NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
599541 | 2mza | 25478 | cing | 4-filtered-FRED | STAR | entry | full | 83 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mza # This FRED archive file contains, for PDB entry <2mza>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2mza _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mza _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2113.25 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 $Cannabinoid_receptor_1 A . 1 1 stop_ save_ save_Cannabinoid_receptor_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Cannabinoid receptor 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code RSKDLRHAFRXMFPSSE _Entity.Number_of_monomers 17 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 ARG . 1 1 2 SER . 1 1 3 LYS . 1 1 4 ASP . 1 1 5 LEU . 1 1 6 ARG . 1 1 7 HIS . 1 1 8 ALA . 1 1 9 PHE . 1 1 10 ARG . 1 1 11 . $. 1 1 12 MET . 1 1 13 PHE . 1 1 14 PRO . 1 1 15 SER . 1 1 16 SER . 1 1 17 GLU . 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 ARG 1 1 1 1 SER 2 2 1 1 LYS 3 3 1 1 ASP 4 4 1 1 LEU 5 5 1 1 ARG 6 6 1 1 HIS 7 7 1 1 ALA 8 8 1 1 PHE 9 9 1 1 ARG 10 10 1 1 . 11 11 1 1 MET 12 12 1 1 PHE 13 13 1 1 PRO 14 14 1 1 SER 15 15 1 1 SER 16 16 1 1 GLU 17 17 1 1 stop_ save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ARG HA . 1 ARG HA 1 1 1 1 2 1 1 2 SER H . 2 SER H 1 1 2 1 1 1 1 1 ARG QB . 1 ARG QB 1 1 2 1 2 1 1 3 LYS H . 3 LYS H 1 1 3 1 1 1 1 2 SER H . 2 SER H 1 1 3 1 2 1 1 3 LYS H . 3 LYS H 1 1 4 1 1 1 1 2 SER HA . 2 SER HA 1 1 4 1 2 1 1 3 LYS H . 3 LYS H 1 1 5 1 1 1 1 2 SER QB . 2 SER QB 1 1 5 1 2 1 1 3 LYS H . 3 LYS H 1 1 6 1 1 1 1 3 LYS H . 3 LYS H 1 1 6 1 2 1 1 4 ASP H . 4 ASP H 1 1 7 1 1 1 1 3 LYS HA . 3 LYS HA 1 1 7 1 2 1 1 4 ASP H . 4 ASP H 1 1 8 1 1 1 1 3 LYS HA . 3 LYS HA 1 1 8 1 2 1 1 6 ARG QB . 6 ARG QB 1 1 9 1 1 1 1 4 ASP HA . 4 ASP HA 1 1 9 1 2 1 1 6 ARG H . 6 ARG H 1 1 10 1 1 1 1 4 ASP H . 4 ASP H 1 1 10 1 2 1 1 5 LEU H . 5 LEU H 1 1 11 1 1 1 1 4 ASP HA . 4 ASP HA 1 1 11 1 2 1 1 5 LEU H . 5 LEU H 1 1 12 1 1 1 1 4 ASP HB2 . 4 ASP HB2 1 1 12 1 2 1 1 5 LEU H . 5 LEU H 1 1 13 1 1 1 1 4 ASP HB3 . 4 ASP HB3 1 1 13 1 2 1 1 5 LEU H . 5 LEU H 1 1 14 1 1 1 1 4 ASP HA . 4 ASP HA 1 1 14 1 2 1 1 7 HIS QB . 7 HIS QB 1 1 15 1 1 1 1 5 LEU H . 5 LEU H 1 1 15 1 2 1 1 6 ARG H . 6 ARG H 1 1 16 1 1 1 1 5 LEU H . 5 LEU H 1 1 16 1 2 1 1 7 HIS H . 7 HIS H 1 1 17 1 1 1 1 5 LEU HA . 5 LEU HA 1 1 17 1 2 1 1 7 HIS H . 7 HIS H 1 1 18 1 1 1 1 5 LEU HA . 5 LEU HA 1 1 18 1 2 1 1 6 ARG H . 6 ARG H 1 1 19 1 1 1 1 5 LEU QB . 5 LEU QB 1 1 19 1 2 1 1 6 ARG H . 6 ARG H 1 1 20 1 1 1 1 5 LEU HA . 5 LEU HA 1 1 20 1 2 1 1 8 ALA H . 8 ALA H 1 1 21 1 1 1 1 5 LEU HA . 5 LEU HA 1 1 21 1 2 1 1 9 PHE H . 9 PHE H 1 1 22 1 1 1 1 5 LEU HA . 5 LEU HA 1 1 22 1 2 1 1 8 ALA MB . 8 ALA QB 1 1 23 1 1 1 1 6 ARG N . 6 ARG N 1 1 23 1 2 1 1 7 HIS H . 7 HIS H 1 1 24 1 1 1 1 6 ARG H . 6 ARG H 1 1 24 1 2 1 1 7 HIS H . 7 HIS H 1 1 25 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 25 1 2 1 1 7 HIS H . 7 HIS H 1 1 26 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 26 1 2 1 1 9 PHE H . 9 PHE H 1 1 27 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 27 1 2 1 1 8 ALA H . 8 ALA H 1 1 28 1 1 1 1 6 ARG H . 6 ARG H 1 1 28 1 2 1 1 8 ALA H . 8 ALA H 1 1 29 1 1 1 1 6 ARG QB . 6 ARG QB 1 1 29 1 2 1 1 7 HIS H . 7 HIS H 1 1 30 1 1 1 1 7 HIS H . 7 HIS H 1 1 30 1 2 1 1 8 ALA H . 8 ALA H 1 1 31 1 1 1 1 6 ARG HA . 6 ARG HA 1 1 31 1 2 1 1 9 PHE QB . 9 PHE QB 1 1 32 1 1 1 1 7 HIS HA . 7 HIS HA 1 1 32 1 2 1 1 8 ALA H . 8 ALA H 1 1 33 1 1 1 1 7 HIS HA . 7 HIS HA 1 1 33 1 2 1 1 9 PHE H . 9 PHE H 1 1 34 1 1 1 1 7 HIS QB . 7 HIS QB 1 1 34 1 2 1 1 8 ALA H . 8 ALA H 1 1 35 1 1 1 1 7 HIS HA . 7 HIS HA 1 1 35 1 2 1 1 10 ARG H . 10 ARG H 1 1 36 1 1 1 1 7 HIS HA . 7 HIS HA 1 1 36 1 2 1 1 10 ARG QB . 10 ARG QB 1 1 37 1 1 1 1 7 HIS H . 7 HIS H 1 1 37 1 2 1 1 9 PHE H . 9 PHE H 1 1 38 1 1 1 1 8 ALA H . 8 ALA H 1 1 38 1 2 1 1 9 PHE H . 9 PHE H 1 1 39 1 1 1 1 8 ALA HA . 8 ALA HA 1 1 39 1 2 1 1 9 PHE H . 9 PHE H 1 1 40 1 1 1 1 8 ALA HA . 8 ALA HA 1 1 40 1 2 1 1 10 ARG H . 10 ARG H 1 1 41 1 1 1 1 8 ALA H . 8 ALA H 1 1 41 1 2 1 1 10 ARG H . 10 ARG H 1 1 42 1 1 1 1 8 ALA MB . 8 ALA QB 1 1 42 1 2 1 1 9 PHE H . 9 PHE H 1 1 43 1 1 1 1 9 PHE H . 9 PHE H 1 1 43 1 2 1 1 10 ARG H . 10 ARG H 1 1 44 1 1 1 1 9 PHE HA . 9 PHE HA 1 1 44 1 2 1 1 10 ARG H . 10 ARG H 1 1 45 1 1 1 1 9 PHE HB2 . 9 PHE HB2 1 1 45 1 2 1 1 10 ARG H . 10 ARG H 1 1 46 1 1 1 1 9 PHE HB3 . 9 PHE HB3 1 1 46 1 2 1 1 10 ARG H . 10 ARG H 1 1 47 1 1 1 1 9 PHE HA . 9 PHE HA 1 1 47 1 2 1 1 12 MET H . 12 MET H 1 1 48 1 1 1 1 10 ARG H . 10 ARG H 1 1 48 1 2 1 1 12 MET H . 12 MET H 1 1 49 1 1 1 1 10 ARG HA . 10 ARG HA 1 1 49 1 2 1 1 12 MET H . 12 MET H 1 1 50 1 1 1 1 10 ARG HA . 10 ARG HA 1 1 50 1 2 1 1 13 PHE H . 13 PHE H 1 1 51 1 1 1 1 12 MET H . 12 MET H 1 1 51 1 2 1 1 13 PHE H . 13 PHE H 1 1 52 1 1 1 1 12 MET HA . 12 MET HA 1 1 52 1 2 1 1 13 PHE H . 13 PHE H 1 1 53 1 1 1 1 12 MET QB . 12 MET QB 1 1 53 1 2 1 1 13 PHE H . 13 PHE H 1 1 54 1 1 1 1 13 PHE HA . 13 PHE HA 1 1 54 1 2 1 1 15 SER H . 15 SER H 1 1 55 1 1 1 1 13 PHE H . 13 PHE H 1 1 55 1 2 1 1 14 PRO QD . 14 PROO QD 1 1 56 1 1 1 1 14 PRO HA . 14 PROO HA 1 1 56 1 2 1 1 15 SER H . 15 SER H 1 1 57 1 1 1 1 14 PRO QB . 14 PROO QB 1 1 57 1 2 1 1 15 SER H . 15 SER H 1 1 58 1 1 1 1 14 PRO CG . 14 PROO CG 1 1 58 1 2 1 1 14 PRO N . 14 PROO N 1 1 59 1 1 1 1 15 SER H . 15 SER H 1 1 59 1 2 1 1 16 SER H . 16 SER H 1 1 60 1 1 1 1 15 SER HA . 15 SER HA 1 1 60 1 2 1 1 16 SER H . 16 SER H 1 1 61 1 1 1 1 16 SER HA . 16 SER HA 1 1 61 1 2 1 1 17 GLU H . 17 GLU H 1 1 62 1 1 1 1 16 SER H . 16 SER H 1 1 62 1 2 1 1 17 GLU H . 17 GLU H 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 3.5 1 1 2 1 . . . . . . . 4.5 1 1 3 1 . . . . . . . 2.8 1 1 4 1 . . . . . . . 3.5 1 1 5 1 . . . . . . . 4.0 1 1 6 1 . . . . . . . 2.8 1 1 7 1 . . . . . . . 3.5 1 1 8 1 . . . . . . . 4.5 1 1 9 1 . . . . . . . 5.0 1 1 10 1 . . . . . . . 2.8 1 1 11 1 . . . . . . . 3.5 1 1 12 1 . . . . . . . 3.5 1 1 13 1 . . . . . . . 3.5 1 1 14 1 . . . . . . . 4.5 1 1 15 1 . . . . . . . 2.8 1 1 16 1 . . . . . . . 4.2 1 1 17 1 . . . . . . . 3.8 1 1 18 1 . . . . . . . 3.5 1 1 19 1 . . . . . . . 3.5 1 1 20 1 . . . . . . . 4.5 1 1 21 1 . . . . . . . 5.0 1 1 22 1 . . . . . . . 4.5 1 1 23 1 . . . . . . . 2.8 1 1 24 1 . . . . . . . 2.8 1 1 25 1 . . . . . . . 3.5 1 1 26 1 . . . . . . . 4.2 1 1 27 1 . . . . . . . 3.8 1 1 28 1 . . . . . . . 4.2 1 1 29 1 . . . . . . . 3.5 1 1 30 1 . . . . . . . 2.8 1 1 31 1 . . . . . . . 4.5 1 1 32 1 . . . . . . . 3.4 1 1 33 1 . . . . . . . 3.8 1 1 34 1 . . . . . . . 3.8 1 1 35 1 . . . . . . . 4.2 1 1 36 1 . . . . . . . 4.5 1 1 37 1 . . . . . . . 4.2 1 1 38 1 . . . . . . . 2.8 1 1 39 1 . . . . . . . 3.5 1 1 40 1 . . . . . . . 3.8 1 1 41 1 . . . . . . . 4.2 1 1 42 1 . . . . . . . 3.5 1 1 43 1 . . . . . . . 2.8 1 1 44 1 . . . . . . . 3.5 1 1 45 1 . . . . . . . 4.0 1 1 46 1 . . . . . . . 4.0 1 1 47 1 . . . . . . . 4.2 1 1 48 1 . . . . . . . 4.2 1 1 49 1 . . . . . . . 4.2 1 1 50 1 . . . . . . . 4.5 1 1 51 1 . . . . . . . 2.8 1 1 52 1 . . . . . . . 3.5 1 1 53 1 . . . . . . . 3.5 1 1 54 1 . . . . . . . 4.2 1 1 55 1 . . . . . . . 4.5 1 1 56 1 . . . . . . . 3.5 1 1 57 1 . . . . . . . 4.0 1 1 58 1 . . . . . . . 2.33 1 1 59 1 . . . . . . . 2.8 1 1 60 1 . . . . . . . 3.5 1 1 61 1 . . . . . . . 3.5 1 1 62 1 . . . . . . . 2.8 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 5 LEU O . 5 LEU O 1 2 1 1 2 1 1 8 ALA H . 8 ALA H 1 2 2 1 1 1 1 5 LEU O . 5 LEU O 1 2 2 1 2 1 1 8 ALA N . 8 ALA N 1 2 3 1 1 1 1 6 ARG O . 6 ARG O 1 2 3 1 2 1 1 9 PHE H . 9 PHE H 1 2 4 1 1 1 1 6 ARG O . 6 ARG O 1 2 4 1 2 1 1 9 PHE N . 9 PHE N 1 2 5 1 1 1 1 7 HIS O . 7 HIS O 1 2 5 1 2 1 1 10 ARG H . 10 ARG H 1 2 6 1 1 1 1 7 HIS O . 7 HIS O 1 2 6 1 2 1 1 10 ARG N . 10 ARG N 1 2 7 1 1 1 1 10 ARG O . 10 ARG O 1 2 7 1 2 1 1 13 PHE H . 13 PHE H 1 2 8 1 1 1 1 10 ARG O . 10 ARG O 1 2 8 1 2 1 1 13 PHE N . 13 PHE N 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 1.8 1 2 2 1 . . . . . . . 2.7 1 2 3 1 . . . . . . . 1.8 1 2 4 1 . . . . . . . 2.7 1 2 5 1 . . . . . . . 1.8 1 2 6 1 . . . . . . . 2.7 1 2 7 1 . . . . . . . 1.8 1 2 8 1 . . . . . . . 2.7 1 2 stop_ save_ save_DYANA/DIANA_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 1 ARG C 1 1 2 SER N 1 1 2 SER CA 1 1 2 SER C -89.99999 -70.0 . 2 SER . . 2 SER . . 2 SER . . 2 SER . 1 1 2 PHI 1 1 2 SER C 1 1 3 LYS N 1 1 3 LYS CA 1 1 3 LYS C -89.99999 -70.0 . 3 LYS . . 3 LYS . . 3 LYS . . 3 LYS . 1 1 3 PHI 1 1 3 LYS C 1 1 4 ASP N 1 1 4 ASP CA 1 1 4 ASP C -89.99999 -70.0 . 4 ASP . . 4 ASP . . 4 ASP . . 4 ASP . 1 1 4 PHI 1 1 4 ASP C 1 1 5 LEU N 1 1 5 LEU CA 1 1 5 LEU C -75.0 -55.0 . 5 LEU . . 5 LEU . . 5 LEU . . 5 LEU . 1 1 5 PHI 1 1 5 LEU C 1 1 6 ARG N 1 1 6 ARG CA 1 1 6 ARG C -75.0 -55.0 . 6 ARG . . 6 ARG . . 6 ARG . . 6 ARG . 1 1 6 PHI 1 1 6 ARG C 1 1 7 HIS N 1 1 7 HIS CA 1 1 7 HIS C -75.0 -55.0 . 7 HIS . . 7 HIS . . 7 HIS . . 7 HIS . 1 1 7 PHI 1 1 7 HIS C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -75.0 -55.0 . 8 ALA . . 8 ALA . . 8 ALA . . 8 ALA . 1 1 8 PHI 1 1 8 ALA C 1 1 9 PHE N 1 1 9 PHE CA 1 1 9 PHE C -75.0 -55.0 . 9 PHE . . 9 PHE . . 9 PHE . . 9 PHE . 1 1 9 PHI 1 1 9 PHE C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -75.0 -55.0 . 10 ARG . . 10 ARG . . 10 ARG . . 10 ARG . 1 1 10 PHI 1 1 12 MET C 1 1 13 PHE N 1 1 13 PHE CA 1 1 13 PHE C -89.99999 -70.0 . 13 PHE . . 13 PHE . . 13 PHE . . 13 PHE . 1 1 11 PHI 1 1 14 PRO C 1 1 15 SER N 1 1 15 SER CA 1 1 15 SER C -89.99999 -70.0 . 15 SER . . 15 SER . . 15 SER . . 15 SER . 1 1 12 PHI 1 1 15 SER C 1 1 16 SER N 1 1 16 SER CA 1 1 16 SER C -89.99999 -70.0 . 16 SER . . 16 SER . . 16 SER . . 16 SER . 1 1 13 PHI 1 1 16 SER C 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU C -89.99999 -70.0 . 17 GLU . . 17 GLU . . 17 GLU . . 17 GLU . 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 ARG C C 2.202 1.411 -1.813 1.00 . A A . 1 ARG C 1 1 1 2 1 1 1 ARG CA C 2.093 0.000 -1.242 1.00 . A A . 1 ARG CA 1 1 1 3 1 1 1 ARG CB C 1.440 -0.928 -2.267 1.00 . A A . 1 ARG CB 1 1 1 4 1 1 1 ARG CD C 3.058 -2.851 -2.237 1.00 . A A . 1 ARG CD 1 1 1 5 1 1 1 ARG CG C 1.630 -2.405 -1.961 1.00 . A A . 1 ARG CG 1 1 1 6 1 1 1 ARG CZ C 4.902 -3.960 -1.049 1.00 . A A . 1 ARG CZ 1 1 1 7 1 1 1 ARG H1 H 1.807 0.001 0.855 1.00 . A A . 1 ARG H1 1 1 1 8 1 1 1 ARG HA H 3.085 -0.364 -1.021 1.00 . A A . 1 ARG HA 1 1 1 9 1 1 1 ARG HB2 H 0.379 -0.724 -2.297 1.00 . A A . 1 ARG HB2 1 1 1 10 1 1 1 ARG HB3 H 1.864 -0.727 -3.239 1.00 . A A . 1 ARG HB3 1 1 1 11 1 1 1 ARG HD2 H 3.058 -3.494 -3.104 1.00 . A A . 1 ARG HD2 1 1 1 12 1 1 1 ARG HD3 H 3.661 -1.978 -2.436 1.00 . A A . 1 ARG HD3 1 1 1 13 1 1 1 ARG HE H 3.040 -3.790 -0.356 1.00 . A A . 1 ARG HE 1 1 1 14 1 1 1 ARG HG2 H 1.406 -2.579 -0.919 1.00 . A A . 1 ARG HG2 1 1 1 15 1 1 1 ARG HG3 H 0.957 -2.981 -2.578 1.00 . A A . 1 ARG HG3 1 1 1 16 1 1 1 ARG HH11 H 5.392 -3.191 -2.852 1.00 . A A . 1 ARG HH11 1 1 1 17 1 1 1 ARG HH12 H 6.684 -3.975 -2.004 1.00 . A A . 1 ARG HH12 1 1 1 18 1 1 1 ARG HH21 H 4.732 -4.826 0.770 1.00 . A A . 1 ARG HH21 1 1 1 19 1 1 1 ARG HH22 H 6.307 -4.906 0.055 1.00 . A A . 1 ARG HH22 1 1 1 20 1 1 1 ARG N N 1.329 0.000 0.000 1.00 . A A . 1 ARG N 1 1 1 21 1 1 1 ARG NE N 3.632 -3.578 -1.107 1.00 . A A . 1 ARG NE 1 1 1 22 1 1 1 ARG NH1 N 5.727 -3.687 -2.051 1.00 . A A . 1 ARG NH1 1 1 1 23 1 1 1 ARG NH2 N 5.351 -4.618 0.013 1.00 . A A . 1 ARG NH2 1 1 1 24 1 1 1 ARG O O 1.662 2.363 -1.250 1.00 . A A . 1 ARG O 1 1 1 25 1 1 2 SER C C 1.914 3.151 -4.500 1.00 . A A . 2 SER C 1 1 1 26 1 1 2 SER CA C 3.088 2.831 -3.580 1.00 . A A . 2 SER CA 1 1 1 27 1 1 2 SER CB C 4.394 2.847 -4.376 1.00 . A A . 2 SER CB 1 1 1 28 1 1 2 SER H H 3.311 0.740 -3.336 1.00 . A A . 2 SER H 1 1 1 29 1 1 2 SER HA H 3.139 3.583 -2.806 1.00 . A A . 2 SER HA 1 1 1 30 1 1 2 SER HB2 H 4.643 3.865 -4.635 1.00 . A A . 2 SER HB2 1 1 1 31 1 1 2 SER HB3 H 5.185 2.426 -3.773 1.00 . A A . 2 SER HB3 1 1 1 32 1 1 2 SER HG H 5.091 2.149 -6.069 1.00 . A A . 2 SER HG 1 1 1 33 1 1 2 SER N N 2.904 1.537 -2.934 1.00 . A A . 2 SER N 1 1 1 34 1 1 2 SER O O 1.553 4.313 -4.686 1.00 . A A . 2 SER O 1 1 1 35 1 1 2 SER OG O 4.274 2.089 -5.568 1.00 . A A . 2 SER OG 1 1 1 36 1 1 3 LYS C C -1.110 2.454 -5.191 1.00 . A A . 3 LYS C 1 1 1 37 1 1 3 LYS CA C 0.186 2.277 -5.976 1.00 . A A . 3 LYS CA 1 1 1 38 1 1 3 LYS CB C 0.069 1.070 -6.910 1.00 . A A . 3 LYS CB 1 1 1 39 1 1 3 LYS CD C 1.529 1.863 -8.793 1.00 . A A . 3 LYS CD 1 1 1 40 1 1 3 LYS CE C 2.998 2.227 -8.943 1.00 . A A . 3 LYS CE 1 1 1 41 1 1 3 LYS CG C 1.324 0.805 -7.722 1.00 . A A . 3 LYS CG 1 1 1 42 1 1 3 LYS H H 1.654 1.207 -4.888 1.00 . A A . 3 LYS H 1 1 1 43 1 1 3 LYS HA H 0.360 3.163 -6.567 1.00 . A A . 3 LYS HA 1 1 1 44 1 1 3 LYS HB2 H -0.144 0.192 -6.318 1.00 . A A . 3 LYS HB2 1 1 1 45 1 1 3 LYS HB3 H -0.749 1.239 -7.595 1.00 . A A . 3 LYS HB3 1 1 1 46 1 1 3 LYS HD2 H 1.166 1.483 -9.737 1.00 . A A . 3 LYS HD2 1 1 1 47 1 1 3 LYS HD3 H 0.973 2.749 -8.522 1.00 . A A . 3 LYS HD3 1 1 1 48 1 1 3 LYS HE2 H 3.070 3.251 -9.276 1.00 . A A . 3 LYS HE2 1 1 1 49 1 1 3 LYS HE3 H 3.481 2.126 -7.982 1.00 . A A . 3 LYS HE3 1 1 1 50 1 1 3 LYS HG2 H 2.178 0.808 -7.060 1.00 . A A . 3 LYS HG2 1 1 1 51 1 1 3 LYS HG3 H 1.238 -0.163 -8.196 1.00 . A A . 3 LYS HG3 1 1 1 52 1 1 3 LYS HZ1 H 3.024 1.045 -10.666 1.00 . A A . 3 LYS HZ1 1 1 1 53 1 1 3 LYS HZ2 H 4.069 0.506 -9.449 1.00 . A A . 3 LYS HZ2 1 1 1 54 1 1 3 LYS HZ3 H 4.476 1.862 -10.374 1.00 . A A . 3 LYS HZ3 1 1 1 55 1 1 3 LYS N N 1.321 2.110 -5.075 1.00 . A A . 3 LYS N 1 1 1 56 1 1 3 LYS NZ N 3.690 1.349 -9.927 1.00 . A A . 3 LYS NZ 1 1 1 57 1 1 3 LYS O O -2.060 3.070 -5.675 1.00 . A A . 3 LYS O 1 1 1 58 1 1 4 ASP C C -2.438 3.411 -2.526 1.00 . A A . 4 ASP C 1 1 1 59 1 1 4 ASP CA C -2.319 2.014 -3.126 1.00 . A A . 4 ASP CA 1 1 1 60 1 1 4 ASP CB C -2.259 0.970 -2.010 1.00 . A A . 4 ASP CB 1 1 1 61 1 1 4 ASP CG C -3.325 -0.097 -2.157 1.00 . A A . 4 ASP CG 1 1 1 62 1 1 4 ASP H H -0.351 1.434 -3.649 1.00 . A A . 4 ASP H 1 1 1 63 1 1 4 ASP HA H -3.188 1.823 -3.738 1.00 . A A . 4 ASP HA 1 1 1 64 1 1 4 ASP HB2 H -1.291 0.490 -2.027 1.00 . A A . 4 ASP HB2 1 1 1 65 1 1 4 ASP HB3 H -2.395 1.462 -1.058 1.00 . A A . 4 ASP HB3 1 1 1 66 1 1 4 ASP N N -1.141 1.913 -3.979 1.00 . A A . 4 ASP N 1 1 1 67 1 1 4 ASP O O -3.538 3.878 -2.224 1.00 . A A . 4 ASP O 1 1 1 68 1 1 4 ASP OD1 O -4.523 0.248 -2.085 1.00 . A A . 4 ASP OD1 1 1 1 69 1 1 4 ASP OD2 O -2.963 -1.278 -2.343 1.00 . A A . 4 ASP OD2 1 1 1 70 1 1 5 LEU C C -1.753 6.448 -2.812 1.00 . A A . 5 LEU C 1 1 1 71 1 1 5 LEU CA C -1.276 5.420 -1.791 1.00 . A A . 5 LEU CA 1 1 1 72 1 1 5 LEU CB C 0.136 5.771 -1.319 1.00 . A A . 5 LEU CB 1 1 1 73 1 1 5 LEU CD1 C -0.344 7.362 0.558 1.00 . A A . 5 LEU CD1 1 1 1 74 1 1 5 LEU CD2 C 1.816 7.523 -0.693 1.00 . A A . 5 LEU CD2 1 1 1 75 1 1 5 LEU CG C 0.334 7.193 -0.793 1.00 . A A . 5 LEU CG 1 1 1 76 1 1 5 LEU H H -0.456 3.652 -2.616 1.00 . A A . 5 LEU H 1 1 1 77 1 1 5 LEU HA H -1.945 5.435 -0.943 1.00 . A A . 5 LEU HA 1 1 1 78 1 1 5 LEU HB2 H 0.399 5.086 -0.527 1.00 . A A . 5 LEU HB2 1 1 1 79 1 1 5 LEU HB3 H 0.808 5.629 -2.153 1.00 . A A . 5 LEU HB3 1 1 1 80 1 1 5 LEU HD11 H 0.385 7.675 1.290 1.00 . A A . 5 LEU HD11 1 1 1 81 1 1 5 LEU HD12 H -0.779 6.421 0.863 1.00 . A A . 5 LEU HD12 1 1 1 82 1 1 5 LEU HD13 H -1.120 8.108 0.480 1.00 . A A . 5 LEU HD13 1 1 1 83 1 1 5 LEU HD21 H 1.958 8.585 -0.826 1.00 . A A . 5 LEU HD21 1 1 1 84 1 1 5 LEU HD22 H 2.356 6.988 -1.461 1.00 . A A . 5 LEU HD22 1 1 1 85 1 1 5 LEU HD23 H 2.186 7.228 0.279 1.00 . A A . 5 LEU HD23 1 1 1 86 1 1 5 LEU HG H -0.119 7.891 -1.483 1.00 . A A . 5 LEU HG 1 1 1 87 1 1 5 LEU N N -1.300 4.075 -2.356 1.00 . A A . 5 LEU N 1 1 1 88 1 1 5 LEU O O -2.284 7.498 -2.449 1.00 . A A . 5 LEU O 1 1 1 89 1 1 6 ARG C C -3.461 7.357 -5.062 1.00 . A A . 6 ARG C 1 1 1 90 1 1 6 ARG CA C -1.973 7.034 -5.163 1.00 . A A . 6 ARG CA 1 1 1 91 1 1 6 ARG CB C -1.668 6.408 -6.525 1.00 . A A . 6 ARG CB 1 1 1 92 1 1 6 ARG CD C 0.799 6.882 -6.593 1.00 . A A . 6 ARG CD 1 1 1 93 1 1 6 ARG CG C -0.542 7.100 -7.276 1.00 . A A . 6 ARG CG 1 1 1 94 1 1 6 ARG CZ C 3.076 7.806 -6.669 1.00 . A A . 6 ARG CZ 1 1 1 95 1 1 6 ARG H H -1.133 5.286 -4.317 1.00 . A A . 6 ARG H 1 1 1 96 1 1 6 ARG HA H -1.411 7.951 -5.064 1.00 . A A . 6 ARG HA 1 1 1 97 1 1 6 ARG HB2 H -1.391 5.374 -6.379 1.00 . A A . 6 ARG HB2 1 1 1 98 1 1 6 ARG HB3 H -2.558 6.451 -7.135 1.00 . A A . 6 ARG HB3 1 1 1 99 1 1 6 ARG HD2 H 0.663 6.966 -5.525 1.00 . A A . 6 ARG HD2 1 1 1 100 1 1 6 ARG HD3 H 1.153 5.891 -6.834 1.00 . A A . 6 ARG HD3 1 1 1 101 1 1 6 ARG HE H 1.496 8.590 -7.600 1.00 . A A . 6 ARG HE 1 1 1 102 1 1 6 ARG HG2 H -0.492 6.703 -8.278 1.00 . A A . 6 ARG HG2 1 1 1 103 1 1 6 ARG HG3 H -0.748 8.160 -7.316 1.00 . A A . 6 ARG HG3 1 1 1 104 1 1 6 ARG HH11 H 2.876 6.128 -5.561 1.00 . A A . 6 ARG HH11 1 1 1 105 1 1 6 ARG HH12 H 4.476 6.790 -5.623 1.00 . A A . 6 ARG HH12 1 1 1 106 1 1 6 ARG HH21 H 3.599 9.471 -7.690 1.00 . A A . 6 ARG HH21 1 1 1 107 1 1 6 ARG HH22 H 4.886 8.691 -6.834 1.00 . A A . 6 ARG HH22 1 1 1 108 1 1 6 ARG N N -1.562 6.138 -4.090 1.00 . A A . 6 ARG N 1 1 1 109 1 1 6 ARG NE N 1.797 7.859 -7.022 1.00 . A A . 6 ARG NE 1 1 1 110 1 1 6 ARG NH1 N 3.512 6.828 -5.887 1.00 . A A . 6 ARG NH1 1 1 1 111 1 1 6 ARG NH2 N 3.923 8.732 -7.100 1.00 . A A . 6 ARG NH2 1 1 1 112 1 1 6 ARG O O -3.897 8.448 -5.429 1.00 . A A . 6 ARG O 1 1 1 113 1 1 7 HIS C C -5.988 7.479 -3.218 1.00 . A A . 7 HIS C 1 1 1 114 1 1 7 HIS CA C -5.676 6.582 -4.412 1.00 . A A . 7 HIS CA 1 1 1 115 1 1 7 HIS CB C -6.367 5.229 -4.242 1.00 . A A . 7 HIS CB 1 1 1 116 1 1 7 HIS CD2 C -6.686 3.123 -5.723 1.00 . A A . 7 HIS CD2 1 1 1 117 1 1 7 HIS CE1 C -6.461 4.075 -7.686 1.00 . A A . 7 HIS CE1 1 1 1 118 1 1 7 HIS CG C -6.465 4.442 -5.513 1.00 . A A . 7 HIS CG 1 1 1 119 1 1 7 HIS H H -3.830 5.551 -4.286 1.00 . A A . 7 HIS H 1 1 1 120 1 1 7 HIS HA H -6.045 7.055 -5.309 1.00 . A A . 7 HIS HA 1 1 1 121 1 1 7 HIS HB2 H -5.814 4.636 -3.528 1.00 . A A . 7 HIS HB2 1 1 1 122 1 1 7 HIS HB3 H -7.370 5.388 -3.871 1.00 . A A . 7 HIS HB3 1 1 1 123 1 1 7 HIS HD1 H -6.158 5.958 -6.944 1.00 . A A . 7 HIS HD1 1 1 1 124 1 1 7 HIS HD2 H -6.840 2.369 -4.964 1.00 . A A . 7 HIS HD2 1 1 1 125 1 1 7 HIS HE1 H -6.402 4.228 -8.753 1.00 . A A . 7 HIS HE1 1 1 1 126 1 1 7 HIS N N -4.236 6.400 -4.562 1.00 . A A . 7 HIS N 1 1 1 127 1 1 7 HIS ND1 N -6.327 5.010 -6.762 1.00 . A A . 7 HIS ND1 1 1 1 128 1 1 7 HIS NE2 N -6.679 2.921 -7.082 1.00 . A A . 7 HIS NE2 1 1 1 129 1 1 7 HIS O O -7.081 8.037 -3.119 1.00 . A A . 7 HIS O 1 1 1 130 1 1 8 ALA C C -5.091 9.924 -1.477 1.00 . A A . 8 ALA C 1 1 1 131 1 1 8 ALA CA C -5.195 8.443 -1.130 1.00 . A A . 8 ALA CA 1 1 1 132 1 1 8 ALA CB C -4.165 8.074 -0.072 1.00 . A A . 8 ALA CB 1 1 1 133 1 1 8 ALA H H -4.174 7.143 -2.450 1.00 . A A . 8 ALA H 1 1 1 134 1 1 8 ALA HA H -6.177 8.247 -0.725 1.00 . A A . 8 ALA HA 1 1 1 135 1 1 8 ALA HB1 H -4.664 7.902 0.870 1.00 . A A . 8 ALA HB1 1 1 1 136 1 1 8 ALA HB2 H -3.645 7.177 -0.374 1.00 . A A . 8 ALA HB2 1 1 1 137 1 1 8 ALA HB3 H -3.457 8.881 0.037 1.00 . A A . 8 ALA HB3 1 1 1 138 1 1 8 ALA N N -5.023 7.613 -2.315 1.00 . A A . 8 ALA N 1 1 1 139 1 1 8 ALA O O -5.604 10.779 -0.755 1.00 . A A . 8 ALA O 1 1 1 140 1 1 9 PHE C C -5.597 12.240 -3.355 1.00 . A A . 9 PHE C 1 1 1 141 1 1 9 PHE CA C -4.251 11.600 -3.030 1.00 . A A . 9 PHE CA 1 1 1 142 1 1 9 PHE CB C -3.338 11.654 -4.257 1.00 . A A . 9 PHE CB 1 1 1 143 1 1 9 PHE CD1 C -1.617 13.310 -3.490 1.00 . A A . 9 PHE CD1 1 1 1 144 1 1 9 PHE CD2 C -2.889 13.821 -5.440 1.00 . A A . 9 PHE CD2 1 1 1 145 1 1 9 PHE CE1 C -0.935 14.506 -3.617 1.00 . A A . 9 PHE CE1 1 1 1 146 1 1 9 PHE CE2 C -2.211 15.017 -5.573 1.00 . A A . 9 PHE CE2 1 1 1 147 1 1 9 PHE CG C -2.600 12.954 -4.399 1.00 . A A . 9 PHE CG 1 1 1 148 1 1 9 PHE CZ C -1.233 15.361 -4.660 1.00 . A A . 9 PHE CZ 1 1 1 149 1 1 9 PHE H H -4.037 9.496 -3.122 1.00 . A A . 9 PHE H 1 1 1 150 1 1 9 PHE HA H -3.789 12.150 -2.224 1.00 . A A . 9 PHE HA 1 1 1 151 1 1 9 PHE HB2 H -2.607 10.863 -4.188 1.00 . A A . 9 PHE HB2 1 1 1 152 1 1 9 PHE HB3 H -3.934 11.511 -5.146 1.00 . A A . 9 PHE HB3 1 1 1 153 1 1 9 PHE HD1 H -1.383 12.642 -2.673 1.00 . A A . 9 PHE HD1 1 1 1 154 1 1 9 PHE HD2 H -3.654 13.554 -6.155 1.00 . A A . 9 PHE HD2 1 1 1 155 1 1 9 PHE HE1 H -0.171 14.771 -2.901 1.00 . A A . 9 PHE HE1 1 1 1 156 1 1 9 PHE HE2 H -2.446 15.684 -6.389 1.00 . A A . 9 PHE HE2 1 1 1 157 1 1 9 PHE HZ H -0.701 16.295 -4.762 1.00 . A A . 9 PHE HZ 1 1 1 158 1 1 9 PHE N N -4.423 10.222 -2.587 1.00 . A A . 9 PHE N 1 1 1 159 1 1 9 PHE O O -5.755 13.458 -3.266 1.00 . A A . 9 PHE O 1 1 1 160 1 1 10 ARG C C -8.673 12.277 -2.815 1.00 . A A . 10 ARG C 1 1 1 161 1 1 10 ARG CA C -7.897 11.894 -4.072 1.00 . A A . 10 ARG CA 1 1 1 162 1 1 10 ARG CB C -8.666 10.827 -4.853 1.00 . A A . 10 ARG CB 1 1 1 163 1 1 10 ARG CD C -10.574 10.942 -6.485 1.00 . A A . 10 ARG CD 1 1 1 164 1 1 10 ARG CG C -9.114 11.286 -6.231 1.00 . A A . 10 ARG CG 1 1 1 165 1 1 10 ARG CZ C -11.964 10.324 -8.416 1.00 . A A . 10 ARG CZ 1 1 1 166 1 1 10 ARG H H -6.377 10.449 -3.783 1.00 . A A . 10 ARG H 1 1 1 167 1 1 10 ARG HA H -7.784 12.770 -4.692 1.00 . A A . 10 ARG HA 1 1 1 168 1 1 10 ARG HB2 H -8.033 9.960 -4.975 1.00 . A A . 10 ARG HB2 1 1 1 169 1 1 10 ARG HB3 H -9.542 10.546 -4.288 1.00 . A A . 10 ARG HB3 1 1 1 170 1 1 10 ARG HD2 H -10.778 9.968 -6.067 1.00 . A A . 10 ARG HD2 1 1 1 171 1 1 10 ARG HD3 H -11.193 11.680 -5.997 1.00 . A A . 10 ARG HD3 1 1 1 172 1 1 10 ARG HE H -10.274 11.379 -8.519 1.00 . A A . 10 ARG HE 1 1 1 173 1 1 10 ARG HG2 H -8.990 12.356 -6.302 1.00 . A A . 10 ARG HG2 1 1 1 174 1 1 10 ARG HG3 H -8.504 10.800 -6.978 1.00 . A A . 10 ARG HG3 1 1 1 175 1 1 10 ARG HH11 H -12.654 9.679 -6.631 1.00 . A A . 10 ARG HH11 1 1 1 176 1 1 10 ARG HH12 H -13.625 9.251 -8.000 1.00 . A A . 10 ARG HH12 1 1 1 177 1 1 10 ARG HH21 H -11.543 10.820 -10.330 1.00 . A A . 10 ARG HH21 1 1 1 178 1 1 10 ARG HH22 H -12.991 9.899 -10.104 1.00 . A A . 10 ARG HH22 1 1 1 179 1 1 10 ARG N N -6.564 11.410 -3.732 1.00 . A A . 10 ARG N 1 1 1 180 1 1 10 ARG NE N -10.891 10.923 -7.910 1.00 . A A . 10 ARG NE 1 1 1 181 1 1 10 ARG NH1 N -12.817 9.700 -7.617 1.00 . A A . 10 ARG NH1 1 1 1 182 1 1 10 ARG NH2 N -12.184 10.350 -9.724 1.00 . A A . 10 ARG NH2 1 1 1 183 1 1 10 ARG O O -9.559 13.128 -2.891 1.00 . A A . 10 ARG O 1 1 1 184 1 1 11 . C C -8.827 13.394 -0.053 1.00 . A A . 11 SEP C 1 1 1 185 1 1 11 . CA C -9.018 11.942 -0.409 1.00 . A A . 11 SEP CA 1 1 1 186 1 1 11 . CB C -8.565 10.928 0.683 1.00 . A A . 11 SEP CB 1 1 1 187 1 1 11 . H H -7.591 10.960 -1.704 1.00 . A A . 11 SEP H 1 1 1 188 1 1 11 . HA H -10.098 11.783 -0.589 1.00 . A A . 11 SEP HA 1 1 1 189 1 1 11 . HB2 H -8.686 9.878 0.359 1.00 . A A . 11 SEP HB2 1 1 1 190 1 1 11 . HB3 H -7.482 11.017 0.908 1.00 . A A . 11 SEP HB3 1 1 1 191 1 1 11 . N N -8.328 11.650 -1.700 1.00 . A A . 11 SEP N 1 1 1 192 1 1 11 . O O -9.713 14.067 0.473 1.00 . A A . 11 SEP O 1 1 1 193 1 1 11 . O1P O -9.085 12.061 4.267 1.00 . A A . 11 SEP O1P 1 1 1 194 1 1 11 . O2P O -9.222 9.603 3.947 1.00 . A A . 11 SEP O2P 1 1 1 195 1 1 11 . O3P O -7.143 10.822 3.259 1.00 . A A . 11 SEP O3P 1 1 1 196 1 1 11 . OG O -9.320 11.109 1.904 1.00 . A A . 11 SEP OG 1 1 1 197 1 1 11 . P P -8.660 10.905 3.368 1.00 . A A . 11 SEP P 1 1 1 198 1 1 12 MET C C -8.017 16.216 -1.018 1.00 . A A . 12 MET C 1 1 1 199 1 1 12 MET CA C -7.278 15.271 -0.076 1.00 . A A . 12 MET CA 1 1 1 200 1 1 12 MET CB C -5.768 15.475 -0.210 1.00 . A A . 12 MET CB 1 1 1 201 1 1 12 MET CE C -2.611 17.144 1.495 1.00 . A A . 12 MET CE 1 1 1 202 1 1 12 MET CG C -5.204 16.498 0.763 1.00 . A A . 12 MET CG 1 1 1 203 1 1 12 MET H H -6.963 13.297 -0.771 1.00 . A A . 12 MET H 1 1 1 204 1 1 12 MET HA H -7.573 15.490 0.939 1.00 . A A . 12 MET HA 1 1 1 205 1 1 12 MET HB2 H -5.272 14.532 -0.035 1.00 . A A . 12 MET HB2 1 1 1 206 1 1 12 MET HB3 H -5.549 15.807 -1.214 1.00 . A A . 12 MET HB3 1 1 1 207 1 1 12 MET HE1 H -1.625 16.752 1.699 1.00 . A A . 12 MET HE1 1 1 1 208 1 1 12 MET HE2 H -2.653 17.497 0.475 1.00 . A A . 12 MET HE2 1 1 1 209 1 1 12 MET HE3 H -2.820 17.961 2.169 1.00 . A A . 12 MET HE3 1 1 1 210 1 1 12 MET HG2 H -4.861 17.356 0.205 1.00 . A A . 12 MET HG2 1 1 1 211 1 1 12 MET HG3 H -5.990 16.802 1.439 1.00 . A A . 12 MET HG3 1 1 1 212 1 1 12 MET N N -7.628 13.882 -0.353 1.00 . A A . 12 MET N 1 1 1 213 1 1 12 MET O O -8.254 17.378 -0.687 1.00 . A A . 12 MET O 1 1 1 214 1 1 12 MET SD S -3.827 15.850 1.730 1.00 . A A . 12 MET SD 1 1 1 215 1 1 13 PHE C C -10.513 16.804 -2.726 1.00 . A A . 13 PHE C 1 1 1 216 1 1 13 PHE CA C -9.088 16.511 -3.184 1.00 . A A . 13 PHE CA 1 1 1 217 1 1 13 PHE CB C -9.112 15.788 -4.532 1.00 . A A . 13 PHE CB 1 1 1 218 1 1 13 PHE CD1 C -6.814 16.542 -5.204 1.00 . A A . 13 PHE CD1 1 1 1 219 1 1 13 PHE CD2 C -8.573 16.703 -6.806 1.00 . A A . 13 PHE CD2 1 1 1 220 1 1 13 PHE CE1 C -5.925 17.065 -6.124 1.00 . A A . 13 PHE CE1 1 1 1 221 1 1 13 PHE CE2 C -7.689 17.226 -7.730 1.00 . A A . 13 PHE CE2 1 1 1 222 1 1 13 PHE CG C -8.147 16.356 -5.534 1.00 . A A . 13 PHE CG 1 1 1 223 1 1 13 PHE CZ C -6.363 17.406 -7.389 1.00 . A A . 13 PHE CZ 1 1 1 224 1 1 13 PHE H H -8.159 14.777 -2.399 1.00 . A A . 13 PHE H 1 1 1 225 1 1 13 PHE HA H -8.559 17.445 -3.295 1.00 . A A . 13 PHE HA 1 1 1 226 1 1 13 PHE HB2 H -8.858 14.749 -4.381 1.00 . A A . 13 PHE HB2 1 1 1 227 1 1 13 PHE HB3 H -10.104 15.855 -4.951 1.00 . A A . 13 PHE HB3 1 1 1 228 1 1 13 PHE HD1 H -6.471 16.274 -4.216 1.00 . A A . 13 PHE HD1 1 1 1 229 1 1 13 PHE HD2 H -9.611 16.562 -7.074 1.00 . A A . 13 PHE HD2 1 1 1 230 1 1 13 PHE HE1 H -4.889 17.204 -5.855 1.00 . A A . 13 PHE HE1 1 1 1 231 1 1 13 PHE HE2 H -8.034 17.491 -8.718 1.00 . A A . 13 PHE HE2 1 1 1 232 1 1 13 PHE HZ H -5.670 17.815 -8.109 1.00 . A A . 13 PHE HZ 1 1 1 233 1 1 13 PHE N N -8.377 15.711 -2.193 1.00 . A A . 13 PHE N 1 1 1 234 1 1 13 PHE O O -11.051 16.151 -1.831 1.00 . A A . 13 PHE O 1 1 1 235 1 1 14 PRO C C -13.547 17.221 -3.547 1.00 . A A . 14 PRO C 1 1 1 236 1 1 14 PRO CA C -12.512 18.213 -3.027 1.00 . A A . 14 PRO CA 1 1 1 237 1 1 14 PRO CB C -12.662 19.562 -3.733 1.00 . A A . 14 PRO CB 1 1 1 238 1 1 14 PRO CD C -10.560 18.631 -4.429 1.00 . A A . 14 PRO CD 1 1 1 239 1 1 14 PRO CG C -11.695 19.507 -4.865 1.00 . A A . 14 PRO CG 1 1 1 240 1 1 14 PRO HA H -12.644 18.345 -1.963 1.00 . A A . 14 PRO HA 1 1 1 241 1 1 14 PRO HB2 H -13.678 19.676 -4.086 1.00 . A A . 14 PRO HB2 1 1 1 242 1 1 14 PRO HB3 H -12.422 20.361 -3.047 1.00 . A A . 14 PRO HB3 1 1 1 243 1 1 14 PRO HD2 H -10.243 18.014 -5.256 1.00 . A A . 14 PRO HD2 1 1 1 244 1 1 14 PRO HD3 H -9.736 19.222 -4.059 1.00 . A A . 14 PRO HD3 1 1 1 245 1 1 14 PRO HG2 H -12.172 19.082 -5.735 1.00 . A A . 14 PRO HG2 1 1 1 246 1 1 14 PRO HG3 H -11.329 20.500 -5.083 1.00 . A A . 14 PRO HG3 1 1 1 247 1 1 14 PRO N N -11.141 17.810 -3.353 1.00 . A A . 14 PRO N 1 1 1 248 1 1 14 PRO O O -14.699 17.227 -3.113 1.00 . A A . 14 PRO O 1 1 1 249 1 1 15 SER C C -14.366 14.293 -4.041 1.00 . A A . 15 SER C 1 1 1 250 1 1 15 SER CA C -14.021 15.374 -5.060 1.00 . A A . 15 SER CA 1 1 1 251 1 1 15 SER CB C -13.377 14.741 -6.295 1.00 . A A . 15 SER CB 1 1 1 252 1 1 15 SER H H -12.198 16.415 -4.784 1.00 . A A . 15 SER H 1 1 1 253 1 1 15 SER HA H -14.930 15.876 -5.356 1.00 . A A . 15 SER HA 1 1 1 254 1 1 15 SER HB2 H -13.653 13.699 -6.347 1.00 . A A . 15 SER HB2 1 1 1 255 1 1 15 SER HB3 H -13.726 15.251 -7.181 1.00 . A A . 15 SER HB3 1 1 1 256 1 1 15 SER HG H -11.670 15.556 -6.803 1.00 . A A . 15 SER HG 1 1 1 257 1 1 15 SER N N -13.129 16.370 -4.479 1.00 . A A . 15 SER N 1 1 1 258 1 1 15 SER O O -15.420 13.662 -4.122 1.00 . A A . 15 SER O 1 1 1 259 1 1 15 SER OG O -11.964 14.837 -6.239 1.00 . A A . 15 SER OG 1 1 1 260 1 1 16 SER C C -14.777 13.505 -1.085 1.00 . A A . 16 SER C 1 1 1 261 1 1 16 SER CA C -13.675 13.076 -2.049 1.00 . A A . 16 SER CA 1 1 1 262 1 1 16 SER CB C -12.376 12.831 -1.279 1.00 . A A . 16 SER CB 1 1 1 263 1 1 16 SER H H -12.648 14.620 -3.072 1.00 . A A . 16 SER H 1 1 1 264 1 1 16 SER HA H -13.974 12.160 -2.535 1.00 . A A . 16 SER HA 1 1 1 265 1 1 16 SER HB2 H -11.717 12.218 -1.876 1.00 . A A . 16 SER HB2 1 1 1 266 1 1 16 SER HB3 H -11.898 13.779 -1.074 1.00 . A A . 16 SER HB3 1 1 1 267 1 1 16 SER HG H -11.812 12.110 0.453 1.00 . A A . 16 SER HG 1 1 1 268 1 1 16 SER N N -13.469 14.084 -3.082 1.00 . A A . 16 SER N 1 1 1 269 1 1 16 SER O O -15.513 12.671 -0.557 1.00 . A A . 16 SER O 1 1 1 270 1 1 16 SER OG O -12.627 12.171 -0.051 1.00 . A A . 16 SER OG 1 1 1 271 1 1 17 GLU C C -17.219 15.560 -0.690 1.00 . A A . 17 GLU C 1 1 1 272 1 1 17 GLU CA C -15.896 15.350 0.041 1.00 . A A . 17 GLU CA 1 1 1 273 1 1 17 GLU CB C -15.419 16.672 0.646 1.00 . A A . 17 GLU CB 1 1 1 274 1 1 17 GLU CD C -16.004 18.034 2.691 1.00 . A A . 17 GLU CD 1 1 1 275 1 1 17 GLU CG C -15.491 16.708 2.163 1.00 . A A . 17 GLU CG 1 1 1 276 1 1 17 GLU H H -14.268 15.425 -1.311 1.00 . A A . 17 GLU H 1 1 1 277 1 1 17 GLU HA H -16.047 14.635 0.835 1.00 . A A . 17 GLU HA 1 1 1 278 1 1 17 GLU HB2 H -14.395 16.841 0.349 1.00 . A A . 17 GLU HB2 1 1 1 279 1 1 17 GLU HB3 H -16.033 17.472 0.258 1.00 . A A . 17 GLU HB3 1 1 1 280 1 1 17 GLU HG2 H -16.153 15.924 2.498 1.00 . A A . 17 GLU HG2 1 1 1 281 1 1 17 GLU HG3 H -14.502 16.537 2.561 1.00 . A A . 17 GLU HG3 1 1 1 282 1 1 17 GLU N N -14.884 14.811 -0.860 1.00 . A A . 17 GLU N 1 1 1 283 1 1 17 GLU O O -18.164 14.791 -0.516 1.00 . A A . 17 GLU O 1 1 1 284 1 1 17 GLU OE1 O -15.256 19.031 2.617 1.00 . A A . 17 GLU OE1 1 1 1 285 1 1 17 GLU OE2 O -17.152 18.074 3.180 1.00 . A A . 17 GLU OE2 1 1 2 286 1 1 1 ARG C C 2.903 1.642 -1.848 1.00 . A A . 1 ARG C 1 1 2 287 1 1 1 ARG CA C 3.117 0.168 -1.514 1.00 . A A . 1 ARG CA 1 1 2 288 1 1 1 ARG CB C 2.214 -0.237 -0.347 1.00 . A A . 1 ARG CB 1 1 2 289 1 1 1 ARG CD C 2.017 -2.678 -0.909 1.00 . A A . 1 ARG CD 1 1 2 290 1 1 1 ARG CG C 2.445 -1.659 0.136 1.00 . A A . 1 ARG CG 1 1 2 291 1 1 1 ARG CZ C 3.059 -4.122 -2.604 1.00 . A A . 1 ARG CZ 1 1 2 292 1 1 1 ARG H1 H 5.214 0.250 -1.781 1.00 . A A . 1 ARG H1 1 1 2 293 1 1 1 ARG HA H 2.860 -0.425 -2.378 1.00 . A A . 1 ARG HA 1 1 2 294 1 1 1 ARG HB2 H 2.393 0.434 0.481 1.00 . A A . 1 ARG HB2 1 1 2 295 1 1 1 ARG HB3 H 1.184 -0.147 -0.656 1.00 . A A . 1 ARG HB3 1 1 2 296 1 1 1 ARG HD2 H 1.585 -3.530 -0.406 1.00 . A A . 1 ARG HD2 1 1 2 297 1 1 1 ARG HD3 H 1.277 -2.226 -1.551 1.00 . A A . 1 ARG HD3 1 1 2 298 1 1 1 ARG HE H 3.999 -2.669 -1.611 1.00 . A A . 1 ARG HE 1 1 2 299 1 1 1 ARG HG2 H 3.496 -1.793 0.344 1.00 . A A . 1 ARG HG2 1 1 2 300 1 1 1 ARG HG3 H 1.874 -1.820 1.038 1.00 . A A . 1 ARG HG3 1 1 2 301 1 1 1 ARG HH11 H 1.106 -4.499 -2.251 1.00 . A A . 1 ARG HH11 1 1 2 302 1 1 1 ARG HH12 H 1.853 -5.509 -3.444 1.00 . A A . 1 ARG HH12 1 1 2 303 1 1 1 ARG HH21 H 4.993 -3.993 -3.180 1.00 . A A . 1 ARG HH21 1 1 2 304 1 1 1 ARG HH22 H 4.064 -5.221 -3.971 1.00 . A A . 1 ARG HH22 1 1 2 305 1 1 1 ARG N N 4.513 -0.093 -1.189 1.00 . A A . 1 ARG N 1 1 2 306 1 1 1 ARG NE N 3.141 -3.129 -1.725 1.00 . A A . 1 ARG NE 1 1 2 307 1 1 1 ARG NH1 N 1.912 -4.763 -2.780 1.00 . A A . 1 ARG NH1 1 1 2 308 1 1 1 ARG NH2 N 4.126 -4.474 -3.310 1.00 . A A . 1 ARG NH2 1 1 2 309 1 1 1 ARG O O 2.083 2.317 -1.227 1.00 . A A . 1 ARG O 1 1 2 310 1 1 2 SER C C 2.323 3.740 -4.138 1.00 . A A . 2 SER C 1 1 2 311 1 1 2 SER CA C 3.543 3.528 -3.247 1.00 . A A . 2 SER CA 1 1 2 312 1 1 2 SER CB C 4.811 3.958 -3.988 1.00 . A A . 2 SER CB 1 1 2 313 1 1 2 SER H H 4.284 1.545 -3.291 1.00 . A A . 2 SER H 1 1 2 314 1 1 2 SER HA H 3.434 4.131 -2.358 1.00 . A A . 2 SER HA 1 1 2 315 1 1 2 SER HB2 H 5.641 3.352 -3.658 1.00 . A A . 2 SER HB2 1 1 2 316 1 1 2 SER HB3 H 4.667 3.824 -5.050 1.00 . A A . 2 SER HB3 1 1 2 317 1 1 2 SER HG H 5.880 5.579 -4.250 1.00 . A A . 2 SER HG 1 1 2 318 1 1 2 SER N N 3.648 2.134 -2.833 1.00 . A A . 2 SER N 1 1 2 319 1 1 2 SER O O 1.751 4.830 -4.180 1.00 . A A . 2 SER O 1 1 2 320 1 1 2 SER OG O 5.111 5.320 -3.737 1.00 . A A . 2 SER OG 1 1 2 321 1 1 3 LYS C C -0.522 2.845 -4.945 1.00 . A A . 3 LYS C 1 1 2 322 1 1 3 LYS CA C 0.776 2.758 -5.741 1.00 . A A . 3 LYS CA 1 1 2 323 1 1 3 LYS CB C 0.743 1.534 -6.660 1.00 . A A . 3 LYS CB 1 1 2 324 1 1 3 LYS CD C 0.343 0.616 -8.963 1.00 . A A . 3 LYS CD 1 1 2 325 1 1 3 LYS CE C -1.077 0.074 -9.022 1.00 . A A . 3 LYS CE 1 1 2 326 1 1 3 LYS CG C 0.426 1.869 -8.107 1.00 . A A . 3 LYS CG 1 1 2 327 1 1 3 LYS H H 2.426 1.848 -4.775 1.00 . A A . 3 LYS H 1 1 2 328 1 1 3 LYS HA H 0.875 3.648 -6.345 1.00 . A A . 3 LYS HA 1 1 2 329 1 1 3 LYS HB2 H 1.706 1.048 -6.627 1.00 . A A . 3 LYS HB2 1 1 2 330 1 1 3 LYS HB3 H -0.010 0.848 -6.298 1.00 . A A . 3 LYS HB3 1 1 2 331 1 1 3 LYS HD2 H 0.667 0.854 -9.966 1.00 . A A . 3 LYS HD2 1 1 2 332 1 1 3 LYS HD3 H 0.991 -0.140 -8.543 1.00 . A A . 3 LYS HD3 1 1 2 333 1 1 3 LYS HE2 H -1.062 -0.881 -9.524 1.00 . A A . 3 LYS HE2 1 1 2 334 1 1 3 LYS HE3 H -1.440 -0.055 -8.014 1.00 . A A . 3 LYS HE3 1 1 2 335 1 1 3 LYS HG2 H -0.523 2.383 -8.149 1.00 . A A . 3 LYS HG2 1 1 2 336 1 1 3 LYS HG3 H 1.203 2.510 -8.497 1.00 . A A . 3 LYS HG3 1 1 2 337 1 1 3 LYS HZ1 H -2.912 1.040 -9.272 1.00 . A A . 3 LYS HZ1 1 1 2 338 1 1 3 LYS HZ2 H -2.138 0.652 -10.726 1.00 . A A . 3 LYS HZ2 1 1 2 339 1 1 3 LYS HZ3 H -1.583 1.948 -9.792 1.00 . A A . 3 LYS HZ3 1 1 2 340 1 1 3 LYS N N 1.929 2.690 -4.851 1.00 . A A . 3 LYS N 1 1 2 341 1 1 3 LYS NZ N -1.992 0.993 -9.754 1.00 . A A . 3 LYS NZ 1 1 2 342 1 1 3 LYS O O -1.499 3.443 -5.397 1.00 . A A . 3 LYS O 1 1 2 343 1 1 4 ASP C C -1.948 3.656 -2.335 1.00 . A A . 4 ASP C 1 1 2 344 1 1 4 ASP CA C -1.701 2.260 -2.899 1.00 . A A . 4 ASP CA 1 1 2 345 1 1 4 ASP CB C -1.535 1.257 -1.756 1.00 . A A . 4 ASP CB 1 1 2 346 1 1 4 ASP CG C -2.492 0.086 -1.869 1.00 . A A . 4 ASP CG 1 1 2 347 1 1 4 ASP H H 0.286 1.787 -3.454 1.00 . A A . 4 ASP H 1 1 2 348 1 1 4 ASP HA H -2.553 1.972 -3.497 1.00 . A A . 4 ASP HA 1 1 2 349 1 1 4 ASP HB2 H -0.525 0.875 -1.765 1.00 . A A . 4 ASP HB2 1 1 2 350 1 1 4 ASP HB3 H -1.717 1.758 -0.817 1.00 . A A . 4 ASP HB3 1 1 2 351 1 1 4 ASP N N -0.524 2.247 -3.759 1.00 . A A . 4 ASP N 1 1 2 352 1 1 4 ASP O O -3.089 4.039 -2.074 1.00 . A A . 4 ASP O 1 1 2 353 1 1 4 ASP OD1 O -3.700 0.326 -2.074 1.00 . A A . 4 ASP OD1 1 1 2 354 1 1 4 ASP OD2 O -2.032 -1.069 -1.753 1.00 . A A . 4 ASP OD2 1 1 2 355 1 1 5 LEU C C -1.496 6.731 -2.672 1.00 . A A . 5 LEU C 1 1 2 356 1 1 5 LEU CA C -0.970 5.766 -1.615 1.00 . A A . 5 LEU CA 1 1 2 357 1 1 5 LEU CB C 0.396 6.237 -1.112 1.00 . A A . 5 LEU CB 1 1 2 358 1 1 5 LEU CD1 C 1.403 5.411 1.029 1.00 . A A . 5 LEU CD1 1 1 2 359 1 1 5 LEU CD2 C 1.052 7.863 0.680 1.00 . A A . 5 LEU CD2 1 1 2 360 1 1 5 LEU CG C 0.513 6.468 0.395 1.00 . A A . 5 LEU CG 1 1 2 361 1 1 5 LEU H H 0.011 4.052 -2.375 1.00 . A A . 5 LEU H 1 1 2 362 1 1 5 LEU HA H -1.662 5.745 -0.786 1.00 . A A . 5 LEU HA 1 1 2 363 1 1 5 LEU HB2 H 1.126 5.493 -1.390 1.00 . A A . 5 LEU HB2 1 1 2 364 1 1 5 LEU HB3 H 0.627 7.169 -1.610 1.00 . A A . 5 LEU HB3 1 1 2 365 1 1 5 LEU HD11 H 1.141 5.297 2.070 1.00 . A A . 5 LEU HD11 1 1 2 366 1 1 5 LEU HD12 H 2.436 5.715 0.949 1.00 . A A . 5 LEU HD12 1 1 2 367 1 1 5 LEU HD13 H 1.265 4.470 0.517 1.00 . A A . 5 LEU HD13 1 1 2 368 1 1 5 LEU HD21 H 0.756 8.166 1.673 1.00 . A A . 5 LEU HD21 1 1 2 369 1 1 5 LEU HD22 H 0.651 8.558 -0.043 1.00 . A A . 5 LEU HD22 1 1 2 370 1 1 5 LEU HD23 H 2.130 7.853 0.612 1.00 . A A . 5 LEU HD23 1 1 2 371 1 1 5 LEU HG H -0.468 6.390 0.842 1.00 . A A . 5 LEU HG 1 1 2 372 1 1 5 LEU N N -0.871 4.412 -2.149 1.00 . A A . 5 LEU N 1 1 2 373 1 1 5 LEU O O -2.120 7.742 -2.348 1.00 . A A . 5 LEU O 1 1 2 374 1 1 6 ARG C C -3.204 7.453 -4.989 1.00 . A A . 6 ARG C 1 1 2 375 1 1 6 ARG CA C -1.693 7.249 -5.042 1.00 . A A . 6 ARG CA 1 1 2 376 1 1 6 ARG CB C -1.299 6.620 -6.380 1.00 . A A . 6 ARG CB 1 1 2 377 1 1 6 ARG CD C 1.131 7.122 -6.778 1.00 . A A . 6 ARG CD 1 1 2 378 1 1 6 ARG CG C -0.301 7.449 -7.171 1.00 . A A . 6 ARG CG 1 1 2 379 1 1 6 ARG CZ C 2.274 9.280 -7.060 1.00 . A A . 6 ARG CZ 1 1 2 380 1 1 6 ARG H H -0.742 5.591 -4.132 1.00 . A A . 6 ARG H 1 1 2 381 1 1 6 ARG HA H -1.208 8.209 -4.948 1.00 . A A . 6 ARG HA 1 1 2 382 1 1 6 ARG HB2 H -0.861 5.651 -6.194 1.00 . A A . 6 ARG HB2 1 1 2 383 1 1 6 ARG HB3 H -2.187 6.496 -6.980 1.00 . A A . 6 ARG HB3 1 1 2 384 1 1 6 ARG HD2 H 1.115 6.368 -6.005 1.00 . A A . 6 ARG HD2 1 1 2 385 1 1 6 ARG HD3 H 1.649 6.738 -7.644 1.00 . A A . 6 ARG HD3 1 1 2 386 1 1 6 ARG HE H 2.009 8.350 -5.316 1.00 . A A . 6 ARG HE 1 1 2 387 1 1 6 ARG HG2 H -0.430 7.242 -8.224 1.00 . A A . 6 ARG HG2 1 1 2 388 1 1 6 ARG HG3 H -0.487 8.496 -6.983 1.00 . A A . 6 ARG HG3 1 1 2 389 1 1 6 ARG HH11 H 1.581 8.455 -8.769 1.00 . A A . 6 ARG HH11 1 1 2 390 1 1 6 ARG HH12 H 2.388 9.977 -8.954 1.00 . A A . 6 ARG HH12 1 1 2 391 1 1 6 ARG HH21 H 3.074 10.354 -5.547 1.00 . A A . 6 ARG HH21 1 1 2 392 1 1 6 ARG HH22 H 3.238 11.056 -7.121 1.00 . A A . 6 ARG HH22 1 1 2 393 1 1 6 ARG N N -1.244 6.410 -3.937 1.00 . A A . 6 ARG N 1 1 2 394 1 1 6 ARG NE N 1.844 8.295 -6.280 1.00 . A A . 6 ARG NE 1 1 2 395 1 1 6 ARG NH1 N 2.064 9.233 -8.369 1.00 . A A . 6 ARG NH1 1 1 2 396 1 1 6 ARG NH2 N 2.915 10.315 -6.532 1.00 . A A . 6 ARG NH2 1 1 2 397 1 1 6 ARG O O -3.715 8.499 -5.393 1.00 . A A . 6 ARG O 1 1 2 398 1 1 7 HIS C C -5.787 7.411 -3.220 1.00 . A A . 7 HIS C 1 1 2 399 1 1 7 HIS CA C -5.369 6.517 -4.383 1.00 . A A . 7 HIS CA 1 1 2 400 1 1 7 HIS CB C -5.955 5.117 -4.201 1.00 . A A . 7 HIS CB 1 1 2 401 1 1 7 HIS CD2 C -7.034 3.597 -6.005 1.00 . A A . 7 HIS CD2 1 1 2 402 1 1 7 HIS CE1 C -8.632 4.953 -6.652 1.00 . A A . 7 HIS CE1 1 1 2 403 1 1 7 HIS CG C -6.927 4.731 -5.274 1.00 . A A . 7 HIS CG 1 1 2 404 1 1 7 HIS H H -3.452 5.640 -4.183 1.00 . A A . 7 HIS H 1 1 2 405 1 1 7 HIS HA H -5.748 6.941 -5.300 1.00 . A A . 7 HIS HA 1 1 2 406 1 1 7 HIS HB2 H -5.153 4.394 -4.206 1.00 . A A . 7 HIS HB2 1 1 2 407 1 1 7 HIS HB3 H -6.471 5.070 -3.253 1.00 . A A . 7 HIS HB3 1 1 2 408 1 1 7 HIS HD1 H -8.129 6.459 -5.363 1.00 . A A . 7 HIS HD1 1 1 2 409 1 1 7 HIS HD2 H -6.399 2.726 -5.935 1.00 . A A . 7 HIS HD2 1 1 2 410 1 1 7 HIS HE1 H -9.485 5.361 -7.174 1.00 . A A . 7 HIS HE1 1 1 2 411 1 1 7 HIS N N -3.916 6.448 -4.489 1.00 . A A . 7 HIS N 1 1 2 412 1 1 7 HIS ND1 N -7.942 5.560 -5.704 1.00 . A A . 7 HIS ND1 1 1 2 413 1 1 7 HIS NE2 N -8.102 3.760 -6.854 1.00 . A A . 7 HIS NE2 1 1 2 414 1 1 7 HIS O O -6.922 7.882 -3.163 1.00 . A A . 7 HIS O 1 1 2 415 1 1 8 ALA C C -5.137 9.956 -1.511 1.00 . A A . 8 ALA C 1 1 2 416 1 1 8 ALA CA C -5.134 8.479 -1.133 1.00 . A A . 8 ALA CA 1 1 2 417 1 1 8 ALA CB C -4.109 8.215 -0.039 1.00 . A A . 8 ALA CB 1 1 2 418 1 1 8 ALA H H -3.974 7.237 -2.394 1.00 . A A . 8 ALA H 1 1 2 419 1 1 8 ALA HA H -6.109 8.213 -0.750 1.00 . A A . 8 ALA HA 1 1 2 420 1 1 8 ALA HB1 H -4.619 8.071 0.903 1.00 . A A . 8 ALA HB1 1 1 2 421 1 1 8 ALA HB2 H -3.544 7.328 -0.282 1.00 . A A . 8 ALA HB2 1 1 2 422 1 1 8 ALA HB3 H -3.441 9.059 0.039 1.00 . A A . 8 ALA HB3 1 1 2 423 1 1 8 ALA N N -4.861 7.640 -2.293 1.00 . A A . 8 ALA N 1 1 2 424 1 1 8 ALA O O -5.738 10.782 -0.823 1.00 . A A . 8 ALA O 1 1 2 425 1 1 9 PHE C C -5.775 12.197 -3.419 1.00 . A A . 9 PHE C 1 1 2 426 1 1 9 PHE CA C -4.388 11.661 -3.078 1.00 . A A . 9 PHE CA 1 1 2 427 1 1 9 PHE CB C -3.476 11.756 -4.303 1.00 . A A . 9 PHE CB 1 1 2 428 1 1 9 PHE CD1 C -2.237 13.802 -3.545 1.00 . A A . 9 PHE CD1 1 1 2 429 1 1 9 PHE CD2 C -3.120 13.768 -5.760 1.00 . A A . 9 PHE CD2 1 1 2 430 1 1 9 PHE CE1 C -1.736 15.072 -3.760 1.00 . A A . 9 PHE CE1 1 1 2 431 1 1 9 PHE CE2 C -2.620 15.037 -5.981 1.00 . A A . 9 PHE CE2 1 1 2 432 1 1 9 PHE CG C -2.933 13.136 -4.541 1.00 . A A . 9 PHE CG 1 1 2 433 1 1 9 PHE CZ C -1.928 15.691 -4.980 1.00 . A A . 9 PHE CZ 1 1 2 434 1 1 9 PHE H H -4.005 9.579 -3.115 1.00 . A A . 9 PHE H 1 1 2 435 1 1 9 PHE HA H -3.970 12.259 -2.282 1.00 . A A . 9 PHE HA 1 1 2 436 1 1 9 PHE HB2 H -2.638 11.089 -4.172 1.00 . A A . 9 PHE HB2 1 1 2 437 1 1 9 PHE HB3 H -4.033 11.462 -5.180 1.00 . A A . 9 PHE HB3 1 1 2 438 1 1 9 PHE HD1 H -2.086 13.319 -2.590 1.00 . A A . 9 PHE HD1 1 1 2 439 1 1 9 PHE HD2 H -3.661 13.259 -6.543 1.00 . A A . 9 PHE HD2 1 1 2 440 1 1 9 PHE HE1 H -1.195 15.580 -2.975 1.00 . A A . 9 PHE HE1 1 1 2 441 1 1 9 PHE HE2 H -2.772 15.519 -6.936 1.00 . A A . 9 PHE HE2 1 1 2 442 1 1 9 PHE HZ H -1.537 16.682 -5.151 1.00 . A A . 9 PHE HZ 1 1 2 443 1 1 9 PHE N N -4.463 10.283 -2.609 1.00 . A A . 9 PHE N 1 1 2 444 1 1 9 PHE O O -6.017 13.402 -3.366 1.00 . A A . 9 PHE O 1 1 2 445 1 1 10 ARG C C -8.841 12.056 -2.878 1.00 . A A . 10 ARG C 1 1 2 446 1 1 10 ARG CA C -8.045 11.671 -4.122 1.00 . A A . 10 ARG CA 1 1 2 447 1 1 10 ARG CB C -8.745 10.524 -4.853 1.00 . A A . 10 ARG CB 1 1 2 448 1 1 10 ARG CD C -8.331 9.477 -7.100 1.00 . A A . 10 ARG CD 1 1 2 449 1 1 10 ARG CG C -8.814 10.714 -6.359 1.00 . A A . 10 ARG CG 1 1 2 450 1 1 10 ARG CZ C -6.841 10.318 -8.864 1.00 . A A . 10 ARG CZ 1 1 2 451 1 1 10 ARG H H -6.429 10.344 -3.793 1.00 . A A . 10 ARG H 1 1 2 452 1 1 10 ARG HA H -7.992 12.526 -4.779 1.00 . A A . 10 ARG HA 1 1 2 453 1 1 10 ARG HB2 H -8.212 9.606 -4.652 1.00 . A A . 10 ARG HB2 1 1 2 454 1 1 10 ARG HB3 H -9.753 10.435 -4.477 1.00 . A A . 10 ARG HB3 1 1 2 455 1 1 10 ARG HD2 H -7.456 9.091 -6.598 1.00 . A A . 10 ARG HD2 1 1 2 456 1 1 10 ARG HD3 H -9.114 8.733 -7.079 1.00 . A A . 10 ARG HD3 1 1 2 457 1 1 10 ARG HE H -8.652 9.543 -9.176 1.00 . A A . 10 ARG HE 1 1 2 458 1 1 10 ARG HG2 H -9.837 10.912 -6.642 1.00 . A A . 10 ARG HG2 1 1 2 459 1 1 10 ARG HG3 H -8.193 11.553 -6.636 1.00 . A A . 10 ARG HG3 1 1 2 460 1 1 10 ARG HH11 H -6.101 10.457 -6.989 1.00 . A A . 10 ARG HH11 1 1 2 461 1 1 10 ARG HH12 H -5.061 11.046 -8.243 1.00 . A A . 10 ARG HH12 1 1 2 462 1 1 10 ARG HH21 H -7.290 10.316 -10.835 1.00 . A A . 10 ARG HH21 1 1 2 463 1 1 10 ARG HH22 H -5.738 10.967 -10.430 1.00 . A A . 10 ARG HH22 1 1 2 464 1 1 10 ARG N N -6.682 11.291 -3.770 1.00 . A A . 10 ARG N 1 1 2 465 1 1 10 ARG NE N -7.990 9.768 -8.490 1.00 . A A . 10 ARG NE 1 1 2 466 1 1 10 ARG NH1 N -5.926 10.633 -7.958 1.00 . A A . 10 ARG NH1 1 1 2 467 1 1 10 ARG NH2 N -6.604 10.553 -10.149 1.00 . A A . 10 ARG NH2 1 1 2 468 1 1 10 ARG O O -9.780 12.844 -2.983 1.00 . A A . 10 ARG O 1 1 2 469 1 1 11 . C C -8.974 13.254 -0.112 1.00 . A A . 11 SEP C 1 1 2 470 1 1 11 . CA C -9.157 11.798 -0.458 1.00 . A A . 11 SEP CA 1 1 2 471 1 1 11 . CB C -8.710 10.796 0.647 1.00 . A A . 11 SEP CB 1 1 2 472 1 1 11 . H H -7.673 10.857 -1.720 1.00 . A A . 11 SEP H 1 1 2 473 1 1 11 . HA H -10.234 11.635 -0.647 1.00 . A A . 11 SEP HA 1 1 2 474 1 1 11 . HB2 H -8.718 9.748 0.292 1.00 . A A . 11 SEP HB2 1 1 2 475 1 1 11 . HB3 H -7.661 10.965 0.962 1.00 . A A . 11 SEP HB3 1 1 2 476 1 1 11 . N N -8.453 11.498 -1.740 1.00 . A A . 11 SEP N 1 1 2 477 1 1 11 . O O -9.868 13.928 0.400 1.00 . A A . 11 SEP O 1 1 2 478 1 1 11 . O1P O -9.107 9.498 3.906 1.00 . A A . 11 SEP O1P 1 1 2 479 1 1 11 . O2P O -7.513 11.280 3.235 1.00 . A A . 11 SEP O2P 1 1 2 480 1 1 11 . O3P O -9.755 11.914 4.163 1.00 . A A . 11 SEP O3P 1 1 2 481 1 1 11 . OG O -9.574 10.881 1.805 1.00 . A A . 11 SEP OG 1 1 2 482 1 1 11 . P P -8.995 10.900 3.316 1.00 . A A . 11 SEP P 1 1 2 483 1 1 12 MET C C -8.173 16.072 -1.087 1.00 . A A . 12 MET C 1 1 2 484 1 1 12 MET CA C -7.432 15.136 -0.136 1.00 . A A . 12 MET CA 1 1 2 485 1 1 12 MET CB C -5.923 15.347 -0.268 1.00 . A A . 12 MET CB 1 1 2 486 1 1 12 MET CE C -3.077 15.510 1.233 1.00 . A A . 12 MET CE 1 1 2 487 1 1 12 MET CG C -5.437 16.654 0.337 1.00 . A A . 12 MET CG 1 1 2 488 1 1 12 MET H H -7.103 13.158 -0.813 1.00 . A A . 12 MET H 1 1 2 489 1 1 12 MET HA H -7.731 15.361 0.877 1.00 . A A . 12 MET HA 1 1 2 490 1 1 12 MET HB2 H -5.413 14.534 0.227 1.00 . A A . 12 MET HB2 1 1 2 491 1 1 12 MET HB3 H -5.660 15.342 -1.316 1.00 . A A . 12 MET HB3 1 1 2 492 1 1 12 MET HE1 H -2.786 15.916 0.275 1.00 . A A . 12 MET HE1 1 1 2 493 1 1 12 MET HE2 H -2.256 15.606 1.929 1.00 . A A . 12 MET HE2 1 1 2 494 1 1 12 MET HE3 H -3.333 14.467 1.120 1.00 . A A . 12 MET HE3 1 1 2 495 1 1 12 MET HG2 H -4.807 17.157 -0.381 1.00 . A A . 12 MET HG2 1 1 2 496 1 1 12 MET HG3 H -6.294 17.274 0.557 1.00 . A A . 12 MET HG3 1 1 2 497 1 1 12 MET N N -7.775 13.745 -0.405 1.00 . A A . 12 MET N 1 1 2 498 1 1 12 MET O O -8.415 17.235 -0.765 1.00 . A A . 12 MET O 1 1 2 499 1 1 12 MET SD S -4.496 16.408 1.856 1.00 . A A . 12 MET SD 1 1 2 500 1 1 13 PHE C C -10.670 16.638 -2.801 1.00 . A A . 13 PHE C 1 1 2 501 1 1 13 PHE CA C -9.243 16.346 -3.256 1.00 . A A . 13 PHE CA 1 1 2 502 1 1 13 PHE CB C -9.264 15.612 -4.598 1.00 . A A . 13 PHE CB 1 1 2 503 1 1 13 PHE CD1 C -6.904 16.147 -5.263 1.00 . A A . 13 PHE CD1 1 1 2 504 1 1 13 PHE CD2 C -8.651 16.602 -6.821 1.00 . A A . 13 PHE CD2 1 1 2 505 1 1 13 PHE CE1 C -5.972 16.625 -6.164 1.00 . A A . 13 PHE CE1 1 1 2 506 1 1 13 PHE CE2 C -7.723 17.080 -7.727 1.00 . A A . 13 PHE CE2 1 1 2 507 1 1 13 PHE CG C -8.253 16.131 -5.580 1.00 . A A . 13 PHE CG 1 1 2 508 1 1 13 PHE CZ C -6.381 17.091 -7.398 1.00 . A A . 13 PHE CZ 1 1 2 509 1 1 13 PHE H H -8.310 14.622 -2.457 1.00 . A A . 13 PHE H 1 1 2 510 1 1 13 PHE HA H -8.718 17.281 -3.374 1.00 . A A . 13 PHE HA 1 1 2 511 1 1 13 PHE HB2 H -9.057 14.566 -4.432 1.00 . A A . 13 PHE HB2 1 1 2 512 1 1 13 PHE HB3 H -10.243 15.716 -5.042 1.00 . A A . 13 PHE HB3 1 1 2 513 1 1 13 PHE HD1 H -6.582 15.782 -4.299 1.00 . A A . 13 PHE HD1 1 1 2 514 1 1 13 PHE HD2 H -9.700 16.594 -7.079 1.00 . A A . 13 PHE HD2 1 1 2 515 1 1 13 PHE HE1 H -4.924 16.631 -5.905 1.00 . A A . 13 PHE HE1 1 1 2 516 1 1 13 PHE HE2 H -8.047 17.444 -8.691 1.00 . A A . 13 PHE HE2 1 1 2 517 1 1 13 PHE HZ H -5.655 17.464 -8.104 1.00 . A A . 13 PHE HZ 1 1 2 518 1 1 13 PHE N N -8.531 15.556 -2.258 1.00 . A A . 13 PHE N 1 1 2 519 1 1 13 PHE O O -11.207 15.990 -1.901 1.00 . A A . 13 PHE O 1 1 2 520 1 1 14 PRO C C -13.705 17.039 -3.628 1.00 . A A . 14 PRO C 1 1 2 521 1 1 14 PRO CA C -12.673 18.038 -3.114 1.00 . A A . 14 PRO CA 1 1 2 522 1 1 14 PRO CB C -12.827 19.382 -3.831 1.00 . A A . 14 PRO CB 1 1 2 523 1 1 14 PRO CD C -10.722 18.451 -4.518 1.00 . A A . 14 PRO CD 1 1 2 524 1 1 14 PRO CG C -11.859 19.322 -4.961 1.00 . A A . 14 PRO CG 1 1 2 525 1 1 14 PRO HA H -12.807 18.177 -2.051 1.00 . A A . 14 PRO HA 1 1 2 526 1 1 14 PRO HB2 H -13.843 19.490 -4.185 1.00 . A A . 14 PRO HB2 1 1 2 527 1 1 14 PRO HB3 H -12.590 20.186 -3.150 1.00 . A A . 14 PRO HB3 1 1 2 528 1 1 14 PRO HD2 H -10.402 17.829 -5.340 1.00 . A A . 14 PRO HD2 1 1 2 529 1 1 14 PRO HD3 H -9.900 19.048 -4.152 1.00 . A A . 14 PRO HD3 1 1 2 530 1 1 14 PRO HG2 H -12.335 18.893 -5.830 1.00 . A A . 14 PRO HG2 1 1 2 531 1 1 14 PRO HG3 H -11.492 20.313 -5.183 1.00 . A A . 14 PRO HG3 1 1 2 532 1 1 14 PRO N N -11.301 17.637 -3.436 1.00 . A A . 14 PRO N 1 1 2 533 1 1 14 PRO O O -14.859 17.049 -3.200 1.00 . A A . 14 PRO O 1 1 2 534 1 1 15 SER C C -14.518 14.105 -4.092 1.00 . A A . 15 SER C 1 1 2 535 1 1 15 SER CA C -14.170 15.175 -5.122 1.00 . A A . 15 SER CA 1 1 2 536 1 1 15 SER CB C -13.519 14.528 -6.346 1.00 . A A . 15 SER CB 1 1 2 537 1 1 15 SER H H -12.349 16.221 -4.849 1.00 . A A . 15 SER H 1 1 2 538 1 1 15 SER HA H -15.078 15.672 -5.428 1.00 . A A . 15 SER HA 1 1 2 539 1 1 15 SER HB2 H -12.451 14.472 -6.196 1.00 . A A . 15 SER HB2 1 1 2 540 1 1 15 SER HB3 H -13.917 13.532 -6.478 1.00 . A A . 15 SER HB3 1 1 2 541 1 1 15 SER HG H -13.285 14.907 -8.254 1.00 . A A . 15 SER HG 1 1 2 542 1 1 15 SER N N -13.281 16.178 -4.548 1.00 . A A . 15 SER N 1 1 2 543 1 1 15 SER O O -15.570 13.471 -4.171 1.00 . A A . 15 SER O 1 1 2 544 1 1 15 SER OG O -13.776 15.281 -7.518 1.00 . A A . 15 SER OG 1 1 2 545 1 1 16 SER C C -14.911 13.374 -1.100 1.00 . A A . 16 SER C 1 1 2 546 1 1 16 SER CA C -13.837 12.914 -2.081 1.00 . A A . 16 SER CA 1 1 2 547 1 1 16 SER CB C -12.530 12.643 -1.334 1.00 . A A . 16 SER CB 1 1 2 548 1 1 16 SER H H -12.807 14.446 -3.117 1.00 . A A . 16 SER H 1 1 2 549 1 1 16 SER HA H -14.167 12.001 -2.555 1.00 . A A . 16 SER HA 1 1 2 550 1 1 16 SER HB2 H -12.028 11.800 -1.785 1.00 . A A . 16 SER HB2 1 1 2 551 1 1 16 SER HB3 H -11.895 13.516 -1.397 1.00 . A A . 16 SER HB3 1 1 2 552 1 1 16 SER HG H -12.015 11.894 0.401 1.00 . A A . 16 SER HG 1 1 2 553 1 1 16 SER N N -13.627 13.909 -3.126 1.00 . A A . 16 SER N 1 1 2 554 1 1 16 SER O O -15.656 12.562 -0.553 1.00 . A A . 16 SER O 1 1 2 555 1 1 16 SER OG O -12.773 12.352 0.031 1.00 . A A . 16 SER OG 1 1 2 556 1 1 17 GLU C C -17.303 15.464 -0.666 1.00 . A A . 17 GLU C 1 1 2 557 1 1 17 GLU CA C -15.964 15.253 0.034 1.00 . A A . 17 GLU CA 1 1 2 558 1 1 17 GLU CB C -15.456 16.581 0.599 1.00 . A A . 17 GLU CB 1 1 2 559 1 1 17 GLU CD C -14.555 15.846 2.842 1.00 . A A . 17 GLU CD 1 1 2 560 1 1 17 GLU CG C -15.583 16.687 2.110 1.00 . A A . 17 GLU CG 1 1 2 561 1 1 17 GLU H H -14.360 15.281 -1.348 1.00 . A A . 17 GLU H 1 1 2 562 1 1 17 GLU HA H -16.102 14.556 0.847 1.00 . A A . 17 GLU HA 1 1 2 563 1 1 17 GLU HB2 H -14.415 16.696 0.336 1.00 . A A . 17 GLU HB2 1 1 2 564 1 1 17 GLU HB3 H -16.022 17.387 0.154 1.00 . A A . 17 GLU HB3 1 1 2 565 1 1 17 GLU HG2 H -15.451 17.720 2.397 1.00 . A A . 17 GLU HG2 1 1 2 566 1 1 17 GLU HG3 H -16.569 16.357 2.400 1.00 . A A . 17 GLU HG3 1 1 2 567 1 1 17 GLU N N -14.982 14.684 -0.882 1.00 . A A . 17 GLU N 1 1 2 568 1 1 17 GLU O O -18.350 15.510 -0.022 1.00 . A A . 17 GLU O 1 1 2 569 1 1 17 GLU OE1 O -13.485 15.576 2.259 1.00 . A A . 17 GLU OE1 1 1 2 570 1 1 17 GLU OE2 O -14.822 15.459 3.999 1.00 . A A . 17 GLU OE2 1 1 3 571 1 1 1 ARG C C 2.627 2.309 -1.356 1.00 . A A . 1 ARG C 1 1 3 572 1 1 1 ARG CA C 2.883 0.907 -0.813 1.00 . A A . 1 ARG CA 1 1 3 573 1 1 1 ARG CB C 1.990 -0.103 -1.536 1.00 . A A . 1 ARG CB 1 1 3 574 1 1 1 ARG CD C 3.366 -1.926 -2.584 1.00 . A A . 1 ARG CD 1 1 3 575 1 1 1 ARG CG C 2.474 -1.539 -1.415 1.00 . A A . 1 ARG CG 1 1 3 576 1 1 1 ARG CZ C 3.504 -3.701 -4.280 1.00 . A A . 1 ARG CZ 1 1 3 577 1 1 1 ARG H1 H 3.263 0.349 1.193 1.00 . A A . 1 ARG H1 1 1 3 578 1 1 1 ARG HA H 3.917 0.649 -0.988 1.00 . A A . 1 ARG HA 1 1 3 579 1 1 1 ARG HB2 H 0.994 -0.046 -1.122 1.00 . A A . 1 ARG HB2 1 1 3 580 1 1 1 ARG HB3 H 1.951 0.154 -2.583 1.00 . A A . 1 ARG HB3 1 1 3 581 1 1 1 ARG HD2 H 3.280 -1.171 -3.351 1.00 . A A . 1 ARG HD2 1 1 3 582 1 1 1 ARG HD3 H 4.388 -1.973 -2.239 1.00 . A A . 1 ARG HD3 1 1 3 583 1 1 1 ARG HE H 2.337 -3.757 -2.663 1.00 . A A . 1 ARG HE 1 1 3 584 1 1 1 ARG HG2 H 3.034 -1.645 -0.498 1.00 . A A . 1 ARG HG2 1 1 3 585 1 1 1 ARG HG3 H 1.617 -2.197 -1.394 1.00 . A A . 1 ARG HG3 1 1 3 586 1 1 1 ARG HH11 H 4.692 -2.103 -4.623 1.00 . A A . 1 ARG HH11 1 1 3 587 1 1 1 ARG HH12 H 4.780 -3.361 -5.811 1.00 . A A . 1 ARG HH12 1 1 3 588 1 1 1 ARG HH21 H 2.444 -5.421 -4.221 1.00 . A A . 1 ARG HH21 1 1 3 589 1 1 1 ARG HH22 H 3.500 -5.247 -5.581 1.00 . A A . 1 ARG HH22 1 1 3 590 1 1 1 ARG N N 2.646 0.855 0.625 1.00 . A A . 1 ARG N 1 1 3 591 1 1 1 ARG NE N 2.997 -3.221 -3.150 1.00 . A A . 1 ARG NE 1 1 3 592 1 1 1 ARG NH1 N 4.398 -2.997 -4.961 1.00 . A A . 1 ARG NH1 1 1 3 593 1 1 1 ARG NH2 N 3.118 -4.887 -4.731 1.00 . A A . 1 ARG NH2 1 1 3 594 1 1 1 ARG O O 1.761 3.030 -0.858 1.00 . A A . 1 ARG O 1 1 3 595 1 1 2 SER C C 2.037 4.048 -3.921 1.00 . A A . 2 SER C 1 1 3 596 1 1 2 SER CA C 3.243 4.008 -2.987 1.00 . A A . 2 SER CA 1 1 3 597 1 1 2 SER CB C 4.512 4.377 -3.758 1.00 . A A . 2 SER CB 1 1 3 598 1 1 2 SER H H 4.058 2.071 -2.731 1.00 . A A . 2 SER H 1 1 3 599 1 1 2 SER HA H 3.093 4.725 -2.194 1.00 . A A . 2 SER HA 1 1 3 600 1 1 2 SER HB2 H 4.591 3.753 -4.635 1.00 . A A . 2 SER HB2 1 1 3 601 1 1 2 SER HB3 H 4.459 5.414 -4.057 1.00 . A A . 2 SER HB3 1 1 3 602 1 1 2 SER HG H 6.452 4.294 -3.501 1.00 . A A . 2 SER HG 1 1 3 603 1 1 2 SER N N 3.385 2.690 -2.379 1.00 . A A . 2 SER N 1 1 3 604 1 1 2 SER O O 1.422 5.097 -4.116 1.00 . A A . 