NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_dress | stage | program | type | subtype | item_count |
369920 | 1bjb | cing | dress | 4-filtered-FRED | STAR | entry | full | 36 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1bjb # This FRED archive file contains, for PDB entry <1bjb>: # # - 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_1bjb _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1bjb _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3258.36 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 $AMYLOID_BETA_PEPTIDE A . 1 1 stop_ save_ save_AMYLOID_BETA_PEPTIDE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "AMYLOID BETA PEPTIDE" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DAEFRHDSGYEVHHQELVFFAEDVGSNK _Entity.Number_of_monomers 28 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 ASP . 1 1 2 ALA . 1 1 3 GLU . 1 1 4 PHE . 1 1 5 ARG . 1 1 6 HIS . 1 1 7 ASP . 1 1 8 SER . 1 1 9 GLY . 1 1 10 TYR . 1 1 11 GLU . 1 1 12 VAL . 1 1 13 HIS . 1 1 14 HIS . 1 1 15 GLN . 1 1 16 GLU . 1 1 17 LEU . 1 1 18 VAL . 1 1 19 PHE . 1 1 20 PHE . 1 1 21 ALA . 1 1 22 GLU . 1 1 23 ASP . 1 1 24 VAL . 1 1 25 GLY . 1 1 26 SER . 1 1 27 ASN . 1 1 28 LYS . 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 ASP 1 1 1 1 ALA 2 2 1 1 GLU 3 3 1 1 PHE 4 4 1 1 ARG 5 5 1 1 HIS 6 6 1 1 ASP 7 7 1 1 SER 8 8 1 1 GLY 9 9 1 1 TYR 10 10 1 1 GLU 11 11 1 1 VAL 12 12 1 1 HIS 13 13 1 1 HIS 14 14 1 1 GLN 15 15 1 1 GLU 16 16 1 1 LEU 17 17 1 1 VAL 18 18 1 1 PHE 19 19 1 1 PHE 20 20 1 1 ALA 21 21 1 1 GLU 22 22 1 1 ASP 23 23 1 1 VAL 24 24 1 1 GLY 25 25 1 1 SER 26 26 1 1 ASN 27 27 1 1 LYS 28 28 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 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 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 MB . 2 . HB* 1 1 1 1 2 1 1 4 PHE QD . 4 . HD* 1 1 2 1 1 1 1 4 PHE QD . 4 . HD* 1 1 2 1 2 1 1 5 ARG QG . 5 . HG* 1 1 3 1 1 1 1 5 ARG HA . 5 . HA 1 1 3 1 2 1 1 5 ARG HE . 5 . HE 1 1 4 1 1 1 1 5 ARG QB . 5 . HB* 1 1 4 1 2 1 1 5 ARG HE . 5 . HE 1 1 5 1 1 1 1 6 HIS HA . 6 . HA 1 1 5 1 2 1 1 6 HIS HD2 . 6 . HD2 1 1 6 1 1 1 1 9 GLY QA . 9 . HA* 1 1 6 1 2 1 1 10 TYR QD . 10 . HD* 1 1 7 1 1 1 1 10 TYR QD . 10 . HD* 1 1 7 1 2 1 1 11 GLU HA . 11 . HA 1 1 8 1 1 1 1 10 TYR QD . 10 . HD* 1 1 8 1 2 1 1 11 GLU QB . 11 . HB* 1 1 9 1 1 1 1 10 TYR QD . 10 . HD* 1 1 9 1 2 1 1 11 GLU QG . 11 . HG* 1 1 10 1 1 1 1 10 TYR QD . 10 . HD* 1 1 10 1 2 1 1 12 VAL MG1 . 12 . HG1* 1 1 11 1 1 1 1 10 TYR QD . 10 . HD* 1 1 11 1 2 1 1 12 VAL MG2 . 12 . HG2* 1 1 12 1 1 1 1 10 TYR QE . 10 . HE* 1 1 12 1 2 1 1 11 GLU HA . 11 . HA 1 1 13 1 1 1 1 10 TYR QE . 10 . HE* 1 1 13 1 2 1 1 12 VAL HA . 12 . HA* 1 1 14 1 1 1 1 10 TYR QE . 10 . HE* 1 1 14 1 2 1 1 12 VAL MG1 . 12 . HG1* 1 1 15 1 1 1 1 10 TYR QE . 10 . HE* 1 1 15 1 2 1 1 12 VAL MG2 . 12 . HG2* 1 1 16 1 1 1 1 12 VAL HA . 12 . HA 1 1 16 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 17 1 1 1 1 12 VAL HB . 12 . HB 1 1 17 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 18 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 18 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 19 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 19 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 20 1 1 1 1 12 VAL MG1 . 12 . HG1* 1 1 20 1 2 1 1 15 GLN QE . 15 . HE2* 1 1 21 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 21 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 22 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 22 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 23 1 1 1 1 12 VAL MG2 . 12 . HG2* 1 1 23 1 2 1 1 15 GLN QE . 15 . HE2* 1 1 24 1 1 1 1 13 HIS HA . 13 . HA 1 1 24 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 25 1 1 1 1 14 HIS HA . 14 . HA 1 1 25 1 2 1 1 14 HIS HD2 . 14 . HD2 1 1 26 1 1 1 1 15 GLN QB . 15 . HB* 1 1 26 1 2 1 1 19 PHE QD . 19 . HD* 1 1 27 1 1 1 1 15 GLN QG . 15 . HG* 1 1 27 1 2 1 1 19 PHE QD . 19 . HD* 1 1 28 1 1 1 1 16 GLU QB . 16 . HB* 1 1 28 1 2 1 1 19 PHE QD . 19 . HD* 1 1 29 1 1 1 1 16 GLU QG . 16 . HG* 1 1 29 1 2 1 1 19 PHE QD . 19 . HD* 1 1 30 1 1 1 1 17 LEU HA . 17 . HA 1 1 30 1 2 1 1 19 PHE QD . 19 . HD* 1 1 31 1 1 1 1 17 LEU HA . 17 . HA 1 1 31 1 2 1 1 20 PHE QD . 20 . HD* 1 1 32 1 1 1 1 17 LEU QD . 17 . HD* 1 1 32 1 2 1 1 20 PHE QD . 20 . HD* 1 1 33 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 33 1 2 1 1 19 PHE QD . 19 . HD* 1 1 34 1 1 1 1 18 VAL MG2 . 18 . HG2* 1 1 34 1 2 1 1 19 PHE QD . 19 . HD* 1 1 35 1 1 1 1 20 PHE QD . 20 . HD* 1 1 35 1 2 1 1 21 ALA HA . 21 . HA 1 1 36 1 1 1 1 20 PHE QD . 20 . HD* 1 1 36 1 2 1 1 21 ALA MB . 21 . 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 6.4 1 1 2 1 . . . . . 0.0 0.0 7.2 1 1 3 1 . . . . . 0.0 0.0 4.2 1 1 4 1 . . . . . 0.0 0.0 4.4 1 1 5 1 . . . . . 0.0 0.0 3.4 1 1 6 1 . . . . . 0.0 0.0 7.2 1 1 7 1 . . . . . 0.0 0.0 5.4 1 1 8 1 . . . . . 0.0 0.0 8.0 1 1 9 1 . . . . . 0.0 0.0 7.2 1 1 10 1 . . . . . 0.0 0.0 7.2 1 1 11 1 . . . . . 0.0 0.0 6.4 1 1 12 1 . . . . . 0.0 0.0 7.0 1 1 13 1 . . . . . 0.0 0.0 6.4 1 1 14 1 . . . . . 0.0 0.0 7.2 1 1 15 1 . . . . . 0.0 0.0 6.4 1 1 16 1 . . . . . 0.0 0.0 5.0 1 1 17 1 . . . . . 0.0 0.0 4.2 1 1 18 1 . . . . . 0.0 0.0 5.7 1 1 19 1 . . . . . 0.0 0.0 4.2 1 1 20 1 . . . . . 0.0 0.0 5.9 1 1 21 1 . . . . . 0.0 0.0 5.7 1 1 22 1 . . . . . 0.0 0.0 5.7 1 1 23 1 . . . . . 0.0 0.0 5.9 1 1 24 1 . . . . . 0.0 0.0 3.4 1 1 25 1 . . . . . 0.0 0.0 3.4 1 1 26 1 . . . . . 0.0 0.0 7.2 1 1 27 1 . . . . . 0.0 0.0 7.2 1 1 28 1 . . . . . 0.0 0.0 7.2 1 1 29 1 . . . . . 0.0 0.0 8.0 1 1 30 1 . . . . . 0.0 0.0 5.4 1 1 31 1 . . . . . 0.0 0.0 5.4 1 1 32 1 . . . . . 0.0 0.0 7.2 1 1 33 1 . . . . . 0.0 0.0 6.4 1 1 34 1 . . . . . 0.0 0.0 7.2 1 1 35 1 . . . . . 0.0 0.0 6.2 1 1 36 1 . . . . . 0.0 0.0 6.4 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ASP C C -2.609 -4.952 -0.616 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C -2.663 -3.440 -0.388 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C -3.068 -2.748 -1.719 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C -4.232 -3.501 -2.412 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H -0.668 -3.746 0.130 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP H2 H -0.969 -2.245 -0.605 1.00 . A A . 1 ASP H2 1 1 1 7 1 1 1 ASP H3 H -1.431 -2.509 1.008 1.00 . A A . 1 ASP H3 1 1 1 8 1 1 1 ASP HA H -3.392 -3.223 0.380 1.00 . A A . 1 ASP HA 1 1 1 9 1 1 1 ASP HB2 H -3.373 -1.730 -1.524 1.00 . A A . 1 ASP HB2 1 1 1 10 1 1 1 ASP HB3 H -2.217 -2.726 -2.383 1.00 . A A . 1 ASP HB3 1 1 1 11 1 1 1 ASP N N -1.332 -2.947 0.071 1.00 . A A . 1 ASP N 1 1 1 12 1 1 1 ASP O O -1.617 -5.483 -1.078 1.00 . A A . 1 ASP O 1 1 1 13 1 1 1 ASP OD1 O -5.359 -3.177 -2.093 1.00 . A A . 1 ASP OD1 1 1 1 14 1 1 1 ASP OD2 O -3.937 -4.364 -3.223 1.00 . A A . 1 ASP OD2 1 1 1 15 1 1 2 ALA C C -4.295 -7.203 -1.894 1.00 . A A . 2 ALA C 1 1 1 16 1 1 2 ALA CA C -3.816 -7.063 -0.445 1.00 . A A . 2 ALA CA 1 1 1 17 1 1 2 ALA CB C -4.855 -7.599 0.556 1.00 . A A . 2 ALA CB 1 1 1 18 1 1 2 ALA H H -4.454 -5.082 0.090 1.00 . A A . 2 ALA H 1 1 1 19 1 1 2 ALA HA H -2.852 -7.536 -0.321 1.00 . A A . 2 ALA HA 1 1 1 20 1 1 2 ALA HB1 H -5.726 -6.961 0.569 1.00 . A A . 2 ALA HB1 1 1 1 21 1 1 2 ALA HB2 H -5.159 -8.596 0.275 1.00 . A A . 2 ALA HB2 1 1 1 22 1 1 2 ALA HB3 H -4.430 -7.626 1.548 1.00 . A A . 2 ALA HB3 1 1 1 23 1 1 2 ALA N N -3.701 -5.587 -0.278 1.00 . A A . 2 ALA N 1 1 1 24 1 1 2 ALA O O -3.506 -7.439 -2.788 1.00 . A A . 2 ALA O 1 1 1 25 1 1 3 GLU C C -7.590 -6.487 -3.275 1.00 . A A . 3 GLU C 1 1 1 26 1 1 3 GLU CA C -6.206 -7.139 -3.404 1.00 . A A . 3 GLU CA 1 1 1 27 1 1 3 GLU CB C -6.312 -8.620 -3.799 1.00 . A A . 3 GLU CB 1 1 1 28 1 1 3 GLU CD C -6.333 -8.115 -6.281 1.00 . A A . 3 GLU CD 1 1 1 29 1 1 3 GLU CG C -7.109 -8.735 -5.100 1.00 . A A . 3 GLU CG 1 1 1 30 1 1 3 GLU H H -6.174 -6.867 -1.318 1.00 . A A . 3 GLU H 1 1 1 31 1 1 3 GLU HA H -5.607 -6.582 -4.112 1.00 . A A . 3 GLU HA 1 1 1 32 1 1 3 GLU HB2 H -5.325 -9.035 -3.936 1.00 . A A . 3 GLU HB2 1 1 1 33 1 1 3 GLU HB3 H -6.813 -9.173 -3.018 1.00 . A A . 3 GLU HB3 1 1 1 34 1 1 3 GLU HG2 H -7.294 -9.777 -5.287 1.00 . A A . 3 GLU HG2 1 1 1 35 1 1 3 GLU HG3 H -8.056 -8.228 -4.987 1.00 . A A . 3 GLU HG3 1 1 1 36 1 1 3 GLU N N -5.583 -7.046 -2.071 1.00 . A A . 3 GLU N 1 1 1 37 1 1 3 GLU O O -8.573 -7.113 -2.930 1.00 . A A . 3 GLU O 1 1 1 38 1 1 3 GLU OE1 O -6.491 -6.921 -6.481 1.00 . A A . 3 GLU OE1 1 1 1 39 1 1 3 GLU OE2 O -5.623 -8.875 -6.918 1.00 . A A . 3 GLU OE2 1 1 1 40 1 1 4 PHE C C -8.503 -2.981 -4.056 1.00 . A A . 4 PHE C 1 1 1 41 1 1 4 PHE CA C -8.821 -4.373 -3.513 1.00 . A A . 4 PHE CA 1 1 1 42 1 1 4 PHE CB C -9.347 -4.268 -2.046 1.00 . A A . 4 PHE CB 1 1 1 43 1 1 4 PHE CD1 C -8.137 -2.359 -0.900 1.00 . A A . 4 PHE CD1 1 1 1 44 1 1 4 PHE CD2 C -7.513 -4.586 -0.318 1.00 . A A . 4 PHE CD2 1 1 1 45 1 1 4 PHE CE1 C -7.208 -1.863 -0.010 1.00 . A A . 4 PHE CE1 1 1 1 46 1 1 4 PHE CE2 C -6.583 -4.090 0.572 1.00 . A A . 4 PHE CE2 1 1 1 47 1 1 4 PHE CG C -8.299 -3.723 -1.062 1.00 . A A . 4 PHE CG 1 1 1 48 1 1 4 PHE CZ C -6.430 -2.728 0.726 1.00 . A A . 4 PHE CZ 1 1 1 49 1 1 4 PHE H H -6.736 -4.814 -3.830 1.00 . A A . 4 PHE H 1 1 1 50 1 1 4 PHE HA H -9.565 -4.816 -4.154 1.00 . A A . 4 PHE HA 1 1 1 51 1 1 4 PHE HB2 H -10.207 -3.613 -2.025 1.00 . A A . 4 PHE HB2 1 1 1 52 1 1 4 PHE HB3 H -9.668 -5.241 -1.704 1.00 . A A . 4 PHE HB3 1 1 1 53 1 1 4 PHE HD1 H -8.745 -1.677 -1.474 1.00 . A A . 4 PHE HD1 1 1 1 54 1 1 4 PHE HD2 H -7.626 -5.654 -0.434 1.00 . A A . 4 PHE HD2 1 1 1 55 1 1 4 PHE HE1 H -7.090 -0.795 0.107 1.00 . A A . 4 PHE HE1 1 1 1 56 1 1 4 PHE HE2 H -5.974 -4.767 1.151 1.00 . A A . 4 PHE HE2 1 1 1 57 1 1 4 PHE HZ H -5.701 -2.341 1.424 1.00 . A A . 4 PHE HZ 1 1 1 58 1 1 4 PHE N N -7.587 -5.218 -3.566 1.00 . A A . 4 PHE N 1 1 1 59 1 1 4 PHE O O -9.393 -2.215 -4.369 1.00 . A A . 4 PHE O 1 1 1 60 1 1 5 ARG C C -5.512 -1.686 -5.511 1.00 . A A . 5 ARG C 1 1 1 61 1 1 5 ARG CA C -6.754 -1.397 -4.657 1.00 . A A . 5 ARG CA 1 1 1 62 1 1 5 ARG CB C -6.413 -0.483 -3.477 1.00 . A A . 5 ARG CB 1 1 1 63 1 1 5 ARG CD C -7.230 1.923 -3.394 1.00 . A A . 5 ARG CD 1 1 1 64 1 1 5 ARG CG C -6.253 0.929 -4.055 1.00 . A A . 5 ARG CG 1 1 1 65 1 1 5 ARG CZ C -9.554 1.154 -3.733 1.00 . A A . 5 ARG CZ 1 1 1 66 1 1 5 ARG H H -6.560 -3.355 -3.860 1.00 . A A . 5 ARG H 1 1 1 67 1 1 5 ARG HA H -7.518 -0.967 -5.288 1.00 . A A . 5 ARG HA 1 1 1 68 1 1 5 ARG HB2 H -7.195 -0.527 -2.737 1.00 . A A . 5 ARG HB2 1 1 1 69 1 1 5 ARG HB3 H -5.486 -0.791 -3.015 1.00 . A A . 5 ARG HB3 1 1 1 70 1 1 5 ARG HD2 H -7.385 1.705 -2.347 1.00 . A A . 5 ARG HD2 1 1 1 71 1 1 5 ARG HD3 H -6.836 2.924 -3.481 1.00 . A A . 5 ARG HD3 1 1 1 72 1 1 5 ARG HE H -8.619 2.381 -4.969 1.00 . A A . 5 ARG HE 1 1 1 73 1 1 5 ARG HG2 H -5.226 1.221 -3.911 1.00 . A A . 5 ARG HG2 1 1 1 74 1 1 5 ARG HG3 H -6.448 0.898 -5.118 1.00 . A A . 5 ARG HG3 1 1 1 75 1 1 5 ARG HH11 H -8.666 0.438 -2.081 1.00 . A A . 5 ARG HH11 1 1 1 76 1 1 5 ARG HH12 H -10.291 -0.089 -2.350 1.00 . A A . 5 ARG HH12 1 1 1 77 1 1 5 ARG HH21 H -10.662 1.715 -5.301 1.00 . A A . 5 ARG HH21 1 1 1 78 1 1 5 ARG HH22 H -11.438 0.645 -4.182 1.00 . A A . 5 ARG HH22 1 1 1 79 1 1 5 ARG N N -7.230 -2.700 -4.142 1.00 . A A . 5 ARG N 1 1 1 80 1 1 5 ARG NE N -8.531 1.866 -4.140 1.00 . A A . 5 ARG NE 1 1 1 81 1 1 5 ARG NH1 N -9.497 0.448 -2.636 1.00 . A A . 5 ARG NH1 1 1 1 82 1 1 5 ARG NH2 N -10.636 1.173 -4.462 1.00 . A A . 5 ARG NH2 1 1 1 83 1 1 5 ARG O O -4.487 -1.037 -5.438 1.00 . A A . 5 ARG O 1 1 1 84 1 1 6 HIS C C -5.383 -3.823 -8.480 1.00 . A A . 6 HIS C 1 1 1 85 1 1 6 HIS CA C -4.682 -3.210 -7.261 1.00 . A A . 6 HIS CA 1 1 1 86 1 1 6 HIS CB C -3.832 -4.288 -6.561 1.00 . A A . 6 HIS CB 1 1 1 87 1 1 6 HIS CD2 C -2.102 -2.822 -5.194 1.00 . A A . 6 HIS CD2 1 1 1 88 1 1 6 HIS CE1 C -0.381 -3.382 -6.204 1.00 . A A . 6 HIS CE1 1 1 1 89 1 1 6 HIS CG C -2.467 -3.720 -6.177 1.00 . A A . 6 HIS CG 1 1 1 90 1 1 6 HIS H H -6.579 -3.120 -6.280 1.00 . A A . 6 HIS H 1 1 1 91 1 1 6 HIS HA H -4.084 -2.379 -7.592 1.00 . A A . 6 HIS HA 1 1 1 92 1 1 6 HIS HB2 H -4.330 -4.645 -5.673 1.00 . A A . 6 HIS HB2 1 1 1 93 1 1 6 HIS HB3 H -3.664 -5.127 -7.215 1.00 . A A . 6 HIS HB3 1 1 1 94 1 1 6 HIS HD1 H -1.267 -4.647 -7.512 1.00 . A A . 6 HIS HD1 1 1 1 95 1 1 6 HIS HD2 H -2.787 -2.353 -4.506 1.00 . A A . 6 HIS HD2 1 1 1 96 1 1 6 HIS HE1 H 0.651 -3.465 -6.511 1.00 . A A . 6 HIS HE1 1 1 1 97 1 1 6 HIS N N -5.707 -2.695 -6.315 1.00 . A A . 6 HIS N 1 1 1 98 1 1 6 HIS ND1 N -1.356 -4.024 -6.761 1.00 . A A . 6 HIS ND1 1 1 1 99 1 1 6 HIS NE2 N -0.799 -2.620 -5.222 1.00 . A A . 6 HIS NE2 1 1 1 100 1 1 6 HIS O O -5.026 -3.529 -9.604 1.00 . A A . 6 HIS O 1 1 1 101 1 1 7 ASP C C -8.559 -5.613 -8.873 1.00 . A A . 7 ASP C 1 1 1 102 1 1 7 ASP CA C -7.121 -5.329 -9.325 1.00 . A A . 7 ASP CA 1 1 1 103 1 1 7 ASP CB C -6.435 -6.675 -9.721 1.00 . A A . 7 ASP CB 1 1 1 104 1 1 7 ASP CG C -4.902 -6.566 -9.690 1.00 . A A . 7 ASP CG 1 1 1 105 1 1 7 ASP H H -6.612 -4.855 -7.295 1.00 . A A . 7 ASP H 1 1 1 106 1 1 7 ASP HA H -7.163 -4.653 -10.160 1.00 . A A . 7 ASP HA 1 1 1 107 1 1 7 ASP HB2 H -6.744 -7.466 -9.051 1.00 . A A . 7 ASP HB2 1 1 1 108 1 1 7 ASP HB3 H -6.741 -6.949 -10.721 1.00 . A A . 7 ASP HB3 1 1 1 109 1 1 7 ASP N N -6.361 -4.661 -8.221 1.00 . A A . 7 ASP N 1 1 1 110 1 1 7 ASP O O -9.173 -6.581 -9.279 1.00 . A A . 7 ASP O 1 1 1 111 1 1 7 ASP OD1 O -4.368 -6.091 -10.679 1.00 . A A . 7 ASP OD1 1 1 1 112 1 1 7 ASP OD2 O -4.350 -6.964 -8.678 1.00 . A A . 7 ASP OD2 1 1 1 113 1 1 8 SER C C -10.843 -3.563 -6.814 1.00 . A A . 8 SER C 1 1 1 114 1 1 8 SER CA C -10.444 -4.879 -7.502 1.00 . A A . 8 SER CA 1 1 1 115 1 1 8 SER CB C -10.480 -6.086 -6.502 1.00 . A A . 8 SER CB 1 1 1 116 1 1 8 SER H H -8.499 -3.982 -7.756 1.00 . A A . 8 SER H 1 1 1 117 1 1 8 SER HA H -11.121 -5.055 -8.325 1.00 . A A . 8 SER HA 1 1 1 118 1 1 8 SER HB2 H -11.190 -5.941 -5.701 1.00 . A A . 8 SER HB2 1 1 1 119 1 1 8 SER HB3 H -10.709 -7.005 -7.022 1.00 . A A . 8 SER HB3 1 1 1 120 1 1 8 SER HG H -8.781 -7.004 -6.257 1.00 . A A . 8 SER HG 1 1 1 121 1 1 8 SER N N -9.053 -4.740 -8.036 1.00 . A A . 8 SER N 1 1 1 122 1 1 8 SER O O -11.456 -3.541 -5.763 1.00 . A A . 8 SER O 1 1 1 123 1 1 8 SER OG O -9.170 -6.179 -5.959 1.00 . A A . 8 SER OG 1 1 1 124 1 1 9 GLY C C -9.565 -0.241 -7.392 1.00 . A A . 9 GLY C 1 1 1 125 1 1 9 GLY CA C -10.746 -1.114 -6.978 1.00 . A A . 9 GLY CA 1 1 1 126 1 1 9 GLY H H -9.970 -2.595 -8.309 1.00 . A A . 9 GLY H 1 1 1 127 1 1 9 GLY HA2 H -11.648 -0.746 -7.446 1.00 . A A . 9 GLY HA2 1 1 1 128 1 1 9 GLY HA3 H -10.856 -1.104 -5.905 1.00 . A A . 9 GLY HA3 1 1 1 129 1 1 9 GLY N N -10.463 -2.494 -7.467 1.00 . A A . 9 GLY N 1 1 1 130 1 1 9 GLY O O -8.998 0.460 -6.579 1.00 . A A . 9 GLY O 1 1 1 131 1 1 10 TYR C C -6.898 0.584 -8.383 1.00 . A A . 10 TYR C 1 1 1 132 1 1 10 TYR CA C -8.126 0.430 -9.311 1.00 . A A . 10 TYR CA 1 1 1 133 1 1 10 TYR CB C -8.705 1.820 -9.759 1.00 . A A . 10 TYR CB 1 1 1 134 1 1 10 TYR CD1 C -8.848 3.236 -7.645 1.00 . A A . 10 TYR CD1 1 1 1 135 1 1 10 TYR CD2 C -10.858 2.327 -8.535 1.00 . A A . 10 TYR CD2 1 1 1 136 1 1 10 TYR CE1 C -9.564 3.813 -6.622 1.00 . A A . 10 TYR CE1 1 1 1 137 1 1 10 TYR CE2 C -11.573 2.904 -7.510 1.00 . A A . 10 TYR CE2 1 1 1 138 1 1 10 TYR CG C -9.488 2.486 -8.614 1.00 . A A . 10 TYR CG 1 1 1 139 1 1 10 TYR CZ C -10.931 3.652 -6.545 1.00 . A A . 10 TYR CZ 1 1 1 140 1 1 10 TYR H H -9.789 -0.926 -9.225 1.00 . A A . 10 TYR H 1 1 1 141 1 1 10 TYR HA H -7.815 -0.116 -10.189 1.00 . A A . 10 TYR HA 1 1 1 142 1 1 10 TYR HB2 H -7.929 2.487 -10.097 1.00 . A A . 10 TYR HB2 1 1 1 143 1 1 10 TYR HB3 H -9.383 1.652 -10.582 1.00 . A A . 10 TYR HB3 1 1 1 144 1 1 10 TYR HD1 H -7.781 3.376 -7.683 1.00 . A A . 10 TYR HD1 1 1 1 145 1 1 10 TYR HD2 H -11.377 1.746 -9.283 1.00 . A A . 10 TYR HD2 1 1 1 146 1 1 10 TYR HE1 H -9.044 4.393 -5.874 1.00 . A A . 10 TYR HE1 1 1 1 147 1 1 10 TYR HE2 H -12.643 2.765 -7.469 1.00 . A A . 10 TYR HE2 1 1 1 148 1 1 10 TYR HH H -12.154 4.956 -5.881 1.00 . A A . 10 TYR HH 1 1 1 149 1 1 10 TYR N N -9.252 -0.330 -8.666 1.00 . A A . 10 TYR N 1 1 1 150 1 1 10 TYR O O -6.619 -0.309 -7.610 1.00 . A A . 10 TYR O 1 1 1 151 1 1 10 TYR OH O -11.645 4.229 -5.516 1.00 . A A . 10 TYR OH 1 1 1 152 1 1 11 GLU C C -4.601 3.413 -7.670 1.00 . A A . 11 GLU C 1 1 1 153 1 1 11 GLU CA C -4.994 1.946 -7.635 1.00 . A A . 11 GLU CA 1 1 1 154 1 1 11 GLU CB C -3.807 1.059 -8.123 1.00 . A A . 11 GLU CB 1 1 1 155 1 1 11 GLU CD C -4.095 -0.562 -10.038 1.00 . A A . 11 GLU CD 1 1 1 156 1 1 11 GLU CG C -3.782 0.899 -9.665 1.00 . A A . 11 GLU CG 1 1 1 157 1 1 11 GLU H H -6.468 2.360 -9.141 1.00 . A A . 11 GLU H 1 1 1 158 1 1 11 GLU HA H -5.254 1.773 -6.612 1.00 . A A . 11 GLU HA 1 1 1 159 1 1 11 GLU HB2 H -2.873 1.496 -7.805 1.00 . A A . 11 GLU HB2 1 1 1 160 1 1 11 GLU HB3 H -3.893 0.092 -7.651 1.00 . A A . 11 GLU HB3 1 1 1 161 1 1 11 GLU HG2 H -4.505 1.545 -10.137 1.00 . A A . 11 GLU HG2 1 1 1 162 1 1 11 GLU HG3 H -2.805 1.156 -10.047 1.00 . A A . 11 GLU HG3 1 1 1 163 1 1 11 GLU N N -6.200 1.684 -8.487 1.00 . A A . 11 GLU N 1 1 1 164 1 1 11 GLU O O -3.573 3.800 -7.145 1.00 . A A . 11 GLU O 1 1 1 165 1 1 11 GLU OE1 O -3.186 -1.367 -9.918 1.00 . A A . 11 GLU OE1 1 1 1 166 1 1 11 GLU OE2 O -5.229 -0.796 -10.424 1.00 . A A . 11 GLU OE2 1 1 1 167 1 1 12 VAL C C -4.239 6.075 -9.435 1.00 . A A . 12 VAL C 1 1 1 168 1 1 12 VAL CA C -5.350 5.640 -8.473 1.00 . A A . 12 VAL CA 1 1 1 169 1 1 12 VAL CB C -5.102 6.292 -7.095 1.00 . A A . 12 VAL CB 1 1 1 170 1 1 12 VAL CG1 C -5.268 7.825 -7.186 1.00 . A A . 12 VAL CG1 1 1 1 171 1 1 12 VAL CG2 C -6.104 5.765 -6.059 1.00 . A A . 12 VAL CG2 1 1 1 172 1 1 12 VAL H H -6.261 3.706 -8.653 1.00 . A A . 12 VAL H 1 1 1 173 1 1 12 VAL HA H -6.287 5.999 -8.872 1.00 . A A . 12 VAL HA 1 1 1 174 1 1 12 VAL HB H -4.109 6.001 -6.791 1.00 . A A . 12 VAL HB 1 1 1 175 1 1 12 VAL HG11 H -4.616 8.235 -7.941 1.00 . A A . 12 VAL HG11 1 1 1 176 1 1 12 VAL HG12 H -6.288 8.073 -7.444 1.00 . A A . 12 VAL HG12 1 1 1 177 1 1 12 VAL HG13 H -5.031 8.283 -6.237 1.00 . A A . 12 VAL HG13 1 1 1 178 1 1 12 VAL HG21 H -7.079 5.663 -6.509 1.00 . A A . 12 VAL HG21 1 1 1 179 1 1 12 VAL HG22 H -5.775 4.804 -5.693 1.00 . A A . 12 VAL HG22 1 1 1 180 1 1 12 VAL HG23 H -6.167 6.450 -5.229 1.00 . A A . 12 VAL HG23 1 1 1 181 1 1 12 VAL N N -5.476 4.161 -8.292 1.00 . A A . 12 VAL N 1 1 1 182 1 1 12 VAL O O -4.459 6.962 -10.235 1.00 . A A . 12 VAL O 1 1 1 183 1 1 13 HIS C C -1.271 6.999 -9.613 1.00 . A A . 13 HIS C 1 1 1 184 1 1 13 HIS CA C -1.887 5.698 -10.148 1.00 . A A . 13 HIS CA 1 1 1 185 1 1 13 HIS CB C -2.277 5.834 -11.662 1.00 . A A . 13 HIS CB 1 1 1 186 1 1 13 HIS CD2 C -3.907 3.719 -11.546 1.00 . A A . 13 HIS CD2 1 1 1 187 1 1 13 HIS CE1 C -3.490 2.939 -13.421 1.00 . A A . 13 HIS CE1 1 1 1 188 1 1 13 HIS CG C -2.970 4.551 -12.148 1.00 . A A . 13 HIS CG 1 1 1 189 1 1 13 HIS H H -3.030 4.729 -8.651 1.00 . A A . 13 HIS H 1 1 1 190 1 1 13 HIS HA H -1.186 4.891 -10.001 1.00 . A A . 13 HIS HA 1 1 1 191 1 1 13 HIS HB2 H -2.923 6.679 -11.849 1.00 . A A . 13 HIS HB2 1 1 1 192 1 1 13 HIS HB3 H -1.382 5.969 -12.248 1.00 . A A . 13 HIS HB3 1 1 1 193 1 1 13 HIS HD1 H -2.148 4.347 -13.983 1.00 . A A . 13 HIS HD1 1 1 1 194 1 1 13 HIS HD2 H -4.326 3.858 -10.559 1.00 . A A . 13 HIS HD2 1 1 1 195 1 1 13 HIS HE1 H -3.495 2.306 -14.296 1.00 . A A . 13 HIS HE1 1 1 1 196 1 1 13 HIS N N -3.101 5.433 -9.320 1.00 . A A . 13 HIS N 1 1 1 197 1 1 13 HIS ND1 N -2.764 4.005 -13.301 1.00 . A A . 13 HIS ND1 1 1 1 198 1 1 13 HIS NE2 N -4.217 2.724 -12.354 1.00 . A A . 13 HIS NE2 1 1 1 199 1 1 13 HIS O O -0.805 7.848 -10.349 1.00 . A A . 13 HIS O 1 1 1 200 1 1 14 HIS C C -0.025 7.788 -6.297 1.00 . A A . 14 HIS C 1 1 1 201 1 1 14 HIS CA C -0.769 8.250 -7.550 1.00 . A A . 14 HIS CA 1 1 1 202 1 1 14 HIS CB C -1.898 9.168 -7.101 1.00 . A A . 14 HIS CB 1 1 1 203 1 1 14 HIS CD2 C -2.961 9.811 -9.400 1.00 . A A . 14 HIS CD2 1 1 1 204 1 1 14 HIS CE1 C -2.523 11.833 -9.423 1.00 . A A . 14 HIS CE1 1 1 1 205 1 1 14 HIS CG C -2.289 10.101 -8.240 1.00 . A A . 14 HIS CG 1 1 1 206 1 1 14 HIS H H -1.701 6.349 -7.795 1.00 . A A . 14 HIS H 1 1 1 207 1 1 14 HIS HA H -0.094 8.775 -8.197 1.00 . A A . 14 HIS HA 1 1 1 208 1 1 14 HIS HB2 H -2.751 8.571 -6.828 1.00 . A A . 14 HIS HB2 1 1 1 209 1 1 14 HIS HB3 H -1.589 9.760 -6.252 1.00 . A A . 14 HIS HB3 1 1 1 210 1 1 14 HIS HD1 H -1.572 11.893 -7.635 1.00 . A A . 14 HIS HD1 1 1 1 211 1 1 14 HIS HD2 H -3.309 8.822 -9.645 1.00 . A A . 14 HIS HD2 1 1 1 212 1 1 14 HIS HE1 H -2.454 12.867 -9.727 1.00 . A A . 14 HIS HE1 1 1 1 213 1 1 14 HIS N N -1.307 7.082 -8.304 1.00 . A A . 14 HIS N 1 1 1 214 1 1 14 HIS ND1 N -2.045 11.368 -8.313 1.00 . A A . 14 HIS ND1 1 1 1 215 1 1 14 HIS NE2 N -3.105 10.896 -10.133 1.00 . A A . 14 HIS NE2 1 1 1 216 1 1 14 HIS O O 0.876 8.464 -5.840 1.00 . A A . 14 HIS O 1 1 1 217 1 1 15 GLN C C 0.807 4.729 -4.853 1.00 . A A . 15 GLN C 1 1 1 218 1 1 15 GLN CA C 0.186 6.069 -4.554 1.00 . A A . 15 GLN CA 1 1 1 219 1 1 15 GLN CB C -0.860 5.843 -3.438 1.00 . A A . 15 GLN CB 1 1 1 220 1 1 15 GLN CD C -3.214 6.558 -4.036 1.00 . A A . 15 GLN CD 1 1 1 221 1 1 15 GLN CG C -2.234 5.378 -4.001 1.00 . A A . 15 GLN CG 1 1 1 222 1 1 15 GLN H H -1.176 6.178 -6.216 1.00 . A A . 15 GLN H 1 1 1 223 1 1 15 GLN HA H 0.975 6.710 -4.207 1.00 . A A . 15 GLN HA 1 1 1 224 1 1 15 GLN HB2 H -0.493 5.063 -2.782 1.00 . A A . 15 GLN HB2 1 1 1 225 1 1 15 GLN HB3 H -0.962 6.745 -2.859 1.00 . A A . 15 GLN HB3 1 1 1 226 1 1 15 GLN HE21 H -4.571 5.631 -2.923 1.00 . A A . 15 GLN HE21 1 1 1 227 1 1 15 GLN HE22 H -4.988 7.198 -3.422 1.00 . A A . 15 GLN HE22 1 1 1 228 1 1 15 GLN HG2 H -2.148 4.975 -4.998 1.00 . A A . 15 GLN HG2 1 1 1 229 1 1 15 GLN HG3 H -2.642 4.610 -3.360 1.00 . A A . 15 GLN HG3 1 1 1 230 1 1 15 GLN N N -0.439 6.657 -5.784 1.00 . A A . 15 GLN N 1 1 1 231 1 1 15 GLN NE2 N -4.352 6.454 -3.409 1.00 . A A . 15 GLN NE2 1 1 1 232 1 1 15 GLN O O 1.884 4.406 -4.389 1.00 . A A . 15 GLN O 1 1 1 233 1 1 15 GLN OE1 O -2.954 7.583 -4.634 1.00 . A A . 15 GLN OE1 1 1 1 234 1 1 16 GLU C C 2.027 2.758 -6.644 1.00 . A A . 16 GLU C 1 1 1 235 1 1 16 GLU CA C 0.661 2.635 -5.956 1.00 . A A . 16 GLU CA 1 1 1 236 1 1 16 GLU CB C -0.330 1.890 -6.870 1.00 . A A . 16 GLU CB 1 1 1 237 1 1 16 GLU CD C -0.674 -0.203 -8.232 1.00 . A A . 16 GLU CD 1 1 1 238 1 1 16 GLU CG C 0.340 0.611 -7.415 1.00 . A A . 16 GLU CG 1 1 1 239 1 1 16 GLU H H -0.761 4.251 -5.989 1.00 . A A . 16 GLU H 1 1 1 240 1 1 16 GLU HA H 0.784 2.155 -5.001 1.00 . A A . 16 GLU HA 1 1 1 241 1 1 16 GLU HB2 H -1.209 1.627 -6.297 1.00 . A A . 16 GLU HB2 1 1 1 242 1 1 16 GLU HB3 H -0.627 2.528 -7.689 1.00 . A A . 16 GLU HB3 1 1 1 243 1 1 16 GLU HG2 H 1.182 0.879 -8.040 1.00 . A A . 16 GLU HG2 1 1 1 244 1 1 16 GLU HG3 H 0.708 0.016 -6.596 1.00 . A A . 16 GLU HG3 1 1 1 245 1 1 16 GLU N N 0.105 3.962 -5.633 1.00 . A A . 16 GLU N 1 1 1 246 1 1 16 GLU O O 2.939 2.005 -6.359 1.00 . A A . 16 GLU O 1 1 1 247 1 1 16 GLU OE1 O -1.450 -0.904 -7.602 1.00 . A A . 16 GLU OE1 1 1 1 248 1 1 16 GLU OE2 O -0.615 -0.077 -9.445 1.00 . A A . 16 GLU OE2 1 1 1 249 1 1 17 LEU C C 4.495 4.517 -7.381 1.00 . A A . 17 LEU C 1 1 1 250 1 1 17 LEU CA C 3.409 3.922 -8.257 1.00 . A A . 17 LEU CA 1 1 1 251 1 1 17 LEU CB C 3.225 4.867 -9.484 1.00 . A A . 17 LEU CB 1 1 1 252 1 1 17 LEU CD1 C 1.654 6.030 -11.046 1.00 . A A . 17 LEU CD1 1 1 1 253 1 1 17 LEU CD2 C 1.255 3.599 -10.466 1.00 . A A . 17 LEU CD2 1 1 1 254 1 1 17 LEU CG C 1.755 4.969 -9.930 1.00 . A A . 17 LEU CG 1 1 1 255 1 1 17 LEU H H 1.352 4.304 -7.681 1.00 . A A . 17 LEU H 1 1 1 256 1 1 17 LEU HA H 3.730 2.951 -8.563 1.00 . A A . 17 LEU HA 1 1 1 257 1 1 17 LEU HB2 H 3.576 5.859 -9.238 1.00 . A A . 17 LEU HB2 1 1 1 258 1 1 17 LEU HB3 H 3.825 4.496 -10.302 1.00 . A A . 17 LEU HB3 1 1 1 259 1 1 17 LEU HD11 H 2.405 5.856 -11.803 1.00 . A A . 17 LEU HD11 1 1 1 260 1 1 17 LEU HD12 H 0.682 5.995 -11.514 1.00 . A A . 17 LEU HD12 1 1 1 261 1 1 17 LEU HD13 H 1.802 7.016 -10.632 1.00 . A A . 17 LEU HD13 1 1 1 262 1 1 17 LEU HD21 H 2.028 3.116 -11.047 1.00 . A A . 17 LEU HD21 1 1 1 263 1 1 17 LEU HD22 H 0.984 2.952 -9.646 1.00 . A A . 17 LEU HD22 1 1 1 264 1 1 17 LEU HD23 H 0.387 3.731 -11.096 1.00 . A A . 17 LEU HD23 1 1 1 265 1 1 17 LEU HG H 1.183 5.281 -9.069 1.00 . A A . 17 LEU HG 1 1 1 266 1 1 17 LEU N N 2.123 3.721 -7.522 1.00 . A A . 17 LEU N 1 1 1 267 1 1 17 LEU O O 5.661 4.495 -7.721 1.00 . A A . 17 LEU O 1 1 1 268 1 1 18 VAL C C 5.720 4.612 -4.520 1.00 . A A . 18 VAL C 1 1 1 269 1 1 18 VAL CA C 4.979 5.661 -5.289 1.00 . A A . 18 VAL CA 1 1 1 270 1 1 18 VAL CB C 4.169 6.500 -4.330 1.00 . A A . 18 VAL CB 1 1 1 271 1 1 18 VAL CG1 C 5.037 7.029 -3.178 1.00 . A A . 18 VAL CG1 1 1 1 272 1 1 18 VAL CG2 C 3.550 7.588 -5.155 1.00 . A A . 18 VAL CG2 1 1 1 273 1 1 18 VAL H H 3.096 5.000 -6.086 1.00 . A A . 18 VAL H 1 1 1 274 1 1 18 VAL HA H 5.696 6.271 -5.820 1.00 . A A . 18 VAL HA 1 1 1 275 1 1 18 VAL HB H 3.390 5.914 -3.881 1.00 . A A . 18 VAL HB 1 1 1 276 1 1 18 VAL HG11 H 5.988 7.378 -3.546 1.00 . A A . 18 VAL HG11 1 1 1 277 1 1 18 VAL HG12 H 4.523 7.820 -2.656 1.00 . A A . 18 VAL HG12 1 1 1 278 1 1 18 VAL HG13 H 5.209 6.216 -2.483 1.00 . A A . 18 VAL HG13 1 1 1 279 1 1 18 VAL HG21 H 4.321 8.125 -5.684 1.00 . A A . 18 VAL HG21 1 1 1 280 1 1 18 VAL HG22 H 2.895 7.115 -5.876 1.00 . A A . 18 VAL HG22 1 1 1 281 1 1 18 VAL HG23 H 2.982 8.244 -4.521 1.00 . A A . 18 VAL HG23 1 1 1 282 1 1 18 VAL N N 4.058 5.032 -6.272 1.00 . A A . 18 VAL N 1 1 1 283 1 1 18 VAL O O 6.919 4.663 -4.365 1.00 . A A . 18 VAL O 1 1 1 284 1 1 19 PHE C C 6.315 1.692 -4.237 1.00 . A A . 19 PHE C 1 1 1 285 1 1 19 PHE CA C 5.539 2.579 -3.278 1.00 . A A . 19 PHE CA 1 1 1 286 1 1 19 PHE CB C 4.357 1.879 -2.555 1.00 . A A . 19 PHE CB 1 1 1 287 1 1 19 PHE CD1 C 4.240 -0.277 -3.903 1.00 . A A . 19 PHE CD1 1 1 1 288 1 1 19 PHE CD2 C 2.240 0.954 -3.523 1.00 . A A . 19 PHE CD2 1 1 1 289 1 1 19 PHE CE1 C 3.535 -1.234 -4.595 1.00 . A A . 19 PHE CE1 1 1 1 290 1 1 19 PHE CE2 C 1.529 -0.007 -4.215 1.00 . A A . 19 PHE CE2 1 1 1 291 1 1 19 PHE CG C 3.600 0.820 -3.363 1.00 . A A . 19 PHE CG 1 1 1 292 1 1 19 PHE CZ C 2.177 -1.099 -4.749 1.00 . A A . 19 PHE CZ 1 1 1 293 1 1 19 PHE H H 3.995 3.708 -4.263 1.00 . A A . 19 PHE H 1 1 1 294 1 1 19 PHE HA H 6.213 3.011 -2.557 1.00 . A A . 19 PHE HA 1 1 1 295 1 1 19 PHE HB2 H 4.714 1.407 -1.655 1.00 . A A . 19 PHE HB2 1 1 1 296 1 1 19 PHE HB3 H 3.641 2.639 -2.265 1.00 . A A . 19 PHE HB3 1 1 1 297 1 1 19 PHE HD1 H 5.306 -0.376 -3.788 1.00 . A A . 19 PHE HD1 1 1 1 298 1 1 19 PHE HD2 H 1.739 1.829 -3.116 1.00 . A A . 19 PHE HD2 1 1 1 299 1 1 19 PHE HE1 H 4.047 -2.088 -5.014 1.00 . A A . 19 PHE HE1 1 1 1 300 1 1 19 PHE HE2 H 0.460 0.095 -4.335 1.00 . A A . 19 PHE HE2 1 1 1 301 1 1 19 PHE HZ H 1.622 -1.848 -5.290 1.00 . A A . 19 PHE HZ 1 1 1 302 1 1 19 PHE N N 4.949 3.675 -4.065 1.00 . A A . 19 PHE N 1 1 1 303 1 1 19 PHE O O 7.279 1.055 -3.860 1.00 . A A . 19 PHE O 1 1 1 304 1 1 20 PHE C C 7.829 1.561 -6.849 1.00 . A A . 20 PHE C 1 1 1 305 1 1 20 PHE CA C 6.503 0.878 -6.522 1.00 . A A . 20 PHE CA 1 1 1 306 1 1 20 PHE CB C 5.598 0.850 -7.745 1.00 . A A . 20 PHE CB 1 1 1 307 1 1 20 PHE CD1 C 6.357 -1.295 -8.868 1.00 . A A . 20 PHE CD1 1 1 1 308 1 1 20 PHE CD2 C 6.943 0.779 -9.891 1.00 . A A . 20 PHE CD2 1 1 1 309 1 1 20 PHE CE1 C 7.014 -1.975 -9.873 1.00 . A A . 20 PHE CE1 1 1 1 310 1 1 20 PHE CE2 C 7.599 0.100 -10.895 1.00 . A A . 20 PHE CE2 1 1 1 311 1 1 20 PHE CG C 6.317 0.087 -8.869 1.00 . A A . 20 PHE CG 1 1 1 312 1 1 20 PHE CZ C 7.635 -1.278 -10.886 1.00 . A A . 20 PHE CZ 1 1 1 313 1 1 20 PHE H H 5.072 2.247 -5.683 1.00 . A A . 20 PHE H 1 1 1 314 1 1 20 PHE HA H 6.680 -0.121 -6.153 1.00 . A A . 20 PHE HA 1 1 1 315 1 1 20 PHE HB2 H 4.663 0.364 -7.506 1.00 . A A . 20 PHE HB2 1 1 1 316 1 1 20 PHE HB3 H 5.401 1.862 -8.064 1.00 . A A . 20 PHE HB3 1 1 1 317 1 1 20 PHE HD1 H 5.873 -1.848 -8.077 1.00 . A A . 20 PHE HD1 1 1 1 318 1 1 20 PHE HD2 H 6.917 1.858 -9.903 1.00 . A A . 20 PHE HD2 1 1 1 319 1 1 20 PHE HE1 H 7.042 -3.055 -9.864 1.00 . A A . 20 PHE HE1 1 1 1 320 1 1 20 PHE HE2 H 8.085 0.647 -11.689 1.00 . A A . 20 PHE HE2 1 1 1 321 1 1 20 PHE HZ H 8.150 -1.811 -11.672 1.00 . A A . 20 PHE HZ 1 1 1 322 1 1 20 PHE N N 5.853 1.695 -5.462 1.00 . A A . 20 PHE N 1 1 1 323 1 1 20 PHE O O 8.846 0.929 -7.042 1.00 . A A . 20 PHE O 1 1 1 324 1 1 21 ALA C C 9.940 3.387 -6.064 1.00 . A A . 21 ALA C 1 1 1 325 1 1 21 ALA CA C 8.981 3.662 -7.197 1.00 . A A . 21 ALA CA 1 1 1 326 1 1 21 ALA CB C 8.599 5.142 -7.253 1.00 . A A . 21 ALA CB 1 1 1 327 1 1 21 ALA H H 6.931 3.326 -6.713 1.00 . A A . 21 ALA H 1 1 1 328 1 1 21 ALA HA H 9.422 3.297 -8.109 1.00 . A A . 21 ALA HA 1 1 1 329 1 1 21 ALA HB1 H 7.991 5.404 -6.400 1.00 . A A . 21 ALA HB1 1 1 1 330 1 1 21 ALA HB2 H 9.484 5.760 -7.253 1.00 . A A . 21 ALA HB2 1 1 1 331 1 1 21 ALA HB3 H 8.032 5.338 -8.152 1.00 . A A . 21 ALA HB3 1 1 1 332 1 1 21 ALA N N 7.771 2.865 -6.891 1.00 . A A . 21 ALA N 1 1 1 333 1 1 21 ALA O O 11.102 3.125 -6.292 1.00 . A A . 21 ALA O 1 1 1 334 1 1 22 GLU C C 10.779 1.734 -3.677 1.00 . A A . 22 GLU C 1 1 1 335 1 1 22 GLU CA C 10.274 3.186 -3.689 1.00 . A A . 22 GLU CA 1 1 1 336 1 1 22 GLU CB C 9.467 3.491 -2.408 1.00 . A A . 22 GLU CB 1 1 1 337 1 1 22 GLU CD C 10.721 5.692 -2.144 1.00 . A A . 22 GLU CD 1 1 1 338 1 1 22 GLU CG C 9.329 5.027 -2.229 1.00 . A A . 22 GLU CG 1 1 1 339 1 1 22 GLU H H 8.454 3.660 -4.771 1.00 . A A . 22 GLU H 1 1 1 340 1 1 22 GLU HA H 11.129 3.829 -3.781 1.00 . A A . 22 GLU HA 1 1 1 341 1 1 22 GLU HB2 H 8.487 3.045 -2.479 1.00 . A A . 22 GLU HB2 1 1 1 342 1 1 22 GLU HB3 H 9.971 3.074 -1.547 1.00 . A A . 22 GLU HB3 1 1 1 343 1 1 22 GLU HG2 H 8.785 5.455 -3.058 1.00 . A A . 22 GLU HG2 1 1 1 344 1 1 22 GLU HG3 H 8.785 5.239 -1.319 1.00 . A A . 22 GLU HG3 1 1 1 345 1 1 22 GLU N N 9.410 3.444 -4.872 1.00 . A A . 22 GLU N 1 1 1 346 1 1 22 GLU O O 11.812 1.455 -3.099 1.00 . A A . 22 GLU O 1 1 1 347 1 1 22 GLU OE1 O 11.312 5.579 -1.082 1.00 . A A . 22 GLU OE1 1 1 1 348 1 1 22 GLU OE2 O 11.114 6.272 -3.145 1.00 . A A . 22 GLU OE2 1 1 1 349 1 1 23 ASP C C 11.686 -0.664 -5.267 1.00 . A A . 23 ASP C 1 1 1 350 1 1 23 ASP CA C 10.439 -0.583 -4.371 1.00 . A A . 23 ASP CA 1 1 1 351 1 1 23 ASP CB C 9.228 -1.409 -4.943 1.00 . A A . 23 ASP CB 1 1 1 352 1 1 23 ASP CG C 9.563 -2.204 -6.226 1.00 . A A . 23 ASP CG 1 1 1 353 1 1 23 ASP H H 9.218 1.156 -4.756 1.00 . A A . 23 ASP H 1 1 1 354 1 1 23 ASP HA H 10.689 -0.922 -3.376 1.00 . A A . 23 ASP HA 1 1 1 355 1 1 23 ASP HB2 H 8.903 -2.112 -4.189 1.00 . A A . 23 ASP HB2 1 1 1 356 1 1 23 ASP HB3 H 8.402 -0.749 -5.148 1.00 . A A . 23 ASP HB3 1 1 1 357 1 1 23 ASP N N 10.039 0.858 -4.314 1.00 . A A . 23 ASP N 1 1 1 358 1 1 23 ASP O O 12.676 -1.259 -4.889 1.00 . A A . 23 ASP O 1 1 1 359 1 1 23 ASP OD1 O 10.274 -3.185 -6.087 1.00 . A A . 23 ASP OD1 1 1 1 360 1 1 23 ASP OD2 O 9.091 -1.787 -7.271 1.00 . A A . 23 ASP OD2 1 1 1 361 1 1 24 VAL C C 13.931 0.628 -6.706 1.00 . A A . 24 VAL C 1 1 1 362 1 1 24 VAL CA C 12.728 -0.052 -7.395 1.00 . A A . 24 VAL CA 1 1 1 363 1 1 24 VAL CB C 12.285 0.736 -8.660 1.00 . A A . 24 VAL CB 1 1 1 364 1 1 24 VAL CG1 C 13.476 0.927 -9.624 1.00 . A A . 24 VAL CG1 1 1 1 365 1 1 24 VAL CG2 C 11.163 -0.036 -9.389 1.00 . A A . 24 VAL CG2 1 1 1 366 1 1 24 VAL H H 10.747 0.389 -6.664 1.00 . A A . 24 VAL H 1 1 1 367 1 1 24 VAL HA H 12.988 -1.071 -7.643 1.00 . A A . 24 VAL HA 1 1 1 368 1 1 24 VAL HB H 11.910 1.706 -8.365 1.00 . A A . 24 VAL HB 1 1 1 369 1 1 24 VAL HG11 H 14.018 0.000 -9.746 1.00 . A A . 24 VAL HG11 1 1 1 370 1 1 24 VAL HG12 H 13.124 1.253 -10.591 1.00 . A A . 24 VAL HG12 1 1 1 371 1 1 24 VAL HG13 H 14.149 1.677 -9.234 1.00 . A A . 24 VAL HG13 1 1 1 372 1 1 24 VAL HG21 H 11.457 -1.061 -9.559 1.00 . A A . 24 VAL HG21 1 1 1 373 1 1 24 VAL HG22 H 10.261 -0.027 -8.798 1.00 . A A . 24 VAL HG22 1 1 1 374 1 1 24 VAL HG23 H 10.948 0.427 -10.341 1.00 . A A . 24 VAL HG23 1 1 1 375 1 1 24 VAL N N 11.587 -0.059 -6.426 1.00 . A A . 24 VAL N 1 1 1 376 1 1 24 VAL O O 15.043 0.137 -6.727 1.00 . A A . 24 VAL O 1 1 1 377 1 1 25 GLY C C 13.926 3.981 -5.339 1.00 . A A . 25 GLY C 1 1 1 378 1 1 25 GLY CA C 14.595 2.605 -5.379 1.00 . A A . 25 GLY CA 1 1 1 379 1 1 25 GLY H H 12.700 2.064 -6.165 1.00 . A A . 25 GLY H 1 1 1 380 1 1 25 GLY HA2 H 14.737 2.225 -4.378 1.00 . A A . 25 GLY HA2 1 1 1 381 1 1 25 GLY HA3 H 15.531 2.662 -5.915 1.00 . A A . 25 GLY HA3 1 1 1 382 1 1 25 GLY N N 13.622 1.752 -6.118 1.00 . A A . 25 GLY N 1 1 1 383 1 1 25 GLY O O 13.719 4.570 -4.296 1.00 . A A . 25 GLY O 1 1 1 384 1 1 26 SER C C 12.555 5.697 -8.284 1.00 . A A . 26 SER C 1 1 1 385 1 1 26 SER CA C 12.946 5.728 -6.794 1.00 . A A . 26 SER CA 1 1 1 386 1 1 26 SER CB C 13.947 6.874 -6.500 1.00 . A A . 26 SER CB 1 1 1 387 1 1 26 SER H H 13.832 3.848 -7.298 1.00 . A A . 26 SER H 1 1 1 388 1 1 26 SER HA H 12.051 5.804 -6.194 1.00 . A A . 26 SER HA 1 1 1 389 1 1 26 SER HB2 H 14.972 6.564 -6.651 1.00 . A A . 26 SER HB2 1 1 1 390 1 1 26 SER HB3 H 13.741 7.761 -7.082 1.00 . A A . 26 SER HB3 1 1 1 391 1 1 26 SER HG H 14.548 6.967 -4.651 1.00 . A A . 26 SER HG 1 1 1 392 1 1 26 SER N N 13.614 4.417 -6.531 1.00 . A A . 26 SER N 1 1 1 393 1 1 26 SER O O 12.607 6.693 -8.980 1.00 . A A . 26 SER O 1 1 1 394 1 1 26 SER OG O 13.738 7.167 -5.126 1.00 . A A . 26 SER OG 1 1 1 395 1 1 27 ASN C C 12.863 4.700 -11.112 1.00 . A A . 27 ASN C 1 1 1 396 1 1 27 ASN CA C 11.750 4.273 -10.135 1.00 . A A . 27 ASN CA 1 1 1 397 1 1 27 ASN CB C 10.446 5.067 -10.415 1.00 . A A . 27 ASN CB 1 1 1 398 1 1 27 ASN CG C 9.564 4.258 -11.371 1.00 . A A . 27 ASN CG 1 1 1 399 1 1 27 ASN H H 12.150 3.771 -8.082 1.00 . A A . 27 ASN H 1 1 1 400 1 1 27 ASN HA H 11.582 3.213 -10.256 1.00 . A A . 27 ASN HA 1 1 1 401 1 1 27 ASN HB2 H 9.901 5.231 -9.501 1.00 . A A . 27 ASN HB2 1 1 1 402 1 1 27 ASN HB3 H 10.661 6.027 -10.863 1.00 . A A . 27 ASN HB3 1 1 1 403 1 1 27 ASN HD21 H 8.829 3.109 -9.927 1.00 . A A . 27 ASN HD21 1 1 1 404 1 1 27 ASN HD22 H 8.250 2.775 -11.486 1.00 . A A . 27 ASN HD22 1 1 1 405 1 1 27 ASN N N 12.168 4.518 -8.716 1.00 . A A . 27 ASN N 1 1 1 406 1 1 27 ASN ND2 N 8.819 3.301 -10.887 1.00 . A A . 27 ASN ND2 1 1 1 407 1 1 27 ASN O O 12.597 5.105 -12.228 1.00 . A A . 27 ASN O 1 1 1 408 1 1 27 ASN OD1 O 9.543 4.487 -12.565 1.00 . A A . 27 ASN OD1 1 1 1 409 1 1 28 LYS C C 15.376 6.464 -11.758 1.00 . A A . 28 LYS C 1 1 1 410 1 1 28 LYS CA C 15.308 4.952 -11.430 1.00 . A A . 28 LYS CA 1 1 1 411 1 1 28 LYS CB C 15.340 4.130 -12.767 1.00 . A A . 28 LYS CB 1 1 1 412 1 1 28 LYS CD C 16.122 2.022 -11.488 1.00 . A A . 28 LYS CD 1 1 1 413 1 1 28 LYS CE C 17.583 2.190 -11.958 1.00 . A A . 28 LYS CE 1 1 1 414 1 1 28 LYS CG C 15.118 2.611 -12.521 1.00 . A A . 28 LYS CG 1 1 1 415 1 1 28 LYS H H 14.197 4.245 -9.726 1.00 . A A . 28 LYS H 1 1 1 416 1 1 28 LYS HA H 16.174 4.705 -10.834 1.00 . A A . 28 LYS HA 1 1 1 417 1 1 28 LYS HB2 H 14.579 4.492 -13.441 1.00 . A A . 28 LYS HB2 1 1 1 418 1 1 28 LYS HB3 H 16.296 4.273 -13.250 1.00 . A A . 28 LYS HB3 1 1 1 419 1 1 28 LYS HD2 H 15.993 2.504 -10.529 1.00 . A A . 28 LYS HD2 1 1 1 420 1 1 28 LYS HD3 H 15.915 0.970 -11.362 1.00 . A A . 28 LYS HD3 1 1 1 421 1 1 28 LYS HE2 H 17.839 3.234 -12.061 1.00 . A A . 28 LYS HE2 1 1 1 422 1 1 28 LYS HE3 H 18.249 1.743 -11.235 1.00 . A A . 28 LYS HE3 1 1 1 423 1 1 28 LYS HG2 H 14.110 2.454 -12.167 1.00 . A A . 28 LYS HG2 1 1 1 424 1 1 28 LYS HG3 H 15.220 2.087 -13.460 1.00 . A A . 28 LYS HG3 1 1 1 425 1 1 28 LYS HZ1 H 16.905 1.068 -13.580 1.00 . A A . 28 LYS HZ1 1 1 1 426 1 1 28 LYS HZ2 H 18.095 2.211 -13.976 1.00 . A A . 28 LYS HZ2 1 1 1 427 1 1 28 LYS HZ3 H 18.527 0.782 -13.168 1.00 . A A . 28 LYS HZ3 1 1 1 428 1 1 28 LYS N N 14.082 4.585 -10.639 1.00 . A A . 28 LYS N 1 1 1 429 1 1 28 LYS NZ N 17.792 1.512 -13.269 1.00 . A A . 28 LYS NZ 1 1 1 430 1 1 28 LYS O O 14.462 7.173 -11.367 1.00 . A A . 28 LYS O 1 1 1 431 1 1 28 LYS OXT O 16.355 6.834 -12.388 1.00 . A A . 28 LYS OXT 1 1 2 432 1 1 1 ASP C C -16.335 -5.748 -13.315 1.00 . A A . 1 ASP C 1 1 2 433 1 1 1 ASP CA C -15.014 -6.362 -13.820 1.00 . A A . 1 ASP CA 1 1 2 434 1 1 1 ASP CB C -15.108 -6.680 -15.336 1.00 . A A . 1 ASP CB 1 1 2 435 1 1 1 ASP CG C -16.201 -7.736 -15.601 1.00 . A A . 1 ASP CG 1 1 2 436 1 1 1 ASP H1 H -15.450 -7.815 -12.386 1.00 . A A . 1 ASP H1 1 1 2 437 1 1 1 ASP H2 H -14.630 -8.411 -13.747 1.00 . A A . 1 ASP H2 1 1 2 438 1 1 1 ASP H3 H -13.791 -7.508 -12.583 1.00 . A A . 1 ASP H3 1 1 2 439 1 1 1 ASP HA H -14.221 -5.656 -13.640 1.00 . A A . 1 ASP HA 1 1 2 440 1 1 1 ASP HB2 H -15.335 -5.781 -15.889 1.00 . A A . 1 ASP HB2 1 1 2 441 1 1 1 ASP HB3 H -14.159 -7.063 -15.681 1.00 . A A . 1 ASP HB3 1 1 2 442 1 1 1 ASP N N -14.699 -7.619 -13.078 1.00 . A A . 1 ASP N 1 1 2 443 1 1 1 ASP O O -17.080 -5.140 -14.059 1.00 . A A . 1 ASP O 1 1 2 444 1 1 1 ASP OD1 O -15.879 -8.904 -15.450 1.00 . A A . 1 ASP OD1 1 1 2 445 1 1 1 ASP OD2 O -17.295 -7.317 -15.940 1.00 . A A . 1 ASP OD2 1 1 2 446 1 1 2 ALA C C -17.593 -3.925 -11.020 1.00 . A A . 2 ALA C 1 1 2 447 1 1 2 ALA CA C -17.810 -5.405 -11.390 1.00 . A A . 2 ALA CA 1 1 2 448 1 1 2 ALA CB C -18.090 -6.266 -10.142 1.00 . A A . 2 ALA CB 1 1 2 449 1 1 2 ALA H H -15.918 -6.434 -11.512 1.00 . A A . 2 ALA H 1 1 2 450 1 1 2 ALA HA H -18.638 -5.479 -12.080 1.00 . A A . 2 ALA HA 1 1 2 451 1 1 2 ALA HB1 H -17.171 -6.452 -9.609 1.00 . A A . 2 ALA HB1 1 1 2 452 1 1 2 ALA HB2 H -18.784 -5.764 -9.485 1.00 . A A . 2 ALA HB2 1 1 2 453 1 1 2 ALA HB3 H -18.519 -7.211 -10.439 1.00 . A A . 2 ALA HB3 1 1 2 454 1 1 2 ALA N N -16.572 -5.935 -12.042 1.00 . A A . 2 ALA N 1 1 2 455 1 1 2 ALA O O -17.795 -3.062 -11.852 1.00 . A A . 2 ALA O 1 1 2 456 1 1 3 GLU C C -15.967 -2.383 -8.141 1.00 . A A . 3 GLU C 1 1 2 457 1 1 3 GLU CA C -16.945 -2.289 -9.321 1.00 . A A . 3 GLU CA 1 1 2 458 1 1 3 GLU CB C -18.288 -1.668 -8.893 1.00 . A A . 3 GLU CB 1 1 2 459 1 1 3 GLU CD C -18.284 0.812 -9.493 1.00 . A A . 3 GLU CD 1 1 2 460 1 1 3 GLU CG C -18.034 -0.233 -8.385 1.00 . A A . 3 GLU CG 1 1 2 461 1 1 3 GLU H H -17.052 -4.398 -9.157 1.00 . A A . 3 GLU H 1 1 2 462 1 1 3 GLU HA H -16.479 -1.719 -10.109 1.00 . A A . 3 GLU HA 1 1 2 463 1 1 3 GLU HB2 H -18.967 -1.655 -9.733 1.00 . A A . 3 GLU HB2 1 1 2 464 1 1 3 GLU HB3 H -18.733 -2.259 -8.106 1.00 . A A . 3 GLU HB3 1 1 2 465 1 1 3 GLU HG2 H -18.696 -0.056 -7.553 1.00 . A A . 3 GLU HG2 1 1 2 466 1 1 3 GLU HG3 H -17.015 -0.127 -8.043 1.00 . A A . 3 GLU HG3 1 1 2 467 1 1 3 GLU N N -17.194 -3.674 -9.796 1.00 . A A . 3 GLU N 1 1 2 468 1 1 3 GLU O O -16.341 -2.391 -6.984 1.00 . A A . 3 GLU O 1 1 2 469 1 1 3 GLU OE1 O -17.754 0.616 -10.576 1.00 . A A . 3 GLU OE1 1 1 2 470 1 1 3 GLU OE2 O -18.993 1.759 -9.194 1.00 . A A . 3 GLU OE2 1 1 2 471 1 1 4 PHE C C -12.453 -1.829 -8.249 1.00 . A A . 4 PHE C 1 1 2 472 1 1 4 PHE CA C -13.592 -2.554 -7.552 1.00 . A A . 4 PHE CA 1 1 2 473 1 1 4 PHE CB C -13.236 -4.035 -7.312 1.00 . A A . 4 PHE CB 1 1 2 474 1 1 4 PHE CD1 C -14.614 -4.592 -5.265 1.00 . A A . 4 PHE CD1 1 1 2 475 1 1 4 PHE CD2 C -15.297 -5.516 -7.357 1.00 . A A . 4 PHE CD2 1 1 2 476 1 1 4 PHE CE1 C -15.674 -5.217 -4.644 1.00 . A A . 4 PHE CE1 1 1 2 477 1 1 4 PHE CE2 C -16.358 -6.140 -6.734 1.00 . A A . 4 PHE CE2 1 1 2 478 1 1 4 PHE CG C -14.416 -4.736 -6.626 1.00 . A A . 4 PHE CG 1 1 2 479 1 1 4 PHE CZ C -16.546 -5.991 -5.378 1.00 . A A . 4 PHE CZ 1 1 2 480 1 1 4 PHE H H -14.523 -2.448 -9.479 1.00 . A A . 4 PHE H 1 1 2 481 1 1 4 PHE HA H -13.835 -2.050 -6.630 1.00 . A A . 4 PHE HA 1 1 2 482 1 1 4 PHE HB2 H -13.026 -4.535 -8.248 1.00 . A A . 4 PHE HB2 1 1 2 483 1 1 4 PHE HB3 H -12.366 -4.109 -6.674 1.00 . A A . 4 PHE HB3 1 1 2 484 1 1 4 PHE HD1 H -13.934 -3.986 -4.684 1.00 . A A . 4 PHE HD1 1 1 2 485 1 1 4 PHE HD2 H -15.156 -5.637 -8.421 1.00 . A A . 4 PHE HD2 1 1 2 486 1 1 4 PHE HE1 H -15.821 -5.098 -3.580 1.00 . A A . 4 PHE HE1 1 1 2 487 1 1 4 PHE HE2 H -17.042 -6.747 -7.309 1.00 . A A . 4 PHE HE2 1 1 2 488 1 1 4 PHE HZ H -17.376 -6.480 -4.890 1.00 . A A . 4 PHE HZ 1 1 2 489 1 1 4 PHE N N -14.723 -2.457 -8.520 1.00 . A A . 4 PHE N 1 1 2 490 1 1 4 PHE O O -11.972 -0.813 -7.795 1.00 . A A . 4 PHE O 1 1 2 491 1 1 5 ARG C C -11.426 -0.543 -10.949 1.00 . A A . 5 ARG C 1 1 2 492 1 1 5 ARG CA C -10.959 -1.790 -10.172 1.00 . A A . 5 ARG CA 1 1 2 493 1 1 5 ARG CB C -10.412 -2.877 -11.155 1.00 . A A . 5 ARG CB 1 1 2 494 1 1 5 ARG CD C -12.710 -3.215 -12.234 1.00 . A A . 5 ARG CD 1 1 2 495 1 1 5 ARG CG C -11.498 -3.908 -11.584 1.00 . A A . 5 ARG CG 1 1 2 496 1 1 5 ARG CZ C -11.905 -2.799 -14.515 1.00 . A A . 5 ARG CZ 1 1 2 497 1 1 5 ARG H H -12.526 -3.194 -9.671 1.00 . A A . 5 ARG H 1 1 2 498 1 1 5 ARG HA H -10.212 -1.468 -9.476 1.00 . A A . 5 ARG HA 1 1 2 499 1 1 5 ARG HB2 H -9.991 -2.412 -12.036 1.00 . A A . 5 ARG HB2 1 1 2 500 1 1 5 ARG HB3 H -9.619 -3.415 -10.657 1.00 . A A . 5 ARG HB3 1 1 2 501 1 1 5 ARG HD2 H -13.391 -3.948 -12.639 1.00 . A A . 5 ARG HD2 1 1 2 502 1 1 5 ARG HD3 H -13.246 -2.616 -11.514 1.00 . A A . 5 ARG HD3 1 1 2 503 1 1 5 ARG HE H -12.155 -1.364 -13.170 1.00 . A A . 5 ARG HE 1 1 2 504 1 1 5 ARG HG2 H -11.067 -4.596 -12.293 1.00 . A A . 5 ARG HG2 1 1 2 505 1 1 5 ARG HG3 H -11.828 -4.474 -10.726 1.00 . A A . 5 ARG HG3 1 1 2 506 1 1 5 ARG HH11 H -12.300 -4.711 -14.056 1.00 . A A . 5 ARG HH11 1 1 2 507 1 1 5 ARG HH12 H -11.744 -4.428 -15.670 1.00 . A A . 5 ARG HH12 1 1 2 508 1 1 5 ARG HH21 H -11.452 -0.976 -15.202 1.00 . A A . 5 ARG HH21 1 1 2 509 1 1 5 ARG HH22 H -11.249 -2.274 -16.332 1.00 . A A . 5 ARG HH22 1 1 2 510 1 1 5 ARG N N -12.068 -2.383 -9.367 1.00 . A A . 5 ARG N 1 1 2 511 1 1 5 ARG NE N -12.228 -2.328 -13.336 1.00 . A A . 5 ARG NE 1 1 2 512 1 1 5 ARG NH1 N -11.991 -4.079 -14.766 1.00 . A A . 5 ARG NH1 1 1 2 513 1 1 5 ARG NH2 N -11.504 -1.950 -15.421 1.00 . A A . 5 ARG NH2 1 1 2 514 1 1 5 ARG O O -10.722 0.004 -11.775 1.00 . A A . 5 ARG O 1 1 2 515 1 1 6 HIS C C -13.252 2.233 -10.289 1.00 . A A . 6 HIS C 1 1 2 516 1 1 6 HIS CA C -13.325 1.010 -11.211 1.00 . A A . 6 HIS CA 1 1 2 517 1 1 6 HIS CB C -14.794 0.645 -11.444 1.00 . A A . 6 HIS CB 1 1 2 518 1 1 6 HIS CD2 C -14.242 -0.371 -13.814 1.00 . A A . 6 HIS CD2 1 1 2 519 1 1 6 HIS CE1 C -15.548 -1.978 -13.777 1.00 . A A . 6 HIS CE1 1 1 2 520 1 1 6 HIS CG C -14.910 -0.338 -12.606 1.00 . A A . 6 HIS CG 1 1 2 521 1 1 6 HIS H H -13.089 -0.687 -9.952 1.00 . A A . 6 HIS H 1 1 2 522 1 1 6 HIS HA H -12.849 1.250 -12.143 1.00 . A A . 6 HIS HA 1 1 2 523 1 1 6 HIS HB2 H -15.199 0.183 -10.555 1.00 . A A . 6 HIS HB2 1 1 2 524 1 1 6 HIS HB3 H -15.373 1.526 -11.682 1.00 . A A . 6 HIS HB3 1 1 2 525 1 1 6 HIS HD1 H -16.318 -1.621 -11.940 1.00 . A A . 6 HIS HD1 1 1 2 526 1 1 6 HIS HD2 H -13.491 0.344 -14.110 1.00 . A A . 6 HIS HD2 1 1 2 527 1 1 6 HIS HE1 H -16.094 -2.865 -14.061 1.00 . A A . 6 HIS HE1 1 1 2 528 1 1 6 HIS N N -12.629 -0.161 -10.622 1.00 . A A . 6 HIS N 1 1 2 529 1 1 6 HIS ND1 N -15.700 -1.358 -12.651 1.00 . A A . 6 HIS ND1 1 1 2 530 1 1 6 HIS NE2 N -14.650 -1.397 -14.534 1.00 . A A . 6 HIS NE2 1 1 2 531 1 1 6 HIS O O -12.896 3.310 -10.726 1.00 . A A . 6 HIS O 1 1 2 532 1 1 7 ASP C C -13.656 2.618 -6.597 1.00 . A A . 7 ASP C 1 1 2 533 1 1 7 ASP CA C -13.566 3.142 -8.041 1.00 . A A . 7 ASP CA 1 1 2 534 1 1 7 ASP CB C -14.757 4.091 -8.347 1.00 . A A . 7 ASP CB 1 1 2 535 1 1 7 ASP CG C -16.025 3.260 -8.638 1.00 . A A . 7 ASP CG 1 1 2 536 1 1 7 ASP H H -13.862 1.133 -8.747 1.00 . A A . 7 ASP H 1 1 2 537 1 1 7 ASP HA H -12.634 3.667 -8.148 1.00 . A A . 7 ASP HA 1 1 2 538 1 1 7 ASP HB2 H -14.948 4.748 -7.511 1.00 . A A . 7 ASP HB2 1 1 2 539 1 1 7 ASP HB3 H -14.519 4.697 -9.208 1.00 . A A . 7 ASP HB3 1 1 2 540 1 1 7 ASP N N -13.591 2.026 -9.039 1.00 . A A . 7 ASP N 1 1 2 541 1 1 7 ASP O O -14.255 3.233 -5.734 1.00 . A A . 7 ASP O 1 1 2 542 1 1 7 ASP OD1 O -16.570 2.734 -7.680 1.00 . A A . 7 ASP OD1 1 1 2 543 1 1 7 ASP OD2 O -16.374 3.195 -9.806 1.00 . A A . 7 ASP OD2 1 1 2 544 1 1 8 SER C C -11.914 -0.204 -4.984 1.00 . A A . 8 SER C 1 1 2 545 1 1 8 SER CA C -13.045 0.842 -5.025 1.00 . A A . 8 SER CA 1 1 2 546 1 1 8 SER CB C -14.448 0.181 -4.777 1.00 . A A . 8 SER CB 1 1 2 547 1 1 8 SER H H -12.584 1.037 -7.116 1.00 . A A . 8 SER H 1 1 2 548 1 1 8 SER HA H -12.845 1.595 -4.276 1.00 . A A . 8 SER HA 1 1 2 549 1 1 8 SER HB2 H -14.376 -0.748 -4.231 1.00 . A A . 8 SER HB2 1 1 2 550 1 1 8 SER HB3 H -15.096 0.860 -4.241 1.00 . A A . 8 SER HB3 1 1 2 551 1 1 8 SER HG H -15.801 0.456 -6.151 1.00 . A A . 8 SER HG 1 1 2 552 1 1 8 SER N N -13.049 1.483 -6.380 1.00 . A A . 8 SER N 1 1 2 553 1 1 8 SER O O -12.026 -1.262 -4.392 1.00 . A A . 8 SER O 1 1 2 554 1 1 8 SER OG O -15.006 -0.073 -6.060 1.00 . A A . 8 SER OG 1 1 2 555 1 1 9 GLY C C -8.976 -0.453 -7.124 1.00 . A A . 9 GLY C 1 1 2 556 1 1 9 GLY CA C -9.617 -0.684 -5.744 1.00 . A A . 9 GLY CA 1 1 2 557 1 1 9 GLY H H -10.845 1.035 -6.089 1.00 . A A . 9 GLY H 1 1 2 558 1 1 9 GLY HA2 H -8.917 -0.403 -4.971 1.00 . A A . 9 GLY HA2 1 1 2 559 1 1 9 GLY HA3 H -9.880 -1.727 -5.645 1.00 . A A . 9 GLY HA3 1 1 2 560 1 1 9 GLY N N -10.844 0.164 -5.640 1.00 . A A . 9 GLY N 1 1 2 561 1 1 9 GLY O O -8.136 -1.214 -7.563 1.00 . A A . 9 GLY O 1 1 2 562 1 1 10 TYR C C -7.473 1.507 -9.101 1.00 . A A . 10 TYR C 1 1 2 563 1 1 10 TYR CA C -8.913 1.001 -9.106 1.00 . A A . 10 TYR CA 1 1 2 564 1 1 10 TYR CB C -9.852 2.087 -9.662 1.00 . A A . 10 TYR CB 1 1 2 565 1 1 10 TYR CD1 C -10.008 3.688 -7.680 1.00 . A A . 10 TYR CD1 1 1 2 566 1 1 10 TYR CD2 C -8.968 4.456 -9.678 1.00 . A A . 10 TYR CD2 1 1 2 567 1 1 10 TYR CE1 C -9.775 4.913 -7.091 1.00 . A A . 10 TYR CE1 1 1 2 568 1 1 10 TYR CE2 C -8.736 5.679 -9.088 1.00 . A A . 10 TYR CE2 1 1 2 569 1 1 10 TYR CG C -9.607 3.448 -8.982 1.00 . A A . 10 TYR CG 1 1 2 570 1 1 10 TYR CZ C -9.138 5.916 -7.791 1.00 . A A . 10 TYR CZ 1 1 2 571 1 1 10 TYR H H -10.090 1.169 -7.337 1.00 . A A . 10 TYR H 1 1 2 572 1 1 10 TYR HA H -8.957 0.138 -9.749 1.00 . A A . 10 TYR HA 1 1 2 573 1 1 10 TYR HB2 H -9.687 2.191 -10.725 1.00 . A A . 10 TYR HB2 1 1 2 574 1 1 10 TYR HB3 H -10.872 1.793 -9.489 1.00 . A A . 10 TYR HB3 1 1 2 575 1 1 10 TYR HD1 H -10.511 2.918 -7.115 1.00 . A A . 10 TYR HD1 1 1 2 576 1 1 10 TYR HD2 H -8.650 4.286 -10.695 1.00 . A A . 10 TYR HD2 1 1 2 577 1 1 10 TYR HE1 H -10.095 5.088 -6.074 1.00 . A A . 10 TYR HE1 1 1 2 578 1 1 10 TYR HE2 H -8.235 6.456 -9.647 1.00 . A A . 10 TYR HE2 1 1 2 579 1 1 10 TYR HH H -7.978 7.171 -6.941 1.00 . A A . 10 TYR HH 1 1 2 580 1 1 10 TYR N N -9.411 0.609 -7.759 1.00 . A A . 10 TYR N 1 1 2 581 1 1 10 TYR O O -6.861 1.676 -8.062 1.00 . A A . 10 TYR O 1 1 2 582 1 1 10 TYR OH O -8.902 7.141 -7.201 1.00 . A A . 10 TYR OH 1 1 2 583 1 1 11 GLU C C -5.568 3.749 -10.315 1.00 . A A . 11 GLU C 1 1 2 584 1 1 11 GLU CA C -5.603 2.231 -10.472 1.00 . A A . 11 GLU CA 1 1 2 585 1 1 11 GLU CB C -5.114 1.798 -11.865 1.00 . A A . 11 GLU CB 1 1 2 586 1 1 11 GLU CD C -3.024 0.465 -12.381 1.00 . A A . 11 GLU CD 1 1 2 587 1 1 11 GLU CG C -4.429 0.412 -11.757 1.00 . A A . 11 GLU CG 1 1 2 588 1 1 11 GLU H H -7.555 1.574 -11.081 1.00 . A A . 11 GLU H 1 1 2 589 1 1 11 GLU HA H -5.001 1.808 -9.685 1.00 . A A . 11 GLU HA 1 1 2 590 1 1 11 GLU HB2 H -5.955 1.728 -12.540 1.00 . A A . 11 GLU HB2 1 1 2 591 1 1 11 GLU HB3 H -4.434 2.533 -12.262 1.00 . A A . 11 GLU HB3 1 1 2 592 1 1 11 GLU HG2 H -4.344 0.095 -10.727 1.00 . A A . 11 GLU HG2 1 1 2 593 1 1 11 GLU HG3 H -5.019 -0.321 -12.284 1.00 . A A . 11 GLU HG3 1 1 2 594 1 1 11 GLU N N -6.992 1.734 -10.296 1.00 . A A . 11 GLU N 1 1 2 595 1 1 11 GLU O O -6.172 4.494 -11.062 1.00 . A A . 11 GLU O 1 1 2 596 1 1 11 GLU OE1 O -2.967 0.402 -13.599 1.00 . A A . 11 GLU OE1 1 1 2 597 1 1 11 GLU OE2 O -2.084 0.567 -11.610 1.00 . A A . 11 GLU OE2 1 1 2 598 1 1 12 VAL C C -3.400 6.174 -9.611 1.00 . A A . 12 VAL C 1 1 2 599 1 1 12 VAL CA C -4.632 5.556 -8.935 1.00 . A A . 12 VAL CA 1 1 2 600 1 1 12 VAL CB C -4.485 5.612 -7.409 1.00 . A A . 12 VAL CB 1 1 2 601 1 1 12 VAL CG1 C -4.342 7.069 -6.913 1.00 . A A . 12 VAL CG1 1 1 2 602 1 1 12 VAL CG2 C -5.709 4.986 -6.718 1.00 . A A . 12 VAL CG2 1 1 2 603 1 1 12 VAL H H -4.383 3.428 -8.783 1.00 . A A . 12 VAL H 1 1 2 604 1 1 12 VAL HA H -5.500 6.121 -9.240 1.00 . A A . 12 VAL HA 1 1 2 605 1 1 12 VAL HB H -3.613 5.018 -7.178 1.00 . A A . 12 VAL HB 1 1 2 606 1 1 12 VAL HG11 H -3.717 7.642 -7.575 1.00 . A A . 12 VAL HG11 1 1 2 607 1 1 12 VAL HG12 H -5.309 7.547 -6.860 1.00 . A A . 12 VAL HG12 1 1 2 608 1 1 12 VAL HG13 H -3.899 7.074 -5.928 1.00 . A A . 12 VAL HG13 1 1 2 609 1 1 12 VAL HG21 H -6.613 5.470 -7.054 1.00 . A A . 12 VAL HG21 1 1 2 610 1 1 12 VAL HG22 H -5.767 3.931 -6.939 1.00 . A A . 12 VAL HG22 1 1 2 611 1 1 12 VAL HG23 H -5.626 5.112 -5.648 1.00 . A A . 12 VAL HG23 1 1 2 612 1 1 12 VAL N N -4.828 4.125 -9.310 1.00 . A A . 12 VAL N 1 1 2 613 1 1 12 VAL O O -3.516 7.179 -10.281 1.00 . A A . 12 VAL O 1 1 2 614 1 1 13 HIS C C -0.328 7.135 -9.182 1.00 . A A . 13 HIS C 1 1 2 615 1 1 13 HIS CA C -0.934 5.939 -9.938 1.00 . A A . 13 HIS CA 1 1 2 616 1 1 13 HIS CB C -1.033 6.321 -11.449 1.00 . A A . 13 HIS CB 1 1 2 617 1 1 13 HIS CD2 C -2.394 4.175 -12.136 1.00 . A A . 13 HIS CD2 1 1 2 618 1 1 13 HIS CE1 C -1.183 3.520 -13.687 1.00 . A A . 13 HIS CE1 1 1 2 619 1 1 13 HIS CG C -1.346 5.062 -12.252 1.00 . A A . 13 HIS CG 1 1 2 620 1 1 13 HIS H H -2.321 4.728 -8.835 1.00 . A A . 13 HIS H 1 1 2 621 1 1 13 HIS HA H -0.268 5.097 -9.823 1.00 . A A . 13 HIS HA 1 1 2 622 1 1 13 HIS HB2 H -1.788 7.061 -11.652 1.00 . A A . 13 HIS HB2 1 1 2 623 1 1 13 HIS HB3 H -0.088 6.712 -11.793 1.00 . A A . 13 HIS HB3 1 1 2 624 1 1 13 HIS HD1 H 0.189 5.004 -13.567 1.00 . A A . 13 HIS HD1 1 1 2 625 1 1 13 HIS HD2 H -3.187 4.259 -11.404 1.00 . A A . 13 HIS HD2 1 1 2 626 1 1 13 HIS HE1 H -0.785 2.938 -14.504 1.00 . A A . 13 HIS HE1 1 1 2 627 1 1 13 HIS N N -2.276 5.532 -9.393 1.00 . A A . 13 HIS N 1 1 2 628 1 1 13 HIS ND1 N -0.636 4.600 -13.227 1.00 . A A . 13 HIS ND1 1 1 2 629 1 1 13 HIS NE2 N -2.278 3.220 -13.035 1.00 . A A . 13 HIS NE2 1 1 2 630 1 1 13 HIS O O 0.777 7.549 -9.474 1.00 . A A . 13 HIS O 1 1 2 631 1 1 14 HIS C C 0.473 8.343 -6.407 1.00 . A A . 14 HIS C 1 1 2 632 1 1 14 HIS CA C -0.547 8.824 -7.438 1.00 . A A . 14 HIS CA 1 1 2 633 1 1 14 HIS CB C -1.697 9.505 -6.696 1.00 . A A . 14 HIS CB 1 1 2 634 1 1 14 HIS CD2 C -3.181 10.203 -8.765 1.00 . A A . 14 HIS CD2 1 1 2 635 1 1 14 HIS CE1 C -3.168 12.255 -8.479 1.00 . A A . 14 HIS CE1 1 1 2 636 1 1 14 HIS CG C -2.430 10.462 -7.636 1.00 . A A . 14 HIS CG 1 1 2 637 1 1 14 HIS H H -1.936 7.294 -8.028 1.00 . A A . 14 HIS H 1 1 2 638 1 1 14 HIS HA H -0.081 9.515 -8.117 1.00 . A A . 14 HIS HA 1 1 2 639 1 1 14 HIS HB2 H -2.387 8.763 -6.328 1.00 . A A . 14 HIS HB2 1 1 2 640 1 1 14 HIS HB3 H -1.313 10.066 -5.858 1.00 . A A . 14 HIS HB3 1 1 2 641 1 1 14 HIS HD1 H -2.022 12.262 -6.809 1.00 . A A . 14 HIS HD1 1 1 2 642 1 1 14 HIS HD2 H -3.364 9.218 -9.160 1.00 . A A . 14 HIS HD2 1 1 2 643 1 1 14 HIS HE1 H -3.349 13.313 -8.605 1.00 . A A . 14 HIS HE1 1 1 2 644 1 1 14 HIS N N -1.055 7.661 -8.228 1.00 . A A . 14 HIS N 1 1 2 645 1 1 14 HIS ND1 N -2.463 11.748 -7.518 1.00 . A A . 14 HIS ND1 1 1 2 646 1 1 14 HIS NE2 N -3.635 11.329 -9.280 1.00 . A A . 14 HIS NE2 1 1 2 647 1 1 14 HIS O O 1.562 8.867 -6.292 1.00 . A A . 14 HIS O 1 1 2 648 1 1 15 GLN C C 0.928 5.204 -4.910 1.00 . A A . 15 GLN C 1 1 2 649 1 1 15 GLN CA C 0.841 6.690 -4.615 1.00 . A A . 15 GLN CA 1 1 2 650 1 1 15 GLN CB C 0.158 6.896 -3.240 1.00 . A A . 15 GLN CB 1 1 2 651 1 1 15 GLN CD C -1.537 8.184 -1.925 1.00 . A A . 15 GLN CD 1 1 2 652 1 1 15 GLN CG C -0.652 8.213 -3.175 1.00 . A A . 15 GLN CG 1 1 2 653 1 1 15 GLN H H -0.866 7.004 -5.882 1.00 . A A . 15 GLN H 1 1 2 654 1 1 15 GLN HA H 1.850 7.068 -4.625 1.00 . A A . 15 GLN HA 1 1 2 655 1 1 15 GLN HB2 H -0.520 6.074 -3.058 1.00 . A A . 15 GLN HB2 1 1 2 656 1 1 15 GLN HB3 H 0.910 6.893 -2.465 1.00 . A A . 15 GLN HB3 1 1 2 657 1 1 15 GLN HE21 H -3.019 7.247 -2.856 1.00 . A A . 15 GLN HE21 1 1 2 658 1 1 15 GLN HE22 H -3.301 7.601 -1.220 1.00 . A A . 15 GLN HE22 1 1 2 659 1 1 15 GLN HG2 H 0.007 9.066 -3.124 1.00 . A A . 15 GLN HG2 1 1 2 660 1 1 15 GLN HG3 H -1.300 8.318 -4.034 1.00 . A A . 15 GLN HG3 1 1 2 661 1 1 15 GLN N N 0.035 7.341 -5.695 1.00 . A A . 15 GLN N 1 1 2 662 1 1 15 GLN NE2 N -2.717 7.631 -2.006 1.00 . A A . 15 GLN NE2 1 1 2 663 1 1 15 GLN O O 1.901 4.558 -4.576 1.00 . A A . 15 GLN O 1 1 2 664 1 1 15 GLN OE1 O -1.167 8.660 -0.870 1.00 . A A . 15 GLN OE1 1 1 2 665 1 1 16 GLU C C 1.121 2.814 -6.533 1.00 . A A . 16 GLU C 1 1 2 666 1 1 16 GLU CA C -0.192 3.278 -5.899 1.00 . A A . 16 GLU CA 1 1 2 667 1 1 16 GLU CB C -1.371 3.099 -6.878 1.00 . A A . 16 GLU CB 1 1 2 668 1 1 16 GLU CD C -2.348 1.720 -8.742 1.00 . A A . 16 GLU CD 1 1 2 669 1 1 16 GLU CG C -1.139 1.888 -7.812 1.00 . A A . 16 GLU CG 1 1 2 670 1 1 16 GLU H H -0.855 5.313 -5.762 1.00 . A A . 16 GLU H 1 1 2 671 1 1 16 GLU HA H -0.366 2.704 -5.002 1.00 . A A . 16 GLU HA 1 1 2 672 1 1 16 GLU HB2 H -2.284 2.958 -6.319 1.00 . A A . 16 GLU HB2 1 1 2 673 1 1 16 GLU HB3 H -1.466 3.994 -7.470 1.00 . A A . 16 GLU HB3 1 1 2 674 1 1 16 GLU HG2 H -0.260 2.046 -8.420 1.00 . A A . 16 GLU HG2 1 1 2 675 1 1 16 GLU HG3 H -0.988 0.994 -7.221 1.00 . A A . 16 GLU HG3 1 1 2 676 1 1 16 GLU N N -0.113 4.717 -5.532 1.00 . A A . 16 GLU N 1 1 2 677 1 1 16 GLU O O 1.680 1.821 -6.109 1.00 . A A . 16 GLU O 1 1 2 678 1 1 16 GLU OE1 O -2.483 2.576 -9.601 1.00 . A A . 16 GLU OE1 1 1 2 679 1 1 16 GLU OE2 O -3.064 0.752 -8.546 1.00 . A A . 16 GLU OE2 1 1 2 680 1 1 17 LEU C C 4.067 3.597 -7.419 1.00 . A A . 17 LEU C 1 1 2 681 1 1 17 LEU CA C 2.846 3.129 -8.172 1.00 . A A . 17 LEU CA 1 1 2 682 1 1 17 LEU CB C 2.895 3.647 -9.639 1.00 . A A . 17 LEU CB 1 1 2 683 1 1 17 LEU CD1 C 4.378 5.724 -9.565 1.00 . A A . 17 LEU CD1 1 1 2 684 1 1 17 LEU CD2 C 2.403 5.605 -11.107 1.00 . A A . 17 LEU CD2 1 1 2 685 1 1 17 LEU CG C 2.930 5.183 -9.717 1.00 . A A . 17 LEU CG 1 1 2 686 1 1 17 LEU H H 1.090 4.349 -7.816 1.00 . A A . 17 LEU H 1 1 2 687 1 1 17 LEU HA H 2.859 2.069 -8.158 1.00 . A A . 17 LEU HA 1 1 2 688 1 1 17 LEU HB2 H 3.759 3.230 -10.134 1.00 . A A . 17 LEU HB2 1 1 2 689 1 1 17 LEU HB3 H 2.015 3.279 -10.147 1.00 . A A . 17 LEU HB3 1 1 2 690 1 1 17 LEU HD11 H 5.096 5.029 -9.978 1.00 . A A . 17 LEU HD11 1 1 2 691 1 1 17 LEU HD12 H 4.484 6.669 -10.080 1.00 . A A . 17 LEU HD12 1 1 2 692 1 1 17 LEU HD13 H 4.614 5.886 -8.526 1.00 . A A . 17 LEU HD13 1 1 2 693 1 1 17 LEU HD21 H 1.436 5.162 -11.293 1.00 . A A . 17 LEU HD21 1 1 2 694 1 1 17 LEU HD22 H 2.315 6.679 -11.168 1.00 . A A . 