NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
626755 | 5xer | 36073 | cing | 4-filtered-FRED | STAR | entry | full | 95 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5xer # This FRED archive file contains, for PDB entry <5xer>: # # - 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_5xer _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5xer _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1098.29 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 $THR_VAL_TYR_VAL_TYR_SER_ARG_VAL_LYS A . 1 1 stop_ save_ save_THR_VAL_TYR_VAL_TYR_SER_ARG_VAL_LYS _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "THR VAL TYR VAL TYR SER ARG VAL LYS" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code TVYVYSRVK _Entity.Number_of_monomers 9 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 THR . 1 1 2 VAL . 1 1 3 TYR . 1 1 4 VAL . 1 1 5 TYR . 1 1 6 SER . 1 1 7 ARG . 1 1 8 VAL . 1 1 9 LYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID THR 1 1 1 1 VAL 2 2 1 1 TYR 3 3 1 1 VAL 4 4 1 1 TYR 5 5 1 1 SER 6 6 1 1 ARG 7 7 1 1 VAL 8 8 1 1 LYS 9 9 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 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 THR H1 . 1 THR H 1 1 1 1 2 1 1 1 THR HB . 1 THR HB 1 1 2 1 1 1 1 1 THR H1 . 1 THR H 1 1 2 1 2 1 1 1 THR MG . 1 THR QG2 1 1 3 1 1 1 1 1 THR H1 . 1 THR H 1 1 3 1 2 1 1 2 VAL H . 2 VAL H 1 1 4 1 1 1 1 1 THR H1 . 1 THR H 1 1 4 1 2 1 1 3 TYR H . 3 TYR H 1 1 5 1 1 1 1 1 THR HA . 1 THR HA 1 1 5 1 2 1 1 2 VAL H . 2 VAL H 1 1 6 1 1 1 1 1 THR MG . 1 THR QG2 1 1 6 1 2 1 1 2 VAL H . 2 VAL H 1 1 7 1 1 1 1 2 VAL H . 2 VAL H 1 1 7 1 2 1 1 2 VAL HB . 2 VAL HB 1 1 8 1 1 1 1 2 VAL H . 2 VAL H 1 1 8 1 2 1 1 2 VAL MG1 . 2 VAL QG1 1 1 9 1 1 1 1 2 VAL H . 2 VAL H 1 1 9 1 2 1 1 2 VAL MG2 . 2 VAL QG2 1 1 10 1 1 1 1 2 VAL H . 2 VAL H 1 1 10 1 2 1 1 3 TYR H . 3 TYR H 1 1 11 1 1 1 1 2 VAL HA . 2 VAL HA 1 1 11 1 2 1 1 3 TYR H . 3 TYR H 1 1 12 1 1 1 1 2 VAL HA . 2 VAL HA 1 1 12 1 2 1 1 4 VAL H . 4 VAL H 1 1 13 1 1 1 1 2 VAL HA . 2 VAL HA 1 1 13 1 2 1 1 5 TYR H . 5 TYR H 1 1 14 1 1 1 1 2 VAL HA . 2 VAL HA 1 1 14 1 2 1 1 6 SER H . 6 SER H 1 1 15 1 1 1 1 2 VAL HB . 2 VAL HB 1 1 15 1 2 1 1 3 TYR H . 3 TYR H 1 1 16 1 1 1 1 2 VAL HB . 2 VAL HB 1 1 16 1 2 1 1 6 SER H . 6 SER H 1 1 17 1 1 1 1 2 VAL MG1 . 2 VAL QG1 1 1 17 1 2 1 1 3 TYR H . 3 TYR H 1 1 18 1 1 1 1 2 VAL MG1 . 2 VAL QG1 1 1 18 1 2 1 1 5 TYR H . 5 TYR H 1 1 19 1 1 1 1 2 VAL MG1 . 2 VAL QG1 1 1 19 1 2 1 1 6 SER H . 6 SER H 1 1 20 1 1 1 1 2 VAL MG2 . 2 VAL QG2 1 1 20 1 2 1 1 3 TYR H . 3 TYR H 1 1 21 1 1 1 1 2 VAL MG2 . 2 VAL QG2 1 1 21 1 2 1 1 5 TYR H . 5 TYR H 1 1 22 1 1 1 1 3 TYR H . 3 TYR H 1 1 22 1 2 1 1 3 TYR QB . 3 TYR QB 1 1 23 1 1 1 1 3 TYR H . 3 TYR H 1 1 23 1 2 1 1 4 VAL H . 4 VAL H 1 1 24 1 1 1 1 3 TYR H . 3 TYR H 1 1 24 1 2 1 1 4 VAL MG1 . 4 VAL QG1 1 1 25 1 1 1 1 3 TYR H . 3 TYR H 1 1 25 1 2 1 1 4 VAL MG2 . 4 VAL QG2 1 1 26 1 1 1 1 3 TYR H . 3 TYR H 1 1 26 1 2 1 1 5 TYR H . 5 TYR H 1 1 27 1 1 1 1 3 TYR HA . 3 TYR HA 1 1 27 1 2 1 1 4 VAL H . 4 VAL H 1 1 28 1 1 1 1 3 TYR HA . 3 TYR HA 1 1 28 1 2 1 1 5 TYR H . 5 TYR H 1 1 29 1 1 1 1 3 TYR HA . 3 TYR HA 1 1 29 1 2 1 1 6 SER H . 6 SER H 1 1 30 1 1 1 1 3 TYR QB . 3 TYR QB 1 1 30 1 2 1 1 4 VAL H . 4 VAL H 1 1 31 1 1 1 1 3 TYR QB . 3 TYR QB 1 1 31 1 2 1 1 6 SER H . 6 SER H 1 1 32 1 1 1 1 3 TYR QD . 3 TYR QD 1 1 32 1 2 1 1 5 TYR QD . 5 TYR QD 1 1 33 1 1 1 1 4 VAL H . 4 VAL H 1 1 33 1 2 1 1 4 VAL HB . 4 VAL HB 1 1 34 1 1 1 1 4 VAL H . 4 VAL H 1 1 34 1 2 1 1 4 VAL MG1 . 4 VAL QG1 1 1 35 1 1 1 1 4 VAL H . 4 VAL H 1 1 35 1 2 1 1 4 VAL MG2 . 4 VAL QG2 1 1 36 1 1 1 1 4 VAL H . 4 VAL H 1 1 36 1 2 1 1 5 TYR H . 5 TYR H 1 1 37 1 1 1 1 4 VAL HA . 4 VAL HA 1 1 37 1 2 1 1 5 TYR H . 5 TYR H 1 1 38 1 1 1 1 4 VAL HA . 4 VAL HA 1 1 38 1 2 1 1 6 SER H . 6 SER H 1 1 39 1 1 1 1 4 VAL HA . 4 VAL HA 1 1 39 1 2 1 1 7 ARG H . 7 ARG H 1 1 40 1 1 1 1 4 VAL HB . 4 VAL HB 1 1 40 1 2 1 1 5 TYR H . 5 TYR H 1 1 41 1 1 1 1 4 VAL HB . 4 VAL HB 1 1 41 1 2 1 1 7 ARG H . 7 ARG H 1 1 42 1 1 1 1 4 VAL HB . 4 VAL HB 1 1 42 1 2 1 1 8 VAL H . 8 VAL H 1 1 43 1 1 1 1 4 VAL MG1 . 4 VAL QG1 1 1 43 1 2 1 1 5 TYR H . 5 TYR H 1 1 44 1 1 1 1 4 VAL MG1 . 4 VAL QG1 1 1 44 1 2 1 1 7 ARG H . 7 ARG H 1 1 45 1 1 1 1 4 VAL MG2 . 4 VAL QG2 1 1 45 1 2 1 1 5 TYR H . 5 TYR H 1 1 46 1 1 1 1 4 VAL MG2 . 4 VAL QG2 1 1 46 1 2 1 1 7 ARG H . 7 ARG H 1 1 47 1 1 1 1 5 TYR H . 5 TYR H 1 1 47 1 2 1 1 5 TYR QB . 5 TYR QB 1 1 48 1 1 1 1 5 TYR H . 5 TYR H 1 1 48 1 2 1 1 6 SER H . 6 SER H 1 1 49 1 1 1 1 5 TYR H . 5 TYR H 1 1 49 1 2 1 1 7 ARG H . 7 ARG H 1 1 50 1 1 1 1 5 TYR HA . 5 TYR HA 1 1 50 1 2 1 1 6 SER H . 6 SER H 1 1 51 1 1 1 1 5 TYR HA . 5 TYR HA 1 1 51 1 2 1 1 8 VAL H . 8 VAL H 1 1 52 1 1 1 1 5 TYR HA . 5 TYR HA 1 1 52 1 2 1 1 9 LYS H . 9 LYS H 1 1 53 1 1 1 1 5 TYR QB . 5 TYR QB 1 1 53 1 2 1 1 6 SER H . 6 SER H 1 1 54 1 1 1 1 6 SER H . 6 SER H 1 1 54 1 2 1 1 6 SER QB . 6 SER QB 1 1 55 1 1 1 1 6 SER H . 6 SER H 1 1 55 1 2 1 1 7 ARG H . 7 ARG H 1 1 56 1 1 1 1 6 SER HA . 6 SER HA 1 1 56 1 2 1 1 7 ARG H . 7 ARG H 1 1 57 1 1 1 1 6 SER HA . 6 SER HA 1 1 57 1 2 1 1 8 VAL H . 8 VAL H 1 1 58 1 1 1 1 6 SER HA . 6 SER HA 1 1 58 1 2 1 1 9 LYS H . 9 LYS H 1 1 59 1 1 1 1 6 SER QB . 6 SER QB 1 1 59 1 2 1 1 7 ARG H . 7 ARG H 1 1 60 1 1 1 1 7 ARG H . 7 ARG H 1 1 60 1 2 1 1 7 ARG QB . 7 ARG QB 1 1 61 1 1 1 1 7 ARG H . 7 ARG H 1 1 61 1 2 1 1 7 ARG QD . 7 ARG QD 1 1 62 1 1 1 1 7 ARG H . 7 ARG H 1 1 62 1 2 1 1 7 ARG QG . 7 ARG QG 1 1 63 1 1 1 1 7 ARG H . 7 ARG H 1 1 63 1 2 1 1 8 VAL H . 8 VAL H 1 1 64 1 1 1 1 7 ARG HA . 7 ARG HA 1 1 64 1 2 1 1 8 VAL H . 8 VAL H 1 1 65 1 1 1 1 7 ARG HA . 7 ARG HA 1 1 65 1 2 1 1 9 LYS H . 9 LYS H 1 1 66 1 1 1 1 7 ARG QB . 7 ARG QB 1 1 66 1 2 1 1 8 VAL H . 8 VAL H 1 1 67 1 1 1 1 7 ARG QD . 7 ARG QD 1 1 67 1 2 1 1 8 VAL H . 8 VAL H 1 1 68 1 1 1 1 7 ARG QG . 7 ARG QG 1 1 68 1 2 1 1 8 VAL H . 8 VAL H 1 1 69 1 1 1 1 8 VAL H . 8 VAL H 1 1 69 1 2 1 1 8 VAL HB . 8 VAL HB 1 1 70 1 1 1 1 8 VAL H . 8 VAL H 1 1 70 1 2 1 1 8 VAL MG1 . 8 VAL QG1 1 1 71 1 1 1 1 8 VAL H . 8 VAL H 1 1 71 1 2 1 1 8 VAL MG2 . 8 VAL QG2 1 1 72 1 1 1 1 8 VAL H . 8 VAL H 1 1 72 1 2 1 1 9 LYS H . 9 LYS H 1 1 73 1 1 1 1 8 VAL HA . 8 VAL HA 1 1 73 1 2 1 1 9 LYS H . 9 LYS H 1 1 74 1 1 1 1 8 VAL HB . 8 VAL HB 1 1 74 1 2 1 1 9 LYS H . 9 LYS H 1 1 75 1 1 1 1 8 VAL MG1 . 8 VAL QG1 1 1 75 1 2 1 1 9 LYS H . 9 LYS H 1 1 76 1 1 1 1 8 VAL MG2 . 8 VAL QG2 1 1 76 1 2 1 1 9 LYS H . 9 LYS H 1 1 77 1 1 1 1 9 LYS H . 9 LYS H 1 1 77 1 2 1 1 9 LYS QB . 9 LYS QB 1 1 78 1 1 1 1 9 LYS H . 9 LYS H 1 1 78 1 2 1 1 9 LYS QD . 9 LYS QD 1 1 79 1 1 1 1 9 LYS H . 9 LYS H 1 1 79 1 2 1 1 9 LYS QG . 9 LYS QG 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 . . . . . . . 3.2 1 1 2 1 . . . . . . . 3.8 1 1 3 1 . . . . . . . 2.8 1 1 4 1 . . . . . . . 4.2 1 1 5 1 . . . . . . . 3.2 1 1 6 1 . . . . . . . 4.5 1 1 7 1 . . . . . . . 3.0 1 1 8 1 . . . . . . . 3.6 1 1 9 1 . . . . . . . 3.6 1 1 10 1 . . . . . . . 2.8 1 1 11 1 . . . . . . . 3.2 1 1 12 1 . . . . . . . 3.8 1 1 13 1 . . . . . . . 3.1 1 1 14 1 . . . . . . . 3.8 1 1 15 1 . . . . . . . 3.0 1 1 16 1 . . . . . . . 4.6 1 1 17 1 . . . . . . . 3.7 1 1 18 1 . . . . . . . 4.6 1 1 19 1 . . . . . . . 3.4 1 1 20 1 . . . . . . . 3.7 1 1 21 1 . . . . . . . 4.6 1 1 22 1 . . . . . . . 3.0 1 1 23 1 . . . . . . . 2.8 1 1 24 1 . . . . . . . 5.1 1 1 25 1 . . . . . . . 5.1 1 1 26 1 . . . . . . . 4.0 1 1 27 1 . . . . . . . 3.4 1 1 28 1 . . . . . . . 4.5 1 1 29 1 . . . . . . . 3.7 1 1 30 1 . . . . . . . 3.3 1 1 31 1 . . . . . . . 5.1 1 1 32 1 . . . . . . . 4.9 1 1 33 1 . . . . . . . 3.5 1 1 34 1 . . . . . . . 3.6 1 1 35 1 . . . . . . . 3.6 1 1 36 1 . . . . . . . 2.8 1 1 37 1 . . . . . . . 3.5 1 1 38 1 . . . . . . . 4.1 1 1 39 1 . . . . . . . 3.3 1 1 40 1 . . . . . . . 3.4 1 1 41 1 . . . . . . . 4.8 1 1 42 1 . . . . . . . 4.4 1 1 43 1 . . . . . . . 4.1 1 1 44 1 . . . . . . . 4.7 1 1 45 1 . . . . . . . 4.1 1 1 46 1 . . . . . . . 4.7 1 1 47 1 . . . . . . . 3.4 1 1 48 1 . . . . . . . 2.8 1 1 49 1 . . . . . . . 4.0 1 1 50 1 . . . . . . . 3.3 1 1 51 1 . . . . . . . 3.5 1 1 52 1 . . . . . . . 3.7 1 1 53 1 . . . . . . . 3.0 1 1 54 1 . . . . . . . 3.0 1 1 55 1 . . . . . . . 2.8 1 1 56 1 . . . . . . . 3.4 1 1 57 1 . . . . . . . 4.4 1 1 58 1 . . . . . . . 3.5 1 1 59 1 . . . . . . . 3.0 1 1 60 1 . . . . . . . 3.0 1 1 61 1 . . . . . . . 4.3 1 1 62 1 . . . . . . . 3.4 1 1 63 1 . . . . . . . 2.8 1 1 64 1 . . . . . . . 3.4 1 1 65 1 . . . . . . . 4.0 1 1 66 1 . . . . . . . 3.0 1 1 67 1 . . . . . . . 4.0 1 1 68 1 . . . . . . . 3.4 1 1 69 1 . . . . . . . 3.0 1 1 70 1 . . . . . . . 3.6 1 1 71 1 . . . . . . . 3.6 1 1 72 1 . . . . . . . 2.8 1 1 73 1 . . . . . . . 3.4 1 1 74 1 . . . . . . . 3.0 1 1 75 1 . . . . . . . 3.8 1 1 76 1 . . . . . . . 3.8 1 1 77 1 . . . . . . . 3.0 1 1 78 1 . . . . . . . 3.8 1 1 79 1 . . . . . . . 3.6 1 1 stop_ save_ save_DYANA/DIANA_dihedral_3 _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 PSI 1 1 1 THR N 1 1 1 THR CA 1 1 1 THR C 1 1 2 VAL N -40.0 -20.0 . 1 THR . . 1 THR . . 1 THR . . 1 THR . 1 1 2 PHI 1 1 1 THR C 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C -80.0 -60.0 . 2 VAL . . 2 VAL . . 2 VAL . . 2 VAL . 1 1 3 PSI 1 1 2 VAL N 1 1 2 VAL CA 1 1 2 VAL C 1 1 3 TYR N -40.0 -20.0 . 2 VAL . . 2 VAL . . 2 VAL . . 2 VAL . 1 1 4 PHI 1 1 2 VAL C 1 1 3 TYR N 1 1 3 TYR CA 1 1 3 TYR C -80.0 -60.0 . 3 TYR . . 3 TYR . . 3 TYR . . 3 TYR . 1 1 5 PSI 1 1 3 TYR N 1 1 3 TYR CA 1 1 3 TYR C 1 1 4 VAL N -40.0 -20.0 . 3 TYR . . 3 TYR . . 3 TYR . . 3 TYR . 1 1 6 PHI 1 1 3 TYR C 1 1 4 VAL N 1 1 4 VAL CA 1 1 4 VAL C -80.0 -60.0 . 4 VAL . . 4 VAL . . 4 VAL . . 4 VAL . 1 1 7 PSI 1 1 4 VAL N 1 1 4 VAL CA 1 1 4 VAL C 1 1 5 TYR N -40.0 -20.0 . 4 VAL . . 4 VAL . . 4 VAL . . 4 VAL . 1 1 8 PHI 1 1 4 VAL C 1 1 5 TYR N 1 1 5 TYR CA 1 1 5 TYR C -80.0 -60.0 . 5 TYR . . 5 TYR . . 5 TYR . . 5 TYR . 1 1 9 PSI 1 1 5 TYR N 1 1 5 TYR CA 1 1 5 TYR C 1 1 6 SER N -40.0 -20.0 . 5 TYR . . 5 TYR . . 5 TYR . . 5 TYR . 1 1 10 PHI 1 1 5 TYR C 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C -80.0 -60.0 . 6 SER . . 6 SER . . 6 SER . . 6 SER . 1 1 11 PSI 1 1 6 SER N 1 1 6 SER CA 1 1 6 SER C 1 1 7 ARG N -40.0 -20.0 . 6 SER . . 6 SER . . 6 SER . . 6 SER . 1 1 12 PHI 1 1 6 SER C 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C -80.0 -60.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1 13 PSI 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C 1 1 8 VAL N -40.0 -20.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1 14 PHI 1 1 7 ARG C 1 1 8 VAL N 1 1 8 VAL CA 1 1 8 VAL C -80.0 -60.0 . 8 VAL . . 8 VAL . . 8 VAL . . 8 VAL . 1 1 15 PSI 1 1 8 VAL N 1 1 8 VAL CA 1 1 8 VAL C 1 1 9 LYS N -40.0 -20.0 . 8 VAL . . 8 VAL . . 8 VAL . . 8 VAL . 1 1 16 PHI 1 1 8 VAL C 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS C -80.0 -60.0 . 9 LYS . . 9 LYS . . 9 LYS . . 9 LYS . 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 THR C C 2.599 -1.399 -1.576 1.00 . A A . 1 THR C 1 1 1 2 1 1 1 THR CA C 2.094 0.000 -1.241 1.00 . A A . 1 THR CA 1 1 1 3 1 1 1 THR CB C 3.295 0.961 -1.161 1.00 . A A . 1 THR CB 1 1 1 4 1 1 1 THR CG2 C 3.574 1.592 -2.517 1.00 . A A . 1 THR CG2 1 1 1 5 1 1 1 THR H1 H 1.806 0.001 0.856 1.00 . A A . 1 THR H1 1 1 1 6 1 1 1 THR HA H 1.442 0.337 -2.034 1.00 . A A . 1 THR HA 1 1 1 7 1 1 1 THR HB H 4.166 0.400 -0.855 1.00 . A A . 1 THR HB 1 1 1 8 1 1 1 THR HG1 H 2.090 2.131 -0.126 1.00 . A A . 1 THR HG1 1 1 1 9 1 1 1 THR HG21 H 2.643 1.897 -2.971 1.00 . A A . 1 THR HG21 1 1 1 10 1 1 1 THR HG22 H 4.066 0.872 -3.154 1.00 . A A . 1 THR HG22 1 1 1 11 1 1 1 THR HG23 H 4.212 2.453 -2.388 1.00 . A A . 1 THR HG23 1 1 1 12 1 1 1 THR N N 1.329 0.000 0.000 1.00 . A A . 1 THR N 1 1 1 13 1 1 1 THR O O 3.324 -1.591 -2.552 1.00 . A A . 1 THR O 1 1 1 14 1 1 1 THR OG1 O 3.037 1.988 -0.196 1.00 . A A . 1 THR OG1 1 1 1 15 1 1 2 VAL C C 1.733 -4.444 -2.003 1.00 . A A . 2 VAL C 1 1 1 16 1 1 2 VAL CA C 2.622 -3.757 -0.972 1.00 . A A . 2 VAL CA 1 1 1 17 1 1 2 VAL CB C 2.582 -4.561 0.341 1.00 . A A . 2 VAL CB 1 1 1 18 1 1 2 VAL CG1 C 3.319 -5.882 0.181 1.00 . A A . 2 VAL CG1 1 1 1 19 1 1 2 VAL CG2 C 3.172 -3.747 1.483 1.00 . A A . 2 VAL CG2 1 1 1 20 1 1 2 VAL H H 1.631 -2.159 0.001 1.00 . A A . 2 VAL H 1 1 1 21 1 1 2 VAL HA H 3.639 -3.750 -1.335 1.00 . A A . 2 VAL HA 1 1 1 22 1 1 2 VAL HB H 1.550 -4.776 0.577 1.00 . A A . 2 VAL HB 1 1 1 23 1 1 2 VAL HG11 H 4.379 -5.693 0.089 1.00 . A A . 2 VAL HG11 1 1 1 24 1 1 2 VAL HG12 H 3.136 -6.504 1.045 1.00 . A A . 2 VAL HG12 1 1 1 25 1 1 2 VAL HG13 H 2.965 -6.386 -0.706 1.00 . A A . 2 VAL HG13 1 1 1 26 1 1 2 VAL HG21 H 4.197 -3.498 1.254 1.00 . A A . 2 VAL HG21 1 1 1 27 1 1 2 VAL HG22 H 2.601 -2.838 1.610 1.00 . A A . 2 VAL HG22 1 1 1 28 1 1 2 VAL HG23 H 3.135 -4.324 2.394 1.00 . A A . 2 VAL HG23 1 1 1 29 1 1 2 VAL N N 2.210 -2.374 -0.761 1.00 . A A . 2 VAL N 1 1 1 30 1 1 2 VAL O O 2.133 -5.429 -2.624 1.00 . A A . 2 VAL O 1 1 1 31 1 1 3 TYR C C 0.262 -4.778 -4.468 1.00 . A A . 3 TYR C 1 1 1 32 1 1 3 TYR CA C -0.420 -4.480 -3.136 1.00 . A A . 3 TYR CA 1 1 1 33 1 1 3 TYR CB C -1.590 -3.519 -3.353 1.00 . A A . 3 TYR CB 1 1 1 34 1 1 3 TYR CD1 C -1.740 -2.045 -5.397 1.00 . A A . 3 TYR CD1 1 1 1 35 1 1 3 TYR CD2 C -0.344 -1.337 -3.600 1.00 . A A . 3 TYR CD2 1 1 1 36 1 1 3 TYR CE1 C -1.402 -0.912 -6.112 1.00 . A A . 3 TYR CE1 1 1 1 37 1 1 3 TYR CE2 C -0.002 -0.201 -4.306 1.00 . A A . 3 TYR CE2 1 1 1 38 1 1 3 TYR CG C -1.218 -2.277 -4.130 1.00 . A A . 3 TYR CG 1 1 1 39 1 1 3 TYR CZ C -0.533 0.007 -5.562 1.00 . A A . 3 TYR CZ 1 1 1 40 1 1 3 TYR H H 0.266 -3.131 -1.656 1.00 . A A . 3 TYR H 1 1 1 41 1 1 3 TYR HA H -0.797 -5.404 -2.723 1.00 . A A . 3 TYR HA 1 1 1 42 1 1 3 TYR HB2 H -2.370 -4.029 -3.897 1.00 . A A . 3 TYR HB2 1 1 1 43 1 1 3 TYR HB3 H -1.974 -3.207 -2.392 1.00 . A A . 3 TYR HB3 1 1 1 44 1 1 3 TYR HD1 H -2.421 -2.766 -5.825 1.00 . A A . 3 TYR HD1 1 1 1 45 1 1 3 TYR HD2 H 0.071 -1.503 -2.616 1.00 . A A . 3 TYR HD2 1 1 1 46 1 1 3 TYR HE1 H -1.819 -0.748 -7.095 1.00 . A A . 3 TYR HE1 1 1 1 47 1 1 3 TYR HE2 H 0.679 0.519 -3.876 1.00 . A A . 3 TYR HE2 1 1 1 48 1 1 3 TYR HH H 0.242 1.762 -5.685 1.00 . A A . 3 TYR HH 1 1 1 49 1 1 3 TYR N N 0.527 -3.917 -2.181 1.00 . A A . 3 TYR N 1 1 1 50 1 1 3 TYR O O -0.018 -5.790 -5.109 1.00 . A A . 3 TYR O 1 1 1 51 1 1 3 TYR OH O -0.194 1.138 -6.270 1.00 . A A . 3 TYR OH 1 1 1 52 1 1 4 VAL C C 2.968 -5.118 -6.003 1.00 . A A . 4 VAL C 1 1 1 53 1 1 4 VAL CA C 1.884 -4.054 -6.132 1.00 . A A . 4 VAL CA 1 1 1 54 1 1 4 VAL CB C 2.530 -2.732 -6.587 1.00 . A A . 4 VAL CB 1 1 1 55 1 1 4 VAL CG1 C 1.506 -1.850 -7.286 1.00 . A A . 4 VAL CG1 1 1 1 56 1 1 4 VAL CG2 C 3.150 -2.006 -5.402 1.00 . A A . 4 VAL CG2 1 1 1 57 1 1 4 VAL H H 1.340 -3.100 -4.322 1.00 . A A . 4 VAL H 1 1 1 58 1 1 4 VAL HA H 1.177 -4.363 -6.887 1.00 . A A . 4 VAL HA 1 1 1 59 1 1 4 VAL HB H 3.315 -2.962 -7.292 1.00 . A A . 4 VAL HB 1 1 1 60 1 1 4 VAL HG11 H 0.522 -2.279 -7.167 1.00 . A A . 4 VAL HG11 1 1 1 61 1 1 4 VAL HG12 H 1.525 -0.862 -6.850 1.00 . A A . 4 VAL HG12 1 1 1 62 1 1 4 VAL HG13 H 1.746 -1.785 -8.337 1.00 . A A . 4 VAL HG13 1 1 1 63 1 1 4 VAL HG21 H 2.530 -1.164 -5.132 1.00 . A A . 4 VAL HG21 1 1 1 64 1 1 4 VAL HG22 H 3.222 -2.683 -4.562 1.00 . A A . 4 VAL HG22 1 1 1 65 1 1 4 VAL HG23 H 4.136 -1.658 -5.668 1.00 . A A . 4 VAL HG23 1 1 1 66 1 1 4 VAL N N 1.160 -3.887 -4.877 1.00 . A A . 4 VAL N 1 1 1 67 1 1 4 VAL O O 3.187 -5.910 -6.920 1.00 . A A . 4 VAL O 1 1 1 68 1 1 5 TYR C C 4.177 -7.525 -4.697 1.00 . A A . 5 TYR C 1 1 1 69 1 1 5 TYR CA C 4.708 -6.097 -4.611 1.00 . A A . 5 TYR CA 1 1 1 70 1 1 5 TYR CB C 5.334 -5.856 -3.237 1.00 . A A . 5 TYR CB 1 1 1 71 1 1 5 TYR CD1 C 5.784 -3.371 -3.271 1.00 . A A . 5 TYR CD1 1 1 1 72 1 1 5 TYR CD2 C 7.645 -4.849 -3.092 1.00 . A A . 5 TYR CD2 1 1 1 73 1 1 5 TYR CE1 C 6.636 -2.285 -3.237 1.00 . A A . 5 TYR CE1 1 1 1 74 1 1 5 TYR CE2 C 8.505 -3.768 -3.056 1.00 . A A . 5 TYR CE2 1 1 1 75 1 1 5 TYR CG C 6.272 -4.670 -3.199 1.00 . A A . 5 TYR CG 1 1 1 76 1 1 5 TYR CZ C 7.996 -2.489 -3.129 1.00 . A A . 5 TYR CZ 1 1 1 77 1 1 5 TYR H H 3.424 -4.474 -4.167 1.00 . A A . 5 TYR H 1 1 1 78 1 1 5 TYR HA H 5.464 -5.960 -5.370 1.00 . A A . 5 TYR HA 1 1 1 79 1 1 5 TYR HB2 H 4.550 -5.681 -2.517 1.00 . A A . 5 TYR HB2 1 1 1 80 1 1 5 TYR HB3 H 5.895 -6.732 -2.946 1.00 . A A . 5 TYR HB3 1 1 1 81 1 1 5 TYR HD1 H 4.718 -3.215 -3.356 1.00 . A A . 5 TYR HD1 1 1 1 82 1 1 5 TYR HD2 H 8.041 -5.853 -3.035 1.00 . A A . 5 TYR HD2 1 1 1 83 1 1 5 TYR HE1 H 6.238 -1.283 -3.294 1.00 . A A . 5 TYR HE1 1 1 1 84 1 1 5 TYR HE2 H 9.570 -3.928 -2.972 1.00 . A A . 5 TYR HE2 1 1 1 85 1 1 5 TYR HH H 8.442 -0.665 -3.543 1.00 . A A . 5 TYR HH 1 1 1 86 1 1 5 TYR N N 3.644 -5.131 -4.860 1.00 . A A . 5 TYR N 1 1 1 87 1 1 5 TYR O O 4.913 -8.454 -5.030 1.00 . A A . 5 TYR O 1 1 1 88 1 1 5 TYR OH O 8.850 -1.410 -3.095 1.00 . A A . 5 TYR OH 1 1 1 89 1 1 6 SER C C 1.678 -9.287 -5.815 1.00 . A A . 6 SER C 1 1 1 90 1 1 6 SER CA C 2.263 -9.006 -4.434 1.00 . A A . 6 SER CA 1 1 1 91 1 1 6 SER CB C 1.165 -9.101 -3.373 1.00 . A A . 6 SER CB 1 1 1 92 1 1 6 SER H H 2.359 -6.912 -4.136 1.00 . A A . 6 SER H 1 1 1 93 1 1 6 SER HA H 3.022 -9.744 -4.221 1.00 . A A . 6 SER HA 1 1 1 94 1 1 6 SER HB2 H 1.557 -8.773 -2.422 1.00 . A A . 6 SER HB2 1 1 1 95 1 1 6 SER HB3 H 0.337 -8.467 -3.659 1.00 . A A . 6 SER HB3 1 1 1 96 1 1 6 SER HG H 1.443 -11.021 -3.108 1.00 . A A . 6 SER HG 1 1 1 97 1 1 6 SER N N 2.894 -7.692 -4.395 1.00 . A A . 6 SER N 1 1 1 98 1 1 6 SER O O 1.578 -10.440 -6.235 1.00 . A A . 6 SER O 1 1 1 99 1 1 6 SER OG O 0.697 -10.432 -3.240 1.00 . A A . 6 SER OG 1 1 1 100 1 1 7 ARG C C 1.800 -8.646 -8.882 1.00 . A A . 7 ARG C 1 1 1 101 1 1 7 ARG CA C 0.717 -8.356 -7.847 1.00 . A A . 7 ARG CA 1 1 1 102 1 1 7 ARG CB C -0.038 -7.081 -8.227 1.00 . A A . 7 ARG CB 1 1 1 103 1 1 7 ARG CD C -0.381 -5.224 -9.886 1.00 . A A . 7 ARG CD 1 1 1 104 1 1 7 ARG CG C 0.382 -6.500 -9.567 1.00 . A A . 7 ARG CG 1 1 1 105 1 1 7 ARG CZ C -0.498 -5.229 -12.341 1.00 . A A . 7 ARG CZ 1 1 1 106 1 1 7 ARG H H 1.399 -7.332 -6.125 1.00 . A A . 7 ARG H 1 1 1 107 1 1 7 ARG HA H 0.023 -9.183 -7.829 1.00 . A A . 7 ARG HA 1 1 1 108 1 1 7 ARG HB2 H -1.095 -7.301 -8.271 1.00 . A A . 7 ARG HB2 1 1 1 109 1 1 7 ARG HB3 H 0.134 -6.335 -7.466 1.00 . A A . 7 ARG HB3 1 1 1 110 1 1 7 ARG HD2 H -1.095 -5.041 -9.096 1.00 . A A . 7 ARG HD2 1 1 1 111 1 1 7 ARG HD3 H 0.320 -4.404 -9.934 1.00 . A A . 7 ARG HD3 1 1 1 112 1 1 7 ARG HE H -2.064 -5.446 -11.125 1.00 . A A . 7 ARG HE 1 1 1 113 1 1 7 ARG HG2 H 1.438 -6.277 -9.537 1.00 . A A . 7 ARG HG2 1 1 1 114 1 1 7 ARG HG3 H 0.188 -7.228 -10.341 1.00 . A A . 7 ARG HG3 1 1 1 115 1 1 7 ARG HH11 H 1.357 -4.982 -11.579 1.00 . A A . 7 ARG HH11 1 1 1 116 1 1 7 ARG HH12 H 1.261 -4.988 -13.309 1.00 . A A . 7 ARG HH12 1 1 1 117 1 1 7 ARG HH21 H -2.203 -5.456 -13.402 1.00 . A A . 7 ARG HH21 1 1 1 118 1 1 7 ARG HH22 H -0.765 -5.256 -14.345 1.00 . A A . 7 ARG HH22 1 1 1 119 1 1 7 ARG N N 1.293 -8.225 -6.514 1.00 . A A . 7 ARG N 1 1 1 120 1 1 7 ARG NE N -1.093 -5.315 -11.157 1.00 . A A . 7 ARG NE 1 1 1 121 1 1 7 ARG NH1 N 0.814 -5.051 -12.416 1.00 . A A . 7 ARG NH1 1 1 1 122 1 1 7 ARG NH2 N -1.214 -5.321 -13.454 1.00 . A A . 7 ARG NH2 1 1 1 123 1 1 7 ARG O O 1.618 -9.478 -9.771 1.00 . A A . 7 ARG O 1 1 1 124 1 1 8 VAL C C 4.417 -9.608 -9.807 1.00 . A A . 8 VAL C 1 1 1 125 1 1 8 VAL CA C 4.041 -8.136 -9.685 1.00 . A A . 8 VAL CA 1 1 1 126 1 1 8 VAL CB C 5.279 -7.337 -9.237 1.00 . A A . 8 VAL CB 1 1 1 127 1 1 8 VAL CG1 C 6.457 -7.618 -10.157 1.00 . A A . 8 VAL CG1 1 1 1 128 1 1 8 VAL CG2 C 4.967 -5.849 -9.196 1.00 . A A . 8 VAL CG2 1 1 1 129 1 1 8 VAL H H 3.014 -7.303 -8.032 1.00 . A A . 8 VAL H 1 1 1 130 1 1 8 VAL HA H 3.734 -7.770 -10.654 1.00 . A A . 8 VAL HA 1 1 1 131 1 1 8 VAL HB H 5.546 -7.654 -8.240 1.00 . A A . 8 VAL HB 1 1 1 132 1 1 8 VAL HG11 H 7.028 -6.711 -10.297 1.00 . A A . 8 VAL HG11 1 1 1 133 1 1 8 VAL HG12 H 7.087 -8.376 -9.715 1.00 . A A . 8 VAL HG12 1 1 1 134 1 1 8 VAL HG13 H 6.093 -7.964 -11.113 1.00 . A A . 8 VAL HG13 1 1 1 135 1 1 8 VAL HG21 H 5.584 -5.332 -9.916 1.00 . A A . 8 VAL HG21 1 1 1 136 1 1 8 VAL HG22 H 3.925 -5.692 -9.438 1.00 . A A . 8 VAL HG22 1 1 1 137 1 1 8 VAL HG23 H 5.168 -5.465 -8.208 1.00 . A A . 8 VAL HG23 1 1 1 138 1 1 8 VAL N N 2.928 -7.953 -8.761 1.00 . A A . 8 VAL N 1 1 1 139 1 1 8 VAL O O 4.272 -10.211 -10.871 1.00 . A A . 8 VAL O 1 1 1 140 1 1 9 LYS C C 4.160 -12.478 -9.187 1.00 . A A . 9 LYS C 1 1 1 141 1 1 9 LYS CA C 5.296 -11.586 -8.694 1.00 . A A . 9 LYS CA 1 1 1 142 1 1 9 LYS CB C 5.709 -12.003 -7.281 1.00 . A A . 9 LYS CB 1 1 1 143 1 1 9 LYS CD C 7.327 -10.171 -6.702 1.00 . A A . 9 LYS CD 1 1 1 144 1 1 9 LYS CE C 8.302 -9.902 -5.566 1.00 . A A . 9 LYS CE 1 1 1 145 1 1 9 LYS CG C 7.150 -11.661 -6.943 1.00 . A A . 9 LYS CG 1 1 1 146 1 1 9 LYS H H 4.992 -9.650 -7.893 1.00 . A A . 9 LYS H 1 1 1 147 1 1 9 LYS HA H 6.141 -11.701 -9.356 1.00 . A A . 9 LYS HA 1 1 1 148 1 1 9 LYS HB2 H 5.067 -11.507 -6.569 1.00 . A A . 9 LYS HB2 1 1 1 149 1 1 9 LYS HB3 H 5.583 -13.072 -7.182 1.00 . A A . 9 LYS HB3 1 1 1 150 1 1 9 LYS HD2 H 7.706 -9.712 -7.602 1.00 . A A . 9 LYS HD2 1 1 1 151 1 1 9 LYS HD3 H 6.368 -9.739 -6.452 1.00 . A A . 9 LYS HD3 1 1 1 152 1 1 9 LYS HE2 H 8.818 -10.819 -5.327 1.00 . A A . 9 LYS HE2 1 1 1 153 1 1 9 LYS HE3 H 9.017 -9.161 -5.890 1.00 . A A . 9 LYS HE3 1 1 1 154 1 1 9 LYS HG2 H 7.438 -12.195 -6.050 1.00 . A A . 9 LYS HG2 1 1 1 155 1 1 9 LYS HG3 H 7.784 -11.961 -7.765 1.00 . A A . 9 LYS HG3 1 1 1 156 1 1 9 LYS HZ1 H 6.855 -8.739 -4.610 1.00 . A A . 9 LYS HZ1 1 1 1 157 1 1 9 LYS HZ2 H 8.284 -8.917 -3.724 1.00 . A A . 9 LYS HZ2 1 1 1 158 1 1 9 LYS HZ3 H 7.186 -10.200 -3.825 1.00 . A A . 9 LYS HZ3 1 1 1 159 1 1 9 LYS N N 4.900 -10.183 -8.711 1.00 . A A . 9 LYS N 1 1 1 160 1 1 9 LYS NZ N 7.608 -9.405 -4.345 1.00 . A A . 9 LYS NZ 1 1 1 161 1 1 9 LYS O O 4.397 -13.546 -9.752 1.00 . A A . 9 LYS O 1 1 2 162 1 1 1 THR C C 2.600 -1.472 -1.594 1.00 . A A . 1 THR C 1 1 2 163 1 1 1 THR CA C 2.014 -0.120 -1.204 1.00 . A A . 1 THR CA 1 1 2 164 1 1 1 THR CB C 3.159 0.899 -1.052 1.00 . A A . 1 THR CB 1 1 2 165 1 1 1 THR CG2 C 3.427 1.613 -2.368 1.00 . A A . 1 THR CG2 1 1 2 166 1 1 1 THR H1 H 1.686 -0.237 0.884 1.00 . A A . 1 THR H1 1 1 2 167 1 1 1 THR HA H 1.361 0.220 -1.994 1.00 . A A . 1 THR HA 1 1 2 168 1 1 1 THR HB H 4.055 0.369 -0.758 1.00 . A A . 1 THR HB 1 1 2 169 1 1 1 THR HG1 H 2.130 2.432 -0.360 1.00 . A A . 1 THR HG1 1 1 2 170 1 1 1 THR HG21 H 3.745 2.626 -2.170 1.00 . A A . 1 THR HG21 1 1 2 171 1 1 1 THR HG22 H 2.524 1.628 -2.959 1.00 . A A . 1 THR HG22 1 1 2 172 1 1 1 THR HG23 H 4.203 1.092 -2.908 1.00 . A A . 1 THR HG23 1 1 2 173 1 1 1 THR N N 1.227 -0.221 0.018 1.00 . A A . 1 THR N 1 1 2 174 1 1 1 THR O O 3.353 -1.578 -2.563 1.00 . A A . 1 THR O 1 1 2 175 1 1 1 THR OG1 O 2.831 1.858 -0.041 1.00 . A A . 1 THR OG1 1 1 2 176 1 1 2 VAL C C 1.910 -4.534 -2.184 1.00 . A A . 2 VAL C 1 1 2 177 1 1 2 VAL CA C 2.740 -3.852 -1.103 1.00 . A A . 2 VAL CA 1 1 2 178 1 1 2 VAL CB C 2.719 -4.720 0.169 1.00 . A A . 2 VAL CB 1 1 2 179 1 1 2 VAL CG1 C 3.531 -5.990 -0.037 1.00 . A A . 2 VAL CG1 1 1 2 180 1 1 2 VAL CG2 C 3.241 -3.932 1.361 1.00 . A A . 2 VAL CG2 1 1 2 181 1 1 2 VAL H H 1.647 -2.358 -0.076 1.00 . A A . 2 VAL H 1 1 2 182 1 1 2 VAL HA H 3.763 -3.774 -1.443 1.00 . A A . 2 VAL HA 1 1 2 183 1 1 2 VAL HB H 1.696 -5.002 0.371 1.00 . A A . 2 VAL HB 1 1 2 184 1 1 2 VAL HG11 H 3.226 -6.466 -0.957 1.00 . A A . 2 VAL HG11 1 1 2 185 1 1 2 VAL HG12 H 4.581 -5.742 -0.089 1.00 . A A . 2 VAL HG12 1 1 2 186 1 1 2 VAL HG13 H 3.361 -6.664 0.789 1.00 . A A . 2 VAL HG13 1 1 2 187 1 1 2 VAL HG21 H 3.221 -4.556 2.242 1.00 . A A . 2 VAL HG21 1 1 2 188 1 1 2 VAL HG22 H 4.256 -3.616 1.167 1.00 . A A . 2 VAL HG22 1 1 2 189 1 1 2 VAL HG23 H 2.619 -3.064 1.520 1.00 . A A . 2 VAL HG23 1 1 2 190 1 1 2 VAL N N 2.250 -2.505 -0.835 1.00 . A A . 2 VAL N 1 1 2 191 1 1 2 VAL O O 2.374 -5.465 -2.843 1.00 . A A . 2 VAL O 1 1 2 192 1 1 3 TYR C C 0.506 -4.826 -4.693 1.00 . A A . 3 TYR C 1 1 2 193 1 1 3 TYR CA C -0.216 -4.630 -3.363 1.00 . A A . 3 TYR CA 1 1 2 194 1 1 3 TYR CB C -1.433 -3.724 -3.559 1.00 . A A . 3 TYR CB 1 1 2 195 1 1 3 TYR CD1 C -0.303 -1.469 -3.674 1.00 . A A . 3 TYR CD1 1 1 2 196 1 1 3 TYR CD2 C -1.625 -2.160 -5.532 1.00 . A A . 3 TYR CD2 1 1 2 197 1 1 3 TYR CE1 C -0.009 -0.282 -4.318 1.00 . A A . 3 TYR CE1 1 1 2 198 1 1 3 TYR CE2 C -1.336 -0.977 -6.185 1.00 . A A . 3 TYR CE2 1 1 2 199 1 1 3 TYR CG C -1.114 -2.427 -4.268 1.00 . A A . 3 TYR CG 1 1 2 200 1 1 3 TYR CZ C -0.528 -0.041 -5.573 1.00 . A A . 3 TYR CZ 1 1 2 201 1 1 3 TYR H H 0.367 -3.320 -1.806 1.00 . A A . 3 TYR H 1 1 2 202 1 1 3 TYR HA H -0.551 -5.592 -3.003 1.00 . A A . 3 TYR HA 1 1 2 203 1 1 3 TYR HB2 H -2.173 -4.248 -4.143 1.00 . A A . 3 TYR HB2 1 1 2 204 1 1 3 TYR HB3 H -1.850 -3.480 -2.593 1.00 . A A . 3 TYR HB3 1 1 2 205 1 1 3 TYR HD1 H 0.102 -1.660 -2.691 1.00 . A A . 3 TYR HD1 1 1 2 206 1 1 3 TYR HD2 H -2.258 -2.895 -6.008 1.00 . A A . 3 TYR HD2 1 1 2 207 1 1 3 TYR HE1 H 0.624 0.451 -3.840 1.00 . A A . 3 TYR HE1 1 1 2 208 1 1 3 TYR HE2 H -1.742 -0.788 -7.167 1.00 . A A . 3 TYR HE2 1 1 2 209 1 1 3 TYR HH H 0.409 1.632 -5.709 1.00 . A A . 3 TYR HH 1 1 2 210 1 1 3 TYR N N 0.680 -4.064 -2.362 1.00 . A A . 3 TYR N 1 1 2 211 1 1 3 TYR O O 0.293 -5.819 -5.388 1.00 . A A . 3 TYR O 1 1 2 212 1 1 3 TYR OH O -0.238 1.139 -6.219 1.00 . A A . 3 TYR OH 1 1 2 213 1 1 4 VAL C C 3.255 -4.945 -6.185 1.00 . A A . 4 VAL C 1 1 2 214 1 1 4 VAL CA C 2.117 -3.936 -6.285 1.00 . A A . 4 VAL CA 1 1 2 215 1 1 4 VAL CB C 2.697 -2.560 -6.663 1.00 . A A . 4 VAL CB 1 1 2 216 1 1 4 VAL CG1 C 1.640 -1.702 -7.341 1.00 . A A . 4 VAL CG1 1 1 2 217 1 1 4 VAL CG2 C 3.255 -1.861 -5.433 1.00 . A A . 4 VAL CG2 1 1 2 218 1 1 4 VAL H H 1.488 -3.102 -4.445 1.00 . A A . 4 VAL H 1 1 2 219 1 1 4 VAL HA H 1.442 -4.246 -7.070 1.00 . A A . 4 VAL HA 1 1 2 220 1 1 4 VAL HB H 3.507 -2.713 -7.362 1.00 . A A . 4 VAL HB 1 1 2 221 1 1 4 VAL HG11 H 0.678 -2.188 -7.263 1.00 . A A . 4 VAL HG11 1 1 2 222 1 1 4 VAL HG12 H 1.596 -0.736 -6.859 1.00 . A A . 4 VAL HG12 1 1 2 223 1 1 4 VAL HG13 H 1.894 -1.574 -8.383 1.00 . A A . 4 VAL HG13 1 1 2 224 1 1 4 VAL HG21 H 3.348 -2.573 -4.627 1.00 . A A . 4 VAL HG21 1 1 2 225 1 1 4 VAL HG22 H 4.226 -1.447 -5.662 1.00 . A A . 4 VAL HG22 1 1 2 226 1 1 4 VAL HG23 H 2.587 -1.066 -5.136 1.00 . A A . 4 VAL HG23 1 1 2 227 1 1 4 VAL N N 1.361 -3.870 -5.040 1.00 . A A . 4 VAL N 1 1 2 228 1 1 4 VAL O O 3.535 -5.678 -7.133 1.00 . A A . 4 VAL O 1 1 2 229 1 1 5 TYR C C 4.570 -7.344 -4.970 1.00 . A A . 5 TYR C 1 1 2 230 1 1 5 TYR CA C 5.019 -5.895 -4.804 1.00 . A A . 5 TYR CA 1 1 2 231 1 1 5 TYR CB C 5.604 -5.688 -3.406 1.00 . A A . 5 TYR CB 1 1 2 232 1 1 5 TYR CD1 C 5.919 -3.185 -3.313 1.00 . A A . 5 TYR CD1 1 1 2 233 1 1 5 TYR CD2 C 7.854 -4.568 -3.157 1.00 . A A . 5 TYR CD2 1 1 2 234 1 1 5 TYR CE1 C 6.711 -2.058 -3.208 1.00 . A A . 5 TYR CE1 1 1 2 235 1 1 5 TYR CE2 C 8.653 -3.447 -3.050 1.00 . A A . 5 TYR CE2 1 1 2 236 1 1 5 TYR CG C 6.475 -4.458 -3.289 1.00 . A A . 5 TYR CG 1 1 2 237 1 1 5 TYR CZ C 8.077 -2.194 -3.076 1.00 . A A . 5 TYR CZ 1 1 2 238 1 1 5 TYR H H 3.640 -4.368 -4.310 1.00 . A A . 5 TYR H 1 1 2 239 1 1 5 TYR HA H 5.782 -5.680 -5.538 1.00 . A A . 5 TYR HA 1 1 2 240 1 1 5 TYR HB2 H 4.797 -5.591 -2.696 1.00 . A A . 5 TYR HB2 1 1 2 241 1 1 5 TYR HB3 H 6.205 -6.547 -3.144 1.00 . A A . 