2 SER O 1 1 3 605 1 1 2 SER OG O 5.667 4.190 -2.959 1.00 . A A . 2 SER OG 1 1 3 606 1 1 3 LYS C C -0.749 2.901 -4.652 1.00 . A A . 3 LYS C 1 1 3 607 1 1 3 LYS CA C 0.571 2.798 -5.409 1.00 . A A . 3 LYS CA 1 1 3 608 1 1 3 LYS CB C 0.627 1.478 -6.181 1.00 . A A . 3 LYS CB 1 1 3 609 1 1 3 LYS CD C 1.852 0.126 -7.908 1.00 . A A . 3 LYS CD 1 1 3 610 1 1 3 LYS CE C 3.268 0.040 -8.455 1.00 . A A . 3 LYS CE 1 1 3 611 1 1 3 LYS CG C 1.536 1.522 -7.397 1.00 . A A . 3 LYS CG 1 1 3 612 1 1 3 LYS H H 2.233 2.095 -4.301 1.00 . A A . 3 LYS H 1 1 3 613 1 1 3 LYS HA H 0.636 3.617 -6.109 1.00 . A A . 3 LYS HA 1 1 3 614 1 1 3 LYS HB2 H 0.983 0.702 -5.519 1.00 . A A . 3 LYS HB2 1 1 3 615 1 1 3 LYS HB3 H -0.371 1.226 -6.512 1.00 . A A . 3 LYS HB3 1 1 3 616 1 1 3 LYS HD2 H 1.749 -0.578 -7.095 1.00 . A A . 3 LYS HD2 1 1 3 617 1 1 3 LYS HD3 H 1.155 -0.126 -8.695 1.00 . A A . 3 LYS HD3 1 1 3 618 1 1 3 LYS HE2 H 3.623 1.039 -8.658 1.00 . A A . 3 LYS HE2 1 1 3 619 1 1 3 LYS HE3 H 3.900 -0.421 -7.711 1.00 . A A . 3 LYS HE3 1 1 3 620 1 1 3 LYS HG2 H 1.045 2.078 -8.182 1.00 . A A . 3 LYS HG2 1 1 3 621 1 1 3 LYS HG3 H 2.459 2.014 -7.127 1.00 . A A . 3 LYS HG3 1 1 3 622 1 1 3 LYS HZ1 H 4.116 -0.430 -10.306 1.00 . A A . 3 LYS HZ1 1 1 3 623 1 1 3 LYS HZ2 H 2.442 -0.665 -10.239 1.00 . A A . 3 LYS HZ2 1 1 3 624 1 1 3 LYS HZ3 H 3.481 -1.765 -9.484 1.00 . A A . 3 LYS HZ3 1 1 3 625 1 1 3 LYS N N 1.704 2.898 -4.496 1.00 . A A . 3 LYS N 1 1 3 626 1 1 3 LYS NZ N 3.331 -0.761 -9.709 1.00 . A A . 3 LYS NZ 1 1 3 627 1 1 3 LYS O O -1.739 3.410 -5.178 1.00 . A A . 3 LYS O 1 1 3 628 1 1 4 ASP C C -2.187 3.861 -2.035 1.00 . A A . 4 ASP C 1 1 3 629 1 1 4 ASP CA C -1.953 2.457 -2.584 1.00 . A A . 4 ASP CA 1 1 3 630 1 1 4 ASP CB C -1.834 1.459 -1.432 1.00 . A A . 4 ASP CB 1 1 3 631 1 1 4 ASP CG C -2.667 0.212 -1.658 1.00 . A A . 4 ASP CG 1 1 3 632 1 1 4 ASP H H 0.066 2.024 -3.051 1.00 . A A . 4 ASP H 1 1 3 633 1 1 4 ASP HA H -2.794 2.182 -3.202 1.00 . A A . 4 ASP HA 1 1 3 634 1 1 4 ASP HB2 H -0.801 1.164 -1.324 1.00 . A A . 4 ASP HB2 1 1 3 635 1 1 4 ASP HB3 H -2.166 1.932 -0.519 1.00 . A A . 4 ASP HB3 1 1 3 636 1 1 4 ASP N N -0.755 2.417 -3.415 1.00 . A A . 4 ASP N 1 1 3 637 1 1 4 ASP O O -3.326 4.265 -1.796 1.00 . A A . 4 ASP O 1 1 3 638 1 1 4 ASP OD1 O -2.255 -0.636 -2.477 1.00 . A A . 4 ASP OD1 1 1 3 639 1 1 4 ASP OD2 O -3.730 0.085 -1.015 1.00 . A A . 4 ASP OD2 1 1 3 640 1 1 5 LEU C C -1.681 6.926 -2.388 1.00 . A A . 5 LEU C 1 1 3 641 1 1 5 LEU CA C -1.188 5.961 -1.315 1.00 . A A . 5 LEU CA 1 1 3 642 1 1 5 LEU CB C 0.177 6.415 -0.793 1.00 . A A . 5 LEU CB 1 1 3 643 1 1 5 LEU CD1 C 2.096 6.134 0.794 1.00 . A A . 5 LEU CD1 1 1 3 644 1 1 5 LEU CD2 C -0.248 6.161 1.665 1.00 . A A . 5 LEU CD2 1 1 3 645 1 1 5 LEU CG C 0.651 5.760 0.505 1.00 . A A . 5 LEU CG 1 1 3 646 1 1 5 LEU H H -0.221 4.226 -2.046 1.00 . A A . 5 LEU H 1 1 3 647 1 1 5 LEU HA H -1.894 5.958 -0.498 1.00 . A A . 5 LEU HA 1 1 3 648 1 1 5 LEU HB2 H 0.909 6.205 -1.556 1.00 . A A . 5 LEU HB2 1 1 3 649 1 1 5 LEU HB3 H 0.128 7.482 -0.627 1.00 . A A . 5 LEU HB3 1 1 3 650 1 1 5 LEU HD11 H 2.323 7.082 0.331 1.00 . A A . 5 LEU HD11 1 1 3 651 1 1 5 LEU HD12 H 2.752 5.373 0.397 1.00 . A A . 5 LEU HD12 1 1 3 652 1 1 5 LEU HD13 H 2.241 6.211 1.862 1.00 . A A . 5 LEU HD13 1 1 3 653 1 1 5 LEU HD21 H -0.783 5.294 2.022 1.00 . A A . 5 LEU HD21 1 1 3 654 1 1 5 LEU HD22 H -0.954 6.907 1.331 1.00 . A A . 5 LEU HD22 1 1 3 655 1 1 5 LEU HD23 H 0.355 6.568 2.463 1.00 . A A . 5 LEU HD23 1 1 3 656 1 1 5 LEU HG H 0.600 4.685 0.397 1.00 . A A . 5 LEU HG 1 1 3 657 1 1 5 LEU N N -1.102 4.601 -1.837 1.00 . A A . 5 LEU N 1 1 3 658 1 1 5 LEU O O -2.293 7.950 -2.082 1.00 . A A . 5 LEU O 1 1 3 659 1 1 6 ARG C C -3.340 7.657 -4.738 1.00 . A A . 6 ARG C 1 1 3 660 1 1 6 ARG CA C -1.831 7.428 -4.764 1.00 . A A . 6 ARG CA 1 1 3 661 1 1 6 ARG CB C -1.426 6.783 -6.091 1.00 . A A . 6 ARG CB 1 1 3 662 1 1 6 ARG CD C 0.710 6.760 -7.415 1.00 . A A . 6 ARG CD 1 1 3 663 1 1 6 ARG CG C -0.437 7.612 -6.894 1.00 . A A . 6 ARG CG 1 1 3 664 1 1 6 ARG CZ C 2.009 6.512 -9.487 1.00 . A A . 6 ARG CZ 1 1 3 665 1 1 6 ARG H H -0.922 5.763 -3.826 1.00 . A A . 6 ARG H 1 1 3 666 1 1 6 ARG HA H -1.333 8.381 -4.670 1.00 . A A . 6 ARG HA 1 1 3 667 1 1 6 ARG HB2 H -0.975 5.823 -5.888 1.00 . A A . 6 ARG HB2 1 1 3 668 1 1 6 ARG HB3 H -2.311 6.637 -6.691 1.00 . A A . 6 ARG HB3 1 1 3 669 1 1 6 ARG HD2 H 1.530 6.815 -6.714 1.00 . A A . 6 ARG HD2 1 1 3 670 1 1 6 ARG HD3 H 0.374 5.737 -7.494 1.00 . A A . 6 ARG HD3 1 1 3 671 1 1 6 ARG HE H 0.850 8.075 -9.049 1.00 . A A . 6 ARG HE 1 1 3 672 1 1 6 ARG HG2 H -0.951 8.055 -7.733 1.00 . A A . 6 ARG HG2 1 1 3 673 1 1 6 ARG HG3 H -0.037 8.391 -6.261 1.00 . A A . 6 ARG HG3 1 1 3 674 1 1 6 ARG HH11 H 2.182 4.976 -8.186 1.00 . A A . 6 ARG HH11 1 1 3 675 1 1 6 ARG HH12 H 3.092 4.813 -9.652 1.00 . A A . 6 ARG HH12 1 1 3 676 1 1 6 ARG HH21 H 2.044 7.873 -10.982 1.00 . A A . 6 ARG HH21 1 1 3 677 1 1 6 ARG HH22 H 3.014 6.462 -11.241 1.00 . A A . 6 ARG HH22 1 1 3 678 1 1 6 ARG N N -1.413 6.592 -3.646 1.00 . A A . 6 ARG N 1 1 3 679 1 1 6 ARG NE N 1.175 7.210 -8.724 1.00 . A A . 6 ARG NE 1 1 3 680 1 1 6 ARG NH1 N 2.466 5.338 -9.074 1.00 . A A . 6 ARG NH1 1 1 3 681 1 1 6 ARG NH2 N 2.386 6.988 -10.667 1.00 . A A . 6 ARG NH2 1 1 3 682 1 1 6 ARG O O -3.826 8.708 -5.159 1.00 . A A . 6 ARG O 1 1 3 683 1 1 7 HIS C C -5.951 7.671 -3.011 1.00 . A A . 7 HIS C 1 1 3 684 1 1 7 HIS CA C -5.528 6.761 -4.160 1.00 . A A . 7 HIS CA 1 1 3 685 1 1 7 HIS CB C -6.140 5.372 -3.977 1.00 . A A . 7 HIS CB 1 1 3 686 1 1 7 HIS CD2 C -6.574 4.843 -6.479 1.00 . A A . 7 HIS CD2 1 1 3 687 1 1 7 HIS CE1 C -8.613 4.061 -6.293 1.00 . A A . 7 HIS CE1 1 1 3 688 1 1 7 HIS CG C -6.911 4.895 -5.169 1.00 . A A . 7 HIS CG 1 1 3 689 1 1 7 HIS H H -3.629 5.855 -3.922 1.00 . A A . 7 HIS H 1 1 3 690 1 1 7 HIS HA H -5.886 7.183 -5.087 1.00 . A A . 7 HIS HA 1 1 3 691 1 1 7 HIS HB2 H -5.351 4.660 -3.787 1.00 . A A . 7 HIS HB2 1 1 3 692 1 1 7 HIS HB3 H -6.813 5.390 -3.131 1.00 . A A . 7 HIS HB3 1 1 3 693 1 1 7 HIS HD1 H -8.721 4.307 -4.265 1.00 . A A . 7 HIS HD1 1 1 3 694 1 1 7 HIS HD2 H -5.633 5.154 -6.912 1.00 . A A . 7 HIS HD2 1 1 3 695 1 1 7 HIS HE1 H -9.579 3.643 -6.533 1.00 . A A . 7 HIS HE1 1 1 3 696 1 1 7 HIS N N -4.075 6.667 -4.241 1.00 . A A . 7 HIS N 1 1 3 697 1 1 7 HIS ND1 N -8.195 4.399 -5.086 1.00 . A A . 7 HIS ND1 1 1 3 698 1 1 7 HIS NE2 N -7.648 4.320 -7.156 1.00 . A A . 7 HIS NE2 1 1 3 699 1 1 7 HIS O O -7.079 8.161 -2.977 1.00 . A A . 7 HIS O 1 1 3 700 1 1 8 ALA C C -5.288 10.219 -1.311 1.00 . A A . 8 ALA C 1 1 3 701 1 1 8 ALA CA C -5.315 8.745 -0.922 1.00 . A A . 8 ALA CA 1 1 3 702 1 1 8 ALA CB C -4.313 8.473 0.191 1.00 . A A . 8 ALA CB 1 1 3 703 1 1 8 ALA H H -4.155 7.474 -2.154 1.00 . A A . 8 ALA H 1 1 3 704 1 1 8 ALA HA H -6.300 8.498 -0.553 1.00 . A A . 8 ALA HA 1 1 3 705 1 1 8 ALA HB1 H -4.840 8.165 1.082 1.00 . A A . 8 ALA HB1 1 1 3 706 1 1 8 ALA HB2 H -3.637 7.689 -0.117 1.00 . A A . 8 ALA HB2 1 1 3 707 1 1 8 ALA HB3 H -3.752 9.372 0.397 1.00 . A A . 8 ALA HB3 1 1 3 708 1 1 8 ALA N N -5.037 7.893 -2.071 1.00 . A A . 8 ALA N 1 1 3 709 1 1 8 ALA O O -5.886 11.060 -0.640 1.00 . A A . 8 ALA O 1 1 3 710 1 1 9 PHE C C -5.853 12.441 -3.281 1.00 . A A . 9 PHE C 1 1 3 711 1 1 9 PHE CA C -4.485 11.899 -2.879 1.00 . A A . 9 PHE CA 1 1 3 712 1 1 9 PHE CB C -3.524 11.975 -4.067 1.00 . A A . 9 PHE CB 1 1 3 713 1 1 9 PHE CD1 C -2.718 14.349 -3.951 1.00 . A A . 9 PHE CD1 1 1 3 714 1 1 9 PHE CD2 C -1.126 12.597 -3.668 1.00 . A A . 9 PHE CD2 1 1 3 715 1 1 9 PHE CE1 C -1.717 15.288 -3.791 1.00 . A A . 9 PHE CE1 1 1 3 716 1 1 9 PHE CE2 C -0.120 13.531 -3.507 1.00 . A A . 9 PHE CE2 1 1 3 717 1 1 9 PHE CG C -2.434 12.994 -3.892 1.00 . A A . 9 PHE CG 1 1 3 718 1 1 9 PHE CZ C -0.417 14.879 -3.567 1.00 . A A . 9 PHE CZ 1 1 3 719 1 1 9 PHE H H -4.136 9.811 -2.894 1.00 . A A . 9 PHE H 1 1 3 720 1 1 9 PHE HA H -4.096 12.501 -2.072 1.00 . A A . 9 PHE HA 1 1 3 721 1 1 9 PHE HB2 H -3.057 11.011 -4.205 1.00 . A A . 9 PHE HB2 1 1 3 722 1 1 9 PHE HB3 H -4.081 12.232 -4.955 1.00 . A A . 9 PHE HB3 1 1 3 723 1 1 9 PHE HD1 H -3.735 14.670 -4.124 1.00 . A A . 9 PHE HD1 1 1 3 724 1 1 9 PHE HD2 H -0.893 11.542 -3.620 1.00 . A A . 9 PHE HD2 1 1 3 725 1 1 9 PHE HE1 H -1.951 16.341 -3.838 1.00 . A A . 9 PHE HE1 1 1 3 726 1 1 9 PHE HE2 H 0.895 13.208 -3.332 1.00 . A A . 9 PHE HE2 1 1 3 727 1 1 9 PHE HZ H 0.367 15.611 -3.442 1.00 . A A . 9 PHE HZ 1 1 3 728 1 1 9 PHE N N -4.591 10.525 -2.400 1.00 . A A . 9 PHE N 1 1 3 729 1 1 9 PHE O O -6.089 13.649 -3.246 1.00 . A A . 9 PHE O 1 1 3 730 1 1 10 ARG C C -8.934 12.343 -2.871 1.00 . A A . 10 ARG C 1 1 3 731 1 1 10 ARG CA C -8.095 11.927 -4.076 1.00 . A A . 10 ARG CA 1 1 3 732 1 1 10 ARG CB C -8.779 10.773 -4.812 1.00 . A A . 10 ARG CB 1 1 3 733 1 1 10 ARG CD C -9.497 10.818 -7.220 1.00 . A A . 10 ARG CD 1 1 3 734 1 1 10 ARG CG C -9.844 11.225 -5.797 1.00 . A A . 10 ARG CG 1 1 3 735 1 1 10 ARG CZ C -9.655 8.836 -8.666 1.00 . A A . 10 ARG CZ 1 1 3 736 1 1 10 ARG H H -6.504 10.591 -3.671 1.00 . A A . 10 ARG H 1 1 3 737 1 1 10 ARG HA H -8.008 12.769 -4.746 1.00 . A A . 10 ARG HA 1 1 3 738 1 1 10 ARG HB2 H -8.031 10.215 -5.356 1.00 . A A . 10 ARG HB2 1 1 3 739 1 1 10 ARG HB3 H -9.243 10.124 -4.085 1.00 . A A . 10 ARG HB3 1 1 3 740 1 1 10 ARG HD2 H -10.048 11.444 -7.905 1.00 . A A . 10 ARG HD2 1 1 3 741 1 1 10 ARG HD3 H -8.438 10.963 -7.373 1.00 . A A . 10 ARG HD3 1 1 3 742 1 1 10 ARG HE H -10.196 8.893 -6.747 1.00 . A A . 10 ARG HE 1 1 3 743 1 1 10 ARG HG2 H -10.787 10.774 -5.525 1.00 . A A . 10 ARG HG2 1 1 3 744 1 1 10 ARG HG3 H -9.931 12.301 -5.750 1.00 . A A . 10 ARG HG3 1 1 3 745 1 1 10 ARG HH11 H -8.912 10.485 -9.564 1.00 . A A . 10 ARG HH11 1 1 3 746 1 1 10 ARG HH12 H -9.029 9.081 -10.571 1.00 . A A . 10 ARG HH12 1 1 3 747 1 1 10 ARG HH21 H -10.355 7.037 -8.064 1.00 . A A . 10 ARG HH21 1 1 3 748 1 1 10 ARG HH22 H -9.850 7.121 -9.718 1.00 . A A . 10 ARG HH22 1 1 3 749 1 1 10 ARG N N -6.751 11.540 -3.664 1.00 . A A . 10 ARG N 1 1 3 750 1 1 10 ARG NE N -9.827 9.420 -7.485 1.00 . A A . 10 ARG NE 1 1 3 751 1 1 10 ARG NH1 N -9.158 9.524 -9.684 1.00 . A A . 10 ARG NH1 1 1 3 752 1 1 10 ARG NH2 N -9.980 7.559 -8.829 1.00 . A A . 10 ARG NH2 1 1 3 753 1 1 10 ARG O O -9.862 13.135 -3.028 1.00 . A A . 10 ARG O 1 1 3 754 1 1 11 . C C -9.146 13.596 -0.127 1.00 . A A . 11 SEP C 1 1 3 755 1 1 11 . CA C -9.342 12.139 -0.459 1.00 . A A . 11 SEP CA 1 1 3 756 1 1 11 . CB C -8.959 11.145 0.677 1.00 . A A . 11 SEP CB 1 1 3 757 1 1 11 . H H -7.819 11.162 -1.645 1.00 . A A . 11 SEP H 1 1 3 758 1 1 11 . HA H -10.414 11.992 -0.690 1.00 . A A . 11 SEP HA 1 1 3 759 1 1 11 . HB2 H -8.828 10.112 0.305 1.00 . A A . 11 SEP HB2 1 1 3 760 1 1 11 . HB3 H -7.979 11.393 1.132 1.00 . A A . 11 SEP HB3 1 1 3 761 1 1 11 . N N -8.593 11.807 -1.708 1.00 . A A . 11 SEP N 1 1 3 762 1 1 11 . O O -10.047 14.294 0.338 1.00 . A A . 11 SEP O 1 1 3 763 1 1 11 . O1P O -9.545 8.706 2.431 1.00 . A A . 11 SEP O1P 1 1 3 764 1 1 11 . O2P O -8.810 10.569 3.900 1.00 . A A . 11 SEP O2P 1 1 3 765 1 1 11 . O3P O -11.255 10.062 3.680 1.00 . A A . 11 SEP O3P 1 1 3 766 1 1 11 . OG O -9.972 11.123 1.710 1.00 . A A . 11 SEP OG 1 1 3 767 1 1 11 . P P -9.916 10.089 2.954 1.00 . A A . 11 SEP P 1 1 3 768 1 1 12 MET C C -8.294 16.388 -1.077 1.00 . A A . 12 MET C 1 1 3 769 1 1 12 MET CA C -7.570 15.450 -0.116 1.00 . A A . 12 MET CA 1 1 3 770 1 1 12 MET CB C -6.057 15.642 -0.240 1.00 . A A . 12 MET CB 1 1 3 771 1 1 12 MET CE C -3.714 17.414 2.594 1.00 . A A . 12 MET CE 1 1 3 772 1 1 12 MET CG C -5.346 15.746 1.100 1.00 . A A . 12 MET CG 1 1 3 773 1 1 12 MET H H -7.251 13.456 -0.750 1.00 . A A . 12 MET H 1 1 3 774 1 1 12 MET HA H -7.872 15.684 0.894 1.00 . A A . 12 MET HA 1 1 3 775 1 1 12 MET HB2 H -5.643 14.804 -0.779 1.00 . A A . 12 MET HB2 1 1 3 776 1 1 12 MET HB3 H -5.865 16.548 -0.795 1.00 . A A . 12 MET HB3 1 1 3 777 1 1 12 MET HE1 H -3.215 16.472 2.414 1.00 . A A . 12 MET HE1 1 1 3 778 1 1 12 MET HE2 H -3.093 18.223 2.242 1.00 . A A . 12 MET HE2 1 1 3 779 1 1 12 MET HE3 H -3.891 17.530 3.653 1.00 . A A . 12 MET HE3 1 1 3 780 1 1 12 MET HG2 H -5.871 15.134 1.819 1.00 . A A . 12 MET HG2 1 1 3 781 1 1 12 MET HG3 H -4.338 15.377 0.985 1.00 . A A . 12 MET HG3 1 1 3 782 1 1 12 MET N N -7.927 14.061 -0.379 1.00 . A A . 12 MET N 1 1 3 783 1 1 12 MET O O -8.524 17.557 -0.764 1.00 . A A . 12 MET O 1 1 3 784 1 1 12 MET SD S -5.278 17.437 1.722 1.00 . A A . 12 MET SD 1 1 3 785 1 1 13 PHE C C -10.773 16.973 -2.810 1.00 . A A . 13 PHE C 1 1 3 786 1 1 13 PHE CA C -9.347 16.662 -3.254 1.00 . A A . 13 PHE CA 1 1 3 787 1 1 13 PHE CB C -9.367 15.921 -4.592 1.00 . A A . 13 PHE CB 1 1 3 788 1 1 13 PHE CD1 C -6.968 16.395 -5.152 1.00 . A A . 13 PHE CD1 1 1 3 789 1 1 13 PHE CD2 C -8.618 16.772 -6.831 1.00 . A A . 13 PHE CD2 1 1 3 790 1 1 13 PHE CE1 C -5.980 16.810 -6.026 1.00 . A A . 13 PHE CE1 1 1 3 791 1 1 13 PHE CE2 C -7.635 17.188 -7.709 1.00 . A A . 13 PHE CE2 1 1 3 792 1 1 13 PHE CG C -8.296 16.372 -5.544 1.00 . A A . 13 PHE CG 1 1 3 793 1 1 13 PHE CZ C -6.315 17.206 -7.306 1.00 . A A . 13 PHE CZ 1 1 3 794 1 1 13 PHE H H -8.438 14.932 -2.439 1.00 . A A . 13 PHE H 1 1 3 795 1 1 13 PHE HA H -8.809 17.590 -3.375 1.00 . A A . 13 PHE HA 1 1 3 796 1 1 13 PHE HB2 H -9.228 14.865 -4.413 1.00 . A A . 13 PHE HB2 1 1 3 797 1 1 13 PHE HB3 H -10.323 16.078 -5.068 1.00 . A A . 13 PHE HB3 1 1 3 798 1 1 13 PHE HD1 H -6.704 16.085 -4.151 1.00 . A A . 13 PHE HD1 1 1 3 799 1 1 13 PHE HD2 H -9.652 16.757 -7.148 1.00 . A A . 13 PHE HD2 1 1 3 800 1 1 13 PHE HE1 H -4.948 16.824 -5.708 1.00 . A A . 13 PHE HE1 1 1 3 801 1 1 13 PHE HE2 H -7.900 17.496 -8.710 1.00 . A A . 13 PHE HE2 1 1 3 802 1 1 13 PHE HZ H -5.545 17.531 -7.990 1.00 . A A . 13 PHE HZ 1 1 3 803 1 1 13 PHE N N -8.650 15.870 -2.247 1.00 . A A . 13 PHE N 1 1 3 804 1 1 13 PHE O O -11.323 16.337 -1.910 1.00 . A A . 13 PHE O 1 1 3 805 1 1 14 PRO C C -13.797 17.405 -3.660 1.00 . A A . 14 PRO C 1 1 3 806 1 1 14 PRO CA C -12.757 18.395 -3.145 1.00 . A A . 14 PRO CA 1 1 3 807 1 1 14 PRO CB C -12.891 19.736 -3.870 1.00 . A A . 14 PRO CB 1 1 3 808 1 1 14 PRO CD C -10.792 18.777 -4.538 1.00 . A A . 14 PRO CD 1 1 3 809 1 1 14 PRO CG C -11.916 19.658 -4.994 1.00 . A A . 14 PRO CG 1 1 3 810 1 1 14 PRO HA H -12.896 18.542 -2.084 1.00 . A A . 14 PRO HA 1 1 3 811 1 1 14 PRO HB2 H -13.903 19.853 -4.232 1.00 . A A . 14 PRO HB2 1 1 3 812 1 1 14 PRO HB3 H -12.649 20.541 -3.193 1.00 . A A . 14 PRO HB3 1 1 3 813 1 1 14 PRO HD2 H -10.475 18.146 -5.355 1.00 . A A . 14 PRO HD2 1 1 3 814 1 1 14 PRO HD3 H -9.965 19.366 -4.171 1.00 . A A . 14 PRO HD3 1 1 3 815 1 1 14 PRO HG2 H -12.389 19.225 -5.862 1.00 . A A . 14 PRO HG2 1 1 3 816 1 1 14 PRO HG3 H -11.540 20.644 -5.223 1.00 . A A . 14 PRO HG3 1 1 3 817 1 1 14 PRO N N -11.387 17.976 -3.456 1.00 . A A . 14 PRO N 1 1 3 818 1 1 14 PRO O O -14.954 17.431 -3.239 1.00 . A A . 14 PRO O 1 1 3 819 1 1 15 SER C C -14.642 14.477 -4.112 1.00 . A A . 15 SER C 1 1 3 820 1 1 15 SER CA C -14.274 15.537 -5.146 1.00 . A A . 15 SER CA 1 1 3 821 1 1 15 SER CB C -13.623 14.875 -6.361 1.00 . A A . 15 SER CB 1 1 3 822 1 1 15 SER H H -12.443 16.563 -4.866 1.00 . A A . 15 SER H 1 1 3 823 1 1 15 SER HA H -15.174 16.044 -5.461 1.00 . A A . 15 SER HA 1 1 3 824 1 1 15 SER HB2 H -13.530 15.599 -7.156 1.00 . A A . 15 SER HB2 1 1 3 825 1 1 15 SER HB3 H -12.642 14.513 -6.088 1.00 . A A . 15 SER HB3 1 1 3 826 1 1 15 SER HG H -14.249 13.661 -7.766 1.00 . A A . 15 SER HG 1 1 3 827 1 1 15 SER N N -13.378 16.534 -4.571 1.00 . A A . 15 SER N 1 1 3 828 1 1 15 SER O O -15.701 13.855 -4.194 1.00 . A A . 15 SER O 1 1 3 829 1 1 15 SER OG O -14.400 13.785 -6.826 1.00 . A A . 15 SER OG 1 1 3 830 1 1 16 SER C C -15.112 13.739 -1.158 1.00 . A A . 16 SER C 1 1 3 831 1 1 16 SER CA C -13.989 13.291 -2.089 1.00 . A A . 16 SER CA 1 1 3 832 1 1 16 SER CB C -12.707 13.062 -1.286 1.00 . A A . 16 SER CB 1 1 3 833 1 1 16 SER H H -12.934 14.806 -3.126 1.00 . A A . 16 SER H 1 1 3 834 1 1 16 SER HA H -14.278 12.365 -2.563 1.00 . A A . 16 SER HA 1 1 3 835 1 1 16 SER HB2 H -12.639 12.020 -1.012 1.00 . A A . 16 SER HB2 1 1 3 836 1 1 16 SER HB3 H -11.854 13.331 -1.892 1.00 . A A . 16 SER HB3 1 1 3 837 1 1 16 SER HG H -11.908 14.394 -0.093 1.00 . A A . 16 SER HG 1 1 3 838 1 1 16 SER N N -13.760 14.278 -3.138 1.00 . A A . 16 SER N 1 1 3 839 1 1 16 SER O O -15.859 12.916 -0.630 1.00 . A A . 16 SER O 1 1 3 840 1 1 16 SER OG O -12.696 13.847 -0.107 1.00 . A A . 16 SER OG 1 1 3 841 1 1 17 GLU C C -17.527 15.902 -0.882 1.00 . A A . 17 GLU C 1 1 3 842 1 1 17 GLU CA C -16.254 15.606 -0.094 1.00 . A A . 17 GLU CA 1 1 3 843 1 1 17 GLU CB C -15.749 16.885 0.578 1.00 . A A . 17 GLU CB 1 1 3 844 1 1 17 GLU CD C -13.897 17.999 1.886 1.00 . A A . 17 GLU CD 1 1 3 845 1 1 17 GLU CG C -14.463 16.692 1.364 1.00 . A A . 17 GLU CG 1 1 3 846 1 1 17 GLU H H -14.597 15.655 -1.411 1.00 . A A . 17 GLU H 1 1 3 847 1 1 17 GLU HA H -16.478 14.875 0.667 1.00 . A A . 17 GLU HA 1 1 3 848 1 1 17 GLU HB2 H -15.575 17.632 -0.182 1.00 . A A . 17 GLU HB2 1 1 3 849 1 1 17 GLU HB3 H -16.510 17.245 1.256 1.00 . A A . 17 GLU HB3 1 1 3 850 1 1 17 GLU HG2 H -14.663 16.044 2.204 1.00 . A A . 17 GLU HG2 1 1 3 851 1 1 17 GLU HG3 H -13.729 16.230 0.721 1.00 . A A . 17 GLU HG3 1 1 3 852 1 1 17 GLU N N -15.223 15.049 -0.962 1.00 . A A . 17 GLU N 1 1 3 853 1 1 17 GLU O O -17.653 15.516 -2.044 1.00 . A A . 17 GLU O 1 1 3 854 1 1 17 GLU OE1 O -13.522 18.855 1.058 1.00 . A A . 17 GLU OE1 1 1 3 855 1 1 17 GLU OE2 O -13.829 18.165 3.122 1.00 . A A . 17 GLU OE2 1 1 4 856 1 1 1 ARG C C 2.670 2.288 -1.298 1.00 . A A . 1 ARG C 1 1 4 857 1 1 1 ARG CA C 2.699 0.910 -0.643 1.00 . A A . 1 ARG CA 1 1 4 858 1 1 1 ARG CB C 2.165 -0.141 -1.618 1.00 . A A . 1 ARG CB 1 1 4 859 1 1 1 ARG CD C 2.815 -2.358 -2.609 1.00 . A A . 1 ARG CD 1 1 4 860 1 1 1 ARG CG C 2.666 -1.547 -1.331 1.00 . A A . 1 ARG CG 1 1 4 861 1 1 1 ARG CZ C 4.030 -4.340 -3.408 1.00 . A A . 1 ARG CZ 1 1 4 862 1 1 1 ARG H1 H 1.984 0.135 1.193 1.00 . A A . 1 ARG H1 1 1 4 863 1 1 1 ARG HA H 3.719 0.667 -0.388 1.00 . A A . 1 ARG HA 1 1 4 864 1 1 1 ARG HB2 H 1.087 -0.150 -1.565 1.00 . A A . 1 ARG HB2 1 1 4 865 1 1 1 ARG HB3 H 2.467 0.128 -2.618 1.00 . A A . 1 ARG HB3 1 1 4 866 1 1 1 ARG HD2 H 1.837 -2.693 -2.923 1.00 . A A . 1 ARG HD2 1 1 4 867 1 1 1 ARG HD3 H 3.240 -1.724 -3.373 1.00 . A A . 1 ARG HD3 1 1 4 868 1 1 1 ARG HE H 4.009 -3.700 -1.519 1.00 . A A . 1 ARG HE 1 1 4 869 1 1 1 ARG HG2 H 3.629 -1.485 -0.844 1.00 . A A . 1 ARG HG2 1 1 4 870 1 1 1 ARG HG3 H 1.963 -2.044 -0.679 1.00 . A A . 1 ARG HG3 1 1 4 871 1 1 1 ARG HH11 H 3.004 -3.341 -4.832 1.00 . A A . 1 ARG HH11 1 1 4 872 1 1 1 ARG HH12 H 3.865 -4.740 -5.382 1.00 . A A . 1 ARG HH12 1 1 4 873 1 1 1 ARG HH21 H 5.147 -5.545 -2.230 1.00 . A A . 1 ARG HH21 1 1 4 874 1 1 1 ARG HH22 H 5.083 -5.993 -3.901 1.00 . A A . 1 ARG HH22 1 1 4 875 1 1 1 ARG N N 1.916 0.903 0.587 1.00 . A A . 1 ARG N 1 1 4 876 1 1 1 ARG NE N 3.677 -3.521 -2.423 1.00 . A A . 1 ARG NE 1 1 4 877 1 1 1 ARG NH1 N 3.597 -4.123 -4.642 1.00 . A A . 1 ARG NH1 1 1 4 878 1 1 1 ARG NH2 N 4.818 -5.378 -3.159 1.00 . A A . 1 ARG NH2 1 1 4 879 1 1 1 ARG O O 2.028 3.211 -0.796 1.00 . A A . 1 ARG O 1 1 4 880 1 1 2 SER C C 2.277 3.795 -4.138 1.00 . A A . 2 SER C 1 1 4 881 1 1 2 SER CA C 3.427 3.684 -3.142 1.00 . A A . 2 SER CA 1 1 4 882 1 1 2 SER CB C 4.765 3.819 -3.872 1.00 . A A . 2 SER CB 1 1 4 883 1 1 2 SER H H 3.860 1.645 -2.770 1.00 . A A . 2 SER H 1 1 4 884 1 1 2 SER HA H 3.340 4.482 -2.419 1.00 . A A . 2 SER HA 1 1 4 885 1 1 2 SER HB2 H 5.554 3.431 -3.246 1.00 . A A . 2 SER HB2 1 1 4 886 1 1 2 SER HB3 H 4.727 3.255 -4.794 1.00 . A A . 2 SER HB3 1 1 4 887 1 1 2 SER HG H 5.856 5.439 -3.735 1.00 . A A . 2 SER HG 1 1 4 888 1 1 2 SER N N 3.369 2.419 -2.420 1.00 . A A . 2 SER N 1 1 4 889 1 1 2 SER O O 1.820 4.892 -4.458 1.00 . A A . 2 SER O 1 1 4 890 1 1 2 SER OG O 5.046 5.174 -4.176 1.00 . A A . 2 SER OG 1 1 4 891 1 1 3 LYS C C -0.631 2.708 -4.876 1.00 . A A . 3 LYS C 1 1 4 892 1 1 3 LYS CA C 0.716 2.614 -5.586 1.00 . A A . 3 LYS CA 1 1 4 893 1 1 3 LYS CB C 0.778 1.330 -6.416 1.00 . A A . 3 LYS CB 1 1 4 894 1 1 3 LYS CD C 2.732 -0.163 -6.930 1.00 . A A . 3 LYS CD 1 1 4 895 1 1 3 LYS CE C 3.530 -0.644 -8.132 1.00 . A A . 3 LYS CE 1 1 4 896 1 1 3 LYS CG C 2.068 1.177 -7.203 1.00 . A A . 3 LYS CG 1 1 4 897 1 1 3 LYS H H 2.219 1.806 -4.333 1.00 . A A . 3 LYS H 1 1 4 898 1 1 3 LYS HA H 0.823 3.464 -6.243 1.00 . A A . 3 LYS HA 1 1 4 899 1 1 3 LYS HB2 H 0.682 0.482 -5.754 1.00 . A A . 3 LYS HB2 1 1 4 900 1 1 3 LYS HB3 H -0.047 1.327 -7.114 1.00 . A A . 3 LYS HB3 1 1 4 901 1 1 3 LYS HD2 H 3.399 -0.059 -6.088 1.00 . A A . 3 LYS HD2 1 1 4 902 1 1 3 LYS HD3 H 1.969 -0.893 -6.700 1.00 . A A . 3 LYS HD3 1 1 4 903 1 1 3 LYS HE2 H 3.734 0.199 -8.774 1.00 . A A . 3 LYS HE2 1 1 4 904 1 1 3 LYS HE3 H 4.462 -1.064 -7.784 1.00 . A A . 3 LYS HE3 1 1 4 905 1 1 3 LYS HG2 H 1.847 1.248 -8.258 1.00 . A A . 3 LYS HG2 1 1 4 906 1 1 3 LYS HG3 H 2.747 1.969 -6.922 1.00 . A A . 3 LYS HG3 1 1 4 907 1 1 3 LYS HZ1 H 3.416 -2.485 -9.113 1.00 . A A . 3 LYS HZ1 1 1 4 908 1 1 3 LYS HZ2 H 2.458 -1.277 -9.809 1.00 . A A . 3 LYS HZ2 1 1 4 909 1 1 3 LYS HZ3 H 1.973 -2.016 -8.367 1.00 . A A . 3 LYS HZ3 1 1 4 910 1 1 3 LYS N N 1.814 2.649 -4.626 1.00 . A A . 3 LYS N 1 1 4 911 1 1 3 LYS NZ N 2.793 -1.678 -8.910 1.00 . A A . 3 LYS NZ 1 1 4 912 1 1 3 LYS O O -1.606 3.207 -5.438 1.00 . A A . 3 LYS O 1 1 4 913 1 1 4 ASP C C -2.134 3.649 -2.261 1.00 . A A . 4 ASP C 1 1 4 914 1 1 4 ASP CA C -1.903 2.260 -2.850 1.00 . A A . 4 ASP CA 1 1 4 915 1 1 4 ASP CB C -1.843 1.221 -1.730 1.00 . A A . 4 ASP CB 1 1 4 916 1 1 4 ASP CG C -2.862 0.114 -1.912 1.00 . A A . 4 ASP CG 1 1 4 917 1 1 4 ASP H H 0.135 1.843 -3.244 1.00 . A A . 4 ASP H 1 1 4 918 1 1 4 ASP HA H -2.726 2.021 -3.507 1.00 . A A . 4 ASP HA 1 1 4 919 1 1 4 ASP HB2 H -0.858 0.778 -1.711 1.00 . A A . 4 ASP HB2 1 1 4 920 1 1 4 ASP HB3 H -2.032 1.709 -0.785 1.00 . A A . 4 ASP HB3 1 1 4 921 1 1 4 ASP N N -0.676 2.228 -3.638 1.00 . A A . 4 ASP N 1 1 4 922 1 1 4 ASP O O -3.272 4.045 -2.007 1.00 . A A . 4 ASP O 1 1 4 923 1 1 4 ASP OD1 O -3.015 -0.371 -3.053 1.00 . A A . 4 ASP OD1 1 1 4 924 1 1 4 ASP OD2 O -3.507 -0.269 -0.913 1.00 . A A . 4 ASP OD2 1 1 4 925 1 1 5 LEU C C -1.629 6.722 -2.529 1.00 . A A . 5 LEU C 1 1 4 926 1 1 5 LEU CA C -1.132 5.727 -1.486 1.00 . A A . 5 LEU CA 1 1 4 927 1 1 5 LEU CB C 0.235 6.166 -0.956 1.00 . A A . 5 LEU CB 1 1 4 928 1 1 5 LEU CD1 C 1.471 6.973 1.069 1.00 . A A . 5 LEU CD1 1 1 4 929 1 1 5 LEU CD2 C 0.083 8.571 -0.265 1.00 . A A . 5 LEU CD2 1 1 4 930 1 1 5 LEU CG C 0.216 7.136 0.225 1.00 . A A . 5 LEU CG 1 1 4 931 1 1 5 LEU H H -0.169 4.013 -2.269 1.00 . A A . 5 LEU H 1 1 4 932 1 1 5 LEU HA H -1.835 5.701 -0.667 1.00 . A A . 5 LEU HA 1 1 4 933 1 1 5 LEU HB2 H 0.770 5.281 -0.649 1.00 . A A . 5 LEU HB2 1 1 4 934 1 1 5 LEU HB3 H 0.766 6.642 -1.769 1.00 . A A . 5 LEU HB3 1 1 4 935 1 1 5 LEU HD11 H 1.327 6.172 1.778 1.00 . A A . 5 LEU HD11 1 1 4 936 1 1 5 LEU HD12 H 1.669 7.892 1.600 1.00 . A A . 5 LEU HD12 1 1 4 937 1 1 5 LEU HD13 H 2.308 6.741 0.428 1.00 . A A . 5 LEU HD13 1 1 4 938 1 1 5 LEU HD21 H -0.156 8.571 -1.318 1.00 . A A . 5 LEU HD21 1 1 4 939 1 1 5 LEU HD22 H 1.016 9.092 -0.107 1.00 . A A . 5 LEU HD22 1 1 4 940 1 1 5 LEU HD23 H -0.703 9.067 0.285 1.00 . A A . 5 LEU HD23 1 1 4 941 1 1 5 LEU HG H -0.637 6.915 0.851 1.00 . A A . 5 LEU HG 1 1 4 942 1 1 5 LEU N N -1.048 4.382 -2.046 1.00 . A A . 5 LEU N 1 1 4 943 1 1 5 LEU O O -2.240 7.736 -2.193 1.00 . A A . 5 LEU O 1 1 4 944 1 1 6 ARG C C -3.296 7.519 -4.852 1.00 . A A . 6 ARG C 1 1 4 945 1 1 6 ARG CA C -1.787 7.290 -4.890 1.00 . A A . 6 ARG CA 1 1 4 946 1 1 6 ARG CB C -1.387 6.683 -6.236 1.00 . A A . 6 ARG CB 1 1 4 947 1 1 6 ARG CD C 0.215 7.091 -8.129 1.00 . A A . 6 ARG CD 1 1 4 948 1 1 6 ARG CG C 0.057 6.957 -6.623 1.00 . A A . 6 ARG CG 1 1 4 949 1 1 6 ARG CZ C 1.592 8.386 -9.701 1.00 . A A . 6 ARG CZ 1 1 4 950 1 1 6 ARG H H -0.875 5.599 -4.003 1.00 . A A . 6 ARG H 1 1 4 951 1 1 6 ARG HA H -1.288 8.240 -4.772 1.00 . A A . 6 ARG HA 1 1 4 952 1 1 6 ARG HB2 H -1.527 5.612 -6.190 1.00 . A A . 6 ARG HB2 1 1 4 953 1 1 6 ARG HB3 H -2.026 7.089 -7.005 1.00 . A A . 6 ARG HB3 1 1 4 954 1 1 6 ARG HD2 H 0.655 6.183 -8.513 1.00 . A A . 6 ARG HD2 1 1 4 955 1 1 6 ARG HD3 H -0.762 7.231 -8.568 1.00 . A A . 6 ARG HD3 1 1 4 956 1 1 6 ARG HE H 1.252 8.889 -7.801 1.00 . A A . 6 ARG HE 1 1 4 957 1 1 6 ARG HG2 H 0.376 7.878 -6.156 1.00 . A A . 6 ARG HG2 1 1 4 958 1 1 6 ARG HG3 H 0.674 6.142 -6.275 1.00 . A A . 6 ARG HG3 1 1 4 959 1 1 6 ARG HH11 H 0.780 6.703 -10.469 1.00 . A A . 6 ARG HH11 1 1 4 960 1 1 6 ARG HH12 H 1.753 7.625 -11.566 1.00 . A A . 6 ARG HH12 1 1 4 961 1 1 6 ARG HH21 H 2.535 10.112 -9.236 1.00 . A A . 6 ARG HH21 1 1 4 962 1 1 6 ARG HH22 H 2.752 9.564 -10.864 1.00 . A A . 6 ARG HH22 1 1 4 963 1 1 6 ARG N N -1.366 6.423 -3.797 1.00 . A A . 6 ARG N 1 1 4 964 1 1 6 ARG NE N 1.065 8.221 -8.493 1.00 . A A . 6 ARG NE 1 1 4 965 1 1 6 ARG NH1 N 1.356 7.498 -10.657 1.00 . A A . 6 ARG NH1 1 1 4 966 1 1 6 ARG NH2 N 2.356 9.441 -9.955 1.00 . A A . 6 ARG NH2 1 1 4 967 1 1 6 ARG O O -3.783 8.580 -5.242 1.00 . A A . 6 ARG O 1 1 4 968 1 1 7 HIS C C -5.900 7.485 -3.116 1.00 . A A . 7 HIS C 1 1 4 969 1 1 7 HIS CA C -5.482 6.607 -4.292 1.00 . A A . 7 HIS CA 1 1 4 970 1 1 7 HIS CB C -6.094 5.213 -4.146 1.00 . A A . 7 HIS CB 1 1 4 971 1 1 7 HIS CD2 C -8.303 5.741 -5.399 1.00 . A A . 7 HIS CD2 1 1 4 972 1 1 7 HIS CE1 C -8.495 3.863 -6.514 1.00 . A A . 7 HIS CE1 1 1 4 973 1 1 7 HIS CG C -7.244 4.964 -5.073 1.00 . A A . 7 HIS CG 1 1 4 974 1 1 7 HIS H H -3.583 5.695 -4.086 1.00 . A A . 7 HIS H 1 1 4 975 1 1 7 HIS HA H -5.843 7.055 -5.205 1.00 . A A . 7 HIS HA 1 1 4 976 1 1 7 HIS HB2 H -5.336 4.472 -4.351 1.00 . A A . 7 HIS HB2 1 1 4 977 1 1 7 HIS HB3 H -6.450 5.088 -3.133 1.00 . A A . 7 HIS HB3 1 1 4 978 1 1 7 HIS HD1 H -6.785 3.028 -5.765 1.00 . A A . 7 HIS HD1 1 1 4 979 1 1 7 HIS HD2 H -8.510 6.734 -5.025 1.00 . A A . 7 HIS HD2 1 1 4 980 1 1 7 HIS HE1 H -8.867 3.093 -7.173 1.00 . A A . 7 HIS HE1 1 1 4 981 1 1 7 HIS N N -4.029 6.516 -4.381 1.00 . A A . 7 HIS N 1 1 4 982 1 1 7 HIS ND1 N -7.395 3.794 -5.787 1.00 . A A . 7 HIS ND1 1 1 4 983 1 1 7 HIS NE2 N -9.065 5.035 -6.296 1.00 . A A . 7 HIS NE2 1 1 4 984 1 1 7 HIS O O -7.029 7.973 -3.064 1.00 . A A . 7 HIS O 1 1 4 985 1 1 8 ALA C C -5.231 9.984 -1.348 1.00 . A A . 8 ALA C 1 1 4 986 1 1 8 ALA CA C -5.257 8.499 -1.000 1.00 . A A . 8 ALA CA 1 1 4 987 1 1 8 ALA CB C -4.251 8.196 0.101 1.00 . A A . 8 ALA CB 1 1 4 988 1 1 8 ALA H H -4.102 7.264 -2.272 1.00 . A A . 8 ALA H 1 1 4 989 1 1 8 ALA HA H -6.241 8.242 -0.635 1.00 . A A . 8 ALA HA 1 1 4 990 1 1 8 ALA HB1 H -4.217 7.130 0.273 1.00 . A A . 8 ALA HB1 1 1 4 991 1 1 8 ALA HB2 H -3.274 8.544 -0.199 1.00 . A A . 8 ALA HB2 1 1 4 992 1 1 8 ALA HB3 H -4.549 8.698 1.009 1.00 . A A . 8 ALA HB3 1 1 4 993 1 1 8 ALA N N -4.983 7.680 -2.174 1.00 . A A . 8 ALA N 1 1 4 994 1 1 8 ALA O O -5.826 10.805 -0.651 1.00 . A A . 8 ALA O 1 1 4 995 1 1 9 PHE C C -5.806 12.268 -3.231 1.00 . A A . 9 PHE C 1 1 4 996 1 1 9 PHE CA C -4.433 11.707 -2.871 1.00 . A A . 9 PHE CA 1 1 4 997 1 1 9 PHE CB C -3.495 11.813 -4.075 1.00 . A A . 9 PHE CB 1 1 4 998 1 1 9 PHE CD1 C -1.295 10.835 -3.366 1.00 . A A . 9 PHE CD1 1 1 4 999 1 1 9 PHE CD2 C -1.440 13.196 -3.671 1.00 . A A . 9 PHE CD2 1 1 4 1000 1 1 9 PHE CE1 C 0.037 10.958 -3.018 1.00 . A A . 9 PHE CE1 1 1 4 1001 1 1 9 PHE CE2 C -0.109 13.325 -3.324 1.00 . A A . 9 PHE CE2 1 1 4 1002 1 1 9 PHE CG C -2.048 11.950 -3.697 1.00 . A A . 9 PHE CG 1 1 4 1003 1 1 9 PHE CZ C 0.630 12.205 -2.996 1.00 . A A . 9 PHE CZ 1 1 4 1004 1 1 9 PHE H H -4.085 9.620 -2.946 1.00 . A A . 9 PHE H 1 1 4 1005 1 1 9 PHE HA H -4.025 12.283 -2.055 1.00 . A A . 9 PHE HA 1 1 4 1006 1 1 9 PHE HB2 H -3.596 10.925 -4.680 1.00 . A A . 9 PHE HB2 1 1 4 1007 1 1 9 PHE HB3 H -3.770 12.676 -4.661 1.00 . A A . 9 PHE HB3 1 1 4 1008 1 1 9 PHE HD1 H -1.759 9.859 -3.383 1.00 . A A . 9 PHE HD1 1 1 4 1009 1 1 9 PHE HD2 H -2.017 14.072 -3.926 1.00 . A A . 9 PHE HD2 1 1 4 1010 1 1 9 PHE HE1 H 0.611 10.080 -2.763 1.00 . A A . 9 PHE HE1 1 1 4 1011 1 1 9 PHE HE2 H 0.353 14.301 -3.308 1.00 . A A . 9 PHE HE2 1 1 4 1012 1 1 9 PHE HZ H 1.671 12.303 -2.726 1.00 . A A . 9 PHE HZ 1 1 4 1013 1 1 9 PHE N N -4.538 10.321 -2.431 1.00 . A A . 9 PHE N 1 1 4 1014 1 1 9 PHE O O -6.036 13.475 -3.149 1.00 . A A . 9 PHE O 1 1 4 1015 1 1 10 ARG C C -8.879 12.167 -2.770 1.00 . A A . 10 ARG C 1 1 4 1016 1 1 10 ARG CA C -8.064 11.790 -4.003 1.00 . A A . 10 ARG CA 1 1 4 1017 1 1 10 ARG CB C -8.764 10.665 -4.767 1.00 . A A . 10 ARG CB 1 1 4 1018 1 1 10 ARG CD C -10.045 11.148 -6.875 1.00 . A A . 10 ARG CD 1 1 4 1019 1 1 10 ARG CG C -8.687 10.814 -6.278 1.00 . A A . 10 ARG CG 1 1 4 1020 1 1 10 ARG CZ C -9.565 10.902 -9.274 1.00 . A A . 10 ARG CZ 1 1 4 1021 1 1 10 ARG H H -6.471 10.435 -3.674 1.00 . A A . 10 ARG H 1 1 4 1022 1 1 10 ARG HA H -7.984 12.654 -4.646 1.00 . A A . 10 ARG HA 1 1 4 1023 1 1 10 ARG HB2 H -8.309 9.724 -4.497 1.00 . A A . 10 ARG HB2 1 1 4 1024 1 1 10 ARG HB3 H -9.805 10.647 -4.482 1.00 . A A . 10 ARG HB3 1 1 4 1025 1 1 10 ARG HD2 H -10.815 10.790 -6.207 1.00 . A A . 10 ARG HD2 1 1 4 1026 1 1 10 ARG HD3 H -10.126 12.220 -6.976 1.00 . A A . 10 ARG HD3 1 1 4 1027 1 1 10 ARG HE H -10.889 9.809 -8.258 1.00 . A A . 10 ARG HE 1 1 4 1028 1 1 10 ARG HG2 H -7.996 11.610 -6.517 1.00 . A A . 10 ARG HG2 1 1 4 1029 1 1 10 ARG HG3 H -8.333 9.887 -6.704 1.00 . A A . 10 ARG HG3 1 1 4 1030 1 1 10 ARG HH11 H -8.498 12.338 -8.336 1.00 . A A . 10 ARG HH11 1 1 4 1031 1 1 10 ARG HH12 H -8.169 12.154 -10.027 1.00 . A A . 10 ARG HH12 1 1 4 1032 1 1 10 ARG HH21 H -10.464 9.557 -10.485 1.00 . A A . 10 ARG HH21 1 1 4 1033 1 1 10 ARG HH22 H -9.289 10.573 -11.249 1.00 . A A . 10 ARG HH22 1 1 4 1034 1 1 10 ARG N N -6.714 11.384 -3.629 1.00 . A A . 10 ARG N 1 1 4 1035 1 1 10 ARG NE N -10.233 10.533 -8.186 1.00 . A A . 10 ARG NE 1 1 4 1036 1 1 10 ARG NH1 N -8.671 11.879 -9.207 1.00 . A A . 10 ARG NH1 1 1 4 1037 1 1 10 ARG NH2 N -9.791 10.294 -10.431 1.00 . A A . 10 ARG NH2 1 1 4 1038 1 1 10 ARG O O -9.807 12.967 -2.884 1.00 . A A . 10 ARG O 1 1 4 1039 1 1 11 . C C -9.018 13.318 0.032 1.00 . A A . 11 SEP C 1 1 4 1040 1 1 11 . CA C -9.246 11.881 -0.361 1.00 . A A . 11 SEP CA 1 1 4 1041 1 1 11 . CB C -8.868 10.831 0.725 1.00 . A A . 11 SEP CB 1 1 4 1042 1 1 11 . H H -7.748 10.940 -1.606 1.00 . A A . 11 SEP H 1 1 4 1043 1 1 11 . HA H -10.324 11.765 -0.582 1.00 . A A . 11 SEP HA 1 1 4 1044 1 1 11 . HB2 H -9.224 9.816 0.470 1.00 . A A . 11 SEP HB2 1 1 4 1045 1 1 11 . HB3 H -7.770 10.714 0.825 1.00 . A A . 11 SEP HB3 1 1 4 1046 1 1 11 . N N -8.521 11.590 -1.633 1.00 . A A . 11 SEP N 1 1 4 1047 1 1 11 . O O -9.898 14.011 0.540 1.00 . A A . 11 SEP O 1 1 4 1048 1 1 11 . O1P O -11.533 9.975 2.805 1.00 . A A . 11 SEP O1P 1 1 4 1049 1 1 11 . O2P O -9.381 8.743 2.688 1.00 . A A . 11 SEP O2P 1 1 4 1050 1 1 11 . O3P O -9.717 10.472 4.472 1.00 . A A . 11 SEP O3P 1 1 4 1051 1 1 11 . OG O -9.426 11.190 2.011 1.00 . A A . 11 SEP OG 1 1 4 1052 1 1 11 . P P -10.030 10.088 3.031 1.00 . A A . 11 SEP P 1 1 4 1053 1 1 12 MET C C -8.129 16.133 -0.802 1.00 . A A . 12 MET C 1 1 4 1054 1 1 12 MET CA C -7.405 15.139 0.102 1.00 . A A . 12 MET CA 1 1 4 1055 1 1 12 MET CB C -5.892 15.310 -0.042 1.00 . A A . 12 MET CB 1 1 4 1056 1 1 12 MET CE C -4.614 18.611 -1.319 1.00 . A A . 12 MET CE 1 1 4 1057 1 1 12 MET CG C -5.379 16.643 0.477 1.00 . A A . 12 MET CG 1 1 4 1058 1 1 12 MET H H -7.134 13.169 -0.623 1.00 . A A . 12 MET H 1 1 4 1059 1 1 12 MET HA H -7.684 15.333 1.126 1.00 . A A . 12 MET HA 1 1 4 1060 1 1 12 MET HB2 H -5.399 14.521 0.505 1.00 . A A . 12 MET HB2 1 1 4 1061 1 1 12 MET HB3 H -5.630 15.231 -1.087 1.00 . A A . 12 MET HB3 1 1 4 1062 1 1 12 MET HE1 H -5.282 19.163 -0.673 1.00 . A A . 12 MET HE1 1 1 4 1063 1 1 12 MET HE2 H -3.816 19.258 -1.650 1.00 . A A . 12 MET HE2 1 1 4 1064 1 1 12 MET HE3 H -5.161 18.246 -2.175 1.00 . A A . 12 MET HE3 1 1 4 1065 1 1 12 MET HG2 H -6.162 17.379 0.378 1.00 . A A . 12 MET HG2 1 1 4 1066 1 1 12 MET HG3 H -5.122 16.532 1.521 1.00 . A A . 12 MET HG3 1 1 4 1067 1 1 12 MET N N -7.793 13.770 -0.216 1.00 . A A . 12 MET N 1 1 4 1068 1 1 12 MET O O -8.331 17.290 -0.432 1.00 . A A . 12 MET O 1 1 4 1069 1 1 12 MET SD S -3.925 17.224 -0.418 1.00 . A A . 12 MET SD 1 1 4 1070 1 1 13 PHE C C -10.628 16.840 -2.459 1.00 . A A . 13 PHE C 1 1 4 1071 1 1 13 PHE CA C -9.217 16.523 -2.944 1.00 . A A . 13 PHE CA 1 1 4 1072 1 1 13 PHE CB C -9.277 15.844 -4.313 1.00 . A A . 13 PHE CB 1 1 4 1073 1 1 13 PHE CD1 C -6.867 16.037 -4.987 1.00 . A A . 13 PHE CD1 1 1 4 1074 1 1 13 PHE CD2 C -8.523 16.992 -6.413 1.00 . A A . 13 PHE CD2 1 1 4 1075 1 1 13 PHE CE1 C -5.875 16.457 -5.853 1.00 . A A . 13 PHE CE1 1 1 4 1076 1 1 13 PHE CE2 C -7.535 17.414 -7.283 1.00 . A A . 13 PHE CE2 1 1 4 1077 1 1 13 PHE CG C -8.201 16.300 -5.257 1.00 . A A . 13 PHE CG 1 1 4 1078 1 1 13 PHE CZ C -6.210 17.145 -7.003 1.00 . A A . 13 PHE CZ 1 1 4 1079 1 1 13 PHE H H -8.327 14.742 -2.224 1.00 . A A . 13 PHE H 1 1 4 1080 1 1 13 PHE HA H -8.664 17.446 -3.033 1.00 . A A . 13 PHE HA 1 1 4 1081 1 1 13 PHE HB2 H -9.172 14.777 -4.183 1.00 . A A . 13 PHE HB2 1 1 4 1082 1 1 13 PHE HB3 H -10.232 16.054 -4.770 1.00 . A A . 13 PHE HB3 1 1 4 1083 1 1 13 PHE HD1 H -6.604 15.497 -4.089 1.00 . A A . 13 PHE HD1 1 1 4 1084 1 1 13 PHE HD2 H -9.560 17.203 -6.633 1.00 . A A . 13 PHE HD2 1 1 4 1085 1 1 13 PHE HE1 H -4.840 16.244 -5.632 1.00 . A A . 13 PHE HE1 1 1 4 1086 1 1 13 PHE HE2 H -7.800 17.952 -8.181 1.00 . A A . 13 PHE HE2 1 1 4 1087 1 1 13 PHE HZ H -5.437 17.474 -7.681 1.00 . A A . 13 PHE HZ 1 1 4 1088 1 1 13 PHE N N -8.517 15.674 -1.987 1.00 . A A . 13 PHE N 1 1 4 1089 1 1 13 PHE O O -11.173 16.175 -1.578 1.00 . A A . 13 PHE O 1 1 4 1090 1 1 14 PRO C C -13.659 17.365 -3.228 1.00 . A A . 14 PRO C 1 1 4 1091 1 1 14 PRO CA C -12.591 18.311 -2.691 1.00 . A A . 14 PRO CA 1 1 4 1092 1 1 14 PRO CB C -12.713 19.686 -3.353 1.00 . A A . 14 PRO CB 1 1 4 1093 1 1 14 PRO CD C -10.646 18.720 -4.103 1.00 . A A . 14 PRO CD 1 1 4 1094 1 1 14 PRO CG C -11.761 19.641 -4.497 1.00 . A A . 14 PRO CG 1 1 4 1095 1 1 14 PRO HA H -12.708 18.413 -1.621 1.00 . A A . 14 PRO HA 1 1 4 1096 1 1 14 PRO HB2 H -13.729 19.838 -3.688 1.00 . A A . 14 PRO HB2 1 1 4 1097 1 1 14 PRO HB3 H -12.443 20.455 -2.645 1.00 . A A . 14 PRO HB3 1 1 4 1098 1 1 14 PRO HD2 H -10.356 18.121 -4.954 1.00 . A A . 14 PRO HD2 1 1 4 1099 1 1 14 PRO HD3 H -9.801 19.277 -3.726 1.00 . A A . 14 PRO HD3 1 1 4 1100 1 1 14 PRO HG2 H -12.260 19.259 -5.375 1.00 . A A . 14 PRO HG2 1 1 4 1101 1 1 14 PRO HG3 H -11.369 20.629 -4.687 1.00 . A A . 14 PRO HG3 1 1 4 1102 1 1 14 PRO N N -11.236 17.882 -3.046 1.00 . A A . 14 PRO N 1 1 4 1103 1 1 14 PRO O O -14.807 17.393 -2.785 1.00 . A A . 14 PRO O 1 1 4 1104 1 1 15 SER C C -14.569 14.476 -3.792 1.00 . A A . 15 SER C 1 1 4 1105 1 1 15 SER CA C -14.199 15.573 -4.786 1.00 . A A . 15 SER CA 1 1 4 1106 1 1 15 SER CB C -13.583 14.954 -6.041 1.00 . A A . 15 SER CB 1 1 4 1107 1 1 15 SER H H -12.344 16.552 -4.496 1.00 . A A . 15 SER H 1 1 4 1108 1 1 15 SER HA H -15.095 16.110 -5.061 1.00 . A A . 15 SER HA 1 1 4 1109 1 1 15 SER HB2 H -12.813 14.254 -5.754 1.00 . A A . 15 SER HB2 1 1 4 1110 1 1 15 SER HB3 H -14.351 14.436 -6.598 1.00 . A A . 15 SER HB3 1 1 4 1111 1 1 15 SER HG H -13.416 15.914 -7.741 1.00 . A A . 15 SER HG 1 1 4 1112 1 1 15 SER N N -13.273 16.527 -4.185 1.00 . A A . 15 SER N 1 1 4 1113 1 1 15 SER O O -15.641 13.878 -3.882 1.00 . A A . 15 SER O 1 1 4 1114 1 1 15 SER OG O -13.009 15.948 -6.872 1.00 . A A . 15 SER OG 1 1 4 1115 1 1 16 SER C C -14.999 13.617 -0.865 1.00 . A A . 16 SER C 1 1 4 1116 1 1 16 SER CA C -13.902 13.190 -1.836 1.00 . A A . 16 SER CA 1 1 4 1117 1 1 16 SER CB C -12.611 12.901 -1.069 1.00 . A A . 16 SER CB 1 1 4 1118 1 1 16 SER H H -12.837 14.729 -2.826 1.00 . A A . 16 SER H 1 1 4 1119 1 1 16 SER HA H -14.218 12.291 -2.344 1.00 . A A . 16 SER HA 1 1 4 1120 1 1 16 SER HB2 H -12.500 11.835 -0.943 1.00 . A A . 16 SER HB2 1 1 4 1121 1 1 16 SER HB3 H -11.770 13.287 -1.627 1.00 . A A . 16 SER HB3 1 1 4 1122 1 1 16 SER HG H -13.194 13.006 0.798 1.00 . A A . 16 SER HG 1 1 4 1123 1 1 16 SER N N -13.673 14.218 -2.845 1.00 . A A . 16 SER N 1 1 4 1124 1 1 16 SER O O -15.684 12.779 -0.280 1.00 . A A . 16 SER O 1 1 4 1125 1 1 16 SER OG O -12.630 13.512 0.210 1.00 . A A . 16 SER OG 1 1 4 1126 1 1 17 GLU C C -17.515 15.599 -0.511 1.00 . A A . 17 GLU C 1 1 4 1127 1 1 17 GLU CA C -16.172 15.464 0.200 1.00 . A A . 17 GLU CA 1 1 4 1128 1 1 17 GLU CB C -15.731 16.825 0.743 1.00 . A A . 17 GLU CB 1 1 4 1129 1 1 17 GLU CD C -17.830 17.007 2.137 1.00 . A A . 17 GLU CD 1 1 4 1130 1 1 17 GLU CG C -16.321 17.157 2.104 1.00 . A A . 17 GLU CG 1 1 4 1131 1 1 17 GLU H H -14.582 15.544 -1.196 1.00 . A A . 17 GLU H 1 1 4 1132 1 1 17 GLU HA H -16.282 14.776 1.024 1.00 . A A . 17 GLU HA 1 1 4 1133 1 1 17 GLU HB2 H -14.654 16.834 0.829 1.00 . A A . 17 GLU HB2 1 1 4 1134 1 1 17 GLU HB3 H -16.034 17.592 0.046 1.00 . A A . 17 GLU HB3 1 1 4 1135 1 1 17 GLU HG2 H -15.893 16.493 2.840 1.00 . A A . 17 GLU HG2 1 1 4 1136 1 1 17 GLU HG3 H -16.070 18.178 2.352 1.00 . A A . 17 GLU HG3 1 1 4 1137 1 1 17 GLU N N -15.159 14.926 -0.701 1.00 . A A . 17 GLU N 1 1 4 1138 1 1 17 GLU O O -17.831 14.825 -1.414 1.00 . A A . 17 GLU O 1 1 4 1139 1 1 17 GLU OE1 O -18.527 17.919 1.645 1.00 . A A . 17 GLU OE1 1 1 4 1140 1 1 17 GLU OE2 O -18.313 15.979 2.656 1.00 . A A . 17 GLU OE2 1 1 5 1141 1 1 1 ARG C C 3.034 2.030 -1.472 1.00 . A A . 1 ARG C 1 1 5 1142 1 1 1 ARG CA C 3.183 0.596 -0.974 1.00 . A A . 1 ARG CA 1 1 5 1143 1 1 1 ARG CB C 2.689 -0.381 -2.042 1.00 . A A . 1 ARG CB 1 1 5 1144 1 1 1 ARG CD C 3.334 -2.537 -3.160 1.00 . A A . 1 ARG CD 1 1 5 1145 1 1 1 ARG CG C 3.176 -1.806 -1.836 1.00 . A A . 1 ARG CG 1 1 5 1146 1 1 1 ARG CZ C 3.252 -4.881 -2.422 1.00 . A A . 1 ARG CZ 1 1 5 1147 1 1 1 ARG H1 H 2.934 0.419 1.121 1.00 . A A . 1 ARG H1 1 1 5 1148 1 1 1 ARG HA H 4.226 0.403 -0.776 1.00 . A A . 1 ARG HA 1 1 5 1149 1 1 1 ARG HB2 H 1.609 -0.388 -2.035 1.00 . A A . 1 ARG HB2 1 1 5 1150 1 1 1 ARG HB3 H 3.032 -0.042 -3.008 1.00 . A A . 1 ARG HB3 1 1 5 1151 1 1 1 ARG HD2 H 2.849 -1.962 -3.934 1.00 . A A . 1 ARG HD2 1 1 5 1152 1 1 1 ARG HD3 H 4.387 -2.625 -3.383 1.00 . A A . 1 ARG HD3 1 1 5 1153 1 1 1 ARG HE H 1.929 -4.024 -3.644 1.00 . A A . 1 ARG HE 1 1 5 1154 1 1 1 ARG HG2 H 4.132 -1.781 -1.335 1.00 . A A . 1 ARG HG2 1 1 5 1155 1 1 1 ARG HG3 H 2.460 -2.336 -1.225 1.00 . A A . 1 ARG HG3 1 1 5 1156 1 1 1 ARG HH11 H 4.803 -3.813 -1.690 1.00 . A A . 1 ARG HH11 1 1 5 1157 1 1 1 ARG HH12 H 4.733 -5.467 -1.177 1.00 . A A . 1 ARG HH12 1 1 5 1158 1 1 1 ARG HH21 H 1.826 -6.202 -2.976 1.00 . A A . 1 ARG HH21 1 1 5 1159 1 1 1 ARG HH22 H 3.040 -6.825 -1.910 1.00 . A A . 1 ARG HH22 1 1 5 1160 1 1 1 ARG N N 2.448 0.400 0.270 1.00 . A A . 1 ARG N 1 1 5 1161 1 1 1 ARG NE N 2.744 -3.873 -3.122 1.00 . A A . 1 ARG NE 1 1 5 1162 1 1 1 ARG NH1 N 4.353 -4.706 -1.705 1.00 . A A . 1 ARG NH1 1 1 5 1163 1 1 1 ARG NH2 N 2.657 -6.067 -2.437 1.00 . A A . 1 ARG NH2 1 1 5 1164 1 1 1 ARG O O 2.341 2.843 -0.859 1.00 . A A . 1 ARG O 1 1 5 1165 1 1 2 SER C C 2.386 3.838 -4.031 1.00 . A A . 2 SER C 1 1 5 1166 1 1 2 SER CA C 3.633 3.672 -3.167 1.00 . A A . 2 SER CA 1 1 5 1167 1 1 2 SER CB C 4.885 3.941 -4.003 1.00 . A A . 2 SER CB 1 1 5 1168 1 1 2 SER H H 4.225 1.643 -3.031 1.00 . A A . 2 SER H 1 1 5 1169 1 1 2 SER HA H 3.592 4.383 -2.356 1.00 . A A . 2 SER HA 1 1 5 1170 1 1 2 SER HB2 H 5.396 3.009 -4.194 1.00 . A A . 2 SER HB2 1 1 5 1171 1 1 2 SER HB3 H 4.598 4.392 -4.942 1.00 . A A . 2 SER HB3 1 1 5 1172 1 1 2 SER HG H 6.599 4.363 -3.154 1.00 . A A . 2 SER HG 1 1 5 1173 1 1 2 SER N N 3.689 2.334 -2.588 1.00 . A A . 2 SER N 1 1 5 1174 1 1 2 SER O O 1.828 4.931 -4.132 1.00 . A A . 2 SER O 1 1 5 1175 1 1 2 SER OG O 5.771 4.817 -3.328 1.00 . A A . 2 SER OG 1 1 5 1176 1 1 3 LYS C C -0.502 2.842 -4.670 1.00 . A A . 3 LYS C 1 1 5 1177 1 1 3 LYS CA C 0.772 2.767 -5.505 1.00 . A A . 3 LYS CA 1 1 5 1178 1 1 3 LYS CB C 0.739 1.523 -6.396 1.00 . A A . 3 LYS CB 1 1 5 1179 1 1 3 LYS CD C 0.346 1.519 -8.877 1.00 . A A . 3 LYS CD 1 1 5 1180 1 1 3 LYS CE C -0.789 2.529 -8.805 1.00 . A A . 3 LYS CE 1 1 5 1181 1 1 3 LYS CG C 1.359 1.739 -7.766 1.00 . A A . 3 LYS CG 1 1 5 1182 1 1 3 LYS H H 2.441 1.903 -4.531 1.00 . A A . 3 LYS H 1 1 5 1183 1 1 3 LYS HA H 0.830 3.646 -6.130 1.00 . A A . 3 LYS HA 1 1 5 1184 1 1 3 LYS HB2 H 1.276 0.727 -5.902 1.00 . A A . 3 LYS HB2 1 1 5 1185 1 1 3 LYS HB3 H -0.290 1.221 -6.533 1.00 . A A . 3 LYS HB3 1 1 5 1186 1 1 3 LYS HD2 H 0.843 1.620 -9.831 1.00 . A A . 3 LYS HD2 1 1 5 1187 1 1 3 LYS HD3 H -0.064 0.523 -8.787 1.00 . A A . 3 LYS HD3 1 1 5 1188 1 1 3 LYS HE2 H -0.570 3.242 -8.025 1.00 . A A . 3 LYS HE2 1 1 5 1189 1 1 3 LYS HE3 H -0.857 3.043 -9.753 1.00 . A A . 3 LYS HE3 1 1 5 1190 1 1 3 LYS HG2 H 1.730 2.751 -7.827 1.00 . A A . 3 LYS HG2 1 1 5 1191 1 1 3 LYS HG3 H 2.177 1.045 -7.894 1.00 . A A . 3 LYS HG3 1 1 5 1192 1 1 3 LYS HZ1 H -1.951 1.043 -7.907 1.00 . A A . 3 LYS HZ1 1 1 5 1193 1 1 3 LYS HZ2 H -2.548 1.573 -9.399 1.00 . A A . 3 LYS HZ2 1 1 5 1194 1 1 3 LYS HZ3 H -2.726 2.542 -8.025 1.00 . A A . 3 LYS HZ3 1 1 5 1195 1 1 3 LYS N N 1.954 2.746 -4.651 1.00 . A A . 3 LYS N 1 1 5 1196 1 1 3 LYS NZ N -2.095 1.876 -8.513 1.00 . A A . 3 LYS NZ 1 1 5 1197 1 1 3 LYS O O -1.517 3.377 -5.115 1.00 . A A . 3 LYS O 1 1 5 1198 1 1 4 ASP C C -1.809 3.700 -1.969 1.00 . A A . 4 ASP C 1 1 5 1199 1 1 4 ASP CA C -1.590 2.310 -2.559 1.00 . A A . 4 ASP CA 1 1 5 1200 1 1 4 ASP CB C -1.392 1.292 -1.435 1.00 . A A . 4 ASP CB 1 1 5 1201 1 1 4 ASP CG C -2.417 0.176 -1.478 1.00 . A A . 4 ASP CG 1 1 5 1202 1 1 4 ASP H H 0.397 1.890 -3.159 1.00 . A A . 4 ASP H 1 1 5 1203 1 1 4 ASP HA H -2.462 2.035 -3.132 1.00 . A A . 4 ASP HA 1 1 5 1204 1 1 4 ASP HB2 H -0.408 0.854 -1.523 1.00 . A A . 4 ASP HB2 1 1 5 1205 1 1 4 ASP HB3 H -1.473 1.795 -0.483 1.00 . A A . 4 ASP HB3 1 1 5 1206 1 1 4 ASP N N -0.441 2.303 -3.457 1.00 . A A . 4 ASP N 1 1 5 1207 1 1 4 ASP O O -2.944 4.106 -1.713 1.00 . A A . 4 ASP O 1 1 5 1208 1 1 4 ASP OD1 O -2.861 -0.180 -2.590 1.00 . A A . 4 ASP OD1 1 1 5 1209 1 1 4 ASP OD2 O -2.776 -0.341 -0.399 1.00 . A A . 4 ASP OD2 1 1 5 1210 1 1 5 LEU C C -1.281 6.770 -2.238 1.00 . A A . 5 LEU C 1 1 5 1211 1 1 5 LEU CA C -0.789 5.771 -1.196 1.00 . A A . 5 LEU CA 1 1 5 1212 1 1 5 LEU CB C 0.581 6.200 -0.669 1.00 . A A . 5 LEU CB 1 1 5 1213 1 1 5 LEU CD1 C 0.365 5.870 1.806 1.00 . A A . 5 LEU CD1 1 1 5 1214 1 1 5 LEU CD2 C 1.901 7.630 0.912 1.00 . A A . 5 LEU CD2 1 1 5 1215 1 1 5 LEU CG C 0.591 6.886 0.698 1.00 . A A . 5 LEU CG 1 1 5 1216 1 1 5 LEU H H 0.159 4.049 -1.981 1.00 . A A . 5 LEU H 1 1 5 1217 1 1 5 LEU HA H -1.491 5.750 -0.375 1.00 . A A . 5 LEU HA 1 1 5 1218 1 1 5 LEU HB2 H 1.200 5.318 -0.600 1.00 . A A . 5 LEU HB2 1 1 5 1219 1 1 5 LEU HB3 H 1.011 6.884 -1.387 1.00 . A A . 5 LEU HB3 1 1 5 1220 1 1 5 LEU HD11 H -0.020 6.371 2.681 1.00 . A A . 5 LEU HD11 1 1 5 1221 1 1 5 LEU HD12 H 1.301 5.389 2.050 1.00 . A A . 5 LEU HD12 1 1 5 1222 1 1 5 LEU HD13 H -0.345 5.127 1.475 1.00 . A A . 5 LEU HD13 1 1 5 1223 1 1 5 LEU HD21 H 2.263 8.000 -0.035 1.00 . A A . 5 LEU HD21 1 1 5 1224 1 1 5 LEU HD22 H 2.630 6.958 1.339 1.00 . A A . 5 LEU HD22 1 1 5 1225 1 1 5 LEU HD23 H 1.738 8.459 1.585 1.00 . A A . 5 LEU HD23 1 1 5 1226 1 1 5 LEU HG H -0.215 7.606 0.737 1.00 . A A . 5 LEU HG 1 1 5 1227 1 1 5 LEU N N -0.717 4.426 -1.756 1.00 . A A . 5 LEU N 1 1 5 1228 1 1 5 LEU O O -1.884 7.789 -1.900 1.00 . A A . 5 LEU O 1 1 5 1229 1 1 6 ARG C C -2.946 7.579 -4.558 1.00 . A A . 6 ARG C 1 1 5 1230 1 1 6 ARG CA C -1.439 7.340 -4.599 1.00 . A A . 6 ARG CA 1 1 5 1231 1 1 6 ARG CB C -1.045 6.729 -5.945 1.00 . A A . 6 ARG CB 1 1 5 1232 1 1 6 ARG CD C -0.406 7.308 -8.306 1.00 . A A . 6 ARG CD 1 1 5 1233 1 1 6 ARG CG C -0.261 7.677 -6.838 1.00 . A A . 6 ARG CG 1 1 5 1234 1 1 6 ARG CZ C 0.524 8.073 -10.449 1.00 . A A . 6 ARG CZ 1 1 5 1235 1 1 6 ARG H H -0.538 5.642 -3.713 1.00 . A A . 6 ARG H 1 1 5 1236 1 1 6 ARG HA H -0.933 8.286 -4.481 1.00 . A A . 6 ARG HA 1 1 5 1237 1 1 6 ARG HB2 H -0.439 5.853 -5.767 1.00 . A A . 6 ARG HB2 1 1 5 1238 1 1 6 ARG HB3 H -1.942 6.435 -6.469 1.00 . A A . 6 ARG HB3 1 1 5 1239 1 1 6 ARG HD2 H 0.078 6.357 -8.474 1.00 . A A . 6 ARG HD2 1 1 5 1240 1 1 6 ARG HD3 H -1.456 7.223 -8.540 1.00 . A A . 6 ARG HD3 1 1 5 1241 1 1 6 ARG HE H 0.365 9.197 -8.810 1.00 . A A . 6 ARG HE 1 1 5 1242 1 1 6 ARG HG2 H -0.630 8.682 -6.693 1.00 . A A . 6 ARG HG2 1 1 5 1243 1 1 6 ARG HG3 H 0.783 7.632 -6.565 1.00 . A A . 6 ARG HG3 1 1 5 1244 1 1 6 ARG HH11 H -0.104 6.153 -10.432 1.00 . A A . 6 ARG HH11 1 1 5 1245 1 1 6 ARG HH12 H 0.553 6.705 -11.937 1.00 . A A . 6 ARG HH12 1 1 5 1246 1 1 6 ARG HH21 H 1.233 9.936 -10.786 1.00 . A A . 6 ARG HH21 1 1 5 1247 1 1 6 ARG HH22 H 1.314 8.856 -12.137 1.00 . A A . 6 ARG HH22 1 1 5 1248 1 1 6 ARG N N -1.022 6.469 -3.507 1.00 . A A . 6 ARG N 1 1 5 1249 1 1 6 ARG NE N 0.197 8.308 -9.183 1.00 . A A . 6 ARG NE 1 1 5 1250 1 1 6 ARG NH1 N 0.307 6.878 -10.983 1.00 . A A . 6 ARG NH1 1 1 5 1251 1 1 6 ARG NH2 N 1.068 9.034 -11.185 1.00 . A A . 6 ARG NH2 1 1 5 1252 1 1 6 ARG O O -3.426 8.645 -4.946 1.00 . A A . 6 ARG O 1 1 5 1253 1 1 7 HIS C C -5.548 7.564 -2.818 1.00 . A A . 7 HIS C 1 1 5 1254 1 1 7 HIS CA C -5.138 6.683 -3.994 1.00 . A A . 7 HIS CA 1 1 5 1255 1 1 7 HIS CB C -5.760 5.294 -3.847 1.00 . A A . 7 HIS CB 1 1 5 1256 1 1 7 HIS CD2 C -7.578 4.241 -5.368 1.00 . A A . 7 HIS CD2 1 1 5 1257 1 1 7 HIS CE1 C -9.181 5.691 -5.002 1.00 . A A . 7 HIS CE1 1 1 5 1258 1 1 7 HIS CG C -7.100 5.166 -4.503 1.00 . A A . 7 HIS CG 1 1 5 1259 1 1 7 HIS H H -3.245 5.757 -3.792 1.00 . A A . 7 HIS H 1 1 5 1260 1 1 7 HIS HA H -5.497 7.134 -4.907 1.00 . A A . 7 HIS HA 1 1 5 1261 1 1 7 HIS HB2 H -5.102 4.564 -4.294 1.00 . A A . 7 HIS HB2 1 1 5 1262 1 1 7 HIS HB3 H -5.880 5.070 -2.797 1.00 . A A . 7 HIS HB3 1 1 5 1263 1 1 7 HIS HD1 H -8.093 6.849 -3.714 1.00 . A A . 7 HIS HD1 1 1 5 1264 1 1 7 HIS HD2 H -7.041 3.386 -5.755 1.00 . A A . 7 HIS HD2 1 1 5 1265 1 1 7 HIS HE1 H -10.132 6.201 -5.035 1.00 . A A . 7 HIS HE1 1 1 5 1266 1 1 7 HIS N N -3.686 6.581 -4.086 1.00 . A A . 7 HIS N 1 1 5 1267 1 1 7 HIS ND1 N -8.129 6.061 -4.295 1.00 . A A . 7 HIS ND1 1 1 5 1268 1 1 7 HIS NE2 N -8.873 4.589 -5.663 1.00 . A A . 7 HIS NE2 1 1 5 1269 1 1 7 HIS O O -6.672 8.061 -2.764 1.00 . A A . 7 HIS O 1 1 5 1270 1 1 8 ALA C C -4.857 10.057 -1.051 1.00 . A A . 8 ALA C 1 1 5 1271 1 1 8 ALA CA C -4.893 8.573 -0.702 1.00 . A A . 8 ALA CA 1 1 5 1272 1 1 8 ALA CB C -3.887 8.263 0.397 1.00 . A A . 8 ALA CB 1 1 5 1273 1 1 8 ALA H H -3.749 7.329 -1.976 1.00 . A A . 8 ALA H 1 1 5 1274 1 1 8 ALA HA H -5.878 8.323 -0.336 1.00 . A A . 8 ALA HA 1 1 5 1275 1 1 8 ALA HB1 H -4.407 8.148 1.337 1.00 . A A . 8 ALA HB1 1 1 5 1276 1 1 8 ALA HB2 H -3.366 7.347 0.159 1.00 . A A . 8 ALA HB2 1 1 5 1277 1 1 8 ALA HB3 H -3.177 9.072 0.473 1.00 . A A . 8 ALA HB3 1 1 5 1278 1 1 8 ALA N N -4.628 7.752 -1.877 1.00 . A A . 8 ALA N 1 1 5 1279 1 1 8 ALA O O -5.445 10.883 -0.352 1.00 . A A . 8 ALA O 1 1 5 1280 1 1 9 PHE C C -5.406 12.320 -3.012 1.00 . A A . 9 PHE C 1 1 5 1281 1 1 9 PHE CA C -4.050 11.775 -2.574 1.00 . A A . 9 PHE CA 1 1 5 1282 1 1 9 PHE CB C -3.047 11.887 -3.725 1.00 . A A . 9 PHE CB 1 1 5 1283 1 1 9 PHE CD1 C -1.905 14.069 -3.245 1.00 . A A . 9 PHE CD1 1 1 5 1284 1 1 9 PHE CD2 C -0.602 12.073 -3.192 1.00 . A A . 9 PHE CD2 1 1 5 1285 1 1 9 PHE CE1 C -0.784 14.813 -2.929 1.00 . A A . 9 PHE CE1 1 1 5 1286 1 1 9 PHE CE2 C 0.523 12.812 -2.876 1.00 . A A . 9 PHE CE2 1 1 5 1287 1 1 9 PHE CG C -1.827 12.692 -3.380 1.00 . A A . 9 PHE CG 1 1 5 1288 1 1 9 PHE CZ C 0.431 14.183 -2.743 1.00 . A A . 9 PHE CZ 1 1 5 1289 1 1 9 PHE H H -3.716 9.686 -2.650 1.00 . A A . 9 PHE H 1 1 5 1290 1 1 9 PHE HA H -3.693 12.359 -1.740 1.00 . A A . 9 PHE HA 1 1 5 1291 1 1 9 PHE HB2 H -2.721 10.897 -4.006 1.00 . A A . 9 PHE HB2 1 1 5 1292 1 1 9 PHE HB3 H -3.529 12.356 -4.569 1.00 . A A . 9 PHE HB3 1 1 5 1293 1 1 9 PHE HD1 H -2.855 14.563 -3.389 1.00 . A A . 9 PHE HD1 1 1 5 1294 1 1 9 PHE HD2 H -0.529 11.000 -3.296 1.00 . A A . 9 PHE HD2 1 1 5 1295 1 1 9 PHE HE1 H -0.859 15.885 -2.825 1.00 . A A . 9 PHE HE1 1 1 5 1296 1 1 9 PHE HE2 H 1.471 12.316 -2.731 1.00 . A A . 9 PHE HE2 1 1 5 1297 1 1 9 PHE HZ H 1.309 14.762 -2.497 1.00 . A A . 9 PHE HZ 1 1 5 1298 1 1 9 PHE N N -4.163 10.390 -2.134 1.00 . A A . 9 PHE N 1 1 5 1299 1 1 9 PHE O O -5.649 13.525 -2.960 1.00 . A A . 9 PHE O 1 1 5 1300 1 1 10 ARG C C -8.511 12.159 -2.708 1.00 . A A . 10 ARG C 1 1 5 1301 1 1 10 ARG CA C -7.616 11.812 -3.895 1.00 . A A . 10 ARG CA 1 1 5 1302 1 1 10 ARG CB C -8.251 10.686 -4.714 1.00 . A A . 10 ARG CB 1 1 5 1303 1 1 10 ARG CD C -8.944 10.674 -7.129 1.00 . A A . 10 ARG CD 1 1 5 1304 1 1 10 ARG CG C -7.776 10.640 -6.157 1.00 . A A . 10 ARG CG 1 1 5 1305 1 1 10 ARG CZ C -9.388 10.192 -9.499 1.00 . A A . 10 ARG CZ 1 1 5 1306 1 1 10 ARG H H -6.033 10.475 -3.464 1.00 . A A . 10 ARG H 1 1 5 1307 1 1 10 ARG HA H -7.513 12.686 -4.520 1.00 . A A . 10 ARG HA 1 1 5 1308 1 1 10 ARG HB2 H -8.014 9.740 -4.249 1.00 . A A . 10 ARG HB2 1 1 5 1309 1 1 10 ARG HB3 H -9.323 10.819 -4.715 1.00 . A A . 10 ARG HB3 1 1 5 1310 1 1 10 ARG HD2 H -9.698 9.979 -6.791 1.00 . A A . 10 ARG HD2 1 1 5 1311 1 1 10 ARG HD3 H -9.355 11.672 -7.143 1.00 . A A . 10 ARG HD3 1 1 5 1312 1 1 10 ARG HE H -7.586 10.145 -8.644 1.00 . A A . 10 ARG HE 1 1 5 1313 1 1 10 ARG HG2 H -7.140 11.493 -6.344 1.00 . A A . 10 ARG HG2 1 1 5 1314 1 1 10 ARG HG3 H -7.215 9.730 -6.312 1.00 . A A . 10 ARG HG3 1 1 5 1315 1 1 10 ARG HH11 H -11.021 10.662 -8.407 1.00 . A A . 10 ARG HH11 1 1 5 1316 1 1 10 ARG HH12 H -11.320 10.320 -10.078 1.00 . A A . 10 ARG HH12 1 1 5 1317 1 1 10 ARG HH21 H -7.967 9.692 -10.847 1.00 . A A . 10 ARG HH21 1 1 5 1318 1 1 10 ARG HH22 H -9.582 9.768 -11.466 1.00 . A A . 10 ARG HH22 1 1 5 1319 1 1 10 ARG N N -6.285 11.422 -3.446 1.00 . A A . 10 ARG N 1 1 5 1320 1 1 10 ARG NE N -8.538 10.310 -8.484 1.00 . A A . 10 ARG NE 1 1 5 1321 1 1 10 ARG NH1 N -10.682 10.409 -9.313 1.00 . A A . 10 ARG NH1 1 1 5 1322 1 1 10 ARG NH2 N -8.942 9.856 -10.703 1.00 . A A . 10 ARG NH2 1 1 5 1323 1 1 10 ARG O O -9.443 12.945 -2.867 1.00 . A A . 10 ARG O 1 1 5 1324 1 1 11 . C C -8.963 13.302 0.004 1.00 . A A . 11 SEP C 1 1 5 1325 1 1 11 . CA C -9.016 11.834 -0.329 1.00 . A A . 11 SEP CA 1 1 5 1326 1 1 11 . CB C -8.571 10.879 0.818 1.00 . A A . 11 SEP CB 1 1 5 1327 1 1 11 . H H -7.431 10.934 -1.493 1.00 . A A . 11 SEP H 1 1 5 1328 1 1 11 . HA H -10.064 11.589 -0.584 1.00 . A A . 11 SEP HA 1 1 5 1329 1 1 11 . HB2 H -8.296 9.875 0.446 1.00 . A A . 11 SEP HB2 1 1 5 1330 1 1 11 . HB3 H -7.652 11.239 1.324 1.00 . A A . 11 SEP HB3 1 1 5 1331 1 1 11 . N N -8.211 11.572 -1.559 1.00 . A A . 11 SEP N 1 1 5 1332 1 1 11 . O O -9.937 13.916 0.439 1.00 . A A . 11 SEP O 1 1 5 1333 1 1 11 . O1P O -10.578 11.792 3.917 1.00 . A A . 11 SEP O1P 1 1 5 1334 1 1 11 . O2P O -9.327 9.654 4.085 1.00 . A A . 11 SEP O2P 1 1 5 1335 1 1 11 . O3P O -8.086 11.773 3.584 1.00 . A A . 11 SEP O3P 1 1 5 1336 1 1 11 . OG O -9.622 10.720 1.799 1.00 . A A . 11 SEP OG 1 1 5 1337 1 1 11 . P P -9.387 11.010 3.374 1.00 . A A . 11 SEP P 1 1 5 1338 1 1 12 MET C C -8.285 16.159 -0.964 1.00 . A A . 12 MET C 1 1 5 1339 1 1 12 MET CA C -7.561 15.291 0.060 1.00 . A A . 12 MET CA 1 1 5 1340 1 1 12 MET CB C -6.064 15.606 0.046 1.00 . A A . 12 MET CB 1 1 5 1341 1 1 12 MET CE C -3.000 16.870 0.282 1.00 . A A . 12 MET CE 1 1 5 1342 1 1 12 MET CG C -5.664 16.697 1.025 1.00 . A A . 12 MET CG 1 1 5 1343 1 1 12 MET H H -7.044 13.333 -0.557 1.00 . A A . 12 MET H 1 1 5 1344 1 1 12 MET HA H -7.956 15.507 1.041 1.00 . A A . 12 MET HA 1 1 5 1345 1 1 12 MET HB2 H -5.517 14.709 0.296 1.00 . A A . 