17 LEU HD22 1 1 2 695 1 1 17 LEU HD23 H 3.083 5.273 -11.878 1.00 . A A . 17 LEU HD23 1 1 2 696 1 1 17 LEU HG H 2.303 5.548 -8.921 1.00 . A A . 17 LEU HG 1 1 2 697 1 1 17 LEU N N 1.573 3.549 -7.523 1.00 . A A . 17 LEU N 1 1 2 698 1 1 17 LEU O O 5.151 3.113 -7.652 1.00 . A A . 17 LEU O 1 1 2 699 1 1 18 VAL C C 5.426 3.950 -4.735 1.00 . A A . 18 VAL C 1 1 2 700 1 1 18 VAL CA C 5.033 5.037 -5.732 1.00 . A A . 18 VAL CA 1 1 2 701 1 1 18 VAL CB C 4.597 6.307 -5.013 1.00 . A A . 18 VAL CB 1 1 2 702 1 1 18 VAL CG1 C 5.776 6.895 -4.207 1.00 . A A . 18 VAL CG1 1 1 2 703 1 1 18 VAL CG2 C 4.146 7.281 -6.103 1.00 . A A . 18 VAL CG2 1 1 2 704 1 1 18 VAL H H 2.979 4.887 -6.375 1.00 . A A . 18 VAL H 1 1 2 705 1 1 18 VAL HA H 5.864 5.232 -6.395 1.00 . A A . 18 VAL HA 1 1 2 706 1 1 18 VAL HB H 3.780 6.095 -4.340 1.00 . A A . 18 VAL HB 1 1 2 707 1 1 18 VAL HG11 H 6.686 6.870 -4.790 1.00 . A A . 18 VAL HG11 1 1 2 708 1 1 18 VAL HG12 H 5.566 7.914 -3.920 1.00 . A A . 18 VAL HG12 1 1 2 709 1 1 18 VAL HG13 H 5.925 6.311 -3.309 1.00 . A A . 18 VAL HG13 1 1 2 710 1 1 18 VAL HG21 H 4.922 7.380 -6.848 1.00 . A A . 18 VAL HG21 1 1 2 711 1 1 18 VAL HG22 H 3.259 6.890 -6.584 1.00 . A A . 18 VAL HG22 1 1 2 712 1 1 18 VAL HG23 H 3.925 8.244 -5.677 1.00 . A A . 18 VAL HG23 1 1 2 713 1 1 18 VAL N N 3.876 4.526 -6.526 1.00 . A A . 18 VAL N 1 1 2 714 1 1 18 VAL O O 6.520 3.948 -4.211 1.00 . A A . 18 VAL O 1 1 2 715 1 1 19 PHE C C 5.620 0.890 -4.240 1.00 . A A . 19 PHE C 1 1 2 716 1 1 19 PHE CA C 4.706 1.922 -3.578 1.00 . A A . 19 PHE CA 1 1 2 717 1 1 19 PHE CB C 3.352 1.267 -3.253 1.00 . A A . 19 PHE CB 1 1 2 718 1 1 19 PHE CD1 C 2.708 3.383 -1.965 1.00 . A A . 19 PHE CD1 1 1 2 719 1 1 19 PHE CD2 C 0.980 2.033 -2.900 1.00 . A A . 19 PHE CD2 1 1 2 720 1 1 19 PHE CE1 C 1.760 4.249 -1.461 1.00 . A A . 19 PHE CE1 1 1 2 721 1 1 19 PHE CE2 C 0.031 2.899 -2.396 1.00 . A A . 19 PHE CE2 1 1 2 722 1 1 19 PHE CG C 2.326 2.266 -2.689 1.00 . A A . 19 PHE CG 1 1 2 723 1 1 19 PHE CZ C 0.421 4.007 -1.676 1.00 . A A . 19 PHE CZ 1 1 2 724 1 1 19 PHE H H 3.647 3.139 -4.996 1.00 . A A . 19 PHE H 1 1 2 725 1 1 19 PHE HA H 5.190 2.302 -2.691 1.00 . A A . 19 PHE HA 1 1 2 726 1 1 19 PHE HB2 H 2.942 0.828 -4.151 1.00 . A A . 19 PHE HB2 1 1 2 727 1 1 19 PHE HB3 H 3.490 0.483 -2.525 1.00 . A A . 19 PHE HB3 1 1 2 728 1 1 19 PHE HD1 H 3.754 3.586 -1.797 1.00 . A A . 19 PHE HD1 1 1 2 729 1 1 19 PHE HD2 H 0.668 1.168 -3.471 1.00 . A A . 19 PHE HD2 1 1 2 730 1 1 19 PHE HE1 H 2.067 5.118 -0.898 1.00 . A A . 19 PHE HE1 1 1 2 731 1 1 19 PHE HE2 H -1.018 2.708 -2.566 1.00 . A A . 19 PHE HE2 1 1 2 732 1 1 19 PHE HZ H -0.321 4.683 -1.280 1.00 . A A . 19 PHE HZ 1 1 2 733 1 1 19 PHE N N 4.496 3.057 -4.520 1.00 . A A . 19 PHE N 1 1 2 734 1 1 19 PHE O O 6.136 0.007 -3.587 1.00 . A A . 19 PHE O 1 1 2 735 1 1 20 PHE C C 7.920 0.928 -6.623 1.00 . A A . 20 PHE C 1 1 2 736 1 1 20 PHE CA C 6.624 0.161 -6.364 1.00 . A A . 20 PHE CA 1 1 2 737 1 1 20 PHE CB C 5.817 -0.136 -7.649 1.00 . A A . 20 PHE CB 1 1 2 738 1 1 20 PHE CD1 C 7.228 -1.666 -9.104 1.00 . A A . 20 PHE CD1 1 1 2 739 1 1 20 PHE CD2 C 7.066 0.634 -9.716 1.00 . A A . 20 PHE CD2 1 1 2 740 1 1 20 PHE CE1 C 8.047 -1.897 -10.190 1.00 . A A . 20 PHE CE1 1 1 2 741 1 1 20 PHE CE2 C 7.884 0.404 -10.802 1.00 . A A . 20 PHE CE2 1 1 2 742 1 1 20 PHE CG C 6.732 -0.400 -8.858 1.00 . A A . 20 PHE CG 1 1 2 743 1 1 20 PHE CZ C 8.375 -0.862 -11.041 1.00 . A A . 20 PHE CZ 1 1 2 744 1 1 20 PHE H H 5.311 1.812 -5.960 1.00 . A A . 20 PHE H 1 1 2 745 1 1 20 PHE HA H 6.859 -0.740 -5.815 1.00 . A A . 20 PHE HA 1 1 2 746 1 1 20 PHE HB2 H 5.188 -0.997 -7.480 1.00 . A A . 20 PHE HB2 1 1 2 747 1 1 20 PHE HB3 H 5.175 0.704 -7.874 1.00 . A A . 20 PHE HB3 1 1 2 748 1 1 20 PHE HD1 H 6.977 -2.482 -8.443 1.00 . A A . 20 PHE HD1 1 1 2 749 1 1 20 PHE HD2 H 6.685 1.629 -9.537 1.00 . A A . 20 PHE HD2 1 1 2 750 1 1 20 PHE HE1 H 8.430 -2.889 -10.376 1.00 . A A . 20 PHE HE1 1 1 2 751 1 1 20 PHE HE2 H 8.140 1.215 -11.466 1.00 . A A . 20 PHE HE2 1 1 2 752 1 1 20 PHE HZ H 9.016 -1.043 -11.891 1.00 . A A . 20 PHE HZ 1 1 2 753 1 1 20 PHE N N 5.774 1.059 -5.528 1.00 . A A . 20 PHE N 1 1 2 754 1 1 20 PHE O O 9.008 0.420 -6.439 1.00 . A A . 20 PHE O 1 1 2 755 1 1 21 ALA C C 9.616 3.304 -6.038 1.00 . A A . 21 ALA C 1 1 2 756 1 1 21 ALA CA C 8.873 3.062 -7.351 1.00 . A A . 21 ALA CA 1 1 2 757 1 1 21 ALA CB C 8.326 4.381 -7.910 1.00 . A A . 21 ALA CB 1 1 2 758 1 1 21 ALA H H 6.833 2.481 -7.178 1.00 . A A . 21 ALA H 1 1 2 759 1 1 21 ALA HA H 9.538 2.582 -8.053 1.00 . A A . 21 ALA HA 1 1 2 760 1 1 21 ALA HB1 H 7.548 4.186 -8.634 1.00 . A A . 21 ALA HB1 1 1 2 761 1 1 21 ALA HB2 H 7.918 4.987 -7.116 1.00 . A A . 21 ALA HB2 1 1 2 762 1 1 21 ALA HB3 H 9.120 4.933 -8.393 1.00 . A A . 21 ALA HB3 1 1 2 763 1 1 21 ALA N N 7.738 2.151 -7.050 1.00 . A A . 21 ALA N 1 1 2 764 1 1 21 ALA O O 10.726 3.791 -6.043 1.00 . A A . 21 ALA O 1 1 2 765 1 1 22 GLU C C 10.805 2.169 -3.597 1.00 . A A . 22 GLU C 1 1 2 766 1 1 22 GLU CA C 9.619 3.145 -3.616 1.00 . A A . 22 GLU CA 1 1 2 767 1 1 22 GLU CB C 8.579 2.813 -2.508 1.00 . A A . 22 GLU CB 1 1 2 768 1 1 22 GLU CD C 9.435 0.943 -1.017 1.00 . A A . 22 GLU CD 1 1 2 769 1 1 22 GLU CG C 9.243 2.468 -1.147 1.00 . A A . 22 GLU CG 1 1 2 770 1 1 22 GLU H H 8.062 2.583 -4.995 1.00 . A A . 22 GLU H 1 1 2 771 1 1 22 GLU HA H 9.972 4.158 -3.543 1.00 . A A . 22 GLU HA 1 1 2 772 1 1 22 GLU HB2 H 7.953 3.678 -2.351 1.00 . A A . 22 GLU HB2 1 1 2 773 1 1 22 GLU HB3 H 7.948 1.999 -2.835 1.00 . A A . 22 GLU HB3 1 1 2 774 1 1 22 GLU HG2 H 10.197 2.965 -1.050 1.00 . A A . 22 GLU HG2 1 1 2 775 1 1 22 GLU HG3 H 8.604 2.800 -0.342 1.00 . A A . 22 GLU HG3 1 1 2 776 1 1 22 GLU N N 8.972 2.960 -4.945 1.00 . A A . 22 GLU N 1 1 2 777 1 1 22 GLU O O 11.924 2.519 -3.275 1.00 . A A . 22 GLU O 1 1 2 778 1 1 22 GLU OE1 O 8.422 0.269 -0.933 1.00 . A A . 22 GLU OE1 1 1 2 779 1 1 22 GLU OE2 O 10.586 0.539 -1.010 1.00 . A A . 22 GLU OE2 1 1 2 780 1 1 23 ASP C C 12.514 0.051 -5.147 1.00 . A A . 23 ASP C 1 1 2 781 1 1 23 ASP CA C 11.496 -0.139 -4.020 1.00 . A A . 23 ASP CA 1 1 2 782 1 1 23 ASP CB C 10.755 -1.468 -4.214 1.00 . A A . 23 ASP CB 1 1 2 783 1 1 23 ASP CG C 9.645 -1.598 -3.163 1.00 . A A . 23 ASP CG 1 1 2 784 1 1 23 ASP H H 9.561 0.777 -4.236 1.00 . A A . 23 ASP H 1 1 2 785 1 1 23 ASP HA H 12.029 -0.163 -3.079 1.00 . A A . 23 ASP HA 1 1 2 786 1 1 23 ASP HB2 H 10.308 -1.496 -5.198 1.00 . A A . 23 ASP HB2 1 1 2 787 1 1 23 ASP HB3 H 11.439 -2.296 -4.116 1.00 . A A . 23 ASP HB3 1 1 2 788 1 1 23 ASP N N 10.489 0.961 -3.973 1.00 . A A . 23 ASP N 1 1 2 789 1 1 23 ASP O O 13.703 0.150 -4.916 1.00 . A A . 23 ASP O 1 1 2 790 1 1 23 ASP OD1 O 9.942 -2.122 -2.102 1.00 . A A . 23 ASP OD1 1 1 2 791 1 1 23 ASP OD2 O 8.556 -1.160 -3.489 1.00 . A A . 23 ASP OD2 1 1 2 792 1 1 24 VAL C C 13.685 1.596 -7.417 1.00 . A A . 24 VAL C 1 1 2 793 1 1 24 VAL CA C 12.895 0.285 -7.540 1.00 . A A . 24 VAL CA 1 1 2 794 1 1 24 VAL CB C 12.028 0.292 -8.830 1.00 . A A . 24 VAL CB 1 1 2 795 1 1 24 VAL CG1 C 12.939 -0.045 -10.036 1.00 . A A . 24 VAL CG1 1 1 2 796 1 1 24 VAL CG2 C 10.904 -0.781 -8.747 1.00 . A A . 24 VAL CG2 1 1 2 797 1 1 24 VAL H H 11.035 0.048 -6.463 1.00 . A A . 24 VAL H 1 1 2 798 1 1 24 VAL HA H 13.593 -0.541 -7.566 1.00 . A A . 24 VAL HA 1 1 2 799 1 1 24 VAL HB H 11.577 1.264 -8.963 1.00 . A A . 24 VAL HB 1 1 2 800 1 1 24 VAL HG11 H 13.927 0.369 -9.896 1.00 . A A . 24 VAL HG11 1 1 2 801 1 1 24 VAL HG12 H 13.037 -1.115 -10.151 1.00 . A A . 24 VAL HG12 1 1 2 802 1 1 24 VAL HG13 H 12.516 0.365 -10.942 1.00 . A A . 24 VAL HG13 1 1 2 803 1 1 24 VAL HG21 H 11.130 -1.527 -7.999 1.00 . A A . 24 VAL HG21 1 1 2 804 1 1 24 VAL HG22 H 9.971 -0.306 -8.490 1.00 . A A . 24 VAL HG22 1 1 2 805 1 1 24 VAL HG23 H 10.778 -1.280 -9.696 1.00 . A A . 24 VAL HG23 1 1 2 806 1 1 24 VAL N N 12.005 0.109 -6.351 1.00 . A A . 24 VAL N 1 1 2 807 1 1 24 VAL O O 14.846 1.654 -7.763 1.00 . A A . 24 VAL O 1 1 2 808 1 1 25 GLY C C 14.926 3.767 -5.864 1.00 . A A . 25 GLY C 1 1 2 809 1 1 25 GLY CA C 13.685 3.945 -6.745 1.00 . A A . 25 GLY CA 1 1 2 810 1 1 25 GLY H H 12.092 2.489 -6.659 1.00 . A A . 25 GLY H 1 1 2 811 1 1 25 GLY HA2 H 13.974 4.336 -7.708 1.00 . A A . 25 GLY HA2 1 1 2 812 1 1 25 GLY HA3 H 13.003 4.628 -6.264 1.00 . A A . 25 GLY HA3 1 1 2 813 1 1 25 GLY N N 13.027 2.611 -6.919 1.00 . A A . 25 GLY N 1 1 2 814 1 1 25 GLY O O 16.007 4.188 -6.229 1.00 . A A . 25 GLY O 1 1 2 815 1 1 26 SER C C 16.967 2.133 -4.468 1.00 . A A . 26 SER C 1 1 2 816 1 1 26 SER CA C 15.830 2.887 -3.766 1.00 . A A . 26 SER CA 1 1 2 817 1 1 26 SER CB C 15.276 2.061 -2.593 1.00 . A A . 26 SER CB 1 1 2 818 1 1 26 SER H H 13.814 2.837 -4.501 1.00 . A A . 26 SER H 1 1 2 819 1 1 26 SER HA H 16.205 3.834 -3.420 1.00 . A A . 26 SER HA 1 1 2 820 1 1 26 SER HB2 H 14.393 2.517 -2.170 1.00 . A A . 26 SER HB2 1 1 2 821 1 1 26 SER HB3 H 15.067 1.040 -2.877 1.00 . A A . 26 SER HB3 1 1 2 822 1 1 26 SER HG H 16.604 1.177 -1.481 1.00 . A A . 26 SER HG 1 1 2 823 1 1 26 SER N N 14.716 3.141 -4.730 1.00 . A A . 26 SER N 1 1 2 824 1 1 26 SER O O 18.117 2.514 -4.367 1.00 . A A . 26 SER O 1 1 2 825 1 1 26 SER OG O 16.321 2.082 -1.630 1.00 . A A . 26 SER OG 1 1 2 826 1 1 27 ASN C C 18.453 1.120 -6.797 1.00 . A A . 27 ASN C 1 1 2 827 1 1 27 ASN CA C 17.571 0.235 -5.904 1.00 . A A . 27 ASN CA 1 1 2 828 1 1 27 ASN CB C 16.760 -0.804 -6.734 1.00 . A A . 27 ASN CB 1 1 2 829 1 1 27 ASN CG C 17.544 -1.284 -7.964 1.00 . A A . 27 ASN CG 1 1 2 830 1 1 27 ASN H H 15.638 0.853 -5.160 1.00 . A A . 27 ASN H 1 1 2 831 1 1 27 ASN HA H 18.200 -0.269 -5.193 1.00 . A A . 27 ASN HA 1 1 2 832 1 1 27 ASN HB2 H 16.541 -1.662 -6.114 1.00 . A A . 27 ASN HB2 1 1 2 833 1 1 27 ASN HB3 H 15.825 -0.382 -7.065 1.00 . A A . 27 ASN HB3 1 1 2 834 1 1 27 ASN HD21 H 16.788 0.123 -9.142 1.00 . A A . 27 ASN HD21 1 1 2 835 1 1 27 ASN HD22 H 17.883 -0.938 -9.890 1.00 . A A . 27 ASN HD22 1 1 2 836 1 1 27 ASN N N 16.588 1.082 -5.153 1.00 . A A . 27 ASN N 1 1 2 837 1 1 27 ASN ND2 N 17.393 -0.647 -9.093 1.00 . A A . 27 ASN ND2 1 1 2 838 1 1 27 ASN O O 19.664 1.087 -6.695 1.00 . A A . 27 ASN O 1 1 2 839 1 1 27 ASN OD1 O 18.296 -2.237 -7.909 1.00 . A A . 27 ASN OD1 1 1 2 840 1 1 28 LYS C C 19.406 3.791 -7.773 1.00 . A A . 28 LYS C 1 1 2 841 1 1 28 LYS CA C 18.537 2.796 -8.571 1.00 . A A . 28 LYS CA 1 1 2 842 1 1 28 LYS CB C 17.516 3.569 -9.412 1.00 . A A . 28 LYS CB 1 1 2 843 1 1 28 LYS CD C 15.837 3.445 -11.262 1.00 . A A . 28 LYS CD 1 1 2 844 1 1 28 LYS CE C 14.435 2.824 -11.369 1.00 . A A . 28 LYS CE 1 1 2 845 1 1 28 LYS CG C 16.741 2.607 -10.332 1.00 . A A . 28 LYS CG 1 1 2 846 1 1 28 LYS H H 16.832 1.839 -7.670 1.00 . A A . 28 LYS H 1 1 2 847 1 1 28 LYS HA H 19.171 2.200 -9.214 1.00 . A A . 28 LYS HA 1 1 2 848 1 1 28 LYS HB2 H 16.824 4.082 -8.760 1.00 . A A . 28 LYS HB2 1 1 2 849 1 1 28 LYS HB3 H 18.033 4.307 -10.010 1.00 . A A . 28 LYS HB3 1 1 2 850 1 1 28 LYS HD2 H 15.744 4.452 -10.883 1.00 . A A . 28 LYS HD2 1 1 2 851 1 1 28 LYS HD3 H 16.289 3.484 -12.241 1.00 . A A . 28 LYS HD3 1 1 2 852 1 1 28 LYS HE2 H 13.904 3.256 -12.204 1.00 . A A . 28 LYS HE2 1 1 2 853 1 1 28 LYS HE3 H 14.501 1.757 -11.514 1.00 . A A . 28 LYS HE3 1 1 2 854 1 1 28 LYS HG2 H 17.437 2.033 -10.929 1.00 . A A . 28 LYS HG2 1 1 2 855 1 1 28 LYS HG3 H 16.155 1.922 -9.741 1.00 . A A . 28 LYS HG3 1 1 2 856 1 1 28 LYS HZ1 H 14.253 3.649 -9.465 1.00 . A A . 28 LYS HZ1 1 1 2 857 1 1 28 LYS HZ2 H 12.809 3.647 -10.359 1.00 . A A . 28 LYS HZ2 1 1 2 858 1 1 28 LYS HZ3 H 13.388 2.207 -9.675 1.00 . A A . 28 LYS HZ3 1 1 2 859 1 1 28 LYS N N 17.808 1.879 -7.643 1.00 . A A . 28 LYS N 1 1 2 860 1 1 28 LYS NZ N 13.662 3.102 -10.124 1.00 . A A . 28 LYS NZ 1 1 2 861 1 1 28 LYS O O 18.909 4.262 -6.762 1.00 . A A . 28 LYS O 1 1 2 862 1 1 28 LYS OXT O 20.517 4.022 -8.222 1.00 . A A . 28 LYS OXT 1 1 3 863 1 1 1 ASP C C -14.541 -8.796 0.067 1.00 . A A . 1 ASP C 1 1 3 864 1 1 1 ASP CA C -14.104 -7.473 0.706 1.00 . A A . 1 ASP CA 1 1 3 865 1 1 1 ASP CB C -12.884 -6.883 -0.077 1.00 . A A . 1 ASP CB 1 1 3 866 1 1 1 ASP CG C -12.860 -7.333 -1.559 1.00 . A A . 1 ASP CG 1 1 3 867 1 1 1 ASP H1 H -13.847 -8.705 2.365 1.00 . A A . 1 ASP H1 1 1 3 868 1 1 1 ASP H2 H -12.736 -7.426 2.274 1.00 . A A . 1 ASP H2 1 1 3 869 1 1 1 ASP H3 H -14.339 -7.124 2.744 1.00 . A A . 1 ASP H3 1 1 3 870 1 1 1 ASP HA H -14.931 -6.778 0.677 1.00 . A A . 1 ASP HA 1 1 3 871 1 1 1 ASP HB2 H -12.943 -5.806 -0.053 1.00 . A A . 1 ASP HB2 1 1 3 872 1 1 1 ASP HB3 H -11.961 -7.183 0.399 1.00 . A A . 1 ASP HB3 1 1 3 873 1 1 1 ASP N N -13.728 -7.699 2.130 1.00 . A A . 1 ASP N 1 1 3 874 1 1 1 ASP O O -14.045 -9.852 0.407 1.00 . A A . 1 ASP O 1 1 3 875 1 1 1 ASP OD1 O -13.731 -6.877 -2.276 1.00 . A A . 1 ASP OD1 1 1 3 876 1 1 1 ASP OD2 O -11.978 -8.106 -1.894 1.00 . A A . 1 ASP OD2 1 1 3 877 1 1 2 ALA C C -14.924 -10.244 -2.589 1.00 . A A . 2 ALA C 1 1 3 878 1 1 2 ALA CA C -15.992 -9.871 -1.570 1.00 . A A . 2 ALA CA 1 1 3 879 1 1 2 ALA CB C -17.311 -9.502 -2.266 1.00 . A A . 2 ALA CB 1 1 3 880 1 1 2 ALA H H -15.816 -7.787 -1.068 1.00 . A A . 2 ALA H 1 1 3 881 1 1 2 ALA HA H -16.121 -10.698 -0.890 1.00 . A A . 2 ALA HA 1 1 3 882 1 1 2 ALA HB1 H -17.203 -8.571 -2.802 1.00 . A A . 2 ALA HB1 1 1 3 883 1 1 2 ALA HB2 H -17.594 -10.277 -2.964 1.00 . A A . 2 ALA HB2 1 1 3 884 1 1 2 ALA HB3 H -18.094 -9.390 -1.531 1.00 . A A . 2 ALA HB3 1 1 3 885 1 1 2 ALA N N -15.467 -8.676 -0.850 1.00 . A A . 2 ALA N 1 1 3 886 1 1 2 ALA O O -14.370 -11.325 -2.529 1.00 . A A . 2 ALA O 1 1 3 887 1 1 3 GLU C C -13.456 -8.344 -5.465 1.00 . A A . 3 GLU C 1 1 3 888 1 1 3 GLU CA C -13.645 -9.552 -4.549 1.00 . A A . 3 GLU CA 1 1 3 889 1 1 3 GLU CB C -14.057 -10.794 -5.399 1.00 . A A . 3 GLU CB 1 1 3 890 1 1 3 GLU CD C -16.058 -9.414 -6.236 1.00 . A A . 3 GLU CD 1 1 3 891 1 1 3 GLU CG C -15.578 -10.797 -5.750 1.00 . A A . 3 GLU CG 1 1 3 892 1 1 3 GLU H H -15.162 -8.478 -3.461 1.00 . A A . 3 GLU H 1 1 3 893 1 1 3 GLU HA H -12.713 -9.692 -4.041 1.00 . A A . 3 GLU HA 1 1 3 894 1 1 3 GLU HB2 H -13.479 -10.828 -6.308 1.00 . A A . 3 GLU HB2 1 1 3 895 1 1 3 GLU HB3 H -13.838 -11.688 -4.833 1.00 . A A . 3 GLU HB3 1 1 3 896 1 1 3 GLU HG2 H -15.760 -11.520 -6.532 1.00 . A A . 3 GLU HG2 1 1 3 897 1 1 3 GLU HG3 H -16.154 -11.090 -4.883 1.00 . A A . 3 GLU HG3 1 1 3 898 1 1 3 GLU N N -14.671 -9.326 -3.487 1.00 . A A . 3 GLU N 1 1 3 899 1 1 3 GLU O O -12.751 -8.403 -6.454 1.00 . A A . 3 GLU O 1 1 3 900 1 1 3 GLU OE1 O -15.755 -9.102 -7.376 1.00 . A A . 3 GLU OE1 1 1 3 901 1 1 3 GLU OE2 O -16.696 -8.744 -5.440 1.00 . A A . 3 GLU OE2 1 1 3 902 1 1 4 PHE C C -12.705 -5.291 -5.594 1.00 . A A . 4 PHE C 1 1 3 903 1 1 4 PHE CA C -14.019 -6.017 -5.887 1.00 . A A . 4 PHE CA 1 1 3 904 1 1 4 PHE CB C -15.231 -5.100 -5.540 1.00 . A A . 4 PHE CB 1 1 3 905 1 1 4 PHE CD1 C -14.814 -4.039 -3.266 1.00 . A A . 4 PHE CD1 1 1 3 906 1 1 4 PHE CD2 C -16.367 -5.842 -3.396 1.00 . A A . 4 PHE CD2 1 1 3 907 1 1 4 PHE CE1 C -15.036 -3.944 -1.908 1.00 . A A . 4 PHE CE1 1 1 3 908 1 1 4 PHE CE2 C -16.590 -5.748 -2.039 1.00 . A A . 4 PHE CE2 1 1 3 909 1 1 4 PHE CG C -15.476 -4.990 -4.022 1.00 . A A . 4 PHE CG 1 1 3 910 1 1 4 PHE CZ C -15.925 -4.799 -1.293 1.00 . A A . 4 PHE CZ 1 1 3 911 1 1 4 PHE H H -14.632 -7.341 -4.272 1.00 . A A . 4 PHE H 1 1 3 912 1 1 4 PHE HA H -14.052 -6.265 -6.939 1.00 . A A . 4 PHE HA 1 1 3 913 1 1 4 PHE HB2 H -15.067 -4.108 -5.937 1.00 . A A . 4 PHE HB2 1 1 3 914 1 1 4 PHE HB3 H -16.121 -5.502 -6.003 1.00 . A A . 4 PHE HB3 1 1 3 915 1 1 4 PHE HD1 H -14.116 -3.363 -3.737 1.00 . A A . 4 PHE HD1 1 1 3 916 1 1 4 PHE HD2 H -16.893 -6.589 -3.972 1.00 . A A . 4 PHE HD2 1 1 3 917 1 1 4 PHE HE1 H -14.512 -3.199 -1.329 1.00 . A A . 4 PHE HE1 1 1 3 918 1 1 4 PHE HE2 H -17.290 -6.419 -1.560 1.00 . A A . 4 PHE HE2 1 1 3 919 1 1 4 PHE HZ H -16.101 -4.727 -0.230 1.00 . A A . 4 PHE HZ 1 1 3 920 1 1 4 PHE N N -14.102 -7.279 -5.091 1.00 . A A . 4 PHE N 1 1 3 921 1 1 4 PHE O O -12.027 -4.864 -6.503 1.00 . A A . 4 PHE O 1 1 3 922 1 1 5 ARG C C -9.850 -4.914 -4.623 1.00 . A A . 5 ARG C 1 1 3 923 1 1 5 ARG CA C -11.122 -4.498 -3.883 1.00 . A A . 5 ARG CA 1 1 3 924 1 1 5 ARG CB C -10.971 -4.763 -2.386 1.00 . A A . 5 ARG CB 1 1 3 925 1 1 5 ARG CD C -10.404 -3.589 -0.242 1.00 . A A . 5 ARG CD 1 1 3 926 1 1 5 ARG CG C -10.166 -3.617 -1.759 1.00 . A A . 5 ARG CG 1 1 3 927 1 1 5 ARG CZ C -12.379 -3.589 1.216 1.00 . A A . 5 ARG CZ 1 1 3 928 1 1 5 ARG H H -12.975 -5.564 -3.659 1.00 . A A . 5 ARG H 1 1 3 929 1 1 5 ARG HA H -11.251 -3.463 -4.077 1.00 . A A . 5 ARG HA 1 1 3 930 1 1 5 ARG HB2 H -11.953 -4.810 -1.942 1.00 . A A . 5 ARG HB2 1 1 3 931 1 1 5 ARG HB3 H -10.470 -5.705 -2.215 1.00 . A A . 5 ARG HB3 1 1 3 932 1 1 5 ARG HD2 H -10.061 -4.513 0.197 1.00 . A A . 5 ARG HD2 1 1 3 933 1 1 5 ARG HD3 H -9.874 -2.756 0.196 1.00 . A A . 5 ARG HD3 1 1 3 934 1 1 5 ARG HE H -12.466 -3.196 -0.725 1.00 . A A . 5 ARG HE 1 1 3 935 1 1 5 ARG HG2 H -9.120 -3.777 -1.970 1.00 . A A . 5 ARG HG2 1 1 3 936 1 1 5 ARG HG3 H -10.468 -2.676 -2.197 1.00 . A A . 5 ARG HG3 1 1 3 937 1 1 5 ARG HH11 H -10.627 -4.007 2.098 1.00 . A A . 5 ARG HH11 1 1 3 938 1 1 5 ARG HH12 H -12.012 -4.018 3.137 1.00 . A A . 5 ARG HH12 1 1 3 939 1 1 5 ARG HH21 H -14.239 -3.205 0.580 1.00 . A A . 5 ARG HH21 1 1 3 940 1 1 5 ARG HH22 H -14.080 -3.556 2.268 1.00 . A A . 5 ARG HH22 1 1 3 941 1 1 5 ARG N N -12.377 -5.183 -4.332 1.00 . A A . 5 ARG N 1 1 3 942 1 1 5 ARG NE N -11.871 -3.427 0.018 1.00 . A A . 5 ARG NE 1 1 3 943 1 1 5 ARG NH1 N -11.612 -3.895 2.228 1.00 . A A . 5 ARG NH1 1 1 3 944 1 1 5 ARG NH2 N -13.666 -3.439 1.366 1.00 . A A . 5 ARG NH2 1 1 3 945 1 1 5 ARG O O -8.853 -4.218 -4.659 1.00 . A A . 5 ARG O 1 1 3 946 1 1 6 HIS C C -8.393 -5.861 -7.132 1.00 . A A . 6 HIS C 1 1 3 947 1 1 6 HIS CA C -8.919 -6.740 -5.982 1.00 . A A . 6 HIS CA 1 1 3 948 1 1 6 HIS CB C -9.486 -8.051 -6.557 1.00 . A A . 6 HIS CB 1 1 3 949 1 1 6 HIS CD2 C -9.795 -8.922 -4.053 1.00 . A A . 6 HIS CD2 1 1 3 950 1 1 6 HIS CE1 C -10.526 -10.810 -4.502 1.00 . A A . 6 HIS CE1 1 1 3 951 1 1 6 HIS CG C -9.853 -9.033 -5.434 1.00 . A A . 6 HIS CG 1 1 3 952 1 1 6 HIS H H -10.863 -6.471 -5.045 1.00 . A A . 6 HIS H 1 1 3 953 1 1 6 HIS HA H -8.096 -6.964 -5.319 1.00 . A A . 6 HIS HA 1 1 3 954 1 1 6 HIS HB2 H -10.373 -7.845 -7.140 1.00 . A A . 6 HIS HB2 1 1 3 955 1 1 6 HIS HB3 H -8.754 -8.521 -7.197 1.00 . A A . 6 HIS HB3 1 1 3 956 1 1 6 HIS HD1 H -10.477 -10.621 -6.516 1.00 . A A . 6 HIS HD1 1 1 3 957 1 1 6 HIS HD2 H -9.453 -8.051 -3.513 1.00 . A A . 6 HIS HD2 1 1 3 958 1 1 6 HIS HE1 H -10.912 -11.815 -4.403 1.00 . A A . 6 HIS HE1 1 1 3 959 1 1 6 HIS N N -9.989 -6.068 -5.186 1.00 . A A . 6 HIS N 1 1 3 960 1 1 6 HIS ND1 N -10.313 -10.224 -5.636 1.00 . A A . 6 HIS ND1 1 1 3 961 1 1 6 HIS NE2 N -10.217 -10.037 -3.490 1.00 . A A . 6 HIS NE2 1 1 3 962 1 1 6 HIS O O -7.196 -5.773 -7.328 1.00 . A A . 6 HIS O 1 1 3 963 1 1 7 ASP C C -10.083 -3.611 -9.621 1.00 . A A . 7 ASP C 1 1 3 964 1 1 7 ASP CA C -8.894 -4.354 -8.999 1.00 . A A . 7 ASP CA 1 1 3 965 1 1 7 ASP CB C -8.200 -5.222 -10.093 1.00 . A A . 7 ASP CB 1 1 3 966 1 1 7 ASP CG C -6.968 -4.472 -10.620 1.00 . A A . 7 ASP CG 1 1 3 967 1 1 7 ASP H H -10.245 -5.334 -7.631 1.00 . A A . 7 ASP H 1 1 3 968 1 1 7 ASP HA H -8.241 -3.600 -8.598 1.00 . A A . 7 ASP HA 1 1 3 969 1 1 7 ASP HB2 H -7.885 -6.176 -9.694 1.00 . A A . 7 ASP HB2 1 1 3 970 1 1 7 ASP HB3 H -8.873 -5.418 -10.917 1.00 . A A . 7 ASP HB3 1 1 3 971 1 1 7 ASP N N -9.296 -5.235 -7.852 1.00 . A A . 7 ASP N 1 1 3 972 1 1 7 ASP O O -9.998 -3.079 -10.712 1.00 . A A . 7 ASP O 1 1 3 973 1 1 7 ASP OD1 O -5.917 -4.680 -10.036 1.00 . A A . 7 ASP OD1 1 1 3 974 1 1 7 ASP OD2 O -7.149 -3.731 -11.574 1.00 . A A . 7 ASP OD2 1 1 3 975 1 1 8 SER C C -13.125 -2.390 -8.050 1.00 . A A . 8 SER C 1 1 3 976 1 1 8 SER CA C -12.425 -2.934 -9.306 1.00 . A A . 8 SER CA 1 1 3 977 1 1 8 SER CB C -13.318 -3.969 -10.021 1.00 . A A . 8 SER CB 1 1 3 978 1 1 8 SER H H -11.132 -4.054 -8.021 1.00 . A A . 8 SER H 1 1 3 979 1 1 8 SER HA H -12.193 -2.101 -9.954 1.00 . A A . 8 SER HA 1 1 3 980 1 1 8 SER HB2 H -13.475 -4.848 -9.412 1.00 . A A . 8 SER HB2 1 1 3 981 1 1 8 SER HB3 H -14.268 -3.544 -10.314 1.00 . A A . 8 SER HB3 1 1 3 982 1 1 8 SER HG H -13.111 -4.092 -11.951 1.00 . A A . 8 SER HG 1 1 3 983 1 1 8 SER N N -11.156 -3.604 -8.884 1.00 . A A . 8 SER N 1 1 3 984 1 1 8 SER O O -14.338 -2.345 -7.970 1.00 . A A . 8 SER O 1 1 3 985 1 1 8 SER OG O -12.583 -4.324 -11.184 1.00 . A A . 8 SER OG 1 1 3 986 1 1 9 GLY C C -12.259 -0.020 -5.620 1.00 . A A . 9 GLY C 1 1 3 987 1 1 9 GLY CA C -12.810 -1.433 -5.813 1.00 . A A . 9 GLY CA 1 1 3 988 1 1 9 GLY H H -11.344 -2.063 -7.254 1.00 . A A . 9 GLY H 1 1 3 989 1 1 9 GLY HA2 H -13.890 -1.398 -5.809 1.00 . A A . 9 GLY HA2 1 1 3 990 1 1 9 GLY HA3 H -12.471 -2.057 -5.002 1.00 . A A . 9 GLY HA3 1 1 3 991 1 1 9 GLY N N -12.310 -1.991 -7.105 1.00 . A A . 9 GLY N 1 1 3 992 1 1 9 GLY O O -12.971 0.861 -5.181 1.00 . A A . 9 GLY O 1 1 3 993 1 1 10 TYR C C -9.392 1.711 -7.008 1.00 . A A . 10 TYR C 1 1 3 994 1 1 10 TYR CA C -10.337 1.473 -5.821 1.00 . A A . 10 TYR CA 1 1 3 995 1 1 10 TYR CB C -9.557 1.497 -4.455 1.00 . A A . 10 TYR CB 1 1 3 996 1 1 10 TYR CD1 C -7.610 -0.013 -5.067 1.00 . A A . 10 TYR CD1 1 1 3 997 1 1 10 TYR CD2 C -7.117 2.242 -4.494 1.00 . A A . 10 TYR CD2 1 1 3 998 1 1 10 TYR CE1 C -6.272 -0.255 -5.285 1.00 . A A . 10 TYR CE1 1 1 3 999 1 1 10 TYR CE2 C -5.779 2.000 -4.711 1.00 . A A . 10 TYR CE2 1 1 3 1000 1 1 10 TYR CG C -8.049 1.235 -4.672 1.00 . A A . 10 TYR CG 1 1 3 1001 1 1 10 TYR CZ C -5.344 0.751 -5.108 1.00 . A A . 10 TYR CZ 1 1 3 1002 1 1 10 TYR H H -10.472 -0.595 -6.301 1.00 . A A . 10 TYR H 1 1 3 1003 1 1 10 TYR HA H -11.094 2.236 -5.839 1.00 . A A . 10 TYR HA 1 1 3 1004 1 1 10 TYR HB2 H -9.682 2.462 -3.985 1.00 . A A . 10 TYR HB2 1 1 3 1005 1 1 10 TYR HB3 H -9.945 0.740 -3.787 1.00 . A A . 10 TYR HB3 1 1 3 1006 1 1 10 TYR HD1 H -8.323 -0.811 -5.210 1.00 . A A . 10 TYR HD1 1 1 3 1007 1 1 10 TYR HD2 H -7.432 3.228 -4.183 1.00 . A A . 10 TYR HD2 1 1 3 1008 1 1 10 TYR HE1 H -5.956 -1.240 -5.595 1.00 . A A . 10 TYR HE1 1 1 3 1009 1 1 10 TYR HE2 H -5.065 2.795 -4.569 1.00 . A A . 10 TYR HE2 1 1 3 1010 1 1 10 TYR HH H -3.806 0.744 -6.238 1.00 . A A . 10 TYR HH 1 1 3 1011 1 1 10 TYR N N -11.002 0.149 -5.955 1.00 . A A . 10 TYR N 1 1 3 1012 1 1 10 TYR O O -9.257 0.894 -7.899 1.00 . A A . 10 TYR O 1 1 3 1013 1 1 10 TYR OH O -4.002 0.517 -5.326 1.00 . A A . 10 TYR OH 1 1 3 1014 1 1 11 GLU C C -7.186 4.598 -7.412 1.00 . A A . 11 GLU C 1 1 3 1015 1 1 11 GLU CA C -7.800 3.322 -7.969 1.00 . A A . 11 GLU CA 1 1 3 1016 1 1 11 GLU CB C -8.524 3.603 -9.324 1.00 . A A . 11 GLU CB 1 1 3 1017 1 1 11 GLU CD C -10.699 4.384 -8.259 1.00 . A A . 11 GLU CD 1 1 3 1018 1 1 11 GLU CG C -9.555 4.754 -9.226 1.00 . A A . 11 GLU CG 1 1 3 1019 1 1 11 GLU H H -8.961 3.444 -6.181 1.00 . A A . 11 GLU H 1 1 3 1020 1 1 11 GLU HA H -7.014 2.588 -8.072 1.00 . A A . 11 GLU HA 1 1 3 1021 1 1 11 GLU HB2 H -7.781 3.870 -10.061 1.00 . A A . 11 GLU HB2 1 1 3 1022 1 1 11 GLU HB3 H -9.018 2.706 -9.663 1.00 . A A . 11 GLU HB3 1 1 3 1023 1 1 11 GLU HG2 H -9.071 5.662 -8.895 1.00 . A A . 11 GLU HG2 1 1 3 1024 1 1 11 GLU HG3 H -9.971 4.933 -10.206 1.00 . A A . 11 GLU HG3 1 1 3 1025 1 1 11 GLU N N -8.774 2.857 -6.943 1.00 . A A . 11 GLU N 1 1 3 1026 1 1 11 GLU O O -7.860 5.400 -6.793 1.00 . A A . 11 GLU O 1 1 3 1027 1 1 11 GLU OE1 O -11.475 3.521 -8.635 1.00 . A A . 11 GLU OE1 1 1 3 1028 1 1 11 GLU OE2 O -10.730 4.982 -7.196 1.00 . A A . 11 GLU OE2 1 1 3 1029 1 1 12 VAL C C -4.135 6.352 -8.204 1.00 . A A . 12 VAL C 1 1 3 1030 1 1 12 VAL CA C -5.169 5.929 -7.169 1.00 . A A . 12 VAL CA 1 1 3 1031 1 1 12 VAL CB C -4.524 5.532 -5.802 1.00 . A A . 12 VAL CB 1 1 3 1032 1 1 12 VAL CG1 C -3.297 6.386 -5.443 1.00 . A A . 12 VAL CG1 1 1 3 1033 1 1 12 VAL CG2 C -5.569 5.749 -4.711 1.00 . A A . 12 VAL CG2 1 1 3 1034 1 1 12 VAL H H -5.449 4.042 -8.165 1.00 . A A . 12 VAL H 1 1 3 1035 1 1 12 VAL HA H -5.861 6.751 -7.037 1.00 . A A . 12 VAL HA 1 1 3 1036 1 1 12 VAL HB H -4.238 4.490 -5.823 1.00 . A A . 12 VAL HB 1 1 3 1037 1 1 12 VAL HG11 H -3.489 7.416 -5.699 1.00 . A A . 12 VAL HG11 1 1 3 1038 1 1 12 VAL HG12 H -3.089 6.319 -4.386 1.00 . A A . 12 VAL HG12 1 1 3 1039 1 1 12 VAL HG13 H -2.435 6.029 -5.981 1.00 . A A . 12 VAL HG13 1 1 3 1040 1 1 12 VAL HG21 H -5.930 6.767 -4.755 1.00 . A A . 12 VAL HG21 1 1 3 1041 1 1 12 VAL HG22 H -6.395 5.073 -4.860 1.00 . A A . 12 VAL HG22 1 1 3 1042 1 1 12 VAL HG23 H -5.134 5.566 -3.741 1.00 . A A . 12 VAL HG23 1 1 3 1043 1 1 12 VAL N N -5.914 4.736 -7.655 1.00 . A A . 12 VAL N 1 1 3 1044 1 1 12 VAL O O -4.188 7.460 -8.695 1.00 . A A . 12 VAL O 1 1 3 1045 1 1 13 HIS C C -1.161 6.802 -9.024 1.00 . A A . 13 HIS C 1 1 3 1046 1 1 13 HIS CA C -2.139 5.705 -9.495 1.00 . A A . 13 HIS CA 1 1 3 1047 1 1 13 HIS CB C -2.760 6.098 -10.870 1.00 . A A . 13 HIS CB 1 1 3 1048 1 1 13 HIS CD2 C -4.525 4.128 -10.882 1.00 . A A . 13 HIS CD2 1 1 3 1049 1 1 13 HIS CE1 C -4.003 3.257 -12.688 1.00 . A A . 13 HIS CE1 1 1 3 1050 1 1 13 HIS CG C -3.481 4.862 -11.415 1.00 . A A . 13 HIS CG 1 1 3 1051 1 1 13 HIS H H -3.279 4.582 -8.056 1.00 . A A . 13 HIS H 1 1 3 1052 1 1 13 HIS HA H -1.588 4.786 -9.615 1.00 . A A . 13 HIS HA 1 1 3 1053 1 1 13 HIS HB2 H -3.460 6.914 -10.800 1.00 . A A . 13 HIS HB2 1 1 3 1054 1 1 13 HIS HB3 H -1.978 6.370 -11.565 1.00 . A A . 13 HIS HB3 1 1 3 1055 1 1 13 HIS HD1 H -2.511 4.542 -13.159 1.00 . A A . 13 HIS HD1 1 1 3 1056 1 1 13 HIS HD2 H -5.005 4.341 -9.941 1.00 . A A . 13 HIS HD2 1 1 3 1057 1 1 13 HIS HE1 H -3.979 2.596 -13.542 1.00 . A A . 13 HIS HE1 1 1 3 1058 1 1 13 HIS N N -3.233 5.454 -8.502 1.00 . A A . 13 HIS N 1 1 3 1059 1 1 13 HIS ND1 N -3.210 4.269 -12.529 1.00 . A A . 13 HIS ND1 1 1 3 1060 1 1 13 HIS NE2 N -4.839 3.131 -11.686 1.00 . A A . 13 HIS NE2 1 1 3 1061 1 1 13 HIS O O -0.201 7.096 -9.708 1.00 . A A . 13 HIS O 1 1 3 1062 1 1 14 HIS C C 0.483 7.653 -6.498 1.00 . A A . 14 HIS C 1 1 3 1063 1 1 14 HIS CA C -0.532 8.447 -7.332 1.00 . A A . 14 HIS CA 1 1 3 1064 1 1 14 HIS CB C -1.320 9.431 -6.431 1.00 . A A . 14 HIS CB 1 1 3 1065 1 1 14 HIS CD2 C -3.001 10.453 -8.145 1.00 . A A . 14 HIS CD2 1 1 3 1066 1 1 14 HIS CE1 C -2.259 12.384 -8.239 1.00 . A A . 14 HIS CE1 1 1 3 1067 1 1 14 HIS CG C -1.921 10.523 -7.303 1.00 . A A . 14 HIS CG 1 1 3 1068 1 1 14 HIS H H -2.215 7.134 -7.368 1.00 . A A . 14 HIS H 1 1 3 1069 1 1 14 HIS HA H -0.067 8.964 -8.145 1.00 . A A . 14 HIS HA 1 1 3 1070 1 1 14 HIS HB2 H -2.117 8.928 -5.910 1.00 . A A . 14 HIS HB2 1 1 3 1071 1 1 14 HIS HB3 H -0.664 9.897 -5.711 1.00 . A A . 14 HIS HB3 1 1 3 1072 1 1 14 HIS HD1 H -0.740 12.121 -6.925 1.00 . A A . 14 HIS HD1 1 1 3 1073 1 1 14 HIS HD2 H -3.576 9.557 -8.288 1.00 . A A . 14 HIS HD2 1 1 3 1074 1 1 14 HIS HE1 H -2.125 13.423 -8.502 1.00 . A A . 14 HIS HE1 1 1 3 1075 1 1 14 HIS N N -1.426 7.386 -7.877 1.00 . A A . 14 HIS N 1 1 3 1076 1 1 14 HIS ND1 N -1.505 11.742 -7.404 1.00 . A A . 14 HIS ND1 1 1 3 1077 1 1 14 HIS NE2 N -3.206 11.619 -8.726 1.00 . A A . 14 HIS NE2 1 1 3 1078 1 1 14 HIS O O 1.428 7.112 -7.036 1.00 . A A . 14 HIS O 1 1 3 1079 1 1 15 GLN C C 1.254 5.376 -4.748 1.00 . A A . 15 GLN C 1 1 3 1080 1 1 15 GLN CA C 1.182 6.833 -4.293 1.00 . A A . 15 GLN CA 1 1 3 1081 1 1 15 GLN CB C 0.658 6.875 -2.839 1.00 . A A . 15 GLN CB 1 1 3 1082 1 1 15 GLN CD C -1.457 8.236 -2.632 1.00 . A A . 15 GLN CD 1 1 3 1083 1 1 15 GLN CG C 0.070 8.259 -2.470 1.00 . A A . 15 GLN CG 1 1 3 1084 1 1 15 GLN H H -0.534 8.033 -4.840 1.00 . A A . 15 GLN H 1 1 3 1085 1 1 15 GLN HA H 2.171 7.253 -4.366 1.00 . A A . 15 GLN HA 1 1 3 1086 1 1 15 GLN HB2 H -0.095 6.110 -2.706 1.00 . A A . 15 GLN HB2 1 1 3 1087 1 1 15 GLN HB3 H 1.477 6.654 -2.171 1.00 . A A . 15 GLN HB3 1 1 3 1088 1 1 15 GLN HE21 H -1.474 9.760 -3.899 1.00 . A A . 15 GLN HE21 1 1 3 1089 1 1 15 GLN HE22 H -2.995 9.101 -3.535 1.00 . A A . 15 GLN HE22 1 1 3 1090 1 1 15 GLN HG2 H 0.299 8.491 -1.440 1.00 . A A . 15 GLN HG2 1 1 3 1091 1 1 15 GLN HG3 H 0.481 9.038 -3.099 1.00 . A A . 15 GLN HG3 1 1 3 1092 1 1 15 GLN N N 0.256 7.585 -5.206 1.00 . A A . 15 GLN N 1 1 3 1093 1 1 15 GLN NE2 N -2.022 9.105 -3.421 1.00 . A A . 15 GLN NE2 1 1 3 1094 1 1 15 GLN O O 2.241 4.698 -4.555 1.00 . A A . 15 GLN O 1 1 3 1095 1 1 15 GLN OE1 O -2.149 7.429 -2.043 1.00 . A A . 15 GLN OE1 1 1 3 1096 1 1 16 GLU C C 1.257 3.110 -6.652 1.00 . A A . 16 GLU C 1 1 3 1097 1 1 16 GLU CA C 0.017 3.582 -5.875 1.00 . A A . 16 GLU CA 1 1 3 1098 1 1 16 GLU CB C -1.217 3.592 -6.759 1.00 . A A . 16 GLU CB 1 1 3 1099 1 1 16 GLU CD C -2.681 2.296 -8.296 1.00 . A A . 16 GLU CD 1 1 3 1100 1 1 16 GLU CG C -1.414 2.229 -7.416 1.00 . A A . 16 GLU CG 1 1 3 1101 1 1 16 GLU H H -0.576 5.588 -5.454 1.00 . A A . 16 GLU H 1 1 3 1102 1 1 16 GLU HA H -0.152 2.915 -5.047 1.00 . A A . 16 GLU HA 1 1 3 1103 1 1 16 GLU HB2 H -2.081 3.828 -6.156 1.00 . A A . 16 GLU HB2 1 1 3 1104 1 1 16 GLU HB3 H -1.101 4.352 -7.514 1.00 . A A . 16 GLU HB3 1 1 3 1105 1 1 16 GLU HG2 H -0.548 1.993 -8.020 1.00 . A A . 16 GLU HG2 1 1 3 1106 1 1 16 GLU HG3 H -1.516 1.471 -6.652 1.00 . A A . 16 GLU HG3 1 1 3 1107 1 1 16 GLU N N 0.169 4.962 -5.347 1.00 . A A . 16 GLU N 1 1 3 1108 1 1 16 GLU O O 1.758 2.029 -6.413 1.00 . A A . 16 GLU O 1 1 3 1109 1 1 16 GLU OE1 O -3.755 2.383 -7.719 1.00 . A A . 16 GLU OE1 1 1 3 1110 1 1 16 GLU OE2 O -2.504 2.259 -9.502 1.00 . A A . 16 GLU OE2 1 1 3 1111 1 1 17 LEU C C 4.157 3.991 -7.639 1.00 . A A . 17 LEU C 1 1 3 1112 1 1 17 LEU CA C 2.907 3.595 -8.376 1.00 . A A . 17 LEU CA 1 1 3 1113 1 1 17 LEU CB C 2.881 4.328 -9.742 1.00 . A A . 17 LEU CB 1 1 3 1114 1 1 17 LEU CD1 C 1.447 5.373 -11.518 1.00 . A A . 17 LEU CD1 1 1 3 1115 1 1 17 LEU CD2 C 0.779 3.154 -10.538 1.00 . A A . 17 LEU CD2 1 1 3 1116 1 1 17 LEU CG C 1.435 4.522 -10.232 1.00 . A A . 17 LEU CG 1 1 3 1117 1 1 17 LEU H H 1.269 4.804 -7.689 1.00 . A A . 17 LEU H 1 1 3 1118 1 1 17 LEU HA H 2.924 2.531 -8.472 1.00 . A A . 17 LEU HA 1 1 3 1119 1 1 17 LEU HB2 H 3.351 5.296 -9.646 1.00 . A A . 17 LEU HB2 1 1 3 1120 1 1 17 LEU HB3 H 3.440 3.751 -10.466 1.00 . A A . 17 LEU HB3 1 1 3 1121 1 1 17 LEU HD11 H 2.036 4.888 -12.283 1.00 . A A . 17 LEU HD11 1 1 3 1122 1 1 17 LEU HD12 H 0.441 5.506 -11.886 1.00 . A A . 17 LEU HD12 1 1 3 1123 1 1 17 LEU HD13 H 1.873 6.345 -11.316 1.00 . A A . 17 LEU HD13 1 1 3 1124 1 1 17 LEU HD21 H 0.765 2.536 -9.653 1.00 . A A . 17 LEU HD21 1 1 3 1125 1 1 17 LEU HD22 H -0.237 3.296 -10.876 1.00 . A A . 17 LEU HD22 1 1 3 1126 1 1 17 LEU HD23 H 1.331 2.638 -11.309 1.00 . A A . 17 LEU HD23 1 1 3 1127 1 1 17 LEU HG H 0.902 5.036 -9.446 1.00 . A A . 17 LEU HG 1 1 3 1128 1 1 17 LEU N N 1.710 3.945 -7.554 1.00 . A A . 17 LEU N 1 1 3 1129 1 1 17 LEU O O 5.228 3.473 -7.869 1.00 . A A . 17 LEU O 1 1 3 1130 1 1 18 VAL C C 5.553 4.233 -5.030 1.00 . A A . 18 VAL C 1 1 3 1131 1 1 18 VAL CA C 5.172 5.378 -5.967 1.00 . A A . 18 VAL CA 1 1 3 1132 1 1 18 VAL CB C 4.782 6.623 -5.194 1.00 . A A . 18 VAL CB 1 1 3 1133 1 1 18 VAL CG1 C 5.999 7.148 -4.408 1.00 . A A . 18 VAL CG1 1 1 3 1134 1 1 18 VAL CG2 C 4.348 7.657 -6.244 1.00 . A A . 18 VAL CG2 1 1 3 1135 1 1 18 VAL H H 3.106 5.326 -6.634 1.00 . A A . 18 VAL H 1 1 3 1136 1 1 18 VAL HA H 5.993 5.580 -6.639 1.00 . A A . 18 VAL HA 1 1 3 1137 1 1 18 VAL HB H 3.985 6.401 -4.506 1.00 . A A . 18 VAL HB 1 1 3 1138 1 1 18 VAL HG11 H 6.894 7.090 -5.009 1.00 . A A . 18 VAL HG11 1 1 3 1139 1 1 18 VAL HG12 H 5.838 8.169 -4.102 1.00 . A A . 18 VAL HG12 1 1 3 1140 1 1 18 VAL HG13 H 6.142 6.547 -3.524 1.00 . A A . 18 VAL HG13 1 1 3 1141 1 1 18 VAL HG21 H 3.780 7.181 -7.031 1.00 . A A . 18 VAL HG21 1 1 3 1142 1 1 18 VAL HG22 H 3.735 8.410 -5.784 1.00 . A A . 18 VAL HG22 1 1 3 1143 1 1 18 VAL HG23 H 5.220 8.102 -6.695 1.00 . A A . 18 VAL HG23 1 1 3 1144 1 1 18 VAL N N 3.994 4.928 -6.756 1.00 . A A . 18 VAL N 1 1 3 1145 1 1 18 VAL O O 6.636 4.222 -4.485 1.00 . A A . 18 VAL O 1 1 3 1146 1 1 19 PHE C C 5.893 1.226 -4.749 1.00 . A A . 19 PHE C 1 1 3 1147 1 1 19 PHE CA C 4.916 2.132 -3.992 1.00 . A A . 19 PHE CA 1 1 3 1148 1 1 19 PHE CB C 3.619 1.354 -3.718 1.00 . A A . 19 PHE CB 1 1 3 1149 1 1 19 PHE CD1 C 2.912 3.210 -2.109 1.00 . A A . 19 PHE CD1 1 1 3 1150 1 1 19 PHE CD2 C 1.224 1.938 -3.205 1.00 . A A . 19 PHE CD2 1 1 3 1151 1 1 19 PHE CE1 C 1.943 3.943 -1.459 1.00 . A A . 19 PHE CE1 1 1 3 1152 1 1 19 PHE CE2 C 0.253 2.672 -2.555 1.00 . A A . 19 PHE CE2 1 1 3 1153 1 1 19 PHE CG C 2.563 2.200 -2.987 1.00 . A A . 19 PHE CG 1 1 3 1154 1 1 19 PHE CZ C 0.610 3.674 -1.681 1.00 . A A . 19 PHE CZ 1 1 3 1155 1 1 19 PHE H H 3.785 3.359 -5.351 1.00 . A A . 19 PHE H 1 1 3 1156 1 1 19 PHE HA H 5.383 2.493 -3.092 1.00 . A A . 19 PHE HA 1 1 3 1157 1 1 19 PHE HB2 H 3.201 1.009 -4.653 1.00 . A A . 19 PHE HB2 1 1 3 1158 1 1 19 PHE HB3 H 3.838 0.491 -3.106 1.00 . A A . 19 PHE HB3 1 1 3 1159 1 1 19 PHE HD1 H 3.950 3.431 -1.932 1.00 . A A . 19 PHE HD1 1 1 3 1160 1 1 19 PHE HD2 H 0.937 1.157 -3.897 1.00 . A A . 19 PHE HD2 1 1 3 1161 1 1 19 PHE HE1 H 2.229 4.729 -0.774 1.00 . A A . 19 PHE HE1 1 1 3 1162 1 1 19 PHE HE2 H -0.792 2.459 -2.732 1.00 . A A . 19 PHE HE2 1 1 3 1163 1 1 19 PHE HZ H -0.151 4.247 -1.172 1.00 . A A . 19 PHE HZ 1 1 3 1164 1 1 19 PHE N N 4.644 3.298 -4.878 1.00 . A A . 19 PHE N 1 1 3 1165 1 1 19 PHE O O 6.617 0.439 -4.172 1.00 . A A . 19 PHE O 1 1 3 1166 1 1 20 PHE C C 8.057 1.395 -7.002 1.00 . A A . 20 PHE C 1 1 3 1167 1 1 20 PHE CA C 6.741 0.611 -6.958 1.00 . A A . 20 PHE CA 1 1 3 1168 1 1 20 PHE CB C 6.031 0.525 -8.337 1.00 . A A . 20 PHE CB 1 1 3 1169 1 1 20 PHE CD1 C 7.894 -0.388 -9.791 1.00 . A A . 20 PHE CD1 1 1 3 1170 1 1 20 PHE CD2 C 7.111 1.820 -10.239 1.00 . A A . 20 PHE CD2 1 1 3 1171 1 1 20 PHE CE1 C 8.806 -0.275 -10.818 1.00 . A A . 20 PHE CE1 1 1 3 1172 1 1 20 PHE CE2 C 8.024 1.935 -11.265 1.00 . A A . 20 PHE CE2 1 1 3 1173 1 1 20 PHE CG C 7.039 0.656 -9.494 1.00 . A A . 20 PHE CG 1 1 3 1174 1 1 20 PHE CZ C 8.873 0.888 -11.556 1.00 . A A . 20 PHE CZ 1 1 3 1175 1 1 20 PHE H H 5.248 2.071 -6.414 1.00 . A A . 20 PHE H 1 1 3 1176 1 1 20 PHE HA H 6.916 -0.373 -6.546 1.00 . A A . 20 PHE HA 1 1 3 1177 1 1 20 PHE HB2 H 5.531 -0.428 -8.411 1.00 . A A . 20 PHE HB2 1 1 3 1178 1 1 20 PHE HB3 H 5.278 1.293 -8.428 1.00 . A A . 20 PHE HB3 1 1 3 1179 1 1 20 PHE HD1 H 7.845 -1.303 -9.218 1.00 . A A . 20 PHE HD1 1 1 3 1180 1 1 20 PHE HD2 H 6.449 2.646 -10.019 1.00 . A A . 20 PHE HD2 1 1 3 1181 1 1 20 PHE HE1 H 9.471 -1.097 -11.044 1.00 . A A . 20 PHE HE1 1 1 3 1182 1 1 20 PHE HE2 H 8.075 2.846 -11.843 1.00 . A A . 20 PHE HE2 1 1 3 1183 1 1 20 PHE HZ H 9.588 0.978 -12.360 1.00 . A A . 20 PHE HZ 1 1 3 1184 1 1 20 PHE N N 5.863 1.397 -6.046 1.00 . A A . 20 PHE N 1 1 3 1185 1 1 20 PHE O O 9.133 0.843 -6.902 1.00 . A A . 20 PHE O 1 1 3 1186 1 1 21 ALA C C 9.865 3.390 -5.896 1.00 . A A . 21 ALA C 1 1 3 1187 1 1 21 ALA CA C 9.108 3.584 -7.206 1.00 . A A . 21 ALA CA 1 1 3 1188 1 1 21 ALA CB C 8.639 5.030 -7.341 1.00 . A A . 21 ALA CB 1 1 3 1189 1 1 21 ALA H H 7.028 3.065 -7.231 1.00 . A A . 21 ALA H 1 1 3 1190 1 1 21 ALA HA H 9.738 3.286 -8.029 1.00 . A A . 21 ALA HA 1 1 3 1191 1 1 21 ALA HB1 H 7.901 5.108 -8.126 1.00 . A A . 21 ALA HB1 1 1 3 1192 1 1 21 ALA HB2 H 8.202 5.372 -6.414 1.00 . A A . 21 ALA HB2 1 1 3 1193 1 1 21 ALA HB3 H 9.478 5.663 -7.580 1.00 . A A . 21 ALA HB3 1 1 3 1194 1 1 21 ALA N N 7.922 2.687 -7.153 1.00 . A A . 21 ALA N 1 1 3 1195 1 1 21 ALA O O 11.072 3.501 -5.851 1.00 . A A . 21 ALA O 1 1 3 1196 1 1 22 GLU C C 10.573 1.620 -3.559 1.00 . A A . 22 GLU C 1 1 3 1197 1 1 22 GLU CA C 9.689 2.874 -3.523 1.00 . A A . 22 GLU CA 1 1 3 1198 1 1 22 GLU CB C 8.554 2.687 -2.494 1.00 . A A . 22 GLU CB 1 1 3 1199 1 1 22 GLU CD C 6.740 4.007 -1.323 1.00 . A A . 22 GLU CD 1 1 3 1200 1 1 22 GLU CG C 8.192 4.044 -1.842 1.00 . A A . 22 GLU CG 1 1 3 1201 1 1 22 GLU H H 8.128 3.026 -5.001 1.00 . A A . 22 GLU H 1 1 3 1202 1 1 22 GLU HA H 10.296 3.729 -3.296 1.00 . A A . 22 GLU HA 1 1 3 1203 1 1 22 GLU HB2 H 7.687 2.275 -2.983 1.00 . A A . 22 GLU HB2 1 1 3 1204 1 1 22 GLU HB3 H 8.863 2.001 -1.719 1.00 . A A . 22 GLU HB3 1 1 3 1205 1 1 22 GLU HG2 H 8.853 4.239 -1.010 1.00 . A A . 22 GLU HG2 1 1 3 1206 1 1 22 GLU HG3 H 8.297 4.847 -2.560 1.00 . A A . 22 GLU HG3 1 1 3 1207 1 1 22 GLU N N 9.100 3.097 -4.872 1.00 . A A . 22 GLU N 1 1 3 1208 1 1 22 GLU O O 11.642 1.592 -2.979 1.00 . A A . 22 GLU O 1 1 3 1209 1 1 22 GLU OE1 O 6.466 3.141 -0.508 1.00 . A A . 22 GLU OE1 1 1 3 1210 1 1 22 GLU OE2 O 5.978 4.848 -1.770 1.00 . A A . 22 GLU OE2 1 1 3 1211 1 1 23 ASP C C 12.134 -0.398 -5.132 1.00 . A A . 23 ASP C 1 1 3 1212 1 1 23 ASP CA C 10.817 -0.674 -4.390 1.00 . A A . 23 ASP CA 1 1 3 1213 1 1 23 ASP CB C 9.884 -1.678 -5.165 1.00 . A A . 23 ASP CB 1 1 3 1214 1 1 23 ASP CG C 10.494 -2.181 -6.494 1.00 . A A . 23 ASP CG 1 1 3 1215 1 1 23 ASP H H 9.211 0.743 -4.686 1.00 . A A . 23 ASP H 1 1 3 1216 1 1 23 ASP HA H 11.039 -1.057 -3.404 1.00 . A A . 23 ASP HA 1 1 3 1217 1 1 23 ASP HB2 H 9.696 -2.534 -4.534 1.00 . A A . 23 ASP HB2 1 1 3 1218 1 1 23 ASP HB3 H 8.931 -1.214 -5.372 1.00 . A A . 23 ASP HB3 1 1 3 1219 1 1 23 ASP N N 10.080 0.623 -4.252 1.00 . A A . 23 ASP N 1 1 3 1220 1 1 23 ASP O O 13.191 -0.817 -4.700 1.00 . A A . 23 ASP O 1 1 3 1221 1 1 23 ASP OD1 O 11.340 -3.055 -6.404 1.00 . A A . 23 ASP OD1 1 1 3 1222 1 1 23 ASP OD2 O 10.083 -1.664 -7.520 1.00 . A A . 23 ASP OD2 1 1 3 1223 1 1 24 VAL C C 14.230 1.368 -6.195 1.00 . A A . 24 VAL C 1 1 3 1224 1 1 24 VAL CA C 13.178 0.674 -7.083 1.00 . A A . 24 VAL CA 1 1 3 1225 1 1 24 VAL CB C 12.679 1.624 -8.212 1.00 . A A . 24 VAL CB 1 1 3 1226 1 1 24 VAL CG1 C 13.866 2.181 -9.027 1.00 . A A . 24 VAL CG1 1 1 3 1227 1 1 24 VAL CG2 C 11.736 0.850 -9.159 1.00 . A A . 24 VAL CG2 1 1 3 1228 1 1 24 VAL H H 11.101 0.577 -6.493 1.00 . A A . 24 VAL H 1 1 3 1229 1 1 24 VAL HA H 13.606 -0.227 -7.499 1.00 . A A . 24 VAL HA 1 1 3 1230 1 1 24 VAL HB H 12.138 2.450 -7.779 1.00 . A A . 24 VAL HB 1 1 3 1231 1 1 24 VAL HG11 H 14.511 1.379 -9.354 1.00 . A A . 24 VAL HG11 1 1 3 1232 1 1 24 VAL HG12 H 13.497 2.708 -9.894 1.00 . A A . 24 VAL HG12 1 1 3 1233 1 1 24 VAL HG13 H 14.442 2.870 -8.427 1.00 . A A . 24 VAL HG13 1 1 3 1234 1 1 24 VAL HG21 H 12.193 -0.074 -9.479 1.00 . A A . 24 VAL HG21 1 1 3 1235 1 1 24 VAL HG22 H 10.810 0.620 -8.653 1.00 . A A . 24 VAL HG22 1 1 3 1236 1 1 24 VAL HG23 H 11.508 1.447 -10.031 1.00 . A A . 24 VAL HG23 1 1 3 1237 1 1 24 VAL N N 12.003 0.303 -6.231 1.00 . A A . 24 VAL N 1 1 3 1238 1 1 24 VAL O O 15.380 0.974 -6.154 1.00 . A A . 24 VAL O 1 1 3 1239 1 1 25 GLY C C 13.974 4.556 -4.461 1.00 . A A . 25 GLY C 1 1 3 1240 1 1 25 GLY CA C 14.637 3.187 -4.600 1.00 . A A . 25 GLY CA 1 1 3 1241 1 1 25 GLY H H 12.838 2.649 -5.612 1.00 . A A . 25 GLY H 1 1 3 1242 1 1 25 GLY HA2 H 14.688 2.703 -3.636 1.00 . A A . 25 GLY HA2 1 1 3 1243 1 1 25 GLY HA3 H 15.625 3.298 -5.020 1.00 . A A . 25 GLY HA3 1 1 3 1244 1 1 25 GLY N N 13.775 2.389 -5.517 1.00 . A A . 25 GLY N 1 1 3 1245 1 1 25 GLY O O 13.641 4.992 -3.376 1.00 . A A . 25 GLY O 1 1 3 1246 1 1 26 SER C C 12.885 6.790 -7.171 1.00 . A A . 26 SER C 1 1 3 1247 1 1 26 SER CA C 13.180 6.532 -5.684 1.00 . A A . 26 SER CA 1 1 3 1248 1 1 26 SER CB C 14.166 7.586 -5.118 1.00 . A A . 26 SER CB 1 1 3 1249 1 1 26 SER H H 14.112 4.747 -6.424 1.00 . A A . 26 SER H 1 1 3 1250 1 1 26 SER HA H 12.248 6.526 -5.134 1.00 . A A . 26 SER HA 1 1 3 1251 1 1 26 SER HB2 H 14.549 7.299 -4.149 1.00 . A A . 26 SER HB2 1 1 3 1252 1 1 26 SER HB3 H 14.984 7.784 -5.795 1.00 . A A . 26 SER HB3 1 1 3 1253 1 1 26 SER HG H 13.744 9.435 -5.546 1.00 . A A . 26 SER HG 1 1 3 1254 1 1 26 SER N N 13.811 5.181 -5.598 1.00 . A A . 26 SER N 1 1 3 1255 1 1 26 SER O O 13.194 7.837 -7.709 1.00 . A A . 26 SER O 1 1 3 1256 1 1 26 SER OG O 13.373 8.756 -4.977 1.00 . A A . 26 SER OG 1 1 3 1257 1 1 27 ASN C C 13.175 6.042 -10.125 1.00 . A A . 27 ASN C 1 1 3 1258 1 1 27 ASN CA C 11.922 5.864 -9.242 1.00 . A A . 27 ASN CA 1 1 3 1259 1 1 27 ASN CB C 10.942 7.053 -9.469 1.00 . A A . 27 ASN CB 1 1 3 1260 1 1 27 ASN CG C 9.886 6.658 -10.509 1.00 . A A . 27 ASN CG 1 1 3 1261 1 1 27 ASN H H 12.071 4.988 -7.276 1.00 . A A . 27 ASN H 1 1 3 1262 1 1 27 ASN HA H 11.450 4.929 -9.509 1.00 . A A . 27 ASN HA 1 1 3 1263 1 1 27 ASN HB2 H 10.443 7.318 -8.549 1.00 . A A . 27 ASN HB2 1 1 3 1264 1 1 27 ASN HB3 H 11.469 7.926 -9.830 1.00 . A A . 27 ASN HB3 1 1 3 1265 1 1 27 ASN HD21 H 8.385 6.765 -9.216 1.00 . A A . 27 ASN HD21 1 1 3 1266 1 1 27 ASN HD22 H 7.952 6.320 -10.796 1.00 . A A . 27 ASN HD22 1 1 3 1267 1 1 27 ASN N N 12.287 5.797 -7.786 1.00 . A A . 27 ASN N 1 1 3 1268 1 1 27 ASN ND2 N 8.636 6.574 -10.143 1.00 . A A . 27 ASN ND2 1 1 3 1269 1 1 27 ASN O O 13.076 6.418 -11.278 1.00 . A A . 27 ASN O 1 1 3 1270 1 1 27 ASN OD1 O 10.187 6.421 -11.662 1.00 . A A . 27 ASN OD1 1 1 3 1271 1 1 28 LYS C C 15.680 4.921 -11.484 1.00 . A A . 28 LYS C 1 1 3 1272 1 1 28 LYS CA C 15.612 5.891 -10.290 1.00 . A A . 28 LYS CA 1 1 3 1273 1 1 28 LYS CB C 16.754 5.609 -9.305 1.00 . A A . 28 LYS CB 1 1 3 1274 1 1 28 LYS CD C 17.741 6.330 -7.105 1.00 . A A . 28 LYS CD 1 1 3 1275 1 1 28 LYS CE C 17.030 5.416 -6.085 1.00 . A A . 28 LYS CE 1 1 3 1276 1 1 28 LYS CG C 16.770 6.719 -8.230 1.00 . A A . 28 LYS CG 1 1 3 1277 1 1 28 LYS H H 14.330 5.458 -8.619 1.00 . A A . 28 LYS H 1 1 3 1278 1 1 28 LYS HA H 15.704 6.909 -10.641 1.00 . A A . 28 LYS HA 1 1 3 1279 1 1 28 LYS HB2 H 16.606 4.642 -8.847 1.00 . A A . 28 LYS HB2 1 1 3 1280 1 1 28 LYS HB3 H 17.697 5.601 -9.833 1.00 . A A . 28 LYS HB3 1 1 3 1281 1 1 28 LYS HD2 H 18.597 5.823 -7.525 1.00 . A A . 28 LYS HD2 1 1 3 1282 1 1 28 LYS HD3 H 18.078 7.229 -6.612 1.00 . A A . 28 LYS HD3 1 1 3 1283 1 1 28 LYS HE2 H 16.521 6.014 -5.344 1.00 . A A . 28 LYS HE2 1 1 3 1284 1 1 28 LYS HE3 H 16.310 4.781 -6.579 1.00 . A A . 28 LYS HE3 1 1 3 1285 1 1 28 LYS HG2 H 17.098 7.646 -8.677 1.00 . A A . 28 LYS HG2 1 1 3 1286 1 1 28 LYS HG3 H 15.778 6.870 -7.827 1.00 . A A . 28 LYS HG3 1 1 3 1287 1 1 28 LYS HZ1 H 18.978 4.755 -5.748 1.00 . A A . 28 LYS HZ1 1 1 3 1288 1 1 28 LYS HZ2 H 17.990 4.735 -4.368 1.00 . A A . 28 LYS HZ2 1 1 3 1289 1 1 28 LYS HZ3 H 17.794 3.551 -5.569 1.00 . A A . 28 LYS HZ3 1 1 3 1290 1 1 28 LYS N N 14.318 5.761 -9.551 1.00 . A A . 28 LYS N 1 1 3 1291 1 1 28 LYS NZ N 18.022 4.549 -5.391 1.00 . A A . 28 LYS NZ 1 1 3 1292 1 1 28 LYS O O 15.951 5.415 -12.567 1.00 . A A . 28 LYS O 1 1 3 1293 1 1 28 LYS OXT O 15.458 3.745 -11.250 1.00 . A A . 28 LYS OXT 1 1 4 1294 1 1 1 ASP C C -13.581 -8.017 0.020 1.00 . A A . 1 ASP C 1 1 4 1295 1 1 1 ASP CA C -14.125 -6.645 0.437 1.00 . A A . 1 ASP CA 1 1 4 1296 1 1 1 ASP CB C -14.290 -6.619 1.968 1.00 . A A . 1 ASP CB 1 1 4 1297 1 1 1 ASP CG C -14.643 -5.193 2.424 1.00 . A A . 1 ASP CG 1 1 4 1298 1 1 1 ASP H1 H -15.685 -7.204 -0.827 1.00 . A A . 1 ASP H1 1 1 4 1299 1 1 1 ASP H2 H -16.170 -6.256 0.496 1.00 . A A . 1 ASP H2 1 1 4 1300 1 1 1 ASP H3 H -15.366 -5.536 -0.814 1.00 . A A . 1 ASP H3 1 1 4 1301 1 1 1 ASP HA H -13.428 -5.885 0.118 1.00 . A A . 1 ASP HA 1 1 4 1302 1 1 1 ASP HB2 H -15.081 -7.291 2.269 1.00 . A A . 1 ASP HB2 1 1 4 1303 1 1 1 ASP HB3 H -13.372 -6.931 2.448 1.00 . A A . 1 ASP HB3 1 1 4 1304 1 1 1 ASP N N -15.436 -6.392 -0.228 1.00 . A A . 1 ASP N 1 1 4 1305 1 1 1 ASP O O -14.336 -8.951 -0.176 1.00 . A A . 1 ASP O 1 1 4 1306 1 1 1 ASP OD1 O -15.796 -4.836 2.247 1.00 . A A . 1 ASP OD1 1 1 4 1307 1 1 1 ASP OD2 O -13.742 -4.537 2.921 1.00 . A A . 1 ASP OD2 1 1 4 1308 1 1 2 ALA C C -10.103 -9.226 -0.210 1.00 . A A . 2 ALA C 1 1 4 1309 1 1 2 ALA CA C -11.596 -9.356 -0.499 1.00 . A A . 2 ALA CA 1 1 4 1310 1 1 2 ALA CB C -11.824 -9.609 -2.004 1.00 . A A . 2 ALA CB 1 1 4 1311 1 1 2 ALA H H -11.739 -7.288 0.076 1.00 . A A . 2 ALA H 1 1 4 1312 1 1 2 ALA HA H -11.979 -10.176 0.086 1.00 . A A . 2 ALA HA 1 1 4 1313 1 1 2 ALA HB1 H -11.507 -8.753 -2.580 1.00 . A A . 2 ALA HB1 1 1 4 1314 1 1 2 ALA HB2 H -11.260 -10.474 -2.324 1.00 . A A . 2 ALA HB2 1 1 4 1315 1 1 2 ALA HB3 H -12.871 -9.790 -2.196 1.00 . A A . 2 ALA HB3 1 1 4 1316 1 1 2 ALA N N -12.279 -8.086 -0.100 1.00 . A A . 2 ALA N 1 1 4 1317 1 1 2 ALA O O -9.561 -9.963 0.592 1.00 . A A . 2 ALA O 1 1 4 1318 1 1 3 GLU C C -7.605 -6.666 -1.174 1.00 . A A . 3 GLU C 1 1 4 1319 1 1 3 GLU CA C -8.023 -8.053 -0.690 1.00 . A A . 3 GLU CA 1 1 4 1320 1 1 3 GLU CB C -7.265 -9.168 -1.462 1.00 . A A . 3 GLU CB 1 1 4 1321 1 1 3 GLU CD C -6.999 -7.967 -3.702 1.00 . A A . 3 GLU CD 1 1 4 1322 1 1 3 GLU CG C -7.630 -9.174 -2.977 1.00 . A A . 3 GLU CG 1 1 4 1323 1 1 3 GLU H H -9.989 -7.729 -1.509 1.00 . A A . 3 GLU H 1 1 4 1324 1 1 3 GLU HA H -7.828 -8.083 0.363 1.00 . A A . 3 GLU HA 1 1 4 1325 1 1 3 GLU HB2 H -6.202 -9.042 -1.349 1.00 . A A . 3 GLU HB2 1 1 4 1326 1 1 3 GLU HB3 H -7.540 -10.123 -1.040 1.00 . A A . 3 GLU HB3 1 1 4 1327 1 1 3 GLU HG2 H -7.254 -10.079 -3.433 1.00 . A A . 3 GLU HG2 1 1 4 1328 1 1 3 GLU HG3 H -8.703 -9.152 -3.105 1.00 . A A . 3 GLU HG3 1 1 4 1329 1 1 3 GLU N N -9.486 -8.286 -0.878 1.00 . A A . 3 GLU N 1 1 4 1330 1 1 3 GLU O O -6.441 -6.319 -1.222 1.00 . A A . 3 GLU O 1 1 4 1331 1 1 3 GLU OE1 O -5.780 -7.904 -3.714 1.00 . A A . 3 GLU OE1 1 1 4 1332 1 1 3 GLU OE2 O -7.774 -7.168 -4.204 1.00 . A A . 3 GLU OE2 1 1 4 1333 1 1 4 PHE C C -7.993 -3.565 -0.904 1.00 . A A . 4 PHE C 1 1 4 1334 1 1 4 PHE CA C -8.390 -4.526 -2.016 1.00 . A A . 4 PHE CA 1 1 4 1335 1 1 4 PHE CB C -9.683 -4.044 -2.696 1.00 . A A . 4 PHE CB 1 1 4 1336 1 1 4 PHE CD1 C -10.697 -6.109 -3.757 1.00 . A A . 4 PHE CD1 1 1 4 1337 1 1 4 PHE CD2 C -9.496 -4.601 -5.161 1.00 . A A . 4 PHE CD2 1 1 4 1338 1 1 4 PHE CE1 C -10.948 -6.921 -4.843 1.00 . A A . 4 PHE CE1 1 1 4 1339 1 1 4 PHE CE2 C -9.746 -5.412 -6.247 1.00 . A A . 4 PHE CE2 1 1 4 1340 1 1 4 PHE CG C -9.969 -4.942 -3.907 1.00 . A A . 4 PHE CG 1 1 4 1341 1 1 4 PHE CZ C -10.472 -6.572 -6.089 1.00 . A A . 4 PHE CZ 1 1 4 1342 1 1 4 PHE H H -9.504 -6.283 -1.416 1.00 . A A . 4 PHE H 1 1 4 1343 1 1 4 PHE HA H -7.585 -4.558 -2.730 1.00 . A A . 4 PHE HA 1 1 4 1344 1 1 4 PHE HB2 H -10.518 -4.105 -2.016 1.00 . A A . 4 PHE HB2 1 1 4 1345 1 1 4 PHE HB3 H -9.576 -3.022 -3.030 1.00 . A A . 4 PHE HB3 1 1 4 1346 1 1 4 PHE HD1 H -11.072 -6.389 -2.783 1.00 . A A . 4 PHE HD1 1 1 4 1347 1 1 4 PHE HD2 H -8.928 -3.692 -5.292 1.00 . A A . 4 PHE HD2 1 1 4 1348 1 1 4 PHE HE1 H -11.516 -7.831 -4.719 1.00 . A A . 4 PHE HE1 1 1 4 1349 1 1 4 PHE HE2 H -9.373 -5.137 -7.222 1.00 . A A . 4 PHE HE2 1 1 4 1350 1 1 4 PHE HZ H -10.668 -7.208 -6.940 1.00 . A A . 4 PHE HZ 1 1 4 1351 1 1 4 PHE N N -8.606 -5.910 -1.511 1.00 . A A . 4 PHE N 1 1 4 1352 1 1 4 PHE O O -7.085 -2.777 -1.080 1.00 . A A . 4 PHE O 1 1 4 1353 1 1 5 ARG C C -7.772 -3.579 2.518 1.00 . A A . 5 ARG C 1 1 4 1354 1 1 5 ARG CA C -8.402 -2.782 1.370 1.00 . A A . 5 ARG CA 1 1 4 1355 1 1 5 ARG CB C -9.726 -2.133 1.825 1.00 . A A . 5 ARG CB 1 1 4 1356 1 1 5 ARG CD C -11.699 -3.276 0.752 1.00 . A A . 5 ARG CD 1 1 4 1357 1 1 5 ARG CG C -10.827 -3.213 2.013 1.00 . A A . 5 ARG CG 1 1 4 1358 1 1 5 ARG CZ C -13.734 -1.896 0.508 1.00 . A A . 5 ARG CZ 1 1 4 1359 1 1 5 ARG H H -9.401 -4.333 0.259 1.00 . A A . 5 ARG H 1 1 4 1360 1 1 5 ARG HA H -7.710 -2.019 1.057 1.00 . A A . 5 ARG HA 1 1 4 1361 1 1 5 ARG HB2 H -9.571 -1.613 2.759 1.00 . A A . 5 ARG HB2 1 1 4 1362 1 1 5 ARG HB3 H -10.021 -1.404 1.086 1.00 . A A . 5 ARG HB3 1 1 4 1363 1 1 5 ARG HD2 H -11.089 -3.392 -0.128 1.00 . A A . 5 ARG HD2 1 1 4 1364 1 1 5 ARG HD3 H -12.383 -4.106 0.817 1.00 . A A . 5 ARG HD3 1 1 4 1365 1 1 5 ARG HE H -11.902 -1.152 0.686 1.00 . A A . 5 ARG HE 1 1 4 1366 1 1 5 ARG HG2 H -10.389 -4.184 2.197 1.00 . A A . 5 ARG HG2 1 1 4 1367 1 1 5 ARG HG3 H -11.441 -2.955 2.863 1.00 . A A . 5 ARG HG3 1 1 4 1368 1 1 5 ARG HH11 H -14.083 -3.876 0.508 1.00 . A A . 5 ARG HH11 1 1 4 1369 1 1 5 ARG HH12 H -15.475 -2.866 0.342 1.00 . A A . 5 ARG HH12 1 1 4 1370 1 1 5 ARG HH21 H -13.671 0.104 0.476 1.00 . A A . 5 ARG HH21 1 1 4 1371 1 1 5 ARG HH22 H -15.246 -0.599 0.322 1.00 . A A . 5 ARG HH22 1 1 4 1372 1 1 5 ARG N N -8.686 -3.667 0.199 1.00 . A A . 5 ARG N 1 1 4 1373 1 1 5 ARG NE N -12.431 -1.977 0.647 1.00 . A A . 5 ARG NE 1 1 4 1374 1 1 5 ARG NH1 N -14.485 -2.963 0.448 1.00 . A A . 5 ARG NH1 1 1 4 1375 1 1 5 ARG NH2 N -14.258 -0.703 0.429 1.00 . A A . 5 ARG NH2 1 1 4 1376 1 1 5 ARG O O -7.981 -3.300 3.684 1.00 . A A . 5 ARG O 1 1 4 1377 1 1 6 HIS C C -4.913 -5.623 2.473 1.00 . A A . 6 HIS C 1 1 4 1378 1 1 6 HIS CA C -6.307 -5.448 3.077 1.00 . A A . 6 HIS CA 1 1 4 1379 1 1 6 HIS CB C -7.116 -6.763 3.151 1.00 . A A . 6 HIS CB 1 1 4 1380 1 1 6 HIS CD2 C -5.075 -8.196 3.965 1.00 . A A . 6 HIS CD2 1 1 4 1381 1 1 6 HIS CE1 C -6.001 -9.274 5.466 1.00 . A A . 6 HIS CE1 1 1 4 1382 1 1 6 HIS CG C -6.389 -7.796 4.009 1.00 . A A . 6 HIS CG 1 1 4 1383 1 1 6 HIS H H -6.866 -4.744 1.184 1.00 . A A . 6 HIS H 1 1 4 1384 1 1 6 HIS HA H -6.222 -4.970 4.034 1.00 . A A . 6 HIS HA 1 1 4 1385 1 1 6 HIS HB2 H -8.088 -6.575 3.585 1.00 . A A . 6 HIS HB2 1 1 4 1386 1 1 6 HIS HB3 H -7.251 -7.173 2.162 1.00 . A A . 6 HIS HB3 1 1 4 1387 1 1 6 HIS HD1 H -7.842 -8.457 5.250 1.00 . A A . 6 HIS HD1 1 1 4 1388 1 1 6 HIS HD2 H -4.362 -7.787 3.266 1.00 . A A . 6 HIS HD2 1 1 4 1389 1 1 6 HIS HE1 H -6.179 -9.964 6.278 1.00 . A A . 6 HIS HE1 1 1 4 1390 1 1 6 HIS N N -7.005 -4.561 2.129 1.00 . A A . 6 HIS N 1 1 4 1391 1 1 6 HIS ND1 N -6.908 -8.501 4.960 1.00 . A A . 6 HIS ND1 1 1 4 1392 1 1 6 HIS NE2 N -4.840 -9.118 4.876 1.00 . A A . 6 HIS NE2 1 1 4 1393 1 1 6 HIS O O -3.921 -5.371 3.132 1.00 . A A . 6 HIS O 1 1 4 1394 1 1 7 ASP C C -3.368 -5.119 -0.477 1.00 . A A . 7 ASP C 1 1 4 1395 1 1 7 ASP CA C -3.604 -6.265 0.512 1.00 . A A . 7 ASP CA 1 1 4 1396 1 1 7 ASP CB C -3.680 -7.627 -0.223 1.00 . A A . 7 ASP CB 1 1 4 1397 1 1 7 ASP CG C -4.127 -8.718 0.768 1.00 . A A . 7 ASP CG 1 1 4 1398 1 1 7 ASP H H -5.721 -6.223 0.756 1.00 . A A . 7 ASP H 1 1 4 1399 1 1 7 ASP HA H -2.807 -6.263 1.228 1.00 . A A . 7 ASP HA 1 1 4 1400 1 1 7 ASP HB2 H -4.380 -7.583 -1.043 1.00 . A A . 7 ASP HB2 1 1 4 1401 1 1 7 ASP HB3 H -2.707 -7.883 -0.620 1.00 . A A . 7 ASP HB3 1 1 4 1402 1 1 7 ASP N N -4.889 -6.046 1.233 1.00 . A A . 7 ASP N 1 1 4 1403 1 1 7 ASP O O -2.691 -5.275 -1.476 1.00 . A A . 7 ASP O 1 1 4 1404 1 1 7 ASP OD1 O -5.327 -8.826 0.960 1.00 . A A . 7 ASP OD1 1 1 4 1405 1 1 7 ASP OD2 O -3.242 -9.383 1.282 1.00 . A A . 7 ASP OD2 1 1 4 1406 1 1 8 SER C C -4.122 -3.045 -2.451 1.00 . A A . 8 SER C 1 1 4 1407 1 1 8 SER CA C -3.854 -2.749 -0.966 1.00 . A A . 8 SER CA 1 1 4 1408 1 1 8 SER CB C -2.441 -2.147 -0.778 1.00 . A A . 8 SER CB 1 1 4 1409 1 1 8 SER H H -4.473 -3.979 0.688 1.00 . A A . 8 SER H 1 1 4 1410 1 1 8 SER HA H -4.601 -2.054 -0.615 1.00 . A A . 8 SER HA 1 1 4 1411 1 1 8 SER HB2 H -1.661 -2.853 -1.025 1.00 . A A . 8 SER HB2 1 1 4 1412 1 1 8 SER HB3 H -2.314 -1.239 -1.349 1.00 . A A . 8 SER HB3 1 1 4 1413 1 1 8 SER HG H -1.670 -2.353 0.994 1.00 . A A . 8 SER HG 1 1 4 1414 1 1 8 SER N N -3.953 -3.995 -0.140 1.00 . A A . 8 SER N 1 1 4 1415 1 1 8 SER O O -3.492 -2.494 -3.334 1.00 . A A . 8 SER O 1 1 4 1416 1 1 8 SER OG O -2.384 -1.842 0.607 1.00 . A A . 8 SER OG 1 1 4 1417 1 1 9 GLY C C -6.237 -3.203 -4.758 1.00 . A A . 9 GLY C 1 1 4 1418 1 1 9 GLY CA C -5.445 -4.314 -4.061 1.00 . A A . 9 GLY CA 1 1 4 1419 1 1 9 GLY H H -5.547 -4.315 -1.902 1.00 . A A . 9 GLY H 1 1 4 1420 1 1 9 GLY HA2 H -4.546 -4.514 -4.627 1.00 . A A . 9 GLY HA2 1 1 4 1421 1 1 9 GLY HA3 H -6.045 -5.210 -4.028 1.00 . A A . 9 GLY HA3 1 1 4 1422 1 1 9 GLY N N -5.072 -3.920 -2.666 1.00 . A A . 9 GLY N 1 1 4 1423 1 1 9 GLY O O -6.513 -3.288 -5.940 1.00 . A A . 9 GLY O 1 1 4 1424 1 1 10 TYR C C -6.612 -0.308 -5.653 1.00 . A A . 10 TYR C 1 1 4 1425 1 1 10 TYR CA C -7.347 -1.026 -4.509 1.00 . A A . 10 TYR CA 1 1 4 1426 1 1 10 TYR CB C -7.584 -0.046 -3.328 1.00 . A A . 10 TYR CB 1 1 4 1427 1 1 10 TYR CD1 C -5.496 1.425 -3.552 1.00 . A A . 10 TYR CD1 1 1 4 1428 1 1 10 TYR CD2 C -5.776 0.179 -1.552 1.00 . A A . 10 TYR CD2 1 1 4 1429 1 1 10 TYR CE1 C -4.309 1.935 -3.075 1.00 . A A . 10 TYR CE1 1 1 4 1430 1 1 10 TYR CE2 C -4.587 0.690 -1.075 1.00 . A A . 10 TYR CE2 1 1 4 1431 1 1 10 TYR CG C -6.249 0.538 -2.799 1.00 . A A . 10 TYR CG 1 1 4 1432 1 1 10 TYR CZ C -3.845 1.571 -1.831 1.00 . A A . 10 TYR CZ 1 1 4 1433 1 1 10 TYR H H -6.320 -2.206 -3.046 1.00 . A A . 10 TYR H 1 1 4 1434 1 1 10 TYR HA H -8.298 -1.381 -4.877 1.00 . A A . 10 TYR HA 1 1 4 1435 1 1 10 TYR HB2 H -8.219 0.768 -3.644 1.00 . A A . 10 TYR HB2 1 1 4 1436 1 1 10 TYR HB3 H -8.077 -0.574 -2.524 1.00 . A A . 10 TYR HB3 1 1 4 1437 1 1 10 TYR HD1 H -5.834 1.734 -4.526 1.00 . A A . 10 TYR HD1 1 1 4 1438 1 1 10 TYR HD2 H -6.340 -0.507 -0.939 1.00 . A A . 10 TYR HD2 1 1 4 1439 1 1 10 TYR HE1 H -3.741 2.624 -3.685 1.00 . A A . 10 TYR HE1 1 1 4 1440 1 1 10 TYR HE2 H -4.235 0.399 -0.099 1.00 . A A . 10 TYR HE2 1 1 4 1441 1 1 10 TYR HH H -2.819 2.435 -0.474 1.00 . A A . 10 TYR HH 1 1 4 1442 1 1 10 TYR N N -6.575 -2.196 -3.992 1.00 . A A . 10 TYR N 1 1 4 1443 1 1 10 TYR O O -5.490 -0.645 -5.983 1.00 . A A . 10 TYR O 1 1 4 1444 1 1 10 TYR OH O -2.656 2.078 -1.350 1.00 . A A . 10 TYR OH 1 1 4 1445 1 1 11 GLU C C -6.594 2.908 -6.898 1.00 . A A . 11 GLU C 1 1 4 1446 1 1 11 GLU CA C -6.692 1.458 -7.334 1.00 . A A . 11 GLU CA 1 1 4 1447 1 1 11 GLU CB C -7.585 1.325 -8.578 1.00 . A A . 11 GLU CB 1 1 4 1448 1 1 11 GLU CD C -6.053 0.530 -10.426 1.00 . A A . 11 GLU CD 1 1 4 1449 1 1 11 GLU CG C -7.096 0.102 -9.380 1.00 . A A . 11 GLU CG 1 1 4 1450 1 1 11 GLU H H -8.182 0.882 -5.895 1.00 . A A . 11 GLU H 1 1 4 1451 1 1 11 GLU HA H -5.688 1.116 -7.519 1.00 . A A . 11 GLU HA 1 1 4 1452 1 1 11 GLU HB2 H -8.613 1.181 -8.281 1.00 . A A . 11 GLU HB2 1 1 4 1453 1 1 11 GLU HB3 H -7.525 2.218 -9.186 1.00 . A A . 11 GLU HB3 1 1 4 1454 1 1 11 GLU HG2 H -6.642 -0.622 -8.719 1.00 . A A . 11 GLU HG2 1 1 4 1455 1 1 11 GLU HG3 H -7.935 -0.358 -9.877 1.00 . A A . 11 GLU HG3 1 1 4 1456 1 1 11 GLU N N -7.282 0.667 -6.214 1.00 . A A . 11 GLU N 1 1 4 1457 1 1 11 GLU O O -7.515 3.458 -6.324 1.00 . A A . 11 GLU O 1 1 4 1458 1 1 11 GLU OE1 O -4.946 0.820 -10.003 1.00 . A A . 11 GLU OE1 1 1 4 1459 1 1 11 GLU OE2 O -6.419 0.543 -11.591 1.00 . A A . 11 GLU OE2 1 1 4 1460 1 1 12 VAL C C -4.470 5.631 -7.977 1.00 . A A . 12 VAL C 1 1 4 1461 1 1 12 VAL CA C -5.174 4.892 -6.841 1.00 . A A . 12 VAL CA 1 1 4 1462 1 1 12 VAL CB C -4.324 4.858 -5.533 1.00 . A A . 12 VAL CB 1 1 4 1463 1 1 12 VAL CG1 C -3.418 6.099 -5.342 1.00 . A A . 12 VAL CG1 1 1 4 1464 1 1 12 VAL CG2 C -5.301 4.800 -4.357 1.00 . A A . 12 VAL CG2 1 1 4 1465 1 1 12 VAL H H -4.784 2.930 -7.675 1.00 . A A . 