5 TYR HB3 1 1 2 242 1 1 5 TYR HD1 H 4.849 -3.081 -3.416 1.00 . A A . 5 TYR HD1 1 1 2 243 1 1 5 TYR HD2 H 8.302 -5.551 -3.138 1.00 . A A . 5 TYR HD2 1 1 2 244 1 1 5 TYR HE1 H 6.260 -1.076 -3.228 1.00 . A A . 5 TYR HE1 1 1 2 245 1 1 5 TYR HE2 H 9.723 -3.553 -2.947 1.00 . A A . 5 TYR HE2 1 1 2 246 1 1 5 TYR HH H 8.802 -0.557 -3.777 1.00 . A A . 5 TYR HH 1 1 2 247 1 1 5 TYR N N 3.909 -4.977 -5.029 1.00 . A A . 5 TYR N 1 1 2 248 1 1 5 TYR O O 5.363 -8.213 -5.332 1.00 . A A . 5 TYR O 1 1 2 249 1 1 5 TYR OH O 8.870 -1.074 -2.971 1.00 . A A . 5 TYR OH 1 1 2 250 1 1 6 SER C C 2.196 -9.181 -6.227 1.00 . A A . 6 SER C 1 1 2 251 1 1 6 SER CA C 2.737 -8.938 -4.821 1.00 . A A . 6 SER CA 1 1 2 252 1 1 6 SER CB C 1.624 -9.144 -3.792 1.00 . A A . 6 SER CB 1 1 2 253 1 1 6 SER H H 2.710 -6.859 -4.420 1.00 . A A . 6 SER H 1 1 2 254 1 1 6 SER HA H 3.531 -9.643 -4.626 1.00 . A A . 6 SER HA 1 1 2 255 1 1 6 SER HB2 H 1.333 -8.188 -3.384 1.00 . A A . 6 SER HB2 1 1 2 256 1 1 6 SER HB3 H 0.773 -9.604 -4.273 1.00 . A A . 6 SER HB3 1 1 2 257 1 1 6 SER HG H 1.332 -10.541 -2.450 1.00 . A A . 6 SER HG 1 1 2 258 1 1 6 SER N N 3.292 -7.595 -4.704 1.00 . A A . 6 SER N 1 1 2 259 1 1 6 SER O O 2.167 -10.316 -6.705 1.00 . A A . 6 SER O 1 1 2 260 1 1 6 SER OG O 2.058 -9.979 -2.732 1.00 . A A . 6 SER OG 1 1 2 261 1 1 7 ARG C C 2.345 -8.383 -9.257 1.00 . A A . 7 ARG C 1 1 2 262 1 1 7 ARG CA C 1.227 -8.204 -8.234 1.00 . A A . 7 ARG CA 1 1 2 263 1 1 7 ARG CB C 0.410 -6.955 -8.569 1.00 . A A . 7 ARG CB 1 1 2 264 1 1 7 ARG CD C 0.000 -5.039 -10.143 1.00 . A A . 7 ARG CD 1 1 2 265 1 1 7 ARG CG C 0.825 -6.287 -9.870 1.00 . A A . 7 ARG CG 1 1 2 266 1 1 7 ARG CZ C -1.789 -5.745 -11.674 1.00 . A A . 7 ARG CZ 1 1 2 267 1 1 7 ARG H H 1.817 -7.231 -6.450 1.00 . A A . 7 ARG H 1 1 2 268 1 1 7 ARG HA H 0.579 -9.067 -8.271 1.00 . A A . 7 ARG HA 1 1 2 269 1 1 7 ARG HB2 H -0.631 -7.230 -8.648 1.00 . A A . 7 ARG HB2 1 1 2 270 1 1 7 ARG HB3 H 0.526 -6.239 -7.769 1.00 . A A . 7 ARG HB3 1 1 2 271 1 1 7 ARG HD2 H -0.753 -4.946 -9.375 1.00 . A A . 7 ARG HD2 1 1 2 272 1 1 7 ARG HD3 H 0.653 -4.179 -10.112 1.00 . A A . 7 ARG HD3 1 1 2 273 1 1 7 ARG HE H -0.228 -4.615 -12.189 1.00 . A A . 7 ARG HE 1 1 2 274 1 1 7 ARG HG2 H 1.867 -6.009 -9.805 1.00 . A A . 7 ARG HG2 1 1 2 275 1 1 7 ARG HG3 H 0.687 -6.985 -10.682 1.00 . A A . 7 ARG HG3 1 1 2 276 1 1 7 ARG HH11 H -1.989 -6.399 -9.773 1.00 . A A . 7 ARG HH11 1 1 2 277 1 1 7 ARG HH12 H -3.244 -6.889 -10.862 1.00 . A A . 7 ARG HH12 1 1 2 278 1 1 7 ARG HH21 H -1.875 -5.254 -13.633 1.00 . A A . 7 ARG HH21 1 1 2 279 1 1 7 ARG HH22 H -3.178 -6.238 -13.058 1.00 . A A . 7 ARG HH22 1 1 2 280 1 1 7 ARG N N 1.768 -8.108 -6.884 1.00 . A A . 7 ARG N 1 1 2 281 1 1 7 ARG NE N -0.655 -5.091 -11.447 1.00 . A A . 7 ARG NE 1 1 2 282 1 1 7 ARG NH1 N -2.390 -6.398 -10.689 1.00 . A A . 7 ARG NH1 1 1 2 283 1 1 7 ARG NH2 N -2.325 -5.745 -12.888 1.00 . A A . 7 ARG NH2 1 1 2 284 1 1 7 ARG O O 2.227 -9.179 -10.189 1.00 . A A . 7 ARG O 1 1 2 285 1 1 8 VAL C C 5.029 -9.156 -10.167 1.00 . A A . 8 VAL C 1 1 2 286 1 1 8 VAL CA C 4.571 -7.714 -9.981 1.00 . A A . 8 VAL CA 1 1 2 287 1 1 8 VAL CB C 5.754 -6.873 -9.467 1.00 . A A . 8 VAL CB 1 1 2 288 1 1 8 VAL CG1 C 6.964 -7.042 -10.373 1.00 . A A . 8 VAL CG1 1 1 2 289 1 1 8 VAL CG2 C 5.358 -5.408 -9.360 1.00 . A A . 8 VAL CG2 1 1 2 290 1 1 8 VAL H H 3.466 -7.022 -8.314 1.00 . A A . 8 VAL H 1 1 2 291 1 1 8 VAL HA H 4.264 -7.318 -10.939 1.00 . A A . 8 VAL HA 1 1 2 292 1 1 8 VAL HB H 6.018 -7.225 -8.481 1.00 . A A . 8 VAL HB 1 1 2 293 1 1 8 VAL HG11 H 7.498 -6.106 -10.438 1.00 . A A . 8 VAL HG11 1 1 2 294 1 1 8 VAL HG12 H 7.614 -7.803 -9.968 1.00 . A A . 8 VAL HG12 1 1 2 295 1 1 8 VAL HG13 H 6.636 -7.337 -11.360 1.00 . A A . 8 VAL HG13 1 1 2 296 1 1 8 VAL HG21 H 6.016 -4.812 -9.975 1.00 . A A . 8 VAL HG21 1 1 2 297 1 1 8 VAL HG22 H 4.339 -5.284 -9.698 1.00 . A A . 8 VAL HG22 1 1 2 298 1 1 8 VAL HG23 H 5.437 -5.087 -8.332 1.00 . A A . 8 VAL HG23 1 1 2 299 1 1 8 VAL N N 3.431 -7.638 -9.076 1.00 . A A . 8 VAL N 1 1 2 300 1 1 8 VAL O O 4.940 -9.713 -11.261 1.00 . A A . 8 VAL O 1 1 2 301 1 1 9 LYS C C 4.828 -12.106 -9.299 1.00 . A A . 9 LYS C 1 1 2 302 1 1 9 LYS CA C 5.993 -11.137 -9.130 1.00 . A A . 9 LYS CA 1 1 2 303 1 1 9 LYS CB C 6.768 -11.471 -7.853 1.00 . A A . 9 LYS CB 1 1 2 304 1 1 9 LYS CD C 6.754 -11.224 -5.354 1.00 . A A . 9 LYS CD 1 1 2 305 1 1 9 LYS CE C 5.901 -11.240 -4.094 1.00 . A A . 9 LYS CE 1 1 2 306 1 1 9 LYS CG C 5.912 -11.447 -6.599 1.00 . A A . 9 LYS CG 1 1 2 307 1 1 9 LYS H H 5.567 -9.262 -8.244 1.00 . A A . 9 LYS H 1 1 2 308 1 1 9 LYS HA H 6.654 -11.236 -9.978 1.00 . A A . 9 LYS HA 1 1 2 309 1 1 9 LYS HB2 H 7.195 -12.458 -7.954 1.00 . A A . 9 LYS HB2 1 1 2 310 1 1 9 LYS HB3 H 7.566 -10.753 -7.733 1.00 . A A . 9 LYS HB3 1 1 2 311 1 1 9 LYS HD2 H 7.493 -12.008 -5.284 1.00 . A A . 9 LYS HD2 1 1 2 312 1 1 9 LYS HD3 H 7.249 -10.266 -5.431 1.00 . A A . 9 LYS HD3 1 1 2 313 1 1 9 LYS HE2 H 4.861 -11.246 -4.380 1.00 . A A . 9 LYS HE2 1 1 2 314 1 1 9 LYS HE3 H 6.126 -12.136 -3.534 1.00 . A A . 9 LYS HE3 1 1 2 315 1 1 9 LYS HG2 H 5.192 -10.647 -6.681 1.00 . A A . 9 LYS HG2 1 1 2 316 1 1 9 LYS HG3 H 5.395 -12.392 -6.509 1.00 . A A . 9 LYS HG3 1 1 2 317 1 1 9 LYS HZ1 H 6.394 -10.356 -2.267 1.00 . A A . 9 LYS HZ1 1 1 2 318 1 1 9 LYS HZ2 H 5.318 -9.444 -3.200 1.00 . A A . 9 LYS HZ2 1 1 2 319 1 1 9 LYS HZ3 H 6.957 -9.502 -3.614 1.00 . A A . 9 LYS HZ3 1 1 2 320 1 1 9 LYS N N 5.521 -9.758 -9.089 1.00 . A A . 9 LYS N 1 1 2 321 1 1 9 LYS NZ N 6.161 -10.052 -3.234 1.00 . A A . 9 LYS NZ 1 1 2 322 1 1 9 LYS O O 4.934 -13.102 -10.015 1.00 . A A . 9 LYS O 1 1 3 323 1 1 1 THR C C 2.600 -1.433 -1.572 1.00 . A A . 1 THR C 1 1 3 324 1 1 1 THR CA C 2.071 -0.053 -1.199 1.00 . A A . 1 THR CA 1 1 3 325 1 1 1 THR CB C 3.251 0.936 -1.135 1.00 . A A . 1 THR CB 1 1 3 326 1 1 1 THR CG2 C 3.479 1.595 -2.487 1.00 . A A . 1 THR CG2 1 1 3 327 1 1 1 THR H1 H 1.841 -0.093 0.904 1.00 . A A . 1 THR H1 1 1 3 328 1 1 1 THR HA H 1.391 0.281 -1.969 1.00 . A A . 1 THR HA 1 1 3 329 1 1 1 THR HB H 4.143 0.391 -0.861 1.00 . A A . 1 THR HB 1 1 3 330 1 1 1 THR HG1 H 2.448 2.631 -0.527 1.00 . A A . 1 THR HG1 1 1 3 331 1 1 1 THR HG21 H 2.568 2.075 -2.812 1.00 . A A . 1 THR HG21 1 1 3 332 1 1 1 THR HG22 H 3.769 0.845 -3.208 1.00 . A A . 1 THR HG22 1 1 3 333 1 1 1 THR HG23 H 4.263 2.332 -2.399 1.00 . A A . 1 THR HG23 1 1 3 334 1 1 1 THR N N 1.341 -0.092 0.061 1.00 . A A . 1 THR N 1 1 3 335 1 1 1 THR O O 3.302 -1.591 -2.571 1.00 . A A . 1 THR O 1 1 3 336 1 1 1 THR OG1 O 2.995 1.940 -0.146 1.00 . A A . 1 THR OG1 1 1 3 337 1 1 2 VAL C C 1.796 -4.490 -2.029 1.00 . A A . 2 VAL C 1 1 3 338 1 1 2 VAL CA C 2.696 -3.800 -1.010 1.00 . A A . 2 VAL CA 1 1 3 339 1 1 2 VAL CB C 2.711 -4.627 0.289 1.00 . A A . 2 VAL CB 1 1 3 340 1 1 2 VAL CG1 C 3.474 -5.927 0.085 1.00 . A A . 2 VAL CG1 1 1 3 341 1 1 2 VAL CG2 C 3.313 -3.818 1.428 1.00 . A A . 2 VAL CG2 1 1 3 342 1 1 2 VAL H H 1.695 -2.243 0.016 1.00 . A A . 2 VAL H 1 1 3 343 1 1 2 VAL HA H 3.703 -3.762 -1.400 1.00 . A A . 2 VAL HA 1 1 3 344 1 1 2 VAL HB H 1.691 -4.871 0.548 1.00 . A A . 2 VAL HB 1 1 3 345 1 1 2 VAL HG11 H 3.332 -6.565 0.945 1.00 . A A . 2 VAL HG11 1 1 3 346 1 1 2 VAL HG12 H 3.108 -6.425 -0.800 1.00 . A A . 2 VAL HG12 1 1 3 347 1 1 2 VAL HG13 H 4.527 -5.711 -0.031 1.00 . A A . 2 VAL HG13 1 1 3 348 1 1 2 VAL HG21 H 2.724 -2.927 1.585 1.00 . A A . 2 VAL HG21 1 1 3 349 1 1 2 VAL HG22 H 3.315 -4.412 2.330 1.00 . A A . 2 VAL HG22 1 1 3 350 1 1 2 VAL HG23 H 4.326 -3.542 1.178 1.00 . A A . 2 VAL HG23 1 1 3 351 1 1 2 VAL N N 2.257 -2.431 -0.764 1.00 . A A . 2 VAL N 1 1 3 352 1 1 2 VAL O O 2.202 -5.455 -2.678 1.00 . A A . 2 VAL O 1 1 3 353 1 1 3 TYR C C 0.266 -4.818 -4.459 1.00 . A A . 3 TYR C 1 1 3 354 1 1 3 TYR CA C -0.385 -4.560 -3.104 1.00 . A A . 3 TYR CA 1 1 3 355 1 1 3 TYR CB C -1.584 -3.624 -3.273 1.00 . A A . 3 TYR CB 1 1 3 356 1 1 3 TYR CD1 C -0.396 -1.409 -3.517 1.00 . A A . 3 TYR CD1 1 1 3 357 1 1 3 TYR CD2 C -1.827 -2.119 -5.286 1.00 . A A . 3 TYR CD2 1 1 3 358 1 1 3 TYR CE1 C -0.100 -0.253 -4.213 1.00 . A A . 3 TYR CE1 1 1 3 359 1 1 3 TYR CE2 C -1.536 -0.967 -5.990 1.00 . A A . 3 TYR CE2 1 1 3 360 1 1 3 TYR CG C -1.263 -2.361 -4.039 1.00 . A A . 3 TYR CG 1 1 3 361 1 1 3 TYR CZ C -0.672 -0.037 -5.450 1.00 . A A . 3 TYR CZ 1 1 3 362 1 1 3 TYR H H 0.308 -3.220 -1.620 1.00 . A A . 3 TYR H 1 1 3 363 1 1 3 TYR HA H -0.729 -5.499 -2.698 1.00 . A A . 3 TYR HA 1 1 3 364 1 1 3 TYR HB2 H -2.366 -4.144 -3.804 1.00 . A A . 3 TYR HB2 1 1 3 365 1 1 3 TYR HB3 H -1.947 -3.337 -2.297 1.00 . A A . 3 TYR HB3 1 1 3 366 1 1 3 TYR HD1 H 0.051 -1.582 -2.548 1.00 . A A . 3 TYR HD1 1 1 3 367 1 1 3 TYR HD2 H -2.504 -2.849 -5.706 1.00 . A A . 3 TYR HD2 1 1 3 368 1 1 3 TYR HE1 H 0.577 0.475 -3.791 1.00 . A A . 3 TYR HE1 1 1 3 369 1 1 3 TYR HE2 H -1.984 -0.797 -6.958 1.00 . A A . 3 TYR HE2 1 1 3 370 1 1 3 TYR HH H 0.411 0.976 -6.672 1.00 . A A . 3 TYR HH 1 1 3 371 1 1 3 TYR N N 0.573 -3.990 -2.165 1.00 . A A . 3 TYR N 1 1 3 372 1 1 3 TYR O O -0.008 -5.825 -5.112 1.00 . A A . 3 TYR O 1 1 3 373 1 1 3 TYR OH O -0.381 1.113 -6.147 1.00 . A A . 3 TYR OH 1 1 3 374 1 1 4 VAL C C 2.941 -5.066 -6.071 1.00 . A A . 4 VAL C 1 1 3 375 1 1 4 VAL CA C 1.827 -4.028 -6.152 1.00 . A A . 4 VAL CA 1 1 3 376 1 1 4 VAL CB C 2.426 -2.682 -6.603 1.00 . A A . 4 VAL CB 1 1 3 377 1 1 4 VAL CG1 C 1.361 -1.817 -7.259 1.00 . A A . 4 VAL CG1 1 1 3 378 1 1 4 VAL CG2 C 3.059 -1.960 -5.423 1.00 . A A . 4 VAL CG2 1 1 3 379 1 1 4 VAL H H 1.311 -3.119 -4.312 1.00 . A A . 4 VAL H 1 1 3 380 1 1 4 VAL HA H 1.107 -4.344 -6.894 1.00 . A A . 4 VAL HA 1 1 3 381 1 1 4 VAL HB H 3.197 -2.881 -7.333 1.00 . A A . 4 VAL HB 1 1 3 382 1 1 4 VAL HG11 H 0.391 -2.271 -7.117 1.00 . A A . 4 VAL HG11 1 1 3 383 1 1 4 VAL HG12 H 1.368 -0.834 -6.810 1.00 . A A . 4 VAL HG12 1 1 3 384 1 1 4 VAL HG13 H 1.567 -1.732 -8.315 1.00 . A A . 4 VAL HG13 1 1 3 385 1 1 4 VAL HG21 H 2.426 -1.140 -5.122 1.00 . A A . 4 VAL HG21 1 1 3 386 1 1 4 VAL HG22 H 3.173 -2.649 -4.598 1.00 . A A . 4 VAL HG22 1 1 3 387 1 1 4 VAL HG23 H 4.028 -1.581 -5.711 1.00 . A A . 4 VAL HG23 1 1 3 388 1 1 4 VAL N N 1.133 -3.900 -4.876 1.00 . A A . 4 VAL N 1 1 3 389 1 1 4 VAL O O 3.155 -5.837 -7.006 1.00 . A A . 4 VAL O 1 1 3 390 1 1 5 TYR C C 4.247 -7.461 -4.844 1.00 . A A . 5 TYR C 1 1 3 391 1 1 5 TYR CA C 4.741 -6.022 -4.742 1.00 . A A . 5 TYR CA 1 1 3 392 1 1 5 TYR CB C 5.394 -5.790 -3.378 1.00 . A A . 5 TYR CB 1 1 3 393 1 1 5 TYR CD1 C 7.684 -4.732 -3.260 1.00 . A A . 5 TYR CD1 1 1 3 394 1 1 5 TYR CD2 C 5.786 -3.296 -3.382 1.00 . A A . 5 TYR CD2 1 1 3 395 1 1 5 TYR CE1 C 8.520 -3.633 -3.224 1.00 . A A . 5 TYR CE1 1 1 3 396 1 1 5 TYR CE2 C 6.614 -2.191 -3.347 1.00 . A A . 5 TYR CE2 1 1 3 397 1 1 5 TYR CG C 6.304 -4.584 -3.340 1.00 . A A . 5 TYR CG 1 1 3 398 1 1 5 TYR CZ C 7.980 -2.364 -3.268 1.00 . A A . 5 TYR CZ 1 1 3 399 1 1 5 TYR H H 3.429 -4.440 -4.236 1.00 . A A . 5 TYR H 1 1 3 400 1 1 5 TYR HA H 5.475 -5.850 -5.516 1.00 . A A . 5 TYR HA 1 1 3 401 1 1 5 TYR HB2 H 4.623 -5.647 -2.637 1.00 . A A . 5 TYR HB2 1 1 3 402 1 1 5 TYR HB3 H 5.982 -6.658 -3.116 1.00 . A A . 5 TYR HB3 1 1 3 403 1 1 5 TYR HD1 H 8.104 -5.727 -3.226 1.00 . A A . 5 TYR HD1 1 1 3 404 1 1 5 TYR HD2 H 4.715 -3.163 -3.443 1.00 . A A . 5 TYR HD2 1 1 3 405 1 1 5 TYR HE1 H 9.589 -3.768 -3.162 1.00 . A A . 5 TYR HE1 1 1 3 406 1 1 5 TYR HE2 H 6.191 -1.197 -3.382 1.00 . A A . 5 TYR HE2 1 1 3 407 1 1 5 TYR HH H 9.722 -1.552 -3.302 1.00 . A A . 5 TYR HH 1 1 3 408 1 1 5 TYR N N 3.647 -5.080 -4.946 1.00 . A A . 5 TYR N 1 1 3 409 1 1 5 TYR O O 4.998 -8.363 -5.217 1.00 . A A . 5 TYR O 1 1 3 410 1 1 5 TYR OH O 8.808 -1.266 -3.232 1.00 . A A . 5 TYR OH 1 1 3 411 1 1 6 SER C C 1.774 -9.271 -5.934 1.00 . A A . 6 SER C 1 1 3 412 1 1 6 SER CA C 2.381 -8.999 -4.561 1.00 . A A . 6 SER CA 1 1 3 413 1 1 6 SER CB C 1.308 -9.141 -3.479 1.00 . A A . 6 SER CB 1 1 3 414 1 1 6 SER H H 2.429 -6.910 -4.221 1.00 . A A . 6 SER H 1 1 3 415 1 1 6 SER HA H 3.163 -9.720 -4.377 1.00 . A A . 6 SER HA 1 1 3 416 1 1 6 SER HB2 H 0.376 -8.738 -3.845 1.00 . A A . 6 SER HB2 1 1 3 417 1 1 6 SER HB3 H 1.179 -10.187 -3.240 1.00 . A A . 6 SER HB3 1 1 3 418 1 1 6 SER HG H 1.471 -7.513 -2.402 1.00 . A A . 6 SER HG 1 1 3 419 1 1 6 SER N N 2.977 -7.669 -4.510 1.00 . A A . 6 SER N 1 1 3 420 1 1 6 SER O O 1.695 -10.418 -6.373 1.00 . A A . 6 SER O 1 1 3 421 1 1 6 SER OG O 1.676 -8.445 -2.301 1.00 . A A . 6 SER OG 1 1 3 422 1 1 7 ARG C C 1.815 -8.572 -8.991 1.00 . A A . 7 ARG C 1 1 3 423 1 1 7 ARG CA C 0.747 -8.329 -7.929 1.00 . A A . 7 ARG CA 1 1 3 424 1 1 7 ARG CB C -0.049 -7.068 -8.270 1.00 . A A . 7 ARG CB 1 1 3 425 1 1 7 ARG CD C -0.474 -5.192 -9.887 1.00 . A A . 7 ARG CD 1 1 3 426 1 1 7 ARG CG C 0.328 -6.453 -9.608 1.00 . A A . 7 ARG CG 1 1 3 427 1 1 7 ARG CZ C -0.637 -5.276 -12.338 1.00 . A A . 7 ARG CZ 1 1 3 428 1 1 7 ARG H H 1.438 -7.318 -6.203 1.00 . A A . 7 ARG H 1 1 3 429 1 1 7 ARG HA H 0.075 -9.174 -7.911 1.00 . A A . 7 ARG HA 1 1 3 430 1 1 7 ARG HB2 H -1.100 -7.315 -8.296 1.00 . A A . 7 ARG HB2 1 1 3 431 1 1 7 ARG HB3 H 0.120 -6.331 -7.499 1.00 . A A . 7 ARG HB3 1 1 3 432 1 1 7 ARG HD2 H -1.173 -5.039 -9.078 1.00 . A A . 7 ARG HD2 1 1 3 433 1 1 7 ARG HD3 H 0.205 -4.354 -9.939 1.00 . A A . 7 ARG HD3 1 1 3 434 1 1 7 ARG HE H -2.191 -5.347 -11.090 1.00 . A A . 7 ARG HE 1 1 3 435 1 1 7 ARG HG2 H 1.378 -6.203 -9.595 1.00 . A A . 7 ARG HG2 1 1 3 436 1 1 7 ARG HG3 H 0.136 -7.172 -10.390 1.00 . A A . 7 ARG HG3 1 1 3 437 1 1 7 ARG HH11 H 1.243 -5.124 -11.616 1.00 . A A . 7 ARG HH11 1 1 3 438 1 1 7 ARG HH12 H 1.115 -5.184 -13.343 1.00 . A A . 7 ARG HH12 1 1 3 439 1 1 7 ARG HH21 H -2.373 -5.428 -13.362 1.00 . A A . 7 ARG HH21 1 1 3 440 1 1 7 ARG HH22 H -0.943 -5.356 -14.335 1.00 . A A . 7 ARG HH22 1 1 3 441 1 1 7 ARG N N 1.348 -8.207 -6.606 1.00 . A A . 7 ARG N 1 1 3 442 1 1 7 ARG NE N -1.215 -5.281 -11.142 1.00 . A A . 7 ARG NE 1 1 3 443 1 1 7 ARG NH1 N 0.682 -5.187 -12.441 1.00 . A A . 7 ARG NH1 1 1 3 444 1 1 7 ARG NH2 N -1.379 -5.360 -13.435 1.00 . A A . 7 ARG NH2 1 1 3 445 1 1 7 ARG O O 1.635 -9.393 -9.891 1.00 . A A . 7 ARG O 1 1 3 446 1 1 8 VAL C C 4.435 -9.449 -9.988 1.00 . A A . 8 VAL C 1 1 3 447 1 1 8 VAL CA C 4.024 -7.990 -9.830 1.00 . A A . 8 VAL CA 1 1 3 448 1 1 8 VAL CB C 5.251 -7.167 -9.393 1.00 . A A . 8 VAL CB 1 1 3 449 1 1 8 VAL CG1 C 6.413 -7.391 -10.349 1.00 . A A . 8 VAL CG1 1 1 3 450 1 1 8 VAL CG2 C 4.898 -5.690 -9.306 1.00 . A A . 8 VAL CG2 1 1 3 451 1 1 8 VAL H H 3.011 -7.214 -8.141 1.00 . A A . 8 VAL H 1 1 3 452 1 1 8 VAL HA H 3.688 -7.615 -10.786 1.00 . A A . 8 VAL HA 1 1 3 453 1 1 8 VAL HB H 5.552 -7.502 -8.411 1.00 . A A . 8 VAL HB 1 1 3 454 1 1 8 VAL HG11 H 6.972 -6.473 -10.457 1.00 . A A . 8 VAL HG11 1 1 3 455 1 1 8 VAL HG12 H 7.058 -8.164 -9.957 1.00 . A A . 8 VAL HG12 1 1 3 456 1 1 8 VAL HG13 H 6.031 -7.695 -11.313 1.00 . A A . 8 VAL HG13 1 1 3 457 1 1 8 VAL HG21 H 5.030 -5.348 -8.291 1.00 . A A . 8 VAL HG21 1 1 3 458 1 1 8 VAL HG22 H 5.546 -5.126 -9.962 1.00 . A A . 8 VAL HG22 1 1 3 459 1 1 8 VAL HG23 H 3.871 -5.547 -9.605 1.00 . A A . 8 VAL HG23 1 1 3 460 1 1 8 VAL N N 2.927 -7.852 -8.880 1.00 . A A . 8 VAL N 1 1 3 461 1 1 8 VAL O O 4.283 -10.036 -11.060 1.00 . A A . 8 VAL O 1 1 3 462 1 1 9 LYS C C 4.286 -12.341 -8.408 1.00 . A A . 9 LYS C 1 1 3 463 1 1 9 LYS CA C 5.387 -11.424 -8.930 1.00 . A A . 9 LYS CA 1 1 3 464 1 1 9 LYS CB C 6.653 -11.598 -8.087 1.00 . A A . 9 LYS CB 1 1 3 465 1 1 9 LYS CD C 7.636 -10.371 -6.128 1.00 . A A . 9 LYS CD 1 1 3 466 1 1 9 LYS CE C 8.099 -10.830 -4.753 1.00 . A A . 9 LYS CE 1 1 3 467 1 1 9 LYS CG C 6.471 -11.207 -6.630 1.00 . A A . 9 LYS CG 1 1 3 468 1 1 9 LYS H H 5.052 -9.511 -8.088 1.00 . A A . 9 LYS H 1 1 3 469 1 1 9 LYS HA H 5.607 -11.691 -9.953 1.00 . A A . 9 LYS HA 1 1 3 470 1 1 9 LYS HB2 H 6.957 -12.633 -8.125 1.00 . A A . 9 LYS HB2 1 1 3 471 1 1 9 LYS HB3 H 7.437 -10.985 -8.507 1.00 . A A . 9 LYS HB3 1 1 3 472 1 1 9 LYS HD2 H 8.459 -10.462 -6.821 1.00 . A A . 9 LYS HD2 1 1 3 473 1 1 9 LYS HD3 H 7.326 -9.337 -6.067 1.00 . A A . 9 LYS HD3 1 1 3 474 1 1 9 LYS HE2 H 8.124 -11.909 -4.738 1.00 . A A . 9 LYS HE2 1 1 3 475 1 1 9 LYS HE3 H 9.092 -10.444 -4.576 1.00 . A A . 9 LYS HE3 1 1 3 476 1 1 9 LYS HG2 H 5.561 -10.633 -6.531 1.00 . A A . 9 LYS HG2 1 1 3 477 1 1 9 LYS HG3 H 6.399 -12.105 -6.033 1.00 . A A . 9 LYS HG3 1 1 3 478 1 1 9 LYS HZ1 H 7.747 -9.913 -2.910 1.00 . A A . 9 LYS HZ1 1 1 3 479 1 1 9 LYS HZ2 H 6.651 -11.146 -3.282 1.00 . A A . 9 LYS HZ2 1 1 3 480 1 1 9 LYS HZ3 H 6.528 -9.645 -4.052 1.00 . A A . 9 LYS HZ3 1 1 3 481 1 1 9 LYS N N 4.956 -10.031 -8.913 1.00 . A A . 9 LYS N 1 1 3 482 1 1 9 LYS NZ N 7.192 -10.350 -3.674 1.00 . A A . 9 LYS NZ 1 1 3 483 1 1 9 LYS O O 4.562 -13.361 -7.776 1.00 . A A . 9 LYS O 1 1 4 484 1 1 1 THR C C 2.391 -1.321 -1.683 1.00 . A A . 1 THR C 1 1 4 485 1 1 1 THR CA C 1.889 0.092 -1.409 1.00 . A A . 1 THR CA 1 1 4 486 1 1 1 THR CB C 3.098 1.037 -1.280 1.00 . A A . 1 THR CB 1 1 4 487 1 1 1 THR CG2 C 3.465 1.633 -2.631 1.00 . A A . 1 THR CG2 1 1 4 488 1 1 1 THR H1 H 1.481 0.144 0.668 1.00 . A A . 1 THR H1 1 1 4 489 1 1 1 THR HA H 1.290 0.420 -2.245 1.00 . A A . 1 THR HA 1 1 4 490 1 1 1 THR HB H 3.942 0.471 -0.912 1.00 . A A . 1 THR HB 1 1 4 491 1 1 1 THR HG1 H 3.241 1.912 0.482 1.00 . A A . 1 THR HG1 1 1 4 492 1 1 1 THR HG21 H 4.013 2.552 -2.482 1.00 . A A . 1 THR HG21 1 1 4 493 1 1 1 THR HG22 H 2.565 1.837 -3.191 1.00 . A A . 1 THR HG22 1 1 4 494 1 1 1 THR HG23 H 4.079 0.934 -3.178 1.00 . A A . 1 THR HG23 1 1 4 495 1 1 1 THR N N 1.055 0.131 -0.214 1.00 . A A . 1 THR N 1 1 4 496 1 1 1 THR O O 3.168 -1.546 -2.611 1.00 . A A . 1 THR O 1 1 4 497 1 1 1 THR OG1 O 2.802 2.088 -0.354 1.00 . A A . 1 THR OG1 1 1 4 498 1 1 2 VAL C C 1.504 -4.363 -2.093 1.00 . A A . 2 VAL C 1 1 4 499 1 1 2 VAL CA C 2.343 -3.665 -1.028 1.00 . A A . 2 VAL CA 1 1 4 500 1 1 2 VAL CB C 2.215 -4.439 0.298 1.00 . A A . 2 VAL CB 1 1 4 501 1 1 2 VAL CG1 C 2.940 -5.773 0.210 1.00 . A A . 2 VAL CG1 1 1 4 502 1 1 2 VAL CG2 C 2.751 -3.607 1.454 1.00 . A A . 2 VAL CG2 1 1 4 503 1 1 2 VAL H H 1.323 -2.032 -0.149 1.00 . A A . 2 VAL H 1 1 4 504 1 1 2 VAL HA H 3.379 -3.681 -1.331 1.00 . A A . 2 VAL HA 1 1 4 505 1 1 2 VAL HB H 1.168 -4.634 0.478 1.00 . A A . 2 VAL HB 1 1 4 506 1 1 2 VAL HG11 H 2.697 -6.372 1.075 1.00 . A A . 2 VAL HG11 1 1 4 507 1 1 2 VAL HG12 H 2.633 -6.291 -0.687 1.00 . A A . 2 VAL HG12 1 1 4 508 1 1 2 VAL HG13 H 4.006 -5.602 0.180 1.00 . A A . 2 VAL HG13 1 1 4 509 1 1 2 VAL HG21 H 2.653 -4.164 2.373 1.00 . A A . 2 VAL HG21 1 1 4 510 1 1 2 VAL HG22 H 3.793 -3.379 1.280 1.00 . A A . 2 VAL HG22 1 1 4 511 1 1 2 VAL HG23 H 2.189 -2.688 1.527 1.00 . A A . 2 VAL HG23 1 1 4 512 1 1 2 VAL N N 1.941 -2.272 -0.871 1.00 . A A . 2 VAL N 1 1 4 513 1 1 2 VAL O O 1.923 -5.367 -2.669 1.00 . A A . 2 VAL O 1 1 4 514 1 1 3 TYR C C 0.171 -4.732 -4.630 1.00 . A A . 3 TYR C 1 1 4 515 1 1 3 TYR CA C -0.581 -4.395 -3.346 1.00 . A A . 3 TYR CA 1 1 4 516 1 1 3 TYR CB C -1.722 -3.423 -3.651 1.00 . A A . 3 TYR CB 1 1 4 517 1 1 3 TYR CD1 C -1.734 -1.992 -5.731 1.00 . A A . 3 TYR CD1 1 1 4 518 1 1 3 TYR CD2 C -0.430 -1.265 -3.873 1.00 . A A . 3 TYR CD2 1 1 4 519 1 1 3 TYR CE1 C -1.339 -0.880 -6.450 1.00 . A A . 3 TYR CE1 1 1 4 520 1 1 3 TYR CE2 C -0.031 -0.149 -4.584 1.00 . A A . 3 TYR CE2 1 1 4 521 1 1 3 TYR CG C -1.288 -2.204 -4.433 1.00 . A A . 3 TYR CG 1 1 4 522 1 1 3 TYR CZ C -0.488 0.039 -5.872 1.00 . A A . 3 TYR CZ 1 1 4 523 1 1 3 TYR H H 0.040 -3.022 -1.860 1.00 . A A . 3 TYR H 1 1 4 524 1 1 3 TYR HA H -0.995 -5.304 -2.936 1.00 . A A . 3 TYR HA 1 1 4 525 1 1 3 TYR HB2 H -2.477 -3.934 -4.228 1.00 . A A . 3 TYR HB2 1 1 4 526 1 1 3 TYR HB3 H -2.155 -3.084 -2.721 1.00 . A A . 3 TYR HB3 1 1 4 527 1 1 3 TYR HD1 H -2.400 -2.714 -6.182 1.00 . A A . 3 TYR HD1 1 1 4 528 1 1 3 TYR HD2 H -0.074 -1.415 -2.864 1.00 . A A . 3 TYR HD2 1 1 4 529 1 1 3 TYR HE1 H -1.696 -0.733 -7.458 1.00 . A A . 3 TYR HE1 1 1 4 530 1 1 3 TYR HE2 H 0.635 0.570 -4.131 1.00 . A A . 3 TYR HE2 1 1 4 531 1 1 3 TYR HH H 0.695 0.937 -7.092 1.00 . A A . 3 TYR HH 1 1 4 532 1 1 3 TYR N N 0.318 -3.823 -2.351 1.00 . A A . 3 TYR N 1 1 4 533 1 1 3 TYR O O -0.088 -5.754 -5.265 1.00 . A A . 3 TYR O 1 1 4 534 1 1 3 TYR OH O -0.092 1.148 -6.583 1.00 . A A . 3 TYR OH 1 1 4 535 1 1 4 VAL C C 2.956 -5.144 -6.000 1.00 . A A . 4 VAL C 1 1 4 536 1 1 4 VAL CA C 1.897 -4.068 -6.213 1.00 . A A . 4 VAL CA 1 1 4 537 1 1 4 VAL CB C 2.587 -2.765 -6.659 1.00 . A A . 4 VAL CB 1 1 4 538 1 1 4 VAL CG1 C 1.618 -1.886 -7.435 1.00 . A A . 4 VAL CG1 1 1 4 539 1 1 4 VAL CG2 C 3.149 -2.022 -5.457 1.00 . A A . 4 VAL CG2 1 1 4 540 1 1 4 VAL H H 1.265 -3.067 -4.459 1.00 . A A . 4 VAL H 1 1 4 541 1 1 4 VAL HA H 1.229 -4.385 -7.001 1.00 . A A . 4 VAL HA 1 1 4 542 1 1 4 VAL HB H 3.408 -3.022 -7.313 1.00 . A A . 4 VAL HB 1 1 4 543 1 1 4 VAL HG11 H 1.626 -0.889 -7.020 1.00 . A A . 4 VAL HG11 1 1 4 544 1 1 4 VAL HG12 H 1.917 -1.848 -8.472 1.00 . A A . 4 VAL HG12 1 1 4 545 1 1 4 VAL HG13 H 0.622 -2.298 -7.362 1.00 . A A . 4 VAL HG13 1 1 4 546 1 1 4 VAL HG21 H 4.153 -1.692 -5.676 1.00 . A A . 4 VAL HG21 1 1 4 547 1 1 4 VAL HG22 H 2.528 -1.164 -5.241 1.00 . A A . 4 VAL HG22 1 1 4 548 1 1 4 VAL HG23 H 3.163 -2.680 -4.601 1.00 . A A . 4 VAL HG23 1 1 4 549 1 1 4 VAL N N 1.105 -3.863 -5.007 1.00 . A A . 4 VAL N 1 1 4 550 1 1 4 VAL O O 3.215 -5.959 -6.885 1.00 . A A . 4 VAL O 1 1 4 551 1 1 5 TYR C C 4.053 -7.537 -4.577 1.00 . A A . 5 TYR C 1 1 4 552 1 1 5 TYR CA C 4.598 -6.115 -4.490 1.00 . A A . 5 TYR CA 1 1 4 553 1 1 5 TYR CB C 5.147 -5.852 -3.086 1.00 . A A . 5 TYR CB 1 1 4 554 1 1 5 TYR CD1 C 5.637 -3.376 -3.148 1.00 . A A . 5 TYR CD1 1 1 4 555 1 1 5 TYR CD2 C 7.461 -4.875 -2.823 1.00 . A A . 5 TYR CD2 1 1 4 556 1 1 5 TYR CE1 C 6.503 -2.301 -3.087 1.00 . A A . 5 TYR CE1 1 1 4 557 1 1 5 TYR CE2 C 8.334 -3.807 -2.759 1.00 . A A . 5 TYR CE2 1 1 4 558 1 1 5 TYR CG C 6.099 -4.680 -3.018 1.00 . A A . 5 TYR CG 1 1 4 559 1 1 5 TYR CZ C 7.850 -2.522 -2.892 1.00 . A A . 5 TYR CZ 1 1 4 560 1 1 5 TYR H H 3.316 -4.465 -4.155 1.00 . A A . 5 TYR H 1 1 4 561 1 1 5 TYR HA H 5.400 -6.004 -5.205 1.00 . A A . 5 TYR HA 1 1 4 562 1 1 5 TYR HB2 H 4.325 -5.650 -2.417 1.00 . A A . 5 TYR HB2 1 1 4 563 1 1 5 TYR HB3 H 5.676 -6.730 -2.744 1.00 . A A . 5 TYR HB3 1 1 4 564 1 1 5 TYR HD1 H 4.581 -3.206 -3.301 1.00 . A A . 5 TYR HD1 1 1 4 565 1 1 5 TYR HD2 H 7.836 -5.883 -2.720 1.00 . A A . 5 TYR HD2 1 1 4 566 1 1 5 TYR HE1 H 6.125 -1.295 -3.191 1.00 . A A . 5 TYR HE1 1 1 4 567 1 1 5 TYR HE2 H 9.389 -3.979 -2.607 1.00 . A A . 5 TYR HE2 1 1 4 568 1 1 5 TYR HH H 9.621 -1.778 -2.811 1.00 . A A . 5 TYR HH 1 1 4 569 1 1 5 TYR N N 3.565 -5.140 -4.820 1.00 . A A . 5 TYR N 1 1 4 570 1 1 5 TYR O O 4.794 -8.482 -4.849 1.00 . A A . 5 TYR O 1 1 4 571 1 1 5 TYR OH O 8.717 -1.455 -2.830 1.00 . A A . 5 TYR OH 1 1 4 572 1 1 6 SER C C 1.601 -9.291 -5.800 1.00 . A A . 6 SER C 1 1 4 573 1 1 6 SER CA C 2.107 -8.987 -4.393 1.00 . A A . 6 SER CA 1 1 4 574 1 1 6 SER CB C 0.946 -9.044 -3.398 1.00 . A A . 6 SER CB 1 1 4 575 1 1 6 SER H H 2.215 -6.889 -4.132 1.00 . A A . 6 SER H 1 1 4 576 1 1 6 SER HA H 2.841 -9.730 -4.119 1.00 . A A . 6 SER HA 1 1 4 577 1 1 6 SER HB2 H 0.671 -8.040 -3.112 1.00 . A A . 6 SER HB2 1 1 4 578 1 1 6 SER HB3 H 0.101 -9.531 -3.862 1.00 . A A . 6 SER HB3 1 1 4 579 1 1 6 SER HG H 1.448 -9.155 -1.507 1.00 . A A . 6 SER HG 1 1 4 580 1 1 6 SER N N 2.753 -7.681 -4.344 1.00 . A A . 6 SER N 1 1 4 581 1 1 6 SER O O 1.509 -10.451 -6.201 1.00 . A A . 6 SER O 1 1 4 582 1 1 6 SER OG O 1.307 -9.767 -2.234 1.00 . A A . 6 SER OG 1 1 4 583 1 1 7 ARG C C 1.914 -8.719 -8.867 1.00 . A A . 7 ARG C 1 1 4 584 1 1 7 ARG CA C 0.775 -8.392 -7.905 1.00 . A A . 7 ARG CA 1 1 4 585 1 1 7 ARG CB C 0.063 -7.115 -8.356 1.00 . A A . 7 ARG CB 1 1 4 586 1 1 7 ARG CD C -0.154 -5.291 -10.072 1.00 . A A . 7 ARG CD 1 1 4 587 1 1 7 ARG CG C 0.570 -6.570 -9.682 1.00 . A A . 7 ARG CG 1 1 4 588 1 1 7 ARG CZ C -1.484 -4.419 -11.946 1.00 . A A . 7 ARG CZ 1 1 4 589 1 1 7 ARG H H 1.369 -7.339 -6.168 1.00 . A A . 7 ARG H 1 1 4 590 1 1 7 ARG HA H 0.069 -9.208 -7.911 1.00 . A A . 7 ARG HA 1 1 4 591 1 1 7 ARG HB2 H -0.992 -7.322 -8.458 1.00 . A A . 7 ARG HB2 1 1 4 592 1 1 7 ARG HB3 H 0.201 -6.355 -7.603 1.00 . A A . 7 ARG HB3 1 1 4 593 1 1 7 ARG HD2 H -0.908 -5.080 -9.329 1.00 . A A . 7 ARG HD2 1 1 4 594 1 1 7 ARG HD3 H 0.561 -4.483 -10.099 1.00 . A A . 7 ARG HD3 1 1 4 595 1 1 7 ARG HE H -0.705 -6.253 -11.858 1.00 . A A . 7 ARG HE 1 1 4 596 1 1 7 ARG HG2 H 1.626 -6.360 -9.593 1.00 . A A . 7 ARG HG2 1 1 4 597 1 1 7 ARG HG3 H 0.412 -7.313 -10.450 1.00 . A A . 7 ARG HG3 1 1 4 598 1 1 7 ARG HH11 H -1.204 -3.119 -10.425 1.00 . A A . 7 ARG HH11 1 1 4 599 1 1 7 ARG HH12 H -2.139 -2.517 -11.753 1.00 . A A . 7 ARG HH12 1 1 4 600 1 1 7 ARG HH21 H -1.936 -5.471 -13.612 1.00 . A A . 7 ARG HH21 1 1 4 601 1 1 7 ARG HH22 H -2.556 -3.855 -13.565 1.00 . A A . 7 ARG HH22 1 1 4 602 1 1 7 ARG N N 1.274 -8.239 -6.544 1.00 . A A . 7 ARG N 1 1 4 603 1 1 7 ARG NE N -0.794 -5.403 -11.380 1.00 . A A . 7 ARG NE 1 1 4 604 1 1 7 ARG NH1 N -1.621 -3.256 -11.323 1.00 . A A . 7 ARG NH1 1 1 4 605 1 1 7 ARG NH2 N -2.037 -4.596 -13.139 1.00 . A A . 7 ARG NH2 1 1 4 606 1 1 7 ARG O O 1.772 -9.568 -9.747 1.00 . A A . 7 ARG O 1 1 4 607 1 1 8 VAL C C 4.566 -9.736 -9.615 1.00 . A A . 8 VAL C 1 1 4 608 1 1 8 VAL CA C 4.205 -8.257 -9.546 1.00 . A A . 8 VAL CA 1 1 4 609 1 1 8 VAL CB C 5.427 -7.465 -9.042 1.00 . A A . 8 VAL CB 1 1 4 610 1 1 8 VAL CG1 C 6.652 -7.779 -9.887 1.00 . A A . 8 VAL CG1 1 1 4 611 1 1 8 VAL CG2 C 5.133 -5.972 -9.047 1.00 . A A . 8 VAL CG2 1 1 4 612 1 1 8 VAL H H 3.094 -7.374 -7.975 1.00 . A A . 8 VAL H 1 1 4 613 1 1 8 VAL HA H 3.962 -7.908 -10.539 1.00 . A A . 8 VAL HA 1 1 4 614 1 1 8 VAL HB H 5.631 -7.767 -8.025 1.00 . A A . 8 VAL HB 1 1 4 615 1 1 8 VAL HG11 H 7.266 -6.894 -9.971 1.00 . A A . 8 VAL HG11 1 1 4 616 1 1 8 VAL HG12 H 7.219 -8.570 -9.419 1.00 . A A . 8 VAL HG12 1 1 4 617 1 1 8 VAL HG13 H 6.339 -8.093 -10.871 1.00 . A A . 8 VAL HG13 1 1 4 618 1 1 8 VAL HG21 H 5.837 -5.470 -9.693 1.00 . A A . 8 VAL HG21 1 1 4 619 1 1 8 VAL HG22 H 4.129 -5.804 -9.410 1.00 . A A . 8 VAL HG22 1 1 4 620 1 1 8 VAL HG23 H 5.223 -5.584 -8.044 1.00 . A A . 8 VAL HG23 1 1 4 621 1 1 8 VAL N N 3.042 -8.038 -8.694 1.00 . A A . 8 VAL N 1 1 4 622 1 1 8 VAL O O 4.475 -10.360 -10.673 1.00 . A A . 8 VAL O 1 1 4 623 1 1 9 LYS C C 4.145 -12.598 -8.688 1.00 . A A . 9 LYS C 1 1 4 624 1 1 9 LYS CA C 5.348 -11.701 -8.410 1.00 . A A . 9 LYS CA 1 1 4 625 1 1 9 LYS CB C 5.932 -12.027 -7.033 1.00 . A A . 9 LYS CB 1 1 4 626 1 1 9 LYS CD C 7.958 -10.770 -6.242 1.00 . A A . 9 LYS CD 1 1 4 627 1 1 9 LYS CE C 9.473 -10.663 -6.313 1.00 . A A . 9 LYS CE 1 1 4 628 1 1 9 LYS CG C 7.450 -11.990 -6.992 1.00 . A A . 9 LYS CG 1 1 4 629 1 1 9 LYS H H 5.026 -9.744 -7.670 1.00 . A A . 9 LYS H 1 1 4 630 1 1 9 LYS HA H 6.100 -11.884 -9.163 1.00 . A A . 9 LYS HA 1 1 4 631 1 1 9 LYS HB2 H 5.556 -11.311 -6.317 1.00 . A A . 9 LYS HB2 1 1 4 632 1 1 9 LYS HB3 H 5.609 -13.017 -6.744 1.00 . A A . 9 LYS HB3 1 1 4 633 1 1 9 LYS HD2 H 7.525 -9.883 -6.680 1.00 . A A . 9 LYS HD2 1 1 4 634 1 1 9 LYS HD3 H 7.659 -10.845 -5.206 1.00 . A A . 9 LYS HD3 1 1 4 635 1 1 9 LYS HE2 H 9.872 -11.604 -6.659 1.00 . A A . 9 LYS HE2 1 1 4 636 1 1 9 LYS HE3 H 9.733 -9.883 -7.014 1.00 . A A . 9 LYS HE3 1 1 4 637 1 1 9 LYS HG2 H 7.809 -12.879 -6.497 1.00 . A A . 9 LYS HG2 1 1 4 638 1 1 9 LYS HG3 H 7.827 -11.962 -8.005 1.00 . A A . 