12 MET HB2 1 1 5 1346 1 1 12 MET HB3 H -5.784 15.923 -0.947 1.00 . A A . 12 MET HB3 1 1 5 1347 1 1 12 MET HE1 H -3.261 16.229 -0.547 1.00 . A A . 12 MET HE1 1 1 5 1348 1 1 12 MET HE2 H -3.171 17.900 0.008 1.00 . A A . 12 MET HE2 1 1 5 1349 1 1 12 MET HE3 H -1.957 16.732 0.529 1.00 . A A . 12 MET HE3 1 1 5 1350 1 1 12 MET HG2 H -5.691 17.648 0.515 1.00 . A A . 12 MET HG2 1 1 5 1351 1 1 12 MET HG3 H -6.373 16.708 1.840 1.00 . A A . 12 MET HG3 1 1 5 1352 1 1 12 MET N N -7.783 13.875 -0.209 1.00 . A A . 12 MET N 1 1 5 1353 1 1 12 MET O O -8.631 17.307 -0.686 1.00 . A A . 12 MET O 1 1 5 1354 1 1 12 MET SD S -4.010 16.452 1.700 1.00 . A A . 12 MET SD 1 1 5 1355 1 1 13 PHE C C -10.668 16.525 -2.883 1.00 . A A . 13 PHE C 1 1 5 1356 1 1 13 PHE CA C -9.193 16.328 -3.217 1.00 . A A . 13 PHE CA 1 1 5 1357 1 1 13 PHE CB C -9.054 15.576 -4.542 1.00 . A A . 13 PHE CB 1 1 5 1358 1 1 13 PHE CD1 C -6.785 16.523 -5.041 1.00 . A A . 13 PHE CD1 1 1 5 1359 1 1 13 PHE CD2 C -8.391 16.444 -6.801 1.00 . A A . 13 PHE CD2 1 1 5 1360 1 1 13 PHE CE1 C -5.865 17.092 -5.902 1.00 . A A . 13 PHE CE1 1 1 5 1361 1 1 13 PHE CE2 C -7.476 17.012 -7.667 1.00 . A A . 13 PHE CE2 1 1 5 1362 1 1 13 PHE CG C -8.057 16.193 -5.480 1.00 . A A . 13 PHE CG 1 1 5 1363 1 1 13 PHE CZ C -6.211 17.335 -7.217 1.00 . A A . 13 PHE CZ 1 1 5 1364 1 1 13 PHE H H -8.211 14.684 -2.312 1.00 . A A . 13 PHE H 1 1 5 1365 1 1 13 PHE HA H -8.724 17.295 -3.311 1.00 . A A . 13 PHE HA 1 1 5 1366 1 1 13 PHE HB2 H -8.738 14.563 -4.342 1.00 . A A . 13 PHE HB2 1 1 5 1367 1 1 13 PHE HB3 H -10.012 15.558 -5.039 1.00 . A A . 13 PHE HB3 1 1 5 1368 1 1 13 PHE HD1 H -6.512 16.332 -4.013 1.00 . A A . 13 PHE HD1 1 1 5 1369 1 1 13 PHE HD2 H -9.381 16.191 -7.155 1.00 . A A . 13 PHE HD2 1 1 5 1370 1 1 13 PHE HE1 H -4.877 17.343 -5.548 1.00 . A A . 13 PHE HE1 1 1 5 1371 1 1 13 PHE HE2 H -7.750 17.201 -8.694 1.00 . A A . 13 PHE HE2 1 1 5 1372 1 1 13 PHE HZ H -5.495 17.780 -7.891 1.00 . A A . 13 PHE HZ 1 1 5 1373 1 1 13 PHE N N -8.511 15.603 -2.150 1.00 . A A . 13 PHE N 1 1 5 1374 1 1 13 PHE O O -11.230 15.855 -2.017 1.00 . A A . 13 PHE O 1 1 5 1375 1 1 14 PRO C C -13.646 16.705 -3.960 1.00 . A A . 14 PRO C 1 1 5 1376 1 1 14 PRO CA C -12.730 17.778 -3.382 1.00 . A A . 14 PRO CA 1 1 5 1377 1 1 14 PRO CB C -12.916 19.100 -4.131 1.00 . A A . 14 PRO CB 1 1 5 1378 1 1 14 PRO CD C -10.705 18.307 -4.633 1.00 . A A . 14 PRO CD 1 1 5 1379 1 1 14 PRO CG C -11.848 19.101 -5.169 1.00 . A A . 14 PRO CG 1 1 5 1380 1 1 14 PRO HA H -12.960 17.920 -2.336 1.00 . A A . 14 PRO HA 1 1 5 1381 1 1 14 PRO HB2 H -13.901 19.129 -4.576 1.00 . A A . 14 PRO HB2 1 1 5 1382 1 1 14 PRO HB3 H -12.801 19.926 -3.445 1.00 . A A . 14 PRO HB3 1 1 5 1383 1 1 14 PRO HD2 H -10.278 17.697 -5.416 1.00 . A A . 14 PRO HD2 1 1 5 1384 1 1 14 PRO HD3 H -9.957 18.965 -4.215 1.00 . A A . 14 PRO HD3 1 1 5 1385 1 1 14 PRO HG2 H -12.221 18.659 -6.080 1.00 . A A . 14 PRO HG2 1 1 5 1386 1 1 14 PRO HG3 H -11.514 20.112 -5.350 1.00 . A A . 14 PRO HG3 1 1 5 1387 1 1 14 PRO N N -11.312 17.469 -3.585 1.00 . A A . 14 PRO N 1 1 5 1388 1 1 14 PRO O O -14.829 16.638 -3.625 1.00 . A A . 14 PRO O 1 1 5 1389 1 1 15 SER C C -14.217 13.716 -4.442 1.00 . A A . 15 SER C 1 1 5 1390 1 1 15 SER CA C -13.860 14.798 -5.457 1.00 . A A . 15 SER CA 1 1 5 1391 1 1 15 SER CB C -13.071 14.185 -6.616 1.00 . A A . 15 SER CB 1 1 5 1392 1 1 15 SER H H -12.144 15.971 -5.056 1.00 . A A . 15 SER H 1 1 5 1393 1 1 15 SER HA H -14.773 15.228 -5.843 1.00 . A A . 15 SER HA 1 1 5 1394 1 1 15 SER HB2 H -12.643 13.246 -6.300 1.00 . A A . 15 SER HB2 1 1 5 1395 1 1 15 SER HB3 H -13.735 14.016 -7.451 1.00 . A A . 15 SER HB3 1 1 5 1396 1 1 15 SER HG H -11.963 15.037 -7.989 1.00 . A A . 15 SER HG 1 1 5 1397 1 1 15 SER N N -13.092 15.866 -4.830 1.00 . A A . 15 SER N 1 1 5 1398 1 1 15 SER O O -15.213 13.010 -4.595 1.00 . A A . 15 SER O 1 1 5 1399 1 1 15 SER OG O -12.024 15.046 -7.031 1.00 . A A . 15 SER OG 1 1 5 1400 1 1 16 SER C C -14.764 13.015 -1.448 1.00 . A A . 16 SER C 1 1 5 1401 1 1 16 SER CA C -13.619 12.596 -2.365 1.00 . A A . 16 SER CA 1 1 5 1402 1 1 16 SER CB C -12.345 12.386 -1.545 1.00 . A A . 16 SER CB 1 1 5 1403 1 1 16 SER H H -12.616 14.186 -3.339 1.00 . A A . 16 SER H 1 1 5 1404 1 1 16 SER HA H -13.883 11.667 -2.849 1.00 . A A . 16 SER HA 1 1 5 1405 1 1 16 SER HB2 H -11.522 12.177 -2.211 1.00 . A A . 16 SER HB2 1 1 5 1406 1 1 16 SER HB3 H -12.132 13.283 -0.981 1.00 . A A . 16 SER HB3 1 1 5 1407 1 1 16 SER HG H -11.973 11.473 0.147 1.00 . A A . 16 SER HG 1 1 5 1408 1 1 16 SER N N -13.394 13.593 -3.405 1.00 . A A . 16 SER N 1 1 5 1409 1 1 16 SER O O -15.488 12.174 -0.917 1.00 . A A . 16 SER O 1 1 5 1410 1 1 16 SER OG O -12.490 11.303 -0.644 1.00 . A A . 16 SER OG 1 1 5 1411 1 1 17 GLU C C -17.262 15.069 -1.209 1.00 . A A . 17 GLU C 1 1 5 1412 1 1 17 GLU CA C -15.977 14.855 -0.415 1.00 . A A . 17 GLU CA 1 1 5 1413 1 1 17 GLU CB C -15.532 16.173 0.223 1.00 . A A . 17 GLU CB 1 1 5 1414 1 1 17 GLU CD C -16.580 18.105 1.469 1.00 . A A . 17 GLU CD 1 1 5 1415 1 1 17 GLU CG C -16.394 16.601 1.399 1.00 . A A . 17 GLU CG 1 1 5 1416 1 1 17 GLU H H -14.312 14.944 -1.719 1.00 . A A . 17 GLU H 1 1 5 1417 1 1 17 GLU HA H -16.167 14.134 0.366 1.00 . A A . 17 GLU HA 1 1 5 1418 1 1 17 GLU HB2 H -14.515 16.067 0.569 1.00 . A A . 17 GLU HB2 1 1 5 1419 1 1 17 GLU HB3 H -15.569 16.951 -0.525 1.00 . A A . 17 GLU HB3 1 1 5 1420 1 1 17 GLU HG2 H -17.365 16.138 1.305 1.00 . A A . 17 GLU HG2 1 1 5 1421 1 1 17 GLU HG3 H -15.925 16.268 2.313 1.00 . A A . 17 GLU HG3 1 1 5 1422 1 1 17 GLU N N -14.921 14.323 -1.268 1.00 . A A . 17 GLU N 1 1 5 1423 1 1 17 GLU O O -18.005 14.125 -1.473 1.00 . A A . 17 GLU O 1 1 5 1424 1 1 17 GLU OE1 O -15.729 18.833 0.917 1.00 . A A . 17 GLU OE1 1 1 5 1425 1 1 17 GLU OE2 O -17.575 18.552 2.076 1.00 . A A . 17 GLU OE2 1 1 6 1426 1 1 1 ARG C C 3.311 2.399 -1.791 1.00 . A A . 1 ARG C 1 1 6 1427 1 1 1 ARG CA C 3.678 0.992 -1.328 1.00 . A A . 1 ARG CA 1 1 6 1428 1 1 1 ARG CB C 2.452 0.080 -1.413 1.00 . A A . 1 ARG CB 1 1 6 1429 1 1 1 ARG CD C 1.583 -2.267 -1.192 1.00 . A A . 1 ARG CD 1 1 6 1430 1 1 1 ARG CG C 2.661 -1.281 -0.770 1.00 . A A . 1 ARG CG 1 1 6 1431 1 1 1 ARG CZ C 2.923 -4.250 -1.757 1.00 . A A . 1 ARG CZ 1 1 6 1432 1 1 1 ARG H1 H 4.058 1.810 0.587 1.00 . A A . 1 ARG H1 1 1 6 1433 1 1 1 ARG HA H 4.451 0.603 -1.973 1.00 . A A . 1 ARG HA 1 1 6 1434 1 1 1 ARG HB2 H 1.623 0.564 -0.918 1.00 . A A . 1 ARG HB2 1 1 6 1435 1 1 1 ARG HB3 H 2.203 -0.071 -2.452 1.00 . A A . 1 ARG HB3 1 1 6 1436 1 1 1 ARG HD2 H 0.698 -2.088 -0.600 1.00 . A A . 1 ARG HD2 1 1 6 1437 1 1 1 ARG HD3 H 1.356 -2.107 -2.235 1.00 . A A . 1 ARG HD3 1 1 6 1438 1 1 1 ARG HE H 1.582 -4.162 -0.283 1.00 . A A . 1 ARG HE 1 1 6 1439 1 1 1 ARG HG2 H 3.624 -1.668 -1.070 1.00 . A A . 1 ARG HG2 1 1 6 1440 1 1 1 ARG HG3 H 2.634 -1.170 0.304 1.00 . A A . 1 ARG HG3 1 1 6 1441 1 1 1 ARG HH11 H 3.266 -2.633 -2.918 1.00 . A A . 1 ARG HH11 1 1 6 1442 1 1 1 ARG HH12 H 4.204 -4.037 -3.305 1.00 . A A . 1 ARG HH12 1 1 6 1443 1 1 1 ARG HH21 H 2.811 -6.018 -0.783 1.00 . A A . 1 ARG HH21 1 1 6 1444 1 1 1 ARG HH22 H 3.944 -5.962 -2.091 1.00 . A A . 1 ARG HH22 1 1 6 1445 1 1 1 ARG N N 4.200 1.013 0.034 1.00 . A A . 1 ARG N 1 1 6 1446 1 1 1 ARG NE N 2.005 -3.653 -1.005 1.00 . A A . 1 ARG NE 1 1 6 1447 1 1 1 ARG NH1 N 3.512 -3.585 -2.741 1.00 . A A . 1 ARG NH1 1 1 6 1448 1 1 1 ARG NH2 N 3.253 -5.514 -1.524 1.00 . A A . 1 ARG NH2 1 1 6 1449 1 1 1 ARG O O 2.494 3.076 -1.167 1.00 . A A . 1 ARG O 1 1 6 1450 1 1 2 SER C C 2.481 4.130 -4.399 1.00 . A A . 2 SER C 1 1 6 1451 1 1 2 SER CA C 3.663 4.160 -3.435 1.00 . A A . 2 SER CA 1 1 6 1452 1 1 2 SER CB C 4.906 4.692 -4.150 1.00 . A A . 2 SER CB 1 1 6 1453 1 1 2 SER H H 4.563 2.245 -3.343 1.00 . A A . 2 SER H 1 1 6 1454 1 1 2 SER HA H 3.424 4.815 -2.611 1.00 . A A . 2 SER HA 1 1 6 1455 1 1 2 SER HB2 H 5.027 5.740 -3.925 1.00 . A A . 2 SER HB2 1 1 6 1456 1 1 2 SER HB3 H 5.775 4.148 -3.808 1.00 . A A . 2 SER HB3 1 1 6 1457 1 1 2 SER HG H 5.669 4.485 -5.942 1.00 . A A . 2 SER HG 1 1 6 1458 1 1 2 SER N N 3.921 2.832 -2.890 1.00 . A A . 2 SER N 1 1 6 1459 1 1 2 SER O O 1.778 5.126 -4.569 1.00 . A A . 2 SER O 1 1 6 1460 1 1 2 SER OG O 4.793 4.536 -5.554 1.00 . A A . 2 SER OG 1 1 6 1461 1 1 3 LYS C C -0.169 2.768 -5.253 1.00 . A A . 3 LYS C 1 1 6 1462 1 1 3 LYS CA C 1.172 2.818 -5.977 1.00 . A A . 3 LYS CA 1 1 6 1463 1 1 3 LYS CB C 1.367 1.542 -6.800 1.00 . A A . 3 LYS CB 1 1 6 1464 1 1 3 LYS CD C 0.198 0.039 -8.438 1.00 . A A . 3 LYS CD 1 1 6 1465 1 1 3 LYS CE C -1.219 -0.370 -8.067 1.00 . A A . 3 LYS CE 1 1 6 1466 1 1 3 LYS CG C 0.487 1.476 -8.036 1.00 . A A . 3 LYS CG 1 1 6 1467 1 1 3 LYS H H 2.864 2.221 -4.853 1.00 . A A . 3 LYS H 1 1 6 1468 1 1 3 LYS HA H 1.178 3.669 -6.641 1.00 . A A . 3 LYS HA 1 1 6 1469 1 1 3 LYS HB2 H 2.399 1.486 -7.115 1.00 . A A . 3 LYS HB2 1 1 6 1470 1 1 3 LYS HB3 H 1.143 0.688 -6.177 1.00 . A A . 3 LYS HB3 1 1 6 1471 1 1 3 LYS HD2 H 0.320 -0.058 -9.507 1.00 . A A . 3 LYS HD2 1 1 6 1472 1 1 3 LYS HD3 H 0.896 -0.614 -7.933 1.00 . A A . 3 LYS HD3 1 1 6 1473 1 1 3 LYS HE2 H -1.211 -0.787 -7.072 1.00 . A A . 3 LYS HE2 1 1 6 1474 1 1 3 LYS HE3 H -1.849 0.508 -8.084 1.00 . A A . 3 LYS HE3 1 1 6 1475 1 1 3 LYS HG2 H -0.448 1.975 -7.828 1.00 . A A . 3 LYS HG2 1 1 6 1476 1 1 3 LYS HG3 H 0.990 1.974 -8.852 1.00 . A A . 3 LYS HG3 1 1 6 1477 1 1 3 LYS HZ1 H -2.225 -2.152 -8.484 1.00 . A A . 3 LYS HZ1 1 1 6 1478 1 1 3 LYS HZ2 H -1.006 -1.777 -9.596 1.00 . A A . 3 LYS HZ2 1 1 6 1479 1 1 3 LYS HZ3 H -2.475 -0.939 -9.636 1.00 . A A . 3 LYS HZ3 1 1 6 1480 1 1 3 LYS N N 2.269 2.980 -5.030 1.00 . A A . 3 LYS N 1 1 6 1481 1 1 3 LYS NZ N -1.770 -1.380 -9.011 1.00 . A A . 3 LYS NZ 1 1 6 1482 1 1 3 LYS O O -1.200 3.145 -5.810 1.00 . A A . 3 LYS O 1 1 6 1483 1 1 4 ASP C C -1.684 3.541 -2.544 1.00 . A A . 4 ASP C 1 1 6 1484 1 1 4 ASP CA C -1.363 2.205 -3.208 1.00 . A A . 4 ASP CA 1 1 6 1485 1 1 4 ASP CB C -1.213 1.116 -2.144 1.00 . A A . 4 ASP CB 1 1 6 1486 1 1 4 ASP CG C -2.341 0.105 -2.188 1.00 . A A . 4 ASP CG 1 1 6 1487 1 1 4 ASP H H 0.705 2.017 -3.620 1.00 . A A . 4 ASP H 1 1 6 1488 1 1 4 ASP HA H -2.175 1.941 -3.868 1.00 . A A . 4 ASP HA 1 1 6 1489 1 1 4 ASP HB2 H -0.280 0.594 -2.302 1.00 . A A . 4 ASP HB2 1 1 6 1490 1 1 4 ASP HB3 H -1.202 1.576 -1.167 1.00 . A A . 4 ASP HB3 1 1 6 1491 1 1 4 ASP N N -0.148 2.302 -4.009 1.00 . A A . 4 ASP N 1 1 6 1492 1 1 4 ASP O O -2.848 3.861 -2.299 1.00 . A A . 4 ASP O 1 1 6 1493 1 1 4 ASP OD1 O -3.370 0.336 -1.519 1.00 . A A . 4 ASP OD1 1 1 6 1494 1 1 4 ASP OD2 O -2.195 -0.918 -2.890 1.00 . A A . 4 ASP OD2 1 1 6 1495 1 1 5 LEU C C -1.339 6.647 -2.615 1.00 . A A . 5 LEU C 1 1 6 1496 1 1 5 LEU CA C -0.815 5.618 -1.618 1.00 . A A . 5 LEU CA 1 1 6 1497 1 1 5 LEU CB C 0.511 6.095 -1.025 1.00 . A A . 5 LEU CB 1 1 6 1498 1 1 5 LEU CD1 C 1.363 5.380 1.222 1.00 . A A . 5 LEU CD1 1 1 6 1499 1 1 5 LEU CD2 C 1.000 7.807 0.740 1.00 . A A . 5 LEU CD2 1 1 6 1500 1 1 5 LEU CG C 0.508 6.392 0.475 1.00 . A A . 5 LEU CG 1 1 6 1501 1 1 5 LEU H H 0.259 4.008 -2.474 1.00 . A A . 5 LEU H 1 1 6 1502 1 1 5 LEU HA H -1.536 5.505 -0.823 1.00 . A A . 5 LEU HA 1 1 6 1503 1 1 5 LEU HB2 H 1.250 5.330 -1.209 1.00 . A A . 5 LEU HB2 1 1 6 1504 1 1 5 LEU HB3 H 0.797 7.000 -1.542 1.00 . A A . 5 LEU HB3 1 1 6 1505 1 1 5 LEU HD11 H 1.766 5.836 2.113 1.00 . A A . 5 LEU HD11 1 1 6 1506 1 1 5 LEU HD12 H 2.173 5.054 0.586 1.00 . A A . 5 LEU HD12 1 1 6 1507 1 1 5 LEU HD13 H 0.756 4.529 1.495 1.00 . A A . 5 LEU HD13 1 1 6 1508 1 1 5 LEU HD21 H 0.934 8.019 1.797 1.00 . A A . 5 LEU HD21 1 1 6 1509 1 1 5 LEU HD22 H 0.388 8.509 0.193 1.00 . A A . 5 LEU HD22 1 1 6 1510 1 1 5 LEU HD23 H 2.027 7.897 0.417 1.00 . A A . 5 LEU HD23 1 1 6 1511 1 1 5 LEU HG H -0.504 6.313 0.849 1.00 . A A . 5 LEU HG 1 1 6 1512 1 1 5 LEU N N -0.645 4.316 -2.255 1.00 . A A . 5 LEU N 1 1 6 1513 1 1 5 LEU O O -2.012 7.606 -2.236 1.00 . A A . 5 LEU O 1 1 6 1514 1 1 6 ARG C C -2.987 7.495 -4.933 1.00 . A A . 6 ARG C 1 1 6 1515 1 1 6 ARG CA C -1.468 7.349 -4.941 1.00 . A A . 6 ARG CA 1 1 6 1516 1 1 6 ARG CB C -1.001 6.846 -6.308 1.00 . A A . 6 ARG CB 1 1 6 1517 1 1 6 ARG CD C 0.548 7.592 -8.141 1.00 . A A . 6 ARG CD 1 1 6 1518 1 1 6 ARG CG C 0.416 7.268 -6.661 1.00 . A A . 6 ARG CG 1 1 6 1519 1 1 6 ARG CZ C -0.130 9.383 -9.683 1.00 . A A . 6 ARG CZ 1 1 6 1520 1 1 6 ARG H H -0.488 5.658 -4.130 1.00 . A A . 6 ARG H 1 1 6 1521 1 1 6 ARG HA H -1.025 8.315 -4.752 1.00 . A A . 6 ARG HA 1 1 6 1522 1 1 6 ARG HB2 H -1.044 5.767 -6.316 1.00 . A A . 6 ARG HB2 1 1 6 1523 1 1 6 ARG HB3 H -1.667 7.231 -7.066 1.00 . A A . 6 ARG HB3 1 1 6 1524 1 1 6 ARG HD2 H 1.585 7.801 -8.359 1.00 . A A . 6 ARG HD2 1 1 6 1525 1 1 6 ARG HD3 H 0.227 6.734 -8.713 1.00 . A A . 6 ARG HD3 1 1 6 1526 1 1 6 ARG HE H -0.929 9.064 -7.884 1.00 . A A . 6 ARG HE 1 1 6 1527 1 1 6 ARG HG2 H 0.673 8.147 -6.088 1.00 . A A . 6 ARG HG2 1 1 6 1528 1 1 6 ARG HG3 H 1.092 6.464 -6.415 1.00 . A A . 6 ARG HG3 1 1 6 1529 1 1 6 ARG HH11 H 1.351 8.190 -10.364 1.00 . A A . 6 ARG HH11 1 1 6 1530 1 1 6 ARG HH12 H 0.864 9.456 -11.442 1.00 . A A . 6 ARG HH12 1 1 6 1531 1 1 6 ARG HH21 H -1.580 10.735 -9.293 1.00 . A A . 6 ARG HH21 1 1 6 1532 1 1 6 ARG HH22 H -0.803 10.904 -10.831 1.00 . A A . 6 ARG HH22 1 1 6 1533 1 1 6 ARG N N -1.028 6.440 -3.890 1.00 . A A . 6 ARG N 1 1 6 1534 1 1 6 ARG NE N -0.259 8.747 -8.523 1.00 . A A . 6 ARG NE 1 1 6 1535 1 1 6 ARG NH1 N 0.769 8.976 -10.569 1.00 . A A . 6 ARG NH1 1 1 6 1536 1 1 6 ARG NH2 N -0.901 10.426 -9.958 1.00 . A A . 6 ARG NH2 1 1 6 1537 1 1 6 ARG O O -3.522 8.551 -5.272 1.00 . A A . 6 ARG O 1 1 6 1538 1 1 7 HIS C C -5.629 7.218 -3.277 1.00 . A A . 7 HIS C 1 1 6 1539 1 1 7 HIS CA C -5.135 6.437 -4.490 1.00 . A A . 7 HIS CA 1 1 6 1540 1 1 7 HIS CB C -5.674 5.007 -4.445 1.00 . A A . 7 HIS CB 1 1 6 1541 1 1 7 HIS CD2 C -7.164 4.984 -6.567 1.00 . A A . 7 HIS CD2 1 1 6 1542 1 1 7 HIS CE1 C -9.034 4.314 -5.639 1.00 . A A . 7 HIS CE1 1 1 6 1543 1 1 7 HIS CG C -6.924 4.812 -5.246 1.00 . A A . 7 HIS CG 1 1 6 1544 1 1 7 HIS H H -3.194 5.615 -4.285 1.00 . A A . 7 HIS H 1 1 6 1545 1 1 7 HIS HA H -5.496 6.920 -5.385 1.00 . A A . 7 HIS HA 1 1 6 1546 1 1 7 HIS HB2 H -4.923 4.334 -4.833 1.00 . A A . 7 HIS HB2 1 1 6 1547 1 1 7 HIS HB3 H -5.891 4.743 -3.420 1.00 . A A . 7 HIS HB3 1 1 6 1548 1 1 7 HIS HD1 H -8.264 4.184 -3.747 1.00 . A A . 7 HIS HD1 1 1 6 1549 1 1 7 HIS HD2 H -6.451 5.309 -7.313 1.00 . A A . 7 HIS HD2 1 1 6 1550 1 1 7 HIS HE1 H -10.061 4.012 -5.499 1.00 . A A . 7 HIS HE1 1 1 6 1551 1 1 7 HIS N N -3.677 6.428 -4.543 1.00 . A A . 7 HIS N 1 1 6 1552 1 1 7 HIS ND1 N -8.115 4.393 -4.693 1.00 . A A . 7 HIS ND1 1 1 6 1553 1 1 7 HIS NE2 N -8.482 4.667 -6.786 1.00 . A A . 7 HIS NE2 1 1 6 1554 1 1 7 HIS O O -6.783 7.643 -3.228 1.00 . A A . 7 HIS O 1 1 6 1555 1 1 8 ALA C C -5.142 9.637 -1.345 1.00 . A A . 8 ALA C 1 1 6 1556 1 1 8 ALA CA C -5.095 8.135 -1.086 1.00 . A A . 8 ALA CA 1 1 6 1557 1 1 8 ALA CB C -4.103 7.818 0.023 1.00 . A A . 8 ALA CB 1 1 6 1558 1 1 8 ALA H H -3.843 7.041 -2.396 1.00 . A A . 8 ALA H 1 1 6 1559 1 1 8 ALA HA H -6.073 7.804 -0.766 1.00 . A A . 8 ALA HA 1 1 6 1560 1 1 8 ALA HB1 H -3.449 8.666 0.172 1.00 . A A . 8 ALA HB1 1 1 6 1561 1 1 8 ALA HB2 H -4.639 7.611 0.937 1.00 . A A . 8 ALA HB2 1 1 6 1562 1 1 8 ALA HB3 H -3.516 6.956 -0.255 1.00 . A A . 8 ALA HB3 1 1 6 1563 1 1 8 ALA N N -4.748 7.404 -2.299 1.00 . A A . 8 ALA N 1 1 6 1564 1 1 8 ALA O O -5.798 10.382 -0.618 1.00 . A A . 8 ALA O 1 1 6 1565 1 1 9 PHE C C -5.785 11.989 -3.139 1.00 . A A . 9 PHE C 1 1 6 1566 1 1 9 PHE CA C -4.400 11.489 -2.739 1.00 . A A . 9 PHE CA 1 1 6 1567 1 1 9 PHE CB C -3.411 11.723 -3.883 1.00 . A A . 9 PHE CB 1 1 6 1568 1 1 9 PHE CD1 C -2.348 13.967 -3.524 1.00 . A A . 9 PHE CD1 1 1 6 1569 1 1 9 PHE CD2 C -1.042 12.015 -3.111 1.00 . A A . 9 PHE CD2 1 1 6 1570 1 1 9 PHE CE1 C -1.274 14.763 -3.171 1.00 . A A . 9 PHE CE1 1 1 6 1571 1 1 9 PHE CE2 C 0.035 12.806 -2.757 1.00 . A A . 9 PHE CE2 1 1 6 1572 1 1 9 PHE CG C -2.243 12.586 -3.498 1.00 . A A . 9 PHE CG 1 1 6 1573 1 1 9 PHE CZ C -0.082 14.182 -2.787 1.00 . A A . 9 PHE CZ 1 1 6 1574 1 1 9 PHE H H -3.937 9.432 -2.928 1.00 . A A . 9 PHE H 1 1 6 1575 1 1 9 PHE HA H -4.070 12.038 -1.871 1.00 . A A . 9 PHE HA 1 1 6 1576 1 1 9 PHE HB2 H -3.025 10.771 -4.215 1.00 . A A . 9 PHE HB2 1 1 6 1577 1 1 9 PHE HB3 H -3.926 12.204 -4.701 1.00 . A A . 9 PHE HB3 1 1 6 1578 1 1 9 PHE HD1 H -3.280 14.423 -3.823 1.00 . A A . 9 PHE HD1 1 1 6 1579 1 1 9 PHE HD2 H -0.949 10.938 -3.088 1.00 . A A . 9 PHE HD2 1 1 6 1580 1 1 9 PHE HE1 H -1.368 15.838 -3.195 1.00 . A A . 9 PHE HE1 1 1 6 1581 1 1 9 PHE HE2 H 0.966 12.348 -2.457 1.00 . A A . 9 PHE HE2 1 1 6 1582 1 1 9 PHE HZ H 0.758 14.802 -2.511 1.00 . A A . 9 PHE HZ 1 1 6 1583 1 1 9 PHE N N -4.440 10.075 -2.385 1.00 . A A . 9 PHE N 1 1 6 1584 1 1 9 PHE O O -6.090 13.175 -3.011 1.00 . A A . 9 PHE O 1 1 6 1585 1 1 10 ARG C C -8.821 11.849 -2.851 1.00 . A A . 10 ARG C 1 1 6 1586 1 1 10 ARG CA C -7.972 11.423 -4.046 1.00 . A A . 10 ARG CA 1 1 6 1587 1 1 10 ARG CB C -8.628 10.238 -4.756 1.00 . A A . 10 ARG CB 1 1 6 1588 1 1 10 ARG CD C -7.520 10.402 -7.005 1.00 . A A . 10 ARG CD 1 1 6 1589 1 1 10 ARG CG C -8.836 10.459 -6.245 1.00 . A A . 10 ARG CG 1 1 6 1590 1 1 10 ARG CZ C -6.149 11.856 -8.436 1.00 . A A . 10 ARG CZ 1 1 6 1591 1 1 10 ARG H H -6.319 10.146 -3.703 1.00 . A A . 10 ARG H 1 1 6 1592 1 1 10 ARG HA H -7.902 12.251 -4.736 1.00 . A A . 10 ARG HA 1 1 6 1593 1 1 10 ARG HB2 H -8.005 9.366 -4.627 1.00 . A A . 10 ARG HB2 1 1 6 1594 1 1 10 ARG HB3 H -9.591 10.052 -4.304 1.00 . A A . 10 ARG HB3 1 1 6 1595 1 1 10 ARG HD2 H -6.718 10.244 -6.299 1.00 . A A . 10 ARG HD2 1 1 6 1596 1 1 10 ARG HD3 H -7.556 9.575 -7.699 1.00 . A A . 10 ARG HD3 1 1 6 1597 1 1 10 ARG HE H -7.954 12.326 -7.731 1.00 . A A . 10 ARG HE 1 1 6 1598 1 1 10 ARG HG2 H -9.492 9.690 -6.626 1.00 . A A . 10 ARG HG2 1 1 6 1599 1 1 10 ARG HG3 H -9.287 11.428 -6.396 1.00 . A A . 10 ARG HG3 1 1 6 1600 1 1 10 ARG HH11 H -5.314 10.072 -7.990 1.00 . A A . 10 ARG HH11 1 1 6 1601 1 1 10 ARG HH12 H -4.358 11.107 -8.998 1.00 . A A . 10 ARG HH12 1 1 6 1602 1 1 10 ARG HH21 H -6.706 13.698 -9.058 1.00 . A A . 10 ARG HH21 1 1 6 1603 1 1 10 ARG HH22 H -5.150 13.170 -9.604 1.00 . A A . 10 ARG HH22 1 1 6 1604 1 1 10 ARG N N -6.620 11.076 -3.625 1.00 . A A . 10 ARG N 1 1 6 1605 1 1 10 ARG NE N -7.263 11.633 -7.748 1.00 . A A . 10 ARG NE 1 1 6 1606 1 1 10 ARG NH1 N -5.195 10.937 -8.478 1.00 . A A . 10 ARG NH1 1 1 6 1607 1 1 10 ARG NH2 N -5.988 13.002 -9.087 1.00 . A A . 10 ARG NH2 1 1 6 1608 1 1 10 ARG O O -9.763 12.620 -3.026 1.00 . A A . 10 ARG O 1 1 6 1609 1 1 11 . C C -9.031 13.142 -0.112 1.00 . A A . 11 SEP C 1 1 6 1610 1 1 11 . CA C -9.232 11.685 -0.438 1.00 . A A . 11 SEP CA 1 1 6 1611 1 1 11 . CB C -8.864 10.695 0.707 1.00 . A A . 11 SEP CB 1 1 6 1612 1 1 11 . H H -7.689 10.711 -1.600 1.00 . A A . 11 SEP H 1 1 6 1613 1 1 11 . HA H -10.302 11.542 -0.676 1.00 . A A . 11 SEP HA 1 1 6 1614 1 1 11 . HB2 H -9.199 9.663 0.495 1.00 . A A . 11 SEP HB2 1 1 6 1615 1 1 11 . HB3 H -7.767 10.600 0.838 1.00 . A A . 11 SEP HB3 1 1 6 1616 1 1 11 . N N -8.474 11.341 -1.677 1.00 . A A . 11 SEP N 1 1 6 1617 1 1 11 . O O -9.932 13.847 0.343 1.00 . A A . 11 SEP O 1 1 6 1618 1 1 11 . O1P O -10.783 10.839 4.133 1.00 . A A . 11 SEP O1P 1 1 6 1619 1 1 11 . O2P O -11.488 9.587 2.108 1.00 . A A . 11 SEP O2P 1 1 6 1620 1 1 11 . O3P O -9.395 8.910 3.311 1.00 . A A . 11 SEP O3P 1 1 6 1621 1 1 11 . OG O -9.458 11.108 1.961 1.00 . A A . 11 SEP OG 1 1 6 1622 1 1 11 . P P -10.279 10.084 2.908 1.00 . A A . 11 SEP P 1 1 6 1623 1 1 12 MET C C -8.172 15.926 -1.057 1.00 . A A . 12 MET C 1 1 6 1624 1 1 12 MET CA C -7.445 14.988 -0.099 1.00 . A A . 12 MET CA 1 1 6 1625 1 1 12 MET CB C -5.933 15.176 -0.232 1.00 . A A . 12 MET CB 1 1 6 1626 1 1 12 MET CE C -4.802 19.115 -0.197 1.00 . A A . 12 MET CE 1 1 6 1627 1 1 12 MET CG C -5.427 16.476 0.372 1.00 . A A . 12 MET CG 1 1 6 1628 1 1 12 MET H H -7.132 12.989 -0.719 1.00 . A A . 12 MET H 1 1 6 1629 1 1 12 MET HA H -7.741 15.225 0.912 1.00 . A A . 12 MET HA 1 1 6 1630 1 1 12 MET HB2 H -5.435 14.356 0.264 1.00 . A A . 12 MET HB2 1 1 6 1631 1 1 12 MET HB3 H -5.671 15.166 -1.279 1.00 . A A . 12 MET HB3 1 1 6 1632 1 1 12 MET HE1 H -5.389 19.058 0.708 1.00 . A A . 12 MET HE1 1 1 6 1633 1 1 12 MET HE2 H -3.867 19.615 0.011 1.00 . A A . 12 MET HE2 1 1 6 1634 1 1 12 MET HE3 H -5.347 19.669 -0.946 1.00 . A A . 12 MET HE3 1 1 6 1635 1 1 12 MET HG2 H -6.274 17.058 0.703 1.00 . A A . 12 MET HG2 1 1 6 1636 1 1 12 MET HG3 H -4.800 16.242 1.220 1.00 . A A . 12 MET HG3 1 1 6 1637 1 1 12 MET N N -7.808 13.599 -0.356 1.00 . A A . 12 MET N 1 1 6 1638 1 1 12 MET O O -8.397 17.096 -0.745 1.00 . A A . 12 MET O 1 1 6 1639 1 1 12 MET SD S -4.473 17.461 -0.799 1.00 . A A . 12 MET SD 1 1 6 1640 1 1 13 PHE C C -10.661 16.514 -2.776 1.00 . A A . 13 PHE C 1 1 6 1641 1 1 13 PHE CA C -9.238 16.198 -3.228 1.00 . A A . 13 PHE CA 1 1 6 1642 1 1 13 PHE CB C -9.269 15.454 -4.565 1.00 . A A . 13 PHE CB 1 1 6 1643 1 1 13 PHE CD1 C -6.908 16.026 -5.193 1.00 . A A . 13 PHE CD1 1 1 6 1644 1 1 13 PHE CD2 C -8.619 16.323 -6.827 1.00 . A A . 13 PHE CD2 1 1 6 1645 1 1 13 PHE CE1 C -5.964 16.478 -6.096 1.00 . A A . 13 PHE CE1 1 1 6 1646 1 1 13 PHE CE2 C -7.680 16.775 -7.735 1.00 . A A . 13 PHE CE2 1 1 6 1647 1 1 13 PHE CG C -8.245 15.944 -5.548 1.00 . A A . 13 PHE CG 1 1 6 1648 1 1 13 PHE CZ C -6.350 16.852 -7.369 1.00 . A A . 13 PHE CZ 1 1 6 1649 1 1 13 PHE H H -8.330 14.467 -2.415 1.00 . A A . 13 PHE H 1 1 6 1650 1 1 13 PHE HA H -8.699 17.124 -3.354 1.00 . A A . 13 PHE HA 1 1 6 1651 1 1 13 PHE HB2 H -9.084 14.405 -4.389 1.00 . A A . 13 PHE HB2 1 1 6 1652 1 1 13 PHE HB3 H -10.245 15.573 -5.012 1.00 . A A . 13 PHE HB3 1 1 6 1653 1 1 13 PHE HD1 H -6.605 15.733 -4.199 1.00 . A A . 13 PHE HD1 1 1 6 1654 1 1 13 PHE HD2 H -9.660 16.263 -7.115 1.00 . A A . 13 PHE HD2 1 1 6 1655 1 1 13 PHE HE1 H -4.925 16.537 -5.808 1.00 . A A . 13 PHE HE1 1 1 6 1656 1 1 13 PHE HE2 H -7.985 17.067 -8.729 1.00 . A A . 13 PHE HE2 1 1 6 1657 1 1 13 PHE HZ H -5.615 17.205 -8.075 1.00 . A A . 13 PHE HZ 1 1 6 1658 1 1 13 PHE N N -8.537 15.406 -2.224 1.00 . A A . 13 PHE N 1 1 6 1659 1 1 13 PHE O O -11.207 15.882 -1.872 1.00 . A A . 13 PHE O 1 1 6 1660 1 1 14 PRO C C -13.689 16.953 -3.607 1.00 . A A . 14 PRO C 1 1 6 1661 1 1 14 PRO CA C -12.643 17.941 -3.102 1.00 . A A . 14 PRO CA 1 1 6 1662 1 1 14 PRO CB C -12.777 19.281 -3.829 1.00 . A A . 14 PRO CB 1 1 6 1663 1 1 14 PRO CD C -10.686 18.314 -4.508 1.00 . A A . 14 PRO CD 1 1 6 1664 1 1 14 PRO CG C -11.810 19.197 -4.959 1.00 . A A . 14 PRO CG 1 1 6 1665 1 1 14 PRO HA H -12.775 18.091 -2.040 1.00 . A A . 14 PRO HA 1 1 6 1666 1 1 14 PRO HB2 H -13.791 19.401 -4.184 1.00 . A A . 14 PRO HB2 1 1 6 1667 1 1 14 PRO HB3 H -12.529 20.087 -3.156 1.00 . A A . 14 PRO HB3 1 1 6 1668 1 1 14 PRO HD2 H -10.375 17.681 -5.325 1.00 . A A . 14 PRO HD2 1 1 6 1669 1 1 14 PRO HD3 H -9.855 18.902 -4.147 1.00 . A A . 14 PRO HD3 1 1 6 1670 1 1 14 PRO HG2 H -12.293 18.773 -5.825 1.00 . A A . 14 PRO HG2 1 1 6 1671 1 1 14 PRO HG3 H -11.425 20.181 -5.186 1.00 . A A . 14 PRO HG3 1 1 6 1672 1 1 14 PRO N N -11.276 17.517 -3.420 1.00 . A A . 14 PRO N 1 1 6 1673 1 1 14 PRO O O -14.844 16.985 -3.182 1.00 . A A . 14 PRO O 1 1 6 1674 1 1 15 SER C C -14.548 14.027 -4.042 1.00 . A A . 15 SER C 1 1 6 1675 1 1 15 SER CA C -14.180 15.081 -5.083 1.00 . A A . 15 SER CA 1 1 6 1676 1 1 15 SER CB C -13.536 14.410 -6.298 1.00 . A A . 15 SER CB 1 1 6 1677 1 1 15 SER H H -12.344 16.101 -4.816 1.00 . A A . 15 SER H 1 1 6 1678 1 1 15 SER HA H -15.079 15.589 -5.397 1.00 . A A . 15 SER HA 1 1 6 1679 1 1 15 SER HB2 H -13.352 13.370 -6.077 1.00 . A A . 15 SER HB2 1 1 6 1680 1 1 15 SER HB3 H -14.205 14.486 -7.144 1.00 . A A . 15 SER HB3 1 1 6 1681 1 1 15 SER HG H -11.602 14.379 -6.609 1.00 . A A . 15 SER HG 1 1 6 1682 1 1 15 SER N N -13.277 16.076 -4.517 1.00 . A A . 15 SER N 1 1 6 1683 1 1 15 SER O O -15.609 13.408 -4.118 1.00 . A A . 15 SER O 1 1 6 1684 1 1 15 SER OG O -12.307 15.031 -6.632 1.00 . A A . 15 SER OG 1 1 6 1685 1 1 16 SER C C -15.008 13.304 -1.084 1.00 . A A . 16 SER C 1 1 6 1686 1 1 16 SER CA C -13.891 12.848 -2.017 1.00 . A A . 16 SER CA 1 1 6 1687 1 1 16 SER CB C -12.606 12.618 -1.218 1.00 . A A . 16 SER CB 1 1 6 1688 1 1 16 SER H H -12.834 14.354 -3.065 1.00 . A A . 16 SER H 1 1 6 1689 1 1 16 SER HA H -14.184 11.921 -2.485 1.00 . A A . 16 SER HA 1 1 6 1690 1 1 16 SER HB2 H -12.635 11.636 -0.771 1.00 . A A . 16 SER HB2 1 1 6 1691 1 1 16 SER HB3 H -11.756 12.688 -1.881 1.00 . A A . 16 SER HB3 1 1 6 1692 1 1 16 SER HG H -12.470 14.463 -0.575 1.00 . A A . 16 SER HG 1 1 6 1693 1 1 16 SER N N -13.662 13.829 -3.071 1.00 . A A . 16 SER N 1 1 6 1694 1 1 16 SER O O -15.732 12.484 -0.519 1.00 . A A . 16 SER O 1 1 6 1695 1 1 16 SER OG O -12.465 13.583 -0.190 1.00 . A A . 16 SER OG 1 1 6 1696 1 1 17 GLU C C -17.472 15.393 -0.831 1.00 . A A . 17 GLU C 1 1 6 1697 1 1 17 GLU CA C -16.171 15.182 -0.062 1.00 . A A . 17 GLU CA 1 1 6 1698 1 1 17 GLU CB C -15.696 16.510 0.532 1.00 . A A . 17 GLU CB 1 1 6 1699 1 1 17 GLU CD C -16.326 16.499 2.978 1.00 . A A . 17 GLU CD 1 1 6 1700 1 1 17 GLU CG C -15.203 16.394 1.964 1.00 . A A . 17 GLU CG 1 1 6 1701 1 1 17 GLU H H -14.534 15.220 -1.405 1.00 . A A . 17 GLU H 1 1 6 1702 1 1 17 GLU HA H -16.350 14.483 0.740 1.00 . A A . 17 GLU HA 1 1 6 1703 1 1 17 GLU HB2 H -14.889 16.894 -0.075 1.00 . A A . 17 GLU HB2 1 1 6 1704 1 1 17 GLU HB3 H -16.516 17.213 0.511 1.00 . A A . 17 GLU HB3 1 1 6 1705 1 1 17 GLU HG2 H -14.716 15.439 2.088 1.00 . A A . 17 GLU HG2 1 1 6 1706 1 1 17 GLU HG3 H -14.494 17.186 2.153 1.00 . A A . 17 GLU HG3 1 1 6 1707 1 1 17 GLU N N -15.142 14.617 -0.928 1.00 . A A . 17 GLU N 1 1 6 1708 1 1 17 GLU O O -17.459 15.786 -1.997 1.00 . A A . 17 GLU O 1 1 6 1709 1 1 17 GLU OE1 O -17.369 17.102 2.647 1.00 . A A . 17 GLU OE1 1 1 6 1710 1 1 17 GLU OE2 O -16.163 15.978 4.101 1.00 . A A . 17 GLU OE2 1 1 7 1711 1 1 1 ARG C C 2.820 1.671 -1.371 1.00 . A A . 1 ARG C 1 1 7 1712 1 1 1 ARG CA C 2.787 0.217 -0.909 1.00 . A A . 1 ARG CA 1 1 7 1713 1 1 1 ARG CB C 2.480 -0.700 -2.095 1.00 . A A . 1 ARG CB 1 1 7 1714 1 1 1 ARG CD C 2.178 -3.065 -2.890 1.00 . A A . 1 ARG CD 1 1 7 1715 1 1 1 ARG CG C 2.153 -2.128 -1.692 1.00 . A A . 1 ARG CG 1 1 7 1716 1 1 1 ARG CZ C 2.305 -5.310 -1.896 1.00 . A A . 1 ARG CZ 1 1 7 1717 1 1 1 ARG H1 H 1.299 0.806 0.476 1.00 . A A . 1 ARG H1 1 1 7 1718 1 1 1 ARG HA H 3.754 -0.043 -0.505 1.00 . A A . 1 ARG HA 1 1 7 1719 1 1 1 ARG HB2 H 1.636 -0.299 -2.636 1.00 . A A . 1 ARG HB2 1 1 7 1720 1 1 1 ARG HB3 H 3.339 -0.721 -2.749 1.00 . A A . 1 ARG HB3 1 1 7 1721 1 1 1 ARG HD2 H 1.592 -2.628 -3.684 1.00 . A A . 1 ARG HD2 1 1 7 1722 1 1 1 ARG HD3 H 3.200 -3.179 -3.219 1.00 . A A . 1 ARG HD3 1 1 7 1723 1 1 1 ARG HE H 0.723 -4.581 -2.867 1.00 . A A . 1 ARG HE 1 1 7 1724 1 1 1 ARG HG2 H 2.882 -2.465 -0.970 1.00 . A A . 1 ARG HG2 1 1 7 1725 1 1 1 ARG HG3 H 1.168 -2.150 -1.249 1.00 . A A . 1 ARG HG3 1 1 7 1726 1 1 1 ARG HH11 H 3.967 -4.184 -1.667 1.00 . A A . 1 ARG HH11 1 1 7 1727 1 1 1 ARG HH12 H 4.043 -5.768 -0.971 1.00 . A A . 1 ARG HH12 1 1 7 1728 1 1 1 ARG HH21 H 0.811 -6.669 -1.954 1.00 . A A . 1 ARG HH21 1 1 7 1729 1 1 1 ARG HH22 H 2.247 -7.182 -1.136 1.00 . A A . 1 ARG HH22 1 1 7 1730 1 1 1 ARG N N 1.797 0.029 0.145 1.00 . A A . 1 ARG N 1 1 7 1731 1 1 1 ARG NE N 1.634 -4.381 -2.567 1.00 . A A . 1 ARG NE 1 1 7 1732 1 1 1 ARG NH1 N 3.540 -5.068 -1.478 1.00 . A A . 1 ARG NH1 1 1 7 1733 1 1 1 ARG NH2 N 1.741 -6.483 -1.641 1.00 . A A . 1 ARG NH2 1 1 7 1734 1 1 1 ARG O O 2.113 2.521 -0.830 1.00 . A A . 1 ARG O 1 1 7 1735 1 1 2 SER C C 2.629 3.620 -3.861 1.00 . A A . 2 SER C 1 1 7 1736 1 1 2 SER CA C 3.776 3.300 -2.907 1.00 . A A . 2 SER CA 1 1 7 1737 1 1 2 SER CB C 5.115 3.460 -3.629 1.00 . A A . 2 SER CB 1 1 7 1738 1 1 2 SER H H 4.184 1.227 -2.764 1.00 . A A . 2 SER H 1 1 7 1739 1 1 2 SER HA H 3.740 3.988 -2.076 1.00 . A A . 2 SER HA 1 1 7 1740 1 1 2 SER HB2 H 5.333 4.511 -3.748 1.00 . A A . 2 SER HB2 1 1 7 1741 1 1 2 SER HB3 H 5.894 2.994 -3.044 1.00 . A A . 2 SER HB3 1 1 7 1742 1 1 2 SER HG H 5.263 1.915 -4.824 1.00 . A A . 2 SER HG 1 1 7 1743 1 1 2 SER N N 3.647 1.948 -2.374 1.00 . A A . 2 SER N 1 1 7 1744 1 1 2 SER O O 2.218 4.773 -3.992 1.00 . A A . 2 SER O 1 1 7 1745 1 1 2 SER OG O 5.079 2.854 -4.909 1.00 . A A . 2 SER OG 1 1 7 1746 1 1 3 LYS C C -0.317 2.877 -4.731 1.00 . A A . 3 LYS C 1 1 7 1747 1 1 3 LYS CA C 1.015 2.758 -5.466 1.00 . A A . 3 LYS CA 1 1 7 1748 1 1 3 LYS CB C 0.967 1.581 -6.443 1.00 . A A . 3 LYS CB 1 1 7 1749 1 1 3 LYS CD C 0.998 1.312 -8.940 1.00 . A A . 3 LYS CD 1 1 7 1750 1 1 3 LYS CE C 2.300 2.051 -9.211 1.00 . A A . 3 LYS CE 1 1 7 1751 1 1 3 LYS CG C 0.261 1.902 -7.749 1.00 . A A . 3 LYS CG 1 1 7 1752 1 1 3 LYS H H 2.485 1.694 -4.377 1.00 . A A . 3 LYS H 1 1 7 1753 1 1 3 LYS HA H 1.188 3.668 -6.021 1.00 . A A . 3 LYS HA 1 1 7 1754 1 1 3 LYS HB2 H 1.978 1.276 -6.669 1.00 . A A . 3 LYS HB2 1 1 7 1755 1 1 3 LYS HB3 H 0.450 0.758 -5.971 1.00 . A A . 3 LYS HB3 1 1 7 1756 1 1 3 LYS HD2 H 1.221 0.275 -8.738 1.00 . A A . 3 LYS HD2 1 1 7 1757 1 1 3 LYS HD3 H 0.365 1.383 -9.814 1.00 . A A . 3 LYS HD3 1 1 7 1758 1 1 3 LYS HE2 H 2.121 3.112 -9.129 1.00 . A A . 3 LYS HE2 1 1 7 1759 1 1 3 LYS HE3 H 3.029 1.750 -8.474 1.00 . A A . 3 LYS HE3 1 1 7 1760 1 1 3 LYS HG2 H -0.737 1.492 -7.718 1.00 . A A . 3 LYS HG2 1 1 7 1761 1 1 3 LYS HG3 H 0.209 2.975 -7.865 1.00 . A A . 3 LYS HG3 1 1 7 1762 1 1 3 LYS HZ1 H 3.873 1.754 -10.553 1.00 . A A . 3 LYS HZ1 1 1 7 1763 1 1 3 LYS HZ2 H 2.507 2.473 -11.246 1.00 . A A . 3 LYS HZ2 1 1 7 1764 1 1 3 LYS HZ3 H 2.502 0.820 -10.887 1.00 . A A . 3 LYS HZ3 1 1 7 1765 1 1 3 LYS N N 2.115 2.590 -4.525 1.00 . A A . 3 LYS N 1 1 7 1766 1 1 3 LYS NZ N 2.833 1.753 -10.570 1.00 . A A . 3 LYS NZ 1 1 7 1767 1 1 3 LYS O O -1.262 3.483 -5.235 1.00 . A A . 3 LYS O 1 1 7 1768 1 1 4 ASP C C -1.820 3.734 -2.159 1.00 . A A . 4 ASP C 1 1 7 1769 1 1 4 ASP CA C -1.598 2.338 -2.734 1.00 . A A . 4 ASP CA 1 1 7 1770 1 1 4 ASP CB C -1.521 1.313 -1.601 1.00 . A A . 4 ASP CB 1 1 7 1771 1 1 4 ASP CG C -2.577 0.233 -1.725 1.00 . A A . 4 ASP CG 1 1 7 1772 1 1 4 ASP H H 0.405 1.827 -3.191 1.00 . A A . 4 ASP H 1 1 7 1773 1 1 4 ASP HA H -2.430 2.090 -3.375 1.00 . A A . 4 ASP HA 1 1 7 1774 1 1 4 ASP HB2 H -0.548 0.843 -1.615 1.00 . A A . 4 ASP HB2 1 1 7 1775 1 1 4 ASP HB3 H -1.658 1.819 -0.657 1.00 . A A . 4 ASP HB3 1 1 7 1776 1 1 4 ASP N N -0.383 2.295 -3.539 1.00 . A A . 4 ASP N 1 1 7 1777 1 1 4 ASP O O -2.957 4.150 -1.933 1.00 . A A . 4 ASP O 1 1 7 1778 1 1 4 ASP OD1 O -3.733 0.569 -2.058 1.00 . A A . 4 ASP OD1 1 1 7 1779 1 1 4 ASP OD2 O -2.248 -0.949 -1.489 1.00 . A A . 4 ASP OD2 1 1 7 1780 1 1 5 LEU C C -1.261 6.797 -2.436 1.00 . A A . 5 LEU C 1 1 7 1781 1 1 5 LEU CA C -0.802 5.802 -1.375 1.00 . A A . 5 LEU CA 1 1 7 1782 1 1 5 LEU CB C 0.559 6.223 -0.818 1.00 . A A . 5 LEU CB 1 1 7 1783 1 1 5 LEU CD1 C 0.618 6.459 1.676 1.00 . A A . 5 LEU CD1 1 1 7 1784 1 1 5 LEU CD2 C 1.662 8.214 0.232 1.00 . A A . 5 LEU CD2 1 1 7 1785 1 1 5 LEU CG C 0.530 7.205 0.354 1.00 . A A . 5 LEU CG 1 1 7 1786 1 1 5 LEU H H 0.151 4.067 -2.125 1.00 . A A . 5 LEU H 1 1 7 1787 1 1 5 LEU HA H -1.524 5.792 -0.572 1.00 . A A . 5 LEU HA 1 1 7 1788 1 1 5 LEU HB2 H 1.072 5.332 -0.491 1.00 . A A . 5 LEU HB2 1 1 7 1789 1 1 5 LEU HB3 H 1.116 6.682 -1.623 1.00 . A A . 5 LEU HB3 1 1 7 1790 1 1 5 LEU HD11 H 0.981 7.127 2.442 1.00 . A A . 5 LEU HD11 1 1 7 1791 1 1 5 LEU HD12 H 1.296 5.625 1.575 1.00 . A A . 5 LEU HD12 1 1 7 1792 1 1 5 LEU HD13 H -0.362 6.095 1.950 1.00 . A A . 5 LEU HD13 1 1 7 1793 1 1 5 LEU HD21 H 1.265 9.162 -0.099 1.00 . A A . 5 LEU HD21 1 1 7 1794 1 1 5 LEU HD22 H 2.386 7.857 -0.485 1.00 . A A . 5 LEU HD22 1 1 7 1795 1 1 5 LEU HD23 H 2.138 8.338 1.194 1.00 . A A . 5 LEU HD23 1 1 7 1796 1 1 5 LEU HG H -0.406 7.746 0.338 1.00 . A A . 5 LEU HG 1 1 7 1797 1 1 5 LEU N N -0.728 4.452 -1.925 1.00 . A A . 5 LEU N 1 1 7 1798 1 1 5 LEU O O -1.863 7.823 -2.120 1.00 . A A . 5 LEU O 1 1 7 1799 1 1 6 ARG C C -2.862 7.604 -4.801 1.00 . A A . 6 ARG C 1 1 7 1800 1 1 6 ARG CA C -1.357 7.352 -4.804 1.00 . A A . 6 ARG CA 1 1 7 1801 1 1 6 ARG CB C -0.936 6.729 -6.136 1.00 . A A . 6 ARG CB 1 1 7 1802 1 1 6 ARG CD C 0.902 6.962 -7.833 1.00 . A A . 6 ARG CD 1 1 7 1803 1 1 6 ARG CG C 0.566 6.742 -6.367 1.00 . A A . 6 ARG CG 1 1 7 1804 1 1 6 ARG CZ C 2.928 7.378 -9.163 1.00 . A A . 6 ARG CZ 1 1 7 1805 1 1 6 ARG H H -0.491 5.653 -3.885 1.00 . A A . 6 ARG H 1 1 7 1806 1 1 6 ARG HA H -0.846 8.295 -4.680 1.00 . A A . 6 ARG HA 1 1 7 1807 1 1 6 ARG HB2 H -1.273 5.703 -6.163 1.00 . A A . 6 ARG HB2 1 1 7 1808 1 1 6 ARG HB3 H -1.407 7.275 -6.939 1.00 . A A . 6 ARG HB3 1 1 7 1809 1 1 6 ARG HD2 H 0.397 6.210 -8.421 1.00 . A A . 6 ARG HD2 1 1 7 1810 1 1 6 ARG HD3 H 0.555 7.941 -8.126 1.00 . A A . 6 ARG HD3 1 1 7 1811 1 1 6 ARG HE H 2.889 6.415 -7.417 1.00 . A A . 6 ARG HE 1 1 7 1812 1 1 6 ARG HG2 H 1.003 7.541 -5.785 1.00 . A A . 6 ARG HG2 1 1 7 1813 1 1 6 ARG HG3 H 0.978 5.796 -6.049 1.00 . A A . 6 ARG HG3 1 1 7 1814 1 1 6 ARG HH11 H 1.220 8.097 -9.968 1.00 . A A . 6 ARG HH11 1 1 7 1815 1 1 6 ARG HH12 H 2.656 8.383 -10.895 1.00 . A A . 6 ARG HH12 1 1 7 1816 1 1 6 ARG HH21 H 4.785 6.786 -8.628 1.00 . A A . 6 ARG HH21 1 1 7 1817 1 1 6 ARG HH22 H 4.683 7.636 -10.133 1.00 . A A . 6 ARG HH22 1 1 7 1818 1 1 6 ARG N N -0.974 6.485 -3.696 1.00 . A A . 6 ARG N 1 1 7 1819 1 1 6 ARG NE N 2.338 6.873 -8.085 1.00 . A A . 6 ARG NE 1 1 7 1820 1 1 6 ARG NH1 N 2.209 8.003 -10.085 1.00 . A A . 6 ARG NH1 1 1 7 1821 1 1 6 ARG NH2 N 4.240 7.257 -9.321 1.00 . A A . 6 ARG NH2 1 1 7 1822 1 1 6 ARG O O -3.325 8.670 -5.208 1.00 . A A . 6 ARG O 1 1 7 1823 1 1 7 HIS C C -5.505 7.621 -3.124 1.00 . A A . 7 HIS C 1 1 7 1824 1 1 7 HIS CA C -5.075 6.729 -4.284 1.00 . A A . 7 HIS CA 1 1 7 1825 1 1 7 HIS CB C -5.711 5.346 -4.143 1.00 . A A . 7 HIS CB 1 1 7 1826 1 1 7 HIS CD2 C -8.266 5.081 -4.502 1.00 . A A . 7 HIS CD2 1 1 7 1827 1 1 7 HIS CE1 C -8.274 4.991 -6.693 1.00 . A A . 7 HIS CE1 1 1 7 1828 1 1 7 HIS CG C -6.983 5.190 -4.919 1.00 . A A . 7 HIS CG 1 1 7 1829 1 1 7 HIS H H -3.195 5.789 -4.030 1.00 . A A . 7 HIS H 1 1 7 1830 1 1 7 HIS HA H -5.408 7.177 -5.208 1.00 . A A . 7 HIS HA 1 1 7 1831 1 1 7 HIS HB2 H -5.015 4.599 -4.495 1.00 . A A . 7 HIS HB2 1 1 7 1832 1 1 7 HIS HB3 H -5.932 5.163 -3.101 1.00 . A A . 7 HIS HB3 1 1 7 1833 1 1 7 HIS HD1 H -6.247 5.182 -6.893 1.00 . A A . 7 HIS HD1 1 1 7 1834 1 1 7 HIS HD2 H -8.611 5.088 -3.478 1.00 . A A . 7 HIS HD2 1 1 7 1835 1 1 7 HIS HE1 H -8.609 4.917 -7.717 1.00 . A A . 7 HIS HE1 1 1 7 1836 1 1 7 HIS N N -3.622 6.615 -4.340 1.00 . A A . 7 HIS N 1 1 7 1837 1 1 7 HIS ND1 N -7.022 5.129 -6.296 1.00 . A A . 7 HIS ND1 1 1 7 1838 1 1 7 HIS NE2 N -9.049 4.958 -5.624 1.00 . A A . 7 HIS NE2 1 1 7 1839 1 1 7 HIS O O -6.627 8.127 -3.100 1.00 . A A . 7 HIS O 1 1 7 1840 1 1 8 ALA C C -4.837 10.121 -1.357 1.00 . A A . 8 ALA C 1 1 7 1841 1 1 8 ALA CA C -4.894 8.640 -1.000 1.00 . A A . 8 ALA CA 1 1 7 1842 1 1 8 ALA CB C -3.917 8.329 0.125 1.00 . A A . 8 ALA CB 1 1 7 1843 1 1 8 ALA H H -3.730 7.378 -2.238 1.00 . A A . 8 ALA H 1 1 7 1844 1 1 8 ALA HA H -5.889 8.400 -0.656 1.00 . A A . 8 ALA HA 1 1 7 1845 1 1 8 ALA HB1 H -3.551 7.319 0.013 1.00 . A A . 8 ALA HB1 1 1 7 1846 1 1 8 ALA HB2 H -3.089 9.020 0.083 1.00 . A A . 8 ALA HB2 1 1 7 1847 1 1 8 ALA HB3 H -4.421 8.426 1.075 1.00 . A A . 8 ALA HB3 1 1 7 1848 1 1 8 ALA N N -4.607 7.808 -2.162 1.00 . A A . 8 ALA N 1 1 7 1849 1 1 8 ALA O O -5.435 10.957 -0.679 1.00 . A A . 8 ALA O 1 1 7 1850 1 1 9 PHE C C -5.334 12.398 -3.276 1.00 . A A . 9 PHE C 1 1 7 1851 1 1 9 PHE CA C -3.980 11.822 -2.872 1.00 . A A . 9 PHE CA 1 1 7 1852 1 1 9 PHE CB C -3.006 11.907 -4.049 1.00 . A A . 9 PHE CB 1 1 7 1853 1 1 9 PHE CD1 C -3.256 14.142 -5.162 1.00 . A A . 9 PHE CD1 1 1 7 1854 1 1 9 PHE CD2 C -1.354 13.776 -3.772 1.00 . A A . 9 PHE CD2 1 1 7 1855 1 1 9 PHE CE1 C -2.819 15.426 -5.426 1.00 . A A . 9 PHE CE1 1 1 7 1856 1 1 9 PHE CE2 C -0.913 15.059 -4.032 1.00 . A A . 9 PHE CE2 1 1 7 1857 1 1 9 PHE CG C -2.529 13.302 -4.334 1.00 . A A . 9 PHE CG 1 1 7 1858 1 1 9 PHE CZ C -1.647 15.886 -4.859 1.00 . A A . 9 PHE CZ 1 1 7 1859 1 1 9 PHE H H -3.662 9.729 -2.926 1.00 . A A . 9 PHE H 1 1 7 1860 1 1 9 PHE HA H -3.587 12.398 -2.049 1.00 . A A . 9 PHE HA 1 1 7 1861 1 1 9 PHE HB2 H -2.140 11.298 -3.835 1.00 . A A . 9 PHE HB2 1 1 7 1862 1 1 9 PHE HB3 H -3.492 11.533 -4.938 1.00 . A A . 9 PHE HB3 1 1 7 1863 1 1 9 PHE HD1 H -4.174 13.784 -5.606 1.00 . A A . 9 PHE HD1 1 1 7 1864 1 1 9 PHE HD2 H -0.779 13.129 -3.124 1.00 . A A . 9 PHE HD2 1 1 7 1865 1 1 9 PHE HE1 H -3.396 16.070 -6.073 1.00 . A A . 9 PHE HE1 1 1 7 1866 1 1 9 PHE HE2 H 0.005 15.415 -3.587 1.00 . A A . 9 PHE HE2 1 1 7 1867 1 1 9 PHE HZ H -1.303 16.889 -5.064 1.00 . A A . 9 PHE HZ 1 1 7 1868 1 1 9 PHE N N -4.115 10.440 -2.426 1.00 . A A . 9 PHE N 1 1 7 1869 1 1 9 PHE O O -5.552 13.608 -3.202 1.00 . A A . 9 PHE O 1 1 7 1870 1 1 10 ARG C C -8.433 12.297 -2.910 1.00 . A A . 10 ARG C 1 1 7 1871 1 1 10 ARG CA C -7.571 11.945 -4.119 1.00 . A A . 10 ARG CA 1 1 7 1872 1 1 10 ARG CB C -8.246 10.842 -4.936 1.00 . A A . 10 ARG CB 1 1 7 1873 1 1 10 ARG CD C -9.943 10.311 -6.711 1.00 . A A . 10 ARG CD 1 1 7 1874 1 1 10 ARG CG C -8.988 11.357 -6.158 1.00 . A A . 10 ARG CG 1 1 7 1875 1 1 10 ARG CZ C -12.376 9.979 -6.835 1.00 . A A . 10 ARG CZ 1 1 7 1876 1 1 10 ARG H H -6.006 10.573 -3.738 1.00 . A A . 10 ARG H 1 1 7 1877 1 1 10 ARG HA H -7.463 12.824 -4.737 1.00 . A A . 10 ARG HA 1 1 7 1878 1 1 10 ARG HB2 H -7.492 10.144 -5.268 1.00 . A A . 10 ARG HB2 1 1 7 1879 1 1 10 ARG HB3 H -8.951 10.324 -4.305 1.00 . A A . 10 ARG HB3 1 1 7 1880 1 1 10 ARG HD2 H -9.923 10.359 -7.790 1.00 . A A . 10 ARG HD2 1 1 7 1881 1 1 10 ARG HD3 H -9.613 9.335 -6.389 1.00 . A A . 10 ARG HD3 1 1 7 1882 1 1 10 ARG HE H -11.447 11.101 -5.473 1.00 . A A . 10 ARG HE 1 1 7 1883 1 1 10 ARG HG2 H -9.554 12.234 -5.881 1.00 . A A . 10 ARG HG2 1 1 7 1884 1 1 10 ARG HG3 H -8.270 11.616 -6.922 1.00 . A A . 10 ARG HG3 1 1 7 1885 1 1 10 ARG HH11 H -11.313 9.009 -8.253 1.00 . A A . 10 ARG HH11 1 1 7 1886 1 1 10 ARG HH12 H -13.029 8.784 -8.328 1.00 . A A . 10 ARG HH12 1 1 7 1887 1 1 10 ARG HH21 H -13.707 10.812 -5.563 1.00 . A A . 10 ARG HH21 1 1 7 1888 1 1 10 ARG HH22 H -14.390 9.811 -6.798 1.00 . A A . 10 ARG HH22 1 1 7 1889 1 1 10 ARG N N -6.239 11.524 -3.702 1.00 . A A . 10 ARG N 1 1 7 1890 1 1 10 ARG NE N -11.314 10.524 -6.253 1.00 . A A . 10 ARG NE 1 1 7 1891 1 1 10 ARG NH1 N -12.227 9.193 -7.893 1.00 . A A . 10 ARG NH1 1 1 7 1892 1 1 10 ARG NH2 N -13.591 10.220 -6.360 1.00 . A A . 10 ARG NH2 1 1 7 1893 1 1 10 ARG O O -9.350 13.107 -3.039 1.00 . A A . 10 ARG O 1 1 7 1894 1 1 11 . C C -8.816 13.417 -0.182 1.00 . A A . 11 SEP C 1 1 7 1895 1 1 11 . CA C -8.898 11.952 -0.525 1.00 . A A . 11 SEP CA 1 1 7 1896 1 1 11 . CB C -8.442 10.982 0.604 1.00 . A A . 11 SEP CB 1 1 7 1897 1 1 11 . H H -7.358 11.031 -1.733 1.00 . A A . 11 SEP H 1 1 7 1898 1 1 11 . HA H -9.955 11.725 -0.759 1.00 . A A . 11 SEP HA 1 1 7 1899 1 1 11 . HB2 H -8.654 9.924 0.361 1.00 . A A . 11 SEP HB2 1 1 7 1900 1 1 11 . HB3 H -7.344 11.008 0.755 1.00 . A A . 11 SEP HB3 1 1 7 1901 1 1 11 . N N -8.125 11.688 -1.775 1.00 . A A . 11 SEP N 1 1 7 1902 1 1 11 . O O -9.768 14.040 0.287 1.00 . A A . 11 SEP O 1 1 7 1903 1 1 11 . O1P O -8.542 8.932 2.662 1.00 . A A . 11 SEP O1P 1 1 7 1904 1 1 11 . O2P O -8.130 10.868 4.162 1.00 . A A . 11 SEP O2P 1 1 7 1905 1 1 11 . O3P O -10.485 10.142 3.702 1.00 . A A . 11 SEP O3P 1 1 7 1906 1 1 11 . OG O -9.101 11.294 1.854 1.00 . A A . 11 SEP OG 1 1 7 1907 1 1 11 . P P -9.085 10.282 3.117 1.00 . A A . 11 SEP P 1 1 7 1908 1 1 12 MET C C -8.123 16.272 -1.153 1.00 . A A . 12 MET C 1 1 7 1909 1 1 12 MET CA C -7.386 15.386 -0.153 1.00 . A A . 12 MET CA 1 1 7 1910 1 1 12 MET CB C -5.886 15.680 -0.202 1.00 . A A . 12 MET CB 1 1 7 1911 1 1 12 MET CE C -4.499 17.110 3.039 1.00 . A A . 12 MET CE 1 1 7 1912 1 1 12 MET CG C -5.146 15.278 1.063 1.00 . A A . 12 MET CG 1 1 7 1913 1 1 12 MET H H -6.914 13.428 -0.802 1.00 . A A . 12 MET H 1 1 7 1914 1 1 12 MET HA H -7.754 15.601 0.839 1.00 . A A . 12 MET HA 1 1 7 1915 1 1 12 MET HB2 H -5.453 15.143 -1.033 1.00 . A A . 12 MET HB2 1 1 7 1916 1 1 12 MET HB3 H -5.743 16.740 -0.355 1.00 . A A . 12 MET HB3 1 1 7 1917 1 1 12 MET HE1 H -5.563 16.927 3.086 1.00 . A A . 12 MET HE1 1 1 7 1918 1 1 12 MET HE2 H -4.014 16.630 3.876 1.00 . A A . 12 MET HE2 1 1 7 1919 1 1 12 MET HE3 H -4.314 18.174 3.077 1.00 . A A . 12 MET HE3 1 1 7 1920 1 1 12 MET HG2 H -5.855 15.223 1.877 1.00 . A A . 12 MET HG2 1 1 7 1921 1 1 12 MET HG3 H -4.701 14.306 0.910 1.00 . A A . 12 MET HG3 1 1 7 1922 1 1 12 MET N N -7.635 13.976 -0.427 1.00 . A A . 12 MET N 1 1 7 1923 1 1 12 MET O O -8.445 17.423 -0.858 1.00 . A A . 12 MET O 1 1 7 1924 1 1 12 MET SD S -3.847 16.446 1.509 1.00 . A A . 12 MET SD 1 1 7 1925 1 1 13 PHE C C -10.547 16.687 -3.009 1.00 . A A . 13 PHE C 1 1 7 1926 1 1 13 PHE CA C -9.083 16.471 -3.381 1.00 . A A . 13 PHE CA 1 1 7 1927 1 1 13 PHE CB C -8.989 15.727 -4.715 1.00 . A A . 13 PHE CB 1 1 7 1928 1 1 13 PHE CD1 C -6.818 16.829 -5.320 1.00 . A A . 13 PHE CD1 1 1 7 1929 1 1 13 PHE CD2 C -8.467 16.563 -7.022 1.00 . A A . 13 PHE CD2 1 1 7 1930 1 1 13 PHE CE1 C -5.973 17.436 -6.230 1.00 . A A . 13 PHE CE1 1 1 7 1931 1 1 13 PHE CE2 C -7.626 17.169 -7.936 1.00 . A A . 13 PHE CE2 1 1 7 1932 1 1 13 PHE CG C -8.073 16.386 -5.705 1.00 . A A . 13 PHE CG 1 1 7 1933 1 1 13 PHE CZ C -6.377 17.606 -7.540 1.00 . A A . 13 PHE CZ 1 1 7 1934 1 1 13 PHE H H -8.104 14.807 -2.513 1.00 . A A . 13 PHE H 1 1 7 1935 1 1 13 PHE HA H -8.604 17.432 -3.480 1.00 . A A . 13 PHE HA 1 1 7 1936 1 1 13 PHE HB2 H -8.621 14.728 -4.536 1.00 . A A . 13 PHE HB2 1 1 7 1937 1 1 13 PHE HB3 H -9.973 15.670 -5.157 1.00 . A A . 13 PHE HB3 1 1 7 1938 1 1 13 PHE HD1 H -6.500 16.696 -4.297 1.00 . A A . 13 PHE HD1 1 1 7 1939 1 1 13 PHE HD2 H -9.444 16.221 -7.334 1.00 . A A . 13 PHE HD2 1 1 7 1940 1 1 13 PHE HE1 H -4.997 17.776 -5.917 1.00 . A A . 13 PHE HE1 1 1 7 1941 1 1 13 PHE HE2 H -7.945 17.300 -8.960 1.00 . A A . 13 PHE HE2 1 1 7 1942 1 1 13 PHE HZ H -5.719 18.080 -8.252 1.00 . A A . 13 PHE HZ 1 1 7 1943 1 1 13 PHE N N -8.386 15.729 -2.337 1.00 . A A . 13 PHE N 1 1 7 1944 1 1 13 PHE O O -11.097 16.019 -2.133 1.00 . A A . 13 PHE O 1 1 7 1945 1 1 14 PRO C C -13.548 16.918 -4.010 1.00 . A A . 14 PRO C 1 1 7 1946 1 1 14 PRO CA C -12.603 17.974 -3.448 1.00 . A A . 14 PRO CA 1 1 7 1947 1 1 14 PRO CB C -12.788 19.304 -4.182 1.00 . A A . 14 PRO CB 1 1 7 1948 1 1 14 PRO CD C -10.602 18.482 -4.746 1.00 . A A . 14 PRO CD 1 1 7 1949 1 1 14 PRO CG C -11.752 19.292 -5.253 1.00 . A A . 14 PRO CG 1 1 7 1950 1 1 14 PRO HA H -12.804 18.111 -2.395 1.00 . A A . 14 PRO HA 1 1 7 1951 1 1 14 PRO HB2 H -13.785 19.353 -4.596 1.00 . A A . 14 PRO HB2 1 1 7 1952 1 1 14 PRO HB3 H -12.636 20.123 -3.495 1.00 . A A . 14 PRO HB3 1 1 7 1953 1 1 14 PRO HD2 H -10.204 17.872 -5.543 1.00 . A A . 14 PRO HD2 1 1 7 1954 1 1 14 PRO HD3 H -9.834 19.126 -4.342 1.00 . A A . 14 PRO HD3 1 1 7 1955 1 1 14 PRO HG2 H -12.153 18.838 -6.147 1.00 . A A . 14 PRO HG2 1 1 7 1956 1 1 14 PRO HG3 H -11.425 20.301 -5.457 1.00 . A A . 14 PRO HG3 1 1 7 1957 1 1 14 PRO N N -11.195 17.646 -3.689 1.00 . A A . 14 PRO N 1 1 7 1958 1 1 14 PRO O O -14.724 16.868 -3.649 1.00 . A A . 14 PRO O 1 1 7 1959 1 1 15 SER C C -14.177 13.941 -4.494 1.00 . A A . 15 SER C 1 1 7 1960 1 1 15 SER CA C -13.827 15.022 -5.512 1.00 . A A . 15 SER CA 1 1 7 1961 1 1 15 SER CB C -13.073 14.404 -6.691 1.00 . A A . 15 SER CB 1 1 7 1962 1 1 15 SER H H -12.083 16.166 -5.144 1.00 . A A . 15 SER H 1 1 7 1963 1 1 15 SER HA H -14.741 15.469 -5.874 1.00 . A A . 15 SER HA 1 1 7 1964 1 1 15 SER HB2 H -12.054 14.203 -6.398 1.00 . A A . 15 SER HB2 1 1 7 1965 1 1 15 SER HB3 H -13.554 13.480 -6.977 1.00 . A A . 15 SER HB3 1 1 7 1966 1 1 15 SER HG H -12.158 15.513 -8.021 1.00 . A A . 15 SER HG 1 1 7 1967 1 1 15 SER N N -13.027 16.075 -4.897 1.00 . A A . 15 SER N 1 1 7 1968 1 1 15 SER O O -15.188 13.251 -4.628 1.00 . A A . 15 SER O 1 1 7 1969 1 1 15 SER OG O -13.064 15.279 -7.806 1.00 . A A . 15 SER OG 1 1 7 1970 1 1 16 SER C C -14.635 13.255 -1.464 1.00 . A A . 16 SER C 1 1 7 1971 1 1 16 SER CA C -13.551 12.801 -2.437 1.00 . A A . 16 SER CA 1 1 7 1972 1 1 16 SER CB C -12.249 12.532 -1.678 1.00 . A A . 16 SER CB 1 1 7 1973 1 1 16 SER H H -12.545 14.380 -3.425 1.00 . A A . 16 SER H 1 1 7 1974 1 1 16 SER HA H -13.873 11.888 -2.916 1.00 . A A . 16 SER HA 1 1 7 1975 1 1 16 SER HB2 H -11.719 11.721 -2.154 1.00 . A A . 16 SER HB2 1 1 7 1976 1 1 16 SER HB3 H -11.636 13.421 -1.695 1.00 . A A . 16 SER HB3 1 1 7 1977 1 1 16 SER HG H -12.654 12.977 0.186 1.00 . A A . 16 SER HG 1 1 7 1978 1 1 16 SER N N -13.334 13.800 -3.476 1.00 . A A . 16 SER N 1 1 7 1979 1 1 16 SER O O -15.383 12.439 -0.927 1.00 . A A . 16 SER O 1 1 7 1980 1 1 16 SER OG O -12.508 12.181 -0.330 1.00 . A A . 16 SER OG 1 1 7 1981 1 1 17 GLU C C -17.031 15.360 -1.055 1.00 . A A . 17 GLU C 1 1 7 1982 1 1 17 GLU CA C -15.705 15.127 -0.336 1.00 . A A . 17 GLU CA 1 1 7 1983 1 1 17 GLU CB C -15.196 16.442 0.258 1.00 . A A . 17 GLU CB 1 1 7 1984 1 1 17 GLU CD C -15.820 16.165 2.690 1.00 . A A . 17 GLU CD 1 1 7 1985 1 1 17 GLU CG C -16.039 16.954 1.414 1.00 . A A . 17 GLU CG 1 1 7 1986 1 1 17 GLU H H -14.089 15.164 -1.702 1.00 . A A . 17 GLU H 1 1 7 1987 1 1 17 GLU HA H -15.862 14.419 0.464 1.00 . A A . 17 GLU HA 1 1 7 1988 1 1 17 GLU HB2 H -14.186 16.297 0.612 1.00 . A A . 17 GLU HB2 1 1 7 1989 1 1 17 GLU HB3 H -15.191 17.194 -0.517 1.00 . A A . 17 GLU HB3 1 1 7 1990 1 1 17 GLU HG2 H -15.784 17.986 1.600 1.00 . A A . 17 GLU HG2 1 1 7 1991 1 1 17 GLU HG3 H -17.082 16.886 1.141 1.00 . A A . 17 GLU HG3 1 1 7 1992 1 1 17 GLU N N -14.713 14.564 -1.244 1.00 . A A . 17 GLU N 1 1 7 1993 1 1 17 GLU O O -17.055 15.700 -2.237 1.00 . A A . 17 GLU O 1 1 7 1994 1 1 17 GLU OE1 O -16.471 15.111 2.855 1.00 . A A . 17 GLU OE1 1 1 7 1995 1 1 17 GLU OE2 O -14.999 16.600 3.524 1.00 . A A . 17 GLU OE2 1 1 8 1996 1 1 1 ARG C C 2.976 1.577 -1.364 1.00 . A A . 1 ARG C 1 1 8 1997 1 1 1 ARG CA C 3.233 0.112 -1.020 1.00 . A A . 1 ARG CA 1 1 8 1998 1 1 1 ARG CB C 1.916 -0.666 -1.043 1.00 . A A . 1 ARG CB 1 1 8 1999 1 1 1 ARG CD C 0.760 -2.284 -2.580 1.00 . A A . 1 ARG CD 1 1 8 2000 1 1 1 ARG CG C 1.370 -0.898 -2.443 1.00 . A A . 1 ARG CG 1 1 8 2001 1 1 1 ARG CZ C 1.757 -3.229 -4.619 1.00 . A A . 1 ARG CZ 1 1 8 2002 1 1 1 ARG H1 H 3.631 -0.764 0.865 1.00 . A A . 1 ARG H1 1 1 8 2003 1 1 1 ARG HA H 3.902 -0.306 -1.757 1.00 . A A . 1 ARG HA 1 1 8 2004 1 1 1 ARG HB2 H 2.072 -1.629 -0.578 1.00 . A A . 1 ARG HB2 1 1 8 2005 1 1 1 ARG HB3 H 1.178 -0.118 -0.479 1.00 . A A . 1 ARG HB3 1 1 8 2006 1 1 1 ARG HD2 H 0.570 -2.679 -1.594 1.00 . A A . 1 ARG HD2 1 1 8 2007 1 1 1 ARG HD3 H -0.172 -2.200 -3.120 1.00 . A A . 1 ARG HD3 1 1 8 2008 1 1 1 ARG HE H 2.174 -3.829 -2.763 1.00 . A A . 1 ARG HE 1 1 8 2009 1 1 1 ARG HG2 H 0.610 -0.160 -2.649 1.00 . A A . 1 ARG HG2 1 1 8 2010 1 1 1 ARG HG3 H 2.176 -0.796 -3.155 1.00 . A A . 1 ARG HG3 1 1 8 2011 1 1 1 ARG HH11 H 0.430 -1.739 -4.934 1.00 . A A . 1 ARG HH11 1 1 8 2012 1 1 1 ARG HH12 H 1.140 -2.414 -6.363 1.00 . A A . 1 ARG HH12 1 1 8 2013 1 1 1 ARG HH21 H 3.116 -4.725 -4.637 1.00 . A A . 1 ARG HH21 1 1 8 2014 1 1 1 ARG HH22 H 2.668 -4.113 -6.193 1.00 . A A . 1 ARG HH22 1 1 8 2015 1 1 1 ARG N N 3.871 -0.011 0.285 1.00 . A A . 1 ARG N 1 1 8 2016 1 1 1 ARG NE N 1.642 -3.202 -3.296 1.00 . A A . 1 ARG NE 1 1 8 2017 1 1 1 ARG NH1 N 1.051 -2.392 -5.367 1.00 . A A . 1 ARG NH1 1 1 8 2018 1 1 1 ARG NH2 N 2.582 -4.093 -5.197 1.00 . A A . 1 ARG NH2 1 1 8 2019 1 1 1 ARG O O 2.091 2.213 -0.792 1.00 . A A . 1 ARG O 1 1 8 2020 1 1 2 SER C C 2.395 3.673 -3.616 1.00 . A A . 2 SER C 1 1 8 2021 1 1 2 SER CA C 3.616 3.495 -2.719 1.00 . A A . 2 SER CA 1 1 8 2022 1 1 2 SER CB C 4.875 3.958 -3.455 1.00 . A A . 2 SER CB 1 1 8 2023 1 1 2 SER H H 4.444 1.546 -2.721 1.00 . A A . 2 SER H 1 1 8 2024 1 1 2 SER HA H 3.487 4.096 -1.831 1.00 . A A . 2 SER HA 1 1 8 2025 1 1 2 SER HB2 H 5.337 3.112 -3.941 1.00 . A A . 2 SER HB2 1 1 8 2026 1 1 2 SER HB3 H 4.605 4.695 -4.196 1.00 . A A . 2 SER HB3 1 1 8 2027 1 1 2 SER HG H 5.946 5.456 -2.786 1.00 . A A . 2 SER HG 1 1 8 2028 1 1 2 SER N N 3.756 2.105 -2.302 1.00 . A A . 2 SER N 1 1 8 2029 1 1 2 SER O O 1.809 4.754 -3.680 1.00 . A A . 2 SER O 1 1 8 2030 1 1 2 SER OG O 5.808 4.533 -2.557 1.00 . A A . 2 SER OG 1 1 8 2031 1 1 3 LYS C C -0.436 2.735 -4.408 1.00 . A A . 3 LYS C 1 1 8 2032 1 1 3 LYS CA C 0.864 2.638 -5.201 1.00 . A A . 3 LYS CA 1 1 8 2033 1 1 3 LYS CB C 0.842 1.391 -6.087 1.00 . A A . 3 LYS CB 1 1 8 2034 1 1 3 LYS CD C 2.228 1.852 -8.130 1.00 . A A . 3 LYS CD 1 1 8 2035 1 1 3 LYS CE C 2.350 1.227 -9.511 1.00 . A A . 3 LYS CE 1 1 8 2036 1 1 3 LYS CG C 0.822 1.701 -7.573 1.00 . A A . 3 LYS CG 1 1 8 2037 1 1 3 LYS H H 2.524 1.770 -4.214 1.00 . A A . 3 LYS H 1 1 8 2038 1 1 3 LYS HA H 0.956 3.513 -5.827 1.00 . A A . 3 LYS HA 1 1 8 2039 1 1 3 LYS HB2 H 1.720 0.798 -5.875 1.00 . A A . 3 LYS HB2 1 1 8 2040 1 1 3 LYS HB3 H -0.038 0.811 -5.849 1.00 . A A . 3 LYS HB3 1 1 8 2041 1 1 3 LYS HD2 H 2.466 2.903 -8.201 1.00 . A A . 3 LYS HD2 1 1 8 2042 1 1 3 LYS HD3 H 2.925 1.367 -7.462 1.00 . A A . 3 LYS HD3 1 1 8 2043 1 1 3 LYS HE2 H 1.560 1.611 -10.138 1.00 . A A . 3 LYS HE2 1 1 8 2044 1 1 3 LYS HE3 H 3.307 1.499 -9.932 1.00 . A A . 3 LYS HE3 1 1 8 2045 1 1 3 LYS HG2 H 0.325 0.895 -8.093 1.00 . A A . 3 LYS HG2 1 1 8 2046 1 1 3 LYS HG3 H 0.280 2.622 -7.732 1.00 . A A . 3 LYS HG3 1 1 8 2047 1 1 3 LYS HZ1 H 1.986 -0.565 -8.501 1.00 . A A . 3 LYS HZ1 1 1 8 2048 1 1 3 LYS HZ2 H 3.161 -0.688 -9.711 1.00 . A A . 3 LYS HZ2 1 1 8 2049 1 1 3 LYS HZ3 H 1.525 -0.590 -10.128 1.00 . A A . 3 LYS HZ3 1 1 8 2050 1 1 3 LYS N N 2.016 2.604 -4.307 1.00 . A A . 3 LYS N 1 1 8 2051 1 1 3 LYS NZ N 2.248 -0.258 -9.459 1.00 . A A . 3 LYS NZ 1 1 8 2052 1 1 3 LYS O O -1.425 3.290 -4.887 1.00 . A A . 3 LYS O 1 1 8 2053 1 1 4 ASP C C -1.844 3.626 -1.789 1.00 . A A . 4 ASP C 1 1 8 2054 1 1 4 ASP CA C -1.603 2.222 -2.336 1.00 . A A . 4 ASP CA 1 1 8 2055 1 1 4 ASP CB C -1.442 1.232 -1.181 1.00 . A A . 4 ASP CB 1 1 8 2056 1 1 4 ASP CG C -2.397 0.060 -1.286 1.00 . A A . 4 ASP CG 1 1 8 2057 1 1 4 ASP H H 0.394 1.766 -2.870 1.00 . A A . 4 ASP H 1 1 8 2058 1 1 4 ASP HA H -2.455 1.930 -2.931 1.00 . A A . 4 ASP HA 1 1 8 2059 1 1 4 ASP HB2 H -0.431 0.850 -1.182 1.00 . A A . 4 ASP HB2 1 1 8 2060 1 1 4 ASP HB3 H -1.628 1.743 -0.248 1.00 . A A . 4 ASP HB3 1 1 8 2061 1 1 4 ASP N N -0.426 2.194 -3.195 1.00 . A A . 4 ASP N 1 1 8 2062 1 1 4 ASP O O -2.986 4.028 -1.563 1.00 . A A . 4 ASP O 1 1 8 2063 1 1 4 ASP OD1 O -2.435 -0.582 -2.357 1.00 . A A . 4 ASP OD1 1 1 8 2064 1 1 4 ASP OD2 O -3.107 -0.217 -0.296 1.00 . A A . 4 ASP OD2 1 1 8 2065 1 1 5 LEU C C -1.336 6.691 -2.134 1.00 . A A . 5 LEU C 1 1 8 2066 1 1 5 LEU CA C -0.854 5.725 -1.056 1.00 . A A . 5 LEU CA 1 1 8 2067 1 1 5 LEU CB C 0.504 6.180 -0.518 1.00 . A A . 5 LEU CB 1 1 8 2068 1 1 5 LEU CD1 C 1.427 7.690 1.256 1.00 . A A . 5 LEU CD1 1 1 8 2069 1 1 5 LEU CD2 C 1.123 8.544 -1.075 1.00 . A A . 5 LEU CD2 1 1 8 2070 1 1 5 LEU CG C 0.574 7.617 -0.001 1.00 . A A . 5 LEU CG 1 1 8 2071 1 1 5 LEU H H 0.122 3.991 -1.777 1.00 . A A . 5 LEU H 1 1 8 2072 1 1 5 LEU HA H -1.569 5.721 -0.247 1.00 . A A . 5 LEU HA 1 1 8 2073 1 1 5 LEU HB2 H 0.775 5.522 0.294 1.00 . A A . 5 LEU HB2 1 1 8 2074 1 1 5 LEU HB3 H 1.226 6.079 -1.317 1.00 . A A . 5 LEU HB3 1 1 8 2075 1 1 5 LEU HD11 H 2.000 8.605 1.250 1.00 . A A . 5 LEU HD11 1 1 8 2076 1 1 5 LEU HD12 H 2.099 6.845 1.286 1.00 . A A . 5 LEU HD12 1 1 8 2077 1 1 5 LEU HD13 H 0.788 7.671 2.127 1.00 . A A . 5 LEU HD13 1 1 8 2078 1 1 5 LEU HD21 H 2.188 8.392 -1.172 1.00 . A A . 5 LEU HD21 1 1 8 2079 1 1 5 LEU HD22 H 0.930 9.570 -0.797 1.00 . A A . 