12 VAL H 1 1 4 1466 1 1 12 VAL HA H -6.108 5.394 -6.649 1.00 . A A . 12 VAL HA 1 1 4 1467 1 1 12 VAL HB H -3.719 3.964 -5.543 1.00 . A A . 12 VAL HB 1 1 4 1468 1 1 12 VAL HG11 H -3.837 6.961 -5.840 1.00 . A A . 12 VAL HG11 1 1 4 1469 1 1 12 VAL HG12 H -3.303 6.334 -4.294 1.00 . A A . 12 VAL HG12 1 1 4 1470 1 1 12 VAL HG13 H -2.439 5.893 -5.743 1.00 . A A . 12 VAL HG13 1 1 4 1471 1 1 12 VAL HG21 H -5.942 3.938 -4.456 1.00 . A A . 12 VAL HG21 1 1 4 1472 1 1 12 VAL HG22 H -4.757 4.731 -3.429 1.00 . A A . 12 VAL HG22 1 1 4 1473 1 1 12 VAL HG23 H -5.914 5.689 -4.349 1.00 . A A . 12 VAL HG23 1 1 4 1474 1 1 12 VAL N N -5.453 3.469 -7.200 1.00 . A A . 12 VAL N 1 1 4 1475 1 1 12 VAL O O -4.956 6.660 -8.395 1.00 . A A . 12 VAL O 1 1 4 1476 1 1 13 HIS C C -1.636 6.820 -9.078 1.00 . A A . 13 HIS C 1 1 4 1477 1 1 13 HIS CA C -2.535 5.657 -9.542 1.00 . A A . 13 HIS CA 1 1 4 1478 1 1 13 HIS CB C -3.441 6.170 -10.710 1.00 . A A . 13 HIS CB 1 1 4 1479 1 1 13 HIS CD2 C -4.978 3.973 -10.669 1.00 . A A . 13 HIS CD2 1 1 4 1480 1 1 13 HIS CE1 C -5.432 3.922 -12.690 1.00 . A A . 13 HIS CE1 1 1 4 1481 1 1 13 HIS CG C -4.341 5.052 -11.269 1.00 . A A . 13 HIS CG 1 1 4 1482 1 1 13 HIS H H -3.074 4.241 -8.016 1.00 . A A . 13 HIS H 1 1 4 1483 1 1 13 HIS HA H -1.894 4.872 -9.918 1.00 . A A . 13 HIS HA 1 1 4 1484 1 1 13 HIS HB2 H -4.058 7.003 -10.413 1.00 . A A . 13 HIS HB2 1 1 4 1485 1 1 13 HIS HB3 H -2.804 6.507 -11.513 1.00 . A A . 13 HIS HB3 1 1 4 1486 1 1 13 HIS HD1 H -4.382 5.566 -13.223 1.00 . A A . 13 HIS HD1 1 1 4 1487 1 1 13 HIS HD2 H -4.937 3.722 -9.620 1.00 . A A . 13 HIS HD2 1 1 4 1488 1 1 13 HIS HE1 H -5.840 3.624 -13.645 1.00 . A A . 13 HIS HE1 1 1 4 1489 1 1 13 HIS N N -3.369 5.080 -8.429 1.00 . A A . 13 HIS N 1 1 4 1490 1 1 13 HIS ND1 N -4.669 4.953 -12.515 1.00 . A A . 13 HIS ND1 1 1 4 1491 1 1 13 HIS NE2 N -5.650 3.286 -11.569 1.00 . A A . 13 HIS NE2 1 1 4 1492 1 1 13 HIS O O -0.843 7.319 -9.854 1.00 . A A . 13 HIS O 1 1 4 1493 1 1 14 HIS C C 0.171 7.636 -6.508 1.00 . A A . 14 HIS C 1 1 4 1494 1 1 14 HIS CA C -0.957 8.337 -7.272 1.00 . A A . 14 HIS CA 1 1 4 1495 1 1 14 HIS CB C -1.812 9.207 -6.311 1.00 . A A . 14 HIS CB 1 1 4 1496 1 1 14 HIS CD2 C -3.782 9.708 -7.962 1.00 . A A . 14 HIS CD2 1 1 4 1497 1 1 14 HIS CE1 C -3.671 11.774 -7.997 1.00 . A A . 14 HIS CE1 1 1 4 1498 1 1 14 HIS CG C -2.750 10.081 -7.135 1.00 . A A . 14 HIS CG 1 1 4 1499 1 1 14 HIS H H -2.431 6.787 -7.269 1.00 . A A . 14 HIS H 1 1 4 1500 1 1 14 HIS HA H -0.567 8.928 -8.075 1.00 . A A . 14 HIS HA 1 1 4 1501 1 1 14 HIS HB2 H -2.402 8.595 -5.649 1.00 . A A . 14 HIS HB2 1 1 4 1502 1 1 14 HIS HB3 H -1.175 9.850 -5.720 1.00 . A A . 14 HIS HB3 1 1 4 1503 1 1 14 HIS HD1 H -2.108 11.953 -6.720 1.00 . A A . 14 HIS HD1 1 1 4 1504 1 1 14 HIS HD2 H -4.062 8.683 -8.132 1.00 . A A . 14 HIS HD2 1 1 4 1505 1 1 14 HIS HE1 H -3.869 12.811 -8.223 1.00 . A A . 14 HIS HE1 1 1 4 1506 1 1 14 HIS N N -1.777 7.224 -7.838 1.00 . A A . 14 HIS N 1 1 4 1507 1 1 14 HIS ND1 N -2.732 11.371 -7.199 1.00 . A A . 14 HIS ND1 1 1 4 1508 1 1 14 HIS NE2 N -4.351 10.770 -8.496 1.00 . A A . 14 HIS NE2 1 1 4 1509 1 1 14 HIS O O 1.140 7.214 -7.105 1.00 . A A . 14 HIS O 1 1 4 1510 1 1 15 GLN C C 1.215 5.398 -4.832 1.00 . A A . 15 GLN C 1 1 4 1511 1 1 15 GLN CA C 1.052 6.841 -4.357 1.00 . A A . 15 GLN CA 1 1 4 1512 1 1 15 GLN CB C 0.594 6.847 -2.892 1.00 . A A . 15 GLN CB 1 1 4 1513 1 1 15 GLN CD C -0.144 8.244 -0.957 1.00 . A A . 15 GLN CD 1 1 4 1514 1 1 15 GLN CG C 0.277 8.282 -2.430 1.00 . A A . 15 GLN CG 1 1 4 1515 1 1 15 GLN H H -0.791 7.877 -4.793 1.00 . A A . 15 GLN H 1 1 4 1516 1 1 15 GLN HA H 2.007 7.329 -4.475 1.00 . A A . 15 GLN HA 1 1 4 1517 1 1 15 GLN HB2 H -0.288 6.228 -2.792 1.00 . A A . 15 GLN HB2 1 1 4 1518 1 1 15 GLN HB3 H 1.377 6.433 -2.275 1.00 . A A . 15 GLN HB3 1 1 4 1519 1 1 15 GLN HE21 H -1.957 7.548 -1.363 1.00 . A A . 15 GLN HE21 1 1 4 1520 1 1 15 GLN HE22 H -1.628 7.798 0.283 1.00 . A A . 15 GLN HE22 1 1 4 1521 1 1 15 GLN HG2 H 1.147 8.914 -2.532 1.00 . A A . 15 GLN HG2 1 1 4 1522 1 1 15 GLN HG3 H -0.535 8.701 -3.007 1.00 . A A . 15 GLN HG3 1 1 4 1523 1 1 15 GLN N N 0.018 7.517 -5.210 1.00 . A A . 15 GLN N 1 1 4 1524 1 1 15 GLN NE2 N -1.343 7.829 -0.654 1.00 . A A . 15 GLN NE2 1 1 4 1525 1 1 15 GLN O O 2.206 4.752 -4.559 1.00 . A A . 15 GLN O 1 1 4 1526 1 1 15 GLN OE1 O 0.613 8.590 -0.070 1.00 . A A . 15 GLN OE1 1 1 4 1527 1 1 16 GLU C C 1.514 3.254 -6.789 1.00 . A A . 16 GLU C 1 1 4 1528 1 1 16 GLU CA C 0.188 3.577 -6.096 1.00 . A A . 16 GLU CA 1 1 4 1529 1 1 16 GLU CB C -0.964 3.499 -7.076 1.00 . A A . 16 GLU CB 1 1 4 1530 1 1 16 GLU CD C -2.420 1.906 -8.294 1.00 . A A . 16 GLU CD 1 1 4 1531 1 1 16 GLU CG C -1.023 2.099 -7.681 1.00 . A A . 16 GLU CG 1 1 4 1532 1 1 16 GLU H H -0.551 5.541 -5.714 1.00 . A A . 16 GLU H 1 1 4 1533 1 1 16 GLU HA H 0.027 2.884 -5.288 1.00 . A A . 16 GLU HA 1 1 4 1534 1 1 16 GLU HB2 H -1.883 3.715 -6.552 1.00 . A A . 16 GLU HB2 1 1 4 1535 1 1 16 GLU HB3 H -0.829 4.232 -7.858 1.00 . A A . 16 GLU HB3 1 1 4 1536 1 1 16 GLU HG2 H -0.262 2.001 -8.444 1.00 . A A . 16 GLU HG2 1 1 4 1537 1 1 16 GLU HG3 H -0.842 1.355 -6.916 1.00 . A A . 16 GLU HG3 1 1 4 1538 1 1 16 GLU N N 0.212 4.952 -5.541 1.00 . A A . 16 GLU N 1 1 4 1539 1 1 16 GLU O O 2.134 2.250 -6.493 1.00 . A A . 16 GLU O 1 1 4 1540 1 1 16 GLU OE1 O -2.582 2.345 -9.421 1.00 . A A . 16 GLU OE1 1 1 4 1541 1 1 16 GLU OE2 O -3.245 1.338 -7.598 1.00 . A A . 16 GLU OE2 1 1 4 1542 1 1 17 LEU C C 4.386 4.279 -7.564 1.00 . A A . 17 LEU C 1 1 4 1543 1 1 17 LEU CA C 3.189 3.884 -8.411 1.00 . A A . 17 LEU CA 1 1 4 1544 1 1 17 LEU CB C 3.187 4.683 -9.740 1.00 . A A . 17 LEU CB 1 1 4 1545 1 1 17 LEU CD1 C 4.598 6.798 -9.657 1.00 . A A . 17 LEU CD1 1 1 4 1546 1 1 17 LEU CD2 C 2.188 6.922 -10.384 1.00 . A A . 17 LEU CD2 1 1 4 1547 1 1 17 LEU CG C 3.185 6.207 -9.450 1.00 . A A . 17 LEU CG 1 1 4 1548 1 1 17 LEU H H 1.372 4.919 -7.877 1.00 . A A . 17 LEU H 1 1 4 1549 1 1 17 LEU HA H 3.257 2.835 -8.568 1.00 . A A . 17 LEU HA 1 1 4 1550 1 1 17 LEU HB2 H 4.057 4.409 -10.321 1.00 . A A . 17 LEU HB2 1 1 4 1551 1 1 17 LEU HB3 H 2.310 4.401 -10.306 1.00 . A A . 17 LEU HB3 1 1 4 1552 1 1 17 LEU HD11 H 4.942 6.614 -10.665 1.00 . A A . 17 LEU HD11 1 1 4 1553 1 1 17 LEU HD12 H 4.580 7.865 -9.487 1.00 . A A . 17 LEU HD12 1 1 4 1554 1 1 17 LEU HD13 H 5.300 6.354 -8.966 1.00 . A A . 17 LEU HD13 1 1 4 1555 1 1 17 LEU HD21 H 1.281 6.344 -10.474 1.00 . A A . 17 LEU HD21 1 1 4 1556 1 1 17 LEU HD22 H 1.941 7.894 -9.983 1.00 . A A . 17 LEU HD22 1 1 4 1557 1 1 17 LEU HD23 H 2.613 7.050 -11.369 1.00 . A A . 17 LEU HD23 1 1 4 1558 1 1 17 LEU HG H 2.890 6.350 -8.425 1.00 . A A . 17 LEU HG 1 1 4 1559 1 1 17 LEU N N 1.910 4.123 -7.687 1.00 . A A . 17 LEU N 1 1 4 1560 1 1 17 LEU O O 5.498 3.865 -7.812 1.00 . A A . 17 LEU O 1 1 4 1561 1 1 18 VAL C C 5.655 4.300 -4.856 1.00 . A A . 18 VAL C 1 1 4 1562 1 1 18 VAL CA C 5.250 5.511 -5.684 1.00 . A A . 18 VAL CA 1 1 4 1563 1 1 18 VAL CB C 4.758 6.640 -4.798 1.00 . A A . 18 VAL CB 1 1 4 1564 1 1 18 VAL CG1 C 5.916 7.126 -3.906 1.00 . A A . 18 VAL CG1 1 1 4 1565 1 1 18 VAL CG2 C 4.294 7.744 -5.752 1.00 . A A . 18 VAL CG2 1 1 4 1566 1 1 18 VAL H H 3.224 5.402 -6.411 1.00 . A A . 18 VAL H 1 1 4 1567 1 1 18 VAL HA H 6.088 5.825 -6.290 1.00 . A A . 18 VAL HA 1 1 4 1568 1 1 18 VAL HB H 3.942 6.312 -4.174 1.00 . A A . 18 VAL HB 1 1 4 1569 1 1 18 VAL HG11 H 6.833 7.188 -4.475 1.00 . A A . 18 VAL HG11 1 1 4 1570 1 1 18 VAL HG12 H 5.690 8.092 -3.484 1.00 . A A . 18 VAL HG12 1 1 4 1571 1 1 18 VAL HG13 H 6.062 6.422 -3.098 1.00 . A A . 18 VAL HG13 1 1 4 1572 1 1 18 VAL HG21 H 5.082 7.974 -6.453 1.00 . A A . 18 VAL HG21 1 1 4 1573 1 1 18 VAL HG22 H 3.440 7.387 -6.310 1.00 . A A . 18 VAL HG22 1 1 4 1574 1 1 18 VAL HG23 H 4.013 8.626 -5.204 1.00 . A A . 18 VAL HG23 1 1 4 1575 1 1 18 VAL N N 4.135 5.082 -6.571 1.00 . A A . 18 VAL N 1 1 4 1576 1 1 18 VAL O O 6.744 4.259 -4.327 1.00 . A A . 18 VAL O 1 1 4 1577 1 1 19 PHE C C 5.953 1.242 -4.850 1.00 . A A . 19 PHE C 1 1 4 1578 1 1 19 PHE CA C 5.016 2.107 -4.007 1.00 . A A . 19 PHE CA 1 1 4 1579 1 1 19 PHE CB C 3.718 1.325 -3.772 1.00 . A A . 19 PHE CB 1 1 4 1580 1 1 19 PHE CD1 C 2.945 3.167 -2.183 1.00 . A A . 19 PHE CD1 1 1 4 1581 1 1 19 PHE CD2 C 1.304 1.919 -3.380 1.00 . A A . 19 PHE CD2 1 1 4 1582 1 1 19 PHE CE1 C 1.946 3.898 -1.575 1.00 . A A . 19 PHE CE1 1 1 4 1583 1 1 19 PHE CE2 C 0.305 2.650 -2.773 1.00 . A A . 19 PHE CE2 1 1 4 1584 1 1 19 PHE CG C 2.631 2.169 -3.090 1.00 . A A . 19 PHE CG 1 1 4 1585 1 1 19 PHE CZ C 0.624 3.640 -1.869 1.00 . A A . 19 PHE CZ 1 1 4 1586 1 1 19 PHE H H 3.897 3.476 -5.245 1.00 . A A . 19 PHE H 1 1 4 1587 1 1 19 PHE HA H 5.497 2.369 -3.077 1.00 . A A . 19 PHE HA 1 1 4 1588 1 1 19 PHE HB2 H 3.335 0.966 -4.716 1.00 . A A . 19 PHE HB2 1 1 4 1589 1 1 19 PHE HB3 H 3.922 0.472 -3.141 1.00 . A A . 19 PHE HB3 1 1 4 1590 1 1 19 PHE HD1 H 3.978 3.379 -1.956 1.00 . A A . 19 PHE HD1 1 1 4 1591 1 1 19 PHE HD2 H 1.049 1.147 -4.096 1.00 . A A . 19 PHE HD2 1 1 4 1592 1 1 19 PHE HE1 H 2.200 4.674 -0.867 1.00 . A A . 19 PHE HE1 1 1 4 1593 1 1 19 PHE HE2 H -0.730 2.446 -3.006 1.00 . A A . 19 PHE HE2 1 1 4 1594 1 1 19 PHE HZ H -0.159 4.211 -1.393 1.00 . A A . 19 PHE HZ 1 1 4 1595 1 1 19 PHE N N 4.753 3.355 -4.780 1.00 . A A . 19 PHE N 1 1 4 1596 1 1 19 PHE O O 6.665 0.395 -4.347 1.00 . A A . 19 PHE O 1 1 4 1597 1 1 20 PHE C C 8.135 1.426 -7.073 1.00 . A A . 20 PHE C 1 1 4 1598 1 1 20 PHE CA C 6.760 0.757 -7.098 1.00 . A A . 20 PHE CA 1 1 4 1599 1 1 20 PHE CB C 6.067 0.840 -8.484 1.00 . A A . 20 PHE CB 1 1 4 1600 1 1 20 PHE CD1 C 7.744 -0.264 -10.038 1.00 . A A . 20 PHE CD1 1 1 4 1601 1 1 20 PHE CD2 C 7.384 2.083 -10.263 1.00 . A A . 20 PHE CD2 1 1 4 1602 1 1 20 PHE CE1 C 8.667 -0.221 -11.061 1.00 . A A . 20 PHE CE1 1 1 4 1603 1 1 20 PHE CE2 C 8.307 2.126 -11.286 1.00 . A A . 20 PHE CE2 1 1 4 1604 1 1 20 PHE CG C 7.095 0.887 -9.631 1.00 . A A . 20 PHE CG 1 1 4 1605 1 1 20 PHE CZ C 8.950 0.974 -11.687 1.00 . A A . 20 PHE CZ 1 1 4 1606 1 1 20 PHE H H 5.311 2.228 -6.438 1.00 . A A . 20 PHE H 1 1 4 1607 1 1 20 PHE HA H 6.854 -0.272 -6.777 1.00 . A A . 20 PHE HA 1 1 4 1608 1 1 20 PHE HB2 H 5.437 -0.026 -8.611 1.00 . A A . 20 PHE HB2 1 1 4 1609 1 1 20 PHE HB3 H 5.434 1.713 -8.539 1.00 . A A . 20 PHE HB3 1 1 4 1610 1 1 20 PHE HD1 H 7.528 -1.206 -9.552 1.00 . A A . 20 PHE HD1 1 1 4 1611 1 1 20 PHE HD2 H 6.885 2.991 -9.957 1.00 . A A . 20 PHE HD2 1 1 4 1612 1 1 20 PHE HE1 H 9.170 -1.125 -11.373 1.00 . A A . 20 PHE HE1 1 1 4 1613 1 1 20 PHE HE2 H 8.528 3.065 -11.774 1.00 . A A . 20 PHE HE2 1 1 4 1614 1 1 20 PHE HZ H 9.673 1.008 -12.488 1.00 . A A . 20 PHE HZ 1 1 4 1615 1 1 20 PHE N N 5.911 1.510 -6.128 1.00 . A A . 20 PHE N 1 1 4 1616 1 1 20 PHE O O 9.156 0.784 -6.932 1.00 . A A . 20 PHE O 1 1 4 1617 1 1 21 ALA C C 10.040 3.301 -5.852 1.00 . A A . 21 ALA C 1 1 4 1618 1 1 21 ALA CA C 9.356 3.532 -7.201 1.00 . A A . 21 ALA CA 1 1 4 1619 1 1 21 ALA CB C 8.979 5.003 -7.378 1.00 . A A . 21 ALA CB 1 1 4 1620 1 1 21 ALA H H 7.251 3.174 -7.316 1.00 . A A . 21 ALA H 1 1 4 1621 1 1 21 ALA HA H 10.002 3.190 -7.993 1.00 . A A . 21 ALA HA 1 1 4 1622 1 1 21 ALA HB1 H 8.389 5.125 -8.274 1.00 . A A . 21 ALA HB1 1 1 4 1623 1 1 21 ALA HB2 H 8.395 5.340 -6.533 1.00 . A A . 21 ALA HB2 1 1 4 1624 1 1 21 ALA HB3 H 9.867 5.612 -7.456 1.00 . A A . 21 ALA HB3 1 1 4 1625 1 1 21 ALA N N 8.108 2.725 -7.208 1.00 . A A . 21 ALA N 1 1 4 1626 1 1 21 ALA O O 11.249 3.270 -5.754 1.00 . A A . 21 ALA O 1 1 4 1627 1 1 22 GLU C C 10.560 1.637 -3.412 1.00 . A A . 22 GLU C 1 1 4 1628 1 1 22 GLU CA C 9.681 2.894 -3.463 1.00 . A A . 22 GLU CA 1 1 4 1629 1 1 22 GLU CB C 8.413 2.771 -2.577 1.00 . A A . 22 GLU CB 1 1 4 1630 1 1 22 GLU CD C 7.181 1.390 -0.915 1.00 . A A . 22 GLU CD 1 1 4 1631 1 1 22 GLU CG C 8.576 1.917 -1.300 1.00 . A A . 22 GLU CG 1 1 4 1632 1 1 22 GLU H H 8.241 3.156 -5.039 1.00 . A A . 22 GLU H 1 1 4 1633 1 1 22 GLU HA H 10.262 3.750 -3.178 1.00 . A A . 22 GLU HA 1 1 4 1634 1 1 22 GLU HB2 H 8.095 3.761 -2.287 1.00 . A A . 22 GLU HB2 1 1 4 1635 1 1 22 GLU HB3 H 7.635 2.333 -3.178 1.00 . A A . 22 GLU HB3 1 1 4 1636 1 1 22 GLU HG2 H 9.235 1.075 -1.447 1.00 . A A . 22 GLU HG2 1 1 4 1637 1 1 22 GLU HG3 H 8.963 2.528 -0.496 1.00 . A A . 22 GLU HG3 1 1 4 1638 1 1 22 GLU N N 9.206 3.130 -4.857 1.00 . A A . 22 GLU N 1 1 4 1639 1 1 22 GLU O O 11.584 1.610 -2.758 1.00 . A A . 22 GLU O 1 1 4 1640 1 1 22 GLU OE1 O 6.842 0.330 -1.418 1.00 . A A . 22 GLU OE1 1 1 4 1641 1 1 22 GLU OE2 O 6.528 2.076 -0.144 1.00 . A A . 22 GLU OE2 1 1 4 1642 1 1 23 ASP C C 12.110 -0.506 -5.019 1.00 . A A . 23 ASP C 1 1 4 1643 1 1 23 ASP CA C 10.831 -0.663 -4.191 1.00 . A A . 23 ASP CA 1 1 4 1644 1 1 23 ASP CB C 9.879 -1.695 -4.824 1.00 . A A . 23 ASP CB 1 1 4 1645 1 1 23 ASP CG C 9.011 -2.322 -3.719 1.00 . A A . 23 ASP CG 1 1 4 1646 1 1 23 ASP H H 9.273 0.763 -4.619 1.00 . A A . 23 ASP H 1 1 4 1647 1 1 23 ASP HA H 11.101 -0.965 -3.189 1.00 . A A . 23 ASP HA 1 1 4 1648 1 1 23 ASP HB2 H 9.229 -1.215 -5.542 1.00 . A A . 23 ASP HB2 1 1 4 1649 1 1 23 ASP HB3 H 10.440 -2.468 -5.329 1.00 . A A . 23 ASP HB3 1 1 4 1650 1 1 23 ASP N N 10.107 0.641 -4.123 1.00 . A A . 23 ASP N 1 1 4 1651 1 1 23 ASP O O 13.172 -0.921 -4.599 1.00 . A A . 23 ASP O 1 1 4 1652 1 1 23 ASP OD1 O 8.219 -1.578 -3.160 1.00 . A A . 23 ASP OD1 1 1 4 1653 1 1 23 ASP OD2 O 9.185 -3.509 -3.493 1.00 . A A . 23 ASP OD2 1 1 4 1654 1 1 24 VAL C C 14.265 1.013 -6.361 1.00 . A A . 24 VAL C 1 1 4 1655 1 1 24 VAL CA C 13.102 0.329 -7.107 1.00 . A A . 24 VAL CA 1 1 4 1656 1 1 24 VAL CB C 12.601 1.219 -8.282 1.00 . A A . 24 VAL CB 1 1 4 1657 1 1 24 VAL CG1 C 13.779 1.641 -9.193 1.00 . A A . 24 VAL CG1 1 1 4 1658 1 1 24 VAL CG2 C 11.574 0.434 -9.131 1.00 . A A . 24 VAL CG2 1 1 4 1659 1 1 24 VAL H H 11.055 0.381 -6.432 1.00 . A A . 24 VAL H 1 1 4 1660 1 1 24 VAL HA H 13.443 -0.626 -7.483 1.00 . A A . 24 VAL HA 1 1 4 1661 1 1 24 VAL HB H 12.127 2.105 -7.886 1.00 . A A . 24 VAL HB 1 1 4 1662 1 1 24 VAL HG11 H 14.393 0.787 -9.439 1.00 . A A . 24 VAL HG11 1 1 4 1663 1 1 24 VAL HG12 H 13.407 2.077 -10.109 1.00 . A A . 24 VAL HG12 1 1 4 1664 1 1 24 VAL HG13 H 14.392 2.376 -8.691 1.00 . A A . 24 VAL HG13 1 1 4 1665 1 1 24 VAL HG21 H 10.865 -0.080 -8.498 1.00 . A A . 24 VAL HG21 1 1 4 1666 1 1 24 VAL HG22 H 11.033 1.117 -9.768 1.00 . A A . 24 VAL HG22 1 1 4 1667 1 1 24 VAL HG23 H 12.074 -0.296 -9.750 1.00 . A A . 24 VAL HG23 1 1 4 1668 1 1 24 VAL N N 11.953 0.090 -6.175 1.00 . A A . 24 VAL N 1 1 4 1669 1 1 24 VAL O O 15.386 0.545 -6.404 1.00 . A A . 24 VAL O 1 1 4 1670 1 1 25 GLY C C 14.620 4.370 -5.024 1.00 . A A . 25 GLY C 1 1 4 1671 1 1 25 GLY CA C 14.959 2.880 -4.934 1.00 . A A . 25 GLY CA 1 1 4 1672 1 1 25 GLY H H 13.022 2.422 -5.719 1.00 . A A . 25 GLY H 1 1 4 1673 1 1 25 GLY HA2 H 14.933 2.570 -3.899 1.00 . A A . 25 GLY HA2 1 1 4 1674 1 1 25 GLY HA3 H 15.945 2.711 -5.341 1.00 . A A . 25 GLY HA3 1 1 4 1675 1 1 25 GLY N N 13.947 2.102 -5.706 1.00 . A A . 25 GLY N 1 1 4 1676 1 1 25 GLY O O 13.482 4.757 -4.840 1.00 . A A . 25 GLY O 1 1 4 1677 1 1 26 SER C C 16.469 7.139 -6.480 1.00 . A A . 26 SER C 1 1 4 1678 1 1 26 SER CA C 15.464 6.637 -5.432 1.00 . A A . 26 SER CA 1 1 4 1679 1 1 26 SER CB C 15.734 7.283 -4.053 1.00 . A A . 26 SER CB 1 1 4 1680 1 1 26 SER H H 16.516 4.758 -5.439 1.00 . A A . 26 SER H 1 1 4 1681 1 1 26 SER HA H 14.465 6.864 -5.776 1.00 . A A . 26 SER HA 1 1 4 1682 1 1 26 SER HB2 H 16.673 6.954 -3.633 1.00 . A A . 26 SER HB2 1 1 4 1683 1 1 26 SER HB3 H 15.707 8.363 -4.106 1.00 . A A . 26 SER HB3 1 1 4 1684 1 1 26 SER HG H 14.172 7.595 -2.936 1.00 . A A . 26 SER HG 1 1 4 1685 1 1 26 SER N N 15.629 5.154 -5.306 1.00 . A A . 26 SER N 1 1 4 1686 1 1 26 SER O O 17.168 8.115 -6.275 1.00 . A A . 26 SER O 1 1 4 1687 1 1 26 SER OG O 14.665 6.828 -3.236 1.00 . A A . 26 SER OG 1 1 4 1688 1 1 27 ASN C C 18.903 6.694 -8.312 1.00 . A A . 27 ASN C 1 1 4 1689 1 1 27 ASN CA C 17.419 6.766 -8.727 1.00 . A A . 27 ASN CA 1 1 4 1690 1 1 27 ASN CB C 17.079 8.192 -9.245 1.00 . A A . 27 ASN CB 1 1 4 1691 1 1 27 ASN CG C 17.566 8.343 -10.692 1.00 . A A . 27 ASN CG 1 1 4 1692 1 1 27 ASN H H 15.902 5.661 -7.670 1.00 . A A . 27 ASN H 1 1 4 1693 1 1 27 ASN HA H 17.252 6.040 -9.510 1.00 . A A . 27 ASN HA 1 1 4 1694 1 1 27 ASN HB2 H 16.012 8.354 -9.222 1.00 . A A . 27 ASN HB2 1 1 4 1695 1 1 27 ASN HB3 H 17.559 8.946 -8.637 1.00 . A A . 27 ASN HB3 1 1 4 1696 1 1 27 ASN HD21 H 16.073 7.270 -11.441 1.00 . A A . 27 ASN HD21 1 1 4 1697 1 1 27 ASN HD22 H 17.181 7.868 -12.581 1.00 . A A . 27 ASN HD22 1 1 4 1698 1 1 27 ASN N N 16.500 6.433 -7.586 1.00 . A A . 27 ASN N 1 1 4 1699 1 1 27 ASN ND2 N 16.883 7.780 -11.650 1.00 . A A . 27 ASN ND2 1 1 4 1700 1 1 27 ASN O O 19.775 7.091 -9.060 1.00 . A A . 27 ASN O 1 1 4 1701 1 1 27 ASN OD1 O 18.569 8.973 -10.963 1.00 . A A . 27 ASN OD1 1 1 4 1702 1 1 28 LYS C C 21.282 7.392 -6.521 1.00 . A A . 28 LYS C 1 1 4 1703 1 1 28 LYS CA C 20.520 6.041 -6.564 1.00 . A A . 28 LYS CA 1 1 4 1704 1 1 28 LYS CB C 21.297 4.986 -7.435 1.00 . A A . 28 LYS CB 1 1 4 1705 1 1 28 LYS CD C 19.833 3.092 -6.528 1.00 . A A . 28 LYS CD 1 1 4 1706 1 1 28 LYS CE C 18.974 1.881 -6.932 1.00 . A A . 28 LYS CE 1 1 4 1707 1 1 28 LYS CG C 20.411 3.759 -7.801 1.00 . A A . 28 LYS CG 1 1 4 1708 1 1 28 LYS H H 18.379 5.883 -6.581 1.00 . A A . 28 LYS H 1 1 4 1709 1 1 28 LYS HA H 20.436 5.676 -5.551 1.00 . A A . 28 LYS HA 1 1 4 1710 1 1 28 LYS HB2 H 21.644 5.450 -8.346 1.00 . A A . 28 LYS HB2 1 1 4 1711 1 1 28 LYS HB3 H 22.162 4.642 -6.885 1.00 . A A . 28 LYS HB3 1 1 4 1712 1 1 28 LYS HD2 H 20.638 2.769 -5.884 1.00 . A A . 28 LYS HD2 1 1 4 1713 1 1 28 LYS HD3 H 19.215 3.793 -5.985 1.00 . A A . 28 LYS HD3 1 1 4 1714 1 1 28 LYS HE2 H 18.227 2.171 -7.657 1.00 . A A . 28 LYS HE2 1 1 4 1715 1 1 28 LYS HE3 H 19.595 1.105 -7.356 1.00 . A A . 28 LYS HE3 1 1 4 1716 1 1 28 LYS HG2 H 19.607 4.067 -8.453 1.00 . A A . 28 LYS HG2 1 1 4 1717 1 1 28 LYS HG3 H 21.018 3.041 -8.333 1.00 . A A . 28 LYS HG3 1 1 4 1718 1 1 28 LYS HZ1 H 18.534 1.888 -4.893 1.00 . A A . 28 LYS HZ1 1 1 4 1719 1 1 28 LYS HZ2 H 17.252 1.374 -5.879 1.00 . A A . 28 LYS HZ2 1 1 4 1720 1 1 28 LYS HZ3 H 18.566 0.340 -5.591 1.00 . A A . 28 LYS HZ3 1 1 4 1721 1 1 28 LYS N N 19.136 6.183 -7.125 1.00 . A A . 28 LYS N 1 1 4 1722 1 1 28 LYS NZ N 18.280 1.330 -5.733 1.00 . A A . 28 LYS NZ 1 1 4 1723 1 1 28 LYS O O 22.502 7.352 -6.474 1.00 . A A . 28 LYS O 1 1 4 1724 1 1 28 LYS OXT O 20.599 8.404 -6.532 1.00 . A A . 28 LYS OXT 1 1 5 1725 1 1 1 ASP C C -20.290 4.682 -5.471 1.00 . A A . 1 ASP C 1 1 5 1726 1 1 1 ASP CA C -21.209 4.341 -6.658 1.00 . A A . 1 ASP CA 1 1 5 1727 1 1 1 ASP CB C -20.648 3.121 -7.474 1.00 . A A . 1 ASP CB 1 1 5 1728 1 1 1 ASP CG C -19.224 3.347 -8.040 1.00 . A A . 1 ASP CG 1 1 5 1729 1 1 1 ASP H1 H -20.753 6.311 -7.164 1.00 . A A . 1 ASP H1 1 1 5 1730 1 1 1 ASP H2 H -20.954 5.290 -8.501 1.00 . A A . 1 ASP H2 1 1 5 1731 1 1 1 ASP H3 H -22.309 5.819 -7.626 1.00 . A A . 1 ASP H3 1 1 5 1732 1 1 1 ASP HA H -22.195 4.109 -6.282 1.00 . A A . 1 ASP HA 1 1 5 1733 1 1 1 ASP HB2 H -20.642 2.248 -6.837 1.00 . A A . 1 ASP HB2 1 1 5 1734 1 1 1 ASP HB3 H -21.309 2.922 -8.304 1.00 . A A . 1 ASP HB3 1 1 5 1735 1 1 1 ASP N N -21.315 5.528 -7.555 1.00 . A A . 1 ASP N 1 1 5 1736 1 1 1 ASP O O -19.104 4.415 -5.489 1.00 . A A . 1 ASP O 1 1 5 1737 1 1 1 ASP OD1 O -18.976 4.418 -8.573 1.00 . A A . 1 ASP OD1 1 1 5 1738 1 1 1 ASP OD2 O -18.450 2.415 -7.904 1.00 . A A . 1 ASP OD2 1 1 5 1739 1 1 2 ALA C C -18.999 6.658 -3.633 1.00 . A A . 2 ALA C 1 1 5 1740 1 1 2 ALA CA C -20.112 5.675 -3.228 1.00 . A A . 2 ALA CA 1 1 5 1741 1 1 2 ALA CB C -19.513 4.403 -2.559 1.00 . A A . 2 ALA CB 1 1 5 1742 1 1 2 ALA H H -21.836 5.460 -4.506 1.00 . A A . 2 ALA H 1 1 5 1743 1 1 2 ALA HA H -20.789 6.170 -2.547 1.00 . A A . 2 ALA HA 1 1 5 1744 1 1 2 ALA HB1 H -20.250 3.613 -2.537 1.00 . A A . 2 ALA HB1 1 1 5 1745 1 1 2 ALA HB2 H -18.645 4.054 -3.097 1.00 . A A . 2 ALA HB2 1 1 5 1746 1 1 2 ALA HB3 H -19.219 4.630 -1.545 1.00 . A A . 2 ALA HB3 1 1 5 1747 1 1 2 ALA N N -20.875 5.274 -4.458 1.00 . A A . 2 ALA N 1 1 5 1748 1 1 2 ALA O O -17.828 6.460 -3.367 1.00 . A A . 2 ALA O 1 1 5 1749 1 1 3 GLU C C -18.175 9.755 -3.638 1.00 . A A . 3 GLU C 1 1 5 1750 1 1 3 GLU CA C -18.507 8.781 -4.757 1.00 . A A . 3 GLU CA 1 1 5 1751 1 1 3 GLU CB C -19.185 9.477 -5.955 1.00 . A A . 3 GLU CB 1 1 5 1752 1 1 3 GLU CD C -18.854 7.609 -7.646 1.00 . A A . 3 GLU CD 1 1 5 1753 1 1 3 GLU CG C -18.426 9.030 -7.214 1.00 . A A . 3 GLU CG 1 1 5 1754 1 1 3 GLU H H -20.386 7.810 -4.442 1.00 . A A . 3 GLU H 1 1 5 1755 1 1 3 GLU HA H -17.581 8.311 -5.054 1.00 . A A . 3 GLU HA 1 1 5 1756 1 1 3 GLU HB2 H -20.227 9.196 -6.027 1.00 . A A . 3 GLU HB2 1 1 5 1757 1 1 3 GLU HB3 H -19.124 10.553 -5.876 1.00 . A A . 3 GLU HB3 1 1 5 1758 1 1 3 GLU HG2 H -18.614 9.729 -8.010 1.00 . A A . 3 GLU HG2 1 1 5 1759 1 1 3 GLU HG3 H -17.365 9.027 -7.004 1.00 . A A . 3 GLU HG3 1 1 5 1760 1 1 3 GLU N N -19.432 7.715 -4.275 1.00 . A A . 3 GLU N 1 1 5 1761 1 1 3 GLU O O -18.614 10.885 -3.544 1.00 . A A . 3 GLU O 1 1 5 1762 1 1 3 GLU OE1 O -18.559 6.694 -6.898 1.00 . A A . 3 GLU OE1 1 1 5 1763 1 1 3 GLU OE2 O -19.452 7.505 -8.703 1.00 . A A . 3 GLU OE2 1 1 5 1764 1 1 4 PHE C C -15.500 8.996 -1.252 1.00 . A A . 4 PHE C 1 1 5 1765 1 1 4 PHE CA C -16.778 9.776 -1.586 1.00 . A A . 4 PHE CA 1 1 5 1766 1 1 4 PHE CB C -17.754 9.655 -0.378 1.00 . A A . 4 PHE CB 1 1 5 1767 1 1 4 PHE CD1 C -19.744 11.164 -0.827 1.00 . A A . 4 PHE CD1 1 1 5 1768 1 1 4 PHE CD2 C -20.010 8.818 -1.165 1.00 . A A . 4 PHE CD2 1 1 5 1769 1 1 4 PHE CE1 C -21.053 11.367 -1.212 1.00 . A A . 4 PHE CE1 1 1 5 1770 1 1 4 PHE CE2 C -21.318 9.020 -1.550 1.00 . A A . 4 PHE CE2 1 1 5 1771 1 1 4 PHE CG C -19.213 9.888 -0.801 1.00 . A A . 4 PHE CG 1 1 5 1772 1 1 4 PHE CZ C -21.841 10.295 -1.574 1.00 . A A . 4 PHE CZ 1 1 5 1773 1 1 4 PHE H H -17.123 8.254 -3.086 1.00 . A A . 4 PHE H 1 1 5 1774 1 1 4 PHE HA H -16.511 10.801 -1.799 1.00 . A A . 4 PHE HA 1 1 5 1775 1 1 4 PHE HB2 H -17.678 8.673 0.067 1.00 . A A . 4 PHE HB2 1 1 5 1776 1 1 4 PHE HB3 H -17.490 10.388 0.371 1.00 . A A . 4 PHE HB3 1 1 5 1777 1 1 4 PHE HD1 H -19.133 12.009 -0.546 1.00 . A A . 4 PHE HD1 1 1 5 1778 1 1 4 PHE HD2 H -19.606 7.816 -1.147 1.00 . A A . 4 PHE HD2 1 1 5 1779 1 1 4 PHE HE1 H -21.461 12.366 -1.231 1.00 . A A . 4 PHE HE1 1 1 5 1780 1 1 4 PHE HE2 H -21.933 8.178 -1.833 1.00 . A A . 4 PHE HE2 1 1 5 1781 1 1 4 PHE HZ H -22.865 10.454 -1.876 1.00 . A A . 4 PHE HZ 1 1 5 1782 1 1 4 PHE N N -17.354 9.166 -2.823 1.00 . A A . 4 PHE N 1 1 5 1783 1 1 4 PHE O O -14.591 9.521 -0.639 1.00 . A A . 4 PHE O 1 1 5 1784 1 1 5 ARG C C -13.343 6.987 -2.602 1.00 . A A . 5 ARG C 1 1 5 1785 1 1 5 ARG CA C -14.315 6.851 -1.442 1.00 . A A . 5 ARG CA 1 1 5 1786 1 1 5 ARG CB C -14.803 5.415 -1.342 1.00 . A A . 5 ARG CB 1 1 5 1787 1 1 5 ARG CD C -16.348 3.926 -0.013 1.00 . A A . 5 ARG CD 1 1 5 1788 1 1 5 ARG CG C -16.111 5.356 -0.532 1.00 . A A . 5 ARG CG 1 1 5 1789 1 1 5 ARG CZ C -16.622 2.002 -1.553 1.00 . A A . 5 ARG CZ 1 1 5 1790 1 1 5 ARG H H -16.251 7.395 -2.168 1.00 . A A . 5 ARG H 1 1 5 1791 1 1 5 ARG HA H -13.817 7.101 -0.540 1.00 . A A . 5 ARG HA 1 1 5 1792 1 1 5 ARG HB2 H -14.973 5.028 -2.332 1.00 . A A . 5 ARG HB2 1 1 5 1793 1 1 5 ARG HB3 H -14.041 4.820 -0.862 1.00 . A A . 5 ARG HB3 1 1 5 1794 1 1 5 ARG HD2 H -15.776 3.771 0.892 1.00 . A A . 5 ARG HD2 1 1 5 1795 1 1 5 ARG HD3 H -17.396 3.790 0.197 1.00 . A A . 5 ARG HD3 1 1 5 1796 1 1 5 ARG HE H -14.950 3.045 -1.369 1.00 . A A . 5 ARG HE 1 1 5 1797 1 1 5 ARG HG2 H -16.047 6.048 0.295 1.00 . A A . 5 ARG HG2 1 1 5 1798 1 1 5 ARG HG3 H -16.928 5.659 -1.172 1.00 . A A . 5 ARG HG3 1 1 5 1799 1 1 5 ARG HH11 H -18.268 2.423 -0.477 1.00 . A A . 5 ARG HH11 1 1 5 1800 1 1 5 ARG HH12 H -18.404 1.096 -1.574 1.00 . A A . 5 ARG HH12 1 1 5 1801 1 1 5 ARG HH21 H -15.134 1.378 -2.736 1.00 . A A . 5 ARG HH21 1 1 5 1802 1 1 5 ARG HH22 H -16.614 0.491 -2.869 1.00 . A A . 5 ARG HH22 1 1 5 1803 1 1 5 ARG N N -15.484 7.754 -1.678 1.00 . A A . 5 ARG N 1 1 5 1804 1 1 5 ARG NE N -15.873 2.954 -1.051 1.00 . A A . 5 ARG NE 1 1 5 1805 1 1 5 ARG NH1 N -17.860 1.831 -1.169 1.00 . A A . 5 ARG NH1 1 1 5 1806 1 1 5 ARG NH2 N -16.082 1.230 -2.455 1.00 . A A . 5 ARG NH2 1 1 5 1807 1 1 5 ARG O O -12.598 6.082 -2.913 1.00 . A A . 5 ARG O 1 1 5 1808 1 1 6 HIS C C -13.140 7.570 -5.428 1.00 . A A . 6 HIS C 1 1 5 1809 1 1 6 HIS CA C -12.537 8.497 -4.370 1.00 . A A . 6 HIS CA 1 1 5 1810 1 1 6 HIS CB C -11.035 8.157 -4.092 1.00 . A A . 6 HIS CB 1 1 5 1811 1 1 6 HIS CD2 C -10.349 9.886 -2.203 1.00 . A A . 6 HIS CD2 1 1 5 1812 1 1 6 HIS CE1 C -10.239 8.559 -0.612 1.00 . A A . 6 HIS CE1 1 1 5 1813 1 1 6 HIS CG C -10.660 8.626 -2.683 1.00 . A A . 6 HIS CG 1 1 5 1814 1 1 6 HIS H H -14.029 8.806 -2.838 1.00 . A A . 6 HIS H 1 1 5 1815 1 1 6 HIS HA H -12.692 9.530 -4.646 1.00 . A A . 6 HIS HA 1 1 5 1816 1 1 6 HIS HB2 H -10.841 7.098 -4.173 1.00 . A A . 6 HIS HB2 1 1 5 1817 1 1 6 HIS HB3 H -10.411 8.677 -4.804 1.00 . A A . 6 HIS HB3 1 1 5 1818 1 1 6 HIS HD1 H -10.735 6.891 -1.646 1.00 . A A . 6 HIS HD1 1 1 5 1819 1 1 6 HIS HD2 H -10.322 10.786 -2.798 1.00 . A A . 6 HIS HD2 1 1 5 1820 1 1 6 HIS HE1 H -10.100 8.150 0.378 1.00 . A A . 6 HIS HE1 1 1 5 1821 1 1 6 HIS N N -13.395 8.151 -3.194 1.00 . A A . 6 HIS N 1 1 5 1822 1 1 6 HIS ND1 N -10.572 7.857 -1.647 1.00 . A A . 6 HIS ND1 1 1 5 1823 1 1 6 HIS NE2 N -10.089 9.826 -0.911 1.00 . A A . 6 HIS NE2 1 1 5 1824 1 1 6 HIS O O -12.480 6.773 -6.064 1.00 . A A . 6 HIS O 1 1 5 1825 1 1 7 ASP C C -15.249 5.464 -6.182 1.00 . A A . 7 ASP C 1 1 5 1826 1 1 7 ASP CA C -15.296 6.975 -6.474 1.00 . A A . 7 ASP CA 1 1 5 1827 1 1 7 ASP CB C -14.835 7.274 -7.934 1.00 . A A . 7 ASP CB 1 1 5 1828 1 1 7 ASP CG C -16.035 7.126 -8.895 1.00 . A A . 7 ASP CG 1 1 5 1829 1 1 7 ASP H H -14.862 8.412 -4.953 1.00 . A A . 7 ASP H 1 1 5 1830 1 1 7 ASP HA H -16.305 7.310 -6.332 1.00 . A A . 7 ASP HA 1 1 5 1831 1 1 7 ASP HB2 H -14.456 8.284 -7.993 1.00 . A A . 7 ASP HB2 1 1 5 1832 1 1 7 ASP HB3 H -14.055 6.595 -8.243 1.00 . A A . 7 ASP HB3 1 1 5 1833 1 1 7 ASP N N -14.436 7.742 -5.531 1.00 . A A . 7 ASP N 1 1 5 1834 1 1 7 ASP O O -14.925 4.664 -7.040 1.00 . A A . 7 ASP O 1 1 5 1835 1 1 7 ASP OD1 O -16.511 6.008 -9.021 1.00 . A A . 7 ASP OD1 1 1 5 1836 1 1 7 ASP OD2 O -16.417 8.141 -9.453 1.00 . A A . 7 ASP OD2 1 1 5 1837 1 1 8 SER C C -14.182 3.048 -4.551 1.00 . A A . 8 SER C 1 1 5 1838 1 1 8 SER CA C -15.584 3.675 -4.525 1.00 . A A . 8 SER CA 1 1 5 1839 1 1 8 SER CB C -16.552 2.873 -5.462 1.00 . A A . 8 SER CB 1 1 5 1840 1 1 8 SER H H -15.813 5.809 -4.295 1.00 . A A . 8 SER H 1 1 5 1841 1 1 8 SER HA H -15.933 3.649 -3.506 1.00 . A A . 8 SER HA 1 1 5 1842 1 1 8 SER HB2 H -17.016 3.528 -6.184 1.00 . A A . 8 SER HB2 1 1 5 1843 1 1 8 SER HB3 H -16.062 2.067 -5.986 1.00 . A A . 8 SER HB3 1 1 5 1844 1 1 8 SER HG H -17.450 2.671 -3.730 1.00 . A A . 8 SER HG 1 1 5 1845 1 1 8 SER N N -15.576 5.117 -4.955 1.00 . A A . 8 SER N 1 1 5 1846 1 1 8 SER O O -14.023 1.856 -4.745 1.00 . A A . 8 SER O 1 1 5 1847 1 1 8 SER OG O -17.560 2.330 -4.619 1.00 . A A . 8 SER OG 1 1 5 1848 1 1 9 GLY C C -11.303 3.088 -5.757 1.00 . A A . 9 GLY C 1 1 5 1849 1 1 9 GLY CA C -11.781 3.427 -4.341 1.00 . A A . 9 GLY CA 1 1 5 1850 1 1 9 GLY H H -13.419 4.829 -4.187 1.00 . A A . 9 GLY H 1 1 5 1851 1 1 9 GLY HA2 H -11.160 4.215 -3.942 1.00 . A A . 9 GLY HA2 1 1 5 1852 1 1 9 GLY HA3 H -11.689 2.553 -3.712 1.00 . A A . 9 GLY HA3 1 1 5 1853 1 1 9 GLY N N -13.203 3.886 -4.345 1.00 . A A . 9 GLY N 1 1 5 1854 1 1 9 GLY O O -10.937 1.963 -6.036 1.00 . A A . 9 GLY O 1 1 5 1855 1 1 10 TYR C C -9.403 3.601 -8.158 1.00 . A A . 10 TYR C 1 1 5 1856 1 1 10 TYR CA C -10.897 3.936 -8.028 1.00 . A A . 10 TYR CA 1 1 5 1857 1 1 10 TYR CB C -11.208 5.263 -8.762 1.00 . A A . 10 TYR CB 1 1 5 1858 1 1 10 TYR CD1 C -9.594 6.623 -7.304 1.00 . A A . 10 TYR CD1 1 1 5 1859 1 1 10 TYR CD2 C -9.507 6.924 -9.662 1.00 . A A . 10 TYR CD2 1 1 5 1860 1 1 10 TYR CE1 C -8.575 7.540 -7.150 1.00 . A A . 10 TYR CE1 1 1 5 1861 1 1 10 TYR CE2 C -8.488 7.840 -9.506 1.00 . A A . 10 TYR CE2 1 1 5 1862 1 1 10 TYR CG C -10.073 6.303 -8.565 1.00 . A A . 10 TYR CG 1 1 5 1863 1 1 10 TYR CZ C -8.015 8.154 -8.249 1.00 . A A . 10 TYR CZ 1 1 5 1864 1 1 10 TYR H H -11.646 4.963 -6.317 1.00 . A A . 10 TYR H 1 1 5 1865 1 1 10 TYR HA H -11.471 3.137 -8.475 1.00 . A A . 10 TYR HA 1 1 5 1866 1 1 10 TYR HB2 H -11.312 5.056 -9.818 1.00 . A A . 10 TYR HB2 1 1 5 1867 1 1 10 TYR HB3 H -12.129 5.678 -8.392 1.00 . A A . 10 TYR HB3 1 1 5 1868 1 1 10 TYR HD1 H -10.014 6.157 -6.426 1.00 . A A . 10 TYR HD1 1 1 5 1869 1 1 10 TYR HD2 H -9.862 6.692 -10.656 1.00 . A A . 10 TYR HD2 1 1 5 1870 1 1 10 TYR HE1 H -8.215 7.778 -6.161 1.00 . A A . 10 TYR HE1 1 1 5 1871 1 1 10 TYR HE2 H -8.058 8.316 -10.375 1.00 . A A . 10 TYR HE2 1 1 5 1872 1 1 10 TYR HH H -6.167 8.617 -8.303 1.00 . A A . 10 TYR HH 1 1 5 1873 1 1 10 TYR N N -11.330 4.084 -6.605 1.00 . A A . 10 TYR N 1 1 5 1874 1 1 10 TYR O O -8.737 3.283 -7.190 1.00 . A A . 10 TYR O 1 1 5 1875 1 1 10 TYR OH O -6.991 9.066 -8.097 1.00 . A A . 10 TYR OH 1 1 5 1876 1 1 11 GLU C C -6.719 4.651 -9.261 1.00 . A A . 11 GLU C 1 1 5 1877 1 1 11 GLU CA C -7.500 3.403 -9.654 1.00 . A A . 11 GLU CA 1 1 5 1878 1 1 11 GLU CB C -7.345 3.078 -11.157 1.00 . A A . 11 GLU CB 1 1 5 1879 1 1 11 GLU CD C -8.460 0.827 -11.133 1.00 . A A . 11 GLU CD 1 1 5 1880 1 1 11 GLU CG C -7.115 1.563 -11.295 1.00 . A A . 11 GLU CG 1 1 5 1881 1 1 11 GLU H H -9.525 3.951 -10.110 1.00 . A A . 11 GLU H 1 1 5 1882 1 1 11 GLU HA H -7.178 2.593 -9.021 1.00 . A A . 11 GLU HA 1 1 5 1883 1 1 11 GLU HB2 H -8.235 3.367 -11.698 1.00 . A A . 11 GLU HB2 1 1 5 1884 1 1 11 GLU HB3 H -6.508 3.609 -11.584 1.00 . A A . 11 GLU HB3 1 1 5 1885 1 1 11 GLU HG2 H -6.693 1.345 -12.263 1.00 . A A . 11 GLU HG2 1 1 5 1886 1 1 11 GLU HG3 H -6.425 1.219 -10.534 1.00 . A A . 11 GLU HG3 1 1 5 1887 1 1 11 GLU N N -8.931 3.691 -9.376 1.00 . A A . 11 GLU N 1 1 5 1888 1 1 11 GLU O O -6.655 5.631 -9.979 1.00 . A A . 11 GLU O 1 1 5 1889 1 1 11 GLU OE1 O -8.831 0.612 -9.990 1.00 . A A . 11 GLU OE1 1 1 5 1890 1 1 11 GLU OE2 O -9.040 0.522 -12.162 1.00 . A A . 11 GLU OE2 1 1 5 1891 1 1 12 VAL C C -4.209 6.076 -8.421 1.00 . A A . 12 VAL C 1 1 5 1892 1 1 12 VAL CA C -5.337 5.627 -7.494 1.00 . A A . 12 VAL CA 1 1 5 1893 1 1 12 VAL CB C -4.785 5.104 -6.134 1.00 . A A . 12 VAL CB 1 1 5 1894 1 1 12 VAL CG1 C -3.681 6.026 -5.569 1.00 . A A . 12 VAL CG1 1 1 5 1895 1 1 12 VAL CG2 C -5.946 5.085 -5.131 1.00 . A A . 12 VAL CG2 1 1 5 1896 1 1 12 VAL H H -6.266 3.689 -7.608 1.00 . A A . 12 VAL H 1 1 5 1897 1 1 12 VAL HA H -5.985 6.473 -7.320 1.00 . A A . 12 VAL HA 1 1 5 1898 1 1 12 VAL HB H -4.394 4.103 -6.256 1.00 . A A . 12 VAL HB 1 1 5 1899 1 1 12 VAL HG11 H -3.914 7.054 -5.802 1.00 . A A . 12 VAL HG11 1 1 5 1900 1 1 12 VAL HG12 H -3.609 5.923 -4.496 1.00 . A A . 12 VAL HG12 1 1 5 1901 1 1 12 VAL HG13 H -2.727 5.767 -6.000 1.00 . A A . 12 VAL HG13 1 1 5 1902 1 1 12 VAL HG21 H -6.757 4.485 -5.514 1.00 . A A . 12 VAL HG21 1 1 5 1903 1 1 12 VAL HG22 H -5.612 4.671 -4.192 1.00 . A A . 12 VAL HG22 1 1 5 1904 1 1 12 VAL HG23 H -6.302 6.092 -4.966 1.00 . A A . 12 VAL HG23 1 1 5 1905 1 1 12 VAL N N -6.150 4.532 -8.094 1.00 . A A . 12 VAL N 1 1 5 1906 1 1 12 VAL O O -4.239 7.187 -8.912 1.00 . A A . 12 VAL O 1 1 5 1907 1 1 13 HIS C C -1.294 6.760 -9.045 1.00 . A A . 13 HIS C 1 1 5 1908 1 1 13 HIS CA C -2.090 5.521 -9.525 1.00 . A A . 13 HIS CA 1 1 5 1909 1 1 13 HIS CB C -2.607 5.739 -10.973 1.00 . A A . 13 HIS CB 1 1 5 1910 1 1 13 HIS CD2 C -3.975 3.473 -11.064 1.00 . A A . 13 HIS CD2 1 1 5 1911 1 1 13 HIS CE1 C -3.140 2.681 -12.786 1.00 . A A . 13 HIS CE1 1 1 5 1912 1 1 13 HIS CG C -3.039 4.379 -11.530 1.00 . A A . 13 HIS CG 1 1 5 1913 1 1 13 HIS H H -3.325 4.321 -8.213 1.00 . A A . 13 HIS H 1 1 5 1914 1 1 13 HIS HA H -1.423 4.674 -9.524 1.00 . A A . 13 HIS HA 1 1 5 1915 1 1 13 HIS HB2 H -3.449 6.414 -11.009 1.00 . A A . 13 HIS HB2 1 1 5 1916 1 1 13 HIS HB3 H -1.820 6.131 -11.599 1.00 . A A . 13 HIS HB3 1 1 5 1917 1 1 13 HIS HD1 H -1.872 4.211 -13.171 1.00 . A A . 13 HIS HD1 1 1 5 1918 1 1 13 HIS HD2 H -4.576 3.605 -10.178 1.00 . A A . 13 HIS HD2 1 1 5 1919 1 1 13 HIS HE1 H -2.918 2.020 -13.610 1.00 . A A . 13 HIS HE1 1 1 5 1920 1 1 13 HIS N N -3.259 5.204 -8.638 1.00 . A A . 13 HIS N 1 1 5 1921 1 1 13 HIS ND1 N -2.564 3.824 -12.595 1.00 . A A . 13 HIS ND1 1 1 5 1922 1 1 13 HIS NE2 N -4.026 2.421 -11.856 1.00 . A A . 13 HIS NE2 1 1 5 1923 1 1 13 HIS O O -0.399 7.214 -9.731 1.00 . A A . 13 HIS O 1 1 5 1924 1 1 14 HIS C C 0.262 7.908 -6.539 1.00 . A A . 14 HIS C 1 1 5 1925 1 1 14 HIS CA C -0.930 8.466 -7.323 1.00 . A A . 14 HIS CA 1 1 5 1926 1 1 14 HIS CB C -1.851 9.259 -6.362 1.00 . A A . 14 HIS CB 1 1 5 1927 1 1 14 HIS CD2 C -3.651 10.249 -7.991 1.00 . A A . 14 HIS CD2 1 1 5 1928 1 1 14 HIS CE1 C -3.096 12.243 -7.921 1.00 . A A . 14 HIS CE1 1 1 5 1929 1 1 14 HIS CG C -2.573 10.349 -7.145 1.00 . A A . 14 HIS CG 1 1 5 1930 1 1 14 HIS H H -2.364 6.880 -7.373 1.00 . A A . 14 HIS H 1 1 5 1931 1 1 14 HIS HA H -0.609 9.090 -8.133 1.00 . A A . 14 HIS HA 1 1 5 1932 1 1 14 HIS HB2 H -2.585 8.615 -5.905 1.00 . A A . 14 HIS HB2 1 1 5 1933 1 1 14 HIS HB3 H -1.272 9.731 -5.581 1.00 . A A . 14 HIS HB3 1 1 5 1934 1 1 14 HIS HD1 H -1.546 12.016 -6.635 1.00 . A A . 14 HIS HD1 1 1 5 1935 1 1 14 HIS HD2 H -4.146 9.322 -8.214 1.00 . A A . 14 HIS HD2 1 1 5 1936 1 1 14 HIS HE1 H -3.063 13.308 -8.095 1.00 . A A . 14 HIS HE1 1 1 5 1937 1 1 14 HIS N N -1.635 7.275 -7.884 1.00 . A A . 14 HIS N 1 1 5 1938 1 1 14 HIS ND1 N -2.277 11.606 -7.144 1.00 . A A . 14 HIS ND1 1 1 5 1939 1 1 14 HIS NE2 N -3.971 11.435 -8.470 1.00 . A A . 14 HIS NE2 1 1 5 1940 1 1 14 HIS O O 1.390 7.954 -6.985 1.00 . A A . 14 HIS O 1 1 5 1941 1 1 15 GLN C C 1.124 5.326 -4.856 1.00 . A A . 15 GLN C 1 1 5 1942 1 1 15 GLN CA C 0.929 6.780 -4.445 1.00 . A A . 15 GLN CA 1 1 5 1943 1 1 15 GLN CB C 0.392 6.834 -3.004 1.00 . A A . 15 GLN CB 1 1 5 1944 1 1 15 GLN CD C -0.806 8.175 -1.271 1.00 . A A . 15 GLN CD 1 1 5 1945 1 1 15 GLN CG C -0.224 8.212 -2.689 1.00 . A A . 15 GLN CG 1 1 5 1946 1 1 15 GLN H H -1.014 7.406 -5.129 1.00 . A A . 15 GLN H 1 1 5 1947 1 1 15 GLN HA H 1.884 7.274 -4.533 1.00 . A A . 15 GLN HA 1 1 5 1948 1 1 15 GLN HB2 H -0.365 6.072 -2.878 1.00 . A A . 15 GLN HB2 1 1 5 1949 1 1 15 GLN HB3 H 1.200 6.631 -2.317 1.00 . A A . 15 GLN HB3 1 1 5 1950 1 1 15 GLN HE21 H -2.475 7.270 -1.852 1.00 . A A . 15 GLN HE21 1 1 5 1951 1 1 15 GLN HE22 H -2.371 7.606 -0.191 1.00 . A A . 15 GLN HE22 1 1 5 1952 1 1 15 GLN HG2 H 0.526 8.987 -2.743 1.00 . A A . 15 GLN HG2 1 1 5 1953 1 1 15 GLN HG3 H -1.024 8.444 -3.377 1.00 . A A . 15 GLN HG3 1 1 5 1954 1 1 15 GLN N N -0.068 7.390 -5.384 1.00 . A A . 15 GLN N 1 1 5 1955 1 1 15 GLN NE2 N -1.982 7.640 -1.089 1.00 . A A . 15 GLN NE2 1 1 5 1956 1 1 15 GLN O O 2.147 4.729 -4.593 1.00 . A A . 15 GLN O 1 1 5 1957 1 1 15 GLN OE1 O -0.200 8.631 -0.322 1.00 . A A . 15 GLN OE1 1 1 5 1958 1 1 16 GLU C C 1.448 3.083 -6.683 1.00 . A A . 16 GLU C 1 1 5 1959 1 1 16 GLU CA C 0.120 3.404 -5.981 1.00 . A A . 16 GLU CA 1 1 5 1960 1 1 16 GLU CB C -1.065 3.256 -6.927 1.00 . A A . 16 GLU CB 1 1 5 1961 1 1 16 GLU CD C -2.088 1.916 -8.774 1.00 . A A . 16 GLU CD 1 1 5 1962 1 1 16 GLU CG C -1.010 1.914 -7.671 1.00 . A A . 16 GLU CG 1 1 5 1963 1 1 16 GLU H H -0.681 5.363 -5.667 1.00 . A A . 16 GLU H 1 1 5 1964 1 1 16 GLU HA H -0.012 2.746 -5.140 1.00 . A A . 16 GLU HA 1 1 5 1965 1 1 16 GLU HB2 H -1.984 3.320 -6.362 1.00 . A A . 16 GLU HB2 1 1 5 1966 1 1 16 GLU HB3 H -1.040 4.070 -7.631 1.00 . A A . 16 GLU HB3 1 1 5 1967 1 1 16 GLU HG2 H -0.034 1.772 -8.116 1.00 . A A . 16 GLU HG2 1 1 5 1968 1 1 16 GLU HG3 H -1.187 1.106 -6.976 1.00 . A A . 16 GLU HG3 1 1 5 1969 1 1 16 GLU N N 0.110 4.810 -5.498 1.00 . A A . 16 GLU N 1 1 5 1970 1 1 16 GLU O O 2.091 2.097 -6.382 1.00 . A A . 16 GLU O 1 1 5 1971 1 1 16 GLU OE1 O -3.252 1.993 -8.411 1.00 . A A . 16 GLU OE1 1 1 5 1972 1 1 16 GLU OE2 O -1.685 1.842 -9.923 1.00 . A A . 16 GLU OE2 1 1 5 1973 1 1 17 LEU C C 4.277 4.166 -7.540 1.00 . A A . 17 LEU C 1 1 5 1974 1 1 17 LEU CA C 3.079 3.749 -8.359 1.00 . A A . 17 LEU CA 1 1 5 1975 1 1 17 LEU CB C 3.091 4.574 -9.684 1.00 . A A . 17 LEU CB 1 1 5 1976 1 1 17 LEU CD1 C 1.753 5.865 -11.376 1.00 . A A . 17 LEU CD1 1 1 5 1977 1 1 17 LEU CD2 C 0.968 3.587 -10.649 1.00 . A A . 17 LEU CD2 1 1 5 1978 1 1 17 LEU CG C 1.668 4.885 -10.186 1.00 . A A . 17 LEU CG 1 1 5 1979 1 1 17 LEU H H 1.242 4.719 -7.779 1.00 . A A . 17 LEU H 1 1 5 1980 1 1 17 LEU HA H 3.167 2.698 -8.523 1.00 . A A . 17 LEU HA 1 1 5 1981 1 1 17 LEU HB2 H 3.612 5.508 -9.526 1.00 . A A . 17 LEU HB2 1 1 5 1982 1 1 17 LEU HB3 H 3.628 4.017 -10.439 1.00 . A A . 17 LEU HB3 1 1 5 1983 1 1 17 LEU HD11 H 2.403 5.470 -12.144 1.00 . A A . 17 LEU HD11 1 1 5 1984 1 1 17 LEU HD12 H 0.773 6.025 -11.800 1.00 . A A . 17 LEU HD12 1 1 5 1985 1 1 17 LEU HD13 H 2.145 6.815 -11.045 1.00 . A A . 17 LEU HD13 1 1 5 1986 1 1 17 LEU HD21 H 1.561 3.086 -11.400 1.00 . A A . 17 LEU HD21 1 1 5 1987 1 1 17 LEU HD22 H 0.832 2.918 -9.814 1.00 . A A . 17 LEU HD22 1 1 5 1988 1 1 17 LEU HD23 H -0.001 3.815 -11.070 1.00 . A A . 17 LEU HD23 1 1 5 1989 1 1 17 LEU HG H 1.130 5.346 -9.373 1.00 . A A . 17 LEU HG 1 1 5 1990 1 1 17 LEU N N 1.809 3.946 -7.600 1.00 . A A . 17 LEU N 1 1 5 1991 1 1 17 LEU O O 5.386 3.743 -7.782 1.00 . A A . 17 LEU O 1 1 5 1992 1 1 18 VAL C C 5.585 4.274 -4.853 1.00 . A A . 18 VAL C 1 1 5 1993 1 1 18 VAL CA C 5.161 5.457 -5.715 1.00 . A A . 18 VAL CA 1 1 5 1994 1 1 18 VAL CB C 4.677 6.620 -4.864 1.00 . A A . 18 VAL CB 1 1 5 1995 1 1 18 VAL CG1 C 5.831 7.128 -3.978 1.00 . A A . 18 VAL CG1 1 1 5 1996 1 1 18 VAL CG2 C 4.254 7.700 -5.862 1.00 . A A . 18 VAL CG2 1 1 5 1997 1 1 18 VAL H H 3.116 5.319 -6.432 1.00 . A A . 18 VAL H 1 1 5 1998 1 1 18 VAL HA H 5.990 5.755 -6.342 1.00 . A A . 18 VAL HA 1 1 5 1999 1 1 18 VAL HB H 3.847 6.329 -4.241 1.00 . A A . 18 VAL HB 1 1 5 2000 1 1 18 VAL HG11 H 6.749 7.178 -4.545 1.00 . A A . 18 VAL HG11 1 1 5 2001 1 1 18 VAL HG12 H 5.601 8.108 -3.589 1.00 . A A . 18 VAL HG12 1 1 5 2002 1 1 18 VAL HG13 H 5.973 6.450 -3.149 1.00 . A A . 18 VAL HG13 1 1 5 2003 1 1 18 VAL HG21 H 3.578 7.271 -6.587 1.00 . A A . 18 VAL HG21 1 1 5 2004 1 1 18 VAL HG22 H 3.757 8.508 -5.354 1.00 . A A . 18 VAL HG22 1 1 5 2005 1 1 18 VAL HG23 H 5.121 8.063 -6.392 1.00 . A A . 18 VAL HG23 1 1 5 2006 1 1 18 VAL N N 4.033 5.001 -6.577 1.00 . A A . 18 VAL N 1 1 5 2007 1 1 18 VAL O O 6.681 4.249 -4.336 1.00 . A A . 18 VAL O 1 1 5 2008 1 1 19 PHE C C 5.940 1.244 -4.746 1.00 . A A . 19 PHE C 1 1 5 2009 1 1 19 PHE CA C 4.983 2.110 -3.925 1.00 . A A . 19 PHE CA 1 1 5 2010 1 1 19 PHE CB C 3.696 1.316 -3.663 1.00 . A A . 19 PHE CB 1 1 5 2011 1 1 19 PHE CD1 C 2.897 3.265 -2.212 1.00 . A A . 19 PHE CD1 1 1 5 2012 1 1 19 PHE CD2 C 1.275 1.835 -3.214 1.00 . A A . 19 PHE CD2 1 1 5 2013 1 1 19 PHE CE1 C 1.888 4.002 -1.628 1.00 . A A . 19 PHE CE1 1 1 5 2014 1 1 19 PHE CE2 C 0.266 2.573 -2.629 1.00 . A A . 19 PHE CE2 1 1 5 2015 1 1 19 PHE CG C 2.597 2.173 -3.010 1.00 . A A . 19 PHE CG 1 1 5 2016 1 1 19 PHE CZ C 0.571 3.656 -1.836 1.00 . A A . 19 PHE CZ 1 1 5 2017 1 1 19 PHE H H 3.826 3.420 -5.190 1.00 . A A . 19 PHE H 1 1 5 2018 1 1 19 PHE HA H 5.462 2.410 -3.007 1.00 . A A . 19 PHE HA 1 1 5 2019 1 1 19 PHE HB2 H 3.319 0.915 -4.592 1.00 . A A . 19 PHE HB2 1 1 5 2020 1 1 19 PHE HB3 H 3.914 0.490 -3.002 1.00 . A A . 19 PHE HB3 1 1 5 2021 1 1 19 PHE HD1 H 3.926 3.548 -2.052 1.00 . A A . 19 PHE HD1 1 1 5 2022 1 1 19 PHE HD2 H 1.029 0.991 -3.846 1.00 . A A . 19 PHE HD2 1 1 5 2023 1 1 19 PHE HE1 H 2.133 4.851 -1.006 1.00 . A A . 19 PHE HE1 1 1 5 2024 1 1 19 PHE HE2 H -0.767 2.301 -2.794 1.00 . A A . 19 PHE HE2 1 1 5 2025 1 1 19 PHE HZ H -0.219 4.232 -1.377 1.00 . A A . 19 PHE HZ 1 1 5 2026 1 1 19 PHE N N 4.691 3.326 -4.737 1.00 . A A . 19 PHE N 1 1 5 2027 1 1 19 PHE O O 6.688 0.441 -4.222 1.00 . A A . 19 PHE O 1 1 5 2028 1 1 20 PHE C C 8.076 1.432 -7.000 1.00 . A A . 20 PHE C 1 1 5 2029 1 1 20 PHE CA C 6.727 0.713 -6.991 1.00 . A A . 20 PHE CA 1 1 5 2030 1 1 20 PHE CB C 6.022 0.735 -8.374 1.00 . A A . 20 PHE CB 1 1 5 2031 1 1 20 PHE CD1 C 7.759 -0.317 -9.898 1.00 . A A . 20 PHE CD1 1 1 5 2032 1 1 20 PHE CD2 C 7.278 2.004 -10.180 1.00 . A A . 20 PHE CD2 1 1 5 2033 1 1 20 PHE CE1 C 8.683 -0.249 -10.920 1.00 . A A . 20 PHE CE1 1 1 5 2034 1 1 20 PHE CE2 C 8.203 2.072 -11.200 1.00 . A A . 20 PHE CE2 1 1 5 2035 1 1 20 PHE CG C 7.049 0.809 -9.521 1.00 . A A . 20 PHE CG 1 1 5 2036 1 1 20 PHE CZ C 8.906 0.946 -11.571 1.00 . A A . 20 PHE CZ 1 1 5 2037 1 1 20 PHE H H 5.241 2.153 -6.357 1.00 . A A . 20 PHE H 1 1 5 2038 1 1 20 PHE HA H 6.860 -0.303 -6.643 1.00 . A A . 20 PHE HA 1 1 5 2039 1 1 20 PHE HB2 H 5.434 -0.164 -8.481 1.00 . A A . 20 PHE HB2 1 1 5 2040 1 1 20 PHE HB3 H 5.349 1.575 -8.443 1.00 . A A . 20 PHE HB3 1 1 5 2041 1 1 20 PHE HD1 H 7.589 -1.256 -9.392 1.00 . A A . 20 PHE HD1 1 1 5 2042 1 1 20 PHE HD2 H 6.731 2.891 -9.896 1.00 . A A . 20 PHE HD2 1 1 5 2043 1 1 20 PHE HE1 H 9.232 -1.132 -11.209 1.00 . A A . 20 PHE HE1 1 1 5 2044 1 1 20 PHE HE2 H 8.376 3.008 -11.711 1.00 . A A . 20 PHE HE2 1 1 5 2045 1 1 20 PHE HZ H 9.630 0.999 -12.371 1.00 . A A . 20 PHE HZ 1 1 5 2046 1 1 20 PHE N N 5.869 1.467 -6.033 1.00 . A A . 20 PHE N 1 1 5 2047 1 1 20 PHE O O 9.120 0.828 -6.865 1.00 . A A . 20 PHE O 1 1 5 2048 1 1 21 ALA C C 9.959 3.338 -5.858 1.00 . A A . 21 ALA C 1 1 5 2049 1 1 21 ALA CA C 9.233 3.563 -7.180 1.00 . A A . 21 ALA CA 1 1 5 2050 1 1 21 ALA CB C 8.833 5.034 -7.333 1.00 . A A . 21 ALA CB 1 1 5 2051 1 1 21 ALA H H 7.136 3.150 -7.256 1.00 . A A . 21 ALA H 1 1 5 2052 1 1 21 ALA HA H 9.854 3.229 -7.993 1.00 . A A . 21 ALA HA 1 1 5 2053 1 1 21 ALA HB1 H 8.233 5.161 -8.222 1.00 . A A . 21 ALA HB1 1 1 5 2054 1 1 21 ALA HB2 H 8.258 5.354 -6.477 1.00 . A A . 21 ALA HB2 1 1 5 2055 1 1 21 ALA HB3 H 9.713 5.655 -7.415 1.00 . A A . 21 ALA HB3 1 1 5 2056 1 1 21 ALA N N 8.006 2.727 -7.156 1.00 . A A . 21 ALA N 1 1 5 2057 1 1 21 ALA O O 11.172 3.353 -5.798 1.00 . A A . 21 ALA O 1 1 5 2058 1 1 22 GLU C C 10.620 1.630 -3.473 1.00 . A A . 22 GLU C 1 1 5 2059 1 1 22 GLU CA C 9.742 2.886 -3.482 1.00 . A A . 22 GLU CA 1 1 5 2060 1 1 22 GLU CB C 8.597 2.721 -2.449 1.00 . A A . 22 GLU CB 1 1 5 2061 1 1 22 GLU CD C 9.649 4.535 -0.983 1.00 . A A . 22 GLU CD 1 1 5 2062 1 1 22 GLU CG C 8.358 4.046 -1.678 1.00 . A A . 22 GLU CG 1 1 5 2063 1 1 22 GLU H H 8.192 3.120 -4.969 1.00 . A A . 22 GLU H 1 1 5 2064 1 1 22 GLU HA H 10.353 3.733 -3.261 1.00 . A A . 22 GLU HA 1 1 5 2065 1 1 22 GLU HB2 H 7.690 2.433 -2.953 1.00 . A A . 22 GLU HB2 1 1 5 2066 1 1 22 GLU HB3 H 8.842 1.944 -1.738 1.00 . A A . 22 GLU HB3 1 1 5 2067 1 1 22 GLU HG2 H 8.011 4.810 -2.359 1.00 . A A . 22 GLU HG2 1 1 5 2068 1 1 22 GLU HG3 H 7.601 3.892 -0.924 1.00 . A A . 22 GLU HG3 1 1 5 2069 1 1 22 GLU N N 9.166 3.123 -4.836 1.00 . A A . 22 GLU N 1 1 5 2070 1 1 22 GLU O O 11.671 1.610 -2.862 1.00 . A A . 22 GLU O 1 1 5 2071 1 1 22 GLU OE1 O 10.220 3.744 -0.248 1.00 . A A . 22 GLU OE1 1 1 5 2072 1 1 22 GLU OE2 O 9.993 5.678 -1.229 1.00 . A A . 22 GLU OE2 1 1 5 2073 1 1 23 ASP C C 12.140 -0.475 -5.107 1.00 . A A . 23 ASP C 1 1 5 2074 1 1 23 ASP CA C 10.875 -0.675 -4.259 1.00 . A A . 23 ASP CA 1 1 5 2075 1 1 23 ASP CB C 9.886 -1.730 -4.884 1.00 . A A . 23 ASP CB 1 1 5 2076 1 1 23 ASP CG C 10.333 -2.260 -6.266 1.00 . A A . 23 ASP CG 1 1 5 2077 1 1 23 ASP H H 9.292 0.745 -4.629 1.00 . A A . 23 ASP H 1 1 5 2078 1 1 23 ASP HA H 11.164 -0.985 -3.265 1.00 . A A . 23 ASP HA 1 1 5 2079 1 1 23 ASP HB2 H 9.805 -2.570 -4.209 1.00 . A A . 23 ASP HB2 1 1 5 2080 1 1 23 ASP HB3 H 8.902 -1.294 -4.982 1.00 . A A . 23 ASP HB3 1 1 5 2081 1 1 23 ASP N N 10.144 0.626 -4.165 1.00 . A A . 23 ASP N 1 1 5 2082 1 1 23 ASP O O 13.218 -0.883 -4.721 1.00 . A A . 23 ASP O 1 1 5 2083 1 1 23 ASP OD1 O 11.228 -3.091 -6.265 1.00 . A A . 23 ASP OD1 1 1 5 2084 1 1 23 ASP OD2 O 9.760 -1.807 -7.242 1.00 . A A . 23 ASP OD2 1 1 5 2085 1 1 24 VAL C C 14.216 1.153 -6.470 1.00 . A A . 24 VAL C 1 1 5 2086 1 1 24 VAL CA C 13.060 0.434 -7.192 1.00 . A A . 24 VAL CA 1 1 5 2087 1 1 24 VAL CB C 12.489 1.302 -8.345 1.00 . A A . 24 VAL CB 1 1 5 2088 1 1 24 VAL CG1 C 13.623 1.902 -9.215 1.00 . A A . 24 VAL CG1 1 1 5 2089 1 1 24 VAL CG2 C 11.575 0.442 -9.239 1.00 . A A . 24 VAL CG2 1 1 5 2090 1 1 24 VAL H H 11.034 0.428 -6.465 1.00 . A A . 24 VAL H 1 1 5 2091 1 1 24 VAL HA H 13.425 -0.507 -7.580 1.00 . A A . 24 VAL HA 1 1 5 2092 1 1 24 VAL HB H 11.895 2.093 -7.914 1.00 . A A . 24 VAL HB 1 1 5 2093 1 1 24 VAL HG11 H 14.336 1.136 -9.485 1.00 . A A . 24 VAL HG11 1 1 5 2094 1 1 24 VAL HG12 H 13.216 2.332 -10.118 1.00 . A A . 24 VAL HG12 1 1 5 2095 1 1 24 VAL HG13 H 14.138 2.680 -8.670 1.00 . A A . 24 VAL HG13 1 1 5 2096 1 1 24 VAL HG21 H 12.090 -0.450 -9.563 1.00 . A A . 24 VAL HG21 1 1 5 2097 1 1 24 VAL HG22 H 10.688 0.155 -8.696 1.00 . A A . 24 VAL HG22 1 1 5 2098 1 1 24 VAL HG23 H 11.274 1.006 -10.109 1.00 . A A . 24 VAL HG23 1 1 5 2099 1 1 24 VAL N N 11.943 0.149 -6.240 1.00 . A A . 24 VAL N 1 1 5 2100 1 1 24 VAL O O 15.344 0.708 -6.542 1.00 . A A . 24 VAL O 1 1 5 2101 1 1 25 GLY C C 14.461 4.311 -4.478 1.00 . A A . 25 GLY C 1 1 5 2102 1 1 25 GLY CA C 14.967 2.993 -5.070 1.00 . A A . 25 GLY CA 1 1 5 2103 1 1 25 GLY H H 12.978 2.554 -5.776 1.00 . A A . 25 GLY H 1 1 5 2104 1 1 25 GLY HA2 H 15.344 2.376 -4.267 1.00 . A A . 25 GLY HA2 1 1 5 2105 1 1 25 GLY HA3 H 15.776 3.207 -5.756 1.00 . A A . 25 GLY HA3 1 1 5 2106 1 1 25 GLY N N 13.904 2.236 -5.801 1.00 . A A . 25 GLY N 1 1 5 2107 1 1 25 GLY O O 15.183 5.290 -4.492 1.00 . A A . 25 GLY O 1 1 5 2108 1 1 26 SER C C 12.816 6.825 -4.122 1.00 . A A . 26 SER C 1 1 5 2109 1 1 26 SER CA C 12.595 5.501 -3.361 1.00 . A A . 26 SER CA 1 1 5 2110 1 1 26 SER CB C 13.118 5.624 -1.898 1.00 . A A . 26 SER CB 1 1 5 2111 1 1 26 SER H H 12.738 3.456 -4.020 1.00 . A A . 26 SER H 1 1 5 2112 1 1 26 SER HA H 11.533 5.330 -3.332 1.00 . A A . 26 SER HA 1 1 5 2113 1 1 26 SER HB2 H 12.576 6.379 -1.347 1.00 . A A . 26 SER HB2 1 1 5 2114 1 1 26 SER HB3 H 13.055 4.678 -1.380 1.00 . A A . 26 SER HB3 1 1 5 2115 1 1 26 SER HG H 14.575 6.880 -1.605 1.00 . A A . 26 SER HG 1 1 5 2116 1 1 26 SER N N 13.245 4.294 -3.983 1.00 . A A . 26 SER N 1 1 5 2117 1 1 26 SER O O 12.801 7.892 -3.540 1.00 . A A . 26 SER O 1 1 5 2118 1 1 26 SER OG O 14.481 6.011 -2.004 1.00 . A A . 26 SER OG 1 1 5 2119 1 1 27 ASN C C 12.715 7.503 -7.673 1.00 . A A . 27 ASN C 1 1 5 2120 1 1 27 ASN CA C 13.240 7.883 -6.292 1.00 . A A . 27 ASN CA 1 1 5 2121 1 1 27 ASN CB C 14.755 8.192 -6.341 1.00 . A A . 27 ASN CB 1 1 5 2122 1 1 27 ASN CG C 15.169 8.956 -5.079 1.00 . A A . 27 ASN CG 1 1 5 2123 1 1 27 ASN H H 13.001 5.800 -5.805 1.00 . A A . 27 ASN H 1 1 5 2124 1 1 27 ASN HA H 12.678 8.727 -5.927 1.00 . A A . 27 ASN HA 1 1 5 2125 1 1 27 ASN HB2 H 15.327 7.276 -6.396 1.00 . A A . 27 ASN HB2 1 1 5 2126 1 1 27 ASN HB3 H 14.988 8.799 -7.201 1.00 . A A . 27 ASN HB3 1 1 5 2127 1 1 27 ASN HD21 H 15.615 7.310 -4.063 1.00 . A A . 27 ASN HD21 1 1 5 2128 1 1 27 ASN HD22 H 15.845 8.765 -3.222 1.00 . A A . 27 ASN HD22 1 1 5 2129 1 1 27 ASN N N 13.010 6.698 -5.410 1.00 . A A . 27 ASN N 1 1 5 2130 1 1 27 ASN ND2 N 15.576 8.288 -4.035 1.00 . A A . 27 ASN ND2 1 1 5 2131 1 1 27 ASN O O 11.708 8.009 -8.129 1.00 . A A . 27 ASN O 1 1 5 2132 1 1 27 ASN OD1 O 15.124 10.170 -5.032 1.00 . A A . 27 ASN OD1 1 1 5 2133 1 1 28 LYS C C 12.048 4.962 -9.501 1.00 . A A . 28 LYS C 1 1 5 2134 1 1 28 LYS CA C 13.075 6.104 -9.648 1.00 . A A . 28 LYS CA 1 1 5 2135 1 1 28 LYS CB C 14.359 5.595 -10.344 1.00 . A A . 28 LYS CB 1 1 5 2136 1 1 28 LYS CD C 15.634 7.811 -10.207 1.00 . A A . 28 LYS CD 1 1 5 2137 1 1 28 LYS CE C 14.773 9.090 -10.235 1.00 . A A . 28 LYS CE 1 1 5 2138 1 1 28 LYS CG C 15.024 6.738 -11.153 1.00 . A A . 28 LYS CG 1 1 5 2139 1 1 28 LYS H H 14.233 6.261 -7.834 1.00 . A A . 28 LYS H 1 1 5 2140 1 1 28 LYS HA H 12.623 6.906 -10.215 1.00 . A A . 28 LYS HA 1 1 5 2141 1 1 28 LYS HB2 H 15.052 5.212 -9.609 1.00 . A A . 28 LYS HB2 1 1 5 2142 1 1 28 LYS HB3 H 14.114 4.792 -11.024 1.00 . A A . 28 LYS HB3 1 1 5 2143 1 1 28 LYS HD2 H 15.703 7.439 -9.194 1.00 . A A . 28 LYS HD2 1 1 5 2144 1 1 28 LYS HD3 H 16.631 8.053 -10.544 1.00 . A A . 28 LYS HD3 1 1 5 2145 1 1 28 LYS HE2 H 14.751 9.504 -11.231 1.00 . A A . 28 LYS HE2 1 1 5 2146 1 1 28 LYS HE3 H 13.761 8.877 -9.923 1.00 . A A . 28 LYS HE3 1 1 5 2147 1 1 28 LYS HG2 H 15.814 6.317 -11.757 1.00 . A A . 28 LYS HG2 1 1 5 2148 1 1 28 LYS HG3 H 14.298 7.181 -11.819 1.00 . A A . 28 LYS HG3 1 1 5 2149 1 1 28 LYS HZ1 H 16.197 9.731 -8.853 1.00 . A A . 28 LYS HZ1 1 1 5 2150 1 1 28 LYS HZ2 H 15.591 10.966 -9.850 1.00 . A A . 28 LYS HZ2 1 1 5 2151 1 1 28 LYS HZ3 H 14.640 10.352 -8.583 1.00 . A A . 28 LYS HZ3 1 1 5 2152 1 1 28 LYS N N 13.437 6.606 -8.286 1.00 . A A . 28 LYS N 1 1 5 2153 1 1 28 LYS NZ N 15.344 10.111 -9.311 1.00 . A A . 28 LYS NZ 1 1 5 2154 1 1 28 LYS O O 11.408 4.663 -10.496 1.00 . A A . 28 LYS O 1 1 5 2155 1 1 28 LYS OXT O 11.961 4.449 -8.398 1.00 . A A . 28 LYS OXT 1 1 6 2156 1 1 1 ASP C C -20.054 4.574 -2.545 1.00 . A A . 1 ASP C 1 1 6 2157 1 1 1 ASP CA C -19.422 5.686 -3.389 1.00 . A A . 1 ASP CA 1 1 6 2158 1 1 1 ASP CB C -17.889 5.528 -3.337 1.00 . A A . 1 ASP CB 1 1 6 2159 1 1 1 ASP CG C -17.489 4.207 -4.016 1.00 . A A . 1 ASP CG 1 1 6 2160 1 1 1 ASP H1 H -20.446 6.904 -2.043 1.00 . A A . 1 ASP H1 1 1 6 2161 1 1 1 ASP H2 H -18.980 7.559 -2.589 1.00 . A A . 1 ASP H2 1 1 6 2162 1 1 1 ASP H3 H -20.334 7.543 -3.612 1.00 . A A . 1 ASP H3 1 1 6 2163 1 1 1 ASP HA H -19.773 5.595 -4.408 1.00 . A A . 1 ASP HA 1 1 6 2164 1 1 1 ASP HB2 H -17.415 6.350 -3.855 1.00 . A A . 1 ASP HB2 1 1 6 2165 1 1 1 ASP HB3 H -17.544 5.524 -2.314 1.00 . A A . 1 ASP HB3 1 1 6 2166 1 1 1 ASP N N -19.825 7.023 -2.869 1.00 . A A . 1 ASP N 1 1 6 2167 1 1 1 ASP O O -20.335 4.769 -1.377 1.00 . A A . 1 ASP O 1 1 6 2168 1 1 1 ASP OD1 O -17.380 4.258 -5.228 1.00 . A A . 1 ASP OD1 1 1 6 2169 1 1 1 ASP OD2 O -17.316 3.230 -3.306 1.00 . A A . 1 ASP OD2 1 1 6 2170 1 1 2 ALA C C -19.800 1.748 -1.481 1.00 . A A . 2 ALA C 1 1 6 2171 1 1 2 ALA CA C -20.861 2.282 -2.453 1.00 . A A . 2 ALA CA 1 1 6 2172 1 1 2 ALA CB C -21.269 1.216 -3.493 1.00 . A A . 2 ALA CB 1 1 6 2173 1 1 2 ALA H H -20.001 3.353 -4.114 1.00 . A A . 2 ALA H 1 1 6 2174 1 1 2 ALA HA H -21.722 2.614 -1.892 1.00 . A A . 2 ALA HA 1 1 6 2175 1 1 2 ALA HB1 H -21.659 1.700 -4.377 1.00 . A A . 2 ALA HB1 1 1 6 2176 1 1 2 ALA HB2 H -20.435 0.594 -3.777 1.00 . A A . 2 ALA HB2 1 1 6 2177 1 1 2 ALA HB3 H -22.046 0.588 -3.084 1.00 . A A . 2 ALA HB3 1 1 6 2178 1 1 2 ALA N N -20.254 3.441 -3.171 1.00 . A A . 2 ALA N 1 1 6 2179 1 1 2 ALA O O -19.924 1.958 -0.290 1.00 . A A . 2 ALA O 1 1 6 2180 1 1 3 GLU C C -16.535 -0.046 -1.894 1.00 . A A . 3 GLU C 1 1 6 2181 1 1 3 GLU CA C -17.716 0.536 -1.122 1.00 . A A . 3 GLU CA 1 1 6 2182 1 1 3 GLU CB C -18.322 -0.560 -0.188 1.00 . A A . 3 GLU CB 1 1 6 2183 1 1 3 GLU CD C -20.494 -1.765 -0.642 1.00 . A A . 3 GLU CD 1 1 6 2184 1 1 3 GLU CG C -19.004 -1.681 -1.021 1.00 . A A . 3 GLU CG 1 1 6 2185 1 1 3 GLU H H -18.746 0.950 -2.972 1.00 . A A . 3 GLU H 1 1 6 2186 1 1 3 GLU HA H -17.316 1.362 -0.569 1.00 . A A . 3 GLU HA 1 1 6 2187 1 1 3 GLU HB2 H -17.537 -0.995 0.414 1.00 . A A . 3 GLU HB2 1 1 6 2188 1 1 3 GLU HB3 H -19.033 -0.107 0.488 1.00 . A A . 3 GLU HB3 1 1 6 2189 1 1 3 GLU HG2 H -18.923 -1.491 -2.082 1.00 . A A . 3 GLU HG2 1 1 6 2190 1 1 3 GLU HG3 H -18.531 -2.629 -0.810 1.00 . A A . 3 GLU HG3 1 1 6 2191 1 1 3 GLU N N -18.794 1.085 -2.002 1.00 . A A . 3 GLU N 1 1 6 2192 1 1 3 GLU O O -15.781 -0.847 -1.373 1.00 . A A . 3 GLU O 1 1 6 2193 1 1 3 GLU OE1 O -21.240 -0.978 -1.201 1.00 . A A . 3 GLU OE1 1 1 6 2194 1 1 3 GLU OE2 O -20.800 -2.608 0.185 1.00 . A A . 3 GLU OE2 1 1 6 2195 1 1 4 PHE C C -14.228 0.979 -4.096 1.00 . A A . 4 PHE C 1 1 6 2196 1 1 4 PHE CA C -15.289 -0.110 -3.977 1.00 . A A . 4 PHE CA 1 1 6 2197 1 1 4 PHE CB C -15.828 -0.494 -5.382 1.00 . A A . 4 PHE CB 1 1 6 2198 1 1 4 PHE CD1 C -18.079 0.669 -5.628 1.00 . A A . 4 PHE CD1 1 1 6 2199 1 1 4 PHE CD2 C -16.271 1.417 -6.990 1.00 . A A . 4 PHE CD2 1 1 6 2200 1 1 4 PHE CE1 C -18.906 1.606 -6.213 1.00 . A A . 4 PHE CE1 1 1 6 2201 1 1 4 PHE CE2 C -17.098 2.353 -7.575 1.00 . A A . 4 PHE CE2 1 1 6 2202 1 1 4 PHE CG C -16.753 0.566 -6.012 1.00 . A A . 4 PHE CG 1 1 6 2203 1 1 4 PHE CZ C -18.416 2.448 -7.187 1.00 . A A . 4 PHE CZ 1 1 6 2204 1 1 4 PHE H H -17.052 1.035 -3.459 1.00 . A A . 4 PHE H 1 1 6 2205 1 1 4 PHE HA H -14.838 -0.985 -3.527 1.00 . A A . 4 PHE HA 1 1 6 2206 1 1 4 PHE HB2 H -14.995 -0.665 -6.049 1.00 . A A . 4 PHE HB2 1 1 6 2207 1 1 4 PHE HB3 H -16.380 -1.419 -5.302 1.00 . A A . 4 PHE HB3 1 1 6 2208 1 1 4 PHE HD1 H -18.471 0.014 -4.864 1.00 . A A . 4 PHE HD1 1 1 6 2209 1 1 4 PHE HD2 H -15.239 1.352 -7.300 1.00 . A A . 4 PHE HD2 1 1 6 2210 1 1 4 PHE HE1 H -19.938 1.680 -5.909 1.00 . A A . 4 PHE HE1 1 1 6 2211 1 1 4 PHE HE2 H -16.711 3.012 -8.337 1.00 . A A . 4 PHE HE2 1 1 6 2212 1 1 4 PHE HZ H -19.066 3.179 -7.645 1.00 . A A . 4 PHE HZ 1 1 6 2213 1 1 4 PHE N N -16.406 0.383 -3.119 1.00 . A A . 4 PHE N 1 1 6 2214 1 1 4 PHE O O -13.055 0.701 -3.967 1.00 . A A . 4 PHE O 1 1 6 2215 1 1 5 ARG C C -12.959 3.667 -3.119 1.00 . A A . 5 ARG C 1 1 6 2216 1 1 5 ARG CA C -13.650 3.315 -4.447 1.00 . A A . 5 ARG CA 1 1 6 2217 1 1 5 ARG CB C -14.385 4.523 -4.998 1.00 . A A . 5 ARG CB 1 1 6 2218 1 1 5 ARG CD C -13.784 6.375 -6.672 1.00 . A A . 5 ARG CD 1 1 6 2219 1 1 5 ARG CG C -13.384 5.637 -5.367 1.00 . A A . 5 ARG CG 1 1 6 2220 1 1 5 ARG CZ C -16.164 6.981 -6.466 1.00 . A A . 5 ARG CZ 1 1 6 2221 1 1 5 ARG H H -15.609 2.376 -4.392 1.00 . A A . 5 ARG H 1 1 6 2222 1 1 5 ARG HA H -12.891 2.988 -5.129 1.00 . A A . 5 ARG HA 1 1 6 2223 1 1 5 ARG HB2 H -14.938 4.193 -5.863 1.00 . A A . 5 ARG HB2 1 1 6 2224 1 1 5 ARG HB3 H -15.071 4.898 -4.254 1.00 . A A . 5 ARG HB3 1 1 6 2225 1 1 5 ARG HD2 H -13.563 7.430 -6.600 1.00 . A A . 5 ARG HD2 1 1 6 2226 1 1 5 ARG HD3 H -13.226 5.967 -7.503 1.00 . A A . 5 ARG HD3 1 1 6 2227 1 1 5 ARG HE H -15.514 5.415 -7.499 1.00 . A A . 5 ARG HE 1 1 6 2228 1 1 5 ARG HG2 H -13.342 6.330 -4.539 1.00 . A A . 5 ARG HG2 1 1 6 2229 1 1 5 ARG HG3 H -12.404 5.198 -5.490 1.00 . A A . 5 ARG HG3 1 1 6 2230 1 1 5 ARG HH11 H -14.877 8.187 -5.508 1.00 . A A . 5 ARG HH11 1 1 6 2231 1 1 5 ARG HH12 H -16.549 8.609 -5.369 1.00 . A A . 5 ARG HH12 1 1 6 2232 1 1 5 ARG HH21 H -17.637 5.931 -7.321 1.00 . A A . 