9 LYS HG3 1 1 4 639 1 1 9 LYS HZ1 H 9.847 -11.095 -4.304 1.00 . A A . 9 LYS HZ1 1 1 4 640 1 1 9 LYS HZ2 H 9.687 -9.443 -4.631 1.00 . A A . 9 LYS HZ2 1 1 4 641 1 1 9 LYS HZ3 H 11.103 -10.259 -5.070 1.00 . A A . 9 LYS HZ3 1 1 4 642 1 1 9 LYS N N 4.975 -10.294 -8.480 1.00 . A A . 9 LYS N 1 1 4 643 1 1 9 LYS NZ N 10.069 -10.342 -4.987 1.00 . A A . 9 LYS NZ 1 1 4 644 1 1 9 LYS O O 3.954 -13.065 -9.812 1.00 . A A . 9 LYS O 1 1 5 645 1 1 1 THR C C 2.346 -1.104 -1.569 1.00 . A A . 1 THR C 1 1 5 646 1 1 1 THR CA C 1.641 0.207 -1.240 1.00 . A A . 1 THR CA 1 1 5 647 1 1 1 THR CB C 2.693 1.326 -1.122 1.00 . A A . 1 THR CB 1 1 5 648 1 1 1 THR CG2 C 2.916 2.002 -2.467 1.00 . A A . 1 THR CG2 1 1 5 649 1 1 1 THR H1 H 1.303 0.147 0.849 1.00 . A A . 1 THR H1 1 1 5 650 1 1 1 THR HA H 0.969 0.456 -2.048 1.00 . A A . 1 THR HA 1 1 5 651 1 1 1 THR HB H 3.626 0.890 -0.796 1.00 . A A . 1 THR HB 1 1 5 652 1 1 1 THR HG1 H 1.407 2.640 -0.409 1.00 . A A . 1 THR HG1 1 1 5 653 1 1 1 THR HG21 H 1.976 2.074 -2.995 1.00 . A A . 1 THR HG21 1 1 5 654 1 1 1 THR HG22 H 3.614 1.420 -3.051 1.00 . A A . 1 THR HG22 1 1 5 655 1 1 1 THR HG23 H 3.317 2.992 -2.310 1.00 . A A . 1 THR HG23 1 1 5 656 1 1 1 THR N N 0.853 0.088 -0.020 1.00 . A A . 1 THR N 1 1 5 657 1 1 1 THR O O 3.116 -1.183 -2.527 1.00 . A A . 1 THR O 1 1 5 658 1 1 1 THR OG1 O 2.269 2.298 -0.159 1.00 . A A . 1 THR OG1 1 1 5 659 1 1 2 VAL C C 1.930 -4.236 -2.037 1.00 . A A . 2 VAL C 1 1 5 660 1 1 2 VAL CA C 2.685 -3.441 -0.978 1.00 . A A . 2 VAL CA 1 1 5 661 1 1 2 VAL CB C 2.725 -4.255 0.329 1.00 . A A . 2 VAL CB 1 1 5 662 1 1 2 VAL CG1 C 3.645 -5.458 0.181 1.00 . A A . 2 VAL CG1 1 1 5 663 1 1 2 VAL CG2 C 3.164 -3.377 1.490 1.00 . A A . 2 VAL CG2 1 1 5 664 1 1 2 VAL H H 1.456 -2.007 -0.023 1.00 . A A . 2 VAL H 1 1 5 665 1 1 2 VAL HA H 3.701 -3.288 -1.313 1.00 . A A . 2 VAL HA 1 1 5 666 1 1 2 VAL HB H 1.728 -4.616 0.535 1.00 . A A . 2 VAL HB 1 1 5 667 1 1 2 VAL HG11 H 3.390 -5.997 -0.719 1.00 . A A . 2 VAL HG11 1 1 5 668 1 1 2 VAL HG12 H 4.670 -5.122 0.123 1.00 . A A . 2 VAL HG12 1 1 5 669 1 1 2 VAL HG13 H 3.526 -6.108 1.035 1.00 . A A . 2 VAL HG13 1 1 5 670 1 1 2 VAL HG21 H 3.186 -3.964 2.397 1.00 . A A . 2 VAL HG21 1 1 5 671 1 1 2 VAL HG22 H 4.152 -2.985 1.293 1.00 . A A . 2 VAL HG22 1 1 5 672 1 1 2 VAL HG23 H 2.469 -2.559 1.607 1.00 . A A . 2 VAL HG23 1 1 5 673 1 1 2 VAL N N 2.078 -2.132 -0.770 1.00 . A A . 2 VAL N 1 1 5 674 1 1 2 VAL O O 2.479 -5.149 -2.652 1.00 . A A . 2 VAL O 1 1 5 675 1 1 3 TYR C C 0.584 -4.750 -4.542 1.00 . A A . 3 TYR C 1 1 5 676 1 1 3 TYR CA C -0.167 -4.563 -3.227 1.00 . A A . 3 TYR CA 1 1 5 677 1 1 3 TYR CB C -1.455 -3.774 -3.470 1.00 . A A . 3 TYR CB 1 1 5 678 1 1 3 TYR CD1 C -0.521 -1.437 -3.671 1.00 . A A . 3 TYR CD1 1 1 5 679 1 1 3 TYR CD2 C -1.758 -2.315 -5.509 1.00 . A A . 3 TYR CD2 1 1 5 680 1 1 3 TYR CE1 C -0.323 -0.257 -4.361 1.00 . A A . 3 TYR CE1 1 1 5 681 1 1 3 TYR CE2 C -1.564 -1.139 -6.207 1.00 . A A . 3 TYR CE2 1 1 5 682 1 1 3 TYR CG C -1.240 -2.485 -4.231 1.00 . A A . 3 TYR CG 1 1 5 683 1 1 3 TYR CZ C -0.846 -0.113 -5.629 1.00 . A A . 3 TYR CZ 1 1 5 684 1 1 3 TYR H H 0.284 -3.146 -1.722 1.00 . A A . 3 TYR H 1 1 5 685 1 1 3 TYR HA H -0.422 -5.535 -2.830 1.00 . A A . 3 TYR HA 1 1 5 686 1 1 3 TYR HB2 H -2.140 -4.384 -4.039 1.00 . A A . 3 TYR HB2 1 1 5 687 1 1 3 TYR HB3 H -1.903 -3.528 -2.519 1.00 . A A . 3 TYR HB3 1 1 5 688 1 1 3 TYR HD1 H -0.112 -1.553 -2.677 1.00 . A A . 3 TYR HD1 1 1 5 689 1 1 3 TYR HD2 H -2.321 -3.120 -5.958 1.00 . A A . 3 TYR HD2 1 1 5 690 1 1 3 TYR HE1 H 0.239 0.547 -3.909 1.00 . A A . 3 TYR HE1 1 1 5 691 1 1 3 TYR HE2 H -1.974 -1.026 -7.200 1.00 . A A . 3 TYR HE2 1 1 5 692 1 1 3 TYR HH H -0.542 1.784 -5.700 1.00 . A A . 3 TYR HH 1 1 5 693 1 1 3 TYR N N 0.666 -3.882 -2.244 1.00 . A A . 3 TYR N 1 1 5 694 1 1 3 TYR O O 0.466 -5.786 -5.197 1.00 . A A . 3 TYR O 1 1 5 695 1 1 3 TYR OH O -0.652 1.061 -6.321 1.00 . A A . 3 TYR OH 1 1 5 696 1 1 4 VAL C C 3.352 -4.692 -6.005 1.00 . A A . 4 VAL C 1 1 5 697 1 1 4 VAL CA C 2.132 -3.790 -6.157 1.00 . A A . 4 VAL CA 1 1 5 698 1 1 4 VAL CB C 2.596 -2.386 -6.588 1.00 . A A . 4 VAL CB 1 1 5 699 1 1 4 VAL CG1 C 1.476 -1.652 -7.310 1.00 . A A . 4 VAL CG1 1 1 5 700 1 1 4 VAL CG2 C 3.075 -1.591 -5.383 1.00 . A A . 4 VAL CG2 1 1 5 701 1 1 4 VAL H H 1.412 -2.939 -4.358 1.00 . A A . 4 VAL H 1 1 5 702 1 1 4 VAL HA H 1.495 -4.190 -6.933 1.00 . A A . 4 VAL HA 1 1 5 703 1 1 4 VAL HB H 3.424 -2.497 -7.273 1.00 . A A . 4 VAL HB 1 1 5 704 1 1 4 VAL HG11 H 1.732 -1.544 -8.354 1.00 . A A . 4 VAL HG11 1 1 5 705 1 1 4 VAL HG12 H 0.559 -2.215 -7.219 1.00 . A A . 4 VAL HG12 1 1 5 706 1 1 4 VAL HG13 H 1.344 -0.674 -6.870 1.00 . A A . 4 VAL HG13 1 1 5 707 1 1 4 VAL HG21 H 2.336 -0.848 -5.126 1.00 . A A . 4 VAL HG21 1 1 5 708 1 1 4 VAL HG22 H 3.222 -2.258 -4.546 1.00 . A A . 4 VAL HG22 1 1 5 709 1 1 4 VAL HG23 H 4.009 -1.103 -5.621 1.00 . A A . 4 VAL HG23 1 1 5 710 1 1 4 VAL N N 1.359 -3.739 -4.922 1.00 . A A . 4 VAL N 1 1 5 711 1 1 4 VAL O O 3.704 -5.437 -6.920 1.00 . A A . 4 VAL O 1 1 5 712 1 1 5 TYR C C 4.854 -6.916 -4.681 1.00 . A A . 5 TYR C 1 1 5 713 1 1 5 TYR CA C 5.175 -5.428 -4.572 1.00 . A A . 5 TYR CA 1 1 5 714 1 1 5 TYR CB C 5.723 -5.114 -3.179 1.00 . A A . 5 TYR CB 1 1 5 715 1 1 5 TYR CD1 C 5.821 -2.591 -3.188 1.00 . A A . 5 TYR CD1 1 1 5 716 1 1 5 TYR CD2 C 7.865 -3.795 -2.961 1.00 . A A . 5 TYR CD2 1 1 5 717 1 1 5 TYR CE1 C 6.511 -1.396 -3.124 1.00 . A A . 5 TYR CE1 1 1 5 718 1 1 5 TYR CE2 C 8.564 -2.605 -2.894 1.00 . A A . 5 TYR CE2 1 1 5 719 1 1 5 TYR CG C 6.484 -3.809 -3.108 1.00 . A A . 5 TYR CG 1 1 5 720 1 1 5 TYR CZ C 7.883 -1.408 -2.977 1.00 . A A . 5 TYR CZ 1 1 5 721 1 1 5 TYR H H 3.663 -4.007 -4.153 1.00 . A A . 5 TYR H 1 1 5 722 1 1 5 TYR HA H 5.924 -5.178 -5.308 1.00 . A A . 5 TYR HA 1 1 5 723 1 1 5 TYR HB2 H 4.903 -5.058 -2.480 1.00 . A A . 5 TYR HB2 1 1 5 724 1 1 5 TYR HB3 H 6.393 -5.906 -2.876 1.00 . A A . 5 TYR HB3 1 1 5 725 1 1 5 TYR HD1 H 4.746 -2.585 -3.303 1.00 . A A . 5 TYR HD1 1 1 5 726 1 1 5 TYR HD2 H 8.396 -4.734 -2.897 1.00 . A A . 5 TYR HD2 1 1 5 727 1 1 5 TYR HE1 H 5.978 -0.459 -3.188 1.00 . A A . 5 TYR HE1 1 1 5 728 1 1 5 TYR HE2 H 9.638 -2.614 -2.780 1.00 . A A . 5 TYR HE2 1 1 5 729 1 1 5 TYR HH H 9.181 -0.244 -2.168 1.00 . A A . 5 TYR HH 1 1 5 730 1 1 5 TYR N N 3.992 -4.620 -4.844 1.00 . A A . 5 TYR N 1 1 5 731 1 1 5 TYR O O 5.723 -7.728 -4.999 1.00 . A A . 5 TYR O 1 1 5 732 1 1 5 TYR OH O 8.575 -0.221 -2.913 1.00 . A A . 5 TYR OH 1 1 5 733 1 1 6 SER C C 2.662 -9.002 -5.878 1.00 . A A . 6 SER C 1 1 5 734 1 1 6 SER CA C 3.164 -8.655 -4.480 1.00 . A A . 6 SER CA 1 1 5 735 1 1 6 SER CB C 2.061 -8.914 -3.451 1.00 . A A . 6 SER CB 1 1 5 736 1 1 6 SER H H 2.953 -6.572 -4.167 1.00 . A A . 6 SER H 1 1 5 737 1 1 6 SER HA H 4.013 -9.281 -4.250 1.00 . A A . 6 SER HA 1 1 5 738 1 1 6 SER HB2 H 2.300 -8.399 -2.534 1.00 . A A . 6 SER HB2 1 1 5 739 1 1 6 SER HB3 H 1.120 -8.548 -3.836 1.00 . A A . 6 SER HB3 1 1 5 740 1 1 6 SER HG H 1.010 -10.512 -3.027 1.00 . A A . 6 SER HG 1 1 5 741 1 1 6 SER N N 3.600 -7.265 -4.415 1.00 . A A . 6 SER N 1 1 5 742 1 1 6 SER O O 2.737 -10.153 -6.309 1.00 . A A . 6 SER O 1 1 5 743 1 1 6 SER OG O 1.934 -10.299 -3.178 1.00 . A A . 6 SER OG 1 1 5 744 1 1 7 ARG C C 2.776 -8.320 -8.937 1.00 . A A . 7 ARG C 1 1 5 745 1 1 7 ARG CA C 1.635 -8.196 -7.932 1.00 . A A . 7 ARG CA 1 1 5 746 1 1 7 ARG CB C 0.717 -7.037 -8.326 1.00 . A A . 7 ARG CB 1 1 5 747 1 1 7 ARG CD C 0.160 -5.232 -9.983 1.00 . A A . 7 ARG CD 1 1 5 748 1 1 7 ARG CG C 1.087 -6.390 -9.650 1.00 . A A . 7 ARG CG 1 1 5 749 1 1 7 ARG CZ C -1.533 -6.155 -11.507 1.00 . A A . 7 ARG CZ 1 1 5 750 1 1 7 ARG H H 2.117 -7.103 -6.185 1.00 . A A . 7 ARG H 1 1 5 751 1 1 7 ARG HA H 1.064 -9.113 -7.938 1.00 . A A . 7 ARG HA 1 1 5 752 1 1 7 ARG HB2 H -0.296 -7.404 -8.400 1.00 . A A . 7 ARG HB2 1 1 5 753 1 1 7 ARG HB3 H 0.762 -6.282 -7.556 1.00 . A A . 7 ARG HB3 1 1 5 754 1 1 7 ARG HD2 H -0.611 -5.177 -9.229 1.00 . A A . 7 ARG HD2 1 1 5 755 1 1 7 ARG HD3 H 0.734 -4.317 -9.978 1.00 . A A . 7 ARG HD3 1 1 5 756 1 1 7 ARG HE H -0.075 -4.905 -12.046 1.00 . A A . 7 ARG HE 1 1 5 757 1 1 7 ARG HG2 H 2.100 -6.020 -9.589 1.00 . A A . 7 ARG HG2 1 1 5 758 1 1 7 ARG HG3 H 1.019 -7.131 -10.433 1.00 . A A . 7 ARG HG3 1 1 5 759 1 1 7 ARG HH11 H -1.701 -6.755 -9.586 1.00 . A A . 7 ARG HH11 1 1 5 760 1 1 7 ARG HH12 H -2.889 -7.399 -10.671 1.00 . A A . 7 ARG HH12 1 1 5 761 1 1 7 ARG HH21 H -1.632 -5.745 -13.484 1.00 . A A . 7 ARG HH21 1 1 5 762 1 1 7 ARG HH22 H -2.848 -6.824 -12.889 1.00 . A A . 7 ARG HH22 1 1 5 763 1 1 7 ARG N N 2.150 -7.998 -6.583 1.00 . A A . 7 ARG N 1 1 5 764 1 1 7 ARG NE N -0.468 -5.391 -11.291 1.00 . A A . 7 ARG NE 1 1 5 765 1 1 7 ARG NH1 N -2.086 -6.825 -10.506 1.00 . A A . 7 ARG NH1 1 1 5 766 1 1 7 ARG NH2 N -2.047 -6.249 -12.727 1.00 . A A . 7 ARG NH2 1 1 5 767 1 1 7 ARG O O 2.738 -9.161 -9.836 1.00 . A A . 7 ARG O 1 1 5 768 1 1 8 VAL C C 5.526 -8.894 -9.794 1.00 . A A . 8 VAL C 1 1 5 769 1 1 8 VAL CA C 4.943 -7.490 -9.673 1.00 . A A . 8 VAL CA 1 1 5 770 1 1 8 VAL CB C 6.043 -6.529 -9.185 1.00 . A A . 8 VAL CB 1 1 5 771 1 1 8 VAL CG1 C 7.273 -6.630 -10.075 1.00 . A A . 8 VAL CG1 1 1 5 772 1 1 8 VAL CG2 C 5.521 -5.101 -9.142 1.00 . A A . 8 VAL CG2 1 1 5 773 1 1 8 VAL H H 3.763 -6.828 -8.045 1.00 . A A . 8 VAL H 1 1 5 774 1 1 8 VAL HA H 4.614 -7.162 -10.648 1.00 . A A . 8 VAL HA 1 1 5 775 1 1 8 VAL HB H 6.326 -6.817 -8.183 1.00 . A A . 8 VAL HB 1 1 5 776 1 1 8 VAL HG11 H 7.722 -5.653 -10.179 1.00 . A A . 8 VAL HG11 1 1 5 777 1 1 8 VAL HG12 H 7.985 -7.309 -9.629 1.00 . A A . 8 VAL HG12 1 1 5 778 1 1 8 VAL HG13 H 6.984 -6.998 -11.048 1.00 . A A . 8 VAL HG13 1 1 5 779 1 1 8 VAL HG21 H 4.455 -5.103 -9.314 1.00 . A A . 8 VAL HG21 1 1 5 780 1 1 8 VAL HG22 H 5.729 -4.670 -8.174 1.00 . A A . 8 VAL HG22 1 1 5 781 1 1 8 VAL HG23 H 6.008 -4.516 -9.908 1.00 . A A . 8 VAL HG23 1 1 5 782 1 1 8 VAL N N 3.790 -7.476 -8.780 1.00 . A A . 8 VAL N 1 1 5 783 1 1 8 VAL O O 5.497 -9.500 -10.865 1.00 . A A . 8 VAL O 1 1 5 784 1 1 9 LYS C C 7.653 -10.905 -9.801 1.00 . A A . 9 LYS C 1 1 5 785 1 1 9 LYS CA C 6.646 -10.739 -8.668 1.00 . A A . 9 LYS CA 1 1 5 786 1 1 9 LYS CB C 5.553 -11.804 -8.782 1.00 . A A . 9 LYS CB 1 1 5 787 1 1 9 LYS CD C 6.400 -13.172 -6.854 1.00 . A A . 9 LYS CD 1 1 5 788 1 1 9 LYS CE C 5.990 -14.069 -5.696 1.00 . A A . 9 LYS CE 1 1 5 789 1 1 9 LYS CG C 5.202 -12.460 -7.458 1.00 . A A . 9 LYS CG 1 1 5 790 1 1 9 LYS H H 6.049 -8.873 -7.864 1.00 . A A . 9 LYS H 1 1 5 791 1 1 9 LYS HA H 7.158 -10.861 -7.726 1.00 . A A . 9 LYS HA 1 1 5 792 1 1 9 LYS HB2 H 4.660 -11.345 -9.181 1.00 . A A . 9 LYS HB2 1 1 5 793 1 1 9 LYS HB3 H 5.887 -12.573 -9.464 1.00 . A A . 9 LYS HB3 1 1 5 794 1 1 9 LYS HD2 H 6.870 -13.778 -7.614 1.00 . A A . 9 LYS HD2 1 1 5 795 1 1 9 LYS HD3 H 7.103 -12.434 -6.494 1.00 . A A . 9 LYS HD3 1 1 5 796 1 1 9 LYS HE2 H 5.207 -14.732 -6.031 1.00 . A A . 9 LYS HE2 1 1 5 797 1 1 9 LYS HE3 H 6.846 -14.651 -5.387 1.00 . A A . 9 LYS HE3 1 1 5 798 1 1 9 LYS HG2 H 4.863 -11.701 -6.769 1.00 . A A . 9 LYS HG2 1 1 5 799 1 1 9 LYS HG3 H 4.412 -13.179 -7.622 1.00 . A A . 9 LYS HG3 1 1 5 800 1 1 9 LYS HZ1 H 6.191 -13.307 -3.762 1.00 . A A . 9 LYS HZ1 1 1 5 801 1 1 9 LYS HZ2 H 4.598 -13.681 -4.188 1.00 . A A . 9 LYS HZ2 1 1 5 802 1 1 9 LYS HZ3 H 5.336 -12.293 -4.812 1.00 . A A . 9 LYS HZ3 1 1 5 803 1 1 9 LYS N N 6.056 -9.406 -8.688 1.00 . A A . 9 LYS N 1 1 5 804 1 1 9 LYS NZ N 5.494 -13.282 -4.533 1.00 . A A . 9 LYS NZ 1 1 5 805 1 1 9 LYS O O 8.118 -9.924 -10.381 1.00 . A A . 9 LYS O 1 1 6 806 1 1 1 THR C C 2.511 -1.353 -1.364 1.00 . A A . 1 THR C 1 1 6 807 1 1 1 THR CA C 1.992 0.022 -0.958 1.00 . A A . 1 THR CA 1 1 6 808 1 1 1 THR CB C 3.189 0.973 -0.767 1.00 . A A . 1 THR CB 1 1 6 809 1 1 1 THR CG2 C 3.524 1.690 -2.066 1.00 . A A . 1 THR CG2 1 1 6 810 1 1 1 THR H1 H 1.620 -0.115 1.121 1.00 . A A . 1 THR H1 1 1 6 811 1 1 1 THR HA H 1.373 0.412 -1.753 1.00 . A A . 1 THR HA 1 1 6 812 1 1 1 THR HB H 4.047 0.391 -0.462 1.00 . A A . 1 THR HB 1 1 6 813 1 1 1 THR HG1 H 3.564 1.894 0.937 1.00 . A A . 1 THR HG1 1 1 6 814 1 1 1 THR HG21 H 4.043 2.611 -1.846 1.00 . A A . 1 THR HG21 1 1 6 815 1 1 1 THR HG22 H 2.613 1.909 -2.602 1.00 . A A . 1 THR HG22 1 1 6 816 1 1 1 THR HG23 H 4.156 1.058 -2.672 1.00 . A A . 1 THR HG23 1 1 6 817 1 1 1 THR N N 1.179 -0.058 0.248 1.00 . A A . 1 THR N 1 1 6 818 1 1 1 THR O O 3.275 -1.482 -2.321 1.00 . A A . 1 THR O 1 1 6 819 1 1 1 THR OG1 O 2.892 1.935 0.252 1.00 . A A . 1 THR OG1 1 1 6 820 1 1 2 VAL C C 1.663 -4.360 -2.026 1.00 . A A . 2 VAL C 1 1 6 821 1 1 2 VAL CA C 2.509 -3.745 -0.917 1.00 . A A . 2 VAL CA 1 1 6 822 1 1 2 VAL CB C 2.416 -4.635 0.337 1.00 . A A . 2 VAL CB 1 1 6 823 1 1 2 VAL CG1 C 3.160 -5.944 0.120 1.00 . A A . 2 VAL CG1 1 1 6 824 1 1 2 VAL CG2 C 2.960 -3.899 1.553 1.00 . A A . 2 VAL CG2 1 1 6 825 1 1 2 VAL H H 1.480 -2.213 0.118 1.00 . A A . 2 VAL H 1 1 6 826 1 1 2 VAL HA H 3.541 -3.718 -1.237 1.00 . A A . 2 VAL HA 1 1 6 827 1 1 2 VAL HB H 1.376 -4.863 0.516 1.00 . A A . 2 VAL HB 1 1 6 828 1 1 2 VAL HG11 H 2.942 -6.620 0.934 1.00 . A A . 2 VAL HG11 1 1 6 829 1 1 2 VAL HG12 H 2.844 -6.387 -0.813 1.00 . A A . 2 VAL HG12 1 1 6 830 1 1 2 VAL HG13 H 4.222 -5.753 0.087 1.00 . A A . 2 VAL HG13 1 1 6 831 1 1 2 VAL HG21 H 2.886 -4.537 2.421 1.00 . A A . 2 VAL HG21 1 1 6 832 1 1 2 VAL HG22 H 3.995 -3.639 1.384 1.00 . A A . 2 VAL HG22 1 1 6 833 1 1 2 VAL HG23 H 2.385 -2.999 1.716 1.00 . A A . 2 VAL HG23 1 1 6 834 1 1 2 VAL N N 2.089 -2.379 -0.632 1.00 . A A . 2 VAL N 1 1 6 835 1 1 2 VAL O O 2.088 -5.304 -2.694 1.00 . A A . 2 VAL O 1 1 6 836 1 1 3 TYR C C 0.293 -4.527 -4.565 1.00 . A A . 3 TYR C 1 1 6 837 1 1 3 TYR CA C -0.442 -4.316 -3.245 1.00 . A A . 3 TYR CA 1 1 6 838 1 1 3 TYR CB C -1.603 -3.341 -3.445 1.00 . A A . 3 TYR CB 1 1 6 839 1 1 3 TYR CD1 C -1.672 -1.734 -5.392 1.00 . A A . 3 TYR CD1 1 1 6 840 1 1 3 TYR CD2 C -0.347 -1.150 -3.499 1.00 . A A . 3 TYR CD2 1 1 6 841 1 1 3 TYR CE1 C -1.306 -0.558 -6.017 1.00 . A A . 3 TYR CE1 1 1 6 842 1 1 3 TYR CE2 C 0.023 0.029 -4.115 1.00 . A A . 3 TYR CE2 1 1 6 843 1 1 3 TYR CG C -1.200 -2.051 -4.124 1.00 . A A . 3 TYR CG 1 1 6 844 1 1 3 TYR CZ C -0.459 0.321 -5.374 1.00 . A A . 3 TYR CZ 1 1 6 845 1 1 3 TYR H H 0.183 -3.070 -1.653 1.00 . A A . 3 TYR H 1 1 6 846 1 1 3 TYR HA H -0.836 -5.265 -2.910 1.00 . A A . 3 TYR HA 1 1 6 847 1 1 3 TYR HB2 H -2.360 -3.812 -4.052 1.00 . A A . 3 TYR HB2 1 1 6 848 1 1 3 TYR HB3 H -2.024 -3.091 -2.482 1.00 . A A . 3 TYR HB3 1 1 6 849 1 1 3 TYR HD1 H -2.335 -2.424 -5.893 1.00 . A A . 3 TYR HD1 1 1 6 850 1 1 3 TYR HD2 H 0.029 -1.382 -2.512 1.00 . A A . 3 TYR HD2 1 1 6 851 1 1 3 TYR HE1 H -1.683 -0.328 -7.003 1.00 . A A . 3 TYR HE1 1 1 6 852 1 1 3 TYR HE2 H 0.687 0.717 -3.612 1.00 . A A . 3 TYR HE2 1 1 6 853 1 1 3 TYR HH H 0.864 1.523 -6.081 1.00 . A A . 3 TYR HH 1 1 6 854 1 1 3 TYR N N 0.465 -3.820 -2.218 1.00 . A A . 3 TYR N 1 1 6 855 1 1 3 TYR O O 0.038 -5.494 -5.284 1.00 . A A . 3 TYR O 1 1 6 856 1 1 3 TYR OH O -0.092 1.494 -5.992 1.00 . A A . 3 TYR OH 1 1 6 857 1 1 4 VAL C C 3.060 -4.772 -6.009 1.00 . A A . 4 VAL C 1 1 6 858 1 1 4 VAL CA C 1.982 -3.699 -6.111 1.00 . A A . 4 VAL CA 1 1 6 859 1 1 4 VAL CB C 2.645 -2.351 -6.451 1.00 . A A . 4 VAL CB 1 1 6 860 1 1 4 VAL CG1 C 1.650 -1.424 -7.133 1.00 . A A . 4 VAL CG1 1 1 6 861 1 1 4 VAL CG2 C 3.214 -1.706 -5.197 1.00 . A A . 4 VAL CG2 1 1 6 862 1 1 4 VAL H H 1.365 -2.866 -4.265 1.00 . A A . 4 VAL H 1 1 6 863 1 1 4 VAL HA H 1.306 -3.957 -6.913 1.00 . A A . 4 VAL HA 1 1 6 864 1 1 4 VAL HB H 3.458 -2.536 -7.137 1.00 . A A . 4 VAL HB 1 1 6 865 1 1 4 VAL HG11 H 1.650 -0.467 -6.633 1.00 . A A . 4 VAL HG11 1 1 6 866 1 1 4 VAL HG12 H 1.931 -1.292 -8.167 1.00 . A A . 4 VAL HG12 1 1 6 867 1 1 4 VAL HG13 H 0.661 -1.856 -7.080 1.00 . A A . 4 VAL HG13 1 1 6 868 1 1 4 VAL HG21 H 4.209 -1.339 -5.401 1.00 . A A . 4 VAL HG21 1 1 6 869 1 1 4 VAL HG22 H 2.582 -0.883 -4.896 1.00 . A A . 4 VAL HG22 1 1 6 870 1 1 4 VAL HG23 H 3.255 -2.436 -4.403 1.00 . A A . 4 VAL HG23 1 1 6 871 1 1 4 VAL N N 1.207 -3.614 -4.878 1.00 . A A . 4 VAL N 1 1 6 872 1 1 4 VAL O O 3.317 -5.502 -6.967 1.00 . A A . 4 VAL O 1 1 6 873 1 1 5 TYR C C 4.215 -7.263 -4.811 1.00 . A A . 5 TYR C 1 1 6 874 1 1 5 TYR CA C 4.742 -5.845 -4.615 1.00 . A A . 5 TYR CA 1 1 6 875 1 1 5 TYR CB C 5.315 -5.692 -3.205 1.00 . A A . 5 TYR CB 1 1 6 876 1 1 5 TYR CD1 C 7.619 -4.702 -2.909 1.00 . A A . 5 TYR CD1 1 1 6 877 1 1 5 TYR CD2 C 5.765 -3.212 -3.063 1.00 . A A . 5 TYR CD2 1 1 6 878 1 1 5 TYR CE1 C 8.477 -3.628 -2.772 1.00 . A A . 5 TYR CE1 1 1 6 879 1 1 5 TYR CE2 C 6.616 -2.132 -2.928 1.00 . A A . 5 TYR CE2 1 1 6 880 1 1 5 TYR CG C 6.250 -4.513 -3.057 1.00 . A A . 5 TYR CG 1 1 6 881 1 1 5 TYR CZ C 7.971 -2.345 -2.783 1.00 . A A . 5 TYR CZ 1 1 6 882 1 1 5 TYR H H 3.440 -4.253 -4.116 1.00 . A A . 5 TYR H 1 1 6 883 1 1 5 TYR HA H 5.527 -5.662 -5.334 1.00 . A A . 5 TYR HA 1 1 6 884 1 1 5 TYR HB2 H 4.504 -5.562 -2.506 1.00 . A A . 5 TYR HB2 1 1 6 885 1 1 5 TYR HB3 H 5.865 -6.586 -2.949 1.00 . A A . 5 TYR HB3 1 1 6 886 1 1 5 TYR HD1 H 8.013 -5.708 -2.901 1.00 . A A . 5 TYR HD1 1 1 6 887 1 1 5 TYR HD2 H 4.703 -3.048 -3.176 1.00 . A A . 5 TYR HD2 1 1 6 888 1 1 5 TYR HE1 H 9.538 -3.794 -2.658 1.00 . A A . 5 TYR HE1 1 1 6 889 1 1 5 TYR HE2 H 6.220 -1.127 -2.936 1.00 . A A . 5 TYR HE2 1 1 6 890 1 1 5 TYR HH H 9.658 -1.570 -2.281 1.00 . A A . 5 TYR HH 1 1 6 891 1 1 5 TYR N N 3.689 -4.862 -4.842 1.00 . A A . 5 TYR N 1 1 6 892 1 1 5 TYR O O 4.964 -8.173 -5.167 1.00 . A A . 5 TYR O 1 1 6 893 1 1 5 TYR OH O 8.822 -1.272 -2.646 1.00 . A A . 5 TYR OH 1 1 6 894 1 1 6 SER C C 1.759 -8.942 -6.140 1.00 . A A . 6 SER C 1 1 6 895 1 1 6 SER CA C 2.290 -8.751 -4.723 1.00 . A A . 6 SER CA 1 1 6 896 1 1 6 SER CB C 1.152 -8.910 -3.713 1.00 . A A . 6 SER CB 1 1 6 897 1 1 6 SER H H 2.374 -6.680 -4.294 1.00 . A A . 6 SER H 1 1 6 898 1 1 6 SER HA H 3.040 -9.504 -4.527 1.00 . A A . 6 SER HA 1 1 6 899 1 1 6 SER HB2 H 1.252 -8.162 -2.941 1.00 . A A . 6 SER HB2 1 1 6 900 1 1 6 SER HB3 H 0.206 -8.781 -4.219 1.00 . A A . 6 SER HB3 1 1 6 901 1 1 6 SER HG H 1.860 -10.216 -2.437 1.00 . A A . 6 SER HG 1 1 6 902 1 1 6 SER N N 2.919 -7.444 -4.576 1.00 . A A . 6 SER N 1 1 6 903 1 1 6 SER O O 1.652 -10.068 -6.628 1.00 . A A . 6 SER O 1 1 6 904 1 1 6 SER OG O 1.178 -10.193 -3.112 1.00 . A A . 6 SER OG 1 1 6 905 1 1 7 ARG C C 2.032 -8.088 -9.163 1.00 . A A . 7 ARG C 1 1 6 906 1 1 7 ARG CA C 0.906 -7.879 -8.156 1.00 . A A . 7 ARG CA 1 1 6 907 1 1 7 ARG CB C 0.152 -6.587 -8.478 1.00 . A A . 7 ARG CB 1 1 6 908 1 1 7 ARG CD C -0.051 -6.905 -10.963 1.00 . A A . 7 ARG CD 1 1 6 909 1 1 7 ARG CG C 0.479 -6.017 -9.848 1.00 . A A . 7 ARG CG 1 1 6 910 1 1 7 ARG CZ C -1.679 -6.786 -12.801 1.00 . A A . 7 ARG CZ 1 1 6 911 1 1 7 ARG H H 1.536 -6.967 -6.353 1.00 . A A . 7 ARG H 1 1 6 912 1 1 7 ARG HA H 0.221 -8.711 -8.222 1.00 . A A . 7 ARG HA 1 1 6 913 1 1 7 ARG HB2 H -0.909 -6.784 -8.438 1.00 . A A . 7 ARG HB2 1 1 6 914 1 1 7 ARG HB3 H 0.401 -5.845 -7.734 1.00 . A A . 7 ARG HB3 1 1 6 915 1 1 7 ARG HD2 H 0.762 -7.146 -11.631 1.00 . A A . 7 ARG HD2 1 1 6 916 1 1 7 ARG HD3 H -0.439 -7.814 -10.526 1.00 . A A . 7 ARG HD3 1 1 6 917 1 1 7 ARG HE H -1.419 -5.375 -11.416 1.00 . A A . 7 ARG HE 1 1 6 918 1 1 7 ARG HG2 H 0.030 -5.039 -9.938 1.00 . A A . 7 ARG HG2 1 1 6 919 1 1 7 ARG HG3 H 1.551 -5.933 -9.946 1.00 . A A . 7 ARG HG3 1 1 6 920 1 1 7 ARG HH11 H -0.562 -8.469 -12.762 1.00 . A A . 7 ARG HH11 1 1 6 921 1 1 7 ARG HH12 H -1.714 -8.373 -14.053 1.00 . A A . 7 ARG HH12 1 1 6 922 1 1 7 ARG HH21 H -2.939 -5.236 -13.111 1.00 . A A . 7 ARG HH21 1 1 6 923 1 1 7 ARG HH22 H -3.064 -6.533 -14.251 1.00 . A A . 7 ARG HH22 1 1 6 924 1 1 7 ARG N N 1.427 -7.835 -6.795 1.00 . A A . 7 ARG N 1 1 6 925 1 1 7 ARG NE N -1.113 -6.253 -11.724 1.00 . A A . 7 ARG NE 1 1 6 926 1 1 7 ARG NH1 N -1.286 -7.973 -13.242 1.00 . A A . 7 ARG NH1 1 1 6 927 1 1 7 ARG NH2 N -2.639 -6.131 -13.441 1.00 . A A . 7 ARG NH2 1 1 6 928 1 1 7 ARG O O 1.881 -8.827 -10.136 1.00 . A A . 7 ARG O 1 1 6 929 1 1 8 VAL C C 4.701 -9.004 -10.025 1.00 . A A . 8 VAL C 1 1 6 930 1 1 8 VAL CA C 4.316 -7.545 -9.810 1.00 . A A . 8 VAL CA 1 1 6 931 1 1 8 VAL CB C 5.531 -6.781 -9.250 1.00 . A A . 8 VAL CB 1 1 6 932 1 1 8 VAL CG1 C 6.754 -7.010 -10.125 1.00 . A A . 8 VAL CG1 1 1 6 933 1 1 8 VAL CG2 C 5.219 -5.297 -9.133 1.00 . A A . 8 VAL CG2 1 1 6 934 1 1 8 VAL H H 3.224 -6.856 -8.132 1.00 . A A . 8 VAL H 1 1 6 935 1 1 8 VAL HA H 4.050 -7.109 -10.762 1.00 . A A . 8 VAL HA 1 1 6 936 1 1 8 VAL HB H 5.746 -7.162 -8.263 1.00 . A A . 8 VAL HB 1 1 6 937 1 1 8 VAL HG11 H 6.443 -7.142 -11.151 1.00 . A A . 8 VAL HG11 1 1 6 938 1 1 8 VAL HG12 H 7.412 -6.156 -10.055 1.00 . A A . 8 VAL HG12 1 1 6 939 1 1 8 VAL HG13 H 7.275 -7.895 -9.791 1.00 . A A . 8 VAL HG13 1 1 6 940 1 1 8 VAL HG21 H 4.166 -5.136 -9.309 1.00 . A A . 8 VAL HG21 1 1 6 941 1 1 8 VAL HG22 H 5.474 -4.953 -8.141 1.00 . A A . 8 VAL HG22 1 1 6 942 1 1 8 VAL HG23 H 5.795 -4.749 -9.863 1.00 . A A . 8 VAL HG23 1 1 6 943 1 1 8 VAL N N 3.163 -7.431 -8.924 1.00 . A A . 8 VAL N 1 1 6 944 1 1 8 VAL O O 4.608 -9.525 -11.136 1.00 . A A . 8 VAL O 1 1 6 945 1 1 9 LYS C C 4.318 -11.977 -8.935 1.00 . A A . 9 LYS C 1 1 6 946 1 1 9 LYS CA C 5.534 -11.061 -9.023 1.00 . A A . 9 LYS CA 1 1 6 947 1 1 9 LYS CB C 6.516 -11.389 -7.897 1.00 . A A . 9 LYS CB 1 1 6 948 1 1 9 LYS CD C 6.969 -10.584 -5.561 1.00 . A A . 9 LYS CD 1 1 6 949 1 1 9 LYS CE C 7.907 -11.649 -5.014 1.00 . A A . 9 LYS CE 1 1 6 950 1 1 9 LYS CG C 5.940 -11.180 -6.507 1.00 . A A . 9 LYS CG 1 1 6 951 1 1 9 LYS H H 5.187 -9.190 -8.095 1.00 . A A . 9 LYS H 1 1 6 952 1 1 9 LYS HA H 6.021 -11.220 -9.973 1.00 . A A . 9 LYS HA 1 1 6 953 1 1 9 LYS HB2 H 6.817 -12.422 -7.987 1.00 . A A . 9 LYS HB2 1 1 6 954 1 1 9 LYS HB3 H 7.388 -10.759 -8.001 1.00 . A A . 9 LYS HB3 1 1 6 955 1 1 9 LYS HD2 H 7.551 -9.847 -6.094 1.00 . A A . 9 LYS HD2 1 1 6 956 1 1 9 LYS HD3 H 6.455 -10.111 -4.736 1.00 . A A . 9 LYS HD3 1 1 6 957 1 1 9 LYS HE2 H 7.605 -11.892 -4.007 1.00 . A A . 9 LYS HE2 1 1 6 958 1 1 9 LYS HE3 H 7.831 -12.529 -5.635 1.00 . A A . 9 LYS HE3 1 1 6 959 1 1 9 LYS HG2 H 5.097 -10.508 -6.574 1.00 . A A . 9 LYS HG2 1 1 6 960 1 1 9 LYS HG3 H 5.614 -12.133 -6.115 1.00 . A A . 9 LYS HG3 1 1 6 961 1 1 9 LYS HZ1 H 9.962 -11.990 -5.165 1.00 . A A . 9 LYS HZ1 1 1 6 962 1 1 9 LYS HZ2 H 9.550 -10.764 -4.076 1.00 . A A . 9 LYS HZ2 1 1 6 963 1 1 9 LYS HZ3 H 9.474 -10.476 -5.742 1.00 . A A . 9 LYS HZ3 1 1 6 964 1 1 9 LYS N N 5.135 -9.660 -8.954 1.00 . A A . 9 LYS N 1 1 6 965 1 1 9 LYS NZ N 9.322 -11.187 -4.998 1.00 . A A . 9 LYS NZ 1 1 6 966 1 1 9 LYS O O 4.419 -13.117 -8.480 1.00 . A A . 9 LYS O 1 1 7 967 1 1 1 THR C C 2.959 -1.177 -1.702 1.00 . A A . 1 THR C 1 1 7 968 1 1 1 THR CA C 2.525 0.240 -1.345 1.00 . A A . 1 THR CA 1 1 7 969 1 1 1 THR CB C 1.047 0.219 -0.911 1.00 . A A . 1 THR CB 1 1 7 970 1 1 1 THR CG2 C 0.923 0.392 0.595 1.00 . A A . 1 THR CG2 1 1 7 971 1 1 1 THR H1 H 2.304 0.968 -3.320 1.00 . A A . 1 THR H1 1 1 7 972 1 1 1 THR HA H 3.118 0.588 -0.511 1.00 . A A . 1 THR HA 1 1 7 973 1 1 1 THR HB H 0.621 -0.735 -1.186 1.00 . A A . 1 THR HB 1 1 7 974 1 1 1 THR HG1 H -0.448 0.891 -2.008 1.00 . A A . 1 THR HG1 1 1 7 975 1 1 1 THR HG21 H 1.197 -0.529 1.087 1.00 . A A . 1 THR HG21 1 1 7 976 1 1 1 THR HG22 H -0.097 0.644 0.845 1.00 . A A . 1 THR HG22 1 1 7 977 1 1 1 THR HG23 H 1.580 1.184 0.921 1.00 . A A . 1 THR HG23 1 1 7 978 1 1 1 THR N N 2.739 1.152 -2.461 1.00 . A A . 1 THR N 1 1 7 979 1 1 1 THR O O 3.612 -1.399 -2.722 1.00 . A A . 1 THR O 1 1 7 980 1 1 1 THR OG1 O 0.327 1.261 -1.578 1.00 . A A . 1 THR OG1 1 1 7 981 1 1 2 VAL C C 1.970 -4.188 -2.062 1.00 . A A . 2 VAL C 1 1 7 982 1 1 2 VAL CA C 2.939 -3.532 -1.085 1.00 . A A . 2 VAL CA 1 1 7 983 1 1 2 VAL CB C 2.944 -4.331 0.232 1.00 . A A . 2 VAL CB 1 1 7 984 1 1 2 VAL CG1 C 3.609 -5.685 0.033 1.00 . A A . 2 VAL CG1 1 1 7 985 1 1 2 VAL CG2 C 3.639 -3.543 1.331 1.00 . A A . 2 VAL CG2 1 1 7 986 1 1 2 VAL H H 2.070 -1.896 -0.061 1.00 . A A . 2 VAL H 1 1 7 987 1 1 2 VAL HA H 3.934 -3.563 -1.504 1.00 . A A . 2 VAL HA 1 1 7 988 1 1 2 VAL HB H 1.919 -4.499 0.531 1.00 . A A . 2 VAL HB 1 1 7 989 1 1 2 VAL HG11 H 3.107 -6.219 -0.761 1.00 . A A . 2 VAL HG11 1 1 7 990 1 1 2 VAL HG12 H 4.647 -5.541 -0.229 1.00 . A A . 2 VAL HG12 1 1 7 991 1 1 2 VAL HG13 H 3.544 -6.256 0.947 1.00 . A A . 2 VAL HG13 1 1 7 992 1 1 2 VAL HG21 H 3.126 -2.604 1.480 1.00 . A A . 2 VAL HG21 1 1 7 993 1 1 2 VAL HG22 H 3.621 -4.112 2.250 1.00 . A A . 2 VAL HG22 1 1 7 994 1 1 2 VAL HG23 H 4.663 -3.353 1.046 1.00 . A A . 2 VAL HG23 1 1 7 995 1 1 2 VAL N N 2.590 -2.135 -0.857 1.00 . A A . 2 VAL N 1 1 7 996 1 1 2 VAL O O 2.275 -5.224 -2.653 1.00 . A A . 2 VAL O 1 1 7 997 1 1 3 TYR C C 0.393 -4.460 -4.484 1.00 . A A . 3 TYR C 1 1 7 998 1 1 3 TYR CA C -0.214 -4.105 -3.130 1.00 . A A . 3 TYR CA 1 1 7 999 1 1 3 TYR CB C -1.340 -3.085 -3.315 1.00 . A A . 3 TYR CB 1 1 7 1000 1 1 3 TYR CD1 C -0.001 -1.079 -4.062 1.00 . A A . 3 TYR CD1 1 1 7 1001 1 1 3 TYR CD2 C -1.718 -1.886 -5.505 1.00 . A A . 3 TYR CD2 1 1 7 1002 1 1 3 TYR CE1 C 0.300 -0.082 -4.970 1.00 . A A . 3 TYR CE1 1 1 7 1003 1 1 3 TYR CE2 C -1.422 -0.894 -6.419 1.00 . A A . 3 TYR CE2 1 1 7 1004 1 1 3 TYR CG C -1.014 -1.997 -4.312 1.00 . A A . 3 TYR CG 1 1 7 1005 1 1 3 TYR CZ C -0.413 0.006 -6.147 1.00 . A A . 3 TYR CZ 1 1 7 1006 1 1 3 TYR H H 0.616 -2.756 -1.726 1.00 . A A . 3 TYR H 1 1 7 1007 1 1 3 TYR HA H -0.623 -5.000 -2.686 1.00 . A A . 3 TYR HA 1 1 7 1008 1 1 3 TYR HB2 H -2.226 -3.596 -3.660 1.00 . A A . 3 TYR HB2 1 1 7 1009 1 1 3 TYR HB3 H -1.549 -2.614 -2.366 1.00 . A A . 3 TYR HB3 1 1 7 1010 1 1 3 TYR HD1 H 0.555 -1.150 -3.138 1.00 . A A . 3 TYR HD1 1 1 7 1011 1 1 3 TYR HD2 H -2.508 -2.592 -5.715 1.00 . A A . 3 TYR HD2 1 1 7 1012 1 1 3 TYR HE1 H 1.091 0.622 -4.757 1.00 . A A . 3 TYR HE1 1 1 7 1013 1 1 3 TYR HE2 H -1.981 -0.824 -7.341 1.00 . A A . 3 TYR HE2 1 1 7 1014 1 1 3 TYR HH H 0.791 1.285 -6.929 1.00 . A A . 3 TYR HH 1 1 7 1015 1 1 3 TYR N N 0.801 -3.579 -2.226 1.00 . A A . 3 TYR N 1 1 7 1016 1 1 3 TYR O O -0.040 -5.405 -5.143 1.00 . A A . 3 TYR O 1 1 7 1017 1 1 3 TYR OH O -0.116 0.997 -7.055 1.00 . A A . 3 TYR OH 1 1 7 1018 1 1 4 VAL C C 3.093 -5.050 -6.053 1.00 . A A . 4 VAL C 1 1 7 1019 1 1 4 VAL CA C 2.068 -3.927 -6.167 1.00 . A A . 4 VAL CA 1 1 7 1020 1 1 4 VAL CB C 2.773 -2.653 -6.673 1.00 . A A . 4 VAL CB 1 1 7 1021 1 1 4 VAL CG1 C 1.792 -1.760 -7.417 1.00 . A A . 4 VAL CG1 1 1 7 1022 1 1 4 VAL CG2 C 3.415 -1.905 -5.514 1.00 . A A . 4 VAL CG2 1 1 7 1023 1 1 4 VAL H H 1.699 -2.955 -4.324 1.00 . A A . 4 VAL H 1 1 7 1024 1 1 4 VAL HA H 1.318 -4.209 -6.892 1.00 . A A . 4 VAL HA 1 1 7 1025 1 1 4 VAL HB H 3.552 -2.946 -7.361 1.00 . A A . 4 VAL HB 1 1 7 1026 1 1 4 VAL HG11 H 2.004 -1.797 -8.475 1.00 . A A . 4 VAL HG11 1 1 7 1027 1 1 4 VAL HG12 H 0.784 -2.104 -7.238 1.00 . A A . 4 VAL HG12 1 1 7 1028 1 1 4 VAL HG13 H 1.893 -0.744 -7.066 1.00 . A A . 4 VAL HG13 1 1 7 1029 1 1 4 VAL HG21 H 3.567 -2.584 -4.689 1.00 . A A . 4 VAL HG21 1 1 7 1030 1 1 4 VAL HG22 H 4.366 -1.502 -5.829 1.00 . A A . 4 VAL HG22 1 1 7 1031 1 1 4 VAL HG23 H 2.768 -1.099 -5.203 1.00 . A A . 4 VAL HG23 1 1 7 1032 1 1 4 VAL N N 1.399 -3.694 -4.893 1.00 . A A . 4 VAL N 1 1 7 1033 1 1 4 VAL O O 3.241 -5.864 -6.964 1.00 . A A . 4 VAL O 1 1 7 1034 1 1 5 TYR C C 4.196 -7.505 -4.733 1.00 . A A . 5 TYR C 1 1 7 1035 1 1 5 TYR CA C 4.811 -6.109 -4.693 1.00 . A A . 