5 LEU HD22 1 1 8 2080 1 1 5 LEU HD23 H 0.640 8.330 -2.017 1.00 . A A . 5 LEU HD23 1 1 8 2081 1 1 5 LEU HG H -0.422 7.950 0.253 1.00 . A A . 5 LEU HG 1 1 8 2082 1 1 5 LEU N N -0.761 4.366 -1.577 1.00 . A A . 5 LEU N 1 1 8 2083 1 1 5 LEU O O -1.952 7.713 -1.834 1.00 . A A . 5 LEU O 1 1 8 2084 1 1 6 ARG C C -2.967 7.422 -4.502 1.00 . A A . 6 ARG C 1 1 8 2085 1 1 6 ARG CA C -1.459 7.194 -4.512 1.00 . A A . 6 ARG CA 1 1 8 2086 1 1 6 ARG CB C -1.037 6.550 -5.834 1.00 . A A . 6 ARG CB 1 1 8 2087 1 1 6 ARG CD C 0.870 7.796 -6.895 1.00 . A A . 6 ARG CD 1 1 8 2088 1 1 6 ARG CG C 0.463 6.581 -6.076 1.00 . A A . 6 ARG CG 1 1 8 2089 1 1 6 ARG CZ C 1.766 8.273 -9.134 1.00 . A A . 6 ARG CZ 1 1 8 2090 1 1 6 ARG H H -0.559 5.529 -3.564 1.00 . A A . 6 ARG H 1 1 8 2091 1 1 6 ARG HA H -0.962 8.147 -4.411 1.00 . A A . 6 ARG HA 1 1 8 2092 1 1 6 ARG HB2 H -1.358 5.519 -5.837 1.00 . A A . 6 ARG HB2 1 1 8 2093 1 1 6 ARG HB3 H -1.522 7.072 -6.645 1.00 . A A . 6 ARG HB3 1 1 8 2094 1 1 6 ARG HD2 H 0.058 8.509 -6.885 1.00 . A A . 6 ARG HD2 1 1 8 2095 1 1 6 ARG HD3 H 1.744 8.241 -6.445 1.00 . A A . 6 ARG HD3 1 1 8 2096 1 1 6 ARG HE H 0.925 6.549 -8.586 1.00 . A A . 6 ARG HE 1 1 8 2097 1 1 6 ARG HG2 H 0.971 6.617 -5.124 1.00 . A A . 6 ARG HG2 1 1 8 2098 1 1 6 ARG HG3 H 0.751 5.687 -6.607 1.00 . A A . 6 ARG HG3 1 1 8 2099 1 1 6 ARG HH11 H 1.933 9.790 -7.810 1.00 . A A . 6 ARG HH11 1 1 8 2100 1 1 6 ARG HH12 H 2.561 10.113 -9.392 1.00 . A A . 6 ARG HH12 1 1 8 2101 1 1 6 ARG HH21 H 1.749 6.963 -10.673 1.00 . A A . 6 ARG HH21 1 1 8 2102 1 1 6 ARG HH22 H 2.455 8.505 -11.020 1.00 . A A . 6 ARG HH22 1 1 8 2103 1 1 6 ARG N N -1.053 6.357 -3.389 1.00 . A A . 6 ARG N 1 1 8 2104 1 1 6 ARG NE N 1.175 7.446 -8.280 1.00 . A A . 6 ARG NE 1 1 8 2105 1 1 6 ARG NH1 N 2.115 9.493 -8.747 1.00 . A A . 6 ARG NH1 1 1 8 2106 1 1 6 ARG NH2 N 2.010 7.881 -10.378 1.00 . A A . 6 ARG NH2 1 1 8 2107 1 1 6 ARG O O -3.450 8.472 -4.928 1.00 . A A . 6 ARG O 1 1 8 2108 1 1 7 HIS C C -5.598 7.433 -2.806 1.00 . A A . 7 HIS C 1 1 8 2109 1 1 7 HIS CA C -5.162 6.524 -3.950 1.00 . A A . 7 HIS CA 1 1 8 2110 1 1 7 HIS CB C -5.775 5.134 -3.776 1.00 . A A . 7 HIS CB 1 1 8 2111 1 1 7 HIS CD2 C -8.366 5.214 -3.868 1.00 . A A . 7 HIS CD2 1 1 8 2112 1 1 7 HIS CE1 C -8.633 4.569 -5.946 1.00 . A A . 7 HIS CE1 1 1 8 2113 1 1 7 HIS CG C -7.135 4.998 -4.388 1.00 . A A . 7 HIS CG 1 1 8 2114 1 1 7 HIS H H -3.265 5.619 -3.691 1.00 . A A . 7 HIS H 1 1 8 2115 1 1 7 HIS HA H -5.509 6.946 -4.881 1.00 . A A . 7 HIS HA 1 1 8 2116 1 1 7 HIS HB2 H -5.129 4.402 -4.238 1.00 . A A . 7 HIS HB2 1 1 8 2117 1 1 7 HIS HB3 H -5.862 4.916 -2.721 1.00 . A A . 7 HIS HB3 1 1 8 2118 1 1 7 HIS HD1 H -6.635 4.362 -6.333 1.00 . A A . 7 HIS HD1 1 1 8 2119 1 1 7 HIS HD2 H -8.589 5.542 -2.862 1.00 . A A . 7 HIS HD2 1 1 8 2120 1 1 7 HIS HE1 H -9.087 4.291 -6.885 1.00 . A A . 7 HIS HE1 1 1 8 2121 1 1 7 HIS N N -3.707 6.431 -4.015 1.00 . A A . 7 HIS N 1 1 8 2122 1 1 7 HIS ND1 N -7.337 4.594 -5.691 1.00 . A A . 7 HIS ND1 1 1 8 2123 1 1 7 HIS NE2 N -9.279 4.941 -4.856 1.00 . A A . 7 HIS NE2 1 1 8 2124 1 1 7 HIS O O -6.727 7.922 -2.784 1.00 . A A . 7 HIS O 1 1 8 2125 1 1 8 ALA C C -4.957 9.980 -1.097 1.00 . A A . 8 ALA C 1 1 8 2126 1 1 8 ALA CA C -4.987 8.506 -0.709 1.00 . A A . 8 ALA CA 1 1 8 2127 1 1 8 ALA CB C -3.997 8.234 0.415 1.00 . A A . 8 ALA CB 1 1 8 2128 1 1 8 ALA H H -3.812 7.237 -1.929 1.00 . A A . 8 ALA H 1 1 8 2129 1 1 8 ALA HA H -5.976 8.258 -0.352 1.00 . A A . 8 ALA HA 1 1 8 2130 1 1 8 ALA HB1 H -3.119 8.848 0.277 1.00 . A A . 8 ALA HB1 1 1 8 2131 1 1 8 ALA HB2 H -4.456 8.470 1.363 1.00 . A A . 8 ALA HB2 1 1 8 2132 1 1 8 ALA HB3 H -3.714 7.192 0.401 1.00 . A A . 8 ALA HB3 1 1 8 2133 1 1 8 ALA N N -4.695 7.655 -1.855 1.00 . A A . 8 ALA N 1 1 8 2134 1 1 8 ALA O O -5.563 10.820 -0.432 1.00 . A A . 8 ALA O 1 1 8 2135 1 1 9 PHE C C -5.492 12.187 -3.119 1.00 . A A . 9 PHE C 1 1 8 2136 1 1 9 PHE CA C -4.137 11.662 -2.654 1.00 . A A . 9 PHE CA 1 1 8 2137 1 1 9 PHE CB C -3.124 11.748 -3.797 1.00 . A A . 9 PHE CB 1 1 8 2138 1 1 9 PHE CD1 C -2.457 14.103 -3.245 1.00 . A A . 9 PHE CD1 1 1 8 2139 1 1 9 PHE CD2 C -0.741 12.533 -3.769 1.00 . A A . 9 PHE CD2 1 1 8 2140 1 1 9 PHE CE1 C -1.505 15.088 -3.064 1.00 . A A . 9 PHE CE1 1 1 8 2141 1 1 9 PHE CE2 C 0.216 13.513 -3.588 1.00 . A A . 9 PHE CE2 1 1 8 2142 1 1 9 PHE CG C -2.087 12.816 -3.600 1.00 . A A . 9 PHE CG 1 1 8 2143 1 1 9 PHE CZ C -0.166 14.792 -3.234 1.00 . A A . 9 PHE CZ 1 1 8 2144 1 1 9 PHE H H -3.786 9.574 -2.666 1.00 . A A . 9 PHE H 1 1 8 2145 1 1 9 PHE HA H -3.792 12.270 -1.832 1.00 . A A . 9 PHE HA 1 1 8 2146 1 1 9 PHE HB2 H -2.613 10.802 -3.888 1.00 . A A . 9 PHE HB2 1 1 8 2147 1 1 9 PHE HB3 H -3.648 11.958 -4.717 1.00 . A A . 9 PHE HB3 1 1 8 2148 1 1 9 PHE HD1 H -3.503 14.336 -3.110 1.00 . A A . 9 PHE HD1 1 1 8 2149 1 1 9 PHE HD2 H -0.441 11.532 -4.046 1.00 . A A . 9 PHE HD2 1 1 8 2150 1 1 9 PHE HE1 H -1.806 16.087 -2.787 1.00 . A A . 9 PHE HE1 1 1 8 2151 1 1 9 PHE HE2 H 1.262 13.278 -3.722 1.00 . A A . 9 PHE HE2 1 1 8 2152 1 1 9 PHE HZ H 0.580 15.560 -3.093 1.00 . A A . 9 PHE HZ 1 1 8 2153 1 1 9 PHE N N -4.247 10.288 -2.178 1.00 . A A . 9 PHE N 1 1 8 2154 1 1 9 PHE O O -5.745 13.391 -3.097 1.00 . A A . 9 PHE O 1 1 8 2155 1 1 10 ARG C C -8.571 12.100 -2.855 1.00 . A A . 10 ARG C 1 1 8 2156 1 1 10 ARG CA C -7.689 11.643 -4.014 1.00 . A A . 10 ARG CA 1 1 8 2157 1 1 10 ARG CB C -8.345 10.462 -4.732 1.00 . A A . 10 ARG CB 1 1 8 2158 1 1 10 ARG CD C -9.570 9.627 -6.762 1.00 . A A . 10 ARG CD 1 1 8 2159 1 1 10 ARG CG C -9.049 10.849 -6.023 1.00 . A A . 10 ARG CG 1 1 8 2160 1 1 10 ARG CZ C -11.292 9.067 -8.424 1.00 . A A . 10 ARG CZ 1 1 8 2161 1 1 10 ARG H H -6.101 10.328 -3.536 1.00 . A A . 10 ARG H 1 1 8 2162 1 1 10 ARG HA H -7.578 12.460 -4.711 1.00 . A A . 10 ARG HA 1 1 8 2163 1 1 10 ARG HB2 H -7.585 9.732 -4.968 1.00 . A A . 10 ARG HB2 1 1 8 2164 1 1 10 ARG HB3 H -9.072 10.013 -4.072 1.00 . A A . 10 ARG HB3 1 1 8 2165 1 1 10 ARG HD2 H -8.770 9.218 -7.362 1.00 . A A . 10 ARG HD2 1 1 8 2166 1 1 10 ARG HD3 H -9.886 8.892 -6.037 1.00 . A A . 10 ARG HD3 1 1 8 2167 1 1 10 ARG HE H -11.025 10.874 -7.623 1.00 . A A . 10 ARG HE 1 1 8 2168 1 1 10 ARG HG2 H -9.882 11.496 -5.788 1.00 . A A . 10 ARG HG2 1 1 8 2169 1 1 10 ARG HG3 H -8.352 11.374 -6.659 1.00 . A A . 10 ARG HG3 1 1 8 2170 1 1 10 ARG HH11 H -10.102 7.528 -7.883 1.00 . A A . 10 ARG HH11 1 1 8 2171 1 1 10 ARG HH12 H -11.321 7.147 -9.054 1.00 . A A . 10 ARG HH12 1 1 8 2172 1 1 10 ARG HH21 H -12.634 10.385 -9.165 1.00 . A A . 10 ARG HH21 1 1 8 2173 1 1 10 ARG HH22 H -12.760 8.773 -9.783 1.00 . A A . 10 ARG HH22 1 1 8 2174 1 1 10 ARG N N -6.361 11.273 -3.541 1.00 . A A . 10 ARG N 1 1 8 2175 1 1 10 ARG NE N -10.697 9.951 -7.631 1.00 . A A . 10 ARG NE 1 1 8 2176 1 1 10 ARG NH1 N -10.870 7.811 -8.457 1.00 . A A . 10 ARG NH1 1 1 8 2177 1 1 10 ARG NH2 N -12.313 9.439 -9.187 1.00 . A A . 10 ARG NH2 1 1 8 2178 1 1 10 ARG O O -9.490 12.888 -3.073 1.00 . A A . 10 ARG O 1 1 8 2179 1 1 11 . C C -8.908 13.449 -0.184 1.00 . A A . 11 SEP C 1 1 8 2180 1 1 11 . CA C -9.069 11.976 -0.456 1.00 . A A . 11 SEP CA 1 1 8 2181 1 1 11 . CB C -8.707 11.040 0.736 1.00 . A A . 11 SEP CB 1 1 8 2182 1 1 11 . H H -7.507 10.957 -1.551 1.00 . A A . 11 SEP H 1 1 8 2183 1 1 11 . HA H -10.130 11.800 -0.712 1.00 . A A . 11 SEP HA 1 1 8 2184 1 1 11 . HB2 H -8.600 9.985 0.424 1.00 . A A . 11 SEP HB2 1 1 8 2185 1 1 11 . HB3 H -7.720 11.291 1.175 1.00 . A A . 11 SEP HB3 1 1 8 2186 1 1 11 . N N -8.276 11.601 -1.664 1.00 . A A . 11 SEP N 1 1 8 2187 1 1 11 . O O -9.834 14.151 0.222 1.00 . A A . 11 SEP O 1 1 8 2188 1 1 11 . O1P O -11.494 10.177 3.362 1.00 . A A . 11 SEP O1P 1 1 8 2189 1 1 11 . O2P O -10.903 8.902 1.315 1.00 . A A . 11 SEP O2P 1 1 8 2190 1 1 11 . O3P O -9.271 9.012 3.215 1.00 . A A . 11 SEP O3P 1 1 8 2191 1 1 11 . OG O -9.717 11.102 1.769 1.00 . A A . 11 SEP OG 1 1 8 2192 1 1 11 . P P -10.345 9.772 2.446 1.00 . A A . 11 SEP P 1 1 8 2193 1 1 12 MET C C -8.060 16.209 -1.240 1.00 . A A . 12 MET C 1 1 8 2194 1 1 12 MET CA C -7.363 15.329 -0.208 1.00 . A A . 12 MET CA 1 1 8 2195 1 1 12 MET CB C -5.849 15.540 -0.280 1.00 . A A . 12 MET CB 1 1 8 2196 1 1 12 MET CE C -3.745 15.182 3.274 1.00 . A A . 12 MET CE 1 1 8 2197 1 1 12 MET CG C -5.225 15.925 1.052 1.00 . A A . 12 MET CG 1 1 8 2198 1 1 12 MET H H -6.992 13.315 -0.741 1.00 . A A . 12 MET H 1 1 8 2199 1 1 12 MET HA H -7.709 15.606 0.777 1.00 . A A . 12 MET HA 1 1 8 2200 1 1 12 MET HB2 H -5.386 14.626 -0.619 1.00 . A A . 12 MET HB2 1 1 8 2201 1 1 12 MET HB3 H -5.640 16.326 -0.990 1.00 . A A . 12 MET HB3 1 1 8 2202 1 1 12 MET HE1 H -2.871 15.517 2.734 1.00 . A A . 12 MET HE1 1 1 8 2203 1 1 12 MET HE2 H -4.187 16.017 3.796 1.00 . A A . 12 MET HE2 1 1 8 2204 1 1 12 MET HE3 H -3.459 14.422 3.986 1.00 . A A . 12 MET HE3 1 1 8 2205 1 1 12 MET HG2 H -4.281 16.415 0.864 1.00 . A A . 12 MET HG2 1 1 8 2206 1 1 12 MET HG3 H -5.889 16.609 1.560 1.00 . A A . 12 MET HG3 1 1 8 2207 1 1 12 MET N N -7.689 13.923 -0.418 1.00 . A A . 12 MET N 1 1 8 2208 1 1 12 MET O O -8.318 17.388 -0.993 1.00 . A A . 12 MET O 1 1 8 2209 1 1 12 MET SD S -4.933 14.501 2.119 1.00 . A A . 12 MET SD 1 1 8 2210 1 1 13 PHE C C -10.476 16.674 -3.094 1.00 . A A . 13 PHE C 1 1 8 2211 1 1 13 PHE CA C -9.030 16.363 -3.467 1.00 . A A . 13 PHE CA 1 1 8 2212 1 1 13 PHE CB C -8.988 15.558 -4.768 1.00 . A A . 13 PHE CB 1 1 8 2213 1 1 13 PHE CD1 C -6.639 16.255 -5.312 1.00 . A A . 13 PHE CD1 1 1 8 2214 1 1 13 PHE CD2 C -8.257 16.260 -7.064 1.00 . A A . 13 PHE CD2 1 1 8 2215 1 1 13 PHE CE1 C -5.674 16.694 -6.198 1.00 . A A . 13 PHE CE1 1 1 8 2216 1 1 13 PHE CE2 C -7.296 16.698 -7.955 1.00 . A A . 13 PHE CE2 1 1 8 2217 1 1 13 PHE CG C -7.940 16.034 -5.734 1.00 . A A . 13 PHE CG 1 1 8 2218 1 1 13 PHE CZ C -6.002 16.914 -7.522 1.00 . A A . 13 PHE CZ 1 1 8 2219 1 1 13 PHE H H -8.132 14.688 -2.534 1.00 . A A . 13 PHE H 1 1 8 2220 1 1 13 PHE HA H -8.500 17.292 -3.611 1.00 . A A . 13 PHE HA 1 1 8 2221 1 1 13 PHE HB2 H -8.780 14.525 -4.537 1.00 . A A . 13 PHE HB2 1 1 8 2222 1 1 13 PHE HB3 H -9.948 15.628 -5.256 1.00 . A A . 13 PHE HB3 1 1 8 2223 1 1 13 PHE HD1 H -6.381 16.082 -4.277 1.00 . A A . 13 PHE HD1 1 1 8 2224 1 1 13 PHE HD2 H -9.269 16.090 -7.404 1.00 . A A . 13 PHE HD2 1 1 8 2225 1 1 13 PHE HE1 H -4.663 16.862 -5.857 1.00 . A A . 13 PHE HE1 1 1 8 2226 1 1 13 PHE HE2 H -7.556 16.869 -8.989 1.00 . A A . 13 PHE HE2 1 1 8 2227 1 1 13 PHE HZ H -5.250 17.257 -8.216 1.00 . A A . 13 PHE HZ 1 1 8 2228 1 1 13 PHE N N -8.363 15.630 -2.397 1.00 . A A . 13 PHE N 1 1 8 2229 1 1 13 PHE O O -11.053 16.074 -2.187 1.00 . A A . 13 PHE O 1 1 8 2230 1 1 14 PRO C C -13.470 17.019 -4.080 1.00 . A A . 14 PRO C 1 1 8 2231 1 1 14 PRO CA C -12.464 18.048 -3.574 1.00 . A A . 14 PRO CA 1 1 8 2232 1 1 14 PRO CB C -12.587 19.351 -4.368 1.00 . A A . 14 PRO CB 1 1 8 2233 1 1 14 PRO CD C -10.451 18.392 -4.907 1.00 . A A . 14 PRO CD 1 1 8 2234 1 1 14 PRO CG C -11.567 19.233 -5.448 1.00 . A A . 14 PRO CG 1 1 8 2235 1 1 14 PRO HA H -12.647 18.244 -2.528 1.00 . A A . 14 PRO HA 1 1 8 2236 1 1 14 PRO HB2 H -13.585 19.436 -4.774 1.00 . A A . 14 PRO HB2 1 1 8 2237 1 1 14 PRO HB3 H -12.382 20.191 -3.722 1.00 . A A . 14 PRO HB3 1 1 8 2238 1 1 14 PRO HD2 H -10.093 17.728 -5.680 1.00 . A A . 14 PRO HD2 1 1 8 2239 1 1 14 PRO HD3 H -9.647 19.011 -4.537 1.00 . A A . 14 PRO HD3 1 1 8 2240 1 1 14 PRO HG2 H -12.002 18.757 -6.313 1.00 . A A . 14 PRO HG2 1 1 8 2241 1 1 14 PRO HG3 H -11.192 20.213 -5.707 1.00 . A A . 14 PRO HG3 1 1 8 2242 1 1 14 PRO N N -11.078 17.635 -3.811 1.00 . A A . 14 PRO N 1 1 8 2243 1 1 14 PRO O O -14.644 17.051 -3.710 1.00 . A A . 14 PRO O 1 1 8 2244 1 1 15 SER C C -14.262 14.061 -4.417 1.00 . A A . 15 SER C 1 1 8 2245 1 1 15 SER CA C -13.862 15.072 -5.487 1.00 . A A . 15 SER CA 1 1 8 2246 1 1 15 SER CB C -13.153 14.358 -6.639 1.00 . A A . 15 SER CB 1 1 8 2247 1 1 15 SER H H -12.057 16.136 -5.185 1.00 . A A . 15 SER H 1 1 8 2248 1 1 15 SER HA H -14.754 15.550 -5.866 1.00 . A A . 15 SER HA 1 1 8 2249 1 1 15 SER HB2 H -12.169 14.052 -6.318 1.00 . A A . 15 SER HB2 1 1 8 2250 1 1 15 SER HB3 H -13.725 13.488 -6.927 1.00 . A A . 15 SER HB3 1 1 8 2251 1 1 15 SER HG H -12.850 16.107 -7.468 1.00 . A A . 15 SER HG 1 1 8 2252 1 1 15 SER N N -13.002 16.109 -4.928 1.00 . A A . 15 SER N 1 1 8 2253 1 1 15 SER O O -15.309 13.421 -4.511 1.00 . A A . 15 SER O 1 1 8 2254 1 1 15 SER OG O -13.021 15.210 -7.764 1.00 . A A . 15 SER OG 1 1 8 2255 1 1 16 SER C C -14.811 13.494 -1.419 1.00 . A A . 16 SER C 1 1 8 2256 1 1 16 SER CA C -13.681 12.988 -2.310 1.00 . A A . 16 SER CA 1 1 8 2257 1 1 16 SER CB C -12.416 12.775 -1.477 1.00 . A A . 16 SER CB 1 1 8 2258 1 1 16 SER H H -12.600 14.462 -3.379 1.00 . A A . 16 SER H 1 1 8 2259 1 1 16 SER HA H -13.977 12.046 -2.747 1.00 . A A . 16 SER HA 1 1 8 2260 1 1 16 SER HB2 H -12.345 11.736 -1.194 1.00 . A A . 16 SER HB2 1 1 8 2261 1 1 16 SER HB3 H -11.551 13.048 -2.064 1.00 . A A . 16 SER HB3 1 1 8 2262 1 1 16 SER HG H -12.282 14.487 -0.533 1.00 . A A . 16 SER HG 1 1 8 2263 1 1 16 SER N N -13.419 13.924 -3.398 1.00 . A A . 16 SER N 1 1 8 2264 1 1 16 SER O O -15.569 12.707 -0.853 1.00 . A A . 16 SER O 1 1 8 2265 1 1 16 SER OG O -12.439 13.568 -0.302 1.00 . A A . 16 SER OG 1 1 8 2266 1 1 17 GLU C C -17.264 15.544 -1.252 1.00 . A A . 17 GLU C 1 1 8 2267 1 1 17 GLU CA C -15.955 15.425 -0.478 1.00 . A A . 17 GLU CA 1 1 8 2268 1 1 17 GLU CB C -15.507 16.807 0.003 1.00 . A A . 17 GLU CB 1 1 8 2269 1 1 17 GLU CD C -14.791 18.231 1.963 1.00 . A A . 17 GLU CD 1 1 8 2270 1 1 17 GLU CG C -15.427 16.929 1.516 1.00 . A A . 17 GLU CG 1 1 8 2271 1 1 17 GLU H H -14.283 15.390 -1.776 1.00 . A A . 17 GLU H 1 1 8 2272 1 1 17 GLU HA H -16.114 14.790 0.381 1.00 . A A . 17 GLU HA 1 1 8 2273 1 1 17 GLU HB2 H -14.530 17.019 -0.407 1.00 . A A . 17 GLU HB2 1 1 8 2274 1 1 17 GLU HB3 H -16.207 17.545 -0.360 1.00 . A A . 17 GLU HB3 1 1 8 2275 1 1 17 GLU HG2 H -16.427 16.877 1.921 1.00 . A A . 17 GLU HG2 1 1 8 2276 1 1 17 GLU HG3 H -14.841 16.108 1.900 1.00 . A A . 17 GLU HG3 1 1 8 2277 1 1 17 GLU N N -14.917 14.814 -1.300 1.00 . A A . 17 GLU N 1 1 8 2278 1 1 17 GLU O O -17.837 14.542 -1.678 1.00 . A A . 17 GLU O 1 1 8 2279 1 1 17 GLU OE1 O -14.964 19.249 1.262 1.00 . A A . 17 GLU OE1 1 1 8 2280 1 1 17 GLU OE2 O -14.119 18.230 3.016 1.00 . A A . 17 GLU OE2 1 1 9 2281 1 1 1 ARG C C 2.989 2.302 -0.927 1.00 . A A . 1 ARG C 1 1 9 2282 1 1 1 ARG CA C 2.911 0.904 -0.321 1.00 . A A . 1 ARG CA 1 1 9 2283 1 1 1 ARG CB C 2.006 0.015 -1.176 1.00 . A A . 1 ARG CB 1 1 9 2284 1 1 1 ARG CD C 2.962 -0.901 -3.313 1.00 . A A . 1 ARG CD 1 1 9 2285 1 1 1 ARG CG C 2.736 -1.148 -1.829 1.00 . A A . 1 ARG CG 1 1 9 2286 1 1 1 ARG CZ C 2.971 -3.164 -4.273 1.00 . A A . 1 ARG CZ 1 1 9 2287 1 1 1 ARG H1 H 2.087 1.811 1.405 1.00 . A A . 1 ARG H1 1 1 9 2288 1 1 1 ARG HA H 3.903 0.478 -0.299 1.00 . A A . 1 ARG HA 1 1 9 2289 1 1 1 ARG HB2 H 1.221 -0.386 -0.552 1.00 . A A . 1 ARG HB2 1 1 9 2290 1 1 1 ARG HB3 H 1.563 0.617 -1.955 1.00 . A A . 1 ARG HB3 1 1 9 2291 1 1 1 ARG HD2 H 2.007 -0.721 -3.784 1.00 . A A . 1 ARG HD2 1 1 9 2292 1 1 1 ARG HD3 H 3.589 -0.030 -3.427 1.00 . A A . 1 ARG HD3 1 1 9 2293 1 1 1 ARG HE H 4.557 -1.958 -4.182 1.00 . A A . 1 ARG HE 1 1 9 2294 1 1 1 ARG HG2 H 3.694 -1.276 -1.347 1.00 . A A . 1 ARG HG2 1 1 9 2295 1 1 1 ARG HG3 H 2.146 -2.044 -1.708 1.00 . A A . 1 ARG HG3 1 1 9 2296 1 1 1 ARG HH11 H 1.187 -2.557 -3.545 1.00 . A A . 1 ARG HH11 1 1 9 2297 1 1 1 ARG HH12 H 1.207 -4.150 -4.226 1.00 . A A . 1 ARG HH12 1 1 9 2298 1 1 1 ARG HH21 H 4.596 -4.054 -5.081 1.00 . A A . 1 ARG HH21 1 1 9 2299 1 1 1 ARG HH22 H 3.147 -5.001 -5.098 1.00 . A A . 1 ARG HH22 1 1 9 2300 1 1 1 ARG N N 2.417 0.959 1.050 1.00 . A A . 1 ARG N 1 1 9 2301 1 1 1 ARG NE N 3.605 -2.038 -3.965 1.00 . A A . 1 ARG NE 1 1 9 2302 1 1 1 ARG NH1 N 1.683 -3.302 -3.991 1.00 . A A . 1 ARG NH1 1 1 9 2303 1 1 1 ARG NH2 N 3.625 -4.154 -4.866 1.00 . A A . 1 ARG NH2 1 1 9 2304 1 1 1 ARG O O 2.412 3.252 -0.398 1.00 . A A . 1 ARG O 1 1 9 2305 1 1 2 SER C C 2.714 3.949 -3.687 1.00 . A A . 2 SER C 1 1 9 2306 1 1 2 SER CA C 3.864 3.702 -2.716 1.00 . A A . 2 SER CA 1 1 9 2307 1 1 2 SER CB C 5.197 3.747 -3.465 1.00 . A A . 2 SER CB 1 1 9 2308 1 1 2 SER H H 4.143 1.625 -2.413 1.00 . A A . 2 SER H 1 1 9 2309 1 1 2 SER HA H 3.858 4.476 -1.964 1.00 . A A . 2 SER HA 1 1 9 2310 1 1 2 SER HB2 H 5.867 3.011 -3.047 1.00 . A A . 2 SER HB2 1 1 9 2311 1 1 2 SER HB3 H 5.028 3.527 -4.510 1.00 . A A . 2 SER HB3 1 1 9 2312 1 1 2 SER HG H 5.122 5.704 -3.412 1.00 . A A . 2 SER HG 1 1 9 2313 1 1 2 SER N N 3.707 2.419 -2.040 1.00 . A A . 2 SER N 1 1 9 2314 1 1 2 SER O O 2.339 5.092 -3.947 1.00 . A A . 2 SER O 1 1 9 2315 1 1 2 SER OG O 5.799 5.025 -3.359 1.00 . A A . 2 SER OG 1 1 9 2316 1 1 3 LYS C C -0.287 3.034 -4.428 1.00 . A A . 3 LYS C 1 1 9 2317 1 1 3 LYS CA C 1.048 2.963 -5.164 1.00 . A A . 3 LYS CA 1 1 9 2318 1 1 3 LYS CB C 1.054 1.765 -6.115 1.00 . A A . 3 LYS CB 1 1 9 2319 1 1 3 LYS CD C 1.424 1.042 -8.492 1.00 . A A . 3 LYS CD 1 1 9 2320 1 1 3 LYS CE C 2.006 1.447 -9.838 1.00 . A A . 3 LYS CE 1 1 9 2321 1 1 3 LYS CG C 1.837 2.008 -7.394 1.00 . A A . 3 LYS CG 1 1 9 2322 1 1 3 LYS H H 2.500 1.982 -3.976 1.00 . A A . 3 LYS H 1 1 9 2323 1 1 3 LYS HA H 1.177 3.868 -5.737 1.00 . A A . 3 LYS HA 1 1 9 2324 1 1 3 LYS HB2 H 1.491 0.918 -5.606 1.00 . A A . 3 LYS HB2 1 1 9 2325 1 1 3 LYS HB3 H 0.035 1.526 -6.382 1.00 . A A . 3 LYS HB3 1 1 9 2326 1 1 3 LYS HD2 H 1.779 0.053 -8.243 1.00 . A A . 3 LYS HD2 1 1 9 2327 1 1 3 LYS HD3 H 0.346 1.032 -8.564 1.00 . A A . 3 LYS HD3 1 1 9 2328 1 1 3 LYS HE2 H 1.438 2.279 -10.225 1.00 . A A . 3 LYS HE2 1 1 9 2329 1 1 3 LYS HE3 H 3.034 1.748 -9.695 1.00 . A A . 3 LYS HE3 1 1 9 2330 1 1 3 LYS HG2 H 1.655 3.018 -7.730 1.00 . A A . 3 LYS HG2 1 1 9 2331 1 1 3 LYS HG3 H 2.890 1.879 -7.191 1.00 . A A . 3 LYS HG3 1 1 9 2332 1 1 3 LYS HZ1 H 2.921 -0.018 -11.013 1.00 . A A . 3 LYS HZ1 1 1 9 2333 1 1 3 LYS HZ2 H 1.536 0.656 -11.713 1.00 . A A . 3 LYS HZ2 1 1 9 2334 1 1 3 LYS HZ3 H 1.388 -0.453 -10.445 1.00 . A A . 3 LYS HZ3 1 1 9 2335 1 1 3 LYS N N 2.157 2.867 -4.222 1.00 . A A . 3 LYS N 1 1 9 2336 1 1 3 LYS NZ N 1.960 0.330 -10.821 1.00 . A A . 3 LYS NZ 1 1 9 2337 1 1 3 LYS O O -1.256 3.599 -4.934 1.00 . A A . 3 LYS O 1 1 9 2338 1 1 4 ASP C C -1.815 3.846 -1.852 1.00 . A A . 4 ASP C 1 1 9 2339 1 1 4 ASP CA C -1.543 2.459 -2.424 1.00 . A A . 4 ASP CA 1 1 9 2340 1 1 4 ASP CB C -1.428 1.439 -1.290 1.00 . A A . 4 ASP CB 1 1 9 2341 1 1 4 ASP CG C -2.413 0.296 -1.437 1.00 . A A . 4 ASP CG 1 1 9 2342 1 1 4 ASP H H 0.478 2.024 -2.882 1.00 . A A . 4 ASP H 1 1 9 2343 1 1 4 ASP HA H -2.366 2.180 -3.064 1.00 . A A . 4 ASP HA 1 1 9 2344 1 1 4 ASP HB2 H -0.428 1.029 -1.283 1.00 . A A . 4 ASP HB2 1 1 9 2345 1 1 4 ASP HB3 H -1.616 1.935 -0.349 1.00 . A A . 4 ASP HB3 1 1 9 2346 1 1 4 ASP N N -0.328 2.459 -3.231 1.00 . A A . 4 ASP N 1 1 9 2347 1 1 4 ASP O O -2.966 4.219 -1.620 1.00 . A A . 4 ASP O 1 1 9 2348 1 1 4 ASP OD1 O -2.206 -0.555 -2.327 1.00 . A A . 4 ASP OD1 1 1 9 2349 1 1 4 ASP OD2 O -3.390 0.253 -0.661 1.00 . A A . 4 ASP OD2 1 1 9 2350 1 1 5 LEU C C -1.374 6.928 -2.139 1.00 . A A . 5 LEU C 1 1 9 2351 1 1 5 LEU CA C -0.872 5.953 -1.079 1.00 . A A . 5 LEU CA 1 1 9 2352 1 1 5 LEU CB C 0.475 6.428 -0.531 1.00 . A A . 5 LEU CB 1 1 9 2353 1 1 5 LEU CD1 C 2.055 6.657 1.402 1.00 . A A . 5 LEU CD1 1 1 9 2354 1 1 5 LEU CD2 C -0.259 7.592 1.564 1.00 . A A . 5 LEU CD2 1 1 9 2355 1 1 5 LEU CG C 0.601 6.475 0.992 1.00 . A A . 5 LEU CG 1 1 9 2356 1 1 5 LEU H H 0.142 4.255 -1.830 1.00 . A A . 5 LEU H 1 1 9 2357 1 1 5 LEU HA H -1.588 5.919 -0.271 1.00 . A A . 5 LEU HA 1 1 9 2358 1 1 5 LEU HB2 H 1.237 5.761 -0.905 1.00 . A A . 5 LEU HB2 1 1 9 2359 1 1 5 LEU HB3 H 0.653 7.424 -0.910 1.00 . A A . 5 LEU HB3 1 1 9 2360 1 1 5 LEU HD11 H 2.195 7.651 1.799 1.00 . A A . 5 LEU HD11 1 1 9 2361 1 1 5 LEU HD12 H 2.691 6.520 0.540 1.00 . A A . 5 LEU HD12 1 1 9 2362 1 1 5 LEU HD13 H 2.309 5.927 2.157 1.00 . A A . 5 LEU HD13 1 1 9 2363 1 1 5 LEU HD21 H -0.560 7.336 2.569 1.00 . A A . 5 LEU HD21 1 1 9 2364 1 1 5 LEU HD22 H -1.137 7.722 0.947 1.00 . A A . 5 LEU HD22 1 1 9 2365 1 1 5 LEU HD23 H 0.308 8.512 1.580 1.00 . A A . 5 LEU HD23 1 1 9 2366 1 1 5 LEU HG H 0.253 5.539 1.405 1.00 . A A . 5 LEU HG 1 1 9 2367 1 1 5 LEU N N -0.749 4.606 -1.625 1.00 . A A . 5 LEU N 1 1 9 2368 1 1 5 LEU O O -2.013 7.931 -1.822 1.00 . A A . 5 LEU O 1 1 9 2369 1 1 6 ARG C C -3.019 7.667 -4.496 1.00 . A A . 6 ARG C 1 1 9 2370 1 1 6 ARG CA C -1.506 7.473 -4.507 1.00 . A A . 6 ARG CA 1 1 9 2371 1 1 6 ARG CB C -1.069 6.863 -5.841 1.00 . A A . 6 ARG CB 1 1 9 2372 1 1 6 ARG CD C -1.218 7.029 -8.344 1.00 . A A . 6 ARG CD 1 1 9 2373 1 1 6 ARG CG C -1.267 7.790 -7.028 1.00 . A A . 6 ARG CG 1 1 9 2374 1 1 6 ARG CZ C -2.396 5.149 -9.404 1.00 . A A . 6 ARG CZ 1 1 9 2375 1 1 6 ARG H H -0.570 5.811 -3.590 1.00 . A A . 6 ARG H 1 1 9 2376 1 1 6 ARG HA H -1.030 8.435 -4.389 1.00 . A A . 6 ARG HA 1 1 9 2377 1 1 6 ARG HB2 H -0.021 6.609 -5.781 1.00 . A A . 6 ARG HB2 1 1 9 2378 1 1 6 ARG HB3 H -1.639 5.963 -6.015 1.00 . A A . 6 ARG HB3 1 1 9 2379 1 1 6 ARG HD2 H -1.246 7.739 -9.157 1.00 . A A . 6 ARG HD2 1 1 9 2380 1 1 6 ARG HD3 H -0.296 6.469 -8.386 1.00 . A A . 6 ARG HD3 1 1 9 2381 1 1 6 ARG HE H -3.090 6.204 -7.860 1.00 . A A . 6 ARG HE 1 1 9 2382 1 1 6 ARG HG2 H -2.229 8.273 -6.940 1.00 . A A . 6 ARG HG2 1 1 9 2383 1 1 6 ARG HG3 H -0.486 8.536 -7.025 1.00 . A A . 6 ARG HG3 1 1 9 2384 1 1 6 ARG HH11 H -0.599 5.592 -10.214 1.00 . A A . 6 ARG HH11 1 1 9 2385 1 1 6 ARG HH12 H -1.440 4.269 -10.952 1.00 . A A . 6 ARG HH12 1 1 9 2386 1 1 6 ARG HH21 H -4.206 4.463 -8.823 1.00 . A A . 6 ARG HH21 1 1 9 2387 1 1 6 ARG HH22 H -3.492 3.628 -10.160 1.00 . A A . 6 ARG HH22 1 1 9 2388 1 1 6 ARG N N -1.083 6.624 -3.400 1.00 . A A . 6 ARG N 1 1 9 2389 1 1 6 ARG NE N -2.341 6.105 -8.484 1.00 . A A . 6 ARG NE 1 1 9 2390 1 1 6 ARG NH1 N -1.396 4.991 -10.261 1.00 . A A . 6 ARG NH1 1 1 9 2391 1 1 6 ARG NH2 N -3.451 4.347 -9.468 1.00 . A A . 6 ARG NH2 1 1 9 2392 1 1 6 ARG O O -3.524 8.714 -4.903 1.00 . A A . 6 ARG O 1 1 9 2393 1 1 7 HIS C C -5.651 7.588 -2.803 1.00 . A A . 7 HIS C 1 1 9 2394 1 1 7 HIS CA C -5.194 6.710 -3.964 1.00 . A A . 7 HIS CA 1 1 9 2395 1 1 7 HIS CB C -5.776 5.304 -3.816 1.00 . A A . 7 HIS CB 1 1 9 2396 1 1 7 HIS CD2 C -6.301 4.161 -6.085 1.00 . A A . 7 HIS CD2 1 1 9 2397 1 1 7 HIS CE1 C -8.426 4.682 -6.223 1.00 . A A . 7 HIS CE1 1 1 9 2398 1 1 7 HIS CG C -6.616 4.878 -4.981 1.00 . A A . 7 HIS CG 1 1 9 2399 1 1 7 HIS H H -3.278 5.843 -3.719 1.00 . A A . 7 HIS H 1 1 9 2400 1 1 7 HIS HA H -5.549 7.142 -4.888 1.00 . A A . 7 HIS HA 1 1 9 2401 1 1 7 HIS HB2 H -4.967 4.595 -3.715 1.00 . A A . 7 HIS HB2 1 1 9 2402 1 1 7 HIS HB3 H -6.393 5.268 -2.930 1.00 . A A . 7 HIS HB3 1 1 9 2403 1 1 7 HIS HD1 H -8.480 5.705 -4.452 1.00 . A A . 7 HIS HD1 1 1 9 2404 1 1 7 HIS HD2 H -5.331 3.750 -6.328 1.00 . A A . 7 HIS HD2 1 1 9 2405 1 1 7 HIS HE1 H -9.442 4.767 -6.578 1.00 . A A . 7 HIS HE1 1 1 9 2406 1 1 7 HIS N N -3.738 6.651 -4.029 1.00 . A A . 7 HIS N 1 1 9 2407 1 1 7 HIS ND1 N -7.954 5.190 -5.098 1.00 . A A . 7 HIS ND1 1 1 9 2408 1 1 7 HIS NE2 N -7.442 4.054 -6.841 1.00 . A A . 7 HIS NE2 1 1 9 2409 1 1 7 HIS O O -6.791 8.050 -2.774 1.00 . A A . 7 HIS O 1 1 9 2410 1 1 8 ALA C C -5.069 10.116 -1.047 1.00 . A A . 8 ALA C 1 1 9 2411 1 1 8 ALA CA C -5.067 8.634 -0.686 1.00 . A A . 8 ALA CA 1 1 9 2412 1 1 8 ALA CB C -4.073 8.364 0.434 1.00 . A A . 8 ALA CB 1 1 9 2413 1 1 8 ALA H H -3.863 7.415 -1.928 1.00 . A A . 8 ALA H 1 1 9 2414 1 1 8 ALA HA H -6.051 8.358 -0.335 1.00 . A A . 8 ALA HA 1 1 9 2415 1 1 8 ALA HB1 H -4.351 8.936 1.307 1.00 . A A . 8 ALA HB1 1 1 9 2416 1 1 8 ALA HB2 H -4.080 7.311 0.675 1.00 . A A . 8 ALA HB2 1 1 9 2417 1 1 8 ALA HB3 H -3.083 8.653 0.114 1.00 . A A . 8 ALA HB3 1 1 9 2418 1 1 8 ALA N N -4.755 7.811 -1.848 1.00 . A A . 8 ALA N 1 1 9 2419 1 1 8 ALA O O -5.694 10.930 -0.367 1.00 . A A . 8 ALA O 1 1 9 2420 1 1 9 PHE C C -5.659 12.360 -2.989 1.00 . A A . 9 PHE C 1 1 9 2421 1 1 9 PHE CA C -4.286 11.844 -2.571 1.00 . A A . 9 PHE CA 1 1 9 2422 1 1 9 PHE CB C -3.305 11.967 -3.739 1.00 . A A . 9 PHE CB 1 1 9 2423 1 1 9 PHE CD1 C -1.112 12.852 -2.900 1.00 . A A . 9 PHE CD1 1 1 9 2424 1 1 9 PHE CD2 C -2.558 14.338 -4.076 1.00 . A A . 9 PHE CD2 1 1 9 2425 1 1 9 PHE CE1 C -0.189 13.868 -2.741 1.00 . A A . 9 PHE CE1 1 1 9 2426 1 1 9 PHE CE2 C -1.639 15.359 -3.921 1.00 . A A . 9 PHE CE2 1 1 9 2427 1 1 9 PHE CG C -2.305 13.074 -3.568 1.00 . A A . 9 PHE CG 1 1 9 2428 1 1 9 PHE CZ C -0.454 15.124 -3.252 1.00 . A A . 9 PHE CZ 1 1 9 2429 1 1 9 PHE H H -3.888 9.765 -2.622 1.00 . A A . 9 PHE H 1 1 9 2430 1 1 9 PHE HA H -3.926 12.440 -1.746 1.00 . A A . 9 PHE HA 1 1 9 2431 1 1 9 PHE HB2 H -2.760 11.041 -3.841 1.00 . A A . 9 PHE HB2 1 1 9 2432 1 1 9 PHE HB3 H -3.859 12.155 -4.646 1.00 . A A . 9 PHE HB3 1 1 9 2433 1 1 9 PHE HD1 H -0.904 11.869 -2.499 1.00 . A A . 9 PHE HD1 1 1 9 2434 1 1 9 PHE HD2 H -3.485 14.524 -4.599 1.00 . A A . 9 PHE HD2 1 1 9 2435 1 1 9 PHE HE1 H 0.736 13.681 -2.217 1.00 . A A . 9 PHE HE1 1 1 9 2436 1 1 9 PHE HE2 H -1.848 16.340 -4.321 1.00 . A A . 9 PHE HE2 1 1 9 2437 1 1 9 PHE HZ H 0.266 15.920 -3.130 1.00 . A A . 9 PHE HZ 1 1 9 2438 1 1 9 PHE N N -4.366 10.459 -2.121 1.00 . A A . 9 PHE N 1 1 9 2439 1 1 9 PHE O O -5.926 13.561 -2.934 1.00 . A A . 9 PHE O 1 1 9 2440 1 1 10 ARG C C -8.748 12.163 -2.638 1.00 . A A . 10 ARG C 1 1 9 2441 1 1 10 ARG CA C -7.873 11.806 -3.836 1.00 . A A . 10 ARG CA 1 1 9 2442 1 1 10 ARG CB C -8.507 10.657 -4.620 1.00 . A A . 10 ARG CB 1 1 9 2443 1 1 10 ARG CD C -9.189 9.736 -6.857 1.00 . A A . 10 ARG CD 1 1 9 2444 1 1 10 ARG CG C -8.687 10.955 -6.100 1.00 . A A . 10 ARG CG 1 1 9 2445 1 1 10 ARG CZ C -7.750 9.546 -8.841 1.00 . A A . 10 ARG CZ 1 1 9 2446 1 1 10 ARG H H -6.256 10.503 -3.427 1.00 . A A . 10 ARG H 1 1 9 2447 1 1 10 ARG HA H -7.795 12.670 -4.479 1.00 . A A . 10 ARG HA 1 1 9 2448 1 1 10 ARG HB2 H -7.880 9.782 -4.526 1.00 . A A . 10 ARG HB2 1 1 9 2449 1 1 10 ARG HB3 H -9.477 10.441 -4.198 1.00 . A A . 10 ARG HB3 1 1 9 2450 1 1 10 ARG HD2 H -9.568 9.017 -6.145 1.00 . A A . 10 ARG HD2 1 1 9 2451 1 1 10 ARG HD3 H -9.986 10.042 -7.518 1.00 . A A . 10 ARG HD3 1 1 9 2452 1 1 10 ARG HE H -7.688 8.323 -7.267 1.00 . A A . 10 ARG HE 1 1 9 2453 1 1 10 ARG HG2 H -9.405 11.755 -6.211 1.00 . A A . 10 ARG HG2 1 1 9 2454 1 1 10 ARG HG3 H -7.738 11.260 -6.514 1.00 . A A . 10 ARG HG3 1 1 9 2455 1 1 10 ARG HH11 H -9.063 11.080 -8.887 1.00 . A A . 10 ARG HH11 1 1 9 2456 1 1 10 ARG HH12 H -8.042 10.935 -10.280 1.00 . A A . 10 ARG HH12 1 1 9 2457 1 1 10 ARG HH21 H -6.338 8.121 -9.094 1.00 . A A . 10 ARG HH21 1 1 9 2458 1 1 10 ARG HH22 H -6.493 9.251 -10.397 1.00 . A A . 10 ARG HH22 1 1 9 2459 1 1 10 ARG N N -6.527 11.445 -3.407 1.00 . A A . 10 ARG N 1 1 9 2460 1 1 10 ARG NE N -8.133 9.109 -7.646 1.00 . A A . 10 ARG NE 1 1 9 2461 1 1 10 ARG NH1 N -8.333 10.607 -9.380 1.00 . A A . 10 ARG NH1 1 1 9 2462 1 1 10 ARG NH2 N -6.781 8.921 -9.498 1.00 . A A . 10 ARG NH2 1 1 9 2463 1 1 10 ARG O O -9.696 12.931 -2.792 1.00 . A A . 10 ARG O 1 1 9 2464 1 1 11 . C C -9.090 13.338 0.110 1.00 . A A . 11 SEP C 1 1 9 2465 1 1 11 . CA C -9.199 11.878 -0.243 1.00 . A A . 11 SEP CA 1 1 9 2466 1 1 11 . CB C -8.778 10.891 0.887 1.00 . A A . 11 SEP CB 1 1 9 2467 1 1 11 . H H -7.624 10.980 -1.422 1.00 . A A . 11 SEP H 1 1 9 2468 1 1 11 . HA H -10.258 11.674 -0.491 1.00 . A A . 11 SEP HA 1 1 9 2469 1 1 11 . HB2 H -9.383 9.966 0.884 1.00 . A A . 11 SEP HB2 1 1 9 2470 1 1 11 . HB3 H -7.737 10.532 0.757 1.00 . A A . 11 SEP HB3 1 1 9 2471 1 1 11 . N N -8.415 11.604 -1.484 1.00 . A A . 11 SEP N 1 1 9 2472 1 1 11 . O O -10.040 13.984 0.551 1.00 . A A . 11 SEP O 1 1 9 2473 1 1 11 . O1P O -6.704 12.784 2.416 1.00 . A A . 11 SEP O1P 1 1 9 2474 1 1 11 . O2P O -8.155 12.487 4.409 1.00 . A A . 11 SEP O2P 1 1 9 2475 1 1 11 . O3P O -6.909 10.517 3.484 1.00 . A A . 11 SEP O3P 1 1 9 2476 1 1 11 . OG O -8.910 11.508 2.190 1.00 . A A . 11 SEP OG 1 1 9 2477 1 1 11 . P P -7.632 11.812 3.136 1.00 . A A . 11 SEP P 1 1 9 2478 1 1 12 MET C C -8.308 16.179 -0.812 1.00 . A A . 12 MET C 1 1 9 2479 1 1 12 MET CA C -7.611 15.269 0.195 1.00 . A A . 12 MET CA 1 1 9 2480 1 1 12 MET CB C -6.103 15.529 0.175 1.00 . A A . 12 MET CB 1 1 9 2481 1 1 12 MET CE C -2.733 15.315 0.990 1.00 . A A . 12 MET CE 1 1 9 2482 1 1 12 MET CG C -5.448 15.407 1.541 1.00 . A A . 12 MET CG 1 1 9 2483 1 1 12 MET H H -7.169 13.301 -0.447 1.00 . A A . 12 MET H 1 1 9 2484 1 1 12 MET HA H -7.991 15.486 1.182 1.00 . A A . 12 MET HA 1 1 9 2485 1 1 12 MET HB2 H -5.636 14.817 -0.489 1.00 . A A . 12 MET HB2 1 1 9 2486 1 1 12 MET HB3 H -5.926 16.526 -0.197 1.00 . A A . 12 MET HB3 1 1 9 2487 1 1 12 MET HE1 H -2.905 15.595 -0.040 1.00 . A A . 12 MET HE1 1 1 9 2488 1 1 12 MET HE2 H -2.701 16.203 1.603 1.00 . A A . 12 MET HE2 1 1 9 2489 1 1 12 MET HE3 H -1.794 14.788 1.068 1.00 . A A . 12 MET HE3 1 1 9 2490 1 1 12 MET HG2 H -5.087 16.379 1.841 1.00 . A A . 12 MET HG2 1 1 9 2491 1 1 12 MET HG3 H -6.187 15.065 2.250 1.00 . A A . 12 MET HG3 1 1 9 2492 1 1 12 MET N N -7.887 13.867 -0.094 1.00 . A A . 12 MET N 1 1 9 2493 1 1 12 MET O O -8.609 17.335 -0.514 1.00 . A A . 12 MET O 1 1 9 2494 1 1 12 MET SD S -4.063 14.252 1.547 1.00 . A A . 12 MET SD 1 1 9 2495 1 1 13 PHE C C -10.694 16.638 -2.722 1.00 . A A . 13 PHE C 1 1 9 2496 1 1 13 PHE CA C -9.222 16.416 -3.055 1.00 . A A . 13 PHE CA 1 1 9 2497 1 1 13 PHE CB C -9.094 15.694 -4.398 1.00 . A A . 13 PHE CB 1 1 9 2498 1 1 13 PHE CD1 C -6.728 16.434 -4.785 1.00 . A A . 13 PHE CD1 1 1 9 2499 1 1 13 PHE CD2 C -8.273 16.585 -6.595 1.00 . A A . 13 PHE CD2 1 1 9 2500 1 1 13 PHE CE1 C -5.729 16.945 -5.591 1.00 . A A . 13 PHE CE1 1 1 9 2501 1 1 13 PHE CE2 C -7.277 17.097 -7.406 1.00 . A A . 13 PHE CE2 1 1 9 2502 1 1 13 PHE CG C -8.010 16.249 -5.277 1.00 . A A . 13 PHE CG 1 1 9 2503 1 1 13 PHE CZ C -6.003 17.276 -6.903 1.00 . A A . 13 PHE CZ 1 1 9 2504 1 1 13 PHE H H -8.297 14.723 -2.182 1.00 . A A . 13 PHE H 1 1 9 2505 1 1 13 PHE HA H -8.732 17.375 -3.124 1.00 . A A . 13 PHE HA 1 1 9 2506 1 1 13 PHE HB2 H -8.875 14.652 -4.219 1.00 . A A . 13 PHE HB2 1 1 9 2507 1 1 13 PHE HB3 H -10.029 15.774 -4.932 1.00 . A A . 13 PHE HB3 1 1 9 2508 1 1 13 PHE HD1 H -6.512 16.175 -3.759 1.00 . A A . 13 PHE HD1 1 1 9 2509 1 1 13 PHE HD2 H -9.269 16.445 -6.989 1.00 . A A . 13 PHE HD2 1 1 9 2510 1 1 13 PHE HE1 H -4.734 17.084 -5.195 1.00 . A A . 13 PHE HE1 1 1 9 2511 1 1 13 PHE HE2 H -7.495 17.355 -8.432 1.00 . A A . 13 PHE HE2 1 1 9 2512 1 1 13 PHE HZ H -5.224 17.676 -7.535 1.00 . A A . 13 PHE HZ 1 1 9 2513 1 1 13 PHE N N -8.561 15.650 -2.004 1.00 . A A . 13 PHE N 1 1 9 2514 1 1 13 PHE O O -11.275 15.959 -1.875 1.00 . A A . 13 PHE O 1 1 9 2515 1 1 14 PRO C C -13.663 16.912 -3.811 1.00 . A A . 14 PRO C 1 1 9 2516 1 1 14 PRO CA C -12.726 17.948 -3.199 1.00 . A A . 14 PRO CA 1 1 9 2517 1 1 14 PRO CB C -12.878 19.294 -3.912 1.00 . A A . 14 PRO CB 1 1 9 2518 1 1 14 PRO CD C -10.684 18.462 -4.429 1.00 . A A . 14 PRO CD 1 1 9 2519 1 1 14 PRO CG C -11.807 19.298 -4.947 1.00 . A A . 14 PRO CG 1 1 9 2520 1 1 14 PRO HA H -12.957 18.066 -2.150 1.00 . A A . 14 PRO HA 1 1 9 2521 1 1 14 PRO HB2 H -13.861 19.359 -4.358 1.00 . A A . 14 PRO HB2 1 1 9 2522 1 1 14 PRO HB3 H -12.745 20.098 -3.203 1.00 . A A . 14 PRO HB3 1 1 9 2523 1 1 14 PRO HD2 H -10.267 17.862 -5.224 1.00 . A A . 14 PRO HD2 1 1 9 2524 1 1 14 PRO HD3 H -9.923 19.093 -3.992 1.00 . A A . 14 PRO HD3 1 1 9 2525 1 1 14 PRO HG2 H -12.187 18.888 -5.870 1.00 . A A . 14 PRO HG2 1 1 9 2526 1 1 14 PRO HG3 H -11.450 20.306 -5.101 1.00 . A A . 14 PRO HG3 1 1 9 2527 1 1 14 PRO N N -11.314 17.613 -3.404 1.00 . A A . 14 PRO N 1 1 9 2528 1 1 14 PRO O O -14.848 16.863 -3.483 1.00 . A A . 14 PRO O 1 1 9 2529 1 1 15 SER C C -14.298 13.952 -4.378 1.00 . A A . 15 SER C 1 1 9 2530 1 1 15 SER CA C -13.912 15.053 -5.362 1.00 . A A . 15 SER CA 1 1 9 2531 1 1 15 SER CB C -13.131 14.455 -6.533 1.00 . A A . 15 SER CB 1 1 9 2532 1 1 15 SER H H -12.172 16.175 -4.921 1.00 . A A . 15 SER H 1 1 9 2533 1 1 15 SER HA H -14.813 15.514 -5.739 1.00 . A A . 15 SER HA 1 1 9 2534 1 1 15 SER HB2 H -12.179 14.089 -6.178 1.00 . A A . 15 SER HB2 1 1 9 2535 1 1 15 SER HB3 H -13.695 13.638 -6.959 1.00 . A A . 15 SER HB3 1 1 9 2536 1 1 15 SER HG H -12.056 15.855 -7.383 1.00 . A A . 15 SER HG 1 1 9 2537 1 1 15 SER N N -13.123 16.086 -4.701 1.00 . A A . 15 SER N 1 1 9 2538 1 1 15 SER O O -15.309 13.273 -4.555 1.00 . A A . 15 SER O 1 1 9 2539 1 1 15 SER OG O -12.900 15.425 -7.540 1.00 . A A . 15 SER OG 1 1 9 2540 1 1 16 SER C C -14.941 13.134 -1.471 1.00 . A A . 16 SER C 1 1 9 2541 1 1 16 SER CA C -13.737 12.761 -2.331 1.00 . A A . 16 SER CA 1 1 9 2542 1 1 16 SER CB C -12.503 12.573 -1.446 1.00 . A A . 16 SER CB 1 1 9 2543 1 1 16 SER H H -12.693 14.355 -3.256 1.00 . A A . 16 SER H 1 1 9 2544 1 1 16 SER HA H -13.947 11.834 -2.842 1.00 . A A . 16 SER HA 1 1 9 2545 1 1 16 SER HB2 H -11.724 12.089 -2.016 1.00 . A A . 16 SER HB2 1 1 9 2546 1 1 16 SER HB3 H -12.155 13.539 -1.109 1.00 . A A . 16 SER HB3 1 1 9 2547 1 1 16 SER HG H -12.182 11.045 -0.263 1.00 . A A . 16 SER HG 1 1 9 2548 1 1 16 SER N N -13.484 13.782 -3.341 1.00 . A A . 16 SER N 1 1 9 2549 1 1 16 SER O O -15.682 12.265 -1.014 1.00 . A A . 16 SER O 1 1 9 2550 1 1 16 SER OG O -12.803 11.775 -0.315 1.00 . A A . 16 SER OG 1 1 9 2551 1 1 17 GLU C C -17.468 15.179 -1.320 1.00 . A A . 17 GLU C 1 1 9 2552 1 1 17 GLU CA C -16.240 14.921 -0.451 1.00 . A A . 17 GLU CA 1 1 9 2553 1 1 17 GLU CB C -15.843 16.203 0.283 1.00 . A A . 17 GLU CB 1 1 9 2554 1 1 17 GLU CD C -15.313 18.666 0.101 1.00 . A A . 17 GLU CD 1 1 9 2555 1 1 17 GLU CG C -15.529 17.364 -0.645 1.00 . A A . 17 GLU CG 1 1 9 2556 1 1 17 GLU H H -14.501 15.077 -1.648 1.00 . A A . 17 GLU H 1 1 9 2557 1 1 17 GLU HA H -16.482 14.161 0.276 1.00 . A A . 17 GLU HA 1 1 9 2558 1 1 17 GLU HB2 H -16.655 16.498 0.933 1.00 . A A . 17 GLU HB2 1 1 9 2559 1 1 17 GLU HB3 H -14.968 16.003 0.884 1.00 . A A . 17 GLU HB3 1 1 9 2560 1 1 17 GLU HG2 H -14.632 17.132 -1.199 1.00 . A A . 17 GLU HG2 1 1 9 2561 1 1 17 GLU HG3 H -16.352 17.492 -1.332 1.00 . A A . 17 GLU HG3 1 1 9 2562 1 1 17 GLU N N -15.127 14.433 -1.256 1.00 . A A . 17 GLU N 1 1 9 2563 1 1 17 GLU O O -18.476 14.481 -1.209 1.00 . A A . 17 GLU O 1 1 9 2564 1 1 17 GLU OE1 O -15.362 18.651 1.349 1.00 . A A . 17 GLU OE1 1 1 9 2565 1 1 17 GLU OE2 O -15.096 19.701 -0.563 1.00 . A A . 17 GLU OE2 1 1 10 2566 1 1 1 ARG C C 3.283 1.750 -2.850 1.00 . A A . 1 ARG C 1 1 10 2567 1 1 1 ARG CA C 3.413 0.249 -2.606 1.00 . A A . 1 ARG CA 1 1 10 2568 1 1 1 ARG CB C 2.269 -0.234 -1.712 1.00 . A A . 1 ARG CB 1 1 10 2569 1 1 1 ARG CD C 0.806 -2.152 -1.006 1.00 . A A . 1 ARG CD 1 1 10 2570 1 1 1 ARG CG C 1.780 -1.633 -2.052 1.00 . A A . 1 ARG CG 1 1 10 2571 1 1 1 ARG CZ C 0.870 -3.519 1.036 1.00 . A A . 1 ARG CZ 1 1 10 2572 1 1 1 ARG H1 H 5.519 0.063 -2.519 1.00 . A A . 1 ARG H1 1 1 10 2573 1 1 1 ARG HA H 3.358 -0.264 -3.555 1.00 . A A . 1 ARG HA 1 1 10 2574 1 1 1 ARG HB2 H 2.605 -0.234 -0.686 1.00 . A A . 1 ARG HB2 1 1 10 2575 1 1 1 ARG HB3 H 1.439 0.448 -1.811 1.00 . A A . 1 ARG HB3 1 1 10 2576 1 1 1 ARG HD2 H 0.420 -1.313 -0.446 1.00 . A A . 1 ARG HD2 1 1 10 2577 1 1 1 ARG HD3 H -0.006 -2.654 -1.508 1.00 . A A . 1 ARG HD3 1 1 10 2578 1 1 1 ARG HE H 2.342 -3.404 -0.305 1.00 . A A . 1 ARG HE 1 1 10 2579 1 1 1 ARG HG2 H 1.282 -1.607 -3.010 1.00 . A A . 1 ARG HG2 1 1 10 2580 1 1 1 ARG HG3 H 2.629 -2.298 -2.103 1.00 . A A . 1 ARG HG3 1 1 10 2581 1 1 1 ARG HH11 H -0.833 -2.466 0.771 1.00 . A A . 1 ARG HH11 1 1 10 2582 1 1 1 ARG HH12 H -0.775 -3.434 2.207 1.00 . A A . 1 ARG HH12 1 1 10 2583 1 1 1 ARG HH21 H 2.430 -4.683 1.581 1.00 . A A . 1 ARG HH21 1 1 10 2584 1 1 1 ARG HH22 H 1.082 -4.694 2.667 1.00 . A A . 1 ARG HH22 1 1 10 2585 1 1 1 ARG N N 4.699 -0.069 -1.998 1.00 . A A . 1 ARG N 1 1 10 2586 1 1 1 ARG NE N 1.443 -3.086 -0.081 1.00 . A A . 1 ARG NE 1 1 10 2587 1 1 1 ARG NH1 N -0.346 -3.105 1.366 1.00 . A A . 1 ARG NH1 1 1 10 2588 1 1 1 ARG NH2 N 1.513 -4.369 1.827 1.00 . A A . 1 ARG NH2 1 1 10 2589 1 1 1 ARG O O 2.591 2.451 -2.111 1.00 . A A . 1 ARG O 1 1 10 2590 1 1 2 SER C C 2.683 3.980 -5.065 1.00 . A A . 2 SER C 1 1 10 2591 1 1 2 SER CA C 3.916 3.654 -4.228 1.00 . A A . 2 SER CA 1 1 10 2592 1 1 2 SER CB C 5.182 4.051 -4.989 1.00 . A A . 2 SER CB 1 1 10 2593 1 1 2 SER H H 4.487 1.626 -4.441 1.00 . A A . 2 SER H 1 1 10 2594 1 1 2 SER HA H 3.870 4.213 -3.306 1.00 . A A . 2 SER HA 1 1 10 2595 1 1 2 SER HB2 H 4.907 4.559 -5.901 1.00 . A A . 2 SER HB2 1 1 10 2596 1 1 2 SER HB3 H 5.776 4.712 -4.374 1.00 . A A . 2 SER HB3 1 1 10 2597 1 1 2 SER HG H 6.874 3.173 -5.441 1.00 . A A . 2 SER HG 1 1 10 2598 1 1 2 SER N N 3.953 2.236 -3.890 1.00 . A A . 2 SER N 1 1 10 2599 1 1 2 SER O O 2.153 5.090 -5.004 1.00 . A A . 2 SER O 1 1 10 2600 1 1 2 SER OG O 5.959 2.912 -5.317 1.00 . A A . 2 SER OG 1 1 10 2601 1 1 3 LYS C C -0.219 3.199 -5.863 1.00 . A A . 3 LYS C 1 1 10 2602 1 1 3 LYS CA C 1.059 3.186 -6.695 1.00 . A A . 3 LYS CA 1 1 10 2603 1 1 3 LYS CB C 0.987 2.073 -7.743 1.00 . A A . 3 LYS CB 1 1 10 2604 1 1 3 LYS CD C 0.593 -0.366 -8.197 1.00 . A A . 3 LYS CD 1 1 10 2605 1 1 3 LYS CE C 1.130 -1.737 -7.814 1.00 . A A . 3 LYS CE 1 1 10 2606 1 1 3 LYS CG C 0.932 0.678 -7.146 1.00 . A A . 3 LYS CG 1 1 10 2607 1 1 3 LYS H H 2.696 2.142 -5.851 1.00 . A A . 3 LYS H 1 1 10 2608 1 1 3 LYS HA H 1.157 4.136 -7.198 1.00 . A A . 3 LYS HA 1 1 10 2609 1 1 3 LYS HB2 H 0.102 2.219 -8.346 1.00 . A A . 3 LYS HB2 1 1 10 2610 1 1 3 LYS HB3 H 1.859 2.136 -8.378 1.00 . A A . 3 LYS HB3 1 1 10 2611 1 1 3 LYS HD2 H -0.480 -0.428 -8.297 1.00 . A A . 3 LYS HD2 1 1 10 2612 1 1 3 LYS HD3 H 1.028 -0.069 -9.140 1.00 . A A . 3 LYS HD3 1 1 10 2613 1 1 3 LYS HE2 H 2.143 -1.626 -7.459 1.00 . A A . 3 LYS HE2 1 1 10 2614 1 1 3 LYS HE3 H 0.514 -2.143 -7.025 1.00 . A A . 3 LYS HE3 1 1 10 2615 1 1 3 LYS HG2 H 1.894 0.442 -6.717 1.00 . A A . 3 LYS HG2 1 1 10 2616 1 1 3 LYS HG3 H 0.176 0.656 -6.373 1.00 . A A . 3 LYS HG3 1 1 10 2617 1 1 3 LYS HZ1 H 1.762 -3.476 -8.784 1.00 . A A . 3 LYS HZ1 1 1 10 2618 1 1 3 LYS HZ2 H 1.436 -2.187 -9.831 1.00 . A A . 3 LYS HZ2 1 1 10 2619 1 1 3 LYS HZ3 H 0.161 -3.045 -9.123 1.00 . A A . 3 LYS HZ3 1 1 10 2620 1 1 3 LYS N N 2.230 3.005 -5.846 1.00 . A A . 3 LYS N 1 1 10 2621 1 1 3 LYS NZ N 1.122 -2.677 -8.969 1.00 . A A . 3 LYS NZ 1 1 10 2622 1 1 3 LYS O O -1.210 3.826 -6.240 1.00 . A A . 3 LYS O 1 1 10 2623 1 1 4 ASP C C -1.578 3.779 -3.154 1.00 . A A . 4 ASP C 1 1 10 2624 1 1 4 ASP CA C -1.346 2.439 -3.845 1.00 . A A . 4 ASP CA 1 1 10 2625 1 1 4 ASP CB C -1.152 1.339 -2.799 1.00 . A A . 4 ASP CB 1 1 10 2626 1 1 4 ASP CG C -2.218 0.265 -2.884 1.00 . A A . 4 ASP CG 1 1 10 2627 1 1 4 ASP H H 0.629 2.025 -4.486 1.00 . A A . 4 ASP H 1 1 10 2628 1 1 4 ASP HA H -2.211 2.203 -4.445 1.00 . A A . 4 ASP HA 1 1 10 2629 1 1 4 ASP HB2 H -0.187 0.875 -2.949 1.00 . A A . 4 ASP HB2 1 1 10 2630 1 1 4 ASP HB3 H -1.186 1.779 -1.813 1.00 . A A . 4 ASP HB3 1 1 10 2631 1 1 4 ASP N N -0.190 2.505 -4.731 1.00 . A A . 4 ASP N 1 1 10 2632 1 1 4 ASP O O -2.714 4.143 -2.847 1.00 . A A . 4 ASP O 1 1 10 2633 1 1 4 ASP OD1 O -3.415 0.610 -2.800 1.00 . A A . 4 ASP OD1 1 1 10 2634 1 1 4 ASP OD2 O -1.856 -0.921 -3.033 1.00 . A A . 4 ASP OD2 1 1 10 2635 1 1 5 LEU C C -1.112 6.869 -3.215 1.00 . A A . 5 LEU C 1 1 10 2636 1 1 5 LEU CA C -0.580 5.809 -2.255 1.00 . A A . 5 LEU CA 1 1 10 2637 1 1 5 LEU CB C 0.793 6.227 -1.727 1.00 . A A . 5 LEU CB 1 1 10 2638 1 1 5 LEU CD1 C 1.724 4.950 0.219 1.00 . A A . 5 LEU CD1 1 1 10 2639 1 1 5 LEU CD2 C 1.683 7.450 0.272 1.00 . A A . 5 LEU CD2 1 1 10 2640 1 1 5 LEU CG C 0.965 6.197 -0.208 1.00 . A A . 5 LEU CG 1 1 10 2641 1 1 5 LEU H H 0.383 4.167 -3.179 1.00 . A A . 5 LEU H 1 1 10 2642 1 1 5 LEU HA H -1.264 5.717 -1.425 1.00 . A A . 5 LEU HA 1 1 10 2643 1 1 5 LEU HB2 H 1.528 5.563 -2.156 1.00 . A A . 5 LEU HB2 1 1 10 2644 1 1 5 LEU HB3 H 0.983 7.236 -2.063 1.00 . A A . 5 LEU HB3 1 1 10 2645 1 1 5 LEU HD11 H 1.677 4.213 -0.568 1.00 . A A . 5 LEU HD11 1 1 10 2646 1 1 5 LEU HD12 H 1.278 4.547 1.117 1.00 . A A . 5 LEU HD12 1 1 10 2647 1 1 5 LEU HD13 H 2.755 5.205 0.413 1.00 . A A . 5 LEU HD13 1 1 10 2648 1 1 5 LEU HD21 H 2.019 7.306 1.288 1.00 . A A . 5 LEU HD21 1 1 10 2649 1 1 5 LEU HD22 H 1.005 8.290 0.233 1.00 . A A . 5 LEU HD22 1 1 10 2650 1 1 5 LEU HD23 H 2.533 7.645 -0.365 1.00 . A A . 5 LEU HD23 1 1 10 2651 1 1 5 LEU HG H -0.010 6.169 0.258 1.00 . A A . 5 LEU HG 1 1 10 2652 1 1 5 LEU N N -0.495 4.509 -2.911 1.00 . A A . 5 LEU N 1 1 10 2653 1 1 5 LEU O O -1.725 7.850 -2.793 1.00 . A A . 5 LEU O 1 1 10 2654 1 1 6 ARG C C -2.840 7.808 -5.437 1.00 . A A . 6 ARG C 1 1 10 2655 1 1 6 ARG CA C -1.331 7.601 -5.525 1.00 . A A . 6 ARG CA 1 1 10 2656 1 1 6 ARG CB C -0.955 7.095 -6.919 1.00 . A A . 6 ARG CB 1 1 10 2657 1 1 6 ARG CD C 0.594 8.615 -8.186 1.00 . A A . 6 ARG CD 1 1 10 2658 1 1 6 ARG CG C -0.851 8.197 -7.960 1.00 . A A . 6 ARG CG 1 1 10 2659 1 1 6 ARG CZ C 2.088 10.410 -7.421 1.00 . A A . 6 ARG CZ 1 1 10 2660 1 1 6 ARG H H -0.381 5.863 -4.780 1.00 . A A . 6 ARG H 1 1 10 2661 1 1 6 ARG HA H -0.839 8.546 -5.351 1.00 . A A . 6 ARG HA 1 1 10 2662 1 1 6 ARG HB2 H 0.000 6.592 -6.862 1.00 . A A . 6 ARG HB2 1 1 10 2663 1 1 6 ARG HB3 H -1.704 6.390 -7.247 1.00 . A A . 6 ARG HB3 1 1 10 2664 1 1 6 ARG HD2 H 1.227 7.747 -8.075 1.00 . A A . 6 ARG HD2 1 1 10 2665 1 1 6 ARG HD3 H 0.689 9.004 -9.189 1.00 . A A . 6 ARG HD3 1 1 10 2666 1 1 6 ARG HE H 0.490 9.755 -6.424 1.00 . A A . 6 ARG HE 1 1 10 2667 1 1 6 ARG HG2 H -1.260 7.839 -8.893 1.00 . A A . 6 ARG HG2 1 1 10 2668 1 1 6 ARG HG3 H -1.415 9.053 -7.622 1.00 . A A . 6 ARG HG3 1 1 10 2669 1 1 6 ARG HH11 H 2.585 9.592 -9.200 1.00 . A A . 6 ARG HH11 1 1 10 2670 1 1 6 ARG HH12 H 3.630 10.859 -8.649 1.00 . A A . 6 ARG HH12 1 1 10 2671 1 1 6 ARG HH21 H 1.859 11.425 -5.687 1.00 . A A . 6 ARG HH21 1 1 10 2672 1 1 6 ARG HH22 H 3.216 11.900 -6.650 1.00 . A A . 6 ARG HH22 1 1 10 2673 1 1 6 ARG N N -0.875 6.664 -4.506 1.00 . A A . 6 ARG N 1 1 10 2674 1 1 6 ARG NE N 1.023 9.638 -7.237 1.00 . A A . 6 ARG NE 1 1 10 2675 1 1 6 ARG NH1 N 2.829 10.276 -8.512 1.00 . A A . 6 ARG NH1 1 1 10 2676 1 1 6 ARG NH2 N 2.415 11.320 -6.511 1.00 . A A . 6 ARG NH2 1 1 10 2677 1 1 6 ARG O O -3.348 8.888 -5.740 1.00 . A A . 6 ARG O 1 1 10 2678 1 1 7 HIS C C -5.403 7.620 -3.650 1.00 . A A . 7 HIS C 1 1 10 2679 1 1 7 HIS CA C -5.003 6.832 -4.894 1.00 . A A . 7 HIS CA 1 1 10 2680 1 1 7 HIS CB C -5.597 5.425 -4.834 1.00 . A A . 7 HIS CB 1 1 10 2681 1 1 7 HIS CD2 C -6.602 4.253 -6.918 1.00 . A A . 7 HIS CD2 1 1 10 2682 1 1 7 HIS CE1 C -8.469 5.393 -7.059 1.00 . A A . 7 HIS CE1 1 1 10 2683 1 1 7 HIS CG C -6.605 5.153 -5.908 1.00 . A A . 7 HIS CG 1 1 10 2684 1 1 7 HIS H H -3.090 5.931 -4.796 1.00 . A A . 7 HIS H 1 1 10 2685 1 1 7 HIS HA H -5.390 7.339 -5.765 1.00 . A A . 7 HIS HA 1 1 10 2686 1 1 7 HIS HB2 H -4.802 4.701 -4.936 1.00 . A A . 7 HIS HB2 1 1 10 2687 1 1 7 HIS HB3 H -6.083 5.286 -3.879 1.00 . A A . 7 HIS HB3 1 1 10 2688 1 1 7 HIS HD1 H -8.084 6.577 -5.435 1.00 . A A . 7 HIS HD1 1 1 10 2689 1 1 7 HIS HD2 H -5.824 3.533 -7.134 1.00 . A A . 7 HIS HD2 1 1 10 2690 1 1 7 HIS HE1 H -9.432 5.751 -7.391 1.00 . A A . 7 HIS HE1 1 1 10 2691 1 1 7 HIS N N -3.552 6.765 -5.022 1.00 . A A . 7 HIS N 1 1 10 2692 1 1 7 HIS ND1 N -7.788 5.853 -6.024 1.00 . A A . 7 HIS ND1 1 1 10 2693 1 1 7 HIS NE2 N -7.770 4.422 -7.619 1.00 . A A . 7 HIS NE2 1 1 10 2694 1 1 7 HIS O O -6.535 8.089 -3.538 1.00 . A A . 7 HIS O 1 1 10 2695 1 1 8 ALA C C -4.720 9.995 -1.725 1.00 . A A . 8 ALA C 1 1 10 2696 1 1 8 ALA CA C -4.722 8.490 -1.482 1.00 . A A . 8 ALA CA 1 1 10 2697 1 1 8 ALA CB C -3.687 8.122 -0.429 1.00 . A A . 8 ALA CB 1 1 10 2698 1 1 8 ALA H H -3.583 7.361 -2.864 1.00 . A A . 8 ALA H 1 1 10 2699 1 1 8 ALA HA H -5.694 8.196 -1.115 1.00 . A A . 8 ALA HA 1 1 10 2700 1 1 8 ALA HB1 H -4.116 8.249 0.555 1.00 . A A . 8 ALA HB1 1 1 10 2701 1 1 8 ALA HB2 H -3.388 7.093 -0.562 1.00 . A A . 8 ALA HB2 1 1 10 2702 1 1 8 ALA HB3 H -2.825 8.764 -0.532 1.00 . A A . 8 ALA HB3 1 1 10 2703 1 1 8 ALA N N -4.467 7.759 -2.717 1.00 . A A . 8 ALA N 1 1 10 2704 1 1 8 ALA O O -5.308 10.759 -0.959 1.00 . A A . 8 ALA O 1 1 10 2705 1 1 9 PHE C C -5.359 12.392 -3.461 1.00 . A A . 9 PHE C 1 1 10 2706 1 1 9 PHE CA C -3.976 11.832 -3.139 1.00 . A A . 9 PHE CA 1 1 10 2707 1 1 9 PHE CB C -3.040 12.037 -4.332 1.00 . A A . 9 PHE CB 1 1 10 2708 1 1 9 PHE CD1 C -2.112 14.354 -4.074 1.00 . A A . 9 PHE CD1 1 1 10 2709 1 1 9 PHE CD2 C -0.642 12.503 -3.759 1.00 . A A . 9 PHE CD2 1 1 10 2710 1 1 9 PHE CE1 C -1.072 15.227 -3.815 1.00 . A A . 9 PHE CE1 1 1 10 2711 1 1 9 PHE CE2 C 0.402 13.372 -3.499 1.00 . A A . 9 PHE CE2 1 1 10 2712 1 1 9 PHE CG C -1.908 12.984 -4.050 1.00 . A A . 9 PHE CG 1 1 10 2713 1 1 9 PHE CZ C 0.186 14.735 -3.526 1.00 . A A . 9 PHE CZ 1 1 10 2714 1 1 9 PHE H H -3.607 9.759 -3.370 1.00 . A A . 9 PHE H 1 1 10 2715 1 1 9 PHE HA H -3.578 12.357 -2.285 1.00 . A A . 9 PHE HA 1 1 10 2716 1 1 9 PHE HB2 H -2.614 11.087 -4.614 1.00 . A A . 9 PHE HB2 1 1 10 2717 1 1 9 PHE HB3 H -3.607 12.434 -5.161 1.00 . A A . 9 PHE HB3 1 1 10 2718 1 1 9 PHE HD1 H -3.095 14.741 -4.298 1.00 . A A . 9 PHE HD1 1 1 10 2719 1 1 9 PHE HD2 H -0.472 11.436 -3.738 1.00 . A A . 9 PHE HD2 1 1 10 2720 1 1 9 PHE HE1 H -1.244 16.293 -3.836 1.00 . A A . 9 PHE HE1 1 1 10 2721 1 1 9 PHE HE2 H 1.384 12.983 -3.274 1.00 . A A . 9 PHE HE2 1 1 10 2722 1 1 9 PHE HZ H 1.000 15.416 -3.324 1.00 . A A . 9 PHE HZ 1 1 10 2723 1 1 9 PHE N N -4.055 10.416 -2.796 1.00 . A A . 9 PHE N 1 1 10 2724 1 1 9 PHE O O -5.612 13.584 -3.290 1.00 . A A . 9 PHE O 1 1 10 2725 1 1 10 ARG C C -8.439 12.168 -3.020 1.00 . A A . 10 ARG C 1 1 10 2726 1 1 10 ARG CA C -7.605 11.929 -4.275 1.00 . A A . 10 ARG CA 1 1 10 2727 1 1 10 ARG CB C -8.272 10.865 -5.149 1.00 . A A . 10 ARG CB 1 1 10 2728 1 1 10 ARG CD C -9.441 10.335 -7.309 1.00 . A A . 10 ARG CD 1 1 10 2729 1 1 10 ARG CG C -8.992 11.435 -6.360 1.00 . A A . 10 ARG CG 1 1 10 2730 1 1 10 ARG CZ C -11.584 9.579 -6.371 1.00 . A A . 10 ARG CZ 1 1 10 2731 1 1 10 ARG H H -5.987 10.585 -4.042 1.00 . A A . 10 ARG H 1 1 10 2732 1 1 10 ARG HA H -7.542 12.852 -4.832 1.00 . A A . 10 ARG HA 1 1 10 2733 1 1 10 ARG HB2 H -7.516 10.177 -5.498 1.00 . A A . 10 ARG HB2 1 1 10 2734 1 1 10 ARG HB3 H -8.990 10.325 -4.551 1.00 . A A . 10 ARG HB3 1 1 10 2735 1 1 10 ARG HD2 H -9.983 10.784 -8.128 1.00 . A A . 10 ARG HD2 1 1 10 2736 1 1 10 ARG HD3 H -8.567 9.829 -7.691 1.00 . A A . 10 ARG HD3 1 1 10 2737 1 1 10 ARG HE H -9.907 8.499 -6.399 1.00 . A A . 10 ARG HE 1 1 10 2738 1 1 10 ARG HG2 H -9.860 11.983 -6.026 1.00 . A A . 10 ARG HG2 1 1 10 2739 1 1 10 ARG HG3 H -8.323 12.101 -6.884 1.00 . A A . 10 ARG HG3 1 1 10 2740 1 1 10 ARG HH11 H -11.608 11.442 -7.152 1.00 . A A . 10 ARG HH11 1 1 10 2741 1 1 10 ARG HH12 H -13.112 10.897 -6.488 1.00 . A A . 10 ARG HH12 1 1 10 2742 1 1 10 ARG HH21 H -11.882 7.769 -5.521 1.00 . A A . 10 ARG HH21 1 1 10 2743 1 1 10 ARG HH22 H -13.266 8.808 -5.560 1.00 . A A . 10 ARG HH22 1 1 10 2744 1 1 10 ARG N N -6.249 11.522 -3.928 1.00 . A A . 10 ARG N 1 1 10 2745 1 1 10 ARG NE N -10.303 9.360 -6.648 1.00 . A A . 10 ARG NE 1 1 10 2746 1 1 10 ARG NH1 N -12.147 10.734 -6.697 1.00 . A A . 10 ARG NH1 1 1 10 2747 1 1 10 ARG NH2 N -12.303 8.642 -5.768 1.00 . A A . 10 ARG NH2 1 1 10 2748 1 1 10 ARG O O -9.383 12.956 -3.065 1.00 . A A . 10 ARG O 1 1 10 2749 1 1 11 . C C -8.744 13.075 -0.193 1.00 . A A . 11 SEP C 1 1 10 2750 1 1 11 . CA C -8.821 11.642 -0.654 1.00 . A A . 11 SEP CA 1 1 10 2751 1 1 11 . CB C -8.324 10.588 0.380 1.00 . A A . 11 SEP CB 1 1 10 2752 1 1 11 . H H -7.292 10.857 -1.968 1.00 . A A . 11 SEP H 1 1 10 2753 1 1 11 . HA H -9.881 11.421 -0.878 1.00 . A A . 11 SEP HA 1 1 10 2754 1 1 11 . HB2 H -8.668 9.566 0.136 1.00 . A A . 11 SEP HB2 1 1 10 2755 1 1 11 . HB3 H -7.219 10.505 0.389 1.00 . A A . 11 SEP HB3 1 1 10 2756 1 1 11 . N N -8.078 11.490 -1.940 1.00 . A A . 11 SEP N 1 1 10 2757 1 1 11 . O O -9.689 13.645 0.350 1.00 . A A . 11 SEP O 1 1 10 2758 1 1 11 . O1P O -9.603 9.885 3.911 1.00 . A A . 11 SEP O1P 1 1 10 2759 1 1 11 . O2P O -11.244 10.921 2.361 1.00 . A A . 11 SEP O2P 1 1 10 2760 1 1 11 . O3P O -10.178 8.736 1.749 1.00 . A A . 11 SEP O3P 1 1 10 2761 1 1 11 . OG O -8.788 10.910 1.712 1.00 . A A . 11 SEP OG 1 1 10 2762 1 1 11 . P P -9.968 10.076 2.443 1.00 . A A . 11 SEP P 1 1 10 2763 1 1 12 MET C C -8.124 16.008 -0.931 1.00 . A A . 12 MET C 1 1 10 2764 1 1 12 MET CA C -7.335 15.053 -0.041 1.00 . A A . 12 MET CA 1 1 10 2765 1 1 12 MET CB C -5.841 15.375 -0.126 1.00 . A A . 12 MET CB 1 1 10 2766 1 1 12 MET CE C -3.724 17.997 1.903 1.00 . A A . 12 MET CE 1 1 10 2767 1 1 12 MET CG C -5.230 15.777 1.206 1.00 . A A . 12 MET CG 1 1 10 2768 1 1 12 MET H H -6.860 13.160 -0.860 1.00 . A A . 12 MET H 1 1 10 2769 1 1 12 MET HA H -7.663 15.177 0.980 1.00 . A A . 12 MET HA 1 1 10 2770 1 1 12 MET HB2 H -5.318 14.504 -0.490 1.00 . A A . 12 MET HB2 1 1 10 2771 1 1 12 MET HB3 H -5.699 16.188 -0.822 1.00 . A A . 12 MET HB3 1 1 10 2772 1 1 12 MET HE1 H -2.831 18.586 1.756 1.00 . A A . 12 MET HE1 1 1 10 2773 1 1 12 MET HE2 H -4.578 18.536 1.520 1.00 . A A . 12 MET HE2 1 1 10 2774 1 1 12 MET HE3 H -3.861 17.807 2.957 1.00 . A A . 12 MET HE3 1 1 10 2775 1 1 12 MET HG2 H -5.855 16.530 1.662 1.00 . A A . 12 MET HG2 1 1 10 2776 1 1 12 MET HG3 H -5.193 14.907 1.846 1.00 . A A . 12 MET HG3 1 1 10 2777 1 1 12 MET N N -7.576 13.666 -0.423 1.00 . A A . 12 MET N 1 1 10 2778 1 1 12 MET O O -8.451 17.123 -0.525 1.00 . A A . 12 MET O 1 1 10 2779 1 1 12 MET SD S -3.562 16.439 1.033 1.00 . A A . 12 MET SD 1 1 10 2780 1 1 13 PHE C C -10.629 16.527 -2.654 1.00 . A A . 13 PHE C 1 1 10 2781 1 1 13 PHE CA C -9.176 16.379 -3.095 1.00 . A A . 13 PHE CA 1 1 10 2782 1 1 13 PHE CB C -9.115 15.759 -4.492 1.00 . A A . 13 PHE CB 1 1 10 2783 1 1 13 PHE CD1 C -6.836 16.643 -5.057 1.00 . A A . 13 PHE CD1 1 1 10 2784 1 1 13 PHE CD2 C -8.588 16.931 -6.648 1.00 . A A . 13 PHE CD2 1 1 10 2785 1 1 13 PHE CE1 C -5.956 17.287 -5.906 1.00 . A A . 13 PHE CE1 1 1 10 2786 1 1 13 PHE CE2 C -7.713 17.576 -7.501 1.00 . A A . 13 PHE CE2 1 1 10 2787 1 1 13 PHE CG C -8.161 16.459 -5.417 1.00 . A A . 13 PHE CG 1 1 10 2788 1 1 13 PHE CZ C -6.394 17.753 -7.130 1.00 . A A . 13 PHE CZ 1 1 10 2789 1 1 13 PHE H H -8.137 14.665 -2.412 1.00 . A A . 13 PHE H 1 1 10 2790 1 1 13 PHE HA H -8.719 17.356 -3.123 1.00 . A A . 13 PHE HA 1 1 10 2791 1 1 13 PHE HB2 H -8.801 14.730 -4.409 1.00 . A A . 13 PHE HB2 1 1 10 2792 1 1 13 PHE HB3 H -10.098 15.797 -4.937 1.00 . A A . 13 PHE HB3 1 1 10 2793 1 1 13 PHE HD1 H -6.491 16.279 -4.100 1.00 . A A . 13 PHE HD1 1 1 10 2794 1 1 13 PHE HD2 H -9.620 16.793 -6.939 1.00 . A A . 13 PHE HD2 1 1 10 2795 1 1 13 PHE HE1 H -4.925 17.424 -5.613 1.00 . A A . 13 PHE HE1 1 1 10 2796 1 1 13 PHE HE2 H -8.059 17.938 -8.457 1.00 . A A . 13 PHE HE2 1 1 10 2797 1 1 13 PHE HZ H -5.709 18.257 -7.795 1.00 . A A . 13 PHE HZ 1 1 10 2798 1 1 13 PHE N N -8.426 15.563 -2.147 1.00 . A A . 13 PHE N 1 1 10 2799 1 1 13 PHE O O -11.133 15.770 -1.824 1.00 . A A . 13 PHE O 1 1 10 2800 1 1 14 PRO C C -13.668 16.774 -3.523 1.00 . A A . 14 PRO C 1 1 10 2801 1 1 14 PRO CA C -12.725 17.799 -2.904 1.00 . A A . 14 PRO CA 1 1 10 2802 1 1 14 PRO CB C -12.964 19.183 -3.513 1.00 . A A . 14 PRO CB 1 1 10 2803 1 1 14 PRO CD C -10.783 18.468 -4.219 1.00 . A A . 14 PRO CD 1 1 10 2804 1 1 14 PRO CG C -11.972 19.287 -4.619 1.00 . A A . 14 PRO CG 1 1 10 2805 1 1 14 PRO HA H -12.889 17.840 -1.837 1.00 . A A . 14 PRO HA 1 1 10 2806 1 1 14 PRO HB2 H -13.978 19.245 -3.883 1.00 . A A . 14 PRO HB2 1 1 10 2807 1 1 14 PRO HB3 H -12.802 19.943 -2.763 1.00 . A A . 14 PRO HB3 1 1 10 2808 1 1 14 PRO HD2 H -10.401 17.941 -5.081 1.00 . A A . 14 PRO HD2 1 1 10 2809 1 1 14 PRO HD3 H -10.014 19.091 -3.785 1.00 . A A . 