5 ARG HH21 1 1 6 2233 1 1 5 ARG HH22 H -18.136 7.318 -6.410 1.00 . A A . 5 ARG HH22 1 1 6 2234 1 1 5 ARG N N -14.647 2.199 -4.317 1.00 . A A . 5 ARG N 1 1 6 2235 1 1 5 ARG NE N -15.245 6.178 -6.944 1.00 . A A . 5 ARG NE 1 1 6 2236 1 1 5 ARG NH1 N -15.836 8.005 -5.723 1.00 . A A . 5 ARG NH1 1 1 6 2237 1 1 5 ARG NH2 N -17.409 6.723 -6.755 1.00 . A A . 5 ARG NH2 1 1 6 2238 1 1 5 ARG O O -12.156 4.573 -3.014 1.00 . A A . 5 ARG O 1 1 6 2239 1 1 6 HIS C C -11.386 2.453 -0.696 1.00 . A A . 6 HIS C 1 1 6 2240 1 1 6 HIS CA C -12.807 3.022 -0.764 1.00 . A A . 6 HIS CA 1 1 6 2241 1 1 6 HIS CB C -13.748 2.247 0.183 1.00 . A A . 6 HIS CB 1 1 6 2242 1 1 6 HIS CD2 C -15.803 3.721 -0.686 1.00 . A A . 6 HIS CD2 1 1 6 2243 1 1 6 HIS CE1 C -17.081 3.401 0.913 1.00 . A A . 6 HIS CE1 1 1 6 2244 1 1 6 HIS CG C -15.146 2.892 0.213 1.00 . A A . 6 HIS CG 1 1 6 2245 1 1 6 HIS H H -13.969 2.207 -2.373 1.00 . A A . 6 HIS H 1 1 6 2246 1 1 6 HIS HA H -12.789 4.066 -0.501 1.00 . A A . 6 HIS HA 1 1 6 2247 1 1 6 HIS HB2 H -13.849 1.225 -0.151 1.00 . A A . 6 HIS HB2 1 1 6 2248 1 1 6 HIS HB3 H -13.348 2.247 1.187 1.00 . A A . 6 HIS HB3 1 1 6 2249 1 1 6 HIS HD1 H -15.848 2.203 1.979 1.00 . A A . 6 HIS HD1 1 1 6 2250 1 1 6 HIS HD2 H -15.396 4.072 -1.622 1.00 . A A . 6 HIS HD2 1 1 6 2251 1 1 6 HIS HE1 H -17.945 3.433 1.562 1.00 . A A . 6 HIS HE1 1 1 6 2252 1 1 6 HIS N N -13.324 2.893 -2.148 1.00 . A A . 6 HIS N 1 1 6 2253 1 1 6 HIS ND1 N -15.999 2.740 1.174 1.00 . A A . 6 HIS ND1 1 1 6 2254 1 1 6 HIS NE2 N -17.003 4.026 -0.235 1.00 . A A . 6 HIS NE2 1 1 6 2255 1 1 6 HIS O O -10.507 3.074 -0.130 1.00 . A A . 6 HIS O 1 1 6 2256 1 1 7 ASP C C -9.885 -0.688 -2.109 1.00 . A A . 7 ASP C 1 1 6 2257 1 1 7 ASP CA C -9.870 0.616 -1.290 1.00 . A A . 7 ASP CA 1 1 6 2258 1 1 7 ASP CB C -9.455 0.307 0.173 1.00 . A A . 7 ASP CB 1 1 6 2259 1 1 7 ASP CG C -10.586 -0.472 0.875 1.00 . A A . 7 ASP CG 1 1 6 2260 1 1 7 ASP H H -11.966 0.853 -1.724 1.00 . A A . 7 ASP H 1 1 6 2261 1 1 7 ASP HA H -9.174 1.285 -1.765 1.00 . A A . 7 ASP HA 1 1 6 2262 1 1 7 ASP HB2 H -8.553 -0.287 0.185 1.00 . A A . 7 ASP HB2 1 1 6 2263 1 1 7 ASP HB3 H -9.265 1.223 0.713 1.00 . A A . 7 ASP HB3 1 1 6 2264 1 1 7 ASP N N -11.211 1.290 -1.281 1.00 . A A . 7 ASP N 1 1 6 2265 1 1 7 ASP O O -9.096 -1.585 -1.879 1.00 . A A . 7 ASP O 1 1 6 2266 1 1 7 ASP OD1 O -10.549 -1.688 0.783 1.00 . A A . 7 ASP OD1 1 1 6 2267 1 1 7 ASP OD2 O -11.425 0.194 1.461 1.00 . A A . 7 ASP OD2 1 1 6 2268 1 1 8 SER C C -11.732 -1.536 -5.188 1.00 . A A . 8 SER C 1 1 6 2269 1 1 8 SER CA C -10.936 -1.944 -3.931 1.00 . A A . 8 SER CA 1 1 6 2270 1 1 8 SER CB C -11.675 -3.043 -3.133 1.00 . A A . 8 SER CB 1 1 6 2271 1 1 8 SER H H -11.386 0.013 -3.182 1.00 . A A . 8 SER H 1 1 6 2272 1 1 8 SER HA H -9.955 -2.283 -4.238 1.00 . A A . 8 SER HA 1 1 6 2273 1 1 8 SER HB2 H -11.236 -3.191 -2.157 1.00 . A A . 8 SER HB2 1 1 6 2274 1 1 8 SER HB3 H -12.730 -2.830 -3.035 1.00 . A A . 8 SER HB3 1 1 6 2275 1 1 8 SER HG H -12.357 -4.523 -4.195 1.00 . A A . 8 SER HG 1 1 6 2276 1 1 8 SER N N -10.788 -0.745 -3.047 1.00 . A A . 8 SER N 1 1 6 2277 1 1 8 SER O O -12.645 -2.218 -5.615 1.00 . A A . 8 SER O 1 1 6 2278 1 1 8 SER OG O -11.492 -4.219 -3.910 1.00 . A A . 8 SER OG 1 1 6 2279 1 1 9 GLY C C -10.960 0.829 -7.834 1.00 . A A . 9 GLY C 1 1 6 2280 1 1 9 GLY CA C -12.007 0.135 -6.963 1.00 . A A . 9 GLY CA 1 1 6 2281 1 1 9 GLY H H -10.600 0.083 -5.336 1.00 . A A . 9 GLY H 1 1 6 2282 1 1 9 GLY HA2 H -12.467 -0.665 -7.526 1.00 . A A . 9 GLY HA2 1 1 6 2283 1 1 9 GLY HA3 H -12.759 0.854 -6.672 1.00 . A A . 9 GLY HA3 1 1 6 2284 1 1 9 GLY N N -11.344 -0.413 -5.737 1.00 . A A . 9 GLY N 1 1 6 2285 1 1 9 GLY O O -10.966 0.694 -9.043 1.00 . A A . 9 GLY O 1 1 6 2286 1 1 10 TYR C C -7.817 2.479 -6.915 1.00 . A A . 10 TYR C 1 1 6 2287 1 1 10 TYR CA C -9.003 2.294 -7.877 1.00 . A A . 10 TYR CA 1 1 6 2288 1 1 10 TYR CB C -9.590 3.661 -8.365 1.00 . A A . 10 TYR CB 1 1 6 2289 1 1 10 TYR CD1 C -9.837 4.577 -5.989 1.00 . A A . 10 TYR CD1 1 1 6 2290 1 1 10 TYR CD2 C -9.023 6.032 -7.690 1.00 . A A . 10 TYR CD2 1 1 6 2291 1 1 10 TYR CE1 C -9.728 5.596 -5.069 1.00 . A A . 10 TYR CE1 1 1 6 2292 1 1 10 TYR CE2 C -8.917 7.050 -6.768 1.00 . A A . 10 TYR CE2 1 1 6 2293 1 1 10 TYR CG C -9.484 4.785 -7.312 1.00 . A A . 10 TYR CG 1 1 6 2294 1 1 10 TYR CZ C -9.267 6.839 -5.452 1.00 . A A . 10 TYR CZ 1 1 6 2295 1 1 10 TYR H H -10.149 1.617 -6.206 1.00 . A A . 10 TYR H 1 1 6 2296 1 1 10 TYR HA H -8.673 1.700 -8.711 1.00 . A A . 10 TYR HA 1 1 6 2297 1 1 10 TYR HB2 H -9.057 3.968 -9.254 1.00 . A A . 10 TYR HB2 1 1 6 2298 1 1 10 TYR HB3 H -10.632 3.539 -8.624 1.00 . A A . 10 TYR HB3 1 1 6 2299 1 1 10 TYR HD1 H -10.200 3.612 -5.669 1.00 . A A . 10 TYR HD1 1 1 6 2300 1 1 10 TYR HD2 H -8.743 6.214 -8.717 1.00 . A A . 10 TYR HD2 1 1 6 2301 1 1 10 TYR HE1 H -10.004 5.421 -4.041 1.00 . A A . 10 TYR HE1 1 1 6 2302 1 1 10 TYR HE2 H -8.556 8.018 -7.080 1.00 . A A . 10 TYR HE2 1 1 6 2303 1 1 10 TYR HH H -8.678 7.521 -3.770 1.00 . A A . 10 TYR HH 1 1 6 2304 1 1 10 TYR N N -10.090 1.555 -7.179 1.00 . A A . 10 TYR N 1 1 6 2305 1 1 10 TYR O O -7.767 1.843 -5.879 1.00 . A A . 10 TYR O 1 1 6 2306 1 1 10 TYR OH O -9.159 7.859 -4.529 1.00 . A A . 10 TYR OH 1 1 6 2307 1 1 11 GLU C C -5.063 4.937 -6.721 1.00 . A A . 11 GLU C 1 1 6 2308 1 1 11 GLU CA C -5.704 3.594 -6.422 1.00 . A A . 11 GLU CA 1 1 6 2309 1 1 11 GLU CB C -4.692 2.449 -6.657 1.00 . A A . 11 GLU CB 1 1 6 2310 1 1 11 GLU CD C -5.081 1.393 -8.928 1.00 . A A . 11 GLU CD 1 1 6 2311 1 1 11 GLU CG C -4.257 2.437 -8.156 1.00 . A A . 11 GLU CG 1 1 6 2312 1 1 11 GLU H H -7.000 3.820 -8.130 1.00 . A A . 11 GLU H 1 1 6 2313 1 1 11 GLU HA H -6.015 3.660 -5.395 1.00 . A A . 11 GLU HA 1 1 6 2314 1 1 11 GLU HB2 H -3.831 2.593 -6.023 1.00 . A A . 11 GLU HB2 1 1 6 2315 1 1 11 GLU HB3 H -5.145 1.505 -6.391 1.00 . A A . 11 GLU HB3 1 1 6 2316 1 1 11 GLU HG2 H -4.404 3.403 -8.614 1.00 . A A . 11 GLU HG2 1 1 6 2317 1 1 11 GLU HG3 H -3.210 2.197 -8.240 1.00 . A A . 11 GLU HG3 1 1 6 2318 1 1 11 GLU N N -6.901 3.339 -7.282 1.00 . A A . 11 GLU N 1 1 6 2319 1 1 11 GLU O O -3.902 5.141 -6.415 1.00 . A A . 11 GLU O 1 1 6 2320 1 1 11 GLU OE1 O -4.703 0.235 -8.855 1.00 . A A . 11 GLU OE1 1 1 6 2321 1 1 11 GLU OE2 O -6.046 1.811 -9.546 1.00 . A A . 11 GLU OE2 1 1 6 2322 1 1 12 VAL C C -4.498 7.182 -8.909 1.00 . A A . 12 VAL C 1 1 6 2323 1 1 12 VAL CA C -5.447 7.184 -7.703 1.00 . A A . 12 VAL CA 1 1 6 2324 1 1 12 VAL CB C -4.734 7.878 -6.520 1.00 . A A . 12 VAL CB 1 1 6 2325 1 1 12 VAL CG1 C -4.463 9.370 -6.830 1.00 . A A . 12 VAL CG1 1 1 6 2326 1 1 12 VAL CG2 C -5.584 7.785 -5.251 1.00 . A A . 12 VAL CG2 1 1 6 2327 1 1 12 VAL H H -6.777 5.500 -7.495 1.00 . A A . 12 VAL H 1 1 6 2328 1 1 12 VAL HA H -6.335 7.736 -7.975 1.00 . A A . 12 VAL HA 1 1 6 2329 1 1 12 VAL HB H -3.816 7.340 -6.364 1.00 . A A . 12 VAL HB 1 1 6 2330 1 1 12 VAL HG11 H -3.860 9.470 -7.717 1.00 . A A . 12 VAL HG11 1 1 6 2331 1 1 12 VAL HG12 H -5.394 9.897 -6.983 1.00 . A A . 12 VAL HG12 1 1 6 2332 1 1 12 VAL HG13 H -3.936 9.830 -6.008 1.00 . A A . 12 VAL HG13 1 1 6 2333 1 1 12 VAL HG21 H -6.625 7.928 -5.493 1.00 . A A . 12 VAL HG21 1 1 6 2334 1 1 12 VAL HG22 H -5.448 6.816 -4.797 1.00 . A A . 12 VAL HG22 1 1 6 2335 1 1 12 VAL HG23 H -5.279 8.545 -4.547 1.00 . A A . 12 VAL HG23 1 1 6 2336 1 1 12 VAL N N -5.862 5.794 -7.310 1.00 . A A . 12 VAL N 1 1 6 2337 1 1 12 VAL O O -4.560 8.082 -9.722 1.00 . A A . 12 VAL O 1 1 6 2338 1 1 13 HIS C C -1.510 6.954 -9.787 1.00 . A A . 13 HIS C 1 1 6 2339 1 1 13 HIS CA C -2.654 5.960 -10.045 1.00 . A A . 13 HIS CA 1 1 6 2340 1 1 13 HIS CB C -3.313 6.189 -11.447 1.00 . A A . 13 HIS CB 1 1 6 2341 1 1 13 HIS CD2 C -5.530 4.853 -10.738 1.00 . A A . 13 HIS CD2 1 1 6 2342 1 1 13 HIS CE1 C -5.910 3.956 -12.567 1.00 . A A . 13 HIS CE1 1 1 6 2343 1 1 13 HIS CG C -4.533 5.260 -11.621 1.00 . A A . 13 HIS CG 1 1 6 2344 1 1 13 HIS H H -3.704 5.490 -8.273 1.00 . A A . 13 HIS H 1 1 6 2345 1 1 13 HIS HA H -2.265 4.955 -9.967 1.00 . A A . 13 HIS HA 1 1 6 2346 1 1 13 HIS HB2 H -3.621 7.212 -11.597 1.00 . A A . 13 HIS HB2 1 1 6 2347 1 1 13 HIS HB3 H -2.594 5.942 -12.214 1.00 . A A . 13 HIS HB3 1 1 6 2348 1 1 13 HIS HD1 H -4.331 4.738 -13.562 1.00 . A A . 13 HIS HD1 1 1 6 2349 1 1 13 HIS HD2 H -5.611 5.148 -9.700 1.00 . A A . 13 HIS HD2 1 1 6 2350 1 1 13 HIS HE1 H -6.366 3.365 -13.347 1.00 . A A . 13 HIS HE1 1 1 6 2351 1 1 13 HIS N N -3.667 6.168 -8.971 1.00 . A A . 13 HIS N 1 1 6 2352 1 1 13 HIS ND1 N -4.837 4.664 -12.726 1.00 . A A . 13 HIS ND1 1 1 6 2353 1 1 13 HIS NE2 N -6.374 4.043 -11.346 1.00 . A A . 13 HIS NE2 1 1 6 2354 1 1 13 HIS O O -0.932 7.525 -10.691 1.00 . A A . 13 HIS O 1 1 6 2355 1 1 14 HIS C C 0.559 7.270 -6.888 1.00 . A A . 14 HIS C 1 1 6 2356 1 1 14 HIS CA C -0.175 8.012 -8.007 1.00 . A A . 14 HIS CA 1 1 6 2357 1 1 14 HIS CB C -0.787 9.313 -7.441 1.00 . A A . 14 HIS CB 1 1 6 2358 1 1 14 HIS CD2 C -2.015 10.206 -9.568 1.00 . A A . 14 HIS CD2 1 1 6 2359 1 1 14 HIS CE1 C -0.928 11.939 -9.882 1.00 . A A . 14 HIS CE1 1 1 6 2360 1 1 14 HIS CG C -1.062 10.281 -8.584 1.00 . A A . 14 HIS CG 1 1 6 2361 1 1 14 HIS H H -1.765 6.605 -7.856 1.00 . A A . 14 HIS H 1 1 6 2362 1 1 14 HIS HA H 0.496 8.225 -8.811 1.00 . A A . 14 HIS HA 1 1 6 2363 1 1 14 HIS HB2 H -1.716 9.105 -6.931 1.00 . A A . 14 HIS HB2 1 1 6 2364 1 1 14 HIS HB3 H -0.104 9.787 -6.750 1.00 . A A . 14 HIS HB3 1 1 6 2365 1 1 14 HIS HD1 H 0.331 11.722 -8.309 1.00 . A A . 14 HIS HD1 1 1 6 2366 1 1 14 HIS HD2 H -2.722 9.397 -9.641 1.00 . A A . 14 HIS HD2 1 1 6 2367 1 1 14 HIS HE1 H -0.572 12.869 -10.301 1.00 . A A . 14 HIS HE1 1 1 6 2368 1 1 14 HIS N N -1.243 7.106 -8.510 1.00 . A A . 14 HIS N 1 1 6 2369 1 1 14 HIS ND1 N -0.422 11.374 -8.833 1.00 . A A . 14 HIS ND1 1 1 6 2370 1 1 14 HIS NE2 N -1.926 11.245 -10.374 1.00 . A A . 14 HIS NE2 1 1 6 2371 1 1 14 HIS O O 1.622 6.721 -7.095 1.00 . A A . 14 HIS O 1 1 6 2372 1 1 15 GLN C C 0.900 5.157 -4.817 1.00 . A A . 15 GLN C 1 1 6 2373 1 1 15 GLN CA C 0.523 6.600 -4.520 1.00 . A A . 15 GLN CA 1 1 6 2374 1 1 15 GLN CB C -0.517 6.647 -3.380 1.00 . A A . 15 GLN CB 1 1 6 2375 1 1 15 GLN CD C -1.729 8.818 -3.789 1.00 . A A . 15 GLN CD 1 1 6 2376 1 1 15 GLN CG C -0.716 8.099 -2.892 1.00 . A A . 15 GLN CG 1 1 6 2377 1 1 15 GLN H H -0.909 7.738 -5.663 1.00 . A A . 15 GLN H 1 1 6 2378 1 1 15 GLN HA H 1.428 7.101 -4.234 1.00 . A A . 15 GLN HA 1 1 6 2379 1 1 15 GLN HB2 H -1.456 6.236 -3.722 1.00 . A A . 15 GLN HB2 1 1 6 2380 1 1 15 GLN HB3 H -0.168 6.054 -2.550 1.00 . A A . 15 GLN HB3 1 1 6 2381 1 1 15 GLN HE21 H -0.427 10.194 -4.373 1.00 . A A . 15 GLN HE21 1 1 6 2382 1 1 15 GLN HE22 H -1.985 10.341 -5.032 1.00 . A A . 15 GLN HE22 1 1 6 2383 1 1 15 GLN HG2 H -1.095 8.097 -1.880 1.00 . A A . 15 GLN HG2 1 1 6 2384 1 1 15 GLN HG3 H 0.217 8.642 -2.910 1.00 . A A . 15 GLN HG3 1 1 6 2385 1 1 15 GLN N N -0.050 7.275 -5.728 1.00 . A A . 15 GLN N 1 1 6 2386 1 1 15 GLN NE2 N -1.348 9.873 -4.454 1.00 . A A . 15 GLN NE2 1 1 6 2387 1 1 15 GLN O O 1.988 4.730 -4.485 1.00 . A A . 15 GLN O 1 1 6 2388 1 1 15 GLN OE1 O -2.874 8.427 -3.896 1.00 . A A . 15 GLN OE1 1 1 6 2389 1 1 16 GLU C C 1.651 2.878 -6.467 1.00 . A A . 16 GLU C 1 1 6 2390 1 1 16 GLU CA C 0.287 3.018 -5.773 1.00 . A A . 16 GLU CA 1 1 6 2391 1 1 16 GLU CB C -0.802 2.471 -6.702 1.00 . A A . 16 GLU CB 1 1 6 2392 1 1 16 GLU CD C -1.748 0.274 -7.529 1.00 . A A . 16 GLU CD 1 1 6 2393 1 1 16 GLU CG C -0.515 0.968 -6.929 1.00 . A A . 16 GLU CG 1 1 6 2394 1 1 16 GLU H H -0.863 4.852 -5.676 1.00 . A A . 16 GLU H 1 1 6 2395 1 1 16 GLU HA H 0.292 2.445 -4.864 1.00 . A A . 16 GLU HA 1 1 6 2396 1 1 16 GLU HB2 H -1.763 2.600 -6.231 1.00 . A A . 16 GLU HB2 1 1 6 2397 1 1 16 GLU HB3 H -0.798 3.001 -7.643 1.00 . A A . 16 GLU HB3 1 1 6 2398 1 1 16 GLU HG2 H 0.324 0.861 -7.603 1.00 . A A . 16 GLU HG2 1 1 6 2399 1 1 16 GLU HG3 H -0.258 0.495 -5.991 1.00 . A A . 16 GLU HG3 1 1 6 2400 1 1 16 GLU N N -0.003 4.446 -5.439 1.00 . A A . 16 GLU N 1 1 6 2401 1 1 16 GLU O O 2.357 1.906 -6.272 1.00 . A A . 16 GLU O 1 1 6 2402 1 1 16 GLU OE1 O -2.622 -0.059 -6.744 1.00 . A A . 16 GLU OE1 1 1 6 2403 1 1 16 GLU OE2 O -1.749 0.116 -8.740 1.00 . A A . 16 GLU OE2 1 1 6 2404 1 1 17 LEU C C 4.404 4.327 -7.124 1.00 . A A . 17 LEU C 1 1 6 2405 1 1 17 LEU CA C 3.263 3.870 -7.993 1.00 . A A . 17 LEU CA 1 1 6 2406 1 1 17 LEU CB C 3.184 4.796 -9.240 1.00 . A A . 17 LEU CB 1 1 6 2407 1 1 17 LEU CD1 C 1.722 5.876 -10.965 1.00 . A A . 17 LEU CD1 1 1 6 2408 1 1 17 LEU CD2 C 1.248 3.504 -10.255 1.00 . A A . 17 LEU CD2 1 1 6 2409 1 1 17 LEU CG C 1.742 4.894 -9.778 1.00 . A A . 17 LEU CG 1 1 6 2410 1 1 17 LEU H H 1.359 4.625 -7.354 1.00 . A A . 17 LEU H 1 1 6 2411 1 1 17 LEU HA H 3.460 2.853 -8.243 1.00 . A A . 17 LEU HA 1 1 6 2412 1 1 17 LEU HB2 H 3.530 5.787 -8.983 1.00 . A A . 17 LEU HB2 1 1 6 2413 1 1 17 LEU HB3 H 3.828 4.403 -10.012 1.00 . A A . 17 LEU HB3 1 1 6 2414 1 1 17 LEU HD11 H 2.519 5.646 -11.658 1.00 . A A . 17 LEU HD11 1 1 6 2415 1 1 17 LEU HD12 H 0.780 5.811 -11.490 1.00 . A A . 17 LEU HD12 1 1 6 2416 1 1 17 LEU HD13 H 1.853 6.887 -10.609 1.00 . A A . 17 LEU HD13 1 1 6 2417 1 1 17 LEU HD21 H 1.933 3.092 -10.984 1.00 . A A . 17 LEU HD21 1 1 6 2418 1 1 17 LEU HD22 H 1.178 2.818 -9.424 1.00 . A A . 17 LEU HD22 1 1 6 2419 1 1 17 LEU HD23 H 0.272 3.590 -10.708 1.00 . A A . 17 LEU HD23 1 1 6 2420 1 1 17 LEU HG H 1.120 5.267 -8.979 1.00 . A A . 17 LEU HG 1 1 6 2421 1 1 17 LEU N N 1.972 3.872 -7.253 1.00 . A A . 17 LEU N 1 1 6 2422 1 1 17 LEU O O 5.530 3.941 -7.327 1.00 . A A . 17 LEU O 1 1 6 2423 1 1 18 VAL C C 5.725 4.407 -4.494 1.00 . A A . 18 VAL C 1 1 6 2424 1 1 18 VAL CA C 5.217 5.616 -5.268 1.00 . A A . 18 VAL CA 1 1 6 2425 1 1 18 VAL CB C 4.671 6.661 -4.319 1.00 . A A . 18 VAL CB 1 1 6 2426 1 1 18 VAL CG1 C 5.823 7.223 -3.469 1.00 . A A . 18 VAL CG1 1 1 6 2427 1 1 18 VAL CG2 C 4.093 7.748 -5.207 1.00 . A A . 18 VAL CG2 1 1 6 2428 1 1 18 VAL H H 3.187 5.444 -6.058 1.00 . A A . 18 VAL H 1 1 6 2429 1 1 18 VAL HA H 6.022 6.014 -5.872 1.00 . A A . 18 VAL HA 1 1 6 2430 1 1 18 VAL HB H 3.904 6.243 -3.683 1.00 . A A . 18 VAL HB 1 1 6 2431 1 1 18 VAL HG11 H 6.653 7.501 -4.102 1.00 . A A . 18 VAL HG11 1 1 6 2432 1 1 18 VAL HG12 H 5.491 8.085 -2.913 1.00 . A A . 18 VAL HG12 1 1 6 2433 1 1 18 VAL HG13 H 6.160 6.470 -2.774 1.00 . A A . 18 VAL HG13 1 1 6 2434 1 1 18 VAL HG21 H 4.748 7.918 -6.051 1.00 . A A . 18 VAL HG21 1 1 6 2435 1 1 18 VAL HG22 H 3.146 7.397 -5.576 1.00 . A A . 18 VAL HG22 1 1 6 2436 1 1 18 VAL HG23 H 3.953 8.658 -4.656 1.00 . A A . 18 VAL HG23 1 1 6 2437 1 1 18 VAL N N 4.114 5.148 -6.164 1.00 . A A . 18 VAL N 1 1 6 2438 1 1 18 VAL O O 6.866 4.354 -4.086 1.00 . A A . 18 VAL O 1 1 6 2439 1 1 19 PHE C C 6.076 1.389 -4.489 1.00 . A A . 19 PHE C 1 1 6 2440 1 1 19 PHE CA C 5.147 2.213 -3.605 1.00 . A A . 19 PHE CA 1 1 6 2441 1 1 19 PHE CB C 3.870 1.402 -3.345 1.00 . A A . 19 PHE CB 1 1 6 2442 1 1 19 PHE CD1 C 2.939 3.439 -2.088 1.00 . A A . 19 PHE CD1 1 1 6 2443 1 1 19 PHE CD2 C 1.440 1.745 -2.834 1.00 . A A . 19 PHE CD2 1 1 6 2444 1 1 19 PHE CE1 C 1.882 4.138 -1.544 1.00 . A A . 19 PHE CE1 1 1 6 2445 1 1 19 PHE CE2 C 0.381 2.443 -2.290 1.00 . A A . 19 PHE CE2 1 1 6 2446 1 1 19 PHE CG C 2.727 2.234 -2.738 1.00 . A A . 19 PHE CG 1 1 6 2447 1 1 19 PHE CZ C 0.601 3.639 -1.645 1.00 . A A . 19 PHE CZ 1 1 6 2448 1 1 19 PHE H H 3.937 3.613 -4.704 1.00 . A A . 19 PHE H 1 1 6 2449 1 1 19 PHE HA H 5.644 2.473 -2.686 1.00 . A A . 19 PHE HA 1 1 6 2450 1 1 19 PHE HB2 H 3.523 0.967 -4.270 1.00 . A A . 19 PHE HB2 1 1 6 2451 1 1 19 PHE HB3 H 4.098 0.597 -2.660 1.00 . A A . 19 PHE HB3 1 1 6 2452 1 1 19 PHE HD1 H 3.938 3.841 -2.014 1.00 . A A . 19 PHE HD1 1 1 6 2453 1 1 19 PHE HD2 H 1.263 0.811 -3.350 1.00 . A A . 19 PHE HD2 1 1 6 2454 1 1 19 PHE HE1 H 2.058 5.077 -1.040 1.00 . A A . 19 PHE HE1 1 1 6 2455 1 1 19 PHE HE2 H -0.622 2.050 -2.371 1.00 . A A . 19 PHE HE2 1 1 6 2456 1 1 19 PHE HZ H -0.228 4.184 -1.219 1.00 . A A . 19 PHE HZ 1 1 6 2457 1 1 19 PHE N N 4.829 3.471 -4.333 1.00 . A A . 19 PHE N 1 1 6 2458 1 1 19 PHE O O 6.869 0.597 -4.018 1.00 . A A . 19 PHE O 1 1 6 2459 1 1 20 PHE C C 8.124 1.590 -6.777 1.00 . A A . 20 PHE C 1 1 6 2460 1 1 20 PHE CA C 6.761 0.908 -6.773 1.00 . A A . 20 PHE CA 1 1 6 2461 1 1 20 PHE CB C 6.069 1.012 -8.150 1.00 . A A . 20 PHE CB 1 1 6 2462 1 1 20 PHE CD1 C 8.073 1.070 -9.705 1.00 . A A . 20 PHE CD1 1 1 6 2463 1 1 20 PHE CD2 C 6.686 -0.867 -9.743 1.00 . A A . 20 PHE CD2 1 1 6 2464 1 1 20 PHE CE1 C 8.886 0.514 -10.665 1.00 . A A . 20 PHE CE1 1 1 6 2465 1 1 20 PHE CE2 C 7.501 -1.426 -10.707 1.00 . A A . 20 PHE CE2 1 1 6 2466 1 1 20 PHE CG C 6.966 0.386 -9.232 1.00 . A A . 20 PHE CG 1 1 6 2467 1 1 20 PHE CZ C 8.601 -0.736 -11.168 1.00 . A A . 20 PHE CZ 1 1 6 2468 1 1 20 PHE H H 5.271 2.306 -6.041 1.00 . A A . 20 PHE H 1 1 6 2469 1 1 20 PHE HA H 6.878 -0.124 -6.473 1.00 . A A . 20 PHE HA 1 1 6 2470 1 1 20 PHE HB2 H 5.121 0.496 -8.110 1.00 . A A . 20 PHE HB2 1 1 6 2471 1 1 20 PHE HB3 H 5.882 2.039 -8.408 1.00 . A A . 20 PHE HB3 1 1 6 2472 1 1 20 PHE HD1 H 8.306 2.051 -9.321 1.00 . A A . 20 PHE HD1 1 1 6 2473 1 1 20 PHE HD2 H 5.824 -1.413 -9.387 1.00 . A A . 20 PHE HD2 1 1 6 2474 1 1 20 PHE HE1 H 9.747 1.061 -11.020 1.00 . A A . 20 PHE HE1 1 1 6 2475 1 1 20 PHE HE2 H 7.276 -2.407 -11.101 1.00 . A A . 20 PHE HE2 1 1 6 2476 1 1 20 PHE HZ H 9.239 -1.175 -11.922 1.00 . A A . 20 PHE HZ 1 1 6 2477 1 1 20 PHE N N 5.931 1.630 -5.765 1.00 . A A . 20 PHE N 1 1 6 2478 1 1 20 PHE O O 9.150 0.950 -6.719 1.00 . A A . 20 PHE O 1 1 6 2479 1 1 21 ALA C C 10.041 3.494 -5.531 1.00 . A A . 21 ALA C 1 1 6 2480 1 1 21 ALA CA C 9.321 3.717 -6.856 1.00 . A A . 21 ALA CA 1 1 6 2481 1 1 21 ALA CB C 8.919 5.183 -7.016 1.00 . A A . 21 ALA CB 1 1 6 2482 1 1 21 ALA H H 7.226 3.332 -6.894 1.00 . A A . 21 ALA H 1 1 6 2483 1 1 21 ALA HA H 9.958 3.378 -7.658 1.00 . A A . 21 ALA HA 1 1 6 2484 1 1 21 ALA HB1 H 8.097 5.264 -7.712 1.00 . A A . 21 ALA HB1 1 1 6 2485 1 1 21 ALA HB2 H 8.598 5.590 -6.066 1.00 . A A . 21 ALA HB2 1 1 6 2486 1 1 21 ALA HB3 H 9.753 5.761 -7.382 1.00 . A A . 21 ALA HB3 1 1 6 2487 1 1 21 ALA N N 8.087 2.891 -6.846 1.00 . A A . 21 ALA N 1 1 6 2488 1 1 21 ALA O O 11.245 3.631 -5.441 1.00 . A A . 21 ALA O 1 1 6 2489 1 1 22 GLU C C 10.685 1.599 -3.168 1.00 . A A . 22 GLU C 1 1 6 2490 1 1 22 GLU CA C 9.893 2.915 -3.198 1.00 . A A . 22 GLU CA 1 1 6 2491 1 1 22 GLU CB C 8.793 2.867 -2.119 1.00 . A A . 22 GLU CB 1 1 6 2492 1 1 22 GLU CD C 7.298 4.248 -0.666 1.00 . A A . 22 GLU CD 1 1 6 2493 1 1 22 GLU CG C 8.575 4.270 -1.524 1.00 . A A . 22 GLU CG 1 1 6 2494 1 1 22 GLU H H 8.297 3.071 -4.660 1.00 . A A . 22 GLU H 1 1 6 2495 1 1 22 GLU HA H 10.590 3.720 -3.046 1.00 . A A . 22 GLU HA 1 1 6 2496 1 1 22 GLU HB2 H 7.875 2.502 -2.554 1.00 . A A . 22 GLU HB2 1 1 6 2497 1 1 22 GLU HB3 H 9.078 2.194 -1.323 1.00 . A A . 22 GLU HB3 1 1 6 2498 1 1 22 GLU HG2 H 9.416 4.545 -0.903 1.00 . A A . 22 GLU HG2 1 1 6 2499 1 1 22 GLU HG3 H 8.468 5.009 -2.306 1.00 . A A . 22 GLU HG3 1 1 6 2500 1 1 22 GLU N N 9.271 3.155 -4.530 1.00 . A A . 22 GLU N 1 1 6 2501 1 1 22 GLU O O 11.571 1.435 -2.352 1.00 . A A . 22 GLU O 1 1 6 2502 1 1 22 GLU OE1 O 6.251 4.505 -1.239 1.00 . A A . 22 GLU OE1 1 1 6 2503 1 1 22 GLU OE2 O 7.439 3.974 0.514 1.00 . A A . 22 GLU OE2 1 1 6 2504 1 1 23 ASP C C 12.092 -0.677 -5.245 1.00 . A A . 23 ASP C 1 1 6 2505 1 1 23 ASP CA C 11.022 -0.617 -4.145 1.00 . A A . 23 ASP CA 1 1 6 2506 1 1 23 ASP CB C 9.937 -1.676 -4.392 1.00 . A A . 23 ASP CB 1 1 6 2507 1 1 23 ASP CG C 9.226 -1.993 -3.062 1.00 . A A . 23 ASP CG 1 1 6 2508 1 1 23 ASP H H 9.614 0.914 -4.689 1.00 . A A . 23 ASP H 1 1 6 2509 1 1 23 ASP HA H 11.504 -0.826 -3.199 1.00 . A A . 23 ASP HA 1 1 6 2510 1 1 23 ASP HB2 H 9.207 -1.302 -5.095 1.00 . A A . 23 ASP HB2 1 1 6 2511 1 1 23 ASP HB3 H 10.374 -2.580 -4.794 1.00 . A A . 23 ASP HB3 1 1 6 2512 1 1 23 ASP N N 10.338 0.709 -4.061 1.00 . A A . 23 ASP N 1 1 6 2513 1 1 23 ASP O O 13.173 -1.188 -5.024 1.00 . A A . 23 ASP O 1 1 6 2514 1 1 23 ASP OD1 O 8.553 -1.099 -2.574 1.00 . A A . 23 ASP OD1 1 1 6 2515 1 1 23 ASP OD2 O 9.398 -3.112 -2.605 1.00 . A A . 23 ASP OD2 1 1 6 2516 1 1 24 VAL C C 13.326 1.242 -7.780 1.00 . A A . 24 VAL C 1 1 6 2517 1 1 24 VAL CA C 12.682 -0.137 -7.566 1.00 . A A . 24 VAL CA 1 1 6 2518 1 1 24 VAL CB C 11.889 -0.546 -8.848 1.00 . A A . 24 VAL CB 1 1 6 2519 1 1 24 VAL CG1 C 12.860 -1.148 -9.893 1.00 . A A . 24 VAL CG1 1 1 6 2520 1 1 24 VAL CG2 C 10.803 -1.604 -8.518 1.00 . A A . 24 VAL CG2 1 1 6 2521 1 1 24 VAL H H 10.869 0.246 -6.497 1.00 . A A . 24 VAL H 1 1 6 2522 1 1 24 VAL HA H 13.472 -0.855 -7.395 1.00 . A A . 24 VAL HA 1 1 6 2523 1 1 24 VAL HB H 11.407 0.327 -9.264 1.00 . A A . 24 VAL HB 1 1 6 2524 1 1 24 VAL HG11 H 13.801 -0.619 -9.893 1.00 . A A . 24 VAL HG11 1 1 6 2525 1 1 24 VAL HG12 H 13.055 -2.187 -9.672 1.00 . A A . 24 VAL HG12 1 1 6 2526 1 1 24 VAL HG13 H 12.425 -1.078 -10.878 1.00 . A A . 24 VAL HG13 1 1 6 2527 1 1 24 VAL HG21 H 11.207 -2.373 -7.875 1.00 . A A . 24 VAL HG21 1 1 6 2528 1 1 24 VAL HG22 H 9.966 -1.137 -8.020 1.00 . A A . 24 VAL HG22 1 1 6 2529 1 1 24 VAL HG23 H 10.444 -2.068 -9.425 1.00 . A A . 24 VAL HG23 1 1 6 2530 1 1 24 VAL N N 11.753 -0.152 -6.395 1.00 . A A . 24 VAL N 1 1 6 2531 1 1 24 VAL O O 14.427 1.309 -8.293 1.00 . A A . 24 VAL O 1 1 6 2532 1 1 25 GLY C C 13.859 3.914 -8.897 1.00 . A A . 25 GLY C 1 1 6 2533 1 1 25 GLY CA C 13.166 3.686 -7.546 1.00 . A A . 25 GLY CA 1 1 6 2534 1 1 25 GLY H H 11.756 2.159 -6.963 1.00 . A A . 25 GLY H 1 1 6 2535 1 1 25 GLY HA2 H 12.343 4.381 -7.470 1.00 . A A . 25 GLY HA2 1 1 6 2536 1 1 25 GLY HA3 H 13.868 3.886 -6.749 1.00 . A A . 25 GLY HA3 1 1 6 2537 1 1 25 GLY N N 12.636 2.288 -7.382 1.00 . A A . 25 GLY N 1 1 6 2538 1 1 25 GLY O O 15.035 4.222 -8.940 1.00 . A A . 25 GLY O 1 1 6 2539 1 1 26 SER C C 12.582 4.457 -12.290 1.00 . A A . 26 SER C 1 1 6 2540 1 1 26 SER CA C 13.666 3.944 -11.332 1.00 . A A . 26 SER CA 1 1 6 2541 1 1 26 SER CB C 14.245 2.584 -11.816 1.00 . A A . 26 SER CB 1 1 6 2542 1 1 26 SER H H 12.165 3.504 -9.847 1.00 . A A . 26 SER H 1 1 6 2543 1 1 26 SER HA H 14.453 4.677 -11.301 1.00 . A A . 26 SER HA 1 1 6 2544 1 1 26 SER HB2 H 14.350 2.550 -12.891 1.00 . A A . 26 SER HB2 1 1 6 2545 1 1 26 SER HB3 H 15.198 2.381 -11.348 1.00 . A A . 26 SER HB3 1 1 6 2546 1 1 26 SER HG H 13.731 1.043 -10.750 1.00 . A A . 26 SER HG 1 1 6 2547 1 1 26 SER N N 13.106 3.753 -9.956 1.00 . A A . 26 SER N 1 1 6 2548 1 1 26 SER O O 12.477 5.648 -12.511 1.00 . A A . 26 SER O 1 1 6 2549 1 1 26 SER OG O 13.303 1.605 -11.400 1.00 . A A . 26 SER OG 1 1 6 2550 1 1 27 ASN C C 9.459 4.384 -13.017 1.00 . A A . 27 ASN C 1 1 6 2551 1 1 27 ASN CA C 10.716 3.924 -13.777 1.00 . A A . 27 ASN CA 1 1 6 2552 1 1 27 ASN CB C 10.395 2.701 -14.662 1.00 . A A . 27 ASN CB 1 1 6 2553 1 1 27 ASN CG C 9.890 1.538 -13.799 1.00 . A A . 27 ASN CG 1 1 6 2554 1 1 27 ASN H H 11.960 2.609 -12.600 1.00 . A A . 27 ASN H 1 1 6 2555 1 1 27 ASN HA H 11.056 4.736 -14.405 1.00 . A A . 27 ASN HA 1 1 6 2556 1 1 27 ASN HB2 H 9.634 2.952 -15.387 1.00 . A A . 27 ASN HB2 1 1 6 2557 1 1 27 ASN HB3 H 11.284 2.382 -15.188 1.00 . A A . 27 ASN HB3 1 1 6 2558 1 1 27 ASN HD21 H 7.993 2.101 -13.940 1.00 . A A . 27 ASN HD21 1 1 6 2559 1 1 27 ASN HD22 H 8.265 0.702 -13.023 1.00 . A A . 27 ASN HD22 1 1 6 2560 1 1 27 ASN N N 11.811 3.549 -12.828 1.00 . A A . 27 ASN N 1 1 6 2561 1 1 27 ASN ND2 N 8.611 1.438 -13.568 1.00 . A A . 27 ASN ND2 1 1 6 2562 1 1 27 ASN O O 8.479 4.760 -13.630 1.00 . A A . 27 ASN O 1 1 6 2563 1 1 27 ASN OD1 O 10.655 0.717 -13.331 1.00 . A A . 27 ASN OD1 1 1 6 2564 1 1 28 LYS C C 7.165 3.858 -10.895 1.00 . A A . 28 LYS C 1 1 6 2565 1 1 28 LYS CA C 8.432 4.736 -10.781 1.00 . A A . 28 LYS CA 1 1 6 2566 1 1 28 LYS CB C 8.053 6.238 -11.052 1.00 . A A . 28 LYS CB 1 1 6 2567 1 1 28 LYS CD C 10.384 7.152 -10.430 1.00 . A A . 28 LYS CD 1 1 6 2568 1 1 28 LYS CE C 10.730 8.104 -11.595 1.00 . A A . 28 LYS CE 1 1 6 2569 1 1 28 LYS CG C 8.858 7.191 -10.128 1.00 . A A . 28 LYS CG 1 1 6 2570 1 1 28 LYS H H 10.379 4.010 -11.308 1.00 . A A . 28 LYS H 1 1 6 2571 1 1 28 LYS HA H 8.809 4.636 -9.774 1.00 . A A . 28 LYS HA 1 1 6 2572 1 1 28 LYS HB2 H 8.215 6.511 -12.082 1.00 . A A . 28 LYS HB2 1 1 6 2573 1 1 28 LYS HB3 H 7.004 6.388 -10.840 1.00 . A A . 28 LYS HB3 1 1 6 2574 1 1 28 LYS HD2 H 10.919 7.476 -9.549 1.00 . A A . 28 LYS HD2 1 1 6 2575 1 1 28 LYS HD3 H 10.710 6.150 -10.663 1.00 . A A . 28 LYS HD3 1 1 6 2576 1 1 28 LYS HE2 H 10.187 9.034 -11.505 1.00 . A A . 28 LYS HE2 1 1 6 2577 1 1 28 LYS HE3 H 11.788 8.320 -11.584 1.00 . A A . 28 LYS HE3 1 1 6 2578 1 1 28 LYS HG2 H 8.487 8.197 -10.255 1.00 . A A . 28 LYS HG2 1 1 6 2579 1 1 28 LYS HG3 H 8.693 6.912 -9.099 1.00 . A A . 28 LYS HG3 1 1 6 2580 1 1 28 LYS HZ1 H 10.004 6.526 -12.739 1.00 . A A . 28 LYS HZ1 1 1 6 2581 1 1 28 LYS HZ2 H 9.685 8.059 -13.396 1.00 . A A . 28 LYS HZ2 1 1 6 2582 1 1 28 LYS HZ3 H 11.250 7.403 -13.485 1.00 . A A . 28 LYS HZ3 1 1 6 2583 1 1 28 LYS N N 9.544 4.331 -11.708 1.00 . A A . 28 LYS N 1 1 6 2584 1 1 28 LYS NZ N 10.391 7.477 -12.902 1.00 . A A . 28 LYS NZ 1 1 6 2585 1 1 28 LYS O O 6.372 3.966 -9.976 1.00 . A A . 28 LYS O 1 1 6 2586 1 1 28 LYS OXT O 7.045 3.130 -11.866 1.00 . A A . 28 LYS OXT 1 1 7 2587 1 1 1 ASP C C -16.977 -3.294 -12.060 1.00 . A A . 1 ASP C 1 1 7 2588 1 1 1 ASP CA C -16.973 -1.942 -12.780 1.00 . A A . 1 ASP CA 1 1 7 2589 1 1 1 ASP CB C -15.974 -2.012 -13.966 1.00 . A A . 1 ASP CB 1 1 7 2590 1 1 1 ASP CG C -15.590 -0.594 -14.428 1.00 . A A . 1 ASP CG 1 1 7 2591 1 1 1 ASP H1 H -15.703 -0.412 -12.126 1.00 . A A . 1 ASP H1 1 1 7 2592 1 1 1 ASP H2 H -17.333 -0.187 -11.710 1.00 . A A . 1 ASP H2 1 1 7 2593 1 1 1 ASP H3 H -16.390 -1.324 -10.872 1.00 . A A . 1 ASP H3 1 1 7 2594 1 1 1 ASP HA H -17.967 -1.721 -13.136 1.00 . A A . 1 ASP HA 1 1 7 2595 1 1 1 ASP HB2 H -15.078 -2.547 -13.686 1.00 . A A . 1 ASP HB2 1 1 7 2596 1 1 1 ASP HB3 H -16.433 -2.534 -14.794 1.00 . A A . 1 ASP HB3 1 1 7 2597 1 1 1 ASP N N -16.569 -0.887 -11.799 1.00 . A A . 1 ASP N 1 1 7 2598 1 1 1 ASP O O -15.968 -3.679 -11.505 1.00 . A A . 1 ASP O 1 1 7 2599 1 1 1 ASP OD1 O -16.397 -0.020 -15.140 1.00 . A A . 1 ASP OD1 1 1 7 2600 1 1 1 ASP OD2 O -14.513 -0.166 -14.041 1.00 . A A . 1 ASP OD2 1 1 7 2601 1 1 2 ALA C C -17.550 -5.388 -10.031 1.00 . A A . 2 ALA C 1 1 7 2602 1 1 2 ALA CA C -18.243 -5.319 -11.411 1.00 . A A . 2 ALA CA 1 1 7 2603 1 1 2 ALA CB C -17.648 -6.386 -12.356 1.00 . A A . 2 ALA CB 1 1 7 2604 1 1 2 ALA H H -18.875 -3.592 -12.545 1.00 . A A . 2 ALA H 1 1 7 2605 1 1 2 ALA HA H -19.295 -5.516 -11.270 1.00 . A A . 2 ALA HA 1 1 7 2606 1 1 2 ALA HB1 H -18.061 -6.279 -13.347 1.00 . A A . 2 ALA HB1 1 1 7 2607 1 1 2 ALA HB2 H -16.574 -6.276 -12.413 1.00 . A A . 2 ALA HB2 1 1 7 2608 1 1 2 ALA HB3 H -17.875 -7.376 -11.989 1.00 . A A . 2 ALA HB3 1 1 7 2609 1 1 2 ALA N N -18.101 -3.973 -12.079 1.00 . A A . 2 ALA N 1 1 7 2610 1 1 2 ALA O O -17.022 -6.413 -9.648 1.00 . A A . 2 ALA O 1 1 7 2611 1 1 3 GLU C C -15.536 -4.606 -7.869 1.00 . A A . 3 GLU C 1 1 7 2612 1 1 3 GLU CA C -16.981 -4.093 -7.982 1.00 . A A . 3 GLU CA 1 1 7 2613 1 1 3 GLU CB C -17.936 -4.792 -6.931 1.00 . A A . 3 GLU CB 1 1 7 2614 1 1 3 GLU CD C -16.720 -6.394 -5.305 1.00 . A A . 3 GLU CD 1 1 7 2615 1 1 3 GLU CG C -17.585 -6.281 -6.583 1.00 . A A . 3 GLU CG 1 1 7 2616 1 1 3 GLU H H -18.046 -3.504 -9.746 1.00 . A A . 3 GLU H 1 1 7 2617 1 1 3 GLU HA H -16.942 -3.034 -7.804 1.00 . A A . 3 GLU HA 1 1 7 2618 1 1 3 GLU HB2 H -17.932 -4.194 -6.031 1.00 . A A . 3 GLU HB2 1 1 7 2619 1 1 3 GLU HB3 H -18.944 -4.767 -7.317 1.00 . A A . 3 GLU HB3 1 1 7 2620 1 1 3 GLU HG2 H -18.501 -6.828 -6.415 1.00 . A A . 3 GLU HG2 1 1 7 2621 1 1 3 GLU HG3 H -17.062 -6.755 -7.398 1.00 . A A . 3 GLU HG3 1 1 7 2622 1 1 3 GLU N N -17.590 -4.271 -9.343 1.00 . A A . 3 GLU N 1 1 7 2623 1 1 3 GLU O O -15.006 -4.830 -6.799 1.00 . A A . 3 GLU O 1 1 7 2624 1 1 3 GLU OE1 O -17.098 -5.797 -4.309 1.00 . A A . 3 GLU OE1 1 1 7 2625 1 1 3 GLU OE2 O -15.714 -7.082 -5.397 1.00 . A A . 3 GLU OE2 1 1 7 2626 1 1 4 PHE C C -12.640 -4.174 -8.411 1.00 . A A . 4 PHE C 1 1 7 2627 1 1 4 PHE CA C -13.519 -5.246 -9.065 1.00 . A A . 4 PHE CA 1 1 7 2628 1 1 4 PHE CB C -13.123 -5.466 -10.539 1.00 . A A . 4 PHE CB 1 1 7 2629 1 1 4 PHE CD1 C -11.077 -6.943 -10.301 1.00 . A A . 4 PHE CD1 1 1 7 2630 1 1 4 PHE CD2 C -10.757 -4.697 -11.042 1.00 . A A . 4 PHE CD2 1 1 7 2631 1 1 4 PHE CE1 C -9.717 -7.162 -10.377 1.00 . A A . 4 PHE CE1 1 1 7 2632 1 1 4 PHE CE2 C -9.398 -4.915 -11.119 1.00 . A A . 4 PHE CE2 1 1 7 2633 1 1 4 PHE CG C -11.607 -5.709 -10.633 1.00 . A A . 4 PHE CG 1 1 7 2634 1 1 4 PHE CZ C -8.877 -6.147 -10.786 1.00 . A A . 4 PHE CZ 1 1 7 2635 1 1 4 PHE H H -15.393 -4.527 -9.834 1.00 . A A . 4 PHE H 1 1 7 2636 1 1 4 PHE HA H -13.451 -6.169 -8.514 1.00 . A A . 4 PHE HA 1 1 7 2637 1 1 4 PHE HB2 H -13.640 -6.332 -10.930 1.00 . A A . 4 PHE HB2 1 1 7 2638 1 1 4 PHE HB3 H -13.385 -4.610 -11.141 1.00 . A A . 4 PHE HB3 1 1 7 2639 1 1 4 PHE HD1 H -11.731 -7.742 -9.980 1.00 . A A . 4 PHE HD1 1 1 7 2640 1 1 4 PHE HD2 H -11.158 -3.729 -11.304 1.00 . A A . 4 PHE HD2 1 1 7 2641 1 1 4 PHE HE1 H -9.310 -8.127 -10.117 1.00 . A A . 4 PHE HE1 1 1 7 2642 1 1 4 PHE HE2 H -8.741 -4.120 -11.440 1.00 . A A . 4 PHE HE2 1 1 7 2643 1 1 4 PHE HZ H -7.813 -6.318 -10.844 1.00 . A A . 4 PHE HZ 1 1 7 2644 1 1 4 PHE N N -14.923 -4.755 -9.012 1.00 . A A . 4 PHE N 1 1 7 2645 1 1 4 PHE O O -11.678 -4.473 -7.733 1.00 . A A . 4 PHE O 1 1 7 2646 1 1 5 ARG C C -12.851 -1.373 -6.723 1.00 . A A . 5 ARG C 1 1 7 2647 1 1 5 ARG CA C -12.291 -1.778 -8.095 1.00 . A A . 5 ARG CA 1 1 7 2648 1 1 5 ARG CB C -12.388 -0.566 -9.095 1.00 . A A . 5 ARG CB 1 1 7 2649 1 1 5 ARG CD C -13.274 -1.537 -11.277 1.00 . A A . 5 ARG CD 1 1 7 2650 1 1 5 ARG CG C -13.606 -0.657 -10.053 1.00 . A A . 5 ARG CG 1 1 7 2651 1 1 5 ARG CZ C -11.674 -1.468 -13.122 1.00 . A A . 5 ARG CZ 1 1 7 2652 1 1 5 ARG H H -13.821 -2.818 -9.212 1.00 . A A . 5 ARG H 1 1 7 2653 1 1 5 ARG HA H -11.272 -2.077 -7.953 1.00 . A A . 5 ARG HA 1 1 7 2654 1 1 5 ARG HB2 H -12.464 0.362 -8.548 1.00 . A A . 5 ARG HB2 1 1 7 2655 1 1 5 ARG HB3 H -11.478 -0.519 -9.670 1.00 . A A . 5 ARG HB3 1 1 7 2656 1 1 5 ARG HD2 H -13.003 -2.537 -10.981 1.00 . A A . 5 ARG HD2 1 1 7 2657 1 1 5 ARG HD3 H -14.123 -1.588 -11.937 1.00 . A A . 5 ARG HD3 1 1 7 2658 1 1 5 ARG HE H -11.696 -0.124 -11.664 1.00 . A A . 5 ARG HE 1 1 7 2659 1 1 5 ARG HG2 H -14.462 -1.063 -9.536 1.00 . A A . 5 ARG HG2 1 1 7 2660 1 1 5 ARG HG3 H -13.860 0.337 -10.390 1.00 . A A . 5 ARG HG3 1 1 7 2661 1 1 5 ARG HH11 H -12.996 -2.978 -13.145 1.00 . A A . 5 ARG HH11 1 1 7 2662 1 1 5 ARG HH12 H -11.869 -2.942 -14.460 1.00 . A A . 5 ARG HH12 1 1 7 2663 1 1 5 ARG HH21 H -10.257 -0.071 -13.320 1.00 . A A . 5 ARG HH21 1 1 7 2664 1 1 5 ARG HH22 H -10.301 -1.273 -14.566 1.00 . A A . 5 ARG HH22 1 1 7 2665 1 1 5 ARG N N -13.028 -2.950 -8.652 1.00 . A A . 5 ARG N 1 1 7 2666 1 1 5 ARG NE N -12.123 -0.933 -12.016 1.00 . A A . 5 ARG NE 1 1 7 2667 1 1 5 ARG NH1 N -12.224 -2.547 -13.613 1.00 . A A . 5 ARG NH1 1 1 7 2668 1 1 5 ARG NH2 N -10.665 -0.893 -13.716 1.00 . A A . 5 ARG NH2 1 1 7 2669 1 1 5 ARG O O -12.657 -0.265 -6.260 1.00 . A A . 5 ARG O 1 1 7 2670 1 1 6 HIS C C -13.572 -3.090 -3.761 1.00 . A A . 6 HIS C 1 1 7 2671 1 1 6 HIS CA C -14.154 -2.104 -4.778 1.00 . A A . 6 HIS CA 1 1 7 2672 1 1 6 HIS CB C -15.682 -2.304 -4.871 1.00 . A A . 6 HIS CB 1 1 7 2673 1 1 6 HIS CD2 C -16.056 -0.677 -6.926 1.00 . A A . 6 HIS CD2 1 1 7 2674 1 1 6 HIS CE1 C -17.505 0.545 -6.091 1.00 . A A . 6 HIS CE1 1 1 7 2675 1 1 6 HIS CG C -16.299 -1.133 -5.644 1.00 . A A . 6 HIS CG 1 1 7 2676 1 1 6 HIS H H -13.630 -3.170 -6.565 1.00 . A A . 6 HIS H 1 1 7 2677 1 1 6 HIS HA H -13.939 -1.101 -4.458 1.00 . A A . 6 HIS HA 1 1 7 2678 1 1 6 HIS HB2 H -15.928 -3.224 -5.377 1.00 . A A . 6 HIS HB2 1 1 7 2679 1 1 6 HIS HB3 H -16.115 -2.328 -3.882 1.00 . A A . 6 HIS HB3 1 1 7 2680 1 1 6 HIS HD1 H -17.601 -0.381 -4.293 1.00 . A A . 6 HIS HD1 1 1 7 2681 1 1 6 HIS HD2 H -15.347 -1.119 -7.606 1.00 . A A . 6 HIS HD2 1 1 7 2682 1 1 6 HIS HE1 H -18.237 1.329 -5.956 1.00 . A A . 6 HIS HE1 1 1 7 2683 1 1 6 HIS N N -13.533 -2.311 -6.118 1.00 . A A . 6 HIS N 1 1 7 2684 1 1 6 HIS ND1 N -17.203 -0.331 -5.187 1.00 . A A . 6 HIS ND1 1 1 7 2685 1 1 6 HIS NE2 N -16.814 0.368 -7.191 1.00 . A A . 6 HIS NE2 1 1 7 2686 1 1 6 HIS O O -13.130 -2.678 -2.705 1.00 . A A . 6 HIS O 1 1 7 2687 1 1 7 ASP C C -12.067 -6.368 -3.880 1.00 . A A . 7 ASP C 1 1 7 2688 1 1 7 ASP CA C -13.044 -5.403 -3.185 1.00 . A A . 7 ASP CA 1 1 7 2689 1 1 7 ASP CB C -14.250 -6.168 -2.582 1.00 . A A . 7 ASP CB 1 1 7 2690 1 1 7 ASP CG C -13.886 -6.664 -1.172 1.00 . A A . 7 ASP CG 1 1 7 2691 1 1 7 ASP H H -13.961 -4.619 -4.963 1.00 . A A . 7 ASP H 1 1 7 2692 1 1 7 ASP HA H -12.497 -4.904 -2.409 1.00 . A A . 7 ASP HA 1 1 7 2693 1 1 7 ASP HB2 H -15.108 -5.516 -2.509 1.00 . A A . 7 ASP HB2 1 1 7 2694 1 1 7 ASP HB3 H -14.515 -7.017 -3.196 1.00 . A A . 7 ASP HB3 1 1 7 2695 1 1 7 ASP N N -13.587 -4.358 -4.103 1.00 . A A . 7 ASP N 1 1 7 2696 1 1 7 ASP O O -12.019 -7.542 -3.564 1.00 . A A . 7 ASP O 1 1 7 2697 1 1 7 ASP OD1 O -13.982 -5.850 -0.268 1.00 . A A . 7 ASP OD1 1 1 7 2698 1 1 7 ASP OD2 O -13.530 -7.827 -1.077 1.00 . A A . 7 ASP OD2 1 1 7 2699 1 1 8 SER C C -9.499 -5.774 -6.533 1.00 . A A . 8 SER C 1 1 7 2700 1 1 8 SER CA C -10.306 -6.662 -5.567 1.00 . A A . 8 SER CA 1 1 7 2701 1 1 8 SER CB C -11.053 -7.786 -6.361 1.00 . A A . 8 SER CB 1 1 7 2702 1 1 8 SER H H -11.400 -4.884 -5.011 1.00 . A A . 8 SER H 1 1 7 2703 1 1 8 SER HA H -9.617 -7.099 -4.861 1.00 . A A . 8 SER HA 1 1 7 2704 1 1 8 SER HB2 H -10.468 -8.164 -7.187 1.00 . A A . 8 SER HB2 1 1 7 2705 1 1 8 SER HB3 H -11.332 -8.604 -5.716 1.00 . A A . 8 SER HB3 1 1 7 2706 1 1 8 SER HG H -12.985 -7.589 -6.453 1.00 . A A . 8 SER HG 1 1 7 2707 1 1 8 SER N N -11.309 -5.838 -4.808 1.00 . A A . 8 SER N 1 1 7 2708 1 1 8 SER O O -9.119 -6.191 -7.611 1.00 . A A . 8 SER O 1 1 7 2709 1 1 8 SER OG O -12.226 -7.165 -6.861 1.00 . A A . 8 SER OG 1 1 7 2710 1 1 9 GLY C C -8.649 -2.171 -6.393 1.00 . A A . 9 GLY C 1 1 7 2711 1 1 9 GLY CA C -8.486 -3.592 -6.938 1.00 . A A . 9 GLY CA 1 1 7 2712 1 1 9 GLY H H -9.591 -4.290 -5.222 1.00 . A A . 9 GLY H 1 1 7 2713 1 1 9 GLY HA2 H -7.439 -3.863 -6.921 1.00 . A A . 9 GLY HA2 1 1 7 2714 1 1 9 GLY HA3 H -8.848 -3.627 -7.954 1.00 . A A . 9 GLY HA3 1 1 7 2715 1 1 9 GLY N N -9.259 -4.561 -6.104 1.00 . A A . 9 GLY N 1 1 7 2716 1 1 9 GLY O O -9.387 -1.378 -6.945 1.00 . A A . 9 GLY O 1 1 7 2717 1 1 10 TYR C C -7.950 0.602 -5.686 1.00 . A A . 10 TYR C 1 1 7 2718 1 1 10 TYR CA C -8.001 -0.544 -4.663 1.00 . A A . 10 TYR CA 1 1 7 2719 1 1 10 TYR CB C -6.807 -0.431 -3.682 1.00 . A A . 10 TYR CB 1 1 7 2720 1 1 10 TYR CD1 C -4.895 -1.133 -5.218 1.00 . A A . 10 TYR CD1 1 1 7 2721 1 1 10 TYR CD2 C -4.821 1.037 -4.244 1.00 . A A . 10 TYR CD2 1 1 7 2722 1 1 10 TYR CE1 C -3.700 -0.884 -5.858 1.00 . A A . 10 TYR CE1 1 1 7 2723 1 1 10 TYR CE2 C -3.625 1.284 -4.885 1.00 . A A . 10 TYR CE2 1 1 7 2724 1 1 10 TYR CG C -5.468 -0.173 -4.404 1.00 . A A . 10 TYR CG 1 1 7 2725 1 1 10 TYR CZ C -3.060 0.326 -5.695 1.00 . A A . 10 TYR CZ 1 1 7 2726 1 1 10 TYR H H -7.379 -2.591 -4.932 1.00 . A A . 10 TYR H 1 1 7 2727 1 1 10 TYR HA H -8.927 -0.470 -4.112 1.00 . A A . 10 TYR HA 1 1 7 2728 1 1 10 TYR HB2 H -6.992 0.387 -3.004 1.00 . A A . 10 TYR HB2 1 1 7 2729 1 1 10 TYR HB3 H -6.713 -1.346 -3.123 1.00 . A A . 10 TYR HB3 1 1 7 2730 1 1 10 TYR HD1 H -5.383 -2.087 -5.356 1.00 . A A . 10 TYR HD1 1 1 7 2731 1 1 10 TYR HD2 H -5.251 1.799 -3.610 1.00 . A A . 10 TYR HD2 1 1 7 2732 1 1 10 TYR HE1 H -3.263 -1.642 -6.492 1.00 . A A . 10 TYR HE1 1 1 7 2733 1 1 10 TYR HE2 H -3.129 2.234 -4.750 1.00 . A A . 10 TYR HE2 1 1 7 2734 1 1 10 TYR HH H -1.836 0.058 -7.139 1.00 . A A . 10 TYR HH 1 1 7 2735 1 1 10 TYR N N -7.950 -1.895 -5.320 1.00 . A A . 10 TYR N 1 1 7 2736 1 1 10 TYR O O -8.649 1.589 -5.565 1.00 . A A . 10 TYR O 1 1 7 2737 1 1 10 TYR OH O -1.866 0.580 -6.334 1.00 . A A . 10 TYR OH 1 1 7 2738 1 1 11 GLU C C -6.792 2.793 -7.456 1.00 . A A . 11 GLU C 1 1 7 2739 1 1 11 GLU CA C -6.831 1.299 -7.790 1.00 . A A . 11 GLU CA 1 1 7 2740 1 1 11 GLU CB C -7.900 1.035 -8.884 1.00 . A A . 11 GLU CB 1 1 7 2741 1 1 11 GLU CD C -8.882 -0.852 -10.262 1.00 . A A . 11 GLU CD 1 1 7 2742 1 1 11 GLU CG C -7.602 -0.310 -9.592 1.00 . A A . 11 GLU CG 1 1 7 2743 1 1 11 GLU H H -6.604 -0.468 -6.630 1.00 . A A . 11 GLU H 1 1 7 2744 1 1 11 GLU HA H -5.843 1.035 -8.124 1.00 . A A . 11 GLU HA 1 1 7 2745 1 1 11 GLU HB2 H -8.881 1.008 -8.433 1.00 . A A . 11 GLU HB2 1 1 7 2746 1 1 11 GLU HB3 H -7.880 1.832 -9.614 1.00 . A A . 11 GLU HB3 1 1 7 2747 1 1 11 GLU HG2 H -6.848 -0.162 -10.351 1.00 . A A . 11 GLU HG2 1 1 7 2748 1 1 11 GLU HG3 H -7.235 -1.037 -8.880 1.00 . A A . 11 GLU HG3 1 1 7 2749 1 1 11 GLU N N -7.101 0.375 -6.653 1.00 . A A . 11 GLU N 1 1 7 2750 1 1 11 GLU O O -7.797 3.433 -7.214 1.00 . A A . 11 GLU O 1 1 7 2751 1 1 11 GLU OE1 O -9.330 -0.198 -11.191 1.00 . A A . 11 GLU OE1 1 1 7 2752 1 1 11 GLU OE2 O -9.345 -1.889 -9.812 1.00 . A A . 11 GLU OE2 1 1 7 2753 1 1 12 VAL C C -4.485 5.246 -8.339 1.00 . A A . 12 VAL C 1 1 7 2754 1 1 12 VAL CA C -5.304 4.721 -7.173 1.00 . A A . 12 VAL CA 1 1 7 2755 1 1 12 VAL CB C -4.532 4.778 -5.841 1.00 . A A . 12 VAL CB 1 1 7 2756 1 1 12 VAL CG1 C -3.919 6.180 -5.576 1.00 . A A . 12 VAL CG1 1 1 7 2757 1 1 12 VAL CG2 C -5.506 4.433 -4.716 1.00 . A A . 12 VAL CG2 1 1 7 2758 1 1 12 VAL H H -4.832 2.693 -7.679 1.00 . A A . 12 VAL H 1 1 7 2759 1 1 12 VAL HA H -6.225 5.281 -7.133 1.00 . A A . 12 VAL HA 1 1 7 2760 1 1 12 VAL HB H -3.755 4.028 -5.873 1.00 . A A . 12 VAL HB 1 1 7 2761 1 1 12 VAL HG11 H -4.244 6.896 -6.316 1.00 . A A . 12 VAL HG11 1 1 7 2762 1 1 12 VAL HG12 H -4.201 6.551 -4.601 1.00 . A A . 12 VAL HG12 1 1 7 2763 1 1 12 VAL HG13 H -2.844 6.106 -5.609 1.00 . A A . 12 VAL HG13 1 1 7 2764 1 1 12 VAL HG21 H -5.987 3.489 -4.923 1.00 . A A . 12 VAL HG21 1 1 7 2765 1 1 12 VAL HG22 H -4.969 4.362 -3.784 1.00 . A A . 12 VAL HG22 1 1 7 2766 1 1 12 VAL HG23 H -6.261 5.201 -4.642 1.00 . A A . 12 VAL HG23 1 1 7 2767 1 1 12 VAL N N -5.583 3.286 -7.469 1.00 . A A . 12 VAL N 1 1 7 2768 1 1 12 VAL O O -4.940 6.117 -9.052 1.00 . A A . 12 VAL O 1 1 7 2769 1 1 13 HIS C C -1.497 6.269 -9.189 1.00 . A A . 13 HIS C 1 1 7 2770 1 1 13 HIS CA C -2.326 5.021 -9.546 1.00 . A A . 13 HIS CA 1 1 7 2771 1 1 13 HIS CB C -3.077 5.242 -10.901 1.00 . A A . 13 HIS CB 1 1 7 2772 1 1 13 HIS CD2 C -4.310 2.892 -10.501 1.00 . A A . 13 HIS CD2 1 1 7 2773 1 1 13 HIS CE1 C -5.526 2.924 -12.177 1.00 . A A . 13 HIS CE1 1 1 7 2774 1 1 13 HIS CG C -4.047 4.073 -11.187 1.00 . A A . 13 HIS CG 1 1 7 2775 1 1 13 HIS H H -3.064 3.979 -7.830 1.00 . A A . 13 HIS H 1 1 7 2776 1 1 13 HIS HA H -1.652 4.190 -9.667 1.00 . A A . 13 HIS HA 1 1 7 2777 1 1 13 HIS HB2 H -3.630 6.169 -10.903 1.00 . A A . 13 HIS HB2 1 1 7 2778 1 1 13 HIS HB3 H -2.356 5.278 -11.702 1.00 . A A . 13 HIS HB3 1 1 7 2779 1 1 13 HIS HD1 H -4.901 4.705 -12.905 1.00 . A A . 13 HIS HD1 1 1 7 2780 1 1 13 HIS HD2 H -3.834 2.585 -9.580 1.00 . A A . 13 HIS HD2 1 1 7 2781 1 1 13 HIS HE1 H -6.257 2.647 -12.922 1.00 . A A . 13 HIS HE1 1 1 7 2782 1 1 13 HIS N N -3.312 4.676 -8.473 1.00 . A A . 13 HIS N 1 1 7 2783 1 1 13 HIS ND1 N -4.835 4.019 -12.209 1.00 . A A . 13 HIS ND1 1 1 7 2784 1 1 13 HIS NE2 N -5.231 2.192 -11.130 1.00 . A A . 13 HIS NE2 1 1 7 2785 1 1 13 HIS O O -0.751 6.765 -10.011 1.00 . A A . 13 HIS O 1 1 7 2786 1 1 14 HIS C C 0.158 7.345 -6.564 1.00 . A A . 14 HIS C 1 1 7 2787 1 1 14 HIS CA C -0.910 7.935 -7.481 1.00 . A A . 14 HIS CA 1 1 7 2788 1 1 14 HIS CB C -1.832 8.883 -6.672 1.00 . A A . 14 HIS CB 1 1 7 2789 1 1 14 HIS CD2 C -3.717 9.088 -8.473 1.00 . A A . 14 HIS CD2 1 1 7 2790 1 1 14 HIS CE1 C -3.715 11.143 -8.729 1.00 . A A . 14 HIS CE1 1 1 7 2791 1 1 14 HIS CG C -2.760 9.610 -7.637 1.00 . A A . 14 HIS CG 1 1 7 2792 1 1 14 HIS H H -2.274 6.296 -7.365 1.00 . A A . 14 HIS H 1 1 7 2793 1 1 14 HIS HA H -0.465 8.439 -8.311 1.00 . A A . 14 HIS HA 1 1 7 2794 1 1 14 HIS HB2 H -2.433 8.341 -5.960 1.00 . A A . 14 HIS HB2 1 1 7 2795 1 1 14 HIS HB3 H -1.242 9.618 -6.143 1.00 . A A . 14 HIS HB3 1 1 7 2796 1 1 14 HIS HD1 H -2.244 11.550 -7.394 1.00 . A A . 14 HIS HD1 1 1 7 2797 1 1 14 HIS HD2 H -3.930 8.037 -8.542 1.00 . A A . 14 HIS HD2 1 1 7 2798 1 1 14 HIS HE1 H -3.953 12.137 -9.079 1.00 . A A . 14 HIS HE1 1 1 7 2799 1 1 14 HIS N N -1.655 6.738 -7.972 1.00 . A A . 14 HIS N 1 1 7 2800 1 1 14 HIS ND1 N -2.806 10.884 -7.841 1.00 . A A . 14 HIS ND1 1 1 7 2801 1 1 14 HIS NE2 N -4.308 10.052 -9.151 1.00 . A A . 14 HIS NE2 1 1 7 2802 1 1 14 HIS O O 1.308 7.214 -6.936 1.00 . A A . 14 HIS O 1 1 7 2803 1 1 15 GLN C C 1.143 5.051 -4.883 1.00 . A A . 15 GLN C 1 1 7 2804 1 1 15 GLN CA C 0.631 6.390 -4.354 1.00 . A A . 15 GLN CA 1 1 7 2805 1 1 15 GLN CB C -0.146 6.158 -3.049 1.00 . A A . 15 GLN CB 1 1 7 2806 1 1 15 GLN CD C -0.943 8.539 -2.957 1.00 . A A . 15 GLN CD 1 1 7 2807 1 1 15 GLN CG C -0.162 7.442 -2.215 1.00 . A A . 15 GLN CG 1 1 7 2808 1 1 15 GLN H H -1.222 7.134 -5.169 1.00 . A A . 15 GLN H 1 1 7 2809 1 1 15 GLN HA H 1.473 7.048 -4.211 1.00 . A A . 15 GLN HA 1 1 7 2810 1 1 15 GLN HB2 H -1.158 5.851 -3.272 1.00 . A A . 15 GLN HB2 1 1 7 2811 1 1 15 GLN HB3 H 0.326 5.377 -2.471 1.00 . A A . 15 GLN HB3 1 1 7 2812 1 1 15 GLN HE21 H -2.645 7.516 -2.949 1.00 . A A . 15 GLN HE21 1 1 7 2813 1 1 15 GLN HE22 H -2.718 9.037 -3.698 1.00 . A A . 15 GLN HE22 1 1 7 2814 1 1 15 GLN HG2 H -0.641 7.247 -1.267 1.00 . A A . 15 GLN HG2 1 1 7 2815 1 1 15 GLN HG3 H 0.850 7.775 -2.038 1.00 . A A . 15 GLN HG3 1 1 7 2816 1 1 15 GLN N N -0.278 6.994 -5.379 1.00 . A A . 15 GLN N 1 1 7 2817 1 1 15 GLN NE2 N -2.207 8.348 -3.224 1.00 . A A . 15 GLN NE2 1 1 7 2818 1 1 15 GLN O O 2.120 4.504 -4.412 1.00 . A A . 15 GLN O 1 1 7 2819 1 1 15 GLN OE1 O -0.411 9.574 -3.303 1.00 . A A . 15 GLN OE1 1 1 7 2820 1 1 16 GLU C C 2.233 3.349 -7.082 1.00 . A A . 16 GLU C 1 1 7 2821 1 1 16 GLU CA C 0.831 3.265 -6.481 1.00 . A A . 16 GLU CA 1 1 7 2822 1 1 16 GLU CB C -0.198 2.948 -7.553 1.00 . A A . 16 GLU CB 1 1 7 2823 1 1 16 GLU CD C -0.801 1.477 -9.465 1.00 . A A . 16 GLU CD 1 1 7 2824 1 1 16 GLU CG C 0.229 1.712 -8.346 1.00 . A A . 16 GLU CG 1 1 7 2825 1 1 16 GLU H H -0.335 5.037 -6.205 1.00 . A A . 16 GLU H 1 1 7 2826 1 1 16 GLU HA H 0.844 2.525 -5.708 1.00 . A A . 16 GLU HA 1 1 7 2827 1 1 16 GLU HB2 H -1.167 2.798 -7.101 1.00 . A A . 16 GLU HB2 1 1 7 2828 1 1 16 GLU HB3 H -0.257 3.796 -8.218 1.00 . A A . 16 GLU HB3 1 1 7 2829 1 1 16 GLU HG2 H 1.209 1.871 -8.777 1.00 . A A . 16 GLU HG2 1 1 7 2830 1 1 16 GLU HG3 H 0.282 0.857 -7.689 1.00 . A A . 16 GLU HG3 1 1 7 2831 1 1 16 GLU N N 0.449 4.556 -5.867 1.00 . A A . 16 GLU N 1 1 7 2832 1 1 16 GLU O O 3.072 2.501 -6.848 1.00 . A A . 16 GLU O 1 1 7 2833 1 1 16 GLU OE1 O -1.793 0.829 -9.175 1.00 . A A . 16 GLU OE1 1 1 7 2834 1 1 16 GLU OE2 O -0.538 1.964 -10.554 1.00 . A A . 16 GLU OE2 1 1 7 2835 1 1 17 LEU C C 4.823 4.968 -7.476 1.00 . A A . 17 LEU C 1 1 7 2836 1 1 17 LEU CA C 3.766 4.577 -8.489 1.00 . A A . 17 LEU CA 1 1 7 2837 1 1 17 LEU CB C 3.698 5.684 -9.589 1.00 . A A . 17 LEU CB 1 1 7 2838 1 1 17 LEU CD1 C 2.253 7.089 -11.097 1.00 . A A . 17 LEU CD1 1 1 7 2839 1 1 17 LEU CD2 C 1.749 4.631 -10.846 1.00 . A A . 17 LEU CD2 1 1 7 2840 1 1 17 LEU CG C 2.259 5.898 -10.116 1.00 . A A . 17 LEU CG 1 1 7 2841 1 1 17 LEU H H 1.718 5.041 -7.962 1.00 . A A . 17 LEU H 1 1 7 2842 1 1 17 LEU HA H 4.030 3.627 -8.893 1.00 . A A . 17 LEU HA 1 1 7 2843 1 1 17 LEU HB2 H 4.059 6.620 -9.186 1.00 . A A . 17 LEU HB2 1 1 7 2844 1 1 17 LEU HB3 H 4.344 5.403 -10.409 1.00 . A A . 17 LEU HB3 1 1 7 2845 1 1 17 LEU HD11 H 2.982 6.935 -11.881 1.00 . A A . 17 LEU HD11 1 1 7 2846 1 1 17 LEU HD12 H 1.278 7.199 -11.548 1.00 . A A . 17 LEU HD12 1 1 7 2847 1 1 17 LEU HD13 H 2.496 8.001 -10.573 1.00 . A A . 17 LEU HD13 1 1 7 2848 1 1 17 LEU HD21 H 2.403 4.383 -11.669 1.00 . A A . 17 LEU HD21 1 1 7 2849 1 1 17 LEU HD22 H 1.712 3.790 -10.169 1.00 . A A . 17 LEU HD22 1 1 7 2850 1 1 17 LEU HD23 H 0.754 4.800 -11.232 1.00 . A A . 17 LEU HD23 1 1 7 2851 1 1 17 LEU HG H 1.631 6.127 -9.271 1.00 . A A . 17 LEU HG 1 1 7 2852 1 1 17 LEU N N 2.438 4.391 -7.838 1.00 . A A . 17 LEU N 1 1 7 2853 1 1 17 LEU O O 6.006 4.828 -7.709 1.00 . A A . 17 LEU O 1 1 7 2854 1 1 18 VAL C C 5.754 4.703 -4.505 1.00 . A A . 18 VAL C 1 1 7 2855 1 1 18 VAL CA C 5.212 5.887 -5.259 1.00 . A A . 18 VAL CA 1 1 7 2856 1 1 18 VAL CB C 4.386 6.759 -4.339 1.00 . A A . 18 VAL CB 1 1 7 2857 1 1 18 VAL CG1 C 5.140 7.082 -3.040 1.00 . A A . 18 VAL CG1 1 1 7 2858 1 1 18 VAL CG2 C 4.039 7.994 -5.135 1.00 . A A . 18 VAL CG2 1 1 7 2859 1 1 18 VAL H H 3.363 5.526 -6.280 1.00 . A A . 18 VAL H 1 1 7 2860 1 1 18 VAL HA H 6.042 6.442 -5.666 1.00 . A A . 18 VAL HA 1 1 7 2861 1 1 18 VAL HB H 3.476 6.257 -4.067 1.00 . A A . 18 VAL HB 1 1 7 2862 1 1 18 VAL HG11 H 6.167 7.340 -3.250 1.00 . A A . 18 VAL HG11 1 1 7 2863 1 1 18 VAL HG12 H 4.657 7.891 -2.515 1.00 . A A . 18 VAL HG12 1 1 7 2864 1 1 18 VAL HG13 H 5.126 6.205 -2.405 1.00 . A A . 18 VAL HG13 1 1 7 2865 1 1 18 VAL HG21 H 3.515 7.683 -6.028 1.00 . A A . 18 VAL HG21 1 1 7 2866 1 1 18 VAL HG22 H 3.406 8.637 -4.554 1.00 . A A . 18 VAL HG22 1 1 7 2867 1 1 18 VAL HG23 H 4.949 8.496 -5.425 1.00 . A A . 18 VAL HG23 1 1 7 2868 1 1 18 VAL N N 4.335 5.448 -6.373 1.00 . A A . 18 VAL N 1 1 7 2869 1 1 18 VAL O O 6.913 4.670 -4.147 1.00 . A A . 18 VAL O 1 1 7 2870 1 1 19 PHE C C 6.047 1.641 -4.508 1.00 . A A . 19 PHE C 1 1 7 2871 1 1 19 PHE CA C 5.277 2.554 -3.565 1.00 . A A . 19 PHE CA 1 1 7 2872 1 1 19 PHE CB C 3.968 1.945 -2.977 1.00 . A A . 19 PHE CB 1 1 7 2873 1 1 19 PHE CD1 C 3.293 0.391 -4.936 1.00 . A A . 19 PHE CD1 1 1 7 2874 1 1 19 PHE CD2 C 1.616 1.387 -3.567 1.00 . A A . 19 PHE CD2 1 1 7 2875 1 1 19 PHE CE1 C 2.315 -0.262 -5.655 1.00 . A A . 19 PHE CE1 1 1 7 2876 1 1 19 PHE CE2 C 0.635 0.732 -4.285 1.00 . A A . 19 PHE CE2 1 1 7 2877 1 1 19 PHE CG C 2.952 1.219 -3.881 1.00 . A A . 19 PHE CG 1 1 7 2878 1 1 19 PHE CZ C 0.987 -0.095 -5.331 1.00 . A A . 19 PHE CZ 1 1 7 2879 1 1 19 PHE H H 3.969 3.864 -4.639 1.00 . A A . 19 PHE H 1 1 7 2880 1 1 19 PHE HA H 5.908 2.856 -2.751 1.00 . A A . 19 PHE HA 1 1 7 2881 1 1 19 PHE HB2 H 4.244 1.247 -2.204 1.00 . A A . 19 PHE HB2 1 1 7 2882 1 1 19 PHE HB3 H 3.440 2.758 -2.500 1.00 . A A . 19 PHE HB3 1 1 7 2883 1 1 19 PHE HD1 H 4.320 0.256 -5.216 1.00 . A A . 19 PHE HD1 1 1 7 2884 1 1 19 PHE HD2 H 1.344 2.058 -2.761 1.00 . A A . 19 PHE HD2 1 1 7 2885 1 1 19 PHE HE1 H 2.591 -0.907 -6.476 1.00 . A A . 19 PHE HE1 1 1 7 2886 1 1 19 PHE HE2 H -0.405 0.867 -4.027 1.00 . A A . 19 PHE HE2 1 1 7 2887 1 1 19 PHE HZ H 0.227 -0.613 -5.894 1.00 . A A . 19 PHE HZ 1 1 7 2888 1 1 19 PHE N N 4.878 3.765 -4.300 1.00 . A A . 19 PHE N 1 1 7 2889 1 1 19 PHE O O 6.785 0.770 -4.091 1.00 . A A . 19 PHE O 1 1 7 2890 1 1 20 PHE C C 7.915 1.709 -6.929 1.00 . A A . 20 PHE C 1 1 7 2891 1 1 20 PHE CA C 6.511 1.110 -6.841 1.00 . A A . 20 PHE CA 1 1 7 2892 1 1 20 PHE CB C 5.743 1.292 -8.157 1.00 . A A . 20 PHE CB 1 1 7 2893 1 1 20 PHE CD1 C 6.635 -0.619 -9.570 1.00 . A A . 20 PHE CD1 1 1 7 2894 1 1 20 PHE CD2 C 7.275 1.603 -10.152 1.00 . A A . 20 PHE CD2 1 1 7 2895 1 1 20 PHE CE1 C 7.385 -1.110 -10.618 1.00 . A A . 20 PHE CE1 1 1 7 2896 1 1 20 PHE CE2 C 8.024 1.113 -11.201 1.00 . A A . 20 PHE CE2 1 1 7 2897 1 1 20 PHE CG C 6.574 0.741 -9.328 1.00 . A A . 20 PHE CG 1 1 7 2898 1 1 20 PHE CZ C 8.080 -0.244 -11.435 1.00 . A A . 20 PHE CZ 1 1 7 2899 1 1 20 PHE H H 5.219 2.622 -6.023 1.00 . A A . 20 PHE H 1 1 7 2900 1 1 20 PHE HA H 6.568 0.070 -6.552 1.00 . A A . 20 PHE HA 1 1 7 2901 1 1 20 PHE HB2 H 4.799 0.769 -8.114 1.00 . A A . 20 PHE HB2 1 1 7 2902 1 1 20 PHE HB3 H 5.555 2.340 -8.324 1.00 . A A . 20 PHE HB3 1 1 7 2903 1 1 20 PHE HD1 H 6.092 -1.304 -8.934 1.00 . A A . 20 PHE HD1 1 1 7 2904 1 1 20 PHE HD2 H 7.237 2.669 -9.975 1.00 . A A . 20 PHE HD2 1 1 7 2905 1 1 20 PHE HE1 H 7.426 -2.174 -10.800 1.00 . A A . 20 PHE HE1 1 1 7 2906 1 1 20 PHE HE2 H 8.568 1.794 -11.839 1.00 . A A . 20 PHE HE2 1 1 7 2907 1 1 20 PHE HZ H 8.667 -0.628 -12.257 1.00 . A A . 20 PHE HZ 1 1 7 2908 1 1 20 PHE N N 5.835 1.898 -5.776 1.00 . A A . 20 PHE N 1 1 7 2909 1 1 20 PHE O O 8.896 1.007 -7.046 1.00 . A A . 20 PHE O 1 1 7 2910 1 1 21 ALA C C 10.030 3.424 -5.658 1.00 . A A . 21 ALA C 1 1 7 2911 1 1 21 ALA CA C 9.259 3.741 -6.928 1.00 . A A . 21 ALA CA 1 1 7 2912 1 1 21 ALA CB C 8.984 5.239 -7.026 1.00 . A A . 21 ALA CB 1 1 7 2913 1 1 21 ALA H H 7.141 3.528 -6.753 1.00 . A A . 21 ALA H 1 1 7 2914 1 1 21 ALA HA H 9.821 3.369 -7.771 1.00 . A A . 21 ALA HA 1 1 7 2915 1 1 21 ALA HB1 H 8.314 5.542 -6.233 1.00 . A A . 21 ALA HB1 1 1 7 2916 1 1 21 ALA HB2 H 9.905 5.795 -6.938 1.00 . A A . 21 ALA HB2 1 1 7 2917 1 1 21 ALA HB3 H 8.524 5.466 -7.976 1.00 . A A . 21 ALA HB3 1 1 7 2918 1 1 21 ALA N N 7.964 3.014 -6.859 1.00 . A A . 21 ALA N 1 1 7 2919 1 1 21 ALA O O 11.241 3.349 -5.679 1.00 . A A . 21 ALA O 1 1 7 2920 1 1 22 GLU C C 10.470 1.493 -3.340 1.00 . A A . 22 GLU C 1 1 7 2921 1 1 22 GLU CA C 9.926 2.934 -3.286 1.00 . A A . 22 GLU CA 1 1 7 2922 1 1 22 GLU CB C 8.839 3.129 -2.183 1.00 . A A . 22 GLU CB 1 1 7 2923 1 1 22 GLU CD C 8.031 0.893 -1.296 1.00 . A A . 22 GLU CD 1 1 7 2924 1 1 22 GLU CG C 8.921 2.120 -1.001 1.00 . A A . 22 GLU CG 1 1 7 2925 1 1 22 GLU H H 8.310 3.354 -4.665 1.00 . A A . 22 GLU H 1 1 7 2926 1 1 22 GLU HA H 10.743 3.618 -3.139 1.00 . A A . 22 GLU HA 1 1 7 2927 1 1 22 GLU HB2 H 8.932 4.129 -1.786 1.00 . A A . 22 GLU HB2 1 1 7 2928 1 1 22 GLU HB3 H 7.870 3.050 -2.640 1.00 . A A . 22 GLU HB3 1 1 7 2929 1 1 22 GLU HG2 H 9.937 1.802 -0.819 1.00 . A A . 22 GLU HG2 1 1 7 2930 1 1 22 GLU HG3 H 8.557 2.599 -0.104 1.00 . A A . 22 GLU HG3 1 1 7 2931 1 1 22 GLU N N 9.288 3.257 -4.595 1.00 . A A . 22 GLU N 1 1 7 2932 1 1 22 GLU O O 11.422 1.161 -2.660 1.00 . A A . 22 GLU O 1 1 7 2933 1 1 22 GLU OE1 O 6.829 1.045 -1.142 1.00 . A A . 22 GLU OE1 1 1 7 2934 1 1 22 GLU OE2 O 8.592 -0.127 -1.657 1.00 . A A . 22 GLU OE2 1 1 7 2935 1 1 23 ASP C C 11.497 -0.857 -5.209 1.00 . A A . 23 ASP C 1 1 7 2936 1 1 23 ASP CA C 10.254 -0.740 -4.312 1.00 . A A . 23 ASP CA 1 1 7 2937 1 1 23 ASP CB C 9.042 -1.511 -4.902 1.00 . A A . 23 ASP CB 1 1 7 2938 1 1 23 ASP CG C 9.489 -2.805 -5.607 1.00 . A A . 23 ASP CG 1 1 7 2939 1 1 23 ASP H H 9.087 1.027 -4.680 1.00 . A A . 23 ASP H 1 1 7 2940 1 1 23 ASP HA H 10.490 -1.144 -3.338 1.00 . A A . 23 ASP HA 1 1 7 2941 1 1 23 ASP HB2 H 8.360 -1.770 -4.105 1.00 . A A . 23 ASP HB2 1 1 7 2942 1 1 23 ASP HB3 H 8.509 -0.890 -5.608 1.00 . A A . 23 ASP HB3 1 1 7 2943 1 1 23 ASP N N 9.841 0.686 -4.158 1.00 . A A . 23 ASP N 1 1 7 2944 1 1 23 ASP O O 12.486 -1.440 -4.810 1.00 . A A . 23 ASP O 1 1 7 2945 1 1 23 ASP OD1 O 9.819 -3.731 -4.883 1.00 . A A . 23 ASP OD1 1 1 7 2946 1 1 23 ASP OD2 O 9.477 -2.790 -6.827 1.00 . A A . 23 ASP OD2 1 1 7 2947 1 1 24 VAL C C 13.630 0.691 -6.964 1.00 . A A . 24 VAL C 1 1 7 2948 1 1 24 VAL CA C 12.558 -0.349 -7.351 1.00 . A A . 24 VAL CA 1 1 7 2949 1 1 24 VAL CB C 12.027 -0.068 -8.787 1.00 . A A . 24 VAL CB 1 1 7 2950 1 1 24 VAL CG1 C 13.065 -0.548 -9.831 1.00 . A A . 24 VAL CG1 1 1 7 2951 1 1 24 VAL CG2 C 10.724 -0.859 -9.056 1.00 . A A . 24 VAL CG2 1 1 7 2952 1 1 24 VAL H H 10.584 0.157 -6.650 1.00 . A A . 24 VAL H 1 1 7 2953 1 1 24 VAL HA H 13.002 -1.334 -7.310 1.00 . A A . 24 VAL HA 1 1 7 2954 1 1 24 VAL HB H 11.844 0.992 -8.894 1.00 . A A . 24 VAL HB 1 1 7 2955 1 1 24 VAL HG11 H 14.029 -0.095 -9.662 1.00 . A A . 24 VAL HG11 1 1 7 2956 1 1 24 VAL HG12 H 13.180 -1.621 -9.774 1.00 . A A . 24 VAL HG12 1 1 7 2957 1 1 24 VAL HG13 H 12.733 -0.288 -10.824 1.00 . A A . 24 VAL HG13 1 1 7 2958 1 1 24 VAL HG21 H 10.890 -1.915 -8.902 1.00 . A A . 24 VAL HG21 1 1 7 2959 1 1 24 VAL HG22 H 9.931 -0.539 -8.401 1.00 . A A . 24 VAL HG22 1 1 7 2960 1 1 24 VAL HG23 H 10.403 -0.706 -10.075 1.00 . A A . 24 VAL HG23 1 1 7 2961 1 1 24 VAL N N 11.409 -0.299 -6.391 1.00 . A A . 24 VAL N 1 1 7 2962 1 1 24 VAL O O 14.673 0.769 -7.583 1.00 . A A . 24 VAL O 1 1 7 2963 1 1 25 GLY C C 14.634 3.493 -6.601 1.00 . A A . 25 GLY C 1 1 7 2964 1 1 25 GLY CA C 14.290 2.518 -5.474 1.00 . A A . 25 GLY CA 1 1 7 2965 1 1 25 GLY H H 12.466 1.368 -5.511 1.00 . A A . 25 GLY H 1 1 7 2966 1 1 25 GLY HA2 H 13.835 3.062 -4.659 1.00 . A A . 25 GLY HA2 1 1 7 2967 1 1 25 GLY HA3 H 15.193 2.040 -5.124 1.00 . A A . 25 GLY HA3 1 1 7 2968 1 1 25 GLY N N 13.334 1.471 -5.953 1.00 . A A . 25 GLY N 1 1 7 2969 1 1 25 GLY O O 15.713 3.438 -7.157 1.00 . A A . 25 GLY O 1 1 7 2970 1 1 26 SER C C 14.332 4.771 -9.276 1.00 . A A . 26 SER C 1 1 7 2971 1 1 26 SER CA C 13.808 5.385 -7.963 1.00 . A A . 26 SER CA 1 1 7 2972 1 1 26 SER CB C 14.757 6.517 -7.441 1.00 . A A . 26 SER CB 1 1 7 2973 1 1 26 SER H H 12.852 4.277 -6.380 1.00 . A A . 26 SER H 1 1 7 2974 1 1 26 SER HA H 12.827 5.798 -8.151 1.00 . A A . 26 SER HA 1 1 7 2975 1 1 26 SER HB2 H 14.703 7.390 -8.075 1.00 . A A . 26 SER HB2 1 1 7 2976 1 1 26 SER HB3 H 14.511 6.791 -6.425 1.00 . A A . 26 SER HB3 1 1 7 2977 1 1 26 SER HG H 16.414 5.975 -6.577 1.00 . A A . 26 SER HG 1 1 7 2978 1 1 26 SER N N 13.681 4.343 -6.892 1.00 . A A . 26 SER N 1 1 7 2979 1 1 26 SER O O 15.073 5.387 -10.019 1.00 . A A . 26 SER O 1 1 7 2980 1 1 26 SER OG O 16.080 5.999 -7.477 1.00 . A A . 26 SER OG 1 1 7 2981 1 1 27 ASN C C 15.829 2.630 -10.793 1.00 . A A . 27 ASN C 1 1 7 2982 1 1 27 ASN CA C 14.298 2.770 -10.712 1.00 . A A . 27 ASN CA 1 1 7 2983 1 1 27 ASN CB C 13.730 3.499 -11.965 1.00 . A A . 27 ASN CB 1 1 7 2984 1 1 27 ASN CG C 13.692 2.512 -13.138 1.00 . A A . 27 ASN CG 1 1 7 2985 1 1 27 ASN H H 13.310 3.136 -8.840 1.00 . A A . 27 ASN H 1 1 7 2986 1 1 27 ASN HA H 13.864 1.788 -10.635 1.00 . A A . 27 ASN HA 1 1 7 2987 1 1 27 ASN HB2 H 12.725 3.843 -11.772 1.00 . A A . 27 ASN HB2 1 1 7 2988 1 1 27 ASN HB3 H 14.342 4.347 -12.238 1.00 . A A . 27 ASN HB3 1 1 7 2989 1 1 27 ASN HD21 H 12.140 1.512 -12.409 1.00 . A A . 27 ASN HD21 1 1 7 2990 1 1 27 ASN HD22 H 12.744 0.938 -13.888 1.00 . A A . 27 ASN HD22 1 1 7 2991 1 1 27 ASN N N 13.907 3.550 -9.497 1.00 . A A . 27 ASN N 1 1 7 2992 1 1 27 ASN ND2 N 12.783 1.576 -13.146 1.00 . A A . 27 ASN ND2 1 1 7 2993 1 1 27 ASN O O 16.463 3.084 -11.727 1.00 . A A . 27 ASN O 1 1 7 2994 1 1 27 ASN OD1 O 14.487 2.584 -14.055 1.00 . A A . 27 ASN OD1 1 1 7 2995 1 1 28 LYS C C 18.269 0.639 -10.679 1.00 . A A . 28 LYS C 1 1 7 2996 1 1 28 LYS CA C 17.850 1.775 -9.726 1.00 . A A . 