5 TYR CA 1 1 7 1036 1 1 5 TYR CB C 5.495 -5.880 -3.345 1.00 . A A . 5 TYR CB 1 1 7 1037 1 1 5 TYR CD1 C 6.043 -3.416 -3.265 1.00 . A A . 5 TYR CD1 1 1 7 1038 1 1 5 TYR CD2 C 7.846 -4.964 -3.450 1.00 . A A . 5 TYR CD2 1 1 7 1039 1 1 5 TYR CE1 C 6.939 -2.364 -3.273 1.00 . A A . 5 TYR CE1 1 1 7 1040 1 1 5 TYR CE2 C 8.749 -3.919 -3.457 1.00 . A A . 5 TYR CE2 1 1 7 1041 1 1 5 TYR CG C 6.480 -4.732 -3.353 1.00 . A A . 5 TYR CG 1 1 7 1042 1 1 5 TYR CZ C 8.291 -2.621 -3.368 1.00 . A A . 5 TYR CZ 1 1 7 1043 1 1 5 TYR H H 3.634 -4.410 -4.238 1.00 . A A . 5 TYR H 1 1 7 1044 1 1 5 TYR HA H 5.549 -6.031 -5.478 1.00 . A A . 5 TYR HA 1 1 7 1045 1 1 5 TYR HB2 H 4.745 -5.666 -2.600 1.00 . A A . 5 TYR HB2 1 1 7 1046 1 1 5 TYR HB3 H 6.030 -6.775 -3.064 1.00 . A A . 5 TYR HB3 1 1 7 1047 1 1 5 TYR HD1 H 4.984 -3.218 -3.190 1.00 . A A . 5 TYR HD1 1 1 7 1048 1 1 5 TYR HD2 H 8.202 -5.982 -3.520 1.00 . A A . 5 TYR HD2 1 1 7 1049 1 1 5 TYR HE1 H 6.581 -1.348 -3.203 1.00 . A A . 5 TYR HE1 1 1 7 1050 1 1 5 TYR HE2 H 9.808 -4.120 -3.532 1.00 . A A . 5 TYR HE2 1 1 7 1051 1 1 5 TYR HH H 8.744 -0.777 -3.667 1.00 . A A . 5 TYR HH 1 1 7 1052 1 1 5 TYR N N 3.798 -5.087 -4.927 1.00 . A A . 5 TYR N 1 1 7 1053 1 1 5 TYR O O 4.868 -8.483 -5.061 1.00 . A A . 5 TYR O 1 1 7 1054 1 1 5 TYR OH O 9.188 -1.577 -3.376 1.00 . A A . 5 TYR OH 1 1 7 1055 1 1 6 SER C C 1.551 -9.129 -5.744 1.00 . A A . 6 SER C 1 1 7 1056 1 1 6 SER CA C 2.205 -8.864 -4.392 1.00 . A A . 6 SER CA 1 1 7 1057 1 1 6 SER CB C 1.146 -8.879 -3.288 1.00 . A A . 6 SER CB 1 1 7 1058 1 1 6 SER H H 2.430 -6.773 -4.146 1.00 . A A . 6 SER H 1 1 7 1059 1 1 6 SER HA H 2.928 -9.642 -4.195 1.00 . A A . 6 SER HA 1 1 7 1060 1 1 6 SER HB2 H 1.557 -8.440 -2.392 1.00 . A A . 6 SER HB2 1 1 7 1061 1 1 6 SER HB3 H 0.288 -8.305 -3.609 1.00 . A A . 6 SER HB3 1 1 7 1062 1 1 6 SER HG H 1.483 -10.793 -3.044 1.00 . A A . 6 SER HG 1 1 7 1063 1 1 6 SER N N 2.912 -7.589 -4.398 1.00 . A A . 6 SER N 1 1 7 1064 1 1 6 SER O O 1.359 -10.280 -6.138 1.00 . A A . 6 SER O 1 1 7 1065 1 1 6 SER OG O 0.728 -10.202 -3.000 1.00 . A A . 6 SER OG 1 1 7 1066 1 1 7 ARG C C 1.602 -8.539 -8.828 1.00 . A A . 7 ARG C 1 1 7 1067 1 1 7 ARG CA C 0.578 -8.171 -7.758 1.00 . A A . 7 ARG CA 1 1 7 1068 1 1 7 ARG CB C -0.115 -6.859 -8.131 1.00 . A A . 7 ARG CB 1 1 7 1069 1 1 7 ARG CD C -0.412 -5.009 -9.806 1.00 . A A . 7 ARG CD 1 1 7 1070 1 1 7 ARG CG C 0.286 -6.324 -9.496 1.00 . A A . 7 ARG CG 1 1 7 1071 1 1 7 ARG CZ C -0.629 -5.086 -12.253 1.00 . A A . 7 ARG CZ 1 1 7 1072 1 1 7 ARG H H 1.391 -7.165 -6.083 1.00 . A A . 7 ARG H 1 1 7 1073 1 1 7 ARG HA H -0.162 -8.955 -7.701 1.00 . A A . 7 ARG HA 1 1 7 1074 1 1 7 ARG HB2 H -1.183 -7.017 -8.130 1.00 . A A . 7 ARG HB2 1 1 7 1075 1 1 7 ARG HB3 H 0.131 -6.114 -7.390 1.00 . A A . 7 ARG HB3 1 1 7 1076 1 1 7 ARG HD2 H -1.080 -4.771 -8.992 1.00 . A A . 7 ARG HD2 1 1 7 1077 1 1 7 ARG HD3 H 0.334 -4.235 -9.898 1.00 . A A . 7 ARG HD3 1 1 7 1078 1 1 7 ARG HE H -2.157 -5.117 -10.972 1.00 . A A . 7 ARG HE 1 1 7 1079 1 1 7 ARG HG2 H 1.354 -6.164 -9.510 1.00 . A A . 7 ARG HG2 1 1 7 1080 1 1 7 ARG HG3 H 0.019 -7.051 -10.249 1.00 . A A . 7 ARG HG3 1 1 7 1081 1 1 7 ARG HH11 H 1.270 -4.986 -11.571 1.00 . A A . 7 ARG HH11 1 1 7 1082 1 1 7 ARG HH12 H 1.102 -5.041 -13.295 1.00 . A A . 7 ARG HH12 1 1 7 1083 1 1 7 ARG HH21 H -2.390 -5.190 -13.240 1.00 . A A . 7 ARG HH21 1 1 7 1084 1 1 7 ARG HH22 H -0.980 -5.157 -14.243 1.00 . A A . 7 ARG HH22 1 1 7 1085 1 1 7 ARG N N 1.212 -8.056 -6.451 1.00 . A A . 7 ARG N 1 1 7 1086 1 1 7 ARG NE N -1.181 -5.077 -11.045 1.00 . A A . 7 ARG NE 1 1 7 1087 1 1 7 ARG NH1 N 0.689 -5.033 -12.384 1.00 . A A . 7 ARG NH1 1 1 7 1088 1 1 7 ARG NH2 N -1.396 -5.150 -13.334 1.00 . A A . 7 ARG NH2 1 1 7 1089 1 1 7 ARG O O 1.338 -9.372 -9.696 1.00 . A A . 7 ARG O 1 1 7 1090 1 1 8 VAL C C 4.124 -9.667 -9.831 1.00 . A A . 8 VAL C 1 1 7 1091 1 1 8 VAL CA C 3.837 -8.174 -9.722 1.00 . A A . 8 VAL CA 1 1 7 1092 1 1 8 VAL CB C 5.135 -7.440 -9.336 1.00 . A A . 8 VAL CB 1 1 7 1093 1 1 8 VAL CG1 C 6.261 -7.810 -10.289 1.00 . A A . 8 VAL CG1 1 1 7 1094 1 1 8 VAL CG2 C 4.911 -5.935 -9.321 1.00 . A A . 8 VAL CG2 1 1 7 1095 1 1 8 VAL H H 2.924 -7.259 -8.045 1.00 . A A . 8 VAL H 1 1 7 1096 1 1 8 VAL HA H 3.513 -7.808 -10.685 1.00 . A A . 8 VAL HA 1 1 7 1097 1 1 8 VAL HB H 5.418 -7.750 -8.341 1.00 . A A . 8 VAL HB 1 1 7 1098 1 1 8 VAL HG11 H 5.851 -8.017 -11.267 1.00 . A A . 8 VAL HG11 1 1 7 1099 1 1 8 VAL HG12 H 6.960 -6.989 -10.357 1.00 . A A . 8 VAL HG12 1 1 7 1100 1 1 8 VAL HG13 H 6.771 -8.688 -9.920 1.00 . A A . 8 VAL HG13 1 1 7 1101 1 1 8 VAL HG21 H 3.855 -5.730 -9.220 1.00 . A A . 8 VAL HG21 1 1 7 1102 1 1 8 VAL HG22 H 5.443 -5.499 -8.489 1.00 . A A . 8 VAL HG22 1 1 7 1103 1 1 8 VAL HG23 H 5.274 -5.507 -10.244 1.00 . A A . 8 VAL HG23 1 1 7 1104 1 1 8 VAL N N 2.773 -7.913 -8.760 1.00 . A A . 8 VAL N 1 1 7 1105 1 1 8 VAL O O 3.906 -10.278 -10.877 1.00 . A A . 8 VAL O 1 1 7 1106 1 1 9 LYS C C 3.873 -12.451 -7.937 1.00 . A A . 9 LYS C 1 1 7 1107 1 1 9 LYS CA C 4.931 -11.674 -8.714 1.00 . A A . 9 LYS CA 1 1 7 1108 1 1 9 LYS CB C 6.308 -11.899 -8.084 1.00 . A A . 9 LYS CB 1 1 7 1109 1 1 9 LYS CD C 7.785 -10.969 -6.278 1.00 . A A . 9 LYS CD 1 1 7 1110 1 1 9 LYS CE C 7.900 -10.641 -4.797 1.00 . A A . 9 LYS CE 1 1 7 1111 1 1 9 LYS CG C 6.392 -11.461 -6.632 1.00 . A A . 9 LYS CG 1 1 7 1112 1 1 9 LYS H H 4.767 -9.711 -7.938 1.00 . A A . 9 LYS H 1 1 7 1113 1 1 9 LYS HA H 4.947 -12.031 -9.732 1.00 . A A . 9 LYS HA 1 1 7 1114 1 1 9 LYS HB2 H 6.547 -12.951 -8.136 1.00 . A A . 9 LYS HB2 1 1 7 1115 1 1 9 LYS HB3 H 7.043 -11.343 -8.649 1.00 . A A . 9 LYS HB3 1 1 7 1116 1 1 9 LYS HD2 H 8.502 -11.739 -6.521 1.00 . A A . 9 LYS HD2 1 1 7 1117 1 1 9 LYS HD3 H 8.000 -10.079 -6.853 1.00 . A A . 9 LYS HD3 1 1 7 1118 1 1 9 LYS HE2 H 7.024 -10.089 -4.495 1.00 . A A . 9 LYS HE2 1 1 7 1119 1 1 9 LYS HE3 H 7.953 -11.565 -4.240 1.00 . A A . 9 LYS HE3 1 1 7 1120 1 1 9 LYS HG2 H 5.686 -10.661 -6.465 1.00 . A A . 9 LYS HG2 1 1 7 1121 1 1 9 LYS HG3 H 6.144 -12.301 -5.998 1.00 . A A . 9 LYS HG3 1 1 7 1122 1 1 9 LYS HZ1 H 8.837 -8.917 -4.081 1.00 . A A . 9 LYS HZ1 1 1 7 1123 1 1 9 LYS HZ2 H 9.642 -9.645 -5.378 1.00 . A A . 9 LYS HZ2 1 1 7 1124 1 1 9 LYS HZ3 H 9.728 -10.334 -3.835 1.00 . A A . 9 LYS HZ3 1 1 7 1125 1 1 9 LYS N N 4.615 -10.251 -8.743 1.00 . A A . 9 LYS N 1 1 7 1126 1 1 9 LYS NZ N 9.112 -9.828 -4.502 1.00 . A A . 9 LYS NZ 1 1 7 1127 1 1 9 LYS O O 3.931 -13.677 -7.846 1.00 . A A . 9 LYS O 1 1 8 1128 1 1 1 THR C C 2.860 -1.138 -1.708 1.00 . A A . 1 THR C 1 1 8 1129 1 1 1 THR CA C 2.411 0.276 -1.362 1.00 . A A . 1 THR CA 1 1 8 1130 1 1 1 THR CB C 0.907 0.258 -1.027 1.00 . A A . 1 THR CB 1 1 8 1131 1 1 1 THR CG2 C 0.684 0.413 0.470 1.00 . A A . 1 THR CG2 1 1 8 1132 1 1 1 THR H1 H 2.323 1.031 -3.338 1.00 . A A . 1 THR H1 1 1 8 1133 1 1 1 THR HA H 2.949 0.611 -0.487 1.00 . A A . 1 THR HA 1 1 8 1134 1 1 1 THR HB H 0.496 -0.691 -1.341 1.00 . A A . 1 THR HB 1 1 8 1135 1 1 1 THR HG1 H 0.346 1.189 -2.673 1.00 . A A . 1 THR HG1 1 1 8 1136 1 1 1 THR HG21 H 0.862 -0.533 0.960 1.00 . A A . 1 THR HG21 1 1 8 1137 1 1 1 THR HG22 H -0.333 0.727 0.651 1.00 . A A . 1 THR HG22 1 1 8 1138 1 1 1 THR HG23 H 1.365 1.154 0.859 1.00 . A A . 1 THR HG23 1 1 8 1139 1 1 1 THR N N 2.701 1.201 -2.450 1.00 . A A . 1 THR N 1 1 8 1140 1 1 1 THR O O 3.578 -1.351 -2.685 1.00 . A A . 1 THR O 1 1 8 1141 1 1 1 THR OG1 O 0.236 1.312 -1.727 1.00 . A A . 1 THR OG1 1 1 8 1142 1 1 2 VAL C C 1.885 -4.140 -2.170 1.00 . A A . 2 VAL C 1 1 8 1143 1 1 2 VAL CA C 2.791 -3.500 -1.123 1.00 . A A . 2 VAL CA 1 1 8 1144 1 1 2 VAL CB C 2.705 -4.316 0.181 1.00 . A A . 2 VAL CB 1 1 8 1145 1 1 2 VAL CG1 C 3.376 -5.670 0.009 1.00 . A A . 2 VAL CG1 1 1 8 1146 1 1 2 VAL CG2 C 3.330 -3.544 1.334 1.00 . A A . 2 VAL CG2 1 1 8 1147 1 1 2 VAL H H 1.863 -1.872 -0.138 1.00 . A A . 2 VAL H 1 1 8 1148 1 1 2 VAL HA H 3.811 -3.531 -1.476 1.00 . A A . 2 VAL HA 1 1 8 1149 1 1 2 VAL HB H 1.663 -4.482 0.410 1.00 . A A . 2 VAL HB 1 1 8 1150 1 1 2 VAL HG11 H 2.926 -6.192 -0.822 1.00 . A A . 2 VAL HG11 1 1 8 1151 1 1 2 VAL HG12 H 4.430 -5.528 -0.182 1.00 . A A . 2 VAL HG12 1 1 8 1152 1 1 2 VAL HG13 H 3.249 -6.252 0.910 1.00 . A A . 2 VAL HG13 1 1 8 1153 1 1 2 VAL HG21 H 4.371 -3.356 1.118 1.00 . A A . 2 VAL HG21 1 1 8 1154 1 1 2 VAL HG22 H 2.813 -2.604 1.460 1.00 . A A . 2 VAL HG22 1 1 8 1155 1 1 2 VAL HG23 H 3.249 -4.123 2.241 1.00 . A A . 2 VAL HG23 1 1 8 1156 1 1 2 VAL N N 2.433 -2.104 -0.901 1.00 . A A . 2 VAL N 1 1 8 1157 1 1 2 VAL O O 2.224 -5.169 -2.753 1.00 . A A . 2 VAL O 1 1 8 1158 1 1 3 TYR C C 0.470 -4.373 -4.694 1.00 . A A . 3 TYR C 1 1 8 1159 1 1 3 TYR CA C -0.224 -4.032 -3.379 1.00 . A A . 3 TYR CA 1 1 8 1160 1 1 3 TYR CB C -1.330 -3.005 -3.624 1.00 . A A . 3 TYR CB 1 1 8 1161 1 1 3 TYR CD1 C 0.063 -0.996 -4.256 1.00 . A A . 3 TYR CD1 1 1 8 1162 1 1 3 TYR CD2 C -1.558 -1.777 -5.819 1.00 . A A . 3 TYR CD2 1 1 8 1163 1 1 3 TYR CE1 C 0.428 0.010 -5.129 1.00 . A A . 3 TYR CE1 1 1 8 1164 1 1 3 TYR CE2 C -1.198 -0.775 -6.700 1.00 . A A . 3 TYR CE2 1 1 8 1165 1 1 3 TYR CG C -0.934 -1.906 -4.584 1.00 . A A . 3 TYR CG 1 1 8 1166 1 1 3 TYR CZ C -0.205 0.116 -6.350 1.00 . A A . 3 TYR CZ 1 1 8 1167 1 1 3 TYR H H 0.518 -2.705 -1.906 1.00 . A A . 3 TYR H 1 1 8 1168 1 1 3 TYR HA H -0.664 -4.931 -2.973 1.00 . A A . 3 TYR HA 1 1 8 1169 1 1 3 TYR HB2 H -2.193 -3.507 -4.033 1.00 . A A . 3 TYR HB2 1 1 8 1170 1 1 3 TYR HB3 H -1.599 -2.544 -2.685 1.00 . A A . 3 TYR HB3 1 1 8 1171 1 1 3 TYR HD1 H 0.557 -1.081 -3.299 1.00 . A A . 3 TYR HD1 1 1 8 1172 1 1 3 TYR HD2 H -2.335 -2.477 -6.090 1.00 . A A . 3 TYR HD2 1 1 8 1173 1 1 3 TYR HE1 H 1.206 0.708 -4.856 1.00 . A A . 3 TYR HE1 1 1 8 1174 1 1 3 TYR HE2 H -1.694 -0.692 -7.656 1.00 . A A . 3 TYR HE2 1 1 8 1175 1 1 3 TYR HH H 0.999 1.486 -6.956 1.00 . A A . 3 TYR HH 1 1 8 1176 1 1 3 TYR N N 0.732 -3.522 -2.403 1.00 . A A . 3 TYR N 1 1 8 1177 1 1 3 TYR O O 0.078 -5.309 -5.392 1.00 . A A . 3 TYR O 1 1 8 1178 1 1 3 TYR OH O 0.155 1.117 -7.224 1.00 . A A . 3 TYR OH 1 1 8 1179 1 1 4 VAL C C 3.266 -4.957 -6.088 1.00 . A A . 4 VAL C 1 1 8 1180 1 1 4 VAL CA C 2.255 -3.828 -6.256 1.00 . A A . 4 VAL CA 1 1 8 1181 1 1 4 VAL CB C 2.996 -2.552 -6.698 1.00 . A A . 4 VAL CB 1 1 8 1182 1 1 4 VAL CG1 C 2.070 -1.645 -7.495 1.00 . A A . 4 VAL CG1 1 1 8 1183 1 1 4 VAL CG2 C 3.563 -1.821 -5.491 1.00 . A A . 4 VAL CG2 1 1 8 1184 1 1 4 VAL H H 1.769 -2.877 -4.429 1.00 . A A . 4 VAL H 1 1 8 1185 1 1 4 VAL HA H 1.553 -4.099 -7.032 1.00 . A A . 4 VAL HA 1 1 8 1186 1 1 4 VAL HB H 3.818 -2.841 -7.337 1.00 . A A . 4 VAL HB 1 1 8 1187 1 1 4 VAL HG11 H 2.351 -1.672 -8.537 1.00 . A A . 4 VAL HG11 1 1 8 1188 1 1 4 VAL HG12 H 1.051 -1.986 -7.386 1.00 . A A . 4 VAL HG12 1 1 8 1189 1 1 4 VAL HG13 H 2.153 -0.634 -7.126 1.00 . A A . 4 VAL HG13 1 1 8 1190 1 1 4 VAL HG21 H 3.659 -2.511 -4.666 1.00 . A A . 4 VAL HG21 1 1 8 1191 1 1 4 VAL HG22 H 4.535 -1.418 -5.738 1.00 . A A . 4 VAL HG22 1 1 8 1192 1 1 4 VAL HG23 H 2.900 -1.016 -5.213 1.00 . A A . 4 VAL HG23 1 1 8 1193 1 1 4 VAL N N 1.504 -3.607 -5.026 1.00 . A A . 4 VAL N 1 1 8 1194 1 1 4 VAL O O 3.470 -5.762 -6.998 1.00 . A A . 4 VAL O 1 1 8 1195 1 1 5 TYR C C 4.269 -7.434 -4.730 1.00 . A A . 5 TYR C 1 1 8 1196 1 1 5 TYR CA C 4.886 -6.041 -4.632 1.00 . A A . 5 TYR CA 1 1 8 1197 1 1 5 TYR CB C 5.480 -5.832 -3.239 1.00 . A A . 5 TYR CB 1 1 8 1198 1 1 5 TYR CD1 C 6.042 -3.371 -3.166 1.00 . A A . 5 TYR CD1 1 1 8 1199 1 1 5 TYR CD2 C 7.838 -4.936 -3.106 1.00 . A A . 5 TYR CD2 1 1 8 1200 1 1 5 TYR CE1 C 6.943 -2.326 -3.103 1.00 . A A . 5 TYR CE1 1 1 8 1201 1 1 5 TYR CE2 C 8.747 -3.898 -3.041 1.00 . A A . 5 TYR CE2 1 1 8 1202 1 1 5 TYR CG C 6.472 -4.692 -3.169 1.00 . A A . 5 TYR CG 1 1 8 1203 1 1 5 TYR CZ C 8.295 -2.595 -3.040 1.00 . A A . 5 TYR CZ 1 1 8 1204 1 1 5 TYR H H 3.688 -4.342 -4.234 1.00 . A A . 5 TYR H 1 1 8 1205 1 1 5 TYR HA H 5.674 -5.957 -5.366 1.00 . A A . 5 TYR HA 1 1 8 1206 1 1 5 TYR HB2 H 4.684 -5.620 -2.543 1.00 . A A . 5 TYR HB2 1 1 8 1207 1 1 5 TYR HB3 H 5.990 -6.734 -2.933 1.00 . A A . 5 TYR HB3 1 1 8 1208 1 1 5 TYR HD1 H 4.982 -3.163 -3.216 1.00 . A A . 5 TYR HD1 1 1 8 1209 1 1 5 TYR HD2 H 8.189 -5.958 -3.107 1.00 . A A . 5 TYR HD2 1 1 8 1210 1 1 5 TYR HE1 H 6.590 -1.305 -3.102 1.00 . A A . 5 TYR HE1 1 1 8 1211 1 1 5 TYR HE2 H 9.805 -4.108 -2.992 1.00 . A A . 5 TYR HE2 1 1 8 1212 1 1 5 TYR HH H 8.807 -0.823 -2.498 1.00 . A A . 5 TYR HH 1 1 8 1213 1 1 5 TYR N N 3.894 -5.012 -4.920 1.00 . A A . 5 TYR N 1 1 8 1214 1 1 5 TYR O O 4.958 -8.410 -5.024 1.00 . A A . 5 TYR O 1 1 8 1215 1 1 5 TYR OH O 9.197 -1.558 -2.977 1.00 . A A . 5 TYR OH 1 1 8 1216 1 1 6 SER C C 1.691 -9.033 -5.934 1.00 . A A . 6 SER C 1 1 8 1217 1 1 6 SER CA C 2.255 -8.787 -4.538 1.00 . A A . 6 SER CA 1 1 8 1218 1 1 6 SER CB C 1.125 -8.810 -3.507 1.00 . A A . 6 SER CB 1 1 8 1219 1 1 6 SER H H 2.471 -6.701 -4.251 1.00 . A A . 6 SER H 1 1 8 1220 1 1 6 SER HA H 2.960 -9.571 -4.304 1.00 . A A . 6 SER HA 1 1 8 1221 1 1 6 SER HB2 H 1.541 -8.701 -2.517 1.00 . A A . 6 SER HB2 1 1 8 1222 1 1 6 SER HB3 H 0.446 -7.993 -3.704 1.00 . A A . 6 SER HB3 1 1 8 1223 1 1 6 SER HG H 1.006 -10.764 -3.433 1.00 . A A . 6 SER HG 1 1 8 1224 1 1 6 SER N N 2.966 -7.515 -4.481 1.00 . A A . 6 SER N 1 1 8 1225 1 1 6 SER O O 1.520 -10.177 -6.354 1.00 . A A . 6 SER O 1 1 8 1226 1 1 6 SER OG O 0.404 -10.029 -3.567 1.00 . A A . 6 SER OG 1 1 8 1227 1 1 7 ARG C C 1.948 -8.405 -9.000 1.00 . A A . 7 ARG C 1 1 8 1228 1 1 7 ARG CA C 0.857 -8.046 -7.996 1.00 . A A . 7 ARG CA 1 1 8 1229 1 1 7 ARG CB C 0.195 -6.726 -8.396 1.00 . A A . 7 ARG CB 1 1 8 1230 1 1 7 ARG CD C 0.017 -4.854 -10.064 1.00 . A A . 7 ARG CD 1 1 8 1231 1 1 7 ARG CG C 0.687 -6.176 -9.725 1.00 . A A . 7 ARG CG 1 1 8 1232 1 1 7 ARG CZ C -1.828 -5.420 -11.588 1.00 . A A . 7 ARG CZ 1 1 8 1233 1 1 7 ARG H H 1.561 -7.064 -6.258 1.00 . A A . 7 ARG H 1 1 8 1234 1 1 7 ARG HA H 0.111 -8.827 -7.997 1.00 . A A . 7 ARG HA 1 1 8 1235 1 1 7 ARG HB2 H -0.872 -6.878 -8.468 1.00 . A A . 7 ARG HB2 1 1 8 1236 1 1 7 ARG HB3 H 0.394 -5.991 -7.631 1.00 . A A . 7 ARG HB3 1 1 8 1237 1 1 7 ARG HD2 H -0.727 -4.640 -9.311 1.00 . A A . 7 ARG HD2 1 1 8 1238 1 1 7 ARG HD3 H 0.765 -4.076 -10.062 1.00 . A A . 7 ARG HD3 1 1 8 1239 1 1 7 ARG HE H -0.146 -4.495 -12.129 1.00 . A A . 7 ARG HE 1 1 8 1240 1 1 7 ARG HG2 H 1.754 -6.022 -9.667 1.00 . A A . 7 ARG HG2 1 1 8 1241 1 1 7 ARG HG3 H 0.467 -6.892 -10.503 1.00 . A A . 7 ARG HG3 1 1 8 1242 1 1 7 ARG HH11 H -2.117 -5.965 -9.664 1.00 . A A . 7 ARG HH11 1 1 8 1243 1 1 7 ARG HH12 H -3.409 -6.358 -10.748 1.00 . A A . 7 ARG HH12 1 1 8 1244 1 1 7 ARG HH21 H -1.841 -5.006 -13.566 1.00 . A A . 7 ARG HH21 1 1 8 1245 1 1 7 ARG HH22 H -3.251 -5.813 -12.968 1.00 . A A . 7 ARG HH22 1 1 8 1246 1 1 7 ARG N N 1.403 -7.949 -6.647 1.00 . A A . 7 ARG N 1 1 8 1247 1 1 7 ARG NE N -0.630 -4.888 -11.373 1.00 . A A . 7 ARG NE 1 1 8 1248 1 1 7 ARG NH1 N -2.507 -5.959 -10.584 1.00 . A A . 7 ARG NH1 1 1 8 1249 1 1 7 ARG NH2 N -2.350 -5.412 -12.808 1.00 . A A . 7 ARG NH2 1 1 8 1250 1 1 7 ARG O O 1.738 -9.226 -9.893 1.00 . A A . 7 ARG O 1 1 8 1251 1 1 8 VAL C C 4.526 -9.533 -9.848 1.00 . A A . 8 VAL C 1 1 8 1252 1 1 8 VAL CA C 4.238 -8.040 -9.740 1.00 . A A . 8 VAL CA 1 1 8 1253 1 1 8 VAL CB C 5.510 -7.317 -9.260 1.00 . A A . 8 VAL CB 1 1 8 1254 1 1 8 VAL CG1 C 6.695 -7.680 -10.142 1.00 . A A . 8 VAL CG1 1 1 8 1255 1 1 8 VAL CG2 C 5.291 -5.811 -9.241 1.00 . A A . 8 VAL CG2 1 1 8 1256 1 1 8 VAL H H 3.220 -7.142 -8.116 1.00 . A A . 8 VAL H 1 1 8 1257 1 1 8 VAL HA H 3.980 -7.661 -10.718 1.00 . A A . 8 VAL HA 1 1 8 1258 1 1 8 VAL HB H 5.726 -7.641 -8.253 1.00 . A A . 8 VAL HB 1 1 8 1259 1 1 8 VAL HG11 H 7.352 -6.827 -10.231 1.00 . A A . 8 VAL HG11 1 1 8 1260 1 1 8 VAL HG12 H 7.234 -8.505 -9.699 1.00 . A A . 8 VAL HG12 1 1 8 1261 1 1 8 VAL HG13 H 6.341 -7.965 -11.121 1.00 . A A . 8 VAL HG13 1 1 8 1262 1 1 8 VAL HG21 H 4.233 -5.603 -9.185 1.00 . A A . 8 VAL HG21 1 1 8 1263 1 1 8 VAL HG22 H 5.788 -5.386 -8.381 1.00 . A A . 8 VAL HG22 1 1 8 1264 1 1 8 VAL HG23 H 5.698 -5.376 -10.142 1.00 . A A . 8 VAL HG23 1 1 8 1265 1 1 8 VAL N N 3.113 -7.785 -8.847 1.00 . A A . 8 VAL N 1 1 8 1266 1 1 8 VAL O O 4.375 -10.130 -10.914 1.00 . A A . 8 VAL O 1 1 8 1267 1 1 9 LYS C C 4.062 -12.382 -9.194 1.00 . A A . 9 LYS C 1 1 8 1268 1 1 9 LYS CA C 5.249 -11.557 -8.705 1.00 . A A . 9 LYS CA 1 1 8 1269 1 1 9 LYS CB C 5.632 -11.985 -7.287 1.00 . A A . 9 LYS CB 1 1 8 1270 1 1 9 LYS CD C 7.169 -10.743 -5.737 1.00 . A A . 9 LYS CD 1 1 8 1271 1 1 9 LYS CE C 8.615 -10.421 -5.393 1.00 . A A . 9 LYS CE 1 1 8 1272 1 1 9 LYS CG C 7.076 -11.681 -6.928 1.00 . A A . 9 LYS CG 1 1 8 1273 1 1 9 LYS H H 5.042 -9.603 -7.918 1.00 . A A . 9 LYS H 1 1 8 1274 1 1 9 LYS HA H 6.087 -11.730 -9.363 1.00 . A A . 9 LYS HA 1 1 8 1275 1 1 9 LYS HB2 H 4.992 -11.472 -6.584 1.00 . A A . 9 LYS HB2 1 1 8 1276 1 1 9 LYS HB3 H 5.475 -13.050 -7.191 1.00 . A A . 9 LYS HB3 1 1 8 1277 1 1 9 LYS HD2 H 6.654 -9.823 -5.972 1.00 . A A . 9 LYS HD2 1 1 8 1278 1 1 9 LYS HD3 H 6.700 -11.211 -4.883 1.00 . A A . 9 LYS HD3 1 1 8 1279 1 1 9 LYS HE2 H 9.146 -10.191 -6.304 1.00 . A A . 9 LYS HE2 1 1 8 1280 1 1 9 LYS HE3 H 8.633 -9.561 -4.739 1.00 . A A . 9 LYS HE3 1 1 8 1281 1 1 9 LYS HG2 H 7.579 -12.605 -6.685 1.00 . A A . 9 LYS HG2 1 1 8 1282 1 1 9 LYS HG3 H 7.558 -11.219 -7.778 1.00 . A A . 9 LYS HG3 1 1 8 1283 1 1 9 LYS HZ1 H 10.306 -11.559 -4.937 1.00 . A A . 9 LYS HZ1 1 1 8 1284 1 1 9 LYS HZ2 H 8.879 -12.461 -5.031 1.00 . A A . 9 LYS HZ2 1 1 8 1285 1 1 9 LYS HZ3 H 9.173 -11.483 -3.682 1.00 . A A . 9 LYS HZ3 1 1 8 1286 1 1 9 LYS N N 4.941 -10.132 -8.737 1.00 . A A . 9 LYS N 1 1 8 1287 1 1 9 LYS NZ N 9.290 -11.561 -4.713 1.00 . A A . 9 LYS NZ 1 1 8 1288 1 1 9 LYS O O 4.148 -13.605 -9.305 1.00 . A A . 9 LYS O 1 1 9 1289 1 1 1 THR C C 2.563 -1.315 -2.045 1.00 . A A . 1 THR C 1 1 9 1290 1 1 1 THR CA C 2.275 0.124 -1.633 1.00 . A A . 1 THR CA 1 1 9 1291 1 1 1 THR CB C 3.591 0.925 -1.656 1.00 . A A . 1 THR CB 1 1 9 1292 1 1 1 THR CG2 C 3.651 1.832 -2.876 1.00 . A A . 1 THR CG2 1 1 9 1293 1 1 1 THR H1 H 2.174 -0.029 0.476 1.00 . A A . 1 THR H1 1 1 9 1294 1 1 1 THR HA H 1.597 0.565 -2.349 1.00 . A A . 1 THR HA 1 1 9 1295 1 1 1 THR HB H 4.417 0.230 -1.703 1.00 . A A . 1 THR HB 1 1 9 1296 1 1 1 THR HG1 H 2.927 2.261 -0.367 1.00 . A A . 1 THR HG1 1 1 9 1297 1 1 1 THR HG21 H 4.679 1.963 -3.177 1.00 . A A . 1 THR HG21 1 1 9 1298 1 1 1 THR HG22 H 3.222 2.793 -2.631 1.00 . A A . 1 THR HG22 1 1 9 1299 1 1 1 THR HG23 H 3.093 1.385 -3.684 1.00 . A A . 1 THR HG23 1 1 9 1300 1 1 1 THR N N 1.643 0.179 -0.321 1.00 . A A . 1 THR N 1 1 9 1301 1 1 1 THR O O 2.898 -1.586 -3.199 1.00 . A A . 1 THR O 1 1 9 1302 1 1 1 THR OG1 O 3.708 1.710 -0.465 1.00 . A A . 1 THR OG1 1 1 9 1303 1 1 2 VAL C C 1.823 -4.143 -2.527 1.00 . A A . 2 VAL C 1 1 9 1304 1 1 2 VAL CA C 2.672 -3.649 -1.361 1.00 . A A . 2 VAL CA 1 1 9 1305 1 1 2 VAL CB C 2.374 -4.512 -0.121 1.00 . A A . 2 VAL CB 1 1 9 1306 1 1 2 VAL CG1 C 2.892 -5.929 -0.319 1.00 . A A . 2 VAL CG1 1 1 9 1307 1 1 2 VAL CG2 C 2.980 -3.883 1.124 1.00 . A A . 2 VAL CG2 1 1 9 1308 1 1 2 VAL H H 2.159 -1.959 -0.196 1.00 . A A . 2 VAL H 1 1 9 1309 1 1 2 VAL HA H 3.716 -3.766 -1.613 1.00 . A A . 2 VAL HA 1 1 9 1310 1 1 2 VAL HB H 1.303 -4.560 0.010 1.00 . A A . 2 VAL HB 1 1 9 1311 1 1 2 VAL HG11 H 2.606 -6.538 0.526 1.00 . A A . 2 VAL HG11 1 1 9 1312 1 1 2 VAL HG12 H 2.470 -6.344 -1.223 1.00 . A A . 2 VAL HG12 1 1 9 1313 1 1 2 VAL HG13 H 3.969 -5.910 -0.400 1.00 . A A . 2 VAL HG13 1 1 9 1314 1 1 2 VAL HG21 H 3.996 -3.583 0.916 1.00 . A A . 2 VAL HG21 1 1 9 1315 1 1 2 VAL HG22 H 2.400 -3.018 1.410 1.00 . A A . 2 VAL HG22 1 1 9 1316 1 1 2 VAL HG23 H 2.975 -4.602 1.930 1.00 . A A . 2 VAL HG23 1 1 9 1317 1 1 2 VAL N N 2.429 -2.236 -1.096 1.00 . A A . 2 VAL N 1 1 9 1318 1 1 2 VAL O O 2.145 -5.150 -3.160 1.00 . A A . 2 VAL O 1 1 9 1319 1 1 3 TYR C C 0.628 -4.309 -5.100 1.00 . A A . 3 TYR C 1 1 9 1320 1 1 3 TYR CA C -0.158 -3.796 -3.897 1.00 . A A . 3 TYR CA 1 1 9 1321 1 1 3 TYR CB C -1.013 -2.596 -4.307 1.00 . A A . 3 TYR CB 1 1 9 1322 1 1 3 TYR CD1 C -0.851 -0.713 -2.633 1.00 . A A . 3 TYR CD1 1 1 9 1323 1 1 3 TYR CD2 C -2.749 -2.150 -2.528 1.00 . A A . 3 TYR CD2 1 1 9 1324 1 1 3 TYR CE1 C -1.335 0.013 -1.561 1.00 . A A . 3 TYR CE1 1 1 9 1325 1 1 3 TYR CE2 C -3.242 -1.429 -1.457 1.00 . A A . 3 TYR CE2 1 1 9 1326 1 1 3 TYR CG C -1.548 -1.805 -3.134 1.00 . A A . 3 TYR CG 1 1 9 1327 1 1 3 TYR CZ C -2.531 -0.349 -0.978 1.00 . A A . 3 TYR CZ 1 1 9 1328 1 1 3 TYR H H 0.536 -2.637 -2.268 1.00 . A A . 3 TYR H 1 1 9 1329 1 1 3 TYR HA H -0.806 -4.583 -3.542 1.00 . A A . 3 TYR HA 1 1 9 1330 1 1 3 TYR HB2 H -0.420 -1.929 -4.913 1.00 . A A . 3 TYR HB2 1 1 9 1331 1 1 3 TYR HB3 H -1.857 -2.945 -4.884 1.00 . A A . 3 TYR HB3 1 1 9 1332 1 1 3 TYR HD1 H 0.086 -0.432 -3.092 1.00 . A A . 3 TYR HD1 1 1 9 1333 1 1 3 TYR HD2 H -3.304 -2.997 -2.906 1.00 . A A . 3 TYR HD2 1 1 9 1334 1 1 3 TYR HE1 H -0.778 0.859 -1.186 1.00 . A A . 3 TYR HE1 1 1 9 1335 1 1 3 TYR HE2 H -4.178 -1.712 -0.999 1.00 . A A . 3 TYR HE2 1 1 9 1336 1 1 3 TYR HH H -3.970 0.267 0.138 1.00 . A A . 3 TYR HH 1 1 9 1337 1 1 3 TYR N N 0.739 -3.429 -2.807 1.00 . A A . 3 TYR N 1 1 9 1338 1 1 3 TYR O O 0.481 -5.462 -5.506 1.00 . A A . 3 TYR O 1 1 9 1339 1 1 3 TYR OH O -3.017 0.371 0.090 1.00 . A A . 3 TYR OH 1 1 9 1340 1 1 4 VAL C C 3.201 -4.976 -6.496 1.00 . A A . 4 VAL C 1 1 9 1341 1 1 4 VAL CA C 2.276 -3.809 -6.820 1.00 . A A . 4 VAL CA 1 1 9 1342 1 1 4 VAL CB C 3.122 -2.618 -7.310 1.00 . A A . 4 VAL CB 1 1 9 1343 1 1 4 VAL CG1 C 2.257 -1.627 -8.074 1.00 . A A . 4 VAL CG1 1 1 9 1344 1 1 4 VAL CG2 C 3.816 -1.941 -6.138 1.00 . A A . 4 VAL CG2 1 1 9 1345 1 1 4 VAL H H 1.538 -2.540 -5.296 1.00 . A A . 4 VAL H 1 1 9 1346 1 1 4 VAL HA H 1.608 -4.101 -7.618 1.00 . A A . 4 VAL HA 1 1 9 1347 1 1 4 VAL HB H 3.879 -2.994 -7.982 1.00 . A A . 4 VAL HB 1 1 9 1348 1 1 4 VAL HG11 H 1.891 -0.871 -7.394 1.00 . A A . 4 VAL HG11 1 1 9 1349 1 1 4 VAL HG12 H 2.844 -1.161 -8.851 1.00 . A A . 4 VAL HG12 1 1 9 1350 1 1 4 VAL HG13 H 1.420 -2.146 -8.517 1.00 . A A . 4 VAL HG13 1 1 9 1351 1 1 4 VAL HG21 H 4.391 -2.672 -5.590 1.00 . A A . 4 VAL HG21 1 1 9 1352 1 1 4 VAL HG22 H 4.475 -1.168 -6.507 1.00 . A A . 4 VAL HG22 1 1 9 1353 1 1 4 VAL HG23 H 3.076 -1.501 -5.486 1.00 . A A . 4 VAL HG23 1 1 9 1354 1 1 4 VAL N N 1.464 -3.444 -5.665 1.00 . A A . 4 VAL N 1 1 9 1355 1 1 4 VAL O O 3.375 -5.887 -7.305 1.00 . A A . 4 VAL O 1 1 9 1356 1 1 5 TYR C C 4.013 -7.359 -4.914 1.00 . A A . 5 TYR C 1 1 9 1357 1 1 5 TYR CA C 4.700 -5.998 -4.875 1.00 . A A . 5 TYR CA 1 1 9 1358 1 1 5 TYR CB C 5.212 -5.713 -3.462 1.00 . A A . 5 TYR CB 1 1 9 1359 1 1 5 TYR CD1 C 7.476 -4.603 -3.333 1.00 . A A . 5 TYR CD1 1 1 9 1360 1 1 5 TYR CD2 C 5.540 -3.212 -3.325 1.00 . A A . 5 TYR CD2 1 1 9 1361 1 1 5 TYR CE1 C 8.285 -3.486 -3.251 1.00 . A A . 5 TYR CE1 1 1 9 1362 1 1 5 TYR CE2 C 6.341 -2.090 -3.245 1.00 . A A . 5 TYR CE2 1 1 9 1363 1 1 5 TYR CG C 6.092 -4.487 -3.372 1.00 . A A . 5 TYR CG 1 1 9 1364 1 1 5 TYR CZ C 7.713 -2.231 -3.207 1.00 . A A . 5 TYR CZ 1 1 9 1365 1 1 5 TYR H H 3.612 -4.191 -4.704 1.00 . A A . 5 TYR H 1 1 9 1366 1 1 5 TYR HA H 5.540 -6.011 -5.555 1.00 . A A . 5 TYR HA 1 1 9 1367 1 1 5 TYR HB2 H 4.369 -5.563 -2.804 1.00 . A A . 5 TYR HB2 1 1 9 1368 1 1 5 TYR HB3 H 5.786 -6.560 -3.116 1.00 . A A . 5 TYR HB3 1 1 9 1369 1 1 5 TYR HD1 H 7.922 -5.587 -3.367 1.00 . A A . 5 TYR HD1 1 1 9 1370 1 1 5 TYR HD2 H 4.465 -3.105 -3.354 1.00 . A A . 5 TYR HD2 1 1 9 1371 1 1 5 TYR HE1 H 9.359 -3.596 -3.222 1.00 . A A . 5 TYR HE1 1 1 9 1372 1 1 5 TYR HE2 H 5.893 -1.108 -3.210 1.00 . A A . 5 TYR HE2 1 1 9 1373 1 1 5 TYR HH H 9.072 -1.179 -2.347 1.00 . A A . 5 TYR HH 1 1 9 1374 1 1 5 TYR N N 3.791 -4.943 -5.306 1.00 . A A . 5 TYR N 1 1 9 1375 1 1 5 TYR O O 4.669 -8.396 -5.019 1.00 . A A . 5 TYR O 1 1 9 1376 1 1 5 TYR OH O 8.514 -1.116 -3.125 1.00 . A A . 5 TYR OH 1 1 9 1377 1 1 6 SER C C 1.509 -8.945 -6.279 1.00 . A A . 6 SER C 1 1 9 1378 1 1 6 SER CA C 1.909 -8.581 -4.852 1.00 . A A . 6 SER CA 1 1 9 1379 1 1 6 SER CB C 0.659 -8.437 -3.981 1.00 . A A . 6 SER CB 1 1 9 1380 1 1 6 SER H H 2.221 -6.490 -4.748 1.00 . A A . 6 SER H 1 1 9 1381 1 1 6 SER HA H 2.527 -9.371 -4.452 1.00 . A A . 6 SER HA 1 1 9 1382 1 1 6 SER HB2 H 0.941 -8.051 -3.014 1.00 . A A . 6 SER HB2 1 1 9 1383 1 1 6 SER HB3 H -0.029 -7.753 -4.456 1.00 . A A . 6 SER HB3 1 1 9 1384 1 1 6 SER HG H 0.352 -10.113 -3.014 1.00 . A A . 6 SER HG 1 1 9 1385 1 1 6 SER N N 2.687 -7.348 -4.830 1.00 . A A . 6 SER N 1 1 9 1386 1 1 6 SER O O 1.335 -10.120 -6.606 1.00 . A A . 6 SER O 1 1 9 1387 1 1 6 SER OG O 0.014 -9.686 -3.805 1.00 . A A . 6 SER OG 1 1 9 1388 1 1 7 ARG C C 2.168 -8.654 -9.330 1.00 . A A . 7 ARG C 1 1 9 1389 1 1 7 ARG CA C 0.985 -8.141 -8.515 1.00 . A A . 7 ARG CA 1 1 9 1390 1 1 7 ARG CB C 0.456 -6.842 -9.125 1.00 . A A . 7 ARG CB 1 1 9 1391 1 1 7 ARG CD C 0.596 -5.149 -10.977 1.00 . A A . 7 ARG CD 1 1 9 1392 1 1 7 ARG CG C 1.142 -6.457 -10.426 1.00 . A A . 7 ARG CG 1 1 9 1393 1 1 7 ARG CZ C -1.290 -5.814 -12.407 1.00 . A A . 7 ARG CZ 1 1 9 1394 1 1 7 ARG H H 1.518 -7.016 -6.804 1.00 . A A . 7 ARG H 1 1 9 1395 1 1 7 ARG HA H 0.201 -8.883 -8.536 1.00 . A A . 7 ARG HA 1 1 9 1396 1 1 7 ARG HB2 H -0.600 -6.953 -9.320 1.00 . A A . 7 ARG HB2 1 1 9 1397 1 1 7 ARG HB3 H 0.601 -6.041 -8.416 1.00 . A A . 7 ARG HB3 1 1 9 1398 1 1 7 ARG HD2 H 0.736 -4.375 -10.236 1.00 . A A . 7 ARG HD2 1 1 9 1399 1 1 7 ARG HD3 H 1.145 -4.894 -11.871 1.00 . A A . 7 ARG HD3 1 1 9 1400 1 1 7 ARG HE H -1.463 -4.859 -10.665 1.00 . A A . 7 ARG HE 1 1 9 1401 1 1 7 ARG HG2 H 2.200 -6.344 -10.245 1.00 . A A . 7 ARG HG2 1 1 9 1402 1 1 7 ARG HG3 H 0.980 -7.239 -11.152 1.00 . A A . 7 ARG HG3 1 1 9 1403 1 1 7 ARG HH11 H 0.534 -6.308 -13.121 1.00 . A A . 7 ARG HH11 1 1 9 1404 1 1 7 ARG HH12 H -0.803 -6.771 -14.120 1.00 . A A . 7 ARG HH12 1 1 9 1405 1 1 7 ARG HH21 H -3.232 -5.464 -11.971 1.00 . A A . 7 ARG HH21 1 1 9 1406 1 1 7 ARG HH22 H -2.945 -6.290 -13.465 1.00 . A A . 7 ARG HH22 1 1 9 1407 1 1 7 ARG N N 1.365 -7.930 -7.124 1.00 . A A . 7 ARG N 1 1 9 1408 1 1 7 ARG NE N -0.825 -5.242 -11.302 1.00 . A A . 7 ARG NE 1 1 9 1409 1 1 7 ARG NH1 N -0.451 -6.340 -13.289 1.00 . A A . 7 ARG NH1 1 1 9 1410 1 1 7 ARG NH2 N -2.597 -5.860 -12.633 1.00 . A A . 7 ARG NH2 1 1 9 1411 1 1 7 ARG O O 2.022 -9.553 -10.159 1.00 . A A . 7 ARG O 1 1 9 1412 1 1 8 VAL C C 4.753 -9.983 -9.738 1.00 . A A . 8 VAL C 1 1 9 1413 1 1 8 VAL CA C 4.550 -8.473 -9.801 1.00 . A A . 8 VAL CA 1 1 9 1414 1 1 8 VAL CB C 5.795 -7.774 -9.226 1.00 . A A . 8 VAL CB 1 1 9 1415 1 1 8 VAL CG1 C 7.023 -8.093 -10.066 1.00 . A A . 8 VAL CG1 1 1 9 1416 1 1 8 VAL CG2 C 5.572 -6.271 -9.143 1.00 . A A . 8 VAL CG2 1 1 9 1417 1 1 8 VAL H H 3.394 -7.364 -8.418 1.00 . A A . 8 VAL H 1 1 9 1418 1 1 8 VAL HA H 4.442 -8.178 -10.835 1.00 . A A . 8 VAL HA 1 1 9 1419 1 1 8 VAL HB H 5.964 -8.147 -8.227 1.00 . A A . 8 VAL HB 1 1 9 1420 1 1 8 VAL HG11 H 7.688 -7.242 -10.067 1.00 . A A . 8 VAL HG11 1 1 9 1421 1 1 8 VAL HG12 H 7.532 -8.949 -9.649 1.00 . A A . 8 VAL HG12 1 1 9 1422 1 1 8 VAL HG13 H 6.719 -8.312 -11.079 1.00 . A A . 8 VAL HG13 1 1 9 1423 1 1 8 VAL HG21 H 4.608 -6.028 -9.565 1.00 . A A . 8 VAL HG21 1 1 9 1424 1 1 8 VAL HG22 H 5.600 -5.959 -8.109 1.00 . A A . 8 VAL HG22 1 1 9 1425 1 1 8 VAL HG23 H 6.347 -5.761 -9.694 1.00 . A A . 8 VAL HG23 1 1 9 1426 1 1 8 VAL N N 3.341 -8.075 -9.090 1.00 . A A . 