14 PRO HD3 1 1 10 2810 1 1 14 PRO HG2 H -12.396 18.896 -5.531 1.00 . A A . 14 PRO HG2 1 1 10 2811 1 1 14 PRO HG3 H -11.678 20.318 -4.752 1.00 . A A . 14 PRO HG3 1 1 10 2812 1 1 14 PRO N N -11.320 17.527 -3.222 1.00 . A A . 14 PRO N 1 1 10 2813 1 1 14 PRO O O -14.831 16.670 -3.132 1.00 . A A . 14 PRO O 1 1 10 2814 1 1 15 SER C C -14.258 13.834 -4.232 1.00 . A A . 15 SER C 1 1 10 2815 1 1 15 SER CA C -13.960 15.002 -5.167 1.00 . A A . 15 SER CA 1 1 10 2816 1 1 15 SER CB C -13.233 14.498 -6.415 1.00 . A A . 15 SER CB 1 1 10 2817 1 1 15 SER H H -12.227 16.148 -4.759 1.00 . A A . 15 SER H 1 1 10 2818 1 1 15 SER HA H -14.893 15.458 -5.463 1.00 . A A . 15 SER HA 1 1 10 2819 1 1 15 SER HB2 H -12.601 13.665 -6.149 1.00 . A A . 15 SER HB2 1 1 10 2820 1 1 15 SER HB3 H -13.961 14.179 -7.148 1.00 . A A . 15 SER HB3 1 1 10 2821 1 1 15 SER HG H -12.328 15.358 -7.925 1.00 . A A . 15 SER HG 1 1 10 2822 1 1 15 SER N N -13.161 16.018 -4.491 1.00 . A A . 15 SER N 1 1 10 2823 1 1 15 SER O O -15.259 13.136 -4.392 1.00 . A A . 15 SER O 1 1 10 2824 1 1 15 SER OG O -12.429 15.517 -6.984 1.00 . A A . 15 SER OG 1 1 10 2825 1 1 16 SER C C -14.721 12.819 -1.360 1.00 . A A . 16 SER C 1 1 10 2826 1 1 16 SER CA C -13.547 12.543 -2.295 1.00 . A A . 16 SER CA 1 1 10 2827 1 1 16 SER CB C -12.266 12.354 -1.480 1.00 . A A . 16 SER CB 1 1 10 2828 1 1 16 SER H H -12.603 14.219 -3.179 1.00 . A A . 16 SER H 1 1 10 2829 1 1 16 SER HA H -13.748 11.638 -2.849 1.00 . A A . 16 SER HA 1 1 10 2830 1 1 16 SER HB2 H -12.294 11.395 -0.986 1.00 . A A . 16 SER HB2 1 1 10 2831 1 1 16 SER HB3 H -11.413 12.394 -2.142 1.00 . A A . 16 SER HB3 1 1 10 2832 1 1 16 SER HG H -11.446 13.120 0.126 1.00 . A A . 16 SER HG 1 1 10 2833 1 1 16 SER N N -13.381 13.629 -3.254 1.00 . A A . 16 SER N 1 1 10 2834 1 1 16 SER O O -15.361 11.894 -0.862 1.00 . A A . 16 SER O 1 1 10 2835 1 1 16 SER OG O -12.130 13.369 -0.500 1.00 . A A . 16 SER OG 1 1 10 2836 1 1 17 GLU C C -17.413 14.539 -1.020 1.00 . A A . 17 GLU C 1 1 10 2837 1 1 17 GLU CA C -16.094 14.496 -0.254 1.00 . A A . 17 GLU CA 1 1 10 2838 1 1 17 GLU CB C -15.808 15.864 0.369 1.00 . A A . 17 GLU CB 1 1 10 2839 1 1 17 GLU CD C -15.084 16.829 2.588 1.00 . A A . 17 GLU CD 1 1 10 2840 1 1 17 GLU CG C -14.790 15.820 1.495 1.00 . A A . 17 GLU CG 1 1 10 2841 1 1 17 GLU H H -14.451 14.791 -1.556 1.00 . A A . 17 GLU H 1 1 10 2842 1 1 17 GLU HA H -16.173 13.762 0.534 1.00 . A A . 17 GLU HA 1 1 10 2843 1 1 17 GLU HB2 H -15.436 16.526 -0.400 1.00 . A A . 17 GLU HB2 1 1 10 2844 1 1 17 GLU HB3 H -16.731 16.267 0.761 1.00 . A A . 17 GLU HB3 1 1 10 2845 1 1 17 GLU HG2 H -14.795 14.831 1.929 1.00 . A A . 17 GLU HG2 1 1 10 2846 1 1 17 GLU HG3 H -13.812 16.028 1.087 1.00 . A A . 17 GLU HG3 1 1 10 2847 1 1 17 GLU N N -14.997 14.098 -1.129 1.00 . A A . 17 GLU N 1 1 10 2848 1 1 17 GLU O O -17.707 13.650 -1.818 1.00 . A A . 17 GLU O 1 1 10 2849 1 1 17 GLU OE1 O -14.884 18.038 2.347 1.00 . A A . 17 GLU OE1 1 1 10 2850 1 1 17 GLU OE2 O -15.514 16.411 3.683 1.00 . A A . 17 GLU OE2 1 1 11 2851 1 1 1 ARG C C 2.651 1.847 -2.345 1.00 . A A . 1 ARG C 1 1 11 2852 1 1 1 ARG CA C 2.800 0.394 -1.904 1.00 . A A . 1 ARG CA 1 1 11 2853 1 1 1 ARG CB C 1.657 0.017 -0.959 1.00 . A A . 1 ARG CB 1 1 11 2854 1 1 1 ARG CD C 2.293 -0.325 1.448 1.00 . A A . 1 ARG CD 1 1 11 2855 1 1 1 ARG CG C 1.766 0.658 0.414 1.00 . A A . 1 ARG CG 1 1 11 2856 1 1 1 ARG CZ C 1.959 -0.866 3.823 1.00 . A A . 1 ARG CZ 1 1 11 2857 1 1 1 ARG H1 H 4.641 -0.581 -1.532 1.00 . A A . 1 ARG H1 1 1 11 2858 1 1 1 ARG HA H 2.758 -0.240 -2.777 1.00 . A A . 1 ARG HA 1 1 11 2859 1 1 1 ARG HB2 H 0.722 0.326 -1.403 1.00 . A A . 1 ARG HB2 1 1 11 2860 1 1 1 ARG HB3 H 1.650 -1.055 -0.833 1.00 . A A . 1 ARG HB3 1 1 11 2861 1 1 1 ARG HD2 H 2.090 -1.329 1.106 1.00 . A A . 1 ARG HD2 1 1 11 2862 1 1 1 ARG HD3 H 3.359 -0.187 1.545 1.00 . A A . 1 ARG HD3 1 1 11 2863 1 1 1 ARG HE H 0.999 0.577 2.837 1.00 . A A . 1 ARG HE 1 1 11 2864 1 1 1 ARG HG2 H 2.442 1.499 0.357 1.00 . A A . 1 ARG HG2 1 1 11 2865 1 1 1 ARG HG3 H 0.789 1.000 0.720 1.00 . A A . 1 ARG HG3 1 1 11 2866 1 1 1 ARG HH11 H 3.324 -2.013 2.873 1.00 . A A . 1 ARG HH11 1 1 11 2867 1 1 1 ARG HH12 H 3.080 -2.384 4.547 1.00 . A A . 1 ARG HH12 1 1 11 2868 1 1 1 ARG HH21 H 0.668 0.098 5.042 1.00 . A A . 1 ARG HH21 1 1 11 2869 1 1 1 ARG HH22 H 1.568 -1.183 5.780 1.00 . A A . 1 ARG HH22 1 1 11 2870 1 1 1 ARG N N 4.087 0.178 -1.254 1.00 . A A . 1 ARG N 1 1 11 2871 1 1 1 ARG NE N 1.668 -0.133 2.754 1.00 . A A . 1 ARG NE 1 1 11 2872 1 1 1 ARG NH1 N 2.861 -1.835 3.741 1.00 . A A . 1 ARG NH1 1 1 11 2873 1 1 1 ARG NH2 N 1.348 -0.631 4.977 1.00 . A A . 1 ARG NH2 1 1 11 2874 1 1 1 ARG O O 1.868 2.604 -1.771 1.00 . A A . 1 ARG O 1 1 11 2875 1 1 2 SER C C 2.237 3.755 -4.899 1.00 . A A . 2 SER C 1 1 11 2876 1 1 2 SER CA C 3.364 3.594 -3.884 1.00 . A A . 2 SER CA 1 1 11 2877 1 1 2 SER CB C 4.702 3.962 -4.528 1.00 . A A . 2 SER CB 1 1 11 2878 1 1 2 SER H H 4.013 1.581 -3.784 1.00 . A A . 2 SER H 1 1 11 2879 1 1 2 SER HA H 3.181 4.257 -3.051 1.00 . A A . 2 SER HA 1 1 11 2880 1 1 2 SER HB2 H 4.557 4.791 -5.204 1.00 . A A . 2 SER HB2 1 1 11 2881 1 1 2 SER HB3 H 5.404 4.244 -3.757 1.00 . A A . 2 SER HB3 1 1 11 2882 1 1 2 SER HG H 6.157 2.744 -5.016 1.00 . A A . 2 SER HG 1 1 11 2883 1 1 2 SER N N 3.409 2.231 -3.368 1.00 . A A . 2 SER N 1 1 11 2884 1 1 2 SER O O 1.633 4.822 -5.010 1.00 . A A . 2 SER O 1 1 11 2885 1 1 2 SER OG O 5.236 2.868 -5.255 1.00 . A A . 2 SER OG 1 1 11 2886 1 1 3 LYS C C -0.474 2.731 -5.987 1.00 . A A . 3 LYS C 1 1 11 2887 1 1 3 LYS CA C 0.902 2.705 -6.643 1.00 . A A . 3 LYS CA 1 1 11 2888 1 1 3 LYS CB C 1.020 1.484 -7.559 1.00 . A A . 3 LYS CB 1 1 11 2889 1 1 3 LYS CD C 0.597 1.256 -10.024 1.00 . A A . 3 LYS CD 1 1 11 2890 1 1 3 LYS CE C 0.670 2.072 -11.306 1.00 . A A . 3 LYS CE 1 1 11 2891 1 1 3 LYS CG C 1.519 1.816 -8.954 1.00 . A A . 3 LYS CG 1 1 11 2892 1 1 3 LYS H H 2.474 1.864 -5.502 1.00 . A A . 3 LYS H 1 1 11 2893 1 1 3 LYS HA H 1.023 3.600 -7.234 1.00 . A A . 3 LYS HA 1 1 11 2894 1 1 3 LYS HB2 H 1.705 0.779 -7.112 1.00 . A A . 3 LYS HB2 1 1 11 2895 1 1 3 LYS HB3 H 0.047 1.022 -7.648 1.00 . A A . 3 LYS HB3 1 1 11 2896 1 1 3 LYS HD2 H 0.888 0.239 -10.242 1.00 . A A . 3 LYS HD2 1 1 11 2897 1 1 3 LYS HD3 H -0.419 1.270 -9.655 1.00 . A A . 3 LYS HD3 1 1 11 2898 1 1 3 LYS HE2 H 1.468 2.793 -11.213 1.00 . A A . 3 LYS HE2 1 1 11 2899 1 1 3 LYS HE3 H 0.880 1.406 -12.130 1.00 . A A . 3 LYS HE3 1 1 11 2900 1 1 3 LYS HG2 H 1.569 2.889 -9.063 1.00 . A A . 3 LYS HG2 1 1 11 2901 1 1 3 LYS HG3 H 2.505 1.393 -9.084 1.00 . A A . 3 LYS HG3 1 1 11 2902 1 1 3 LYS HZ1 H -1.386 2.113 -11.672 1.00 . A A . 3 LYS HZ1 1 1 11 2903 1 1 3 LYS HZ2 H -0.525 3.338 -12.459 1.00 . A A . 3 LYS HZ2 1 1 11 2904 1 1 3 LYS HZ3 H -0.819 3.446 -10.797 1.00 . A A . 3 LYS HZ3 1 1 11 2905 1 1 3 LYS N N 1.958 2.686 -5.638 1.00 . A A . 3 LYS N 1 1 11 2906 1 1 3 LYS NZ N -0.605 2.793 -11.577 1.00 . A A . 3 LYS NZ 1 1 11 2907 1 1 3 LYS O O -1.440 3.228 -6.568 1.00 . A A . 3 LYS O 1 1 11 2908 1 1 4 ASP C C -2.029 3.456 -3.265 1.00 . A A . 4 ASP C 1 1 11 2909 1 1 4 ASP CA C -1.815 2.159 -4.039 1.00 . A A . 4 ASP CA 1 1 11 2910 1 1 4 ASP CB C -1.835 0.969 -3.078 1.00 . A A . 4 ASP CB 1 1 11 2911 1 1 4 ASP CG C -2.592 -0.217 -3.643 1.00 . A A . 4 ASP CG 1 1 11 2912 1 1 4 ASP H H 0.248 1.815 -4.365 1.00 . A A . 4 ASP H 1 1 11 2913 1 1 4 ASP HA H -2.615 2.046 -4.754 1.00 . A A . 4 ASP HA 1 1 11 2914 1 1 4 ASP HB2 H -0.820 0.661 -2.876 1.00 . A A . 4 ASP HB2 1 1 11 2915 1 1 4 ASP HB3 H -2.308 1.268 -2.154 1.00 . A A . 4 ASP HB3 1 1 11 2916 1 1 4 ASP N N -0.557 2.195 -4.775 1.00 . A A . 4 ASP N 1 1 11 2917 1 1 4 ASP O O -3.164 3.854 -2.999 1.00 . A A . 4 ASP O 1 1 11 2918 1 1 4 ASP OD1 O -2.253 -0.661 -4.760 1.00 . A A . 4 ASP OD1 1 1 11 2919 1 1 4 ASP OD2 O -3.523 -0.703 -2.967 1.00 . A A . 4 ASP OD2 1 1 11 2920 1 1 5 LEU C C -1.419 6.516 -3.067 1.00 . A A . 5 LEU C 1 1 11 2921 1 1 5 LEU CA C -0.998 5.364 -2.159 1.00 . A A . 5 LEU CA 1 1 11 2922 1 1 5 LEU CB C 0.357 5.673 -1.520 1.00 . A A . 5 LEU CB 1 1 11 2923 1 1 5 LEU CD1 C 0.369 4.524 0.708 1.00 . A A . 5 LEU CD1 1 1 11 2924 1 1 5 LEU CD2 C 1.544 6.714 0.427 1.00 . A A . 5 LEU CD2 1 1 11 2925 1 1 5 LEU CG C 0.355 5.868 -0.003 1.00 . A A . 5 LEU CG 1 1 11 2926 1 1 5 LEU H H -0.055 3.746 -3.144 1.00 . A A . 5 LEU H 1 1 11 2927 1 1 5 LEU HA H -1.736 5.247 -1.380 1.00 . A A . 5 LEU HA 1 1 11 2928 1 1 5 LEU HB2 H 1.024 4.855 -1.747 1.00 . A A . 5 LEU HB2 1 1 11 2929 1 1 5 LEU HB3 H 0.736 6.580 -1.971 1.00 . A A . 5 LEU HB3 1 1 11 2930 1 1 5 LEU HD11 H -0.386 3.883 0.279 1.00 . A A . 5 LEU HD11 1 1 11 2931 1 1 5 LEU HD12 H 0.163 4.671 1.758 1.00 . A A . 5 LEU HD12 1 1 11 2932 1 1 5 LEU HD13 H 1.340 4.066 0.592 1.00 . A A . 5 LEU HD13 1 1 11 2933 1 1 5 LEU HD21 H 2.457 6.255 0.079 1.00 . A A . 5 LEU HD21 1 1 11 2934 1 1 5 LEU HD22 H 1.564 6.784 1.505 1.00 . A A . 5 LEU HD22 1 1 11 2935 1 1 5 LEU HD23 H 1.454 7.704 0.004 1.00 . A A . 5 LEU HD23 1 1 11 2936 1 1 5 LEU HG H -0.548 6.389 0.285 1.00 . A A . 5 LEU HG 1 1 11 2937 1 1 5 LEU N N -0.931 4.112 -2.904 1.00 . A A . 5 LEU N 1 1 11 2938 1 1 5 LEU O O -2.012 7.494 -2.611 1.00 . A A . 5 LEU O 1 1 11 2939 1 1 6 ARG C C -2.959 7.697 -5.312 1.00 . A A . 6 ARG C 1 1 11 2940 1 1 6 ARG CA C -1.458 7.422 -5.325 1.00 . A A . 6 ARG CA 1 1 11 2941 1 1 6 ARG CB C -1.019 6.998 -6.728 1.00 . A A . 6 ARG CB 1 1 11 2942 1 1 6 ARG CD C -0.420 7.693 -9.068 1.00 . A A . 6 ARG CD 1 1 11 2943 1 1 6 ARG CG C -0.958 8.148 -7.720 1.00 . A A . 6 ARG CG 1 1 11 2944 1 1 6 ARG CZ C 1.659 7.919 -10.361 1.00 . A A . 6 ARG CZ 1 1 11 2945 1 1 6 ARG H H -0.637 5.589 -4.656 1.00 . A A . 6 ARG H 1 1 11 2946 1 1 6 ARG HA H -0.936 8.326 -5.051 1.00 . A A . 6 ARG HA 1 1 11 2947 1 1 6 ARG HB2 H -0.036 6.553 -6.666 1.00 . A A . 6 ARG HB2 1 1 11 2948 1 1 6 ARG HB3 H -1.715 6.264 -7.103 1.00 . A A . 6 ARG HB3 1 1 11 2949 1 1 6 ARG HD2 H -0.269 6.625 -9.038 1.00 . A A . 6 ARG HD2 1 1 11 2950 1 1 6 ARG HD3 H -1.146 7.933 -9.830 1.00 . A A . 6 ARG HD3 1 1 11 2951 1 1 6 ARG HE H 1.103 9.129 -8.876 1.00 . A A . 6 ARG HE 1 1 11 2952 1 1 6 ARG HG2 H -1.953 8.545 -7.858 1.00 . A A . 6 ARG HG2 1 1 11 2953 1 1 6 ARG HG3 H -0.312 8.918 -7.325 1.00 . A A . 6 ARG HG3 1 1 11 2954 1 1 6 ARG HH11 H 0.483 6.370 -10.905 1.00 . A A . 6 ARG HH11 1 1 11 2955 1 1 6 ARG HH12 H 1.951 6.540 -11.809 1.00 . A A . 6 ARG HH12 1 1 11 2956 1 1 6 ARG HH21 H 3.039 9.365 -10.059 1.00 . A A . 6 ARG HH21 1 1 11 2957 1 1 6 ARG HH22 H 3.405 8.244 -11.326 1.00 . A A . 6 ARG HH22 1 1 11 2958 1 1 6 ARG N N -1.111 6.392 -4.353 1.00 . A A . 6 ARG N 1 1 11 2959 1 1 6 ARG NE N 0.847 8.341 -9.398 1.00 . A A . 6 ARG NE 1 1 11 2960 1 1 6 ARG NH1 N 1.338 6.855 -11.084 1.00 . A A . 6 ARG NH1 1 1 11 2961 1 1 6 ARG NH2 N 2.794 8.562 -10.602 1.00 . A A . 6 ARG NH2 1 1 11 2962 1 1 6 ARG O O -3.397 8.821 -5.562 1.00 . A A . 6 ARG O 1 1 11 2963 1 1 7 HIS C C -5.636 7.510 -3.700 1.00 . A A . 7 HIS C 1 1 11 2964 1 1 7 HIS CA C -5.194 6.795 -4.973 1.00 . A A . 7 HIS CA 1 1 11 2965 1 1 7 HIS CB C -5.854 5.418 -5.054 1.00 . A A . 7 HIS CB 1 1 11 2966 1 1 7 HIS CD2 C -5.360 5.221 -7.593 1.00 . A A . 7 HIS CD2 1 1 11 2967 1 1 7 HIS CE1 C -6.899 3.748 -8.106 1.00 . A A . 7 HIS CE1 1 1 11 2968 1 1 7 HIS CG C -6.028 4.918 -6.455 1.00 . A A . 7 HIS CG 1 1 11 2969 1 1 7 HIS H H -3.335 5.794 -4.829 1.00 . A A . 7 HIS H 1 1 11 2970 1 1 7 HIS HA H -5.502 7.382 -5.826 1.00 . A A . 7 HIS HA 1 1 11 2971 1 1 7 HIS HB2 H -5.246 4.703 -4.520 1.00 . A A . 7 HIS HB2 1 1 11 2972 1 1 7 HIS HB3 H -6.831 5.467 -4.595 1.00 . A A . 7 HIS HB3 1 1 11 2973 1 1 7 HIS HD1 H -7.634 3.578 -6.204 1.00 . A A . 7 HIS HD1 1 1 11 2974 1 1 7 HIS HD2 H -4.537 5.916 -7.688 1.00 . A A . 7 HIS HD2 1 1 11 2975 1 1 7 HIS HE1 H -7.523 3.064 -8.663 1.00 . A A . 7 HIS HE1 1 1 11 2976 1 1 7 HIS N N -3.742 6.664 -5.019 1.00 . A A . 7 HIS N 1 1 11 2977 1 1 7 HIS ND1 N -6.987 3.993 -6.811 1.00 . A A . 7 HIS ND1 1 1 11 2978 1 1 7 HIS NE2 N -5.920 4.480 -8.604 1.00 . A A . 7 HIS NE2 1 1 11 2979 1 1 7 HIS O O -6.750 8.027 -3.621 1.00 . A A . 7 HIS O 1 1 11 2980 1 1 8 ALA C C -4.968 9.704 -1.565 1.00 . A A . 8 ALA C 1 1 11 2981 1 1 8 ALA CA C -5.053 8.187 -1.436 1.00 . A A . 8 ALA CA 1 1 11 2982 1 1 8 ALA CB C -4.105 7.693 -0.353 1.00 . A A . 8 ALA CB 1 1 11 2983 1 1 8 ALA H H -3.883 7.105 -2.828 1.00 . A A . 8 ALA H 1 1 11 2984 1 1 8 ALA HA H -6.059 7.916 -1.150 1.00 . A A . 8 ALA HA 1 1 11 2985 1 1 8 ALA HB1 H -3.278 8.381 -0.259 1.00 . A A . 8 ALA HB1 1 1 11 2986 1 1 8 ALA HB2 H -4.633 7.633 0.587 1.00 . A A . 8 ALA HB2 1 1 11 2987 1 1 8 ALA HB3 H -3.732 6.716 -0.620 1.00 . A A . 8 ALA HB3 1 1 11 2988 1 1 8 ALA N N -4.755 7.534 -2.705 1.00 . A A . 8 ALA N 1 1 11 2989 1 1 8 ALA O O -5.567 10.439 -0.780 1.00 . A A . 8 ALA O 1 1 11 2990 1 1 9 PHE C C -5.385 12.247 -3.157 1.00 . A A . 9 PHE C 1 1 11 2991 1 1 9 PHE CA C -4.053 11.597 -2.791 1.00 . A A . 9 PHE CA 1 1 11 2992 1 1 9 PHE CB C -3.031 11.841 -3.904 1.00 . A A . 9 PHE CB 1 1 11 2993 1 1 9 PHE CD1 C -1.019 10.656 -2.986 1.00 . A A . 9 PHE CD1 1 1 11 2994 1 1 9 PHE CD2 C -0.860 12.998 -3.408 1.00 . A A . 9 PHE CD2 1 1 11 2995 1 1 9 PHE CE1 C 0.291 10.644 -2.543 1.00 . A A . 9 PHE CE1 1 1 11 2996 1 1 9 PHE CE2 C 0.450 12.991 -2.967 1.00 . A A . 9 PHE CE2 1 1 11 2997 1 1 9 PHE CG C -1.608 11.831 -3.423 1.00 . A A . 9 PHE CG 1 1 11 2998 1 1 9 PHE CZ C 1.025 11.813 -2.533 1.00 . A A . 9 PHE CZ 1 1 11 2999 1 1 9 PHE H H -3.765 9.531 -3.154 1.00 . A A . 9 PHE H 1 1 11 3000 1 1 9 PHE HA H -3.690 12.040 -1.877 1.00 . A A . 9 PHE HA 1 1 11 3001 1 1 9 PHE HB2 H -3.133 11.070 -4.652 1.00 . A A . 9 PHE HB2 1 1 11 3002 1 1 9 PHE HB3 H -3.224 12.803 -4.355 1.00 . A A . 9 PHE HB3 1 1 11 3003 1 1 9 PHE HD1 H -1.594 9.741 -2.993 1.00 . A A . 9 PHE HD1 1 1 11 3004 1 1 9 PHE HD2 H -1.309 13.920 -3.747 1.00 . A A . 9 PHE HD2 1 1 11 3005 1 1 9 PHE HE1 H 0.737 9.721 -2.204 1.00 . A A . 9 PHE HE1 1 1 11 3006 1 1 9 PHE HE2 H 1.022 13.906 -2.960 1.00 . A A . 9 PHE HE2 1 1 11 3007 1 1 9 PHE HZ H 2.049 11.805 -2.189 1.00 . A A . 9 PHE HZ 1 1 11 3008 1 1 9 PHE N N -4.218 10.167 -2.561 1.00 . A A . 9 PHE N 1 1 11 3009 1 1 9 PHE O O -5.595 13.435 -2.915 1.00 . A A . 9 PHE O 1 1 11 3010 1 1 10 ARG C C -8.497 12.139 -2.930 1.00 . A A . 10 ARG C 1 1 11 3011 1 1 10 ARG CA C -7.590 11.955 -4.143 1.00 . A A . 10 ARG CA 1 1 11 3012 1 1 10 ARG CB C -8.242 10.994 -5.139 1.00 . A A . 10 ARG CB 1 1 11 3013 1 1 10 ARG CD C -10.097 10.715 -6.811 1.00 . A A . 10 ARG CD 1 1 11 3014 1 1 10 ARG CG C -9.666 11.373 -5.509 1.00 . A A . 10 ARG CG 1 1 11 3015 1 1 10 ARG CZ C -12.114 9.602 -7.668 1.00 . A A . 10 ARG CZ 1 1 11 3016 1 1 10 ARG H H -6.054 10.519 -3.909 1.00 . A A . 10 ARG H 1 1 11 3017 1 1 10 ARG HA H -7.450 12.913 -4.621 1.00 . A A . 10 ARG HA 1 1 11 3018 1 1 10 ARG HB2 H -7.651 10.976 -6.043 1.00 . A A . 10 ARG HB2 1 1 11 3019 1 1 10 ARG HB3 H -8.256 10.004 -4.708 1.00 . A A . 10 ARG HB3 1 1 11 3020 1 1 10 ARG HD2 H -9.825 11.361 -7.632 1.00 . A A . 10 ARG HD2 1 1 11 3021 1 1 10 ARG HD3 H -9.583 9.771 -6.909 1.00 . A A . 10 ARG HD3 1 1 11 3022 1 1 10 ARG HE H -12.101 10.997 -6.243 1.00 . A A . 10 ARG HE 1 1 11 3023 1 1 10 ARG HG2 H -10.331 11.053 -4.720 1.00 . A A . 10 ARG HG2 1 1 11 3024 1 1 10 ARG HG3 H -9.726 12.445 -5.620 1.00 . A A . 10 ARG HG3 1 1 11 3025 1 1 10 ARG HH11 H -10.384 9.002 -8.521 1.00 . A A . 10 ARG HH11 1 1 11 3026 1 1 10 ARG HH12 H -11.813 8.224 -9.116 1.00 . A A . 10 ARG HH12 1 1 11 3027 1 1 10 ARG HH21 H -13.991 9.981 -7.019 1.00 . A A . 10 ARG HH21 1 1 11 3028 1 1 10 ARG HH22 H -13.864 8.782 -8.262 1.00 . A A . 10 ARG HH22 1 1 11 3029 1 1 10 ARG N N -6.280 11.458 -3.742 1.00 . A A . 10 ARG N 1 1 11 3030 1 1 10 ARG NE N -11.538 10.478 -6.853 1.00 . A A . 10 ARG NE 1 1 11 3031 1 1 10 ARG NH1 N -11.377 8.884 -8.504 1.00 . A A . 10 ARG NH1 1 1 11 3032 1 1 10 ARG NH2 N -13.431 9.442 -7.648 1.00 . A A . 10 ARG NH2 1 1 11 3033 1 1 10 ARG O O -9.403 12.969 -2.975 1.00 . A A . 10 ARG O 1 1 11 3034 1 1 11 . C C -8.969 12.854 -0.077 1.00 . A A . 11 SEP C 1 1 11 3035 1 1 11 . CA C -9.057 11.459 -0.639 1.00 . A A . 11 SEP CA 1 1 11 3036 1 1 11 . CB C -8.661 10.322 0.349 1.00 . A A . 11 SEP CB 1 1 11 3037 1 1 11 . H H -7.476 10.705 -1.908 1.00 . A A . 11 SEP H 1 1 11 3038 1 1 11 . HA H -10.107 11.289 -0.945 1.00 . A A . 11 SEP HA 1 1 11 3039 1 1 11 . HB2 H -9.375 9.478 0.326 1.00 . A A . 11 SEP HB2 1 1 11 3040 1 1 11 . HB3 H -7.689 9.860 0.081 1.00 . A A . 11 SEP HB3 1 1 11 3041 1 1 11 . N N -8.237 11.369 -1.883 1.00 . A A . 11 SEP N 1 1 11 3042 1 1 11 . O O -9.931 13.419 0.441 1.00 . A A . 11 SEP O 1 1 11 3043 1 1 11 . O1P O -10.001 9.949 3.662 1.00 . A A . 11 SEP O1P 1 1 11 3044 1 1 11 . O2P O -8.473 8.396 2.471 1.00 . A A . 11 SEP O2P 1 1 11 3045 1 1 11 . O3P O -7.514 10.170 3.960 1.00 . A A . 11 SEP O3P 1 1 11 3046 1 1 11 . OG O -8.595 10.815 1.708 1.00 . A A . 11 SEP OG 1 1 11 3047 1 1 11 . P P -8.638 9.828 2.990 1.00 . A A . 11 SEP P 1 1 11 3048 1 1 12 MET C C -8.196 15.808 -0.581 1.00 . A A . 12 MET C 1 1 11 3049 1 1 12 MET CA C -7.515 14.768 0.303 1.00 . A A . 12 MET CA 1 1 11 3050 1 1 12 MET CB C -6.010 15.036 0.358 1.00 . A A . 12 MET CB 1 1 11 3051 1 1 12 MET CE C -3.166 16.915 2.272 1.00 . A A . 12 MET CE 1 1 11 3052 1 1 12 MET CG C -5.637 16.234 1.216 1.00 . A A . 12 MET CG 1 1 11 3053 1 1 12 MET H H -7.043 12.919 -0.612 1.00 . A A . 12 MET H 1 1 11 3054 1 1 12 MET HA H -7.921 14.840 1.301 1.00 . A A . 12 MET HA 1 1 11 3055 1 1 12 MET HB2 H -5.515 14.164 0.761 1.00 . A A . 12 MET HB2 1 1 11 3056 1 1 12 MET HB3 H -5.650 15.213 -0.644 1.00 . A A . 12 MET HB3 1 1 11 3057 1 1 12 MET HE1 H -3.026 17.918 2.648 1.00 . A A . 12 MET HE1 1 1 11 3058 1 1 12 MET HE2 H -3.725 16.335 2.991 1.00 . A A . 12 MET HE2 1 1 11 3059 1 1 12 MET HE3 H -2.203 16.454 2.107 1.00 . A A . 12 MET HE3 1 1 11 3060 1 1 12 MET HG2 H -6.414 16.978 1.129 1.00 . A A . 12 MET HG2 1 1 11 3061 1 1 12 MET HG3 H -5.562 15.913 2.245 1.00 . A A . 12 MET HG3 1 1 11 3062 1 1 12 MET N N -7.771 13.419 -0.189 1.00 . A A . 12 MET N 1 1 11 3063 1 1 12 MET O O -8.514 16.908 -0.130 1.00 . A A . 12 MET O 1 1 11 3064 1 1 12 MET SD S -4.069 16.978 0.726 1.00 . A A . 12 MET SD 1 1 11 3065 1 1 13 PHE C C -10.534 16.544 -2.448 1.00 . A A . 13 PHE C 1 1 11 3066 1 1 13 PHE CA C -9.059 16.355 -2.790 1.00 . A A . 13 PHE CA 1 1 11 3067 1 1 13 PHE CB C -8.920 15.816 -4.216 1.00 . A A . 13 PHE CB 1 1 11 3068 1 1 13 PHE CD1 C -6.696 16.925 -4.566 1.00 . A A . 13 PHE CD1 1 1 11 3069 1 1 13 PHE CD2 C -8.287 16.990 -6.341 1.00 . A A . 13 PHE CD2 1 1 11 3070 1 1 13 PHE CE1 C -5.801 17.640 -5.339 1.00 . A A . 13 PHE CE1 1 1 11 3071 1 1 13 PHE CE2 C -7.396 17.705 -7.119 1.00 . A A . 13 PHE CE2 1 1 11 3072 1 1 13 PHE CG C -7.948 16.593 -5.058 1.00 . A A . 13 PHE CG 1 1 11 3073 1 1 13 PHE CZ C -6.150 18.029 -6.617 1.00 . A A . 13 PHE CZ 1 1 11 3074 1 1 13 PHE H H -8.141 14.560 -2.143 1.00 . A A . 13 PHE H 1 1 11 3075 1 1 13 PHE HA H -8.562 17.310 -2.726 1.00 . A A . 13 PHE HA 1 1 11 3076 1 1 13 PHE HB2 H -8.578 14.793 -4.174 1.00 . A A . 13 PHE HB2 1 1 11 3077 1 1 13 PHE HB3 H -9.883 15.850 -4.701 1.00 . A A . 13 PHE HB3 1 1 11 3078 1 1 13 PHE HD1 H -6.421 16.620 -3.567 1.00 . A A . 13 PHE HD1 1 1 11 3079 1 1 13 PHE HD2 H -9.261 16.736 -6.735 1.00 . A A . 13 PHE HD2 1 1 11 3080 1 1 13 PHE HE1 H -4.828 17.892 -4.944 1.00 . A A . 13 PHE HE1 1 1 11 3081 1 1 13 PHE HE2 H -7.672 18.007 -8.118 1.00 . A A . 13 PHE HE2 1 1 11 3082 1 1 13 PHE HZ H -5.453 18.588 -7.223 1.00 . A A . 13 PHE HZ 1 1 11 3083 1 1 13 PHE N N -8.417 15.452 -1.843 1.00 . A A . 13 PHE N 1 1 11 3084 1 1 13 PHE O O -11.130 15.763 -1.705 1.00 . A A . 13 PHE O 1 1 11 3085 1 1 14 PRO C C -13.487 16.987 -3.528 1.00 . A A . 14 PRO C 1 1 11 3086 1 1 14 PRO CA C -12.551 17.922 -2.770 1.00 . A A . 14 PRO CA 1 1 11 3087 1 1 14 PRO CB C -12.684 19.354 -3.296 1.00 . A A . 14 PRO CB 1 1 11 3088 1 1 14 PRO CD C -10.490 18.578 -3.897 1.00 . A A . 14 PRO CD 1 1 11 3089 1 1 14 PRO CG C -11.599 19.488 -4.308 1.00 . A A . 14 PRO CG 1 1 11 3090 1 1 14 PRO HA H -12.795 17.900 -1.718 1.00 . A A . 14 PRO HA 1 1 11 3091 1 1 14 PRO HB2 H -13.660 19.486 -3.742 1.00 . A A . 14 PRO HB2 1 1 11 3092 1 1 14 PRO HB3 H -12.555 20.053 -2.484 1.00 . A A . 14 PRO HB3 1 1 11 3093 1 1 14 PRO HD2 H -10.068 18.085 -4.761 1.00 . A A . 14 PRO HD2 1 1 11 3094 1 1 14 PRO HD3 H -9.731 19.138 -3.372 1.00 . A A . 14 PRO HD3 1 1 11 3095 1 1 14 PRO HG2 H -11.970 19.209 -5.283 1.00 . A A . 14 PRO HG2 1 1 11 3096 1 1 14 PRO HG3 H -11.233 20.503 -4.321 1.00 . A A . 14 PRO HG3 1 1 11 3097 1 1 14 PRO N N -11.138 17.605 -3.002 1.00 . A A . 14 PRO N 1 1 11 3098 1 1 14 PRO O O -14.678 16.907 -3.226 1.00 . A A . 14 PRO O 1 1 11 3099 1 1 15 SER C C -14.138 14.135 -4.493 1.00 . A A . 15 SER C 1 1 11 3100 1 1 15 SER CA C -13.728 15.353 -5.315 1.00 . A A . 15 SER CA 1 1 11 3101 1 1 15 SER CB C -12.934 14.908 -6.545 1.00 . A A . 15 SER CB 1 1 11 3102 1 1 15 SER H H -11.986 16.388 -4.704 1.00 . A A . 15 SER H 1 1 11 3103 1 1 15 SER HA H -14.619 15.869 -5.640 1.00 . A A . 15 SER HA 1 1 11 3104 1 1 15 SER HB2 H -12.938 13.830 -6.603 1.00 . A A . 15 SER HB2 1 1 11 3105 1 1 15 SER HB3 H -13.392 15.318 -7.433 1.00 . A A . 15 SER HB3 1 1 11 3106 1 1 15 SER HG H -11.533 16.249 -6.821 1.00 . A A . 15 SER HG 1 1 11 3107 1 1 15 SER N N -12.941 16.281 -4.512 1.00 . A A . 15 SER N 1 1 11 3108 1 1 15 SER O O -15.152 13.496 -4.772 1.00 . A A . 15 SER O 1 1 11 3109 1 1 15 SER OG O -11.591 15.356 -6.474 1.00 . A A . 15 SER OG 1 1 11 3110 1 1 16 SER C C -14.653 13.035 -1.552 1.00 . A A . 16 SER C 1 1 11 3111 1 1 16 SER CA C -13.618 12.677 -2.614 1.00 . A A . 16 SER CA 1 1 11 3112 1 1 16 SER CB C -12.330 12.193 -1.945 1.00 . A A . 16 SER CB 1 1 11 3113 1 1 16 SER H H -12.547 14.368 -3.304 1.00 . A A . 16 SER H 1 1 11 3114 1 1 16 SER HA H -14.012 11.884 -3.232 1.00 . A A . 16 SER HA 1 1 11 3115 1 1 16 SER HB2 H -11.597 12.985 -1.965 1.00 . A A . 16 SER HB2 1 1 11 3116 1 1 16 SER HB3 H -12.540 11.923 -0.920 1.00 . A A . 16 SER HB3 1 1 11 3117 1 1 16 SER HG H -12.004 10.269 -2.116 1.00 . A A . 16 SER HG 1 1 11 3118 1 1 16 SER N N -13.341 13.820 -3.476 1.00 . A A . 16 SER N 1 1 11 3119 1 1 16 SER O O -15.451 12.194 -1.141 1.00 . A A . 16 SER O 1 1 11 3120 1 1 16 SER OG O -11.800 11.063 -2.615 1.00 . A A . 16 SER OG 1 1 11 3121 1 1 17 GLU C C -16.932 15.057 -0.714 1.00 . A A . 17 GLU C 1 1 11 3122 1 1 17 GLU CA C -15.568 14.759 -0.099 1.00 . A A . 17 GLU CA 1 1 11 3123 1 1 17 GLU CB C -15.022 16.012 0.590 1.00 . A A . 17 GLU CB 1 1 11 3124 1 1 17 GLU CD C -12.961 17.089 1.576 1.00 . A A . 17 GLU CD 1 1 11 3125 1 1 17 GLU CG C -13.691 15.791 1.289 1.00 . A A . 17 GLU CG 1 1 11 3126 1 1 17 GLU H H -13.971 14.914 -1.480 1.00 . A A . 17 GLU H 1 1 11 3127 1 1 17 GLU HA H -15.681 13.977 0.636 1.00 . A A . 17 GLU HA 1 1 11 3128 1 1 17 GLU HB2 H -14.892 16.788 -0.151 1.00 . A A . 17 GLU HB2 1 1 11 3129 1 1 17 GLU HB3 H -15.740 16.345 1.325 1.00 . A A . 17 GLU HB3 1 1 11 3130 1 1 17 GLU HG2 H -13.871 15.282 2.224 1.00 . A A . 17 GLU HG2 1 1 11 3131 1 1 17 GLU HG3 H -13.066 15.175 0.659 1.00 . A A . 17 GLU HG3 1 1 11 3132 1 1 17 GLU N N -14.632 14.290 -1.114 1.00 . A A . 17 GLU N 1 1 11 3133 1 1 17 GLU O O -17.059 15.924 -1.578 1.00 . A A . 17 GLU O 1 1 11 3134 1 1 17 GLU OE1 O -13.635 18.130 1.723 1.00 . A A . 17 GLU OE1 1 1 11 3135 1 1 17 GLU OE2 O -11.715 17.062 1.655 1.00 . A A . 17 GLU OE2 1 1 12 3136 1 1 1 ARG C C 2.651 1.890 -1.577 1.00 . A A . 1 ARG C 1 1 12 3137 1 1 1 ARG CA C 2.911 0.452 -1.139 1.00 . A A . 1 ARG CA 1 1 12 3138 1 1 1 ARG CB C 2.296 -0.519 -2.149 1.00 . A A . 1 ARG CB 1 1 12 3139 1 1 1 ARG CD C 2.767 -2.980 -1.958 1.00 . A A . 1 ARG CD 1 1 12 3140 1 1 1 ARG CG C 3.225 -1.654 -2.546 1.00 . A A . 1 ARG CG 1 1 12 3141 1 1 1 ARG CZ C 4.752 -4.393 -2.284 1.00 . A A . 1 ARG CZ 1 1 12 3142 1 1 1 ARG H1 H 2.804 -0.452 0.771 1.00 . A A . 1 ARG H1 1 1 12 3143 1 1 1 ARG HA H 3.977 0.288 -1.098 1.00 . A A . 1 ARG HA 1 1 12 3144 1 1 1 ARG HB2 H 1.402 -0.947 -1.721 1.00 . A A . 1 ARG HB2 1 1 12 3145 1 1 1 ARG HB3 H 2.032 0.029 -3.041 1.00 . A A . 1 ARG HB3 1 1 12 3146 1 1 1 ARG HD2 H 2.944 -2.966 -0.892 1.00 . A A . 1 ARG HD2 1 1 12 3147 1 1 1 ARG HD3 H 1.710 -3.095 -2.145 1.00 . A A . 1 ARG HD3 1 1 12 3148 1 1 1 ARG HE H 2.984 -4.693 -3.156 1.00 . A A . 1 ARG HE 1 1 12 3149 1 1 1 ARG HG2 H 3.239 -1.737 -3.622 1.00 . A A . 1 ARG HG2 1 1 12 3150 1 1 1 ARG HG3 H 4.220 -1.435 -2.187 1.00 . A A . 1 ARG HG3 1 1 12 3151 1 1 1 ARG HH11 H 5.015 -2.836 -1.024 1.00 . A A . 1 ARG HH11 1 1 12 3152 1 1 1 ARG HH12 H 6.407 -3.840 -1.263 1.00 . A A . 1 ARG HH12 1 1 12 3153 1 1 1 ARG HH21 H 4.809 -6.023 -3.478 1.00 . A A . 1 ARG HH21 1 1 12 3154 1 1 1 ARG HH22 H 6.288 -5.652 -2.660 1.00 . A A . 1 ARG HH22 1 1 12 3155 1 1 1 ARG N N 2.369 0.208 0.192 1.00 . A A . 1 ARG N 1 1 12 3156 1 1 1 ARG NE N 3.480 -4.113 -2.542 1.00 . A A . 1 ARG NE 1 1 12 3157 1 1 1 ARG NH1 N 5.449 -3.626 -1.456 1.00 . A A . 1 ARG NH1 1 1 12 3158 1 1 1 ARG NH2 N 5.331 -5.442 -2.854 1.00 . A A . 1 ARG NH2 1 1 12 3159 1 1 1 ARG O O 1.807 2.581 -1.005 1.00 . A A . 1 ARG O 1 1 12 3160 1 1 2 SER C C 2.019 3.799 -4.020 1.00 . A A . 2 SER C 1 1 12 3161 1 1 2 SER CA C 3.234 3.693 -3.105 1.00 . A A . 2 SER CA 1 1 12 3162 1 1 2 SER CB C 4.495 4.116 -3.861 1.00 . A A . 2 SER CB 1 1 12 3163 1 1 2 SER H H 4.039 1.737 -3.007 1.00 . A A . 2 SER H 1 1 12 3164 1 1 2 SER HA H 3.093 4.352 -2.261 1.00 . A A . 2 SER HA 1 1 12 3165 1 1 2 SER HB2 H 4.213 4.648 -4.757 1.00 . A A . 2 SER HB2 1 1 12 3166 1 1 2 SER HB3 H 5.090 4.762 -3.232 1.00 . A A . 2 SER HB3 1 1 12 3167 1 1 2 SER HG H 6.034 3.277 -4.735 1.00 . A A . 2 SER HG 1 1 12 3168 1 1 2 SER N N 3.383 2.336 -2.593 1.00 . A A . 2 SER N 1 1 12 3169 1 1 2 SER O O 1.426 4.869 -4.165 1.00 . A A . 2 SER O 1 1 12 3170 1 1 2 SER OG O 5.274 2.989 -4.225 1.00 . A A . 2 SER OG 1 1 12 3171 1 1 3 LYS C C -0.802 2.735 -4.760 1.00 . A A . 3 LYS C 1 1 12 3172 1 1 3 LYS CA C 0.506 2.645 -5.539 1.00 . A A . 3 LYS CA 1 1 12 3173 1 1 3 LYS CB C 0.528 1.362 -6.373 1.00 . A A . 3 LYS CB 1 1 12 3174 1 1 3 LYS CD C 0.655 0.310 -8.651 1.00 . A A . 3 LYS CD 1 1 12 3175 1 1 3 LYS CE C 2.048 -0.153 -9.048 1.00 . A A . 3 LYS CE 1 1 12 3176 1 1 3 LYS CG C 0.703 1.608 -7.862 1.00 . A A . 3 LYS CG 1 1 12 3177 1 1 3 LYS H H 2.164 1.859 -4.482 1.00 . A A . 3 LYS H 1 1 12 3178 1 1 3 LYS HA H 0.577 3.495 -6.200 1.00 . A A . 3 LYS HA 1 1 12 3179 1 1 3 LYS HB2 H 1.343 0.740 -6.034 1.00 . A A . 3 LYS HB2 1 1 12 3180 1 1 3 LYS HB3 H -0.403 0.834 -6.224 1.00 . A A . 3 LYS HB3 1 1 12 3181 1 1 3 LYS HD2 H 0.194 -0.454 -8.042 1.00 . A A . 3 LYS HD2 1 1 12 3182 1 1 3 LYS HD3 H 0.067 0.464 -9.545 1.00 . A A . 3 LYS HD3 1 1 12 3183 1 1 3 LYS HE2 H 2.282 0.248 -10.023 1.00 . A A . 3 LYS HE2 1 1 12 3184 1 1 3 LYS HE3 H 2.757 0.221 -8.325 1.00 . A A . 3 LYS HE3 1 1 12 3185 1 1 3 LYS HG2 H -0.089 2.255 -8.207 1.00 . A A . 3 LYS HG2 1 1 12 3186 1 1 3 LYS HG3 H 1.659 2.084 -8.029 1.00 . A A . 3 LYS HG3 1 1 12 3187 1 1 3 LYS HZ1 H 1.521 -2.062 -8.384 1.00 . A A . 3 LYS HZ1 1 1 12 3188 1 1 3 LYS HZ2 H 3.124 -1.938 -8.913 1.00 . A A . 3 LYS HZ2 1 1 12 3189 1 1 3 LYS HZ3 H 1.862 -1.983 -10.039 1.00 . A A . 3 LYS HZ3 1 1 12 3190 1 1 3 LYS N N 1.652 2.681 -4.638 1.00 . A A . 3 LYS N 1 1 12 3191 1 1 3 LYS NZ N 2.145 -1.638 -9.100 1.00 . A A . 3 LYS NZ 1 1 12 3192 1 1 3 LYS O O -1.814 3.206 -5.280 1.00 . A A . 3 LYS O 1 1 12 3193 1 1 4 ASP C C -2.178 3.713 -2.088 1.00 . A A . 4 ASP C 1 1 12 3194 1 1 4 ASP CA C -1.957 2.315 -2.660 1.00 . A A . 4 ASP CA 1 1 12 3195 1 1 4 ASP CB C -1.822 1.301 -1.523 1.00 . A A . 4 ASP CB 1 1 12 3196 1 1 4 ASP CG C -2.458 -0.033 -1.858 1.00 . A A . 4 ASP CG 1 1 12 3197 1 1 4 ASP H H 0.063 1.920 -3.153 1.00 . A A . 4 ASP H 1 1 12 3198 1 1 4 ASP HA H -2.810 2.050 -3.266 1.00 . A A . 4 ASP HA 1 1 12 3199 1 1 4 ASP HB2 H -0.773 1.138 -1.318 1.00 . A A . 4 ASP HB2 1 1 12 3200 1 1 4 ASP HB3 H -2.300 1.696 -0.638 1.00 . A A . 4 ASP HB3 1 1 12 3201 1 1 4 ASP N N -0.774 2.283 -3.511 1.00 . A A . 4 ASP N 1 1 12 3202 1 1 4 ASP O O -3.314 4.130 -1.860 1.00 . A A . 4 ASP O 1 1 12 3203 1 1 4 ASP OD1 O -2.336 -0.473 -3.021 1.00 . A A . 4 ASP OD1 1 1 12 3204 1 1 4 ASP OD2 O -3.076 -0.638 -0.958 1.00 . A A . 4 ASP OD2 1 1 12 3205 1 1 5 LEU C C -1.617 6.775 -2.373 1.00 . A A . 5 LEU C 1 1 12 3206 1 1 5 LEU CA C -1.157 5.781 -1.311 1.00 . A A . 5 LEU CA 1 1 12 3207 1 1 5 LEU CB C 0.205 6.203 -0.757 1.00 . A A . 5 LEU CB 1 1 12 3208 1 1 5 LEU CD1 C 1.754 6.437 1.200 1.00 . A A . 5 LEU CD1 1 1 12 3209 1 1 5 LEU CD2 C -0.490 7.540 1.246 1.00 . A A . 5 LEU CD2 1 1 12 3210 1 1 5 LEU CG C 0.301 6.333 0.763 1.00 . A A . 5 LEU CG 1 1 12 3211 1 1 5 LEU H H -0.207 4.045 -2.058 1.00 . A A . 5 LEU H 1 1 12 3212 1 1 5 LEU HA H -1.877 5.775 -0.506 1.00 . A A . 5 LEU HA 1 1 12 3213 1 1 5 LEU HB2 H 0.931 5.470 -1.073 1.00 . A A . 5 LEU HB2 1 1 12 3214 1 1 5 LEU HB3 H 0.454 7.162 -1.189 1.00 . A A . 5 LEU HB3 1 1 12 3215 1 1 5 LEU HD11 H 1.804 6.481 2.277 1.00 . A A . 5 LEU HD11 1 1 12 3216 1 1 5 LEU HD12 H 2.192 7.331 0.782 1.00 . A A . 5 LEU HD12 1 1 12 3217 1 1 5 LEU HD13 H 2.298 5.572 0.848 1.00 . A A . 5 LEU HD13 1 1 12 3218 1 1 5 LEU HD21 H 0.045 8.444 0.997 1.00 . A A . 5 LEU HD21 1 1 12 3219 1 1 5 LEU HD22 H -0.619 7.481 2.317 1.00 . A A . 5 LEU HD22 1 1 12 3220 1 1 5 LEU HD23 H -1.459 7.551 0.767 1.00 . A A . 5 LEU HD23 1 1 12 3221 1 1 5 LEU HG H -0.123 5.450 1.221 1.00 . A A . 5 LEU HG 1 1 12 3222 1 1 5 LEU N N -1.084 4.431 -1.857 1.00 . A A . 5 LEU N 1 1 12 3223 1 1 5 LEU O O -2.218 7.802 -2.058 1.00 . A A . 5 LEU O 1 1 12 3224 1 1 6 ARG C C -3.222 7.577 -4.737 1.00 . A A . 6 ARG C 1 1 12 3225 1 1 6 ARG CA C -1.718 7.324 -4.742 1.00 . A A . 6 ARG CA 1 1 12 3226 1 1 6 ARG CB C -1.300 6.697 -6.073 1.00 . A A . 6 ARG CB 1 1 12 3227 1 1 6 ARG CD C 0.580 7.300 -7.629 1.00 . A A . 6 ARG CD 1 1 12 3228 1 1 6 ARG CG C -0.780 7.706 -7.085 1.00 . A A . 6 ARG CG 1 1 12 3229 1 1 6 ARG CZ C 2.284 8.241 -9.131 1.00 . A A . 6 ARG CZ 1 1 12 3230 1 1 6 ARG H H -0.851 5.627 -3.821 1.00 . A A . 6 ARG H 1 1 12 3231 1 1 6 ARG HA H -1.206 8.267 -4.621 1.00 . A A . 6 ARG HA 1 1 12 3232 1 1 6 ARG HB2 H -0.520 5.973 -5.888 1.00 . A A . 6 ARG HB2 1 1 12 3233 1 1 6 ARG HB3 H -2.152 6.194 -6.504 1.00 . A A . 6 ARG HB3 1 1 12 3234 1 1 6 ARG HD2 H 1.200 6.975 -6.806 1.00 . A A . 6 ARG HD2 1 1 12 3235 1 1 6 ARG HD3 H 0.446 6.483 -8.322 1.00 . A A . 6 ARG HD3 1 1 12 3236 1 1 6 ARG HE H 0.902 9.306 -8.165 1.00 . A A . 6 ARG HE 1 1 12 3237 1 1 6 ARG HG2 H -1.479 7.771 -7.906 1.00 . A A . 6 ARG HG2 1 1 12 3238 1 1 6 ARG HG3 H -0.694 8.670 -6.606 1.00 . A A . 6 ARG HG3 1 1 12 3239 1 1 6 ARG HH11 H 2.357 6.234 -8.914 1.00 . A A . 6 ARG HH11 1 1 12 3240 1 1 6 ARG HH12 H 3.552 6.910 -9.970 1.00 . A A . 6 ARG HH12 1 1 12 3241 1 1 6 ARG HH21 H 2.470 10.209 -9.553 1.00 . A A . 6 ARG HH21 1 1 12 3242 1 1 6 ARG HH22 H 3.617 9.172 -10.332 1.00 . A A . 6 ARG HH22 1 1 12 3243 1 1 6 ARG N N -1.333 6.460 -3.633 1.00 . A A . 6 ARG N 1 1 12 3244 1 1 6 ARG NE N 1.246 8.402 -8.317 1.00 . A A . 6 ARG NE 1 1 12 3245 1 1 6 ARG NH1 N 2.772 7.029 -9.356 1.00 . A A . 6 ARG NH1 1 1 12 3246 1 1 6 ARG NH2 N 2.836 9.294 -9.721 1.00 . A A . 6 ARG NH2 1 1 12 3247 1 1 6 ARG O O -3.685 8.643 -5.146 1.00 . A A . 6 ARG O 1 1 12 3248 1 1 7 HIS C C -5.862 7.601 -3.055 1.00 . A A . 7 HIS C 1 1 12 3249 1 1 7 HIS CA C -5.435 6.706 -4.214 1.00 . A A . 7 HIS CA 1 1 12 3250 1 1 7 HIS CB C -6.072 5.323 -4.068 1.00 . A A . 7 HIS CB 1 1 12 3251 1 1 7 HIS CD2 C -6.368 4.084 -6.327 1.00 . A A . 7 HIS CD2 1 1 12 3252 1 1 7 HIS CE1 C -8.449 4.645 -6.730 1.00 . A A . 7 HIS CE1 1 1 12 3253 1 1 7 HIS CG C -6.786 4.860 -5.300 1.00 . A A . 7 HIS CG 1 1 12 3254 1 1 7 HIS H H -3.555 5.765 -3.960 1.00 . A A . 7 HIS H 1 1 12 3255 1 1 7 HIS HA H -5.769 7.151 -5.138 1.00 . A A . 7 HIS HA 1 1 12 3256 1 1 7 HIS HB2 H -5.302 4.601 -3.840 1.00 . A A . 7 HIS HB2 1 1 12 3257 1 1 7 HIS HB3 H -6.787 5.347 -3.258 1.00 . A A . 7 HIS HB3 1 1 12 3258 1 1 7 HIS HD1 H -8.675 5.754 -5.026 1.00 . A A . 7 HIS HD1 1 1 12 3259 1 1 7 HIS HD2 H -5.389 3.640 -6.438 1.00 . A A . 7 HIS HD2 1 1 12 3260 1 1 7 HIS HE1 H -9.415 4.735 -7.202 1.00 . A A . 7 HIS HE1 1 1 12 3261 1 1 7 HIS N N -3.982 6.590 -4.272 1.00 . A A . 7 HIS N 1 1 12 3262 1 1 7 HIS ND1 N -8.093 5.196 -5.583 1.00 . A A . 7 HIS ND1 1 1 12 3263 1 1 7 HIS NE2 N -7.419 3.965 -7.202 1.00 . A A . 7 HIS NE2 1 1 12 3264 1 1 7 HIS O O -6.983 8.108 -3.030 1.00 . A A . 7 HIS O 1 1 12 3265 1 1 8 ALA C C -5.189 10.105 -1.296 1.00 . A A . 8 ALA C 1 1 12 3266 1 1 8 ALA CA C -5.246 8.624 -0.935 1.00 . A A . 8 ALA CA 1 1 12 3267 1 1 8 ALA CB C -4.268 8.315 0.189 1.00 . A A . 8 ALA CB 1 1 12 3268 1 1 8 ALA H H -4.085 7.358 -2.171 1.00 . A A . 8 ALA H 1 1 12 3269 1 1 8 ALA HA H -6.241 8.386 -0.588 1.00 . A A . 8 ALA HA 1 1 12 3270 1 1 8 ALA HB1 H -3.727 7.410 -0.044 1.00 . A A . 8 ALA HB1 1 1 12 3271 1 1 8 ALA HB2 H -3.571 9.134 0.295 1.00 . A A . 8 ALA HB2 1 1 12 3272 1 1 8 ALA HB3 H -4.811 8.182 1.113 1.00 . A A . 8 ALA HB3 1 1 12 3273 1 1 8 ALA N N -4.962 7.790 -2.096 1.00 . A A . 8 ALA N 1 1 12 3274 1 1 8 ALA O O -5.785 10.942 -0.619 1.00 . A A . 8 ALA O 1 1 12 3275 1 1 9 PHE C C -5.687 12.378 -3.218 1.00 . A A . 9 PHE C 1 1 12 3276 1 1 9 PHE CA C -4.332 11.801 -2.817 1.00 . A A . 9 PHE CA 1 1 12 3277 1 1 9 PHE CB C -3.361 11.882 -3.997 1.00 . A A . 9 PHE CB 1 1 12 3278 1 1 9 PHE CD1 C -1.032 12.150 -3.103 1.00 . A A . 9 PHE CD1 1 1 12 3279 1 1 9 PHE CD2 C -2.106 14.053 -4.056 1.00 . A A . 9 PHE CD2 1 1 12 3280 1 1 9 PHE CE1 C 0.092 12.911 -2.841 1.00 . A A . 9 PHE CE1 1 1 12 3281 1 1 9 PHE CE2 C -0.984 14.819 -3.798 1.00 . A A . 9 PHE CE2 1 1 12 3282 1 1 9 PHE CG C -2.142 12.712 -3.713 1.00 . A A . 9 PHE CG 1 1 12 3283 1 1 9 PHE CZ C 0.115 14.247 -3.188 1.00 . A A . 9 PHE CZ 1 1 12 3284 1 1 9 PHE H H -4.016 9.708 -2.866 1.00 . A A . 9 PHE H 1 1 12 3285 1 1 9 PHE HA H -3.937 12.379 -1.996 1.00 . A A . 9 PHE HA 1 1 12 3286 1 1 9 PHE HB2 H -3.032 10.886 -4.252 1.00 . A A . 9 PHE HB2 1 1 12 3287 1 1 9 PHE HB3 H -3.870 12.316 -4.843 1.00 . A A . 9 PHE HB3 1 1 12 3288 1 1 9 PHE HD1 H -1.049 11.104 -2.831 1.00 . A A . 9 PHE HD1 1 1 12 3289 1 1 9 PHE HD2 H -2.965 14.502 -4.532 1.00 . A A . 9 PHE HD2 1 1 12 3290 1 1 9 PHE HE1 H 0.950 12.460 -2.365 1.00 . A A . 9 PHE HE1 1 1 12 3291 1 1 9 PHE HE2 H -0.969 15.864 -4.069 1.00 . A A . 9 PHE HE2 1 1 12 3292 1 1 9 PHE HZ H 0.993 14.843 -2.985 1.00 . A A . 9 PHE HZ 1 1 12 3293 1 1 9 PHE N N -4.468 10.420 -2.367 1.00 . A A . 9 PHE N 1 1 12 3294 1 1 9 PHE O O -5.904 13.588 -3.147 1.00 . A A . 9 PHE O 1 1 12 3295 1 1 10 ARG C C -8.786 12.277 -2.845 1.00 . A A . 10 ARG C 1 1 12 3296 1 1 10 ARG CA C -7.927 11.925 -4.055 1.00 . A A . 10 ARG CA 1 1 12 3297 1 1 10 ARG CB C -8.603 10.822 -4.871 1.00 . A A . 10 ARG CB 1 1 12 3298 1 1 10 ARG CD C -10.002 12.053 -6.557 1.00 . A A . 10 ARG CD 1 1 12 3299 1 1 10 ARG CG C -8.782 11.172 -6.339 1.00 . A A . 10 ARG CG 1 1 12 3300 1 1 10 ARG CZ C -11.384 10.737 -8.107 1.00 . A A . 10 ARG CZ 1 1 12 3301 1 1 10 ARG H H -6.362 10.552 -3.675 1.00 . A A . 10 ARG H 1 1 12 3302 1 1 10 ARG HA H -7.819 12.803 -4.674 1.00 . A A . 10 ARG HA 1 1 12 3303 1 1 10 ARG HB2 H -8.004 9.925 -4.808 1.00 . A A . 10 ARG HB2 1 1 12 3304 1 1 10 ARG HB3 H -9.577 10.625 -4.449 1.00 . A A . 10 ARG HB3 1 1 12 3305 1 1 10 ARG HD2 H -10.201 12.601 -5.648 1.00 . A A . 10 ARG HD2 1 1 12 3306 1 1 10 ARG HD3 H -9.790 12.747 -7.357 1.00 . A A . 10 ARG HD3 1 1 12 3307 1 1 10 ARG HE H -11.864 11.140 -6.213 1.00 . A A . 10 ARG HE 1 1 12 3308 1 1 10 ARG HG2 H -7.904 11.700 -6.683 1.00 . A A . 10 ARG HG2 1 1 12 3309 1 1 10 ARG HG3 H -8.900 10.260 -6.905 1.00 . A A . 10 ARG HG3 1 1 12 3310 1 1 10 ARG HH11 H -9.651 11.423 -8.886 1.00 . A A . 10 ARG HH11 1 1 12 3311 1 1 10 ARG HH12 H -10.635 10.494 -9.968 1.00 . A A . 10 ARG HH12 1 1 12 3312 1 1 10 ARG HH21 H -13.168 9.915 -7.628 1.00 . A A . 10 ARG HH21 1 1 12 3313 1 1 10 ARG HH22 H -12.635 9.637 -9.252 1.00 . A A . 10 ARG HH22 1 1 12 3314 1 1 10 ARG N N -6.594 11.503 -3.640 1.00 . A A . 10 ARG N 1 1 12 3315 1 1 10 ARG NE N -11.185 11.271 -6.907 1.00 . A A . 10 ARG NE 1 1 12 3316 1 1 10 ARG NH1 N -10.483 10.898 -9.066 1.00 . A A . 10 ARG NH1 1 1 12 3317 1 1 10 ARG NH2 N -12.486 10.039 -8.349 1.00 . A A . 10 ARG NH2 1 1 12 3318 1 1 10 ARG O O -9.702 13.089 -2.972 1.00 . A A . 10 ARG O 1 1 12 3319 1 1 11 . C C -9.115 13.384 -0.083 1.00 . A A . 11 SEP C 1 1 12 3320 1 1 11 . CA C -9.249 11.931 -0.460 1.00 . A A . 11 SEP CA 1 1 12 3321 1 1 11 . CB C -8.836 10.920 0.650 1.00 . A A . 11 SEP CB 1 1 12 3322 1 1 11 . H H -7.712 11.009 -1.670 1.00 . A A . 11 SEP H 1 1 12 3323 1 1 11 . HA H -10.312 11.748 -0.704 1.00 . A A . 11 SEP HA 1 1 12 3324 1 1 11 . HB2 H -8.223 10.089 0.255 1.00 . A A . 11 SEP HB2 1 1 12 3325 1 1 11 . HB3 H -8.189 11.389 1.419 1.00 . A A . 11 SEP HB3 1 1 12 3326 1 1 11 . N N -8.478 11.667 -1.710 1.00 . A A . 11 SEP N 1 1 12 3327 1 1 11 . O O -10.047 14.031 0.395 1.00 . A A . 11 SEP O 1 1 12 3328 1 1 11 . O1P O -8.892 8.045 1.343 1.00 . A A . 11 SEP O1P 1 1 12 3329 1 1 11 . O2P O -10.899 8.468 2.742 1.00 . A A . 11 SEP O2P 1 1 12 3330 1 1 11 . O3P O -11.146 8.284 0.254 1.00 . A A . 11 SEP O3P 1 1 12 3331 1 1 11 . OG O -10.001 10.350 1.292 1.00 . A A . 11 SEP OG 1 1 12 3332 1 1 11 . P P -10.242 8.752 1.388 1.00 . A A . 11 SEP P 1 1 12 3333 1 1 12 MET C C -8.310 16.233 -0.987 1.00 . A A . 12 MET C 1 1 12 3334 1 1 12 MET CA C -7.615 15.298 -0.002 1.00 . A A . 12 MET CA 1 1 12 3335 1 1 12 MET CB C -6.104 15.538 -0.034 1.00 . A A . 12 MET CB 1 1 12 3336 1 1 12 MET CE C -3.586 17.901 0.522 1.00 . A A . 12 MET CE 1 1 12 3337 1 1 12 MET CG C -5.549 16.092 1.268 1.00 . A A . 12 MET CG 1 1 12 3338 1 1 12 MET H H -7.211 13.338 -0.692 1.00 . A A . 12 MET H 1 1 12 3339 1 1 12 MET HA H -7.982 15.505 0.992 1.00 . A A . 12 MET HA 1 1 12 3340 1 1 12 MET HB2 H -5.608 14.601 -0.242 1.00 . A A . 12 MET HB2 1 1 12 3341 1 1 12 MET HB3 H -5.879 16.239 -0.824 1.00 . A A . 12 MET HB3 1 1 12 3342 1 1 12 MET HE1 H -3.020 17.072 0.922 1.00 . A A . 12 MET HE1 1 1 12 3343 1 1 12 MET HE2 H -3.631 17.820 -0.554 1.00 . A A . 12 MET HE2 1 1 12 3344 1 1 12 MET HE3 H -3.107 18.830 0.794 1.00 . A A . 12 MET HE3 1 1 12 3345 1 1 12 MET HG2 H -6.257 15.896 2.059 1.00 . A A . 12 MET HG2 1 1 12 3346 1 1 12 MET HG3 H -4.618 15.591 1.488 1.00 . A A . 12 MET HG3 1 1 12 3347 1 1 12 MET N N -7.913 13.904 -0.309 1.00 . A A . 12 MET N 1 1 12 3348 1 1 12 MET O O -8.591 17.389 -0.669 1.00 . A A . 12 MET O 1 1 12 3349 1 1 12 MET SD S -5.246 17.868 1.193 1.00 . A A . 12 MET SD 1 1 12 3350 1 1 13 PHE C C -10.704 16.779 -2.848 1.00 . A A . 13 PHE C 1 1 12 3351 1 1 13 PHE CA C -9.246 16.516 -3.216 1.00 . A A . 13 PHE CA 1 1 12 3352 1 1 13 PHE CB C -9.171 15.798 -4.565 1.00 . A A . 13 PHE CB 1 1 12 3353 1 1 13 PHE CD1 C -6.899 16.706 -5.124 1.00 . A A . 13 PHE CD1 1 1 12 3354 1 1 13 PHE CD2 C -8.575 16.723 -6.820 1.00 . A A . 13 PHE CD2 1 1 12 3355 1 1 13 PHE CE1 C -6.001 17.281 -6.002 1.00 . A A . 13 PHE CE1 1 1 12 3356 1 1 13 PHE CE2 C -7.681 17.297 -7.703 1.00 . A A . 13 PHE CE2 1 1 12 3357 1 1 13 PHE CG C -8.196 16.421 -5.522 1.00 . A A . 13 PHE CG 1 1 12 3358 1 1 13 PHE CZ C -6.391 17.575 -7.294 1.00 . A A . 13 PHE CZ 1 1 12 3359 1 1 13 PHE H H -8.336 14.797 -2.378 1.00 . A A . 13 PHE H 1 1 12 3360 1 1 13 PHE HA H -8.730 17.460 -3.291 1.00 . A A . 13 PHE HA 1 1 12 3361 1 1 13 PHE HB2 H -8.868 14.774 -4.403 1.00 . A A . 13 PHE HB2 1 1 12 3362 1 1 13 PHE HB3 H -10.146 15.811 -5.027 1.00 . A A . 13 PHE HB3 1 1 12 3363 1 1 13 PHE HD1 H -6.592 16.475 -4.114 1.00 . A A . 13 PHE HD1 1 1 12 3364 1 1 13 PHE HD2 H -9.584 16.505 -7.141 1.00 . A A . 13 PHE HD2 1 1 12 3365 1 1 13 PHE HE1 H -4.993 17.497 -5.680 1.00 . A A . 13 PHE HE1 1 1 12 3366 1 1 13 PHE HE2 H -7.990 17.526 -8.712 1.00 . A A . 13 PHE HE2 1 1 12 3367 1 1 13 PHE HZ H -5.691 18.025 -7.982 1.00 . A A . 13 PHE HZ 1 1 12 3368 1 1 13 PHE N N -8.585 15.725 -2.184 1.00 . A A . 13 PHE N 1 1 12 3369 1 1 13 PHE O O -11.285 16.113 -1.991 1.00 . A A . 13 PHE O 1 1 12 3370 1 1 14 PRO C C -13.687 17.149 -3.870 1.00 . A A . 14 PRO C 1 1 12 3371 1 1 14 PRO CA C -12.706 18.151 -3.272 1.00 . A A . 14 PRO CA 1 1 12 3372 1 1 14 PRO CB C -12.834 19.507 -3.971 1.00 . A A . 14 PRO CB 1 1 12 3373 1 1 14 PRO CD C -10.678 18.612 -4.545 1.00 . A A . 14 PRO CD 1 1 12 3374 1 1 14 PRO CG C -11.792 19.484 -5.035 1.00 . A A . 14 PRO CG 1 1 12 3375 1 1 14 PRO HA H -12.911 18.267 -2.217 1.00 . A A . 14 PRO HA 1 1 12 3376 1 1 14 PRO HB2 H -13.825 19.607 -4.390 1.00 . A A . 14 PRO HB2 1 1 12 3377 1 1 14 PRO HB3 H -12.655 20.300 -3.261 1.00 . A A . 14 PRO HB3 1 1 12 3378 1 1 14 PRO HD2 H -10.300 18.005 -5.355 1.00 . A A . 14 PRO HD2 1 1 12 3379 1 1 14 PRO HD3 H -9.888 19.215 -4.123 1.00 . A A . 14 PRO HD3 1 1 12 3380 1 1 14 PRO HG2 H -12.205 19.074 -5.944 1.00 . A A . 14 PRO HG2 1 1 12 3381 1 1 14 PRO HG3 H -11.421 20.483 -5.207 1.00 . A A . 14 PRO HG3 1 1 12 3382 1 1 14 PRO N N -11.310 17.776 -3.511 1.00 . A A . 14 PRO N 1 1 12 3383 1 1 14 PRO O O -14.867 17.134 -3.519 1.00 . A A . 14 PRO O 1 1 12 3384 1 1 15 SER C C -14.425 14.213 -4.441 1.00 . A A . 15 SER C 1 1 12 3385 1 1 15 SER CA C -14.025 15.307 -5.426 1.00 . A A . 15 SER CA 1 1 12 3386 1 1 15 SER CB C -13.286 14.692 -6.616 1.00 . A A . 15 SER CB 1 1 12 3387 1 1 15 SER H H -12.242 16.372 -5.014 1.00 . A A . 15 SER H 1 1 12 3388 1 1 15 SER HA H -14.918 15.798 -5.782 1.00 . A A . 15 SER HA 1 1 12 3389 1 1 15 SER HB2 H -14.004 14.359 -7.349 1.00 . A A . 15 SER HB2 1 1 12 3390 1 1 15 SER HB3 H -12.639 15.436 -7.057 1.00 . A A . 15 SER HB3 1 1 12 3391 1 1 15 SER HG H -11.890 13.860 -5.522 1.00 . A A . 15 SER HG 1 1 12 3392 1 1 15 SER N N -13.191 16.311 -4.776 1.00 . A A . 15 SER N 1 1 12 3393 1 1 15 SER O O -15.460 13.566 -4.601 1.00 . A A . 15 SER O 1 1 12 3394 1 1 15 SER OG O -12.499 13.585 -6.211 1.00 . A A . 15 SER OG 1 1 12 3395 1 1 16 SER C C -14.781 13.534 -1.322 1.00 . A A . 16 SER C 1 1 12 3396 1 1 16 SER CA C -13.860 12.993 -2.411 1.00 . A A . 16 SER CA 1 1 12 3397 1 1 16 SER CB C -12.549 12.507 -1.791 1.00 . A A . 16 SER CB 1 1 12 3398 1 1 16 SER H H -12.787 14.559 -3.348 1.00 . A A . 16 SER H 1 1 12 3399 1 1 16 SER HA H -14.348 12.162 -2.898 1.00 . A A . 16 SER HA 1 1 12 3400 1 1 16 SER HB2 H -11.832 12.316 -2.575 1.00 . A A . 16 SER HB2 1 1 12 3401 1 1 16 SER HB3 H -12.163 13.269 -1.129 1.00 . A A . 16 SER HB3 1 1 12 3402 1 1 16 SER HG H -11.999 10.727 -1.187 1.00 . A A . 16 SER HG 1 1 12 3403 1 1 16 SER N N -13.596 14.011 -3.421 1.00 . A A . 16 SER N 1 1 12 3404 1 1 16 SER O O -15.538 12.784 -0.706 1.00 . A A . 16 SER O 1 1 12 3405 1 1 16 SER OG O -12.745 11.315 -1.051 1.00 . A A . 16 SER OG 1 1 12 3406 1 1 17 GLU C C -16.963 15.681 -0.580 1.00 . A A . 17 GLU C 1 1 12 3407 1 1 17 GLU CA C -15.537 15.483 -0.075 1.00 . A A . 17 GLU CA 1 1 12 3408 1 1 17 GLU CB C -14.935 16.831 0.327 1.00 . A A . 17 GLU CB 1 1 12 3409 1 1 17 GLU CD C -15.986 16.754 2.622 1.00 . A A . 17 GLU CD 1 1 12 3410 1 1 17 GLU CG C -14.717 16.978 1.823 1.00 . A A . 17 GLU CG 1 1 12 3411 1 1 17 GLU H H -14.087 15.386 -1.615 1.00 . A A . 17 GLU H 1 1 12 3412 1 1 17 GLU HA H -15.560 14.838 0.789 1.00 . A A . 17 GLU HA 1 1 12 3413 1 1 17 GLU HB2 H -13.982 16.949 -0.169 1.00 . A A . 17 GLU HB2 1 1 12 3414 1 1 17 GLU HB3 H -15.598 17.619 0.002 1.00 . A A . 17 GLU HB3 1 1 12 3415 1 1 17 GLU HG2 H -13.978 16.256 2.139 1.00 . A A . 17 GLU HG2 1 1 12 3416 1 1 17 GLU HG3 H -14.353 17.975 2.025 1.00 . A A . 17 GLU HG3 1 1 12 3417 1 1 17 GLU N N -14.710 14.841 -1.091 1.00 . A A . 17 GLU N 1 1 12 3418 1 1 17 GLU O O -17.224 16.556 -1.405 1.00 . A A . 17 GLU O 1 1 12 3419 1 1 17 GLU OE1 O -16.300 15.583 2.921 1.00 . A A . 17 GLU OE1 1 1 12 3420 1 1 17 GLU OE2 O -16.664 17.751 2.949 1.00 . A A . 17 GLU OE2 1 1 13 3421 1 1 1 ARG C C 2.483 2.591 -1.287 1.00 . A A . 1 ARG C 1 1 13 3422 1 1 1 ARG CA C 2.663 1.265 -0.554 1.00 . A A . 1 ARG CA 1 1 13 3423 1 1 1 ARG CB C 2.039 0.131 -1.368 1.00 . A A . 1 ARG CB 1 1 13 3424 1 1 1 ARG CD C 3.535 -0.561 -3.265 1.00 . A A . 1 ARG CD 1 1 13 3425 1 1 1 ARG CG C 3.049 -0.892 -1.862 1.00 . A A . 1 ARG CG 1 1 13 3426 1 1 1 ARG CZ C 4.635 -2.672 -3.882 1.00 . A A . 1 ARG CZ 1 1 13 3427 1 1 1 ARG H1 H 2.586 1.010 1.546 1.00 . A A . 1 ARG H1 1 1 13 3428 1 1 1 ARG HA H 3.719 1.073 -0.436 1.00 . A A . 1 ARG HA 1 1 13 3429 1 1 1 ARG HB2 H 1.313 -0.381 -0.753 1.00 . A A . 1 ARG HB2 1 1 13 3430 1 1 1 ARG HB3 H 1.537 0.553 -2.226 1.00 . A A . 1 ARG HB3 1 1 13 3431 1 1 1 ARG HD2 H 2.818 0.094 -3.735 1.00 . A A . 1 ARG HD2 1 1 13 3432 1 1 1 ARG HD3 H 4.488 -0.059 -3.192 1.00 . A A . 1 ARG HD3 1 1 13 3433 1 1 1 ARG HE H 3.062 -1.888 -4.825 1.00 . A A . 1 ARG HE 1 1 13 3434 1 1 1 ARG HG2 H 3.896 -0.900 -1.192 1.00 . A A . 1 ARG HG2 1 1 13 3435 1 1 1 ARG HG3 H 2.585 -1.867 -1.871 1.00 . A A . 1 ARG HG3 1 1 13 3436 1 1 1 ARG HH11 H 5.444 -1.725 -2.292 1.00 . A A . 1 ARG HH11 1 1 13 3437 1 1 1 ARG HH12 H 6.209 -3.214 -2.737 1.00 . A A . 1 ARG HH12 1 1 13 3438 1 1 1 ARG HH21 H 4.061 -3.849 -5.422 1.00 . A A . 1 ARG HH21 1 1 13 3439 1 1 1 ARG HH22 H 5.423 -4.421 -4.519 1.00 . A A . 1 ARG HH22 1 1 13 3440 1 1 1 ARG N N 2.067 1.322 0.776 1.00 . A A . 1 ARG N 1 1 13 3441 1 1 1 ARG NE N 3.691 -1.759 -4.086 1.00 . A A . 1 ARG NE 1 1 13 3442 1 1 1 ARG NH1 N 5.501 -2.525 -2.889 1.00 . A A . 1 ARG NH1 1 1 13 3443 1 1 1 ARG NH2 N 4.712 -3.735 -4.673 1.00 . A A . 1 ARG NH2 1 1 13 3444 1 1 1 ARG O O 1.774 3.481 -0.817 1.00 . A A . 1 ARG O 1 1 13 3445 1 1 2 SER C C 1.861 3.875 -4.197 1.00 . A A . 2 SER C 1 1 13 3446 1 1 2 SER CA C 3.046 3.934 -3.238 1.00 . A A . 2 SER CA 1 1 13 3447 1 1 2 SER CB C 4.342 4.146 -4.023 1.00 . A A . 2 SER CB 1 1 13 3448 1 1 2 SER H H 3.681 1.971 -2.763 1.00 . A A . 2 SER H 1 1 13 3449 1 1 2 SER HA H 2.905 4.763 -2.561 1.00 . A A . 2 SER HA 1 1 13 3450 1 1 2 SER HB2 H 4.891 3.218 -4.064 1.00 . A A . 2 SER HB2 1 1 13 3451 1 1 2 SER HB3 H 4.103 4.468 -5.026 1.00 . A A . 2 SER HB3 1 1 13 3452 1 1 2 SER HG H 6.066 5.014 -3.687 1.00 . A A . 2 SER HG 1 1 13 3453 1 1 2 SER N N 3.131 2.715 -2.441 1.00 . A A . 2 SER N 1 1 13 3454 1 1 2 SER O O 1.259 4.898 -4.523 1.00 . A A . 2 SER O 1 1 13 3455 1 1 2 SER OG O 5.154 5.132 -3.409 1.00 . A A . 2 SER OG 1 1 13 3456 1 1 3 LYS C C -0.917 2.565 -4.835 1.00 . A A . 3 LYS C 1 1 13 3457 1 1 3 LYS CA C 0.418 2.472 -5.567 1.00 . A A . 3 LYS CA 1 1 13 3458 1 1 3 LYS CB C 0.537 1.114 -6.262 1.00 . A A . 3 LYS CB 1 1 13 3459 1 1 3 LYS CD C 1.208 -0.173 -8.313 1.00 . A A . 3 LYS CD 1 1 13 3460 1 1 3 LYS CE C 1.723 -0.075 -9.740 1.00 . A A . 3 LYS CE 1 1 13 3461 1 1 3 LYS CG C 1.181 1.187 -7.635 1.00 . A A . 3 LYS CG 1 1 13 3462 1 1 3 LYS H H 2.049 1.890 -4.350 1.00 . A A . 3 LYS H 1 1 13 3463 1 1 3 LYS HA H 0.462 3.252 -6.312 1.00 . A A . 3 LYS HA 1 1 13 3464 1 1 3 LYS HB2 H 1.132 0.457 -5.643 1.00 . A A . 3 LYS HB2 1 1 13 3465 1 1 3 LYS HB3 H -0.451 0.692 -6.373 1.00 . A A . 3 LYS HB3 1 1 13 3466 1 1 3 LYS HD2 H 1.855 -0.832 -7.753 1.00 . A A . 3 LYS HD2 1 1 13 3467 1 1 3 LYS HD3 H 0.205 -0.577 -8.328 1.00 . A A . 3 LYS HD3 1 1 13 3468 1 1 3 LYS HE2 H 1.427 0.878 -10.151 1.00 . A A . 3 LYS HE2 1 1 13 3469 1 1 3 LYS HE3 H 2.801 -0.141 -9.725 1.00 . A A . 3 LYS HE3 1 1 13 3470 1 1 3 LYS HG2 H 0.618 1.873 -8.251 1.00 . A A . 3 LYS HG2 1 1 13 3471 1 1 3 LYS HG3 H 2.195 1.546 -7.529 1.00 . A A . 3 LYS HG3 1 1 13 3472 1 1 3 LYS HZ1 H 0.144 -1.110 -10.634 1.00 . A A . 3 LYS HZ1 1 1 13 3473 1 1 3 LYS HZ2 H 1.460 -2.090 -10.221 1.00 . A A . 3 LYS HZ2 1 1 13 3474 1 1 3 LYS HZ3 H 1.554 -1.072 -11.568 1.00 . A A . 3 LYS HZ3 1 1 13 3475 1 1 3 LYS N N 1.531 2.668 -4.646 1.00 . A A . 3 LYS N 1 1 13 3476 1 1 3 LYS NZ N 1.182 -1.163 -10.601 1.00 . A A . 3 LYS NZ 1 1 13 3477 1 1 3 LYS O O -1.939 2.907 -5.429 1.00 . A A . 3 LYS O 1 1 13 3478 1 1 4 ASP C C -2.330 3.714 -2.172 1.00 . A A . 4 ASP C 1 1 13 3479 1 1 4 ASP CA C -2.109 2.311 -2.728 1.00 . A A . 4 ASP CA 1 1 13 3480 1 1 4 ASP CB C -2.020 1.303 -1.581 1.00 . A A . 4 ASP CB 1 1 13 3481 1 1 4 ASP CG C -2.997 0.155 -1.743 1.00 . A A . 4 ASP CG 1 1 13 3482 1 1 4 ASP H H -0.053 1.993 -3.125 1.00 . A A . 4 ASP H 1 1 13 3483 1 1 4 ASP HA H -2.945 2.052 -3.360 1.00 . A A . 4 ASP HA 1 1 13 3484 1 1 4 ASP HB2 H -1.020 0.897 -1.544 1.00 . A A . 4 ASP HB2 1 1 13 3485 1 1 4 ASP HB3 H -2.235 1.807 -0.651 1.00 . A A . 4 ASP HB3 1 1 13 3486 1 1 4 ASP N N -0.900 2.259 -3.542 1.00 . A A . 4 ASP N 1 1 13 3487 1 1 4 ASP O O -3.462 4.112 -1.894 1.00 . A A . 4 ASP O 1 1 13 3488 1 1 4 ASP OD1 O -2.671 -0.804 -2.474 1.00 . A A . 4 ASP OD1 1 1 13 3489 1 1 4 ASP OD2 O -4.088 0.215 -1.138 1.00 . A A . 4 ASP OD2 1 1 13 3490 1 1 5 LEU C C -1.853 6.781 -2.544 1.00 . A A . 5 LEU C 1 1 13 3491 1 1 5 LEU CA C -1.317 5.819 -1.489 1.00 . A A . 5 LEU CA 1 1 13 3492 1 1 5 LEU CB C 0.063 6.281 -1.015 1.00 . A A . 5 LEU CB 1 1 13 3493 1 1 5 LEU CD1 C -0.758 7.648 0.919 1.00 . A A . 5 LEU CD1 1 1 13 3494 1 1 5 LEU CD2 C -0.041 5.279 1.280 1.00 . A A . 5 LEU CD2 1 1 13 3495 1 1 5 LEU CG C 0.202 6.552 0.483 1.00 . A A . 5 LEU CG 1 1 13 3496 1 1 5 LEU H H -0.368 4.089 -2.252 1.00 . A A . 5 LEU H 1 1 13 3497 1 1 5 LEU HA H -1.994 5.814 -0.647 1.00 . A A . 5 LEU HA 1 1 13 3498 1 1 5 LEU HB2 H 0.776 5.516 -1.281 1.00 . A A . 5 LEU HB2 1 1 13 3499 1 1 5 LEU HB3 H 0.304 7.194 -1.542 1.00 . A A . 5 LEU HB3 1 1 13 3500 1 1 5 LEU HD11 H -0.520 8.563 0.399 1.00 . A A . 5 LEU HD11 1 1 13 3501 1 1 5 LEU HD12 H -0.667 7.804 1.984 1.00 . A A . 5 LEU HD12 1 1 13 3502 1 1 5 LEU HD13 H -1.771 7.353 0.684 1.00 . A A . 5 LEU HD13 1 1 13 3503 1 1 5 LEU HD21 H 0.815 4.627 1.188 1.00 . A A . 5 LEU HD21 1 1 13 3504 1 1 5 LEU HD22 H -0.918 4.778 0.898 1.00 . A A . 5 LEU HD22 1 1 13 3505 1 1 5 LEU HD23 H -0.194 5.529 2.320 1.00 . A A . 5 LEU HD23 1 1 13 3506 1 1 5 LEU HG H 1.208 6.890 0.689 1.00 . A A . 5 LEU HG 1 1 13 3507 1 1 5 LEU N N -1.242 4.460 -2.013 1.00 . A A . 5 LEU N 1 1 13 3508 1 1 5 LEU O O -2.459 7.801 -2.218 1.00 . A A . 5 LEU O 1 1 13 3509 1 1 6 ARG C C -3.596 7.501 -4.836 1.00 . A A . 6 ARG C 1 1 13 3510 1 1 6 ARG CA C -2.088 7.281 -4.915 1.00 . A A . 6 ARG CA 1 1 13 3511 1 1 6 ARG CB C -1.725 6.637 -6.254 1.00 . A A . 6 ARG CB 1 1 13 3512 1 1 6 ARG CD C -0.211 6.656 -8.260 1.00 . A A . 6 ARG CD 1 1 13 3513 1 1 6 ARG CG C -0.731 7.447 -7.070 1.00 . A A . 6 ARG CG 1 1 13 3514 1 1 6 ARG CZ C 2.216 6.563 -7.877 1.00 . A A . 6 ARG CZ 1 1 13 3515 1 1 6 ARG H H -1.137 5.621 -4.008 1.00 . A A . 6 ARG H 1 1 13 3516 1 1 6 ARG HA H -1.592 8.236 -4.839 1.00 . A A . 6 ARG HA 1 1 13 3517 1 1 6 ARG HB2 H -1.296 5.663 -6.068 1.00 . A A . 6 ARG HB2 1 1 13 3518 1 1 6 ARG HB3 H -2.625 6.519 -6.838 1.00 . A A . 6 ARG HB3 1 1 13 3519 1 1 6 ARG HD2 H -0.957 5.929 -8.546 1.00 . A A . 6 ARG HD2 1 1 13 3520 1 1 6 ARG HD3 H -0.039 7.336 -9.080 1.00 . A A . 6 ARG HD3 1 1 13 3521 1 1 6 ARG HE H 0.988 4.993 -7.794 1.00 . A A . 6 ARG HE 1 1 13 3522 1 1 6 ARG HG2 H -1.218 8.340 -7.431 1.00 . A A . 6 ARG HG2 1 1 13 3523 1 1 6 ARG HG3 H 0.102 7.719 -6.438 1.00 . A A . 6 ARG HG3 1 1 13 3524 1 1 6 ARG HH11 H 1.491 8.400 -8.300 1.00 . A A . 6 ARG HH11 1 1 13 3525 1 1 6 ARG HH12 H 3.200 8.321 -8.027 1.00 . A A . 6 ARG HH12 1 1 13 3526 1 1 6 ARG HH21 H 3.237 4.876 -7.433 1.00 . A A . 6 ARG HH21 1 1 13 3527 1 1 6 ARG HH22 H 4.192 6.315 -7.535 1.00 . A A . 6 ARG HH22 1 1 13 3528 1 1 6 ARG N N -1.627 6.447 -3.811 1.00 . A A . 6 ARG N 1 1 13 3529 1 1 6 ARG NE N 1.035 5.959 -7.952 1.00 . A A . 6 ARG NE 1 1 13 3530 1 1 6 ARG NH1 N 2.310 7.868 -8.086 1.00 . A A . 6 ARG NH1 1 1 13 3531 1 1 6 ARG NH2 N 3.305 5.860 -7.592 1.00 . A A . 6 ARG NH2 1 1 13 3532 1 1 6 ARG O O -4.102 8.549 -5.240 1.00 . A A . 6 ARG O 1 1 13 3533 1 1 7 HIS C C -6.145 7.502 -3.019 1.00 . A A . 