28 LYS CA 1 1 7 2997 1 1 28 LYS CB C 18.238 1.426 -8.264 1.00 . A A . 28 LYS CB 1 1 7 2998 1 1 28 LYS CD C 18.889 3.752 -7.456 1.00 . A A . 28 LYS CD 1 1 7 2999 1 1 28 LYS CE C 18.465 3.822 -5.975 1.00 . A A . 28 LYS CE 1 1 7 3000 1 1 28 LYS CG C 19.404 2.328 -7.797 1.00 . A A . 28 LYS CG 1 1 7 3001 1 1 28 LYS H H 15.815 1.641 -9.063 1.00 . A A . 28 LYS H 1 1 7 3002 1 1 28 LYS HA H 18.336 2.690 -10.039 1.00 . A A . 28 LYS HA 1 1 7 3003 1 1 28 LYS HB2 H 17.388 1.560 -7.611 1.00 . A A . 28 LYS HB2 1 1 7 3004 1 1 28 LYS HB3 H 18.546 0.392 -8.197 1.00 . A A . 28 LYS HB3 1 1 7 3005 1 1 28 LYS HD2 H 19.679 4.467 -7.634 1.00 . A A . 28 LYS HD2 1 1 7 3006 1 1 28 LYS HD3 H 18.052 4.015 -8.086 1.00 . A A . 28 LYS HD3 1 1 7 3007 1 1 28 LYS HE2 H 17.908 4.729 -5.795 1.00 . A A . 28 LYS HE2 1 1 7 3008 1 1 28 LYS HE3 H 17.846 2.976 -5.713 1.00 . A A . 28 LYS HE3 1 1 7 3009 1 1 28 LYS HG2 H 19.871 1.880 -6.931 1.00 . A A . 28 LYS HG2 1 1 7 3010 1 1 28 LYS HG3 H 20.146 2.392 -8.580 1.00 . A A . 28 LYS HG3 1 1 7 3011 1 1 28 LYS HZ1 H 20.527 3.774 -5.679 1.00 . A A . 28 LYS HZ1 1 1 7 3012 1 1 28 LYS HZ2 H 19.682 4.694 -4.529 1.00 . A A . 28 LYS HZ2 1 1 7 3013 1 1 28 LYS HZ3 H 19.633 2.998 -4.462 1.00 . A A . 28 LYS HZ3 1 1 7 3014 1 1 28 LYS N N 16.373 1.990 -9.788 1.00 . A A . 28 LYS N 1 1 7 3015 1 1 28 LYS NZ N 19.668 3.822 -5.095 1.00 . A A . 28 LYS NZ 1 1 7 3016 1 1 28 LYS O O 17.501 -0.305 -10.781 1.00 . A A . 28 LYS O 1 1 7 3017 1 1 28 LYS OXT O 19.337 0.783 -11.253 1.00 . A A . 28 LYS OXT 1 1 8 3018 1 1 1 ASP C C -18.234 2.314 -1.029 1.00 . A A . 1 ASP C 1 1 8 3019 1 1 1 ASP CA C -18.078 3.836 -0.939 1.00 . A A . 1 ASP CA 1 1 8 3020 1 1 1 ASP CB C -16.579 4.169 -0.814 1.00 . A A . 1 ASP CB 1 1 8 3021 1 1 1 ASP CG C -16.403 5.695 -0.741 1.00 . A A . 1 ASP CG 1 1 8 3022 1 1 1 ASP H1 H -19.297 3.585 0.736 1.00 . A A . 1 ASP H1 1 1 8 3023 1 1 1 ASP H2 H -18.169 4.845 0.882 1.00 . A A . 1 ASP H2 1 1 8 3024 1 1 1 ASP H3 H -19.545 5.048 -0.092 1.00 . A A . 1 ASP H3 1 1 8 3025 1 1 1 ASP HA H -18.484 4.280 -1.837 1.00 . A A . 1 ASP HA 1 1 8 3026 1 1 1 ASP HB2 H -16.170 3.719 0.080 1.00 . A A . 1 ASP HB2 1 1 8 3027 1 1 1 ASP HB3 H -16.038 3.789 -1.669 1.00 . A A . 1 ASP HB3 1 1 8 3028 1 1 1 ASP N N -18.829 4.368 0.236 1.00 . A A . 1 ASP N 1 1 8 3029 1 1 1 ASP O O -18.673 1.678 -0.090 1.00 . A A . 1 ASP O 1 1 8 3030 1 1 1 ASP OD1 O -16.289 6.280 -1.805 1.00 . A A . 1 ASP OD1 1 1 8 3031 1 1 1 ASP OD2 O -16.394 6.187 0.376 1.00 . A A . 1 ASP OD2 1 1 8 3032 1 1 2 ALA C C -16.640 -0.352 -2.011 1.00 . A A . 2 ALA C 1 1 8 3033 1 1 2 ALA CA C -17.957 0.307 -2.400 1.00 . A A . 2 ALA CA 1 1 8 3034 1 1 2 ALA CB C -18.260 0.047 -3.881 1.00 . A A . 2 ALA CB 1 1 8 3035 1 1 2 ALA H H -17.524 2.362 -2.881 1.00 . A A . 2 ALA H 1 1 8 3036 1 1 2 ALA HA H -18.711 -0.103 -1.752 1.00 . A A . 2 ALA HA 1 1 8 3037 1 1 2 ALA HB1 H -19.181 0.540 -4.160 1.00 . A A . 2 ALA HB1 1 1 8 3038 1 1 2 ALA HB2 H -17.462 0.428 -4.500 1.00 . A A . 2 ALA HB2 1 1 8 3039 1 1 2 ALA HB3 H -18.366 -1.013 -4.059 1.00 . A A . 2 ALA HB3 1 1 8 3040 1 1 2 ALA N N -17.865 1.783 -2.168 1.00 . A A . 2 ALA N 1 1 8 3041 1 1 2 ALA O O -16.611 -1.526 -1.694 1.00 . A A . 2 ALA O 1 1 8 3042 1 1 3 GLU C C -13.806 -1.401 -2.032 1.00 . A A . 3 GLU C 1 1 8 3043 1 1 3 GLU CA C -14.212 0.043 -1.716 1.00 . A A . 3 GLU CA 1 1 8 3044 1 1 3 GLU CB C -14.043 0.375 -0.218 1.00 . A A . 3 GLU CB 1 1 8 3045 1 1 3 GLU CD C -16.263 0.113 1.060 1.00 . A A . 3 GLU CD 1 1 8 3046 1 1 3 GLU CG C -14.910 -0.544 0.696 1.00 . A A . 3 GLU CG 1 1 8 3047 1 1 3 GLU H H -15.759 1.379 -2.333 1.00 . A A . 3 GLU H 1 1 8 3048 1 1 3 GLU HA H -13.549 0.656 -2.317 1.00 . A A . 3 GLU HA 1 1 8 3049 1 1 3 GLU HB2 H -13.007 0.272 0.054 1.00 . A A . 3 GLU HB2 1 1 8 3050 1 1 3 GLU HB3 H -14.335 1.407 -0.082 1.00 . A A . 3 GLU HB3 1 1 8 3051 1 1 3 GLU HG2 H -15.092 -1.492 0.211 1.00 . A A . 3 GLU HG2 1 1 8 3052 1 1 3 GLU HG3 H -14.371 -0.738 1.611 1.00 . A A . 3 GLU HG3 1 1 8 3053 1 1 3 GLU N N -15.608 0.451 -2.057 1.00 . A A . 3 GLU N 1 1 8 3054 1 1 3 GLU O O -13.005 -2.016 -1.353 1.00 . A A . 3 GLU O 1 1 8 3055 1 1 3 GLU OE1 O -16.250 1.276 1.437 1.00 . A A . 3 GLU OE1 1 1 8 3056 1 1 3 GLU OE2 O -17.253 -0.592 0.943 1.00 . A A . 3 GLU OE2 1 1 8 3057 1 1 4 PHE C C -12.792 -3.340 -4.270 1.00 . A A . 4 PHE C 1 1 8 3058 1 1 4 PHE CA C -14.153 -3.262 -3.588 1.00 . A A . 4 PHE CA 1 1 8 3059 1 1 4 PHE CB C -15.292 -3.649 -4.587 1.00 . A A . 4 PHE CB 1 1 8 3060 1 1 4 PHE CD1 C -15.001 -1.370 -5.804 1.00 . A A . 4 PHE CD1 1 1 8 3061 1 1 4 PHE CD2 C -16.949 -2.672 -6.215 1.00 . A A . 4 PHE CD2 1 1 8 3062 1 1 4 PHE CE1 C -15.456 -0.408 -6.680 1.00 . A A . 4 PHE CE1 1 1 8 3063 1 1 4 PHE CE2 C -17.406 -1.709 -7.091 1.00 . A A . 4 PHE CE2 1 1 8 3064 1 1 4 PHE CG C -15.740 -2.521 -5.556 1.00 . A A . 4 PHE CG 1 1 8 3065 1 1 4 PHE CZ C -16.660 -0.577 -7.324 1.00 . A A . 4 PHE CZ 1 1 8 3066 1 1 4 PHE H H -15.035 -1.301 -3.553 1.00 . A A . 4 PHE H 1 1 8 3067 1 1 4 PHE HA H -14.127 -3.968 -2.783 1.00 . A A . 4 PHE HA 1 1 8 3068 1 1 4 PHE HB2 H -14.986 -4.498 -5.181 1.00 . A A . 4 PHE HB2 1 1 8 3069 1 1 4 PHE HB3 H -16.153 -3.951 -4.008 1.00 . A A . 4 PHE HB3 1 1 8 3070 1 1 4 PHE HD1 H -14.056 -1.210 -5.312 1.00 . A A . 4 PHE HD1 1 1 8 3071 1 1 4 PHE HD2 H -17.545 -3.556 -6.042 1.00 . A A . 4 PHE HD2 1 1 8 3072 1 1 4 PHE HE1 H -14.866 0.479 -6.860 1.00 . A A . 4 PHE HE1 1 1 8 3073 1 1 4 PHE HE2 H -18.351 -1.845 -7.595 1.00 . A A . 4 PHE HE2 1 1 8 3074 1 1 4 PHE HZ H -17.017 0.177 -8.010 1.00 . A A . 4 PHE HZ 1 1 8 3075 1 1 4 PHE N N -14.401 -1.880 -3.086 1.00 . A A . 4 PHE N 1 1 8 3076 1 1 4 PHE O O -12.516 -4.300 -4.955 1.00 . A A . 4 PHE O 1 1 8 3077 1 1 5 ARG C C -10.769 -2.478 -6.217 1.00 . A A . 5 ARG C 1 1 8 3078 1 1 5 ARG CA C -10.596 -2.332 -4.709 1.00 . A A . 5 ARG CA 1 1 8 3079 1 1 5 ARG CB C -9.777 -3.479 -4.136 1.00 . A A . 5 ARG CB 1 1 8 3080 1 1 5 ARG CD C -8.244 -3.438 -2.108 1.00 . A A . 5 ARG CD 1 1 8 3081 1 1 5 ARG CG C -9.700 -3.299 -2.605 1.00 . A A . 5 ARG CG 1 1 8 3082 1 1 5 ARG CZ C -7.638 -5.798 -2.463 1.00 . A A . 5 ARG CZ 1 1 8 3083 1 1 5 ARG H H -12.219 -1.591 -3.504 1.00 . A A . 5 ARG H 1 1 8 3084 1 1 5 ARG HA H -10.099 -1.406 -4.503 1.00 . A A . 5 ARG HA 1 1 8 3085 1 1 5 ARG HB2 H -10.266 -4.410 -4.354 1.00 . A A . 5 ARG HB2 1 1 8 3086 1 1 5 ARG HB3 H -8.798 -3.478 -4.593 1.00 . A A . 5 ARG HB3 1 1 8 3087 1 1 5 ARG HD2 H -7.703 -2.523 -2.303 1.00 . A A . 5 ARG HD2 1 1 8 3088 1 1 5 ARG HD3 H -8.214 -3.638 -1.048 1.00 . A A . 5 ARG HD3 1 1 8 3089 1 1 5 ARG HE H -7.069 -4.322 -3.665 1.00 . A A . 5 ARG HE 1 1 8 3090 1 1 5 ARG HG2 H -10.077 -2.320 -2.334 1.00 . A A . 5 ARG HG2 1 1 8 3091 1 1 5 ARG HG3 H -10.339 -4.038 -2.146 1.00 . A A . 5 ARG HG3 1 1 8 3092 1 1 5 ARG HH11 H -8.771 -5.422 -0.850 1.00 . A A . 5 ARG HH11 1 1 8 3093 1 1 5 ARG HH12 H -8.344 -7.081 -1.098 1.00 . A A . 5 ARG HH12 1 1 8 3094 1 1 5 ARG HH21 H -6.521 -6.430 -4.000 1.00 . A A . 5 ARG HH21 1 1 8 3095 1 1 5 ARG HH22 H -7.055 -7.660 -2.904 1.00 . A A . 5 ARG HH22 1 1 8 3096 1 1 5 ARG N N -11.957 -2.343 -4.072 1.00 . A A . 5 ARG N 1 1 8 3097 1 1 5 ARG NE N -7.572 -4.548 -2.856 1.00 . A A . 5 ARG NE 1 1 8 3098 1 1 5 ARG NH1 N -8.303 -6.124 -1.387 1.00 . A A . 5 ARG NH1 1 1 8 3099 1 1 5 ARG NH2 N -7.024 -6.699 -3.178 1.00 . A A . 5 ARG NH2 1 1 8 3100 1 1 5 ARG O O -9.928 -2.988 -6.928 1.00 . A A . 5 ARG O 1 1 8 3101 1 1 6 HIS C C -12.290 -3.399 -8.635 1.00 . A A . 6 HIS C 1 1 8 3102 1 1 6 HIS CA C -12.384 -2.003 -8.023 1.00 . A A . 6 HIS CA 1 1 8 3103 1 1 6 HIS CB C -11.518 -1.004 -8.830 1.00 . A A . 6 HIS CB 1 1 8 3104 1 1 6 HIS CD2 C -11.774 0.998 -7.114 1.00 . A A . 6 HIS CD2 1 1 8 3105 1 1 6 HIS CE1 C -12.402 2.456 -8.448 1.00 . A A . 6 HIS CE1 1 1 8 3106 1 1 6 HIS CG C -11.831 0.422 -8.371 1.00 . A A . 6 HIS CG 1 1 8 3107 1 1 6 HIS H H -12.500 -1.645 -5.909 1.00 . A A . 6 HIS H 1 1 8 3108 1 1 6 HIS HA H -13.416 -1.688 -8.042 1.00 . A A . 6 HIS HA 1 1 8 3109 1 1 6 HIS HB2 H -10.466 -1.194 -8.684 1.00 . A A . 6 HIS HB2 1 1 8 3110 1 1 6 HIS HB3 H -11.740 -1.075 -9.884 1.00 . A A . 6 HIS HB3 1 1 8 3111 1 1 6 HIS HD1 H -12.367 1.300 -10.111 1.00 . A A . 6 HIS HD1 1 1 8 3112 1 1 6 HIS HD2 H -11.480 0.484 -6.212 1.00 . A A . 6 HIS HD2 1 1 8 3113 1 1 6 HIS HE1 H -12.732 3.397 -8.862 1.00 . A A . 6 HIS HE1 1 1 8 3114 1 1 6 HIS N N -11.921 -2.006 -6.608 1.00 . A A . 6 HIS N 1 1 8 3115 1 1 6 HIS ND1 N -12.225 1.378 -9.145 1.00 . A A . 6 HIS ND1 1 1 8 3116 1 1 6 HIS NE2 N -12.133 2.265 -7.181 1.00 . A A . 6 HIS NE2 1 1 8 3117 1 1 6 HIS O O -12.334 -3.493 -9.845 1.00 . A A . 6 HIS O 1 1 8 3118 1 1 7 ASP C C -10.838 -6.515 -7.414 1.00 . A A . 7 ASP C 1 1 8 3119 1 1 7 ASP CA C -12.057 -5.863 -8.110 1.00 . A A . 7 ASP CA 1 1 8 3120 1 1 7 ASP CB C -11.891 -6.092 -9.641 1.00 . A A . 7 ASP CB 1 1 8 3121 1 1 7 ASP CG C -10.535 -5.581 -10.224 1.00 . A A . 7 ASP CG 1 1 8 3122 1 1 7 ASP H H -12.175 -4.180 -6.813 1.00 . A A . 7 ASP H 1 1 8 3123 1 1 7 ASP HA H -12.950 -6.362 -7.761 1.00 . A A . 7 ASP HA 1 1 8 3124 1 1 7 ASP HB2 H -11.954 -7.153 -9.802 1.00 . A A . 7 ASP HB2 1 1 8 3125 1 1 7 ASP HB3 H -12.715 -5.628 -10.160 1.00 . A A . 7 ASP HB3 1 1 8 3126 1 1 7 ASP N N -12.174 -4.397 -7.770 1.00 . A A . 7 ASP N 1 1 8 3127 1 1 7 ASP O O -10.174 -7.356 -7.989 1.00 . A A . 7 ASP O 1 1 8 3128 1 1 7 ASP OD1 O -9.828 -4.843 -9.550 1.00 . A A . 7 ASP OD1 1 1 8 3129 1 1 7 ASP OD2 O -10.283 -5.976 -11.350 1.00 . A A . 7 ASP OD2 1 1 8 3130 1 1 8 SER C C -8.080 -6.397 -6.129 1.00 . A A . 8 SER C 1 1 8 3131 1 1 8 SER CA C -9.420 -6.657 -5.403 1.00 . A A . 8 SER CA 1 1 8 3132 1 1 8 SER CB C -9.672 -8.198 -5.159 1.00 . A A . 8 SER CB 1 1 8 3133 1 1 8 SER H H -11.158 -5.427 -5.800 1.00 . A A . 8 SER H 1 1 8 3134 1 1 8 SER HA H -9.386 -6.164 -4.447 1.00 . A A . 8 SER HA 1 1 8 3135 1 1 8 SER HB2 H -9.199 -8.518 -4.243 1.00 . A A . 8 SER HB2 1 1 8 3136 1 1 8 SER HB3 H -10.729 -8.412 -5.106 1.00 . A A . 8 SER HB3 1 1 8 3137 1 1 8 SER HG H -8.415 -9.488 -5.897 1.00 . A A . 8 SER HG 1 1 8 3138 1 1 8 SER N N -10.577 -6.109 -6.197 1.00 . A A . 8 SER N 1 1 8 3139 1 1 8 SER O O -7.139 -7.163 -6.051 1.00 . A A . 8 SER O 1 1 8 3140 1 1 8 SER OG O -9.108 -8.922 -6.244 1.00 . A A . 8 SER OG 1 1 8 3141 1 1 9 GLY C C -7.194 -3.395 -8.021 1.00 . A A . 9 GLY C 1 1 8 3142 1 1 9 GLY CA C -6.878 -4.829 -7.595 1.00 . A A . 9 GLY CA 1 1 8 3143 1 1 9 GLY H H -8.861 -4.714 -6.822 1.00 . A A . 9 GLY H 1 1 8 3144 1 1 9 GLY HA2 H -5.995 -4.844 -6.974 1.00 . A A . 9 GLY HA2 1 1 8 3145 1 1 9 GLY HA3 H -6.748 -5.456 -8.465 1.00 . A A . 9 GLY HA3 1 1 8 3146 1 1 9 GLY N N -8.065 -5.283 -6.815 1.00 . A A . 9 GLY N 1 1 8 3147 1 1 9 GLY O O -7.401 -3.115 -9.185 1.00 . A A . 9 GLY O 1 1 8 3148 1 1 10 TYR C C -6.472 -0.366 -8.118 1.00 . A A . 10 TYR C 1 1 8 3149 1 1 10 TYR CA C -7.519 -1.091 -7.269 1.00 . A A . 10 TYR CA 1 1 8 3150 1 1 10 TYR CB C -7.672 -0.412 -5.878 1.00 . A A . 10 TYR CB 1 1 8 3151 1 1 10 TYR CD1 C -5.222 -0.660 -5.207 1.00 . A A . 10 TYR CD1 1 1 8 3152 1 1 10 TYR CD2 C -6.261 1.460 -4.925 1.00 . A A . 10 TYR CD2 1 1 8 3153 1 1 10 TYR CE1 C -4.045 -0.147 -4.705 1.00 . A A . 10 TYR CE1 1 1 8 3154 1 1 10 TYR CE2 C -5.083 1.972 -4.424 1.00 . A A . 10 TYR CE2 1 1 8 3155 1 1 10 TYR CG C -6.345 0.140 -5.321 1.00 . A A . 10 TYR CG 1 1 8 3156 1 1 10 TYR CZ C -3.967 1.173 -4.309 1.00 . A A . 10 TYR CZ 1 1 8 3157 1 1 10 TYR H H -7.040 -2.838 -6.123 1.00 . A A . 10 TYR H 1 1 8 3158 1 1 10 TYR HA H -8.465 -1.032 -7.784 1.00 . A A . 10 TYR HA 1 1 8 3159 1 1 10 TYR HB2 H -8.380 0.401 -5.964 1.00 . A A . 10 TYR HB2 1 1 8 3160 1 1 10 TYR HB3 H -8.059 -1.127 -5.168 1.00 . A A . 10 TYR HB3 1 1 8 3161 1 1 10 TYR HD1 H -5.264 -1.696 -5.510 1.00 . A A . 10 TYR HD1 1 1 8 3162 1 1 10 TYR HD2 H -7.128 2.101 -5.006 1.00 . A A . 10 TYR HD2 1 1 8 3163 1 1 10 TYR HE1 H -3.177 -0.783 -4.624 1.00 . A A . 10 TYR HE1 1 1 8 3164 1 1 10 TYR HE2 H -5.039 3.008 -4.120 1.00 . A A . 10 TYR HE2 1 1 8 3165 1 1 10 TYR HH H -2.305 2.080 -4.540 1.00 . A A . 10 TYR HH 1 1 8 3166 1 1 10 TYR N N -7.220 -2.534 -7.035 1.00 . A A . 10 TYR N 1 1 8 3167 1 1 10 TYR O O -5.387 -0.861 -8.358 1.00 . A A . 10 TYR O 1 1 8 3168 1 1 10 TYR OH O -2.789 1.689 -3.810 1.00 . A A . 10 TYR OH 1 1 8 3169 1 1 11 GLU C C -6.081 3.112 -8.856 1.00 . A A . 11 GLU C 1 1 8 3170 1 1 11 GLU CA C -6.001 1.676 -9.376 1.00 . A A . 11 GLU CA 1 1 8 3171 1 1 11 GLU CB C -6.479 1.583 -10.852 1.00 . A A . 11 GLU CB 1 1 8 3172 1 1 11 GLU CD C -8.956 1.538 -10.251 1.00 . A A . 11 GLU CD 1 1 8 3173 1 1 11 GLU CG C -7.860 2.244 -11.079 1.00 . A A . 11 GLU CG 1 1 8 3174 1 1 11 GLU H H -7.762 1.122 -8.287 1.00 . A A . 11 GLU H 1 1 8 3175 1 1 11 GLU HA H -4.979 1.340 -9.300 1.00 . A A . 11 GLU HA 1 1 8 3176 1 1 11 GLU HB2 H -5.754 2.073 -11.485 1.00 . A A . 11 GLU HB2 1 1 8 3177 1 1 11 GLU HB3 H -6.526 0.544 -11.144 1.00 . A A . 11 GLU HB3 1 1 8 3178 1 1 11 GLU HG2 H -7.816 3.291 -10.816 1.00 . A A . 11 GLU HG2 1 1 8 3179 1 1 11 GLU HG3 H -8.110 2.170 -12.126 1.00 . A A . 11 GLU HG3 1 1 8 3180 1 1 11 GLU N N -6.868 0.807 -8.536 1.00 . A A . 11 GLU N 1 1 8 3181 1 1 11 GLU O O -7.134 3.607 -8.506 1.00 . A A . 11 GLU O 1 1 8 3182 1 1 11 GLU OE1 O -9.270 0.411 -10.599 1.00 . A A . 11 GLU OE1 1 1 8 3183 1 1 11 GLU OE2 O -9.418 2.166 -9.312 1.00 . A A . 11 GLU OE2 1 1 8 3184 1 1 12 VAL C C -3.551 5.686 -9.053 1.00 . A A . 12 VAL C 1 1 8 3185 1 1 12 VAL CA C -4.782 5.131 -8.355 1.00 . A A . 12 VAL CA 1 1 8 3186 1 1 12 VAL CB C -4.586 5.140 -6.816 1.00 . A A . 12 VAL CB 1 1 8 3187 1 1 12 VAL CG1 C -4.117 6.533 -6.339 1.00 . A A . 12 VAL CG1 1 1 8 3188 1 1 12 VAL CG2 C -5.903 4.801 -6.125 1.00 . A A . 12 VAL CG2 1 1 8 3189 1 1 12 VAL H H -4.144 3.231 -9.138 1.00 . A A . 12 VAL H 1 1 8 3190 1 1 12 VAL HA H -5.637 5.708 -8.659 1.00 . A A . 12 VAL HA 1 1 8 3191 1 1 12 VAL HB H -3.857 4.389 -6.552 1.00 . A A . 12 VAL HB 1 1 8 3192 1 1 12 VAL HG11 H -4.522 7.312 -6.969 1.00 . A A . 12 VAL HG11 1 1 8 3193 1 1 12 VAL HG12 H -4.429 6.718 -5.322 1.00 . A A . 12 VAL HG12 1 1 8 3194 1 1 12 VAL HG13 H -3.041 6.574 -6.379 1.00 . A A . 12 VAL HG13 1 1 8 3195 1 1 12 VAL HG21 H -6.704 5.399 -6.533 1.00 . A A . 12 VAL HG21 1 1 8 3196 1 1 12 VAL HG22 H -6.125 3.757 -6.275 1.00 . A A . 12 VAL HG22 1 1 8 3197 1 1 12 VAL HG23 H -5.823 4.988 -5.064 1.00 . A A . 12 VAL HG23 1 1 8 3198 1 1 12 VAL N N -4.930 3.723 -8.830 1.00 . A A . 12 VAL N 1 1 8 3199 1 1 12 VAL O O -3.629 6.647 -9.792 1.00 . A A . 12 VAL O 1 1 8 3200 1 1 13 HIS C C -0.486 6.620 -8.684 1.00 . A A . 13 HIS C 1 1 8 3201 1 1 13 HIS CA C -1.109 5.366 -9.323 1.00 . A A . 13 HIS CA 1 1 8 3202 1 1 13 HIS CB C -1.246 5.541 -10.866 1.00 . A A . 13 HIS CB 1 1 8 3203 1 1 13 HIS CD2 C -2.538 3.193 -10.914 1.00 . A A . 13 HIS CD2 1 1 8 3204 1 1 13 HIS CE1 C -3.141 3.237 -12.894 1.00 . A A . 13 HIS CE1 1 1 8 3205 1 1 13 HIS CG C -2.067 4.380 -11.469 1.00 . A A . 13 HIS CG 1 1 8 3206 1 1 13 HIS H H -2.534 4.271 -8.150 1.00 . A A . 13 HIS H 1 1 8 3207 1 1 13 HIS HA H -0.448 4.534 -9.138 1.00 . A A . 13 HIS HA 1 1 8 3208 1 1 13 HIS HB2 H -1.732 6.475 -11.110 1.00 . A A . 13 HIS HB2 1 1 8 3209 1 1 13 HIS HB3 H -0.272 5.531 -11.323 1.00 . A A . 13 HIS HB3 1 1 8 3210 1 1 13 HIS HD1 H -2.316 5.025 -13.367 1.00 . A A . 13 HIS HD1 1 1 8 3211 1 1 13 HIS HD2 H -2.390 2.882 -9.889 1.00 . A A . 13 HIS HD2 1 1 8 3212 1 1 13 HIS HE1 H -3.588 2.966 -13.839 1.00 . A A . 13 HIS HE1 1 1 8 3213 1 1 13 HIS N N -2.456 5.029 -8.766 1.00 . A A . 13 HIS N 1 1 8 3214 1 1 13 HIS ND1 N -2.480 4.333 -12.693 1.00 . A A . 13 HIS ND1 1 1 8 3215 1 1 13 HIS NE2 N -3.201 2.498 -11.815 1.00 . A A . 13 HIS NE2 1 1 8 3216 1 1 13 HIS O O 0.709 6.816 -8.782 1.00 . A A . 13 HIS O 1 1 8 3217 1 1 14 HIS C C 0.298 8.312 -6.370 1.00 . A A . 14 HIS C 1 1 8 3218 1 1 14 HIS CA C -0.788 8.680 -7.386 1.00 . A A . 14 HIS CA 1 1 8 3219 1 1 14 HIS CB C -1.931 9.395 -6.651 1.00 . A A . 14 HIS CB 1 1 8 3220 1 1 14 HIS CD2 C -3.511 9.871 -8.710 1.00 . A A . 14 HIS CD2 1 1 8 3221 1 1 14 HIS CE1 C -3.525 11.941 -8.620 1.00 . A A . 14 HIS CE1 1 1 8 3222 1 1 14 HIS CG C -2.719 10.248 -7.645 1.00 . A A . 14 HIS CG 1 1 8 3223 1 1 14 HIS H H -2.249 7.213 -7.999 1.00 . A A . 14 HIS H 1 1 8 3224 1 1 14 HIS HA H -0.369 9.317 -8.146 1.00 . A A . 14 HIS HA 1 1 8 3225 1 1 14 HIS HB2 H -2.598 8.680 -6.195 1.00 . A A . 14 HIS HB2 1 1 8 3226 1 1 14 HIS HB3 H -1.535 10.040 -5.881 1.00 . A A . 14 HIS HB3 1 1 8 3227 1 1 14 HIS HD1 H -2.312 12.124 -7.009 1.00 . A A . 14 HIS HD1 1 1 8 3228 1 1 14 HIS HD2 H -3.690 8.851 -9.003 1.00 . A A . 14 HIS HD2 1 1 8 3229 1 1 14 HIS HE1 H -3.731 12.979 -8.838 1.00 . A A . 14 HIS HE1 1 1 8 3230 1 1 14 HIS N N -1.298 7.430 -8.046 1.00 . A A . 14 HIS N 1 1 8 3231 1 1 14 HIS ND1 N -2.772 11.539 -7.647 1.00 . A A . 14 HIS ND1 1 1 8 3232 1 1 14 HIS NE2 N -4.006 10.936 -9.309 1.00 . A A . 14 HIS NE2 1 1 8 3233 1 1 14 HIS O O 1.324 8.956 -6.276 1.00 . A A . 14 HIS O 1 1 8 3234 1 1 15 GLN C C 1.057 5.239 -4.876 1.00 . A A . 15 GLN C 1 1 8 3235 1 1 15 GLN CA C 0.903 6.720 -4.590 1.00 . A A . 15 GLN CA 1 1 8 3236 1 1 15 GLN CB C 0.300 6.882 -3.163 1.00 . A A . 15 GLN CB 1 1 8 3237 1 1 15 GLN CD C -2.186 7.139 -3.486 1.00 . A A . 15 GLN CD 1 1 8 3238 1 1 15 GLN CG C -0.886 7.870 -3.123 1.00 . A A . 15 GLN CG 1 1 8 3239 1 1 15 GLN H H -0.870 6.831 -5.807 1.00 . A A . 15 GLN H 1 1 8 3240 1 1 15 GLN HA H 1.882 7.164 -4.666 1.00 . A A . 15 GLN HA 1 1 8 3241 1 1 15 GLN HB2 H -0.044 5.923 -2.799 1.00 . A A . 15 GLN HB2 1 1 8 3242 1 1 15 GLN HB3 H 1.072 7.226 -2.495 1.00 . A A . 15 GLN HB3 1 1 8 3243 1 1 15 GLN HE21 H -3.318 8.518 -2.628 1.00 . A A . 15 GLN HE21 1 1 8 3244 1 1 15 GLN HE22 H -4.160 7.224 -3.339 1.00 . A A . 15 GLN HE22 1 1 8 3245 1 1 15 GLN HG2 H -0.987 8.268 -2.123 1.00 . A A . 15 GLN HG2 1 1 8 3246 1 1 15 GLN HG3 H -0.740 8.695 -3.805 1.00 . A A . 15 GLN HG3 1 1 8 3247 1 1 15 GLN N N -0.006 7.269 -5.646 1.00 . A A . 15 GLN N 1 1 8 3248 1 1 15 GLN NE2 N -3.317 7.671 -3.120 1.00 . A A . 15 GLN NE2 1 1 8 3249 1 1 15 GLN O O 2.081 4.650 -4.592 1.00 . A A . 15 GLN O 1 1 8 3250 1 1 15 GLN OE1 O -2.193 6.087 -4.097 1.00 . A A . 15 GLN OE1 1 1 8 3251 1 1 16 GLU C C 1.281 2.889 -6.564 1.00 . A A . 16 GLU C 1 1 8 3252 1 1 16 GLU CA C 0.018 3.243 -5.779 1.00 . A A . 16 GLU CA 1 1 8 3253 1 1 16 GLU CB C -1.215 2.941 -6.606 1.00 . A A . 16 GLU CB 1 1 8 3254 1 1 16 GLU CD C -2.629 1.124 -7.623 1.00 . A A . 16 GLU CD 1 1 8 3255 1 1 16 GLU CG C -1.337 1.429 -6.825 1.00 . A A . 16 GLU CG 1 1 8 3256 1 1 16 GLU H H -0.773 5.231 -5.636 1.00 . A A . 16 GLU H 1 1 8 3257 1 1 16 GLU HA H -0.005 2.690 -4.856 1.00 . A A . 16 GLU HA 1 1 8 3258 1 1 16 GLU HB2 H -2.089 3.324 -6.102 1.00 . A A . 16 GLU HB2 1 1 8 3259 1 1 16 GLU HB3 H -1.119 3.416 -7.564 1.00 . A A . 16 GLU HB3 1 1 8 3260 1 1 16 GLU HG2 H -0.471 1.088 -7.380 1.00 . A A . 16 GLU HG2 1 1 8 3261 1 1 16 GLU HG3 H -1.355 0.917 -5.875 1.00 . A A . 16 GLU HG3 1 1 8 3262 1 1 16 GLU N N 0.015 4.686 -5.438 1.00 . A A . 16 GLU N 1 1 8 3263 1 1 16 GLU O O 1.948 1.925 -6.241 1.00 . A A . 16 GLU O 1 1 8 3264 1 1 16 GLU OE1 O -3.672 1.612 -7.216 1.00 . A A . 16 GLU OE1 1 1 8 3265 1 1 16 GLU OE2 O -2.506 0.415 -8.607 1.00 . A A . 16 GLU OE2 1 1 8 3266 1 1 17 LEU C C 4.044 3.875 -7.653 1.00 . A A . 17 LEU C 1 1 8 3267 1 1 17 LEU CA C 2.793 3.387 -8.372 1.00 . A A . 17 LEU CA 1 1 8 3268 1 1 17 LEU CB C 2.632 4.049 -9.794 1.00 . A A . 17 LEU CB 1 1 8 3269 1 1 17 LEU CD1 C 4.881 5.204 -10.245 1.00 . A A . 17 LEU CD1 1 1 8 3270 1 1 17 LEU CD2 C 2.731 6.254 -11.041 1.00 . A A . 17 LEU CD2 1 1 8 3271 1 1 17 LEU CG C 3.369 5.408 -9.916 1.00 . A A . 17 LEU CG 1 1 8 3272 1 1 17 LEU H H 1.005 4.450 -7.783 1.00 . A A . 17 LEU H 1 1 8 3273 1 1 17 LEU HA H 2.876 2.332 -8.443 1.00 . A A . 17 LEU HA 1 1 8 3274 1 1 17 LEU HB2 H 3.013 3.366 -10.539 1.00 . A A . 17 LEU HB2 1 1 8 3275 1 1 17 LEU HB3 H 1.580 4.192 -9.994 1.00 . A A . 17 LEU HB3 1 1 8 3276 1 1 17 LEU HD11 H 5.104 4.163 -10.429 1.00 . A A . 17 LEU HD11 1 1 8 3277 1 1 17 LEU HD12 H 5.172 5.771 -11.117 1.00 . A A . 17 LEU HD12 1 1 8 3278 1 1 17 LEU HD13 H 5.482 5.540 -9.411 1.00 . A A . 17 LEU HD13 1 1 8 3279 1 1 17 LEU HD21 H 1.666 6.341 -10.903 1.00 . A A . 17 LEU HD21 1 1 8 3280 1 1 17 LEU HD22 H 3.159 7.246 -11.044 1.00 . A A . 17 LEU HD22 1 1 8 3281 1 1 17 LEU HD23 H 2.914 5.796 -12.003 1.00 . A A . 17 LEU HD23 1 1 8 3282 1 1 17 LEU HG H 3.262 5.898 -8.964 1.00 . A A . 17 LEU HG 1 1 8 3283 1 1 17 LEU N N 1.574 3.681 -7.568 1.00 . A A . 17 LEU N 1 1 8 3284 1 1 17 LEU O O 5.139 3.428 -7.920 1.00 . A A . 17 LEU O 1 1 8 3285 1 1 18 VAL C C 5.529 4.214 -5.062 1.00 . A A . 18 VAL C 1 1 8 3286 1 1 18 VAL CA C 5.031 5.313 -5.987 1.00 . A A . 18 VAL CA 1 1 8 3287 1 1 18 VAL CB C 4.584 6.535 -5.205 1.00 . A A . 18 VAL CB 1 1 8 3288 1 1 18 VAL CG1 C 5.795 7.153 -4.482 1.00 . A A . 18 VAL CG1 1 1 8 3289 1 1 18 VAL CG2 C 4.019 7.505 -6.246 1.00 . A A . 18 VAL CG2 1 1 8 3290 1 1 18 VAL H H 2.960 5.119 -6.547 1.00 . A A . 18 VAL H 1 1 8 3291 1 1 18 VAL HA H 5.816 5.566 -6.687 1.00 . A A . 18 VAL HA 1 1 8 3292 1 1 18 VAL HB H 3.832 6.271 -4.479 1.00 . A A . 18 VAL HB 1 1 8 3293 1 1 18 VAL HG11 H 6.654 7.181 -5.136 1.00 . A A . 18 VAL HG11 1 1 8 3294 1 1 18 VAL HG12 H 5.566 8.154 -4.150 1.00 . A A . 18 VAL HG12 1 1 8 3295 1 1 18 VAL HG13 H 6.040 6.551 -3.617 1.00 . A A . 18 VAL HG13 1 1 8 3296 1 1 18 VAL HG21 H 4.716 7.609 -7.066 1.00 . A A . 18 VAL HG21 1 1 8 3297 1 1 18 VAL HG22 H 3.094 7.101 -6.638 1.00 . A A . 18 VAL HG22 1 1 8 3298 1 1 18 VAL HG23 H 3.829 8.467 -5.803 1.00 . A A . 18 VAL HG23 1 1 8 3299 1 1 18 VAL N N 3.860 4.785 -6.740 1.00 . A A . 18 VAL N 1 1 8 3300 1 1 18 VAL O O 6.653 4.257 -4.607 1.00 . A A . 18 VAL O 1 1 8 3301 1 1 19 PHE C C 6.011 1.257 -4.727 1.00 . A A . 19 PHE C 1 1 8 3302 1 1 19 PHE CA C 5.032 2.124 -3.930 1.00 . A A . 19 PHE CA 1 1 8 3303 1 1 19 PHE CB C 3.788 1.294 -3.582 1.00 . A A . 19 PHE CB 1 1 8 3304 1 1 19 PHE CD1 C 2.961 3.296 -2.214 1.00 . A A . 19 PHE CD1 1 1 8 3305 1 1 19 PHE CD2 C 1.374 1.700 -3.000 1.00 . A A . 19 PHE CD2 1 1 8 3306 1 1 19 PHE CE1 C 1.945 4.012 -1.614 1.00 . A A . 19 PHE CE1 1 1 8 3307 1 1 19 PHE CE2 C 0.359 2.416 -2.398 1.00 . A A . 19 PHE CE2 1 1 8 3308 1 1 19 PHE CG C 2.684 2.132 -2.913 1.00 . A A . 19 PHE CG 1 1 8 3309 1 1 19 PHE CZ C 0.644 3.572 -1.706 1.00 . A A . 19 PHE CZ 1 1 8 3310 1 1 19 PHE H H 3.771 3.300 -5.221 1.00 . A A . 19 PHE H 1 1 8 3311 1 1 19 PHE HA H 5.519 2.516 -3.051 1.00 . A A . 19 PHE HA 1 1 8 3312 1 1 19 PHE HB2 H 3.389 0.845 -4.480 1.00 . A A . 19 PHE HB2 1 1 8 3313 1 1 19 PHE HB3 H 4.068 0.502 -2.902 1.00 . A A . 19 PHE HB3 1 1 8 3314 1 1 19 PHE HD1 H 3.976 3.654 -2.142 1.00 . A A . 19 PHE HD1 1 1 8 3315 1 1 19 PHE HD2 H 1.143 0.799 -3.552 1.00 . A A . 19 PHE HD2 1 1 8 3316 1 1 19 PHE HE1 H 2.173 4.918 -1.071 1.00 . A A . 19 PHE HE1 1 1 8 3317 1 1 19 PHE HE2 H -0.661 2.070 -2.471 1.00 . A A . 19 PHE HE2 1 1 8 3318 1 1 19 PHE HZ H -0.152 4.130 -1.234 1.00 . A A . 19 PHE HZ 1 1 8 3319 1 1 19 PHE N N 4.663 3.262 -4.816 1.00 . A A . 19 PHE N 1 1 8 3320 1 1 19 PHE O O 6.826 0.542 -4.179 1.00 . A A . 19 PHE O 1 1 8 3321 1 1 20 PHE C C 8.053 1.397 -7.042 1.00 . A A . 20 PHE C 1 1 8 3322 1 1 20 PHE CA C 6.756 0.603 -6.950 1.00 . A A . 20 PHE CA 1 1 8 3323 1 1 20 PHE CB C 6.081 0.498 -8.321 1.00 . A A . 20 PHE CB 1 1 8 3324 1 1 20 PHE CD1 C 6.811 -1.801 -9.102 1.00 . A A . 20 PHE CD1 1 1 8 3325 1 1 20 PHE CD2 C 7.845 0.104 -10.100 1.00 . A A . 20 PHE CD2 1 1 8 3326 1 1 20 PHE CE1 C 7.585 -2.632 -9.886 1.00 . A A . 20 PHE CE1 1 1 8 3327 1 1 20 PHE CE2 C 8.619 -0.727 -10.883 1.00 . A A . 20 PHE CE2 1 1 8 3328 1 1 20 PHE CG C 6.936 -0.428 -9.202 1.00 . A A . 20 PHE CG 1 1 8 3329 1 1 20 PHE CZ C 8.489 -2.095 -10.777 1.00 . A A . 20 PHE CZ 1 1 8 3330 1 1 20 PHE H H 5.199 1.994 -6.379 1.00 . A A . 20 PHE H 1 1 8 3331 1 1 20 PHE HA H 6.954 -0.375 -6.533 1.00 . A A . 20 PHE HA 1 1 8 3332 1 1 20 PHE HB2 H 5.088 0.087 -8.213 1.00 . A A . 20 PHE HB2 1 1 8 3333 1 1 20 PHE HB3 H 6.008 1.467 -8.790 1.00 . A A . 20 PHE HB3 1 1 8 3334 1 1 20 PHE HD1 H 6.104 -2.228 -8.407 1.00 . A A . 20 PHE HD1 1 1 8 3335 1 1 20 PHE HD2 H 7.953 1.175 -10.189 1.00 . A A . 20 PHE HD2 1 1 8 3336 1 1 20 PHE HE1 H 7.482 -3.703 -9.801 1.00 . A A . 20 PHE HE1 1 1 8 3337 1 1 20 PHE HE2 H 9.327 -0.305 -11.582 1.00 . A A . 20 PHE HE2 1 1 8 3338 1 1 20 PHE HZ H 9.095 -2.745 -11.391 1.00 . A A . 20 PHE HZ 1 1 8 3339 1 1 20 PHE N N 5.880 1.377 -6.025 1.00 . A A . 20 PHE N 1 1 8 3340 1 1 20 PHE O O 9.131 0.863 -6.910 1.00 . A A . 20 PHE O 1 1 8 3341 1 1 21 ALA C C 9.851 3.484 -6.045 1.00 . A A . 21 ALA C 1 1 8 3342 1 1 21 ALA CA C 9.096 3.566 -7.370 1.00 . A A . 21 ALA CA 1 1 8 3343 1 1 21 ALA CB C 8.627 4.998 -7.630 1.00 . A A . 21 ALA CB 1 1 8 3344 1 1 21 ALA H H 7.012 3.047 -7.363 1.00 . A A . 21 ALA H 1 1 8 3345 1 1 21 ALA HA H 9.739 3.196 -8.154 1.00 . A A . 21 ALA HA 1 1 8 3346 1 1 21 ALA HB1 H 7.939 5.016 -8.463 1.00 . A A . 21 ALA HB1 1 1 8 3347 1 1 21 ALA HB2 H 8.126 5.390 -6.756 1.00 . A A . 21 ALA HB2 1 1 8 3348 1 1 21 ALA HB3 H 9.474 5.629 -7.859 1.00 . A A . 21 ALA HB3 1 1 8 3349 1 1 21 ALA N N 7.907 2.677 -7.266 1.00 . A A . 21 ALA N 1 1 8 3350 1 1 21 ALA O O 11.043 3.718 -6.002 1.00 . A A . 21 ALA O 1 1 8 3351 1 1 22 GLU C C 10.488 1.708 -3.596 1.00 . A A . 22 GLU C 1 1 8 3352 1 1 22 GLU CA C 9.691 3.021 -3.657 1.00 . A A . 22 GLU CA 1 1 8 3353 1 1 22 GLU CB C 8.517 3.052 -2.633 1.00 . A A . 22 GLU CB 1 1 8 3354 1 1 22 GLU CD C 8.170 0.862 -1.421 1.00 . A A . 22 GLU CD 1 1 8 3355 1 1 22 GLU CG C 8.801 2.266 -1.323 1.00 . A A . 22 GLU CG 1 1 8 3356 1 1 22 GLU H H 8.142 2.989 -5.147 1.00 . A A . 22 GLU H 1 1 8 3357 1 1 22 GLU HA H 10.352 3.852 -3.511 1.00 . A A . 22 GLU HA 1 1 8 3358 1 1 22 GLU HB2 H 8.314 4.082 -2.377 1.00 . A A . 22 GLU HB2 1 1 8 3359 1 1 22 GLU HB3 H 7.636 2.651 -3.101 1.00 . A A . 22 GLU HB3 1 1 8 3360 1 1 22 GLU HG2 H 9.861 2.177 -1.134 1.00 . A A . 22 GLU HG2 1 1 8 3361 1 1 22 GLU HG3 H 8.354 2.785 -0.488 1.00 . A A . 22 GLU HG3 1 1 8 3362 1 1 22 GLU N N 9.105 3.150 -5.017 1.00 . A A . 22 GLU N 1 1 8 3363 1 1 22 GLU O O 11.544 1.654 -2.994 1.00 . A A . 22 GLU O 1 1 8 3364 1 1 22 GLU OE1 O 6.955 0.805 -1.304 1.00 . A A . 22 GLU OE1 1 1 8 3365 1 1 22 GLU OE2 O 8.930 -0.072 -1.607 1.00 . A A . 22 GLU OE2 1 1 8 3366 1 1 23 ASP C C 11.941 -0.489 -5.025 1.00 . A A . 23 ASP C 1 1 8 3367 1 1 23 ASP CA C 10.623 -0.645 -4.253 1.00 . A A . 23 ASP CA 1 1 8 3368 1 1 23 ASP CB C 9.629 -1.672 -4.921 1.00 . A A . 23 ASP CB 1 1 8 3369 1 1 23 ASP CG C 10.058 -2.172 -6.322 1.00 . A A . 23 ASP CG 1 1 8 3370 1 1 23 ASP H H 9.098 0.830 -4.689 1.00 . A A . 23 ASP H 1 1 8 3371 1 1 23 ASP HA H 10.844 -0.946 -3.238 1.00 . A A . 23 ASP HA 1 1 8 3372 1 1 23 ASP HB2 H 9.543 -2.533 -4.274 1.00 . A A . 23 ASP HB2 1 1 8 3373 1 1 23 ASP HB3 H 8.647 -1.226 -4.996 1.00 . A A . 23 ASP HB3 1 1 8 3374 1 1 23 ASP N N 9.951 0.694 -4.228 1.00 . A A . 23 ASP N 1 1 8 3375 1 1 23 ASP O O 12.983 -0.931 -4.580 1.00 . A A . 23 ASP O 1 1 8 3376 1 1 23 ASP OD1 O 11.037 -2.898 -6.373 1.00 . A A . 23 ASP OD1 1 1 8 3377 1 1 23 ASP OD2 O 9.381 -1.805 -7.268 1.00 . A A . 23 ASP OD2 1 1 8 3378 1 1 24 VAL C C 13.927 1.432 -6.350 1.00 . A A . 24 VAL C 1 1 8 3379 1 1 24 VAL CA C 13.021 0.386 -7.040 1.00 . A A . 24 VAL CA 1 1 8 3380 1 1 24 VAL CB C 12.506 0.898 -8.416 1.00 . A A . 24 VAL CB 1 1 8 3381 1 1 24 VAL CG1 C 13.691 1.143 -9.380 1.00 . A A . 24 VAL CG1 1 1 8 3382 1 1 24 VAL CG2 C 11.549 -0.153 -9.036 1.00 . A A . 24 VAL CG2 1 1 8 3383 1 1 24 VAL H H 10.952 0.454 -6.449 1.00 . A A . 24 VAL H 1 1 8 3384 1 1 24 VAL HA H 13.571 -0.537 -7.156 1.00 . A A . 24 VAL HA 1 1 8 3385 1 1 24 VAL HB H 11.969 1.825 -8.273 1.00 . A A . 24 VAL HB 1 1 8 3386 1 1 24 VAL HG11 H 14.498 0.452 -9.184 1.00 . A A . 24 VAL HG11 1 1 8 3387 1 1 24 VAL HG12 H 13.384 1.034 -10.410 1.00 . A A . 24 VAL HG12 1 1 8 3388 1 1 24 VAL HG13 H 14.051 2.150 -9.244 1.00 . A A . 24 VAL HG13 1 1 8 3389 1 1 24 VAL HG21 H 11.833 -1.153 -8.740 1.00 . A A . 24 VAL HG21 1 1 8 3390 1 1 24 VAL HG22 H 10.541 0.033 -8.702 1.00 . A A . 24 VAL HG22 1 1 8 3391 1 1 24 VAL HG23 H 11.558 -0.098 -10.115 1.00 . A A . 24 VAL HG23 1 1 8 3392 1 1 24 VAL N N 11.834 0.142 -6.167 1.00 . A A . 24 VAL N 1 1 8 3393 1 1 24 VAL O O 15.088 1.576 -6.678 1.00 . A A . 24 VAL O 1 1 8 3394 1 1 25 GLY C C 14.694 4.227 -5.587 1.00 . A A . 25 GLY C 1 1 8 3395 1 1 25 GLY CA C 14.101 3.184 -4.642 1.00 . A A . 25 GLY CA 1 1 8 3396 1 1 25 GLY H H 12.408 1.976 -5.194 1.00 . A A . 25 GLY H 1 1 8 3397 1 1 25 GLY HA2 H 13.422 3.673 -3.959 1.00 . A A . 25 GLY HA2 1 1 8 3398 1 1 25 GLY HA3 H 14.896 2.713 -4.082 1.00 . A A . 25 GLY HA3 1 1 8 3399 1 1 25 GLY N N 13.352 2.137 -5.403 1.00 . A A . 25 GLY N 1 1 8 3400 1 1 25 GLY O O 15.877 4.505 -5.542 1.00 . A A . 25 GLY O 1 1 8 3401 1 1 26 SER C C 15.432 5.323 -8.277 1.00 . A A . 26 SER C 1 1 8 3402 1 1 26 SER CA C 14.241 5.806 -7.420 1.00 . A A . 26 SER CA 1 1 8 3403 1 1 26 SER CB C 14.605 7.100 -6.648 1.00 . A A . 26 SER CB 1 1 8 3404 1 1 26 SER H H 12.906 4.466 -6.366 1.00 . A A . 26 SER H 1 1 8 3405 1 1 26 SER HA H 13.401 5.988 -8.075 1.00 . A A . 26 SER HA 1 1 8 3406 1 1 26 SER HB2 H 13.855 7.344 -5.910 1.00 . A A . 26 SER HB2 1 1 8 3407 1 1 26 SER HB3 H 15.577 7.036 -6.181 1.00 . A A . 26 SER HB3 1 1 8 3408 1 1 26 SER HG H 15.508 8.487 -7.670 1.00 . A A . 26 SER HG 1 1 8 3409 1 1 26 SER N N 13.836 4.764 -6.417 1.00 . A A . 26 SER N 1 1 8 3410 1 1 26 SER O O 16.240 6.112 -8.727 1.00 . A A . 26 SER O 1 1 8 3411 1 1 26 SER OG O 14.625 8.113 -7.645 1.00 . A A . 26 SER OG 1 1 8 3412 1 1 27 ASN C C 17.882 3.329 -8.498 1.00 . A A . 27 ASN C 1 1 8 3413 1 1 27 ASN CA C 16.549 3.336 -9.265 1.00 . A A . 27 ASN CA 1 1 8 3414 1 1 27 ASN CB C 16.727 4.050 -10.650 1.00 . A A . 27 ASN CB 1 1 8 3415 1 1 27 ASN CG C 15.352 4.291 -11.286 1.00 . A A . 27 ASN CG 1 1 8 3416 1 1 27 ASN H H 14.775 3.480 -8.059 1.00 . A A . 27 ASN H 1 1 8 3417 1 1 27 ASN HA H 16.251 2.311 -9.425 1.00 . A A . 27 ASN HA 1 1 8 3418 1 1 27 ASN HB2 H 17.242 4.993 -10.551 1.00 . A A . 27 ASN HB2 1 1 8 3419 1 1 27 ASN HB3 H 17.300 3.416 -11.311 1.00 . A A . 27 ASN HB3 1 1 8 3420 1 1 27 ASN HD21 H 15.395 6.244 -10.936 1.00 . A A . 27 ASN HD21 1 1 8 3421 1 1 27 ASN HD22 H 14.000 5.678 -11.719 1.00 . A A . 27 ASN HD22 1 1 8 3422 1 1 27 ASN N N 15.480 4.025 -8.466 1.00 . A A . 27 ASN N 1 1 8 3423 1 1 27 ASN ND2 N 14.875 5.505 -11.317 1.00 . A A . 27 ASN ND2 1 1 8 3424 1 1 27 ASN O O 18.903 3.790 -8.969 1.00 . A A . 27 ASN O 1 1 8 3425 1 1 27 ASN OD1 O 14.701 3.380 -11.759 1.00 . A A . 27 ASN OD1 1 1 8 3426 1 1 28 LYS C C 18.699 1.461 -5.448 1.00 . A A . 28 LYS C 1 1 8 3427 1 1 28 LYS CA C 18.961 2.660 -6.380 1.00 . A A . 28 LYS CA 1 1 8 3428 1 1 28 LYS CB C 19.123 3.933 -5.504 1.00 . A A . 28 LYS CB 1 1 8 3429 1 1 28 LYS CD C 18.641 6.141 -6.651 1.00 . A A . 28 LYS CD 1 1 8 3430 1 1 28 LYS CE C 19.046 6.961 -7.891 1.00 . A A . 28 LYS CE 1 1 8 3431 1 1 28 LYS CG C 19.738 5.105 -6.311 1.00 . A A . 28 LYS CG 1 1 8 3432 1 1 28 LYS H H 16.924 2.435 -7.028 1.00 . A A . 28 LYS H 1 1 8 3433 1 1 28 LYS HA H 19.857 2.474 -6.957 1.00 . A A . 28 LYS HA 1 1 8 3434 1 1 28 LYS HB2 H 18.175 4.212 -5.074 1.00 . A A . 28 LYS HB2 1 1 8 3435 1 1 28 LYS HB3 H 19.794 3.703 -4.688 1.00 . A A . 28 LYS HB3 1 1 8 3436 1 1 28 LYS HD2 H 17.708 5.635 -6.847 1.00 . A A . 28 LYS HD2 1 1 8 3437 1 1 28 LYS HD3 H 18.496 6.806 -5.812 1.00 . A A . 28 LYS HD3 1 1 8 3438 1 1 28 LYS HE2 H 19.210 6.313 -8.739 1.00 . A A . 28 LYS HE2 1 1 8 3439 1 1 28 LYS HE3 H 18.263 7.662 -8.137 1.00 . A A . 28 LYS HE3 1 1 8 3440 1 1 28 LYS HG2 H 20.492 5.585 -5.705 1.00 . A A . 28 LYS HG2 1 1 8 3441 1 1 28 LYS HG3 H 20.215 4.742 -7.209 1.00 . A A . 28 LYS HG3 1 1 8 3442 1 1 28 LYS HZ1 H 20.618 7.540 -6.653 1.00 . A A . 28 LYS HZ1 1 1 8 3443 1 1 28 LYS HZ2 H 21.031 7.432 -8.297 1.00 . A A . 28 LYS HZ2 1 1 8 3444 1 1 28 LYS HZ3 H 20.111 8.744 -7.738 1.00 . A A . 28 LYS HZ3 1 1 8 3445 1 1 28 LYS N N 17.793 2.783 -7.311 1.00 . A A . 28 LYS N 1 1 8 3446 1 1 28 LYS NZ N 20.296 7.727 -7.624 1.00 . A A . 28 LYS NZ 1 1 8 3447 1 1 28 LYS O O 17.568 1.358 -4.993 1.00 . A A . 28 LYS O 1 1 8 3448 1 1 28 LYS OXT O 19.643 0.716 -5.242 1.00 . A A . 28 LYS OXT 1 1 9 3449 1 1 1 ASP C C -15.565 9.131 -0.887 1.00 . A A . 1 ASP C 1 1 9 3450 1 1 1 ASP CA C -16.853 9.179 -0.059 1.00 . A A . 1 ASP CA 1 1 9 3451 1 1 1 ASP CB C -17.299 7.736 0.243 1.00 . A A . 1 ASP CB 1 1 9 3452 1 1 1 ASP CG C -18.569 7.772 1.108 1.00 . A A . 1 ASP CG 1 1 9 3453 1 1 1 ASP H1 H -17.542 10.223 -1.728 1.00 . A A . 1 ASP H1 1 1 9 3454 1 1 1 ASP H2 H -18.726 9.271 -0.968 1.00 . A A . 1 ASP H2 1 1 9 3455 1 1 1 ASP H3 H -18.227 10.731 -0.259 1.00 . A A . 1 ASP H3 1 1 9 3456 1 1 1 ASP HA H -16.658 9.711 0.861 1.00 . A A . 1 ASP HA 1 1 9 3457 1 1 1 ASP HB2 H -17.508 7.207 -0.677 1.00 . A A . 1 ASP HB2 1 1 9 3458 1 1 1 ASP HB3 H -16.519 7.208 0.776 1.00 . A A . 1 ASP HB3 1 1 9 3459 1 1 1 ASP N N -17.917 9.906 -0.811 1.00 . A A . 1 ASP N 1 1 9 3460 1 1 1 ASP O O -15.599 9.206 -2.100 1.00 . A A . 1 ASP O 1 1 9 3461 1 1 1 ASP OD1 O -18.404 7.792 2.318 1.00 . A A . 1 ASP OD1 1 1 9 3462 1 1 1 ASP OD2 O -19.634 7.778 0.511 1.00 . A A . 1 ASP OD2 1 1 9 3463 1 1 2 ALA C C -13.017 7.672 -1.733 1.00 . A A . 2 ALA C 1 1 9 3464 1 1 2 ALA CA C -13.128 8.941 -0.871 1.00 . A A . 2 ALA CA 1 1 9 3465 1 1 2 ALA CB C -12.030 8.939 0.197 1.00 . A A . 2 ALA CB 1 1 9 3466 1 1 2 ALA H H -14.509 8.949 0.785 1.00 . A A . 2 ALA H 1 1 9 3467 1 1 2 ALA HA H -13.018 9.808 -1.508 1.00 . A A . 2 ALA HA 1 1 9 3468 1 1 2 ALA HB1 H -12.164 8.102 0.867 1.00 . A A . 2 ALA HB1 1 1 9 3469 1 1 2 ALA HB2 H -11.058 8.860 -0.268 1.00 . A A . 2 ALA HB2 1 1 9 3470 1 1 2 ALA HB3 H -12.068 9.853 0.768 1.00 . A A . 2 ALA HB3 1 1 9 3471 1 1 2 ALA N N -14.461 9.004 -0.193 1.00 . A A . 2 ALA N 1 1 9 3472 1 1 2 ALA O O -12.253 7.631 -2.679 1.00 . A A . 2 ALA O 1 1 9 3473 1 1 3 GLU C C -12.485 4.661 -1.953 1.00 . A A . 3 GLU C 1 1 9 3474 1 1 3 GLU CA C -13.834 5.368 -2.063 1.00 . A A . 3 GLU CA 1 1 9 3475 1 1 3 GLU CB C -14.199 5.574 -3.568 1.00 . A A . 3 GLU CB 1 1 9 3476 1 1 3 GLU CD C -14.442 3.105 -4.395 1.00 . A A . 3 GLU CD 1 1 9 3477 1 1 3 GLU CG C -15.153 4.438 -4.034 1.00 . A A . 3 GLU CG 1 1 9 3478 1 1 3 GLU H H -14.376 6.802 -0.583 1.00 . A A . 3 GLU H 1 1 9 3479 1 1 3 GLU HA H -14.583 4.760 -1.577 1.00 . A A . 3 GLU HA 1 1 9 3480 1 1 3 GLU HB2 H -14.713 6.518 -3.684 1.00 . A A . 3 GLU HB2 1 1 9 3481 1 1 3 GLU HB3 H -13.318 5.596 -4.194 1.00 . A A . 3 GLU HB3 1 1 9 3482 1 1 3 GLU HG2 H -15.875 4.238 -3.258 1.00 . A A . 3 GLU HG2 1 1 9 3483 1 1 3 GLU HG3 H -15.688 4.784 -4.905 1.00 . A A . 3 GLU HG3 1 1 9 3484 1 1 3 GLU N N -13.794 6.682 -1.360 1.00 . A A . 3 GLU N 1 1 9 3485 1 1 3 GLU O O -11.541 4.984 -2.645 1.00 . A A . 3 GLU O 1 1 9 3486 1 1 3 GLU OE1 O -13.263 2.947 -4.115 1.00 . A A . 3 GLU OE1 1 1 9 3487 1 1 3 GLU OE2 O -15.154 2.286 -4.953 1.00 . A A . 3 GLU OE2 1 1 9 3488 1 1 4 PHE C C -11.532 1.646 -0.058 1.00 . A A . 4 PHE C 1 1 9 3489 1 1 4 PHE CA C -11.206 2.919 -0.833 1.00 . A A . 4 PHE CA 1 1 9 3490 1 1 4 PHE CB C -10.161 3.793 -0.057 1.00 . A A . 4 PHE CB 1 1 9 3491 1 1 4 PHE CD1 C -11.738 5.182 1.409 1.00 . A A . 4 PHE CD1 1 1 9 3492 1 1 4 PHE CD2 C -9.968 3.983 2.457 1.00 . A A . 4 PHE CD2 1 1 9 3493 1 1 4 PHE CE1 C -12.142 5.659 2.639 1.00 . A A . 4 PHE CE1 1 1 9 3494 1 1 4 PHE CE2 C -10.370 4.460 3.688 1.00 . A A . 4 PHE CE2 1 1 9 3495 1 1 4 PHE CG C -10.645 4.337 1.304 1.00 . A A . 4 PHE CG 1 1 9 3496 1 1 4 PHE CZ C -11.457 5.299 3.779 1.00 . A A . 4 PHE CZ 1 1 9 3497 1 1 4 PHE H H -13.262 3.524 -0.546 1.00 . A A . 4 PHE H 1 1 9 3498 1 1 4 PHE HA H -10.804 2.632 -1.792 1.00 . A A . 4 PHE HA 1 1 9 3499 1 1 4 PHE HB2 H -9.272 3.201 0.104 1.00 . A A . 4 PHE HB2 1 1 9 3500 1 1 4 PHE HB3 H -9.883 4.636 -0.672 1.00 . A A . 4 PHE HB3 1 1 9 3501 1 1 4 PHE HD1 H -12.285 5.480 0.529 1.00 . A A . 4 PHE HD1 1 1 9 3502 1 1 4 PHE HD2 H -9.113 3.326 2.399 1.00 . A A . 4 PHE HD2 1 1 9 3503 1 1 4 PHE HE1 H -12.996 6.317 2.707 1.00 . A A . 4 PHE HE1 1 1 9 3504 1 1 4 PHE HE2 H -9.830 4.175 4.580 1.00 . A A . 4 PHE HE2 1 1 9 3505 1 1 4 PHE HZ H -11.773 5.673 4.742 1.00 . A A . 4 PHE HZ 1 1 9 3506 1 1 4 PHE N N -12.451 3.710 -1.062 1.00 . A A . 4 PHE N 1 1 9 3507 1 1 4 PHE O O -10.965 0.612 -0.349 1.00 . A A . 4 PHE O 1 1 9 3508 1 1 5 ARG C C -13.701 -0.393 0.877 1.00 . A A . 5 ARG C 1 1 9 3509 1 1 5 ARG CA C -12.806 0.527 1.698 1.00 . A A . 5 ARG CA 1 1 9 3510 1 1 5 ARG CB C -13.550 0.959 2.972 1.00 . A A . 5 ARG CB 1 1 9 3511 1 1 5 ARG CD C -11.448 1.276 4.344 1.00 . A A . 5 ARG CD 1 1 9 3512 1 1 5 ARG CG C -12.704 1.969 3.758 1.00 . A A . 5 ARG CG 1 1 9 3513 1 1 5 ARG CZ C -9.407 0.365 3.315 1.00 . A A . 5 ARG CZ 1 1 9 3514 1 1 5 ARG H H -12.846 2.606 1.087 1.00 . A A . 5 ARG H 1 1 9 3515 1 1 5 ARG HA H -11.919 -0.027 1.898 1.00 . A A . 5 ARG HA 1 1 9 3516 1 1 5 ARG HB2 H -14.493 1.415 2.705 1.00 . A A . 5 ARG HB2 1 1 9 3517 1 1 5 ARG HB3 H -13.755 0.095 3.589 1.00 . A A . 5 ARG HB3 1 1 9 3518 1 1 5 ARG HD2 H -11.040 1.855 5.159 1.00 . A A . 5 ARG HD2 1 1 9 3519 1 1 5 ARG HD3 H -11.692 0.285 4.698 1.00 . A A . 5 ARG HD3 1 1 9 3520 1 1 5 ARG HE H -10.521 1.756 2.464 1.00 . A A . 5 ARG HE 1 1 9 3521 1 1 5 ARG HG2 H -12.421 2.775 3.097 1.00 . A A . 5 ARG HG2 1 1 9 3522 1 1 5 ARG HG3 H -13.311 2.377 4.550 1.00 . A A . 5 ARG HG3 1 1 9 3523 1 1 5 ARG HH11 H -9.888 -0.404 5.105 1.00 . A A . 5 ARG HH11 1 1 9 3524 1 1 5 ARG HH12 H -8.455 -1.042 4.373 1.00 . A A . 5 ARG HH12 1 1 9 3525 1 1 5 ARG HH21 H -8.720 0.971 1.535 1.00 . A A . 5 ARG HH21 1 1 9 3526 1 1 5 ARG HH22 H -7.783 -0.254 2.322 1.00 . A A . 5 ARG HH22 1 1 9 3527 1 1 5 ARG N N -12.426 1.741 0.896 1.00 . A A . 5 ARG N 1 1 9 3528 1 1 5 ARG NE N -10.425 1.184 3.254 1.00 . A A . 5 ARG NE 1 1 9 3529 1 1 5 ARG NH1 N -9.239 -0.421 4.345 1.00 . A A . 5 ARG NH1 1 1 9 3530 1 1 5 ARG NH2 N -8.572 0.361 2.313 1.00 . A A . 5 ARG NH2 1 1 9 3531 1 1 5 ARG O O -13.994 -1.515 1.239 1.00 . A A . 5 ARG O 1 1 9 3532 1 1 6 HIS C C -14.260 -1.744 -1.764 1.00 . A A . 6 HIS C 1 1 9 3533 1 1 6 HIS CA C -14.967 -0.494 -1.227 1.00 . A A . 6 HIS CA 1 1 9 3534 1 1 6 HIS CB C -15.240 0.476 -2.378 1.00 . A A . 6 HIS CB 1 1 9 3535 1 1 6 HIS CD2 C -15.924 2.526 -0.830 1.00 . A A . 6 HIS CD2 1 1 9 3536 1 1 6 HIS CE1 C -17.678 3.053 -1.801 1.00 . A A . 6 HIS CE1 1 1 9 3537 1 1 6 HIS CG C -16.095 1.652 -1.891 1.00 . A A . 6 HIS CG 1 1 9 3538 1 1 6 HIS H H -13.762 1.082 -0.364 1.00 . A A . 6 HIS H 1 1 9 3539 1 1 6 HIS HA H -15.887 -0.777 -0.741 1.00 . A A . 6 HIS HA 1 1 9 3540 1 1 6 HIS HB2 H -14.306 0.863 -2.760 1.00 . A A . 6 HIS HB2 1 1 9 3541 1 1 6 HIS HB3 H -15.763 -0.028 -3.177 1.00 . A A . 6 HIS HB3 1 1 9 3542 1 1 6 HIS HD1 H -17.605 1.625 -3.233 1.00 . A A . 6 HIS HD1 1 1 9 3543 1 1 6 HIS HD2 H -15.097 2.502 -0.136 1.00 . A A . 6 HIS HD2 1 1 9 3544 1 1 6 HIS HE1 H -18.594 3.559 -2.066 1.00 . A A . 6 HIS HE1 1 1 9 3545 1 1 6 HIS N N -14.088 0.173 -0.226 1.00 . A A . 6 HIS N 1 1 9 3546 1 1 6 HIS ND1 N -17.196 2.038 -2.445 1.00 . A A . 6 HIS ND1 1 1 9 3547 1 1 6 HIS NE2 N -16.918 3.391 -0.788 1.00 . A A . 6 HIS NE2 1 1 9 3548 1 1 6 HIS O O -14.893 -2.658 -2.256 1.00 . A A . 6 HIS O 1 1 9 3549 1 1 7 ASP C C -10.955 -3.082 -1.117 1.00 . A A . 7 ASP C 1 1 9 3550 1 1 7 ASP CA C -12.101 -2.853 -2.112 1.00 . A A . 7 ASP CA 1 1 9 3551 1 1 7 ASP CB C -11.551 -2.503 -3.519 1.00 . A A . 7 ASP CB 1 1 9 3552 1 1 7 ASP CG C -12.679 -1.911 -4.392 1.00 . A A . 7 ASP CG 1 1 9 3553 1 1 7 ASP H H -12.511 -0.957 -1.241 1.00 . A A . 7 ASP H 1 1 9 3554 1 1 7 ASP HA H -12.703 -3.740 -2.117 1.00 . A A . 7 ASP HA 1 1 9 3555 1 1 7 ASP HB2 H -10.750 -1.783 -3.434 1.00 . A A . 7 ASP HB2 1 1 9 3556 1 1 7 ASP HB3 H -11.164 -3.392 -3.995 1.00 . A A . 7 ASP HB3 1 1 9 3557 1 1 7 ASP N N -12.953 -1.726 -1.646 1.00 . A A . 7 ASP N 1 1 9 3558 1 1 7 ASP O O -9.951 -3.686 -1.439 1.00 . A A . 7 ASP O 1 1 9 3559 1 1 7 ASP OD1 O -13.381 -2.713 -4.984 1.00 . A A . 7 ASP OD1 1 1 9 3560 1 1 7 ASP OD2 O -12.780 -0.693 -4.417 1.00 . A A . 7 ASP OD2 1 1 9 3561 1 1 8 SER C C -8.763 -2.312 0.748 1.00 . A A . 8 SER C 1 1 9 3562 1 1 8 SER CA C -10.186 -2.687 1.200 1.00 . A A . 8 SER CA 1 1 9 3563 1 1 8 SER CB C -10.235 -4.141 1.738 1.00 . A A . 8 SER CB 1 1 9 3564 1 1 8 SER H H -12.018 -2.113 0.220 1.00 . A A . 8 SER H 1 1 9 3565 1 1 8 SER HA H -10.489 -2.000 1.976 1.00 . A A . 8 SER HA 1 1 9 3566 1 1 8 SER HB2 H -11.252 -4.468 1.897 1.00 . A A . 8 SER HB2 1 1 9 3567 1 1 8 SER HB3 H -9.725 -4.830 1.079 1.00 . A A . 8 SER HB3 1 1 9 3568 1 1 8 SER HG H -9.228 -3.208 3.136 1.00 . A A . 8 SER HG 1 1 9 3569 1 1 8 SER N N -11.171 -2.579 0.074 1.00 . A A . 8 SER N 1 1 9 3570 1 1 8 SER O O -7.794 -2.976 1.067 1.00 . A A . 8 SER O 1 1 9 3571 1 1 8 SER OG O -9.560 -4.097 2.990 1.00 . A A . 8 SER OG 1 1 9 3572 1 1 9 GLY C C -7.444 -0.751 -2.056 1.00 . A A . 9 GLY C 1 1 9 3573 1 1 9 GLY CA C -7.413 -0.713 -0.527 1.00 . A A . 9 GLY CA 1 1 9 3574 1 1 9 GLY H H -9.534 -0.755 -0.195 1.00 . A A . 9 GLY H 1 1 9 3575 1 1 9 GLY HA2 H -7.283 0.307 -0.201 1.00 . A A . 9 GLY HA2 1 1 9 3576 1 1 9 GLY HA3 H -6.587 -1.312 -0.171 1.00 . A A . 9 GLY HA3 1 1 9 3577 1 1 9 GLY N N -8.706 -1.236 0.009 1.00 . A A . 9 GLY N 1 1 9 3578 1 1 9 GLY O O -6.581 -1.333 -2.681 1.00 . A A . 9 GLY O 1 1 9 3579 1 1 10 TYR C C -7.461 0.609 -4.823 1.00 . A A . 10 TYR C 1 1 9 3580 1 1 10 TYR CA C -8.630 -0.061 -4.089 1.00 . A A . 10 TYR CA 1 1 9 3581 1 1 10 TYR CB C -9.940 0.705 -4.399 1.00 . A A . 10 TYR CB 1 1 9 3582 1 1 10 TYR CD1 C -8.984 2.919 -3.523 1.00 . A A . 10 TYR CD1 1 1 9 3583 1 1 10 TYR CD2 C -10.407 2.972 -5.430 1.00 . A A . 10 TYR CD2 1 1 9 3584 1 1 10 TYR CE1 C -8.848 4.288 -3.588 1.00 . A A . 10 TYR CE1 1 1 9 3585 1 1 10 TYR CE2 C -10.270 4.342 -5.494 1.00 . A A . 10 TYR CE2 1 1 9 3586 1 1 10 TYR CG C -9.766 2.242 -4.445 1.00 . A A . 10 TYR CG 1 1 9 3587 1 1 10 TYR CZ C -9.490 5.010 -4.573 1.00 . A A . 10 TYR CZ 1 1 9 3588 1 1 10 TYR H H -9.111 0.315 -2.023 1.00 . A A . 10 TYR H 1 1 9 3589 1 1 10 TYR HA H -8.722 -1.074 -4.453 1.00 . A A . 10 TYR HA 1 1 9 3590 1 1 10 TYR HB2 H -10.297 0.374 -5.364 1.00 . A A . 10 TYR HB2 1 1 9 3591 1 1 10 TYR HB3 H -10.674 0.473 -3.648 1.00 . A A . 10 TYR HB3 1 1 9 3592 1 1 10 TYR HD1 H -8.472 2.378 -2.743 1.00 . A A . 10 TYR HD1 1 1 9 3593 1 1 10 TYR HD2 H -11.021 2.468 -6.160 1.00 . A A . 10 TYR HD2 1 1 9 3594 1 1 10 TYR HE1 H -8.235 4.798 -2.860 1.00 . A A . 10 TYR HE1 1 1 9 3595 1 1 10 TYR HE2 H -10.777 4.895 -6.270 1.00 . A A . 10 TYR HE2 1 1 9 3596 1 1 10 TYR HH H -10.037 6.766 -4.081 1.00 . A A . 10 TYR HH 1 1 9 3597 1 1 10 TYR N N -8.454 -0.120 -2.603 1.00 . A A . 10 TYR N 1 1 9 3598 1 1 10 TYR O O -6.498 1.039 -4.216 1.00 . A A . 10 TYR O 1 1 9 3599 1 1 10 TYR OH O -9.354 6.381 -4.634 1.00 . A A . 10 TYR OH 1 1 9 3600 1 1 11 GLU C C -6.580 2.818 -6.771 1.00 . A A . 11 GLU C 1 1 9 3601 1 1 11 GLU CA C -6.540 1.304 -6.962 1.00 . A A . 11 GLU CA 1 1 9 3602 1 1 11 GLU CB C -6.783 0.933 -8.447 1.00 . A A . 11 GLU CB 1 1 9 3603 1 1 11 GLU CD C -7.717 2.800 -9.899 1.00 . A A . 11 GLU CD 1 1 9 3604 1 1 11 GLU CG C -8.078 1.601 -8.999 1.00 . A A . 11 GLU CG 1 1 9 3605 1 1 11 GLU H H -8.404 0.308 -6.547 1.00 . A A . 11 GLU H 1 1 9 3606 1 1 11 GLU HA H -5.582 0.952 -6.618 1.00 . A A . 11 GLU HA 1 1 9 3607 1 1 11 GLU HB2 H -5.924 1.229 -9.032 1.00 . A A . 11 GLU HB2 1 1 9 3608 1 1 11 GLU HB3 H -6.883 -0.140 -8.526 1.00 . A A . 11 GLU HB3 1 1 9 3609 1 1 11 GLU HG2 H -8.631 0.878 -9.581 1.00 . A A . 11 GLU HG2 1 1 9 3610 1 1 11 GLU HG3 H -8.715 1.941 -8.196 1.00 . A A . 11 GLU HG3 1 1 9 3611 1 1 11 GLU N N -7.599 0.674 -6.124 1.00 . A A . 11 GLU N 1 1 9 3612 1 1 11 GLU O O -7.558 3.359 -6.295 1.00 . A A . 11 GLU O 1 1 9 3613 1 1 11 GLU OE1 O -7.540 3.875 -9.347 1.00 . A A . 11 GLU OE1 1 1 9 3614 1 1 11 GLU OE2 O -7.636 2.574 -11.096 1.00 . A A . 11 GLU OE2 1 1 9 3615 1 1 12 VAL C C -4.658 5.514 -8.211 1.00 . A A . 12 VAL C 1 1 9 3616 1 1 12 VAL CA C -5.418 4.937 -7.019 1.00 . A A . 12 VAL CA 1 1 9 3617 1 1 12 VAL CB C -4.683 5.257 -5.699 1.00 . A A . 12 VAL CB 1 1 9 3618 1 1 12 VAL CG1 C -4.426 6.771 -5.578 1.00 . A A . 12 VAL CG1 1 1 9 3619 1 1 12 VAL CG2 C -5.533 4.833 -4.496 1.00 . A A . 12 VAL CG2 1 1 9 3620 1 1 12 VAL H H -4.760 2.954 -7.536 1.00 . A A . 12 VAL H 1 1 9 3621 1 1 12 VAL HA H -6.411 5.363 -7.018 1.00 . A A . 12 VAL HA 1 1 9 3622 1 1 12 VAL HB H -3.756 4.700 -5.695 1.00 . A A . 12 VAL HB 1 1 9 3623 1 1 12 VAL HG11 H -3.855 7.116 -6.423 1.00 . A A . 12 VAL HG11 1 1 9 3624 1 1 12 VAL HG12 H -5.363 7.307 -5.548 1.00 . A A . 12 VAL HG12 1 1 9 3625 1 1 12 VAL HG13 H -3.873 6.981 -4.674 1.00 . A A . 12 VAL HG13 1 1 9 3626 1 1 12 VAL HG21 H -6.520 5.263 -4.577 1.00 . A A . 12 VAL HG21 1 1 9 3627 1 1 12 VAL HG22 H -5.612 3.757 -4.454 1.00 . A A . 12 VAL HG22 1 1 9 3628 1 1 12 VAL HG23 H -5.074 5.183 -3.583 1.00 . A A . 12 VAL HG23 1 1 9 3629 1 1 12 VAL N N -5.509 3.455 -7.154 1.00 . A A . 12 VAL N 1 1 9 3630 1 1 12 VAL O O -5.164 6.388 -8.883 1.00 . A A . 12 VAL O 1 1 9 3631 1 1 13 HIS C C -1.766 6.674 -9.176 1.00 . A A . 13 HIS C 1 1 9 3632 1 1 13 HIS CA C -2.524 5.367 -9.494 1.00 . A A . 13 HIS CA 1 1 9 3633 1 1 13 HIS CB C -3.297 5.508 -10.853 1.00 . A A . 13 HIS CB 1 1 9 3634 1 1 13 HIS CD2 C -4.566 3.191 -10.555 1.00 . A A . 13 HIS CD2 1 1 9 3635 1 1 13 HIS CE1 C -4.165 2.388 -12.420 1.00 . A A . 13 HIS CE1 1 1 9 3636 1 1 13 HIS CG C -3.812 4.119 -11.255 1.00 . A A . 13 HIS CG 1 1 9 3637 1 1 13 HIS H H -3.200 4.269 -7.779 1.00 . A A . 13 HIS H 1 1 9 3638 1 1 13 HIS HA H -1.791 4.581 -9.600 1.00 . A A . 13 HIS HA 1 1 9 3639 1 1 13 HIS HB2 H -4.120 6.200 -10.819 1.00 . A A . 13 HIS HB2 1 1 9 3640 1 1 13 HIS HB3 H -2.613 5.840 -11.620 1.00 . A A . 13 HIS HB3 1 1 9 3641 1 1 13 HIS HD1 H -3.092 3.949 -13.136 1.00 . A A . 13 HIS HD1 1 1 9 3642 1 1 13 HIS HD2 H -4.929 3.321 -9.548 1.00 . A A . 13 HIS HD2 1 1 9 3643 1 1 13 HIS HE1 H -4.133 1.717 -13.265 1.00 . A A . 13 HIS HE1 1 1 9 3644 1 1 13 HIS N N -3.476 4.978 -8.399 1.00 . A A . 13 HIS N 1 1 9 3645 1 1 13 HIS ND1 N -3.602 3.554 -12.398 1.00 . A A . 13 HIS ND1 1 1 9 3646 1 1 13 HIS NE2 N -4.775 2.121 -11.294 1.00 . A A . 13 HIS NE2 1 1 9 3647 1 1 13 HIS O O -1.316 7.371 -10.065 1.00 . A A . 13 HIS O 1 1 9 3648 1 1 14 HIS C C 0.175 7.563 -6.557 1.00 . A A . 14 HIS C 1 1 9 3649 1 1 14 HIS CA C -0.941 8.178 -7.404 1.00 . A A . 14 HIS CA 1 1 9 3650 1 1 14 HIS CB C -1.867 9.063 -6.523 1.00 . A A . 14 HIS CB 1 1 9 3651 1 1 14 HIS CD2 C -3.802 9.300 -8.284 1.00 . A A . 14 HIS CD2 1 1 9 3652 1 1 14 HIS CE1 C -3.919 11.365 -8.364 1.00 . A A . 14 HIS CE1 1 1 9 3653 1 1 14 HIS CG C -2.858 9.802 -7.418 1.00 . A A . 14 HIS CG 1 1 9 3654 1 1 14 HIS H H -2.045 6.361 -7.238 1.00 . A A . 14 HIS H 1 1 9 3655 1 1 14 HIS HA H -0.530 8.715 -8.231 1.00 . A A . 14 HIS HA 1 1 9 3656 1 1 14 HIS HB2 H -2.413 8.475 -5.804 1.00 . A A . 14 HIS HB2 1 1 9 3657 1 1 14 HIS HB3 H -1.277 9.796 -5.993 1.00 . A A . 14 HIS HB3 1 1 9 3658 1 1 14 HIS HD1 H -2.451 11.743 -7.020 1.00 . A A . 14 HIS HD1 1 1 9 3659 1 1 14 HIS HD2 H -3.963 8.249 -8.447 1.00 . A A . 14 HIS HD2 1 1 9 3660 1 1 14 HIS HE1 H -4.218 12.370 -8.623 1.00 . A A . 14 HIS HE1 1 1 9 3661 1 1 14 HIS N N -1.653 6.961 -7.898 1.00 . A A . 14 HIS N 1 1 9 3662 1 1 14 HIS ND1 N -2.983 11.085 -7.514 1.00 . A A . 14 HIS ND1 1 1 9 3663 1 1 14 HIS NE2 N -4.457 10.283 -8.870 1.00 . A A . 14 HIS NE2 1 1 9 3664 1 1 14 HIS O O 1.214 7.218 -7.081 1.00 . A A . 14 HIS O 1 1 9 3665 1 1 15 GLN C C 1.189 5.384 -4.807 1.00 . A A . 15 GLN C 1 1 9 3666 1 1 15 GLN CA C 0.960 6.827 -4.355 1.00 . A A . 15 GLN CA 1 1 9 3667 1 1 15 GLN CB C 0.431 6.839 -2.915 1.00 . A A . 15 GLN CB 1 1 9 3668 1 1 15 GLN CD C -0.399 8.251 -1.030 1.00 . A A . 15 GLN CD 1 1 9 3669 1 1 15 GLN CG C 0.053 8.271 -2.495 1.00 . A A . 15 GLN CG 1 1 9 3670 1 1 15 GLN H H -0.923 7.727 -4.919 1.00 . A A . 15 GLN H 1 1 9 3671 1 1 15 GLN HA H 1.900 7.348 -4.446 1.00 . A A . 15 GLN HA 1 1 9 3672 1 1 15 GLN HB2 H -0.436 6.197 -2.847 1.00 . A A . 15 GLN HB2 1 1 9 3673 1 1 15 GLN HB3 H 1.196 6.458 -2.256 1.00 . A A . 15 GLN HB3 1 1 9 3674 1 1 15 GLN HE21 H -2.173 7.471 -1.459 1.00 . A A . 15 GLN HE21 1 1 9 3675 1 1 15 GLN HE22 H -1.892 7.774 0.187 1.00 . A A . 15 GLN HE22 1 1 9 3676 1 1 15 GLN HG2 H 0.903 8.932 -2.591 1.00 . A A . 15 GLN HG2 1 1 9 3677 1 1 15 GLN HG3 H -0.757 8.647 -3.101 1.00 . A A . 15 GLN HG3 1 1 9 3678 1 1 15 GLN N N -0.063 7.429 -5.275 1.00 . A A . 15 GLN N 1 1 9 3679 1 1 15 GLN NE2 N -1.588 7.795 -0.744 1.00 . A A . 15 GLN NE2 1 1 9 3680 1 1 15 GLN O O 2.200 4.780 -4.510 1.00 . A A . 15 GLN O 1 1 9 3681 1 1 15 GLN OE1 O 0.321 8.649 -0.136 1.00 . A A . 15 GLN OE1 1 1 9 3682 1 1 16 GLU C C 1.603 3.241 -6.736 1.00 . A A . 16 GLU C 1 1 9 3683 1 1 16 GLU CA C 0.250 3.505 -6.061 1.00 . A A . 16 GLU CA 1 1 9 3684 1 1 16 GLU CB C -0.897 3.376 -7.055 1.00 . A A . 16 GLU CB 1 1 9 3685 1 1 16 GLU CD C -2.059 1.874 -8.682 1.00 . A A . 16 GLU CD 1 1 9 3686 1 1 16 GLU CG C -0.831 2.018 -7.760 1.00 . A A . 16 GLU CG 1 1 9 3687 1 1 16 GLU H H -0.569 5.443 -5.716 1.00 . A A . 16 GLU H 1 1 9 3688 1 1 16 GLU HA H 0.110 2.814 -5.247 1.00 . A A . 16 GLU HA 1 1 9 3689 1 1 16 GLU HB2 H -1.837 3.476 -6.529 1.00 . A A . 16 GLU HB2 1 1 9 3690 1 1 16 GLU HB3 H -0.821 4.170 -7.780 1.00 . A A . 16 GLU HB3 1 1 9 3691 1 1 16 GLU HG2 H 0.079 1.959 -8.344 1.00 . A A . 16 GLU HG2 1 1 9 3692 1 1 16 GLU HG3 H -0.819 1.225 -7.025 1.00 . A A . 16 GLU HG3 1 1 9 3693 1 1 16 GLU N N 0.215 4.887 -5.524 1.00 . A A . 16 GLU N 1 1 9 3694 1 1 16 GLU O O 2.265 2.268 -6.426 1.00 . A A . 16 GLU O 1 1 9 3695 1 1 16 GLU OE1 O -3.140 1.706 -8.138 1.00 . A A . 16 GLU OE1 1 1 9 3696 1 1 16 GLU OE2 O -1.849 1.941 -9.882 1.00 . A A . 16 GLU OE2 1 1 9 3697 1 1 17 LEU C C 4.440 4.406 -7.490 1.00 . A A . 17 LEU C 1 1 9 3698 1 1 17 LEU CA C 3.270 3.947 -8.340 1.00 . A A . 17 LEU CA 1 1 9 3699 1 1 17 LEU CB C 3.229 4.731 -9.676 1.00 . A A . 17 LEU CB 1 1 9 3700 1 1 17 LEU CD1 C 4.397 6.968 -9.929 1.00 . A A . 17 LEU CD1 1 1 9 3701 1 1 17 LEU CD2 C 1.880 6.833 -10.085 1.00 . A A . 17 LEU CD2 1 1 9 3702 1 1 17 LEU CG C 3.134 6.254 -9.401 1.00 . A A . 17 LEU CG 1 1 9 3703 1 1 17 LEU H H 1.407 4.892 -7.838 1.00 . A A . 17 LEU H 1 1 9 3704 1 1 17 LEU HA H 3.395 2.902 -8.491 1.00 . A A . 17 LEU HA 1 1 9 3705 1 1 17 LEU HB2 H 4.120 4.501 -10.243 1.00 . A A . 17 LEU HB2 1 1 9 3706 1 1 17 LEU HB3 H 2.378 4.393 -10.249 1.00 . A A . 17 LEU HB3 1 1 9 3707 1 1 17 LEU HD11 H 5.275 6.570 -9.442 1.00 . A A . 17 LEU HD11 1 1 9 3708 1 1 17 LEU HD12 H 4.496 6.822 -10.995 1.00 . A A . 17 LEU HD12 1 1 9 3709 1 1 17 LEU HD13 H 4.339 8.026 -9.724 1.00 . A A . 17 LEU HD13 1 1 9 3710 1 1 17 LEU HD21 H 1.004 6.300 -9.748 1.00 . A A . 17 LEU HD21 1 1 9 3711 1 1 17 LEU HD22 H 1.768 7.878 -9.835 1.00 . A A . 17 LEU HD22 1 1 9 3712 1 1 17 LEU HD23 H 1.954 6.735 -11.159 1.00 . A A . 17 LEU HD23 1 1 9 3713 1 1 17 LEU HG H 3.063 6.411 -8.339 1.00 . A A . 17 LEU HG 1 1 9 3714 1 1 17 LEU N N 1.972 4.122 -7.633 1.00 . A A . 17 LEU N 1 1 9 3715 1 1 17 LEU O O 5.576 4.077 -7.758 1.00 . A A . 17 LEU O 1 1 9 3716 1 1 18 VAL C C 5.707 4.426 -4.790 1.00 . A A . 18 VAL C 1 1 9 3717 1 1 18 VAL CA C 5.248 5.640 -5.591 1.00 . A A . 18 VAL CA 1 1 9 3718 1 1 18 VAL CB C 4.705 6.729 -4.682 1.00 . A A . 18 VAL CB 1 1 9 3719 1 1 18 VAL CG1 C 5.838 7.236 -3.771 1.00 . A A . 18 VAL CG1 1 1 9 3720 1 1 18 VAL CG2 C 4.217 7.836 -5.619 1.00 . A A . 18 VAL CG2 1 1 9 3721 1 1 18 VAL H H 3.220 5.422 -6.297 1.00 . A A . 18 VAL H 1 1 9 3722 1 1 18 VAL HA H 6.068 6.002 -6.196 1.00 . A A . 18 VAL HA 1 1 9 3723 1 1 18 VAL HB H 3.894 6.360 -4.075 1.00 . A A . 18 VAL HB 1 1 9 3724 1 1 18 VAL HG11 H 6.750 7.366 -4.337 1.00 . A A . 18 VAL HG11 1 1 9 3725 1 1 18 VAL HG12 H 5.564 8.174 -3.315 1.00 . A A . 18 VAL HG12 1 1 9 3726 1 1 18 VAL HG13 H 6.018 6.510 -2.991 1.00 . A A . 18 VAL HG13 1 1 9 3727 1 1 18 VAL HG21 H 5.023 8.149 -6.268 1.00 . A A . 18 VAL HG21 1 1 9 3728 1 1 18 VAL HG22 H 3.423 7.446 -6.237 1.00 . A A . 18 VAL HG22 1 1 9 3729 1 1 18 VAL HG23 H 3.846 8.674 -5.055 1.00 . A A . 18 VAL HG23 1 1 9 3730 1 1 18 VAL N N 4.148 5.165 -6.474 1.00 . A A . 18 VAL N 1 1 9 3731 1 1 18 VAL O O 6.810 4.399 -4.291 1.00 . A A . 18 VAL O 1 1 9 3732 1 1 19 PHE C C 6.074 1.383 -4.852 1.00 . A A . 19 PHE C 1 1 9 3733 1 1 19 PHE CA C 5.138 2.203 -3.963 1.00 . A A . 19 PHE CA 1 1 9 3734 1 1 19 PHE CB C 3.858 1.393 -3.712 1.00 . A A . 19 PHE CB 1 1 9 3735 1 1 19 PHE CD1 C 3.064 3.252 -2.150 1.00 . A A . 19 PHE CD1 1 1 9 3736 1 1 19 PHE CD2 C 1.435 1.942 -3.298 1.00 . A A . 19 PHE CD2 1 1 9 3737 1 1 19 PHE CE1 C 2.058 3.975 -1.544 1.00 . A A . 19 PHE CE1 1 1 9 3738 1 1 19 PHE CE2 C 0.428 2.666 -2.690 1.00 . A A . 19 PHE CE2 1 1 9 3739 1 1 19 PHE CG C 2.760 2.228 -3.032 1.00 . A A . 19 PHE CG 1 1 9 3740 1 1 19 PHE CZ C 0.739 3.681 -1.814 1.00 . A A . 19 PHE CZ 1 1 9 3741 1 1 19 PHE H H 3.957 3.566 -5.145 1.00 . A A . 19 PHE H 1 1 9 3742 1 1 19 PHE HA H 5.633 2.455 -3.038 1.00 . A A . 19 PHE HA 1 1 9 3743 1 1 19 PHE HB2 H 3.475 1.014 -4.648 1.00 . A A . 19 PHE HB2 1 1 9 3744 1 1 19 PHE HB3 H 4.085 0.553 -3.072 1.00 . A A . 19 PHE HB3 1 1 9 3745 1 1 19 PHE HD1 H 4.095 3.491 -1.940 1.00 . A A . 19 PHE HD1 1 1 9 3746 1 1 19 PHE HD2 H 1.186 1.150 -3.993 1.00 . A A . 19 PHE HD2 1 1 9 3747 1 1 19 PHE HE1 H 2.305 4.770 -0.857 1.00 . A A . 19 PHE HE1 1 1 9 3748 1 1 19 PHE HE2 H -0.605 2.435 -2.904 1.00 . A A . 19 PHE HE2 1 1 9 3749 1 1 19 PHE HZ H -0.050 4.246 -1.339 1.00 . A A . 19 PHE HZ 1 1 9 3750 1 1 19 PHE N N 4.828 3.458 -4.707 1.00 . A A . 19 PHE N 1 1 9 3751 1 1 19 PHE O O 6.832 0.553 -4.388 1.00 . A A . 19 PHE O 1 1 9 3752 1 1 20 PHE C C 8.184 1.649 -7.096 1.00 . A A . 20 PHE C 1 1 9 3753 1 1 20 PHE CA C 6.817 0.962 -7.135 1.00 . A A . 20 PHE CA 1 1 9 3754 1 1 20 PHE CB C 6.123 1.093 -8.518 1.00 . A A . 20 PHE CB 1 1 9 3755 1 1 20 PHE CD1 C 7.845 -0.012 -10.016 1.00 . A A . 20 PHE CD1 1 1 9 3756 1 1 20 PHE CD2 C 7.454 2.326 -10.295 1.00 . A A . 20 PHE CD2 1 1 9 3757 1 1 20 PHE CE1 C 8.790 0.025 -11.018 1.00 . A A . 20 PHE CE1 1 1 9 3758 1 1 20 PHE CE2 C 8.401 2.362 -11.298 1.00 . A A . 20 PHE CE2 1 1 9 3759 1 1 20 PHE CG C 7.170 1.137 -9.646 1.00 . A A . 20 PHE CG 1 1 9 3760 1 1 20 PHE CZ C 9.069 1.212 -11.660 1.00 . A A . 20 PHE CZ 1 1 9 3761 1 1 20 PHE H H 5.342 2.371 -6.403 1.00 . A A . 20 PHE H 1 1 9 3762 1 1 20 PHE HA H 6.924 -0.077 -6.856 1.00 . A A . 20 PHE HA 1 1 9 3763 1 1 20 PHE HB2 H 5.477 0.241 -8.667 1.00 . A A . 20 PHE HB2 1 1 9 3764 1 1 20 PHE HB3 H 5.512 1.979 -8.560 1.00 . A A . 