8 VAL N 1 1 9 1427 1 1 8 VAL O O 4.697 -10.672 -10.756 1.00 . A A . 8 VAL O 1 1 9 1428 1 1 9 LYS C C 3.957 -12.576 -7.737 1.00 . A A . 9 LYS C 1 1 9 1429 1 1 9 LYS CA C 5.199 -11.921 -8.334 1.00 . A A . 9 LYS CA 1 1 9 1430 1 1 9 LYS CB C 6.402 -12.158 -7.419 1.00 . A A . 9 LYS CB 1 1 9 1431 1 1 9 LYS CD C 7.410 -10.347 -5.999 1.00 . A A . 9 LYS CD 1 1 9 1432 1 1 9 LYS CE C 7.825 -10.114 -4.554 1.00 . A A . 9 LYS CE 1 1 9 1433 1 1 9 LYS CG C 6.323 -11.404 -6.102 1.00 . A A . 9 LYS CG 1 1 9 1434 1 1 9 LYS H H 5.021 -9.892 -7.759 1.00 . A A . 9 LYS H 1 1 9 1435 1 1 9 LYS HA H 5.397 -12.365 -9.297 1.00 . A A . 9 LYS HA 1 1 9 1436 1 1 9 LYS HB2 H 6.472 -13.213 -7.201 1.00 . A A . 9 LYS HB2 1 1 9 1437 1 1 9 LYS HB3 H 7.299 -11.845 -7.935 1.00 . A A . 9 LYS HB3 1 1 9 1438 1 1 9 LYS HD2 H 8.272 -10.673 -6.561 1.00 . A A . 9 LYS HD2 1 1 9 1439 1 1 9 LYS HD3 H 7.038 -9.419 -6.412 1.00 . A A . 9 LYS HD3 1 1 9 1440 1 1 9 LYS HE2 H 7.809 -9.053 -4.356 1.00 . A A . 9 LYS HE2 1 1 9 1441 1 1 9 LYS HE3 H 7.119 -10.612 -3.906 1.00 . A A . 9 LYS HE3 1 1 9 1442 1 1 9 LYS HG2 H 5.359 -10.922 -6.031 1.00 . A A . 9 LYS HG2 1 1 9 1443 1 1 9 LYS HG3 H 6.438 -12.106 -5.289 1.00 . A A . 9 LYS HG3 1 1 9 1444 1 1 9 LYS HZ1 H 9.830 -10.400 -5.063 1.00 . A A . 9 LYS HZ1 1 1 9 1445 1 1 9 LYS HZ2 H 9.162 -11.672 -4.172 1.00 . A A . 9 LYS HZ2 1 1 9 1446 1 1 9 LYS HZ3 H 9.564 -10.221 -3.402 1.00 . A A . 9 LYS HZ3 1 1 9 1447 1 1 9 LYS N N 4.989 -10.492 -8.533 1.00 . A A . 9 LYS N 1 1 9 1448 1 1 9 LYS NZ N 9.191 -10.638 -4.278 1.00 . A A . 9 LYS NZ 1 1 9 1449 1 1 9 LYS O O 3.942 -13.779 -7.475 1.00 . A A . 9 LYS O 1 1 10 1450 1 1 1 THR C C 2.614 -1.344 -1.964 1.00 . A A . 1 THR C 1 1 10 1451 1 1 1 THR CA C 2.322 0.096 -1.558 1.00 . A A . 1 THR CA 1 1 10 1452 1 1 1 THR CB C 3.625 0.914 -1.641 1.00 . A A . 1 THR CB 1 1 10 1453 1 1 1 THR CG2 C 3.672 1.727 -2.926 1.00 . A A . 1 THR CG2 1 1 10 1454 1 1 1 THR H1 H 2.322 0.054 0.558 1.00 . A A . 1 THR H1 1 1 10 1455 1 1 1 THR HA H 1.611 0.519 -2.252 1.00 . A A . 1 THR HA 1 1 10 1456 1 1 1 THR HB H 4.462 0.231 -1.634 1.00 . A A . 1 THR HB 1 1 10 1457 1 1 1 THR HG1 H 2.860 2.148 -0.306 1.00 . A A . 1 THR HG1 1 1 10 1458 1 1 1 THR HG21 H 4.615 1.560 -3.424 1.00 . A A . 1 THR HG21 1 1 10 1459 1 1 1 THR HG22 H 3.569 2.777 -2.691 1.00 . A A . 1 THR HG22 1 1 10 1460 1 1 1 THR HG23 H 2.864 1.423 -3.574 1.00 . A A . 1 THR HG23 1 1 10 1461 1 1 1 THR N N 1.740 0.158 -0.223 1.00 . A A . 1 THR N 1 1 10 1462 1 1 1 THR O O 2.909 -1.625 -3.126 1.00 . A A . 1 THR O 1 1 10 1463 1 1 1 THR OG1 O 3.727 1.789 -0.512 1.00 . A A . 1 THR OG1 1 1 10 1464 1 1 2 VAL C C 1.880 -4.193 -2.370 1.00 . A A . 2 VAL C 1 1 10 1465 1 1 2 VAL CA C 2.781 -3.668 -1.258 1.00 . A A . 2 VAL CA 1 1 10 1466 1 1 2 VAL CB C 2.563 -4.517 0.009 1.00 . A A . 2 VAL CB 1 1 10 1467 1 1 2 VAL CG1 C 3.090 -5.929 -0.198 1.00 . A A . 2 VAL CG1 1 1 10 1468 1 1 2 VAL CG2 C 3.226 -3.862 1.210 1.00 . A A . 2 VAL CG2 1 1 10 1469 1 1 2 VAL H H 2.289 -1.970 -0.093 1.00 . A A . 2 VAL H 1 1 10 1470 1 1 2 VAL HA H 3.812 -3.772 -1.563 1.00 . A A . 2 VAL HA 1 1 10 1471 1 1 2 VAL HB H 1.501 -4.578 0.198 1.00 . A A . 2 VAL HB 1 1 10 1472 1 1 2 VAL HG11 H 2.613 -6.369 -1.062 1.00 . A A . 2 VAL HG11 1 1 10 1473 1 1 2 VAL HG12 H 4.159 -5.895 -0.354 1.00 . A A . 2 VAL HG12 1 1 10 1474 1 1 2 VAL HG13 H 2.872 -6.526 0.675 1.00 . A A . 2 VAL HG13 1 1 10 1475 1 1 2 VAL HG21 H 4.228 -3.558 0.946 1.00 . A A . 2 VAL HG21 1 1 10 1476 1 1 2 VAL HG22 H 2.654 -2.995 1.509 1.00 . A A . 2 VAL HG22 1 1 10 1477 1 1 2 VAL HG23 H 3.266 -4.566 2.028 1.00 . A A . 2 VAL HG23 1 1 10 1478 1 1 2 VAL N N 2.528 -2.255 -1.000 1.00 . A A . 2 VAL N 1 1 10 1479 1 1 2 VAL O O 2.179 -5.209 -2.997 1.00 . A A . 2 VAL O 1 1 10 1480 1 1 3 TYR C C 0.560 -4.428 -4.873 1.00 . A A . 3 TYR C 1 1 10 1481 1 1 3 TYR CA C -0.169 -3.890 -3.646 1.00 . A A . 3 TYR CA 1 1 10 1482 1 1 3 TYR CB C -1.050 -2.704 -4.043 1.00 . A A . 3 TYR CB 1 1 10 1483 1 1 3 TYR CD1 C -0.818 -0.775 -2.429 1.00 . A A . 3 TYR CD1 1 1 10 1484 1 1 3 TYR CD2 C -2.695 -2.224 -2.188 1.00 . A A . 3 TYR CD2 1 1 10 1485 1 1 3 TYR CE1 C -1.253 -0.026 -1.353 1.00 . A A . 3 TYR CE1 1 1 10 1486 1 1 3 TYR CE2 C -3.138 -1.480 -1.112 1.00 . A A . 3 TYR CE2 1 1 10 1487 1 1 3 TYR CG C -1.531 -1.886 -2.865 1.00 . A A . 3 TYR CG 1 1 10 1488 1 1 3 TYR CZ C -2.413 -0.381 -0.698 1.00 . A A . 3 TYR CZ 1 1 10 1489 1 1 3 TYR H H 0.593 -2.692 -2.077 1.00 . A A . 3 TYR H 1 1 10 1490 1 1 3 TYR HA H -0.795 -4.672 -3.242 1.00 . A A . 3 TYR HA 1 1 10 1491 1 1 3 TYR HB2 H -0.491 -2.050 -4.693 1.00 . A A . 3 TYR HB2 1 1 10 1492 1 1 3 TYR HB3 H -1.919 -3.070 -4.569 1.00 . A A . 3 TYR HB3 1 1 10 1493 1 1 3 TYR HD1 H 0.090 -0.499 -2.944 1.00 . A A . 3 TYR HD1 1 1 10 1494 1 1 3 TYR HD2 H -3.260 -3.086 -2.514 1.00 . A A . 3 TYR HD2 1 1 10 1495 1 1 3 TYR HE1 H -0.686 0.835 -1.029 1.00 . A A . 3 TYR HE1 1 1 10 1496 1 1 3 TYR HE2 H -4.047 -1.758 -0.598 1.00 . A A . 3 TYR HE2 1 1 10 1497 1 1 3 TYR HH H -3.808 0.424 0.352 1.00 . A A . 3 TYR HH 1 1 10 1498 1 1 3 TYR N N 0.777 -3.493 -2.610 1.00 . A A . 3 TYR N 1 1 10 1499 1 1 3 TYR O O 0.403 -5.592 -5.243 1.00 . A A . 3 TYR O 1 1 10 1500 1 1 3 TYR OH O -2.850 0.362 0.374 1.00 . A A . 3 TYR OH 1 1 10 1501 1 1 4 VAL C C 3.068 -5.111 -6.377 1.00 . A A . 4 VAL C 1 1 10 1502 1 1 4 VAL CA C 2.117 -3.960 -6.685 1.00 . A A . 4 VAL CA 1 1 10 1503 1 1 4 VAL CB C 2.927 -2.776 -7.247 1.00 . A A . 4 VAL CB 1 1 10 1504 1 1 4 VAL CG1 C 2.014 -1.802 -7.975 1.00 . A A . 4 VAL CG1 1 1 10 1505 1 1 4 VAL CG2 C 3.687 -2.075 -6.131 1.00 . A A . 4 VAL CG2 1 1 10 1506 1 1 4 VAL H H 1.445 -2.658 -5.158 1.00 . A A . 4 VAL H 1 1 10 1507 1 1 4 VAL HA H 1.414 -4.279 -7.441 1.00 . A A . 4 VAL HA 1 1 10 1508 1 1 4 VAL HB H 3.645 -3.162 -7.956 1.00 . A A . 4 VAL HB 1 1 10 1509 1 1 4 VAL HG11 H 2.535 -1.389 -8.826 1.00 . A A . 4 VAL HG11 1 1 10 1510 1 1 4 VAL HG12 H 1.128 -2.322 -8.311 1.00 . A A . 4 VAL HG12 1 1 10 1511 1 1 4 VAL HG13 H 1.731 -1.004 -7.305 1.00 . A A . 4 VAL HG13 1 1 10 1512 1 1 4 VAL HG21 H 3.395 -2.492 -5.179 1.00 . A A . 4 VAL HG21 1 1 10 1513 1 1 4 VAL HG22 H 4.749 -2.215 -6.275 1.00 . A A . 4 VAL HG22 1 1 10 1514 1 1 4 VAL HG23 H 3.459 -1.020 -6.148 1.00 . A A . 4 VAL HG23 1 1 10 1515 1 1 4 VAL N N 1.361 -3.572 -5.500 1.00 . A A . 4 VAL N 1 1 10 1516 1 1 4 VAL O O 3.207 -6.045 -7.168 1.00 . A A . 4 VAL O 1 1 10 1517 1 1 5 TYR C C 3.985 -7.443 -4.778 1.00 . A A . 5 TYR C 1 1 10 1518 1 1 5 TYR CA C 4.661 -6.075 -4.810 1.00 . A A . 5 TYR CA 1 1 10 1519 1 1 5 TYR CB C 5.240 -5.748 -3.432 1.00 . A A . 5 TYR CB 1 1 10 1520 1 1 5 TYR CD1 C 7.495 -4.612 -3.447 1.00 . A A . 5 TYR CD1 1 1 10 1521 1 1 5 TYR CD2 C 5.546 -3.242 -3.377 1.00 . A A . 5 TYR CD2 1 1 10 1522 1 1 5 TYR CE1 C 8.293 -3.484 -3.435 1.00 . A A . 5 TYR CE1 1 1 10 1523 1 1 5 TYR CE2 C 6.336 -2.109 -3.365 1.00 . A A . 5 TYR CE2 1 1 10 1524 1 1 5 TYR CG C 6.109 -4.511 -3.419 1.00 . A A . 5 TYR CG 1 1 10 1525 1 1 5 TYR CZ C 7.709 -2.236 -3.394 1.00 . A A . 5 TYR CZ 1 1 10 1526 1 1 5 TYR H H 3.568 -4.271 -4.634 1.00 . A A . 5 TYR H 1 1 10 1527 1 1 5 TYR HA H 5.465 -6.099 -5.531 1.00 . A A . 5 TYR HA 1 1 10 1528 1 1 5 TYR HB2 H 4.430 -5.591 -2.737 1.00 . A A . 5 TYR HB2 1 1 10 1529 1 1 5 TYR HB3 H 5.841 -6.580 -3.095 1.00 . A A . 5 TYR HB3 1 1 10 1530 1 1 5 TYR HD1 H 7.949 -5.591 -3.479 1.00 . A A . 5 TYR HD1 1 1 10 1531 1 1 5 TYR HD2 H 4.470 -3.146 -3.354 1.00 . A A . 5 TYR HD2 1 1 10 1532 1 1 5 TYR HE1 H 9.369 -3.583 -3.458 1.00 . A A . 5 TYR HE1 1 1 10 1533 1 1 5 TYR HE2 H 5.879 -1.131 -3.333 1.00 . A A . 5 TYR HE2 1 1 10 1534 1 1 5 TYR HH H 9.047 -1.094 -4.171 1.00 . A A . 5 TYR HH 1 1 10 1535 1 1 5 TYR N N 3.721 -5.039 -5.222 1.00 . A A . 5 TYR N 1 1 10 1536 1 1 5 TYR O O 4.646 -8.476 -4.881 1.00 . A A . 5 TYR O 1 1 10 1537 1 1 5 TYR OH O 8.501 -1.110 -3.381 1.00 . A A . 5 TYR OH 1 1 10 1538 1 1 6 SER C C 1.432 -9.085 -5.983 1.00 . A A . 6 SER C 1 1 10 1539 1 1 6 SER CA C 1.897 -8.679 -4.588 1.00 . A A . 6 SER CA 1 1 10 1540 1 1 6 SER CB C 0.690 -8.522 -3.661 1.00 . A A . 6 SER CB 1 1 10 1541 1 1 6 SER H H 2.194 -6.583 -4.560 1.00 . A A . 6 SER H 1 1 10 1542 1 1 6 SER HA H 2.542 -9.452 -4.198 1.00 . A A . 6 SER HA 1 1 10 1543 1 1 6 SER HB2 H 0.876 -7.716 -2.967 1.00 . A A . 6 SER HB2 1 1 10 1544 1 1 6 SER HB3 H -0.186 -8.294 -4.251 1.00 . A A . 6 SER HB3 1 1 10 1545 1 1 6 SER HG H -0.123 -9.518 -2.184 1.00 . A A . 6 SER HG 1 1 10 1546 1 1 6 SER N N 2.664 -7.439 -4.636 1.00 . A A . 6 SER N 1 1 10 1547 1 1 6 SER O O 1.270 -10.269 -6.276 1.00 . A A . 6 SER O 1 1 10 1548 1 1 6 SER OG O 0.452 -9.711 -2.928 1.00 . A A . 6 SER OG 1 1 10 1549 1 1 7 ARG C C 1.916 -8.864 -9.067 1.00 . A A . 7 ARG C 1 1 10 1550 1 1 7 ARG CA C 0.770 -8.344 -8.205 1.00 . A A . 7 ARG CA 1 1 10 1551 1 1 7 ARG CB C 0.195 -7.066 -8.820 1.00 . A A . 7 ARG CB 1 1 10 1552 1 1 7 ARG CD C 0.220 -5.419 -10.718 1.00 . A A . 7 ARG CD 1 1 10 1553 1 1 7 ARG CG C 0.810 -6.706 -10.162 1.00 . A A . 7 ARG CG 1 1 10 1554 1 1 7 ARG CZ C 0.341 -5.643 -13.163 1.00 . A A . 7 ARG CZ 1 1 10 1555 1 1 7 ARG H H 1.364 -7.168 -6.549 1.00 . A A . 7 ARG H 1 1 10 1556 1 1 7 ARG HA H -0.005 -9.094 -8.166 1.00 . A A . 7 ARG HA 1 1 10 1557 1 1 7 ARG HB2 H -0.869 -7.194 -8.959 1.00 . A A . 7 ARG HB2 1 1 10 1558 1 1 7 ARG HB3 H 0.364 -6.246 -8.139 1.00 . A A . 7 ARG HB3 1 1 10 1559 1 1 7 ARG HD2 H -0.545 -5.068 -10.042 1.00 . A A . 7 ARG HD2 1 1 10 1560 1 1 7 ARG HD3 H 1.005 -4.680 -10.788 1.00 . A A . 7 ARG HD3 1 1 10 1561 1 1 7 ARG HE H -1.340 -5.727 -12.092 1.00 . A A . 7 ARG HE 1 1 10 1562 1 1 7 ARG HG2 H 1.875 -6.575 -10.036 1.00 . A A . 7 ARG HG2 1 1 10 1563 1 1 7 ARG HG3 H 0.623 -7.508 -10.860 1.00 . A A . 7 ARG HG3 1 1 10 1564 1 1 7 ARG HH11 H 2.118 -5.356 -12.247 1.00 . A A . 7 ARG HH11 1 1 10 1565 1 1 7 ARG HH12 H 2.189 -5.516 -13.971 1.00 . A A . 7 ARG HH12 1 1 10 1566 1 1 7 ARG HH21 H -1.260 -5.938 -14.362 1.00 . A A . 7 ARG HH21 1 1 10 1567 1 1 7 ARG HH22 H 0.267 -5.846 -15.173 1.00 . A A . 7 ARG HH22 1 1 10 1568 1 1 7 ARG N N 1.218 -8.092 -6.841 1.00 . A A . 7 ARG N 1 1 10 1569 1 1 7 ARG NE N -0.368 -5.613 -12.040 1.00 . A A . 7 ARG NE 1 1 10 1570 1 1 7 ARG NH1 N 1.657 -5.492 -13.124 1.00 . A A . 7 ARG NH1 1 1 10 1571 1 1 7 ARG NH2 N -0.267 -5.824 -14.328 1.00 . A A . 7 ARG NH2 1 1 10 1572 1 1 7 ARG O O 1.740 -9.786 -9.863 1.00 . A A . 7 ARG O 1 1 10 1573 1 1 8 VAL C C 4.491 -10.175 -9.575 1.00 . A A . 8 VAL C 1 1 10 1574 1 1 8 VAL CA C 4.268 -8.669 -9.664 1.00 . A A . 8 VAL CA 1 1 10 1575 1 1 8 VAL CB C 5.533 -7.944 -9.169 1.00 . A A . 8 VAL CB 1 1 10 1576 1 1 8 VAL CG1 C 6.722 -8.276 -10.057 1.00 . A A . 8 VAL CG1 1 1 10 1577 1 1 8 VAL CG2 C 5.300 -6.441 -9.116 1.00 . A A . 8 VAL CG2 1 1 10 1578 1 1 8 VAL H H 3.171 -7.537 -8.252 1.00 . A A . 8 VAL H 1 1 10 1579 1 1 8 VAL HA H 4.105 -8.400 -10.697 1.00 . A A . 8 VAL HA 1 1 10 1580 1 1 8 VAL HB H 5.753 -8.287 -8.168 1.00 . A A . 8 VAL HB 1 1 10 1581 1 1 8 VAL HG11 H 7.384 -7.424 -10.107 1.00 . A A . 8 VAL HG11 1 1 10 1582 1 1 8 VAL HG12 H 7.253 -9.122 -9.647 1.00 . A A . 8 VAL HG12 1 1 10 1583 1 1 8 VAL HG13 H 6.372 -8.517 -11.051 1.00 . A A . 8 VAL HG13 1 1 10 1584 1 1 8 VAL HG21 H 4.319 -6.217 -9.509 1.00 . A A . 8 VAL HG21 1 1 10 1585 1 1 8 VAL HG22 H 5.364 -6.102 -8.093 1.00 . A A . 8 VAL HG22 1 1 10 1586 1 1 8 VAL HG23 H 6.049 -5.939 -9.710 1.00 . A A . 8 VAL HG23 1 1 10 1587 1 1 8 VAL N N 3.092 -8.266 -8.902 1.00 . A A . 8 VAL N 1 1 10 1588 1 1 8 VAL O O 4.390 -10.889 -10.572 1.00 . A A . 8 VAL O 1 1 10 1589 1 1 9 LYS C C 3.746 -12.874 -8.337 1.00 . A A . 9 LYS C 1 1 10 1590 1 1 9 LYS CA C 5.031 -12.074 -8.150 1.00 . A A . 9 LYS CA 1 1 10 1591 1 1 9 LYS CB C 5.590 -12.305 -6.744 1.00 . A A . 9 LYS CB 1 1 10 1592 1 1 9 LYS CD C 7.054 -10.601 -5.621 1.00 . A A . 9 LYS CD 1 1 10 1593 1 1 9 LYS CE C 7.999 -9.525 -6.133 1.00 . A A . 9 LYS CE 1 1 10 1594 1 1 9 LYS CG C 7.008 -11.794 -6.562 1.00 . A A . 9 LYS CG 1 1 10 1595 1 1 9 LYS H H 4.861 -10.033 -7.615 1.00 . A A . 9 LYS H 1 1 10 1596 1 1 9 LYS HA H 5.757 -12.407 -8.876 1.00 . A A . 9 LYS HA 1 1 10 1597 1 1 9 LYS HB2 H 4.954 -11.804 -6.030 1.00 . A A . 9 LYS HB2 1 1 10 1598 1 1 9 LYS HB3 H 5.582 -13.366 -6.538 1.00 . A A . 9 LYS HB3 1 1 10 1599 1 1 9 LYS HD2 H 6.062 -10.183 -5.536 1.00 . A A . 9 LYS HD2 1 1 10 1600 1 1 9 LYS HD3 H 7.392 -10.933 -4.650 1.00 . A A . 9 LYS HD3 1 1 10 1601 1 1 9 LYS HE2 H 8.998 -9.749 -5.792 1.00 . A A . 9 LYS HE2 1 1 10 1602 1 1 9 LYS HE3 H 7.977 -9.529 -7.213 1.00 . A A . 9 LYS HE3 1 1 10 1603 1 1 9 LYS HG2 H 7.617 -12.586 -6.151 1.00 . A A . 9 LYS HG2 1 1 10 1604 1 1 9 LYS HG3 H 7.401 -11.498 -7.524 1.00 . A A . 9 LYS HG3 1 1 10 1605 1 1 9 LYS HZ1 H 6.822 -8.246 -4.975 1.00 . A A . 9 LYS HZ1 1 1 10 1606 1 1 9 LYS HZ2 H 7.320 -7.574 -6.445 1.00 . A A . 9 LYS HZ2 1 1 10 1607 1 1 9 LYS HZ3 H 8.419 -7.720 -5.167 1.00 . A A . 9 LYS HZ3 1 1 10 1608 1 1 9 LYS N N 4.795 -10.652 -8.372 1.00 . A A . 9 LYS N 1 1 10 1609 1 1 9 LYS NZ N 7.613 -8.171 -5.646 1.00 . A A . 9 LYS NZ 1 1 10 1610 1 1 9 LYS O O 3.135 -13.320 -7.365 1.00 . A A . 9 LYS O 1 1 11 1611 1 1 1 THR C C 2.513 -1.631 -1.897 1.00 . A A . 1 THR C 1 1 11 1612 1 1 1 THR CA C 2.046 -0.264 -1.409 1.00 . A A . 1 THR CA 1 1 11 1613 1 1 1 THR CB C 3.257 0.685 -1.341 1.00 . A A . 1 THR CB 1 1 11 1614 1 1 1 THR CG2 C 3.412 1.458 -2.643 1.00 . A A . 1 THR CG2 1 1 11 1615 1 1 1 THR H1 H 1.918 -0.475 0.693 1.00 . A A . 1 THR H1 1 1 11 1616 1 1 1 THR HA H 1.338 0.138 -2.119 1.00 . A A . 1 THR HA 1 1 11 1617 1 1 1 THR HB H 4.149 0.096 -1.181 1.00 . A A . 1 THR HB 1 1 11 1618 1 1 1 THR HG1 H 2.203 1.943 -0.247 1.00 . A A . 1 THR HG1 1 1 11 1619 1 1 1 THR HG21 H 3.870 0.822 -3.386 1.00 . A A . 1 THR HG21 1 1 11 1620 1 1 1 THR HG22 H 4.036 2.323 -2.475 1.00 . A A . 1 THR HG22 1 1 11 1621 1 1 1 THR HG23 H 2.441 1.776 -2.990 1.00 . A A . 1 THR HG23 1 1 11 1622 1 1 1 THR N N 1.378 -0.367 -0.117 1.00 . A A . 1 THR N 1 1 11 1623 1 1 1 THR O O 3.156 -1.742 -2.940 1.00 . A A . 1 THR O 1 1 11 1624 1 1 1 THR OG1 O 3.101 1.602 -0.252 1.00 . A A . 1 THR OG1 1 1 11 1625 1 1 2 VAL C C 1.657 -4.593 -2.577 1.00 . A A . 2 VAL C 1 1 11 1626 1 1 2 VAL CA C 2.568 -4.031 -1.492 1.00 . A A . 2 VAL CA 1 1 11 1627 1 1 2 VAL CB C 2.527 -4.964 -0.267 1.00 . A A . 2 VAL CB 1 1 11 1628 1 1 2 VAL CG1 C 3.272 -6.258 -0.557 1.00 . A A . 2 VAL CG1 1 1 11 1629 1 1 2 VAL CG2 C 3.108 -4.267 0.954 1.00 . A A . 2 VAL CG2 1 1 11 1630 1 1 2 VAL H H 1.670 -2.518 -0.315 1.00 . A A . 2 VAL H 1 1 11 1631 1 1 2 VAL HA H 3.582 -4.005 -1.864 1.00 . A A . 2 VAL HA 1 1 11 1632 1 1 2 VAL HB H 1.495 -5.207 -0.060 1.00 . A A . 2 VAL HB 1 1 11 1633 1 1 2 VAL HG11 H 4.334 -6.063 -0.590 1.00 . A A . 2 VAL HG11 1 1 11 1634 1 1 2 VAL HG12 H 3.061 -6.977 0.221 1.00 . A A . 2 VAL HG12 1 1 11 1635 1 1 2 VAL HG13 H 2.950 -6.653 -1.509 1.00 . A A . 2 VAL HG13 1 1 11 1636 1 1 2 VAL HG21 H 4.115 -3.942 0.737 1.00 . A A . 2 VAL HG21 1 1 11 1637 1 1 2 VAL HG22 H 2.499 -3.410 1.203 1.00 . A A . 2 VAL HG22 1 1 11 1638 1 1 2 VAL HG23 H 3.122 -4.953 1.788 1.00 . A A . 2 VAL HG23 1 1 11 1639 1 1 2 VAL N N 2.184 -2.670 -1.135 1.00 . A A . 2 VAL N 1 1 11 1640 1 1 2 VAL O O 2.025 -5.527 -3.289 1.00 . A A . 2 VAL O 1 1 11 1641 1 1 3 TYR C C 0.177 -4.700 -5.041 1.00 . A A . 3 TYR C 1 1 11 1642 1 1 3 TYR CA C -0.500 -4.462 -3.695 1.00 . A A . 3 TYR CA 1 1 11 1643 1 1 3 TYR CB C -1.618 -3.429 -3.849 1.00 . A A . 3 TYR CB 1 1 11 1644 1 1 3 TYR CD1 C -1.663 -1.784 -5.764 1.00 . A A . 3 TYR CD1 1 1 11 1645 1 1 3 TYR CD2 C -0.255 -1.304 -3.901 1.00 . A A . 3 TYR CD2 1 1 11 1646 1 1 3 TYR CE1 C -1.257 -0.615 -6.378 1.00 . A A . 3 TYR CE1 1 1 11 1647 1 1 3 TYR CE2 C 0.156 -0.132 -4.507 1.00 . A A . 3 TYR CE2 1 1 11 1648 1 1 3 TYR CG C -1.170 -2.149 -4.517 1.00 . A A . 3 TYR CG 1 1 11 1649 1 1 3 TYR CZ C -0.348 0.208 -5.746 1.00 . A A . 3 TYR CZ 1 1 11 1650 1 1 3 TYR H H 0.230 -3.277 -2.101 1.00 . A A . 3 TYR H 1 1 11 1651 1 1 3 TYR HA H -0.928 -5.392 -3.351 1.00 . A A . 3 TYR HA 1 1 11 1652 1 1 3 TYR HB2 H -2.411 -3.854 -4.445 1.00 . A A . 3 TYR HB2 1 1 11 1653 1 1 3 TYR HB3 H -2.003 -3.178 -2.872 1.00 . A A . 3 TYR HB3 1 1 11 1654 1 1 3 TYR HD1 H -2.375 -2.430 -6.257 1.00 . A A . 3 TYR HD1 1 1 11 1655 1 1 3 TYR HD2 H 0.138 -1.574 -2.932 1.00 . A A . 3 TYR HD2 1 1 11 1656 1 1 3 TYR HE1 H -1.651 -0.348 -7.348 1.00 . A A . 3 TYR HE1 1 1 11 1657 1 1 3 TYR HE2 H 0.868 0.512 -4.013 1.00 . A A . 3 TYR HE2 1 1 11 1658 1 1 3 TYR HH H 1.019 1.407 -6.369 1.00 . A A . 3 TYR HH 1 1 11 1659 1 1 3 TYR N N 0.466 -4.017 -2.698 1.00 . A A . 3 TYR N 1 1 11 1660 1 1 3 TYR O O -0.163 -5.637 -5.764 1.00 . A A . 3 TYR O 1 1 11 1661 1 1 3 TYR OH O 0.060 1.373 -6.353 1.00 . A A . 3 TYR OH 1 1 11 1662 1 1 4 VAL C C 3.015 -4.959 -6.510 1.00 . A A . 4 VAL C 1 1 11 1663 1 1 4 VAL CA C 1.868 -3.961 -6.629 1.00 . A A . 4 VAL CA 1 1 11 1664 1 1 4 VAL CB C 2.430 -2.600 -7.081 1.00 . A A . 4 VAL CB 1 1 11 1665 1 1 4 VAL CG1 C 1.352 -1.780 -7.772 1.00 . A A . 4 VAL CG1 1 1 11 1666 1 1 4 VAL CG2 C 3.009 -1.844 -5.895 1.00 . A A . 4 VAL CG2 1 1 11 1667 1 1 4 VAL H H 1.366 -3.119 -4.754 1.00 . A A . 4 VAL H 1 1 11 1668 1 1 4 VAL HA H 1.177 -4.310 -7.384 1.00 . A A . 4 VAL HA 1 1 11 1669 1 1 4 VAL HB H 3.225 -2.779 -7.789 1.00 . A A . 4 VAL HB 1 1 11 1670 1 1 4 VAL HG11 H 1.375 -0.767 -7.396 1.00 . A A . 4 VAL HG11 1 1 11 1671 1 1 4 VAL HG12 H 1.531 -1.774 -8.837 1.00 . A A . 4 VAL HG12 1 1 11 1672 1 1 4 VAL HG13 H 0.384 -2.215 -7.572 1.00 . A A . 4 VAL HG13 1 1 11 1673 1 1 4 VAL HG21 H 3.938 -1.377 -6.185 1.00 . A A . 4 VAL HG21 1 1 11 1674 1 1 4 VAL HG22 H 2.309 -1.085 -5.574 1.00 . A A . 4 VAL HG22 1 1 11 1675 1 1 4 VAL HG23 H 3.190 -2.532 -5.082 1.00 . A A . 4 VAL HG23 1 1 11 1676 1 1 4 VAL N N 1.140 -3.845 -5.371 1.00 . A A . 4 VAL N 1 1 11 1677 1 1 4 VAL O O 3.305 -5.702 -7.448 1.00 . A A . 4 VAL O 1 1 11 1678 1 1 5 TYR C C 4.365 -7.325 -5.334 1.00 . A A . 5 TYR C 1 1 11 1679 1 1 5 TYR CA C 4.781 -5.875 -5.109 1.00 . A A . 5 TYR CA 1 1 11 1680 1 1 5 TYR CB C 5.308 -5.698 -3.685 1.00 . A A . 5 TYR CB 1 1 11 1681 1 1 5 TYR CD1 C 5.846 -3.231 -3.683 1.00 . A A . 5 TYR CD1 1 1 11 1682 1 1 5 TYR CD2 C 7.615 -4.768 -3.248 1.00 . A A . 5 TYR CD2 1 1 11 1683 1 1 5 TYR CE1 C 6.725 -2.174 -3.548 1.00 . A A . 5 TYR CE1 1 1 11 1684 1 1 5 TYR CE2 C 8.501 -3.717 -3.109 1.00 . A A . 5 TYR CE2 1 1 11 1685 1 1 5 TYR CG C 6.274 -4.545 -3.535 1.00 . A A . 5 TYR CG 1 1 11 1686 1 1 5 TYR CZ C 8.051 -2.422 -3.261 1.00 . A A . 5 TYR CZ 1 1 11 1687 1 1 5 TYR H H 3.386 -4.354 -4.642 1.00 . A A . 5 TYR H 1 1 11 1688 1 1 5 TYR HA H 5.567 -5.625 -5.807 1.00 . A A . 5 TYR HA 1 1 11 1689 1 1 5 TYR HB2 H 4.477 -5.522 -3.020 1.00 . A A . 5 TYR HB2 1 1 11 1690 1 1 5 TYR HB3 H 5.819 -6.601 -3.383 1.00 . A A . 5 TYR HB3 1 1 11 1691 1 1 5 TYR HD1 H 4.807 -3.040 -3.907 1.00 . A A . 5 TYR HD1 1 1 11 1692 1 1 5 TYR HD2 H 7.964 -5.784 -3.130 1.00 . A A . 5 TYR HD2 1 1 11 1693 1 1 5 TYR HE1 H 6.373 -1.159 -3.666 1.00 . A A . 5 TYR HE1 1 1 11 1694 1 1 5 TYR HE2 H 9.539 -3.911 -2.885 1.00 . A A . 5 TYR HE2 1 1 11 1695 1 1 5 TYR HH H 9.471 -1.304 -3.916 1.00 . A A . 5 TYR HH 1 1 11 1696 1 1 5 TYR N N 3.663 -4.970 -5.351 1.00 . A A . 5 TYR N 1 1 11 1697 1 1 5 TYR O O 5.200 -8.186 -5.613 1.00 . A A . 5 TYR O 1 1 11 1698 1 1 5 TYR OH O 8.931 -1.372 -3.125 1.00 . A A . 5 TYR OH 1 1 11 1699 1 1 6 SER C C 2.322 -9.234 -6.876 1.00 . A A . 6 SER C 1 1 11 1700 1 1 6 SER CA C 2.540 -8.935 -5.396 1.00 . A A . 6 SER CA 1 1 11 1701 1 1 6 SER CB C 1.225 -9.100 -4.632 1.00 . A A . 6 SER CB 1 1 11 1702 1 1 6 SER H H 2.452 -6.860 -4.986 1.00 . A A . 6 SER H 1 1 11 1703 1 1 6 SER HA H 3.265 -9.632 -5.003 1.00 . A A . 6 SER HA 1 1 11 1704 1 1 6 SER HB2 H 1.429 -9.128 -3.572 1.00 . A A . 6 SER HB2 1 1 11 1705 1 1 6 SER HB3 H 0.577 -8.264 -4.852 1.00 . A A . 6 SER HB3 1 1 11 1706 1 1 6 SER HG H -0.384 -10.169 -4.958 1.00 . A A . 6 SER HG 1 1 11 1707 1 1 6 SER N N 3.068 -7.588 -5.210 1.00 . A A . 6 SER N 1 1 11 1708 1 1 6 SER O O 2.353 -10.389 -7.299 1.00 . A A . 6 SER O 1 1 11 1709 1 1 6 SER OG O 0.567 -10.299 -5.002 1.00 . A A . 6 SER OG 1 1 11 1710 1 1 7 ARG C C 3.181 -8.652 -9.816 1.00 . A A . 7 ARG C 1 1 11 1711 1 1 7 ARG CA C 1.877 -8.331 -9.092 1.00 . A A . 7 ARG CA 1 1 11 1712 1 1 7 ARG CB C 1.262 -7.054 -9.668 1.00 . A A . 7 ARG CB 1 1 11 1713 1 1 7 ARG CD C -0.253 -5.080 -9.319 1.00 . A A . 7 ARG CD 1 1 11 1714 1 1 7 ARG CG C 0.251 -6.394 -8.744 1.00 . A A . 7 ARG CG 1 1 11 1715 1 1 7 ARG CZ C -2.622 -5.001 -8.666 1.00 . A A . 7 ARG CZ 1 1 11 1716 1 1 7 ARG H H 2.088 -7.286 -7.264 1.00 . A A . 7 ARG H 1 1 11 1717 1 1 7 ARG HA H 1.187 -9.149 -9.237 1.00 . A A . 7 ARG HA 1 1 11 1718 1 1 7 ARG HB2 H 2.052 -6.345 -9.866 1.00 . A A . 7 ARG HB2 1 1 11 1719 1 1 7 ARG HB3 H 0.765 -7.295 -10.596 1.00 . A A . 7 ARG HB3 1 1 11 1720 1 1 7 ARG HD2 H 0.553 -4.362 -9.302 1.00 . A A . 7 ARG HD2 1 1 11 1721 1 1 7 ARG HD3 H -0.567 -5.245 -10.339 1.00 . A A . 7 ARG HD3 1 1 11 1722 1 1 7 ARG HE H -1.199 -3.811 -7.934 1.00 . A A . 7 ARG HE 1 1 11 1723 1 1 7 ARG HG2 H -0.588 -7.060 -8.609 1.00 . A A . 7 ARG HG2 1 1 11 1724 1 1 7 ARG HG3 H 0.720 -6.204 -7.790 1.00 . A A . 7 ARG HG3 1 1 11 1725 1 1 7 ARG HH11 H -2.167 -6.402 -10.049 1.00 . A A . 7 ARG HH11 1 1 11 1726 1 1 7 ARG HH12 H -3.834 -6.336 -9.579 1.00 . A A . 7 ARG HH12 1 1 11 1727 1 1 7 ARG HH21 H -3.390 -3.715 -7.308 1.00 . A A . 7 ARG HH21 1 1 11 1728 1 1 7 ARG HH22 H -4.528 -4.807 -8.021 1.00 . A A . 7 ARG HH22 1 1 11 1729 1 1 7 ARG N N 2.101 -8.182 -7.659 1.00 . A A . 7 ARG N 1 1 11 1730 1 1 7 ARG NE N -1.379 -4.546 -8.557 1.00 . A A . 7 ARG NE 1 1 11 1731 1 1 7 ARG NH1 N -2.897 -5.994 -9.500 1.00 . A A . 7 ARG NH1 1 1 11 1732 1 1 7 ARG NH2 N -3.593 -4.464 -7.939 1.00 . A A . 7 ARG NH2 1 1 11 1733 1 1 7 ARG O O 3.264 -9.626 -10.565 1.00 . A A . 7 ARG O 1 1 11 1734 1 1 8 VAL C C 5.942 -9.476 -10.121 1.00 . A A . 8 VAL C 1 1 11 1735 1 1 8 VAL CA C 5.497 -8.021 -10.219 1.00 . A A . 8 VAL CA 1 1 11 1736 1 1 8 VAL CB C 6.572 -7.123 -9.579 1.00 . A A . 8 VAL CB 1 1 11 1737 1 1 8 VAL CG1 C 7.886 -7.240 -10.336 1.00 . A A . 8 VAL CG1 1 1 11 1738 1 1 8 VAL CG2 C 6.100 -5.678 -9.533 1.00 . A A . 8 VAL CG2 1 1 11 1739 1 1 8 VAL H H 4.069 -7.067 -8.982 1.00 . A A . 8 VAL H 1 1 11 1740 1 1 8 VAL HA H 5.407 -7.752 -11.261 1.00 . A A . 8 VAL HA 1 1 11 1741 1 1 8 VAL HB H 6.735 -7.459 -8.565 1.00 . A A . 8 VAL HB 1 1 11 1742 1 1 8 VAL HG11 H 8.440 -6.318 -10.239 1.00 . A A . 8 VAL HG11 1 1 11 1743 1 1 8 VAL HG12 H 8.466 -8.055 -9.927 1.00 . A A . 8 VAL HG12 1 1 11 1744 1 1 8 VAL HG13 H 7.684 -7.430 -11.380 1.00 . A A . 8 VAL HG13 1 1 11 1745 1 1 8 VAL HG21 H 5.674 -5.470 -8.563 1.00 . A A . 8 VAL HG21 1 1 11 1746 1 1 8 VAL HG22 H 6.939 -5.019 -9.706 1.00 . A A . 8 VAL HG22 1 1 11 1747 1 1 8 VAL HG23 H 5.354 -5.518 -10.297 1.00 . A A . 8 VAL HG23 1 1 11 1748 1 1 8 VAL N N 4.197 -7.826 -9.589 1.00 . A A . 8 VAL N 1 1 11 1749 1 1 8 VAL O O 6.080 -10.164 -11.133 1.00 . A A . 8 VAL O 1 1 11 1750 1 1 9 LYS C C 5.441 -12.289 -8.897 1.00 . A A . 9 LYS C 1 1 11 1751 1 1 9 LYS CA C 6.591 -11.315 -8.664 1.00 . A A . 9 LYS CA 1 1 11 1752 1 1 9 LYS CB C 7.124 -11.471 -7.238 1.00 . A A . 9 LYS CB 1 1 11 1753 1 1 9 LYS CD C 6.759 -10.781 -4.850 1.00 . A A . 9 LYS CD 1 1 11 1754 1 1 9 LYS CE C 5.786 -10.887 -3.686 1.00 . A A . 9 LYS CE 1 1 11 1755 1 1 9 LYS CG C 6.096 -11.151 -6.166 1.00 . A A . 9 LYS CG 1 1 11 1756 1 1 9 LYS H H 6.036 -9.343 -8.129 1.00 . A A . 9 LYS H 1 1 11 1757 1 1 9 LYS HA H 7.384 -11.538 -9.362 1.00 . A A . 9 LYS HA 1 1 11 1758 1 1 9 LYS HB2 H 7.454 -12.490 -7.099 1.00 . A A . 9 LYS HB2 1 1 11 1759 1 1 9 LYS HB3 H 7.967 -10.808 -7.107 1.00 . A A . 9 LYS HB3 1 1 11 1760 1 1 9 LYS HD2 H 7.588 -11.450 -4.673 1.00 . A A . 9 LYS HD2 1 1 11 1761 1 1 9 LYS HD3 H 7.122 -9.764 -4.914 1.00 . A A . 9 LYS HD3 1 1 11 1762 1 1 9 LYS HE2 H 4.840 -10.462 -3.985 1.00 . A A . 9 LYS HE2 1 1 11 1763 1 1 9 LYS HE3 H 5.651 -11.930 -3.441 1.00 . A A . 9 LYS HE3 1 1 11 1764 1 1 9 LYS HG2 H 5.490 -10.322 -6.497 1.00 . A A . 9 LYS HG2 1 1 11 1765 1 1 9 LYS HG3 H 5.470 -12.019 -6.011 1.00 . A A . 9 LYS HG3 1 1 11 1766 1 1 9 LYS HZ1 H 6.429 -10.835 -1.699 1.00 . A A . 9 LYS HZ1 1 1 11 1767 1 1 9 LYS HZ2 H 5.589 -9.449 -2.184 1.00 . A A . 9 LYS HZ2 1 1 11 1768 1 1 9 LYS HZ3 H 7.184 -9.693 -2.693 1.00 . A A . 9 LYS HZ3 1 1 11 1769 1 1 9 LYS N N 6.164 -9.940 -8.896 1.00 . A A . 9 LYS N 1 1 11 1770 1 1 9 LYS NZ N 6.282 -10.165 -2.481 1.00 . A A . 9 LYS NZ 1 1 11 1771 1 1 9 LYS O O 5.316 -12.870 -9.976 1.00 . A A . 9 LYS O 1 1 12 1772 1 1 1 THR C C 2.305 -1.440 -1.951 1.00 . A A . 1 THR C 1 1 12 1773 1 1 1 THR CA C 1.913 -0.022 -1.554 1.00 . A A . 1 THR CA 1 1 12 1774 1 1 1 THR CB C 3.179 0.854 -1.504 1.00 . A A . 1 THR CB 1 1 12 1775 1 1 1 THR CG2 C 3.415 1.540 -2.841 1.00 . A A . 1 THR CG2 1 1 12 1776 1 1 1 THR H1 H 1.718 -0.103 0.552 1.00 . A A . 1 THR H1 1 1 12 1777 1 1 1 THR HA H 1.250 0.382 -2.306 1.00 . A A . 1 THR HA 1 1 12 1778 1 1 1 THR HB H 4.028 0.221 -1.287 1.00 . A A . 1 THR HB 1 1 12 1779 1 1 1 THR HG1 H 3.851 2.373 -0.441 1.00 . A A . 1 THR HG1 1 1 12 1780 1 1 1 THR HG21 H 2.477 1.911 -3.226 1.00 . A A . 1 THR HG21 1 1 12 1781 1 1 1 THR HG22 H 3.838 0.833 -3.539 1.00 . A A . 1 THR HG22 1 1 12 1782 1 1 1 THR HG23 H 4.099 2.365 -2.706 1.00 . A A . 1 THR HG23 1 1 12 1783 1 1 1 THR N N 1.207 -0.009 -0.279 1.00 . A A . 1 THR N 1 1 12 1784 1 1 1 THR O O 2.966 -1.651 -2.968 1.00 . A A . 1 THR O 1 1 12 1785 1 1 1 THR OG1 O 3.054 1.838 -0.472 1.00 . A A . 1 THR OG1 1 1 12 1786 1 1 2 VAL C C 1.281 -4.378 -2.489 1.00 . A A . 2 VAL C 1 1 12 1787 1 1 2 VAL CA C 2.198 -3.812 -1.412 1.00 . A A . 2 VAL CA 1 1 12 1788 1 1 2 VAL CB C 2.068 -4.669 -0.139 1.00 . A A . 2 VAL CB 1 1 12 1789 1 1 2 VAL CG1 C 2.735 -6.021 -0.335 1.00 . A A . 2 VAL CG1 1 1 12 1790 1 1 2 VAL CG2 C 2.662 -3.940 1.057 1.00 . A A . 2 VAL CG2 1 1 12 1791 1 1 2 VAL H H 1.368 -2.181 -0.348 1.00 . A A . 2 VAL H 1 1 12 1792 1 1 2 VAL HA H 3.221 -3.869 -1.756 1.00 . A A . 2 VAL HA 1 1 12 1793 1 1 2 VAL HB H 1.018 -4.835 0.053 1.00 . A A . 2 VAL HB 1 1 12 1794 1 1 2 VAL HG11 H 2.413 -6.449 -1.273 1.00 . A A . 2 VAL HG11 1 1 12 1795 1 1 2 VAL HG12 H 3.808 -5.896 -0.345 1.00 . A A . 2 VAL HG12 1 1 12 1796 1 1 2 VAL HG13 H 2.457 -6.680 0.475 1.00 . A A . 2 VAL HG13 1 1 12 1797 1 1 2 VAL HG21 H 2.103 -3.034 1.239 1.00 . A A . 2 VAL HG21 1 1 12 1798 1 1 2 VAL HG22 H 2.609 -4.576 1.929 1.00 . A A . 2 VAL HG22 1 1 12 1799 1 1 2 VAL HG23 H 3.693 -3.694 0.853 1.00 . A A . 2 VAL HG23 1 1 12 1800 1 1 2 VAL N N 1.892 -2.412 -1.143 1.00 . A A . 2 VAL N 1 1 12 1801 1 1 2 VAL O O 1.608 -5.373 -3.138 1.00 . A A . 2 VAL O 1 1 12 1802 1 1 3 TYR C C -0.141 -4.535 -4.985 1.00 . A A . 3 TYR C 1 1 12 1803 1 1 3 TYR CA C -0.835 -4.180 -3.674 1.00 . A A . 3 TYR CA 1 1 12 1804 1 1 3 TYR CB C -1.882 -3.092 -3.917 1.00 . A A . 3 TYR CB 1 1 12 1805 1 1 3 TYR CD1 C -0.388 -1.060 -4.049 1.00 . A A . 3 TYR CD1 1 1 12 1806 1 1 3 TYR CD2 C -1.779 -1.557 -5.919 1.00 . A A . 3 TYR CD2 1 1 12 1807 1 1 3 TYR CE1 C 0.110 0.047 -4.707 1.00 . A A . 3 TYR CE1 1 1 12 1808 1 1 3 TYR CE2 C -1.286 -0.452 -6.586 1.00 . A A . 3 TYR CE2 1 1 12 1809 1 1 3 TYR CG C -1.340 -1.881 -4.642 1.00 . A A . 3 TYR CG 1 1 12 1810 1 1 3 TYR CZ C -0.341 0.347 -5.975 1.00 . A A . 3 TYR CZ 1 1 12 1811 1 1 3 TYR H H -0.073 -2.953 -2.128 1.00 . A A . 3 TYR H 1 1 12 1812 1 1 3 TYR HA H -1.329 -5.061 -3.291 1.00 . A A . 