7 HIS C 1 1 13 3534 1 1 7 HIS CA C -5.758 6.593 -4.182 1.00 . A A . 7 HIS CA 1 1 13 3535 1 1 7 HIS CB C -6.356 5.201 -3.978 1.00 . A A . 7 HIS CB 1 1 13 3536 1 1 7 HIS CD2 C -8.740 4.480 -4.698 1.00 . A A . 7 HIS CD2 1 1 13 3537 1 1 7 HIS CE1 C -8.475 4.621 -6.870 1.00 . A A . 7 HIS CE1 1 1 13 3538 1 1 7 HIS CG C -7.468 4.882 -4.928 1.00 . A A . 7 HIS CG 1 1 13 3539 1 1 7 HIS H H -3.847 5.698 -4.010 1.00 . A A . 7 HIS H 1 1 13 3540 1 1 7 HIS HA H -6.150 7.013 -5.096 1.00 . A A . 7 HIS HA 1 1 13 3541 1 1 7 HIS HB2 H -5.581 4.461 -4.114 1.00 . A A . 7 HIS HB2 1 1 13 3542 1 1 7 HIS HB3 H -6.745 5.128 -2.972 1.00 . A A . 7 HIS HB3 1 1 13 3543 1 1 7 HIS HD1 H -6.523 5.225 -6.779 1.00 . A A . 7 HIS HD1 1 1 13 3544 1 1 7 HIS HD2 H -9.196 4.312 -3.733 1.00 . A A . 7 HIS HD2 1 1 13 3545 1 1 7 HIS HE1 H -8.666 4.591 -7.933 1.00 . A A . 7 HIS HE1 1 1 13 3546 1 1 7 HIS N N -4.308 6.508 -4.314 1.00 . A A . 7 HIS N 1 1 13 3547 1 1 7 HIS ND1 N -7.334 4.960 -6.298 1.00 . A A . 7 HIS ND1 1 1 13 3548 1 1 7 HIS NE2 N -9.345 4.325 -5.921 1.00 . A A . 7 HIS NE2 1 1 13 3549 1 1 7 HIS O O -7.275 7.985 -2.946 1.00 . A A . 7 HIS O 1 1 13 3550 1 1 8 ALA C C -5.438 10.054 -1.345 1.00 . A A . 8 ALA C 1 1 13 3551 1 1 8 ALA CA C -5.443 8.580 -0.954 1.00 . A A . 8 ALA CA 1 1 13 3552 1 1 8 ALA CB C -4.401 8.315 0.123 1.00 . A A . 8 ALA CB 1 1 13 3553 1 1 8 ALA H H -4.320 7.316 -2.226 1.00 . A A . 8 ALA H 1 1 13 3554 1 1 8 ALA HA H -6.414 8.328 -0.551 1.00 . A A . 8 ALA HA 1 1 13 3555 1 1 8 ALA HB1 H -3.877 7.398 -0.103 1.00 . A A . 8 ALA HB1 1 1 13 3556 1 1 8 ALA HB2 H -3.698 9.134 0.153 1.00 . A A . 8 ALA HB2 1 1 13 3557 1 1 8 ALA HB3 H -4.890 8.224 1.081 1.00 . A A . 8 ALA HB3 1 1 13 3558 1 1 8 ALA N N -5.201 7.729 -2.112 1.00 . A A . 8 ALA N 1 1 13 3559 1 1 8 ALA O O -6.017 10.892 -0.653 1.00 . A A . 8 ALA O 1 1 13 3560 1 1 9 PHE C C -6.084 12.273 -3.294 1.00 . A A . 9 PHE C 1 1 13 3561 1 1 9 PHE CA C -4.700 11.738 -2.940 1.00 . A A . 9 PHE CA 1 1 13 3562 1 1 9 PHE CB C -3.782 11.819 -4.162 1.00 . A A . 9 PHE CB 1 1 13 3563 1 1 9 PHE CD1 C -1.632 12.119 -2.902 1.00 . A A . 9 PHE CD1 1 1 13 3564 1 1 9 PHE CD2 C -2.150 13.663 -4.644 1.00 . A A . 9 PHE CD2 1 1 13 3565 1 1 9 PHE CE1 C -0.448 12.788 -2.657 1.00 . A A . 9 PHE CE1 1 1 13 3566 1 1 9 PHE CE2 C -0.967 14.335 -4.403 1.00 . A A . 9 PHE CE2 1 1 13 3567 1 1 9 PHE CG C -2.496 12.548 -3.897 1.00 . A A . 9 PHE CG 1 1 13 3568 1 1 9 PHE CZ C -0.115 13.898 -3.408 1.00 . A A . 9 PHE CZ 1 1 13 3569 1 1 9 PHE H H -4.340 9.652 -2.967 1.00 . A A . 9 PHE H 1 1 13 3570 1 1 9 PHE HA H -4.286 12.342 -2.148 1.00 . A A . 9 PHE HA 1 1 13 3571 1 1 9 PHE HB2 H -3.535 10.818 -4.484 1.00 . A A . 9 PHE HB2 1 1 13 3572 1 1 9 PHE HB3 H -4.299 12.332 -4.958 1.00 . A A . 9 PHE HB3 1 1 13 3573 1 1 9 PHE HD1 H -1.892 11.250 -2.314 1.00 . A A . 9 PHE HD1 1 1 13 3574 1 1 9 PHE HD2 H -2.816 14.007 -5.422 1.00 . A A . 9 PHE HD2 1 1 13 3575 1 1 9 PHE HE1 H 0.216 12.443 -1.878 1.00 . A A . 9 PHE HE1 1 1 13 3576 1 1 9 PHE HE2 H -0.709 15.204 -4.992 1.00 . A A . 9 PHE HE2 1 1 13 3577 1 1 9 PHE HZ H 0.810 14.421 -3.218 1.00 . A A . 9 PHE HZ 1 1 13 3578 1 1 9 PHE N N -4.781 10.364 -2.458 1.00 . A A . 9 PHE N 1 1 13 3579 1 1 9 PHE O O -6.325 13.479 -3.252 1.00 . A A . 9 PHE O 1 1 13 3580 1 1 10 ARG C C -9.156 12.134 -2.772 1.00 . A A . 10 ARG C 1 1 13 3581 1 1 10 ARG CA C -8.350 11.746 -4.009 1.00 . A A . 10 ARG CA 1 1 13 3582 1 1 10 ARG CB C -9.045 10.597 -4.742 1.00 . A A . 10 ARG CB 1 1 13 3583 1 1 10 ARG CD C -8.452 11.195 -7.110 1.00 . A A . 10 ARG CD 1 1 13 3584 1 1 10 ARG CG C -8.324 10.157 -6.006 1.00 . A A . 10 ARG CG 1 1 13 3585 1 1 10 ARG CZ C -6.869 10.445 -8.835 1.00 . A A . 10 ARG CZ 1 1 13 3586 1 1 10 ARG H H -6.739 10.419 -3.660 1.00 . A A . 10 ARG H 1 1 13 3587 1 1 10 ARG HA H -8.292 12.599 -4.668 1.00 . A A . 10 ARG HA 1 1 13 3588 1 1 10 ARG HB2 H -9.110 9.748 -4.077 1.00 . A A . 10 ARG HB2 1 1 13 3589 1 1 10 ARG HB3 H -10.042 10.909 -5.012 1.00 . A A . 10 ARG HB3 1 1 13 3590 1 1 10 ARG HD2 H -9.470 11.554 -7.132 1.00 . A A . 10 ARG HD2 1 1 13 3591 1 1 10 ARG HD3 H -7.785 12.016 -6.892 1.00 . A A . 10 ARG HD3 1 1 13 3592 1 1 10 ARG HE H -8.855 10.414 -9.019 1.00 . A A . 10 ARG HE 1 1 13 3593 1 1 10 ARG HG2 H -7.277 10.014 -5.781 1.00 . A A . 10 ARG HG2 1 1 13 3594 1 1 10 ARG HG3 H -8.751 9.226 -6.347 1.00 . A A . 10 ARG HG3 1 1 13 3595 1 1 10 ARG HH11 H -6.015 11.127 -7.137 1.00 . A A . 10 ARG HH11 1 1 13 3596 1 1 10 ARG HH12 H -4.910 10.595 -8.362 1.00 . A A . 10 ARG HH12 1 1 13 3597 1 1 10 ARG HH21 H -7.412 9.710 -10.639 1.00 . A A . 10 ARG HH21 1 1 13 3598 1 1 10 ARG HH22 H -5.706 9.790 -10.353 1.00 . A A . 10 ARG HH22 1 1 13 3599 1 1 10 ARG N N -6.991 11.366 -3.645 1.00 . A A . 10 ARG N 1 1 13 3600 1 1 10 ARG NE N -8.115 10.645 -8.420 1.00 . A A . 10 ARG NE 1 1 13 3601 1 1 10 ARG NH1 N -5.848 10.748 -8.047 1.00 . A A . 10 ARG NH1 1 1 13 3602 1 1 10 ARG NH2 N -6.644 9.940 -10.042 1.00 . A A . 10 ARG NH2 1 1 13 3603 1 1 10 ARG O O -10.095 12.920 -2.887 1.00 . A A . 10 ARG O 1 1 13 3604 1 1 11 . C C -9.294 13.338 -0.001 1.00 . A A . 11 SEP C 1 1 13 3605 1 1 11 . CA C -9.488 11.886 -0.353 1.00 . A A . 11 SEP CA 1 1 13 3606 1 1 11 . CB C -9.065 10.875 0.753 1.00 . A A . 11 SEP CB 1 1 13 3607 1 1 11 . H H -7.994 10.942 -1.600 1.00 . A A . 11 SEP H 1 1 13 3608 1 1 11 . HA H -10.566 11.735 -0.554 1.00 . A A . 11 SEP HA 1 1 13 3609 1 1 11 . HB2 H -9.343 9.835 0.501 1.00 . A A . 11 SEP HB2 1 1 13 3610 1 1 11 . HB3 H -7.964 10.836 0.879 1.00 . A A . 11 SEP HB3 1 1 13 3611 1 1 11 . N N -8.776 11.582 -1.629 1.00 . A A . 11 SEP N 1 1 13 3612 1 1 11 . O O -10.185 14.021 0.504 1.00 . A A . 11 SEP O 1 1 13 3613 1 1 11 . O1P O -8.411 10.676 4.180 1.00 . A A . 11 SEP O1P 1 1 13 3614 1 1 11 . O2P O -7.570 12.464 2.676 1.00 . A A . 11 SEP O2P 1 1 13 3615 1 1 11 . O3P O -9.658 12.852 4.008 1.00 . A A . 11 SEP O3P 1 1 13 3616 1 1 11 . OG O -9.678 11.207 2.021 1.00 . A A . 11 SEP OG 1 1 13 3617 1 1 11 . P P -8.831 11.816 3.259 1.00 . A A . 11 SEP P 1 1 13 3618 1 1 12 MET C C -8.434 16.148 -0.975 1.00 . A A . 12 MET C 1 1 13 3619 1 1 12 MET CA C -7.731 15.204 -0.005 1.00 . A A . 12 MET CA 1 1 13 3620 1 1 12 MET CB C -6.216 15.393 -0.097 1.00 . A A . 12 MET CB 1 1 13 3621 1 1 12 MET CE C -3.778 18.142 0.576 1.00 . A A . 12 MET CE 1 1 13 3622 1 1 12 MET CG C -5.623 16.138 1.088 1.00 . A A . 12 MET CG 1 1 13 3623 1 1 12 MET H H -7.417 13.224 -0.683 1.00 . A A . 12 MET H 1 1 13 3624 1 1 12 MET HA H -8.053 15.434 1.000 1.00 . A A . 12 MET HA 1 1 13 3625 1 1 12 MET HB2 H -5.746 14.423 -0.157 1.00 . A A . 12 MET HB2 1 1 13 3626 1 1 12 MET HB3 H -5.988 15.950 -0.994 1.00 . A A . 12 MET HB3 1 1 13 3627 1 1 12 MET HE1 H -3.597 18.520 -0.420 1.00 . A A . 12 MET HE1 1 1 13 3628 1 1 12 MET HE2 H -3.401 18.846 1.303 1.00 . A A . 12 MET HE2 1 1 13 3629 1 1 12 MET HE3 H -3.275 17.194 0.699 1.00 . A A . 12 MET HE3 1 1 13 3630 1 1 12 MET HG2 H -6.234 15.948 1.958 1.00 . A A . 12 MET HG2 1 1 13 3631 1 1 12 MET HG3 H -4.624 15.766 1.265 1.00 . A A . 12 MET HG3 1 1 13 3632 1 1 12 MET N N -8.086 13.817 -0.281 1.00 . A A . 12 MET N 1 1 13 3633 1 1 12 MET O O -8.663 17.317 -0.662 1.00 . A A . 12 MET O 1 1 13 3634 1 1 12 MET SD S -5.539 17.918 0.818 1.00 . A A . 12 MET SD 1 1 13 3635 1 1 13 PHE C C -10.882 16.748 -2.749 1.00 . A A . 13 PHE C 1 1 13 3636 1 1 13 PHE CA C -9.448 16.433 -3.169 1.00 . A A . 13 PHE CA 1 1 13 3637 1 1 13 PHE CB C -9.447 15.697 -4.510 1.00 . A A . 13 PHE CB 1 1 13 3638 1 1 13 PHE CD1 C -7.024 16.119 -5.004 1.00 . A A . 13 PHE CD1 1 1 13 3639 1 1 13 PHE CD2 C -8.621 16.546 -6.722 1.00 . A A . 13 PHE CD2 1 1 13 3640 1 1 13 PHE CE1 C -6.005 16.517 -5.849 1.00 . A A . 13 PHE CE1 1 1 13 3641 1 1 13 PHE CE2 C -7.606 16.945 -7.571 1.00 . A A . 13 PHE CE2 1 1 13 3642 1 1 13 PHE CG C -8.342 16.129 -5.430 1.00 . A A . 13 PHE CG 1 1 13 3643 1 1 13 PHE CZ C -6.296 16.929 -7.134 1.00 . A A . 13 PHE CZ 1 1 13 3644 1 1 13 PHE H H -8.563 14.696 -2.343 1.00 . A A . 13 PHE H 1 1 13 3645 1 1 13 PHE HA H -8.906 17.360 -3.276 1.00 . A A . 13 PHE HA 1 1 13 3646 1 1 13 PHE HB2 H -9.335 14.638 -4.331 1.00 . A A . 13 PHE HB2 1 1 13 3647 1 1 13 PHE HB3 H -10.387 15.875 -5.011 1.00 . A A . 13 PHE HB3 1 1 13 3648 1 1 13 PHE HD1 H -6.794 15.795 -3.999 1.00 . A A . 13 PHE HD1 1 1 13 3649 1 1 13 PHE HD2 H -9.646 16.559 -7.065 1.00 . A A . 13 PHE HD2 1 1 13 3650 1 1 13 PHE HE1 H -4.981 16.503 -5.505 1.00 . A A . 13 PHE HE1 1 1 13 3651 1 1 13 PHE HE2 H -7.838 17.267 -8.576 1.00 . A A . 13 PHE HE2 1 1 13 3652 1 1 13 PHE HZ H -5.502 17.241 -7.796 1.00 . A A . 13 PHE HZ 1 1 13 3653 1 1 13 PHE N N -8.773 15.635 -2.152 1.00 . A A . 13 PHE N 1 1 13 3654 1 1 13 PHE O O -11.450 16.111 -1.862 1.00 . A A . 13 PHE O 1 1 13 3655 1 1 14 PRO C C -13.889 17.200 -3.662 1.00 . A A . 14 PRO C 1 1 13 3656 1 1 14 PRO CA C -12.855 18.178 -3.115 1.00 . A A . 14 PRO CA 1 1 13 3657 1 1 14 PRO CB C -12.966 19.528 -3.827 1.00 . A A . 14 PRO CB 1 1 13 3658 1 1 14 PRO CD C -10.864 18.558 -4.471 1.00 . A A . 14 PRO CD 1 1 13 3659 1 1 14 PRO CG C -11.968 19.458 -4.930 1.00 . A A . 14 PRO CG 1 1 13 3660 1 1 14 PRO HA H -13.015 18.313 -2.055 1.00 . A A . 14 PRO HA 1 1 13 3661 1 1 14 PRO HB2 H -13.970 19.655 -4.208 1.00 . A A . 14 PRO HB2 1 1 13 3662 1 1 14 PRO HB3 H -12.735 20.324 -3.135 1.00 . A A . 14 PRO HB3 1 1 13 3663 1 1 14 PRO HD2 H -10.542 17.930 -5.288 1.00 . A A . 14 PRO HD2 1 1 13 3664 1 1 14 PRO HD3 H -10.036 19.136 -4.088 1.00 . A A . 14 PRO HD3 1 1 13 3665 1 1 14 PRO HG2 H -12.429 19.050 -5.817 1.00 . A A . 14 PRO HG2 1 1 13 3666 1 1 14 PRO HG3 H -11.573 20.443 -5.131 1.00 . A A . 14 PRO HG3 1 1 13 3667 1 1 14 PRO N N -11.481 17.755 -3.402 1.00 . A A . 14 PRO N 1 1 13 3668 1 1 14 PRO O O -15.054 17.228 -3.266 1.00 . A A . 14 PRO O 1 1 13 3669 1 1 15 SER C C -14.740 14.282 -4.163 1.00 . A A . 15 SER C 1 1 13 3670 1 1 15 SER CA C -14.344 15.350 -5.178 1.00 . A A . 15 SER CA 1 1 13 3671 1 1 15 SER CB C -13.671 14.698 -6.386 1.00 . A A . 15 SER CB 1 1 13 3672 1 1 15 SER H H -12.514 16.363 -4.848 1.00 . A A . 15 SER H 1 1 13 3673 1 1 15 SER HA H -15.234 15.865 -5.507 1.00 . A A . 15 SER HA 1 1 13 3674 1 1 15 SER HB2 H -13.118 15.445 -6.935 1.00 . A A . 15 SER HB2 1 1 13 3675 1 1 15 SER HB3 H -12.994 13.927 -6.045 1.00 . A A . 15 SER HB3 1 1 13 3676 1 1 15 SER HG H -14.433 13.181 -7.365 1.00 . A A . 15 SER HG 1 1 13 3677 1 1 15 SER N N -13.455 16.335 -4.574 1.00 . A A . 15 SER N 1 1 13 3678 1 1 15 SER O O -15.801 13.667 -4.275 1.00 . A A . 15 SER O 1 1 13 3679 1 1 15 SER OG O -14.630 14.113 -7.251 1.00 . A A . 15 SER OG 1 1 13 3680 1 1 16 SER C C -15.031 13.642 -1.044 1.00 . A A . 16 SER C 1 1 13 3681 1 1 16 SER CA C -14.137 13.070 -2.140 1.00 . A A . 16 SER CA 1 1 13 3682 1 1 16 SER CB C -12.820 12.581 -1.535 1.00 . A A . 16 SER CB 1 1 13 3683 1 1 16 SER H H -13.051 14.589 -3.138 1.00 . A A . 16 SER H 1 1 13 3684 1 1 16 SER HA H -14.643 12.236 -2.603 1.00 . A A . 16 SER HA 1 1 13 3685 1 1 16 SER HB2 H -12.372 11.854 -2.195 1.00 . A A . 16 SER HB2 1 1 13 3686 1 1 16 SER HB3 H -12.149 13.419 -1.414 1.00 . A A . 16 SER HB3 1 1 13 3687 1 1 16 SER HG H -13.067 11.025 -0.371 1.00 . A A . 16 SER HG 1 1 13 3688 1 1 16 SER N N -13.880 14.067 -3.173 1.00 . A A . 16 SER N 1 1 13 3689 1 1 16 SER O O -15.824 12.923 -0.438 1.00 . A A . 16 SER O 1 1 13 3690 1 1 16 SER OG O -13.032 11.979 -0.270 1.00 . A A . 16 SER OG 1 1 13 3691 1 1 17 GLU C C -17.096 15.912 -0.287 1.00 . A A . 17 GLU C 1 1 13 3692 1 1 17 GLU CA C -15.692 15.610 0.227 1.00 . A A . 17 GLU CA 1 1 13 3693 1 1 17 GLU CB C -15.009 16.906 0.669 1.00 . A A . 17 GLU CB 1 1 13 3694 1 1 17 GLU CD C -13.339 15.995 2.332 1.00 . A A . 17 GLU CD 1 1 13 3695 1 1 17 GLU CG C -14.547 16.887 2.116 1.00 . A A . 17 GLU CG 1 1 13 3696 1 1 17 GLU H H -14.247 15.462 -1.314 1.00 . A A . 17 GLU H 1 1 13 3697 1 1 17 GLU HA H -15.767 14.946 1.074 1.00 . A A . 17 GLU HA 1 1 13 3698 1 1 17 GLU HB2 H -14.148 17.078 0.040 1.00 . A A . 17 GLU HB2 1 1 13 3699 1 1 17 GLU HB3 H -15.703 17.724 0.545 1.00 . A A . 17 GLU HB3 1 1 13 3700 1 1 17 GLU HG2 H -14.289 17.893 2.412 1.00 . A A . 17 GLU HG2 1 1 13 3701 1 1 17 GLU HG3 H -15.356 16.528 2.735 1.00 . A A . 17 GLU HG3 1 1 13 3702 1 1 17 GLU N N -14.897 14.941 -0.797 1.00 . A A . 17 GLU N 1 1 13 3703 1 1 17 GLU O O -17.923 15.012 -0.428 1.00 . A A . 17 GLU O 1 1 13 3704 1 1 17 GLU OE1 O -12.583 15.775 1.363 1.00 . A A . 17 GLU OE1 1 1 13 3705 1 1 17 GLU OE2 O -13.150 15.518 3.470 1.00 . A A . 17 GLU OE2 1 1 14 3706 1 1 1 ARG C C 2.823 1.539 -2.705 1.00 . A A . 1 ARG C 1 1 14 3707 1 1 1 ARG CA C 3.049 0.082 -2.309 1.00 . A A . 1 ARG CA 1 1 14 3708 1 1 1 ARG CB C 2.114 -0.295 -1.159 1.00 . A A . 1 ARG CB 1 1 14 3709 1 1 1 ARG CD C 1.653 -0.231 1.311 1.00 . A A . 1 ARG CD 1 1 14 3710 1 1 1 ARG CG C 2.543 0.271 0.185 1.00 . A A . 1 ARG CG 1 1 14 3711 1 1 1 ARG CZ C 1.513 1.634 2.906 1.00 . A A . 1 ARG CZ 1 1 14 3712 1 1 1 ARG H1 H 4.637 -0.744 -1.180 1.00 . A A . 1 ARG H1 1 1 14 3713 1 1 1 ARG HA H 2.831 -0.547 -3.159 1.00 . A A . 1 ARG HA 1 1 14 3714 1 1 1 ARG HB2 H 1.123 0.072 -1.380 1.00 . A A . 1 ARG HB2 1 1 14 3715 1 1 1 ARG HB3 H 2.080 -1.371 -1.077 1.00 . A A . 1 ARG HB3 1 1 14 3716 1 1 1 ARG HD2 H 0.925 -0.914 0.899 1.00 . A A . 1 ARG HD2 1 1 14 3717 1 1 1 ARG HD3 H 2.266 -0.752 2.031 1.00 . A A . 1 ARG HD3 1 1 14 3718 1 1 1 ARG HE H 0.019 1.021 1.735 1.00 . A A . 1 ARG HE 1 1 14 3719 1 1 1 ARG HG2 H 3.561 -0.030 0.384 1.00 . A A . 1 ARG HG2 1 1 14 3720 1 1 1 ARG HG3 H 2.485 1.349 0.146 1.00 . A A . 1 ARG HG3 1 1 14 3721 1 1 1 ARG HH11 H 3.307 0.708 2.837 1.00 . A A . 1 ARG HH11 1 1 14 3722 1 1 1 ARG HH12 H 3.195 2.025 3.957 1.00 . A A . 1 ARG HH12 1 1 14 3723 1 1 1 ARG HH21 H -0.141 2.757 3.206 1.00 . A A . 1 ARG HH21 1 1 14 3724 1 1 1 ARG HH22 H 1.233 3.189 4.167 1.00 . A A . 1 ARG HH22 1 1 14 3725 1 1 1 ARG N N 4.438 -0.143 -1.928 1.00 . A A . 1 ARG N 1 1 14 3726 1 1 1 ARG NE N 0.953 0.860 1.984 1.00 . A A . 1 ARG NE 1 1 14 3727 1 1 1 ARG NH1 N 2.775 1.439 3.263 1.00 . A A . 1 ARG NH1 1 1 14 3728 1 1 1 ARG NH2 N 0.811 2.607 3.473 1.00 . A A . 1 ARG NH2 1 1 14 3729 1 1 1 ARG O O 1.885 2.182 -2.235 1.00 . A A . 1 ARG O 1 1 14 3730 1 1 2 SER C C 2.410 3.607 -4.978 1.00 . A A . 2 SER C 1 1 14 3731 1 1 2 SER CA C 3.589 3.434 -4.027 1.00 . A A . 2 SER CA 1 1 14 3732 1 1 2 SER CB C 4.885 3.862 -4.719 1.00 . A A . 2 SER CB 1 1 14 3733 1 1 2 SER H H 4.418 1.489 -3.909 1.00 . A A . 2 SER H 1 1 14 3734 1 1 2 SER HA H 3.432 4.058 -3.160 1.00 . A A . 2 SER HA 1 1 14 3735 1 1 2 SER HB2 H 5.607 4.158 -3.974 1.00 . A A . 2 SER HB2 1 1 14 3736 1 1 2 SER HB3 H 5.275 3.031 -5.290 1.00 . A A . 2 SER HB3 1 1 14 3737 1 1 2 SER HG H 5.358 5.600 -5.487 1.00 . A A . 2 SER HG 1 1 14 3738 1 1 2 SER N N 3.691 2.052 -3.571 1.00 . A A . 2 SER N 1 1 14 3739 1 1 2 SER O O 1.826 4.687 -5.074 1.00 . A A . 2 SER O 1 1 14 3740 1 1 2 SER OG O 4.659 4.952 -5.595 1.00 . A A . 2 SER OG 1 1 14 3741 1 1 3 LYS C C -0.385 2.601 -5.892 1.00 . A A . 3 LYS C 1 1 14 3742 1 1 3 LYS CA C 0.952 2.563 -6.626 1.00 . A A . 3 LYS CA 1 1 14 3743 1 1 3 LYS CB C 1.007 1.342 -7.547 1.00 . A A . 3 LYS CB 1 1 14 3744 1 1 3 LYS CD C 0.050 0.132 -9.529 1.00 . A A . 3 LYS CD 1 1 14 3745 1 1 3 LYS CE C -1.003 0.157 -10.627 1.00 . A A . 3 LYS CE 1 1 14 3746 1 1 3 LYS CG C -0.095 1.320 -8.592 1.00 . A A . 3 LYS CG 1 1 14 3747 1 1 3 LYS H H 2.566 1.701 -5.561 1.00 . A A . 3 LYS H 1 1 14 3748 1 1 3 LYS HA H 1.047 3.458 -7.222 1.00 . A A . 3 LYS HA 1 1 14 3749 1 1 3 LYS HB2 H 1.959 1.333 -8.057 1.00 . A A . 3 LYS HB2 1 1 14 3750 1 1 3 LYS HB3 H 0.921 0.449 -6.945 1.00 . A A . 3 LYS HB3 1 1 14 3751 1 1 3 LYS HD2 H 1.028 0.161 -9.985 1.00 . A A . 3 LYS HD2 1 1 14 3752 1 1 3 LYS HD3 H -0.058 -0.780 -8.959 1.00 . A A . 3 LYS HD3 1 1 14 3753 1 1 3 LYS HE2 H -1.874 0.678 -10.260 1.00 . A A . 3 LYS HE2 1 1 14 3754 1 1 3 LYS HE3 H -0.602 0.682 -11.481 1.00 . A A . 3 LYS HE3 1 1 14 3755 1 1 3 LYS HG2 H -1.051 1.257 -8.094 1.00 . A A . 3 LYS HG2 1 1 14 3756 1 1 3 LYS HG3 H -0.048 2.231 -9.171 1.00 . A A . 3 LYS HG3 1 1 14 3757 1 1 3 LYS HZ1 H -2.084 -1.168 -11.827 1.00 . A A . 3 LYS HZ1 1 1 14 3758 1 1 3 LYS HZ2 H -1.838 -1.720 -10.247 1.00 . A A . 3 LYS HZ2 1 1 14 3759 1 1 3 LYS HZ3 H -0.565 -1.749 -11.360 1.00 . A A . 3 LYS HZ3 1 1 14 3760 1 1 3 LYS N N 2.063 2.534 -5.681 1.00 . A A . 3 LYS N 1 1 14 3761 1 1 3 LYS NZ N -1.400 -1.216 -11.045 1.00 . A A . 3 LYS NZ 1 1 14 3762 1 1 3 LYS O O -1.354 3.184 -6.378 1.00 . A A . 3 LYS O 1 1 14 3763 1 1 4 ASP C C -1.860 3.267 -3.195 1.00 . A A . 4 ASP C 1 1 14 3764 1 1 4 ASP CA C -1.647 1.941 -3.919 1.00 . A A . 4 ASP CA 1 1 14 3765 1 1 4 ASP CB C -1.582 0.798 -2.905 1.00 . A A . 4 ASP CB 1 1 14 3766 1 1 4 ASP CG C -2.600 -0.289 -3.193 1.00 . A A . 4 ASP CG 1 1 14 3767 1 1 4 ASP H H 0.377 1.530 -4.386 1.00 . A A . 4 ASP H 1 1 14 3768 1 1 4 ASP HA H -2.478 1.772 -4.586 1.00 . A A . 4 ASP HA 1 1 14 3769 1 1 4 ASP HB2 H -0.596 0.357 -2.931 1.00 . A A . 4 ASP HB2 1 1 14 3770 1 1 4 ASP HB3 H -1.771 1.190 -1.917 1.00 . A A . 4 ASP HB3 1 1 14 3771 1 1 4 ASP N N -0.429 1.977 -4.720 1.00 . A A . 4 ASP N 1 1 14 3772 1 1 4 ASP O O -2.991 3.643 -2.886 1.00 . A A . 4 ASP O 1 1 14 3773 1 1 4 ASP OD1 O -3.811 -0.018 -3.057 1.00 . A A . 4 ASP OD1 1 1 14 3774 1 1 4 ASP OD2 O -2.185 -1.410 -3.553 1.00 . A A . 4 ASP OD2 1 1 14 3775 1 1 5 LEU C C -1.339 6.349 -3.174 1.00 . A A . 5 LEU C 1 1 14 3776 1 1 5 LEU CA C -0.832 5.256 -2.239 1.00 . A A . 5 LEU CA 1 1 14 3777 1 1 5 LEU CB C 0.545 5.635 -1.691 1.00 . A A . 5 LEU CB 1 1 14 3778 1 1 5 LEU CD1 C 2.242 5.389 0.136 1.00 . A A . 5 LEU CD1 1 1 14 3779 1 1 5 LEU CD2 C 0.041 6.476 0.616 1.00 . A A . 5 LEU CD2 1 1 14 3780 1 1 5 LEU CG C 0.758 5.406 -0.194 1.00 . A A . 5 LEU CG 1 1 14 3781 1 1 5 LEU H H 0.107 3.621 -3.198 1.00 . A A . 5 LEU H 1 1 14 3782 1 1 5 LEU HA H -1.523 5.155 -1.415 1.00 . A A . 5 LEU HA 1 1 14 3783 1 1 5 LEU HB2 H 1.283 5.055 -2.223 1.00 . A A . 5 LEU HB2 1 1 14 3784 1 1 5 LEU HB3 H 0.702 6.686 -1.892 1.00 . A A . 5 LEU HB3 1 1 14 3785 1 1 5 LEU HD11 H 2.691 4.494 -0.267 1.00 . A A . 5 LEU HD11 1 1 14 3786 1 1 5 LEU HD12 H 2.372 5.405 1.208 1.00 . A A . 5 LEU HD12 1 1 14 3787 1 1 5 LEU HD13 H 2.717 6.257 -0.296 1.00 . A A . 5 LEU HD13 1 1 14 3788 1 1 5 LEU HD21 H 0.760 7.019 1.211 1.00 . A A . 5 LEU HD21 1 1 14 3789 1 1 5 LEU HD22 H -0.684 6.008 1.266 1.00 . A A . 5 LEU HD22 1 1 14 3790 1 1 5 LEU HD23 H -0.462 7.158 -0.053 1.00 . A A . 5 LEU HD23 1 1 14 3791 1 1 5 LEU HG H 0.345 4.445 0.079 1.00 . A A . 5 LEU HG 1 1 14 3792 1 1 5 LEU N N -0.766 3.972 -2.927 1.00 . A A . 5 LEU N 1 1 14 3793 1 1 5 LEU O O -1.938 7.330 -2.731 1.00 . A A . 5 LEU O 1 1 14 3794 1 1 6 ARG C C -3.035 7.375 -5.383 1.00 . A A . 6 ARG C 1 1 14 3795 1 1 6 ARG CA C -1.529 7.144 -5.466 1.00 . A A . 6 ARG CA 1 1 14 3796 1 1 6 ARG CB C -1.153 6.667 -6.870 1.00 . A A . 6 ARG CB 1 1 14 3797 1 1 6 ARG CD C -0.017 7.397 -8.990 1.00 . A A . 6 ARG CD 1 1 14 3798 1 1 6 ARG CG C 0.029 7.412 -7.470 1.00 . A A . 6 ARG CG 1 1 14 3799 1 1 6 ARG CZ C 1.436 8.053 -10.861 1.00 . A A . 6 ARG CZ 1 1 14 3800 1 1 6 ARG H H -0.615 5.371 -4.760 1.00 . A A . 6 ARG H 1 1 14 3801 1 1 6 ARG HA H -1.023 8.076 -5.264 1.00 . A A . 6 ARG HA 1 1 14 3802 1 1 6 ARG HB2 H -0.903 5.617 -6.826 1.00 . A A . 6 ARG HB2 1 1 14 3803 1 1 6 ARG HB3 H -2.003 6.800 -7.522 1.00 . A A . 6 ARG HB3 1 1 14 3804 1 1 6 ARG HD2 H 0.018 6.372 -9.328 1.00 . A A . 6 ARG HD2 1 1 14 3805 1 1 6 ARG HD3 H -0.942 7.851 -9.313 1.00 . A A . 6 ARG HD3 1 1 14 3806 1 1 6 ARG HE H 1.629 8.704 -8.986 1.00 . A A . 6 ARG HE 1 1 14 3807 1 1 6 ARG HG2 H 0.006 8.437 -7.130 1.00 . A A . 6 ARG HG2 1 1 14 3808 1 1 6 ARG HG3 H 0.943 6.941 -7.141 1.00 . A A . 6 ARG HG3 1 1 14 3809 1 1 6 ARG HH11 H -0.038 6.757 -11.342 1.00 . A A . 6 ARG HH11 1 1 14 3810 1 1 6 ARG HH12 H 0.993 7.228 -12.653 1.00 . A A . 6 ARG HH12 1 1 14 3811 1 1 6 ARG HH21 H 2.994 9.331 -10.703 1.00 . A A . 6 ARG HH21 1 1 14 3812 1 1 6 ARG HH22 H 2.718 8.691 -12.288 1.00 . A A . 6 ARG HH22 1 1 14 3813 1 1 6 ARG N N -1.097 6.173 -4.468 1.00 . A A . 6 ARG N 1 1 14 3814 1 1 6 ARG NE N 1.102 8.129 -9.578 1.00 . A A . 6 ARG NE 1 1 14 3815 1 1 6 ARG NH1 N 0.740 7.282 -11.686 1.00 . A A . 6 ARG NH1 1 1 14 3816 1 1 6 ARG NH2 N 2.467 8.749 -11.322 1.00 . A A . 6 ARG NH2 1 1 14 3817 1 1 6 ARG O O -3.522 8.472 -5.660 1.00 . A A . 6 ARG O 1 1 14 3818 1 1 7 HIS C C -5.614 7.185 -3.618 1.00 . A A . 7 HIS C 1 1 14 3819 1 1 7 HIS CA C -5.219 6.424 -4.879 1.00 . A A . 7 HIS CA 1 1 14 3820 1 1 7 HIS CB C -5.837 5.025 -4.859 1.00 . A A . 7 HIS CB 1 1 14 3821 1 1 7 HIS CD2 C -8.005 4.807 -3.452 1.00 . A A . 7 HIS CD2 1 1 14 3822 1 1 7 HIS CE1 C -9.461 5.206 -5.042 1.00 . A A . 7 HIS CE1 1 1 14 3823 1 1 7 HIS CG C -7.311 5.026 -4.594 1.00 . A A . 7 HIS CG 1 1 14 3824 1 1 7 HIS H H -3.323 5.487 -4.792 1.00 . A A . 7 HIS H 1 1 14 3825 1 1 7 HIS HA H -5.591 6.960 -5.739 1.00 . A A . 7 HIS HA 1 1 14 3826 1 1 7 HIS HB2 H -5.674 4.553 -5.816 1.00 . A A . 7 HIS HB2 1 1 14 3827 1 1 7 HIS HB3 H -5.360 4.439 -4.087 1.00 . A A . 7 HIS HB3 1 1 14 3828 1 1 7 HIS HD1 H -8.062 5.467 -6.512 1.00 . A A . 7 HIS HD1 1 1 14 3829 1 1 7 HIS HD2 H -7.588 4.582 -2.481 1.00 . A A . 7 HIS HD2 1 1 14 3830 1 1 7 HIS HE1 H -10.391 5.355 -5.570 1.00 . A A . 7 HIS HE1 1 1 14 3831 1 1 7 HIS N N -3.768 6.334 -4.999 1.00 . A A . 7 HIS N 1 1 14 3832 1 1 7 HIS ND1 N -8.252 5.272 -5.571 1.00 . A A . 7 HIS ND1 1 1 14 3833 1 1 7 HIS NE2 N -9.339 4.925 -3.758 1.00 . A A . 7 HIS NE2 1 1 14 3834 1 1 7 HIS O O -6.738 7.672 -3.501 1.00 . A A . 7 HIS O 1 1 14 3835 1 1 8 ALA C C -4.903 9.498 -1.627 1.00 . A A . 8 ALA C 1 1 14 3836 1 1 8 ALA CA C -4.932 7.987 -1.424 1.00 . A A . 8 ALA CA 1 1 14 3837 1 1 8 ALA CB C -3.912 7.575 -0.373 1.00 . A A . 8 ALA CB 1 1 14 3838 1 1 8 ALA H H -3.804 6.875 -2.827 1.00 . A A . 8 ALA H 1 1 14 3839 1 1 8 ALA HA H -5.912 7.701 -1.070 1.00 . A A . 8 ALA HA 1 1 14 3840 1 1 8 ALA HB1 H -3.266 8.412 -0.151 1.00 . A A . 8 ALA HB1 1 1 14 3841 1 1 8 ALA HB2 H -4.425 7.267 0.525 1.00 . A A . 8 ALA HB2 1 1 14 3842 1 1 8 ALA HB3 H -3.320 6.754 -0.750 1.00 . A A . 8 ALA HB3 1 1 14 3843 1 1 8 ALA N N -4.682 7.284 -2.676 1.00 . A A . 8 ALA N 1 1 14 3844 1 1 8 ALA O O -5.483 10.252 -0.845 1.00 . A A . 8 ALA O 1 1 14 3845 1 1 9 PHE C C -5.487 11.946 -3.318 1.00 . A A . 9 PHE C 1 1 14 3846 1 1 9 PHE CA C -4.118 11.357 -2.988 1.00 . A A . 9 PHE CA 1 1 14 3847 1 1 9 PHE CB C -3.159 11.579 -4.160 1.00 . A A . 9 PHE CB 1 1 14 3848 1 1 9 PHE CD1 C -1.964 13.701 -3.558 1.00 . A A . 9 PHE CD1 1 1 14 3849 1 1 9 PHE CD2 C -0.704 11.680 -3.654 1.00 . A A . 9 PHE CD2 1 1 14 3850 1 1 9 PHE CE1 C -0.823 14.400 -3.212 1.00 . A A . 9 PHE CE1 1 1 14 3851 1 1 9 PHE CE2 C 0.441 12.373 -3.308 1.00 . A A . 9 PHE CE2 1 1 14 3852 1 1 9 PHE CG C -1.917 12.335 -3.783 1.00 . A A . 9 PHE CG 1 1 14 3853 1 1 9 PHE CZ C 0.381 13.734 -3.086 1.00 . A A . 9 PHE CZ 1 1 14 3854 1 1 9 PHE H H -3.783 9.286 -3.270 1.00 . A A . 9 PHE H 1 1 14 3855 1 1 9 PHE HA H -3.727 11.855 -2.115 1.00 . A A . 9 PHE HA 1 1 14 3856 1 1 9 PHE HB2 H -2.857 10.620 -4.554 1.00 . A A . 9 PHE HB2 1 1 14 3857 1 1 9 PHE HB3 H -3.668 12.137 -4.931 1.00 . A A . 9 PHE HB3 1 1 14 3858 1 1 9 PHE HD1 H -2.905 14.223 -3.655 1.00 . A A . 9 PHE HD1 1 1 14 3859 1 1 9 PHE HD2 H -0.656 10.614 -3.828 1.00 . A A . 9 PHE HD2 1 1 14 3860 1 1 9 PHE HE1 H -0.872 15.464 -3.038 1.00 . A A . 9 PHE HE1 1 1 14 3861 1 1 9 PHE HE2 H 1.381 11.849 -3.210 1.00 . A A . 9 PHE HE2 1 1 14 3862 1 1 9 PHE HZ H 1.274 14.278 -2.816 1.00 . A A . 9 PHE HZ 1 1 14 3863 1 1 9 PHE N N -4.224 9.935 -2.683 1.00 . A A . 9 PHE N 1 1 14 3864 1 1 9 PHE O O -5.724 13.139 -3.126 1.00 . A A . 9 PHE O 1 1 14 3865 1 1 10 ARG C C -8.578 11.759 -2.928 1.00 . A A . 10 ARG C 1 1 14 3866 1 1 10 ARG CA C -7.727 11.537 -4.175 1.00 . A A . 10 ARG CA 1 1 14 3867 1 1 10 ARG CB C -8.396 10.504 -5.084 1.00 . A A . 10 ARG CB 1 1 14 3868 1 1 10 ARG CD C -7.124 10.935 -7.209 1.00 . A A . 10 ARG CD 1 1 14 3869 1 1 10 ARG CG C -8.489 10.941 -6.537 1.00 . A A . 10 ARG CG 1 1 14 3870 1 1 10 ARG CZ C -7.328 12.914 -8.654 1.00 . A A . 10 ARG CZ 1 1 14 3871 1 1 10 ARG H H -6.135 10.162 -3.946 1.00 . A A . 10 ARG H 1 1 14 3872 1 1 10 ARG HA H -7.642 12.472 -4.709 1.00 . A A . 10 ARG HA 1 1 14 3873 1 1 10 ARG HB2 H -7.830 9.585 -5.043 1.00 . A A . 10 ARG HB2 1 1 14 3874 1 1 10 ARG HB3 H -9.396 10.318 -4.723 1.00 . A A . 10 ARG HB3 1 1 14 3875 1 1 10 ARG HD2 H -6.392 10.573 -6.503 1.00 . A A . 10 ARG HD2 1 1 14 3876 1 1 10 ARG HD3 H -7.160 10.273 -8.061 1.00 . A A . 10 ARG HD3 1 1 14 3877 1 1 10 ARG HE H -5.983 12.701 -7.196 1.00 . A A . 10 ARG HE 1 1 14 3878 1 1 10 ARG HG2 H -9.141 10.262 -7.067 1.00 . A A . 10 ARG HG2 1 1 14 3879 1 1 10 ARG HG3 H -8.896 11.940 -6.577 1.00 . A A . 10 ARG HG3 1 1 14 3880 1 1 10 ARG HH11 H -8.658 11.442 -9.035 1.00 . A A . 10 ARG HH11 1 1 14 3881 1 1 10 ARG HH12 H -8.790 12.842 -10.047 1.00 . A A . 10 ARG HH12 1 1 14 3882 1 1 10 ARG HH21 H -6.148 14.550 -8.521 1.00 . A A . 10 ARG HH21 1 1 14 3883 1 1 10 ARG HH22 H -7.362 14.609 -9.754 1.00 . A A . 10 ARG HH22 1 1 14 3884 1 1 10 ARG N N -6.383 11.101 -3.816 1.00 . A A . 10 ARG N 1 1 14 3885 1 1 10 ARG NE N -6.730 12.268 -7.659 1.00 . A A . 10 ARG NE 1 1 14 3886 1 1 10 ARG NH1 N -8.341 12.353 -9.299 1.00 . A A . 10 ARG NH1 1 1 14 3887 1 1 10 ARG NH2 N -6.912 14.124 -9.005 1.00 . A A . 10 ARG NH2 1 1 14 3888 1 1 10 ARG O O -9.507 12.564 -2.968 1.00 . A A . 10 ARG O 1 1 14 3889 1 1 11 . C C -8.865 12.585 -0.054 1.00 . A A . 11 SEP C 1 1 14 3890 1 1 11 . CA C -9.007 11.181 -0.582 1.00 . A A . 11 SEP CA 1 1 14 3891 1 1 11 . CB C -8.588 10.056 0.411 1.00 . A A . 11 SEP CB 1 1 14 3892 1 1 11 . H H -7.470 10.403 -1.891 1.00 . A A . 11 SEP H 1 1 14 3893 1 1 11 . HA H -10.072 11.027 -0.836 1.00 . A A . 11 SEP HA 1 1 14 3894 1 1 11 . HB2 H -8.556 9.061 -0.070 1.00 . A A . 11 SEP HB2 1 1 14 3895 1 1 11 . HB3 H -7.558 10.203 0.794 1.00 . A A . 11 SEP HB3 1 1 14 3896 1 1 11 . N N -8.246 11.049 -1.860 1.00 . A A . 11 SEP N 1 1 14 3897 1 1 11 . O O -9.791 13.180 0.497 1.00 . A A . 11 SEP O 1 1 14 3898 1 1 11 . O1P O -8.450 10.039 3.859 1.00 . A A . 11 SEP O1P 1 1 14 3899 1 1 11 . O2P O -10.508 8.702 3.479 1.00 . A A . 11 SEP O2P 1 1 14 3900 1 1 11 . O3P O -8.329 7.912 2.523 1.00 . A A . 11 SEP O3P 1 1 14 3901 1 1 11 . OG O -9.505 9.983 1.528 1.00 . A A . 11 SEP OG 1 1 14 3902 1 1 11 . P P -9.172 9.134 2.866 1.00 . A A . 11 SEP P 1 1 14 3903 1 1 12 MET C C -8.086 15.511 -0.636 1.00 . A A . 12 MET C 1 1 14 3904 1 1 12 MET CA C -7.358 14.477 0.217 1.00 . A A . 12 MET CA 1 1 14 3905 1 1 12 MET CB C -5.850 14.726 0.165 1.00 . A A . 12 MET CB 1 1 14 3906 1 1 12 MET CE C -3.848 17.686 2.296 1.00 . A A . 12 MET CE 1 1 14 3907 1 1 12 MET CG C -5.330 15.553 1.329 1.00 . A A . 12 MET CG 1 1 14 3908 1 1 12 MET H H -6.966 12.600 -0.680 1.00 . A A . 12 MET H 1 1 14 3909 1 1 12 MET HA H -7.694 14.569 1.239 1.00 . A A . 12 MET HA 1 1 14 3910 1 1 12 MET HB2 H -5.339 13.775 0.171 1.00 . A A . 12 MET HB2 1 1 14 3911 1 1 12 MET HB3 H -5.614 15.246 -0.752 1.00 . A A . 12 MET HB3 1 1 14 3912 1 1 12 MET HE1 H -4.088 18.719 2.504 1.00 . A A . 12 MET HE1 1 1 14 3913 1 1 12 MET HE2 H -4.159 17.070 3.127 1.00 . A A . 12 MET HE2 1 1 14 3914 1 1 12 MET HE3 H -2.783 17.586 2.152 1.00 . A A . 12 MET HE3 1 1 14 3915 1 1 12 MET HG2 H -6.134 15.706 2.033 1.00 . A A . 12 MET HG2 1 1 14 3916 1 1 12 MET HG3 H -4.531 15.009 1.811 1.00 . A A . 12 MET HG3 1 1 14 3917 1 1 12 MET N N -7.664 13.124 -0.234 1.00 . A A . 12 MET N 1 1 14 3918 1 1 12 MET O O -8.360 16.622 -0.182 1.00 . A A . 12 MET O 1 1 14 3919 1 1 12 MET SD S -4.704 17.163 0.812 1.00 . A A . 12 MET SD 1 1 14 3920 1 1 13 PHE C C -10.538 16.247 -2.350 1.00 . A A . 13 PHE C 1 1 14 3921 1 1 13 PHE CA C -9.093 16.035 -2.789 1.00 . A A . 13 PHE CA 1 1 14 3922 1 1 13 PHE CB C -9.057 15.472 -4.212 1.00 . A A . 13 PHE CB 1 1 14 3923 1 1 13 PHE CD1 C -6.813 16.471 -4.723 1.00 . A A . 13 PHE CD1 1 1 14 3924 1 1 13 PHE CD2 C -8.523 16.620 -6.378 1.00 . A A . 13 PHE CD2 1 1 14 3925 1 1 13 PHE CE1 C -5.942 17.144 -5.558 1.00 . A A . 13 PHE CE1 1 1 14 3926 1 1 13 PHE CE2 C -7.656 17.293 -7.218 1.00 . A A . 13 PHE CE2 1 1 14 3927 1 1 13 PHE CG C -8.112 16.202 -5.122 1.00 . A A . 13 PHE CG 1 1 14 3928 1 1 13 PHE CZ C -6.364 17.554 -6.808 1.00 . A A . 13 PHE CZ 1 1 14 3929 1 1 13 PHE H H -8.153 14.239 -2.177 1.00 . A A . 13 PHE H 1 1 14 3930 1 1 13 PHE HA H -8.581 16.985 -2.774 1.00 . A A . 13 PHE HA 1 1 14 3931 1 1 13 PHE HB2 H -8.749 14.438 -4.174 1.00 . A A . 13 PHE HB2 1 1 14 3932 1 1 13 PHE HB3 H -10.047 15.533 -4.639 1.00 . A A . 13 PHE HB3 1 1 14 3933 1 1 13 PHE HD1 H -6.481 16.149 -3.746 1.00 . A A . 13 PHE HD1 1 1 14 3934 1 1 13 PHE HD2 H -9.535 16.416 -6.699 1.00 . A A . 13 PHE HD2 1 1 14 3935 1 1 13 PHE HE1 H -4.931 17.346 -5.236 1.00 . A A . 13 PHE HE1 1 1 14 3936 1 1 13 PHE HE2 H -7.990 17.613 -8.194 1.00 . A A . 13 PHE HE2 1 1 14 3937 1 1 13 PHE HZ H -5.685 18.080 -7.463 1.00 . A A . 13 PHE HZ 1 1 14 3938 1 1 13 PHE N N -8.397 15.138 -1.873 1.00 . A A . 13 PHE N 1 1 14 3939 1 1 13 PHE O O -11.091 15.486 -1.555 1.00 . A A . 13 PHE O 1 1 14 3940 1 1 14 PRO C C -13.552 16.703 -3.223 1.00 . A A . 14 PRO C 1 1 14 3941 1 1 14 PRO CA C -12.556 17.646 -2.556 1.00 . A A . 14 PRO CA 1 1 14 3942 1 1 14 PRO CB C -12.713 19.066 -3.107 1.00 . A A . 14 PRO CB 1 1 14 3943 1 1 14 PRO CD C -10.570 18.257 -3.832 1.00 . A A . 14 PRO CD 1 1 14 3944 1 1 14 PRO CG C -11.708 19.160 -4.202 1.00 . A A . 14 PRO CG 1 1 14 3945 1 1 14 PRO HA H -12.726 17.651 -1.489 1.00 . A A . 14 PRO HA 1 1 14 3946 1 1 14 PRO HB2 H -13.718 19.201 -3.479 1.00 . A A . 14 PRO HB2 1 1 14 3947 1 1 14 PRO HB3 H -12.513 19.783 -2.325 1.00 . A A . 14 PRO HB3 1 1 14 3948 1 1 14 PRO HD2 H -10.213 17.746 -4.714 1.00 . A A . 14 PRO HD2 1 1 14 3949 1 1 14 PRO HD3 H -9.771 18.817 -3.369 1.00 . A A . 14 PRO HD3 1 1 14 3950 1 1 14 PRO HG2 H -12.150 18.844 -5.135 1.00 . A A . 14 PRO HG2 1 1 14 3951 1 1 14 PRO HG3 H -11.345 20.174 -4.282 1.00 . A A . 14 PRO HG3 1 1 14 3952 1 1 14 PRO N N -11.167 17.308 -2.879 1.00 . A A . 14 PRO N 1 1 14 3953 1 1 14 PRO O O -14.722 16.652 -2.843 1.00 . A A . 14 PRO O 1 1 14 3954 1 1 15 SER C C -14.305 13.834 -4.055 1.00 . A A . 15 SER C 1 1 14 3955 1 1 15 SER CA C -13.931 15.020 -4.939 1.00 . A A . 15 SER CA 1 1 14 3956 1 1 15 SER CB C -13.224 14.525 -6.202 1.00 . A A . 15 SER CB 1 1 14 3957 1 1 15 SER H H -12.138 16.045 -4.474 1.00 . A A . 15 SER H 1 1 14 3958 1 1 15 SER HA H -14.834 15.540 -5.223 1.00 . A A . 15 SER HA 1 1 14 3959 1 1 15 SER HB2 H -13.396 15.225 -7.006 1.00 . A A . 15 SER HB2 1 1 14 3960 1 1 15 SER HB3 H -12.163 14.449 -6.011 1.00 . A A . 15 SER HB3 1 1 14 3961 1 1 15 SER HG H -13.363 12.581 -6.002 1.00 . A A . 15 SER HG 1 1 14 3962 1 1 15 SER N N -13.081 15.959 -4.218 1.00 . A A . 15 SER N 1 1 14 3963 1 1 15 SER O O -15.343 13.203 -4.250 1.00 . A A . 15 SER O 1 1 14 3964 1 1 15 SER OG O -13.710 13.253 -6.594 1.00 . A A . 15 SER OG 1 1 14 3965 1 1 16 SER C C -14.851 12.732 -1.230 1.00 . A A . 16 SER C 1 1 14 3966 1 1 16 SER CA C -13.687 12.426 -2.168 1.00 . A A . 16 SER CA 1 1 14 3967 1 1 16 SER CB C -12.426 12.130 -1.354 1.00 . A A . 16 SER CB 1 1 14 3968 1 1 16 SER H H -12.639 14.079 -2.976 1.00 . A A . 16 SER H 1 1 14 3969 1 1 16 SER HA H -13.935 11.558 -2.760 1.00 . A A . 16 SER HA 1 1 14 3970 1 1 16 SER HB2 H -11.555 12.393 -1.935 1.00 . A A . 16 SER HB2 1 1 14 3971 1 1 16 SER HB3 H -12.442 12.713 -0.444 1.00 . A A . 16 SER HB3 1 1 14 3972 1 1 16 SER HG H -13.233 10.381 -0.997 1.00 . A A . 16 SER HG 1 1 14 3973 1 1 16 SER N N -13.450 13.538 -3.081 1.00 . A A . 16 SER N 1 1 14 3974 1 1 16 SER O O -15.521 11.824 -0.740 1.00 . A A . 16 SER O 1 1 14 3975 1 1 16 SER OG O -12.349 10.756 -1.013 1.00 . A A . 16 SER OG 1 1 14 3976 1 1 17 GLU C C -17.488 14.515 -0.866 1.00 . A A . 17 GLU C 1 1 14 3977 1 1 17 GLU CA C -16.166 14.444 -0.107 1.00 . A A . 17 GLU CA 1 1 14 3978 1 1 17 GLU CB C -15.846 15.807 0.510 1.00 . A A . 17 GLU CB 1 1 14 3979 1 1 17 GLU CD C -15.909 16.882 2.795 1.00 . A A . 17 GLU CD 1 1 14 3980 1 1 17 GLU CG C -15.392 15.728 1.958 1.00 . A A . 17 GLU CG 1 1 14 3981 1 1 17 GLU H H -14.515 14.695 -1.407 1.00 . A A . 17 GLU H 1 1 14 3982 1 1 17 GLU HA H -16.258 13.714 0.684 1.00 . A A . 17 GLU HA 1 1 14 3983 1 1 17 GLU HB2 H -15.061 16.274 -0.067 1.00 . A A . 17 GLU HB2 1 1 14 3984 1 1 17 GLU HB3 H -16.730 16.425 0.465 1.00 . A A . 17 GLU HB3 1 1 14 3985 1 1 17 GLU HG2 H -15.753 14.804 2.385 1.00 . A A . 17 GLU HG2 1 1 14 3986 1 1 17 GLU HG3 H -14.312 15.739 1.985 1.00 . A A . 17 GLU HG3 1 1 14 3987 1 1 17 GLU N N -15.084 14.018 -0.986 1.00 . A A . 17 GLU N 1 1 14 3988 1 1 17 GLU O O -17.615 13.970 -1.962 1.00 . A A . 17 GLU O 1 1 14 3989 1 1 17 GLU OE1 O -15.791 18.041 2.344 1.00 . A A . 17 GLU OE1 1 1 14 3990 1 1 17 GLU OE2 O -16.432 16.627 3.900 1.00 . A A . 17 GLU OE2 1 1 15 3991 1 1 1 ARG C C 3.350 2.087 -2.492 1.00 . A A . 1 ARG C 1 1 15 3992 1 1 1 ARG CA C 3.677 0.621 -2.222 1.00 . A A . 1 ARG CA 1 1 15 3993 1 1 1 ARG CB C 2.543 -0.027 -1.426 1.00 . A A . 1 ARG CB 1 1 15 3994 1 1 1 ARG CD C 1.560 -2.144 -0.494 1.00 . A A . 1 ARG CD 1 1 15 3995 1 1 1 ARG CG C 2.801 -1.482 -1.073 1.00 . A A . 1 ARG CG 1 1 15 3996 1 1 1 ARG CZ C 2.154 -4.519 -0.267 1.00 . A A . 1 ARG CZ 1 1 15 3997 1 1 1 ARG H1 H 5.430 1.305 -1.252 1.00 . A A . 1 ARG H1 1 1 15 3998 1 1 1 ARG HA H 3.781 0.108 -3.166 1.00 . A A . 1 ARG HA 1 1 15 3999 1 1 1 ARG HB2 H 2.402 0.524 -0.508 1.00 . A A . 1 ARG HB2 1 1 15 4000 1 1 1 ARG HB3 H 1.636 0.024 -2.009 1.00 . A A . 1 ARG HB3 1 1 15 4001 1 1 1 ARG HD2 H 1.057 -1.436 0.148 1.00 . A A . 1 ARG HD2 1 1 15 4002 1 1 1 ARG HD3 H 0.904 -2.421 -1.306 1.00 . A A . 1 ARG HD3 1 1 15 4003 1 1 1 ARG HE H 1.908 -3.255 1.256 1.00 . A A . 1 ARG HE 1 1 15 4004 1 1 1 ARG HG2 H 3.094 -2.013 -1.967 1.00 . A A . 1 ARG HG2 1 1 15 4005 1 1 1 ARG HG3 H 3.597 -1.531 -0.345 1.00 . A A . 1 ARG HG3 1 1 15 4006 1 1 1 ARG HH11 H 1.917 -3.880 -2.169 1.00 . A A . 1 ARG HH11 1 1 15 4007 1 1 1 ARG HH12 H 2.335 -5.552 -1.995 1.00 . A A . 1 ARG HH12 1 1 15 4008 1 1 1 ARG HH21 H 2.459 -5.454 1.498 1.00 . A A . 1 ARG HH21 1 1 15 4009 1 1 1 ARG HH22 H 2.643 -6.447 0.092 1.00 . A A . 1 ARG HH22 1 1 15 4010 1 1 1 ARG N N 4.938 0.494 -1.501 1.00 . A A . 1 ARG N 1 1 15 4011 1 1 1 ARG NE N 1.887 -3.338 0.280 1.00 . A A . 1 ARG NE 1 1 15 4012 1 1 1 ARG NH1 N 2.133 -4.662 -1.585 1.00 . A A . 1 ARG NH1 1 1 15 4013 1 1 1 ARG NH2 N 2.443 -5.559 0.504 1.00 . A A . 1 ARG NH2 1 1 15 4014 1 1 1 ARG O O 2.602 2.715 -1.743 1.00 . A A . 1 ARG O 1 1 15 4015 1 1 2 SER C C 2.397 4.168 -4.729 1.00 . A A . 2 SER C 1 1 15 4016 1 1 2 SER CA C 3.690 4.020 -3.933 1.00 . A A . 2 SER CA 1 1 15 4017 1 1 2 SER CB C 4.869 4.553 -4.749 1.00 . A A . 2 SER CB 1 1 15 4018 1 1 2 SER H H 4.505 2.075 -4.124 1.00 . A A . 2 SER H 1 1 15 4019 1 1 2 SER HA H 3.606 4.593 -3.022 1.00 . A A . 2 SER HA 1 1 15 4020 1 1 2 SER HB2 H 5.792 4.182 -4.329 1.00 . A A . 2 SER HB2 1 1 15 4021 1 1 2 SER HB3 H 4.778 4.215 -5.771 1.00 . A A . 2 SER HB3 1 1 15 4022 1 1 2 SER HG H 5.692 6.278 -5.182 1.00 . A A . 2 SER HG 1 1 15 4023 1 1 2 SER N N 3.918 2.627 -3.566 1.00 . A A . 2 SER N 1 1 15 4024 1 1 2 SER O O 1.761 5.222 -4.712 1.00 . A A . 2 SER O 1 1 15 4025 1 1 2 SER OG O 4.898 5.970 -4.737 1.00 . A A . 2 SER OG 1 1 15 4026 1 1 3 LYS C C -0.442 3.117 -5.338 1.00 . A A . 3 LYS C 1 1 15 4027 1 1 3 LYS CA C 0.797 3.112 -6.229 1.00 . A A . 3 LYS CA 1 1 15 4028 1 1 3 LYS CB C 0.765 1.896 -7.158 1.00 . A A . 3 LYS CB 1 1 15 4029 1 1 3 LYS CD C 0.557 -0.598 -7.364 1.00 . A A . 3 LYS CD 1 1 15 4030 1 1 3 LYS CE C -0.917 -0.727 -7.716 1.00 . A A . 3 LYS CE 1 1 15 4031 1 1 3 LYS CG C 0.805 0.568 -6.422 1.00 . A A . 3 LYS CG 1 1 15 4032 1 1 3 LYS H H 2.563 2.292 -5.400 1.00 . A A . 3 LYS H 1 1 15 4033 1 1 3 LYS HA H 0.799 4.011 -6.826 1.00 . A A . 3 LYS HA 1 1 15 4034 1 1 3 LYS HB2 H -0.140 1.932 -7.746 1.00 . A A . 3 LYS HB2 1 1 15 4035 1 1 3 LYS HB3 H 1.618 1.943 -7.820 1.00 . A A . 3 LYS HB3 1 1 15 4036 1 1 3 LYS HD2 H 1.119 -0.442 -8.273 1.00 . A A . 3 LYS HD2 1 1 15 4037 1 1 3 LYS HD3 H 0.886 -1.511 -6.887 1.00 . A A . 3 LYS HD3 1 1 15 4038 1 1 3 LYS HE2 H -1.172 -1.775 -7.763 1.00 . A A . 3 LYS HE2 1 1 15 4039 1 1 3 LYS HE3 H -1.501 -0.250 -6.943 1.00 . A A . 3 LYS HE3 1 1 15 4040 1 1 3 LYS HG2 H 1.777 0.448 -5.966 1.00 . A A . 3 LYS HG2 1 1 15 4041 1 1 3 LYS HG3 H 0.043 0.568 -5.656 1.00 . A A . 3 LYS HG3 1 1 15 4042 1 1 3 LYS HZ1 H -0.558 0.674 -9.222 1.00 . A A . 3 LYS HZ1 1 1 15 4043 1 1 3 LYS HZ2 H -2.195 0.305 -9.006 1.00 . A A . 3 LYS HZ2 1 1 15 4044 1 1 3 LYS HZ3 H -1.176 -0.796 -9.787 1.00 . A A . 3 LYS HZ3 1 1 15 4045 1 1 3 LYS N N 2.014 3.104 -5.426 1.00 . A A . 3 LYS N 1 1 15 4046 1 1 3 LYS NZ N -1.233 -0.091 -9.025 1.00 . A A . 3 LYS NZ 1 1 15 4047 1 1 3 LYS O O -1.481 3.665 -5.707 1.00 . A A . 3 LYS O 1 1 15 4048 1 1 4 ASP C C -1.692 3.806 -2.593 1.00 . A A . 4 ASP C 1 1 15 4049 1 1 4 ASP CA C -1.434 2.441 -3.221 1.00 . A A . 4 ASP CA 1 1 15 4050 1 1 4 ASP CB C -1.144 1.409 -2.130 1.00 . A A . 4 ASP CB 1 1 15 4051 1 1 4 ASP CG C -1.699 0.039 -2.465 1.00 . A A . 4 ASP CG 1 1 15 4052 1 1 4 ASP H H 0.530 2.086 -3.929 1.00 . A A . 4 ASP H 1 1 15 4053 1 1 4 ASP HA H -2.315 2.137 -3.766 1.00 . A A . 4 ASP HA 1 1 15 4054 1 1 4 ASP HB2 H -0.075 1.322 -2.001 1.00 . A A . 4 ASP HB2 1 1 15 4055 1 1 4 ASP HB3 H -1.588 1.741 -1.203 1.00 . A A . 4 ASP HB3 1 1 15 4056 1 1 4 ASP N N -0.324 2.504 -4.165 1.00 . A A . 4 ASP N 1 1 15 4057 1 1 4 ASP O O -2.831 4.151 -2.276 1.00 . A A . 4 ASP O 1 1 15 4058 1 1 4 ASP OD1 O -2.893 -0.046 -2.818 1.00 . A A . 4 ASP OD1 1 1 15 4059 1 1 4 ASP OD2 O -0.939 -0.948 -2.375 1.00 . A A . 4 ASP OD2 1 1 15 4060 1 1 5 LEU C C -1.324 6.902 -2.819 1.00 . A A . 5 LEU C 1 1 15 4061 1 1 5 LEU CA C -0.737 5.909 -1.821 1.00 . A A . 5 LEU CA 1 1 15 4062 1 1 5 LEU CB C 0.635 6.393 -1.348 1.00 . A A . 5 LEU CB 1 1 15 4063 1 1 5 LEU CD1 C 2.135 6.938 0.585 1.00 . A A . 5 LEU CD1 1 1 15 4064 1 1 5 LEU CD2 C 0.102 8.330 0.152 1.00 . A A . 5 LEU CD2 1 1 15 4065 1 1 5 LEU CG C 0.700 6.932 0.081 1.00 . A A . 5 LEU CG 1 1 15 4066 1 1 5 LEU H H 0.255 4.251 -2.685 1.00 . A A . 5 LEU H 1 1 15 4067 1 1 5 LEU HA H -1.398 5.838 -0.970 1.00 . A A . 5 LEU HA 1 1 15 4068 1 1 5 LEU HB2 H 1.321 5.564 -1.420 1.00 . A A . 5 LEU HB2 1 1 15 4069 1 1 5 LEU HB3 H 0.954 7.181 -2.015 1.00 . A A . 5 LEU HB3 1 1 15 4070 1 1 5 LEU HD11 H 2.479 5.922 0.702 1.00 . A A . 5 LEU HD11 1 1 15 4071 1 1 5 LEU HD12 H 2.180 7.446 1.537 1.00 . A A . 5 LEU HD12 1 1 15 4072 1 1 5 LEU HD13 H 2.764 7.453 -0.127 1.00 . A A . 5 LEU HD13 1 1 15 4073 1 1 5 LEU HD21 H -0.845 8.290 0.669 1.00 . A A . 5 LEU HD21 1 1 15 4074 1 1 5 LEU HD22 H -0.050 8.707 -0.849 1.00 . A A . 5 LEU HD22 1 1 15 4075 1 1 5 LEU HD23 H 0.777 8.984 0.684 1.00 . A A . 5 LEU HD23 1 1 15 4076 1 1 5 LEU HG H 0.122 6.287 0.729 1.00 . A A . 5 LEU HG 1 1 15 4077 1 1 5 LEU N N -0.627 4.580 -2.413 1.00 . A A . 5 LEU N 1 1 15 4078 1 1 5 LEU O O -1.957 7.884 -2.432 1.00 . A A . 5 LEU O 1 1 15 4079 1 1 6 ARG C C -3.131 7.675 -5.042 1.00 . A A . 6 ARG C 1 1 15 4080 1 1 6 ARG CA C -1.618 7.510 -5.157 1.00 . A A . 6 ARG CA 1 1 15 4081 1 1 6 ARG CB C -1.259 6.945 -6.532 1.00 . A A . 6 ARG CB 1 1 15 4082 1 1 6 ARG CD C -0.162 7.743 -8.648 1.00 . A A . 6 ARG CD 1 1 15 4083 1 1 6 ARG CG C -1.275 7.985 -7.641 1.00 . A A . 6 ARG CG 1 1 15 4084 1 1 6 ARG CZ C 2.275 8.029 -8.806 1.00 . A A . 6 ARG CZ 1 1 15 4085 1 1 6 ARG H H -0.597 5.841 -4.350 1.00 . A A . 6 ARG H 1 1 15 4086 1 1 6 ARG HA H -1.153 8.477 -5.042 1.00 . A A . 6 ARG HA 1 1 15 4087 1 1 6 ARG HB2 H -0.269 6.516 -6.486 1.00 . A A . 6 ARG HB2 1 1 15 4088 1 1 6 ARG HB3 H -1.967 6.170 -6.786 1.00 . A A . 6 ARG HB3 1 1 15 4089 1 1 6 ARG HD2 H -0.087 6.681 -8.833 1.00 . A A . 6 ARG HD2 1 1 15 4090 1 1 6 ARG HD3 H -0.410 8.251 -9.568 1.00 . A A . 6 ARG HD3 1 1 15 4091 1 1 6 ARG HE H 1.137 8.737 -7.329 1.00 . A A . 6 ARG HE 1 1 15 4092 1 1 6 ARG HG2 H -2.225 7.938 -8.152 1.00 . A A . 6 ARG HG2 1 1 15 4093 1 1 6 ARG HG3 H -1.147 8.964 -7.204 1.00 . A A . 6 ARG HG3 1 1 15 4094 1 1 6 ARG HH11 H 1.441 6.989 -10.324 1.00 . A A . 6 ARG HH11 1 1 15 4095 1 1 6 ARG HH12 H 3.158 7.199 -10.423 1.00 . A A . 6 ARG HH12 1 1 15 4096 1 1 6 ARG HH21 H 3.397 9.020 -7.448 1.00 . A A . 6 ARG HH21 1 1 15 4097 1 1 6 ARG HH22 H 4.270 8.353 -8.786 1.00 . A A . 6 ARG HH22 1 1 15 4098 1 1 6 ARG N N -1.110 6.639 -4.104 1.00 . A A . 6 ARG N 1 1 15 4099 1 1 6 ARG NE N 1.127 8.232 -8.168 1.00 . A A . 6 ARG NE 1 1 15 4100 1 1 6 ARG NH1 N 2.293 7.349 -9.944 1.00 . A A . 6 ARG NH1 1 1 15 4101 1 1 6 ARG NH2 N 3.407 8.507 -8.305 1.00 . A A . 6 ARG NH2 1 1 15 4102 1 1 6 ARG O O -3.679 8.723 -5.385 1.00 . A A . 6 ARG O 1 1 15 4103 1 1 7 HIS C C -5.645 7.500 -3.185 1.00 . A A . 7 HIS C 1 1 15 4104 1 1 7 HIS CA C -5.250 6.664 -4.398 1.00 . A A . 7 HIS CA 1 1 15 4105 1 1 7 HIS CB C -5.797 5.243 -4.253 1.00 . A A . 7 HIS CB 1 1 15 4106 1 1 7 HIS CD2 C -6.957 4.281 -6.364 1.00 . A A . 7 HIS CD2 1 1 15 4107 1 1 7 HIS CE1 C -5.211 3.323 -7.281 1.00 . A A . 7 HIS CE1 1 1 15 4108 1 1 7 HIS CG C -5.897 4.504 -5.552 1.00 . A A . 7 HIS CG 1 1 15 4109 1 1 7 HIS H H -3.308 5.826 -4.302 1.00 . A A . 7 HIS H 1 1 15 4110 1 1 7 HIS HA H -5.672 7.114 -5.284 1.00 . A A . 7 HIS HA 1 1 15 4111 1 1 7 HIS HB2 H -5.148 4.679 -3.600 1.00 . A A . 7 HIS HB2 1 1 15 4112 1 1 7 HIS HB3 H -6.786 5.288 -3.819 1.00 . A A . 7 HIS HB3 1 1 15 4113 1 1 7 HIS HD1 H -3.903 3.875 -5.807 1.00 . A A . 7 HIS HD1 1 1 15 4114 1 1 7 HIS HD2 H -7.971 4.619 -6.204 1.00 . A A . 7 HIS HD2 1 1 15 4115 1 1 7 HIS HE1 H -4.581 2.771 -7.963 1.00 . A A . 7 HIS HE1 1 1 15 4116 1 1 7 HIS N N -3.800 6.634 -4.558 1.00 . A A . 7 HIS N 1 1 15 4117 1 1 7 HIS ND1 N -4.819 3.891 -6.154 1.00 . A A . 7 HIS ND1 1 1 15 4118 1 1 7 HIS NE2 N -6.504 3.545 -7.432 1.00 . A A . 7 HIS NE2 1 1 15 4119 1 1 7 HIS O O -6.788 7.941 -3.070 1.00 . A A . 7 HIS O 1 1 15 4120 1 1 8 ALA C C -4.992 9.990 -1.399 1.00 . A A . 8 ALA C 1 1 15 4121 1 1 8 ALA CA C -4.941 8.499 -1.081 1.00 . A A . 8 ALA CA 1 1 15 4122 1 1 8 ALA CB C -3.872 8.216 -0.036 1.00 . A A . 8 ALA CB 1 1 15 4123 1 1 8 ALA H H -3.801 7.337 -2.433 1.00 . A A . 8 ALA H 1 1 15 4124 1 1 8 ALA HA H -5.896 8.195 -0.676 1.00 . A A . 8 ALA HA 1 1 15 4125 1 1 8 ALA HB1 H -4.167 8.654 0.907 1.00 . A A . 8 ALA HB1 1 1 15 4126 1 1 8 ALA HB2 H -3.758 7.149 0.082 1.00 . A A . 8 ALA HB2 1 1 15 4127 1 1 8 ALA HB3 H -2.935 8.647 -0.355 1.00 . A A . 8 ALA HB3 1 1 15 4128 1 1 8 ALA N N -4.692 7.714 -2.284 1.00 . A A . 8 ALA N 1 1 15 4129 1 1 8 ALA O O -5.586 10.773 -0.657 1.00 . A A . 8 ALA O 1 1 15 4130 1 1 9 PHE C C -5.740 12.263 -3.275 1.00 . A A . 9 PHE C 1 1 15 4131 1 1 9 PHE CA C -4.339 11.774 -2.920 1.00 . A A . 9 PHE CA 1 1 15 4132 1 1 9 PHE CB C -3.405 11.954 -4.118 1.00 . A A . 9 PHE CB 1 1 15 4133 1 1 9 PHE CD1 C -1.659 13.263 -2.878 1.00 . A A . 9 PHE CD1 1 1 15 4134 1 1 9 PHE CD2 C -2.435 14.106 -4.969 1.00 . A A . 9 PHE CD2 1 1 15 4135 1 1 9 PHE CE1 C -0.808 14.344 -2.754 1.00 . A A . 9 PHE CE1 1 1 15 4136 1 1 9 PHE CE2 C -1.585 15.190 -4.850 1.00 . A A . 9 PHE CE2 1 1 15 4137 1 1 9 PHE CG C -2.481 13.131 -3.986 1.00 . A A . 9 PHE CG 1 1 15 4138 1 1 9 PHE CZ C -0.772 15.310 -3.741 1.00 . A A . 9 PHE CZ 1 1 15 4139 1 1 9 PHE H H -3.911 9.705 -3.056 1.00 . A A . 9 PHE H 1 1 15 4140 1 1 9 PHE HA H -3.966 12.357 -2.092 1.00 . A A . 9 PHE HA 1 1 15 4141 1 1 9 PHE HB2 H -2.798 11.068 -4.229 1.00 . A A . 9 PHE HB2 1 1 15 4142 1 1 9 PHE HB3 H -3.997 12.094 -5.010 1.00 . A A . 9 PHE HB3 1 1 15 4143 1 1 9 PHE HD1 H -1.687 12.508 -2.105 1.00 . A A . 9 PHE HD1 1 1 15 4144 1 1 9 PHE HD2 H -3.071 14.015 -5.837 1.00 . A A . 9 PHE HD2 1 1 15 4145 1 1 9 PHE HE1 H -0.173 14.435 -1.885 1.00 . A A . 9 PHE HE1 1 1 15 4146 1 1 9 PHE HE2 H -1.559 15.943 -5.623 1.00 . A A . 9 PHE HE2 1 1 15 4147 1 1 9 PHE HZ H -0.107 16.155 -3.646 1.00 . A A . 9 PHE HZ 1 1 15 4148 1 1 9 PHE N N -4.366 10.376 -2.505 1.00 . A A . 9 PHE N 1 1 15 4149 1 1 9 PHE O O -6.035 13.455 -3.182 1.00 . A A . 9 PHE O 1 1 15 4150 1 1 10 ARG C C -8.801 12.002 -2.819 1.00 . A A . 10 ARG C 1 1 15 4151 1 1 10 ARG CA C -7.968 11.670 -4.054 1.00 . A A . 10 ARG CA 1 1 15 4152 1 1 10 ARG CB C -8.610 10.512 -4.820 1.00 . A A . 10 ARG CB 1 1 15 4153 1 1 10 ARG CD C -9.114 10.926 -7.247 1.00 . A A . 10 ARG CD 1 1 15 4154 1 1 10 ARG CG C -8.109 10.374 -6.248 1.00 . A A . 10 ARG CG 1 1 15 4155 1 1 10 ARG CZ C -9.138 12.452 -9.174 1.00 . A A . 10 ARG CZ 1 1 15 4156 1 1 10 ARG H H -6.305 10.401 -3.737 1.00 . A A . 10 ARG H 1 1 15 4157 1 1 10 ARG HA H -7.935 12.539 -4.695 1.00 . A A . 10 ARG HA 1 1 15 4158 1 1 10 ARG HB2 H -8.401 9.590 -4.297 1.00 . A A . 10 ARG HB2 1 1 15 4159 1 1 10 ARG HB3 H -9.679 10.665 -4.849 1.00 . A A . 10 ARG HB3 1 1 15 4160 1 1 10 ARG HD2 H -9.632 10.100 -7.710 1.00 . A A . 10 ARG HD2 1 1 15 4161 1 1 10 ARG HD3 H -9.823 11.545 -6.719 1.00 . A A . 10 ARG HD3 1 1 15 4162 1 1 10 ARG HE H -7.491 11.716 -8.324 1.00 . A A . 10 ARG HE 1 1 15 4163 1 1 10 ARG HG2 H -7.182 10.918 -6.349 1.00 . A A . 10 ARG HG2 1 1 15 4164 1 1 10 ARG HG3 H -7.940 9.328 -6.461 1.00 . A A . 10 ARG HG3 1 1 15 4165 1 1 10 ARG HH11 H -10.961 11.958 -8.458 1.00 . A A . 10 ARG HH11 1 1 15 4166 1 1 10 ARG HH12 H -10.964 13.034 -9.817 1.00 . A A . 10 ARG HH12 1 1 15 4167 1 1 10 ARG HH21 H -7.481 13.131 -10.113 1.00 . A A . 10 ARG HH21 1 1 15 4168 1 1 10 ARG HH22 H -8.984 13.699 -10.758 1.00 . A A . 10 ARG HH22 1 1 15 4169 1 1 10 ARG N N -6.599 11.334 -3.683 1.00 . A A . 10 ARG N 1 1 15 4170 1 1 10 ARG NE N -8.470 11.724 -8.287 1.00 . A A . 10 ARG NE 1 1 15 4171 1 1 10 ARG NH1 N -10.463 12.483 -9.148 1.00 . A A . 10 ARG NH1 1 1 15 4172 1 1 10 ARG NH2 N -8.480 13.152 -10.090 1.00 . A A . 10 ARG NH2 1 1 15 4173 1 1 10 ARG O O -9.765 12.758 -2.928 1.00 . A A . 10 ARG O 1 1 15 4174 1 1 11 . C C -9.081 13.149 -0.066 1.00 . A A . 11 SEP C 1 1 15 4175 1 1 11 . CA C -9.153 11.684 -0.411 1.00 . A A . 11 SEP CA 1 1 15 4176 1 1 11 . CB C -8.649 10.717 0.700 1.00 . A A . 11 SEP CB 1 1 15 4177 1 1 11 . H H -7.613 10.822 -1.662 1.00 . A A . 11 SEP H 1 1 15 4178 1 1 11 . HA H -10.214 11.443 -0.613 1.00 . A A . 11 SEP HA 1 1 15 4179 1 1 11 . HB2 H -8.913 9.663 0.492 1.00 . A A . 11 SEP HB2 1 1 15 4180 1 1 11 . HB3 H -7.542 10.707 0.770 1.00 . A A . 11 SEP HB3 1 1 15 4181 1 1 11 . N N -8.415 11.435 -1.685 1.00 . A A . 11 SEP N 1 1 15 4182 1 1 11 . O O -10.026 13.757 0.435 1.00 . A A . 11 SEP O 1 1 15 4183 1 1 11 . O1P O -10.057 8.680 2.308 1.00 . A A . 11 SEP O1P 1 1 15 4184 1 1 11 . O2P O -8.505 9.660 3.980 1.00 . A A . 11 SEP O2P 1 1 15 4185 1 1 11 . O3P O -10.872 10.478 3.866 1.00 . A A . 11 SEP O3P 1 1 15 4186 1 1 11 . OG O -9.205 11.071 1.988 1.00 . A A . 11 SEP OG 1 1 15 4187 1 1 11 . P P -9.691 9.957 3.057 1.00 . A A . 11 SEP P 1 1 15 4188 1 1 12 MET C C -8.474 16.017 -1.034 1.00 . A A . 12 MET C 1 1 15 4189 1 1 12 MET CA C -7.678 15.138 -0.075 1.00 . A A . 12 MET CA 1 1 15 4190 1 1 12 MET CB C -6.187 15.458 -0.190 1.00 . A A . 12 MET CB 1 1 15 4191 1 1 12 MET CE C -4.139 17.502 2.766 1.00 . A A . 12 MET CE 1 1 15 4192 1 1 12 MET CG C -5.517 15.724 1.148 1.00 . A A . 12 MET CG 1 1 15 4193 1 1 12 MET H H -7.200 13.188 -0.744 1.00 . A A . 12 MET H 1 1 15 4194 1 1 12 MET HA H -8.004 15.341 0.935 1.00 . A A . 12 MET HA 1 1 15 4195 1 1 12 MET HB2 H -5.687 14.623 -0.659 1.00 . A A . 12 MET HB2 1 1 15 4196 1 1 12 MET HB3 H -6.065 16.334 -0.809 1.00 . A A . 12 MET HB3 1 1 15 4197 1 1 12 MET HE1 H -3.111 17.729 3.008 1.00 . A A . 12 MET HE1 1 1 15 4198 1 1 12 MET HE2 H -4.748 18.379 2.928 1.00 . A A . 12 MET HE2 1 1 15 4199 1 1 12 MET HE3 H -4.490 16.699 3.397 1.00 . A A . 12 MET HE3 1 1 15 4200 1 1 12 MET HG2 H -6.269 16.035 1.857 1.00 . A A . 12 MET HG2 1 1 15 4201 1 1 12 MET HG3 H -5.058 14.809 1.493 1.00 . A A . 12 MET HG3 1 1 15 4202 1 1 12 MET N N -7.916 13.725 -0.345 1.00 . A A . 12 MET N 1 1 15 4203 1 1 12 MET O O -8.800 17.162 -0.718 1.00 . A A . 12 MET O 1 1 15 4204 1 1 12 MET SD S -4.252 17.005 1.049 1.00 . A A . 12 MET SD 1 1 15 4205 1 1 13 PHE C C -10.989 16.403 -2.772 1.00 . A A . 13 PHE C 1 1 15 4206 1 1 13 PHE CA C -9.541 16.211 -3.213 1.00 . A A . 13 PHE CA 1 1 15 4207 1 1 13 PHE CB C -9.498 15.474 -4.554 1.00 . A A . 13 PHE CB 1 1 15 4208 1 1 13 PHE CD1 C -7.200 16.250 -5.196 1.00 . A A . 13 PHE CD1 1 1 15 4209 1 1 13 PHE CD2 C -8.954 16.457 -6.798 1.00 . A A . 13 PHE CD2 1 1 15 4210 1 1 13 PHE CE1 C -6.309 16.800 -6.097 1.00 . A A . 13 PHE CE1 1 1 15 4211 1 1 13 PHE CE2 C -8.067 17.008 -7.704 1.00 . A A . 13 PHE CE2 1 1 15 4212 1 1 13 PHE CG C -8.532 16.072 -5.536 1.00 . A A . 13 PHE CG 1 1 15 4213 1 1 13 PHE CZ C -6.743 17.179 -7.353 1.00 . A A . 13 PHE CZ 1 1 15 4214 1 1 13 PHE H H -8.497 14.558 -2.401 1.00 . A A . 13 PHE H 1 1 15 4215 1 1 13 PHE HA H -9.081 17.180 -3.330 1.00 . A A . 13 PHE HA 1 1 15 4216 1 1 13 PHE HB2 H -9.206 14.449 -4.384 1.00 . A A . 13 PHE HB2 1 1 15 4217 1 1 13 PHE HB3 H -10.482 15.495 -4.999 1.00 . A A . 13 PHE HB3 1 1 15 4218 1 1 13 PHE HD1 H -6.859 15.953 -4.215 1.00 . A A . 13 PHE HD1 1 1 15 4219 1 1 13 PHE HD2 H -9.991 16.323 -7.073 1.00 . A A . 13 PHE HD2 1 1 15 4220 1 1 13 PHE HE1 H -5.273 16.933 -5.821 1.00 . A A . 13 PHE HE1 1 1 15 4221 1 1 13 PHE HE2 H -8.410 17.302 -8.684 1.00 . A A . 13 PHE HE2 1 1 15 4222 1 1 13 PHE HZ H -6.048 17.609 -8.059 1.00 . A A . 13 PHE HZ 1 1 15 4223 1 1 13 PHE N N -8.784 15.475 -2.207 1.00 . A A . 13 PHE N 1 1 15 4224 1 1 13 PHE O O -11.487 15.722 -1.875 1.00 . A A . 13 PHE O 1 1 15 4225 1 1 14 PRO C C -14.038 16.594 -3.636 1.00 . A A . 14 PRO C 1 1 15 4226 1 1 14 PRO CA C -13.083 17.659 -3.107 1.00 . A A . 14 PRO CA 1 1 15 4227 1 1 14 PRO CB C -13.321 18.992 -3.820 1.00 . A A . 14 PRO CB 1 1 15 4228 1 1 14 PRO CD C -11.152 18.204 -4.495 1.00 . A A . 14 PRO CD 1 1 15 4229 1 1 14 PRO CG C -12.338 19.004 -4.939 1.00 . A A . 14 PRO CG 1 1 15 4230 1 1 14 PRO HA H -13.237 17.784 -2.045 1.00 . A A . 14 PRO HA 1 1 15 4231 1 1 14 PRO HB2 H -14.337 19.032 -4.185 1.00 . A A . 14 PRO HB2 1 1 15 4232 1 1 14 PRO HB3 H -13.147 19.807 -3.134 1.00 . A A . 14 PRO HB3 1 1 15 4233 1 1 14 PRO HD2 H -10.784 17.604 -5.313 1.00 . A A . 14 PRO HD2 1 1 15 4234 1 1 14 PRO HD3 H -10.376 18.857 -4.124 1.00 . A A . 14 PRO HD3 1 1 15 4235 1 1 14 PRO HG2 H -12.775 18.552 -5.817 1.00 . A A . 14 PRO HG2 1 1 15 4236 1 1 14 PRO HG3 H -12.034 20.019 -5.150 1.00 . A A . 14 PRO HG3 1 1 15 4237 1 1 14 PRO N N -11.682 17.354 -3.416 1.00 . A A . 14 PRO N 1 1 15 4238 1 1 14 PRO O O -15.197 16.529 -3.227 1.00 . A A . 14 PRO O 1 1 15 4239 1 1 15 SER C C -14.650 13.612 -4.106 1.00 . A A . 15 SER C 1 1 15 4240 1 1 15 SER CA C -14.354 14.701 -5.133 1.00 . A A . 15 SER CA 1 1 15 4241 1 1 15 SER CB C -13.642 14.096 -6.344 1.00 . A A . 15 SER CB 1 1 15 4242 1 1 15 SER H H -12.611 15.864 -4.831 1.00 . A A . 15 SER H 1 1 15 4243 1 1 15 SER HA H -15.287 15.138 -5.456 1.00 . A A . 15 SER HA 1 1 15 4244 1 1 15 SER HB2 H -12.752 13.582 -6.015 1.00 . A A . 15 SER HB2 1 1 15 4245 1 1 15 SER HB3 H -14.302 13.395 -6.834 1.00 . A A . 15 SER HB3 1 1 15 4246 1 1 15 SER HG H -12.357 15.351 -7.126 1.00 . A A . 15 SER HG 1 1 15 4247 1 1 15 SER N N -13.543 15.761 -4.546 1.00 . A A . 15 SER N 1 1 15 4248 1 1 15 SER O O -15.657 12.910 -4.203 1.00 . A A . 15 SER O 1 1 15 4249 1 1 15 SER OG O -13.272 15.101 -7.273 1.00 . A A . 15 SER OG 1 1 15 4250 1 1 16 SER C C -14.746 13.024 -0.917 1.00 . A A . 16 SER C 1 1 15 4251 1 1 16 SER CA C -13.928 12.472 -2.081 1.00 . A A . 16 SER CA 1 1 15 4252 1 1 16 SER CB C -12.562 12.000 -1.580 1.00 . A A . 16 SER CB 1 1 15 4253 1 1 16 SER H H -12.983 14.067 -3.102 1.00 . A A . 16 SER H 1 1 15 4254 1 1 16 SER HA H -14.455 11.632 -2.509 1.00 . A A . 16 SER HA 1 1 15 4255 1 1 16 SER HB2 H -11.808 12.714 -1.872 1.00 . A A . 