20 PHE HB3 1 1 9 3765 1 1 20 PHE HD1 H 7.629 -0.945 -9.515 1.00 . A A . 20 PHE HD1 1 1 9 3766 1 1 20 PHE HD2 H 6.934 3.232 -10.018 1.00 . A A . 20 PHE HD2 1 1 9 3767 1 1 20 PHE HE1 H 9.313 -0.878 -11.299 1.00 . A A . 20 PHE HE1 1 1 9 3768 1 1 20 PHE HE2 H 8.618 3.293 -11.800 1.00 . A A . 20 PHE HE2 1 1 9 3769 1 1 20 PHE HZ H 9.811 1.241 -12.445 1.00 . A A . 20 PHE HZ 1 1 9 3770 1 1 20 PHE N N 5.976 1.670 -6.126 1.00 . A A . 20 PHE N 1 1 9 3771 1 1 20 PHE O O 9.211 1.009 -7.035 1.00 . A A . 20 PHE O 1 1 9 3772 1 1 21 ALA C C 10.111 3.369 -5.800 1.00 . A A . 21 ALA C 1 1 9 3773 1 1 21 ALA CA C 9.402 3.758 -7.095 1.00 . A A . 21 ALA CA 1 1 9 3774 1 1 21 ALA CB C 9.023 5.252 -7.104 1.00 . A A . 21 ALA CB 1 1 9 3775 1 1 21 ALA H H 7.294 3.409 -7.183 1.00 . A A . 21 ALA H 1 1 9 3776 1 1 21 ALA HA H 10.021 3.488 -7.935 1.00 . A A . 21 ALA HA 1 1 9 3777 1 1 21 ALA HB1 H 8.017 5.377 -7.476 1.00 . A A . 21 ALA HB1 1 1 9 3778 1 1 21 ALA HB2 H 9.071 5.670 -6.108 1.00 . A A . 21 ALA HB2 1 1 9 3779 1 1 21 ALA HB3 H 9.692 5.803 -7.747 1.00 . A A . 21 ALA HB3 1 1 9 3780 1 1 21 ALA N N 8.152 2.954 -7.132 1.00 . A A . 21 ALA N 1 1 9 3781 1 1 21 ALA O O 11.313 3.208 -5.751 1.00 . A A . 21 ALA O 1 1 9 3782 1 1 22 GLU C C 10.509 1.470 -3.515 1.00 . A A . 22 GLU C 1 1 9 3783 1 1 22 GLU CA C 9.808 2.838 -3.440 1.00 . A A . 22 GLU CA 1 1 9 3784 1 1 22 GLU CB C 8.585 2.835 -2.481 1.00 . A A . 22 GLU CB 1 1 9 3785 1 1 22 GLU CD C 7.956 0.564 -1.588 1.00 . A A . 22 GLU CD 1 1 9 3786 1 1 22 GLU CG C 8.719 1.868 -1.278 1.00 . A A . 22 GLU CG 1 1 9 3787 1 1 22 GLU H H 8.336 3.363 -4.919 1.00 . A A . 22 GLU H 1 1 9 3788 1 1 22 GLU HA H 10.519 3.587 -3.150 1.00 . A A . 22 GLU HA 1 1 9 3789 1 1 22 GLU HB2 H 8.439 3.838 -2.104 1.00 . A A . 22 GLU HB2 1 1 9 3790 1 1 22 GLU HB3 H 7.710 2.569 -3.047 1.00 . A A . 22 GLU HB3 1 1 9 3791 1 1 22 GLU HG2 H 9.753 1.644 -1.058 1.00 . A A . 22 GLU HG2 1 1 9 3792 1 1 22 GLU HG3 H 8.280 2.325 -0.402 1.00 . A A . 22 GLU HG3 1 1 9 3793 1 1 22 GLU N N 9.299 3.219 -4.786 1.00 . A A . 22 GLU N 1 1 9 3794 1 1 22 GLU O O 11.506 1.244 -2.857 1.00 . A A . 22 GLU O 1 1 9 3795 1 1 22 GLU OE1 O 6.742 0.599 -1.452 1.00 . A A . 22 GLU OE1 1 1 9 3796 1 1 22 GLU OE2 O 8.621 -0.394 -1.947 1.00 . A A . 22 GLU OE2 1 1 9 3797 1 1 23 ASP C C 11.890 -0.643 -5.199 1.00 . A A . 23 ASP C 1 1 9 3798 1 1 23 ASP CA C 10.523 -0.767 -4.507 1.00 . A A . 23 ASP CA 1 1 9 3799 1 1 23 ASP CB C 9.490 -1.605 -5.347 1.00 . A A . 23 ASP CB 1 1 9 3800 1 1 23 ASP CG C 10.077 -2.163 -6.663 1.00 . A A . 23 ASP CG 1 1 9 3801 1 1 23 ASP H H 9.154 0.876 -4.820 1.00 . A A . 23 ASP H 1 1 9 3802 1 1 23 ASP HA H 10.661 -1.219 -3.535 1.00 . A A . 23 ASP HA 1 1 9 3803 1 1 23 ASP HB2 H 9.152 -2.438 -4.748 1.00 . A A . 23 ASP HB2 1 1 9 3804 1 1 23 ASP HB3 H 8.625 -1.002 -5.579 1.00 . A A . 23 ASP HB3 1 1 9 3805 1 1 23 ASP N N 9.954 0.606 -4.327 1.00 . A A . 23 ASP N 1 1 9 3806 1 1 23 ASP O O 12.862 -1.221 -4.752 1.00 . A A . 23 ASP O 1 1 9 3807 1 1 23 ASP OD1 O 10.816 -3.129 -6.559 1.00 . A A . 23 ASP OD1 1 1 9 3808 1 1 23 ASP OD2 O 9.758 -1.597 -7.695 1.00 . A A . 23 ASP OD2 1 1 9 3809 1 1 24 VAL C C 14.264 0.860 -6.122 1.00 . A A . 24 VAL C 1 1 9 3810 1 1 24 VAL CA C 13.159 0.333 -7.057 1.00 . A A . 24 VAL CA 1 1 9 3811 1 1 24 VAL CB C 12.859 1.358 -8.188 1.00 . A A . 24 VAL CB 1 1 9 3812 1 1 24 VAL CG1 C 14.163 1.711 -8.946 1.00 . A A . 24 VAL CG1 1 1 9 3813 1 1 24 VAL CG2 C 11.847 0.749 -9.183 1.00 . A A . 24 VAL CG2 1 1 9 3814 1 1 24 VAL H H 11.066 0.523 -6.559 1.00 . A A . 24 VAL H 1 1 9 3815 1 1 24 VAL HA H 13.476 -0.611 -7.478 1.00 . A A . 24 VAL HA 1 1 9 3816 1 1 24 VAL HB H 12.441 2.258 -7.764 1.00 . A A . 24 VAL HB 1 1 9 3817 1 1 24 VAL HG11 H 14.768 0.829 -9.093 1.00 . A A . 24 VAL HG11 1 1 9 3818 1 1 24 VAL HG12 H 13.936 2.141 -9.911 1.00 . A A . 24 VAL HG12 1 1 9 3819 1 1 24 VAL HG13 H 14.728 2.432 -8.375 1.00 . A A . 24 VAL HG13 1 1 9 3820 1 1 24 VAL HG21 H 12.198 -0.208 -9.542 1.00 . A A . 24 VAL HG21 1 1 9 3821 1 1 24 VAL HG22 H 10.891 0.609 -8.705 1.00 . A A . 24 VAL HG22 1 1 9 3822 1 1 24 VAL HG23 H 11.710 1.409 -10.028 1.00 . A A . 24 VAL HG23 1 1 9 3823 1 1 24 VAL N N 11.904 0.109 -6.272 1.00 . A A . 24 VAL N 1 1 9 3824 1 1 24 VAL O O 15.341 0.298 -6.063 1.00 . A A . 24 VAL O 1 1 9 3825 1 1 25 GLY C C 15.934 3.466 -5.173 1.00 . A A . 25 GLY C 1 1 9 3826 1 1 25 GLY CA C 14.929 2.544 -4.475 1.00 . A A . 25 GLY CA 1 1 9 3827 1 1 25 GLY H H 13.067 2.326 -5.530 1.00 . A A . 25 GLY H 1 1 9 3828 1 1 25 GLY HA2 H 14.375 3.120 -3.748 1.00 . A A . 25 GLY HA2 1 1 9 3829 1 1 25 GLY HA3 H 15.470 1.763 -3.958 1.00 . A A . 25 GLY HA3 1 1 9 3830 1 1 25 GLY N N 13.953 1.925 -5.425 1.00 . A A . 25 GLY N 1 1 9 3831 1 1 25 GLY O O 16.318 4.476 -4.617 1.00 . A A . 25 GLY O 1 1 9 3832 1 1 26 SER C C 16.799 5.343 -7.369 1.00 . A A . 26 SER C 1 1 9 3833 1 1 26 SER CA C 17.313 3.913 -7.155 1.00 . A A . 26 SER CA 1 1 9 3834 1 1 26 SER CB C 17.548 3.245 -8.520 1.00 . A A . 26 SER CB 1 1 9 3835 1 1 26 SER H H 15.980 2.269 -6.756 1.00 . A A . 26 SER H 1 1 9 3836 1 1 26 SER HA H 18.240 3.960 -6.603 1.00 . A A . 26 SER HA 1 1 9 3837 1 1 26 SER HB2 H 16.677 3.311 -9.156 1.00 . A A . 26 SER HB2 1 1 9 3838 1 1 26 SER HB3 H 18.406 3.665 -9.024 1.00 . A A . 26 SER HB3 1 1 9 3839 1 1 26 SER HG H 18.683 1.664 -8.530 1.00 . A A . 26 SER HG 1 1 9 3840 1 1 26 SER N N 16.331 3.096 -6.367 1.00 . A A . 26 SER N 1 1 9 3841 1 1 26 SER O O 17.567 6.282 -7.441 1.00 . A A . 26 SER O 1 1 9 3842 1 1 26 SER OG O 17.805 1.882 -8.210 1.00 . A A . 26 SER OG 1 1 9 3843 1 1 27 ASN C C 14.099 7.185 -6.375 1.00 . A A . 27 ASN C 1 1 9 3844 1 1 27 ASN CA C 14.807 6.750 -7.668 1.00 . A A . 27 ASN CA 1 1 9 3845 1 1 27 ASN CB C 13.779 6.592 -8.805 1.00 . A A . 27 ASN CB 1 1 9 3846 1 1 27 ASN CG C 12.854 5.396 -8.522 1.00 . A A . 27 ASN CG 1 1 9 3847 1 1 27 ASN H H 14.960 4.624 -7.387 1.00 . A A . 27 ASN H 1 1 9 3848 1 1 27 ASN HA H 15.531 7.506 -7.938 1.00 . A A . 27 ASN HA 1 1 9 3849 1 1 27 ASN HB2 H 13.175 7.483 -8.897 1.00 . A A . 27 ASN HB2 1 1 9 3850 1 1 27 ASN HB3 H 14.291 6.422 -9.742 1.00 . A A . 27 ASN HB3 1 1 9 3851 1 1 27 ASN HD21 H 12.143 6.153 -6.824 1.00 . A A . 27 ASN HD21 1 1 9 3852 1 1 27 ASN HD22 H 11.530 4.637 -7.263 1.00 . A A . 27 ASN HD22 1 1 9 3853 1 1 27 ASN N N 15.498 5.439 -7.460 1.00 . A A . 27 ASN N 1 1 9 3854 1 1 27 ASN ND2 N 12.115 5.398 -7.447 1.00 . A A . 27 ASN ND2 1 1 9 3855 1 1 27 ASN O O 13.586 8.285 -6.299 1.00 . A A . 27 ASN O 1 1 9 3856 1 1 27 ASN OD1 O 12.795 4.449 -9.278 1.00 . A A . 27 ASN OD1 1 1 9 3857 1 1 28 LYS C C 11.949 6.828 -4.285 1.00 . A A . 28 LYS C 1 1 9 3858 1 1 28 LYS CA C 13.457 6.540 -4.080 1.00 . A A . 28 LYS CA 1 1 9 3859 1 1 28 LYS CB C 14.187 7.744 -3.375 1.00 . A A . 28 LYS CB 1 1 9 3860 1 1 28 LYS CD C 16.614 8.019 -4.080 1.00 . A A . 28 LYS CD 1 1 9 3861 1 1 28 LYS CE C 18.060 7.543 -3.828 1.00 . A A . 28 LYS CE 1 1 9 3862 1 1 28 LYS CG C 15.658 7.370 -3.051 1.00 . A A . 28 LYS CG 1 1 9 3863 1 1 28 LYS H H 14.539 5.434 -5.562 1.00 . A A . 28 LYS H 1 1 9 3864 1 1 28 LYS HA H 13.564 5.648 -3.479 1.00 . A A . 28 LYS HA 1 1 9 3865 1 1 28 LYS HB2 H 14.148 8.631 -3.989 1.00 . A A . 28 LYS HB2 1 1 9 3866 1 1 28 LYS HB3 H 13.677 7.961 -2.449 1.00 . A A . 28 LYS HB3 1 1 9 3867 1 1 28 LYS HD2 H 16.318 7.757 -5.086 1.00 . A A . 28 LYS HD2 1 1 9 3868 1 1 28 LYS HD3 H 16.571 9.095 -3.982 1.00 . A A . 28 LYS HD3 1 1 9 3869 1 1 28 LYS HE2 H 18.755 8.328 -4.088 1.00 . A A . 28 LYS HE2 1 1 9 3870 1 1 28 LYS HE3 H 18.209 7.280 -2.791 1.00 . A A . 28 LYS HE3 1 1 9 3871 1 1 28 LYS HG2 H 15.900 7.737 -2.065 1.00 . A A . 28 LYS HG2 1 1 9 3872 1 1 28 LYS HG3 H 15.784 6.297 -3.050 1.00 . A A . 28 LYS HG3 1 1 9 3873 1 1 28 LYS HZ1 H 17.528 6.108 -5.239 1.00 . A A . 28 LYS HZ1 1 1 9 3874 1 1 28 LYS HZ2 H 19.162 6.563 -5.299 1.00 . A A . 28 LYS HZ2 1 1 9 3875 1 1 28 LYS HZ3 H 18.606 5.545 -4.056 1.00 . A A . 28 LYS HZ3 1 1 9 3876 1 1 28 LYS N N 14.100 6.296 -5.408 1.00 . A A . 28 LYS N 1 1 9 3877 1 1 28 LYS NZ N 18.363 6.350 -4.668 1.00 . A A . 28 LYS NZ 1 1 9 3878 1 1 28 LYS O O 11.551 7.983 -4.255 1.00 . A A . 28 LYS O 1 1 9 3879 1 1 28 LYS OXT O 11.262 5.838 -4.471 1.00 . A A . 28 LYS OXT 1 1 10 3880 1 1 1 ASP C C -12.085 -0.328 -18.413 1.00 . A A . 1 ASP C 1 1 10 3881 1 1 1 ASP CA C -11.345 0.842 -19.072 1.00 . A A . 1 ASP CA 1 1 10 3882 1 1 1 ASP CB C -11.727 2.174 -18.365 1.00 . A A . 1 ASP CB 1 1 10 3883 1 1 1 ASP CG C -13.257 2.339 -18.204 1.00 . A A . 1 ASP CG 1 1 10 3884 1 1 1 ASP H1 H -12.377 0.160 -20.747 1.00 . A A . 1 ASP H1 1 1 10 3885 1 1 1 ASP H2 H -12.144 1.840 -20.717 1.00 . A A . 1 ASP H2 1 1 10 3886 1 1 1 ASP H3 H -10.847 0.810 -21.094 1.00 . A A . 1 ASP H3 1 1 10 3887 1 1 1 ASP HA H -10.280 0.674 -18.993 1.00 . A A . 1 ASP HA 1 1 10 3888 1 1 1 ASP HB2 H -11.262 2.201 -17.389 1.00 . A A . 1 ASP HB2 1 1 10 3889 1 1 1 ASP HB3 H -11.353 3.009 -18.939 1.00 . A A . 1 ASP HB3 1 1 10 3890 1 1 1 ASP N N -11.705 0.919 -20.517 1.00 . A A . 1 ASP N 1 1 10 3891 1 1 1 ASP O O -13.170 -0.684 -18.830 1.00 . A A . 1 ASP O 1 1 10 3892 1 1 1 ASP OD1 O -13.955 2.117 -19.181 1.00 . A A . 1 ASP OD1 1 1 10 3893 1 1 1 ASP OD2 O -13.642 2.682 -17.101 1.00 . A A . 1 ASP OD2 1 1 10 3894 1 1 2 ALA C C -12.719 -1.586 -15.366 1.00 . A A . 2 ALA C 1 1 10 3895 1 1 2 ALA CA C -12.077 -2.042 -16.667 1.00 . A A . 2 ALA CA 1 1 10 3896 1 1 2 ALA CB C -10.989 -3.080 -16.370 1.00 . A A . 2 ALA CB 1 1 10 3897 1 1 2 ALA H H -10.593 -0.548 -17.121 1.00 . A A . 2 ALA H 1 1 10 3898 1 1 2 ALA HA H -12.865 -2.464 -17.267 1.00 . A A . 2 ALA HA 1 1 10 3899 1 1 2 ALA HB1 H -10.516 -3.395 -17.289 1.00 . A A . 2 ALA HB1 1 1 10 3900 1 1 2 ALA HB2 H -10.239 -2.662 -15.715 1.00 . A A . 2 ALA HB2 1 1 10 3901 1 1 2 ALA HB3 H -11.427 -3.945 -15.892 1.00 . A A . 2 ALA HB3 1 1 10 3902 1 1 2 ALA N N -11.467 -0.888 -17.402 1.00 . A A . 2 ALA N 1 1 10 3903 1 1 2 ALA O O -13.650 -2.217 -14.904 1.00 . A A . 2 ALA O 1 1 10 3904 1 1 3 GLU C C -13.155 -0.895 -12.481 1.00 . A A . 3 GLU C 1 1 10 3905 1 1 3 GLU CA C -12.683 0.102 -13.556 1.00 . A A . 3 GLU CA 1 1 10 3906 1 1 3 GLU CB C -13.806 1.098 -13.965 1.00 . A A . 3 GLU CB 1 1 10 3907 1 1 3 GLU CD C -15.453 0.653 -15.840 1.00 . A A . 3 GLU CD 1 1 10 3908 1 1 3 GLU CG C -15.152 0.412 -14.346 1.00 . A A . 3 GLU CG 1 1 10 3909 1 1 3 GLU H H -11.442 -0.085 -15.294 1.00 . A A . 3 GLU H 1 1 10 3910 1 1 3 GLU HA H -11.860 0.658 -13.128 1.00 . A A . 3 GLU HA 1 1 10 3911 1 1 3 GLU HB2 H -13.975 1.784 -13.154 1.00 . A A . 3 GLU HB2 1 1 10 3912 1 1 3 GLU HB3 H -13.438 1.657 -14.812 1.00 . A A . 3 GLU HB3 1 1 10 3913 1 1 3 GLU HG2 H -15.138 -0.647 -14.153 1.00 . A A . 3 GLU HG2 1 1 10 3914 1 1 3 GLU HG3 H -15.946 0.844 -13.753 1.00 . A A . 3 GLU HG3 1 1 10 3915 1 1 3 GLU N N -12.194 -0.510 -14.833 1.00 . A A . 3 GLU N 1 1 10 3916 1 1 3 GLU O O -14.048 -0.628 -11.700 1.00 . A A . 3 GLU O 1 1 10 3917 1 1 3 GLU OE1 O -14.883 -0.067 -16.642 1.00 . A A . 3 GLU OE1 1 1 10 3918 1 1 3 GLU OE2 O -16.236 1.551 -16.102 1.00 . A A . 3 GLU OE2 1 1 10 3919 1 1 4 PHE C C -12.245 -2.879 -10.136 1.00 . A A . 4 PHE C 1 1 10 3920 1 1 4 PHE CA C -12.798 -3.139 -11.538 1.00 . A A . 4 PHE CA 1 1 10 3921 1 1 4 PHE CB C -12.207 -4.458 -12.115 1.00 . A A . 4 PHE CB 1 1 10 3922 1 1 4 PHE CD1 C -9.937 -3.262 -12.534 1.00 . A A . 4 PHE CD1 1 1 10 3923 1 1 4 PHE CD2 C -10.388 -5.347 -13.591 1.00 . A A . 4 PHE CD2 1 1 10 3924 1 1 4 PHE CE1 C -8.699 -3.226 -13.145 1.00 . A A . 4 PHE CE1 1 1 10 3925 1 1 4 PHE CE2 C -9.152 -5.311 -14.199 1.00 . A A . 4 PHE CE2 1 1 10 3926 1 1 4 PHE CG C -10.800 -4.330 -12.752 1.00 . A A . 4 PHE CG 1 1 10 3927 1 1 4 PHE CZ C -8.305 -4.250 -13.976 1.00 . A A . 4 PHE CZ 1 1 10 3928 1 1 4 PHE H H -11.800 -2.147 -13.164 1.00 . A A . 4 PHE H 1 1 10 3929 1 1 4 PHE HA H -13.860 -3.255 -11.440 1.00 . A A . 4 PHE HA 1 1 10 3930 1 1 4 PHE HB2 H -12.160 -5.214 -11.345 1.00 . A A . 4 PHE HB2 1 1 10 3931 1 1 4 PHE HB3 H -12.884 -4.812 -12.879 1.00 . A A . 4 PHE HB3 1 1 10 3932 1 1 4 PHE HD1 H -10.223 -2.448 -11.887 1.00 . A A . 4 PHE HD1 1 1 10 3933 1 1 4 PHE HD2 H -11.046 -6.183 -13.772 1.00 . A A . 4 PHE HD2 1 1 10 3934 1 1 4 PHE HE1 H -8.035 -2.394 -12.972 1.00 . A A . 4 PHE HE1 1 1 10 3935 1 1 4 PHE HE2 H -8.848 -6.117 -14.851 1.00 . A A . 4 PHE HE2 1 1 10 3936 1 1 4 PHE HZ H -7.336 -4.220 -14.452 1.00 . A A . 4 PHE HZ 1 1 10 3937 1 1 4 PHE N N -12.505 -2.029 -12.495 1.00 . A A . 4 PHE N 1 1 10 3938 1 1 4 PHE O O -11.992 -3.804 -9.388 1.00 . A A . 4 PHE O 1 1 10 3939 1 1 5 ARG C C -10.195 -1.961 -8.274 1.00 . A A . 5 ARG C 1 1 10 3940 1 1 5 ARG CA C -11.527 -1.257 -8.447 1.00 . A A . 5 ARG CA 1 1 10 3941 1 1 5 ARG CB C -12.545 -1.697 -7.371 1.00 . A A . 5 ARG CB 1 1 10 3942 1 1 5 ARG CD C -14.773 -0.802 -6.582 1.00 . A A . 5 ARG CD 1 1 10 3943 1 1 5 ARG CG C -13.940 -1.211 -7.808 1.00 . A A . 5 ARG CG 1 1 10 3944 1 1 5 ARG CZ C -15.055 1.614 -6.951 1.00 . A A . 5 ARG CZ 1 1 10 3945 1 1 5 ARG H H -12.287 -0.923 -10.448 1.00 . A A . 5 ARG H 1 1 10 3946 1 1 5 ARG HA H -11.364 -0.206 -8.365 1.00 . A A . 5 ARG HA 1 1 10 3947 1 1 5 ARG HB2 H -12.557 -2.771 -7.279 1.00 . A A . 5 ARG HB2 1 1 10 3948 1 1 5 ARG HB3 H -12.267 -1.268 -6.419 1.00 . A A . 5 ARG HB3 1 1 10 3949 1 1 5 ARG HD2 H -15.826 -0.930 -6.782 1.00 . A A . 5 ARG HD2 1 1 10 3950 1 1 5 ARG HD3 H -14.505 -1.399 -5.722 1.00 . A A . 5 ARG HD3 1 1 10 3951 1 1 5 ARG HE H -13.886 0.862 -5.540 1.00 . A A . 5 ARG HE 1 1 10 3952 1 1 5 ARG HG2 H -13.838 -0.371 -8.482 1.00 . A A . 5 ARG HG2 1 1 10 3953 1 1 5 ARG HG3 H -14.424 -2.012 -8.346 1.00 . A A . 5 ARG HG3 1 1 10 3954 1 1 5 ARG HH11 H -16.084 0.408 -8.178 1.00 . A A . 5 ARG HH11 1 1 10 3955 1 1 5 ARG HH12 H -16.296 2.106 -8.442 1.00 . A A . 5 ARG HH12 1 1 10 3956 1 1 5 ARG HH21 H -14.136 3.019 -5.861 1.00 . A A . 5 ARG HH21 1 1 10 3957 1 1 5 ARG HH22 H -15.174 3.603 -7.118 1.00 . A A . 5 ARG HH22 1 1 10 3958 1 1 5 ARG N N -12.068 -1.624 -9.801 1.00 . A A . 5 ARG N 1 1 10 3959 1 1 5 ARG NE N -14.498 0.640 -6.271 1.00 . A A . 5 ARG NE 1 1 10 3960 1 1 5 ARG NH1 N -15.875 1.355 -7.934 1.00 . A A . 5 ARG NH1 1 1 10 3961 1 1 5 ARG NH2 N -14.766 2.840 -6.617 1.00 . A A . 5 ARG NH2 1 1 10 3962 1 1 5 ARG O O -9.782 -2.274 -7.180 1.00 . A A . 5 ARG O 1 1 10 3963 1 1 6 HIS C C -8.431 -4.222 -8.815 1.00 . A A . 6 HIS C 1 1 10 3964 1 1 6 HIS CA C -8.258 -2.858 -9.496 1.00 . A A . 6 HIS CA 1 1 10 3965 1 1 6 HIS CB C -7.180 -1.984 -8.782 1.00 . A A . 6 HIS CB 1 1 10 3966 1 1 6 HIS CD2 C -6.894 -0.620 -11.049 1.00 . A A . 6 HIS CD2 1 1 10 3967 1 1 6 HIS CE1 C -5.001 0.137 -10.704 1.00 . A A . 6 HIS CE1 1 1 10 3968 1 1 6 HIS CG C -6.479 -1.083 -9.809 1.00 . A A . 6 HIS CG 1 1 10 3969 1 1 6 HIS H H -10.032 -1.854 -10.224 1.00 . A A . 6 HIS H 1 1 10 3970 1 1 6 HIS HA H -8.010 -3.024 -10.533 1.00 . A A . 6 HIS HA 1 1 10 3971 1 1 6 HIS HB2 H -7.637 -1.359 -8.033 1.00 . A A . 6 HIS HB2 1 1 10 3972 1 1 6 HIS HB3 H -6.427 -2.598 -8.309 1.00 . A A . 6 HIS HB3 1 1 10 3973 1 1 6 HIS HD1 H -4.721 -0.705 -8.884 1.00 . A A . 6 HIS HD1 1 1 10 3974 1 1 6 HIS HD2 H -7.847 -0.845 -11.507 1.00 . A A . 6 HIS HD2 1 1 10 3975 1 1 6 HIS HE1 H -4.069 0.666 -10.830 1.00 . A A . 6 HIS HE1 1 1 10 3976 1 1 6 HIS N N -9.581 -2.171 -9.411 1.00 . A A . 6 HIS N 1 1 10 3977 1 1 6 HIS ND1 N -5.301 -0.574 -9.663 1.00 . A A . 6 HIS ND1 1 1 10 3978 1 1 6 HIS NE2 N -5.963 0.135 -11.591 1.00 . A A . 6 HIS NE2 1 1 10 3979 1 1 6 HIS O O -7.706 -4.583 -7.908 1.00 . A A . 6 HIS O 1 1 10 3980 1 1 7 ASP C C -10.255 -6.231 -7.318 1.00 . A A . 7 ASP C 1 1 10 3981 1 1 7 ASP CA C -9.784 -6.288 -8.795 1.00 . A A . 7 ASP CA 1 1 10 3982 1 1 7 ASP CB C -8.497 -7.201 -9.055 1.00 . A A . 7 ASP CB 1 1 10 3983 1 1 7 ASP CG C -7.849 -7.835 -7.806 1.00 . A A . 7 ASP CG 1 1 10 3984 1 1 7 ASP H H -9.969 -4.541 -10.031 1.00 . A A . 7 ASP H 1 1 10 3985 1 1 7 ASP HA H -10.605 -6.657 -9.391 1.00 . A A . 7 ASP HA 1 1 10 3986 1 1 7 ASP HB2 H -8.801 -7.998 -9.719 1.00 . A A . 7 ASP HB2 1 1 10 3987 1 1 7 ASP HB3 H -7.741 -6.629 -9.572 1.00 . A A . 7 ASP HB3 1 1 10 3988 1 1 7 ASP N N -9.428 -4.924 -9.303 1.00 . A A . 7 ASP N 1 1 10 3989 1 1 7 ASP O O -10.000 -7.102 -6.510 1.00 . A A . 7 ASP O 1 1 10 3990 1 1 7 ASP OD1 O -7.100 -7.129 -7.151 1.00 . A A . 7 ASP OD1 1 1 10 3991 1 1 7 ASP OD2 O -8.143 -8.997 -7.575 1.00 . A A . 7 ASP OD2 1 1 10 3992 1 1 8 SER C C -10.416 -4.777 -4.589 1.00 . A A . 8 SER C 1 1 10 3993 1 1 8 SER CA C -11.514 -4.921 -5.650 1.00 . A A . 8 SER CA 1 1 10 3994 1 1 8 SER CB C -12.479 -6.090 -5.277 1.00 . A A . 8 SER CB 1 1 10 3995 1 1 8 SER H H -11.135 -4.502 -7.723 1.00 . A A . 8 SER H 1 1 10 3996 1 1 8 SER HA H -12.078 -4.001 -5.668 1.00 . A A . 8 SER HA 1 1 10 3997 1 1 8 SER HB2 H -11.968 -7.034 -5.160 1.00 . A A . 8 SER HB2 1 1 10 3998 1 1 8 SER HB3 H -13.039 -5.864 -4.381 1.00 . A A . 8 SER HB3 1 1 10 3999 1 1 8 SER HG H -14.259 -5.998 -6.057 1.00 . A A . 8 SER HG 1 1 10 4000 1 1 8 SER N N -10.961 -5.165 -7.022 1.00 . A A . 8 SER N 1 1 10 4001 1 1 8 SER O O -10.279 -5.573 -3.679 1.00 . A A . 8 SER O 1 1 10 4002 1 1 8 SER OG O -13.371 -6.167 -6.380 1.00 . A A . 8 SER OG 1 1 10 4003 1 1 9 GLY C C -8.736 -1.877 -3.687 1.00 . A A . 9 GLY C 1 1 10 4004 1 1 9 GLY CA C -8.537 -3.373 -3.874 1.00 . A A . 9 GLY CA 1 1 10 4005 1 1 9 GLY H H -9.833 -3.139 -5.538 1.00 . A A . 9 GLY H 1 1 10 4006 1 1 9 GLY HA2 H -8.616 -3.886 -2.927 1.00 . A A . 9 GLY HA2 1 1 10 4007 1 1 9 GLY HA3 H -7.591 -3.575 -4.357 1.00 . A A . 9 GLY HA3 1 1 10 4008 1 1 9 GLY N N -9.663 -3.727 -4.774 1.00 . A A . 9 GLY N 1 1 10 4009 1 1 9 GLY O O -9.323 -1.451 -2.711 1.00 . A A . 9 GLY O 1 1 10 4010 1 1 10 TYR C C -7.797 0.949 -5.913 1.00 . A A . 10 TYR C 1 1 10 4011 1 1 10 TYR CA C -8.355 0.354 -4.612 1.00 . A A . 10 TYR CA 1 1 10 4012 1 1 10 TYR CB C -7.570 0.891 -3.387 1.00 . A A . 10 TYR CB 1 1 10 4013 1 1 10 TYR CD1 C -5.303 -0.003 -4.093 1.00 . A A . 10 TYR CD1 1 1 10 4014 1 1 10 TYR CD2 C -5.502 2.330 -3.668 1.00 . A A . 10 TYR CD2 1 1 10 4015 1 1 10 TYR CE1 C -3.975 0.167 -4.405 1.00 . A A . 10 TYR CE1 1 1 10 4016 1 1 10 TYR CE2 C -4.173 2.500 -3.981 1.00 . A A . 10 TYR CE2 1 1 10 4017 1 1 10 TYR CG C -6.080 1.078 -3.723 1.00 . A A . 10 TYR CG 1 1 10 4018 1 1 10 TYR CZ C -3.401 1.419 -4.352 1.00 . A A . 10 TYR CZ 1 1 10 4019 1 1 10 TYR H H -7.777 -1.554 -5.397 1.00 . A A . 10 TYR H 1 1 10 4020 1 1 10 TYR HA H -9.401 0.612 -4.534 1.00 . A A . 10 TYR HA 1 1 10 4021 1 1 10 TYR HB2 H -7.998 1.837 -3.095 1.00 . A A . 10 TYR HB2 1 1 10 4022 1 1 10 TYR HB3 H -7.648 0.203 -2.562 1.00 . A A . 10 TYR HB3 1 1 10 4023 1 1 10 TYR HD1 H -5.737 -0.992 -4.138 1.00 . A A . 10 TYR HD1 1 1 10 4024 1 1 10 TYR HD2 H -6.097 3.183 -3.378 1.00 . A A . 10 TYR HD2 1 1 10 4025 1 1 10 TYR HE1 H -3.384 -0.690 -4.696 1.00 . A A . 10 TYR HE1 1 1 10 4026 1 1 10 TYR HE2 H -3.736 3.485 -3.935 1.00 . A A . 10 TYR HE2 1 1 10 4027 1 1 10 TYR HH H -2.006 1.608 -5.623 1.00 . A A . 10 TYR HH 1 1 10 4028 1 1 10 TYR N N -8.239 -1.133 -4.643 1.00 . A A . 10 TYR N 1 1 10 4029 1 1 10 TYR O O -6.981 0.330 -6.569 1.00 . A A . 10 TYR O 1 1 10 4030 1 1 10 TYR OH O -2.070 1.584 -4.666 1.00 . A A . 10 TYR OH 1 1 10 4031 1 1 11 GLU C C -7.414 4.255 -7.213 1.00 . A A . 11 GLU C 1 1 10 4032 1 1 11 GLU CA C -7.766 2.800 -7.487 1.00 . A A . 11 GLU CA 1 1 10 4033 1 1 11 GLU CB C -8.872 2.700 -8.570 1.00 . A A . 11 GLU CB 1 1 10 4034 1 1 11 GLU CD C -9.451 1.237 -10.579 1.00 . A A . 11 GLU CD 1 1 10 4035 1 1 11 GLU CG C -8.793 1.289 -9.186 1.00 . A A . 11 GLU CG 1 1 10 4036 1 1 11 GLU H H -8.906 2.582 -5.670 1.00 . A A . 11 GLU H 1 1 10 4037 1 1 11 GLU HA H -6.854 2.319 -7.806 1.00 . A A . 11 GLU HA 1 1 10 4038 1 1 11 GLU HB2 H -9.846 2.856 -8.129 1.00 . A A . 11 GLU HB2 1 1 10 4039 1 1 11 GLU HB3 H -8.709 3.449 -9.332 1.00 . A A . 11 GLU HB3 1 1 10 4040 1 1 11 GLU HG2 H -7.755 1.017 -9.292 1.00 . A A . 11 GLU HG2 1 1 10 4041 1 1 11 GLU HG3 H -9.267 0.578 -8.529 1.00 . A A . 11 GLU HG3 1 1 10 4042 1 1 11 GLU N N -8.249 2.133 -6.242 1.00 . A A . 11 GLU N 1 1 10 4043 1 1 11 GLU O O -8.263 5.095 -6.982 1.00 . A A . 11 GLU O 1 1 10 4044 1 1 11 GLU OE1 O -8.898 1.869 -11.463 1.00 . A A . 11 GLU OE1 1 1 10 4045 1 1 11 GLU OE2 O -10.467 0.568 -10.689 1.00 . A A . 11 GLU OE2 1 1 10 4046 1 1 12 VAL C C -4.591 6.073 -8.177 1.00 . A A . 12 VAL C 1 1 10 4047 1 1 12 VAL CA C -5.530 5.813 -7.015 1.00 . A A . 12 VAL CA 1 1 10 4048 1 1 12 VAL CB C -4.785 5.768 -5.666 1.00 . A A . 12 VAL CB 1 1 10 4049 1 1 12 VAL CG1 C -3.862 6.998 -5.469 1.00 . A A . 12 VAL CG1 1 1 10 4050 1 1 12 VAL CG2 C -5.840 5.758 -4.564 1.00 . A A . 12 VAL CG2 1 1 10 4051 1 1 12 VAL H H -5.530 3.717 -7.445 1.00 . A A . 12 VAL H 1 1 10 4052 1 1 12 VAL HA H -6.300 6.567 -7.026 1.00 . A A . 12 VAL HA 1 1 10 4053 1 1 12 VAL HB H -4.210 4.854 -5.621 1.00 . A A . 12 VAL HB 1 1 10 4054 1 1 12 VAL HG11 H -4.093 7.772 -6.187 1.00 . A A . 12 VAL HG11 1 1 10 4055 1 1 12 VAL HG12 H -3.975 7.412 -4.478 1.00 . A A . 12 VAL HG12 1 1 10 4056 1 1 12 VAL HG13 H -2.830 6.702 -5.592 1.00 . A A . 12 VAL HG13 1 1 10 4057 1 1 12 VAL HG21 H -6.526 4.939 -4.722 1.00 . A A . 12 VAL HG21 1 1 10 4058 1 1 12 VAL HG22 H -5.361 5.642 -3.604 1.00 . A A . 12 VAL HG22 1 1 10 4059 1 1 12 VAL HG23 H -6.392 6.687 -4.583 1.00 . A A . 12 VAL HG23 1 1 10 4060 1 1 12 VAL N N -6.127 4.471 -7.252 1.00 . A A . 12 VAL N 1 1 10 4061 1 1 12 VAL O O -4.783 7.019 -8.912 1.00 . A A . 12 VAL O 1 1 10 4062 1 1 13 HIS C C -1.548 6.396 -9.097 1.00 . A A . 13 HIS C 1 1 10 4063 1 1 13 HIS CA C -2.583 5.287 -9.370 1.00 . A A . 13 HIS CA 1 1 10 4064 1 1 13 HIS CB C -3.292 5.524 -10.747 1.00 . A A . 13 HIS CB 1 1 10 4065 1 1 13 HIS CD2 C -5.004 3.542 -10.141 1.00 . A A . 13 HIS CD2 1 1 10 4066 1 1 13 HIS CE1 C -6.244 3.728 -11.788 1.00 . A A . 13 HIS CE1 1 1 10 4067 1 1 13 HIS CG C -4.509 4.584 -10.921 1.00 . A A . 13 HIS CG 1 1 10 4068 1 1 13 HIS H H -3.556 4.477 -7.640 1.00 . A A . 13 HIS H 1 1 10 4069 1 1 13 HIS HA H -2.064 4.343 -9.416 1.00 . A A . 13 HIS HA 1 1 10 4070 1 1 13 HIS HB2 H -3.626 6.546 -10.841 1.00 . A A . 13 HIS HB2 1 1 10 4071 1 1 13 HIS HB3 H -2.594 5.319 -11.543 1.00 . A A . 13 HIS HB3 1 1 10 4072 1 1 13 HIS HD1 H -5.268 5.269 -12.664 1.00 . A A . 13 HIS HD1 1 1 10 4073 1 1 13 HIS HD2 H -4.575 3.198 -9.211 1.00 . A A . 13 HIS HD2 1 1 10 4074 1 1 13 HIS HE1 H -7.045 3.572 -12.495 1.00 . A A . 13 HIS HE1 1 1 10 4075 1 1 13 HIS N N -3.615 5.208 -8.291 1.00 . A A . 13 HIS N 1 1 10 4076 1 1 13 HIS ND1 N -5.329 4.635 -11.919 1.00 . A A . 13 HIS ND1 1 1 10 4077 1 1 13 HIS NE2 N -6.081 3.025 -10.696 1.00 . A A . 13 HIS NE2 1 1 10 4078 1 1 13 HIS O O -0.644 6.586 -9.887 1.00 . A A . 13 HIS O 1 1 10 4079 1 1 14 HIS C C 0.270 7.523 -6.698 1.00 . A A . 14 HIS C 1 1 10 4080 1 1 14 HIS CA C -0.762 8.189 -7.612 1.00 . A A . 14 HIS CA 1 1 10 4081 1 1 14 HIS CB C -1.493 9.314 -6.841 1.00 . A A . 14 HIS CB 1 1 10 4082 1 1 14 HIS CD2 C -3.316 9.945 -8.599 1.00 . A A . 14 HIS CD2 1 1 10 4083 1 1 14 HIS CE1 C -2.729 11.885 -9.016 1.00 . A A . 14 HIS CE1 1 1 10 4084 1 1 14 HIS CG C -2.211 10.217 -7.833 1.00 . A A . 14 HIS CG 1 1 10 4085 1 1 14 HIS H H -2.451 6.893 -7.401 1.00 . A A . 14 HIS H 1 1 10 4086 1 1 14 HIS HA H -0.308 8.577 -8.499 1.00 . A A . 14 HIS HA 1 1 10 4087 1 1 14 HIS HB2 H -2.220 8.905 -6.160 1.00 . A A . 14 HIS HB2 1 1 10 4088 1 1 14 HIS HB3 H -0.786 9.912 -6.283 1.00 . A A . 14 HIS HB3 1 1 10 4089 1 1 14 HIS HD1 H -1.140 11.932 -7.757 1.00 . A A . 14 HIS HD1 1 1 10 4090 1 1 14 HIS HD2 H -3.825 8.998 -8.576 1.00 . A A . 14 HIS HD2 1 1 10 4091 1 1 14 HIS HE1 H -2.686 12.880 -9.436 1.00 . A A . 14 HIS HE1 1 1 10 4092 1 1 14 HIS N N -1.705 7.093 -7.992 1.00 . A A . 14 HIS N 1 1 10 4093 1 1 14 HIS ND1 N -1.894 11.432 -8.135 1.00 . A A . 14 HIS ND1 1 1 10 4094 1 1 14 HIS NE2 N -3.633 10.991 -9.335 1.00 . A A . 14 HIS NE2 1 1 10 4095 1 1 14 HIS O O 1.283 7.043 -7.165 1.00 . A A . 14 HIS O 1 1 10 4096 1 1 15 GLN C C 1.130 5.428 -4.826 1.00 . A A . 15 GLN C 1 1 10 4097 1 1 15 GLN CA C 0.896 6.878 -4.407 1.00 . A A . 15 GLN CA 1 1 10 4098 1 1 15 GLN CB C 0.244 6.913 -3.012 1.00 . A A . 15 GLN CB 1 1 10 4099 1 1 15 GLN CD C -1.726 8.487 -2.877 1.00 . A A . 15 GLN CD 1 1 10 4100 1 1 15 GLN CG C -0.213 8.349 -2.653 1.00 . A A . 15 GLN CG 1 1 10 4101 1 1 15 GLN H H -0.863 7.911 -5.123 1.00 . A A . 15 GLN H 1 1 10 4102 1 1 15 GLN HA H 1.850 7.381 -4.411 1.00 . A A . 15 GLN HA 1 1 10 4103 1 1 15 GLN HB2 H -0.593 6.231 -2.985 1.00 . A A . 15 GLN HB2 1 1 10 4104 1 1 15 GLN HB3 H 0.967 6.585 -2.280 1.00 . A A . 15 GLN HB3 1 1 10 4105 1 1 15 GLN HE21 H -1.530 9.948 -4.208 1.00 . A A . 15 GLN HE21 1 1 10 4106 1 1 15 GLN HE22 H -3.126 9.473 -3.877 1.00 . A A . 15 GLN HE22 1 1 10 4107 1 1 15 GLN HG2 H -0.003 8.552 -1.612 1.00 . A A . 15 GLN HG2 1 1 10 4108 1 1 15 GLN HG3 H 0.301 9.084 -3.257 1.00 . A A . 15 GLN HG3 1 1 10 4109 1 1 15 GLN N N -0.023 7.505 -5.418 1.00 . A A . 15 GLN N 1 1 10 4110 1 1 15 GLN NE2 N -2.163 9.377 -3.725 1.00 . A A . 15 GLN NE2 1 1 10 4111 1 1 15 GLN O O 2.149 4.842 -4.525 1.00 . A A . 15 GLN O 1 1 10 4112 1 1 15 GLN OE1 O -2.524 7.789 -2.284 1.00 . A A . 15 GLN OE1 1 1 10 4113 1 1 16 GLU C C 1.545 3.272 -6.720 1.00 . A A . 16 GLU C 1 1 10 4114 1 1 16 GLU CA C 0.198 3.512 -6.026 1.00 . A A . 16 GLU CA 1 1 10 4115 1 1 16 GLU CB C -0.951 3.329 -7.001 1.00 . A A . 16 GLU CB 1 1 10 4116 1 1 16 GLU CD C -2.224 1.615 -8.299 1.00 . A A . 16 GLU CD 1 1 10 4117 1 1 16 GLU CG C -0.872 1.934 -7.633 1.00 . A A . 16 GLU CG 1 1 10 4118 1 1 16 GLU H H -0.637 5.457 -5.718 1.00 . A A . 16 GLU H 1 1 10 4119 1 1 16 GLU HA H 0.087 2.832 -5.200 1.00 . A A . 16 GLU HA 1 1 10 4120 1 1 16 GLU HB2 H -1.891 3.464 -6.485 1.00 . A A . 16 GLU HB2 1 1 10 4121 1 1 16 GLU HB3 H -0.867 4.081 -7.768 1.00 . A A . 16 GLU HB3 1 1 10 4122 1 1 16 GLU HG2 H -0.082 1.924 -8.371 1.00 . A A . 16 GLU HG2 1 1 10 4123 1 1 16 GLU HG3 H -0.642 1.191 -6.881 1.00 . A A . 16 GLU HG3 1 1 10 4124 1 1 16 GLU N N 0.151 4.909 -5.523 1.00 . A A . 16 GLU N 1 1 10 4125 1 1 16 GLU O O 2.206 2.285 -6.459 1.00 . A A . 16 GLU O 1 1 10 4126 1 1 16 GLU OE1 O -3.118 1.209 -7.571 1.00 . A A . 16 GLU OE1 1 1 10 4127 1 1 16 GLU OE2 O -2.288 1.798 -9.502 1.00 . A A . 16 GLU OE2 1 1 10 4128 1 1 17 LEU C C 4.379 4.472 -7.447 1.00 . A A . 17 LEU C 1 1 10 4129 1 1 17 LEU CA C 3.196 4.054 -8.307 1.00 . A A . 17 LEU CA 1 1 10 4130 1 1 17 LEU CB C 3.117 4.898 -9.623 1.00 . A A . 17 LEU CB 1 1 10 4131 1 1 17 LEU CD1 C 4.997 6.600 -9.837 1.00 . A A . 17 LEU CD1 1 1 10 4132 1 1 17 LEU CD2 C 2.611 7.319 -10.192 1.00 . A A . 17 LEU CD2 1 1 10 4133 1 1 17 LEU CG C 3.530 6.377 -9.390 1.00 . A A . 17 LEU CG 1 1 10 4134 1 1 17 LEU H H 1.335 4.971 -7.744 1.00 . A A . 17 LEU H 1 1 10 4135 1 1 17 LEU HA H 3.324 3.019 -8.504 1.00 . A A . 17 LEU HA 1 1 10 4136 1 1 17 LEU HB2 H 3.760 4.446 -10.364 1.00 . A A . 17 LEU HB2 1 1 10 4137 1 1 17 LEU HB3 H 2.104 4.854 -9.998 1.00 . A A . 17 LEU HB3 1 1 10 4138 1 1 17 LEU HD11 H 5.661 5.916 -9.332 1.00 . A A . 17 LEU HD11 1 1 10 4139 1 1 17 LEU HD12 H 5.093 6.448 -10.904 1.00 . A A . 17 LEU HD12 1 1 10 4140 1 1 17 LEU HD13 H 5.303 7.609 -9.602 1.00 . A A . 17 LEU HD13 1 1 10 4141 1 1 17 LEU HD21 H 2.509 6.973 -11.210 1.00 . A A . 17 LEU HD21 1 1 10 4142 1 1 17 LEU HD22 H 1.635 7.353 -9.734 1.00 . A A . 17 LEU HD22 1 1 10 4143 1 1 17 LEU HD23 H 3.019 8.320 -10.203 1.00 . A A . 17 LEU HD23 1 1 10 4144 1 1 17 LEU HG H 3.434 6.591 -8.340 1.00 . A A . 17 LEU HG 1 1 10 4145 1 1 17 LEU N N 1.906 4.194 -7.580 1.00 . A A . 17 LEU N 1 1 10 4146 1 1 17 LEU O O 5.504 4.096 -7.697 1.00 . A A . 17 LEU O 1 1 10 4147 1 1 18 VAL C C 5.679 4.450 -4.774 1.00 . A A . 18 VAL C 1 1 10 4148 1 1 18 VAL CA C 5.235 5.683 -5.555 1.00 . A A . 18 VAL CA 1 1 10 4149 1 1 18 VAL CB C 4.723 6.775 -4.631 1.00 . A A . 18 VAL CB 1 1 10 4150 1 1 18 VAL CG1 C 5.899 7.310 -3.799 1.00 . A A . 18 VAL CG1 1 1 10 4151 1 1 18 VAL CG2 C 4.186 7.879 -5.546 1.00 . A A . 18 VAL CG2 1 1 10 4152 1 1 18 VAL H H 3.199 5.545 -6.269 1.00 . A A . 18 VAL H 1 1 10 4153 1 1 18 VAL HA H 6.056 6.035 -6.163 1.00 . A A . 18 VAL HA 1 1 10 4154 1 1 18 VAL HB H 3.947 6.404 -3.979 1.00 . A A . 18 VAL HB 1 1 10 4155 1 1 18 VAL HG11 H 6.683 7.670 -4.449 1.00 . A A . 18 VAL HG11 1 1 10 4156 1 1 18 VAL HG12 H 5.565 8.108 -3.156 1.00 . A A . 18 VAL HG12 1 1 10 4157 1 1 18 VAL HG13 H 6.304 6.522 -3.185 1.00 . A A . 18 VAL HG13 1 1 10 4158 1 1 18 VAL HG21 H 4.941 8.153 -6.269 1.00 . A A . 18 VAL HG21 1 1 10 4159 1 1 18 VAL HG22 H 3.329 7.504 -6.084 1.00 . A A . 18 VAL HG22 1 1 10 4160 1 1 18 VAL HG23 H 3.894 8.740 -4.971 1.00 . A A . 18 VAL HG23 1 1 10 4161 1 1 18 VAL N N 4.116 5.249 -6.439 1.00 . A A . 18 VAL N 1 1 10 4162 1 1 18 VAL O O 6.789 4.384 -4.292 1.00 . A A . 18 VAL O 1 1 10 4163 1 1 19 PHE C C 6.016 1.423 -4.848 1.00 . A A . 19 PHE C 1 1 10 4164 1 1 19 PHE CA C 5.080 2.241 -3.957 1.00 . A A . 19 PHE CA 1 1 10 4165 1 1 19 PHE CB C 3.788 1.446 -3.712 1.00 . A A . 19 PHE CB 1 1 10 4166 1 1 19 PHE CD1 C 3.015 3.341 -2.181 1.00 . A A . 19 PHE CD1 1 1 10 4167 1 1 19 PHE CD2 C 1.369 1.998 -3.257 1.00 . A A . 19 PHE CD2 1 1 10 4168 1 1 19 PHE CE1 C 2.023 4.077 -1.570 1.00 . A A . 19 PHE CE1 1 1 10 4169 1 1 19 PHE CE2 C 0.374 2.733 -2.644 1.00 . A A . 19 PHE CE2 1 1 10 4170 1 1 19 PHE CG C 2.699 2.294 -3.029 1.00 . A A . 19 PHE CG 1 1 10 4171 1 1 19 PHE CZ C 0.701 3.773 -1.801 1.00 . A A . 19 PHE CZ 1 1 10 4172 1 1 19 PHE H H 3.906 3.630 -5.106 1.00 . A A . 19 PHE H 1 1 10 4173 1 1 19 PHE HA H 5.581 2.496 -3.037 1.00 . A A . 19 PHE HA 1 1 10 4174 1 1 19 PHE HB2 H 3.404 1.078 -4.651 1.00 . A A . 19 PHE HB2 1 1 10 4175 1 1 19 PHE HB3 H 4.003 0.600 -3.078 1.00 . A A . 19 PHE HB3 1 1 10 4176 1 1 19 PHE HD1 H 4.048 3.588 -2.004 1.00 . A A . 19 PHE HD1 1 1 10 4177 1 1 19 PHE HD2 H 1.107 1.187 -3.925 1.00 . A A . 19 PHE HD2 1 1 10 4178 1 1 19 PHE HE1 H 2.284 4.891 -0.910 1.00 . A A . 19 PHE HE1 1 1 10 4179 1 1 19 PHE HE2 H -0.663 2.495 -2.824 1.00 . A A . 19 PHE HE2 1 1 10 4180 1 1 19 PHE HZ H -0.079 4.347 -1.322 1.00 . A A . 19 PHE HZ 1 1 10 4181 1 1 19 PHE N N 4.780 3.503 -4.685 1.00 . A A . 19 PHE N 1 1 10 4182 1 1 19 PHE O O 6.753 0.573 -4.386 1.00 . A A . 19 PHE O 1 1 10 4183 1 1 20 PHE C C 8.156 1.712 -7.054 1.00 . A A . 20 PHE C 1 1 10 4184 1 1 20 PHE CA C 6.795 1.020 -7.118 1.00 . A A . 20 PHE CA 1 1 10 4185 1 1 20 PHE CB C 6.152 1.155 -8.515 1.00 . A A . 20 PHE CB 1 1 10 4186 1 1 20 PHE CD1 C 7.481 -0.546 -9.842 1.00 . A A . 20 PHE CD1 1 1 10 4187 1 1 20 PHE CD2 C 7.842 1.767 -10.304 1.00 . A A . 20 PHE CD2 1 1 10 4188 1 1 20 PHE CE1 C 8.418 -0.883 -10.797 1.00 . A A . 20 PHE CE1 1 1 10 4189 1 1 20 PHE CE2 C 8.779 1.430 -11.258 1.00 . A A . 20 PHE CE2 1 1 10 4190 1 1 20 PHE CG C 7.187 0.779 -9.588 1.00 . A A . 20 PHE CG 1 1 10 4191 1 1 20 PHE CZ C 9.067 0.105 -11.505 1.00 . A A . 20 PHE CZ 1 1 10 4192 1 1 20 PHE H H 5.324 2.442 -6.400 1.00 . A A . 20 PHE H 1 1 10 4193 1 1 20 PHE HA H 6.900 -0.020 -6.839 1.00 . A A . 20 PHE HA 1 1 10 4194 1 1 20 PHE HB2 H 5.302 0.491 -8.581 1.00 . A A . 20 PHE HB2 1 1 10 4195 1 1 20 PHE HB3 H 5.807 2.158 -8.694 1.00 . A A . 20 PHE HB3 1 1 10 4196 1 1 20 PHE HD1 H 6.974 -1.324 -9.289 1.00 . A A . 20 PHE HD1 1 1 10 4197 1 1 20 PHE HD2 H 7.620 2.808 -10.115 1.00 . A A . 20 PHE HD2 1 1 10 4198 1 1 20 PHE HE1 H 8.642 -1.923 -10.989 1.00 . A A . 20 PHE HE1 1 1 10 4199 1 1 20 PHE HE2 H 9.287 2.205 -11.813 1.00 . A A . 20 PHE HE2 1 1 10 4200 1 1 20 PHE HZ H 9.800 -0.159 -12.253 1.00 . A A . 20 PHE HZ 1 1 10 4201 1 1 20 PHE N N 5.943 1.730 -6.120 1.00 . A A . 20 PHE N 1 1 10 4202 1 1 20 PHE O O 9.188 1.073 -7.038 1.00 . A A . 20 PHE O 1 1 10 4203 1 1 21 ALA C C 10.074 3.365 -5.665 1.00 . A A . 21 ALA C 1 1 10 4204 1 1 21 ALA CA C 9.373 3.815 -6.944 1.00 . A A . 21 ALA CA 1 1 10 4205 1 1 21 ALA CB C 9.020 5.304 -6.878 1.00 . A A . 21 ALA CB 1 1 10 4206 1 1 21 ALA H H 7.257 3.475 -7.038 1.00 . A A . 21 ALA H 1 1 10 4207 1 1 21 ALA HA H 9.988 3.578 -7.795 1.00 . A A . 21 ALA HA 1 1 10 4208 1 1 21 ALA HB1 H 8.326 5.490 -6.072 1.00 . A A . 21 ALA HB1 1 1 10 4209 1 1 21 ALA HB2 H 9.910 5.891 -6.709 1.00 . A A . 21 ALA HB2 1 1 10 4210 1 1 21 ALA HB3 H 8.567 5.618 -7.806 1.00 . A A . 21 ALA HB3 1 1 10 4211 1 1 21 ALA N N 8.118 3.019 -7.016 1.00 . A A . 21 ALA N 1 1 10 4212 1 1 21 ALA O O 11.280 3.222 -5.623 1.00 . A A . 21 ALA O 1 1 10 4213 1 1 22 GLU C C 10.535 1.357 -3.484 1.00 . A A . 22 GLU C 1 1 10 4214 1 1 22 GLU CA C 9.790 2.695 -3.340 1.00 . A A . 22 GLU CA 1 1 10 4215 1 1 22 GLU CB C 8.619 2.527 -2.353 1.00 . A A . 22 GLU CB 1 1 10 4216 1 1 22 GLU CD C 6.868 3.863 -1.112 1.00 . A A . 22 GLU CD 1 1 10 4217 1 1 22 GLU CG C 8.322 3.860 -1.629 1.00 . A A . 22 GLU CG 1 1 10 4218 1 1 22 GLU H H 8.297 3.282 -4.784 1.00 . A A . 22 GLU H 1 1 10 4219 1 1 22 GLU HA H 10.479 3.447 -3.006 1.00 . A A . 22 GLU HA 1 1 10 4220 1 1 22 GLU HB2 H 7.744 2.200 -2.890 1.00 . A A . 22 GLU HB2 1 1 10 4221 1 1 22 GLU HB3 H 8.861 1.776 -1.615 1.00 . A A . 22 GLU HB3 1 1 10 4222 1 1 22 GLU HG2 H 8.987 3.977 -0.786 1.00 . A A . 22 GLU HG2 1 1 10 4223 1 1 22 GLU HG3 H 8.466 4.694 -2.302 1.00 . A A . 22 GLU HG3 1 1 10 4224 1 1 22 GLU N N 9.262 3.144 -4.660 1.00 . A A . 22 GLU N 1 1 10 4225 1 1 22 GLU O O 11.538 1.126 -2.836 1.00 . A A . 22 GLU O 1 1 10 4226 1 1 22 GLU OE1 O 6.546 2.961 -0.355 1.00 . A A . 22 GLU OE1 1 1 10 4227 1 1 22 GLU OE2 O 6.153 4.770 -1.502 1.00 . A A . 22 GLU OE2 1 1 10 4228 1 1 23 ASP C C 11.947 -0.636 -5.325 1.00 . A A . 23 ASP C 1 1 10 4229 1 1 23 ASP CA C 10.601 -0.822 -4.606 1.00 . A A . 23 ASP CA 1 1 10 4230 1 1 23 ASP CB C 9.567 -1.645 -5.462 1.00 . A A . 23 ASP CB 1 1 10 4231 1 1 23 ASP CG C 10.128 -2.118 -6.823 1.00 . A A . 23 ASP CG 1 1 10 4232 1 1 23 ASP H H 9.198 0.803 -4.822 1.00 . A A . 23 ASP H 1 1 10 4233 1 1 23 ASP HA H 10.773 -1.317 -3.661 1.00 . A A . 23 ASP HA 1 1 10 4234 1 1 23 ASP HB2 H 9.269 -2.518 -4.899 1.00 . A A . 23 ASP HB2 1 1 10 4235 1 1 23 ASP HB3 H 8.680 -1.053 -5.636 1.00 . A A . 23 ASP HB3 1 1 10 4236 1 1 23 ASP N N 10.004 0.525 -4.344 1.00 . A A . 23 ASP N 1 1 10 4237 1 1 23 ASP O O 12.947 -1.197 -4.920 1.00 . A A . 23 ASP O 1 1 10 4238 1 1 23 ASP OD1 O 10.891 -3.070 -6.793 1.00 . A A . 23 ASP OD1 1 1 10 4239 1 1 23 ASP OD2 O 9.766 -1.503 -7.812 1.00 . A A . 23 ASP OD2 1 1 10 4240 1 1 24 VAL C C 14.257 0.943 -6.257 1.00 . A A . 24 VAL C 1 1 10 4241 1 1 24 VAL CA C 13.132 0.443 -7.183 1.00 . A A . 24 VAL CA 1 1 10 4242 1 1 24 VAL CB C 12.762 1.518 -8.250 1.00 . A A . 24 VAL CB 1 1 10 4243 1 1 24 VAL CG1 C 14.026 2.008 -9.000 1.00 . A A . 24 VAL CG1 1 1 10 4244 1 1 24 VAL CG2 C 11.774 0.910 -9.271 1.00 . A A . 24 VAL CG2 1 1 10 4245 1 1 24 VAL H H 11.051 0.547 -6.623 1.00 . A A . 24 VAL H 1 1 10 4246 1 1 24 VAL HA H 13.454 -0.471 -7.663 1.00 . A A . 24 VAL HA 1 1 10 4247 1 1 24 VAL HB H 12.290 2.357 -7.764 1.00 . A A . 24 VAL HB 1 1 10 4248 1 1 24 VAL HG11 H 14.715 1.193 -9.162 1.00 . A A . 24 VAL HG11 1 1 10 4249 1 1 24 VAL HG12 H 13.759 2.431 -9.959 1.00 . A A . 24 VAL HG12 1 1 10 4250 1 1 24 VAL HG13 H 14.521 2.773 -8.421 1.00 . A A . 24 VAL HG13 1 1 10 4251 1 1 24 VAL HG21 H 12.182 0.006 -9.700 1.00 . A A . 24 VAL HG21 1 1 10 4252 1 1 24 VAL HG22 H 10.838 0.673 -8.790 1.00 . A A . 24 VAL HG22 1 1 10 4253 1 1 24 VAL HG23 H 11.579 1.616 -10.066 1.00 . A A . 24 VAL HG23 1 1 10 4254 1 1 24 VAL N N 11.909 0.151 -6.371 1.00 . A A . 24 VAL N 1 1 10 4255 1 1 24 VAL O O 15.329 0.370 -6.227 1.00 . A A . 24 VAL O 1 1 10 4256 1 1 25 GLY C C 16.276 3.069 -5.214 1.00 . A A . 25 GLY C 1 1 10 4257 1 1 25 GLY CA C 14.952 2.602 -4.579 1.00 . A A . 25 GLY CA 1 1 10 4258 1 1 25 GLY H H 13.076 2.396 -5.609 1.00 . A A . 25 GLY H 1 1 10 4259 1 1 25 GLY HA2 H 14.484 3.454 -4.108 1.00 . A A . 25 GLY HA2 1 1 10 4260 1 1 25 GLY HA3 H 15.180 1.874 -3.814 1.00 . A A . 25 GLY HA3 1 1 10 4261 1 1 25 GLY N N 13.966 1.996 -5.531 1.00 . A A . 25 GLY N 1 1 10 4262 1 1 25 GLY O O 17.124 3.594 -4.518 1.00 . A A . 25 GLY O 1 1 10 4263 1 1 26 SER C C 17.631 4.810 -7.389 1.00 . A A . 26 SER C 1 1 10 4264 1 1 26 SER CA C 17.667 3.287 -7.214 1.00 . A A . 26 SER CA 1 1 10 4265 1 1 26 SER CB C 17.705 2.542 -8.575 1.00 . A A . 26 SER CB 1 1 10 4266 1 1 26 SER H H 15.701 2.446 -7.008 1.00 . A A . 26 SER H 1 1 10 4267 1 1 26 SER HA H 18.530 3.023 -6.624 1.00 . A A . 26 SER HA 1 1 10 4268 1 1 26 SER HB2 H 16.851 2.777 -9.192 1.00 . A A . 26 SER HB2 1 1 10 4269 1 1 26 SER HB3 H 18.619 2.748 -9.113 1.00 . A A . 26 SER HB3 1 1 10 4270 1 1 26 SER HG H 17.579 1.073 -7.283 1.00 . A A . 26 SER HG 1 1 10 4271 1 1 26 SER N N 16.422 2.872 -6.501 1.00 . A A . 26 SER N 1 1 10 4272 1 1 26 SER O O 18.038 5.533 -6.500 1.00 . A A . 26 SER O 1 1 10 4273 1 1 26 SER OG O 17.660 1.162 -8.235 1.00 . A A . 26 SER OG 1 1 10 4274 1 1 27 ASN C C 16.031 7.347 -7.822 1.00 . A A . 27 ASN C 1 1 10 4275 1 1 27 ASN CA C 17.056 6.725 -8.790 1.00 . A A . 27 ASN CA 1 1 10 4276 1 1 27 ASN CB C 16.618 6.933 -10.257 1.00 . A A . 27 ASN CB 1 1 10 4277 1 1 27 ASN CG C 15.218 6.347 -10.508 1.00 . A A . 27 ASN CG 1 1 10 4278 1 1 27 ASN H H 16.836 4.618 -9.192 1.00 . A A . 27 ASN H 1 1 10 4279 1 1 27 ASN HA H 18.023 7.176 -8.620 1.00 . A A . 27 ASN HA 1 1 10 4280 1 1 27 ASN HB2 H 16.602 7.989 -10.488 1.00 . A A . 27 ASN HB2 1 1 10 4281 1 1 27 ASN HB3 H 17.318 6.447 -10.921 1.00 . A A . 27 ASN HB3 1 1 10 4282 1 1 27 ASN HD21 H 14.499 8.055 -11.220 1.00 . A A . 27 ASN HD21 1 1 10 4283 1 1 27 ASN HD22 H 13.399 6.764 -11.179 1.00 . A A . 27 ASN HD22 1 1 10 4284 1 1 27 ASN N N 17.145 5.256 -8.519 1.00 . A A . 27 ASN N 1 1 10 4285 1 1 27 ASN ND2 N 14.295 7.120 -11.011 1.00 . A A . 27 ASN ND2 1 1 10 4286 1 1 27 ASN O O 16.021 8.542 -7.598 1.00 . A A . 27 ASN O 1 1 10 4287 1 1 27 ASN OD1 O 14.952 5.190 -10.251 1.00 . A A . 27 ASN OD1 1 1 10 4288 1 1 28 LYS C C 14.770 7.041 -4.918 1.00 . A A . 28 LYS C 1 1 10 4289 1 1 28 LYS CA C 14.143 6.899 -6.318 1.00 . A A . 28 LYS CA 1 1 10 4290 1 1 28 LYS CB C 13.025 5.824 -6.285 1.00 . A A . 28 LYS CB 1 1 10 4291 1 1 28 LYS CD C 12.133 6.465 -8.577 1.00 . A A . 28 LYS CD 1 1 10 4292 1 1 28 LYS CE C 11.512 5.875 -9.854 1.00 . A A . 28 LYS CE 1 1 10 4293 1 1 28 LYS CG C 12.680 5.316 -7.705 1.00 . A A . 28 LYS CG 1 1 10 4294 1 1 28 LYS H H 15.281 5.538 -7.521 1.00 . A A . 28 LYS H 1 1 10 4295 1 1 28 LYS HA H 13.732 7.850 -6.629 1.00 . A A . 28 LYS HA 1 1 10 4296 1 1 28 LYS HB2 H 13.350 4.983 -5.690 1.00 . A A . 28 LYS HB2 1 1 10 4297 1 1 28 LYS HB3 H 12.142 6.241 -5.822 1.00 . A A . 28 LYS HB3 1 1 10 4298 1 1 28 LYS HD2 H 11.382 7.020 -8.035 1.00 . A A . 28 LYS HD2 1 1 10 4299 1 1 28 LYS HD3 H 12.935 7.139 -8.839 1.00 . A A . 28 LYS HD3 1 1 10 4300 1 1 28 LYS HE2 H 12.190 5.173 -10.319 1.00 . A A . 28 LYS HE2 1 1 10 4301 1 1 28 LYS HE3 H 10.588 5.366 -9.620 1.00 . A A . 28 LYS HE3 1 1 10 4302 1 1 28 LYS HG2 H 13.555 4.886 -8.168 1.00 . A A . 28 LYS HG2 1 1 10 4303 1 1 28 LYS HG3 H 11.934 4.544 -7.627 1.00 . A A . 28 LYS HG3 1 1 10 4304 1 1 28 LYS HZ1 H 11.502 7.880 -10.421 1.00 . A A . 28 LYS HZ1 1 1 10 4305 1 1 28 LYS HZ2 H 11.752 6.796 -11.704 1.00 . A A . 28 LYS HZ2 1 1 10 4306 1 1 28 LYS HZ3 H 10.201 6.979 -11.036 1.00 . A A . 28 LYS HZ3 1 1 10 4307 1 1 28 LYS N N 15.204 6.485 -7.283 1.00 . A A . 28 LYS N 1 1 10 4308 1 1 28 LYS NZ N 11.219 6.964 -10.826 1.00 . A A . 28 LYS NZ 1 1 10 4309 1 1 28 LYS O O 14.418 8.006 -4.260 1.00 . A A . 28 LYS O 1 1 10 4310 1 1 28 LYS OXT O 15.566 6.175 -4.586 1.00 . A A . 28 LYS OXT 1 1 11 4311 1 1 1 ASP C C -13.710 -11.365 -10.414 1.00 . A A . 1 ASP C 1 1 11 4312 1 1 1 ASP CA C -14.016 -12.845 -10.128 1.00 . A A . 1 ASP CA 1 1 11 4313 1 1 1 ASP CB C -12.738 -13.699 -10.309 1.00 . A A . 1 ASP CB 1 1 11 4314 1 1 1 ASP CG C -13.023 -15.141 -9.855 1.00 . A A . 1 ASP CG 1 1 11 4315 1 1 1 ASP H1 H -15.362 -12.544 -11.689 1.00 . A A . 1 ASP H1 1 1 11 4316 1 1 1 ASP H2 H -14.700 -14.110 -11.635 1.00 . A A . 1 ASP H2 1 1 11 4317 1 1 1 ASP H3 H -15.892 -13.652 -10.516 1.00 . A A . 1 ASP H3 1 1 11 4318 1 1 1 ASP HA H -14.384 -12.937 -9.115 1.00 . A A . 1 ASP HA 1 1 11 4319 1 1 1 ASP HB2 H -12.434 -13.707 -11.346 1.00 . A A . 1 ASP HB2 1 1 11 4320 1 1 1 ASP HB3 H -11.930 -13.292 -9.716 1.00 . A A . 1 ASP HB3 1 1 11 4321 1 1 1 ASP N N -15.073 -13.323 -11.064 1.00 . A A . 1 ASP N 1 1 11 4322 1 1 1 ASP O O -12.765 -11.033 -11.105 1.00 . A A . 1 ASP O 1 1 11 4323 1 1 1 ASP OD1 O -13.522 -15.882 -10.688 1.00 . A A . 1 ASP OD1 1 1 11 4324 1 1 1 ASP OD2 O -12.728 -15.421 -8.704 1.00 . A A . 1 ASP OD2 1 1 11 4325 1 1 2 ALA C C -13.132 -8.517 -9.298 1.00 . A A . 2 ALA C 1 1 11 4326 1 1 2 ALA CA C -14.378 -9.035 -10.040 1.00 . A A . 2 ALA CA 1 1 11 4327 1 1 2 ALA CB C -15.629 -8.335 -9.500 1.00 . A A . 2 ALA CB 1 1 11 4328 1 1 2 ALA H H -15.280 -10.854 -9.313 1.00 . A A . 2 ALA H 1 1 11 4329 1 1 2 ALA HA H -14.268 -8.822 -11.094 1.00 . A A . 2 ALA HA 1 1 11 4330 1 1 2 ALA HB1 H -16.509 -8.711 -10.001 1.00 . A A . 2 ALA HB1 1 1 11 4331 1 1 2 ALA HB2 H -15.729 -8.517 -8.439 1.00 . A A . 2 ALA HB2 1 1 11 4332 1 1 2 ALA HB3 H -15.562 -7.270 -9.666 1.00 . A A . 2 ALA HB3 1 1 11 4333 1 1 2 ALA N N -14.540 -10.515 -9.858 1.00 . A A . 2 ALA N 1 1 11 4334 1 1 2 ALA O O -12.664 -7.427 -9.565 1.00 . A A . 2 ALA O 1 1 11 4335 1 1 3 GLU C C -11.540 -7.716 -6.774 1.00 . A A . 3 GLU C 1 1 11 4336 1 1 3 GLU CA C -11.449 -9.040 -7.550 1.00 . A A . 3 GLU CA 1 1 11 4337 1 1 3 GLU CB C -10.202 -9.104 -8.522 1.00 . A A . 3 GLU CB 1 1 11 4338 1 1 3 GLU CD C -8.435 -7.265 -8.154 1.00 . A A . 3 GLU CD 1 1 11 4339 1 1 3 GLU CG C -9.652 -7.720 -8.995 1.00 . A A . 3 GLU CG 1 1 11 4340 1 1 3 GLU H H -13.108 -10.188 -8.256 1.00 . A A . 3 GLU H 1 1 11 4341 1 1 3 GLU HA H -11.397 -9.821 -6.814 1.00 . A A . 3 GLU HA 1 1 11 4342 1 1 3 GLU HB2 H -9.419 -9.670 -8.045 1.00 . A A . 3 GLU HB2 1 1 11 4343 1 1 3 GLU HB3 H -10.486 -9.656 -9.406 1.00 . A A . 3 GLU HB3 1 1 11 4344 1 1 3 GLU HG2 H -9.335 -7.810 -10.023 1.00 . A A . 3 GLU HG2 1 1 11 4345 1 1 3 GLU HG3 H -10.421 -6.963 -8.949 1.00 . A A . 3 GLU HG3 1 1 11 4346 1 1 3 GLU N N -12.652 -9.333 -8.392 1.00 . A A . 3 GLU N 1 1 11 4347 1 1 3 GLU O O -10.561 -7.179 -6.296 1.00 . A A . 3 GLU O 1 1 11 4348 1 1 3 GLU OE1 O -7.554 -8.084 -7.938 1.00 . A A . 3 GLU OE1 1 1 11 4349 1 1 3 GLU OE2 O -8.449 -6.107 -7.767 1.00 . A A . 3 GLU OE2 1 1 11 4350 1 1 4 PHE C C -12.398 -5.980 -4.529 1.00 . A A . 4 PHE C 1 1 11 4351 1 1 4 PHE CA C -13.013 -5.957 -5.936 1.00 . A A . 4 PHE CA 1 1 11 4352 1 1 4 PHE CB C -14.541 -5.751 -5.847 1.00 . A A . 4 PHE CB 1 1 11 4353 1 1 4 PHE CD1 C -14.846 -4.176 -3.874 1.00 . A A . 4 PHE CD1 1 1 11 4354 1 1 4 PHE CD2 C -15.130 -3.293 -6.072 1.00 . A A . 4 PHE CD2 1 1 11 4355 1 1 4 PHE CE1 C -15.119 -2.935 -3.338 1.00 . A A . 4 PHE CE1 1 1 11 4356 1 1 4 PHE CE2 C -15.403 -2.051 -5.536 1.00 . A A . 4 PHE CE2 1 1 11 4357 1 1 4 PHE CG C -14.849 -4.366 -5.246 1.00 . A A . 4 PHE CG 1 1 11 4358 1 1 4 PHE CZ C -15.397 -1.872 -4.169 1.00 . A A . 4 PHE CZ 1 1 11 4359 1 1 4 PHE H H -13.480 -7.748 -7.058 1.00 . A A . 4 PHE H 1 1 11 4360 1 1 4 PHE HA H -12.569 -5.148 -6.499 1.00 . A A . 4 PHE HA 1 1 11 4361 1 1 4 PHE HB2 H -14.978 -5.813 -6.833 1.00 . A A . 4 PHE HB2 1 1 11 4362 1 1 4 PHE HB3 H -14.992 -6.511 -5.225 1.00 . A A . 4 PHE HB3 1 1 11 4363 1 1 4 PHE HD1 H -14.631 -5.003 -3.214 1.00 . A A . 4 PHE HD1 1 1 11 4364 1 1 4 PHE HD2 H -15.135 -3.424 -7.144 1.00 . A A . 4 PHE HD2 1 1 11 4365 1 1 4 PHE HE1 H -15.115 -2.797 -2.267 1.00 . A A . 4 PHE HE1 1 1 11 4366 1 1 4 PHE HE2 H -15.620 -1.218 -6.188 1.00 . A A . 4 PHE HE2 1 1 11 4367 1 1 4 PHE HZ H -15.611 -0.899 -3.750 1.00 . A A . 4 PHE HZ 1 1 11 4368 1 1 4 PHE N N -12.748 -7.238 -6.659 1.00 . A A . 4 PHE N 1 1 11 4369 1 1 4 PHE O O -11.569 -5.154 -4.205 1.00 . A A . 4 PHE O 1 1 11 4370 1 1 5 ARG C C -10.819 -7.419 -2.177 1.00 . A A . 5 ARG C 1 1 11 4371 1 1 5 ARG CA C -12.306 -7.080 -2.342 1.00 . A A . 5 ARG CA 1 1 11 4372 1 1 5 ARG CB C -13.165 -8.156 -1.606 1.00 . A A . 5 ARG CB 1 1 11 4373 1 1 5 ARG CD C -14.979 -9.196 -3.039 1.00 . A A . 5 ARG CD 1 1 11 4374 1 1 5 ARG CG C -13.529 -9.353 -2.532 1.00 . A A . 5 ARG CG 1 1 11 4375 1 1 5 ARG CZ C -16.377 -10.188 -1.273 1.00 . A A . 5 ARG CZ 1 1 11 4376 1 1 5 ARG H H -13.473 -7.580 -4.090 1.00 . A A . 5 ARG H 1 1 11 4377 1 1 5 ARG HA H -12.448 -6.122 -1.885 1.00 . A A . 5 ARG HA 1 1 11 4378 1 1 5 ARG HB2 H -12.635 -8.537 -0.745 1.00 . A A . 5 ARG HB2 1 1 11 4379 1 1 5 ARG HB3 H -14.060 -7.673 -1.242 1.00 . A A . 5 ARG HB3 1 1 11 4380 1 1 5 ARG HD2 H -15.084 -8.281 -3.605 1.00 . A A . 5 ARG HD2 1 1 11 4381 1 1 5 ARG HD3 H -15.261 -10.027 -3.667 1.00 . A A . 5 ARG HD3 1 1 11 4382 1 1 5 ARG HE H -16.126 -8.233 -1.505 1.00 . A A . 5 ARG HE 1 1 11 4383 1 1 5 ARG HG2 H -12.853 -9.409 -3.372 1.00 . A A . 5 ARG HG2 1 1 11 4384 1 1 5 ARG HG3 H -13.446 -10.273 -1.972 1.00 . A A . 5 ARG HG3 1 1 11 4385 1 1 5 ARG HH11 H -15.479 -11.495 -2.501 1.00 . A A . 5 ARG HH11 1 1 11 4386 1 1 5 ARG HH12 H -16.463 -12.187 -1.258 1.00 . A A . 5 ARG HH12 1 1 11 4387 1 1 5 ARG HH21 H -17.372 -9.096 0.076 1.00 . A A . 5 ARG HH21 1 1 11 4388 1 1 5 ARG HH22 H -17.550 -10.814 0.225 1.00 . A A . 5 ARG HH22 1 1 11 4389 1 1 5 ARG N N -12.816 -6.942 -3.745 1.00 . A A . 5 ARG N 1 1 11 4390 1 1 5 ARG NE N -15.890 -9.118 -1.854 1.00 . A A . 5 ARG NE 1 1 11 4391 1 1 5 ARG NH1 N -16.083 -11.382 -1.713 1.00 . A A . 5 ARG NH1 1 1 11 4392 1 1 5 ARG NH2 N -17.161 -10.020 -0.243 1.00 . A A . 5 ARG NH2 1 1 11 4393 1 1 5 ARG O O -10.360 -7.720 -1.091 1.00 . A A . 5 ARG O 1 1 11 4394 1 1 6 HIS C C -7.905 -6.319 -3.061 1.00 . A A . 6 HIS C 1 1 11 4395 1 1 6 HIS CA C -8.649 -7.643 -3.272 1.00 . A A . 6 HIS CA 1 1 11 4396 1 1 6 HIS CB C -8.221 -8.243 -4.621 1.00 . A A . 6 HIS CB 1 1 11 4397 1 1 6 HIS CD2 C -10.011 -10.197 -4.281 1.00 . A A . 6 HIS CD2 1 1 11 4398 1 1 6 HIS CE1 C -9.419 -11.394 -5.865 1.00 . A A . 6 HIS CE1 1 1 11 4399 1 1 6 HIS CG C -8.946 -9.565 -4.908 1.00 . A A . 6 HIS CG 1 1 11 4400 1 1 6 HIS H H -10.562 -7.098 -4.090 1.00 . A A . 6 HIS H 1 1 11 4401 1 1 6 HIS HA H -8.425 -8.320 -2.467 1.00 . A A . 6 HIS HA 1 1 11 4402 1 1 6 HIS HB2 H -8.426 -7.549 -5.421 1.00 . A A . 6 HIS HB2 1 1 11 4403 1 1 6 HIS HB3 H -7.159 -8.437 -4.607 1.00 . A A . 6 HIS HB3 1 1 11 4404 1 1 6 HIS HD1 H -7.914 -10.208 -6.521 1.00 . A A . 6 HIS HD1 1 1 11 4405 1 1 6 HIS HD2 H -10.539 -9.820 -3.419 1.00 . A A . 6 HIS HD2 1 1 11 4406 1 1 6 HIS HE1 H -9.362 -12.206 -6.575 1.00 . A A . 6 HIS HE1 1 1 11 4407 1 1 6 HIS N N -10.112 -7.350 -3.268 1.00 . A A . 6 HIS N 1 1 11 4408 1 1 6 HIS ND1 N -8.636 -10.363 -5.875 1.00 . A A . 6 HIS ND1 1 1 11 4409 1 1 6 HIS NE2 N -10.290 -11.332 -4.890 1.00 . A A . 6 HIS NE2 1 1 11 4410 1 1 6 HIS O O -6.753 -6.300 -2.673 1.00 . A A . 6 HIS O 1 1 11 4411 1 1 7 ASP C C -9.236 -2.917 -2.906 1.00 . A A . 7 ASP C 1 1 11 4412 1 1 7 ASP CA C -8.075 -3.873 -3.196 1.00 . A A . 7 ASP CA 1 1 11 4413 1 1 7 ASP CB C -7.375 -3.499 -4.525 1.00 . A A . 7 ASP CB 1 1 11 4414 1 1 7 ASP CG C -8.449 -3.168 -5.599 1.00 . A A . 7 ASP CG 1 1 11 4415 1 1 7 ASP H H -9.533 -5.340 -3.642 1.00 . A A . 7 ASP H 1 1 11 4416 1 1 7 ASP HA H -7.419 -3.858 -2.348 1.00 . A A . 7 ASP HA 1 1 11 4417 1 1 7 ASP HB2 H -6.727 -2.648 -4.379 1.00 . A A . 7 ASP HB2 1 1 11 4418 1 1 7 ASP HB3 H -6.779 -4.329 -4.879 1.00 . A A . 7 ASP HB3 1 1 11 4419 1 1 7 ASP N N -8.612 -5.251 -3.335 1.00 . A A . 7 ASP N 1 1 11 4420 1 1 7 ASP O O -9.119 -1.724 -3.092 1.00 . A A . 7 ASP O 1 1 11 4421 1 1 7 ASP OD1 O -9.243 -4.054 -5.877 1.00 . A A . 7 ASP OD1 1 1 11 4422 1 1 7 ASP OD2 O -8.418 -2.045 -6.078 1.00 . A A . 7 ASP OD2 1 1 11 4423 1 1 8 SER C C -11.946 -1.804 -3.356 1.00 . A A . 8 SER C 1 1 11 4424 1 1 8 SER CA C -11.556 -2.678 -2.139 1.00 . A A . 8 SER CA 1 1 11 4425 1 1 8 SER CB C -11.263 -1.794 -0.901 1.00 . A A . 8 SER CB 1 1 11 4426 1 1 8 SER H H -10.319 -4.449 -2.333 1.00 . A A . 8 SER H 1 1 11 4427 1 1 8 SER HA H -12.361 -3.371 -1.953 1.00 . A A . 8 SER HA 1 1 11 4428 1 1 8 SER HB2 H -10.743 -2.347 -0.132 1.00 . A A . 8 SER HB2 1 1 11 4429 1 1 8 SER HB3 H -10.706 -0.904 -1.158 1.00 . A A . 8 SER HB3 1 1 11 4430 1 1 8 SER HG H -12.641 -1.753 0.470 1.00 . A A . 8 SER HG 1 1 11 4431 1 1 8 SER N N -10.327 -3.479 -2.459 1.00 . A A . 8 SER N 1 1 11 4432 1 1 8 SER O O -12.589 -0.779 -3.231 1.00 . A A . 8 SER O 1 1 11 4433 1 1 8 SER OG O -12.551 -1.427 -0.427 1.00 . A A . 8 SER OG 1 1 11 4434 1 1 9 GLY C C -11.289 -0.144 -5.816 1.00 . A A . 9 GLY C 1 1 11 4435 1 1 9 GLY CA C -11.786 -1.594 -5.811 1.00 . A A . 9 GLY CA 1 1 11 4436 1 1 9 GLY H H -11.022 -3.112 -4.486 1.00 . A A . 9 GLY H 1 1 11 4437 1 1 9 GLY HA2 H -11.281 -2.139 -6.596 1.00 . A A . 9 GLY HA2 1 1 11 4438 1 1 9 GLY HA3 H -12.846 -1.602 -6.006 1.00 . A A . 9 GLY HA3 1 1 11 4439 1 1 9 GLY N N -11.526 -2.275 -4.504 1.00 . A A . 9 GLY N 1 1 11 4440 1 1 9 GLY O O -11.894 0.705 -6.443 1.00 . A A . 9 GLY O 1 1 11 4441 1 1 10 TYR C C -8.656 1.707 -6.205 1.00 . A A . 10 TYR C 1 1 11 4442 1 1 10 TYR CA C -9.625 1.460 -5.047 1.00 . A A . 10 TYR CA 1 1 11 4443 1 1 10 TYR CB C -8.909 1.594 -3.672 1.00 . A A . 10 TYR CB 1 1 11 4444 1 1 10 TYR CD1 C -6.783 0.283 -4.059 1.00 . A A . 10 TYR CD1 1 1 11 4445 1 1 10 TYR CD2 C -6.582 2.626 -3.728 1.00 . A A . 10 TYR CD2 1 1 11 4446 1 1 10 TYR CE1 C -5.422 0.177 -4.210 1.00 . A A . 10 TYR CE1 1 1 11 4447 1 1 10 TYR CE2 C -5.216 2.523 -3.879 1.00 . A A . 10 TYR CE2 1 1 11 4448 1 1 10 TYR CG C -7.378 1.502 -3.818 1.00 . A A . 10 TYR CG 1 1 11 4449 1 1 10 TYR CZ C -4.625 1.299 -4.121 1.00 . A A . 10 TYR CZ 1 1 11 4450 1 1 10 TYR H H -9.745 -0.610 -4.632 1.00 . A A . 10 TYR H 1 1 11 4451 1 1 10 TYR HA H -10.430 2.172 -5.099 1.00 . A A . 10 TYR HA 1 1 11 4452 1 1 10 TYR HB2 H -9.166 2.541 -3.229 1.00 . A A . 10 TYR HB2 1 1 11 4453 1 1 10 TYR HB3 H -9.240 0.801 -3.016 1.00 . A A . 10 TYR HB3 1 1 11 4454 1 1 10 TYR HD1 H -7.390 -0.602 -4.134 1.00 . A A . 10 TYR HD1 1 1 11 4455 1 1 10 TYR HD2 H -7.026 3.592 -3.538 1.00 . A A . 10 TYR HD2 1 1 11 4456 1 1 10 TYR HE1 H -4.989 -0.793 -4.399 1.00 . A A . 10 TYR HE1 1 1 11 4457 1 1 10 TYR HE2 H -4.609 3.410 -3.806 1.00 . A A . 10 TYR HE2 1 1 11 4458 1 1 10 TYR HH H -3.078 1.121 -5.217 1.00 . A A . 10 TYR HH 1 1 11 4459 1 1 10 TYR N N -10.203 0.097 -5.122 1.00 . A A . 10 TYR N 1 1 11 4460 1 1 10 TYR O O -8.004 0.796 -6.679 1.00 . A A . 10 TYR O 1 1 11 4461 1 1 10 TYR OH O -3.257 1.201 -4.277 1.00 . A A . 10 TYR OH 1 1 11 4462 1 1 11 GLU C C -7.113 4.701 -7.384 1.00 . A A . 11 GLU C 1 1 11 4463 1 1 11 GLU CA C -7.697 3.339 -7.729 1.00 . A A . 11 GLU CA 1 1 11 4464 1 1 11 GLU CB C -8.495 3.423 -9.046 1.00 . A A . 11 GLU CB 1 1 11 4465 1 1 11 GLU CD C -9.962 1.307 -8.977 1.00 . A A . 11 GLU CD 1 1 11 4466 1 1 11 GLU CG C -8.732 1.998 -9.619 1.00 . A A . 11 GLU CG 1 1 11 4467 1 1 11 GLU H H -9.158 3.622 -6.180 1.00 . A A . 11 GLU H 1 1 11 4468 1 1 11 GLU HA H -6.880 2.634 -7.774 1.00 . A A . 11 GLU HA 1 1 11 4469 1 1 11 GLU HB2 H -9.432 3.935 -8.877 1.00 . A A . 11 GLU HB2 1 1 11 4470 1 1 11 GLU HB3 H -7.931 3.995 -9.769 1.00 . A A . 11 GLU HB3 1 1 11 4471 1 1 11 GLU HG2 H -8.895 2.068 -10.684 1.00 . A A . 11 GLU HG2 1 1 11 4472 1 1 11 GLU HG3 H -7.852 1.391 -9.452 1.00 . A A . 11 GLU HG3 1 1 11 4473 1 1 11 GLU N N -8.600 2.944 -6.613 1.00 . A A . 11 GLU N 1 1 11 4474 1 1 11 GLU O O -7.832 5.626 -7.056 1.00 . A A . 11 GLU O 1 1 11 4475 1 1 11 GLU OE1 O -10.979 1.971 -8.851 1.00 . A A . 11 GLU OE1 1 1 11 4476 1 1 11 GLU OE2 O -9.819 0.140 -8.646 1.00 . A A . 11 GLU OE2 1 1 11 4477 1 1 12 VAL C C -4.097 6.309 -8.288 1.00 . A A . 12 VAL C 1 1 11 4478 1 1 12 VAL CA C -5.075 6.022 -7.167 1.00 . A A . 12 VAL CA 1 1 11 4479 1 1 12 VAL CB C -4.362 5.821 -5.799 1.00 . A A . 12 VAL CB 1 1 11 4480 1 1 12 VAL CG1 C -3.173 6.794 -5.595 1.00 . A A . 12 VAL CG1 1 1 11 4481 1 1 12 VAL CG2 C -5.396 6.089 -4.713 1.00 . A A . 12 VAL CG2 1 1 11 4482 1 1 12 VAL H H -5.314 3.963 -7.749 1.00 . A A . 12 VAL H 1 1 11 4483 1 1 12 VAL HA H -5.768 6.848 -7.128 1.00 . A A . 12 VAL HA 1 1 11 4484 1 1 12 VAL HB H -4.014 4.803 -5.711 1.00 . A A . 12 VAL HB 1 1 11 4485 1 1 12 VAL HG11 H -3.446 7.791 -5.905 1.00 . A A . 12 VAL HG11 1 1 11 4486 1 1 12 VAL HG12 H -2.884 6.817 -4.554 1.00 . A A . 12 VAL HG12 1 1 11 4487 1 1 12 VAL HG13 H -2.324 6.463 -6.171 1.00 . A A . 12 VAL HG13 1 1 11 4488 1 1 12 VAL HG21 H -6.234 5.420 -4.842 1.00 . A A . 12 VAL HG21 1 1 11 4489 1 1 12 VAL HG22 H -4.958 5.931 -3.741 1.00 . A A . 12 VAL HG22 1 1 11 4490 1 1 12 VAL HG23 H -5.746 7.108 -4.790 1.00 . A A . 12 VAL HG23 1 1 11 4491 1 1 12 VAL N N -5.812 4.762 -7.474 1.00 . A A . 12 VAL N 1 1 11 4492 1 1 12 VAL O O -4.225 7.319 -8.945 1.00 . A A . 12 VAL O 1 1 11 4493 1 1 13 HIS C C -1.016 6.524 -9.094 1.00 . A A . 13 HIS C 1 1 11 4494 1 1 13 HIS CA C -2.111 5.521 -9.519 1.00 . A A . 13 HIS CA 1 1 11 4495 1 1 13 HIS CB C -2.737 5.983 -10.875 1.00 . A A . 13 HIS CB 1 1 11 4496 1 1 13 HIS CD2 C -4.718 4.187 -10.572 1.00 . A A . 13 HIS CD2 1 1 11 4497 1 1 13 HIS CE1 C -5.613 4.458 -12.420 1.00 . A A . 13 HIS CE1 1 1 11 4498 1 1 13 HIS CG C -3.988 5.158 -11.251 1.00 . A A . 13 HIS CG 1 1 11 4499 1 1 13 HIS H H -3.162 4.621 -7.875 1.00 . A A . 13 HIS H 1 1 11 4500 1 1 13 HIS HA H -1.657 4.550 -9.656 1.00 . A A . 13 HIS HA 1 1 11 4501 1 1 13 HIS HB2 H -3.005 7.029 -10.849 1.00 . A A . 13 HIS HB2 1 1 11 4502 1 1 13 HIS HB3 H -2.006 5.848 -11.656 1.00 . A A . 13 HIS HB3 1 1 11 4503 1 1 13 HIS HD1 H -4.345 5.877 -13.105 1.00 . A A . 13 HIS HD1 1 1 11 4504 1 1 13 HIS HD2 H -4.505 3.822 -9.579 1.00 . A A . 13 HIS HD2 1 1 11 4505 1 1 13 HIS HE1 H -6.284 4.365 -13.261 1.00 . A A . 13 HIS HE1 1 1 11 4506 1 1 13 HIS N N -3.166 5.406 -8.462 1.00 . A A . 13 HIS N 1 1 11 4507 1 1 13 HIS ND1 N -4.605 5.268 -12.383 1.00 . A A . 13 HIS ND1 1 1 11 4508 1 1 13 HIS NE2 N -5.721 3.765 -11.314 1.00 . A A . 13 HIS NE2 1 1 11 4509 1 1 13 HIS O O 0.089 6.441 -9.592 1.00 . A A . 13 HIS O 1 1 11 4510 1 1 14 HIS C C 0.628 7.712 -6.770 1.00 . A A . 14 HIS C 1 1 11 4511 1 1 14 HIS CA C -0.332 8.443 -7.721 1.00 . A A . 14 HIS CA 1 1 11 4512 1 1 14 HIS CB C -1.049 9.592 -6.973 1.00 . A A . 14 HIS CB 1 1 11 4513 1 1 14 HIS CD2 C -2.798 10.269 -8.782 1.00 . A A . 14 HIS CD2 1 1 11 4514 1 1 14 HIS CE1 C -2.135 12.182 -9.209 1.00 . A A . 14 HIS CE1 1 1 11 4515 1 1 14 HIS CG C -1.705 10.512 -7.992 1.00 . A A . 14 HIS CG 1 1 11 4516 1 1 14 HIS H H -2.234 7.457 -7.828 1.00 . A A . 14 HIS H 1 1 11 4517 1 1 14 HIS HA H 0.185 8.833 -8.575 1.00 . A A . 14 HIS HA 1 1 11 4518 1 1 14 HIS HB2 H -1.817 9.200 -6.324 1.00 . A A . 14 HIS HB2 1 1 11 4519 1 1 14 HIS HB3 H -0.348 10.169 -6.387 1.00 . A A . 