3 TYR HA 1 1 12 1813 1 1 3 TYR HB2 H -2.686 -3.500 -4.510 1.00 . A A . 3 TYR HB2 1 1 12 1814 1 1 3 TYR HB3 H -2.275 -2.761 -2.966 1.00 . A A . 3 TYR HB3 1 1 12 1815 1 1 3 TYR HD1 H -0.036 -1.298 -3.055 1.00 . A A . 3 TYR HD1 1 1 12 1816 1 1 3 TYR HD2 H -2.519 -2.185 -6.394 1.00 . A A . 3 TYR HD2 1 1 12 1817 1 1 3 TYR HE1 H 0.850 0.673 -4.229 1.00 . A A . 3 TYR HE1 1 1 12 1818 1 1 3 TYR HE2 H -1.639 -0.217 -7.578 1.00 . A A . 3 TYR HE2 1 1 12 1819 1 1 3 TYR HH H 1.018 1.245 -6.996 1.00 . A A . 3 TYR HH 1 1 12 1820 1 1 3 TYR N N 0.131 -3.739 -2.676 1.00 . A A . 3 TYR N 1 1 12 1821 1 1 3 TYR O O -0.520 -5.490 -5.663 1.00 . A A . 3 TYR O 1 1 12 1822 1 1 3 TYR OH O 0.152 1.449 -6.635 1.00 . A A . 3 TYR OH 1 1 12 1823 1 1 4 VAL C C 2.707 -5.050 -6.359 1.00 . A A . 4 VAL C 1 1 12 1824 1 1 4 VAL CA C 1.629 -3.991 -6.565 1.00 . A A . 4 VAL CA 1 1 12 1825 1 1 4 VAL CB C 2.289 -2.695 -7.073 1.00 . A A . 4 VAL CB 1 1 12 1826 1 1 4 VAL CG1 C 1.283 -1.849 -7.839 1.00 . A A . 4 VAL CG1 1 1 12 1827 1 1 4 VAL CG2 C 2.884 -1.911 -5.914 1.00 . A A . 4 VAL CG2 1 1 12 1828 1 1 4 VAL H H 1.134 -3.013 -4.754 1.00 . A A . 4 VAL H 1 1 12 1829 1 1 4 VAL HA H 0.937 -4.337 -7.318 1.00 . A A . 4 VAL HA 1 1 12 1830 1 1 4 VAL HB H 3.088 -2.963 -7.748 1.00 . A A . 4 VAL HB 1 1 12 1831 1 1 4 VAL HG11 H 1.360 -0.820 -7.518 1.00 . A A . 4 VAL HG11 1 1 12 1832 1 1 4 VAL HG12 H 1.489 -1.914 -8.897 1.00 . A A . 4 VAL HG12 1 1 12 1833 1 1 4 VAL HG13 H 0.285 -2.212 -7.643 1.00 . A A . 4 VAL HG13 1 1 12 1834 1 1 4 VAL HG21 H 3.000 -2.563 -5.061 1.00 . A A . 4 VAL HG21 1 1 12 1835 1 1 4 VAL HG22 H 3.850 -1.520 -6.201 1.00 . A A . 4 VAL HG22 1 1 12 1836 1 1 4 VAL HG23 H 2.228 -1.093 -5.656 1.00 . A A . 4 VAL HG23 1 1 12 1837 1 1 4 VAL N N 0.879 -3.759 -5.336 1.00 . A A . 4 VAL N 1 1 12 1838 1 1 4 VAL O O 2.971 -5.862 -7.246 1.00 . A A . 4 VAL O 1 1 12 1839 1 1 5 TYR C C 3.873 -7.426 -5.010 1.00 . A A . 5 TYR C 1 1 12 1840 1 1 5 TYR CA C 4.377 -5.993 -4.862 1.00 . A A . 5 TYR CA 1 1 12 1841 1 1 5 TYR CB C 4.884 -5.765 -3.437 1.00 . A A . 5 TYR CB 1 1 12 1842 1 1 5 TYR CD1 C 7.226 -4.936 -2.983 1.00 . A A . 5 TYR CD1 1 1 12 1843 1 1 5 TYR CD2 C 5.561 -3.336 -3.574 1.00 . A A . 5 TYR CD2 1 1 12 1844 1 1 5 TYR CE1 C 8.166 -3.929 -2.882 1.00 . A A . 5 TYR CE1 1 1 12 1845 1 1 5 TYR CE2 C 6.495 -2.322 -3.477 1.00 . A A . 5 TYR CE2 1 1 12 1846 1 1 5 TYR CG C 5.909 -4.659 -3.329 1.00 . A A . 5 TYR CG 1 1 12 1847 1 1 5 TYR CZ C 7.795 -2.624 -3.131 1.00 . A A . 5 TYR CZ 1 1 12 1848 1 1 5 TYR H H 3.071 -4.364 -4.517 1.00 . A A . 5 TYR H 1 1 12 1849 1 1 5 TYR HA H 5.191 -5.837 -5.553 1.00 . A A . 5 TYR HA 1 1 12 1850 1 1 5 TYR HB2 H 4.051 -5.507 -2.802 1.00 . A A . 5 TYR HB2 1 1 12 1851 1 1 5 TYR HB3 H 5.339 -6.675 -3.074 1.00 . A A . 5 TYR HB3 1 1 12 1852 1 1 5 TYR HD1 H 7.513 -5.960 -2.788 1.00 . A A . 5 TYR HD1 1 1 12 1853 1 1 5 TYR HD2 H 4.541 -3.104 -3.844 1.00 . A A . 5 TYR HD2 1 1 12 1854 1 1 5 TYR HE1 H 9.185 -4.164 -2.612 1.00 . A A . 5 TYR HE1 1 1 12 1855 1 1 5 TYR HE2 H 6.205 -1.300 -3.672 1.00 . A A . 5 TYR HE2 1 1 12 1856 1 1 5 TYR HH H 8.328 -0.850 -2.616 1.00 . A A . 5 TYR HH 1 1 12 1857 1 1 5 TYR N N 3.326 -5.036 -5.184 1.00 . A A . 5 TYR N 1 1 12 1858 1 1 5 TYR O O 4.656 -8.353 -5.213 1.00 . A A . 5 TYR O 1 1 12 1859 1 1 5 TYR OH O 8.728 -1.616 -3.033 1.00 . A A . 5 TYR OH 1 1 12 1860 1 1 6 SER C C 1.747 -9.291 -6.494 1.00 . A A . 6 SER C 1 1 12 1861 1 1 6 SER CA C 1.948 -8.916 -5.029 1.00 . A A . 6 SER CA 1 1 12 1862 1 1 6 SER CB C 0.607 -8.949 -4.294 1.00 . A A . 6 SER CB 1 1 12 1863 1 1 6 SER H H 1.986 -6.818 -4.746 1.00 . A A . 6 SER H 1 1 12 1864 1 1 6 SER HA H 2.616 -9.633 -4.574 1.00 . A A . 6 SER HA 1 1 12 1865 1 1 6 SER HB2 H 0.549 -8.111 -3.616 1.00 . A A . 6 SER HB2 1 1 12 1866 1 1 6 SER HB3 H -0.197 -8.886 -5.013 1.00 . A A . 6 SER HB3 1 1 12 1867 1 1 6 SER HG H -0.051 -10.780 -4.060 1.00 . A A . 6 SER HG 1 1 12 1868 1 1 6 SER N N 2.558 -7.597 -4.909 1.00 . A A . 6 SER N 1 1 12 1869 1 1 6 SER O O 1.713 -10.470 -6.845 1.00 . A A . 6 SER O 1 1 12 1870 1 1 6 SER OG O 0.462 -10.148 -3.551 1.00 . A A . 6 SER OG 1 1 12 1871 1 1 7 ARG C C 2.713 -8.954 -9.437 1.00 . A A . 7 ARG C 1 1 12 1872 1 1 7 ARG CA C 1.417 -8.499 -8.771 1.00 . A A . 7 ARG CA 1 1 12 1873 1 1 7 ARG CB C 0.909 -7.222 -9.442 1.00 . A A . 7 ARG CB 1 1 12 1874 1 1 7 ARG CD C -0.479 -5.134 -9.261 1.00 . A A . 7 ARG CD 1 1 12 1875 1 1 7 ARG CG C -0.078 -6.439 -8.591 1.00 . A A . 7 ARG CG 1 1 12 1876 1 1 7 ARG CZ C -2.413 -3.617 -9.192 1.00 . A A . 7 ARG CZ 1 1 12 1877 1 1 7 ARG H H 1.652 -7.359 -7.004 1.00 . A A . 7 ARG H 1 1 12 1878 1 1 7 ARG HA H 0.675 -9.275 -8.887 1.00 . A A . 7 ARG HA 1 1 12 1879 1 1 7 ARG HB2 H 1.752 -6.581 -9.657 1.00 . A A . 7 ARG HB2 1 1 12 1880 1 1 7 ARG HB3 H 0.422 -7.485 -10.368 1.00 . A A . 7 ARG HB3 1 1 12 1881 1 1 7 ARG HD2 H 0.358 -4.454 -9.225 1.00 . A A . 7 ARG HD2 1 1 12 1882 1 1 7 ARG HD3 H -0.733 -5.338 -10.291 1.00 . A A . 7 ARG HD3 1 1 12 1883 1 1 7 ARG HE H -1.814 -4.771 -7.679 1.00 . A A . 7 ARG HE 1 1 12 1884 1 1 7 ARG HG2 H -0.963 -7.039 -8.438 1.00 . A A . 7 ARG HG2 1 1 12 1885 1 1 7 ARG HG3 H 0.379 -6.218 -7.638 1.00 . A A . 7 ARG HG3 1 1 12 1886 1 1 7 ARG HH11 H -1.411 -3.638 -10.946 1.00 . A A . 7 ARG HH11 1 1 12 1887 1 1 7 ARG HH12 H -2.776 -2.573 -10.883 1.00 . A A . 7 ARG HH12 1 1 12 1888 1 1 7 ARG HH21 H -3.614 -3.373 -7.584 1.00 . A A . 7 ARG HH21 1 1 12 1889 1 1 7 ARG HH22 H -4.028 -2.422 -8.971 1.00 . A A . 7 ARG HH22 1 1 12 1890 1 1 7 ARG N N 1.616 -8.278 -7.344 1.00 . A A . 7 ARG N 1 1 12 1891 1 1 7 ARG NE N -1.625 -4.511 -8.604 1.00 . A A . 7 ARG NE 1 1 12 1892 1 1 7 ARG NH1 N -2.181 -3.245 -10.443 1.00 . A A . 7 ARG NH1 1 1 12 1893 1 1 7 ARG NH2 N -3.436 -3.094 -8.528 1.00 . A A . 7 ARG NH2 1 1 12 1894 1 1 7 ARG O O 2.748 -9.980 -10.116 1.00 . A A . 7 ARG O 1 1 12 1895 1 1 8 VAL C C 5.418 -9.978 -9.610 1.00 . A A . 8 VAL C 1 1 12 1896 1 1 8 VAL CA C 5.075 -8.506 -9.816 1.00 . A A . 8 VAL CA 1 1 12 1897 1 1 8 VAL CB C 6.193 -7.640 -9.206 1.00 . A A . 8 VAL CB 1 1 12 1898 1 1 8 VAL CG1 C 7.514 -7.895 -9.917 1.00 . A A . 8 VAL CG1 1 1 12 1899 1 1 8 VAL CG2 C 5.820 -6.167 -9.270 1.00 . A A . 8 VAL CG2 1 1 12 1900 1 1 8 VAL H H 3.687 -7.378 -8.686 1.00 . A A . 8 VAL H 1 1 12 1901 1 1 8 VAL HA H 5.028 -8.302 -10.876 1.00 . A A . 8 VAL HA 1 1 12 1902 1 1 8 VAL HB H 6.310 -7.916 -8.169 1.00 . A A . 8 VAL HB 1 1 12 1903 1 1 8 VAL HG11 H 8.140 -7.018 -9.838 1.00 . A A . 8 VAL HG11 1 1 12 1904 1 1 8 VAL HG12 H 8.012 -8.738 -9.461 1.00 . A A . 8 VAL HG12 1 1 12 1905 1 1 8 VAL HG13 H 7.326 -8.108 -10.959 1.00 . A A . 8 VAL HG13 1 1 12 1906 1 1 8 VAL HG21 H 5.363 -5.872 -8.337 1.00 . A A . 8 VAL HG21 1 1 12 1907 1 1 8 VAL HG22 H 6.709 -5.576 -9.437 1.00 . A A . 8 VAL HG22 1 1 12 1908 1 1 8 VAL HG23 H 5.124 -6.006 -10.079 1.00 . A A . 8 VAL HG23 1 1 12 1909 1 1 8 VAL N N 3.777 -8.183 -9.237 1.00 . A A . 8 VAL N 1 1 12 1910 1 1 8 VAL O O 5.533 -10.740 -10.570 1.00 . A A . 8 VAL O 1 1 12 1911 1 1 9 LYS C C 4.651 -12.619 -7.993 1.00 . A A . 9 LYS C 1 1 12 1912 1 1 9 LYS CA C 5.906 -11.752 -8.017 1.00 . A A . 9 LYS CA 1 1 12 1913 1 1 9 LYS CB C 6.610 -11.817 -6.660 1.00 . A A . 9 LYS CB 1 1 12 1914 1 1 9 LYS CD C 8.550 -10.537 -5.706 1.00 . A A . 9 LYS CD 1 1 12 1915 1 1 9 LYS CE C 8.945 -11.201 -4.396 1.00 . A A . 9 LYS CE 1 1 12 1916 1 1 9 LYS CG C 8.105 -11.561 -6.737 1.00 . A A . 9 LYS CG 1 1 12 1917 1 1 9 LYS H H 5.474 -9.717 -7.629 1.00 . A A . 9 LYS H 1 1 12 1918 1 1 9 LYS HA H 6.574 -12.128 -8.778 1.00 . A A . 9 LYS HA 1 1 12 1919 1 1 9 LYS HB2 H 6.173 -11.077 -6.006 1.00 . A A . 9 LYS HB2 1 1 12 1920 1 1 9 LYS HB3 H 6.456 -12.798 -6.234 1.00 . A A . 9 LYS HB3 1 1 12 1921 1 1 9 LYS HD2 H 9.400 -9.995 -6.093 1.00 . A A . 9 LYS HD2 1 1 12 1922 1 1 9 LYS HD3 H 7.737 -9.850 -5.521 1.00 . A A . 9 LYS HD3 1 1 12 1923 1 1 9 LYS HE2 H 9.210 -10.434 -3.685 1.00 . A A . 9 LYS HE2 1 1 12 1924 1 1 9 LYS HE3 H 8.101 -11.761 -4.023 1.00 . A A . 9 LYS HE3 1 1 12 1925 1 1 9 LYS HG2 H 8.630 -12.488 -6.557 1.00 . A A . 9 LYS HG2 1 1 12 1926 1 1 9 LYS HG3 H 8.348 -11.194 -7.724 1.00 . A A . 9 LYS HG3 1 1 12 1927 1 1 9 LYS HZ1 H 10.807 -11.696 -5.203 1.00 . A A . 9 LYS HZ1 1 1 12 1928 1 1 9 LYS HZ2 H 9.783 -13.023 -4.978 1.00 . A A . 9 LYS HZ2 1 1 12 1929 1 1 9 LYS HZ3 H 10.548 -12.312 -3.648 1.00 . A A . 9 LYS HZ3 1 1 12 1930 1 1 9 LYS N N 5.579 -10.371 -8.352 1.00 . A A . 9 LYS N 1 1 12 1931 1 1 9 LYS NZ N 10.102 -12.123 -4.568 1.00 . A A . 9 LYS NZ 1 1 12 1932 1 1 9 LYS O O 4.733 -13.846 -7.937 1.00 . A A . 9 LYS O 1 1 13 1933 1 1 1 THR C C 2.969 -1.178 -1.639 1.00 . A A . 1 THR C 1 1 13 1934 1 1 1 THR CA C 2.540 0.234 -1.256 1.00 . A A . 1 THR CA 1 1 13 1935 1 1 1 THR CB C 1.037 0.229 -0.919 1.00 . A A . 1 THR CB 1 1 13 1936 1 1 1 THR CG2 C 0.818 0.348 0.581 1.00 . A A . 1 THR CG2 1 1 13 1937 1 1 1 THR H1 H 2.461 1.040 -3.211 1.00 . A A . 1 THR H1 1 1 13 1938 1 1 1 THR HA H 3.084 0.538 -0.373 1.00 . A A . 1 THR HA 1 1 13 1939 1 1 1 THR HB H 0.611 -0.705 -1.257 1.00 . A A . 1 THR HB 1 1 13 1940 1 1 1 THR HG1 H -0.550 1.316 -1.354 1.00 . A A . 1 THR HG1 1 1 13 1941 1 1 1 THR HG21 H 1.516 1.063 0.991 1.00 . A A . 1 THR HG21 1 1 13 1942 1 1 1 THR HG22 H 0.973 -0.614 1.046 1.00 . A A . 1 THR HG22 1 1 13 1943 1 1 1 THR HG23 H -0.191 0.681 0.772 1.00 . A A . 1 THR HG23 1 1 13 1944 1 1 1 THR N N 2.844 1.182 -2.320 1.00 . A A . 1 THR N 1 1 13 1945 1 1 1 THR O O 3.683 -1.376 -2.622 1.00 . A A . 1 THR O 1 1 13 1946 1 1 1 THR OG1 O 0.381 1.311 -1.590 1.00 . A A . 1 THR OG1 1 1 13 1947 1 1 2 VAL C C 1.948 -4.152 -2.176 1.00 . A A . 2 VAL C 1 1 13 1948 1 1 2 VAL CA C 2.864 -3.553 -1.115 1.00 . A A . 2 VAL CA 1 1 13 1949 1 1 2 VAL CB C 2.768 -4.401 0.168 1.00 . A A . 2 VAL CB 1 1 13 1950 1 1 2 VAL CG1 C 3.419 -5.760 -0.040 1.00 . A A . 2 VAL CG1 1 1 13 1951 1 1 2 VAL CG2 C 3.406 -3.668 1.339 1.00 . A A . 2 VAL CG2 1 1 13 1952 1 1 2 VAL H H 1.962 -1.938 -0.087 1.00 . A A . 2 VAL H 1 1 13 1953 1 1 2 VAL HA H 3.883 -3.590 -1.470 1.00 . A A . 2 VAL HA 1 1 13 1954 1 1 2 VAL HB H 1.724 -4.557 0.394 1.00 . A A . 2 VAL HB 1 1 13 1955 1 1 2 VAL HG11 H 4.473 -5.627 -0.232 1.00 . A A . 2 VAL HG11 1 1 13 1956 1 1 2 VAL HG12 H 3.286 -6.362 0.847 1.00 . A A . 2 VAL HG12 1 1 13 1957 1 1 2 VAL HG13 H 2.959 -6.253 -0.883 1.00 . A A . 2 VAL HG13 1 1 13 1958 1 1 2 VAL HG21 H 4.449 -3.490 1.126 1.00 . A A . 2 VAL HG21 1 1 13 1959 1 1 2 VAL HG22 H 2.903 -2.724 1.490 1.00 . A A . 2 VAL HG22 1 1 13 1960 1 1 2 VAL HG23 H 3.317 -4.269 2.231 1.00 . A A . 2 VAL HG23 1 1 13 1961 1 1 2 VAL N N 2.527 -2.158 -0.856 1.00 . A A . 2 VAL N 1 1 13 1962 1 1 2 VAL O O 2.271 -5.171 -2.786 1.00 . A A . 2 VAL O 1 1 13 1963 1 1 3 TYR C C 0.526 -4.299 -4.703 1.00 . A A . 3 TYR C 1 1 13 1964 1 1 3 TYR CA C -0.161 -3.981 -3.379 1.00 . A A . 3 TYR CA 1 1 13 1965 1 1 3 TYR CB C -1.252 -2.932 -3.596 1.00 . A A . 3 TYR CB 1 1 13 1966 1 1 3 TYR CD1 C -1.463 -1.646 -5.758 1.00 . A A . 3 TYR CD1 1 1 13 1967 1 1 3 TYR CD2 C 0.171 -0.928 -4.178 1.00 . A A . 3 TYR CD2 1 1 13 1968 1 1 3 TYR CE1 C -1.090 -0.627 -6.613 1.00 . A A . 3 TYR CE1 1 1 13 1969 1 1 3 TYR CE2 C 0.549 0.094 -5.026 1.00 . A A . 3 TYR CE2 1 1 13 1970 1 1 3 TYR CG C -0.841 -1.815 -4.528 1.00 . A A . 3 TYR CG 1 1 13 1971 1 1 3 TYR CZ C -0.084 0.241 -6.242 1.00 . A A . 3 TYR CZ 1 1 13 1972 1 1 3 TYR H H 0.603 -2.704 -1.874 1.00 . A A . 3 TYR H 1 1 13 1973 1 1 3 TYR HA H -0.614 -4.884 -2.996 1.00 . A A . 3 TYR HA 1 1 13 1974 1 1 3 TYR HB2 H -2.123 -3.410 -4.017 1.00 . A A . 3 TYR HB2 1 1 13 1975 1 1 3 TYR HB3 H -1.513 -2.492 -2.645 1.00 . A A . 3 TYR HB3 1 1 13 1976 1 1 3 TYR HD1 H -2.251 -2.327 -6.046 1.00 . A A . 3 TYR HD1 1 1 13 1977 1 1 3 TYR HD2 H 0.665 -1.047 -3.224 1.00 . A A . 3 TYR HD2 1 1 13 1978 1 1 3 TYR HE1 H -1.586 -0.511 -7.566 1.00 . A A . 3 TYR HE1 1 1 13 1979 1 1 3 TYR HE2 H 1.337 0.774 -4.736 1.00 . A A . 3 TYR HE2 1 1 13 1980 1 1 3 TYR HH H -0.315 1.996 -6.992 1.00 . A A . 3 TYR HH 1 1 13 1981 1 1 3 TYR N N 0.804 -3.511 -2.392 1.00 . A A . 3 TYR N 1 1 13 1982 1 1 3 TYR O O 0.119 -5.211 -5.424 1.00 . A A . 3 TYR O 1 1 13 1983 1 1 3 TYR OH O 0.291 1.258 -7.091 1.00 . A A . 3 TYR OH 1 1 13 1984 1 1 4 VAL C C 3.310 -4.890 -6.117 1.00 . A A . 4 VAL C 1 1 13 1985 1 1 4 VAL CA C 2.317 -3.741 -6.254 1.00 . A A . 4 VAL CA 1 1 13 1986 1 1 4 VAL CB C 3.078 -2.466 -6.664 1.00 . A A . 4 VAL CB 1 1 13 1987 1 1 4 VAL CG1 C 2.166 -1.523 -7.434 1.00 . A A . 4 VAL CG1 1 1 13 1988 1 1 4 VAL CG2 C 3.659 -1.776 -5.438 1.00 . A A . 4 VAL CG2 1 1 13 1989 1 1 4 VAL H H 1.848 -2.830 -4.402 1.00 . A A . 4 VAL H 1 1 13 1990 1 1 4 VAL HA H 1.610 -3.979 -7.036 1.00 . A A . 4 VAL HA 1 1 13 1991 1 1 4 VAL HB H 3.894 -2.750 -7.311 1.00 . A A . 4 VAL HB 1 1 13 1992 1 1 4 VAL HG11 H 2.263 -0.524 -7.037 1.00 . A A . 4 VAL HG11 1 1 13 1993 1 1 4 VAL HG12 H 2.443 -1.526 -8.478 1.00 . A A . 4 VAL HG12 1 1 13 1994 1 1 4 VAL HG13 H 1.142 -1.852 -7.333 1.00 . A A . 4 VAL HG13 1 1 13 1995 1 1 4 VAL HG21 H 4.635 -1.382 -5.677 1.00 . A A . 4 VAL HG21 1 1 13 1996 1 1 4 VAL HG22 H 3.008 -0.966 -5.138 1.00 . A A . 4 VAL HG22 1 1 13 1997 1 1 4 VAL HG23 H 3.744 -2.487 -4.630 1.00 . A A . 4 VAL HG23 1 1 13 1998 1 1 4 VAL N N 1.571 -3.540 -5.018 1.00 . A A . 4 VAL N 1 1 13 1999 1 1 4 VAL O O 3.501 -5.673 -7.048 1.00 . A A . 4 VAL O 1 1 13 2000 1 1 5 TYR C C 4.273 -7.417 -4.818 1.00 . A A . 5 TYR C 1 1 13 2001 1 1 5 TYR CA C 4.914 -6.038 -4.692 1.00 . A A . 5 TYR CA 1 1 13 2002 1 1 5 TYR CB C 5.519 -5.869 -3.298 1.00 . A A . 5 TYR CB 1 1 13 2003 1 1 5 TYR CD1 C 7.899 -5.027 -3.264 1.00 . A A . 5 TYR CD1 1 1 13 2004 1 1 5 TYR CD2 C 6.139 -3.432 -3.073 1.00 . A A . 5 TYR CD2 1 1 13 2005 1 1 5 TYR CE1 C 8.834 -4.012 -3.183 1.00 . A A . 5 TYR CE1 1 1 13 2006 1 1 5 TYR CE2 C 7.066 -2.411 -2.993 1.00 . A A . 5 TYR CE2 1 1 13 2007 1 1 5 TYR CG C 6.538 -4.755 -3.210 1.00 . A A . 5 TYR CG 1 1 13 2008 1 1 5 TYR CZ C 8.412 -2.706 -3.049 1.00 . A A . 5 TYR CZ 1 1 13 2009 1 1 5 TYR H H 3.744 -4.331 -4.248 1.00 . A A . 5 TYR H 1 1 13 2010 1 1 5 TYR HA H 5.700 -5.950 -5.428 1.00 . A A . 5 TYR HA 1 1 13 2011 1 1 5 TYR HB2 H 4.731 -5.653 -2.594 1.00 . A A . 5 TYR HB2 1 1 13 2012 1 1 5 TYR HB3 H 6.008 -6.789 -3.012 1.00 . A A . 5 TYR HB3 1 1 13 2013 1 1 5 TYR HD1 H 8.227 -6.051 -3.369 1.00 . A A . 5 TYR HD1 1 1 13 2014 1 1 5 TYR HD2 H 5.083 -3.204 -3.029 1.00 . A A . 5 TYR HD2 1 1 13 2015 1 1 5 TYR HE1 H 9.888 -4.243 -3.227 1.00 . A A . 5 TYR HE1 1 1 13 2016 1 1 5 TYR HE2 H 6.736 -1.388 -2.887 1.00 . A A . 5 TYR HE2 1 1 13 2017 1 1 5 TYR HH H 10.189 -2.056 -2.711 1.00 . A A . 5 TYR HH 1 1 13 2018 1 1 5 TYR N N 3.939 -4.985 -4.951 1.00 . A A . 5 TYR N 1 1 13 2019 1 1 5 TYR O O 4.945 -8.399 -5.131 1.00 . A A . 5 TYR O 1 1 13 2020 1 1 5 TYR OH O 9.339 -1.692 -2.968 1.00 . A A . 5 TYR OH 1 1 13 2021 1 1 6 SER C C 1.661 -8.942 -6.052 1.00 . A A . 6 SER C 1 1 13 2022 1 1 6 SER CA C 2.236 -8.738 -4.654 1.00 . A A . 6 SER CA 1 1 13 2023 1 1 6 SER CB C 1.110 -8.766 -3.618 1.00 . A A . 6 SER CB 1 1 13 2024 1 1 6 SER H H 2.488 -6.662 -4.326 1.00 . A A . 6 SER H 1 1 13 2025 1 1 6 SER HA H 2.928 -9.540 -4.442 1.00 . A A . 6 SER HA 1 1 13 2026 1 1 6 SER HB2 H 1.002 -7.785 -3.182 1.00 . A A . 6 SER HB2 1 1 13 2027 1 1 6 SER HB3 H 0.187 -9.049 -4.102 1.00 . A A . 6 SER HB3 1 1 13 2028 1 1 6 SER HG H 1.487 -10.574 -2.963 1.00 . A A . 6 SER HG 1 1 13 2029 1 1 6 SER N N 2.969 -7.480 -4.572 1.00 . A A . 6 SER N 1 1 13 2030 1 1 6 SER O O 1.447 -10.073 -6.489 1.00 . A A . 6 SER O 1 1 13 2031 1 1 6 SER OG O 1.390 -9.696 -2.586 1.00 . A A . 6 SER OG 1 1 13 2032 1 1 7 ARG C C 1.946 -8.232 -9.116 1.00 . A A . 7 ARG C 1 1 13 2033 1 1 7 ARG CA C 0.861 -7.894 -8.098 1.00 . A A . 7 ARG CA 1 1 13 2034 1 1 7 ARG CB C 0.206 -6.560 -8.459 1.00 . A A . 7 ARG CB 1 1 13 2035 1 1 7 ARG CD C -0.075 -6.959 -10.925 1.00 . A A . 7 ARG CD 1 1 13 2036 1 1 7 ARG CG C 0.548 -6.072 -9.858 1.00 . A A . 7 ARG CG 1 1 13 2037 1 1 7 ARG CZ C -2.128 -5.809 -11.637 1.00 . A A . 7 ARG CZ 1 1 13 2038 1 1 7 ARG H H 1.604 -6.965 -6.347 1.00 . A A . 7 ARG H 1 1 13 2039 1 1 7 ARG HA H 0.111 -8.670 -8.118 1.00 . A A . 7 ARG HA 1 1 13 2040 1 1 7 ARG HB2 H -0.867 -6.669 -8.392 1.00 . A A . 7 ARG HB2 1 1 13 2041 1 1 7 ARG HB3 H 0.528 -5.811 -7.752 1.00 . A A . 7 ARG HB3 1 1 13 2042 1 1 7 ARG HD2 H 0.715 -7.463 -11.461 1.00 . A A . 7 ARG HD2 1 1 13 2043 1 1 7 ARG HD3 H -0.706 -7.691 -10.442 1.00 . A A . 7 ARG HD3 1 1 13 2044 1 1 7 ARG HE H -0.465 -5.952 -12.728 1.00 . A A . 7 ARG HE 1 1 13 2045 1 1 7 ARG HG2 H 0.175 -5.066 -9.979 1.00 . A A . 7 ARG HG2 1 1 13 2046 1 1 7 ARG HG3 H 1.621 -6.078 -9.978 1.00 . A A . 7 ARG HG3 1 1 13 2047 1 1 7 ARG HH11 H -2.215 -6.643 -9.799 1.00 . A A . 7 ARG HH11 1 1 13 2048 1 1 7 ARG HH12 H -3.655 -5.829 -10.313 1.00 . A A . 7 ARG HH12 1 1 13 2049 1 1 7 ARG HH21 H -2.355 -4.878 -13.416 1.00 . A A . 7 ARG HH21 1 1 13 2050 1 1 7 ARG HH22 H -3.734 -4.826 -12.371 1.00 . A A . 7 ARG HH22 1 1 13 2051 1 1 7 ARG N N 1.413 -7.838 -6.749 1.00 . A A . 7 ARG N 1 1 13 2052 1 1 7 ARG NE N -0.878 -6.192 -11.873 1.00 . A A . 7 ARG NE 1 1 13 2053 1 1 7 ARG NH1 N -2.714 -6.120 -10.489 1.00 . A A . 7 ARG NH1 1 1 13 2054 1 1 7 ARG NH2 N -2.794 -5.114 -12.550 1.00 . A A . 7 ARG NH2 1 1 13 2055 1 1 7 ARG O O 1.716 -8.995 -10.054 1.00 . A A . 7 ARG O 1 1 13 2056 1 1 8 VAL C C 4.519 -9.391 -9.982 1.00 . A A . 8 VAL C 1 1 13 2057 1 1 8 VAL CA C 4.251 -7.899 -9.824 1.00 . A A . 8 VAL CA 1 1 13 2058 1 1 8 VAL CB C 5.533 -7.209 -9.320 1.00 . A A . 8 VAL CB 1 1 13 2059 1 1 8 VAL CG1 C 6.719 -7.578 -10.199 1.00 . A A . 8 VAL CG1 1 1 13 2060 1 1 8 VAL CG2 C 5.343 -5.700 -9.274 1.00 . A A . 8 VAL CG2 1 1 13 2061 1 1 8 VAL H H 3.252 -7.060 -8.157 1.00 . A A . 8 VAL H 1 1 13 2062 1 1 8 VAL HA H 4.000 -7.484 -10.789 1.00 . A A . 8 VAL HA 1 1 13 2063 1 1 8 VAL HB H 5.735 -7.556 -8.318 1.00 . A A . 8 VAL HB 1 1 13 2064 1 1 8 VAL HG11 H 7.443 -6.777 -10.181 1.00 . A A . 8 VAL HG11 1 1 13 2065 1 1 8 VAL HG12 H 7.174 -8.485 -9.829 1.00 . A A . 8 VAL HG12 1 1 13 2066 1 1 8 VAL HG13 H 6.380 -7.733 -11.213 1.00 . A A . 8 VAL HG13 1 1 13 2067 1 1 8 VAL HG21 H 5.683 -5.325 -8.320 1.00 . A A . 8 VAL HG21 1 1 13 2068 1 1 8 VAL HG22 H 5.915 -5.240 -10.066 1.00 . A A . 8 VAL HG22 1 1 13 2069 1 1 8 VAL HG23 H 4.297 -5.465 -9.402 1.00 . A A . 8 VAL HG23 1 1 13 2070 1 1 8 VAL N N 3.130 -7.658 -8.923 1.00 . A A . 8 VAL N 1 1 13 2071 1 1 8 VAL O O 4.364 -9.950 -11.068 1.00 . A A . 8 VAL O 1 1 13 2072 1 1 9 LYS C C 4.083 -12.252 -8.247 1.00 . A A . 9 LYS C 1 1 13 2073 1 1 9 LYS CA C 5.210 -11.462 -8.905 1.00 . A A . 9 LYS CA 1 1 13 2074 1 1 9 LYS CB C 6.532 -11.745 -8.186 1.00 . A A . 9 LYS CB 1 1 13 2075 1 1 9 LYS CD C 7.880 -11.001 -6.202 1.00 . A A . 9 LYS CD 1 1 13 2076 1 1 9 LYS CE C 7.795 -10.270 -4.871 1.00 . A A . 9 LYS CE 1 1 13 2077 1 1 9 LYS CG C 6.504 -11.401 -6.707 1.00 . A A . 9 LYS CG 1 1 13 2078 1 1 9 LYS H H 5.028 -9.533 -8.053 1.00 . A A . 9 LYS H 1 1 13 2079 1 1 9 LYS HA H 5.297 -11.773 -9.935 1.00 . A A . 9 LYS HA 1 1 13 2080 1 1 9 LYS HB2 H 6.765 -12.794 -8.287 1.00 . A A . 9 LYS HB2 1 1 13 2081 1 1 9 LYS HB3 H 7.313 -11.164 -8.655 1.00 . A A . 9 LYS HB3 1 1 13 2082 1 1 9 LYS HD2 H 8.480 -11.889 -6.074 1.00 . A A . 9 LYS HD2 1 1 13 2083 1 1 9 LYS HD3 H 8.346 -10.351 -6.930 1.00 . A A . 9 LYS HD3 1 1 13 2084 1 1 9 LYS HE2 H 8.320 -9.332 -4.955 1.00 . A A . 9 LYS HE2 1 1 13 2085 1 1 9 LYS HE3 H 6.756 -10.082 -4.645 1.00 . A A . 9 LYS HE3 1 1 13 2086 1 1 9 LYS HG2 H 5.822 -10.580 -6.549 1.00 . A A . 9 LYS HG2 1 1 13 2087 1 1 9 LYS HG3 H 6.165 -12.265 -6.153 1.00 . A A . 9 LYS HG3 1 1 13 2088 1 1 9 LYS HZ1 H 9.386 -11.291 -3.983 1.00 . A A . 9 LYS HZ1 1 1 13 2089 1 1 9 LYS HZ2 H 7.869 -11.952 -3.633 1.00 . A A . 9 LYS HZ2 1 1 13 2090 1 1 9 LYS HZ3 H 8.363 -10.522 -2.876 1.00 . A A . 9 LYS HZ3 1 1 13 2091 1 1 9 LYS N N 4.922 -10.033 -8.890 1.00 . A A . 9 LYS N 1 1 13 2092 1 1 9 LYS NZ N 8.395 -11.064 -3.763 1.00 . A A . 9 LYS NZ 1 1 13 2093 1 1 9 LYS O O 3.384 -11.742 -7.371 1.00 . A A . 9 LYS O 1 1 14 2094 1 1 1 THR C C 2.933 -1.130 -1.623 1.00 . A A . 1 THR C 1 1 14 2095 1 1 1 THR CA C 2.501 0.284 -1.253 1.00 . A A . 1 THR CA 1 1 14 2096 1 1 1 THR CB C 0.995 0.281 -0.928 1.00 . A A . 1 THR CB 1 1 14 2097 1 1 1 THR CG2 C 0.764 0.410 0.570 1.00 . A A . 1 THR CG2 1 1 14 2098 1 1 1 THR H1 H 2.437 1.078 -3.214 1.00 . A A . 1 THR H1 1 1 14 2099 1 1 1 THR HA H 3.038 0.594 -0.368 1.00 . A A . 1 THR HA 1 1 14 2100 1 1 1 THR HB H 0.573 -0.656 -1.263 1.00 . A A . 1 THR HB 1 1 14 2101 1 1 1 THR HG1 H 0.313 1.168 -2.552 1.00 . A A . 1 THR HG1 1 1 14 2102 1 1 1 THR HG21 H 1.456 1.131 0.980 1.00 . A A . 1 THR HG21 1 1 14 2103 1 1 1 THR HG22 H 0.920 -0.548 1.042 1.00 . A A . 1 THR HG22 1 1 14 2104 1 1 1 THR HG23 H -0.248 0.740 0.750 1.00 . A A . 1 THR HG23 1 1 14 2105 1 1 1 THR N N 2.812 1.226 -2.321 1.00 . A A . 1 THR N 1 1 14 2106 1 1 1 THR O O 3.655 -1.334 -2.599 1.00 . A A . 1 THR O 1 1 14 2107 1 1 1 THR OG1 O 0.344 1.358 -1.611 1.00 . A A . 1 THR OG1 1 1 14 2108 1 1 2 VAL C C 1.917 -4.107 -2.150 1.00 . A A . 2 VAL C 1 1 14 2109 1 1 2 VAL CA C 2.825 -3.501 -1.085 1.00 . A A . 2 VAL CA 1 1 14 2110 1 1 2 VAL CB C 2.719 -4.341 0.202 1.00 . A A . 2 VAL CB 1 1 14 2111 1 1 2 VAL CG1 C 3.371 -5.701 0.007 1.00 . A A . 2 VAL CG1 1 1 14 2112 1 1 2 VAL CG2 C 3.348 -3.601 1.373 1.00 . A A . 2 VAL CG2 1 1 14 2113 1 1 2 VAL H H 1.914 -1.880 -0.075 1.00 . A A . 2 VAL H 1 1 14 2114 1 1 2 VAL HA H 3.847 -3.540 -1.433 1.00 . A A . 2 VAL HA 1 1 14 2115 1 1 2 VAL HB H 1.673 -4.496 0.421 1.00 . A A . 2 VAL HB 1 1 14 2116 1 1 2 VAL HG11 H 3.232 -6.297 0.897 1.00 . A A . 2 VAL HG11 1 1 14 2117 1 1 2 VAL HG12 H 2.919 -6.201 -0.837 1.00 . A A . 2 VAL HG12 1 1 14 2118 1 1 2 VAL HG13 H 4.428 -5.570 -0.176 1.00 . A A . 2 VAL HG13 1 1 14 2119 1 1 2 VAL HG21 H 4.393 -3.425 1.167 1.00 . A A . 2 VAL HG21 1 1 14 2120 1 1 2 VAL HG22 H 2.844 -2.656 1.514 1.00 . A A . 2 VAL HG22 1 1 14 2121 1 1 2 VAL HG23 H 3.252 -4.197 2.268 1.00 . A A . 2 VAL HG23 1 1 14 2122 1 1 2 VAL N N 2.486 -2.105 -0.838 1.00 . A A . 2 VAL N 1 1 14 2123 1 1 2 VAL O O 2.245 -5.130 -2.751 1.00 . A A . 2 VAL O 1 1 14 2124 1 1 3 TYR C C 0.516 -4.271 -4.688 1.00 . A A . 3 TYR C 1 1 14 2125 1 1 3 TYR CA C -0.182 -3.945 -3.370 1.00 . A A . 3 TYR CA 1 1 14 2126 1 1 3 TYR CB C -1.272 -2.898 -3.603 1.00 . A A . 3 TYR CB 1 1 14 2127 1 1 3 TYR CD1 C -1.466 -1.625 -5.775 1.00 . A A . 3 TYR CD1 1 1 14 2128 1 1 3 TYR CD2 C 0.155 -0.897 -4.186 1.00 . A A . 3 TYR CD2 1 1 14 2129 1 1 3 TYR CE1 C -1.087 -0.611 -6.633 1.00 . A A . 3 TYR CE1 1 1 14 2130 1 1 3 TYR CE2 C 0.539 0.121 -5.037 1.00 . A A . 3 TYR CE2 1 1 14 2131 1 1 3 TYR CG C -0.853 -1.786 -4.538 1.00 . A A . 3 TYR CG 1 1 14 2132 1 1 3 TYR CZ C -0.084 0.260 -6.260 1.00 . A A . 3 TYR CZ 1 1 14 2133 1 1 3 TYR H H 0.570 -2.658 -1.868 1.00 . A A . 3 TYR H 1 1 14 2134 1 1 3 TYR HA H -0.638 -4.845 -2.985 1.00 . A A . 3 TYR HA 1 1 14 2135 1 1 3 TYR HB2 H -2.139 -3.379 -4.028 1.00 . A A . 3 TYR HB2 1 1 14 2136 1 1 3 TYR HB3 H -1.541 -2.452 -2.656 1.00 . A A . 3 TYR HB3 1 1 14 2137 1 1 3 TYR HD1 H -2.251 -2.308 -6.065 1.00 . A A . 3 TYR HD1 1 1 14 2138 1 1 3 TYR HD2 H 0.641 -1.009 -3.228 1.00 . A A . 3 TYR HD2 1 1 14 2139 1 1 3 TYR HE1 H -1.575 -0.501 -7.591 1.00 . A A . 3 TYR HE1 1 1 14 2140 1 1 3 TYR HE2 H 1.325 0.802 -4.745 1.00 . A A . 3 TYR HE2 1 1 14 2141 1 1 3 TYR HH H -0.149 1.164 -7.955 1.00 . A A . 3 TYR HH 1 1 14 2142 1 1 3 TYR N N 0.775 -3.468 -2.379 1.00 . A A . 3 TYR N 1 1 14 2143 1 1 3 TYR O O 0.115 -5.187 -5.406 1.00 . A A . 3 TYR O 1 1 14 2144 1 1 3 TYR OH O 0.297 1.271 -7.111 1.00 . A A . 3 TYR OH 1 1 14 2145 1 1 4 VAL C C 3.310 -4.869 -6.076 1.00 . A A . 4 VAL C 1 1 14 2146 1 1 4 VAL CA C 2.319 -3.721 -6.228 1.00 . A A . 4 VAL CA 1 1 14 2147 1 1 4 VAL CB C 3.082 -2.448 -6.639 1.00 . A A . 4 VAL CB 1 1 14 2148 1 1 4 VAL CG1 C 2.176 -1.511 -7.422 1.00 . A A . 4 VAL CG1 1 1 14 2149 1 1 4 VAL CG2 C 3.653 -1.751 -5.414 1.00 . A A . 4 VAL CG2 1 1 14 2150 1 1 4 VAL H H 1.834 -2.799 -4.386 1.00 . A A . 4 VAL H 1 1 14 2151 1 1 4 VAL HA H 1.618 -3.965 -7.013 1.00 . A A . 4 VAL HA 1 1 14 2152 1 1 4 VAL HB H 3.904 -2.736 -7.279 1.00 . A A . 4 VAL HB 1 1 14 2153 1 1 4 VAL HG11 H 1.151 -1.841 -7.329 1.00 . A A . 4 VAL HG11 1 1 14 2154 1 1 4 VAL HG12 H 2.270 -0.508 -7.031 1.00 . A A . 4 VAL HG12 1 1 14 2155 1 1 4 VAL HG13 H 2.463 -1.520 -8.463 1.00 . A A . 4 VAL HG13 1 1 14 2156 1 1 4 VAL HG21 H 4.632 -1.359 -5.647 1.00 . A A . 4 VAL HG21 1 1 14 2157 1 1 4 VAL HG22 H 3.001 -0.940 -5.124 1.00 . A A . 4 VAL HG22 1 1 14 2158 1 1 4 VAL HG23 H 3.732 -2.457 -4.601 1.00 . A A . 4 VAL HG23 1 1 14 2159 1 1 4 VAL N N 1.563 -3.513 -4.998 1.00 . A A . 4 VAL N 1 1 14 2160 1 1 4 VAL O O 3.509 -5.658 -7.001 1.00 . A A . 4 VAL O 1 1 14 2161 1 1 5 TYR C C 4.264 -7.388 -4.754 1.00 . A A . 5 TYR C 1 1 14 2162 1 1 5 TYR CA C 4.903 -6.008 -4.632 1.00 . A A . 5 TYR CA 1 1 14 2163 1 1 5 TYR CB C 5.498 -5.830 -3.234 1.00 . A A . 5 TYR CB 1 1 14 2164 1 1 5 TYR CD1 C 6.112 -3.386 -3.085 1.00 . A A . 5 TYR CD1 1 1 14 2165 1 1 5 TYR CD2 C 7.876 -4.988 -3.122 1.00 . A A . 5 TYR CD2 1 1 14 2166 1 1 5 TYR CE1 C 7.036 -2.362 -3.004 1.00 . A A . 5 TYR CE1 1 1 14 2167 1 1 5 TYR CE2 C 8.807 -3.971 -3.041 1.00 . A A . 5 TYR CE2 1 1 14 2168 1 1 5 TYR CG C 6.514 -4.714 -3.145 1.00 . A A . 5 TYR CG 1 1 14 2169 1 1 5 TYR CZ C 8.383 -2.660 -2.982 1.00 . A A . 5 TYR CZ 1 1 14 2170 1 1 5 TYR H H 3.730 -4.299 -4.207 1.00 . A A . 5 TYR H 1 1 14 2171 1 1 5 TYR HA H 5.695 -5.924 -5.362 1.00 . A A . 5 TYR HA 1 1 14 2172 1 1 5 TYR HB2 H 4.704 -5.611 -2.537 1.00 . A A . 5 TYR HB2 1 1 14 2173 1 1 5 TYR HB3 H 5.986 -6.748 -2.939 1.00 . A A . 5 TYR HB3 1 1 14 2174 1 1 5 TYR HD1 H 5.056 -3.155 -3.102 1.00 . A A . 5 TYR HD1 1 1 14 2175 1 1 5 TYR HD2 H 8.205 -6.016 -3.169 1.00 . A A . 5 TYR HD2 1 1 14 2176 1 1 5 TYR HE1 H 6.704 -1.335 -2.958 1.00 . A A . 5 TYR HE1 1 1 14 2177 1 1 5 TYR HE2 H 9.862 -4.204 -3.024 1.00 . A A . 5 TYR HE2 1 1 14 2178 1 1 5 TYR HH H 9.232 -1.210 -2.049 1.00 . A A . 5 TYR HH 1 1 14 2179 1 1 5 TYR N N 3.930 -4.957 -4.905 1.00 . A A . 5 TYR N 1 1 14 2180 1 1 5 TYR O O 4.938 -8.372 -5.055 1.00 . A A . 5 TYR O 1 1 14 2181 1 1 5 TYR OH O 9.308 -1.644 -2.902 1.00 . A A . 5 TYR OH 1 1 14 2182 1 1 6 SER C C 1.661 -8.921 -5.998 1.00 . A A . 6 SER C 1 1 14 2183 1 1 6 SER CA C 2.226 -8.709 -4.597 1.00 . A A . 6 SER CA 1 1 14 2184 1 1 6 SER CB C 1.092 -8.730 -3.569 1.00 . A A . 6 SER CB 1 1 14 2185 1 1 6 SER H H 2.475 -6.630 -4.281 1.00 . A A . 6 SER H 1 1 14 2186 1 1 6 SER HA H 2.916 -9.508 -4.374 1.00 . A A . 6 SER HA 1 1 14 2187 1 1 6 SER HB2 H 1.332 -8.059 -2.759 1.00 . A A . 6 SER HB2 1 1 14 2188 1 1 6 SER HB3 H 0.175 -8.410 -4.042 1.00 . A A . 6 SER HB3 1 1 14 2189 1 1 6 SER HG H 1.622 -10.240 -2.440 1.00 . A A . 6 SER HG 1 1 14 2190 1 1 6 SER N N 2.957 -7.450 -4.517 1.00 . A A . 6 SER N 1 1 14 2191 1 1 6 SER O O 1.451 -10.055 -6.429 1.00 . A A . 6 SER O 1 1 14 2192 1 1 6 SER OG O 0.905 -10.032 -3.043 1.00 . A A . 6 SER OG 1 1 14 2193 1 1 7 ARG C C 1.970 -8.230 -9.064 1.00 . A A . 7 ARG C 1 1 14 2194 1 1 7 ARG CA C 0.877 -7.886 -8.056 1.00 . A A . 7 ARG CA 1 1 14 2195 1 1 7 ARG CB C 0.223 -6.555 -8.431 1.00 . A A . 7 ARG CB 1 1 14 2196 1 1 7 ARG CD C -0.038 -6.969 -10.896 1.00 . A A . 7 ARG CD 1 1 14 2197 1 1 7 ARG CG C 0.576 -6.076 -9.830 1.00 . A A . 7 ARG CG 1 1 14 2198 1 1 7 ARG CZ C -2.086 -5.825 -11.630 1.00 . A A . 