16 SER HB2 1 1 15 4256 1 1 16 SER HB3 H -12.585 11.920 -0.503 1.00 . A A . 16 SER HB3 1 1 15 4257 1 1 16 SER HG H -11.273 10.649 -2.174 1.00 . A A . 16 SER HG 1 1 15 4258 1 1 16 SER N N -13.765 13.478 -3.124 1.00 . A A . 16 SER N 1 1 15 4259 1 1 16 SER O O -15.489 12.291 -0.265 1.00 . A A . 16 SER O 1 1 15 4260 1 1 16 SER OG O -12.228 10.735 -2.125 1.00 . A A . 16 SER OG 1 1 15 4261 1 1 17 GLU C C -16.707 15.428 -0.042 1.00 . A A . 17 GLU C 1 1 15 4262 1 1 17 GLU CA C -15.327 14.971 0.422 1.00 . A A . 17 GLU CA 1 1 15 4263 1 1 17 GLU CB C -14.533 16.168 0.950 1.00 . A A . 17 GLU CB 1 1 15 4264 1 1 17 GLU CD C -12.762 16.260 2.749 1.00 . A A . 17 GLU CD 1 1 15 4265 1 1 17 GLU CG C -13.103 15.827 1.336 1.00 . A A . 17 GLU CG 1 1 15 4266 1 1 17 GLU H H -13.995 14.852 -1.219 1.00 . A A . 17 GLU H 1 1 15 4267 1 1 17 GLU HA H -15.448 14.252 1.218 1.00 . A A . 17 GLU HA 1 1 15 4268 1 1 17 GLU HB2 H -14.506 16.932 0.187 1.00 . A A . 17 GLU HB2 1 1 15 4269 1 1 17 GLU HB3 H -15.035 16.561 1.822 1.00 . A A . 17 GLU HB3 1 1 15 4270 1 1 17 GLU HG2 H -12.969 14.759 1.262 1.00 . A A . 17 GLU HG2 1 1 15 4271 1 1 17 GLU HG3 H -12.431 16.322 0.651 1.00 . A A . 17 GLU HG3 1 1 15 4272 1 1 17 GLU N N -14.602 14.321 -0.663 1.00 . A A . 17 GLU N 1 1 15 4273 1 1 17 GLU O O -17.515 15.902 0.756 1.00 . A A . 17 GLU O 1 1 15 4274 1 1 17 GLU OE1 O -12.967 15.457 3.682 1.00 . A A . 17 GLU OE1 1 1 15 4275 1 1 17 GLU OE2 O -12.289 17.404 2.920 1.00 . A A . 17 GLU OE2 1 1 16 4276 1 1 1 ARG C C 3.234 2.236 -1.994 1.00 . A A . 1 ARG C 1 1 16 4277 1 1 1 ARG CA C 3.389 0.754 -1.665 1.00 . A A . 1 ARG CA 1 1 16 4278 1 1 1 ARG CB C 2.153 0.255 -0.914 1.00 . A A . 1 ARG CB 1 1 16 4279 1 1 1 ARG CD C 1.826 -2.225 -0.677 1.00 . A A . 1 ARG CD 1 1 16 4280 1 1 1 ARG CG C 1.535 -0.994 -1.521 1.00 . A A . 1 ARG CG 1 1 16 4281 1 1 1 ARG CZ C 2.214 -4.628 -1.021 1.00 . A A . 1 ARG CZ 1 1 16 4282 1 1 1 ARG H1 H 5.469 0.612 -1.298 1.00 . A A . 1 ARG H1 1 1 16 4283 1 1 1 ARG HA H 3.487 0.201 -2.587 1.00 . A A . 1 ARG HA 1 1 16 4284 1 1 1 ARG HB2 H 2.430 0.034 0.106 1.00 . A A . 1 ARG HB2 1 1 16 4285 1 1 1 ARG HB3 H 1.407 1.036 -0.915 1.00 . A A . 1 ARG HB3 1 1 16 4286 1 1 1 ARG HD2 H 2.806 -2.121 -0.238 1.00 . A A . 1 ARG HD2 1 1 16 4287 1 1 1 ARG HD3 H 1.086 -2.291 0.106 1.00 . A A . 1 ARG HD3 1 1 16 4288 1 1 1 ARG HE H 1.431 -3.394 -2.379 1.00 . A A . 1 ARG HE 1 1 16 4289 1 1 1 ARG HG2 H 0.465 -0.860 -1.586 1.00 . A A . 1 ARG HG2 1 1 16 4290 1 1 1 ARG HG3 H 1.942 -1.141 -2.510 1.00 . A A . 1 ARG HG3 1 1 16 4291 1 1 1 ARG HH11 H 2.754 -3.931 0.797 1.00 . A A . 1 ARG HH11 1 1 16 4292 1 1 1 ARG HH12 H 3.022 -5.624 0.541 1.00 . A A . 1 ARG HH12 1 1 16 4293 1 1 1 ARG HH21 H 1.779 -5.622 -2.727 1.00 . A A . 1 ARG HH21 1 1 16 4294 1 1 1 ARG HH22 H 2.468 -6.584 -1.464 1.00 . A A . 1 ARG HH22 1 1 16 4295 1 1 1 ARG N N 4.591 0.521 -0.872 1.00 . A A . 1 ARG N 1 1 16 4296 1 1 1 ARG NE N 1.789 -3.452 -1.469 1.00 . A A . 1 ARG NE 1 1 16 4297 1 1 1 ARG NH1 N 2.704 -4.737 0.206 1.00 . A A . 1 ARG NH1 1 1 16 4298 1 1 1 ARG NH2 N 2.148 -5.699 -1.801 1.00 . A A . 1 ARG NH2 1 1 16 4299 1 1 1 ARG O O 2.616 2.988 -1.241 1.00 . A A . 1 ARG O 1 1 16 4300 1 1 2 SER C C 2.480 4.287 -4.393 1.00 . A A . 2 SER C 1 1 16 4301 1 1 2 SER CA C 3.728 4.041 -3.551 1.00 . A A . 2 SER CA 1 1 16 4302 1 1 2 SER CB C 4.978 4.416 -4.350 1.00 . A A . 2 SER CB 1 1 16 4303 1 1 2 SER H H 4.279 2.000 -3.682 1.00 . A A . 2 SER H 1 1 16 4304 1 1 2 SER HA H 3.678 4.657 -2.666 1.00 . A A . 2 SER HA 1 1 16 4305 1 1 2 SER HB2 H 4.683 4.858 -5.289 1.00 . A A . 2 SER HB2 1 1 16 4306 1 1 2 SER HB3 H 5.562 5.128 -3.785 1.00 . A A . 2 SER HB3 1 1 16 4307 1 1 2 SER HG H 6.460 3.503 -5.248 1.00 . A A . 2 SER HG 1 1 16 4308 1 1 2 SER N N 3.800 2.648 -3.124 1.00 . A A . 2 SER N 1 1 16 4309 1 1 2 SER O O 1.922 5.385 -4.392 1.00 . A A . 2 SER O 1 1 16 4310 1 1 2 SER OG O 5.777 3.276 -4.612 1.00 . A A . 2 SER OG 1 1 16 4311 1 1 3 LYS C C -0.409 3.370 -5.117 1.00 . A A . 3 LYS C 1 1 16 4312 1 1 3 LYS CA C 0.863 3.358 -5.959 1.00 . A A . 3 LYS CA 1 1 16 4313 1 1 3 LYS CB C 0.820 2.194 -6.951 1.00 . A A . 3 LYS CB 1 1 16 4314 1 1 3 LYS CD C 1.636 1.246 -9.129 1.00 . A A . 3 LYS CD 1 1 16 4315 1 1 3 LYS CE C 2.679 0.141 -9.052 1.00 . A A . 3 LYS CE 1 1 16 4316 1 1 3 LYS CG C 1.858 2.297 -8.055 1.00 . A A . 3 LYS CG 1 1 16 4317 1 1 3 LYS H H 2.533 2.407 -5.071 1.00 . A A . 3 LYS H 1 1 16 4318 1 1 3 LYS HA H 0.926 4.286 -6.507 1.00 . A A . 3 LYS HA 1 1 16 4319 1 1 3 LYS HB2 H 0.986 1.272 -6.414 1.00 . A A . 3 LYS HB2 1 1 16 4320 1 1 3 LYS HB3 H -0.159 2.163 -7.408 1.00 . A A . 3 LYS HB3 1 1 16 4321 1 1 3 LYS HD2 H 0.657 0.810 -8.998 1.00 . A A . 3 LYS HD2 1 1 16 4322 1 1 3 LYS HD3 H 1.695 1.717 -10.100 1.00 . A A . 3 LYS HD3 1 1 16 4323 1 1 3 LYS HE2 H 3.484 0.376 -9.730 1.00 . A A . 3 LYS HE2 1 1 16 4324 1 1 3 LYS HE3 H 3.060 0.095 -8.042 1.00 . A A . 3 LYS HE3 1 1 16 4325 1 1 3 LYS HG2 H 1.795 3.276 -8.506 1.00 . A A . 3 LYS HG2 1 1 16 4326 1 1 3 LYS HG3 H 2.841 2.159 -7.626 1.00 . A A . 3 LYS HG3 1 1 16 4327 1 1 3 LYS HZ1 H 1.191 -1.321 -8.949 1.00 . A A . 3 LYS HZ1 1 1 16 4328 1 1 3 LYS HZ2 H 2.754 -1.945 -9.117 1.00 . A A . 3 LYS HZ2 1 1 16 4329 1 1 3 LYS HZ3 H 1.975 -1.246 -10.446 1.00 . A A . 3 LYS HZ3 1 1 16 4330 1 1 3 LYS N N 2.046 3.257 -5.112 1.00 . A A . 3 LYS N 1 1 16 4331 1 1 3 LYS NZ N 2.109 -1.186 -9.416 1.00 . A A . 3 LYS NZ 1 1 16 4332 1 1 3 LYS O O -1.416 3.963 -5.505 1.00 . A A . 3 LYS O 1 1 16 4333 1 1 4 ASP C C -1.765 4.009 -2.423 1.00 . A A . 4 ASP C 1 1 16 4334 1 1 4 ASP CA C -1.503 2.651 -3.066 1.00 . A A . 4 ASP CA 1 1 16 4335 1 1 4 ASP CB C -1.273 1.596 -1.982 1.00 . A A . 4 ASP CB 1 1 16 4336 1 1 4 ASP CG C -2.313 0.494 -2.017 1.00 . A A . 4 ASP CG 1 1 16 4337 1 1 4 ASP H H 0.476 2.260 -3.709 1.00 . A A . 4 ASP H 1 1 16 4338 1 1 4 ASP HA H -2.367 2.371 -3.650 1.00 . A A . 4 ASP HA 1 1 16 4339 1 1 4 ASP HB2 H -0.299 1.151 -2.123 1.00 . A A . 4 ASP HB2 1 1 16 4340 1 1 4 ASP HB3 H -1.310 2.071 -1.013 1.00 . A A . 4 ASP HB3 1 1 16 4341 1 1 4 ASP N N -0.356 2.714 -3.964 1.00 . A A . 4 ASP N 1 1 16 4342 1 1 4 ASP O O -2.910 4.361 -2.134 1.00 . A A . 4 ASP O 1 1 16 4343 1 1 4 ASP OD1 O -2.364 -0.243 -3.025 1.00 . A A . 4 ASP OD1 1 1 16 4344 1 1 4 ASP OD2 O -3.076 0.367 -1.037 1.00 . A A . 4 ASP OD2 1 1 16 4345 1 1 5 LEU C C -1.359 7.104 -2.590 1.00 . A A . 5 LEU C 1 1 16 4346 1 1 5 LEU CA C -0.812 6.089 -1.591 1.00 . A A . 5 LEU CA 1 1 16 4347 1 1 5 LEU CB C 0.550 6.551 -1.071 1.00 . A A . 5 LEU CB 1 1 16 4348 1 1 5 LEU CD1 C 2.548 6.184 0.398 1.00 . A A . 5 LEU CD1 1 1 16 4349 1 1 5 LEU CD2 C 0.245 6.031 1.362 1.00 . A A . 5 LEU CD2 1 1 16 4350 1 1 5 LEU CG C 1.105 5.785 0.131 1.00 . A A . 5 LEU CG 1 1 16 4351 1 1 5 LEU H H 0.188 4.434 -2.453 1.00 . A A . 5 LEU H 1 1 16 4352 1 1 5 LEU HA H -1.498 6.012 -0.761 1.00 . A A . 5 LEU HA 1 1 16 4353 1 1 5 LEU HB2 H 1.261 6.460 -1.878 1.00 . A A . 5 LEU HB2 1 1 16 4354 1 1 5 LEU HB3 H 0.460 7.591 -0.789 1.00 . A A . 5 LEU HB3 1 1 16 4355 1 1 5 LEU HD11 H 3.118 5.309 0.672 1.00 . A A . 5 LEU HD11 1 1 16 4356 1 1 5 LEU HD12 H 2.580 6.902 1.204 1.00 . A A . 5 LEU HD12 1 1 16 4357 1 1 5 LEU HD13 H 2.970 6.625 -0.494 1.00 . A A . 5 LEU HD13 1 1 16 4358 1 1 5 LEU HD21 H -0.700 6.457 1.062 1.00 . A A . 5 LEU HD21 1 1 16 4359 1 1 5 LEU HD22 H 0.755 6.714 2.026 1.00 . A A . 5 LEU HD22 1 1 16 4360 1 1 5 LEU HD23 H 0.073 5.094 1.873 1.00 . A A . 5 LEU HD23 1 1 16 4361 1 1 5 LEU HG H 1.086 4.726 -0.086 1.00 . A A . 5 LEU HG 1 1 16 4362 1 1 5 LEU N N -0.698 4.769 -2.201 1.00 . A A . 5 LEU N 1 1 16 4363 1 1 5 LEU O O -1.994 8.087 -2.206 1.00 . A A . 5 LEU O 1 1 16 4364 1 1 6 ARG C C -3.092 7.931 -4.852 1.00 . A A . 6 ARG C 1 1 16 4365 1 1 6 ARG CA C -1.579 7.751 -4.925 1.00 . A A . 6 ARG CA 1 1 16 4366 1 1 6 ARG CB C -1.186 7.204 -6.299 1.00 . A A . 6 ARG CB 1 1 16 4367 1 1 6 ARG CD C -0.830 7.915 -8.683 1.00 . A A . 6 ARG CD 1 1 16 4368 1 1 6 ARG CG C -1.725 8.025 -7.459 1.00 . A A . 6 ARG CG 1 1 16 4369 1 1 6 ARG CZ C -2.346 8.272 -10.585 1.00 . A A . 6 ARG CZ 1 1 16 4370 1 1 6 ARG H H -0.599 6.059 -4.115 1.00 . A A . 6 ARG H 1 1 16 4371 1 1 6 ARG HA H -1.107 8.711 -4.781 1.00 . A A . 6 ARG HA 1 1 16 4372 1 1 6 ARG HB2 H -0.108 7.185 -6.371 1.00 . A A . 6 ARG HB2 1 1 16 4373 1 1 6 ARG HB3 H -1.562 6.197 -6.393 1.00 . A A . 6 ARG HB3 1 1 16 4374 1 1 6 ARG HD2 H 0.152 8.284 -8.429 1.00 . A A . 6 ARG HD2 1 1 16 4375 1 1 6 ARG HD3 H -0.761 6.876 -8.969 1.00 . A A . 6 ARG HD3 1 1 16 4376 1 1 6 ARG HE H -0.931 9.550 -10.000 1.00 . A A . 6 ARG HE 1 1 16 4377 1 1 6 ARG HG2 H -2.711 7.666 -7.714 1.00 . A A . 6 ARG HG2 1 1 16 4378 1 1 6 ARG HG3 H -1.784 9.060 -7.158 1.00 . A A . 6 ARG HG3 1 1 16 4379 1 1 6 ARG HH11 H -2.620 6.532 -9.595 1.00 . A A . 6 ARG HH11 1 1 16 4380 1 1 6 ARG HH12 H -3.682 6.797 -10.938 1.00 . A A . 6 ARG HH12 1 1 16 4381 1 1 6 ARG HH21 H -2.324 9.909 -11.770 1.00 . A A . 6 ARG HH21 1 1 16 4382 1 1 6 ARG HH22 H -3.513 8.718 -12.175 1.00 . A A . 6 ARG HH22 1 1 16 4383 1 1 6 ARG N N -1.110 6.859 -3.872 1.00 . A A . 6 ARG N 1 1 16 4384 1 1 6 ARG NE N -1.349 8.684 -9.811 1.00 . A A . 6 ARG NE 1 1 16 4385 1 1 6 ARG NH1 N -2.930 7.104 -10.354 1.00 . A A . 6 ARG NH1 1 1 16 4386 1 1 6 ARG NH2 N -2.762 9.029 -11.593 1.00 . A A . 6 ARG NH2 1 1 16 4387 1 1 6 ARG O O -3.620 8.990 -5.194 1.00 . A A . 6 ARG O 1 1 16 4388 1 1 7 HIS C C -5.662 7.755 -3.072 1.00 . A A . 7 HIS C 1 1 16 4389 1 1 7 HIS CA C -5.239 6.933 -4.286 1.00 . A A . 7 HIS CA 1 1 16 4390 1 1 7 HIS CB C -5.806 5.516 -4.180 1.00 . A A . 7 HIS CB 1 1 16 4391 1 1 7 HIS CD2 C -8.171 6.146 -5.038 1.00 . A A . 7 HIS CD2 1 1 16 4392 1 1 7 HIS CE1 C -8.598 4.317 -6.170 1.00 . A A . 7 HIS CE1 1 1 16 4393 1 1 7 HIS CG C -7.097 5.331 -4.915 1.00 . A A . 7 HIS CG 1 1 16 4394 1 1 7 HIS H H -3.310 6.073 -4.147 1.00 . A A . 7 HIS H 1 1 16 4395 1 1 7 HIS HA H -5.631 7.401 -5.176 1.00 . A A . 7 HIS HA 1 1 16 4396 1 1 7 HIS HB2 H -5.090 4.818 -4.587 1.00 . A A . 7 HIS HB2 1 1 16 4397 1 1 7 HIS HB3 H -5.979 5.282 -3.139 1.00 . A A . 7 HIS HB3 1 1 16 4398 1 1 7 HIS HD1 H -6.815 3.412 -5.739 1.00 . A A . 7 HIS HD1 1 1 16 4399 1 1 7 HIS HD2 H -8.285 7.128 -4.601 1.00 . A A . 7 HIS HD2 1 1 16 4400 1 1 7 HIS HE1 H -9.095 3.583 -6.786 1.00 . A A . 7 HIS HE1 1 1 16 4401 1 1 7 HIS N N -3.786 6.890 -4.404 1.00 . A A . 7 HIS N 1 1 16 4402 1 1 7 HIS ND1 N -7.397 4.193 -5.635 1.00 . A A . 7 HIS ND1 1 1 16 4403 1 1 7 HIS NE2 N -9.090 5.493 -5.822 1.00 . A A . 7 HIS NE2 1 1 16 4404 1 1 7 HIS O O -6.803 8.206 -2.983 1.00 . A A . 7 HIS O 1 1 16 4405 1 1 8 ALA C C -5.036 10.209 -1.228 1.00 . A A . 8 ALA C 1 1 16 4406 1 1 8 ALA CA C -5.009 8.713 -0.933 1.00 . A A . 8 ALA CA 1 1 16 4407 1 1 8 ALA CB C -3.974 8.403 0.138 1.00 . A A . 8 ALA CB 1 1 16 4408 1 1 8 ALA H H -3.842 7.560 -2.269 1.00 . A A . 8 ALA H 1 1 16 4409 1 1 8 ALA HA H -5.978 8.413 -0.560 1.00 . A A . 8 ALA HA 1 1 16 4410 1 1 8 ALA HB1 H -4.474 8.058 1.032 1.00 . A A . 8 ALA HB1 1 1 16 4411 1 1 8 ALA HB2 H -3.305 7.634 -0.220 1.00 . A A . 8 ALA HB2 1 1 16 4412 1 1 8 ALA HB3 H -3.410 9.295 0.363 1.00 . A A . 8 ALA HB3 1 1 16 4413 1 1 8 ALA N N -4.733 7.944 -2.140 1.00 . A A . 8 ALA N 1 1 16 4414 1 1 8 ALA O O -5.642 10.986 -0.491 1.00 . A A . 8 ALA O 1 1 16 4415 1 1 9 PHE C C -5.708 12.525 -3.068 1.00 . A A . 9 PHE C 1 1 16 4416 1 1 9 PHE CA C -4.320 12.009 -2.701 1.00 . A A . 9 PHE CA 1 1 16 4417 1 1 9 PHE CB C -3.366 12.195 -3.883 1.00 . A A . 9 PHE CB 1 1 16 4418 1 1 9 PHE CD1 C -0.984 12.019 -3.112 1.00 . A A . 9 PHE CD1 1 1 16 4419 1 1 9 PHE CD2 C -1.883 14.188 -3.531 1.00 . A A . 9 PHE CD2 1 1 16 4420 1 1 9 PHE CE1 C 0.227 12.585 -2.760 1.00 . A A . 9 PHE CE1 1 1 16 4421 1 1 9 PHE CE2 C -0.674 14.759 -3.181 1.00 . A A . 9 PHE CE2 1 1 16 4422 1 1 9 PHE CG C -2.051 12.813 -3.501 1.00 . A A . 9 PHE CG 1 1 16 4423 1 1 9 PHE CZ C 0.382 13.957 -2.794 1.00 . A A . 9 PHE CZ 1 1 16 4424 1 1 9 PHE H H -3.909 9.938 -2.857 1.00 . A A . 9 PHE H 1 1 16 4425 1 1 9 PHE HA H -3.950 12.573 -1.859 1.00 . A A . 9 PHE HA 1 1 16 4426 1 1 9 PHE HB2 H -3.162 11.232 -4.327 1.00 . A A . 9 PHE HB2 1 1 16 4427 1 1 9 PHE HB3 H -3.834 12.833 -4.617 1.00 . A A . 9 PHE HB3 1 1 16 4428 1 1 9 PHE HD1 H -1.105 10.945 -3.085 1.00 . A A . 9 PHE HD1 1 1 16 4429 1 1 9 PHE HD2 H -2.708 14.817 -3.833 1.00 . A A . 9 PHE HD2 1 1 16 4430 1 1 9 PHE HE1 H 1.050 11.955 -2.458 1.00 . A A . 9 PHE HE1 1 1 16 4431 1 1 9 PHE HE2 H -0.556 15.832 -3.208 1.00 . A A . 9 PHE HE2 1 1 16 4432 1 1 9 PHE HZ H 1.327 14.401 -2.521 1.00 . A A . 9 PHE HZ 1 1 16 4433 1 1 9 PHE N N -4.373 10.605 -2.310 1.00 . A A . 9 PHE N 1 1 16 4434 1 1 9 PHE O O -5.987 13.719 -2.959 1.00 . A A . 9 PHE O 1 1 16 4435 1 1 10 ARG C C -8.773 12.320 -2.660 1.00 . A A . 10 ARG C 1 1 16 4436 1 1 10 ARG CA C -7.933 11.979 -3.888 1.00 . A A . 10 ARG CA 1 1 16 4437 1 1 10 ARG CB C -8.588 10.835 -4.665 1.00 . A A . 10 ARG CB 1 1 16 4438 1 1 10 ARG CD C -8.545 9.447 -6.759 1.00 . A A . 10 ARG CD 1 1 16 4439 1 1 10 ARG CG C -7.730 10.299 -5.799 1.00 . A A . 10 ARG CG 1 1 16 4440 1 1 10 ARG CZ C -7.382 9.605 -8.920 1.00 . A A . 10 ARG CZ 1 1 16 4441 1 1 10 ARG H H -6.293 10.680 -3.568 1.00 . A A . 10 ARG H 1 1 16 4442 1 1 10 ARG HA H -7.877 12.849 -4.524 1.00 . A A . 10 ARG HA 1 1 16 4443 1 1 10 ARG HB2 H -8.793 10.023 -3.983 1.00 . A A . 10 ARG HB2 1 1 16 4444 1 1 10 ARG HB3 H -9.519 11.187 -5.083 1.00 . A A . 10 ARG HB3 1 1 16 4445 1 1 10 ARG HD2 H -8.200 8.426 -6.695 1.00 . A A . 10 ARG HD2 1 1 16 4446 1 1 10 ARG HD3 H -9.584 9.496 -6.470 1.00 . A A . 10 ARG HD3 1 1 16 4447 1 1 10 ARG HE H -9.134 10.462 -8.503 1.00 . A A . 10 ARG HE 1 1 16 4448 1 1 10 ARG HG2 H -7.307 11.131 -6.342 1.00 . A A . 10 ARG HG2 1 1 16 4449 1 1 10 ARG HG3 H -6.936 9.697 -5.382 1.00 . A A . 10 ARG HG3 1 1 16 4450 1 1 10 ARG HH11 H -6.426 8.509 -7.518 1.00 . A A . 10 ARG HH11 1 1 16 4451 1 1 10 ARG HH12 H -5.617 8.628 -9.046 1.00 . A A . 10 ARG HH12 1 1 16 4452 1 1 10 ARG HH21 H -8.079 10.626 -10.519 1.00 . A A . 10 ARG HH21 1 1 16 4453 1 1 10 ARG HH22 H -6.558 9.833 -10.752 1.00 . A A . 10 ARG HH22 1 1 16 4454 1 1 10 ARG N N -6.575 11.616 -3.503 1.00 . A A . 10 ARG N 1 1 16 4455 1 1 10 ARG NE N -8.415 9.904 -8.140 1.00 . A A . 10 ARG NE 1 1 16 4456 1 1 10 ARG NH1 N -6.394 8.853 -8.456 1.00 . A A . 10 ARG NH1 1 1 16 4457 1 1 10 ARG NH2 N -7.336 10.059 -10.166 1.00 . A A . 10 ARG NH2 1 1 16 4458 1 1 10 ARG O O -9.723 13.093 -2.777 1.00 . A A . 10 ARG O 1 1 16 4459 1 1 11 . C C -9.071 13.466 0.088 1.00 . A A . 11 SEP C 1 1 16 4460 1 1 11 . CA C -9.156 12.002 -0.257 1.00 . A A . 11 SEP CA 1 1 16 4461 1 1 11 . CB C -8.672 11.030 0.859 1.00 . A A . 11 SEP CB 1 1 16 4462 1 1 11 . H H -7.618 11.117 -1.494 1.00 . A A . 11 SEP H 1 1 16 4463 1 1 11 . HA H -10.217 11.772 -0.469 1.00 . A A . 11 SEP HA 1 1 16 4464 1 1 11 . HB2 H -9.270 10.100 0.895 1.00 . A A . 11 SEP HB2 1 1 16 4465 1 1 11 . HB3 H -7.636 10.677 0.681 1.00 . A A . 11 SEP HB3 1 1 16 4466 1 1 11 . N N -8.409 11.744 -1.524 1.00 . A A . 11 SEP N 1 1 16 4467 1 1 11 . O O -10.014 14.084 0.580 1.00 . A A . 11 SEP O 1 1 16 4468 1 1 11 . O1P O -11.293 11.799 1.988 1.00 . A A . 11 SEP O1P 1 1 16 4469 1 1 11 . O2P O -10.262 10.563 3.879 1.00 . A A . 11 SEP O2P 1 1 16 4470 1 1 11 . O3P O -10.129 13.066 3.821 1.00 . A A . 11 SEP O3P 1 1 16 4471 1 1 11 . OG O -8.744 11.658 2.161 1.00 . A A . 11 SEP OG 1 1 16 4472 1 1 11 . P P -10.134 11.797 2.979 1.00 . A A . 11 SEP P 1 1 16 4473 1 1 12 MET C C -8.404 16.326 -0.895 1.00 . A A . 12 MET C 1 1 16 4474 1 1 12 MET CA C -7.648 15.440 0.090 1.00 . A A . 12 MET CA 1 1 16 4475 1 1 12 MET CB C -6.149 15.738 0.016 1.00 . A A . 12 MET CB 1 1 16 4476 1 1 12 MET CE C -2.809 16.202 1.198 1.00 . A A . 12 MET CE 1 1 16 4477 1 1 12 MET CG C -5.577 16.303 1.306 1.00 . A A . 12 MET CG 1 1 16 4478 1 1 12 MET H H -7.184 13.485 -0.574 1.00 . A A . 12 MET H 1 1 16 4479 1 1 12 MET HA H -7.998 15.652 1.089 1.00 . A A . 12 MET HA 1 1 16 4480 1 1 12 MET HB2 H -5.624 14.824 -0.216 1.00 . A A . 12 MET HB2 1 1 16 4481 1 1 12 MET HB3 H -5.975 16.454 -0.773 1.00 . A A . 12 MET HB3 1 1 16 4482 1 1 12 MET HE1 H -3.164 16.816 0.382 1.00 . A A . 12 MET HE1 1 1 16 4483 1 1 12 MET HE2 H -2.340 16.829 1.941 1.00 . A A . 12 MET HE2 1 1 16 4484 1 1 12 MET HE3 H -2.092 15.486 0.825 1.00 . A A . 12 MET HE3 1 1 16 4485 1 1 12 MET HG2 H -5.238 17.311 1.123 1.00 . A A . 12 MET HG2 1 1 16 4486 1 1 12 MET HG3 H -6.357 16.318 2.053 1.00 . A A . 12 MET HG3 1 1 16 4487 1 1 12 MET N N -7.898 14.030 -0.182 1.00 . A A . 12 MET N 1 1 16 4488 1 1 12 MET O O -8.721 17.477 -0.593 1.00 . A A . 12 MET O 1 1 16 4489 1 1 12 MET SD S -4.192 15.334 1.934 1.00 . A A . 12 MET SD 1 1 16 4490 1 1 13 PHE C C -10.882 16.672 -2.741 1.00 . A A . 13 PHE C 1 1 16 4491 1 1 13 PHE CA C -9.407 16.526 -3.103 1.00 . A A . 13 PHE CA 1 1 16 4492 1 1 13 PHE CB C -9.270 15.824 -4.456 1.00 . A A . 13 PHE CB 1 1 16 4493 1 1 13 PHE CD1 C -6.866 16.385 -4.906 1.00 . A A . 13 PHE CD1 1 1 16 4494 1 1 13 PHE CD2 C -8.490 16.957 -6.556 1.00 . A A . 13 PHE CD2 1 1 16 4495 1 1 13 PHE CE1 C -5.868 16.915 -5.702 1.00 . A A . 13 PHE CE1 1 1 16 4496 1 1 13 PHE CE2 C -7.496 17.488 -7.356 1.00 . A A . 13 PHE CE2 1 1 16 4497 1 1 13 PHE CG C -8.187 16.400 -5.323 1.00 . A A . 13 PHE CG 1 1 16 4498 1 1 13 PHE CZ C -6.183 17.466 -6.929 1.00 . A A . 13 PHE CZ 1 1 16 4499 1 1 13 PHE H H -8.410 14.861 -2.255 1.00 . A A . 13 PHE H 1 1 16 4500 1 1 13 PHE HA H -8.966 17.508 -3.171 1.00 . A A . 13 PHE HA 1 1 16 4501 1 1 13 PHE HB2 H -9.043 14.782 -4.292 1.00 . A A . 13 PHE HB2 1 1 16 4502 1 1 13 PHE HB3 H -10.204 15.905 -4.992 1.00 . A A . 13 PHE HB3 1 1 16 4503 1 1 13 PHE HD1 H -6.617 15.954 -3.948 1.00 . A A . 13 PHE HD1 1 1 16 4504 1 1 13 PHE HD2 H -9.518 16.974 -6.891 1.00 . A A . 13 PHE HD2 1 1 16 4505 1 1 13 PHE HE1 H -4.842 16.897 -5.366 1.00 . A A . 13 PHE HE1 1 1 16 4506 1 1 13 PHE HE2 H -7.747 17.918 -8.314 1.00 . A A . 13 PHE HE2 1 1 16 4507 1 1 13 PHE HZ H -5.405 17.881 -7.552 1.00 . A A . 13 PHE HZ 1 1 16 4508 1 1 13 PHE N N -8.689 15.783 -2.074 1.00 . A A . 13 PHE N 1 1 16 4509 1 1 13 PHE O O -11.412 15.956 -1.890 1.00 . A A . 13 PHE O 1 1 16 4510 1 1 14 PRO C C -13.882 16.824 -3.793 1.00 . A A . 14 PRO C 1 1 16 4511 1 1 14 PRO CA C -12.984 17.885 -3.165 1.00 . A A . 14 PRO CA 1 1 16 4512 1 1 14 PRO CB C -13.209 19.242 -3.836 1.00 . A A . 14 PRO CB 1 1 16 4513 1 1 14 PRO CD C -10.993 18.512 -4.427 1.00 . A A . 14 PRO CD 1 1 16 4514 1 1 14 PRO CG C -12.161 19.322 -4.891 1.00 . A A . 14 PRO CG 1 1 16 4515 1 1 14 PRO HA H -13.204 17.962 -2.110 1.00 . A A . 14 PRO HA 1 1 16 4516 1 1 14 PRO HB2 H -14.203 19.275 -4.261 1.00 . A A . 14 PRO HB2 1 1 16 4517 1 1 14 PRO HB3 H -13.097 20.031 -3.108 1.00 . A A . 14 PRO HB3 1 1 16 4518 1 1 14 PRO HD2 H -10.591 17.942 -5.251 1.00 . A A . 14 PRO HD2 1 1 16 4519 1 1 14 PRO HD3 H -10.235 19.153 -4.003 1.00 . A A . 14 PRO HD3 1 1 16 4520 1 1 14 PRO HG2 H -12.546 18.934 -5.821 1.00 . A A . 14 PRO HG2 1 1 16 4521 1 1 14 PRO HG3 H -11.841 20.346 -5.014 1.00 . A A . 14 PRO HG3 1 1 16 4522 1 1 14 PRO N N -11.561 17.622 -3.400 1.00 . A A . 14 PRO N 1 1 16 4523 1 1 14 PRO O O -15.059 16.713 -3.452 1.00 . A A . 14 PRO O 1 1 16 4524 1 1 15 SER C C -14.391 13.854 -4.432 1.00 . A A . 15 SER C 1 1 16 4525 1 1 15 SER CA C -14.068 14.997 -5.390 1.00 . A A . 15 SER CA 1 1 16 4526 1 1 15 SER CB C -13.276 14.466 -6.586 1.00 . A A . 15 SER CB 1 1 16 4527 1 1 15 SER H H -12.374 16.185 -4.940 1.00 . A A . 15 SER H 1 1 16 4528 1 1 15 SER HA H -14.994 15.426 -5.743 1.00 . A A . 15 SER HA 1 1 16 4529 1 1 15 SER HB2 H -12.220 14.587 -6.398 1.00 . A A . 15 SER HB2 1 1 16 4530 1 1 15 SER HB3 H -13.500 13.418 -6.726 1.00 . A A . 15 SER HB3 1 1 16 4531 1 1 15 SER HG H -13.990 14.556 -8.408 1.00 . A A . 15 SER HG 1 1 16 4532 1 1 15 SER N N -13.317 16.047 -4.711 1.00 . A A . 15 SER N 1 1 16 4533 1 1 15 SER O O -15.373 13.134 -4.614 1.00 . A A . 15 SER O 1 1 16 4534 1 1 15 SER OG O -13.612 15.167 -7.771 1.00 . A A . 15 SER OG 1 1 16 4535 1 1 16 SER C C -14.775 13.053 -1.374 1.00 . A A . 16 SER C 1 1 16 4536 1 1 16 SER CA C -13.749 12.637 -2.424 1.00 . A A . 16 SER CA 1 1 16 4537 1 1 16 SER CB C -12.421 12.294 -1.746 1.00 . A A . 16 SER CB 1 1 16 4538 1 1 16 SER H H -12.791 14.300 -3.318 1.00 . A A . 16 SER H 1 1 16 4539 1 1 16 SER HA H -14.115 11.763 -2.942 1.00 . A A . 16 SER HA 1 1 16 4540 1 1 16 SER HB2 H -12.593 11.561 -0.973 1.00 . A A . 16 SER HB2 1 1 16 4541 1 1 16 SER HB3 H -11.739 11.889 -2.481 1.00 . A A . 16 SER HB3 1 1 16 4542 1 1 16 SER HG H -11.567 13.246 -0.262 1.00 . A A . 16 SER HG 1 1 16 4543 1 1 16 SER N N -13.556 13.694 -3.409 1.00 . A A . 16 SER N 1 1 16 4544 1 1 16 SER O O -15.481 12.214 -0.816 1.00 . A A . 16 SER O 1 1 16 4545 1 1 16 SER OG O -11.834 13.444 -1.163 1.00 . A A . 16 SER OG 1 1 16 4546 1 1 17 GLU C C -17.136 15.196 -0.778 1.00 . A A . 17 GLU C 1 1 16 4547 1 1 17 GLU CA C -15.790 14.882 -0.131 1.00 . A A . 17 GLU CA 1 1 16 4548 1 1 17 GLU CB C -15.222 16.142 0.526 1.00 . A A . 17 GLU CB 1 1 16 4549 1 1 17 GLU CD C -13.811 15.131 2.362 1.00 . A A . 17 GLU CD 1 1 16 4550 1 1 17 GLU CG C -15.005 16.002 2.024 1.00 . A A . 17 GLU CG 1 1 16 4551 1 1 17 GLU H H -14.261 14.973 -1.592 1.00 . A A . 17 GLU H 1 1 16 4552 1 1 17 GLU HA H -15.937 14.127 0.627 1.00 . A A . 17 GLU HA 1 1 16 4553 1 1 17 GLU HB2 H -14.273 16.376 0.066 1.00 . A A . 17 GLU HB2 1 1 16 4554 1 1 17 GLU HB3 H -15.905 16.960 0.358 1.00 . A A . 17 GLU HB3 1 1 16 4555 1 1 17 GLU HG2 H -14.845 16.984 2.444 1.00 . A A . 17 GLU HG2 1 1 16 4556 1 1 17 GLU HG3 H -15.889 15.563 2.463 1.00 . A A . 17 GLU HG3 1 1 16 4557 1 1 17 GLU N N -14.851 14.354 -1.113 1.00 . A A . 17 GLU N 1 1 16 4558 1 1 17 GLU O O -18.159 15.276 -0.099 1.00 . A A . 17 GLU O 1 1 16 4559 1 1 17 GLU OE1 O -12.721 15.374 1.804 1.00 . A A . 17 GLU OE1 1 1 16 4560 1 1 17 GLU OE2 O -13.968 14.205 3.185 1.00 . A A . 17 GLU OE2 1 1 17 4561 1 1 1 ARG C C 2.917 2.074 -1.106 1.00 . A A . 1 ARG C 1 1 17 4562 1 1 1 ARG CA C 2.979 0.646 -0.574 1.00 . A A . 1 ARG CA 1 1 17 4563 1 1 1 ARG CB C 2.287 -0.305 -1.553 1.00 . A A . 1 ARG CB 1 1 17 4564 1 1 1 ARG CD C 2.696 -2.647 -2.369 1.00 . A A . 1 ARG CD 1 1 17 4565 1 1 1 ARG CG C 3.246 -1.232 -2.282 1.00 . A A . 1 ARG CG 1 1 17 4566 1 1 1 ARG CZ C 3.065 -3.251 -4.723 1.00 . A A . 1 ARG CZ 1 1 17 4567 1 1 1 ARG H1 H 1.435 0.241 0.815 1.00 . A A . 1 ARG H1 1 1 17 4568 1 1 1 ARG HA H 4.014 0.355 -0.475 1.00 . A A . 1 ARG HA 1 1 17 4569 1 1 1 ARG HB2 H 1.580 -0.912 -1.008 1.00 . A A . 1 ARG HB2 1 1 17 4570 1 1 1 ARG HB3 H 1.756 0.280 -2.289 1.00 . A A . 1 ARG HB3 1 1 17 4571 1 1 1 ARG HD2 H 2.866 -3.143 -1.425 1.00 . A A . 1 ARG HD2 1 1 17 4572 1 1 1 ARG HD3 H 1.634 -2.594 -2.561 1.00 . A A . 1 ARG HD3 1 1 17 4573 1 1 1 ARG HE H 3.993 -4.093 -3.171 1.00 . A A . 1 ARG HE 1 1 17 4574 1 1 1 ARG HG2 H 3.403 -0.857 -3.283 1.00 . A A . 1 ARG HG2 1 1 17 4575 1 1 1 ARG HG3 H 4.186 -1.252 -1.751 1.00 . A A . 1 ARG HG3 1 1 17 4576 1 1 1 ARG HH11 H 1.708 -1.785 -4.425 1.00 . A A . 1 ARG HH11 1 1 17 4577 1 1 1 ARG HH12 H 1.978 -2.221 -6.080 1.00 . A A . 1 ARG HH12 1 1 17 4578 1 1 1 ARG HH21 H 4.357 -4.676 -5.346 1.00 . A A . 1 ARG HH21 1 1 17 4579 1 1 1 ARG HH22 H 3.484 -3.866 -6.602 1.00 . A A . 1 ARG HH22 1 1 17 4580 1 1 1 ARG N N 2.360 0.555 0.743 1.00 . A A . 1 ARG N 1 1 17 4581 1 1 1 ARG NE N 3.333 -3.418 -3.432 1.00 . A A . 1 ARG NE 1 1 17 4582 1 1 1 ARG NH1 N 2.177 -2.345 -5.107 1.00 . A A . 1 ARG NH1 1 1 17 4583 1 1 1 ARG NH2 N 3.687 -3.992 -5.632 1.00 . A A . 1 ARG NH2 1 1 17 4584 1 1 1 ARG O O 2.189 2.914 -0.577 1.00 . A A . 1 ARG O 1 1 17 4585 1 1 2 SER C C 2.544 3.870 -3.706 1.00 . A A . 2 SER C 1 1 17 4586 1 1 2 SER CA C 3.723 3.671 -2.758 1.00 . A A . 2 SER CA 1 1 17 4587 1 1 2 SER CB C 5.038 3.877 -3.511 1.00 . A A . 2 SER CB 1 1 17 4588 1 1 2 SER H H 4.245 1.631 -2.534 1.00 . A A . 2 SER H 1 1 17 4589 1 1 2 SER HA H 3.656 4.397 -1.962 1.00 . A A . 2 SER HA 1 1 17 4590 1 1 2 SER HB2 H 4.895 4.617 -4.284 1.00 . A A . 2 SER HB2 1 1 17 4591 1 1 2 SER HB3 H 5.795 4.220 -2.821 1.00 . A A . 2 SER HB3 1 1 17 4592 1 1 2 SER HG H 4.969 2.504 -4.906 1.00 . A A . 2 SER HG 1 1 17 4593 1 1 2 SER N N 3.687 2.343 -2.157 1.00 . A A . 2 SER N 1 1 17 4594 1 1 2 SER O O 2.089 4.994 -3.923 1.00 . A A . 2 SER O 1 1 17 4595 1 1 2 SER OG O 5.478 2.670 -4.110 1.00 . A A . 2 SER OG 1 1 17 4596 1 1 3 LYS C C -0.392 2.942 -4.437 1.00 . A A . 3 LYS C 1 1 17 4597 1 1 3 LYS CA C 0.927 2.822 -5.193 1.00 . A A . 3 LYS CA 1 1 17 4598 1 1 3 LYS CB C 0.909 1.573 -6.077 1.00 . A A . 3 LYS CB 1 1 17 4599 1 1 3 LYS CD C 1.215 0.942 -8.489 1.00 . A A . 3 LYS CD 1 1 17 4600 1 1 3 LYS CE C 1.957 1.746 -9.545 1.00 . A A . 3 LYS CE 1 1 17 4601 1 1 3 LYS CG C 0.486 1.847 -7.510 1.00 . A A . 3 LYS CG 1 1 17 4602 1 1 3 LYS H H 2.459 1.904 -4.056 1.00 . A A . 3 LYS H 1 1 17 4603 1 1 3 LYS HA H 1.050 3.693 -5.819 1.00 . A A . 3 LYS HA 1 1 17 4604 1 1 3 LYS HB2 H 1.899 1.142 -6.091 1.00 . A A . 3 LYS HB2 1 1 17 4605 1 1 3 LYS HB3 H 0.221 0.856 -5.652 1.00 . A A . 3 LYS HB3 1 1 17 4606 1 1 3 LYS HD2 H 1.927 0.338 -7.946 1.00 . A A . 3 LYS HD2 1 1 17 4607 1 1 3 LYS HD3 H 0.495 0.301 -8.977 1.00 . A A . 3 LYS HD3 1 1 17 4608 1 1 3 LYS HE2 H 1.277 2.466 -9.974 1.00 . A A . 3 LYS HE2 1 1 17 4609 1 1 3 LYS HE3 H 2.779 2.265 -9.073 1.00 . A A . 3 LYS HE3 1 1 17 4610 1 1 3 LYS HG2 H -0.576 1.677 -7.601 1.00 . A A . 3 LYS HG2 1 1 17 4611 1 1 3 LYS HG3 H 0.710 2.877 -7.750 1.00 . A A . 3 LYS HG3 1 1 17 4612 1 1 3 LYS HZ1 H 3.105 1.431 -11.261 1.00 . A A . 3 LYS HZ1 1 1 17 4613 1 1 3 LYS HZ2 H 1.708 0.479 -11.187 1.00 . A A . 3 LYS HZ2 1 1 17 4614 1 1 3 LYS HZ3 H 3.045 0.097 -10.223 1.00 . A A . 3 LYS HZ3 1 1 17 4615 1 1 3 LYS N N 2.053 2.771 -4.269 1.00 . A A . 3 LYS N 1 1 17 4616 1 1 3 LYS NZ N 2.492 0.878 -10.630 1.00 . A A . 3 LYS NZ 1 1 17 4617 1 1 3 LYS O O -1.373 3.473 -4.960 1.00 . A A . 3 LYS O 1 1 17 4618 1 1 4 ASP C C -1.865 3.922 -1.884 1.00 . A A . 4 ASP C 1 1 17 4619 1 1 4 ASP CA C -1.608 2.500 -2.375 1.00 . A A . 4 ASP CA 1 1 17 4620 1 1 4 ASP CB C -1.472 1.552 -1.183 1.00 . A A . 4 ASP CB 1 1 17 4621 1 1 4 ASP CG C -2.611 0.555 -1.103 1.00 . A A . 4 ASP CG 1 1 17 4622 1 1 4 ASP H H 0.404 2.035 -2.843 1.00 . A A . 4 ASP H 1 1 17 4623 1 1 4 ASP HA H -2.444 2.185 -2.981 1.00 . A A . 4 ASP HA 1 1 17 4624 1 1 4 ASP HB2 H -0.545 1.005 -1.270 1.00 . A A . 4 ASP HB2 1 1 17 4625 1 1 4 ASP HB3 H -1.459 2.131 -0.271 1.00 . A A . 4 ASP HB3 1 1 17 4626 1 1 4 ASP N N -0.410 2.446 -3.204 1.00 . A A . 4 ASP N 1 1 17 4627 1 1 4 ASP O O -3.013 4.321 -1.681 1.00 . A A . 4 ASP O 1 1 17 4628 1 1 4 ASP OD1 O -2.702 -0.315 -1.995 1.00 . A A . 4 ASP OD1 1 1 17 4629 1 1 4 ASP OD2 O -3.412 0.644 -0.149 1.00 . A A . 4 ASP OD2 1 1 17 4630 1 1 5 LEU C C -1.384 6.976 -2.343 1.00 . A A . 5 LEU C 1 1 17 4631 1 1 5 LEU CA C -0.901 6.057 -1.225 1.00 . A A . 5 LEU CA 1 1 17 4632 1 1 5 LEU CB C 0.449 6.545 -0.696 1.00 . A A . 5 LEU CB 1 1 17 4633 1 1 5 LEU CD1 C -0.319 7.994 1.199 1.00 . A A . 5 LEU CD1 1 1 17 4634 1 1 5 LEU CD2 C 0.091 5.556 1.579 1.00 . A A . 5 LEU CD2 1 1 17 4635 1 1 5 LEU CG C 0.530 6.794 0.810 1.00 . A A . 5 LEU CG 1 1 17 4636 1 1 5 LEU H H 0.096 4.306 -1.873 1.00 . A A . 5 LEU H 1 1 17 4637 1 1 5 LEU HA H -1.622 6.077 -0.422 1.00 . A A . 5 LEU HA 1 1 17 4638 1 1 5 LEU HB2 H 1.191 5.803 -0.949 1.00 . A A . 5 LEU HB2 1 1 17 4639 1 1 5 LEU HB3 H 0.685 7.472 -1.199 1.00 . A A . 5 LEU HB3 1 1 17 4640 1 1 5 LEU HD11 H 0.324 8.827 1.440 1.00 . A A . 5 LEU HD11 1 1 17 4641 1 1 5 LEU HD12 H -0.923 7.745 2.059 1.00 . A A . 5 LEU HD12 1 1 17 4642 1 1 5 LEU HD13 H -0.963 8.262 0.373 1.00 . A A . 5 LEU HD13 1 1 17 4643 1 1 5 LEU HD21 H 0.116 5.764 2.639 1.00 . A A . 5 LEU HD21 1 1 17 4644 1 1 5 LEU HD22 H 0.760 4.738 1.356 1.00 . A A . 5 LEU HD22 1 1 17 4645 1 1 5 LEU HD23 H -0.915 5.289 1.287 1.00 . A A . 5 LEU HD23 1 1 17 4646 1 1 5 LEU HG H 1.555 7.010 1.079 1.00 . A A . 5 LEU HG 1 1 17 4647 1 1 5 LEU N N -0.791 4.680 -1.694 1.00 . A A . 5 LEU N 1 1 17 4648 1 1 5 LEU O O -2.011 8.004 -2.087 1.00 . A A . 5 LEU O 1 1 17 4649 1 1 6 ARG C C -3.005 7.601 -4.749 1.00 . A A . 6 ARG C 1 1 17 4650 1 1 6 ARG CA C -1.495 7.387 -4.739 1.00 . A A . 6 ARG CA 1 1 17 4651 1 1 6 ARG CB C -1.058 6.696 -6.033 1.00 . A A . 6 ARG CB 1 1 17 4652 1 1 6 ARG CD C 1.042 7.796 -6.865 1.00 . A A . 6 ARG CD 1 1 17 4653 1 1 6 ARG CG C -0.459 7.645 -7.057 1.00 . A A . 6 ARG CG 1 1 17 4654 1 1 6 ARG CZ C 3.098 7.408 -8.157 1.00 . A A . 6 ARG CZ 1 1 17 4655 1 1 6 ARG H H -0.587 5.768 -3.722 1.00 . A A . 6 ARG H 1 1 17 4656 1 1 6 ARG HA H -1.007 8.348 -4.672 1.00 . A A . 6 ARG HA 1 1 17 4657 1 1 6 ARG HB2 H -0.319 5.945 -5.795 1.00 . A A . 6 ARG HB2 1 1 17 4658 1 1 6 ARG HB3 H -1.917 6.217 -6.477 1.00 . A A . 6 ARG HB3 1 1 17 4659 1 1 6 ARG HD2 H 1.249 8.799 -6.523 1.00 . A A . 6 ARG HD2 1 1 17 4660 1 1 6 ARG HD3 H 1.369 7.087 -6.120 1.00 . A A . 6 ARG HD3 1 1 17 4661 1 1 6 ARG HE H 1.264 7.507 -8.935 1.00 . A A . 6 ARG HE 1 1 17 4662 1 1 6 ARG HG2 H -0.646 7.257 -8.047 1.00 . A A . 6 ARG HG2 1 1 17 4663 1 1 6 ARG HG3 H -0.926 8.613 -6.954 1.00 . A A . 6 ARG HG3 1 1 17 4664 1 1 6 ARG HH11 H 3.372 7.632 -6.168 1.00 . A A . 6 ARG HH11 1 1 17 4665 1 1 6 ARG HH12 H 4.814 7.357 -7.090 1.00 . A A . 6 ARG HH12 1 1 17 4666 1 1 6 ARG HH21 H 3.154 7.145 -10.160 1.00 . A A . 6 ARG HH21 1 1 17 4667 1 1 6 ARG HH22 H 4.688 7.081 -9.360 1.00 . A A . 6 ARG HH22 1 1 17 4668 1 1 6 ARG N N -1.089 6.597 -3.582 1.00 . A A . 6 ARG N 1 1 17 4669 1 1 6 ARG NE N 1.779 7.558 -8.103 1.00 . A A . 6 ARG NE 1 1 17 4670 1 1 6 ARG NH1 N 3.821 7.471 -7.047 1.00 . A A . 6 ARG NH1 1 1 17 4671 1 1 6 ARG NH2 N 3.696 7.193 -9.321 1.00 . A A . 6 ARG NH2 1 1 17 4672 1 1 6 ARG O O -3.494 8.629 -5.218 1.00 . A A . 6 ARG O 1 1 17 4673 1 1 7 HIS C C -5.648 7.652 -3.071 1.00 . A A . 7 HIS C 1 1 17 4674 1 1 7 HIS CA C -5.195 6.704 -4.177 1.00 . A A . 7 HIS CA 1 1 17 4675 1 1 7 HIS CB C -5.797 5.316 -3.953 1.00 . A A . 7 HIS CB 1 1 17 4676 1 1 7 HIS CD2 C -6.578 4.454 -6.271 1.00 . A A . 7 HIS CD2 1 1 17 4677 1 1 7 HIS CE1 C -8.742 4.534 -5.931 1.00 . A A . 7 HIS CE1 1 1 17 4678 1 1 7 HIS CG C -6.775 4.909 -5.012 1.00 . A A . 7 HIS CG 1 1 17 4679 1 1 7 HIS H H -3.293 5.828 -3.870 1.00 . A A . 7 HIS H 1 1 17 4680 1 1 7 HIS HA H -5.540 7.087 -5.125 1.00 . A A . 7 HIS HA 1 1 17 4681 1 1 7 HIS HB2 H -5.003 4.585 -3.937 1.00 . A A . 7 HIS HB2 1 1 17 4682 1 1 7 HIS HB3 H -6.311 5.303 -3.002 1.00 . A A . 7 HIS HB3 1 1 17 4683 1 1 7 HIS HD1 H -8.602 5.237 -4.014 1.00 . A A . 7 HIS HD1 1 1 17 4684 1 1 7 HIS HD2 H -5.624 4.297 -6.755 1.00 . A A . 7 HIS HD2 1 1 17 4685 1 1 7 HIS HE1 H -9.809 4.458 -6.079 1.00 . A A . 7 HIS HE1 1 1 17 4686 1 1 7 HIS N N -3.740 6.623 -4.228 1.00 . A A . 7 HIS N 1 1 17 4687 1 1 7 HIS ND1 N -8.141 4.949 -4.830 1.00 . A A . 7 HIS ND1 1 1 17 4688 1 1 7 HIS NE2 N -7.816 4.228 -6.821 1.00 . A A . 7 HIS NE2 1 1 17 4689 1 1 7 HIS O O -6.781 8.131 -3.076 1.00 . A A . 7 HIS O 1 1 17 4690 1 1 8 ALA C C -5.042 10.269 -1.458 1.00 . A A . 8 ALA C 1 1 17 4691 1 1 8 ALA CA C -5.061 8.810 -1.013 1.00 . A A . 8 ALA CA 1 1 17 4692 1 1 8 ALA CB C -4.077 8.591 0.127 1.00 . A A . 8 ALA CB 1 1 17 4693 1 1 8 ALA H H -3.867 7.507 -2.175 1.00 . A A . 8 ALA H 1 1 17 4694 1 1 8 ALA HA H -6.051 8.567 -0.653 1.00 . A A . 8 ALA HA 1 1 17 4695 1 1 8 ALA HB1 H -3.080 8.841 -0.206 1.00 . A A . 8 ALA HB1 1 1 17 4696 1 1 8 ALA HB2 H -4.347 9.221 0.961 1.00 . A A . 8 ALA HB2 1 1 17 4697 1 1 8 ALA HB3 H -4.106 7.556 0.433 1.00 . A A . 8 ALA HB3 1 1 17 4698 1 1 8 ALA N N -4.754 7.919 -2.124 1.00 . A A . 8 ALA N 1 1 17 4699 1 1 8 ALA O O -5.660 11.128 -0.829 1.00 . A A . 8 ALA O 1 1 17 4700 1 1 9 PHE C C -5.593 12.412 -3.515 1.00 . A A . 9 PHE C 1 1 17 4701 1 1 9 PHE CA C -4.226 11.897 -3.073 1.00 . A A . 9 PHE CA 1 1 17 4702 1 1 9 PHE CB C -3.248 11.938 -4.248 1.00 . A A . 9 PHE CB 1 1 17 4703 1 1 9 PHE CD1 C -1.718 13.715 -3.355 1.00 . A A . 9 PHE CD1 1 1 17 4704 1 1 9 PHE CD2 C -0.765 11.641 -4.045 1.00 . A A . 9 PHE CD2 1 1 17 4705 1 1 9 PHE CE1 C -0.463 14.181 -3.011 1.00 . A A . 9 PHE CE1 1 1 17 4706 1 1 9 PHE CE2 C 0.493 12.102 -3.703 1.00 . A A . 9 PHE CE2 1 1 17 4707 1 1 9 PHE CG C -1.883 12.441 -3.875 1.00 . A A . 9 PHE CG 1 1 17 4708 1 1 9 PHE CZ C 0.643 13.373 -3.185 1.00 . A A . 9 PHE CZ 1 1 17 4709 1 1 9 PHE H H -3.856 9.814 -3.002 1.00 . A A . 9 PHE H 1 1 17 4710 1 1 9 PHE HA H -3.854 12.532 -2.284 1.00 . A A . 9 PHE HA 1 1 17 4711 1 1 9 PHE HB2 H -3.136 10.941 -4.648 1.00 . A A . 9 PHE HB2 1 1 17 4712 1 1 9 PHE HB3 H -3.645 12.586 -5.015 1.00 . A A . 9 PHE HB3 1 1 17 4713 1 1 9 PHE HD1 H -2.583 14.347 -3.218 1.00 . A A . 9 PHE HD1 1 1 17 4714 1 1 9 PHE HD2 H -0.882 10.646 -4.450 1.00 . A A . 9 PHE HD2 1 1 17 4715 1 1 9 PHE HE1 H -0.348 15.175 -2.606 1.00 . A A . 9 PHE HE1 1 1 17 4716 1 1 9 PHE HE2 H 1.356 11.467 -3.840 1.00 . A A . 9 PHE HE2 1 1 17 4717 1 1 9 PHE HZ H 1.625 13.735 -2.918 1.00 . A A . 9 PHE HZ 1 1 17 4718 1 1 9 PHE N N -4.327 10.542 -2.545 1.00 . A A . 9 PHE N 1 1 17 4719 1 1 9 PHE O O -5.847 13.616 -3.508 1.00 . A A . 9 PHE O 1 1 17 4720 1 1 10 ARG C C -8.691 12.240 -3.167 1.00 . A A . 10 ARG C 1 1 17 4721 1 1 10 ARG CA C -7.809 11.849 -4.350 1.00 . A A . 10 ARG CA 1 1 17 4722 1 1 10 ARG CB C -8.445 10.685 -5.111 1.00 . A A . 10 ARG CB 1 1 17 4723 1 1 10 ARG CD C -10.843 10.471 -5.833 1.00 . A A . 10 ARG CD 1 1 17 4724 1 1 10 ARG CG C -9.496 11.118 -6.119 1.00 . A A . 10 ARG CG 1 1 17 4725 1 1 10 ARG CZ C -12.114 8.480 -6.512 1.00 . A A . 10 ARG CZ 1 1 17 4726 1 1 10 ARG H H -6.208 10.545 -3.885 1.00 . A A . 10 ARG H 1 1 17 4727 1 1 10 ARG HA H -7.721 12.696 -5.013 1.00 . A A . 10 ARG HA 1 1 17 4728 1 1 10 ARG HB2 H -7.670 10.149 -5.639 1.00 . A A . 10 ARG HB2 1 1 17 4729 1 1 10 ARG HB3 H -8.911 10.018 -4.401 1.00 . A A . 10 ARG HB3 1 1 17 4730 1 1 10 ARG HD2 H -10.932 10.315 -4.768 1.00 . A A . 10 ARG HD2 1 1 17 4731 1 1 10 ARG HD3 H -11.624 11.138 -6.165 1.00 . A A . 10 ARG HD3 1 1 17 4732 1 1 10 ARG HE H -10.213 8.839 -6.997 1.00 . A A . 10 ARG HE 1 1 17 4733 1 1 10 ARG HG2 H -9.607 12.191 -6.071 1.00 . A A . 10 ARG HG2 1 1 17 4734 1 1 10 ARG HG3 H -9.172 10.831 -7.109 1.00 . A A . 10 ARG HG3 1 1 17 4735 1 1 10 ARG HH11 H -13.143 9.801 -5.382 1.00 . A A . 10 ARG HH11 1 1 17 4736 1 1 10 ARG HH12 H -14.028 8.393 -5.868 1.00 . A A . 10 ARG HH12 1 1 17 4737 1 1 10 ARG HH21 H -11.367 6.981 -7.644 1.00 . A A . 10 ARG HH21 1 1 17 4738 1 1 10 ARG HH22 H -13.016 6.789 -7.154 1.00 . A A . 10 ARG HH22 1 1 17 4739 1 1 10 ARG N N -6.469 11.490 -3.902 1.00 . A A . 10 ARG N 1 1 17 4740 1 1 10 ARG NE N -10.990 9.188 -6.515 1.00 . A A . 10 ARG NE 1 1 17 4741 1 1 10 ARG NH1 N -13.182 8.928 -5.868 1.00 . A A . 10 ARG NH1 1 1 17 4742 1 1 10 ARG NH2 N -12.170 7.321 -7.156 1.00 . A A . 10 ARG NH2 1 1 17 4743 1 1 10 ARG O O -9.627 13.018 -3.346 1.00 . A A . 10 ARG O 1 1 17 4744 1 1 11 . C C -8.998 13.461 -0.414 1.00 . A A . 11 SEP C 1 1 17 4745 1 1 11 . CA C -9.169 12.007 -0.772 1.00 . A A . 11 SEP CA 1 1 17 4746 1 1 11 . CB C -8.814 11.001 0.363 1.00 . A A . 11 SEP CB 1 1 17 4747 1 1 11 . H H -7.594 11.067 -1.918 1.00 . A A . 11 SEP H 1 1 17 4748 1 1 11 . HA H -10.231 11.854 -1.039 1.00 . A A . 11 SEP HA 1 1 17 4749 1 1 11 . HB2 H -8.400 10.054 -0.030 1.00 . A A . 11 SEP HB2 1 1 17 4750 1 1 11 . HB3 H -8.014 11.388 1.026 1.00 . A A . 11 SEP HB3 1 1 17 4751 1 1 11 . N N -8.377 11.699 -1.999 1.00 . A A . 11 SEP N 1 1 17 4752 1 1 11 . O O -9.919 14.144 0.033 1.00 . A A . 11 SEP O 1 1 17 4753 1 1 11 . O1P O -8.536 9.326 2.777 1.00 . A A . 11 SEP O1P 1 1 17 4754 1 1 11 . O2P O -10.819 10.022 3.463 1.00 . A A . 11 SEP O2P 1 1 17 4755 1 1 11 . O3P O -10.543 8.232 1.730 1.00 . A A . 11 SEP O3P 1 1 17 4756 1 1 11 . OG O -9.980 10.684 1.159 1.00 . A A . 11 SEP OG 1 1 17 4757 1 1 11 . P P -9.967 9.526 2.290 1.00 . A A . 11 SEP P 1 1 17 4758 1 1 12 MET C C -8.159 16.275 -1.284 1.00 . A A . 12 MET C 1 1 17 4759 1 1 12 MET CA C -7.440 15.329 -0.327 1.00 . A A . 12 MET CA 1 1 17 4760 1 1 12 MET CB C -5.928 15.542 -0.421 1.00 . A A . 12 MET CB 1 1 17 4761 1 1 12 MET CE C -4.220 14.892 2.977 1.00 . A A . 12 MET CE 1 1 17 4762 1 1 12 MET CG C -5.122 14.533 0.381 1.00 . A A . 12 MET CG 1 1 17 4763 1 1 12 MET H H -7.083 13.347 -0.978 1.00 . A A . 12 MET H 1 1 17 4764 1 1 12 MET HA H -7.763 15.542 0.681 1.00 . A A . 12 MET HA 1 1 17 4765 1 1 12 MET HB2 H -5.630 15.468 -1.456 1.00 . A A . 12 MET HB2 1 1 17 4766 1 1 12 MET HB3 H -5.692 16.530 -0.056 1.00 . A A . 12 MET HB3 1 1 17 4767 1 1 12 MET HE1 H -5.094 14.257 2.971 1.00 . A A . 12 MET HE1 1 1 17 4768 1 1 12 MET HE2 H -3.402 14.374 3.456 1.00 . A A . 12 MET HE2 1 1 17 4769 1 1 12 MET HE3 H -4.437 15.800 3.518 1.00 . A A . 12 MET HE3 1 1 17 4770 1 1 12 MET HG2 H -5.779 14.044 1.085 1.00 . A A . 12 MET HG2 1 1 17 4771 1 1 12 MET HG3 H -4.714 13.798 -0.297 1.00 . A A . 12 MET HG3 1 1 17 4772 1 1 12 MET N N -7.776 13.940 -0.620 1.00 . A A . 12 MET N 1 1 17 4773 1 1 12 MET O O -8.402 17.437 -0.957 1.00 . A A . 12 MET O 1 1 17 4774 1 1 12 MET SD S -3.765 15.295 1.292 1.00 . A A . 12 MET SD 1 1 17 4775 1 1 13 PHE C C -10.619 16.865 -3.042 1.00 . A A . 13 PHE C 1 1 17 4776 1 1 13 PHE CA C -9.185 16.572 -3.471 1.00 . A A . 13 PHE CA 1 1 17 4777 1 1 13 PHE CB C -9.182 15.850 -4.820 1.00 . A A . 13 PHE CB 1 1 17 4778 1 1 13 PHE CD1 C -6.811 16.412 -5.418 1.00 . A A . 13 PHE CD1 1 1 17 4779 1 1 13 PHE CD2 C -8.514 16.820 -7.035 1.00 . A A . 13 PHE CD2 1 1 17 4780 1 1 13 PHE CE1 C -5.858 16.892 -6.297 1.00 . A A . 13 PHE CE1 1 1 17 4781 1 1 13 PHE CE2 C -7.566 17.301 -7.919 1.00 . A A . 13 PHE CE2 1 1 17 4782 1 1 13 PHE CG C -8.148 16.371 -5.777 1.00 . A A . 13 PHE CG 1 1 17 4783 1 1 13 PHE CZ C -6.236 17.336 -7.549 1.00 . A A . 13 PHE CZ 1 1 17 4784 1 1 13 PHE H H -8.274 14.837 -2.668 1.00 . A A . 13 PHE H 1 1 17 4785 1 1 13 PHE HA H -8.653 17.506 -3.571 1.00 . A A . 13 PHE HA 1 1 17 4786 1 1 13 PHE HB2 H -8.984 14.801 -4.658 1.00 . A A . 13 PHE HB2 1 1 17 4787 1 1 13 PHE HB3 H -10.151 15.962 -5.282 1.00 . A A . 13 PHE HB3 1 1 17 4788 1 1 13 PHE HD1 H -6.513 16.064 -4.440 1.00 . A A . 13 PHE HD1 1 1 17 4789 1 1 13 PHE HD2 H -9.555 16.793 -7.326 1.00 . A A . 13 PHE HD2 1 1 17 4790 1 1 13 PHE HE1 H -4.818 16.918 -6.005 1.00 . A A . 13 PHE HE1 1 1 17 4791 1 1 13 PHE HE2 H -7.865 17.648 -8.897 1.00 . A A . 13 PHE HE2 1 1 17 4792 1 1 13 PHE HZ H -5.493 17.712 -8.237 1.00 . A A . 13 PHE HZ 1 1 17 4793 1 1 13 PHE N N -8.495 15.771 -2.466 1.00 . A A . 13 PHE N 1 1 17 4794 1 1 13 PHE O O -11.176 16.213 -2.159 1.00 . A A . 13 PHE O 1 1 17 4795 1 1 14 PRO C C -13.636 17.298 -3.945 1.00 . A A . 14 PRO C 1 1 17 4796 1 1 14 PRO CA C -12.610 18.277 -3.383 1.00 . A A . 14 PRO CA 1 1 17 4797 1 1 14 PRO CB C -12.737 19.638 -4.070 1.00 . A A . 14 PRO CB 1 1 17 4798 1 1 14 PRO CD C -10.630 18.694 -4.744 1.00 . A A . 14 PRO CD 1 1 17 4799 1 1 14 PRO CG C -11.735 19.601 -5.172 1.00 . A A . 14 PRO CG 1 1 17 4800 1 1 14 PRO HA H -12.769 18.392 -2.320 1.00 . A A . 14 PRO HA 1 1 17 4801 1 1 14 PRO HB2 H -13.741 19.759 -4.452 1.00 . A A . 14 PRO HB2 1 1 17 4802 1 1 14 PRO HB3 H -12.517 20.424 -3.364 1.00 . A A . 14 PRO HB3 1 1 17 4803 1 1 14 PRO HD2 H -10.305 18.078 -5.570 1.00 . A A . 14 PRO HD2 1 1 17 4804 1 1 14 PRO HD3 H -9.806 19.277 -4.359 1.00 . A A . 14 PRO HD3 1 1 17 4805 1 1 14 PRO HG2 H -12.195 19.228 -6.074 1.00 . A A . 14 PRO HG2 1 1 17 4806 1 1 14 PRO HG3 H -11.333 20.590 -5.336 1.00 . A A . 14 PRO HG3 1 1 17 4807 1 1 14 PRO N N -11.233 17.872 -3.681 1.00 . A A . 14 PRO N 1 1 17 4808 1 1 14 PRO O O -14.804 17.317 -3.556 1.00 . A A . 14 PRO O 1 1 17 4809 1 1 15 SER C C -14.471 14.381 -4.476 1.00 . A A . 15 SER C 1 1 17 4810 1 1 15 SER CA C -14.073 15.460 -5.479 1.00 . A A . 15 SER CA 1 1 17 4811 1 1 15 SER CB C -13.388 14.820 -6.688 1.00 . A A . 15 SER CB 1 1 17 4812 1 1 15 SER H H -12.250 16.478 -5.129 1.00 . A A . 15 SER H 1 1 17 4813 1 1 15 SER HA H -14.963 15.973 -5.810 1.00 . A A . 15 SER HA 1 1 17 4814 1 1 15 SER HB2 H -14.106 14.707 -7.487 1.00 . A A . 15 SER HB2 1 1 17 4815 1 1 15 SER HB3 H -12.579 15.455 -7.019 1.00 . A A . 15 SER HB3 1 1 17 4816 1 1 15 SER HG H -12.318 13.228 -7.085 1.00 . A A . 15 SER HG 1 1 17 4817 1 1 15 SER N N -13.192 16.444 -4.861 1.00 . A A . 15 SER N 1 1 17 4818 1 1 15 SER O O -15.526 13.761 -4.601 1.00 . A A . 15 SER O 1 1 17 4819 1 1 15 SER OG O -12.864 13.544 -6.362 1.00 . A A . 15 SER OG 1 1 17 4820 1 1 16 SER C C -14.807 13.706 -1.380 1.00 . A A . 16 SER C 1 1 17 4821 1 1 16 SER CA C -13.876 13.157 -2.457 1.00 . A A . 16 SER CA 1 1 17 4822 1 1 16 SER CB C -12.563 12.693 -1.825 1.00 . A A . 16 SER CB 1 1 17 4823 1 1 16 SER H H -12.791 14.690 -3.435 1.00 . A A . 16 SER H 1 1 17 4824 1 1 16 SER HA H -14.354 12.315 -2.934 1.00 . A A . 16 SER HA 1 1 17 4825 1 1 16 SER HB2 H -11.771 12.757 -2.556 1.00 . A A . 16 SER HB2 1 1 17 4826 1 1 16 SER HB3 H -12.328 13.327 -0.982 1.00 . A A . 16 SER HB3 1 1 17 4827 1 1 16 SER HG H -12.967 10.794 -2.093 1.00 . A A . 16 SER HG 1 1 17 4828 1 1 16 SER N N -13.617 14.163 -3.481 1.00 . A A . 16 SER N 1 1 17 4829 1 1 16 SER O O -15.608 12.970 -0.805 1.00 . A A . 16 SER O 1 1 17 4830 1 1 16 SER OG O -12.660 11.352 -1.374 1.00 . A A . 16 SER OG 1 1 17 4831 1 1 17 GLU C C -16.814 16.182 -0.721 1.00 . A A . 17 GLU C 1 1 17 4832 1 1 17 GLU CA C -15.524 15.650 -0.104 1.00 . A A . 17 GLU CA 1 1 17 4833 1 1 17 GLU CB C -14.756 16.793 0.564 1.00 . A A . 17 GLU CB 1 1 17 4834 1 1 17 GLU CD C -15.361 19.222 0.226 1.00 . A A . 17 GLU CD 1 1 17 4835 1 1 17 GLU CG C -14.608 18.023 -0.316 1.00 . A A . 17 GLU CG 1 1 17 4836 1 1 17 GLU H H -14.035 15.537 -1.605 1.00 . A A . 17 GLU H 1 1 17 4837 1 1 17 GLU HA H -15.774 14.912 0.643 1.00 . A A . 17 GLU HA 1 1 17 4838 1 1 17 GLU HB2 H -15.276 17.081 1.466 1.00 . A A . 17 GLU HB2 1 1 17 4839 1 1 17 GLU HB3 H -13.769 16.442 0.825 1.00 . A A . 17 GLU HB3 1 1 17 4840 1 1 17 GLU HG2 H -13.561 18.276 -0.386 1.00 . A A . 17 GLU HG2 1 1 17 4841 1 1 17 GLU HG3 H -14.988 17.793 -1.301 1.00 . A A . 17 GLU HG3 1 1 17 4842 1 1 17 GLU N N -14.693 15.003 -1.113 1.00 . A A . 17 GLU N 1 1 17 4843 1 1 17 GLU O O -16.860 16.500 -1.909 1.00 . A A . 17 GLU O 1 1 17 4844 1 1 17 GLU OE1 O -15.406 19.385 1.463 1.00 . A A . 17 GLU OE1 1 1 17 4845 1 1 17 GLU OE2 O -15.906 19.997 -0.588 1.00 . A A . 17 GLU OE2 1 1 18 4846 1 1 1 ARG C C 2.225 1.343 -1.574 1.00 . A A . 1 ARG C 1 1 18 4847 1 1 1 ARG CA C 2.316 -0.127 -1.175 1.00 . A A . 1 ARG CA 1 1 18 4848 1 1 1 ARG CB C 2.275 -1.009 -2.424 1.00 . A A . 1 ARG CB 1 1 18 4849 1 1 1 ARG CD C 3.503 -2.706 -3.813 1.00 . A A . 1 ARG CD 1 1 18 4850 1 1 1 ARG CG C 3.635 -1.551 -2.833 1.00 . A A . 1 ARG CG 1 1 18 4851 1 1 1 ARG CZ C 5.816 -3.525 -3.963 1.00 . A A . 1 ARG CZ 1 1 18 4852 1 1 1 ARG H1 H 1.202 -0.075 0.624 1.00 . A A . 1 ARG H1 1 1 18 4853 1 1 1 ARG HA H 3.251 -0.291 -0.661 1.00 . A A . 1 ARG HA 1 1 18 4854 1 1 1 ARG HB2 H 1.620 -1.848 -2.237 1.00 . A A . 1 ARG HB2 1 1 18 4855 1 1 1 ARG HB3 H 1.880 -0.431 -3.246 1.00 . A A . 1 ARG HB3 1 1 18 4856 1 1 1 ARG HD2 H 2.539 -3.171 -3.673 1.00 . A A . 1 ARG HD2 1 1 18 4857 1 1 1 ARG HD3 H 3.572 -2.317 -4.818 1.00 . A A . 1 ARG HD3 1 1 18 4858 1 1 1 ARG HE H 4.285 -4.562 -3.215 1.00 . A A . 1 ARG HE 1 1 18 4859 1 1 1 ARG HG2 H 4.201 -0.759 -3.301 1.00 . A A . 1 ARG HG2 1 1 18 4860 1 1 1 ARG HG3 H 4.154 -1.895 -1.951 1.00 . A A . 1 ARG HG3 1 1 18 4861 1 1 1 ARG HH11 H 5.529 -1.655 -4.670 1.00 . A A . 1 ARG HH11 1 1 18 4862 1 1 1 ARG HH12 H 7.156 -2.244 -4.769 1.00 . A A . 1 ARG HH12 1 1 18 4863 1 1 1 ARG HH21 H 6.423 -5.350 -3.340 1.00 . A A . 1 ARG HH21 1 1 18 4864 1 1 1 ARG HH22 H 7.662 -4.347 -4.013 1.00 . A A . 1 ARG HH22 1 1 18 4865 1 1 1 ARG N N 1.236 -0.487 -0.265 1.00 . A A . 1 ARG N 1 1 18 4866 1 1 1 ARG NE N 4.546 -3.709 -3.620 1.00 . A A . 1 ARG NE 1 1 18 4867 1 1 1 ARG NH1 N 6.198 -2.381 -4.513 1.00 . A A . 1 ARG NH1 1 1 18 4868 1 1 1 ARG NH2 N 6.707 -4.486 -3.755 1.00 . A A . 1 ARG NH2 1 1 18 4869 1 1 1 ARG O O 1.410 2.093 -1.037 1.00 . A A . 1 ARG O 1 1 18 4870 1 1 2 SER C C 1.866 3.422 -3.859 1.00 . A A . 2 SER C 1 1 18 4871 1 1 2 SER CA C 3.083 3.129 -2.988 1.00 . A A . 2 SER CA 1 1 18 4872 1 1 2 SER CB C 4.366 3.407 -3.773 1.00 . A A . 2 SER CB 1 1 18 4873 1 1 2 SER H H 3.693 1.102 -2.910 1.00 . A A . 2 SER H 1 1 18 4874 1 1 2 SER HA H 3.055 3.773 -2.122 1.00 . A A . 2 SER HA 1 1 18 4875 1 1 2 SER HB2 H 4.989 2.525 -3.766 1.00 . A A . 2 SER HB2 1 1 18 4876 1 1 2 SER HB3 H 4.113 3.661 -4.793 1.00 . A A . 2 SER HB3 1 1 18 4877 1 1 2 SER HG H 5.993 4.470 -3.529 1.00 . A A . 2 SER HG 1 1 18 4878 1 1 2 SER N N 3.066 1.748 -2.520 1.00 . A A . 2 SER N 1 1 18 4879 1 1 2 SER O O 1.409 4.562 -3.946 1.00 . A A . 2 SER O 1 1 18 4880 1 1 2 SER OG O 5.091 4.482 -3.202 1.00 . A A . 2 SER OG 1 1 18 4881 1 1 3 LYS C C -1.093 2.696 -4.545 1.00 . A A . 3 LYS C 1 1 18 4882 1 1 3 LYS CA C 0.179 2.527 -5.370 1.00 . A A . 3 LYS CA 1 1 18 4883 1 1 3 LYS CB C 0.047 1.309 -6.287 1.00 . A A . 3 LYS CB 1 1 18 4884 1 1 3 LYS CD C 1.370 -0.355 -7.625 1.00 . A A . 3 LYS CD 1 1 18 4885 1 1 3 LYS CE C 1.882 -0.469 -9.053 1.00 . A A . 3 LYS CE 1 1 18 4886 1 1 3 LYS CG C 1.248 1.096 -7.192 1.00 . A A . 3 LYS CG 1 1 18 4887 1 1 3 LYS H H 1.753 1.499 -4.396 1.00 . A A . 3 LYS H 1 1 18 4888 1 1 3 LYS HA H 0.322 3.409 -5.975 1.00 . A A . 3 LYS HA 1 1 18 4889 1 1 3 LYS HB2 H -0.079 0.426 -5.678 1.00 . A A . 3 LYS HB2 1 1 18 4890 1 1 3 LYS HB3 H -0.828 1.435 -6.909 1.00 . A A . 3 LYS HB3 1 1 18 4891 1 1 3 LYS HD2 H 2.058 -0.862 -6.966 1.00 . A A . 3 LYS HD2 1 1 18 4892 1 1 3 LYS HD3 H 0.397 -0.823 -7.563 1.00 . A A . 3 LYS HD3 1 1 18 4893 1 1 3 LYS HE2 H 1.054 -0.332 -9.731 1.00 . A A . 3 LYS HE2 1 1 18 4894 1 1 3 LYS HE3 H 2.617 0.304 -9.221 1.00 . A A . 3 LYS HE3 1 1 18 4895 1 1 3 LYS HG2 H 1.140 1.715 -8.070 1.00 . A A . 3 LYS HG2 1 1 18 4896 1 1 3 LYS HG3 H 2.144 1.379 -6.658 1.00 . A A . 3 LYS HG3 1 1 18 4897 1 1 3 LYS HZ1 H 2.498 -2.372 -8.447 1.00 . A A . 3 LYS HZ1 1 1 18 4898 1 1 3 LYS HZ2 H 3.491 -1.672 -9.625 1.00 . A A . 3 LYS HZ2 1 1 18 4899 1 1 3 LYS HZ3 H 1.981 -2.299 -10.057 1.00 . A A . 3 LYS HZ3 1 1 18 4900 1 1 3 LYS N N 1.345 2.384 -4.505 1.00 . A A . 3 LYS N 1 1 18 4901 1 1 3 LYS NZ N 2.507 -1.796 -9.313 1.00 . A A . 3 LYS NZ 1 1 18 4902 1 1 3 LYS O O -2.053 3.326 -4.989 1.00 . A A . 3 LYS O 1 1 18 4903 1 1 4 ASP C C -2.396 3.635 -1.901 1.00 . A A . 4 ASP C 1 1 18 4904 1 1 4 ASP CA C -2.246 2.221 -2.455 1.00 . A A . 4 ASP CA 1 1 18 4905 1 1 4 ASP CB C -2.111 1.222 -1.305 1.00 . A A . 4 ASP CB 1 1 18 4906 1 1 4 ASP CG C -3.257 0.230 -1.262 1.00 . A A . 4 ASP CG 1 1 18 4907 1 1 4 ASP H H -0.297 1.642 -3.045 1.00 . A A . 4 ASP H 1 1 18 4908 1 1 4 ASP HA H -3.126 1.978 -3.030 1.00 . A A . 4 ASP HA 1 1 18 4909 1 1 4 ASP HB2 H -1.188 0.671 -1.421 1.00 . A A . 4 ASP HB2 1 1 18 4910 1 1 4 ASP HB3 H -2.089 1.760 -0.369 1.00 . A A . 4 ASP HB3 1 1 18 4911 1 1 4 ASP N N -1.092 2.131 -3.343 1.00 . A A . 4 ASP N 1 1 18 4912 1 1 4 ASP O O -3.507 4.094 -1.636 1.00 . A A . 4 ASP O 1 1 18 4913 1 1 4 ASP OD1 O -4.403 0.637 -1.544 1.00 . A A . 4 ASP OD1 1 1 18 4914 1 1 4 ASP OD2 O -3.008 -0.952 -0.946 1.00 . A A . 4 ASP OD2 1 1 18 4915 1 1 5 LEU C C -1.746 6.670 -2.267 1.00 . A A . 5 LEU C 1 1 18 4916 1 1 5 LEU CA C -1.276 5.681 -1.205 1.00 . A A . 5 LEU CA 1 1 18 4917 1 1 5 LEU CB C 0.121 6.066 -0.715 1.00 . A A . 5 LEU CB 1 1 18 4918 1 1 5 LEU CD1 C -0.213 6.262 1.761 1.00 . A A . 5 LEU CD1 1 1 18 4919 1 1 5 LEU CD2 C 1.561 7.615 0.630 1.00 . A A . 5 LEU CD2 1 1 18 4920 1 1 5 LEU CG C 0.174 7.004 0.491 1.00 . A A . 5 LEU CG 1 1 18 4921 1 1 5 LEU H H -0.415 3.900 -1.958 1.00 . A A . 5 LEU H 1 1 18 4922 1 1 5 LEU HA H -1.962 5.713 -0.372 1.00 . A A . 5 LEU HA 1 1 18 4923 1 1 5 LEU HB2 H 0.640 5.158 -0.451 1.00 . A A . 5 LEU HB2 1 1 18 4924 1 1 5 LEU HB3 H 0.636 6.549 -1.534 1.00 . A A . 5 LEU HB3 1 1 18 4925 1 1 5 LEU HD11 H -1.273 6.057 1.749 1.00 . A A . 5 LEU HD11 1 1 18 4926 1 1 5 LEU HD12 H 0.026 6.871 2.621 1.00 . A A . 5 LEU HD12 1 1 18 4927 1 1 5 LEU HD13 H 0.334 5.332 1.816 1.00 . A A . 5 LEU HD13 1 1 18 4928 1 1 5 LEU HD21 H 1.990 7.762 -0.350 1.00 . A A . 5 LEU HD21 1 1 18 4929 1 1 5 LEU HD22 H 2.191 6.951 1.204 1.00 . A A . 5 LEU HD22 1 1 18 4930 1 1 5 LEU HD23 H 1.485 8.567 1.137 1.00 . A A . 5 LEU HD23 1 1 18 4931 1 1 5 LEU HG H -0.534 7.808 0.346 1.00 . A A . 5 LEU HG 1 1 18 4932 1 1 5 LEU N N -1.271 4.319 -1.728 1.00 . A A . 5 LEU N 1 1 18 4933 1 1 5 LEU O O -2.299 7.723 -1.947 1.00 . A A . 5 LEU O 1 1 18 4934 1 1 6 ARG C C -3.419 7.485 -4.579 1.00 . A A . 6 ARG C 1 1 18 4935 1 1 6 ARG CA C -1.925 7.181 -4.639 1.00 . A A . 6 ARG CA 1 1 18 4936 1 1 6 ARG CB C -1.583 6.518 -5.975 1.00 . A A . 6 ARG CB 1 1 18 4937 1 1 6 ARG CD C 0.126 7.260 -7.661 1.00 . A A . 6 ARG CD 1 1 18 4938 1 1 6 ARG CG C -0.104 6.577 -6.322 1.00 . A A . 6 ARG CG 1 1 18 4939 1 1 6 ARG CZ C 1.807 8.694 -8.740 1.00 . A A . 6 ARG CZ 1 1 18 4940 1 1 6 ARG H H -1.078 5.472 -3.722 1.00 . A A . 6 ARG H 1 1 18 4941 1 1 6 ARG HA H -1.378 8.108 -4.557 1.00 . A A . 6 ARG HA 1 1 18 4942 1 1 6 ARG HB2 H -1.879 5.480 -5.934 1.00 . A A . 6 ARG HB2 1 1 18 4943 1 1 6 ARG HB3 H -2.135 7.011 -6.760 1.00 . A A . 6 ARG HB3 1 1 18 4944 1 1 6 ARG HD2 H 0.148 6.508 -8.435 1.00 . A A . 6 ARG HD2 1 1 18 4945 1 1 6 ARG HD3 H -0.689 7.944 -7.846 1.00 . A A . 6 ARG HD3 1 1 18 4946 1 1 6 ARG HE H 1.939 7.983 -6.881 1.00 . A A . 6 ARG HE 1 1 18 4947 1 1 6 ARG HG2 H 0.415 7.130 -5.554 1.00 . A A . 6 ARG HG2 1 1 18 4948 1 1 6 ARG HG3 H 0.285 5.571 -6.369 1.00 . A A . 6 ARG HG3 1 1 18 4949 1 1 6 ARG HH11 H 0.205 8.250 -9.888 1.00 . A A . 6 ARG HH11 1 1 18 4950 1 1 6 ARG HH12 H 1.398 9.260 -10.636 1.00 . A A . 6 ARG HH12 1 1 18 4951 1 1 6 ARG HH21 H 3.516 9.313 -7.855 1.00 . A A . 6 ARG HH21 1 1 18 4952 1 1 6 ARG HH22 H 3.281 9.863 -9.479 1.00 . A A . 6 ARG HH22 1 1 18 4953 1 1 6 ARG N N -1.524 6.324 -3.531 1.00 . A A . 6 ARG N 1 1 18 4954 1 1 6 ARG NE N 1.384 8.002 -7.688 1.00 . A A . 6 ARG NE 1 1 18 4955 1 1 6 ARG NH1 N 1.077 8.738 -9.846 1.00 . A A . 6 ARG NH1 1 1 18 4956 1 1 6 ARG NH2 N 2.963 9.343 -8.687 1.00 . A A . 6 ARG NH2 1 1 18 4957 1 1 6 ARG O O -3.862 8.559 -4.988 1.00 . A A . 6 ARG O 1 1 18 4958 1 1 7 HIS C C -5.986 7.627 -2.792 1.00 . A A . 7 HIS C 1 1 18 4959 1 1 7 HIS CA C -5.636 6.698 -3.951 1.00 . A A . 7 HIS CA 1 1 18 4960 1 1 7 HIS CB C -6.312 5.341 -3.753 1.00 . A A . 7 HIS CB 1 1 18 4961 1 1 7 HIS CD2 C -8.879 5.010 -3.928 1.00 . A A . 7 HIS CD2 1 1 18 4962 1 1 7 HIS CE1 C -9.079 5.205 -6.103 1.00 . A A . 7 HIS CE1 1 1 18 4963 1 1 7 HIS CG C -7.642 5.230 -4.433 1.00 . A A . 7 HIS CG 1 1 18 4964 1 1 7 HIS H H -3.779 5.699 -3.756 1.00 . A A . 7 HIS H 1 1 18 4965 1 1 7 HIS HA H -5.993 7.138 -4.869 1.00 . A A . 7 HIS HA 1 1 18 4966 1 1 7 HIS HB2 H -5.672 4.567 -4.150 1.00 . A A . 7 HIS HB2 1 1 18 4967 1 1 7 HIS HB3 H -6.463 5.171 -2.697 1.00 . A A . 7 HIS HB3 1 1 18 4968 1 1 7 HIS HD1 H -7.086 5.510 -6.446 1.00 . A A . 7 HIS HD1 1 1 18 4969 1 1 7 HIS HD2 H -9.131 4.870 -2.887 1.00 . A A . 7 HIS HD2 1 1 18 4970 1 1 7 HIS HE1 H -9.501 5.249 -7.096 1.00 . A A . 7 HIS HE1 1 1 18 4971 1 1 7 HIS N N -4.191 6.533 -4.065 1.00 . A A . 7 HIS N 1 1 18 4972 1 1 7 HIS ND1 N -7.802 5.346 -5.798 1.00 . A A . 7 HIS ND1 1 1 18 4973 1 1 7 HIS NE2 N -9.754 4.999 -4.986 1.00 . A A . 7 HIS NE2 1 1 18 4974 1 1 7 HIS O O -7.088 8.172 -2.732 1.00 . A A . 7 HIS O 1 1 18 4975 1 1 8 ALA C C -5.159 10.137 -1.109 1.00 . A A . 8 ALA C 1 1 18 4976 1 1 8 ALA CA C -5.250 8.666 -0.718 1.00 . A A . 8 ALA CA 1 1 18 4977 1 1 8 ALA CB C -4.237 8.344 0.371 1.00 . A A . 8 ALA CB 1 1 18 4978 1 1 8 ALA H H -4.183 7.341 -1.977 1.00 . A A . 8 ALA H 1 1 18 4979 1 1 8 ALA HA H -6.237 8.468 -0.327 1.00 . A A . 8 ALA HA 1 1 18 4980 1 1 8 ALA HB1 H -4.757 7.997 1.253 1.00 . A A . 