14 HIS HB3 1 1 11 4520 1 1 14 HIS HD1 H -0.578 12.190 -7.910 1.00 . A A . 14 HIS HD1 1 1 11 4521 1 1 14 HIS HD2 H -3.339 9.340 -8.760 1.00 . A A . 14 HIS HD2 1 1 11 4522 1 1 14 HIS HE1 H -2.046 13.169 -9.641 1.00 . A A . 14 HIS HE1 1 1 11 4523 1 1 14 HIS N N -1.332 7.433 -8.196 1.00 . A A . 14 HIS N 1 1 11 4524 1 1 14 HIS ND1 N -1.338 11.712 -8.301 1.00 . A A . 14 HIS ND1 1 1 11 4525 1 1 14 HIS NE2 N -3.062 11.316 -9.539 1.00 . A A . 14 HIS NE2 1 1 11 4526 1 1 14 HIS O O 1.572 7.091 -7.216 1.00 . A A . 14 HIS O 1 1 11 4527 1 1 15 GLN C C 1.260 5.629 -4.801 1.00 . A A . 15 GLN C 1 1 11 4528 1 1 15 GLN CA C 1.233 7.115 -4.463 1.00 . A A . 15 GLN CA 1 1 11 4529 1 1 15 GLN CB C 0.646 7.304 -3.049 1.00 . A A . 15 GLN CB 1 1 11 4530 1 1 15 GLN CD C -1.254 8.973 -3.077 1.00 . A A . 15 GLN CD 1 1 11 4531 1 1 15 GLN CG C 0.244 8.779 -2.801 1.00 . A A . 15 GLN CG 1 1 11 4532 1 1 15 GLN H H -0.414 8.312 -5.197 1.00 . A A . 15 GLN H 1 1 11 4533 1 1 15 GLN HA H 2.248 7.476 -4.533 1.00 . A A . 15 GLN HA 1 1 11 4534 1 1 15 GLN HB2 H -0.210 6.655 -2.920 1.00 . A A . 15 GLN HB2 1 1 11 4535 1 1 15 GLN HB3 H 1.393 7.021 -2.322 1.00 . A A . 15 GLN HB3 1 1 11 4536 1 1 15 GLN HE21 H -1.814 7.650 -1.708 1.00 . A A . 15 GLN HE21 1 1 11 4537 1 1 15 GLN HE22 H -3.081 8.398 -2.555 1.00 . A A . 15 GLN HE22 1 1 11 4538 1 1 15 GLN HG2 H 0.435 9.040 -1.771 1.00 . A A . 15 GLN HG2 1 1 11 4539 1 1 15 GLN HG3 H 0.807 9.445 -3.438 1.00 . A A . 15 GLN HG3 1 1 11 4540 1 1 15 GLN N N 0.365 7.796 -5.486 1.00 . A A . 15 GLN N 1 1 11 4541 1 1 15 GLN NE2 N -2.122 8.283 -2.389 1.00 . A A . 15 GLN NE2 1 1 11 4542 1 1 15 GLN O O 2.203 4.931 -4.497 1.00 . A A . 15 GLN O 1 1 11 4543 1 1 15 GLN OE1 O -1.648 9.754 -3.920 1.00 . A A . 15 GLN OE1 1 1 11 4544 1 1 16 GLU C C 1.306 3.360 -6.598 1.00 . A A . 16 GLU C 1 1 11 4545 1 1 16 GLU CA C 0.042 3.796 -5.853 1.00 . A A . 16 GLU CA 1 1 11 4546 1 1 16 GLU CB C -1.166 3.710 -6.750 1.00 . A A . 16 GLU CB 1 1 11 4547 1 1 16 GLU CD C -2.858 2.177 -7.726 1.00 . A A . 16 GLU CD 1 1 11 4548 1 1 16 GLU CG C -1.471 2.249 -7.053 1.00 . A A . 16 GLU CG 1 1 11 4549 1 1 16 GLU H H -0.523 5.845 -5.637 1.00 . A A . 16 GLU H 1 1 11 4550 1 1 16 GLU HA H -0.102 3.181 -4.983 1.00 . A A . 16 GLU HA 1 1 11 4551 1 1 16 GLU HB2 H -2.007 4.177 -6.261 1.00 . A A . 16 GLU HB2 1 1 11 4552 1 1 16 GLU HB3 H -0.957 4.234 -7.667 1.00 . A A . 16 GLU HB3 1 1 11 4553 1 1 16 GLU HG2 H -0.707 1.859 -7.713 1.00 . A A . 16 GLU HG2 1 1 11 4554 1 1 16 GLU HG3 H -1.463 1.671 -6.139 1.00 . A A . 16 GLU HG3 1 1 11 4555 1 1 16 GLU N N 0.194 5.210 -5.433 1.00 . A A . 16 GLU N 1 1 11 4556 1 1 16 GLU O O 1.841 2.299 -6.337 1.00 . A A . 16 GLU O 1 1 11 4557 1 1 16 GLU OE1 O -3.832 2.357 -7.009 1.00 . A A . 16 GLU OE1 1 1 11 4558 1 1 16 GLU OE2 O -2.866 1.948 -8.924 1.00 . A A . 16 GLU OE2 1 1 11 4559 1 1 17 LEU C C 4.223 4.130 -7.457 1.00 . A A . 17 LEU C 1 1 11 4560 1 1 17 LEU CA C 2.968 3.872 -8.276 1.00 . A A . 17 LEU CA 1 1 11 4561 1 1 17 LEU CB C 2.963 4.705 -9.609 1.00 . A A . 17 LEU CB 1 1 11 4562 1 1 17 LEU CD1 C 5.139 5.992 -9.948 1.00 . A A . 17 LEU CD1 1 1 11 4563 1 1 17 LEU CD2 C 2.937 7.182 -10.264 1.00 . A A . 17 LEU CD2 1 1 11 4564 1 1 17 LEU CG C 3.672 6.085 -9.454 1.00 . A A . 17 LEU CG 1 1 11 4565 1 1 17 LEU H H 1.275 5.047 -7.668 1.00 . A A . 17 LEU H 1 1 11 4566 1 1 17 LEU HA H 2.940 2.827 -8.454 1.00 . A A . 17 LEU HA 1 1 11 4567 1 1 17 LEU HB2 H 3.458 4.127 -10.376 1.00 . A A . 17 LEU HB2 1 1 11 4568 1 1 17 LEU HB3 H 1.939 4.847 -9.922 1.00 . A A . 17 LEU HB3 1 1 11 4569 1 1 17 LEU HD11 H 5.615 5.095 -9.584 1.00 . A A . 17 LEU HD11 1 1 11 4570 1 1 17 LEU HD12 H 5.171 5.981 -11.028 1.00 . A A . 17 LEU HD12 1 1 11 4571 1 1 17 LEU HD13 H 5.698 6.845 -9.594 1.00 . A A . 17 LEU HD13 1 1 11 4572 1 1 17 LEU HD21 H 2.442 6.760 -11.126 1.00 . A A . 17 LEU HD21 1 1 11 4573 1 1 17 LEU HD22 H 2.200 7.669 -9.644 1.00 . A A . 17 LEU HD22 1 1 11 4574 1 1 17 LEU HD23 H 3.635 7.934 -10.605 1.00 . A A . 17 LEU HD23 1 1 11 4575 1 1 17 LEU HG H 3.657 6.344 -8.411 1.00 . A A . 17 LEU HG 1 1 11 4576 1 1 17 LEU N N 1.745 4.206 -7.502 1.00 . A A . 17 LEU N 1 1 11 4577 1 1 17 LEU O O 5.258 3.554 -7.710 1.00 . A A . 17 LEU O 1 1 11 4578 1 1 18 VAL C C 5.580 4.071 -4.760 1.00 . A A . 18 VAL C 1 1 11 4579 1 1 18 VAL CA C 5.301 5.291 -5.632 1.00 . A A . 18 VAL CA 1 1 11 4580 1 1 18 VAL CB C 4.978 6.522 -4.787 1.00 . A A . 18 VAL CB 1 1 11 4581 1 1 18 VAL CG1 C 6.193 6.901 -3.911 1.00 . A A . 18 VAL CG1 1 1 11 4582 1 1 18 VAL CG2 C 4.675 7.639 -5.791 1.00 . A A . 18 VAL CG2 1 1 11 4583 1 1 18 VAL H H 3.261 5.437 -6.322 1.00 . A A . 18 VAL H 1 1 11 4584 1 1 18 VAL HA H 6.156 5.474 -6.267 1.00 . A A . 18 VAL HA 1 1 11 4585 1 1 18 VAL HB H 4.123 6.337 -4.155 1.00 . A A . 18 VAL HB 1 1 11 4586 1 1 18 VAL HG11 H 7.110 6.827 -4.478 1.00 . A A . 18 VAL HG11 1 1 11 4587 1 1 18 VAL HG12 H 6.088 7.909 -3.540 1.00 . A A . 18 VAL HG12 1 1 11 4588 1 1 18 VAL HG13 H 6.254 6.231 -3.065 1.00 . A A . 18 VAL HG13 1 1 11 4589 1 1 18 VAL HG21 H 5.465 7.688 -6.528 1.00 . A A . 18 VAL HG21 1 1 11 4590 1 1 18 VAL HG22 H 3.752 7.412 -6.303 1.00 . A A . 18 VAL HG22 1 1 11 4591 1 1 18 VAL HG23 H 4.579 8.586 -5.291 1.00 . A A . 18 VAL HG23 1 1 11 4592 1 1 18 VAL N N 4.115 4.990 -6.485 1.00 . A A . 18 VAL N 1 1 11 4593 1 1 18 VAL O O 6.654 3.934 -4.211 1.00 . A A . 18 VAL O 1 1 11 4594 1 1 19 PHE C C 5.589 0.990 -4.636 1.00 . A A . 19 PHE C 1 1 11 4595 1 1 19 PHE CA C 4.729 1.982 -3.851 1.00 . A A . 19 PHE CA 1 1 11 4596 1 1 19 PHE CB C 3.350 1.361 -3.595 1.00 . A A . 19 PHE CB 1 1 11 4597 1 1 19 PHE CD1 C 2.810 3.423 -2.169 1.00 . A A . 19 PHE CD1 1 1 11 4598 1 1 19 PHE CD2 C 1.016 2.140 -3.072 1.00 . A A . 19 PHE CD2 1 1 11 4599 1 1 19 PHE CE1 C 1.904 4.275 -1.572 1.00 . A A . 19 PHE CE1 1 1 11 4600 1 1 19 PHE CE2 C 0.107 2.993 -2.474 1.00 . A A . 19 PHE CE2 1 1 11 4601 1 1 19 PHE CG C 2.374 2.345 -2.925 1.00 . A A . 19 PHE CG 1 1 11 4602 1 1 19 PHE CZ C 0.552 4.060 -1.724 1.00 . A A . 19 PHE CZ 1 1 11 4603 1 1 19 PHE H H 3.749 3.403 -5.141 1.00 . A A . 19 PHE H 1 1 11 4604 1 1 19 PHE HA H 5.231 2.238 -2.931 1.00 . A A . 19 PHE HA 1 1 11 4605 1 1 19 PHE HB2 H 2.923 1.028 -4.530 1.00 . A A . 19 PHE HB2 1 1 11 4606 1 1 19 PHE HB3 H 3.459 0.503 -2.948 1.00 . A A . 19 PHE HB3 1 1 11 4607 1 1 19 PHE HD1 H 3.867 3.606 -2.053 1.00 . A A . 19 PHE HD1 1 1 11 4608 1 1 19 PHE HD2 H 0.663 1.308 -3.669 1.00 . A A . 19 PHE HD2 1 1 11 4609 1 1 19 PHE HE1 H 2.256 5.111 -0.985 1.00 . A A . 19 PHE HE1 1 1 11 4610 1 1 19 PHE HE2 H -0.953 2.822 -2.595 1.00 . A A . 19 PHE HE2 1 1 11 4611 1 1 19 PHE HZ H -0.158 4.726 -1.256 1.00 . A A . 19 PHE HZ 1 1 11 4612 1 1 19 PHE N N 4.587 3.221 -4.668 1.00 . A A . 19 PHE N 1 1 11 4613 1 1 19 PHE O O 6.085 0.025 -4.090 1.00 . A A . 19 PHE O 1 1 11 4614 1 1 20 PHE C C 7.891 1.138 -6.895 1.00 . A A . 20 PHE C 1 1 11 4615 1 1 20 PHE CA C 6.528 0.439 -6.837 1.00 . A A . 20 PHE CA 1 1 11 4616 1 1 20 PHE CB C 5.804 0.423 -8.201 1.00 . A A . 20 PHE CB 1 1 11 4617 1 1 20 PHE CD1 C 7.358 -1.032 -9.578 1.00 . A A . 20 PHE CD1 1 1 11 4618 1 1 20 PHE CD2 C 7.197 1.280 -10.140 1.00 . A A . 20 PHE CD2 1 1 11 4619 1 1 20 PHE CE1 C 8.271 -1.216 -10.596 1.00 . A A . 20 PHE CE1 1 1 11 4620 1 1 20 PHE CE2 C 8.109 1.097 -11.158 1.00 . A A . 20 PHE CE2 1 1 11 4621 1 1 20 PHE CG C 6.814 0.217 -9.343 1.00 . A A . 20 PHE CG 1 1 11 4622 1 1 20 PHE CZ C 8.647 -0.151 -11.386 1.00 . A A . 20 PHE CZ 1 1 11 4623 1 1 20 PHE H H 5.282 2.087 -6.250 1.00 . A A . 20 PHE H 1 1 11 4624 1 1 20 PHE HA H 6.644 -0.558 -6.437 1.00 . A A . 20 PHE HA 1 1 11 4625 1 1 20 PHE HB2 H 5.081 -0.379 -8.212 1.00 . A A . 20 PHE HB2 1 1 11 4626 1 1 20 PHE HB3 H 5.274 1.351 -8.358 1.00 . A A . 20 PHE HB3 1 1 11 4627 1 1 20 PHE HD1 H 7.067 -1.871 -8.963 1.00 . A A . 20 PHE HD1 1 1 11 4628 1 1 20 PHE HD2 H 6.780 2.262 -9.967 1.00 . A A . 20 PHE HD2 1 1 11 4629 1 1 20 PHE HE1 H 8.691 -2.195 -10.773 1.00 . A A . 20 PHE HE1 1 1 11 4630 1 1 20 PHE HE2 H 8.403 1.933 -11.777 1.00 . A A . 20 PHE HE2 1 1 11 4631 1 1 20 PHE HZ H 9.362 -0.295 -12.183 1.00 . A A . 20 PHE HZ 1 1 11 4632 1 1 20 PHE N N 5.724 1.281 -5.904 1.00 . A A . 20 PHE N 1 1 11 4633 1 1 20 PHE O O 8.936 0.533 -6.755 1.00 . A A . 20 PHE O 1 1 11 4634 1 1 21 ALA C C 9.745 3.189 -5.817 1.00 . A A . 21 ALA C 1 1 11 4635 1 1 21 ALA CA C 9.043 3.274 -7.179 1.00 . A A . 21 ALA CA 1 1 11 4636 1 1 21 ALA CB C 8.639 4.723 -7.481 1.00 . A A . 21 ALA CB 1 1 11 4637 1 1 21 ALA H H 6.948 2.845 -7.212 1.00 . A A . 21 ALA H 1 1 11 4638 1 1 21 ALA HA H 9.692 2.889 -7.951 1.00 . A A . 21 ALA HA 1 1 11 4639 1 1 21 ALA HB1 H 7.833 4.747 -8.199 1.00 . A A . 21 ALA HB1 1 1 11 4640 1 1 21 ALA HB2 H 8.314 5.222 -6.579 1.00 . A A . 21 ALA HB2 1 1 11 4641 1 1 21 ALA HB3 H 9.482 5.260 -7.888 1.00 . A A . 21 ALA HB3 1 1 11 4642 1 1 21 ALA N N 7.820 2.429 -7.103 1.00 . A A . 21 ALA N 1 1 11 4643 1 1 21 ALA O O 10.902 3.541 -5.699 1.00 . A A . 21 ALA O 1 1 11 4644 1 1 22 GLU C C 10.626 1.487 -3.530 1.00 . A A . 22 GLU C 1 1 11 4645 1 1 22 GLU CA C 9.550 2.579 -3.457 1.00 . A A . 22 GLU CA 1 1 11 4646 1 1 22 GLU CB C 8.374 2.194 -2.514 1.00 . A A . 22 GLU CB 1 1 11 4647 1 1 22 GLU CD C 8.847 -0.124 -1.564 1.00 . A A . 22 GLU CD 1 1 11 4648 1 1 22 GLU CG C 8.824 1.390 -1.263 1.00 . A A . 22 GLU CG 1 1 11 4649 1 1 22 GLU H H 8.065 2.472 -5.008 1.00 . A A . 22 GLU H 1 1 11 4650 1 1 22 GLU HA H 9.997 3.514 -3.174 1.00 . A A . 22 GLU HA 1 1 11 4651 1 1 22 GLU HB2 H 7.899 3.101 -2.174 1.00 . A A . 22 GLU HB2 1 1 11 4652 1 1 22 GLU HB3 H 7.644 1.627 -3.070 1.00 . A A . 22 GLU HB3 1 1 11 4653 1 1 22 GLU HG2 H 9.805 1.710 -0.937 1.00 . A A . 22 GLU HG2 1 1 11 4654 1 1 22 GLU HG3 H 8.127 1.563 -0.455 1.00 . A A . 22 GLU HG3 1 1 11 4655 1 1 22 GLU N N 9.002 2.726 -4.836 1.00 . A A . 22 GLU N 1 1 11 4656 1 1 22 GLU O O 11.712 1.632 -3.002 1.00 . A A . 22 GLU O 1 1 11 4657 1 1 22 GLU OE1 O 7.789 -0.643 -1.886 1.00 . A A . 22 GLU OE1 1 1 11 4658 1 1 22 GLU OE2 O 9.925 -0.684 -1.454 1.00 . A A . 22 GLU OE2 1 1 11 4659 1 1 23 ASP C C 12.358 -0.289 -5.237 1.00 . A A . 23 ASP C 1 1 11 4660 1 1 23 ASP CA C 11.175 -0.745 -4.379 1.00 . A A . 23 ASP CA 1 1 11 4661 1 1 23 ASP CB C 10.404 -1.868 -5.078 1.00 . A A . 23 ASP CB 1 1 11 4662 1 1 23 ASP CG C 9.141 -2.188 -4.266 1.00 . A A . 23 ASP CG 1 1 11 4663 1 1 23 ASP H H 9.360 0.402 -4.584 1.00 . A A . 23 ASP H 1 1 11 4664 1 1 23 ASP HA H 11.540 -1.071 -3.417 1.00 . A A . 23 ASP HA 1 1 11 4665 1 1 23 ASP HB2 H 10.120 -1.561 -6.076 1.00 . A A . 23 ASP HB2 1 1 11 4666 1 1 23 ASP HB3 H 11.016 -2.754 -5.145 1.00 . A A . 23 ASP HB3 1 1 11 4667 1 1 23 ASP N N 10.260 0.423 -4.197 1.00 . A A . 23 ASP N 1 1 11 4668 1 1 23 ASP O O 13.501 -0.538 -4.909 1.00 . A A . 23 ASP O 1 1 11 4669 1 1 23 ASP OD1 O 9.276 -2.917 -3.296 1.00 . A A . 23 ASP OD1 1 1 11 4670 1 1 23 ASP OD2 O 8.110 -1.678 -4.666 1.00 . A A . 23 ASP OD2 1 1 11 4671 1 1 24 VAL C C 13.994 1.873 -6.525 1.00 . A A . 24 VAL C 1 1 11 4672 1 1 24 VAL CA C 13.053 0.899 -7.269 1.00 . A A . 24 VAL CA 1 1 11 4673 1 1 24 VAL CB C 12.331 1.630 -8.435 1.00 . A A . 24 VAL CB 1 1 11 4674 1 1 24 VAL CG1 C 13.357 2.144 -9.471 1.00 . A A . 24 VAL CG1 1 1 11 4675 1 1 24 VAL CG2 C 11.360 0.657 -9.145 1.00 . A A . 24 VAL CG2 1 1 11 4676 1 1 24 VAL H H 11.069 0.512 -6.496 1.00 . A A . 24 VAL H 1 1 11 4677 1 1 24 VAL HA H 13.636 0.069 -7.645 1.00 . A A . 24 VAL HA 1 1 11 4678 1 1 24 VAL HB H 11.783 2.471 -8.039 1.00 . A A . 24 VAL HB 1 1 11 4679 1 1 24 VAL HG11 H 14.089 1.379 -9.691 1.00 . A A . 24 VAL HG11 1 1 11 4680 1 1 24 VAL HG12 H 12.856 2.418 -10.388 1.00 . A A . 24 VAL HG12 1 1 11 4681 1 1 24 VAL HG13 H 13.868 3.014 -9.088 1.00 . A A . 24 VAL HG13 1 1 11 4682 1 1 24 VAL HG21 H 10.758 0.117 -8.431 1.00 . A A . 24 VAL HG21 1 1 11 4683 1 1 24 VAL HG22 H 10.702 1.212 -9.797 1.00 . A A . 24 VAL HG22 1 1 11 4684 1 1 24 VAL HG23 H 11.913 -0.059 -9.738 1.00 . A A . 24 VAL HG23 1 1 11 4685 1 1 24 VAL N N 12.020 0.372 -6.317 1.00 . A A . 24 VAL N 1 1 11 4686 1 1 24 VAL O O 15.106 2.120 -6.951 1.00 . A A . 24 VAL O 1 1 11 4687 1 1 25 GLY C C 14.489 4.667 -5.358 1.00 . A A . 25 GLY C 1 1 11 4688 1 1 25 GLY CA C 14.299 3.354 -4.602 1.00 . A A . 25 GLY CA 1 1 11 4689 1 1 25 GLY H H 12.598 2.157 -5.144 1.00 . A A . 25 GLY H 1 1 11 4690 1 1 25 GLY HA2 H 13.768 3.549 -3.682 1.00 . A A . 25 GLY HA2 1 1 11 4691 1 1 25 GLY HA3 H 15.263 2.920 -4.377 1.00 . A A . 25 GLY HA3 1 1 11 4692 1 1 25 GLY N N 13.504 2.396 -5.426 1.00 . A A . 25 GLY N 1 1 11 4693 1 1 25 GLY O O 15.588 5.178 -5.444 1.00 . A A . 25 GLY O 1 1 11 4694 1 1 26 SER C C 14.474 6.523 -7.720 1.00 . A A . 26 SER C 1 1 11 4695 1 1 26 SER CA C 13.353 6.433 -6.666 1.00 . A A . 26 SER CA 1 1 11 4696 1 1 26 SER CB C 13.438 7.621 -5.653 1.00 . A A . 26 SER CB 1 1 11 4697 1 1 26 SER H H 12.560 4.650 -5.761 1.00 . A A . 26 SER H 1 1 11 4698 1 1 26 SER HA H 12.405 6.480 -7.182 1.00 . A A . 26 SER HA 1 1 11 4699 1 1 26 SER HB2 H 13.158 8.553 -6.121 1.00 . A A . 26 SER HB2 1 1 11 4700 1 1 26 SER HB3 H 12.809 7.443 -4.793 1.00 . A A . 26 SER HB3 1 1 11 4701 1 1 26 SER HG H 14.821 7.536 -4.284 1.00 . A A . 26 SER HG 1 1 11 4702 1 1 26 SER N N 13.391 5.154 -5.884 1.00 . A A . 26 SER N 1 1 11 4703 1 1 26 SER O O 14.912 7.599 -8.079 1.00 . A A . 26 SER O 1 1 11 4704 1 1 26 SER OG O 14.794 7.697 -5.230 1.00 . A A . 26 SER OG 1 1 11 4705 1 1 27 ASN C C 17.242 6.010 -8.753 1.00 . A A . 27 ASN C 1 1 11 4706 1 1 27 ASN CA C 15.976 5.257 -9.206 1.00 . A A . 27 ASN CA 1 1 11 4707 1 1 27 ASN CB C 15.447 5.830 -10.551 1.00 . A A . 27 ASN CB 1 1 11 4708 1 1 27 ASN CG C 14.181 5.072 -10.968 1.00 . A A . 27 ASN CG 1 1 11 4709 1 1 27 ASN H H 14.480 4.548 -7.832 1.00 . A A . 27 ASN H 1 1 11 4710 1 1 27 ASN HA H 16.227 4.213 -9.328 1.00 . A A . 27 ASN HA 1 1 11 4711 1 1 27 ASN HB2 H 15.206 6.878 -10.456 1.00 . A A . 27 ASN HB2 1 1 11 4712 1 1 27 ASN HB3 H 16.193 5.714 -11.324 1.00 . A A . 27 ASN HB3 1 1 11 4713 1 1 27 ASN HD21 H 13.018 6.044 -9.684 1.00 . A A . 27 ASN HD21 1 1 11 4714 1 1 27 ASN HD22 H 12.232 4.878 -10.634 1.00 . A A . 27 ASN HD22 1 1 11 4715 1 1 27 ASN N N 14.893 5.366 -8.177 1.00 . A A . 27 ASN N 1 1 11 4716 1 1 27 ASN ND2 N 13.050 5.355 -10.380 1.00 . A A . 27 ASN ND2 1 1 11 4717 1 1 27 ASN O O 17.675 6.960 -9.377 1.00 . A A . 27 ASN O 1 1 11 4718 1 1 27 ASN OD1 O 14.211 4.215 -11.830 1.00 . A A . 27 ASN OD1 1 1 11 4719 1 1 28 LYS C C 20.185 6.148 -8.111 1.00 . A A . 28 LYS C 1 1 11 4720 1 1 28 LYS CA C 19.030 6.168 -7.088 1.00 . A A . 28 LYS CA 1 1 11 4721 1 1 28 LYS CB C 19.446 5.389 -5.821 1.00 . A A . 28 LYS CB 1 1 11 4722 1 1 28 LYS CD C 18.080 4.541 -3.847 1.00 . A A . 28 LYS CD 1 1 11 4723 1 1 28 LYS CE C 19.216 4.006 -2.950 1.00 . A A . 28 LYS CE 1 1 11 4724 1 1 28 LYS CG C 18.553 5.800 -4.617 1.00 . A A . 28 LYS CG 1 1 11 4725 1 1 28 LYS H H 17.380 4.777 -7.210 1.00 . A A . 28 LYS H 1 1 11 4726 1 1 28 LYS HA H 18.803 7.195 -6.831 1.00 . A A . 28 LYS HA 1 1 11 4727 1 1 28 LYS HB2 H 19.368 4.329 -6.016 1.00 . A A . 28 LYS HB2 1 1 11 4728 1 1 28 LYS HB3 H 20.476 5.612 -5.584 1.00 . A A . 28 LYS HB3 1 1 11 4729 1 1 28 LYS HD2 H 17.229 4.799 -3.233 1.00 . A A . 28 LYS HD2 1 1 11 4730 1 1 28 LYS HD3 H 17.773 3.772 -4.541 1.00 . A A . 28 LYS HD3 1 1 11 4731 1 1 28 LYS HE2 H 19.000 2.990 -2.652 1.00 . A A . 28 LYS HE2 1 1 11 4732 1 1 28 LYS HE3 H 20.160 4.022 -3.475 1.00 . A A . 28 LYS HE3 1 1 11 4733 1 1 28 LYS HG2 H 19.118 6.442 -3.957 1.00 . A A . 28 LYS HG2 1 1 11 4734 1 1 28 LYS HG3 H 17.690 6.353 -4.957 1.00 . A A . 28 LYS HG3 1 1 11 4735 1 1 28 LYS HZ1 H 18.630 5.602 -1.743 1.00 . A A . 28 LYS HZ1 1 1 11 4736 1 1 28 LYS HZ2 H 19.184 4.247 -0.881 1.00 . A A . 28 LYS HZ2 1 1 11 4737 1 1 28 LYS HZ3 H 20.291 5.257 -1.678 1.00 . A A . 28 LYS HZ3 1 1 11 4738 1 1 28 LYS N N 17.791 5.545 -7.658 1.00 . A A . 28 LYS N 1 1 11 4739 1 1 28 LYS NZ N 19.339 4.841 -1.721 1.00 . A A . 28 LYS NZ 1 1 11 4740 1 1 28 LYS O O 20.837 7.175 -8.211 1.00 . A A . 28 LYS O 1 1 11 4741 1 1 28 LYS OXT O 20.348 5.110 -8.733 1.00 . A A . 28 LYS OXT 1 1 12 4742 1 1 1 ASP C C -15.531 -6.306 5.906 1.00 . A A . 1 ASP C 1 1 12 4743 1 1 1 ASP CA C -16.833 -5.505 6.024 1.00 . A A . 1 ASP CA 1 1 12 4744 1 1 1 ASP CB C -16.886 -4.837 7.411 1.00 . A A . 1 ASP CB 1 1 12 4745 1 1 1 ASP CG C -18.150 -3.963 7.503 1.00 . A A . 1 ASP CG 1 1 12 4746 1 1 1 ASP H1 H -17.674 -7.380 5.676 1.00 . A A . 1 ASP H1 1 1 12 4747 1 1 1 ASP H2 H -18.598 -6.389 6.698 1.00 . A A . 1 ASP H2 1 1 12 4748 1 1 1 ASP H3 H -18.565 -6.089 5.029 1.00 . A A . 1 ASP H3 1 1 12 4749 1 1 1 ASP HA H -16.857 -4.755 5.246 1.00 . A A . 1 ASP HA 1 1 12 4750 1 1 1 ASP HB2 H -16.917 -5.588 8.188 1.00 . A A . 1 ASP HB2 1 1 12 4751 1 1 1 ASP HB3 H -16.013 -4.218 7.564 1.00 . A A . 1 ASP HB3 1 1 12 4752 1 1 1 ASP N N -18.006 -6.409 5.843 1.00 . A A . 1 ASP N 1 1 12 4753 1 1 1 ASP O O -15.465 -7.450 6.316 1.00 . A A . 1 ASP O 1 1 12 4754 1 1 1 ASP OD1 O -19.164 -4.514 7.900 1.00 . A A . 1 ASP OD1 1 1 12 4755 1 1 1 ASP OD2 O -18.030 -2.794 7.169 1.00 . A A . 1 ASP OD2 1 1 12 4756 1 1 2 ALA C C -12.139 -5.197 5.099 1.00 . A A . 2 ALA C 1 1 12 4757 1 1 2 ALA CA C -13.198 -6.315 5.157 1.00 . A A . 2 ALA CA 1 1 12 4758 1 1 2 ALA CB C -13.265 -7.139 3.845 1.00 . A A . 2 ALA CB 1 1 12 4759 1 1 2 ALA H H -14.659 -4.748 5.037 1.00 . A A . 2 ALA H 1 1 12 4760 1 1 2 ALA HA H -12.982 -6.955 6.000 1.00 . A A . 2 ALA HA 1 1 12 4761 1 1 2 ALA HB1 H -13.774 -6.573 3.081 1.00 . A A . 2 ALA HB1 1 1 12 4762 1 1 2 ALA HB2 H -12.277 -7.392 3.489 1.00 . A A . 2 ALA HB2 1 1 12 4763 1 1 2 ALA HB3 H -13.812 -8.053 4.019 1.00 . A A . 2 ALA HB3 1 1 12 4764 1 1 2 ALA N N -14.533 -5.670 5.344 1.00 . A A . 2 ALA N 1 1 12 4765 1 1 2 ALA O O -11.844 -4.592 6.111 1.00 . A A . 2 ALA O 1 1 12 4766 1 1 3 GLU C C -10.333 -3.649 2.250 1.00 . A A . 3 GLU C 1 1 12 4767 1 1 3 GLU CA C -10.560 -3.886 3.746 1.00 . A A . 3 GLU CA 1 1 12 4768 1 1 3 GLU CB C -9.227 -4.327 4.428 1.00 . A A . 3 GLU CB 1 1 12 4769 1 1 3 GLU CD C -9.044 -6.803 4.890 1.00 . A A . 3 GLU CD 1 1 12 4770 1 1 3 GLU CG C -8.732 -5.691 3.873 1.00 . A A . 3 GLU CG 1 1 12 4771 1 1 3 GLU H H -11.881 -5.476 3.155 1.00 . A A . 3 GLU H 1 1 12 4772 1 1 3 GLU HA H -10.938 -2.970 4.168 1.00 . A A . 3 GLU HA 1 1 12 4773 1 1 3 GLU HB2 H -8.465 -3.584 4.249 1.00 . A A . 3 GLU HB2 1 1 12 4774 1 1 3 GLU HB3 H -9.375 -4.390 5.496 1.00 . A A . 3 GLU HB3 1 1 12 4775 1 1 3 GLU HG2 H -9.204 -5.931 2.930 1.00 . A A . 3 GLU HG2 1 1 12 4776 1 1 3 GLU HG3 H -7.664 -5.653 3.714 1.00 . A A . 3 GLU HG3 1 1 12 4777 1 1 3 GLU N N -11.598 -4.950 3.930 1.00 . A A . 3 GLU N 1 1 12 4778 1 1 3 GLU O O -9.275 -3.231 1.821 1.00 . A A . 3 GLU O 1 1 12 4779 1 1 3 GLU OE1 O -8.254 -6.933 5.811 1.00 . A A . 3 GLU OE1 1 1 12 4780 1 1 3 GLU OE2 O -10.053 -7.459 4.690 1.00 . A A . 3 GLU OE2 1 1 12 4781 1 1 4 PHE C C -10.914 -2.317 -0.347 1.00 . A A . 4 PHE C 1 1 12 4782 1 1 4 PHE CA C -11.304 -3.747 0.020 1.00 . A A . 4 PHE CA 1 1 12 4783 1 1 4 PHE CB C -12.682 -4.100 -0.575 1.00 . A A . 4 PHE CB 1 1 12 4784 1 1 4 PHE CD1 C -12.738 -6.538 0.111 1.00 . A A . 4 PHE CD1 1 1 12 4785 1 1 4 PHE CD2 C -12.677 -6.034 -2.218 1.00 . A A . 4 PHE CD2 1 1 12 4786 1 1 4 PHE CE1 C -12.751 -7.886 -0.178 1.00 . A A . 4 PHE CE1 1 1 12 4787 1 1 4 PHE CE2 C -12.690 -7.383 -2.508 1.00 . A A . 4 PHE CE2 1 1 12 4788 1 1 4 PHE CG C -12.701 -5.601 -0.905 1.00 . A A . 4 PHE CG 1 1 12 4789 1 1 4 PHE CZ C -12.727 -8.309 -1.489 1.00 . A A . 4 PHE CZ 1 1 12 4790 1 1 4 PHE H H -12.189 -4.245 1.922 1.00 . A A . 4 PHE H 1 1 12 4791 1 1 4 PHE HA H -10.553 -4.416 -0.367 1.00 . A A . 4 PHE HA 1 1 12 4792 1 1 4 PHE HB2 H -13.468 -3.889 0.135 1.00 . A A . 4 PHE HB2 1 1 12 4793 1 1 4 PHE HB3 H -12.868 -3.538 -1.480 1.00 . A A . 4 PHE HB3 1 1 12 4794 1 1 4 PHE HD1 H -12.757 -6.212 1.141 1.00 . A A . 4 PHE HD1 1 1 12 4795 1 1 4 PHE HD2 H -12.647 -5.315 -3.024 1.00 . A A . 4 PHE HD2 1 1 12 4796 1 1 4 PHE HE1 H -12.782 -8.610 0.623 1.00 . A A . 4 PHE HE1 1 1 12 4797 1 1 4 PHE HE2 H -12.671 -7.714 -3.537 1.00 . A A . 4 PHE HE2 1 1 12 4798 1 1 4 PHE HZ H -12.737 -9.365 -1.717 1.00 . A A . 4 PHE HZ 1 1 12 4799 1 1 4 PHE N N -11.366 -3.924 1.498 1.00 . A A . 4 PHE N 1 1 12 4800 1 1 4 PHE O O -9.869 -2.102 -0.926 1.00 . A A . 4 PHE O 1 1 12 4801 1 1 5 ARG C C -10.336 0.675 0.559 1.00 . A A . 5 ARG C 1 1 12 4802 1 1 5 ARG CA C -11.416 0.047 -0.331 1.00 . A A . 5 ARG CA 1 1 12 4803 1 1 5 ARG CB C -12.743 0.863 -0.278 1.00 . A A . 5 ARG CB 1 1 12 4804 1 1 5 ARG CD C -12.839 1.825 2.071 1.00 . A A . 5 ARG CD 1 1 12 4805 1 1 5 ARG CG C -13.440 0.793 1.103 1.00 . A A . 5 ARG CG 1 1 12 4806 1 1 5 ARG CZ C -13.900 3.961 1.472 1.00 . A A . 5 ARG CZ 1 1 12 4807 1 1 5 ARG H H -12.566 -1.601 0.492 1.00 . A A . 5 ARG H 1 1 12 4808 1 1 5 ARG HA H -11.025 0.061 -1.324 1.00 . A A . 5 ARG HA 1 1 12 4809 1 1 5 ARG HB2 H -12.544 1.887 -0.559 1.00 . A A . 5 ARG HB2 1 1 12 4810 1 1 5 ARG HB3 H -13.418 0.454 -1.016 1.00 . A A . 5 ARG HB3 1 1 12 4811 1 1 5 ARG HD2 H -13.403 1.846 2.986 1.00 . A A . 5 ARG HD2 1 1 12 4812 1 1 5 ARG HD3 H -11.818 1.570 2.303 1.00 . A A . 5 ARG HD3 1 1 12 4813 1 1 5 ARG HE H -12.041 3.484 0.969 1.00 . A A . 5 ARG HE 1 1 12 4814 1 1 5 ARG HG2 H -14.492 1.004 0.976 1.00 . A A . 5 ARG HG2 1 1 12 4815 1 1 5 ARG HG3 H -13.348 -0.194 1.529 1.00 . A A . 5 ARG HG3 1 1 12 4816 1 1 5 ARG HH11 H -15.044 2.688 2.520 1.00 . A A . 5 ARG HH11 1 1 12 4817 1 1 5 ARG HH12 H -15.787 4.193 2.099 1.00 . A A . 5 ARG HH12 1 1 12 4818 1 1 5 ARG HH21 H -12.968 5.393 0.431 1.00 . A A . 5 ARG HH21 1 1 12 4819 1 1 5 ARG HH22 H -14.598 5.747 0.897 1.00 . A A . 5 ARG HH22 1 1 12 4820 1 1 5 ARG N N -11.745 -1.372 0.007 1.00 . A A . 5 ARG N 1 1 12 4821 1 1 5 ARG NE N -12.849 3.178 1.432 1.00 . A A . 5 ARG NE 1 1 12 4822 1 1 5 ARG NH1 N -14.994 3.584 2.078 1.00 . A A . 5 ARG NH1 1 1 12 4823 1 1 5 ARG NH2 N -13.816 5.124 0.888 1.00 . A A . 5 ARG NH2 1 1 12 4824 1 1 5 ARG O O -10.184 1.881 0.613 1.00 . A A . 5 ARG O 1 1 12 4825 1 1 6 HIS C C -7.187 -0.119 1.454 1.00 . A A . 6 HIS C 1 1 12 4826 1 1 6 HIS CA C -8.515 0.223 2.133 1.00 . A A . 6 HIS CA 1 1 12 4827 1 1 6 HIS CB C -8.587 -0.539 3.479 1.00 . A A . 6 HIS CB 1 1 12 4828 1 1 6 HIS CD2 C -11.225 -0.470 3.669 1.00 . A A . 6 HIS CD2 1 1 12 4829 1 1 6 HIS CE1 C -11.375 0.060 5.663 1.00 . A A . 6 HIS CE1 1 1 12 4830 1 1 6 HIS CG C -9.942 -0.346 4.163 1.00 . A A . 6 HIS CG 1 1 12 4831 1 1 6 HIS H H -9.801 -1.137 1.104 1.00 . A A . 6 HIS H 1 1 12 4832 1 1 6 HIS HA H -8.596 1.277 2.304 1.00 . A A . 6 HIS HA 1 1 12 4833 1 1 6 HIS HB2 H -8.425 -1.594 3.330 1.00 . A A . 6 HIS HB2 1 1 12 4834 1 1 6 HIS HB3 H -7.818 -0.168 4.141 1.00 . A A . 6 HIS HB3 1 1 12 4835 1 1 6 HIS HD1 H -9.388 0.150 6.042 1.00 . A A . 6 HIS HD1 1 1 12 4836 1 1 6 HIS HD2 H -11.458 -0.737 2.652 1.00 . A A . 6 HIS HD2 1 1 12 4837 1 1 6 HIS HE1 H -11.777 0.320 6.632 1.00 . A A . 6 HIS HE1 1 1 12 4838 1 1 6 HIS N N -9.613 -0.190 1.219 1.00 . A A . 6 HIS N 1 1 12 4839 1 1 6 HIS ND1 N -10.110 -0.016 5.400 1.00 . A A . 6 HIS ND1 1 1 12 4840 1 1 6 HIS NE2 N -12.108 -0.215 4.613 1.00 . A A . 6 HIS NE2 1 1 12 4841 1 1 6 HIS O O -6.341 0.733 1.260 1.00 . A A . 6 HIS O 1 1 12 4842 1 1 7 ASP C C -6.092 -3.289 -0.168 1.00 . A A . 7 ASP C 1 1 12 4843 1 1 7 ASP CA C -5.837 -1.901 0.445 1.00 . A A . 7 ASP CA 1 1 12 4844 1 1 7 ASP CB C -4.712 -1.972 1.501 1.00 . A A . 7 ASP CB 1 1 12 4845 1 1 7 ASP CG C -5.253 -2.652 2.779 1.00 . A A . 7 ASP CG 1 1 12 4846 1 1 7 ASP H H -7.794 -2.001 1.303 1.00 . A A . 7 ASP H 1 1 12 4847 1 1 7 ASP HA H -5.576 -1.227 -0.347 1.00 . A A . 7 ASP HA 1 1 12 4848 1 1 7 ASP HB2 H -3.873 -2.535 1.122 1.00 . A A . 7 ASP HB2 1 1 12 4849 1 1 7 ASP HB3 H -4.377 -0.973 1.739 1.00 . A A . 7 ASP HB3 1 1 12 4850 1 1 7 ASP N N -7.064 -1.380 1.114 1.00 . A A . 7 ASP N 1 1 12 4851 1 1 7 ASP O O -5.219 -4.138 -0.173 1.00 . A A . 7 ASP O 1 1 12 4852 1 1 7 ASP OD1 O -5.281 -3.873 2.782 1.00 . A A . 7 ASP OD1 1 1 12 4853 1 1 7 ASP OD2 O -5.612 -1.909 3.678 1.00 . A A . 7 ASP OD2 1 1 12 4854 1 1 8 SER C C -8.821 -4.676 -2.269 1.00 . A A . 8 SER C 1 1 12 4855 1 1 8 SER CA C -7.634 -4.805 -1.295 1.00 . A A . 8 SER CA 1 1 12 4856 1 1 8 SER CB C -7.961 -5.795 -0.145 1.00 . A A . 8 SER CB 1 1 12 4857 1 1 8 SER H H -7.945 -2.765 -0.650 1.00 . A A . 8 SER H 1 1 12 4858 1 1 8 SER HA H -6.784 -5.150 -1.864 1.00 . A A . 8 SER HA 1 1 12 4859 1 1 8 SER HB2 H -7.205 -5.773 0.626 1.00 . A A . 8 SER HB2 1 1 12 4860 1 1 8 SER HB3 H -8.932 -5.613 0.291 1.00 . A A . 8 SER HB3 1 1 12 4861 1 1 8 SER HG H -8.835 -7.445 -0.687 1.00 . A A . 8 SER HG 1 1 12 4862 1 1 8 SER N N -7.282 -3.485 -0.674 1.00 . A A . 8 SER N 1 1 12 4863 1 1 8 SER O O -9.613 -5.586 -2.425 1.00 . A A . 8 SER O 1 1 12 4864 1 1 8 SER OG O -7.953 -7.074 -0.763 1.00 . A A . 8 SER OG 1 1 12 4865 1 1 9 GLY C C -9.885 -1.825 -4.403 1.00 . A A . 9 GLY C 1 1 12 4866 1 1 9 GLY CA C -9.996 -3.258 -3.875 1.00 . A A . 9 GLY CA 1 1 12 4867 1 1 9 GLY H H -8.227 -2.842 -2.718 1.00 . A A . 9 GLY H 1 1 12 4868 1 1 9 GLY HA2 H -9.920 -3.951 -4.700 1.00 . A A . 9 GLY HA2 1 1 12 4869 1 1 9 GLY HA3 H -10.951 -3.380 -3.384 1.00 . A A . 9 GLY HA3 1 1 12 4870 1 1 9 GLY N N -8.899 -3.532 -2.896 1.00 . A A . 9 GLY N 1 1 12 4871 1 1 9 GLY O O -10.251 -1.546 -5.528 1.00 . A A . 9 GLY O 1 1 12 4872 1 1 10 TYR C C -8.203 0.677 -5.069 1.00 . A A . 10 TYR C 1 1 12 4873 1 1 10 TYR CA C -9.201 0.477 -3.914 1.00 . A A . 10 TYR CA 1 1 12 4874 1 1 10 TYR CB C -8.714 1.239 -2.639 1.00 . A A . 10 TYR CB 1 1 12 4875 1 1 10 TYR CD1 C -6.445 0.110 -2.520 1.00 . A A . 10 TYR CD1 1 1 12 4876 1 1 10 TYR CD2 C -6.494 2.488 -2.552 1.00 . A A . 10 TYR CD2 1 1 12 4877 1 1 10 TYR CE1 C -5.070 0.135 -2.463 1.00 . A A . 10 TYR CE1 1 1 12 4878 1 1 10 TYR CE2 C -5.115 2.511 -2.495 1.00 . A A . 10 TYR CE2 1 1 12 4879 1 1 10 TYR CG C -7.172 1.284 -2.565 1.00 . A A . 10 TYR CG 1 1 12 4880 1 1 10 TYR CZ C -4.395 1.336 -2.450 1.00 . A A . 10 TYR CZ 1 1 12 4881 1 1 10 TYR H H -9.114 -1.267 -2.669 1.00 . A A . 10 TYR H 1 1 12 4882 1 1 10 TYR HA H -10.161 0.868 -4.216 1.00 . A A . 10 TYR HA 1 1 12 4883 1 1 10 TYR HB2 H -9.097 2.249 -2.645 1.00 . A A . 10 TYR HB2 1 1 12 4884 1 1 10 TYR HB3 H -9.071 0.743 -1.750 1.00 . A A . 10 TYR HB3 1 1 12 4885 1 1 10 TYR HD1 H -6.955 -0.840 -2.531 1.00 . A A . 10 TYR HD1 1 1 12 4886 1 1 10 TYR HD2 H -7.036 3.422 -2.587 1.00 . A A . 10 TYR HD2 1 1 12 4887 1 1 10 TYR HE1 H -4.522 -0.795 -2.430 1.00 . A A . 10 TYR HE1 1 1 12 4888 1 1 10 TYR HE2 H -4.598 3.457 -2.484 1.00 . A A . 10 TYR HE2 1 1 12 4889 1 1 10 TYR HH H -2.687 1.398 -3.295 1.00 . A A . 10 TYR HH 1 1 12 4890 1 1 10 TYR N N -9.379 -0.962 -3.558 1.00 . A A . 10 TYR N 1 1 12 4891 1 1 10 TYR O O -7.586 -0.253 -5.551 1.00 . A A . 10 TYR O 1 1 12 4892 1 1 10 TYR OH O -3.017 1.362 -2.394 1.00 . A A . 10 TYR OH 1 1 12 4893 1 1 11 GLU C C -6.815 3.786 -6.278 1.00 . A A . 11 GLU C 1 1 12 4894 1 1 11 GLU CA C -7.179 2.332 -6.554 1.00 . A A . 11 GLU CA 1 1 12 4895 1 1 11 GLU CB C -7.896 2.181 -7.922 1.00 . A A . 11 GLU CB 1 1 12 4896 1 1 11 GLU CD C -9.606 3.092 -9.502 1.00 . A A . 11 GLU CD 1 1 12 4897 1 1 11 GLU CG C -9.139 3.093 -8.038 1.00 . A A . 11 GLU CG 1 1 12 4898 1 1 11 GLU H H -8.639 2.602 -5.008 1.00 . A A . 11 GLU H 1 1 12 4899 1 1 11 GLU HA H -6.276 1.743 -6.504 1.00 . A A . 11 GLU HA 1 1 12 4900 1 1 11 GLU HB2 H -7.195 2.418 -8.707 1.00 . A A . 11 GLU HB2 1 1 12 4901 1 1 11 GLU HB3 H -8.201 1.151 -8.046 1.00 . A A . 11 GLU HB3 1 1 12 4902 1 1 11 GLU HG2 H -9.933 2.725 -7.404 1.00 . A A . 11 GLU HG2 1 1 12 4903 1 1 11 GLU HG3 H -8.909 4.108 -7.753 1.00 . A A . 11 GLU HG3 1 1 12 4904 1 1 11 GLU N N -8.097 1.919 -5.456 1.00 . A A . 11 GLU N 1 1 12 4905 1 1 11 GLU O O -7.607 4.528 -5.726 1.00 . A A . 11 GLU O 1 1 12 4906 1 1 11 GLU OE1 O -9.047 3.879 -10.250 1.00 . A A . 11 GLU OE1 1 1 12 4907 1 1 11 GLU OE2 O -10.494 2.305 -9.792 1.00 . A A . 11 GLU OE2 1 1 12 4908 1 1 12 VAL C C -4.389 6.060 -7.665 1.00 . A A . 12 VAL C 1 1 12 4909 1 1 12 VAL CA C -5.151 5.545 -6.450 1.00 . A A . 12 VAL CA 1 1 12 4910 1 1 12 VAL CB C -4.292 5.492 -5.148 1.00 . A A . 12 VAL CB 1 1 12 4911 1 1 12 VAL CG1 C -3.192 6.560 -5.089 1.00 . A A . 12 VAL CG1 1 1 12 4912 1 1 12 VAL CG2 C -5.243 5.721 -3.973 1.00 . A A . 12 VAL CG2 1 1 12 4913 1 1 12 VAL H H -5.039 3.502 -7.114 1.00 . A A . 12 VAL H 1 1 12 4914 1 1 12 VAL HA H -6.006 6.191 -6.315 1.00 . A A . 12 VAL HA 1 1 12 4915 1 1 12 VAL HB H -3.840 4.515 -5.054 1.00 . A A . 12 VAL HB 1 1 12 4916 1 1 12 VAL HG11 H -3.542 7.477 -5.535 1.00 . A A . 12 VAL HG11 1 1 12 4917 1 1 12 VAL HG12 H -2.911 6.752 -4.063 1.00 . A A . 12 VAL HG12 1 1 12 4918 1 1 12 VAL HG13 H -2.323 6.203 -5.616 1.00 . A A . 12 VAL HG13 1 1 12 4919 1 1 12 VAL HG21 H -5.780 6.649 -4.115 1.00 . A A . 12 VAL HG21 1 1 12 4920 1 1 12 VAL HG22 H -5.953 4.912 -3.924 1.00 . A A . 12 VAL HG22 1 1 12 4921 1 1 12 VAL HG23 H -4.690 5.768 -3.049 1.00 . A A . 12 VAL HG23 1 1 12 4922 1 1 12 VAL N N -5.624 4.150 -6.671 1.00 . A A . 12 VAL N 1 1 12 4923 1 1 12 VAL O O -4.693 7.134 -8.138 1.00 . A A . 12 VAL O 1 1 12 4924 1 1 13 HIS C C -1.564 6.760 -8.997 1.00 . A A . 13 HIS C 1 1 12 4925 1 1 13 HIS CA C -2.594 5.654 -9.314 1.00 . A A . 13 HIS CA 1 1 12 4926 1 1 13 HIS CB C -3.506 6.122 -10.499 1.00 . A A . 13 HIS CB 1 1 12 4927 1 1 13 HIS CD2 C -5.204 4.075 -10.079 1.00 . A A . 13 HIS CD2 1 1 12 4928 1 1 13 HIS CE1 C -6.109 4.091 -11.942 1.00 . A A . 13 HIS CE1 1 1 12 4929 1 1 13 HIS CG C -4.617 5.098 -10.819 1.00 . A A . 13 HIS CG 1 1 12 4930 1 1 13 HIS H H -3.269 4.436 -7.673 1.00 . A A . 13 HIS H 1 1 12 4931 1 1 13 HIS HA H -2.051 4.774 -9.623 1.00 . A A . 13 HIS HA 1 1 12 4932 1 1 13 HIS HB2 H -3.962 7.080 -10.299 1.00 . A A . 13 HIS HB2 1 1 12 4933 1 1 13 HIS HB3 H -2.893 6.229 -11.382 1.00 . A A . 13 HIS HB3 1 1 12 4934 1 1 13 HIS HD1 H -5.057 5.633 -12.718 1.00 . A A . 13 HIS HD1 1 1 12 4935 1 1 13 HIS HD2 H -4.954 3.808 -9.064 1.00 . A A . 13 HIS HD2 1 1 12 4936 1 1 13 HIS HE1 H -6.750 3.844 -12.776 1.00 . A A . 13 HIS HE1 1 1 12 4937 1 1 13 HIS N N -3.436 5.289 -8.124 1.00 . A A . 13 HIS N 1 1 12 4938 1 1 13 HIS ND1 N -5.231 5.041 -11.957 1.00 . A A . 13 HIS ND1 1 1 12 4939 1 1 13 HIS NE2 N -6.127 3.463 -10.794 1.00 . A A . 13 HIS NE2 1 1 12 4940 1 1 13 HIS O O -0.730 7.061 -9.827 1.00 . A A . 13 HIS O 1 1 12 4941 1 1 14 HIS C C 0.381 7.651 -6.616 1.00 . A A . 14 HIS C 1 1 12 4942 1 1 14 HIS CA C -0.693 8.410 -7.404 1.00 . A A . 14 HIS CA 1 1 12 4943 1 1 14 HIS CB C -1.396 9.455 -6.496 1.00 . A A . 14 HIS CB 1 1 12 4944 1 1 14 HIS CD2 C -3.341 10.134 -8.104 1.00 . A A . 14 HIS CD2 1 1 12 4945 1 1 14 HIS CE1 C -2.878 12.134 -8.368 1.00 . A A . 14 HIS CE1 1 1 12 4946 1 1 14 HIS CG C -2.213 10.398 -7.367 1.00 . A A . 14 HIS CG 1 1 12 4947 1 1 14 HIS H H -2.337 7.061 -7.196 1.00 . A A . 14 HIS H 1 1 12 4948 1 1 14 HIS HA H -0.285 8.873 -8.279 1.00 . A A . 14 HIS HA 1 1 12 4949 1 1 14 HIS HB2 H -2.055 8.980 -5.786 1.00 . A A . 14 HIS HB2 1 1 12 4950 1 1 14 HIS HB3 H -0.664 10.038 -5.956 1.00 . A A . 14 HIS HB3 1 1 12 4951 1 1 14 HIS HD1 H -1.233 12.159 -7.185 1.00 . A A . 14 HIS HD1 1 1 12 4952 1 1 14 HIS HD2 H -3.801 9.162 -8.146 1.00 . A A . 14 HIS HD2 1 1 12 4953 1 1 14 HIS HE1 H -2.907 13.163 -8.697 1.00 . A A . 14 HIS HE1 1 1 12 4954 1 1 14 HIS N N -1.644 7.336 -7.819 1.00 . A A . 14 HIS N 1 1 12 4955 1 1 14 HIS ND1 N -1.977 11.651 -7.571 1.00 . A A . 14 HIS ND1 1 1 12 4956 1 1 14 HIS NE2 N -3.750 11.223 -8.725 1.00 . A A . 14 HIS NE2 1 1 12 4957 1 1 14 HIS O O 1.276 7.076 -7.203 1.00 . A A . 14 HIS O 1 1 12 4958 1 1 15 GLN C C 1.305 5.473 -4.846 1.00 . A A . 15 GLN C 1 1 12 4959 1 1 15 GLN CA C 1.237 6.942 -4.420 1.00 . A A . 15 GLN CA 1 1 12 4960 1 1 15 GLN CB C 0.763 7.037 -2.962 1.00 . A A . 15 GLN CB 1 1 12 4961 1 1 15 GLN CD C -0.018 8.580 -1.159 1.00 . A A . 15 GLN CD 1 1 12 4962 1 1 15 GLN CG C 0.677 8.512 -2.524 1.00 . A A . 15 GLN CG 1 1 12 4963 1 1 15 GLN H H -0.493 8.137 -4.907 1.00 . A A . 15 GLN H 1 1 12 4964 1 1 15 GLN HA H 2.219 7.369 -4.542 1.00 . A A . 15 GLN HA 1 1 12 4965 1 1 15 GLN HB2 H -0.206 6.566 -2.869 1.00 . A A . 15 GLN HB2 1 1 12 4966 1 1 15 GLN HB3 H 1.462 6.519 -2.324 1.00 . A A . 15 GLN HB3 1 1 12 4967 1 1 15 GLN HE21 H -1.836 8.382 -1.933 1.00 . A A . 15 GLN HE21 1 1 12 4968 1 1 15 GLN HE22 H -1.777 8.532 -0.243 1.00 . A A . 15 GLN HE22 1 1 12 4969 1 1 15 GLN HG2 H 1.667 8.936 -2.436 1.00 . A A . 15 GLN HG2 1 1 12 4970 1 1 15 GLN HG3 H 0.106 9.096 -3.231 1.00 . A A . 15 GLN HG3 1 1 12 4971 1 1 15 GLN N N 0.258 7.655 -5.309 1.00 . A A . 15 GLN N 1 1 12 4972 1 1 15 GLN NE2 N -1.318 8.491 -1.107 1.00 . A A . 15 GLN NE2 1 1 12 4973 1 1 15 GLN O O 2.278 4.791 -4.602 1.00 . A A . 15 GLN O 1 1 12 4974 1 1 15 GLN OE1 O 0.615 8.715 -0.130 1.00 . A A . 15 GLN OE1 1 1 12 4975 1 1 16 GLU C C 1.361 3.235 -6.756 1.00 . A A . 16 GLU C 1 1 12 4976 1 1 16 GLU CA C 0.108 3.660 -5.980 1.00 . A A . 16 GLU CA 1 1 12 4977 1 1 16 GLU CB C -1.116 3.613 -6.871 1.00 . A A . 16 GLU CB 1 1 12 4978 1 1 16 GLU CD C -2.673 2.123 -8.106 1.00 . A A . 16 GLU CD 1 1 12 4979 1 1 16 GLU CG C -1.309 2.191 -7.396 1.00 . A A . 16 GLU CG 1 1 12 4980 1 1 16 GLU H H -0.499 5.675 -5.627 1.00 . A A . 16 GLU H 1 1 12 4981 1 1 16 GLU HA H -0.042 3.000 -5.145 1.00 . A A . 16 GLU HA 1 1 12 4982 1 1 16 GLU HB2 H -1.981 3.919 -6.303 1.00 . A A . 16 GLU HB2 1 1 12 4983 1 1 16 GLU HB3 H -0.980 4.294 -7.698 1.00 . A A . 16 GLU HB3 1 1 12 4984 1 1 16 GLU HG2 H -0.513 1.949 -8.088 1.00 . A A . 16 GLU HG2 1 1 12 4985 1 1 16 GLU HG3 H -1.274 1.489 -6.574 1.00 . A A . 16 GLU HG3 1 1 12 4986 1 1 16 GLU N N 0.240 5.051 -5.478 1.00 . A A . 16 GLU N 1 1 12 4987 1 1 16 GLU O O 1.860 2.141 -6.581 1.00 . A A . 16 GLU O 1 1 12 4988 1 1 16 GLU OE1 O -3.649 1.931 -7.397 1.00 . A A . 16 GLU OE1 1 1 12 4989 1 1 16 GLU OE2 O -2.665 2.271 -9.317 1.00 . A A . 16 GLU OE2 1 1 12 4990 1 1 17 LEU C C 4.277 4.184 -7.614 1.00 . A A . 17 LEU C 1 1 12 4991 1 1 17 LEU CA C 3.036 3.851 -8.410 1.00 . A A . 17 LEU CA 1 1 12 4992 1 1 17 LEU CB C 3.041 4.693 -9.718 1.00 . A A . 17 LEU CB 1 1 12 4993 1 1 17 LEU CD1 C 1.698 6.017 -11.376 1.00 . A A . 17 LEU CD1 1 1 12 4994 1 1 17 LEU CD2 C 0.822 3.795 -10.570 1.00 . A A . 17 LEU CD2 1 1 12 4995 1 1 17 LEU CG C 1.611 5.063 -10.166 1.00 . A A . 17 LEU CG 1 1 12 4996 1 1 17 LEU H H 1.376 4.999 -7.669 1.00 . A A . 17 LEU H 1 1 12 4997 1 1 17 LEU HA H 3.044 2.799 -8.593 1.00 . A A . 17 LEU HA 1 1 12 4998 1 1 17 LEU HB2 H 3.604 5.603 -9.565 1.00 . A A . 17 LEU HB2 1 1 12 4999 1 1 17 LEU HB3 H 3.530 4.126 -10.499 1.00 . A A . 17 LEU HB3 1 1 12 5000 1 1 17 LEU HD11 H 2.336 5.598 -12.140 1.00 . A A . 17 LEU HD11 1 1 12 5001 1 1 17 LEU HD12 H 0.717 6.182 -11.796 1.00 . A A . 17 LEU HD12 1 1 12 5002 1 1 17 LEU HD13 H 2.105 6.967 -11.065 1.00 . A A . 17 LEU HD13 1 1 12 5003 1 1 17 LEU HD21 H 1.339 3.265 -11.356 1.00 . A A . 17 LEU HD21 1 1 12 5004 1 1 17 LEU HD22 H 0.709 3.134 -9.724 1.00 . A A . 17 LEU HD22 1 1 12 5005 1 1 17 LEU HD23 H -0.162 4.068 -10.925 1.00 . A A . 17 LEU HD23 1 1 12 5006 1 1 17 LEU HG H 1.126 5.562 -9.343 1.00 . A A . 17 LEU HG 1 1 12 5007 1 1 17 LEU N N 1.823 4.134 -7.589 1.00 . A A . 17 LEU N 1 1 12 5008 1 1 17 LEU O O 5.349 3.671 -7.852 1.00 . A A . 17 LEU O 1 1 12 5009 1 1 18 VAL C C 5.620 4.238 -4.956 1.00 . A A . 18 VAL C 1 1 12 5010 1 1 18 VAL CA C 5.269 5.444 -5.824 1.00 . A A . 18 VAL CA 1 1 12 5011 1 1 18 VAL CB C 4.877 6.638 -4.968 1.00 . A A . 18 VAL CB 1 1 12 5012 1 1 18 VAL CG1 C 6.107 7.118 -4.178 1.00 . A A . 18 VAL CG1 1 1 12 5013 1 1 18 VAL CG2 C 4.417 7.721 -5.949 1.00 . A A . 18 VAL CG2 1 1 12 5014 1 1 18 VAL H H 3.220 5.455 -6.534 1.00 . A A . 18 VAL H 1 1 12 5015 1 1 18 VAL HA H 6.110 5.679 -6.461 1.00 . A A . 18 VAL HA 1 1 12 5016 1 1 18 VAL HB H 4.087 6.375 -4.282 1.00 . A A . 18 VAL HB 1 1 12 5017 1 1 18 VAL HG11 H 6.968 7.188 -4.825 1.00 . A A . 18 VAL HG11 1 1 12 5018 1 1 18 VAL HG12 H 5.912 8.079 -3.729 1.00 . A A . 18 VAL HG12 1 1 12 5019 1 1 18 VAL HG13 H 6.328 6.413 -3.392 1.00 . A A . 18 VAL HG13 1 1 12 5020 1 1 18 VAL HG21 H 5.188 7.896 -6.685 1.00 . A A . 18 VAL HG21 1 1 12 5021 1 1 18 VAL HG22 H 3.532 7.379 -6.465 1.00 . A A . 18 VAL HG22 1 1 12 5022 1 1 18 VAL HG23 H 4.190 8.632 -5.427 1.00 . A A . 18 VAL HG23 1 1 12 5023 1 1 18 VAL N N 4.106 5.059 -6.670 1.00 . A A . 18 VAL N 1 1 12 5024 1 1 18 VAL O O 6.698 4.169 -4.405 1.00 . A A . 18 VAL O 1 1 12 5025 1 1 19 PHE C C 5.872 1.206 -4.863 1.00 . A A . 19 PHE C 1 1 12 5026 1 1 19 PHE CA C 4.924 2.095 -4.057 1.00 . A A . 19 PHE CA 1 1 12 5027 1 1 19 PHE CB C 3.606 1.338 -3.822 1.00 . A A . 19 PHE CB 1 1 12 5028 1 1 19 PHE CD1 C 2.895 3.223 -2.249 1.00 . A A . 19 PHE CD1 1 1 12 5029 1 1 19 PHE CD2 C 1.209 1.937 -3.328 1.00 . A A . 19 PHE CD2 1 1 12 5030 1 1 19 PHE CE1 C 1.928 3.970 -1.615 1.00 . A A . 19 PHE CE1 1 1 12 5031 1 1 19 PHE CE2 C 0.238 2.685 -2.693 1.00 . A A . 19 PHE CE2 1 1 12 5032 1 1 19 PHE CG C 2.547 2.199 -3.111 1.00 . A A . 19 PHE CG 1 1 12 5033 1 1 19 PHE CZ C 0.595 3.702 -1.836 1.00 . A A . 19 PHE CZ 1 1 12 5034 1 1 19 PHE H H 3.836 3.430 -5.347 1.00 . A A . 19 PHE H 1 1 12 5035 1 1 19 PHE HA H 5.399 2.392 -3.136 1.00 . A A . 19 PHE HA 1 1 12 5036 1 1 19 PHE HB2 H 3.206 1.007 -4.769 1.00 . A A . 19 PHE HB2 1 1 12 5037 1 1 19 PHE HB3 H 3.797 0.467 -3.212 1.00 . A A . 19 PHE HB3 1 1 12 5038 1 1 19 PHE HD1 H 3.934 3.443 -2.075 1.00 . A A . 19 PHE HD1 1 1 12 5039 1 1 19 PHE HD2 H 0.922 1.144 -4.007 1.00 . A A . 19 PHE HD2 1 1 12 5040 1 1 19 PHE HE1 H 2.214 4.766 -0.943 1.00 . A A . 19 PHE HE1 1 1 12 5041 1 1 19 PHE HE2 H -0.806 2.473 -2.870 1.00 . A A . 19 PHE HE2 1 1 12 5042 1 1 19 PHE HZ H -0.165 4.286 -1.341 1.00 . A A . 19 PHE HZ 1 1 12 5043 1 1 19 PHE N N 4.688 3.318 -4.871 1.00 . A A . 19 PHE N 1 1 12 5044 1 1 19 PHE O O 6.569 0.367 -4.328 1.00 . A A . 19 PHE O 1 1 12 5045 1 1 20 PHE C C 8.076 1.380 -7.064 1.00 . A A . 20 PHE C 1 1 12 5046 1 1 20 PHE CA C 6.713 0.682 -7.099 1.00 . A A . 20 PHE CA 1 1 12 5047 1 1 20 PHE CB C 6.022 0.738 -8.493 1.00 . A A . 20 PHE CB 1 1 12 5048 1 1 20 PHE CD1 C 7.948 0.043 -9.995 1.00 . A A . 20 PHE CD1 1 1 12 5049 1 1 20 PHE CD2 C 7.022 2.219 -10.305 1.00 . A A . 20 PHE CD2 1 1 12 5050 1 1 20 PHE CE1 C 8.851 0.283 -11.010 1.00 . A A . 20 PHE CE1 1 1 12 5051 1 1 20 PHE CE2 C 7.927 2.458 -11.319 1.00 . A A . 20 PHE CE2 1 1 12 5052 1 1 20 PHE CG C 7.025 1.009 -9.634 1.00 . A A . 20 PHE CG 1 1 12 5053 1 1 20 PHE CZ C 8.842 1.491 -11.672 1.00 . A A . 20 PHE CZ 1 1 12 5054 1 1 20 PHE H H 5.265 2.162 -6.481 1.00 . A A . 20 PHE H 1 1 12 5055 1 1 20 PHE HA H 6.819 -0.338 -6.758 1.00 . A A . 20 PHE HA 1 1 12 5056 1 1 20 PHE HB2 H 5.535 -0.206 -8.675 1.00 . A A . 20 PHE HB2 1 1 12 5057 1 1 20 PHE HB3 H 5.259 1.501 -8.502 1.00 . A A . 20 PHE HB3 1 1 12 5058 1 1 20 PHE HD1 H 7.960 -0.906 -9.480 1.00 . A A . 20 PHE HD1 1 1 12 5059 1 1 20 PHE HD2 H 6.309 2.986 -10.040 1.00 . A A . 20 PHE HD2 1 1 12 5060 1 1 20 PHE HE1 H 9.567 -0.478 -11.283 1.00 . A A . 20 PHE HE1 1 1 12 5061 1 1 20 PHE HE2 H 7.917 3.406 -11.838 1.00 . A A . 20 PHE HE2 1 1 12 5062 1 1 20 PHE HZ H 9.550 1.678 -12.466 1.00 . A A . 20 PHE HZ 1 1 12 5063 1 1 20 PHE N N 5.856 1.448 -6.148 1.00 . A A . 20 PHE N 1 1 12 5064 1 1 20 PHE O O 9.113 0.760 -6.933 1.00 . A A . 20 PHE O 1 1 12 5065 1 1 21 ALA C C 9.931 3.280 -5.802 1.00 . A A . 21 ALA C 1 1 12 5066 1 1 21 ALA CA C 9.263 3.499 -7.160 1.00 . A A . 21 ALA CA 1 1 12 5067 1 1 21 ALA CB C 8.895 4.975 -7.343 1.00 . A A . 21 ALA CB 1 1 12 5068 1 1 21 ALA H H 7.156 3.114 -7.286 1.00 . A A . 21 ALA H 1 1 12 5069 1 1 21 ALA HA H 9.923 3.155 -7.941 1.00 . A A . 21 ALA HA 1 1 12 5070 1 1 21 ALA HB1 H 8.240 5.091 -8.195 1.00 . A A . 21 ALA HB1 1 1 12 5071 1 1 21 ALA HB2 H 8.393 5.348 -6.463 1.00 . A A . 21 ALA HB2 1 1 12 5072 1 1 21 ALA HB3 H 9.788 5.560 -7.510 1.00 . A A . 21 ALA HB3 1 1 12 5073 1 1 21 ALA N N 8.022 2.681 -7.182 1.00 . A A . 21 ALA N 1 1 12 5074 1 1 21 ALA O O 11.133 3.387 -5.678 1.00 . A A . 21 ALA O 1 1 12 5075 1 1 22 GLU C C 10.575 1.512 -3.469 1.00 . A A . 22 GLU C 1 1 12 5076 1 1 22 GLU CA C 9.642 2.728 -3.451 1.00 . A A . 22 GLU CA 1 1 12 5077 1 1 22 GLU CB C 8.466 2.472 -2.483 1.00 . A A . 22 GLU CB 1 1 12 5078 1 1 22 GLU CD C 6.657 3.762 -1.263 1.00 . A A . 22 GLU CD 1 1 12 5079 1 1 22 GLU CG C 8.138 3.761 -1.689 1.00 . A A . 22 GLU CG 1 1 12 5080 1 1 22 GLU H H 8.149 2.892 -5.004 1.00 . A A . 22 GLU H 1 1 12 5081 1 1 22 GLU HA H 10.204 3.599 -3.171 1.00 . A A . 22 GLU HA 1 1 12 5082 1 1 22 GLU HB2 H 7.602 2.154 -3.041 1.00 . A A . 22 GLU HB2 1 1 12 5083 1 1 22 GLU HB3 H 8.720 1.688 -1.782 1.00 . A A . 22 GLU HB3 1 1 12 5084 1 1 22 GLU HG2 H 8.753 3.811 -0.801 1.00 . A A . 22 GLU HG2 1 1 12 5085 1 1 22 GLU HG3 H 8.336 4.635 -2.294 1.00 . A A . 22 GLU HG3 1 1 12 5086 1 1 22 GLU N N 9.113 2.969 -4.824 1.00 . A A . 22 GLU N 1 1 12 5087 1 1 22 GLU O O 11.628 1.520 -2.861 1.00 . A A . 22 GLU O 1 1 12 5088 1 1 22 GLU OE1 O 6.272 2.819 -0.589 1.00 . A A . 22 GLU OE1 1 1 12 5089 1 1 22 GLU OE2 O 5.987 4.711 -1.634 1.00 . A A . 22 GLU OE2 1 1 12 5090 1 1 23 ASP C C 12.219 -0.453 -5.070 1.00 . A A . 23 ASP C 1 1 12 5091 1 1 23 ASP CA C 10.923 -0.757 -4.312 1.00 . A A . 23 ASP CA 1 1 12 5092 1 1 23 ASP CB C 10.081 -1.791 -5.080 1.00 . A A . 23 ASP CB 1 1 12 5093 1 1 23 ASP CG C 9.118 -2.478 -4.101 1.00 . A A . 23 ASP CG 1 1 12 5094 1 1 23 ASP H H 9.276 0.600 -4.638 1.00 . A A . 23 ASP H 1 1 12 5095 1 1 23 ASP HA H 11.171 -1.121 -3.324 1.00 . A A . 23 ASP HA 1 1 12 5096 1 1 23 ASP HB2 H 9.505 -1.310 -5.856 1.00 . A A . 23 ASP HB2 1 1 12 5097 1 1 23 ASP HB3 H 10.720 -2.534 -5.536 1.00 . A A . 23 ASP HB3 1 1 12 5098 1 1 23 ASP N N 10.137 0.508 -4.183 1.00 . A A . 23 ASP N 1 1 12 5099 1 1 23 ASP O O 13.288 -0.853 -4.652 1.00 . A A . 23 ASP O 1 1 12 5100 1 1 23 ASP OD1 O 8.101 -1.865 -3.822 1.00 . A A . 23 ASP OD1 1 1 12 5101 1 1 23 ASP OD2 O 9.452 -3.575 -3.683 1.00 . A A . 23 ASP OD2 1 1 12 5102 1 1 24 VAL C C 14.305 1.314 -6.147 1.00 . A A . 24 VAL C 1 1 12 5103 1 1 24 VAL CA C 13.229 0.638 -7.022 1.00 . A A . 24 VAL CA 1 1 12 5104 1 1 24 VAL CB C 12.728 1.612 -8.130 1.00 . A A . 24 VAL CB 1 1 12 5105 1 1 24 VAL CG1 C 13.919 2.147 -8.960 1.00 . A A . 24 VAL CG1 1 1 12 5106 1 1 24 VAL CG2 C 11.757 0.868 -9.075 1.00 . A A . 24 VAL CG2 1 1 12 5107 1 1 24 VAL H H 11.155 0.512 -6.424 1.00 . A A . 24 VAL H 1 1 12 5108 1 1 24 VAL HA H 13.647 -0.255 -7.464 1.00 . A A . 24 VAL HA 1 1 12 5109 1 1 24 VAL HB H 12.213 2.445 -7.676 1.00 . A A . 24 VAL HB 1 1 12 5110 1 1 24 VAL HG11 H 14.567 1.337 -9.260 1.00 . A A . 24 VAL HG11 1 1 12 5111 1 1 24 VAL HG12 H 13.560 2.652 -9.846 1.00 . A A . 24 VAL HG12 1 1 12 5112 1 1 24 VAL HG13 H 14.491 2.852 -8.376 1.00 . A A . 24 VAL HG13 1 1 12 5113 1 1 24 VAL HG21 H 10.989 0.359 -8.510 1.00 . A A . 24 VAL HG21 1 1 12 5114 1 1 24 VAL HG22 H 11.280 1.572 -9.742 1.00 . A A . 24 VAL HG22 1 1 12 5115 1 1 24 VAL HG23 H 12.290 0.138 -9.667 1.00 . A A . 24 VAL HG23 1 1 12 5116 1 1 24 VAL N N 12.062 0.248 -6.165 1.00 . A A . 24 VAL N 1 1 12 5117 1 1 24 VAL O O 15.456 0.923 -6.174 1.00 . A A . 24 VAL O 1 1 12 5118 1 1 25 GLY C C 14.731 4.562 -4.812 1.00 . A A . 25 GLY C 1 1 12 5119 1 1 25 GLY CA C 14.795 3.065 -4.497 1.00 . A A . 25 GLY CA 1 1 12 5120 1 1 25 GLY H H 12.937 2.567 -5.446 1.00 . A A . 25 GLY H 1 1 12 5121 1 1 25 GLY HA2 H 14.483 2.908 -3.476 1.00 . A A . 25 GLY HA2 1 1 12 5122 1 1 25 GLY HA3 H 15.812 2.721 -4.617 1.00 . A A . 25 GLY HA3 1 1 12 5123 1 1 25 GLY N N 13.880 2.306 -5.405 1.00 . A A . 25 GLY N 1 1 12 5124 1 1 25 GLY O O 15.675 5.285 -4.563 1.00 . A A . 25 GLY O 1 1 12 5125 1 1 26 SER C C 14.577 7.117 -6.404 1.00 . A A . 26 SER C 1 1 12 5126 1 1 26 SER CA C 13.372 6.416 -5.732 1.00 . A A . 26 SER CA 1 1 12 5127 1 1 26 SER CB C 12.964 7.178 -4.450 1.00 . A A . 26 SER CB 1 1 12 5128 1 1 26 SER H H 12.895 4.337 -5.521 1.00 . A A . 26 SER H 1 1 12 5129 1 1 26 SER HA H 12.548 6.439 -6.430 1.00 . A A . 26 SER HA 1 1 12 5130 1 1 26 SER HB2 H 13.744 7.153 -3.703 1.00 . A A . 26 SER HB2 1 1 12 5131 1 1 26 SER HB3 H 12.683 8.200 -4.663 1.00 . A A . 26 SER HB3 1 1 12 5132 1 1 26 SER HG H 11.082 7.072 -3.965 1.00 . A A . 26 SER HG 1 1 12 5133 1 1 26 SER N N 13.613 4.980 -5.356 1.00 . A A . 26 SER N 1 1 12 5134 1 1 26 SER O O 14.675 8.329 -6.386 1.00 . A A . 26 SER O 1 1 12 5135 1 1 26 SER OG O 11.828 6.467 -3.976 1.00 . A A . 26 SER OG 1 1 12 5136 1 1 27 ASN C C 17.474 7.837 -6.791 1.00 . A A . 27 ASN C 1 1 12 5137 1 1 27 ASN CA C 16.674 6.849 -7.673 1.00 . A A . 27 ASN CA 1 1 12 5138 1 1 27 ASN CB C 16.222 7.532 -8.998 1.00 . A A . 27 ASN CB 1 1 12 5139 1 1 27 ASN CG C 17.233 7.238 -10.117 1.00 . A A . 27 ASN CG 1 1 12 5140 1 1 27 ASN H H 15.303 5.359 -6.960 1.00 . A A . 27 ASN H 1 1 12 5141 1 1 27 ASN HA H 17.312 6.003 -7.888 1.00 . A A . 27 ASN HA 1 1 12 5142 1 1 27 ASN HB2 H 15.258 7.150 -9.302 1.00 . A A . 27 ASN HB2 1 1 12 5143 1 1 27 ASN HB3 H 16.143 8.602 -8.876 1.00 . A A . 27 ASN HB3 1 1 12 5144 1 1 27 ASN HD21 H 18.818 7.526 -8.957 1.00 . A A . 27 ASN HD21 1 1 12 5145 1 1 27 ASN HD22 H 19.162 7.112 -10.567 1.00 . A A . 27 ASN HD22 1 1 12 5146 1 1 27 ASN N N 15.451 6.326 -6.981 1.00 . A A . 27 ASN N 1 1 12 5147 1 1 27 ASN ND2 N 18.511 7.298 -9.859 1.00 . A A . 27 ASN ND2 1 1 12 5148 1 1 27 ASN O O 18.132 8.726 -7.296 1.00 . A A . 27 ASN O 1 1 12 5149 1 1 27 ASN OD1 O 16.867 6.953 -11.240 1.00 . A A . 27 ASN OD1 1 1 12 5150 1 1 28 LYS C C 19.446 7.898 -4.071 1.00 . A A . 28 LYS C 1 1 12 5151 1 1 28 LYS CA C 18.115 8.529 -4.531 1.00 . A A . 28 LYS CA 1 1 12 5152 1 1 28 LYS CB C 17.179 8.786 -3.320 1.00 . A A . 28 LYS CB 1 1 12 5153 1 1 28 LYS CD C 17.834 7.375 -1.313 1.00 . A A . 28 LYS CD 1 1 12 5154 1 1 28 LYS CE C 18.136 5.898 -1.009 1.00 . A A . 28 LYS CE 1 1 12 5155 1 1 28 LYS CG C 16.895 7.476 -2.536 1.00 . A A . 28 LYS CG 1 1 12 5156 1 1 28 LYS H H 16.851 6.905 -5.148 1.00 . A A . 28 LYS H 1 1 12 5157 1 1 28 LYS HA H 18.326 9.475 -5.010 1.00 . A A . 28 LYS HA 1 1 12 5158 1 1 28 LYS HB2 H 17.625 9.527 -2.672 1.00 . A A . 28 LYS HB2 1 1 12 5159 1 1 28 LYS HB3 H 16.243 9.184 -3.684 1.00 . A A . 28 LYS HB3 1 1 12 5160 1 1 28 LYS HD2 H 18.761 7.894 -1.501 1.00 . A A . 28 LYS HD2 1 1 12 5161 1 1 28 LYS HD3 H 17.354 7.829 -0.458 1.00 . A A . 28 LYS HD3 1 1 12 5162 1 1 28 LYS HE2 H 17.239 5.390 -0.685 1.00 . A A . 28 LYS HE2 1 1 12 5163 1 1 28 LYS HE3 H 18.525 5.401 -1.886 1.00 . A A . 28 LYS HE3 1 1 12 5164 1 1 28 LYS HG2 H 15.869 7.475 -2.200 1.00 . A A . 28 LYS HG2 1 1 12 5165 1 1 28 LYS HG3 H 17.040 6.620 -3.177 1.00 . A A . 28 LYS HG3 1 1 12 5166 1 1 28 LYS HZ1 H 19.430 6.758 0.379 1.00 . A A . 28 LYS HZ1 1 1 12 5167 1 1 28 LYS HZ2 H 18.754 5.284 0.882 1.00 . A A . 28 LYS HZ2 1 1 12 5168 1 1 28 LYS HZ3 H 19.991 5.298 -0.281 1.00 . A A . 28 LYS HZ3 1 1 12 5169 1 1 28 LYS N N 17.392 7.643 -5.497 1.00 . A A . 28 LYS N 1 1 12 5170 1 1 28 LYS NZ N 19.154 5.803 0.075 1.00 . A A . 28 LYS NZ 1 1 12 5171 1 1 28 LYS O O 20.301 8.674 -3.679 1.00 . A A . 28 LYS O 1 1 12 5172 1 1 28 LYS OXT O 19.536 6.681 -4.132 1.00 . A A . 28 LYS OXT 1 1 13 5173 1 1 1 ASP C C -13.510 8.143 2.256 1.00 . A A . 1 ASP C 1 1 13 5174 1 1 1 ASP CA C -13.604 7.208 3.475 1.00 . A A . 1 ASP CA 1 1 13 5175 1 1 1 ASP CB C -15.096 6.902 3.844 1.00 . A A . 1 ASP CB 1 1 13 5176 1 1 1 ASP CG C -16.043 7.006 2.629 1.00 . A A . 1 ASP CG 1 1 13 5177 1 1 1 ASP H1 H -12.569 8.777 4.379 1.00 . A A . 1 ASP H1 1 1 13 5178 1 1 1 ASP H2 H -13.634 7.962 5.418 1.00 . A A . 1 ASP H2 1 1 13 5179 1 1 1 ASP H3 H -12.163 7.241 4.977 1.00 . A A . 1 ASP H3 1 1 13 5180 1 1 1 ASP HA H -13.072 6.297 3.253 1.00 . A A . 1 ASP HA 1 1 13 5181 1 1 1 ASP HB2 H -15.162 5.902 4.249 1.00 . A A . 1 ASP HB2 1 1 13 5182 1 1 1 ASP HB3 H -15.433 7.591 4.605 1.00 . A A . 1 ASP HB3 1 1 13 5183 1 1 1 ASP N N -12.943 7.846 4.650 1.00 . A A . 1 ASP N 1 1 13 5184 1 1 1 ASP O O -13.230 9.319 2.390 1.00 . A A . 1 ASP O 1 1 13 5185 1 1 1 ASP OD1 O -16.192 6.005 1.949 1.00 . A A . 1 ASP OD1 1 1 13 5186 1 1 1 ASP OD2 O -16.562 8.096 2.452 1.00 . A A . 1 ASP OD2 1 1 13 5187 1 1 2 ALA C C -15.000 8.202 -0.959 1.00 . A A . 2 ALA C 1 1 13 5188 1 1 2 ALA CA C -13.706 8.338 -0.180 1.00 . A A . 2 ALA CA 1 1 13 5189 1 1 2 ALA CB C -12.558 7.823 -1.059 1.00 . A A . 2 ALA CB 1 1 13 5190 1 1 2 ALA H H -13.977 6.619 1.081 1.00 . A A . 2 ALA H 1 1 13 5191 1 1 2 ALA HA H -13.591 9.386 0.037 1.00 . A A . 2 ALA HA 1 1 13 5192 1 1 2 ALA HB1 H -11.628 7.835 -0.514 1.00 . A A . 2 ALA HB1 1 1 13 5193 1 1 2 ALA HB2 H -12.758 6.812 -1.384 1.00 . A A . 2 ALA HB2 1 1 13 5194 1 1 2 ALA HB3 H -12.460 8.445 -1.937 1.00 . A A . 2 ALA HB3 1 1 13 5195 1 1 2 ALA N N -13.755 7.572 1.102 1.00 . A A . 2 ALA N 1 1 13 5196 1 1 2 ALA O O -15.298 9.068 -1.757 1.00 . A A . 2 ALA O 1 1 13 5197 1 1 3 GLU C C -17.006 7.206 -2.871 1.00 . A A . 3 GLU C 1 1 13 5198 1 1 3 GLU CA C -17.014 6.828 -1.377 1.00 . A A . 3 GLU CA 1 1 13 5199 1 1 3 GLU CB C -18.122 7.586 -0.587 1.00 . A A . 3 GLU CB 1 1 13 5200 1 1 3 GLU CD C -17.746 9.890 0.395 1.00 . A A . 3 GLU CD 1 1 13 5201 1 1 3 GLU CG C -18.175 9.116 -0.867 1.00 . A A . 3 GLU CG 1 1 13 5202 1 1 3 GLU H H -15.371 6.495 -0.034 1.00 . A A . 3 GLU H 1 1 13 5203 1 1 3 GLU HA H -17.189 5.765 -1.307 1.00 . A A . 3 GLU HA 1 1 13 5204 1 1 3 GLU HB2 H -19.076 7.156 -0.841 1.00 . A A . 3 GLU HB2 1 1 13 5205 1 1 3 GLU HB3 H -17.952 7.417 0.464 1.00 . A A . 3 GLU HB3 1 1 13 5206 1 1 3 GLU HG2 H -17.549 9.403 -1.696 1.00 . A A . 3 GLU HG2 1 1 13 5207 1 1 3 GLU HG3 H -19.190 9.392 -1.113 1.00 . A A . 3 GLU HG3 1 1 13 5208 1 1 3 GLU N N -15.710 7.128 -0.700 1.00 . A A . 3 GLU N 1 1 13 5209 1 1 3 GLU O O -18.009 7.574 -3.452 1.00 . A A . 3 GLU O 1 1 13 5210 1 1 3 GLU OE1 O -18.597 10.027 1.259 1.00 . A A . 3 GLU OE1 1 1 13 5211 1 1 3 GLU OE2 O -16.598 10.301 0.434 1.00 . A A . 3 GLU OE2 1 1 13 5212 1 1 4 PHE C C -15.034 6.108 -5.480 1.00 . A A . 4 PHE C 1 1 13 5213 1 1 4 PHE CA C -15.570 7.392 -4.856 1.00 . A A . 4 PHE CA 1 1 13 5214 1 1 4 PHE CB C -14.546 8.548 -4.919 1.00 . A A . 4 PHE CB 1 1 13 5215 1 1 4 PHE CD1 C -15.064 9.243 -7.308 1.00 . A A . 4 PHE CD1 1 1 13 5216 1 1 4 PHE CD2 C -12.826 8.613 -6.777 1.00 . A A . 4 PHE CD2 1 1 13 5217 1 1 4 PHE CE1 C -14.687 9.475 -8.616 1.00 . A A . 4 PHE CE1 1 1 13 5218 1 1 4 PHE CE2 C -12.449 8.844 -8.083 1.00 . A A . 4 PHE CE2 1 1 13 5219 1 1 4 PHE CG C -14.136 8.810 -6.378 1.00 . A A . 4 PHE CG 1 1 13 5220 1 1 4 PHE CZ C -13.379 9.276 -9.003 1.00 . A A . 4 PHE CZ 1 1 13 5221 1 1 4 PHE H H -15.087 6.768 -2.869 1.00 . A A . 4 PHE H 1 1 13 5222 1 1 4 PHE HA H -16.499 7.654 -5.337 1.00 . A A . 4 PHE HA 1 1 13 5223 1 1 4 PHE HB2 H -14.984 9.449 -4.515 1.00 . A A . 4 PHE HB2 1 1 13 5224 1 1 4 PHE HB3 H -13.669 8.297 -4.339 1.00 . A A . 4 PHE HB3 1 1 13 5225 1 1 4 PHE HD1 H -16.091 9.401 -7.013 1.00 . A A . 4 PHE HD1 1 1 13 5226 1 1 4 PHE HD2 H -12.095 8.274 -6.058 1.00 . A A . 4 PHE HD2 1 1 13 5227 1 1 4 PHE HE1 H -15.417 9.813 -9.335 1.00 . A A . 4 PHE HE1 1 1 13 5228 1 1 4 PHE HE2 H -11.423 8.687 -8.385 1.00 . A A . 4 PHE HE2 1 1 13 5229 1 1 4 PHE HZ H -13.085 9.456 -10.026 1.00 . A A . 4 PHE HZ 1 1 13 5230 1 1 4 PHE N N -15.828 7.081 -3.425 1.00 . A A . 4 PHE N 1 1 13 5231 1 1 4 PHE O O -13.851 5.927 -5.680 1.00 . A A . 4 PHE O 1 1 13 5232 1 1 5 ARG C C -15.720 2.948 -5.194 1.00 . A A . 5 ARG C 1 1 13 5233 1 1 5 ARG CA C -15.857 3.920 -6.355 1.00 . A A . 5 ARG CA 1 1 13 5234 1 1 5 ARG CB C -14.606 3.828 -7.277 1.00 . A A . 5 ARG CB 1 1 13 5235 1 1 5 ARG CD C -13.559 1.859 -8.497 1.00 . A A . 5 ARG CD 1 1 13 5236 1 1 5 ARG CG C -14.862 2.624 -8.203 1.00 . A A . 5 ARG CG 1 1 13 5237 1 1 5 ARG CZ C -12.908 -0.502 -8.520 1.00 . A A . 5 ARG CZ 1 1 13 5238 1 1 5 ARG H H -16.901 5.575 -5.516 1.00 . A A . 5 ARG H 1 1 13 5239 1 1 5 ARG HA H -16.749 3.679 -6.898 1.00 . A A . 5 ARG HA 1 1 13 5240 1 1 5 ARG HB2 H -14.513 4.728 -7.868 1.00 . A A . 5 ARG HB2 1 1 13 5241 1 1 5 ARG HB3 H -13.705 3.698 -6.699 1.00 . A A . 5 ARG HB3 1 1 13 5242 1 1 5 ARG HD2 H -13.289 1.974 -9.537 1.00 . A A . 5 ARG HD2 1 1 13 5243 1 1 5 ARG HD3 H -12.748 2.199 -7.874 1.00 . A A . 5 ARG HD3 1 1 13 5244 1 1 5 ARG HE H -14.622 0.142 -7.758 1.00 . A A . 5 ARG HE 1 1 13 5245 1 1 5 ARG HG2 H -15.574 1.957 -7.732 1.00 . A A . 5 ARG HG2 1 1 13 5246 1 1 5 ARG HG3 H -15.308 2.994 -9.113 1.00 . A A . 5 ARG HG3 1 1 13 5247 1 1 5 ARG HH11 H -11.602 0.788 -9.329 1.00 . A A . 5 ARG HH11 1 1 13 5248 1 1 5 ARG HH12 H -11.126 -0.876 -9.354 1.00 . A A . 5 ARG HH12 1 1 13 5249 1 1 5 ARG HH21 H -14.040 -1.973 -7.775 1.00 . A A . 5 ARG HH21 1 1 13 5250 1 1 5 ARG HH22 H -12.525 -2.465 -8.455 1.00 . A A . 5 ARG HH22 1 1 13 5251 1 1 5 ARG N N -16.001 5.275 -5.746 1.00 . A A . 5 ARG N 1 1 13 5252 1 1 5 ARG NE N -13.791 0.412 -8.203 1.00 . A A . 5 ARG NE 1 1 13 5253 1 1 5 ARG NH1 N -11.793 -0.170 -9.114 1.00 . A A . 5 ARG NH1 1 1 13 5254 1 1 5 ARG NH2 N -13.179 -1.744 -8.227 1.00 . A A . 5 ARG NH2 1 1 13 5255 1 1 5 ARG O O -14.774 2.197 -5.071 1.00 . A A . 5 ARG O 1 1 13 5256 1 1 6 HIS C C -15.566 2.451 -2.310 1.00 . A A . 6 HIS C 1 1 13 5257 1 1 6 HIS CA C -16.817 2.163 -3.151 1.00 . A A . 6 HIS CA 1 1 13 5258 1 1 6 HIS CB C -16.883 0.671 -3.589 1.00 . A A . 6 HIS CB 1 1 13 5259 1 1 6 HIS CD2 C -18.964 -0.014 -2.116 1.00 . A A . 6 HIS CD2 1 1 13 5260 1 1 6 HIS CE1 C -18.066 -1.499 -0.981 1.00 . A A . 6 HIS CE1 1 1 13 5261 1 1 6 HIS CG C -17.645 -0.113 -2.520 1.00 . A A . 6 HIS CG 1 1 13 5262 1 1 6 HIS H H -17.448 3.654 -4.565 1.00 . A A . 6 HIS H 1 1 13 5263 1 1 6 HIS HA H -17.692 2.453 -2.588 1.00 . A A . 6 HIS HA 1 1 13 5264 1 1 6 HIS HB2 H -17.415 0.578 -4.525 1.00 . A A . 6 HIS HB2 1 1 13 5265 1 1 6 HIS HB3 H -15.898 0.244 -3.704 1.00 . A A . 6 HIS HB3 1 1 13 5266 1 1 6 HIS HD1 H -16.224 -1.366 -1.814 1.00 . A A . 6 HIS HD1 1 1 13 5267 1 1 6 HIS HD2 H -19.682 0.678 -2.531 1.00 . A A . 6 HIS HD2 1 1 13 5268 1 1 6 HIS HE1 H -17.905 -2.286 -0.259 1.00 . A A . 6 HIS HE1 1 1 13 5269 1 1 6 HIS N N -16.732 3.018 -4.368 1.00 . A A . 6 HIS N 1 1 13 5270 1 1 6 HIS ND1 N -17.151 -1.048 -1.778 1.00 . A A . 6 HIS ND1 1 1 13 5271 1 1 6 HIS NE2 N -19.210 -0.885 -1.156 1.00 . A A . 6 HIS NE2 1 1 13 5272 1 1 6 HIS O O -14.900 1.553 -1.833 1.00 . A A . 6 HIS O 1 1 13 5273 1 1 7 ASP C C -12.844 4.082 -2.215 1.00 . A A . 7 ASP C 1 1 13 5274 1 1 7 ASP CA C -14.141 4.250 -1.401 1.00 . A A . 7 ASP CA 1 1 13 5275 1 1 7 ASP CB C -14.038 3.479 -0.033 1.00 . A A . 7 ASP CB 1 1 13 5276 1 1 7 ASP CG C -13.423 4.355 1.076 1.00 . A A . 7 ASP CG 1 1 13 5277 1 1 7 ASP H H -15.907 4.385 -2.609 1.00 . A A . 