7 ARG CZ 1 1 14 2199 1 1 7 ARG H H 1.606 -6.946 -6.306 1.00 . A A . 7 ARG H 1 1 14 2200 1 1 7 ARG HA H 0.127 -8.663 -8.077 1.00 . A A . 7 ARG HA 1 1 14 2201 1 1 7 ARG HB2 H -0.850 -6.664 -8.372 1.00 . A A . 7 ARG HB2 1 1 14 2202 1 1 7 ARG HB3 H 0.540 -5.801 -7.725 1.00 . A A . 7 ARG HB3 1 1 14 2203 1 1 7 ARG HD2 H 0.756 -7.476 -11.423 1.00 . A A . 7 ARG HD2 1 1 14 2204 1 1 7 ARG HD3 H -0.672 -7.698 -10.413 1.00 . A A . 7 ARG HD3 1 1 14 2205 1 1 7 ARG HE H -0.415 -5.973 -12.708 1.00 . A A . 7 ARG HE 1 1 14 2206 1 1 7 ARG HG2 H 0.204 -5.070 -9.960 1.00 . A A . 7 ARG HG2 1 1 14 2207 1 1 7 ARG HG3 H 1.650 -6.082 -9.942 1.00 . A A . 7 ARG HG3 1 1 14 2208 1 1 7 ARG HH11 H -2.186 -6.647 -9.788 1.00 . A A . 7 ARG HH11 1 1 14 2209 1 1 7 ARG HH12 H -3.623 -5.838 -10.318 1.00 . A A . 7 ARG HH12 1 1 14 2210 1 1 7 ARG HH21 H -2.301 -4.904 -13.417 1.00 . A A . 7 ARG HH21 1 1 14 2211 1 1 7 ARG HH22 H -3.688 -4.847 -12.383 1.00 . A A . 7 ARG HH22 1 1 14 2212 1 1 7 ARG N N 1.418 -7.822 -6.704 1.00 . A A . 7 ARG N 1 1 14 2213 1 1 7 ARG NE N -0.835 -6.209 -11.855 1.00 . A A . 7 ARG NE 1 1 14 2214 1 1 7 ARG NH1 N -2.681 -6.129 -10.485 1.00 . A A . 7 ARG NH1 1 1 14 2215 1 1 7 ARG NH2 N -2.746 -5.135 -12.553 1.00 . A A . 7 ARG NH2 1 1 14 2216 1 1 7 ARG O O 1.747 -8.999 -9.999 1.00 . A A . 7 ARG O 1 1 14 2217 1 1 8 VAL C C 4.549 -9.394 -9.903 1.00 . A A . 8 VAL C 1 1 14 2218 1 1 8 VAL CA C 4.280 -7.901 -9.756 1.00 . A A . 8 VAL CA 1 1 14 2219 1 1 8 VAL CB C 5.558 -7.207 -9.247 1.00 . A A . 8 VAL CB 1 1 14 2220 1 1 8 VAL CG1 C 6.750 -7.582 -10.114 1.00 . A A . 8 VAL CG1 1 1 14 2221 1 1 8 VAL CG2 C 5.367 -5.699 -9.213 1.00 . A A . 8 VAL CG2 1 1 14 2222 1 1 8 VAL H H 3.268 -7.052 -8.102 1.00 . A A . 8 VAL H 1 1 14 2223 1 1 8 VAL HA H 4.035 -7.492 -10.726 1.00 . A A . 8 VAL HA 1 1 14 2224 1 1 8 VAL HB H 5.751 -7.548 -8.241 1.00 . A A . 8 VAL HB 1 1 14 2225 1 1 8 VAL HG11 H 6.429 -7.691 -11.140 1.00 . A A . 8 VAL HG11 1 1 14 2226 1 1 8 VAL HG12 H 7.500 -6.808 -10.050 1.00 . A A . 8 VAL HG12 1 1 14 2227 1 1 8 VAL HG13 H 7.167 -8.517 -9.768 1.00 . A A . 8 VAL HG13 1 1 14 2228 1 1 8 VAL HG21 H 5.845 -5.296 -8.332 1.00 . A A . 8 VAL HG21 1 1 14 2229 1 1 8 VAL HG22 H 5.810 -5.259 -10.095 1.00 . A A . 8 VAL HG22 1 1 14 2230 1 1 8 VAL HG23 H 4.312 -5.469 -9.188 1.00 . A A . 8 VAL HG23 1 1 14 2231 1 1 8 VAL N N 3.152 -7.655 -8.866 1.00 . A A . 8 VAL N 1 1 14 2232 1 1 8 VAL O O 4.402 -9.960 -10.987 1.00 . A A . 8 VAL O 1 1 14 2233 1 1 9 LYS C C 3.990 -12.264 -9.173 1.00 . A A . 9 LYS C 1 1 14 2234 1 1 9 LYS CA C 5.233 -11.458 -8.808 1.00 . A A . 9 LYS CA 1 1 14 2235 1 1 9 LYS CB C 5.754 -11.898 -7.438 1.00 . A A . 9 LYS CB 1 1 14 2236 1 1 9 LYS CD C 7.272 -10.444 -6.063 1.00 . A A . 9 LYS CD 1 1 14 2237 1 1 9 LYS CE C 8.547 -10.600 -5.248 1.00 . A A . 9 LYS CE 1 1 14 2238 1 1 9 LYS CG C 7.190 -11.480 -7.171 1.00 . A A . 9 LYS CG 1 1 14 2239 1 1 9 LYS H H 5.043 -9.524 -7.970 1.00 . A A . 9 LYS H 1 1 14 2240 1 1 9 LYS HA H 5.995 -11.641 -9.550 1.00 . A A . 9 LYS HA 1 1 14 2241 1 1 9 LYS HB2 H 5.127 -11.466 -6.672 1.00 . A A . 9 LYS HB2 1 1 14 2242 1 1 9 LYS HB3 H 5.697 -12.975 -7.373 1.00 . A A . 9 LYS HB3 1 1 14 2243 1 1 9 LYS HD2 H 7.258 -9.458 -6.502 1.00 . A A . 9 LYS HD2 1 1 14 2244 1 1 9 LYS HD3 H 6.420 -10.561 -5.409 1.00 . A A . 9 LYS HD3 1 1 14 2245 1 1 9 LYS HE2 H 9.350 -10.885 -5.910 1.00 . A A . 9 LYS HE2 1 1 14 2246 1 1 9 LYS HE3 H 8.780 -9.653 -4.785 1.00 . A A . 9 LYS HE3 1 1 14 2247 1 1 9 LYS HG2 H 7.760 -12.350 -6.880 1.00 . A A . 9 LYS HG2 1 1 14 2248 1 1 9 LYS HG3 H 7.607 -11.061 -8.076 1.00 . A A . 9 LYS HG3 1 1 14 2249 1 1 9 LYS HZ1 H 9.237 -11.628 -3.565 1.00 . A A . 9 LYS HZ1 1 1 14 2250 1 1 9 LYS HZ2 H 8.315 -12.578 -4.618 1.00 . A A . 9 LYS HZ2 1 1 14 2251 1 1 9 LYS HZ3 H 7.556 -11.447 -3.615 1.00 . A A . 9 LYS HZ3 1 1 14 2252 1 1 9 LYS N N 4.944 -10.029 -8.804 1.00 . A A . 9 LYS N 1 1 14 2253 1 1 9 LYS NZ N 8.403 -11.636 -4.187 1.00 . A A . 9 LYS NZ 1 1 14 2254 1 1 9 LYS O O 4.039 -13.146 -10.030 1.00 . A A . 9 LYS O 1 1 15 2255 1 1 1 THR C C 2.750 -1.349 -1.647 1.00 . A A . 1 THR C 1 1 15 2256 1 1 1 THR CA C 2.422 0.106 -1.333 1.00 . A A . 1 THR CA 1 1 15 2257 1 1 1 THR CB C 3.658 0.774 -0.701 1.00 . A A . 1 THR CB 1 1 15 2258 1 1 1 THR CG2 C 4.400 1.618 -1.726 1.00 . A A . 1 THR CG2 1 1 15 2259 1 1 1 THR H1 H 1.387 0.431 0.484 1.00 . A A . 1 THR H1 1 1 15 2260 1 1 1 THR HA H 2.193 0.620 -2.255 1.00 . A A . 1 THR HA 1 1 15 2261 1 1 1 THR HB H 4.323 0.001 -0.343 1.00 . A A . 1 THR HB 1 1 15 2262 1 1 1 THR HG1 H 4.000 2.141 0.679 1.00 . A A . 1 THR HG1 1 1 15 2263 1 1 1 THR HG21 H 5.445 1.345 -1.728 1.00 . A A . 1 THR HG21 1 1 15 2264 1 1 1 THR HG22 H 4.301 2.663 -1.471 1.00 . A A . 1 THR HG22 1 1 15 2265 1 1 1 THR HG23 H 3.982 1.445 -2.705 1.00 . A A . 1 THR HG23 1 1 15 2266 1 1 1 THR N N 1.259 0.206 -0.461 1.00 . A A . 1 THR N 1 1 15 2267 1 1 1 THR O O 3.631 -1.636 -2.458 1.00 . A A . 1 THR O 1 1 15 2268 1 1 1 THR OG1 O 3.259 1.596 0.403 1.00 . A A . 1 THR OG1 1 1 15 2269 1 1 2 VAL C C 1.340 -4.227 -2.310 1.00 . A A . 2 VAL C 1 1 15 2270 1 1 2 VAL CA C 2.251 -3.692 -1.211 1.00 . A A . 2 VAL CA 1 1 15 2271 1 1 2 VAL CB C 2.007 -4.494 0.080 1.00 . A A . 2 VAL CB 1 1 15 2272 1 1 2 VAL CG1 C 2.537 -5.912 -0.063 1.00 . A A . 2 VAL CG1 1 1 15 2273 1 1 2 VAL CG2 C 2.646 -3.795 1.271 1.00 . A A . 2 VAL CG2 1 1 15 2274 1 1 2 VAL H H 1.349 -1.974 -0.365 1.00 . A A . 2 VAL H 1 1 15 2275 1 1 2 VAL HA H 3.280 -3.834 -1.509 1.00 . A A . 2 VAL HA 1 1 15 2276 1 1 2 VAL HB H 0.941 -4.547 0.251 1.00 . A A . 2 VAL HB 1 1 15 2277 1 1 2 VAL HG11 H 3.617 -5.892 -0.083 1.00 . A A . 2 VAL HG11 1 1 15 2278 1 1 2 VAL HG12 H 2.202 -6.508 0.773 1.00 . A A . 2 VAL HG12 1 1 15 2279 1 1 2 VAL HG13 H 2.169 -6.342 -0.983 1.00 . A A . 2 VAL HG13 1 1 15 2280 1 1 2 VAL HG21 H 2.220 -2.808 1.379 1.00 . A A . 2 VAL HG21 1 1 15 2281 1 1 2 VAL HG22 H 2.460 -4.367 2.168 1.00 . A A . 2 VAL HG22 1 1 15 2282 1 1 2 VAL HG23 H 3.711 -3.712 1.111 1.00 . A A . 2 VAL HG23 1 1 15 2283 1 1 2 VAL N N 2.037 -2.265 -1.000 1.00 . A A . 2 VAL N 1 1 15 2284 1 1 2 VAL O O 1.635 -5.247 -2.933 1.00 . A A . 2 VAL O 1 1 15 2285 1 1 3 TYR C C -0.013 -4.294 -4.867 1.00 . A A . 3 TYR C 1 1 15 2286 1 1 3 TYR CA C -0.725 -3.939 -3.565 1.00 . A A . 3 TYR CA 1 1 15 2287 1 1 3 TYR CB C -1.742 -2.824 -3.814 1.00 . A A . 3 TYR CB 1 1 15 2288 1 1 3 TYR CD1 C -0.220 -0.895 -4.394 1.00 . A A . 3 TYR CD1 1 1 15 2289 1 1 3 TYR CD2 C -1.648 -0.670 -2.499 1.00 . A A . 3 TYR CD2 1 1 15 2290 1 1 3 TYR CE1 C 0.285 0.371 -4.170 1.00 . A A . 3 TYR CE1 1 1 15 2291 1 1 3 TYR CE2 C -1.150 0.597 -2.268 1.00 . A A . 3 TYR CE2 1 1 15 2292 1 1 3 TYR CG C -1.194 -1.438 -3.564 1.00 . A A . 3 TYR CG 1 1 15 2293 1 1 3 TYR CZ C -0.184 1.114 -3.106 1.00 . A A . 3 TYR CZ 1 1 15 2294 1 1 3 TYR H H 0.052 -2.728 -2.013 1.00 . A A . 3 TYR H 1 1 15 2295 1 1 3 TYR HA H -1.245 -4.814 -3.203 1.00 . A A . 3 TYR HA 1 1 15 2296 1 1 3 TYR HB2 H -2.072 -2.870 -4.840 1.00 . A A . 3 TYR HB2 1 1 15 2297 1 1 3 TYR HB3 H -2.590 -2.968 -3.161 1.00 . A A . 3 TYR HB3 1 1 15 2298 1 1 3 TYR HD1 H 0.145 -1.479 -5.227 1.00 . A A . 3 TYR HD1 1 1 15 2299 1 1 3 TYR HD2 H -2.405 -1.078 -1.844 1.00 . A A . 3 TYR HD2 1 1 15 2300 1 1 3 TYR HE1 H 1.041 0.776 -4.826 1.00 . A A . 3 TYR HE1 1 1 15 2301 1 1 3 TYR HE2 H -1.516 1.179 -1.435 1.00 . A A . 3 TYR HE2 1 1 15 2302 1 1 3 TYR HH H 0.749 2.399 -2.022 1.00 . A A . 3 TYR HH 1 1 15 2303 1 1 3 TYR N N 0.232 -3.533 -2.542 1.00 . A A . 3 TYR N 1 1 15 2304 1 1 3 TYR O O -0.450 -5.174 -5.608 1.00 . A A . 3 TYR O 1 1 15 2305 1 1 3 TYR OH O 0.316 2.376 -2.879 1.00 . A A . 3 TYR OH 1 1 15 2306 1 1 4 VAL C C 2.884 -4.955 -6.137 1.00 . A A . 4 VAL C 1 1 15 2307 1 1 4 VAL CA C 1.864 -3.842 -6.350 1.00 . A A . 4 VAL CA 1 1 15 2308 1 1 4 VAL CB C 2.598 -2.568 -6.809 1.00 . A A . 4 VAL CB 1 1 15 2309 1 1 4 VAL CG1 C 1.654 -1.653 -7.573 1.00 . A A . 4 VAL CG1 1 1 15 2310 1 1 4 VAL CG2 C 3.206 -1.845 -5.617 1.00 . A A . 4 VAL CG2 1 1 15 2311 1 1 4 VAL H H 1.388 -2.912 -4.509 1.00 . A A . 4 VAL H 1 1 15 2312 1 1 4 VAL HA H 1.180 -4.139 -7.131 1.00 . A A . 4 VAL HA 1 1 15 2313 1 1 4 VAL HB H 3.399 -2.858 -7.474 1.00 . A A . 4 VAL HB 1 1 15 2314 1 1 4 VAL HG11 H 1.288 -0.881 -6.912 1.00 . A A . 4 VAL HG11 1 1 15 2315 1 1 4 VAL HG12 H 2.180 -1.202 -8.401 1.00 . A A . 4 VAL HG12 1 1 15 2316 1 1 4 VAL HG13 H 0.820 -2.229 -7.947 1.00 . A A . 4 VAL HG13 1 1 15 2317 1 1 4 VAL HG21 H 3.223 -2.508 -4.765 1.00 . A A . 4 VAL HG21 1 1 15 2318 1 1 4 VAL HG22 H 4.215 -1.541 -5.855 1.00 . A A . 4 VAL HG22 1 1 15 2319 1 1 4 VAL HG23 H 2.614 -0.973 -5.384 1.00 . A A . 4 VAL HG23 1 1 15 2320 1 1 4 VAL N N 1.089 -3.601 -5.139 1.00 . A A . 4 VAL N 1 1 15 2321 1 1 4 VAL O O 3.142 -5.755 -7.036 1.00 . A A . 4 VAL O 1 1 15 2322 1 1 5 TYR C C 3.880 -7.416 -4.777 1.00 . A A . 5 TYR C 1 1 15 2323 1 1 5 TYR CA C 4.455 -6.013 -4.610 1.00 . A A . 5 TYR CA 1 1 15 2324 1 1 5 TYR CB C 4.952 -5.821 -3.176 1.00 . A A . 5 TYR CB 1 1 15 2325 1 1 5 TYR CD1 C 7.268 -5.022 -2.564 1.00 . A A . 5 TYR CD1 1 1 15 2326 1 1 5 TYR CD2 C 5.702 -3.418 -3.375 1.00 . A A . 5 TYR CD2 1 1 15 2327 1 1 5 TYR CE1 C 8.222 -4.031 -2.434 1.00 . A A . 5 TYR CE1 1 1 15 2328 1 1 5 TYR CE2 C 6.650 -2.421 -3.249 1.00 . A A . 5 TYR CE2 1 1 15 2329 1 1 5 TYR CG C 5.993 -4.734 -3.036 1.00 . A A . 5 TYR CG 1 1 15 2330 1 1 5 TYR CZ C 7.908 -2.733 -2.779 1.00 . A A . 5 TYR CZ 1 1 15 2331 1 1 5 TYR H H 3.214 -4.334 -4.265 1.00 . A A . 5 TYR H 1 1 15 2332 1 1 5 TYR HA H 5.288 -5.895 -5.287 1.00 . A A . 5 TYR HA 1 1 15 2333 1 1 5 TYR HB2 H 4.116 -5.563 -2.544 1.00 . A A . 5 TYR HB2 1 1 15 2334 1 1 5 TYR HB3 H 5.389 -6.746 -2.826 1.00 . A A . 5 TYR HB3 1 1 15 2335 1 1 5 TYR HD1 H 7.511 -6.039 -2.295 1.00 . A A . 5 TYR HD1 1 1 15 2336 1 1 5 TYR HD2 H 4.715 -3.178 -3.743 1.00 . A A . 5 TYR HD2 1 1 15 2337 1 1 5 TYR HE1 H 9.208 -4.274 -2.066 1.00 . A A . 5 TYR HE1 1 1 15 2338 1 1 5 TYR HE2 H 6.404 -1.405 -3.519 1.00 . A A . 5 TYR HE2 1 1 15 2339 1 1 5 TYR HH H 8.590 -0.977 -3.167 1.00 . A A . 5 TYR HH 1 1 15 2340 1 1 5 TYR N N 3.461 -5.000 -4.941 1.00 . A A . 5 TYR N 1 1 15 2341 1 1 5 TYR O O 4.606 -8.368 -5.062 1.00 . A A . 5 TYR O 1 1 15 2342 1 1 5 TYR OH O 8.855 -1.742 -2.651 1.00 . A A . 5 TYR OH 1 1 15 2343 1 1 6 SER C C 1.472 -9.074 -6.168 1.00 . A A . 6 SER C 1 1 15 2344 1 1 6 SER CA C 1.893 -8.822 -4.724 1.00 . A A . 6 SER CA 1 1 15 2345 1 1 6 SER CB C 0.668 -8.872 -3.808 1.00 . A A . 6 SER CB 1 1 15 2346 1 1 6 SER H H 2.043 -6.740 -4.370 1.00 . A A . 6 SER H 1 1 15 2347 1 1 6 SER HA H 2.588 -9.592 -4.424 1.00 . A A . 6 SER HA 1 1 15 2348 1 1 6 SER HB2 H 0.817 -8.201 -2.976 1.00 . A A . 6 SER HB2 1 1 15 2349 1 1 6 SER HB3 H -0.206 -8.568 -4.365 1.00 . A A . 6 SER HB3 1 1 15 2350 1 1 6 SER HG H 1.297 -10.551 -3.018 1.00 . A A . 6 SER HG 1 1 15 2351 1 1 6 SER N N 2.568 -7.536 -4.597 1.00 . A A . 6 SER N 1 1 15 2352 1 1 6 SER O O 1.358 -10.221 -6.602 1.00 . A A . 6 SER O 1 1 15 2353 1 1 6 SER OG O 0.460 -10.181 -3.307 1.00 . A A . 6 SER OG 1 1 15 2354 1 1 7 ARG C C 2.030 -8.406 -9.200 1.00 . A A . 7 ARG C 1 1 15 2355 1 1 7 ARG CA C 0.834 -8.097 -8.304 1.00 . A A . 7 ARG CA 1 1 15 2356 1 1 7 ARG CB C 0.165 -6.799 -8.759 1.00 . A A . 7 ARG CB 1 1 15 2357 1 1 7 ARG CD C 0.159 -7.244 -11.232 1.00 . A A . 7 ARG CD 1 1 15 2358 1 1 7 ARG CG C 0.632 -6.318 -10.123 1.00 . A A . 7 ARG CG 1 1 15 2359 1 1 7 ARG CZ C -1.614 -7.258 -12.935 1.00 . A A . 7 ARG CZ 1 1 15 2360 1 1 7 ARG H H 1.352 -7.107 -6.506 1.00 . A A . 7 ARG H 1 1 15 2361 1 1 7 ARG HA H 0.123 -8.905 -8.383 1.00 . A A . 7 ARG HA 1 1 15 2362 1 1 7 ARG HB2 H -0.903 -6.954 -8.803 1.00 . A A . 7 ARG HB2 1 1 15 2363 1 1 7 ARG HB3 H 0.379 -6.026 -8.036 1.00 . A A . 7 ARG HB3 1 1 15 2364 1 1 7 ARG HD2 H 1.013 -7.548 -11.819 1.00 . A A . 7 ARG HD2 1 1 15 2365 1 1 7 ARG HD3 H -0.298 -8.114 -10.785 1.00 . A A . 7 ARG HD3 1 1 15 2366 1 1 7 ARG HE H -0.868 -5.618 -12.080 1.00 . A A . 7 ARG HE 1 1 15 2367 1 1 7 ARG HG2 H 0.236 -5.329 -10.301 1.00 . A A . 7 ARG HG2 1 1 15 2368 1 1 7 ARG HG3 H 1.711 -6.282 -10.131 1.00 . A A . 7 ARG HG3 1 1 15 2369 1 1 7 ARG HH11 H -0.917 -9.083 -12.418 1.00 . A A . 7 ARG HH11 1 1 15 2370 1 1 7 ARG HH12 H -2.168 -9.079 -13.618 1.00 . A A . 7 ARG HH12 1 1 15 2371 1 1 7 ARG HH21 H -2.515 -5.600 -13.659 1.00 . A A . 7 ARG HH21 1 1 15 2372 1 1 7 ARG HH22 H -3.075 -7.097 -14.323 1.00 . A A . 7 ARG HH22 1 1 15 2373 1 1 7 ARG N N 1.244 -7.994 -6.909 1.00 . A A . 7 ARG N 1 1 15 2374 1 1 7 ARG NE N -0.812 -6.596 -12.109 1.00 . A A . 7 ARG NE 1 1 15 2375 1 1 7 ARG NH1 N -1.562 -8.582 -12.996 1.00 . A A . 7 ARG NH1 1 1 15 2376 1 1 7 ARG NH2 N -2.472 -6.597 -13.702 1.00 . A A . 7 ARG NH2 1 1 15 2377 1 1 7 ARG O O 1.926 -9.190 -10.144 1.00 . A A . 7 ARG O 1 1 15 2378 1 1 8 VAL C C 4.711 -9.477 -9.792 1.00 . A A . 8 VAL C 1 1 15 2379 1 1 8 VAL CA C 4.382 -7.993 -9.675 1.00 . A A . 8 VAL CA 1 1 15 2380 1 1 8 VAL CB C 5.582 -7.260 -9.047 1.00 . A A . 8 VAL CB 1 1 15 2381 1 1 8 VAL CG1 C 6.850 -7.532 -9.842 1.00 . A A . 8 VAL CG1 1 1 15 2382 1 1 8 VAL CG2 C 5.307 -5.767 -8.960 1.00 . A A . 8 VAL CG2 1 1 15 2383 1 1 8 VAL H H 3.186 -7.172 -8.134 1.00 . A A . 8 VAL H 1 1 15 2384 1 1 8 VAL HA H 4.219 -7.591 -10.664 1.00 . A A . 8 VAL HA 1 1 15 2385 1 1 8 VAL HB H 5.724 -7.638 -8.045 1.00 . A A . 8 VAL HB 1 1 15 2386 1 1 8 VAL HG11 H 6.587 -7.836 -10.845 1.00 . A A . 8 VAL HG11 1 1 15 2387 1 1 8 VAL HG12 H 7.449 -6.634 -9.882 1.00 . A A . 8 VAL HG12 1 1 15 2388 1 1 8 VAL HG13 H 7.412 -8.320 -9.364 1.00 . A A . 8 VAL HG13 1 1 15 2389 1 1 8 VAL HG21 H 6.087 -5.227 -9.475 1.00 . A A . 8 VAL HG21 1 1 15 2390 1 1 8 VAL HG22 H 4.354 -5.548 -9.420 1.00 . A A . 8 VAL HG22 1 1 15 2391 1 1 8 VAL HG23 H 5.284 -5.464 -7.923 1.00 . A A . 8 VAL HG23 1 1 15 2392 1 1 8 VAL N N 3.166 -7.785 -8.898 1.00 . A A . 8 VAL N 1 1 15 2393 1 1 8 VAL O O 4.684 -10.047 -10.883 1.00 . A A . 8 VAL O 1 1 15 2394 1 1 9 LYS C C 4.128 -12.372 -8.933 1.00 . A A . 9 LYS C 1 1 15 2395 1 1 9 LYS CA C 5.356 -11.519 -8.633 1.00 . A A . 9 LYS CA 1 1 15 2396 1 1 9 LYS CB C 5.936 -11.902 -7.270 1.00 . A A . 9 LYS CB 1 1 15 2397 1 1 9 LYS CD C 7.581 -10.376 -6.140 1.00 . A A . 9 LYS CD 1 1 15 2398 1 1 9 LYS CE C 9.002 -10.315 -5.602 1.00 . A A . 9 LYS CE 1 1 15 2399 1 1 9 LYS CG C 7.400 -11.535 -7.107 1.00 . A A . 9 LYS CG 1 1 15 2400 1 1 9 LYS H H 5.027 -9.592 -7.821 1.00 . A A . 9 LYS H 1 1 15 2401 1 1 9 LYS HA H 6.099 -11.699 -9.395 1.00 . A A . 9 LYS HA 1 1 15 2402 1 1 9 LYS HB2 H 5.372 -11.399 -6.498 1.00 . A A . 9 LYS HB2 1 1 15 2403 1 1 9 LYS HB3 H 5.837 -12.970 -7.137 1.00 . A A . 9 LYS HB3 1 1 15 2404 1 1 9 LYS HD2 H 7.363 -9.452 -6.654 1.00 . A A . 9 LYS HD2 1 1 15 2405 1 1 9 LYS HD3 H 6.896 -10.500 -5.312 1.00 . A A . 9 LYS HD3 1 1 15 2406 1 1 9 LYS HE2 H 9.052 -10.889 -4.689 1.00 . A A . 9 LYS HE2 1 1 15 2407 1 1 9 LYS HE3 H 9.669 -10.745 -6.335 1.00 . A A . 9 LYS HE3 1 1 15 2408 1 1 9 LYS HG2 H 7.937 -12.392 -6.728 1.00 . A A . 9 LYS HG2 1 1 15 2409 1 1 9 LYS HG3 H 7.801 -11.253 -8.070 1.00 . A A . 9 LYS HG3 1 1 15 2410 1 1 9 LYS HZ1 H 9.063 -8.612 -4.395 1.00 . A A . 9 LYS HZ1 1 1 15 2411 1 1 9 LYS HZ2 H 9.062 -8.277 -6.053 1.00 . A A . 9 LYS HZ2 1 1 15 2412 1 1 9 LYS HZ3 H 10.467 -8.855 -5.308 1.00 . A A . 9 LYS HZ3 1 1 15 2413 1 1 9 LYS N N 5.022 -10.100 -8.660 1.00 . A A . 9 LYS N 1 1 15 2414 1 1 9 LYS NZ N 9.429 -8.917 -5.320 1.00 . A A . 9 LYS NZ 1 1 15 2415 1 1 9 LYS O O 4.011 -12.952 -10.013 1.00 . A A . 9 LYS O 1 1 16 2416 1 1 1 THR C C 2.810 -1.356 -1.657 1.00 . A A . 1 THR C 1 1 16 2417 1 1 1 THR CA C 2.439 0.083 -1.319 1.00 . A A . 1 THR CA 1 1 16 2418 1 1 1 THR CB C 3.675 0.796 -0.738 1.00 . A A . 1 THR CB 1 1 16 2419 1 1 1 THR CG2 C 4.263 1.769 -1.748 1.00 . A A . 1 THR CG2 1 1 16 2420 1 1 1 THR H1 H 1.465 0.418 0.531 1.00 . A A . 1 THR H1 1 1 16 2421 1 1 1 THR HA H 2.149 0.593 -2.226 1.00 . A A . 1 THR HA 1 1 16 2422 1 1 1 THR HB H 4.421 0.053 -0.498 1.00 . A A . 1 THR HB 1 1 16 2423 1 1 1 THR HG1 H 4.008 1.386 1.115 1.00 . A A . 1 THR HG1 1 1 16 2424 1 1 1 THR HG21 H 3.526 2.517 -2.000 1.00 . A A . 1 THR HG21 1 1 16 2425 1 1 1 THR HG22 H 4.550 1.232 -2.640 1.00 . A A . 1 THR HG22 1 1 16 2426 1 1 1 THR HG23 H 5.132 2.248 -1.322 1.00 . A A . 1 THR HG23 1 1 16 2427 1 1 1 THR N N 1.313 0.133 -0.395 1.00 . A A . 1 THR N 1 1 16 2428 1 1 1 THR O O 3.664 -1.605 -2.508 1.00 . A A . 1 THR O 1 1 16 2429 1 1 1 THR OG1 O 3.317 1.500 0.457 1.00 . A A . 1 THR OG1 1 1 16 2430 1 1 2 VAL C C 1.483 -4.284 -2.275 1.00 . A A . 2 VAL C 1 1 16 2431 1 1 2 VAL CA C 2.422 -3.719 -1.216 1.00 . A A . 2 VAL CA 1 1 16 2432 1 1 2 VAL CB C 2.267 -4.536 0.080 1.00 . A A . 2 VAL CB 1 1 16 2433 1 1 2 VAL CG1 C 2.846 -5.932 -0.096 1.00 . A A . 2 VAL CG1 1 1 16 2434 1 1 2 VAL CG2 C 2.932 -3.818 1.245 1.00 . A A . 2 VAL CG2 1 1 16 2435 1 1 2 VAL H H 1.492 -2.042 -0.319 1.00 . A A . 2 VAL H 1 1 16 2436 1 1 2 VAL HA H 3.441 -3.819 -1.560 1.00 . A A . 2 VAL HA 1 1 16 2437 1 1 2 VAL HB H 1.214 -4.632 0.298 1.00 . A A . 2 VAL HB 1 1 16 2438 1 1 2 VAL HG11 H 3.922 -5.869 -0.164 1.00 . A A . 2 VAL HG11 1 1 16 2439 1 1 2 VAL HG12 H 2.572 -6.545 0.750 1.00 . A A . 2 VAL HG12 1 1 16 2440 1 1 2 VAL HG13 H 2.454 -6.372 -1.002 1.00 . A A . 2 VAL HG13 1 1 16 2441 1 1 2 VAL HG21 H 2.473 -2.850 1.380 1.00 . A A . 2 VAL HG21 1 1 16 2442 1 1 2 VAL HG22 H 2.809 -4.402 2.146 1.00 . A A . 2 VAL HG22 1 1 16 2443 1 1 2 VAL HG23 H 3.984 -3.693 1.038 1.00 . A A . 2 VAL HG23 1 1 16 2444 1 1 2 VAL N N 2.162 -2.303 -0.985 1.00 . A A . 2 VAL N 1 1 16 2445 1 1 2 VAL O O 1.789 -5.289 -2.918 1.00 . A A . 2 VAL O 1 1 16 2446 1 1 3 TYR C C 0.020 -4.391 -4.769 1.00 . A A . 3 TYR C 1 1 16 2447 1 1 3 TYR CA C -0.646 -4.071 -3.435 1.00 . A A . 3 TYR CA 1 1 16 2448 1 1 3 TYR CB C -1.715 -2.995 -3.631 1.00 . A A . 3 TYR CB 1 1 16 2449 1 1 3 TYR CD1 C -0.297 -1.006 -4.268 1.00 . A A . 3 TYR CD1 1 1 16 2450 1 1 3 TYR CD2 C -1.644 -0.845 -2.308 1.00 . A A . 3 TYR CD2 1 1 16 2451 1 1 3 TYR CE1 C 0.168 0.278 -4.059 1.00 . A A . 3 TYR CE1 1 1 16 2452 1 1 3 TYR CE2 C -1.186 0.440 -2.092 1.00 . A A . 3 TYR CE2 1 1 16 2453 1 1 3 TYR CG C -1.210 -1.590 -3.398 1.00 . A A . 3 TYR CG 1 1 16 2454 1 1 3 TYR CZ C -0.280 0.997 -2.970 1.00 . A A . 3 TYR CZ 1 1 16 2455 1 1 3 TYR H H 0.152 -2.838 -1.911 1.00 . A A . 3 TYR H 1 1 16 2456 1 1 3 TYR HA H -1.115 -4.967 -3.055 1.00 . A A . 3 TYR HA 1 1 16 2457 1 1 3 TYR HB2 H -2.090 -3.050 -4.641 1.00 . A A . 3 TYR HB2 1 1 16 2458 1 1 3 TYR HB3 H -2.527 -3.175 -2.941 1.00 . A A . 3 TYR HB3 1 1 16 2459 1 1 3 TYR HD1 H 0.052 -1.571 -5.120 1.00 . A A . 3 TYR HD1 1 1 16 2460 1 1 3 TYR HD2 H -2.354 -1.285 -1.622 1.00 . A A . 3 TYR HD2 1 1 16 2461 1 1 3 TYR HE1 H 0.878 0.715 -4.746 1.00 . A A . 3 TYR HE1 1 1 16 2462 1 1 3 TYR HE2 H -1.536 1.003 -1.240 1.00 . A A . 3 TYR HE2 1 1 16 2463 1 1 3 TYR HH H -0.564 2.881 -2.712 1.00 . A A . 3 TYR HH 1 1 16 2464 1 1 3 TYR N N 0.340 -3.632 -2.453 1.00 . A A . 3 TYR N 1 1 16 2465 1 1 3 TYR O O -0.416 -5.285 -5.496 1.00 . A A . 3 TYR O 1 1 16 2466 1 1 3 TYR OH O 0.181 2.276 -2.758 1.00 . A A . 3 TYR OH 1 1 16 2467 1 1 4 VAL C C 2.880 -4.933 -6.172 1.00 . A A . 4 VAL C 1 1 16 2468 1 1 4 VAL CA C 1.809 -3.860 -6.332 1.00 . A A . 4 VAL CA 1 1 16 2469 1 1 4 VAL CB C 2.472 -2.557 -6.816 1.00 . A A . 4 VAL CB 1 1 16 2470 1 1 4 VAL CG1 C 1.459 -1.676 -7.531 1.00 . A A . 4 VAL CG1 1 1 16 2471 1 1 4 VAL CG2 C 3.105 -1.816 -5.648 1.00 . A A . 4 VAL CG2 1 1 16 2472 1 1 4 VAL H H 1.380 -2.958 -4.467 1.00 . A A . 4 VAL H 1 1 16 2473 1 1 4 VAL HA H 1.102 -4.180 -7.084 1.00 . A A . 4 VAL HA 1 1 16 2474 1 1 4 VAL HB H 3.252 -2.812 -7.518 1.00 . A A . 4 VAL HB 1 1 16 2475 1 1 4 VAL HG11 H 1.932 -1.196 -8.375 1.00 . A A . 4 VAL HG11 1 1 16 2476 1 1 4 VAL HG12 H 0.634 -2.282 -7.876 1.00 . A A . 4 VAL HG12 1 1 16 2477 1 1 4 VAL HG13 H 1.092 -0.923 -6.849 1.00 . A A . 4 VAL HG13 1 1 16 2478 1 1 4 VAL HG21 H 3.185 -2.482 -4.801 1.00 . A A . 4 VAL HG21 1 1 16 2479 1 1 4 VAL HG22 H 4.089 -1.472 -5.930 1.00 . A A . 4 VAL HG22 1 1 16 2480 1 1 4 VAL HG23 H 2.490 -0.969 -5.383 1.00 . A A . 4 VAL HG23 1 1 16 2481 1 1 4 VAL N N 1.081 -3.655 -5.086 1.00 . A A . 4 VAL N 1 1 16 2482 1 1 4 VAL O O 3.128 -5.719 -7.087 1.00 . A A . 4 VAL O 1 1 16 2483 1 1 5 TYR C C 4.031 -7.360 -4.874 1.00 . A A . 5 TYR C 1 1 16 2484 1 1 5 TYR CA C 4.559 -5.937 -4.724 1.00 . A A . 5 TYR CA 1 1 16 2485 1 1 5 TYR CB C 5.111 -5.732 -3.313 1.00 . A A . 5 TYR CB 1 1 16 2486 1 1 5 TYR CD1 C 5.757 -3.300 -3.529 1.00 . A A . 5 TYR CD1 1 1 16 2487 1 1 5 TYR CD2 C 7.420 -4.845 -2.803 1.00 . A A . 5 TYR CD2 1 1 16 2488 1 1 5 TYR CE1 C 6.671 -2.268 -3.441 1.00 . A A . 5 TYR CE1 1 1 16 2489 1 1 5 TYR CE2 C 8.340 -3.819 -2.710 1.00 . A A . 5 TYR CE2 1 1 16 2490 1 1 5 TYR CG C 6.115 -4.605 -3.213 1.00 . A A . 5 TYR CG 1 1 16 2491 1 1 5 TYR CZ C 7.961 -2.532 -3.030 1.00 . A A . 5 TYR CZ 1 1 16 2492 1 1 5 TYR H H 3.270 -4.309 -4.314 1.00 . A A . 5 TYR H 1 1 16 2493 1 1 5 TYR HA H 5.355 -5.783 -5.438 1.00 . A A . 5 TYR HA 1 1 16 2494 1 1 5 TYR HB2 H 4.296 -5.509 -2.643 1.00 . A A . 5 TYR HB2 1 1 16 2495 1 1 5 TYR HB3 H 5.599 -6.640 -2.989 1.00 . A A . 5 TYR HB3 1 1 16 2496 1 1 5 TYR HD1 H 4.746 -3.097 -3.851 1.00 . A A . 5 TYR HD1 1 1 16 2497 1 1 5 TYR HD2 H 7.715 -5.855 -2.554 1.00 . A A . 5 TYR HD2 1 1 16 2498 1 1 5 TYR HE1 H 6.374 -1.260 -3.691 1.00 . A A . 5 TYR HE1 1 1 16 2499 1 1 5 TYR HE2 H 9.350 -4.026 -2.389 1.00 . A A . 5 TYR HE2 1 1 16 2500 1 1 5 TYR HH H 9.079 -1.183 -3.820 1.00 . A A . 5 TYR HH 1 1 16 2501 1 1 5 TYR N N 3.512 -4.961 -5.004 1.00 . A A . 5 TYR N 1 1 16 2502 1 1 5 TYR O O 4.780 -8.281 -5.198 1.00 . A A . 5 TYR O 1 1 16 2503 1 1 5 TYR OH O 8.874 -1.507 -2.940 1.00 . A A . 5 TYR OH 1 1 16 2504 1 1 6 SER C C 1.629 -9.104 -6.168 1.00 . A A . 6 SER C 1 1 16 2505 1 1 6 SER CA C 2.104 -8.842 -4.742 1.00 . A A . 6 SER CA 1 1 16 2506 1 1 6 SER CB C 0.925 -8.944 -3.773 1.00 . A A . 6 SER CB 1 1 16 2507 1 1 6 SER H H 2.189 -6.757 -4.383 1.00 . A A . 6 SER H 1 1 16 2508 1 1 6 SER HA H 2.841 -9.586 -4.478 1.00 . A A . 6 SER HA 1 1 16 2509 1 1 6 SER HB2 H 1.293 -9.177 -2.785 1.00 . A A . 6 SER HB2 1 1 16 2510 1 1 6 SER HB3 H 0.400 -8.000 -3.748 1.00 . A A . 6 SER HB3 1 1 16 2511 1 1 6 SER HG H -0.857 -9.584 -4.278 1.00 . A A . 6 SER HG 1 1 16 2512 1 1 6 SER N N 2.734 -7.531 -4.637 1.00 . A A . 6 SER N 1 1 16 2513 1 1 6 SER O O 1.540 -10.252 -6.604 1.00 . A A . 6 SER O 1 1 16 2514 1 1 6 SER OG O 0.021 -9.959 -4.174 1.00 . A A . 6 SER OG 1 1 16 2515 1 1 7 ARG C C 2.024 -8.401 -9.217 1.00 . A A . 7 ARG C 1 1 16 2516 1 1 7 ARG CA C 0.858 -8.143 -8.267 1.00 . A A . 7 ARG CA 1 1 16 2517 1 1 7 ARG CB C 0.119 -6.869 -8.682 1.00 . A A . 7 ARG CB 1 1 16 2518 1 1 7 ARG CD C 0.019 -7.304 -11.156 1.00 . A A . 7 ARG CD 1 1 16 2519 1 1 7 ARG CG C 0.505 -6.365 -10.063 1.00 . A A . 7 ARG CG 1 1 16 2520 1 1 7 ARG CZ C -1.393 -7.168 -13.164 1.00 . A A . 7 ARG CZ 1 1 16 2521 1 1 7 ARG H H 1.417 -7.142 -6.488 1.00 . A A . 7 ARG H 1 1 16 2522 1 1 7 ARG HA H 0.175 -8.978 -8.318 1.00 . A A . 7 ARG HA 1 1 16 2523 1 1 7 ARG HB2 H -0.943 -7.066 -8.679 1.00 . A A . 7 ARG HB2 1 1 16 2524 1 1 7 ARG HB3 H 0.336 -6.092 -7.965 1.00 . A A . 7 ARG HB3 1 1 16 2525 1 1 7 ARG HD2 H 0.856 -7.569 -11.783 1.00 . A A . 7 ARG HD2 1 1 16 2526 1 1 7 ARG HD3 H -0.382 -8.194 -10.694 1.00 . A A . 7 ARG HD3 1 1 16 2527 1 1 7 ARG HE H -1.453 -5.883 -11.640 1.00 . A A . 7 ARG HE 1 1 16 2528 1 1 7 ARG HG2 H 0.063 -5.391 -10.217 1.00 . A A . 7 ARG HG2 1 1 16 2529 1 1 7 ARG HG3 H 1.581 -6.287 -10.120 1.00 . A A . 7 ARG HG3 1 1 16 2530 1 1 7 ARG HH11 H -0.106 -8.725 -13.133 1.00 . A A . 7 ARG HH11 1 1 16 2531 1 1 7 ARG HH12 H -1.108 -8.619 -14.542 1.00 . A A . 7 ARG HH12 1 1 16 2532 1 1 7 ARG HH21 H -2.777 -5.732 -13.491 1.00 . A A . 7 ARG HH21 1 1 16 2533 1 1 7 ARG HH22 H -2.626 -6.915 -14.746 1.00 . A A . 7 ARG HH22 1 1 16 2534 1 1 7 ARG N N 1.325 -8.031 -6.890 1.00 . A A . 7 ARG N 1 1 16 2535 1 1 7 ARG NE N -1.017 -6.691 -11.983 1.00 . A A . 7 ARG NE 1 1 16 2536 1 1 7 ARG NH1 N -0.822 -8.260 -13.653 1.00 . A A . 7 ARG NH1 1 1 16 2537 1 1 7 ARG NH2 N -2.344 -6.555 -13.857 1.00 . A A . 7 ARG NH2 1 1 16 2538 1 1 7 ARG O O 1.908 -9.184 -10.160 1.00 . A A . 7 ARG O 1 1 16 2539 1 1 8 VAL C C 4.715 -9.363 -9.935 1.00 . A A . 8 VAL C 1 1 16 2540 1 1 8 VAL CA C 4.333 -7.894 -9.794 1.00 . A A . 8 VAL CA 1 1 16 2541 1 1 8 VAL CB C 5.531 -7.117 -9.216 1.00 . A A . 8 VAL CB 1 1 16 2542 1 1 8 VAL CG1 C 6.771 -7.335 -10.069 1.00 . A A . 8 VAL CG1 1 1 16 2543 1 1 8 VAL CG2 C 5.203 -5.636 -9.106 1.00 . A A . 8 VAL CG2 1 1 16 2544 1 1 8 VAL H H 3.177 -7.126 -8.196 1.00 . A A . 8 VAL H 1 1 16 2545 1 1 8 VAL HA H 4.111 -7.494 -10.773 1.00 . A A . 8 VAL HA 1 1 16 2546 1 1 8 VAL HB H 5.733 -7.494 -8.224 1.00 . A A . 8 VAL HB 1 1 16 2547 1 1 8 VAL HG11 H 6.476 -7.668 -11.054 1.00 . A A . 8 VAL HG11 1 1 16 2548 1 1 8 VAL HG12 H 7.320 -6.408 -10.150 1.00 . A A . 8 VAL HG12 1 1 16 2549 1 1 8 VAL HG13 H 7.397 -8.086 -9.609 1.00 . A A . 8 VAL HG13 1 1 16 2550 1 1 8 VAL HG21 H 5.353 -5.309 -8.088 1.00 . A A . 8 VAL HG21 1 1 16 2551 1 1 8 VAL HG22 H 5.850 -5.074 -9.764 1.00 . A A . 8 VAL HG22 1 1 16 2552 1 1 8 VAL HG23 H 4.173 -5.473 -9.389 1.00 . A A . 8 VAL HG23 1 1 16 2553 1 1 8 VAL N N 3.146 -7.736 -8.962 1.00 . A A . 8 VAL N 1 1 16 2554 1 1 8 VAL O O 4.660 -9.928 -11.028 1.00 . A A . 8 VAL O 1 1 16 2555 1 1 9 LYS C C 4.361 -12.262 -9.350 1.00 . A A . 9 LYS C 1 1 16 2556 1 1 9 LYS CA C 5.489 -11.383 -8.820 1.00 . A A . 9 LYS CA 1 1 16 2557 1 1 9 LYS CB C 5.872 -11.825 -7.406 1.00 . A A . 9 LYS CB 1 1 16 2558 1 1 9 LYS CD C 7.267 -10.617 -5.702 1.00 . A A . 9 LYS CD 1 1 16 2559 1 1 9 LYS CE C 8.639 -10.606 -5.046 1.00 . A A . 9 LYS CE 1 1 16 2560 1 1 9 LYS CG C 7.275 -11.410 -6.997 1.00 . A A . 9 LYS CG 1 1 16 2561 1 1 9 LYS H H 5.123 -9.474 -7.982 1.00 . A A . 9 LYS H 1 1 16 2562 1 1 9 LYS HA H 6.347 -11.491 -9.466 1.00 . A A . 9 LYS HA 1 1 16 2563 1 1 9 LYS HB2 H 5.173 -11.393 -6.705 1.00 . A A . 9 LYS HB2 1 1 16 2564 1 1 9 LYS HB3 H 5.807 -12.902 -7.348 1.00 . A A . 9 LYS HB3 1 1 16 2565 1 1 9 LYS HD2 H 6.975 -9.599 -5.914 1.00 . A A . 9 LYS HD2 1 1 16 2566 1 1 9 LYS HD3 H 6.556 -11.063 -5.021 1.00 . A A . 9 LYS HD3 1 1 16 2567 1 1 9 LYS HE2 H 8.671 -11.382 -4.296 1.00 . A A . 9 LYS HE2 1 1 16 2568 1 1 9 LYS HE3 H 9.386 -10.804 -5.801 1.00 . A A . 9 LYS HE3 1 1 16 2569 1 1 9 LYS HG2 H 7.878 -12.296 -6.861 1.00 . A A . 9 LYS HG2 1 1 16 2570 1 1 9 LYS HG3 H 7.702 -10.799 -7.780 1.00 . A A . 9 LYS HG3 1 1 16 2571 1 1 9 LYS HZ1 H 8.182 -8.614 -4.616 1.00 . A A . 9 LYS HZ1 1 1 16 2572 1 1 9 LYS HZ2 H 9.839 -8.921 -4.756 1.00 . A A . 9 LYS HZ2 1 1 16 2573 1 1 9 LYS HZ3 H 9.002 -9.413 -3.370 1.00 . A A . 9 LYS HZ3 1 1 16 2574 1 1 9 LYS N N 5.100 -9.978 -8.823 1.00 . A A . 9 LYS N 1 1 16 2575 1 1 9 LYS NZ N 8.937 -9.297 -4.402 1.00 . A A . 9 LYS NZ 1 1 16 2576 1 1 9 LYS O O 4.345 -13.472 -9.125 1.00 . A A . 9 LYS O 1 1 17 2577 1 1 1 THR C C 2.634 -1.144 -1.498 1.00 . A A . 1 THR C 1 1 17 2578 1 1 1 THR CA C 2.054 0.200 -1.071 1.00 . A A . 1 THR CA 1 1 17 2579 1 1 1 THR CB C 3.109 0.963 -0.248 1.00 . A A . 1 THR CB 1 1 17 2580 1 1 1 THR CG2 C 3.896 0.011 0.640 1.00 . A A . 1 THR CG2 1 1 17 2581 1 1 1 THR H1 H 0.839 0.094 0.659 1.00 . A A . 1 THR H1 1 1 17 2582 1 1 1 THR HA H 1.828 0.780 -1.953 1.00 . A A . 1 THR HA 1 1 17 2583 1 1 1 THR HB H 2.603 1.682 0.381 1.00 . A A . 