8 ALA HB1 1 1 18 4981 1 1 8 ALA HB2 H -3.566 7.574 0.022 1.00 . A A . 8 ALA HB2 1 1 18 4982 1 1 8 ALA HB3 H -3.673 9.232 0.611 1.00 . A A . 8 ALA HB3 1 1 18 4983 1 1 8 ALA N N -5.041 7.802 -1.874 1.00 . A A . 8 ALA N 1 1 18 4984 1 1 8 ALA O O -5.699 11.006 -0.424 1.00 . A A . 8 ALA O 1 1 18 4985 1 1 9 PHE C C -5.651 12.366 -3.123 1.00 . A A . 9 PHE C 1 1 18 4986 1 1 9 PHE CA C -4.310 11.777 -2.695 1.00 . A A . 9 PHE CA 1 1 18 4987 1 1 9 PHE CB C -3.326 11.814 -3.866 1.00 . A A . 9 PHE CB 1 1 18 4988 1 1 9 PHE CD1 C -1.399 12.876 -2.660 1.00 . A A . 9 PHE CD1 1 1 18 4989 1 1 9 PHE CD2 C -2.165 13.885 -4.680 1.00 . A A . 9 PHE CD2 1 1 18 4990 1 1 9 PHE CE1 C -0.430 13.854 -2.534 1.00 . A A . 9 PHE CE1 1 1 18 4991 1 1 9 PHE CE2 C -1.199 14.866 -4.559 1.00 . A A . 9 PHE CE2 1 1 18 4992 1 1 9 PHE CG C -2.276 12.879 -3.733 1.00 . A A . 9 PHE CG 1 1 18 4993 1 1 9 PHE CZ C -0.331 14.851 -3.485 1.00 . A A . 9 PHE CZ 1 1 18 4994 1 1 9 PHE H H -4.065 9.674 -2.718 1.00 . A A . 9 PHE H 1 1 18 4995 1 1 9 PHE HA H -3.914 12.368 -1.884 1.00 . A A . 9 PHE HA 1 1 18 4996 1 1 9 PHE HB2 H -2.824 10.861 -3.936 1.00 . A A . 9 PHE HB2 1 1 18 4997 1 1 9 PHE HB3 H -3.872 11.997 -4.779 1.00 . A A . 9 PHE HB3 1 1 18 4998 1 1 9 PHE HD1 H -1.476 12.096 -1.915 1.00 . A A . 9 PHE HD1 1 1 18 4999 1 1 9 PHE HD2 H -2.844 13.898 -5.520 1.00 . A A . 9 PHE HD2 1 1 18 5000 1 1 9 PHE HE1 H 0.246 13.839 -1.693 1.00 . A A . 9 PHE HE1 1 1 18 5001 1 1 9 PHE HE2 H -1.124 15.644 -5.304 1.00 . A A . 9 PHE HE2 1 1 18 5002 1 1 9 PHE HZ H 0.425 15.616 -3.389 1.00 . A A . 9 PHE HZ 1 1 18 5003 1 1 9 PHE N N -4.473 10.410 -2.214 1.00 . A A . 9 PHE N 1 1 18 5004 1 1 9 PHE O O -5.843 13.582 -3.100 1.00 . A A . 9 PHE O 1 1 18 5005 1 1 10 ARG C C -8.745 12.369 -2.760 1.00 . A A . 10 ARG C 1 1 18 5006 1 1 10 ARG CA C -7.897 11.928 -3.950 1.00 . A A . 10 ARG CA 1 1 18 5007 1 1 10 ARG CB C -8.604 10.799 -4.703 1.00 . A A . 10 ARG CB 1 1 18 5008 1 1 10 ARG CD C -10.032 10.244 -6.696 1.00 . A A . 10 ARG CD 1 1 18 5009 1 1 10 ARG CG C -8.936 11.144 -6.146 1.00 . A A . 10 ARG CG 1 1 18 5010 1 1 10 ARG CZ C -11.867 10.370 -8.327 1.00 . A A . 10 ARG CZ 1 1 18 5011 1 1 10 ARG H H -6.363 10.538 -3.511 1.00 . A A . 10 ARG H 1 1 18 5012 1 1 10 ARG HA H -7.769 12.767 -4.617 1.00 . A A . 10 ARG HA 1 1 18 5013 1 1 10 ARG HB2 H -7.967 9.927 -4.702 1.00 . A A . 10 ARG HB2 1 1 18 5014 1 1 10 ARG HB3 H -9.525 10.563 -4.191 1.00 . A A . 10 ARG HB3 1 1 18 5015 1 1 10 ARG HD2 H -9.582 9.331 -7.057 1.00 . A A . 10 ARG HD2 1 1 18 5016 1 1 10 ARG HD3 H -10.723 10.013 -5.899 1.00 . A A . 10 ARG HD3 1 1 18 5017 1 1 10 ARG HE H -10.413 11.722 -8.141 1.00 . A A . 10 ARG HE 1 1 18 5018 1 1 10 ARG HG2 H -9.271 12.170 -6.193 1.00 . A A . 10 ARG HG2 1 1 18 5019 1 1 10 ARG HG3 H -8.048 11.025 -6.748 1.00 . A A . 10 ARG HG3 1 1 18 5020 1 1 10 ARG HH11 H -11.909 8.748 -7.124 1.00 . A A . 10 ARG HH11 1 1 18 5021 1 1 10 ARG HH12 H -13.197 8.850 -8.278 1.00 . A A . 10 ARG HH12 1 1 18 5022 1 1 10 ARG HH21 H -12.104 11.867 -9.665 1.00 . A A . 10 ARG HH21 1 1 18 5023 1 1 10 ARG HH22 H -13.307 10.624 -9.723 1.00 . A A . 10 ARG HH22 1 1 18 5024 1 1 10 ARG N N -6.575 11.495 -3.515 1.00 . A A . 10 ARG N 1 1 18 5025 1 1 10 ARG NE N -10.763 10.878 -7.790 1.00 . A A . 10 ARG NE 1 1 18 5026 1 1 10 ARG NH1 N -12.365 9.229 -7.873 1.00 . A A . 10 ARG NH1 1 1 18 5027 1 1 10 ARG NH2 N -12.476 11.006 -9.320 1.00 . A A . 10 ARG NH2 1 1 18 5028 1 1 10 ARG O O -9.644 13.190 -2.933 1.00 . A A . 10 ARG O 1 1 18 5029 1 1 11 . C C -9.021 13.638 -0.055 1.00 . A A . 11 SEP C 1 1 18 5030 1 1 11 . CA C -9.204 12.173 -0.358 1.00 . A A . 11 SEP CA 1 1 18 5031 1 1 11 . CB C -8.824 11.206 0.802 1.00 . A A . 11 SEP CB 1 1 18 5032 1 1 11 . H H -7.692 11.150 -1.517 1.00 . A A . 11 SEP H 1 1 18 5033 1 1 11 . HA H -10.273 12.014 -0.593 1.00 . A A . 11 SEP HA 1 1 18 5034 1 1 11 . HB2 H -9.043 10.150 0.558 1.00 . A A . 11 SEP HB2 1 1 18 5035 1 1 11 . HB3 H -7.735 11.214 1.009 1.00 . A A . 11 SEP HB3 1 1 18 5036 1 1 11 . N N -8.443 11.820 -1.593 1.00 . A A . 11 SEP N 1 1 18 5037 1 1 11 . O O -9.929 14.340 0.388 1.00 . A A . 11 SEP O 1 1 18 5038 1 1 11 . O1P O -8.454 11.865 4.307 1.00 . A A . 11 SEP O1P 1 1 18 5039 1 1 11 . O2P O -10.532 10.519 4.117 1.00 . A A . 11 SEP O2P 1 1 18 5040 1 1 11 . O3P O -8.376 9.591 3.236 1.00 . A A . 11 SEP O3P 1 1 18 5041 1 1 11 . OG O -9.541 11.542 2.014 1.00 . A A . 11 SEP OG 1 1 18 5042 1 1 11 . P P -9.200 10.857 3.440 1.00 . A A . 11 SEP P 1 1 18 5043 1 1 12 MET C C -8.116 16.408 -1.107 1.00 . A A . 12 MET C 1 1 18 5044 1 1 12 MET CA C -7.456 15.502 -0.072 1.00 . A A . 12 MET CA 1 1 18 5045 1 1 12 MET CB C -5.938 15.687 -0.109 1.00 . A A . 12 MET CB 1 1 18 5046 1 1 12 MET CE C -3.984 17.005 3.315 1.00 . A A . 12 MET CE 1 1 18 5047 1 1 12 MET CG C -5.413 16.618 0.972 1.00 . A A . 12 MET CG 1 1 18 5048 1 1 12 MET H H -7.120 13.497 -0.660 1.00 . A A . 12 MET H 1 1 18 5049 1 1 12 MET HA H -7.819 15.772 0.909 1.00 . A A . 12 MET HA 1 1 18 5050 1 1 12 MET HB2 H -5.467 14.724 0.016 1.00 . A A . 12 MET HB2 1 1 18 5051 1 1 12 MET HB3 H -5.660 16.094 -1.070 1.00 . A A . 12 MET HB3 1 1 18 5052 1 1 12 MET HE1 H -4.343 17.980 3.021 1.00 . A A . 12 MET HE1 1 1 18 5053 1 1 12 MET HE2 H -4.603 16.617 4.110 1.00 . A A . 12 MET HE2 1 1 18 5054 1 1 12 MET HE3 H -2.964 17.085 3.660 1.00 . A A . 12 MET HE3 1 1 18 5055 1 1 12 MET HG2 H -5.066 17.529 0.507 1.00 . A A . 12 MET HG2 1 1 18 5056 1 1 12 MET HG3 H -6.219 16.848 1.652 1.00 . A A . 12 MET HG3 1 1 18 5057 1 1 12 MET N N -7.802 14.105 -0.307 1.00 . A A . 12 MET N 1 1 18 5058 1 1 12 MET O O -8.355 17.588 -0.851 1.00 . A A . 12 MET O 1 1 18 5059 1 1 12 MET SD S -4.053 15.896 1.910 1.00 . A A . 12 MET SD 1 1 18 5060 1 1 13 PHE C C -10.515 16.849 -3.050 1.00 . A A . 13 PHE C 1 1 18 5061 1 1 13 PHE CA C -9.038 16.606 -3.351 1.00 . A A . 13 PHE CA 1 1 18 5062 1 1 13 PHE CB C -8.893 15.863 -4.681 1.00 . A A . 13 PHE CB 1 1 18 5063 1 1 13 PHE CD1 C -6.469 16.380 -5.075 1.00 . A A . 13 PHE CD1 1 1 18 5064 1 1 13 PHE CD2 C -8.030 16.876 -6.808 1.00 . A A . 13 PHE CD2 1 1 18 5065 1 1 13 PHE CE1 C -5.439 16.860 -5.862 1.00 . A A . 13 PHE CE1 1 1 18 5066 1 1 13 PHE CE2 C -7.004 17.356 -7.600 1.00 . A A . 13 PHE CE2 1 1 18 5067 1 1 13 PHE CG C -7.775 16.384 -5.538 1.00 . A A . 13 PHE CG 1 1 18 5068 1 1 13 PHE CZ C -5.707 17.347 -7.127 1.00 . A A . 13 PHE CZ 1 1 18 5069 1 1 13 PHE H H -8.193 14.902 -2.420 1.00 . A A . 13 PHE H 1 1 18 5070 1 1 13 PHE HA H -8.536 17.558 -3.423 1.00 . A A . 13 PHE HA 1 1 18 5071 1 1 13 PHE HB2 H -8.700 14.819 -4.483 1.00 . A A . 13 PHE HB2 1 1 18 5072 1 1 13 PHE HB3 H -9.812 15.956 -5.239 1.00 . A A . 13 PHE HB3 1 1 18 5073 1 1 13 PHE HD1 H -6.258 15.999 -4.087 1.00 . A A . 13 PHE HD1 1 1 18 5074 1 1 13 PHE HD2 H -9.046 16.883 -7.180 1.00 . A A . 13 PHE HD2 1 1 18 5075 1 1 13 PHE HE1 H -4.426 16.851 -5.490 1.00 . A A . 13 PHE HE1 1 1 18 5076 1 1 13 PHE HE2 H -7.217 17.736 -8.588 1.00 . A A . 13 PHE HE2 1 1 18 5077 1 1 13 PHE HZ H -4.904 17.722 -7.743 1.00 . A A . 13 PHE HZ 1 1 18 5078 1 1 13 PHE N N -8.408 15.848 -2.276 1.00 . A A . 13 PHE N 1 1 18 5079 1 1 13 PHE O O -11.119 16.189 -2.205 1.00 . A A . 13 PHE O 1 1 18 5080 1 1 14 PRO C C -13.457 17.157 -4.227 1.00 . A A . 14 PRO C 1 1 18 5081 1 1 14 PRO CA C -12.521 18.176 -3.585 1.00 . A A . 14 PRO CA 1 1 18 5082 1 1 14 PRO CB C -12.637 19.528 -4.293 1.00 . A A . 14 PRO CB 1 1 18 5083 1 1 14 PRO CD C -10.449 18.649 -4.781 1.00 . A A . 14 PRO CD 1 1 18 5084 1 1 14 PRO CG C -11.538 19.524 -5.299 1.00 . A A . 14 PRO CG 1 1 18 5085 1 1 14 PRO HA H -12.777 18.290 -2.542 1.00 . A A . 14 PRO HA 1 1 18 5086 1 1 14 PRO HB2 H -13.606 19.608 -4.765 1.00 . A A . 14 PRO HB2 1 1 18 5087 1 1 14 PRO HB3 H -12.512 20.325 -3.576 1.00 . A A . 14 PRO HB3 1 1 18 5088 1 1 14 PRO HD2 H -10.044 18.035 -5.572 1.00 . A A . 14 PRO HD2 1 1 18 5089 1 1 14 PRO HD3 H -9.674 19.260 -4.341 1.00 . A A . 14 PRO HD3 1 1 18 5090 1 1 14 PRO HG2 H -11.905 19.146 -6.241 1.00 . A A . 14 PRO HG2 1 1 18 5091 1 1 14 PRO HG3 H -11.148 20.524 -5.421 1.00 . A A . 14 PRO HG3 1 1 18 5092 1 1 14 PRO N N -11.109 17.821 -3.758 1.00 . A A . 14 PRO N 1 1 18 5093 1 1 14 PRO O O -14.651 17.124 -3.930 1.00 . A A . 14 PRO O 1 1 18 5094 1 1 15 SER C C -14.122 14.209 -4.825 1.00 . A A . 15 SER C 1 1 18 5095 1 1 15 SER CA C -13.693 15.308 -5.792 1.00 . A A . 15 SER CA 1 1 18 5096 1 1 15 SER CB C -12.890 14.704 -6.946 1.00 . A A . 15 SER CB 1 1 18 5097 1 1 15 SER H H -11.949 16.402 -5.300 1.00 . A A . 15 SER H 1 1 18 5098 1 1 15 SER HA H -14.577 15.785 -6.191 1.00 . A A . 15 SER HA 1 1 18 5099 1 1 15 SER HB2 H -13.403 13.831 -7.319 1.00 . A A . 15 SER HB2 1 1 18 5100 1 1 15 SER HB3 H -12.797 15.433 -7.737 1.00 . A A . 15 SER HB3 1 1 18 5101 1 1 15 SER HG H -11.321 13.531 -6.988 1.00 . A A . 15 SER HG 1 1 18 5102 1 1 15 SER N N -12.906 16.326 -5.106 1.00 . A A . 15 SER N 1 1 18 5103 1 1 15 SER O O -15.137 13.545 -5.032 1.00 . A A . 15 SER O 1 1 18 5104 1 1 15 SER OG O -11.593 14.324 -6.519 1.00 . A A . 15 SER OG 1 1 18 5105 1 1 16 SER C C -14.806 13.425 -1.888 1.00 . A A . 16 SER C 1 1 18 5106 1 1 16 SER CA C -13.633 13.002 -2.768 1.00 . A A . 16 SER CA 1 1 18 5107 1 1 16 SER CB C -12.401 12.735 -1.902 1.00 . A A . 16 SER CB 1 1 18 5108 1 1 16 SER H H -12.542 14.584 -3.657 1.00 . A A . 16 SER H 1 1 18 5109 1 1 16 SER HA H -13.899 12.094 -3.290 1.00 . A A . 16 SER HA 1 1 18 5110 1 1 16 SER HB2 H -11.746 13.592 -1.939 1.00 . A A . 16 SER HB2 1 1 18 5111 1 1 16 SER HB3 H -12.712 12.564 -0.881 1.00 . A A . 16 SER HB3 1 1 18 5112 1 1 16 SER HG H -11.820 10.871 -1.747 1.00 . A A . 16 SER HG 1 1 18 5113 1 1 16 SER N N -13.339 14.023 -3.767 1.00 . A A . 16 SER N 1 1 18 5114 1 1 16 SER O O -15.557 12.586 -1.393 1.00 . A A . 16 SER O 1 1 18 5115 1 1 16 SER OG O -11.691 11.598 -2.360 1.00 . A A . 16 SER OG 1 1 18 5116 1 1 17 GLU C C -17.279 15.531 -1.722 1.00 . A A . 17 GLU C 1 1 18 5117 1 1 17 GLU CA C -16.035 15.267 -0.879 1.00 . A A . 17 GLU CA 1 1 18 5118 1 1 17 GLU CB C -15.590 16.559 -0.190 1.00 . A A . 17 GLU CB 1 1 18 5119 1 1 17 GLU CD C -14.578 17.411 1.962 1.00 . A A . 17 GLU CD 1 1 18 5120 1 1 17 GLU CG C -14.539 16.343 0.886 1.00 . A A . 17 GLU CG 1 1 18 5121 1 1 17 GLU H H -14.323 15.351 -2.122 1.00 . A A . 17 GLU H 1 1 18 5122 1 1 17 GLU HA H -16.274 14.532 -0.126 1.00 . A A . 17 GLU HA 1 1 18 5123 1 1 17 GLU HB2 H -15.183 17.228 -0.933 1.00 . A A . 17 GLU HB2 1 1 18 5124 1 1 17 GLU HB3 H -16.451 17.023 0.267 1.00 . A A . 17 GLU HB3 1 1 18 5125 1 1 17 GLU HG2 H -14.707 15.382 1.349 1.00 . A A . 17 GLU HG2 1 1 18 5126 1 1 17 GLU HG3 H -13.562 16.353 0.425 1.00 . A A . 17 GLU HG3 1 1 18 5127 1 1 17 GLU N N -14.954 14.732 -1.700 1.00 . A A . 17 GLU N 1 1 18 5128 1 1 17 GLU O O -17.237 15.453 -2.950 1.00 . A A . 17 GLU O 1 1 18 5129 1 1 17 GLU OE1 O -15.647 17.592 2.581 1.00 . A A . 17 GLU OE1 1 1 18 5130 1 1 17 GLU OE2 O -13.538 18.065 2.186 1.00 . A A . 17 GLU OE2 1 1 19 5131 1 1 1 ARG C C 2.829 2.003 -1.055 1.00 . A A . 1 ARG C 1 1 19 5132 1 1 1 ARG CA C 2.828 0.558 -0.565 1.00 . A A . 1 ARG CA 1 1 19 5133 1 1 1 ARG CB C 1.879 -0.282 -1.422 1.00 . A A . 1 ARG CB 1 1 19 5134 1 1 1 ARG CD C 1.757 -2.775 -1.718 1.00 . A A . 1 ARG CD 1 1 19 5135 1 1 1 ARG CG C 2.536 -1.508 -2.035 1.00 . A A . 1 ARG CG 1 1 19 5136 1 1 1 ARG CZ C 1.719 -5.139 -2.391 1.00 . A A . 1 ARG CZ 1 1 19 5137 1 1 1 ARG H1 H 1.624 0.939 1.133 1.00 . A A . 1 ARG H1 1 1 19 5138 1 1 1 ARG HA H 3.828 0.159 -0.655 1.00 . A A . 1 ARG HA 1 1 19 5139 1 1 1 ARG HB2 H 1.055 -0.613 -0.808 1.00 . A A . 1 ARG HB2 1 1 19 5140 1 1 1 ARG HB3 H 1.497 0.333 -2.223 1.00 . A A . 1 ARG HB3 1 1 19 5141 1 1 1 ARG HD2 H 1.858 -2.989 -0.664 1.00 . A A . 1 ARG HD2 1 1 19 5142 1 1 1 ARG HD3 H 0.717 -2.610 -1.954 1.00 . A A . 1 ARG HD3 1 1 19 5143 1 1 1 ARG HE H 2.993 -3.775 -3.093 1.00 . A A . 1 ARG HE 1 1 19 5144 1 1 1 ARG HG2 H 2.579 -1.384 -3.107 1.00 . A A . 1 ARG HG2 1 1 19 5145 1 1 1 ARG HG3 H 3.537 -1.603 -1.642 1.00 . A A . 1 ARG HG3 1 1 19 5146 1 1 1 ARG HH11 H 0.325 -4.622 -1.023 1.00 . A A . 1 ARG HH11 1 1 19 5147 1 1 1 ARG HH12 H 0.309 -6.286 -1.506 1.00 . A A . 1 ARG HH12 1 1 19 5148 1 1 1 ARG HH21 H 2.981 -5.963 -3.738 1.00 . A A . 1 ARG HH21 1 1 19 5149 1 1 1 ARG HH22 H 1.821 -7.048 -3.049 1.00 . A A . 1 ARG HH22 1 1 19 5150 1 1 1 ARG N N 2.441 0.485 0.838 1.00 . A A . 1 ARG N 1 1 19 5151 1 1 1 ARG NE N 2.241 -3.921 -2.482 1.00 . A A . 1 ARG NE 1 1 19 5152 1 1 1 ARG NH1 N 0.701 -5.368 -1.572 1.00 . A A . 1 ARG NH1 1 1 19 5153 1 1 1 ARG NH2 N 2.214 -6.132 -3.119 1.00 . A A . 1 ARG NH2 1 1 19 5154 1 1 1 ARG O O 2.206 2.875 -0.448 1.00 . A A . 1 ARG O 1 1 19 5155 1 1 2 SER C C 2.480 3.832 -3.715 1.00 . A A . 2 SER C 1 1 19 5156 1 1 2 SER CA C 3.616 3.589 -2.725 1.00 . A A . 2 SER CA 1 1 19 5157 1 1 2 SER CB C 4.964 3.786 -3.421 1.00 . A A . 2 SER CB 1 1 19 5158 1 1 2 SER H H 4.006 1.512 -2.595 1.00 . A A . 2 SER H 1 1 19 5159 1 1 2 SER HA H 3.531 4.299 -1.916 1.00 . A A . 2 SER HA 1 1 19 5160 1 1 2 SER HB2 H 4.830 3.710 -4.489 1.00 . A A . 2 SER HB2 1 1 19 5161 1 1 2 SER HB3 H 5.353 4.764 -3.175 1.00 . A A . 2 SER HB3 1 1 19 5162 1 1 2 SER HG H 6.789 3.105 -3.209 1.00 . A A . 2 SER HG 1 1 19 5163 1 1 2 SER N N 3.531 2.249 -2.156 1.00 . A A . 2 SER N 1 1 19 5164 1 1 2 SER O O 2.032 4.964 -3.898 1.00 . A A . 2 SER O 1 1 19 5165 1 1 2 SER OG O 5.900 2.805 -3.007 1.00 . A A . 2 SER OG 1 1 19 5166 1 1 3 LYS C C -0.411 3.008 -4.621 1.00 . A A . 3 LYS C 1 1 19 5167 1 1 3 LYS CA C 0.935 2.854 -5.322 1.00 . A A . 3 LYS CA 1 1 19 5168 1 1 3 LYS CB C 0.916 1.614 -6.218 1.00 . A A . 3 LYS CB 1 1 19 5169 1 1 3 LYS CD C 2.098 0.323 -8.020 1.00 . A A . 3 LYS CD 1 1 19 5170 1 1 3 LYS CE C 2.867 0.756 -9.259 1.00 . A A . 3 LYS CE 1 1 19 5171 1 1 3 LYS CG C 2.248 1.331 -6.892 1.00 . A A . 3 LYS CG 1 1 19 5172 1 1 3 LYS H H 2.417 1.884 -4.162 1.00 . A A . 3 LYS H 1 1 19 5173 1 1 3 LYS HA H 1.111 3.726 -5.932 1.00 . A A . 3 LYS HA 1 1 19 5174 1 1 3 LYS HB2 H 0.650 0.755 -5.618 1.00 . A A . 3 LYS HB2 1 1 19 5175 1 1 3 LYS HB3 H 0.169 1.751 -6.986 1.00 . A A . 3 LYS HB3 1 1 19 5176 1 1 3 LYS HD2 H 2.478 -0.632 -7.690 1.00 . A A . 3 LYS HD2 1 1 19 5177 1 1 3 LYS HD3 H 1.051 0.230 -8.271 1.00 . A A . 3 LYS HD3 1 1 19 5178 1 1 3 LYS HE2 H 2.327 1.557 -9.740 1.00 . A A . 3 LYS HE2 1 1 19 5179 1 1 3 LYS HE3 H 3.842 1.110 -8.956 1.00 . A A . 3 LYS HE3 1 1 19 5180 1 1 3 LYS HG2 H 2.639 2.252 -7.296 1.00 . A A . 3 LYS HG2 1 1 19 5181 1 1 3 LYS HG3 H 2.936 0.936 -6.158 1.00 . A A . 3 LYS HG3 1 1 19 5182 1 1 3 LYS HZ1 H 3.729 -1.048 -9.862 1.00 . A A . 3 LYS HZ1 1 1 19 5183 1 1 3 LYS HZ2 H 3.373 0.002 -11.140 1.00 . A A . 3 LYS HZ2 1 1 19 5184 1 1 3 LYS HZ3 H 2.129 -0.849 -10.373 1.00 . A A . 3 LYS HZ3 1 1 19 5185 1 1 3 LYS N N 2.019 2.761 -4.351 1.00 . A A . 3 LYS N 1 1 19 5186 1 1 3 LYS NZ N 3.036 -0.364 -10.226 1.00 . A A . 3 LYS NZ 1 1 19 5187 1 1 3 LYS O O -1.326 3.642 -5.146 1.00 . A A . 3 LYS O 1 1 19 5188 1 1 4 ASP C C -1.975 3.909 -2.116 1.00 . A A . 4 ASP C 1 1 19 5189 1 1 4 ASP CA C -1.758 2.500 -2.658 1.00 . A A . 4 ASP CA 1 1 19 5190 1 1 4 ASP CB C -1.722 1.496 -1.504 1.00 . A A . 4 ASP CB 1 1 19 5191 1 1 4 ASP CG C -2.717 0.367 -1.688 1.00 . A A . 4 ASP CG 1 1 19 5192 1 1 4 ASP H H 0.241 1.933 -3.066 1.00 . A A . 4 ASP H 1 1 19 5193 1 1 4 ASP HA H -2.577 2.250 -3.315 1.00 . A A . 4 ASP HA 1 1 19 5194 1 1 4 ASP HB2 H -0.732 1.070 -1.436 1.00 . A A . 4 ASP HB2 1 1 19 5195 1 1 4 ASP HB3 H -1.953 2.009 -0.582 1.00 . A A . 4 ASP HB3 1 1 19 5196 1 1 4 ASP N N -0.524 2.425 -3.432 1.00 . A A . 4 ASP N 1 1 19 5197 1 1 4 ASP O O -3.109 4.326 -1.878 1.00 . A A . 4 ASP O 1 1 19 5198 1 1 4 ASP OD1 O -3.879 0.653 -2.045 1.00 . A A . 4 ASP OD1 1 1 19 5199 1 1 4 ASP OD2 O -2.334 -0.802 -1.474 1.00 . A A . 4 ASP OD2 1 1 19 5200 1 1 5 LEU C C -1.436 6.966 -2.486 1.00 . A A . 5 LEU C 1 1 19 5201 1 1 5 LEU CA C -0.951 6.001 -1.408 1.00 . A A . 5 LEU CA 1 1 19 5202 1 1 5 LEU CB C 0.419 6.443 -0.891 1.00 . A A . 5 LEU CB 1 1 19 5203 1 1 5 LEU CD1 C 0.465 4.895 1.080 1.00 . A A . 5 LEU CD1 1 1 19 5204 1 1 5 LEU CD2 C 2.008 6.861 1.003 1.00 . A A . 5 LEU CD2 1 1 19 5205 1 1 5 LEU CG C 0.633 6.334 0.619 1.00 . A A . 5 LEU CG 1 1 19 5206 1 1 5 LEU H H -0.005 4.252 -2.131 1.00 . A A . 5 LEU H 1 1 19 5207 1 1 5 LEU HA H -1.656 6.010 -0.590 1.00 . A A . 5 LEU HA 1 1 19 5208 1 1 5 LEU HB2 H 1.167 5.835 -1.375 1.00 . A A . 5 LEU HB2 1 1 19 5209 1 1 5 LEU HB3 H 0.560 7.477 -1.172 1.00 . A A . 5 LEU HB3 1 1 19 5210 1 1 5 LEU HD11 H 0.469 4.239 0.222 1.00 . A A . 5 LEU HD11 1 1 19 5211 1 1 5 LEU HD12 H -0.473 4.792 1.607 1.00 . A A . 5 LEU HD12 1 1 19 5212 1 1 5 LEU HD13 H 1.278 4.630 1.740 1.00 . A A . 5 LEU HD13 1 1 19 5213 1 1 5 LEU HD21 H 2.216 7.762 0.444 1.00 . A A . 5 LEU HD21 1 1 19 5214 1 1 5 LEU HD22 H 2.755 6.115 0.776 1.00 . A A . 5 LEU HD22 1 1 19 5215 1 1 5 LEU HD23 H 2.027 7.080 2.061 1.00 . A A . 5 LEU HD23 1 1 19 5216 1 1 5 LEU HG H -0.110 6.935 1.126 1.00 . A A . 5 LEU HG 1 1 19 5217 1 1 5 LEU N N -0.881 4.638 -1.923 1.00 . A A . 5 LEU N 1 1 19 5218 1 1 5 LEU O O -2.036 7.998 -2.185 1.00 . A A . 5 LEU O 1 1 19 5219 1 1 6 ARG C C -3.089 7.703 -4.838 1.00 . A A . 6 ARG C 1 1 19 5220 1 1 6 ARG CA C -1.583 7.457 -4.865 1.00 . A A . 6 ARG CA 1 1 19 5221 1 1 6 ARG CB C -1.187 6.800 -6.188 1.00 . A A . 6 ARG CB 1 1 19 5222 1 1 6 ARG CD C 0.135 8.392 -7.615 1.00 . A A . 6 ARG CD 1 1 19 5223 1 1 6 ARG CG C -1.223 7.750 -7.374 1.00 . A A . 6 ARG CG 1 1 19 5224 1 1 6 ARG CZ C 0.590 8.017 -10.002 1.00 . A A . 6 ARG CZ 1 1 19 5225 1 1 6 ARG H H -0.691 5.787 -3.919 1.00 . A A . 6 ARG H 1 1 19 5226 1 1 6 ARG HA H -1.074 8.405 -4.777 1.00 . A A . 6 ARG HA 1 1 19 5227 1 1 6 ARG HB2 H -0.183 6.411 -6.097 1.00 . A A . 6 ARG HB2 1 1 19 5228 1 1 6 ARG HB3 H -1.864 5.984 -6.388 1.00 . A A . 6 ARG HB3 1 1 19 5229 1 1 6 ARG HD2 H -0.011 9.438 -7.841 1.00 . A A . 6 ARG HD2 1 1 19 5230 1 1 6 ARG HD3 H 0.727 8.297 -6.718 1.00 . A A . 6 ARG HD3 1 1 19 5231 1 1 6 ARG HE H 1.554 7.121 -8.503 1.00 . A A . 6 ARG HE 1 1 19 5232 1 1 6 ARG HG2 H -1.509 7.198 -8.257 1.00 . A A . 6 ARG HG2 1 1 19 5233 1 1 6 ARG HG3 H -1.949 8.525 -7.181 1.00 . A A . 6 ARG HG3 1 1 19 5234 1 1 6 ARG HH11 H -0.882 9.345 -9.616 1.00 . A A . 6 ARG HH11 1 1 19 5235 1 1 6 ARG HH12 H -0.551 9.072 -11.294 1.00 . A A . 6 ARG HH12 1 1 19 5236 1 1 6 ARG HH21 H 1.999 6.752 -10.710 1.00 . A A . 6 ARG HH21 1 1 19 5237 1 1 6 ARG HH22 H 1.088 7.596 -11.915 1.00 . A A . 6 ARG HH22 1 1 19 5238 1 1 6 ARG N N -1.173 6.622 -3.742 1.00 . A A . 6 ARG N 1 1 19 5239 1 1 6 ARG NE N 0.848 7.763 -8.724 1.00 . A A . 6 ARG NE 1 1 19 5240 1 1 6 ARG NH1 N -0.359 8.882 -10.331 1.00 . A A . 6 ARG NH1 1 1 19 5241 1 1 6 ARG NH2 N 1.283 7.405 -10.954 1.00 . A A . 6 ARG NH2 1 1 19 5242 1 1 6 ARG O O -3.564 8.756 -5.263 1.00 . A A . 6 ARG O 1 1 19 5243 1 1 7 HIS C C -5.697 7.755 -3.107 1.00 . A A . 7 HIS C 1 1 19 5244 1 1 7 HIS CA C -5.286 6.834 -4.252 1.00 . A A . 7 HIS CA 1 1 19 5245 1 1 7 HIS CB C -5.914 5.453 -4.061 1.00 . A A . 7 HIS CB 1 1 19 5246 1 1 7 HIS CD2 C -5.735 4.472 -6.455 1.00 . A A . 7 HIS CD2 1 1 19 5247 1 1 7 HIS CE1 C -4.631 2.641 -5.970 1.00 . A A . 7 HIS CE1 1 1 19 5248 1 1 7 HIS CG C -5.524 4.466 -5.118 1.00 . A A . 7 HIS CG 1 1 19 5249 1 1 7 HIS H H -3.398 5.909 -4.012 1.00 . A A . 7 HIS H 1 1 19 5250 1 1 7 HIS HA H -5.640 7.255 -5.181 1.00 . A A . 7 HIS HA 1 1 19 5251 1 1 7 HIS HB2 H -5.605 5.054 -3.106 1.00 . A A . 7 HIS HB2 1 1 19 5252 1 1 7 HIS HB3 H -6.990 5.548 -4.076 1.00 . A A . 7 HIS HB3 1 1 19 5253 1 1 7 HIS HD1 H -4.528 3.014 -3.961 1.00 . A A . 7 HIS HD1 1 1 19 5254 1 1 7 HIS HD2 H -6.252 5.235 -7.021 1.00 . A A . 7 HIS HD2 1 1 19 5255 1 1 7 HIS HE1 H -4.115 1.697 -6.063 1.00 . A A . 7 HIS HE1 1 1 19 5256 1 1 7 HIS N N -3.834 6.724 -4.335 1.00 . A A . 7 HIS N 1 1 19 5257 1 1 7 HIS ND1 N -4.830 3.306 -4.846 1.00 . A A . 7 HIS ND1 1 1 19 5258 1 1 7 HIS NE2 N -5.171 3.327 -6.961 1.00 . A A . 7 HIS NE2 1 1 19 5259 1 1 7 HIS O O -6.820 8.257 -3.074 1.00 . A A . 7 HIS O 1 1 19 5260 1 1 8 ALA C C -5.004 10.304 -1.423 1.00 . A A . 8 ALA C 1 1 19 5261 1 1 8 ALA CA C -5.047 8.833 -1.025 1.00 . A A . 8 ALA CA 1 1 19 5262 1 1 8 ALA CB C -4.046 8.556 0.088 1.00 . A A . 8 ALA CB 1 1 19 5263 1 1 8 ALA H H -3.903 7.543 -2.252 1.00 . A A . 8 ALA H 1 1 19 5264 1 1 8 ALA HA H -6.034 8.599 -0.654 1.00 . A A . 8 ALA HA 1 1 19 5265 1 1 8 ALA HB1 H -3.672 7.547 -0.009 1.00 . A A . 8 ALA HB1 1 1 19 5266 1 1 8 ALA HB2 H -3.225 9.253 0.015 1.00 . A A . 8 ALA HB2 1 1 19 5267 1 1 8 ALA HB3 H -4.532 8.670 1.045 1.00 . A A . 8 ALA HB3 1 1 19 5268 1 1 8 ALA N N -4.780 7.971 -2.170 1.00 . A A . 8 ALA N 1 1 19 5269 1 1 8 ALA O O -5.592 11.155 -0.755 1.00 . A A . 8 ALA O 1 1 19 5270 1 1 9 PHE C C -5.552 12.534 -3.371 1.00 . A A . 9 PHE C 1 1 19 5271 1 1 9 PHE CA C -4.185 11.967 -3.000 1.00 . A A . 9 PHE CA 1 1 19 5272 1 1 9 PHE CB C -3.252 12.021 -4.211 1.00 . A A . 9 PHE CB 1 1 19 5273 1 1 9 PHE CD1 C -1.090 12.506 -3.032 1.00 . A A . 9 PHE CD1 1 1 19 5274 1 1 9 PHE CD2 C -1.815 14.011 -4.734 1.00 . A A . 9 PHE CD2 1 1 19 5275 1 1 9 PHE CE1 C 0.037 13.279 -2.824 1.00 . A A . 9 PHE CE1 1 1 19 5276 1 1 9 PHE CE2 C -0.690 14.787 -4.531 1.00 . A A . 9 PHE CE2 1 1 19 5277 1 1 9 PHE CG C -2.028 12.863 -3.988 1.00 . A A . 9 PHE CG 1 1 19 5278 1 1 9 PHE CZ C 0.237 14.421 -3.574 1.00 . A A . 9 PHE CZ 1 1 19 5279 1 1 9 PHE H H -3.859 9.875 -3.004 1.00 . A A . 9 PHE H 1 1 19 5280 1 1 9 PHE HA H -3.764 12.564 -2.205 1.00 . A A . 9 PHE HA 1 1 19 5281 1 1 9 PHE HB2 H -2.926 11.020 -4.450 1.00 . A A . 9 PHE HB2 1 1 19 5282 1 1 9 PHE HB3 H -3.789 12.431 -5.053 1.00 . A A . 9 PHE HB3 1 1 19 5283 1 1 9 PHE HD1 H -1.246 11.613 -2.444 1.00 . A A . 9 PHE HD1 1 1 19 5284 1 1 9 PHE HD2 H -2.539 14.299 -5.482 1.00 . A A . 9 PHE HD2 1 1 19 5285 1 1 9 PHE HE1 H 0.759 12.990 -2.075 1.00 . A A . 9 PHE HE1 1 1 19 5286 1 1 9 PHE HE2 H -0.536 15.680 -5.119 1.00 . A A . 9 PHE HE2 1 1 19 5287 1 1 9 PHE HZ H 1.117 15.025 -3.414 1.00 . A A . 9 PHE HZ 1 1 19 5288 1 1 9 PHE N N -4.305 10.597 -2.514 1.00 . A A . 9 PHE N 1 1 19 5289 1 1 9 PHE O O -5.763 13.747 -3.336 1.00 . A A . 9 PHE O 1 1 19 5290 1 1 10 ARG C C -8.636 12.460 -2.879 1.00 . A A . 10 ARG C 1 1 19 5291 1 1 10 ARG CA C -7.822 12.060 -4.107 1.00 . A A . 10 ARG CA 1 1 19 5292 1 1 10 ARG CB C -8.532 10.931 -4.857 1.00 . A A . 10 ARG CB 1 1 19 5293 1 1 10 ARG CD C -8.951 11.724 -7.204 1.00 . A A . 10 ARG CD 1 1 19 5294 1 1 10 ARG CG C -8.118 10.814 -6.315 1.00 . A A . 10 ARG CG 1 1 19 5295 1 1 10 ARG CZ C -10.959 11.556 -8.613 1.00 . A A . 10 ARG CZ 1 1 19 5296 1 1 10 ARG H H -6.248 10.696 -3.736 1.00 . A A . 10 ARG H 1 1 19 5297 1 1 10 ARG HA H -7.736 12.915 -4.761 1.00 . A A . 10 ARG HA 1 1 19 5298 1 1 10 ARG HB2 H -8.310 9.994 -4.366 1.00 . A A . 10 ARG HB2 1 1 19 5299 1 1 10 ARG HB3 H -9.597 11.104 -4.820 1.00 . A A . 10 ARG HB3 1 1 19 5300 1 1 10 ARG HD2 H -9.449 12.454 -6.584 1.00 . A A . 10 ARG HD2 1 1 19 5301 1 1 10 ARG HD3 H -8.293 12.229 -7.896 1.00 . A A . 10 ARG HD3 1 1 19 5302 1 1 10 ARG HE H -9.875 10.004 -7.983 1.00 . A A . 10 ARG HE 1 1 19 5303 1 1 10 ARG HG2 H -7.079 11.091 -6.408 1.00 . A A . 10 ARG HG2 1 1 19 5304 1 1 10 ARG HG3 H -8.251 9.792 -6.635 1.00 . A A . 10 ARG HG3 1 1 19 5305 1 1 10 ARG HH11 H -10.435 13.438 -8.100 1.00 . A A . 10 ARG HH11 1 1 19 5306 1 1 10 ARG HH12 H -11.849 13.306 -9.093 1.00 . A A . 10 ARG HH12 1 1 19 5307 1 1 10 ARG HH21 H -11.735 9.817 -9.291 1.00 . A A . 10 ARG HH21 1 1 19 5308 1 1 10 ARG HH22 H -12.588 11.246 -9.769 1.00 . A A . 10 ARG HH22 1 1 19 5309 1 1 10 ARG N N -6.476 11.649 -3.727 1.00 . A A . 10 ARG N 1 1 19 5310 1 1 10 ARG NE N -9.955 10.980 -7.961 1.00 . A A . 10 ARG NE 1 1 19 5311 1 1 10 ARG NH1 N -11.092 12.875 -8.600 1.00 . A A . 10 ARG NH1 1 1 19 5312 1 1 10 ARG NH2 N -11.832 10.812 -9.279 1.00 . A A . 10 ARG NH2 1 1 19 5313 1 1 10 ARG O O -9.552 13.271 -3.002 1.00 . A A . 10 ARG O 1 1 19 5314 1 1 11 . C C -8.935 13.680 -0.196 1.00 . A A . 11 SEP C 1 1 19 5315 1 1 11 . CA C -9.012 12.200 -0.468 1.00 . A A . 11 SEP CA 1 1 19 5316 1 1 11 . CB C -8.495 11.288 0.684 1.00 . A A . 11 SEP CB 1 1 19 5317 1 1 11 . H H -7.524 11.227 -1.701 1.00 . A A . 11 SEP H 1 1 19 5318 1 1 11 . HA H -10.075 11.949 -0.646 1.00 . A A . 11 SEP HA 1 1 19 5319 1 1 11 . HB2 H -8.594 10.213 0.445 1.00 . A A . 11 SEP HB2 1 1 19 5320 1 1 11 . HB3 H -7.410 11.424 0.866 1.00 . A A . 11 SEP HB3 1 1 19 5321 1 1 11 . N N -8.288 11.887 -1.736 1.00 . A A . 11 SEP N 1 1 19 5322 1 1 11 . O O -9.875 14.312 0.286 1.00 . A A . 11 SEP O 1 1 19 5323 1 1 11 . O1P O -9.926 10.257 4.008 1.00 . A A . 11 SEP O1P 1 1 19 5324 1 1 11 . O2P O -7.662 9.893 3.055 1.00 . A A . 11 SEP O2P 1 1 19 5325 1 1 11 . O3P O -8.179 12.054 4.216 1.00 . A A . 11 SEP O3P 1 1 19 5326 1 1 11 . OG O -9.219 11.542 1.911 1.00 . A A . 11 SEP OG 1 1 19 5327 1 1 11 . P P -8.741 10.944 3.337 1.00 . A A . 11 SEP P 1 1 19 5328 1 1 12 MET C C -8.433 16.500 -1.229 1.00 . A A . 12 MET C 1 1 19 5329 1 1 12 MET CA C -7.534 15.666 -0.321 1.00 . A A . 12 MET CA 1 1 19 5330 1 1 12 MET CB C -6.066 15.999 -0.591 1.00 . A A . 12 MET CB 1 1 19 5331 1 1 12 MET CE C -4.809 18.089 2.470 1.00 . A A . 12 MET CE 1 1 19 5332 1 1 12 MET CG C -5.647 17.364 -0.070 1.00 . A A . 12 MET CG 1 1 19 5333 1 1 12 MET H H -7.063 13.685 -0.900 1.00 . A A . 12 MET H 1 1 19 5334 1 1 12 MET HA H -7.764 15.900 0.708 1.00 . A A . 12 MET HA 1 1 19 5335 1 1 12 MET HB2 H -5.446 15.252 -0.118 1.00 . A A . 12 MET HB2 1 1 19 5336 1 1 12 MET HB3 H -5.894 15.976 -1.657 1.00 . A A . 12 MET HB3 1 1 19 5337 1 1 12 MET HE1 H -5.823 18.422 2.302 1.00 . A A . 12 MET HE1 1 1 19 5338 1 1 12 MET HE2 H -4.792 17.390 3.294 1.00 . A A . 12 MET HE2 1 1 19 5339 1 1 12 MET HE3 H -4.184 18.938 2.706 1.00 . A A . 12 MET HE3 1 1 19 5340 1 1 12 MET HG2 H -5.426 18.004 -0.911 1.00 . A A . 12 MET HG2 1 1 19 5341 1 1 12 MET HG3 H -6.466 17.785 0.494 1.00 . A A . 12 MET HG3 1 1 19 5342 1 1 12 MET N N -7.775 14.241 -0.519 1.00 . A A . 12 MET N 1 1 19 5343 1 1 12 MET O O -8.748 17.649 -0.920 1.00 . A A . 12 MET O 1 1 19 5344 1 1 12 MET SD S -4.192 17.286 0.993 1.00 . A A . 12 MET SD 1 1 19 5345 1 1 13 PHE C C -11.153 16.594 -2.832 1.00 . A A . 13 PHE C 1 1 19 5346 1 1 13 PHE CA C -9.702 16.604 -3.303 1.00 . A A . 13 PHE CA 1 1 19 5347 1 1 13 PHE CB C -9.597 15.952 -4.683 1.00 . A A . 13 PHE CB 1 1 19 5348 1 1 13 PHE CD1 C -7.448 17.069 -5.338 1.00 . A A . 13 PHE CD1 1 1 19 5349 1 1 13 PHE CD2 C -9.268 17.124 -6.877 1.00 . A A . 13 PHE CD2 1 1 19 5350 1 1 13 PHE CE1 C -6.670 17.786 -6.227 1.00 . A A . 13 PHE CE1 1 1 19 5351 1 1 13 PHE CE2 C -8.495 17.841 -7.771 1.00 . A A . 13 PHE CE2 1 1 19 5352 1 1 13 PHE CG C -8.754 16.730 -5.652 1.00 . A A . 13 PHE CG 1 1 19 5353 1 1 13 PHE CZ C -7.194 18.172 -7.446 1.00 . A A . 13 PHE CZ 1 1 19 5354 1 1 13 PHE H H -8.556 14.996 -2.540 1.00 . A A . 13 PHE H 1 1 19 5355 1 1 13 PHE HA H -9.366 17.627 -3.371 1.00 . A A . 13 PHE HA 1 1 19 5356 1 1 13 PHE HB2 H -9.159 14.971 -4.577 1.00 . A A . 13 PHE HB2 1 1 19 5357 1 1 13 PHE HB3 H -10.586 15.856 -5.104 1.00 . A A . 13 PHE HB3 1 1 19 5358 1 1 13 PHE HD1 H -7.036 16.767 -4.386 1.00 . A A . 13 PHE HD1 1 1 19 5359 1 1 13 PHE HD2 H -10.286 16.865 -7.132 1.00 . A A . 13 PHE HD2 1 1 19 5360 1 1 13 PHE HE1 H -5.653 18.043 -5.971 1.00 . A A . 13 PHE HE1 1 1 19 5361 1 1 13 PHE HE2 H -8.909 18.141 -8.722 1.00 . A A . 13 PHE HE2 1 1 19 5362 1 1 13 PHE HZ H -6.589 18.732 -8.142 1.00 . A A . 13 PHE HZ 1 1 19 5363 1 1 13 PHE N N -8.841 15.914 -2.349 1.00 . A A . 13 PHE N 1 1 19 5364 1 1 13 PHE O O -11.546 15.809 -1.968 1.00 . A A . 13 PHE O 1 1 19 5365 1 1 14 PRO C C -14.224 16.474 -3.669 1.00 . A A . 14 PRO C 1 1 19 5366 1 1 14 PRO CA C -13.390 17.600 -3.068 1.00 . A A . 14 PRO CA 1 1 19 5367 1 1 14 PRO CB C -13.795 18.947 -3.673 1.00 . A A . 14 PRO CB 1 1 19 5368 1 1 14 PRO CD C -11.569 18.451 -4.449 1.00 . A A . 14 PRO CD 1 1 19 5369 1 1 14 PRO CG C -12.836 19.162 -4.793 1.00 . A A . 14 PRO CG 1 1 19 5370 1 1 14 PRO HA H -13.539 17.624 -1.998 1.00 . A A . 14 PRO HA 1 1 19 5371 1 1 14 PRO HB2 H -14.814 18.893 -4.028 1.00 . A A . 14 PRO HB2 1 1 19 5372 1 1 14 PRO HB3 H -13.708 19.721 -2.926 1.00 . A A . 14 PRO HB3 1 1 19 5373 1 1 14 PRO HD2 H -11.183 17.944 -5.320 1.00 . A A . 14 PRO HD2 1 1 19 5374 1 1 14 PRO HD3 H -10.841 19.150 -4.064 1.00 . A A . 14 PRO HD3 1 1 19 5375 1 1 14 PRO HG2 H -13.251 18.774 -5.711 1.00 . A A . 14 PRO HG2 1 1 19 5376 1 1 14 PRO HG3 H -12.620 20.215 -4.893 1.00 . A A . 14 PRO HG3 1 1 19 5377 1 1 14 PRO N N -11.970 17.486 -3.412 1.00 . A A . 14 PRO N 1 1 19 5378 1 1 14 PRO O O -15.356 16.233 -3.248 1.00 . A A . 14 PRO O 1 1 19 5379 1 1 15 SER C C -14.486 13.489 -4.384 1.00 . A A . 15 SER C 1 1 19 5380 1 1 15 SER CA C -14.352 14.687 -5.318 1.00 . A A . 15 SER CA 1 1 19 5381 1 1 15 SER CB C -13.606 14.277 -6.589 1.00 . A A . 15 SER CB 1 1 19 5382 1 1 15 SER H H -12.754 16.026 -4.948 1.00 . A A . 15 SER H 1 1 19 5383 1 1 15 SER HA H -15.340 15.032 -5.586 1.00 . A A . 15 SER HA 1 1 19 5384 1 1 15 SER HB2 H -13.071 13.357 -6.409 1.00 . A A . 15 SER HB2 1 1 19 5385 1 1 15 SER HB3 H -14.317 14.129 -7.389 1.00 . A A . 15 SER HB3 1 1 19 5386 1 1 15 SER HG H -12.163 14.958 -7.726 1.00 . A A . 15 SER HG 1 1 19 5387 1 1 15 SER N N -13.658 15.786 -4.656 1.00 . A A . 15 SER N 1 1 19 5388 1 1 15 SER O O -15.469 12.750 -4.441 1.00 . A A . 15 SER O 1 1 19 5389 1 1 15 SER OG O -12.679 15.275 -6.981 1.00 . A A . 15 SER OG 1 1 19 5390 1 1 16 SER C C -14.167 12.593 -1.271 1.00 . A A . 16 SER C 1 1 19 5391 1 1 16 SER CA C -13.492 12.191 -2.580 1.00 . A A . 16 SER CA 1 1 19 5392 1 1 16 SER CB C -12.062 11.723 -2.306 1.00 . A A . 16 SER CB 1 1 19 5393 1 1 16 SER H H -12.733 13.926 -3.527 1.00 . A A . 16 SER H 1 1 19 5394 1 1 16 SER HA H -14.050 11.380 -3.024 1.00 . A A . 16 SER HA 1 1 19 5395 1 1 16 SER HB2 H -11.473 12.557 -1.958 1.00 . A A . 16 SER HB2 1 1 19 5396 1 1 16 SER HB3 H -12.077 10.951 -1.550 1.00 . A A . 16 SER HB3 1 1 19 5397 1 1 16 SER HG H -11.477 10.241 -3.446 1.00 . A A . 16 SER HG 1 1 19 5398 1 1 16 SER N N -13.489 13.302 -3.524 1.00 . A A . 16 SER N 1 1 19 5399 1 1 16 SER O O -14.766 11.762 -0.590 1.00 . A A . 16 SER O 1 1 19 5400 1 1 16 SER OG O -11.464 11.200 -3.480 1.00 . A A . 16 SER OG 1 1 19 5401 1 1 17 GLU C C -16.129 14.741 0.081 1.00 . A A . 17 GLU C 1 1 19 5402 1 1 17 GLU CA C -14.661 14.385 0.300 1.00 . A A . 17 GLU CA 1 1 19 5403 1 1 17 GLU CB C -13.895 15.613 0.794 1.00 . A A . 17 GLU CB 1 1 19 5404 1 1 17 GLU CD C -13.542 16.467 3.145 1.00 . A A . 17 GLU CD 1 1 19 5405 1 1 17 GLU CG C -13.195 15.399 2.125 1.00 . A A . 17 GLU CG 1 1 19 5406 1 1 17 GLU H H -13.571 14.487 -1.512 1.00 . A A . 17 GLU H 1 1 19 5407 1 1 17 GLU HA H -14.599 13.609 1.048 1.00 . A A . 17 GLU HA 1 1 19 5408 1 1 17 GLU HB2 H -13.151 15.879 0.057 1.00 . A A . 17 GLU HB2 1 1 19 5409 1 1 17 GLU HB3 H -14.588 16.434 0.903 1.00 . A A . 17 GLU HB3 1 1 19 5410 1 1 17 GLU HG2 H -13.486 14.438 2.520 1.00 . A A . 17 GLU HG2 1 1 19 5411 1 1 17 GLU HG3 H -12.127 15.412 1.962 1.00 . A A . 17 GLU HG3 1 1 19 5412 1 1 17 GLU N N -14.063 13.873 -0.927 1.00 . A A . 17 GLU N 1 1 19 5413 1 1 17 GLU O O -17.012 13.899 0.239 1.00 . A A . 17 GLU O 1 1 19 5414 1 1 17 GLU OE1 O -14.732 16.576 3.509 1.00 . A A . 17 GLU OE1 1 1 19 5415 1 1 17 GLU OE2 O -12.623 17.193 3.579 1.00 . A A . 17 GLU OE2 1 1 20 5416 1 1 1 ARG C C 3.356 2.202 -2.884 1.00 . A A . 1 ARG C 1 1 20 5417 1 1 1 ARG CA C 3.818 0.790 -2.535 1.00 . A A . 1 ARG CA 1 1 20 5418 1 1 1 ARG CB C 2.657 -0.002 -1.930 1.00 . A A . 1 ARG CB 1 1 20 5419 1 1 1 ARG CD C 1.108 -0.333 0.021 1.00 . A A . 1 ARG CD 1 1 20 5420 1 1 1 ARG CG C 2.371 0.349 -0.479 1.00 . A A . 1 ARG CG 1 1 20 5421 1 1 1 ARG CZ C 1.195 -0.026 2.458 1.00 . A A . 1 ARG CZ 1 1 20 5422 1 1 1 ARG H1 H 5.648 0.148 -1.689 1.00 . A A . 1 ARG H1 1 1 20 5423 1 1 1 ARG HA H 4.145 0.298 -3.439 1.00 . A A . 1 ARG HA 1 1 20 5424 1 1 1 ARG HB2 H 1.765 0.192 -2.507 1.00 . A A . 1 ARG HB2 1 1 20 5425 1 1 1 ARG HB3 H 2.889 -1.055 -1.984 1.00 . A A . 1 ARG HB3 1 1 20 5426 1 1 1 ARG HD2 H 0.334 -0.219 -0.724 1.00 . A A . 1 ARG HD2 1 1 20 5427 1 1 1 ARG HD3 H 1.315 -1.383 0.166 1.00 . A A . 1 ARG HD3 1 1 20 5428 1 1 1 ARG HE H -0.127 0.846 1.246 1.00 . A A . 1 ARG HE 1 1 20 5429 1 1 1 ARG HG2 H 3.204 0.030 0.130 1.00 . A A . 1 ARG HG2 1 1 20 5430 1 1 1 ARG HG3 H 2.250 1.419 -0.395 1.00 . A A . 1 ARG HG3 1 1 20 5431 1 1 1 ARG HH11 H 2.601 -1.268 1.707 1.00 . A A . 1 ARG HH11 1 1 20 5432 1 1 1 ARG HH12 H 2.651 -1.042 3.424 1.00 . A A . 1 ARG HH12 1 1 20 5433 1 1 1 ARG HH21 H -0.071 1.151 3.506 1.00 . A A . 1 ARG HH21 1 1 20 5434 1 1 1 ARG HH22 H 1.131 0.333 4.446 1.00 . A A . 1 ARG HH22 1 1 20 5435 1 1 1 ARG N N 4.944 0.825 -1.610 1.00 . A A . 1 ARG N 1 1 20 5436 1 1 1 ARG NE N 0.639 0.237 1.281 1.00 . A A . 1 ARG NE 1 1 20 5437 1 1 1 ARG NH1 N 2.234 -0.847 2.536 1.00 . A A . 1 ARG NH1 1 1 20 5438 1 1 1 ARG NH2 N 0.712 0.532 3.561 1.00 . A A . 1 ARG NH2 1 1 20 5439 1 1 1 ARG O O 2.401 2.716 -2.302 1.00 . A A . 1 ARG O 1 1 20 5440 1 1 2 SER C C 2.487 4.174 -5.179 1.00 . A A . 2 SER C 1 1 20 5441 1 1 2 SER CA C 3.706 4.179 -4.261 1.00 . A A . 2 SER CA 1 1 20 5442 1 1 2 SER CB C 4.895 4.822 -4.977 1.00 . A A . 2 SER CB 1 1 20 5443 1 1 2 SER H H 4.794 2.362 -4.265 1.00 . A A . 2 SER H 1 1 20 5444 1 1 2 SER HA H 3.474 4.754 -3.378 1.00 . A A . 2 SER HA 1 1 20 5445 1 1 2 SER HB2 H 5.772 4.209 -4.836 1.00 . A A . 2 SER HB2 1 1 20 5446 1 1 2 SER HB3 H 4.677 4.900 -6.033 1.00 . A A . 2 SER HB3 1 1 20 5447 1 1 2 SER HG H 4.334 6.607 -4.398 1.00 . A A . 2 SER HG 1 1 20 5448 1 1 2 SER N N 4.042 2.824 -3.838 1.00 . A A . 2 SER N 1 1 20 5449 1 1 2 SER O O 1.748 5.156 -5.255 1.00 . A A . 2 SER O 1 1 20 5450 1 1 2 SER OG O 5.157 6.118 -4.468 1.00 . A A . 2 SER OG 1 1 20 5451 1 1 3 LYS C C -0.160 2.825 -6.017 1.00 . A A . 3 LYS C 1 1 20 5452 1 1 3 LYS CA C 1.153 2.925 -6.787 1.00 . A A . 3 LYS CA 1 1 20 5453 1 1 3 LYS CB C 1.333 1.690 -7.673 1.00 . A A . 3 LYS CB 1 1 20 5454 1 1 3 LYS CD C 0.051 -0.400 -7.129 1.00 . A A . 3 LYS CD 1 1 20 5455 1 1 3 LYS CE C 0.288 -1.614 -8.015 1.00 . A A . 3 LYS CE 1 1 20 5456 1 1 3 LYS CG C 1.333 0.382 -6.900 1.00 . A A . 3 LYS CG 1 1 20 5457 1 1 3 LYS H H 2.906 2.311 -5.771 1.00 . A A . 3 LYS H 1 1 20 5458 1 1 3 LYS HA H 1.124 3.805 -7.412 1.00 . A A . 3 LYS HA 1 1 20 5459 1 1 3 LYS HB2 H 0.529 1.658 -8.393 1.00 . A A . 3 LYS HB2 1 1 20 5460 1 1 3 LYS HB3 H 2.273 1.773 -8.199 1.00 . A A . 3 LYS HB3 1 1 20 5461 1 1 3 LYS HD2 H -0.332 -0.734 -6.176 1.00 . A A . 3 LYS HD2 1 1 20 5462 1 1 3 LYS HD3 H -0.675 0.245 -7.604 1.00 . A A . 3 LYS HD3 1 1 20 5463 1 1 3 LYS HE2 H 1.240 -2.052 -7.755 1.00 . A A . 3 LYS HE2 1 1 20 5464 1 1 3 LYS HE3 H -0.499 -2.332 -7.838 1.00 . A A . 3 LYS HE3 1 1 20 5465 1 1 3 LYS HG2 H 2.170 -0.217 -7.225 1.00 . A A . 3 LYS HG2 1 1 20 5466 1 1 3 LYS HG3 H 1.429 0.598 -5.846 1.00 . A A . 3 LYS HG3 1 1 20 5467 1 1 3 LYS HZ1 H -0.363 -0.470 -9.637 1.00 . A A . 3 LYS HZ1 1 1 20 5468 1 1 3 LYS HZ2 H 0.014 -2.071 -10.034 1.00 . A A . 3 LYS HZ2 1 1 20 5469 1 1 3 LYS HZ3 H 1.253 -0.957 -9.747 1.00 . A A . 3 LYS HZ3 1 1 20 5470 1 1 3 LYS N N 2.282 3.061 -5.875 1.00 . A A . 3 LYS N 1 1 20 5471 1 1 3 LYS NZ N 0.299 -1.252 -9.459 1.00 . A A . 3 LYS NZ 1 1 20 5472 1 1 3 LYS O O -1.207 3.258 -6.498 1.00 . A A . 3 LYS O 1 1 20 5473 1 1 4 ASP C C -1.595 3.396 -3.244 1.00 . A A . 4 ASP C 1 1 20 5474 1 1 4 ASP CA C -1.279 2.099 -3.982 1.00 . A A . 4 ASP CA 1 1 20 5475 1 1 4 ASP CB C -1.075 0.963 -2.979 1.00 . A A . 4 ASP CB 1 1 20 5476 1 1 4 ASP CG C -2.187 -0.066 -3.035 1.00 . A A . 4 ASP CG 1 1 20 5477 1 1 4 ASP H H 0.769 1.928 -4.491 1.00 . A A . 4 ASP H 1 1 20 5478 1 1 4 ASP HA H -2.111 1.854 -4.625 1.00 . A A . 4 ASP HA 1 1 20 5479 1 1 4 ASP HB2 H -0.140 0.466 -3.192 1.00 . A A . 4 ASP HB2 1 1 20 5480 1 1 4 ASP HB3 H -1.041 1.374 -1.981 1.00 . A A . 4 ASP HB3 1 1 20 5481 1 1 4 ASP N N -0.096 2.253 -4.820 1.00 . A A . 4 ASP N 1 1 20 5482 1 1 4 ASP O O -2.759 3.711 -2.990 1.00 . A A . 4 ASP O 1 1 20 5483 1 1 4 ASP OD1 O -3.325 0.268 -2.643 1.00 . A A . 4 ASP OD1 1 1 20 5484 1 1 4 ASP OD2 O -1.920 -1.206 -3.471 1.00 . A A . 4 ASP OD2 1 1 20 5485 1 1 5 LEU C C -1.224 6.497 -3.127 1.00 . A A . 5 LEU C 1 1 20 5486 1 1 5 LEU CA C -0.718 5.407 -2.189 1.00 . A A . 5 LEU CA 1 1 20 5487 1 1 5 LEU CB C 0.607 5.836 -1.557 1.00 . A A . 5 LEU CB 1 1 20 5488 1 1 5 LEU CD1 C 0.494 6.423 0.878 1.00 . A A . 5 LEU CD1 1 1 20 5489 1 1 5 LEU CD2 C 1.700 7.929 -0.714 1.00 . A A . 5 LEU CD2 1 1 20 5490 1 1 5 LEU CG C 0.527 6.975 -0.539 1.00 . A A . 5 LEU CG 1 1 20 5491 1 1 5 LEU H H 0.350 3.840 -3.129 1.00 . A A . 5 LEU H 1 1 20 5492 1 1 5 LEU HA H -1.447 5.254 -1.407 1.00 . A A . 5 LEU HA 1 1 20 5493 1 1 5 LEU HB2 H 1.030 4.977 -1.059 1.00 . A A . 5 LEU HB2 1 1 20 5494 1 1 5 LEU HB3 H 1.267 6.149 -2.354 1.00 . A A . 5 LEU HB3 1 1 20 5495 1 1 5 LEU HD11 H 0.274 5.367 0.847 1.00 . A A . 5 LEU HD11 1 1 20 5496 1 1 5 LEU HD12 H -0.271 6.933 1.445 1.00 . A A . 5 LEU HD12 1 1 20 5497 1 1 5 LEU HD13 H 1.454 6.579 1.348 1.00 . A A . 5 LEU HD13 1 1 20 5498 1 1 5 LEU HD21 H 1.629 8.723 0.015 1.00 . A A . 5 LEU HD21 1 1 20 5499 1 1 5 LEU HD22 H 1.676 8.349 -1.708 1.00 . A A . 5 LEU HD22 1 1 20 5500 1 1 5 LEU HD23 H 2.626 7.391 -0.573 1.00 . A A . 5 LEU HD23 1 1 20 5501 1 1 5 LEU HG H -0.385 7.531 -0.702 1.00 . A A . 5 LEU HG 1 1 20 5502 1 1 5 LEU N N -0.552 4.143 -2.900 1.00 . A A . 5 LEU N 1 1 20 5503 1 1 5 LEU O O -1.893 7.438 -2.698 1.00 . A A . 5 LEU O 1 1 20 5504 1 1 6 ARG C C -2.843 7.496 -5.405 1.00 . A A . 6 ARG C 1 1 20 5505 1 1 6 ARG CA C -1.326 7.337 -5.409 1.00 . A A . 6 ARG CA 1 1 20 5506 1 1 6 ARG CB C -0.850 6.912 -6.799 1.00 . A A . 6 ARG CB 1 1 20 5507 1 1 6 ARG CD C -0.837 7.677 -9.193 1.00 . A A . 6 ARG CD 1 1 20 5508 1 1 6 ARG CG C -0.610 8.078 -7.744 1.00 . A A . 6 ARG CG 1 1 20 5509 1 1 6 ARG CZ C -2.234 9.473 -10.125 1.00 . A A . 6 ARG CZ 1 1 20 5510 1 1 6 ARG H H -0.367 5.592 -4.691 1.00 . A A . 6 ARG H 1 1 20 5511 1 1 6 ARG HA H -0.876 8.286 -5.159 1.00 . A A . 6 ARG HA 1 1 20 5512 1 1 6 ARG HB2 H 0.074 6.363 -6.699 1.00 . A A . 6 ARG HB2 1 1 20 5513 1 1 6 ARG HB3 H -1.596 6.268 -7.240 1.00 . A A . 6 ARG HB3 1 1 20 5514 1 1 6 ARG HD2 H 0.035 7.149 -9.548 1.00 . A A . 6 ARG HD2 1 1 20 5515 1 1 6 ARG HD3 H -1.696 7.026 -9.242 1.00 . A A . 6 ARG HD3 1 1 20 5516 1 1 6 ARG HE H -0.323 9.153 -10.599 1.00 . A A . 6 ARG HE 1 1 20 5517 1 1 6 ARG HG2 H -1.290 8.879 -7.493 1.00 . A A . 6 ARG HG2 1 1 20 5518 1 1 6 ARG HG3 H 0.408 8.418 -7.629 1.00 . A A . 6 ARG HG3 1 1 20 5519 1 1 6 ARG HH11 H -3.165 8.279 -8.788 1.00 . A A . 6 ARG HH11 1 1 20 5520 1 1 6 ARG HH12 H -4.138 9.549 -9.452 1.00 . A A . 6 ARG HH12 1 1 20 5521 1 1 6 ARG HH21 H -1.594 10.829 -11.481 1.00 . A A . 6 ARG HH21 1 1 20 5522 1 1 6 ARG HH22 H -3.244 10.998 -10.985 1.00 . A A . 6 ARG HH22 1 1 20 5523 1 1 6 ARG N N -0.903 6.363 -4.410 1.00 . A A . 6 ARG N 1 1 20 5524 1 1 6 ARG NE N -1.071 8.836 -10.051 1.00 . A A . 6 ARG NE 1 1 20 5525 1 1 6 ARG NH1 N -3.264 9.066 -9.396 1.00 . A A . 6 ARG NH1 1 1 20 5526 1 1 6 ARG NH2 N -2.369 10.520 -10.930 1.00 . A A . 6 ARG NH2 1 1 20 5527 1 1 6 ARG O O -3.366 8.575 -5.686 1.00 . A A . 6 ARG O 1 1 20 5528 1 1 7 HIS C C -5.503 7.144 -3.792 1.00 . A A . 7 HIS C 1 1 20 5529 1 1 7 HIS CA C -5.003 6.432 -5.045 1.00 . A A . 7 HIS CA 1 1 20 5530 1 1 7 HIS CB C -5.554 5.007 -5.089 1.00 . A A . 7 HIS CB 1 1 20 5531 1 1 7 HIS CD2 C -6.911 4.748 -7.285 1.00 . A A . 7 HIS CD2 1 1 20 5532 1 1 7 HIS CE1 C -8.922 4.695 -6.414 1.00 . A A . 7 HIS CE1 1 1 20 5533 1 1 7 HIS CG C -6.777 4.863 -5.943 1.00 . A A . 7 HIS CG 1 1 20 5534 1 1 7 HIS H H -3.072 5.583 -4.872 1.00 . A A . 7 HIS H 1 1 20 5535 1 1 7 HIS HA H -5.352 6.971 -5.913 1.00 . A A . 7 HIS HA 1 1 20 5536 1 1 7 HIS HB2 H -4.796 4.347 -5.484 1.00 . A A . 7 HIS HB2 1 1 20 5537 1 1 7 HIS HB3 H -5.810 4.695 -4.087 1.00 . A A . 7 HIS HB3 1 1 20 5538 1 1 7 HIS HD1 H -8.291 4.889 -4.478 1.00 . A A . 7 HIS HD1 1 1 20 5539 1 1 7 HIS HD2 H -6.110 4.738 -8.011 1.00 . A A . 7 HIS HD2 1 1 20 5540 1 1 7 HIS HE1 H -9.996 4.638 -6.310 1.00 . A A . 7 HIS HE1 1 1 20 5541 1 1 7 HIS N N -3.546 6.413 -5.085 1.00 . A A . 7 HIS N 1 1 20 5542 1 1 7 HIS ND1 N -8.055 4.828 -5.427 1.00 . A A . 7 HIS ND1 1 1 20 5543 1 1 7 HIS NE2 N -8.254 4.644 -7.552 1.00 . A A . 7 HIS NE2 1 1 20 5544 1 1 7 HIS O O -6.654 7.575 -3.728 1.00 . A A . 7 HIS O 1 1 20 5545 1 1 8 ALA C C -5.013 9.440 -1.716 1.00 . A A . 8 ALA C 1 1 20 5546 1 1 8 ALA CA C -4.982 7.925 -1.546 1.00 . A A . 8 ALA CA 1 1 20 5547 1 1 8 ALA CB C -4.002 7.535 -0.449 1.00 . A A . 8 ALA CB 1 1 20 5548 1 1 8 ALA H H -3.727 6.900 -2.908 1.00 . A A . 8 ALA H 1 1 20 5549 1 1 8 ALA HA H -5.965 7.585 -1.255 1.00 . A A . 8 ALA HA 1 1 20 5550 1 1 8 ALA HB1 H -3.430 6.676 -0.768 1.00 . A A . 8 ALA HB1 1 1 20 5551 1 1 8 ALA HB2 H -3.335 8.360 -0.253 1.00 . A A . 8 ALA HB2 1 1 20 5552 1 1 8 ALA HB3 H -4.548 7.291 0.450 1.00 . A A . 8 ALA HB3 1 1 20 5553 1 1 8 ALA N N -4.630 7.264 -2.797 1.00 . A A . 8 ALA N 1 1 20 5554 1 1 8 ALA O O -5.670 10.147 -0.951 1.00 . A A . 8 ALA O 1 1 20 5555 1 1 9 PHE C C -5.625 11.904 -3.352 1.00 . A A . 9 PHE C 1 1 20 5556 1 1 9 PHE CA C -4.244 11.365 -2.991 1.00 . A A . 9 PHE CA 1 1 20 5557 1 1 9 PHE CB C -3.259 11.655 -4.125 1.00 . A A . 9 PHE CB 1 1 20 5558 1 1 9 PHE CD1 C -1.191 10.960 -2.886 1.00 . A A . 9 PHE CD1 1 1 20 5559 1 1 9 PHE CD2 C -1.201 13.083 -3.970 1.00 . A A . 9 PHE CD2 1 1 20 5560 1 1 9 PHE CE1 C 0.101 11.185 -2.448 1.00 . A A . 9 PHE CE1 1 1 20 5561 1 1 9 PHE CE2 C 0.090 13.314 -3.536 1.00 . A A . 9 PHE CE2 1 1 20 5562 1 1 9 PHE CG C -1.855 11.904 -3.651 1.00 . A A . 9 PHE CG 1 1 20 5563 1 1 9 PHE CZ C 0.742 12.365 -2.773 1.00 . A A . 9 PHE CZ 1 1 20 5564 1 1 9 PHE H H -3.796 9.319 -3.298 1.00 . A A . 9 PHE H 1 1 20 5565 1 1 9 PHE HA H -3.902 11.857 -2.094 1.00 . A A . 9 PHE HA 1 1 20 5566 1 1 9 PHE HB2 H -3.236 10.811 -4.798 1.00 . A A . 9 PHE HB2 1 1 20 5567 1 1 9 PHE HB3 H -3.589 12.531 -4.664 1.00 . A A . 9 PHE HB3 1 1 20 5568 1 1 9 PHE HD1 H -1.692 10.036 -2.631 1.00 . A A . 9 PHE HD1 1 1 20 5569 1 1 9 PHE HD2 H -1.710 13.827 -4.566 1.00 . A A . 9 PHE HD2 1 1 20 5570 1 1 9 PHE HE1 H 0.607 10.441 -1.852 1.00 . A A . 9 PHE HE1 1 1 20 5571 1 1 9 PHE HE2 H 0.589 14.238 -3.791 1.00 . A A . 9 PHE HE2 1 1 20 5572 1 1 9 PHE HZ H 1.751 12.543 -2.433 1.00 . A A . 9 PHE HZ 1 1 20 5573 1 1 9 PHE N N -4.299 9.933 -2.722 1.00 . A A . 9 PHE N 1 1 20 5574 1 1 9 PHE O O -5.916 13.083 -3.146 1.00 . A A . 9 PHE O 1 1 20 5575 1 1 10 ARG C C -8.686 11.692 -3.056 1.00 . A A . 10 ARG C 1 1 20 5576 1 1 10 ARG CA C -7.821 11.421 -4.283 1.00 . A A . 10 ARG CA 1 1 20 5577 1 1 10 ARG CB C -8.461 10.327 -5.140 1.00 . A A . 10 ARG CB 1 1 20 5578 1 1 10 ARG CD C -7.160 10.970 -7.191 1.00 . A A . 10 ARG CD 1 1 20 5579 1 1 10 ARG CG C -8.537 10.676 -6.617 1.00 . A A . 10 ARG CG 1 1 20 5580 1 1 10 ARG CZ C -7.510 12.689 -8.913 1.00 . A A . 10 ARG CZ 1 1 20 5581 1 1 10 ARG H H -6.181 10.107 -4.031 1.00 . A A . 10 ARG H 1 1 20 5582 1 1 10 ARG HA H -7.750 12.327 -4.866 1.00 . A A . 10 ARG HA 1 1 20 5583 1 1 10 ARG HB2 H -7.883 9.420 -5.036 1.00 . A A . 10 ARG HB2 1 1 20 5584 1 1 10 ARG HB3 H -9.464 10.147 -4.782 1.00 . A A . 10 ARG HB3 1 1 20 5585 1 1 10 ARG HD2 H -6.424 10.842 -6.412 1.00 . A A . 10 ARG HD2 1 1 20 5586 1 1 10 ARG HD3 H -6.962 10.271 -7.991 1.00 . A A . 10 ARG HD3 1 1 20 5587 1 1 10 ARG HE H -6.645 13.007 -7.144 1.00 . A A . 10 ARG HE 1 1 20 5588 1 1 10 ARG HG2 H -8.968 9.844 -7.153 1.00 . A A . 10 ARG HG2 1 1 20 5589 1 1 10 ARG HG3 H -9.162 11.548 -6.739 1.00 . A A . 10 ARG HG3 1 1 20 5590 1 1 10 ARG HH11 H -8.177 10.847 -9.404 1.00 . A A . 10 ARG HH11 1 1 20 5591 1 1 10 ARG HH12 H -8.418 12.068 -10.609 1.00 . A A . 10 ARG HH12 1 1 20 5592 1 1 10 ARG HH21 H -6.957 14.624 -8.723 1.00 . A A . 10 ARG HH21 1 1 20 5593 1 1 10 ARG HH22 H -7.722 14.216 -10.220 1.00 . A A . 10 ARG HH22 1 1 20 5594 1 1 10 ARG N N -6.471 11.033 -3.892 1.00 . A A . 10 ARG N 1 1 20 5595 1 1 10 ARG NE N -7.064 12.330 -7.715 1.00 . A A . 10 ARG NE 1 1 20 5596 1 1 10 ARG NH1 N -8.081 11.795 -9.707 1.00 . A A . 10 ARG NH1 1 1 20 5597 1 1 10 ARG NH2 N -7.386 13.947 -9.319 1.00 . A A . 10 ARG NH2 1 1 20 5598 1 1 10 ARG O O -9.631 12.474 -3.146 1.00 . A A . 10 ARG O 1 1 20 5599 1 1 11 . C C -8.960 12.649 -0.198 1.00 . A A . 11 SEP C 1 1 20 5600 1 1 11 . CA C -9.123 11.232 -0.685 1.00 . A A . 11 SEP CA 1 1 20 5601 1 1 11 . CB C -8.738 10.130 0.346 1.00 . A A . 11 SEP CB 1 1 20 5602 1 1 11 . H H -7.560 10.417 -1.939 1.00 . A A . 11 SEP H 1 1 20 5603 1 1 11 . HA H -10.188 11.092 -0.948 1.00 . A A . 11 SEP HA 1 1 20 5604 1 1 11 . HB2 H -9.324 9.203 0.208 1.00 . A A . 11 SEP HB2 1 1 20 5605 1 1 11 . HB3 H -7.685 9.803 0.231 1.00 . A A . 11 SEP HB3 1 1 20 5606 1 1 11 . N N -8.349 11.047 -1.948 1.00 . A A . 11 SEP N 1 1 20 5607 1 1 11 . O O -9.881 13.277 0.324 1.00 . A A . 11 SEP O 1 1 20 5608 1 1 11 . O1P O -9.811 9.802 3.977 1.00 . A A . 11 SEP O1P 1 1 20 5609 1 1 11 . O2P O -8.614 8.204 2.500 1.00 . A A . 11 SEP O2P 1 1 20 5610 1 1 11 . O3P O -7.331 10.035 3.634 1.00 . A A . 11 SEP O3P 1 1 20 5611 1 1 11 . OG O -8.947 10.593 1.702 1.00 . A A . 11 SEP OG 1 1 20 5612 1 1 11 . P P -8.658 9.656 2.989 1.00 . A A . 11 SEP P 1 1 20 5613 1 1 12 MET C C -8.168 15.540 -0.816 1.00 . A A . 12 MET C 1 1 20 5614 1 1 12 MET CA C -7.420 14.519 0.036 1.00 . A A . 12 MET CA 1 1 20 5615 1 1 12 MET CB C -5.913 14.758 -0.066 1.00 . A A . 12 MET CB 1 1 20 5616 1 1 12 MET CE C -2.506 14.860 1.700 1.00 . A A . 12 MET CE 1 1 20 5617 1 1 12 MET CG C -5.242 14.988 1.278 1.00 . A A . 12 MET CG 1 1 20 5618 1 1 12 MET H H -7.054 12.609 -0.800 1.00 . A A . 12 MET H 1 1 20 5619 1 1 12 MET HA H -7.725 14.634 1.065 1.00 . A A . 12 MET HA 1 1 20 5620 1 1 12 MET HB2 H -5.454 13.897 -0.530 1.00 . A A . 12 MET HB2 1 1 20 5621 1 1 12 MET HB3 H -5.738 15.626 -0.684 1.00 . A A . 12 MET HB3 1 1 20 5622 1 1 12 MET HE1 H -2.730 13.874 1.321 1.00 . A A . 12 MET HE1 1 1 20 5623 1 1 12 MET HE2 H -1.541 15.177 1.332 1.00 . A A . 12 MET HE2 1 1 20 5624 1 1 12 MET HE3 H -2.489 14.836 2.780 1.00 . A A . 12 MET HE3 1 1 20 5625 1 1 12 MET HG2 H -5.944 15.477 1.937 1.00 . A A . 12 MET HG2 1 1 20 5626 1 1 12 MET HG3 H -4.966 14.031 1.696 1.00 . A A . 12 MET HG3 1 1 20 5627 1 1 12 MET N N -7.747 13.159 -0.378 1.00 . A A . 12 MET N 1 1 20 5628 1 1 12 MET O O -8.416 16.664 -0.379 1.00 . A A . 12 MET O 1 1 20 5629 1 1 12 MET SD S -3.763 16.012 1.150 1.00 . A A . 12 MET SD 1 1 20 5630 1 1 13 PHE C C -10.669 16.260 -2.465 1.00 . A A . 13 PHE C 1 1 20 5631 1 1 13 PHE CA C -9.240 16.024 -2.946 1.00 . A A . 13 PHE CA 1 1 20 5632 1 1 13 PHE CB C -9.257 15.429 -4.356 1.00 . A A . 13 PHE CB 1 1 20 5633 1 1 13 PHE CD1 C -6.961 16.284 -4.900 1.00 . A A . 13 PHE CD1 1 1 20 5634 1 1 13 PHE CD2 C -8.662 16.470 -6.560 1.00 . A A . 13 PHE CD2 1 1 20 5635 1 1 13 PHE CE1 C -6.055 16.878 -5.758 1.00 . A A . 13 PHE CE1 1 1 20 5636 1 1 13 PHE CE2 C -7.760 17.064 -7.423 1.00 . A A . 13 PHE CE2 1 1 20 5637 1 1 13 PHE CG C -8.274 16.074 -5.291 1.00 . A A . 13 PHE CG 1 1 20 5638 1 1 13 PHE CZ C -6.455 17.267 -7.021 1.00 . A A . 13 PHE CZ 1 1 20 5639 1 1 13 PHE H H -8.296 14.234 -2.325 1.00 . A A . 13 PHE H 1 1 20 5640 1 1 13 PHE HA H -8.720 16.970 -2.970 1.00 . A A . 13 PHE HA 1 1 20 5641 1 1 13 PHE HB2 H -9.018 14.378 -4.298 1.00 . A A . 13 PHE HB2 1 1 20 5642 1 1 13 PHE HB3 H -10.244 15.548 -4.777 1.00 . A A . 13 PHE HB3 1 1 20 5643 1 1 13 PHE HD1 H -6.647 15.979 -3.912 1.00 . A A . 13 PHE HD1 1 1 20 5644 1 1 13 PHE HD2 H -9.684 16.311 -6.876 1.00 . A A . 13 PHE HD2 1 1 20 5645 1 1 13 PHE HE1 H -5.035 17.036 -5.441 1.00 . A A . 13 PHE HE1 1 1 20 5646 1 1 13 PHE HE2 H -8.076 17.367 -8.410 1.00 . A A . 13 PHE HE2 1 1 20 5647 1 1 13 PHE HZ H -5.749 17.732 -7.693 1.00 . A A . 13 PHE HZ 1 1 20 5648 1 1 13 PHE N N -8.522 15.143 -2.033 1.00 . A A . 13 PHE N 1 1 20 5649 1 1 13 PHE O O -11.201 15.522 -1.635 1.00 . A A . 13 PHE O 1 1 20 5650 1 1 14 PRO C C -13.707 16.738 -3.266 1.00 . A A . 14 PRO C 1 1 20 5651 1 1 14 PRO CA C -12.681 17.672 -2.636 1.00 . A A . 14 PRO CA 1 1 20 5652 1 1 14 PRO CB C -12.835 19.090 -3.193 1.00 . A A . 14 PRO CB 1 1 20 5653 1 1 14 PRO CD C -10.733 18.237 -3.990 1.00 . A A . 14 PRO CD 1 1 20 5654 1 1 14 PRO CG C -11.861 19.163 -4.317 1.00 . A A . 14 PRO CG 1 1 20 5655 1 1 14 PRO HA H -12.819 17.688 -1.565 1.00 . A A . 14 PRO HA 1 1 20 5656 1 1 14 PRO HB2 H -13.850 19.235 -3.537 1.00 . A A . 14 PRO HB2 1 1 20 5657 1 1 14 PRO HB3 H -12.604 19.810 -2.423 1.00 . A A . 14 PRO HB3 1 1 20 5658 1 1 14 PRO HD2 H -10.414 17.703 -4.874 1.00 . A A . 14 PRO HD2 1 1 20 5659 1 1 14 PRO HD3 H -9.910 18.795 -3.568 1.00 . A A . 14 PRO HD3 1 1 20 5660 1 1 14 PRO HG2 H -12.336 18.851 -5.235 1.00 . A A . 14 PRO HG2 1 1 20 5661 1 1 14 PRO HG3 H -11.485 20.171 -4.412 1.00 . A A . 14 PRO HG3 1 1 20 5662 1 1 14 PRO N N -11.306 17.314 -2.996 1.00 . A A . 14 PRO N 1 1 20 5663 1 1 14 PRO O O -14.868 16.709 -2.857 1.00 . A A . 14 PRO O 1 1 20 5664 1 1 15 SER C C -14.525 13.871 -4.043 1.00 . A A . 15 SER C 1 1 20 5665 1 1 15 SER CA C -14.155 15.040 -4.951 1.00 . A A . 15 SER CA 1 1 20 5666 1 1 15 SER CB C -13.487 14.519 -6.225 1.00 . A A . 15 SER CB 1 1 20 5667 1 1 15 SER H H -12.336 16.042 -4.543 1.00 . A A . 15 SER H 1 1 20 5668 1 1 15 SER HA H -15.056 15.571 -5.219 1.00 . A A . 15 SER HA 1 1 20 5669 1 1 15 SER HB2 H -12.450 14.302 -6.022 1.00 . A A . 15 SER HB2 1 1 20 5670 1 1 15 SER HB3 H -13.987 13.616 -6.547 1.00 . A A . 15 SER HB3 1 1 20 5671 1 1 15 SER HG H -12.876 15.295 -7.917 1.00 . A A . 15 SER HG 1 1 20 5672 1 1 15 SER N N -13.272 15.974 -4.263 1.00 . A A . 15 SER N 1 1 20 5673 1 1 15 SER O O -15.577 13.253 -4.205 1.00 . A A . 15 SER O 1 1 20 5674 1 1 15 SER OG O -13.558 15.477 -7.267 1.00 . A A . 15 SER OG 1 1 20 5675 1 1 16 SER C C -14.752 12.931 -0.986 1.00 . A A . 16 SER C 1 1 20 5676 1 1 16 SER CA C -13.882 12.477 -2.154 1.00 . A A . 16 SER CA 1 1 20 5677 1 1 16 SER CB C -12.550 11.935 -1.631 1.00 . A A . 16 SER CB 1 1 20 5678 1 1 16 SER H H -12.830 14.103 -3.008 1.00 . A A . 16 SER H 1 1 20 5679 1 1 16 SER HA H -14.396 11.691 -2.687 1.00 . A A . 16 SER HA 1 1 20 5680 1 1 16 SER HB2 H -12.580 10.856 -1.630 1.00 . A A . 16 SER HB2 1 1 20 5681 1 1 16 SER HB3 H -11.750 12.273 -2.274 1.00 . A A . 16 SER HB3 1 1 20 5682 1 1 16 SER HG H -12.043 13.312 -0.333 1.00 . A A . 16 SER HG 1 1 20 5683 1 1 16 SER N N -13.651 13.574 -3.087 1.00 . A A . 16 SER N 1 1 20 5684 1 1 16 SER O O -15.520 12.148 -0.430 1.00 . A A . 16 SER O 1 1 20 5685 1 1 16 SER OG O -12.298 12.387 -0.312 1.00 . A A . 16 SER OG 1 1 20 5686 1 1 17 GLU C C -16.787 15.190 0.009 1.00 . A A . 17 GLU C 1 1 20 5687 1 1 17 GLU CA C -15.400 14.762 0.481 1.00 . A A . 17 GLU CA 1 1 20 5688 1 1 17 GLU CB C -14.667 15.957 1.094 1.00 . A A . 17 GLU CB 1 1 20 5689 1 1 17 GLU CD C -14.546 17.453 3.126 1.00 . A A . 17 GLU CD 1 1 20 5690 1 1 17 GLU CG C -14.820 16.057 2.602 1.00 . A A . 17 GLU CG 1 1 20 5691 1 1 17 GLU H H -13.996 14.779 -1.104 1.00 . A A . 17 GLU H 1 1 20 5692 1 1 17 GLU HA H -15.509 13.995 1.232 1.00 . A A . 17 GLU HA 1 1 20 5693 1 1 17 GLU HB2 H -13.615 15.876 0.864 1.00 . A A . 17 GLU HB2 1 1 20 5694 1 1 17 GLU HB3 H -15.053 16.865 0.654 1.00 . A A . 17 GLU HB3 1 1 20 5695 1 1 17 GLU HG2 H -15.829 15.781 2.868 1.00 . A A . 17 GLU HG2 1 1 20 5696 1 1 17 GLU HG3 H -14.127 15.371 3.068 1.00 . A A . 17 GLU HG3 1 1 20 5697 1 1 17 GLU N N -14.625 14.204 -0.621 1.00 . A A . 17 GLU N 1 1 20 5698 1 1 17 GLU O O -17.599 15.674 0.797 1.00 . A A . 17 GLU O 1 1 20 5699 1 1 17 GLU OE1 O -15.166 18.410 2.618 1.00 . A A . 17 GLU OE1 1 1 20 5700 1 1 17 GLU OE2 O -13.710 17.588 4.044 1.00 . A A . 17 GLU OE2 1 1 stop_ save_
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