7 ASP H 1 1 13 5278 1 1 7 ASP HA H -14.293 5.301 -1.228 1.00 . A A . 7 ASP HA 1 1 13 5279 1 1 7 ASP HB2 H -15.027 3.170 0.276 1.00 . A A . 7 ASP HB2 1 1 13 5280 1 1 7 ASP HB3 H -13.427 2.595 -0.139 1.00 . A A . 7 ASP HB3 1 1 13 5281 1 1 7 ASP N N -15.310 3.734 -2.179 1.00 . A A . 7 ASP N 1 1 13 5282 1 1 7 ASP O O -11.805 3.760 -1.670 1.00 . A A . 7 ASP O 1 1 13 5283 1 1 7 ASP OD1 O -12.468 5.061 0.788 1.00 . A A . 7 ASP OD1 1 1 13 5284 1 1 7 ASP OD2 O -13.951 4.265 2.171 1.00 . A A . 7 ASP OD2 1 1 13 5285 1 1 8 SER C C -11.295 2.748 -4.490 1.00 . A A . 8 SER C 1 1 13 5286 1 1 8 SER CA C -11.791 4.186 -4.442 1.00 . A A . 8 SER CA 1 1 13 5287 1 1 8 SER CB C -10.652 5.148 -3.980 1.00 . A A . 8 SER CB 1 1 13 5288 1 1 8 SER H H -13.827 4.542 -3.889 1.00 . A A . 8 SER H 1 1 13 5289 1 1 8 SER HA H -12.113 4.456 -5.432 1.00 . A A . 8 SER HA 1 1 13 5290 1 1 8 SER HB2 H -10.321 4.975 -2.969 1.00 . A A . 8 SER HB2 1 1 13 5291 1 1 8 SER HB3 H -9.808 5.104 -4.653 1.00 . A A . 8 SER HB3 1 1 13 5292 1 1 8 SER HG H -10.767 6.946 -4.717 1.00 . A A . 8 SER HG 1 1 13 5293 1 1 8 SER N N -12.955 4.302 -3.507 1.00 . A A . 8 SER N 1 1 13 5294 1 1 8 SER O O -10.281 2.380 -3.927 1.00 . A A . 8 SER O 1 1 13 5295 1 1 8 SER OG O -11.254 6.433 -4.068 1.00 . A A . 8 SER OG 1 1 13 5296 1 1 9 GLY C C -10.622 0.358 -6.349 1.00 . A A . 9 GLY C 1 1 13 5297 1 1 9 GLY CA C -11.795 0.531 -5.384 1.00 . A A . 9 GLY CA 1 1 13 5298 1 1 9 GLY H H -12.874 2.384 -5.613 1.00 . A A . 9 GLY H 1 1 13 5299 1 1 9 GLY HA2 H -11.547 0.085 -4.431 1.00 . A A . 9 GLY HA2 1 1 13 5300 1 1 9 GLY HA3 H -12.669 0.048 -5.792 1.00 . A A . 9 GLY HA3 1 1 13 5301 1 1 9 GLY N N -12.081 1.982 -5.197 1.00 . A A . 9 GLY N 1 1 13 5302 1 1 9 GLY O O -10.028 -0.701 -6.417 1.00 . A A . 9 GLY O 1 1 13 5303 1 1 10 TYR C C -7.856 1.433 -7.332 1.00 . A A . 10 TYR C 1 1 13 5304 1 1 10 TYR CA C -9.208 1.379 -8.047 1.00 . A A . 10 TYR CA 1 1 13 5305 1 1 10 TYR CB C -9.362 2.565 -9.020 1.00 . A A . 10 TYR CB 1 1 13 5306 1 1 10 TYR CD1 C -10.666 4.429 -7.905 1.00 . A A . 10 TYR CD1 1 1 13 5307 1 1 10 TYR CD2 C -8.318 4.706 -8.135 1.00 . A A . 10 TYR CD2 1 1 13 5308 1 1 10 TYR CE1 C -10.757 5.663 -7.300 1.00 . A A . 10 TYR CE1 1 1 13 5309 1 1 10 TYR CE2 C -8.412 5.942 -7.528 1.00 . A A . 10 TYR CE2 1 1 13 5310 1 1 10 TYR CG C -9.448 3.938 -8.329 1.00 . A A . 10 TYR CG 1 1 13 5311 1 1 10 TYR CZ C -9.629 6.428 -7.107 1.00 . A A . 10 TYR CZ 1 1 13 5312 1 1 10 TYR H H -10.851 2.233 -6.969 1.00 . A A . 10 TYR H 1 1 13 5313 1 1 10 TYR HA H -9.273 0.457 -8.600 1.00 . A A . 10 TYR HA 1 1 13 5314 1 1 10 TYR HB2 H -8.525 2.571 -9.698 1.00 . A A . 10 TYR HB2 1 1 13 5315 1 1 10 TYR HB3 H -10.268 2.416 -9.587 1.00 . A A . 10 TYR HB3 1 1 13 5316 1 1 10 TYR HD1 H -11.556 3.841 -8.049 1.00 . A A . 10 TYR HD1 1 1 13 5317 1 1 10 TYR HD2 H -7.357 4.339 -8.459 1.00 . A A . 10 TYR HD2 1 1 13 5318 1 1 10 TYR HE1 H -11.717 6.033 -6.976 1.00 . A A . 10 TYR HE1 1 1 13 5319 1 1 10 TYR HE2 H -7.527 6.541 -7.380 1.00 . A A . 10 TYR HE2 1 1 13 5320 1 1 10 TYR HH H -9.588 7.537 -5.556 1.00 . A A . 10 TYR HH 1 1 13 5321 1 1 10 TYR N N -10.330 1.414 -7.070 1.00 . A A . 10 TYR N 1 1 13 5322 1 1 10 TYR O O -7.784 1.702 -6.148 1.00 . A A . 10 TYR O 1 1 13 5323 1 1 10 TYR OH O -9.713 7.663 -6.498 1.00 . A A . 10 TYR OH 1 1 13 5324 1 1 11 GLU C C -4.780 2.524 -7.255 1.00 . A A . 11 GLU C 1 1 13 5325 1 1 11 GLU CA C -5.432 1.179 -7.546 1.00 . A A . 11 GLU CA 1 1 13 5326 1 1 11 GLU CB C -4.563 0.339 -8.534 1.00 . A A . 11 GLU CB 1 1 13 5327 1 1 11 GLU CD C -3.393 1.403 -10.525 1.00 . A A . 11 GLU CD 1 1 13 5328 1 1 11 GLU CG C -4.724 0.836 -10.002 1.00 . A A . 11 GLU CG 1 1 13 5329 1 1 11 GLU H H -6.969 0.977 -9.041 1.00 . A A . 11 GLU H 1 1 13 5330 1 1 11 GLU HA H -5.467 0.711 -6.588 1.00 . A A . 11 GLU HA 1 1 13 5331 1 1 11 GLU HB2 H -3.529 0.368 -8.227 1.00 . A A . 11 GLU HB2 1 1 13 5332 1 1 11 GLU HB3 H -4.888 -0.689 -8.484 1.00 . A A . 11 GLU HB3 1 1 13 5333 1 1 11 GLU HG2 H -5.026 0.007 -10.626 1.00 . A A . 11 GLU HG2 1 1 13 5334 1 1 11 GLU HG3 H -5.477 1.605 -10.082 1.00 . A A . 11 GLU HG3 1 1 13 5335 1 1 11 GLU N N -6.824 1.176 -8.093 1.00 . A A . 11 GLU N 1 1 13 5336 1 1 11 GLU O O -3.569 2.617 -7.266 1.00 . A A . 11 GLU O 1 1 13 5337 1 1 11 GLU OE1 O -2.976 2.409 -9.977 1.00 . A A . 11 GLU OE1 1 1 13 5338 1 1 11 GLU OE2 O -2.864 0.799 -11.443 1.00 . A A . 11 GLU OE2 1 1 13 5339 1 1 12 VAL C C -4.702 5.655 -7.890 1.00 . A A . 12 VAL C 1 1 13 5340 1 1 12 VAL CA C -5.215 4.907 -6.668 1.00 . A A . 12 VAL CA 1 1 13 5341 1 1 12 VAL CB C -4.122 4.889 -5.554 1.00 . A A . 12 VAL CB 1 1 13 5342 1 1 12 VAL CG1 C -3.752 6.324 -5.131 1.00 . A A . 12 VAL CG1 1 1 13 5343 1 1 12 VAL CG2 C -4.690 4.187 -4.327 1.00 . A A . 12 VAL CG2 1 1 13 5344 1 1 12 VAL H H -6.568 3.288 -7.008 1.00 . A A . 12 VAL H 1 1 13 5345 1 1 12 VAL HA H -6.084 5.430 -6.306 1.00 . A A . 12 VAL HA 1 1 13 5346 1 1 12 VAL HB H -3.252 4.358 -5.904 1.00 . A A . 12 VAL HB 1 1 13 5347 1 1 12 VAL HG11 H -4.608 6.972 -5.229 1.00 . A A . 12 VAL HG11 1 1 13 5348 1 1 12 VAL HG12 H -3.430 6.351 -4.101 1.00 . A A . 12 VAL HG12 1 1 13 5349 1 1 12 VAL HG13 H -2.950 6.692 -5.748 1.00 . A A . 12 VAL HG13 1 1 13 5350 1 1 12 VAL HG21 H -5.583 4.700 -4.001 1.00 . A A . 12 VAL HG21 1 1 13 5351 1 1 12 VAL HG22 H -4.931 3.163 -4.567 1.00 . A A . 12 VAL HG22 1 1 13 5352 1 1 12 VAL HG23 H -3.958 4.205 -3.534 1.00 . A A . 12 VAL HG23 1 1 13 5353 1 1 12 VAL N N -5.617 3.499 -6.991 1.00 . A A . 12 VAL N 1 1 13 5354 1 1 12 VAL O O -5.260 6.674 -8.240 1.00 . A A . 12 VAL O 1 1 13 5355 1 1 13 HIS C C -1.800 6.570 -9.370 1.00 . A A . 13 HIS C 1 1 13 5356 1 1 13 HIS CA C -2.967 5.619 -9.694 1.00 . A A . 13 HIS CA 1 1 13 5357 1 1 13 HIS CB C -3.966 6.369 -10.638 1.00 . A A . 13 HIS CB 1 1 13 5358 1 1 13 HIS CD2 C -5.634 4.279 -10.486 1.00 . A A . 13 HIS CD2 1 1 13 5359 1 1 13 HIS CE1 C -6.915 4.826 -12.015 1.00 . A A . 13 HIS CE1 1 1 13 5360 1 1 13 HIS CG C -5.172 5.481 -11.005 1.00 . A A . 13 HIS CG 1 1 13 5361 1 1 13 HIS H H -3.355 4.262 -8.071 1.00 . A A . 13 HIS H 1 1 13 5362 1 1 13 HIS HA H -2.555 4.781 -10.232 1.00 . A A . 13 HIS HA 1 1 13 5363 1 1 13 HIS HB2 H -4.323 7.286 -10.193 1.00 . A A . 13 HIS HB2 1 1 13 5364 1 1 13 HIS HB3 H -3.456 6.622 -11.553 1.00 . A A . 13 HIS HB3 1 1 13 5365 1 1 13 HIS HD1 H -5.978 6.548 -12.520 1.00 . A A . 13 HIS HD1 1 1 13 5366 1 1 13 HIS HD2 H -5.177 3.737 -9.670 1.00 . A A . 13 HIS HD2 1 1 13 5367 1 1 13 HIS HE1 H -7.731 4.826 -12.724 1.00 . A A . 13 HIS HE1 1 1 13 5368 1 1 13 HIS N N -3.673 5.095 -8.473 1.00 . A A . 13 HIS N 1 1 13 5369 1 1 13 HIS ND1 N -6.015 5.754 -11.946 1.00 . A A . 13 HIS ND1 1 1 13 5370 1 1 13 HIS NE2 N -6.717 3.888 -11.126 1.00 . A A . 13 HIS NE2 1 1 13 5371 1 1 13 HIS O O -1.099 6.970 -10.279 1.00 . A A . 13 HIS O 1 1 13 5372 1 1 14 HIS C C 0.354 7.129 -6.671 1.00 . A A . 14 HIS C 1 1 13 5373 1 1 14 HIS CA C -0.491 7.824 -7.728 1.00 . A A . 14 HIS CA 1 1 13 5374 1 1 14 HIS CB C -0.966 9.205 -7.119 1.00 . A A . 14 HIS CB 1 1 13 5375 1 1 14 HIS CD2 C -3.545 8.716 -7.209 1.00 . A A . 14 HIS CD2 1 1 13 5376 1 1 14 HIS CE1 C -4.130 9.740 -5.512 1.00 . A A . 14 HIS CE1 1 1 13 5377 1 1 14 HIS CG C -2.418 9.263 -6.655 1.00 . A A . 14 HIS CG 1 1 13 5378 1 1 14 HIS H H -2.197 6.564 -7.418 1.00 . A A . 14 HIS H 1 1 13 5379 1 1 14 HIS HA H 0.087 8.014 -8.598 1.00 . A A . 14 HIS HA 1 1 13 5380 1 1 14 HIS HB2 H -0.337 9.483 -6.284 1.00 . A A . 14 HIS HB2 1 1 13 5381 1 1 14 HIS HB3 H -0.842 9.964 -7.877 1.00 . A A . 14 HIS HB3 1 1 13 5382 1 1 14 HIS HD1 H -2.285 10.384 -4.979 1.00 . A A . 14 HIS HD1 1 1 13 5383 1 1 14 HIS HD2 H -3.525 8.118 -8.102 1.00 . A A . 14 HIS HD2 1 1 13 5384 1 1 14 HIS HE1 H -4.731 10.164 -4.722 1.00 . A A . 14 HIS HE1 1 1 13 5385 1 1 14 HIS N N -1.609 6.910 -8.113 1.00 . A A . 14 HIS N 1 1 13 5386 1 1 14 HIS ND1 N -2.847 9.883 -5.606 1.00 . A A . 14 HIS ND1 1 1 13 5387 1 1 14 HIS NE2 N -4.610 9.017 -6.494 1.00 . A A . 14 HIS NE2 1 1 13 5388 1 1 14 HIS O O 1.501 6.802 -6.906 1.00 . A A . 14 HIS O 1 1 13 5389 1 1 15 GLN C C 1.034 4.898 -4.852 1.00 . A A . 15 GLN C 1 1 13 5390 1 1 15 GLN CA C 0.468 6.239 -4.400 1.00 . A A . 15 GLN CA 1 1 13 5391 1 1 15 GLN CB C -0.507 6.009 -3.229 1.00 . A A . 15 GLN CB 1 1 13 5392 1 1 15 GLN CD C -1.296 8.394 -3.061 1.00 . A A . 15 GLN CD 1 1 13 5393 1 1 15 GLN CG C -0.561 7.260 -2.335 1.00 . A A . 15 GLN CG 1 1 13 5394 1 1 15 GLN H H -1.173 7.213 -5.427 1.00 . A A . 15 GLN H 1 1 13 5395 1 1 15 GLN HA H 1.297 6.864 -4.111 1.00 . A A . 15 GLN HA 1 1 13 5396 1 1 15 GLN HB2 H -1.489 5.771 -3.606 1.00 . A A . 15 GLN HB2 1 1 13 5397 1 1 15 GLN HB3 H -0.169 5.176 -2.630 1.00 . A A . 15 GLN HB3 1 1 13 5398 1 1 15 GLN HE21 H -3.082 7.847 -2.387 1.00 . A A . 15 GLN HE21 1 1 13 5399 1 1 15 GLN HE22 H -3.073 9.212 -3.395 1.00 . A A . 15 GLN HE22 1 1 13 5400 1 1 15 GLN HG2 H -1.087 7.026 -1.420 1.00 . A A . 15 GLN HG2 1 1 13 5401 1 1 15 GLN HG3 H 0.440 7.584 -2.086 1.00 . A A . 15 GLN HG3 1 1 13 5402 1 1 15 GLN N N -0.246 6.918 -5.529 1.00 . A A . 15 GLN N 1 1 13 5403 1 1 15 GLN NE2 N -2.591 8.492 -2.937 1.00 . A A . 15 GLN NE2 1 1 13 5404 1 1 15 GLN O O 2.019 4.420 -4.327 1.00 . A A . 15 GLN O 1 1 13 5405 1 1 15 GLN OE1 O -0.699 9.200 -3.746 1.00 . A A . 15 GLN OE1 1 1 13 5406 1 1 16 GLU C C 2.263 3.188 -6.949 1.00 . A A . 16 GLU C 1 1 13 5407 1 1 16 GLU CA C 0.878 3.013 -6.336 1.00 . A A . 16 GLU CA 1 1 13 5408 1 1 16 GLU CB C -0.105 2.478 -7.397 1.00 . A A . 16 GLU CB 1 1 13 5409 1 1 16 GLU CD C -0.360 0.862 -9.313 1.00 . A A . 16 GLU CD 1 1 13 5410 1 1 16 GLU CG C 0.547 1.299 -8.158 1.00 . A A . 16 GLU CG 1 1 13 5411 1 1 16 GLU H H -0.397 4.746 -6.224 1.00 . A A . 16 GLU H 1 1 13 5412 1 1 16 GLU HA H 0.968 2.348 -5.502 1.00 . A A . 16 GLU HA 1 1 13 5413 1 1 16 GLU HB2 H -1.009 2.140 -6.912 1.00 . A A . 16 GLU HB2 1 1 13 5414 1 1 16 GLU HB3 H -0.362 3.266 -8.092 1.00 . A A . 16 GLU HB3 1 1 13 5415 1 1 16 GLU HG2 H 1.507 1.588 -8.563 1.00 . A A . 16 GLU HG2 1 1 13 5416 1 1 16 GLU HG3 H 0.707 0.473 -7.480 1.00 . A A . 16 GLU HG3 1 1 13 5417 1 1 16 GLU N N 0.393 4.320 -5.830 1.00 . A A . 16 GLU N 1 1 13 5418 1 1 16 GLU O O 3.160 2.408 -6.702 1.00 . A A . 16 GLU O 1 1 13 5419 1 1 16 GLU OE1 O -0.212 1.460 -10.368 1.00 . A A . 16 GLU OE1 1 1 13 5420 1 1 16 GLU OE2 O -1.148 -0.040 -9.079 1.00 . A A . 16 GLU OE2 1 1 13 5421 1 1 17 LEU C C 4.751 4.934 -7.401 1.00 . A A . 17 LEU C 1 1 13 5422 1 1 17 LEU CA C 3.700 4.481 -8.391 1.00 . A A . 17 LEU CA 1 1 13 5423 1 1 17 LEU CB C 3.553 5.570 -9.497 1.00 . A A . 17 LEU CB 1 1 13 5424 1 1 17 LEU CD1 C 2.020 6.808 -11.061 1.00 . A A . 17 LEU CD1 1 1 13 5425 1 1 17 LEU CD2 C 1.719 4.323 -10.751 1.00 . A A . 17 LEU CD2 1 1 13 5426 1 1 17 LEU CG C 2.109 5.648 -10.048 1.00 . A A . 17 LEU CG 1 1 13 5427 1 1 17 LEU H H 1.628 4.820 -7.862 1.00 . A A . 17 LEU H 1 1 13 5428 1 1 17 LEU HA H 4.015 3.540 -8.779 1.00 . A A . 17 LEU HA 1 1 13 5429 1 1 17 LEU HB2 H 3.820 6.537 -9.094 1.00 . A A . 17 LEU HB2 1 1 13 5430 1 1 17 LEU HB3 H 4.237 5.344 -10.304 1.00 . A A . 17 LEU HB3 1 1 13 5431 1 1 17 LEU HD11 H 2.829 6.750 -11.774 1.00 . A A . 17 LEU HD11 1 1 13 5432 1 1 17 LEU HD12 H 1.083 6.768 -11.598 1.00 . A A . 17 LEU HD12 1 1 13 5433 1 1 17 LEU HD13 H 2.080 7.753 -10.543 1.00 . A A . 17 LEU HD13 1 1 13 5434 1 1 17 LEU HD21 H 1.770 3.494 -10.061 1.00 . A A . 17 LEU HD21 1 1 13 5435 1 1 17 LEU HD22 H 0.709 4.388 -11.129 1.00 . A A . 17 LEU HD22 1 1 13 5436 1 1 17 LEU HD23 H 2.385 4.124 -11.578 1.00 . A A . 17 LEU HD23 1 1 13 5437 1 1 17 LEU HG H 1.450 5.842 -9.219 1.00 . A A . 17 LEU HG 1 1 13 5438 1 1 17 LEU N N 2.390 4.222 -7.729 1.00 . A A . 17 LEU N 1 1 13 5439 1 1 17 LEU O O 5.936 4.837 -7.645 1.00 . A A . 17 LEU O 1 1 13 5440 1 1 18 VAL C C 5.726 4.746 -4.475 1.00 . A A . 18 VAL C 1 1 13 5441 1 1 18 VAL CA C 5.125 5.913 -5.211 1.00 . A A . 18 VAL CA 1 1 13 5442 1 1 18 VAL CB C 4.261 6.751 -4.291 1.00 . A A . 18 VAL CB 1 1 13 5443 1 1 18 VAL CG1 C 5.004 7.122 -2.996 1.00 . A A . 18 VAL CG1 1 1 13 5444 1 1 18 VAL CG2 C 3.869 7.975 -5.088 1.00 . A A . 18 VAL CG2 1 1 13 5445 1 1 18 VAL H H 3.281 5.463 -6.212 1.00 . A A . 18 VAL H 1 1 13 5446 1 1 18 VAL HA H 5.922 6.503 -5.634 1.00 . A A . 18 VAL HA 1 1 13 5447 1 1 18 VAL HB H 3.374 6.209 -4.019 1.00 . A A . 18 VAL HB 1 1 13 5448 1 1 18 VAL HG11 H 6.002 7.466 -3.216 1.00 . A A . 18 VAL HG11 1 1 13 5449 1 1 18 VAL HG12 H 4.463 7.889 -2.464 1.00 . A A . 18 VAL HG12 1 1 13 5450 1 1 18 VAL HG13 H 5.064 6.247 -2.363 1.00 . A A . 18 VAL HG13 1 1 13 5451 1 1 18 VAL HG21 H 3.551 7.667 -6.074 1.00 . A A . 18 VAL HG21 1 1 13 5452 1 1 18 VAL HG22 H 3.056 8.478 -4.596 1.00 . A A . 18 VAL HG22 1 1 13 5453 1 1 18 VAL HG23 H 4.726 8.621 -5.191 1.00 . A A . 18 VAL HG23 1 1 13 5454 1 1 18 VAL N N 4.254 5.419 -6.305 1.00 . A A . 18 VAL N 1 1 13 5455 1 1 18 VAL O O 6.907 4.714 -4.207 1.00 . A A . 18 VAL O 1 1 13 5456 1 1 19 PHE C C 6.096 1.711 -4.416 1.00 . A A . 19 PHE C 1 1 13 5457 1 1 19 PHE CA C 5.342 2.612 -3.456 1.00 . A A . 19 PHE CA 1 1 13 5458 1 1 19 PHE CB C 4.082 1.963 -2.809 1.00 . A A . 19 PHE CB 1 1 13 5459 1 1 19 PHE CD1 C 3.345 0.382 -4.734 1.00 . A A . 19 PHE CD1 1 1 13 5460 1 1 19 PHE CD2 C 1.721 1.344 -3.280 1.00 . A A . 19 PHE CD2 1 1 13 5461 1 1 19 PHE CE1 C 2.341 -0.295 -5.397 1.00 . A A . 19 PHE CE1 1 1 13 5462 1 1 19 PHE CE2 C 0.716 0.667 -3.941 1.00 . A A . 19 PHE CE2 1 1 13 5463 1 1 19 PHE CG C 3.042 1.207 -3.662 1.00 . A A . 19 PHE CG 1 1 13 5464 1 1 19 PHE CZ C 1.027 -0.155 -5.001 1.00 . A A . 19 PHE CZ 1 1 13 5465 1 1 19 PHE H H 3.952 3.892 -4.460 1.00 . A A . 19 PHE H 1 1 13 5466 1 1 19 PHE HA H 6.002 2.940 -2.677 1.00 . A A . 19 PHE HA 1 1 13 5467 1 1 19 PHE HB2 H 4.422 1.271 -2.054 1.00 . A A . 19 PHE HB2 1 1 13 5468 1 1 19 PHE HB3 H 3.557 2.758 -2.299 1.00 . A A . 19 PHE HB3 1 1 13 5469 1 1 19 PHE HD1 H 4.359 0.266 -5.074 1.00 . A A . 19 PHE HD1 1 1 13 5470 1 1 19 PHE HD2 H 1.476 2.011 -2.464 1.00 . A A . 19 PHE HD2 1 1 13 5471 1 1 19 PHE HE1 H 2.585 -0.937 -6.230 1.00 . A A . 19 PHE HE1 1 1 13 5472 1 1 19 PHE HE2 H -0.312 0.782 -3.627 1.00 . A A . 19 PHE HE2 1 1 13 5473 1 1 19 PHE HZ H 0.245 -0.688 -5.520 1.00 . A A . 19 PHE HZ 1 1 13 5474 1 1 19 PHE N N 4.878 3.805 -4.184 1.00 . A A . 19 PHE N 1 1 13 5475 1 1 19 PHE O O 6.863 0.860 -4.009 1.00 . A A . 19 PHE O 1 1 13 5476 1 1 20 PHE C C 7.894 1.794 -6.888 1.00 . A A . 20 PHE C 1 1 13 5477 1 1 20 PHE CA C 6.510 1.159 -6.745 1.00 . A A . 20 PHE CA 1 1 13 5478 1 1 20 PHE CB C 5.720 1.291 -8.044 1.00 . A A . 20 PHE CB 1 1 13 5479 1 1 20 PHE CD1 C 6.243 -0.872 -9.258 1.00 . A A . 20 PHE CD1 1 1 13 5480 1 1 20 PHE CD2 C 7.325 1.121 -10.000 1.00 . A A . 20 PHE CD2 1 1 13 5481 1 1 20 PHE CE1 C 6.906 -1.593 -10.230 1.00 . A A . 20 PHE CE1 1 1 13 5482 1 1 20 PHE CE2 C 7.987 0.400 -10.971 1.00 . A A . 20 PHE CE2 1 1 13 5483 1 1 20 PHE CG C 6.449 0.490 -9.136 1.00 . A A . 20 PHE CG 1 1 13 5484 1 1 20 PHE CZ C 7.778 -0.958 -11.087 1.00 . A A . 20 PHE CZ 1 1 13 5485 1 1 20 PHE H H 5.206 2.656 -5.920 1.00 . A A . 20 PHE H 1 1 13 5486 1 1 20 PHE HA H 6.602 0.127 -6.440 1.00 . A A . 20 PHE HA 1 1 13 5487 1 1 20 PHE HB2 H 4.721 0.901 -7.914 1.00 . A A . 20 PHE HB2 1 1 13 5488 1 1 20 PHE HB3 H 5.662 2.329 -8.335 1.00 . A A . 20 PHE HB3 1 1 13 5489 1 1 20 PHE HD1 H 5.561 -1.375 -8.590 1.00 . A A . 20 PHE HD1 1 1 13 5490 1 1 20 PHE HD2 H 7.494 2.185 -9.916 1.00 . A A . 20 PHE HD2 1 1 13 5491 1 1 20 PHE HE1 H 6.740 -2.656 -10.319 1.00 . A A . 20 PHE HE1 1 1 13 5492 1 1 20 PHE HE2 H 8.670 0.899 -11.643 1.00 . A A . 20 PHE HE2 1 1 13 5493 1 1 20 PHE HZ H 8.296 -1.522 -11.848 1.00 . A A . 20 PHE HZ 1 1 13 5494 1 1 20 PHE N N 5.844 1.949 -5.678 1.00 . A A . 20 PHE N 1 1 13 5495 1 1 20 PHE O O 8.885 1.117 -7.055 1.00 . A A . 20 PHE O 1 1 13 5496 1 1 21 ALA C C 10.034 3.418 -5.723 1.00 . A A . 21 ALA C 1 1 13 5497 1 1 21 ALA CA C 9.198 3.848 -6.920 1.00 . A A . 21 ALA CA 1 1 13 5498 1 1 21 ALA CB C 8.896 5.353 -6.887 1.00 . A A . 21 ALA CB 1 1 13 5499 1 1 21 ALA H H 7.092 3.594 -6.652 1.00 . A A . 21 ALA H 1 1 13 5500 1 1 21 ALA HA H 9.695 3.550 -7.828 1.00 . A A . 21 ALA HA 1 1 13 5501 1 1 21 ALA HB1 H 8.216 5.583 -6.081 1.00 . A A . 21 ALA HB1 1 1 13 5502 1 1 21 ALA HB2 H 9.805 5.915 -6.745 1.00 . A A . 21 ALA HB2 1 1 13 5503 1 1 21 ALA HB3 H 8.442 5.654 -7.819 1.00 . A A . 21 ALA HB3 1 1 13 5504 1 1 21 ALA N N 7.919 3.100 -6.802 1.00 . A A . 21 ALA N 1 1 13 5505 1 1 21 ALA O O 11.219 3.170 -5.839 1.00 . A A . 21 ALA O 1 1 13 5506 1 1 22 GLU C C 10.599 1.510 -3.511 1.00 . A A . 22 GLU C 1 1 13 5507 1 1 22 GLU CA C 10.034 2.931 -3.344 1.00 . A A . 22 GLU CA 1 1 13 5508 1 1 22 GLU CB C 9.022 2.954 -2.176 1.00 . A A . 22 GLU CB 1 1 13 5509 1 1 22 GLU CD C 7.910 5.155 -1.548 1.00 . A A . 22 GLU CD 1 1 13 5510 1 1 22 GLU CG C 9.148 4.262 -1.343 1.00 . A A . 22 GLU CG 1 1 13 5511 1 1 22 GLU H H 8.395 3.579 -4.603 1.00 . A A . 22 GLU H 1 1 13 5512 1 1 22 GLU HA H 10.850 3.608 -3.178 1.00 . A A . 22 GLU HA 1 1 13 5513 1 1 22 GLU HB2 H 8.027 2.850 -2.576 1.00 . A A . 22 GLU HB2 1 1 13 5514 1 1 22 GLU HB3 H 9.201 2.115 -1.520 1.00 . A A . 22 GLU HB3 1 1 13 5515 1 1 22 GLU HG2 H 9.214 4.010 -0.295 1.00 . A A . 22 GLU HG2 1 1 13 5516 1 1 22 GLU HG3 H 10.038 4.813 -1.608 1.00 . A A . 22 GLU HG3 1 1 13 5517 1 1 22 GLU N N 9.353 3.348 -4.604 1.00 . A A . 22 GLU N 1 1 13 5518 1 1 22 GLU O O 11.652 1.194 -2.991 1.00 . A A . 22 GLU O 1 1 13 5519 1 1 22 GLU OE1 O 6.854 4.739 -1.099 1.00 . A A . 22 GLU OE1 1 1 13 5520 1 1 22 GLU OE2 O 8.079 6.207 -2.141 1.00 . A A . 22 GLU OE2 1 1 13 5521 1 1 23 ASP C C 11.551 -0.725 -5.370 1.00 . A A . 23 ASP C 1 1 13 5522 1 1 23 ASP CA C 10.283 -0.711 -4.500 1.00 . A A . 23 ASP CA 1 1 13 5523 1 1 23 ASP CB C 9.070 -1.446 -5.188 1.00 . A A . 23 ASP CB 1 1 13 5524 1 1 23 ASP CG C 9.406 -2.084 -6.556 1.00 . A A . 23 ASP CG 1 1 13 5525 1 1 23 ASP H H 9.035 1.045 -4.626 1.00 . A A . 23 ASP H 1 1 13 5526 1 1 23 ASP HA H 10.503 -1.184 -3.553 1.00 . A A . 23 ASP HA 1 1 13 5527 1 1 23 ASP HB2 H 8.727 -2.232 -4.530 1.00 . A A . 23 ASP HB2 1 1 13 5528 1 1 23 ASP HB3 H 8.253 -0.755 -5.319 1.00 . A A . 23 ASP HB3 1 1 13 5529 1 1 23 ASP N N 9.868 0.704 -4.244 1.00 . A A . 23 ASP N 1 1 13 5530 1 1 23 ASP O O 12.521 -1.370 -5.021 1.00 . A A . 23 ASP O 1 1 13 5531 1 1 23 ASP OD1 O 10.139 -3.060 -6.538 1.00 . A A . 23 ASP OD1 1 1 13 5532 1 1 23 ASP OD2 O 8.913 -1.562 -7.544 1.00 . A A . 23 ASP OD2 1 1 13 5533 1 1 24 VAL C C 13.930 0.457 -6.638 1.00 . A A . 24 VAL C 1 1 13 5534 1 1 24 VAL CA C 12.659 0.065 -7.412 1.00 . A A . 24 VAL CA 1 1 13 5535 1 1 24 VAL CB C 12.359 1.125 -8.513 1.00 . A A . 24 VAL CB 1 1 13 5536 1 1 24 VAL CG1 C 13.496 1.112 -9.561 1.00 . A A . 24 VAL CG1 1 1 13 5537 1 1 24 VAL CG2 C 11.013 0.812 -9.223 1.00 . A A . 24 VAL CG2 1 1 13 5538 1 1 24 VAL H H 10.672 0.465 -6.682 1.00 . A A . 24 VAL H 1 1 13 5539 1 1 24 VAL HA H 12.807 -0.908 -7.859 1.00 . A A . 24 VAL HA 1 1 13 5540 1 1 24 VAL HB H 12.304 2.106 -8.064 1.00 . A A . 24 VAL HB 1 1 13 5541 1 1 24 VAL HG11 H 13.592 0.129 -10.000 1.00 . A A . 24 VAL HG11 1 1 13 5542 1 1 24 VAL HG12 H 13.285 1.824 -10.345 1.00 . A A . 24 VAL HG12 1 1 13 5543 1 1 24 VAL HG13 H 14.436 1.378 -9.099 1.00 . A A . 24 VAL HG13 1 1 13 5544 1 1 24 VAL HG21 H 10.606 -0.131 -8.889 1.00 . A A . 24 VAL HG21 1 1 13 5545 1 1 24 VAL HG22 H 10.299 1.592 -9.006 1.00 . A A . 24 VAL HG22 1 1 13 5546 1 1 24 VAL HG23 H 11.139 0.762 -10.295 1.00 . A A . 24 VAL HG23 1 1 13 5547 1 1 24 VAL N N 11.497 -0.015 -6.471 1.00 . A A . 24 VAL N 1 1 13 5548 1 1 24 VAL O O 14.953 -0.186 -6.767 1.00 . A A . 24 VAL O 1 1 13 5549 1 1 25 GLY C C 15.891 2.854 -5.920 1.00 . A A . 25 GLY C 1 1 13 5550 1 1 25 GLY CA C 14.976 1.988 -5.052 1.00 . A A . 25 GLY CA 1 1 13 5551 1 1 25 GLY H H 12.961 1.983 -5.811 1.00 . A A . 25 GLY H 1 1 13 5552 1 1 25 GLY HA2 H 14.605 2.577 -4.228 1.00 . A A . 25 GLY HA2 1 1 13 5553 1 1 25 GLY HA3 H 15.531 1.144 -4.669 1.00 . A A . 25 GLY HA3 1 1 13 5554 1 1 25 GLY N N 13.815 1.505 -5.861 1.00 . A A . 25 GLY N 1 1 13 5555 1 1 25 GLY O O 17.100 2.766 -5.839 1.00 . A A . 25 GLY O 1 1 13 5556 1 1 26 SER C C 15.395 6.006 -7.507 1.00 . A A . 26 SER C 1 1 13 5557 1 1 26 SER CA C 15.978 4.598 -7.650 1.00 . A A . 26 SER CA 1 1 13 5558 1 1 26 SER CB C 15.802 4.097 -9.096 1.00 . A A . 26 SER CB 1 1 13 5559 1 1 26 SER H H 14.276 3.663 -6.708 1.00 . A A . 26 SER H 1 1 13 5560 1 1 26 SER HA H 17.026 4.630 -7.391 1.00 . A A . 26 SER HA 1 1 13 5561 1 1 26 SER HB2 H 16.216 4.792 -9.812 1.00 . A A . 26 SER HB2 1 1 13 5562 1 1 26 SER HB3 H 16.243 3.120 -9.230 1.00 . A A . 26 SER HB3 1 1 13 5563 1 1 26 SER HG H 14.142 4.624 -9.972 1.00 . A A . 26 SER HG 1 1 13 5564 1 1 26 SER N N 15.256 3.669 -6.722 1.00 . A A . 26 SER N 1 1 13 5565 1 1 26 SER O O 16.091 6.997 -7.611 1.00 . A A . 26 SER O 1 1 13 5566 1 1 26 SER OG O 14.395 4.009 -9.277 1.00 . A A . 26 SER OG 1 1 13 5567 1 1 27 ASN C C 12.822 7.333 -5.638 1.00 . A A . 27 ASN C 1 1 13 5568 1 1 27 ASN CA C 13.321 7.270 -7.089 1.00 . A A . 27 ASN CA 1 1 13 5569 1 1 27 ASN CB C 12.105 7.280 -8.072 1.00 . A A . 27 ASN CB 1 1 13 5570 1 1 27 ASN CG C 11.949 5.942 -8.817 1.00 . A A . 27 ASN CG 1 1 13 5571 1 1 27 ASN H H 13.647 5.152 -7.198 1.00 . A A . 27 ASN H 1 1 13 5572 1 1 27 ASN HA H 13.954 8.126 -7.274 1.00 . A A . 27 ASN HA 1 1 13 5573 1 1 27 ASN HB2 H 11.186 7.486 -7.544 1.00 . A A . 27 ASN HB2 1 1 13 5574 1 1 27 ASN HB3 H 12.252 8.061 -8.805 1.00 . A A . 27 ASN HB3 1 1 13 5575 1 1 27 ASN HD21 H 11.736 4.889 -7.151 1.00 . A A . 27 ASN HD21 1 1 13 5576 1 1 27 ASN HD22 H 11.669 3.990 -8.589 1.00 . A A . 27 ASN HD22 1 1 13 5577 1 1 27 ASN N N 14.111 6.012 -7.267 1.00 . A A . 27 ASN N 1 1 13 5578 1 1 27 ASN ND2 N 11.770 4.849 -8.129 1.00 . A A . 27 ASN ND2 1 1 13 5579 1 1 27 ASN O O 12.436 8.385 -5.165 1.00 . A A . 27 ASN O 1 1 13 5580 1 1 27 ASN OD1 O 11.991 5.880 -10.030 1.00 . A A . 27 ASN OD1 1 1 13 5581 1 1 28 LYS C C 10.946 6.591 -3.396 1.00 . A A . 28 LYS C 1 1 13 5582 1 1 28 LYS CA C 12.400 6.080 -3.561 1.00 . A A . 28 LYS CA 1 1 13 5583 1 1 28 LYS CB C 13.413 6.891 -2.664 1.00 . A A . 28 LYS CB 1 1 13 5584 1 1 28 LYS CD C 15.242 5.117 -2.674 1.00 . A A . 28 LYS CD 1 1 13 5585 1 1 28 LYS CE C 16.636 4.773 -3.230 1.00 . A A . 28 LYS CE 1 1 13 5586 1 1 28 LYS CG C 14.887 6.578 -3.036 1.00 . A A . 28 LYS CG 1 1 13 5587 1 1 28 LYS H H 13.172 5.392 -5.443 1.00 . A A . 28 LYS H 1 1 13 5588 1 1 28 LYS HA H 12.427 5.038 -3.281 1.00 . A A . 28 LYS HA 1 1 13 5589 1 1 28 LYS HB2 H 13.244 7.951 -2.786 1.00 . A A . 28 LYS HB2 1 1 13 5590 1 1 28 LYS HB3 H 13.245 6.642 -1.627 1.00 . A A . 28 LYS HB3 1 1 13 5591 1 1 28 LYS HD2 H 15.237 4.994 -1.601 1.00 . A A . 28 LYS HD2 1 1 13 5592 1 1 28 LYS HD3 H 14.516 4.442 -3.100 1.00 . A A . 28 LYS HD3 1 1 13 5593 1 1 28 LYS HE2 H 16.827 3.717 -3.117 1.00 . A A . 28 LYS HE2 1 1 13 5594 1 1 28 LYS HE3 H 16.702 5.029 -4.277 1.00 . A A . 28 LYS HE3 1 1 13 5595 1 1 28 LYS HG2 H 15.055 6.752 -4.089 1.00 . A A . 28 LYS HG2 1 1 13 5596 1 1 28 LYS HG3 H 15.532 7.246 -2.482 1.00 . A A . 28 LYS HG3 1 1 13 5597 1 1 28 LYS HZ1 H 17.244 6.120 -1.759 1.00 . A A . 28 LYS HZ1 1 1 13 5598 1 1 28 LYS HZ2 H 18.343 4.855 -2.040 1.00 . A A . 28 LYS HZ2 1 1 13 5599 1 1 28 LYS HZ3 H 18.213 6.131 -3.154 1.00 . A A . 28 LYS HZ3 1 1 13 5600 1 1 28 LYS N N 12.850 6.195 -4.985 1.00 . A A . 28 LYS N 1 1 13 5601 1 1 28 LYS NZ N 17.687 5.527 -2.489 1.00 . A A . 28 LYS NZ 1 1 13 5602 1 1 28 LYS O O 10.142 6.104 -4.172 1.00 . A A . 28 LYS O 1 1 13 5603 1 1 28 LYS OXT O 10.697 7.418 -2.533 1.00 . A A . 28 LYS OXT 1 1 14 5604 1 1 1 ASP C C -0.088 -6.947 8.010 1.00 . A A . 1 ASP C 1 1 14 5605 1 1 1 ASP CA C -0.035 -8.474 8.142 1.00 . A A . 1 ASP CA 1 1 14 5606 1 1 1 ASP CB C -1.029 -9.102 7.127 1.00 . A A . 1 ASP CB 1 1 14 5607 1 1 1 ASP CG C -0.309 -9.449 5.809 1.00 . A A . 1 ASP CG 1 1 14 5608 1 1 1 ASP H1 H -0.590 -8.028 10.101 1.00 . A A . 1 ASP H1 1 1 14 5609 1 1 1 ASP H2 H -1.233 -9.486 9.518 1.00 . A A . 1 ASP H2 1 1 14 5610 1 1 1 ASP H3 H 0.404 -9.397 9.957 1.00 . A A . 1 ASP H3 1 1 14 5611 1 1 1 ASP HA H 0.975 -8.806 7.944 1.00 . A A . 1 ASP HA 1 1 14 5612 1 1 1 ASP HB2 H -1.456 -10.003 7.546 1.00 . A A . 1 ASP HB2 1 1 14 5613 1 1 1 ASP HB3 H -1.837 -8.419 6.908 1.00 . A A . 1 ASP HB3 1 1 14 5614 1 1 1 ASP N N -0.391 -8.877 9.534 1.00 . A A . 1 ASP N 1 1 14 5615 1 1 1 ASP O O -0.786 -6.282 8.752 1.00 . A A . 1 ASP O 1 1 14 5616 1 1 1 ASP OD1 O 0.251 -8.535 5.226 1.00 . A A . 1 ASP OD1 1 1 14 5617 1 1 1 ASP OD2 O -0.358 -10.614 5.452 1.00 . A A . 1 ASP OD2 1 1 14 5618 1 1 2 ALA C C -0.668 -4.453 6.322 1.00 . A A . 2 ALA C 1 1 14 5619 1 1 2 ALA CA C 0.699 -4.965 6.812 1.00 . A A . 2 ALA CA 1 1 14 5620 1 1 2 ALA CB C 1.775 -4.675 5.757 1.00 . A A . 2 ALA CB 1 1 14 5621 1 1 2 ALA H H 1.193 -7.039 6.499 1.00 . A A . 2 ALA H 1 1 14 5622 1 1 2 ALA HA H 0.948 -4.465 7.736 1.00 . A A . 2 ALA HA 1 1 14 5623 1 1 2 ALA HB1 H 1.612 -5.271 4.873 1.00 . A A . 2 ALA HB1 1 1 14 5624 1 1 2 ALA HB2 H 1.757 -3.630 5.483 1.00 . A A . 2 ALA HB2 1 1 14 5625 1 1 2 ALA HB3 H 2.751 -4.910 6.157 1.00 . A A . 2 ALA HB3 1 1 14 5626 1 1 2 ALA N N 0.656 -6.441 7.058 1.00 . A A . 2 ALA N 1 1 14 5627 1 1 2 ALA O O -0.928 -3.265 6.355 1.00 . A A . 2 ALA O 1 1 14 5628 1 1 3 GLU C C -2.840 -4.021 4.249 1.00 . A A . 3 GLU C 1 1 14 5629 1 1 3 GLU CA C -2.868 -5.056 5.367 1.00 . A A . 3 GLU CA 1 1 14 5630 1 1 3 GLU CB C -3.714 -4.560 6.551 1.00 . A A . 3 GLU CB 1 1 14 5631 1 1 3 GLU CD C -5.163 -6.094 7.923 1.00 . A A . 3 GLU CD 1 1 14 5632 1 1 3 GLU CG C -3.718 -5.684 7.595 1.00 . A A . 3 GLU CG 1 1 14 5633 1 1 3 GLU H H -1.200 -6.311 5.887 1.00 . A A . 3 GLU H 1 1 14 5634 1 1 3 GLU HA H -3.285 -5.965 4.963 1.00 . A A . 3 GLU HA 1 1 14 5635 1 1 3 GLU HB2 H -3.275 -3.672 6.983 1.00 . A A . 3 GLU HB2 1 1 14 5636 1 1 3 GLU HB3 H -4.716 -4.317 6.229 1.00 . A A . 3 GLU HB3 1 1 14 5637 1 1 3 GLU HG2 H -3.186 -6.549 7.221 1.00 . A A . 3 GLU HG2 1 1 14 5638 1 1 3 GLU HG3 H -3.212 -5.329 8.479 1.00 . A A . 3 GLU HG3 1 1 14 5639 1 1 3 GLU N N -1.492 -5.377 5.882 1.00 . A A . 3 GLU N 1 1 14 5640 1 1 3 GLU O O -3.796 -3.325 3.976 1.00 . A A . 3 GLU O 1 1 14 5641 1 1 3 GLU OE1 O -5.724 -6.792 7.092 1.00 . A A . 3 GLU OE1 1 1 14 5642 1 1 3 GLU OE2 O -5.624 -5.685 8.977 1.00 . A A . 3 GLU OE2 1 1 14 5643 1 1 4 PHE C C -2.474 -3.195 1.413 1.00 . A A . 4 PHE C 1 1 14 5644 1 1 4 PHE CA C -1.419 -3.044 2.511 1.00 . A A . 4 PHE CA 1 1 14 5645 1 1 4 PHE CB C -0.027 -3.341 1.933 1.00 . A A . 4 PHE CB 1 1 14 5646 1 1 4 PHE CD1 C 1.030 -1.044 1.828 1.00 . A A . 4 PHE CD1 1 1 14 5647 1 1 4 PHE CD2 C 0.263 -2.010 -0.214 1.00 . A A . 4 PHE CD2 1 1 14 5648 1 1 4 PHE CE1 C 1.444 0.078 1.144 1.00 . A A . 4 PHE CE1 1 1 14 5649 1 1 4 PHE CE2 C 0.677 -0.885 -0.900 1.00 . A A . 4 PHE CE2 1 1 14 5650 1 1 4 PHE CG C 0.436 -2.097 1.156 1.00 . A A . 4 PHE CG 1 1 14 5651 1 1 4 PHE CZ C 1.268 0.158 -0.220 1.00 . A A . 4 PHE CZ 1 1 14 5652 1 1 4 PHE H H -1.010 -4.590 3.975 1.00 . A A . 4 PHE H 1 1 14 5653 1 1 4 PHE HA H -1.447 -2.034 2.887 1.00 . A A . 4 PHE HA 1 1 14 5654 1 1 4 PHE HB2 H 0.677 -3.543 2.726 1.00 . A A . 4 PHE HB2 1 1 14 5655 1 1 4 PHE HB3 H -0.057 -4.191 1.265 1.00 . A A . 4 PHE HB3 1 1 14 5656 1 1 4 PHE HD1 H 1.170 -1.100 2.898 1.00 . A A . 4 PHE HD1 1 1 14 5657 1 1 4 PHE HD2 H -0.200 -2.824 -0.753 1.00 . A A . 4 PHE HD2 1 1 14 5658 1 1 4 PHE HE1 H 1.906 0.895 1.677 1.00 . A A . 4 PHE HE1 1 1 14 5659 1 1 4 PHE HE2 H 0.539 -0.822 -1.969 1.00 . A A . 4 PHE HE2 1 1 14 5660 1 1 4 PHE HZ H 1.593 1.039 -0.752 1.00 . A A . 4 PHE HZ 1 1 14 5661 1 1 4 PHE N N -1.691 -3.976 3.642 1.00 . A A . 4 PHE N 1 1 14 5662 1 1 4 PHE O O -2.893 -2.216 0.831 1.00 . A A . 4 PHE O 1 1 14 5663 1 1 5 ARG C C -5.331 -4.332 0.566 1.00 . A A . 5 ARG C 1 1 14 5664 1 1 5 ARG CA C -3.907 -4.681 0.109 1.00 . A A . 5 ARG CA 1 1 14 5665 1 1 5 ARG CB C -3.863 -6.171 -0.310 1.00 . A A . 5 ARG CB 1 1 14 5666 1 1 5 ARG CD C -2.216 -7.719 0.766 1.00 . A A . 5 ARG CD 1 1 14 5667 1 1 5 ARG CG C -3.619 -7.106 0.896 1.00 . A A . 5 ARG CG 1 1 14 5668 1 1 5 ARG CZ C -1.147 -7.058 2.874 1.00 . A A . 5 ARG CZ 1 1 14 5669 1 1 5 ARG H H -2.493 -5.159 1.679 1.00 . A A . 5 ARG H 1 1 14 5670 1 1 5 ARG HA H -3.660 -4.078 -0.736 1.00 . A A . 5 ARG HA 1 1 14 5671 1 1 5 ARG HB2 H -4.794 -6.452 -0.781 1.00 . A A . 5 ARG HB2 1 1 14 5672 1 1 5 ARG HB3 H -3.089 -6.278 -1.056 1.00 . A A . 5 ARG HB3 1 1 14 5673 1 1 5 ARG HD2 H -2.232 -8.739 1.109 1.00 . A A . 5 ARG HD2 1 1 14 5674 1 1 5 ARG HD3 H -1.888 -7.707 -0.264 1.00 . A A . 5 ARG HD3 1 1 14 5675 1 1 5 ARG HE H -0.613 -6.330 1.113 1.00 . A A . 5 ARG HE 1 1 14 5676 1 1 5 ARG HG2 H -3.725 -6.585 1.837 1.00 . A A . 5 ARG HG2 1 1 14 5677 1 1 5 ARG HG3 H -4.348 -7.901 0.875 1.00 . A A . 5 ARG HG3 1 1 14 5678 1 1 5 ARG HH11 H -2.645 -8.383 3.039 1.00 . A A . 5 ARG HH11 1 1 14 5679 1 1 5 ARG HH12 H -1.874 -7.932 4.522 1.00 . A A . 5 ARG HH12 1 1 14 5680 1 1 5 ARG HH21 H 0.361 -5.746 2.970 1.00 . A A . 5 ARG HH21 1 1 14 5681 1 1 5 ARG HH22 H -0.147 -6.418 4.484 1.00 . A A . 5 ARG HH22 1 1 14 5682 1 1 5 ARG N N -2.874 -4.419 1.166 1.00 . A A . 5 ARG N 1 1 14 5683 1 1 5 ARG NE N -1.227 -6.939 1.573 1.00 . A A . 5 ARG NE 1 1 14 5684 1 1 5 ARG NH1 N -1.952 -7.854 3.528 1.00 . A A . 5 ARG NH1 1 1 14 5685 1 1 5 ARG NH2 N -0.241 -6.353 3.491 1.00 . A A . 5 ARG NH2 1 1 14 5686 1 1 5 ARG O O -6.308 -4.757 -0.021 1.00 . A A . 5 ARG O 1 1 14 5687 1 1 6 HIS C C -6.617 -1.585 2.412 1.00 . A A . 6 HIS C 1 1 14 5688 1 1 6 HIS CA C -6.675 -3.102 2.204 1.00 . A A . 6 HIS CA 1 1 14 5689 1 1 6 HIS CB C -6.900 -3.824 3.561 1.00 . A A . 6 HIS CB 1 1 14 5690 1 1 6 HIS CD2 C -6.960 -6.278 2.546 1.00 . A A . 6 HIS CD2 1 1 14 5691 1 1 6 HIS CE1 C -5.632 -7.180 3.856 1.00 . A A . 6 HIS CE1 1 1 14 5692 1 1 6 HIS CG C -6.538 -5.312 3.444 1.00 . A A . 6 HIS CG 1 1 14 5693 1 1 6 HIS H H -4.551 -3.261 2.009 1.00 . A A . 6 HIS H 1 1 14 5694 1 1 6 HIS HA H -7.469 -3.327 1.515 1.00 . A A . 6 HIS HA 1 1 14 5695 1 1 6 HIS HB2 H -6.295 -3.382 4.339 1.00 . A A . 6 HIS HB2 1 1 14 5696 1 1 6 HIS HB3 H -7.939 -3.748 3.849 1.00 . A A . 6 HIS HB3 1 1 14 5697 1 1 6 HIS HD1 H -5.241 -5.544 4.976 1.00 . A A . 6 HIS HD1 1 1 14 5698 1 1 6 HIS HD2 H -7.659 -6.107 1.742 1.00 . A A . 6 HIS HD2 1 1 14 5699 1 1 6 HIS HE1 H -5.011 -7.915 4.349 1.00 . A A . 6 HIS HE1 1 1 14 5700 1 1 6 HIS N N -5.387 -3.554 1.609 1.00 . A A . 6 HIS N 1 1 14 5701 1 1 6 HIS ND1 N -5.721 -5.942 4.222 1.00 . A A . 6 HIS ND1 1 1 14 5702 1 1 6 HIS NE2 N -6.387 -7.434 2.817 1.00 . A A . 6 HIS NE2 1 1 14 5703 1 1 6 HIS O O -7.426 -0.853 1.876 1.00 . A A . 6 HIS O 1 1 14 5704 1 1 7 ASP C C -4.627 1.001 2.413 1.00 . A A . 7 ASP C 1 1 14 5705 1 1 7 ASP CA C -5.452 0.283 3.490 1.00 . A A . 7 ASP CA 1 1 14 5706 1 1 7 ASP CB C -4.756 0.409 4.874 1.00 . A A . 7 ASP CB 1 1 14 5707 1 1 7 ASP CG C -3.505 -0.494 4.957 1.00 . A A . 7 ASP CG 1 1 14 5708 1 1 7 ASP H H -5.036 -1.826 3.564 1.00 . A A . 7 ASP H 1 1 14 5709 1 1 7 ASP HA H -6.421 0.733 3.501 1.00 . A A . 7 ASP HA 1 1 14 5710 1 1 7 ASP HB2 H -4.457 1.431 5.052 1.00 . A A . 7 ASP HB2 1 1 14 5711 1 1 7 ASP HB3 H -5.456 0.122 5.646 1.00 . A A . 7 ASP HB3 1 1 14 5712 1 1 7 ASP N N -5.645 -1.168 3.185 1.00 . A A . 7 ASP N 1 1 14 5713 1 1 7 ASP O O -4.229 2.140 2.563 1.00 . A A . 7 ASP O 1 1 14 5714 1 1 7 ASP OD1 O -2.633 -0.314 4.122 1.00 . A A . 7 ASP OD1 1 1 14 5715 1 1 7 ASP OD2 O -3.489 -1.317 5.857 1.00 . A A . 7 ASP OD2 1 1 14 5716 1 1 8 SER C C -3.784 -0.249 -0.972 1.00 . A A . 8 SER C 1 1 14 5717 1 1 8 SER CA C -3.636 0.763 0.175 1.00 . A A . 8 SER CA 1 1 14 5718 1 1 8 SER CB C -2.149 0.912 0.590 1.00 . A A . 8 SER CB 1 1 14 5719 1 1 8 SER H H -4.796 -0.626 1.355 1.00 . A A . 8 SER H 1 1 14 5720 1 1 8 SER HA H -4.061 1.699 -0.148 1.00 . A A . 8 SER HA 1 1 14 5721 1 1 8 SER HB2 H -2.039 1.425 1.534 1.00 . A A . 8 SER HB2 1 1 14 5722 1 1 8 SER HB3 H -1.645 -0.042 0.632 1.00 . A A . 8 SER HB3 1 1 14 5723 1 1 8 SER HG H -0.892 1.186 -0.868 1.00 . A A . 8 SER HG 1 1 14 5724 1 1 8 SER N N -4.415 0.273 1.354 1.00 . A A . 8 SER N 1 1 14 5725 1 1 8 SER O O -2.946 -0.343 -1.849 1.00 . A A . 8 SER O 1 1 14 5726 1 1 8 SER OG O -1.577 1.705 -0.439 1.00 . A A . 8 SER OG 1 1 14 5727 1 1 9 GLY C C -5.920 -1.370 -3.107 1.00 . A A . 9 GLY C 1 1 14 5728 1 1 9 GLY CA C -5.184 -2.013 -1.937 1.00 . A A . 9 GLY CA 1 1 14 5729 1 1 9 GLY H H -5.490 -0.822 -0.165 1.00 . A A . 9 GLY H 1 1 14 5730 1 1 9 GLY HA2 H -4.271 -2.472 -2.289 1.00 . A A . 9 GLY HA2 1 1 14 5731 1 1 9 GLY HA3 H -5.821 -2.764 -1.498 1.00 . A A . 9 GLY HA3 1 1 14 5732 1 1 9 GLY N N -4.870 -0.976 -0.909 1.00 . A A . 9 GLY N 1 1 14 5733 1 1 9 GLY O O -5.647 -1.662 -4.254 1.00 . A A . 9 GLY O 1 1 14 5734 1 1 10 TYR C C -6.759 0.981 -4.752 1.00 . A A . 10 TYR C 1 1 14 5735 1 1 10 TYR CA C -7.657 0.221 -3.777 1.00 . A A . 10 TYR CA 1 1 14 5736 1 1 10 TYR CB C -8.594 1.220 -3.080 1.00 . A A . 10 TYR CB 1 1 14 5737 1 1 10 TYR CD1 C -7.503 1.726 -0.843 1.00 . A A . 10 TYR CD1 1 1 14 5738 1 1 10 TYR CD2 C -7.391 3.393 -2.538 1.00 . A A . 10 TYR CD2 1 1 14 5739 1 1 10 TYR CE1 C -6.799 2.545 0.011 1.00 . A A . 10 TYR CE1 1 1 14 5740 1 1 10 TYR CE2 C -6.685 4.213 -1.680 1.00 . A A . 10 TYR CE2 1 1 14 5741 1 1 10 TYR CG C -7.806 2.141 -2.126 1.00 . A A . 10 TYR CG 1 1 14 5742 1 1 10 TYR CZ C -6.385 3.793 -0.401 1.00 . A A . 10 TYR CZ 1 1 14 5743 1 1 10 TYR H H -6.996 -0.336 -1.806 1.00 . A A . 10 TYR H 1 1 14 5744 1 1 10 TYR HA H -8.240 -0.504 -4.327 1.00 . A A . 10 TYR HA 1 1 14 5745 1 1 10 TYR HB2 H -9.086 1.829 -3.825 1.00 . A A . 10 TYR HB2 1 1 14 5746 1 1 10 TYR HB3 H -9.341 0.685 -2.515 1.00 . A A . 10 TYR HB3 1 1 14 5747 1 1 10 TYR HD1 H -7.820 0.750 -0.504 1.00 . A A . 10 TYR HD1 1 1 14 5748 1 1 10 TYR HD2 H -7.616 3.738 -3.538 1.00 . A A . 10 TYR HD2 1 1 14 5749 1 1 10 TYR HE1 H -6.570 2.206 1.009 1.00 . A A . 10 TYR HE1 1 1 14 5750 1 1 10 TYR HE2 H -6.368 5.190 -2.012 1.00 . A A . 10 TYR HE2 1 1 14 5751 1 1 10 TYR HH H -6.240 4.803 1.212 1.00 . A A . 10 TYR HH 1 1 14 5752 1 1 10 TYR N N -6.841 -0.506 -2.757 1.00 . A A . 10 TYR N 1 1 14 5753 1 1 10 TYR O O -5.668 1.388 -4.400 1.00 . A A . 10 TYR O 1 1 14 5754 1 1 10 TYR OH O -5.679 4.611 0.458 1.00 . A A . 10 TYR OH 1 1 14 5755 1 1 11 GLU C C -6.511 3.376 -6.725 1.00 . A A . 11 GLU C 1 1 14 5756 1 1 11 GLU CA C -6.463 1.874 -6.977 1.00 . A A . 11 GLU CA 1 1 14 5757 1 1 11 GLU CB C -7.031 1.555 -8.377 1.00 . A A . 11 GLU CB 1 1 14 5758 1 1 11 GLU CD C -5.813 0.478 -10.316 1.00 . A A . 11 GLU CD 1 1 14 5759 1 1 11 GLU CG C -6.406 0.239 -8.914 1.00 . A A . 11 GLU CG 1 1 14 5760 1 1 11 GLU H H -8.144 0.797 -6.167 1.00 . A A . 11 GLU H 1 1 14 5761 1 1 11 GLU HA H -5.438 1.559 -6.877 1.00 . A A . 11 GLU HA 1 1 14 5762 1 1 11 GLU HB2 H -8.104 1.444 -8.318 1.00 . A A . 11 GLU HB2 1 1 14 5763 1 1 11 GLU HB3 H -6.816 2.373 -9.051 1.00 . A A . 11 GLU HB3 1 1 14 5764 1 1 11 GLU HG2 H -5.627 -0.124 -8.258 1.00 . A A . 11 GLU HG2 1 1 14 5765 1 1 11 GLU HG3 H -7.169 -0.522 -8.985 1.00 . A A . 11 GLU HG3 1 1 14 5766 1 1 11 GLU N N -7.255 1.148 -5.949 1.00 . A A . 11 GLU N 1 1 14 5767 1 1 11 GLU O O -7.538 3.933 -6.386 1.00 . A A . 11 GLU O 1 1 14 5768 1 1 11 GLU OE1 O -6.599 0.468 -11.248 1.00 . A A . 11 GLU OE1 1 1 14 5769 1 1 11 GLU OE2 O -4.606 0.660 -10.379 1.00 . A A . 11 GLU OE2 1 1 14 5770 1 1 12 VAL C C -4.543 5.983 -7.984 1.00 . A A . 12 VAL C 1 1 14 5771 1 1 12 VAL CA C -5.177 5.430 -6.716 1.00 . A A . 12 VAL CA 1 1 14 5772 1 1 12 VAL CB C -4.256 5.648 -5.503 1.00 . A A . 12 VAL CB 1 1 14 5773 1 1 12 VAL CG1 C -3.984 7.150 -5.274 1.00 . A A . 12 VAL CG1 1 1 14 5774 1 1 12 VAL CG2 C -4.930 5.094 -4.253 1.00 . A A . 12 VAL CG2 1 1 14 5775 1 1 12 VAL H H -4.591 3.426 -7.181 1.00 . A A . 12 VAL H 1 1 14 5776 1 1 12 VAL HA H -6.133 5.908 -6.568 1.00 . A A . 12 VAL HA 1 1 14 5777 1 1 12 VAL HB H -3.340 5.104 -5.675 1.00 . A A . 12 VAL HB 1 1 14 5778 1 1 12 VAL HG11 H -3.737 7.640 -6.201 1.00 . A A . 12 VAL HG11 1 1 14 5779 1 1 12 VAL HG12 H -4.855 7.630 -4.853 1.00 . A A . 12 VAL HG12 1 1 14 5780 1 1 12 VAL HG13 H -3.158 7.266 -4.588 1.00 . A A . 12 VAL HG13 1 1 14 5781 1 1 12 VAL HG21 H -5.933 5.490 -4.179 1.00 . A A . 12 VAL HG21 1 1 14 5782 1 1 12 VAL HG22 H -4.974 4.017 -4.306 1.00 . A A . 12 VAL HG22 1 1 14 5783 1 1 12 VAL HG23 H -4.370 5.383 -3.377 1.00 . A A . 12 VAL HG23 1 1 14 5784 1 1 12 VAL N N -5.362 3.965 -6.908 1.00 . A A . 12 VAL N 1 1 14 5785 1 1 12 VAL O O -5.094 6.875 -8.595 1.00 . A A . 12 VAL O 1 1 14 5786 1 1 13 HIS C C -1.528 6.818 -9.123 1.00 . A A . 13 HIS C 1 1 14 5787 1 1 13 HIS CA C -2.545 5.722 -9.481 1.00 . A A . 13 HIS CA 1 1 14 5788 1 1 13 HIS CB C -3.403 6.199 -10.696 1.00 . A A . 13 HIS CB 1 1 14 5789 1 1 13 HIS CD2 C -4.921 4.007 -10.489 1.00 . A A . 13 HIS CD2 1 1 14 5790 1 1 13 HIS CE1 C -5.509 3.884 -12.472 1.00 . A A . 13 HIS CE1 1 1 14 5791 1 1 13 HIS CG C -4.332 5.067 -11.167 1.00 . A A . 13 HIS CG 1 1 14 5792 1 1 13 HIS H H -3.101 4.683 -7.700 1.00 . A A . 13 HIS H 1 1 14 5793 1 1 13 HIS HA H -1.997 4.834 -9.755 1.00 . A A . 13 HIS HA 1 1 14 5794 1 1 13 HIS HB2 H -3.984 7.080 -10.479 1.00 . A A . 13 HIS HB2 1 1 14 5795 1 1 13 HIS HB3 H -2.740 6.437 -11.511 1.00 . A A . 13 HIS HB3 1 1 14 5796 1 1 13 HIS HD1 H -4.508 5.515 -13.129 1.00 . A A . 13 HIS HD1 1 1 14 5797 1 1 13 HIS HD2 H -4.806 3.795 -9.437 1.00 . A A . 13 HIS HD2 1 1 14 5798 1 1 13 HIS HE1 H -5.977 3.552 -13.387 1.00 . A A . 13 HIS HE1 1 1 14 5799 1 1 13 HIS N N -3.409 5.398 -8.296 1.00 . A A . 13 HIS N 1 1 14 5800 1 1 13 HIS ND1 N -4.743 4.924 -12.384 1.00 . A A . 13 HIS ND1 1 1 14 5801 1 1 13 HIS NE2 N -5.647 3.285 -11.317 1.00 . A A . 13 HIS NE2 1 1 14 5802 1 1 13 HIS O O -0.711 7.185 -9.946 1.00 . A A . 13 HIS O 1 1 14 5803 1 1 14 HIS C C 0.347 7.596 -6.589 1.00 . A A . 14 HIS C 1 1 14 5804 1 1 14 HIS CA C -0.675 8.368 -7.427 1.00 . A A . 14 HIS CA 1 1 14 5805 1 1 14 HIS CB C -1.444 9.403 -6.565 1.00 . A A . 14 HIS CB 1 1 14 5806 1 1 14 HIS CD2 C -3.460 9.679 -8.208 1.00 . A A . 14 HIS CD2 1 1 14 5807 1 1 14 HIS CE1 C -3.398 11.730 -8.478 1.00 . A A . 14 HIS CE1 1 1 14 5808 1 1 14 HIS CG C -2.417 10.165 -7.456 1.00 . A A . 14 HIS CG 1 1 14 5809 1 1 14 HIS H H -2.285 6.974 -7.294 1.00 . A A . 14 HIS H 1 1 14 5810 1 1 14 HIS HA H -0.211 8.837 -8.269 1.00 . A A . 14 HIS HA 1 1 14 5811 1 1 14 HIS HB2 H -2.008 8.913 -5.790 1.00 . A A . 14 HIS HB2 1 1 14 5812 1 1 14 HIS HB3 H -0.757 10.106 -6.117 1.00 . A A . 14 HIS HB3 1 1 14 5813 1 1 14 HIS HD1 H -1.809 12.085 -7.272 1.00 . A A . 14 HIS HD1 1 1 14 5814 1 1 14 HIS HD2 H -3.718 8.635 -8.253 1.00 . A A . 14 HIS HD2 1 1 14 5815 1 1 14 HIS HE1 H -3.627 12.731 -8.815 1.00 . A A . 14 HIS HE1 1 1 14 5816 1 1 14 HIS N N -1.606 7.307 -7.907 1.00 . A A . 14 HIS N 1 1 14 5817 1 1 14 HIS ND1 N -2.432 11.440 -7.666 1.00 . A A . 14 HIS ND1 1 1 14 5818 1 1 14 HIS NE2 N -4.067 10.662 -8.842 1.00 . A A . 14 HIS NE2 1 1 14 5819 1 1 14 HIS O O 1.262 7.017 -7.140 1.00 . A A . 14 HIS O 1 1 14 5820 1 1 15 GLN C C 1.225 5.400 -4.833 1.00 . A A . 15 GLN C 1 1 14 5821 1 1 15 GLN CA C 1.106 6.857 -4.371 1.00 . A A . 15 GLN CA 1 1 14 5822 1 1 15 GLN CB C 0.562 6.888 -2.929 1.00 . A A . 15 GLN CB 1 1 14 5823 1 1 15 GLN CD C -1.291 8.582 -2.657 1.00 . A A . 15 GLN CD 1 1 14 5824 1 1 15 GLN CG C 0.215 8.333 -2.495 1.00 . A A . 15 GLN CG 1 1 14 5825 1 1 15 GLN H H -0.594 8.073 -4.913 1.00 . A A . 15 GLN H 1 1 14 5826 1 1 15 GLN HA H 2.085 7.305 -4.423 1.00 . A A . 15 GLN HA 1 1 14 5827 1 1 15 GLN HB2 H -0.308 6.250 -2.859 1.00 . A A . 15 GLN HB2 1 1 14 5828 1 1 15 GLN HB3 H 1.319 6.498 -2.266 1.00 . A A . 15 GLN HB3 1 1 14 5829 1 1 15 GLN HE21 H -1.040 10.085 -3.928 1.00 . A A . 15 GLN HE21 1 1 14 5830 1 1 15 GLN HE22 H -2.652 9.707 -3.561 1.00 . A A . 15 GLN HE22 1 1 14 5831 1 1 15 GLN HG2 H 0.474 8.474 -1.455 1.00 . A A . 15 GLN HG2 1 1 14 5832 1 1 15 GLN HG3 H 0.759 9.058 -3.085 1.00 . A A . 15 GLN HG3 1 1 14 5833 1 1 15 GLN N N 0.168 7.589 -5.288 1.00 . A A . 15 GLN N 1 1 14 5834 1 1 15 GLN NE2 N -1.694 9.538 -3.448 1.00 . A A . 15 GLN NE2 1 1 14 5835 1 1 15 GLN O O 2.209 4.738 -4.578 1.00 . A A . 15 GLN O 1 1 14 5836 1 1 15 GLN OE1 O -2.116 7.910 -2.069 1.00 . A A . 15 GLN OE1 1 1 14 5837 1 1 16 GLU C C 1.416 3.191 -6.763 1.00 . A A . 16 GLU C 1 1 14 5838 1 1 16 GLU CA C 0.115 3.578 -6.047 1.00 . A A . 16 GLU CA 1 1 14 5839 1 1 16 GLU CB C -1.066 3.523 -7.014 1.00 . A A . 16 GLU CB 1 1 14 5840 1 1 16 GLU CD C -2.306 2.149 -8.692 1.00 . A A . 16 GLU CD 1 1 14 5841 1 1 16 GLU CG C -1.078 2.183 -7.763 1.00 . A A . 16 GLU CG 1 1 14 5842 1 1 16 GLU H H -0.562 5.570 -5.662 1.00 . A A . 16 GLU H 1 1 14 5843 1 1 16 GLU HA H -0.064 2.896 -5.236 1.00 . A A . 16 GLU HA 1 1 14 5844 1 1 16 GLU HB2 H -1.984 3.633 -6.457 1.00 . A A . 16 GLU HB2 1 1 14 5845 1 1 16 GLU HB3 H -0.987 4.336 -7.721 1.00 . A A . 16 GLU HB3 1 1 14 5846 1 1 16 GLU HG2 H -0.174 2.076 -8.347 1.00 . A A . 16 GLU HG2 1 1 14 5847 1 1 16 GLU HG3 H -1.124 1.370 -7.053 1.00 . A A . 16 GLU HG3 1 1 14 5848 1 1 16 GLU N N 0.191 4.963 -5.507 1.00 . A A . 16 GLU N 1 1 14 5849 1 1 16 GLU O O 1.963 2.130 -6.534 1.00 . A A . 16 GLU O 1 1 14 5850 1 1 16 GLU OE1 O -3.386 1.994 -8.149 1.00 . A A . 16 GLU OE1 1 1 14 5851 1 1 16 GLU OE2 O -2.102 2.280 -9.887 1.00 . A A . 16 GLU OE2 1 1 14 5852 1 1 17 LEU C C 4.317 4.199 -7.546 1.00 . A A . 17 LEU C 1 1 14 5853 1 1 17 LEU CA C 3.114 3.843 -8.378 1.00 . A A . 17 LEU CA 1 1 14 5854 1 1 17 LEU CB C 3.144 4.690 -9.683 1.00 . A A . 17 LEU CB 1 1 14 5855 1 1 17 LEU CD1 C 1.829 6.001 -11.373 1.00 . A A . 17 LEU CD1 1 1 14 5856 1 1 17 LEU CD2 C 1.008 3.732 -10.659 1.00 . A A . 17 LEU CD2 1 1 14 5857 1 1 17 LEU CG C 1.722 5.022 -10.188 1.00 . A A . 17 LEU CG 1 1 14 5858 1 1 17 LEU H H 1.377 4.924 -7.728 1.00 . A A . 17 LEU H 1 1 14 5859 1 1 17 LEU HA H 3.155 2.791 -8.562 1.00 . A A . 17 LEU HA 1 1 14 5860 1 1 17 LEU HB2 H 3.670 5.617 -9.502 1.00 . A A . 17 LEU HB2 1 1 14 5861 1 1 17 LEU HB3 H 3.681 4.144 -10.445 1.00 . A A . 17 LEU HB3 1 1 14 5862 1 1 17 LEU HD11 H 2.501 5.612 -12.125 1.00 . A A . 17 LEU HD11 1 1 14 5863 1 1 17 LEU HD12 H 0.859 6.156 -11.821 1.00 . A A . 17 LEU HD12 1 1 14 5864 1 1 17 LEU HD13 H 2.207 6.954 -11.030 1.00 . A A . 17 LEU HD13 1 1 14 5865 1 1 17 LEU HD21 H 1.042 2.976 -9.891 1.00 . A A . 17 LEU HD21 1 1 14 5866 1 1 17 LEU HD22 H -0.027 3.944 -10.888 1.00 . A A . 17 LEU HD22 1 1 14 5867 1 1 17 LEU HD23 H 1.486 3.340 -11.546 1.00 . A A . 17 LEU HD23 1 1 14 5868 1 1 17 LEU HG H 1.178 5.488 -9.382 1.00 . A A . 17 LEU HG 1 1 14 5869 1 1 17 LEU N N 1.862 4.086 -7.607 1.00 . A A . 17 LEU N 1 1 14 5870 1 1 17 LEU O O 5.404 3.710 -7.761 1.00 . A A . 17 LEU O 1 1 14 5871 1 1 18 VAL C C 5.598 4.264 -4.861 1.00 . A A . 18 VAL C 1 1 14 5872 1 1 18 VAL CA C 5.232 5.468 -5.724 1.00 . A A . 18 VAL CA 1 1 14 5873 1 1 18 VAL CB C 4.791 6.639 -4.863 1.00 . A A . 18 VAL CB 1 1 14 5874 1 1 18 VAL CG1 C 5.996 7.148 -4.055 1.00 . A A . 18 VAL CG1 1 1 14 5875 1 1 18 VAL CG2 C 4.313 7.719 -5.837 1.00 . A A . 18 VAL CG2 1 1 14 5876 1 1 18 VAL H H 3.202 5.439 -6.490 1.00 . A A . 18 VAL H 1 1 14 5877 1 1 18 VAL HA H 6.080 5.735 -6.338 1.00 . A A . 18 VAL HA 1 1 14 5878 1 1 18 VAL HB H 4.000 6.346 -4.190 1.00 . A A . 18 VAL HB 1 1 14 5879 1 1 18 VAL HG11 H 6.856 7.266 -4.698 1.00 . A A . 18 VAL HG11 1 1 14 5880 1 1 18 VAL HG12 H 5.762 8.091 -3.589 1.00 . A A . 18 VAL HG12 1 1 14 5881 1 1 18 VAL HG13 H 6.241 6.436 -3.285 1.00 . A A . 18 VAL HG13 1 1 14 5882 1 1 18 VAL HG21 H 5.085 7.916 -6.567 1.00 . A A . 18 VAL HG21 1 1 14 5883 1 1 18 VAL HG22 H 3.441 7.360 -6.360 1.00 . A A . 18 VAL HG22 1 1 14 5884 1 1 18 VAL HG23 H 4.062 8.622 -5.309 1.00 . A A . 18 VAL HG23 1 1 14 5885 1 1 18 VAL N N 4.100 5.064 -6.603 1.00 . A A . 18 VAL N 1 1 14 5886 1 1 18 VAL O O 6.681 4.205 -4.318 1.00 . A A . 18 VAL O 1 1 14 5887 1 1 19 PHE C C 5.882 1.225 -4.757 1.00 . A A . 19 PHE C 1 1 14 5888 1 1 19 PHE CA C 4.922 2.112 -3.962 1.00 . A A . 19 PHE CA 1 1 14 5889 1 1 19 PHE CB C 3.617 1.331 -3.739 1.00 . A A . 19 PHE CB 1 1 14 5890 1 1 19 PHE CD1 C 2.822 3.185 -2.180 1.00 . A A . 19 PHE CD1 1 1 14 5891 1 1 19 PHE CD2 C 1.197 1.903 -3.357 1.00 . A A . 19 PHE CD2 1 1 14 5892 1 1 19 PHE CE1 C 1.817 3.915 -1.581 1.00 . A A . 19 PHE CE1 1 1 14 5893 1 1 19 PHE CE2 C 0.189 2.632 -2.759 1.00 . A A . 19 PHE CE2 1 1 14 5894 1 1 19 PHE CG C 2.521 2.172 -3.071 1.00 . A A . 19 PHE CG 1 1 14 5895 1 1 19 PHE CZ C 0.499 3.639 -1.870 1.00 . A A . 19 PHE CZ 1 1 14 5896 1 1 19 PHE H H 3.826 3.448 -5.245 1.00 . A A . 19 PHE H 1 1 14 5897 1 1 19 PHE HA H 5.384 2.413 -3.036 1.00 . A A . 19 PHE HA 1 1 14 5898 1 1 19 PHE HB2 H 3.247 0.972 -4.688 1.00 . A A . 19 PHE HB2 1 1 14 5899 1 1 19 PHE HB3 H 3.815 0.478 -3.108 1.00 . A A . 19 PHE HB3 1 1 14 5900 1 1 19 PHE HD1 H 3.851 3.409 -1.957 1.00 . A A . 19 PHE HD1 1 1 14 5901 1 1 19 PHE HD2 H 0.949 1.119 -4.062 1.00 . A A . 19 PHE HD2 1 1 14 5902 1 1 19 PHE HE1 H 2.065 4.702 -0.885 1.00 . A A . 19 PHE HE1 1 1 14 5903 1 1 19 PHE HE2 H -0.844 2.415 -2.987 1.00 . A A . 19 PHE HE2 1 1 14 5904 1 1 19 PHE HZ H -0.289 4.209 -1.401 1.00 . A A . 19 PHE HZ 1 1 14 5905 1 1 19 PHE N N 4.678 3.337 -4.772 1.00 . A A . 19 PHE N 1 1 14 5906 1 1 19 PHE O O 6.590 0.398 -4.216 1.00 . A A . 19 PHE O 1 1 14 5907 1 1 20 PHE C C 8.078 1.402 -6.989 1.00 . A A . 20 PHE C 1 1 14 5908 1 1 20 PHE CA C 6.721 0.694 -6.986 1.00 . A A . 20 PHE CA 1 1 14 5909 1 1 20 PHE CB C 6.014 0.708 -8.370 1.00 . A A . 20 PHE CB 1 1 14 5910 1 1 20 PHE CD1 C 7.822 -0.333 -9.807 1.00 . A A . 20 PHE CD1 1 1 14 5911 1 1 20 PHE CD2 C 7.176 1.917 -10.275 1.00 . A A . 20 PHE CD2 1 1 14 5912 1 1 20 PHE CE1 C 8.742 -0.284 -10.832 1.00 . A A . 20 PHE CE1 1 1 14 5913 1 1 20 PHE CE2 C 8.097 1.966 -11.301 1.00 . A A . 20 PHE CE2 1 1 14 5914 1 1 20 PHE CG C 7.033 0.766 -9.520 1.00 . A A . 20 PHE CG 1 1 14 5915 1 1 20 PHE CZ C 8.880 0.866 -11.580 1.00 . A A . 20 PHE CZ 1 1 14 5916 1 1 20 PHE H H 5.257 2.167 -6.377 1.00 . A A . 20 PHE H 1 1 14 5917 1 1 20 PHE HA H 6.843 -0.318 -6.629 1.00 . A A . 20 PHE HA 1 1 14 5918 1 1 20 PHE HB2 H 5.426 -0.191 -8.468 1.00 . A A . 20 PHE HB2 1 1 14 5919 1 1 20 PHE HB3 H 5.340 1.547 -8.445 1.00 . A A . 20 PHE HB3 1 1 14 5920 1 1 20 PHE HD1 H 7.716 -1.235 -9.224 1.00 . A A . 20 PHE HD1 1 1 14 5921 1 1 20 PHE HD2 H 6.565 2.783 -10.063 1.00 . A A . 20 PHE HD2 1 1 14 5922 1 1 20 PHE HE1 H 9.355 -1.147 -11.049 1.00 . A A . 20 PHE HE1 1 1 14 5923 1 1 20 PHE HE2 H 8.204 2.867 -11.887 1.00 . A A . 20 PHE HE2 1 1 14 5924 1 1 20 PHE HZ H 9.601 0.905 -12.383 1.00 . A A . 20 PHE HZ 1 1 14 5925 1 1 20 PHE N N 5.857 1.460 -6.043 1.00 . A A . 20 PHE N 1 1 14 5926 1 1 20 PHE O O 9.116 0.788 -6.857 1.00 . A A . 20 PHE O 1 1 14 5927 1 1 21 ALA C C 9.962 3.284 -5.828 1.00 . A A . 21 ALA C 1 1 14 5928 1 1 21 ALA CA C 9.255 3.529 -7.158 1.00 . A A . 21 ALA CA 1 1 14 5929 1 1 21 ALA CB C 8.865 5.005 -7.302 1.00 . A A . 21 ALA CB 1 1 14 5930 1 1 21 ALA H H 7.154 3.128 -7.240 1.00 . A A . 21 ALA H 1 1 14 5931 1 1 21 ALA HA H 9.890 3.202 -7.965 1.00 . A A . 21 ALA HA 1 1 14 5932 1 1 21 ALA HB1 H 8.203 5.131 -8.146 1.00 . A A . 21 ALA HB1 1 1 14 5933 1 1 21 ALA HB2 H 8.364 5.350 -6.410 1.00 . A A . 21 ALA HB2 1 1 14 5934 1 1 21 ALA HB3 H 9.748 5.606 -7.461 1.00 . A A . 21 ALA HB3 1 1 14 5935 1 1 21 ALA N N 8.020 2.700 -7.140 1.00 . A A . 21 ALA N 1 1 14 5936 1 1 21 ALA O O 11.173 3.265 -5.759 1.00 . A A . 21 ALA O 1 1 14 5937 1 1 22 GLU C C 10.611 1.604 -3.464 1.00 . A A . 22 GLU C 1 1 14 5938 1 1 22 GLU CA C 9.699 2.839 -3.446 1.00 . A A . 22 GLU CA 1 1 14 5939 1 1 22 GLU CB C 8.533 2.601 -2.460 1.00 . A A . 22 GLU CB 1 1 14 5940 1 1 22 GLU CD C 6.728 3.827 -1.185 1.00 . A A . 22 GLU CD 1 1 14 5941 1 1 22 GLU CG C 8.180 3.903 -1.702 1.00 . A A . 22 GLU CG 1 1 14 5942 1 1 22 GLU H H 8.184 3.120 -4.959 1.00 . A A . 22 GLU H 1 1 14 5943 1 1 22 GLU HA H 10.277 3.702 -3.174 1.00 . A A . 22 GLU HA 1 1 14 5944 1 1 22 GLU HB2 H 7.671 2.250 -3.003 1.00 . A A . 22 GLU HB2 1 1 14 5945 1 1 22 GLU HB3 H 8.805 1.845 -1.738 1.00 . A A . 22 GLU HB3 1 1 14 5946 1 1 22 GLU HG2 H 8.842 4.027 -0.856 1.00 . A A . 22 GLU HG2 1 1 14 5947 1 1 22 GLU HG3 H 8.287 4.760 -2.352 1.00 . A A . 22 GLU HG3 1 1 14 5948 1 1 22 GLU N N 9.155 3.094 -4.812 1.00 . A A . 22 GLU N 1 1 14 5949 1 1 22 GLU O O 11.671 1.595 -2.869 1.00 . A A . 22 GLU O 1 1 14 5950 1 1 22 GLU OE1 O 6.459 2.911 -0.424 1.00 . A A . 22 GLU OE1 1 1 14 5951 1 1 22 GLU OE2 O 5.960 4.689 -1.581 1.00 . A A . 22 GLU OE2 1 1 14 5952 1 1 23 ASP C C 12.180 -0.449 -5.096 1.00 . A A . 23 ASP C 1 1 14 5953 1 1 23 ASP CA C 10.887 -0.686 -4.300 1.00 . A A . 23 ASP CA 1 1 14 5954 1 1 23 ASP CB C 9.923 -1.715 -5.001 1.00 . A A . 23 ASP CB 1 1 14 5955 1 1 23 ASP CG C 10.468 -2.257 -6.342 1.00 . A A . 23 ASP CG 1 1 14 5956 1 1 23 ASP H H 9.281 0.719 -4.615 1.00 . A A . 23 ASP H 1 1 14 5957 1 1 23 ASP HA H 11.140 -1.047 -3.316 1.00 . A A . 23 ASP HA 1 1 14 5958 1 1 23 ASP HB2 H 9.768 -2.552 -4.336 1.00 . A A . 23 ASP HB2 1 1 14 5959 1 1 23 ASP HB3 H 8.960 -1.257 -5.177 1.00 . A A . 23 ASP HB3 1 1 14 5960 1 1 23 ASP N N 10.143 0.604 -4.166 1.00 . A A . 23 ASP N 1 1 14 5961 1 1 23 ASP O O 13.252 -0.821 -4.662 1.00 . A A . 23 ASP O 1 1 14 5962 1 1 23 ASP OD1 O 11.335 -3.113 -6.269 1.00 . A A . 23 ASP OD1 1 1 14 5963 1 1 23 ASP OD2 O 9.990 -1.786 -7.362 1.00 . A A . 23 ASP OD2 1 1 14 5964 1 1 24 VAL C C 14.279 1.214 -6.382 1.00 . A A . 24 VAL C 1 1 14 5965 1 1 24 VAL CA C 13.162 0.479 -7.144 1.00 . A A . 24 VAL CA 1 1 14 5966 1 1 24 VAL CB C 12.640 1.352 -8.321 1.00 . A A . 24 VAL CB 1 1 14 5967 1 1 24 VAL CG1 C 13.815 1.757 -9.244 1.00 . A A . 24 VAL CG1 1 1 14 5968 1 1 24 VAL CG2 C 11.617 0.542 -9.149 1.00 . A A . 24 VAL CG2 1 1 14 5969 1 1 24 VAL H H 11.101 0.419 -6.498 1.00 . A A . 24 VAL H 1 1 14 5970 1 1 24 VAL HA H 13.558 -0.453 -7.522 1.00 . A A . 24 VAL HA 1 1 14 5971 1 1 24 VAL HB H 12.165 2.242 -7.935 1.00 . A A . 24 VAL HB 1 1 14 5972 1 1 24 VAL HG11 H 14.396 0.889 -9.519 1.00 . A A . 24 VAL HG11 1 1 14 5973 1 1 24 VAL HG12 H 13.440 2.225 -10.143 1.00 . A A . 24 VAL HG12 1 1 14 5974 1 1 24 VAL HG13 H 14.460 2.461 -8.738 1.00 . A A . 24 VAL HG13 1 1 14 5975 1 1 24 VAL HG21 H 11.990 -0.452 -9.346 1.00 . A A . 24 VAL HG21 1 1 14 5976 1 1 24 VAL HG22 H 10.687 0.462 -8.610 1.00 . A A . 24 VAL HG22 1 1 14 5977 1 1 24 VAL HG23 H 11.422 1.034 -10.090 1.00 . A A . 24 VAL HG23 1 1 14 5978 1 1 24 VAL N N 12.011 0.166 -6.240 1.00 . A A . 24 VAL N 1 1 14 5979 1 1 24 VAL O O 15.420 0.803 -6.437 1.00 . A A . 24 VAL O 1 1 14 5980 1 1 25 GLY C C 15.936 2.289 -4.179 1.00 . A A . 25 GLY C 1 1 14 5981 1 1 25 GLY CA C 14.856 3.106 -4.900 1.00 . A A . 25 GLY CA 1 1 14 5982 1 1 25 GLY H H 12.964 2.530 -5.709 1.00 . A A . 25 GLY H 1 1 14 5983 1 1 25 GLY HA2 H 15.331 3.814 -5.563 1.00 . A A . 25 GLY HA2 1 1 14 5984 1 1 25 GLY HA3 H 14.289 3.654 -4.161 1.00 . A A . 25 GLY HA3 1 1 14 5985 1 1 25 GLY N N 13.905 2.269 -5.699 1.00 . A A . 25 GLY N 1 1 14 5986 1 1 25 GLY O O 15.687 1.691 -3.151 1.00 . A A . 25 GLY O 1 1 14 5987 1 1 26 SER C C 17.953 0.169 -3.658 1.00 . A A . 26 SER C 1 1 14 5988 1 1 26 SER CA C 18.300 1.559 -4.232 1.00 . A A . 26 SER CA 1 1 14 5989 1 1 26 SER CB C 18.945 2.454 -3.146 1.00 . A A . 26 SER CB 1 1 14 5990 1 1 26 SER H H 17.197 2.802 -5.606 1.00 . A A . 26 SER H 1 1 14 5991 1 1 26 SER HA H 18.997 1.421 -5.046 1.00 . A A . 26 SER HA 1 1 14 5992 1 1 26 SER HB2 H 19.004 3.484 -3.465 1.00 . A A . 26 SER HB2 1 1 14 5993 1 1 26 SER HB3 H 18.420 2.388 -2.204 1.00 . A A . 26 SER HB3 1 1 14 5994 1 1 26 SER HG H 20.345 1.602 -2.101 1.00 . A A . 26 SER HG 1 1 14 5995 1 1 26 SER N N 17.106 2.295 -4.772 1.00 . A A . 26 SER N 1 1 14 5996 1 1 26 SER O O 18.530 -0.256 -2.673 1.00 . A A . 26 SER O 1 1 14 5997 1 1 26 SER OG O 20.258 1.934 -2.998 1.00 . A A . 26 SER OG 1 1 14 5998 1 1 27 ASN C C 16.375 -2.037 -2.387 1.00 . A A . 27 ASN C 1 1 14 5999 1 1 27 ASN CA C 16.530 -1.851 -3.913 1.00 . A A . 27 ASN CA 1 1 14 6000 1 1 27 ASN CB C 17.520 -2.907 -4.501 1.00 . A A . 27 ASN CB 1 1 14 6001 1 1 27 ASN CG C 18.922 -2.780 -3.883 1.00 . A A . 27 ASN CG 1 1 14 6002 1 1 27 ASN H H 16.613 -0.058 -5.091 1.00 . A A . 27 ASN H 1 1 14 6003 1 1 27 ASN HA H 15.561 -1.999 -4.365 1.00 . A A . 27 ASN HA 1 1 14 6004 1 1 27 ASN HB2 H 17.150 -3.905 -4.311 1.00 . A A . 27 ASN HB2 1 1 14 6005 1 1 27 ASN HB3 H 17.602 -2.772 -5.570 1.00 . A A . 27 ASN HB3 1 1 14 6006 1 1 27 ASN HD21 H 19.625 -1.698 -5.391 1.00 . A A . 27 ASN HD21 1 1 14 6007 1 1 27 ASN HD22 H 20.736 -2.020 -4.148 1.00 . A A . 27 ASN HD22 1 1 14 6008 1 1 27 ASN N N 17.017 -0.484 -4.308 1.00 . A A . 27 ASN N 1 1 14 6009 1 1 27 ASN ND2 N 19.837 -2.110 -4.528 1.00 . A A . 27 ASN ND2 1 1 14 6010 1 1 27 ASN O O 16.552 -3.124 -1.871 1.00 . A A . 27 ASN O 1 1 14 6011 1 1 27 ASN OD1 O 19.197 -3.286 -2.812 1.00 . A A . 27 ASN OD1 1 1 14 6012 1 1 28 LYS C C 17.147 -1.259 0.553 1.00 . A A . 28 LYS C 1 1 14 6013 1 1 28 LYS CA C 15.850 -0.941 -0.231 1.00 . A A . 28 LYS CA 1 1 14 6014 1 1 28 LYS CB C 14.739 -1.973 0.168 1.00 . A A . 28 LYS CB 1 1 14 6015 1 1 28 LYS CD C 12.953 -0.439 -0.898 1.00 . A A . 28 LYS CD 1 1 14 6016 1 1 28 LYS CE C 12.536 0.129 0.471 1.00 . A A . 28 LYS CE 1 1 14 6017 1 1 28 LYS CG C 13.493 -1.887 -0.763 1.00 . A A . 28 LYS CG 1 1 14 6018 1 1 28 LYS H H 15.911 -0.117 -2.206 1.00 . A A . 28 LYS H 1 1 14 6019 1 1 28 LYS HA H 15.531 0.053 0.049 1.00 . A A . 28 LYS HA 1 1 14 6020 1 1 28 LYS HB2 H 15.140 -2.975 0.127 1.00 . A A . 28 LYS HB2 1 1 14 6021 1 1 28 LYS HB3 H 14.431 -1.785 1.186 1.00 . A A . 28 LYS HB3 1 1 14 6022 1 1 28 LYS HD2 H 13.692 0.200 -1.358 1.00 . A A . 28 LYS HD2 1 1 14 6023 1 1 28 LYS HD3 H 12.084 -0.462 -1.536 1.00 . A A . 28 LYS HD3 1 1 14 6024 1 1 28 LYS HE2 H 11.943 -0.589 1.017 1.00 . A A . 28 LYS HE2 1 1 14 6025 1 1 28 LYS HE3 H 13.408 0.383 1.056 1.00 . A A . 28 LYS HE3 1 1 14 6026 1 1 28 LYS HG2 H 13.747 -2.263 -1.743 1.00 . A A . 28 LYS HG2 1 1 14 6027 1 1 28 LYS HG3 H 12.714 -2.518 -0.360 1.00 . A A . 28 LYS HG3 1 1 14 6028 1 1 28 LYS HZ1 H 11.621 1.560 -0.739 1.00 . A A . 28 LYS HZ1 1 1 14 6029 1 1 28 LYS HZ2 H 10.781 1.228 0.699 1.00 . A A . 28 LYS HZ2 1 1 14 6030 1 1 28 LYS HZ3 H 12.196 2.167 0.738 1.00 . A A . 28 LYS HZ3 1 1 14 6031 1 1 28 LYS N N 16.043 -0.955 -1.720 1.00 . A A . 28 LYS N 1 1 14 6032 1 1 28 LYS NZ N 11.723 1.364 0.277 1.00 . A A . 28 LYS NZ 1 1 14 6033 1 1 28 LYS O O 18.144 -1.558 -0.087 1.00 . A A . 28 LYS O 1 1 14 6034 1 1 28 LYS OXT O 17.070 -1.182 1.769 1.00 . A A . 28 LYS OXT 1 1 stop_ save_
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