1 THR HB 1 1 17 2584 1 1 1 THR HG1 H 4.839 1.811 -0.672 1.00 . A A . 1 THR HG1 1 1 17 2585 1 1 1 THR HG21 H 3.218 -0.682 1.116 1.00 . A A . 1 THR HG21 1 1 17 2586 1 1 1 THR HG22 H 4.424 0.575 1.394 1.00 . A A . 1 THR HG22 1 1 17 2587 1 1 1 THR HG23 H 4.606 -0.538 0.038 1.00 . A A . 1 THR HG23 1 1 17 2588 1 1 1 THR N N 0.819 0.024 -0.318 1.00 . A A . 1 THR N 1 1 17 2589 1 1 1 THR O O 3.325 -1.239 -2.512 1.00 . A A . 1 THR O 1 1 17 2590 1 1 1 THR OG1 O 4.005 1.657 -1.123 1.00 . A A . 1 THR OG1 1 1 17 2591 1 1 2 VAL C C 1.950 -4.217 -2.041 1.00 . A A . 2 VAL C 1 1 17 2592 1 1 2 VAL CA C 2.839 -3.521 -1.016 1.00 . A A . 2 VAL CA 1 1 17 2593 1 1 2 VAL CB C 2.915 -4.388 0.255 1.00 . A A . 2 VAL CB 1 1 17 2594 1 1 2 VAL CG1 C 3.728 -5.647 -0.005 1.00 . A A . 2 VAL CG1 1 1 17 2595 1 1 2 VAL CG2 C 3.504 -3.591 1.408 1.00 . A A . 2 VAL CG2 1 1 17 2596 1 1 2 VAL H H 1.792 -2.043 0.077 1.00 . A A . 2 VAL H 1 1 17 2597 1 1 2 VAL HA H 3.836 -3.428 -1.423 1.00 . A A . 2 VAL HA 1 1 17 2598 1 1 2 VAL HB H 1.911 -4.683 0.525 1.00 . A A . 2 VAL HB 1 1 17 2599 1 1 2 VAL HG11 H 3.627 -6.319 0.835 1.00 . A A . 2 VAL HG11 1 1 17 2600 1 1 2 VAL HG12 H 3.367 -6.131 -0.901 1.00 . A A . 2 VAL HG12 1 1 17 2601 1 1 2 VAL HG13 H 4.768 -5.383 -0.131 1.00 . A A . 2 VAL HG13 1 1 17 2602 1 1 2 VAL HG21 H 4.500 -3.264 1.147 1.00 . A A . 2 VAL HG21 1 1 17 2603 1 1 2 VAL HG22 H 2.883 -2.729 1.606 1.00 . A A . 2 VAL HG22 1 1 17 2604 1 1 2 VAL HG23 H 3.548 -4.212 2.290 1.00 . A A . 2 VAL HG23 1 1 17 2605 1 1 2 VAL N N 2.347 -2.181 -0.718 1.00 . A A . 2 VAL N 1 1 17 2606 1 1 2 VAL O O 2.383 -5.142 -2.728 1.00 . A A . 2 VAL O 1 1 17 2607 1 1 3 TYR C C 0.387 -4.531 -4.452 1.00 . A A . 3 TYR C 1 1 17 2608 1 1 3 TYR CA C -0.248 -4.346 -3.077 1.00 . A A . 3 TYR CA 1 1 17 2609 1 1 3 TYR CB C -1.489 -3.460 -3.192 1.00 . A A . 3 TYR CB 1 1 17 2610 1 1 3 TYR CD1 C -1.838 -1.904 -5.150 1.00 . A A . 3 TYR CD1 1 1 17 2611 1 1 3 TYR CD2 C -0.404 -1.188 -3.386 1.00 . A A . 3 TYR CD2 1 1 17 2612 1 1 3 TYR CE1 C -1.613 -0.718 -5.822 1.00 . A A . 3 TYR CE1 1 1 17 2613 1 1 3 TYR CE2 C -0.174 0.002 -4.050 1.00 . A A . 3 TYR CE2 1 1 17 2614 1 1 3 TYR CG C -1.239 -2.160 -3.922 1.00 . A A . 3 TYR CG 1 1 17 2615 1 1 3 TYR CZ C -0.780 0.232 -5.267 1.00 . A A . 3 TYR CZ 1 1 17 2616 1 1 3 TYR H H 0.417 -3.026 -1.563 1.00 . A A . 3 TYR H 1 1 17 2617 1 1 3 TYR HA H -0.542 -5.313 -2.697 1.00 . A A . 3 TYR HA 1 1 17 2618 1 1 3 TYR HB2 H -2.259 -3.996 -3.725 1.00 . A A . 3 TYR HB2 1 1 17 2619 1 1 3 TYR HB3 H -1.844 -3.220 -2.200 1.00 . A A . 3 TYR HB3 1 1 17 2620 1 1 3 TYR HD1 H -2.490 -2.650 -5.581 1.00 . A A . 3 TYR HD1 1 1 17 2621 1 1 3 TYR HD2 H 0.070 -1.371 -2.433 1.00 . A A . 3 TYR HD2 1 1 17 2622 1 1 3 TYR HE1 H -2.087 -0.537 -6.775 1.00 . A A . 3 TYR HE1 1 1 17 2623 1 1 3 TYR HE2 H 0.479 0.745 -3.617 1.00 . A A . 3 TYR HE2 1 1 17 2624 1 1 3 TYR HH H 0.057 1.261 -6.659 1.00 . A A . 3 TYR HH 1 1 17 2625 1 1 3 TYR N N 0.704 -3.766 -2.138 1.00 . A A . 3 TYR N 1 1 17 2626 1 1 3 TYR O O 0.144 -5.528 -5.133 1.00 . A A . 3 TYR O 1 1 17 2627 1 1 3 TYR OH O -0.552 1.415 -5.932 1.00 . A A . 3 TYR OH 1 1 17 2628 1 1 4 VAL C C 3.032 -4.612 -6.124 1.00 . A A . 4 VAL C 1 1 17 2629 1 1 4 VAL CA C 1.877 -3.617 -6.147 1.00 . A A . 4 VAL CA 1 1 17 2630 1 1 4 VAL CB C 2.413 -2.234 -6.560 1.00 . A A . 4 VAL CB 1 1 17 2631 1 1 4 VAL CG1 C 1.302 -1.390 -7.166 1.00 . A A . 4 VAL CG1 1 1 17 2632 1 1 4 VAL CG2 C 3.040 -1.528 -5.367 1.00 . A A . 4 VAL CG2 1 1 17 2633 1 1 4 VAL H H 1.359 -2.793 -4.268 1.00 . A A . 4 VAL H 1 1 17 2634 1 1 4 VAL HA H 1.155 -3.936 -6.886 1.00 . A A . 4 VAL HA 1 1 17 2635 1 1 4 VAL HB H 3.177 -2.375 -7.310 1.00 . A A . 4 VAL HB 1 1 17 2636 1 1 4 VAL HG11 H 1.276 -0.426 -6.679 1.00 . A A . 4 VAL HG11 1 1 17 2637 1 1 4 VAL HG12 H 1.487 -1.256 -8.222 1.00 . A A . 4 VAL HG12 1 1 17 2638 1 1 4 VAL HG13 H 0.355 -1.888 -7.027 1.00 . A A . 4 VAL HG13 1 1 17 2639 1 1 4 VAL HG21 H 3.196 -2.240 -4.570 1.00 . A A . 4 VAL HG21 1 1 17 2640 1 1 4 VAL HG22 H 3.988 -1.100 -5.658 1.00 . A A . 4 VAL HG22 1 1 17 2641 1 1 4 VAL HG23 H 2.381 -0.744 -5.025 1.00 . A A . 4 VAL HG23 1 1 17 2642 1 1 4 VAL N N 1.204 -3.563 -4.855 1.00 . A A . 4 VAL N 1 1 17 2643 1 1 4 VAL O O 3.258 -5.340 -7.090 1.00 . A A . 4 VAL O 1 1 17 2644 1 1 5 TYR C C 4.453 -6.996 -4.991 1.00 . A A . 5 TYR C 1 1 17 2645 1 1 5 TYR CA C 4.895 -5.541 -4.864 1.00 . A A . 5 TYR CA 1 1 17 2646 1 1 5 TYR CB C 5.576 -5.320 -3.512 1.00 . A A . 5 TYR CB 1 1 17 2647 1 1 5 TYR CD1 C 5.856 -2.811 -3.441 1.00 . A A . 5 TYR CD1 1 1 17 2648 1 1 5 TYR CD2 C 7.819 -4.163 -3.439 1.00 . A A . 5 TYR CD2 1 1 17 2649 1 1 5 TYR CE1 C 6.635 -1.671 -3.397 1.00 . A A . 5 TYR CE1 1 1 17 2650 1 1 5 TYR CE2 C 8.606 -3.028 -3.393 1.00 . A A . 5 TYR CE2 1 1 17 2651 1 1 5 TYR CG C 6.433 -4.075 -3.463 1.00 . A A . 5 TYR CG 1 1 17 2652 1 1 5 TYR CZ C 8.009 -1.785 -3.372 1.00 . A A . 5 TYR CZ 1 1 17 2653 1 1 5 TYR H H 3.532 -4.033 -4.277 1.00 . A A . 5 TYR H 1 1 17 2654 1 1 5 TYR HA H 5.600 -5.321 -5.652 1.00 . A A . 5 TYR HA 1 1 17 2655 1 1 5 TYR HB2 H 4.821 -5.232 -2.746 1.00 . A A . 5 TYR HB2 1 1 17 2656 1 1 5 TYR HB3 H 6.208 -6.167 -3.292 1.00 . A A . 5 TYR HB3 1 1 17 2657 1 1 5 TYR HD1 H 4.779 -2.725 -3.460 1.00 . A A . 5 TYR HD1 1 1 17 2658 1 1 5 TYR HD2 H 8.284 -5.138 -3.456 1.00 . A A . 5 TYR HD2 1 1 17 2659 1 1 5 TYR HE1 H 6.168 -0.697 -3.380 1.00 . A A . 5 TYR HE1 1 1 17 2660 1 1 5 TYR HE2 H 9.682 -3.117 -3.374 1.00 . A A . 5 TYR HE2 1 1 17 2661 1 1 5 TYR HH H 9.677 -0.863 -3.628 1.00 . A A . 5 TYR HH 1 1 17 2662 1 1 5 TYR N N 3.761 -4.637 -5.013 1.00 . A A . 5 TYR N 1 1 17 2663 1 1 5 TYR O O 5.230 -7.860 -5.398 1.00 . A A . 5 TYR O 1 1 17 2664 1 1 5 TYR OH O 8.790 -0.652 -3.328 1.00 . A A . 5 TYR OH 1 1 17 2665 1 1 6 SER C C 1.998 -8.860 -6.067 1.00 . A A . 6 SER C 1 1 17 2666 1 1 6 SER CA C 2.651 -8.609 -4.711 1.00 . A A . 6 SER CA 1 1 17 2667 1 1 6 SER CB C 1.630 -8.828 -3.593 1.00 . A A . 6 SER CB 1 1 17 2668 1 1 6 SER H H 2.627 -6.527 -4.323 1.00 . A A . 6 SER H 1 1 17 2669 1 1 6 SER HA H 3.467 -9.304 -4.583 1.00 . A A . 6 SER HA 1 1 17 2670 1 1 6 SER HB2 H 2.116 -8.707 -2.637 1.00 . A A . 6 SER HB2 1 1 17 2671 1 1 6 SER HB3 H 0.836 -8.101 -3.687 1.00 . A A . 6 SER HB3 1 1 17 2672 1 1 6 SER HG H 1.072 -10.523 -2.785 1.00 . A A . 6 SER HG 1 1 17 2673 1 1 6 SER N N 3.198 -7.259 -4.640 1.00 . A A . 6 SER N 1 1 17 2674 1 1 6 SER O O 1.926 -9.997 -6.532 1.00 . A A . 6 SER O 1 1 17 2675 1 1 6 SER OG O 1.071 -10.128 -3.660 1.00 . A A . 6 SER OG 1 1 17 2676 1 1 7 ARG C C 1.910 -8.067 -9.107 1.00 . A A . 7 ARG C 1 1 17 2677 1 1 7 ARG CA C 0.877 -7.892 -7.998 1.00 . A A . 7 ARG CA 1 1 17 2678 1 1 7 ARG CB C 0.028 -6.648 -8.269 1.00 . A A . 7 ARG CB 1 1 17 2679 1 1 7 ARG CD C -0.414 -7.099 -10.702 1.00 . A A . 7 ARG CD 1 1 17 2680 1 1 7 ARG CG C 0.158 -6.120 -9.688 1.00 . A A . 7 ARG CG 1 1 17 2681 1 1 7 ARG CZ C -0.008 -7.805 -13.021 1.00 . A A . 7 ARG CZ 1 1 17 2682 1 1 7 ARG H H 1.613 -6.909 -6.274 1.00 . A A . 7 ARG H 1 1 17 2683 1 1 7 ARG HA H 0.234 -8.759 -7.981 1.00 . A A . 7 ARG HA 1 1 17 2684 1 1 7 ARG HB2 H -1.010 -6.889 -8.092 1.00 . A A . 7 ARG HB2 1 1 17 2685 1 1 7 ARG HB3 H 0.329 -5.867 -7.588 1.00 . A A . 7 ARG HB3 1 1 17 2686 1 1 7 ARG HD2 H -0.365 -8.095 -10.287 1.00 . A A . 7 ARG HD2 1 1 17 2687 1 1 7 ARG HD3 H -1.445 -6.838 -10.892 1.00 . A A . 7 ARG HD3 1 1 17 2688 1 1 7 ARG HE H 1.101 -6.482 -12.022 1.00 . A A . 7 ARG HE 1 1 17 2689 1 1 7 ARG HG2 H -0.378 -5.185 -9.765 1.00 . A A . 7 ARG HG2 1 1 17 2690 1 1 7 ARG HG3 H 1.202 -5.957 -9.908 1.00 . A A . 7 ARG HG3 1 1 17 2691 1 1 7 ARG HH11 H -1.601 -8.675 -12.134 1.00 . A A . 7 ARG HH11 1 1 17 2692 1 1 7 ARG HH12 H -1.304 -9.164 -13.769 1.00 . A A . 7 ARG HH12 1 1 17 2693 1 1 7 ARG HH21 H 1.502 -7.118 -14.175 1.00 . A A . 7 ARG HH21 1 1 17 2694 1 1 7 ARG HH22 H 0.462 -8.279 -14.929 1.00 . A A . 7 ARG HH22 1 1 17 2695 1 1 7 ARG N N 1.525 -7.789 -6.696 1.00 . A A . 7 ARG N 1 1 17 2696 1 1 7 ARG NE N 0.322 -7.074 -11.963 1.00 . A A . 7 ARG NE 1 1 17 2697 1 1 7 ARG NH1 N -1.057 -8.615 -12.970 1.00 . A A . 7 ARG NH1 1 1 17 2698 1 1 7 ARG NH2 N 0.711 -7.728 -14.133 1.00 . A A . 7 ARG NH2 1 1 17 2699 1 1 7 ARG O O 1.734 -8.884 -10.011 1.00 . A A . 7 ARG O 1 1 17 2700 1 1 8 VAL C C 4.515 -8.801 -10.237 1.00 . A A . 8 VAL C 1 1 17 2701 1 1 8 VAL CA C 4.051 -7.364 -10.028 1.00 . A A . 8 VAL CA 1 1 17 2702 1 1 8 VAL CB C 5.259 -6.499 -9.622 1.00 . A A . 8 VAL CB 1 1 17 2703 1 1 8 VAL CG1 C 6.388 -6.652 -10.630 1.00 . A A . 8 VAL CG1 1 1 17 2704 1 1 8 VAL CG2 C 4.849 -5.041 -9.486 1.00 . A A . 8 VAL CG2 1 1 17 2705 1 1 8 VAL H H 3.073 -6.662 -8.287 1.00 . A A . 8 VAL H 1 1 17 2706 1 1 8 VAL HA H 3.660 -6.983 -10.960 1.00 . A A . 8 VAL HA 1 1 17 2707 1 1 8 VAL HB H 5.615 -6.842 -8.662 1.00 . A A . 8 VAL HB 1 1 17 2708 1 1 8 VAL HG11 H 6.975 -7.525 -10.384 1.00 . A A . 8 VAL HG11 1 1 17 2709 1 1 8 VAL HG12 H 5.973 -6.763 -11.621 1.00 . A A . 8 VAL HG12 1 1 17 2710 1 1 8 VAL HG13 H 7.019 -5.775 -10.600 1.00 . A A . 8 VAL HG13 1 1 17 2711 1 1 8 VAL HG21 H 5.167 -4.495 -10.361 1.00 . A A . 8 VAL HG21 1 1 17 2712 1 1 8 VAL HG22 H 3.774 -4.976 -9.392 1.00 . A A . 8 VAL HG22 1 1 17 2713 1 1 8 VAL HG23 H 5.312 -4.616 -8.607 1.00 . A A . 8 VAL HG23 1 1 17 2714 1 1 8 VAL N N 2.989 -7.294 -9.032 1.00 . A A . 8 VAL N 1 1 17 2715 1 1 8 VAL O O 4.348 -9.369 -11.316 1.00 . A A . 8 VAL O 1 1 17 2716 1 1 9 LYS C C 4.427 -11.743 -9.356 1.00 . A A . 9 LYS C 1 1 17 2717 1 1 9 LYS CA C 5.587 -10.757 -9.263 1.00 . A A . 9 LYS CA 1 1 17 2718 1 1 9 LYS CB C 6.445 -11.076 -8.036 1.00 . A A . 9 LYS CB 1 1 17 2719 1 1 9 LYS CD C 6.351 -10.679 -5.557 1.00 . A A . 9 LYS CD 1 1 17 2720 1 1 9 LYS CE C 7.133 -11.740 -4.800 1.00 . A A . 9 LYS CE 1 1 17 2721 1 1 9 LYS CG C 5.638 -11.267 -6.763 1.00 . A A . 9 LYS CG 1 1 17 2722 1 1 9 LYS H H 5.204 -8.880 -8.362 1.00 . A A . 9 LYS H 1 1 17 2723 1 1 9 LYS HA H 6.195 -10.850 -10.150 1.00 . A A . 9 LYS HA 1 1 17 2724 1 1 9 LYS HB2 H 7.000 -11.983 -8.225 1.00 . A A . 9 LYS HB2 1 1 17 2725 1 1 9 LYS HB3 H 7.140 -10.264 -7.877 1.00 . A A . 9 LYS HB3 1 1 17 2726 1 1 9 LYS HD2 H 7.035 -9.914 -5.892 1.00 . A A . 9 LYS HD2 1 1 17 2727 1 1 9 LYS HD3 H 5.617 -10.243 -4.894 1.00 . A A . 9 LYS HD3 1 1 17 2728 1 1 9 LYS HE2 H 7.211 -12.621 -5.419 1.00 . A A . 9 LYS HE2 1 1 17 2729 1 1 9 LYS HE3 H 8.122 -11.359 -4.591 1.00 . A A . 9 LYS HE3 1 1 17 2730 1 1 9 LYS HG2 H 4.682 -10.778 -6.877 1.00 . A A . 9 LYS HG2 1 1 17 2731 1 1 9 LYS HG3 H 5.486 -12.325 -6.600 1.00 . A A . 9 LYS HG3 1 1 17 2732 1 1 9 LYS HZ1 H 6.918 -11.595 -2.728 1.00 . A A . 9 LYS HZ1 1 1 17 2733 1 1 9 LYS HZ2 H 6.563 -13.128 -3.347 1.00 . A A . 9 LYS HZ2 1 1 17 2734 1 1 9 LYS HZ3 H 5.464 -11.859 -3.550 1.00 . A A . 9 LYS HZ3 1 1 17 2735 1 1 9 LYS N N 5.099 -9.385 -9.196 1.00 . A A . 9 LYS N 1 1 17 2736 1 1 9 LYS NZ N 6.473 -12.106 -3.516 1.00 . A A . 9 LYS NZ 1 1 17 2737 1 1 9 LYS O O 3.325 -11.383 -9.771 1.00 . A A . 9 LYS O 1 1 18 2738 1 1 1 THR C C 2.539 -1.369 -1.977 1.00 . A A . 1 THR C 1 1 18 2739 1 1 1 THR CA C 2.158 0.060 -1.608 1.00 . A A . 1 THR CA 1 1 18 2740 1 1 1 THR CB C 3.361 0.740 -0.926 1.00 . A A . 1 THR CB 1 1 18 2741 1 1 1 THR CG2 C 4.253 1.419 -1.954 1.00 . A A . 1 THR CG2 1 1 18 2742 1 1 1 THR H1 H 1.092 0.129 0.219 1.00 . A A . 1 THR H1 1 1 18 2743 1 1 1 THR HA H 1.928 0.606 -2.512 1.00 . A A . 1 THR HA 1 1 18 2744 1 1 1 THR HB H 3.939 -0.016 -0.414 1.00 . A A . 1 THR HB 1 1 18 2745 1 1 1 THR HG1 H 3.498 1.718 0.780 1.00 . A A . 1 THR HG1 1 1 18 2746 1 1 1 THR HG21 H 4.754 2.260 -1.497 1.00 . A A . 1 THR HG21 1 1 18 2747 1 1 1 THR HG22 H 3.650 1.765 -2.781 1.00 . A A . 1 THR HG22 1 1 18 2748 1 1 1 THR HG23 H 4.988 0.715 -2.314 1.00 . A A . 1 THR HG23 1 1 18 2749 1 1 1 THR N N 0.978 0.086 -0.753 1.00 . A A . 1 THR N 1 1 18 2750 1 1 1 THR O O 3.445 -1.594 -2.779 1.00 . A A . 1 THR O 1 1 18 2751 1 1 1 THR OG1 O 2.903 1.705 0.027 1.00 . A A . 1 THR OG1 1 1 18 2752 1 1 2 VAL C C 1.194 -4.271 -2.758 1.00 . A A . 2 VAL C 1 1 18 2753 1 1 2 VAL CA C 2.103 -3.742 -1.655 1.00 . A A . 2 VAL CA 1 1 18 2754 1 1 2 VAL CB C 1.910 -4.600 -0.390 1.00 . A A . 2 VAL CB 1 1 18 2755 1 1 2 VAL CG1 C 2.505 -5.986 -0.589 1.00 . A A . 2 VAL CG1 1 1 18 2756 1 1 2 VAL CG2 C 2.528 -3.914 0.818 1.00 . A A . 2 VAL CG2 1 1 18 2757 1 1 2 VAL H H 1.129 -2.092 -0.757 1.00 . A A . 2 VAL H 1 1 18 2758 1 1 2 VAL HA H 3.131 -3.835 -1.974 1.00 . A A . 2 VAL HA 1 1 18 2759 1 1 2 VAL HB H 0.850 -4.709 -0.213 1.00 . A A . 2 VAL HB 1 1 18 2760 1 1 2 VAL HG11 H 2.220 -6.621 0.237 1.00 . A A . 2 VAL HG11 1 1 18 2761 1 1 2 VAL HG12 H 2.136 -6.407 -1.513 1.00 . A A . 2 VAL HG12 1 1 18 2762 1 1 2 VAL HG13 H 3.581 -5.913 -0.631 1.00 . A A . 2 VAL HG13 1 1 18 2763 1 1 2 VAL HG21 H 2.384 -4.529 1.693 1.00 . A A . 2 VAL HG21 1 1 18 2764 1 1 2 VAL HG22 H 3.586 -3.770 0.649 1.00 . A A . 2 VAL HG22 1 1 18 2765 1 1 2 VAL HG23 H 2.055 -2.955 0.969 1.00 . A A . 2 VAL HG23 1 1 18 2766 1 1 2 VAL N N 1.840 -2.334 -1.387 1.00 . A A . 2 VAL N 1 1 18 2767 1 1 2 VAL O O 1.504 -5.270 -3.407 1.00 . A A . 2 VAL O 1 1 18 2768 1 1 3 TYR C C -0.174 -4.349 -5.293 1.00 . A A . 3 TYR C 1 1 18 2769 1 1 3 TYR CA C -0.886 -3.996 -3.991 1.00 . A A . 3 TYR CA 1 1 18 2770 1 1 3 TYR CB C -1.901 -2.879 -4.238 1.00 . A A . 3 TYR CB 1 1 18 2771 1 1 3 TYR CD1 C -0.409 -0.975 -4.964 1.00 . A A . 3 TYR CD1 1 1 18 2772 1 1 3 TYR CD2 C -1.707 -0.696 -2.984 1.00 . A A . 3 TYR CD2 1 1 18 2773 1 1 3 TYR CE1 C 0.117 0.292 -4.804 1.00 . A A . 3 TYR CE1 1 1 18 2774 1 1 3 TYR CE2 C -1.187 0.573 -2.817 1.00 . A A . 3 TYR CE2 1 1 18 2775 1 1 3 TYR CG C -1.329 -1.491 -4.059 1.00 . A A . 3 TYR CG 1 1 18 2776 1 1 3 TYR CZ C -0.275 1.063 -3.729 1.00 . A A . 3 TYR CZ 1 1 18 2777 1 1 3 TYR H H -0.122 -2.805 -2.417 1.00 . A A . 3 TYR H 1 1 18 2778 1 1 3 TYR HA H -1.409 -4.871 -3.631 1.00 . A A . 3 TYR HA 1 1 18 2779 1 1 3 TYR HB2 H -2.272 -2.956 -5.248 1.00 . A A . 3 TYR HB2 1 1 18 2780 1 1 3 TYR HB3 H -2.725 -2.990 -3.548 1.00 . A A . 3 TYR HB3 1 1 18 2781 1 1 3 TYR HD1 H -0.104 -1.581 -5.805 1.00 . A A . 3 TYR HD1 1 1 18 2782 1 1 3 TYR HD2 H -2.420 -1.082 -2.271 1.00 . A A . 3 TYR HD2 1 1 18 2783 1 1 3 TYR HE1 H 0.830 0.676 -5.518 1.00 . A A . 3 TYR HE1 1 1 18 2784 1 1 3 TYR HE2 H -1.493 1.176 -1.975 1.00 . A A . 3 TYR HE2 1 1 18 2785 1 1 3 TYR HH H 0.458 2.698 -4.424 1.00 . A A . 3 TYR HH 1 1 18 2786 1 1 3 TYR N N 0.070 -3.594 -2.966 1.00 . A A . 3 TYR N 1 1 18 2787 1 1 3 TYR O O -0.606 -5.236 -6.030 1.00 . A A . 3 TYR O 1 1 18 2788 1 1 3 TYR OH O 0.246 2.326 -3.565 1.00 . A A . 3 TYR OH 1 1 18 2789 1 1 4 VAL C C 2.790 -4.921 -6.539 1.00 . A A . 4 VAL C 1 1 18 2790 1 1 4 VAL CA C 1.696 -3.887 -6.781 1.00 . A A . 4 VAL CA 1 1 18 2791 1 1 4 VAL CB C 2.339 -2.588 -7.301 1.00 . A A . 4 VAL CB 1 1 18 2792 1 1 4 VAL CG1 C 1.326 -1.768 -8.086 1.00 . A A . 4 VAL CG1 1 1 18 2793 1 1 4 VAL CG2 C 2.913 -1.779 -6.148 1.00 . A A . 4 VAL CG2 1 1 18 2794 1 1 4 VAL H H 1.215 -2.955 -4.943 1.00 . A A . 4 VAL H 1 1 18 2795 1 1 4 VAL HA H 1.023 -4.260 -7.539 1.00 . A A . 4 VAL HA 1 1 18 2796 1 1 4 VAL HB H 3.148 -2.852 -7.966 1.00 . A A . 4 VAL HB 1 1 18 2797 1 1 4 VAL HG11 H 0.547 -2.418 -8.457 1.00 . A A . 4 VAL HG11 1 1 18 2798 1 1 4 VAL HG12 H 0.893 -1.017 -7.442 1.00 . A A . 4 VAL HG12 1 1 18 2799 1 1 4 VAL HG13 H 1.820 -1.288 -8.918 1.00 . A A . 4 VAL HG13 1 1 18 2800 1 1 4 VAL HG21 H 3.010 -2.412 -5.279 1.00 . A A . 4 VAL HG21 1 1 18 2801 1 1 4 VAL HG22 H 3.885 -1.396 -6.425 1.00 . A A . 4 VAL HG22 1 1 18 2802 1 1 4 VAL HG23 H 2.253 -0.955 -5.922 1.00 . A A . 4 VAL HG23 1 1 18 2803 1 1 4 VAL N N 0.921 -3.648 -5.569 1.00 . A A . 4 VAL N 1 1 18 2804 1 1 4 VAL O O 3.102 -5.727 -7.415 1.00 . A A . 4 VAL O 1 1 18 2805 1 1 5 TYR C C 3.949 -7.269 -5.102 1.00 . A A . 5 TYR C 1 1 18 2806 1 1 5 TYR CA C 4.431 -5.826 -4.986 1.00 . A A . 5 TYR CA 1 1 18 2807 1 1 5 TYR CB C 4.920 -5.553 -3.562 1.00 . A A . 5 TYR CB 1 1 18 2808 1 1 5 TYR CD1 C 5.573 -3.135 -3.886 1.00 . A A . 5 TYR CD1 1 1 18 2809 1 1 5 TYR CD2 C 7.193 -4.625 -2.972 1.00 . A A . 5 TYR CD2 1 1 18 2810 1 1 5 TYR CE1 C 6.478 -2.094 -3.805 1.00 . A A . 5 TYR CE1 1 1 18 2811 1 1 5 TYR CE2 C 8.104 -3.590 -2.886 1.00 . A A . 5 TYR CE2 1 1 18 2812 1 1 5 TYR CG C 5.914 -4.417 -3.471 1.00 . A A . 5 TYR CG 1 1 18 2813 1 1 5 TYR CZ C 7.742 -2.327 -3.304 1.00 . A A . 5 TYR CZ 1 1 18 2814 1 1 5 TYR H H 3.078 -4.226 -4.687 1.00 . A A . 5 TYR H 1 1 18 2815 1 1 5 TYR HA H 5.250 -5.675 -5.673 1.00 . A A . 5 TYR HA 1 1 18 2816 1 1 5 TYR HB2 H 4.075 -5.304 -2.940 1.00 . A A . 5 TYR HB2 1 1 18 2817 1 1 5 TYR HB3 H 5.396 -6.442 -3.176 1.00 . A A . 5 TYR HB3 1 1 18 2818 1 1 5 TYR HD1 H 4.582 -2.956 -4.278 1.00 . A A . 5 TYR HD1 1 1 18 2819 1 1 5 TYR HD2 H 7.474 -5.617 -2.645 1.00 . A A . 5 TYR HD2 1 1 18 2820 1 1 5 TYR HE1 H 6.194 -1.105 -4.132 1.00 . A A . 5 TYR HE1 1 1 18 2821 1 1 5 TYR HE2 H 9.094 -3.772 -2.494 1.00 . A A . 5 TYR HE2 1 1 18 2822 1 1 5 TYR HH H 8.405 -0.606 -3.846 1.00 . A A . 5 TYR HH 1 1 18 2823 1 1 5 TYR N N 3.369 -4.892 -5.344 1.00 . A A . 5 TYR N 1 1 18 2824 1 1 5 TYR O O 4.750 -8.193 -5.237 1.00 . A A . 5 TYR O 1 1 18 2825 1 1 5 TYR OH O 8.646 -1.293 -3.221 1.00 . A A . 5 TYR OH 1 1 18 2826 1 1 6 SER C C 1.854 -9.189 -6.604 1.00 . A A . 6 SER C 1 1 18 2827 1 1 6 SER CA C 2.043 -8.783 -5.146 1.00 . A A . 6 SER CA 1 1 18 2828 1 1 6 SER CB C 0.700 -8.821 -4.415 1.00 . A A . 6 SER CB 1 1 18 2829 1 1 6 SER H H 2.047 -6.675 -4.941 1.00 . A A . 6 SER H 1 1 18 2830 1 1 6 SER HA H 2.720 -9.480 -4.675 1.00 . A A . 6 SER HA 1 1 18 2831 1 1 6 SER HB2 H 0.871 -8.790 -3.350 1.00 . A A . 6 SER HB2 1 1 18 2832 1 1 6 SER HB3 H 0.108 -7.967 -4.710 1.00 . A A . 6 SER HB3 1 1 18 2833 1 1 6 SER HG H 0.543 -10.768 -4.574 1.00 . A A . 6 SER HG 1 1 18 2834 1 1 6 SER N N 2.634 -7.453 -5.050 1.00 . A A . 6 SER N 1 1 18 2835 1 1 6 SER O O 1.822 -10.375 -6.930 1.00 . A A . 6 SER O 1 1 18 2836 1 1 6 SER OG O -0.017 -10.003 -4.728 1.00 . A A . 6 SER OG 1 1 18 2837 1 1 7 ARG C C 2.848 -8.899 -9.549 1.00 . A A . 7 ARG C 1 1 18 2838 1 1 7 ARG CA C 1.542 -8.447 -8.901 1.00 . A A . 7 ARG CA 1 1 18 2839 1 1 7 ARG CB C 1.022 -7.189 -9.599 1.00 . A A . 7 ARG CB 1 1 18 2840 1 1 7 ARG CD C -0.382 -5.109 -9.463 1.00 . A A . 7 ARG CD 1 1 18 2841 1 1 7 ARG CG C 0.027 -6.398 -8.767 1.00 . A A . 7 ARG CG 1 1 18 2842 1 1 7 ARG CZ C -2.780 -5.413 -9.908 1.00 . A A . 7 ARG CZ 1 1 18 2843 1 1 7 ARG H H 1.764 -7.269 -7.156 1.00 . A A . 7 ARG H 1 1 18 2844 1 1 7 ARG HA H 0.811 -9.234 -9.005 1.00 . A A . 7 ARG HA 1 1 18 2845 1 1 7 ARG HB2 H 1.859 -6.546 -9.827 1.00 . A A . 7 ARG HB2 1 1 18 2846 1 1 7 ARG HB3 H 0.539 -7.478 -10.521 1.00 . A A . 7 ARG HB3 1 1 18 2847 1 1 7 ARG HD2 H -0.635 -4.375 -8.713 1.00 . A A . 7 ARG HD2 1 1 18 2848 1 1 7 ARG HD3 H 0.453 -4.752 -10.048 1.00 . A A . 7 ARG HD3 1 1 18 2849 1 1 7 ARG HE H -1.360 -5.355 -11.307 1.00 . A A . 7 ARG HE 1 1 18 2850 1 1 7 ARG HG2 H -0.854 -7.002 -8.606 1.00 . A A . 7 ARG HG2 1 1 18 2851 1 1 7 ARG HG3 H 0.479 -6.156 -7.817 1.00 . A A . 7 ARG HG3 1 1 18 2852 1 1 7 ARG HH11 H -2.296 -5.214 -7.957 1.00 . A A . 7 ARG HH11 1 1 18 2853 1 1 7 ARG HH12 H -3.984 -5.428 -8.285 1.00 . A A . 7 ARG HH12 1 1 18 2854 1 1 7 ARG HH21 H -3.579 -5.637 -11.751 1.00 . A A . 7 ARG HH21 1 1 18 2855 1 1 7 ARG HH22 H -4.713 -5.670 -10.443 1.00 . A A . 7 ARG HH22 1 1 18 2856 1 1 7 ARG N N 1.730 -8.195 -7.477 1.00 . A A . 7 ARG N 1 1 18 2857 1 1 7 ARG NE N -1.530 -5.303 -10.344 1.00 . A A . 7 ARG NE 1 1 18 2858 1 1 7 ARG NH1 N -3.041 -5.347 -8.610 1.00 . A A . 7 ARG NH1 1 1 18 2859 1 1 7 ARG NH2 N -3.772 -5.588 -10.772 1.00 . A A . 7 ARG NH2 1 1 18 2860 1 1 7 ARG O O 2.899 -9.938 -10.208 1.00 . A A . 7 ARG O 1 1 18 2861 1 1 8 VAL C C 5.569 -9.890 -9.681 1.00 . A A . 8 VAL C 1 1 18 2862 1 1 8 VAL CA C 5.207 -8.430 -9.924 1.00 . A A . 8 VAL CA 1 1 18 2863 1 1 8 VAL CB C 6.309 -7.533 -9.331 1.00 . A A . 8 VAL CB 1 1 18 2864 1 1 8 VAL CG1 C 7.636 -7.785 -10.030 1.00 . A A . 8 VAL CG1 1 1 18 2865 1 1 8 VAL CG2 C 5.915 -6.067 -9.431 1.00 . A A . 8 VAL CG2 1 1 18 2866 1 1 8 VAL H H 3.798 -7.296 -8.825 1.00 . A A . 8 VAL H 1 1 18 2867 1 1 8 VAL HA H 5.162 -8.253 -10.989 1.00 . A A . 8 VAL HA 1 1 18 2868 1 1 8 VAL HB H 6.425 -7.782 -8.287 1.00 . A A . 8 VAL HB 1 1 18 2869 1 1 8 VAL HG11 H 7.454 -8.062 -11.058 1.00 . A A . 8 VAL HG11 1 1 18 2870 1 1 8 VAL HG12 H 8.237 -6.888 -9.999 1.00 . A A . 8 VAL HG12 1 1 18 2871 1 1 8 VAL HG13 H 8.160 -8.587 -9.530 1.00 . A A . 8 VAL HG13 1 1 18 2872 1 1 8 VAL HG21 H 5.212 -5.939 -10.241 1.00 . A A . 8 VAL HG21 1 1 18 2873 1 1 8 VAL HG22 H 5.457 -5.753 -8.505 1.00 . A A . 8 VAL HG22 1 1 18 2874 1 1 8 VAL HG23 H 6.794 -5.469 -9.619 1.00 . A A . 8 VAL HG23 1 1 18 2875 1 1 8 VAL N N 3.901 -8.111 -9.359 1.00 . A A . 8 VAL N 1 1 18 2876 1 1 8 VAL O O 5.702 -10.674 -10.621 1.00 . A A . 8 VAL O 1 1 18 2877 1 1 9 LYS C C 4.962 -12.587 -8.439 1.00 . A A . 9 LYS C 1 1 18 2878 1 1 9 LYS CA C 6.072 -11.619 -8.042 1.00 . A A . 9 LYS CA 1 1 18 2879 1 1 9 LYS CB C 6.331 -11.712 -6.537 1.00 . A A . 9 LYS CB 1 1 18 2880 1 1 9 LYS CD C 8.804 -11.370 -6.260 1.00 . A A . 9 LYS CD 1 1 18 2881 1 1 9 LYS CE C 9.590 -11.430 -4.960 1.00 . A A . 9 LYS CE 1 1 18 2882 1 1 9 LYS CG C 7.422 -10.775 -6.048 1.00 . A A . 9 LYS CG 1 1 18 2883 1 1 9 LYS H H 5.607 -9.581 -7.706 1.00 . A A . 9 LYS H 1 1 18 2884 1 1 9 LYS HA H 6.974 -11.888 -8.571 1.00 . A A . 9 LYS HA 1 1 18 2885 1 1 9 LYS HB2 H 5.418 -11.474 -6.011 1.00 . A A . 9 LYS HB2 1 1 18 2886 1 1 9 LYS HB3 H 6.620 -12.725 -6.296 1.00 . A A . 9 LYS HB3 1 1 18 2887 1 1 9 LYS HD2 H 8.700 -12.371 -6.651 1.00 . A A . 9 LYS HD2 1 1 18 2888 1 1 9 LYS HD3 H 9.344 -10.758 -6.969 1.00 . A A . 9 LYS HD3 1 1 18 2889 1 1 9 LYS HE2 H 10.641 -11.333 -5.185 1.00 . A A . 9 LYS HE2 1 1 18 2890 1 1 9 LYS HE3 H 9.280 -10.610 -4.329 1.00 . A A . 9 LYS HE3 1 1 18 2891 1 1 9 LYS HG2 H 7.355 -9.844 -6.591 1.00 . A A . 9 LYS HG2 1 1 18 2892 1 1 9 LYS HG3 H 7.278 -10.590 -4.993 1.00 . A A . 9 LYS HG3 1 1 18 2893 1 1 9 LYS HZ1 H 8.735 -13.328 -4.786 1.00 . A A . 9 LYS HZ1 1 1 18 2894 1 1 9 LYS HZ2 H 8.929 -12.527 -3.310 1.00 . A A . 9 LYS HZ2 1 1 18 2895 1 1 9 LYS HZ3 H 10.271 -13.202 -4.088 1.00 . A A . 9 LYS HZ3 1 1 18 2896 1 1 9 LYS N N 5.727 -10.251 -8.412 1.00 . A A . 9 LYS N 1 1 18 2897 1 1 9 LYS NZ N 9.366 -12.712 -4.235 1.00 . A A . 9 LYS NZ 1 1 18 2898 1 1 9 LYS O O 4.072 -12.240 -9.216 1.00 . A A . 9 LYS O 1 1 19 2899 1 1 1 THR C C 2.650 -1.490 -1.987 1.00 . A A . 1 THR C 1 1 19 2900 1 1 1 THR CA C 2.295 -0.049 -1.639 1.00 . A A . 1 THR CA 1 1 19 2901 1 1 1 THR CB C 3.525 0.634 -1.012 1.00 . A A . 1 THR CB 1 1 19 2902 1 1 1 THR CG2 C 4.139 1.637 -1.977 1.00 . A A . 1 THR CG2 1 1 19 2903 1 1 1 THR H1 H 1.262 0.334 0.168 1.00 . A A . 1 THR H1 1 1 19 2904 1 1 1 THR HA H 2.041 0.478 -2.548 1.00 . A A . 1 THR HA 1 1 19 2905 1 1 1 THR HB H 4.262 -0.123 -0.785 1.00 . A A . 1 THR HB 1 1 19 2906 1 1 1 THR HG1 H 3.891 1.820 0.521 1.00 . A A . 1 THR HG1 1 1 19 2907 1 1 1 THR HG21 H 4.837 1.130 -2.627 1.00 . A A . 1 THR HG21 1 1 19 2908 1 1 1 THR HG22 H 4.656 2.403 -1.419 1.00 . A A . 1 THR HG22 1 1 19 2909 1 1 1 THR HG23 H 3.358 2.089 -2.570 1.00 . A A . 1 THR HG23 1 1 19 2910 1 1 1 THR N N 1.143 0.009 -0.749 1.00 . A A . 1 THR N 1 1 19 2911 1 1 1 THR O O 3.529 -1.742 -2.812 1.00 . A A . 1 THR O 1 1 19 2912 1 1 1 THR OG1 O 3.151 1.299 0.200 1.00 . A A . 1 THR OG1 1 1 19 2913 1 1 2 VAL C C 1.255 -4.396 -2.658 1.00 . A A . 2 VAL C 1 1 19 2914 1 1 2 VAL CA C 2.204 -3.851 -1.596 1.00 . A A . 2 VAL CA 1 1 19 2915 1 1 2 VAL CB C 2.043 -4.677 -0.306 1.00 . A A . 2 VAL CB 1 1 19 2916 1 1 2 VAL CG1 C 2.618 -6.073 -0.491 1.00 . A A . 2 VAL CG1 1 1 19 2917 1 1 2 VAL CG2 C 2.705 -3.969 0.866 1.00 . A A . 2 VAL CG2 1 1 19 2918 1 1 2 VAL H H 1.274 -2.170 -0.706 1.00 . A A . 2 VAL H 1 1 19 2919 1 1 2 VAL HA H 3.220 -3.961 -1.945 1.00 . A A . 2 VAL HA 1 1 19 2920 1 1 2 VAL HB H 0.988 -4.772 -0.093 1.00 . A A . 2 VAL HB 1 1 19 2921 1 1 2 VAL HG11 H 2.217 -6.511 -1.393 1.00 . A A . 2 VAL HG11 1 1 19 2922 1 1 2 VAL HG12 H 3.694 -6.012 -0.567 1.00 . A A . 2 VAL HG12 1 1 19 2923 1 1 2 VAL HG13 H 2.351 -6.687 0.356 1.00 . A A . 2 VAL HG13 1 1 19 2924 1 1 2 VAL HG21 H 2.583 -4.563 1.759 1.00 . A A . 2 VAL HG21 1 1 19 2925 1 1 2 VAL HG22 H 3.758 -3.840 0.661 1.00 . A A . 2 VAL HG22 1 1 19 2926 1 1 2 VAL HG23 H 2.246 -3.003 1.009 1.00 . A A . 2 VAL HG23 1 1 19 2927 1 1 2 VAL N N 1.962 -2.434 -1.353 1.00 . A A . 2 VAL N 1 1 19 2928 1 1 2 VAL O O 1.535 -5.413 -3.293 1.00 . A A . 2 VAL O 1 1 19 2929 1 1 3 TYR C C -0.193 -4.518 -5.145 1.00 . A A . 3 TYR C 1 1 19 2930 1 1 3 TYR CA C -0.861 -4.129 -3.830 1.00 . A A . 3 TYR CA 1 1 19 2931 1 1 3 TYR CB C -1.872 -3.007 -4.071 1.00 . A A . 3 TYR CB 1 1 19 2932 1 1 3 TYR CD1 C -0.387 -1.135 -4.887 1.00 . A A . 3 TYR CD1 1 1 19 2933 1 1 3 TYR CD2 C -1.618 -0.798 -2.874 1.00 . A A . 3 TYR CD2 1 1 19 2934 1 1 3 TYR CE1 C 0.156 0.130 -4.773 1.00 . A A . 3 TYR CE1 1 1 19 2935 1 1 3 TYR CE2 C -1.082 0.469 -2.753 1.00 . A A . 3 TYR CE2 1 1 19 2936 1 1 3 TYR CG C -1.282 -1.621 -3.942 1.00 . A A . 3 TYR CG 1 1 19 2937 1 1 3 TYR CZ C -0.196 0.929 -3.705 1.00 . A A . 3 TYR CZ 1 1 19 2938 1 1 3 TYR H H -0.036 -2.910 -2.309 1.00 . A A . 3 TYR H 1 1 19 2939 1 1 3 TYR HA H -1.380 -4.989 -3.434 1.00 . A A . 3 TYR HA 1 1 19 2940 1 1 3 TYR HB2 H -2.276 -3.104 -5.067 1.00 . A A . 3 TYR HB2 1 1 19 2941 1 1 3 TYR HB3 H -2.675 -3.095 -3.353 1.00 . A A . 3 TYR HB3 1 1 19 2942 1 1 3 TYR HD1 H -0.114 -1.763 -5.723 1.00 . A A . 3 TYR HD1 1 1 19 2943 1 1 3 TYR HD2 H -2.313 -1.161 -2.131 1.00 . A A . 3 TYR HD2 1 1 19 2944 1 1 3 TYR HE1 H 0.850 0.490 -5.518 1.00 . A A . 3 TYR HE1 1 1 19 2945 1 1 3 TYR HE2 H -1.356 1.095 -1.916 1.00 . A A . 3 TYR HE2 1 1 19 2946 1 1 3 TYR HH H -0.346 2.808 -3.329 1.00 . A A . 3 TYR HH 1 1 19 2947 1 1 3 TYR N N 0.131 -3.712 -2.846 1.00 . A A . 3 TYR N 1 1 19 2948 1 1 3 TYR O O -0.656 -5.417 -5.847 1.00 . A A . 3 TYR O 1 1 19 2949 1 1 3 TYR OH O 0.342 2.190 -3.587 1.00 . A A . 3 TYR OH 1 1 19 2950 1 1 4 VAL C C 2.725 -5.148 -6.470 1.00 . A A . 4 VAL C 1 1 19 2951 1 1 4 VAL CA C 1.633 -4.109 -6.702 1.00 . A A . 4 VAL CA 1 1 19 2952 1 1 4 VAL CB C 2.271 -2.829 -7.272 1.00 . A A . 4 VAL CB 1 1 19 2953 1 1 4 VAL CG1 C 1.241 -2.017 -8.043 1.00 . A A . 4 VAL CG1 1 1 19 2954 1 1 4 VAL CG2 C 2.889 -2.000 -6.157 1.00 . A A . 4 VAL CG2 1 1 19 2955 1 1 4 VAL H H 1.219 -3.130 -4.872 1.00 . A A . 4 VAL H 1 1 19 2956 1 1 4 VAL HA H 0.933 -4.493 -7.430 1.00 . A A . 4 VAL HA 1 1 19 2957 1 1 4 VAL HB H 3.056 -3.116 -7.956 1.00 . A A . 4 VAL HB 1 1 19 2958 1 1 4 VAL HG11 H 0.445 -2.667 -8.374 1.00 . A A . 4 VAL HG11 1 1 19 2959 1 1 4 VAL HG12 H 0.837 -1.247 -7.403 1.00 . A A . 4 VAL HG12 1 1 19 2960 1 1 4 VAL HG13 H 1.712 -1.561 -8.902 1.00 . A A . 4 VAL HG13 1 1 19 2961 1 1 4 VAL HG21 H 2.243 -1.164 -5.930 1.00 . A A . 4 VAL HG21 1 1 19 2962 1 1 4 VAL HG22 H 3.008 -2.613 -5.275 1.00 . A A . 4 VAL HG22 1 1 19 2963 1 1 4 VAL HG23 H 3.855 -1.634 -6.472 1.00 . A A . 4 VAL HG23 1 1 19 2964 1 1 4 VAL N N 0.899 -3.835 -5.472 1.00 . A A . 4 VAL N 1 1 19 2965 1 1 4 VAL O O 3.001 -5.977 -7.337 1.00 . A A . 4 VAL O 1 1 19 2966 1 1 5 TYR C C 3.907 -7.473 -5.017 1.00 . A A . 5 TYR C 1 1 19 2967 1 1 5 TYR CA C 4.405 -6.033 -4.949 1.00 . A A . 5 TYR CA 1 1 19 2968 1 1 5 TYR CB C 4.942 -5.733 -3.549 1.00 . A A . 5 TYR CB 1 1 19 2969 1 1 5 TYR CD1 C 7.241 -4.814 -3.049 1.00 . A A . 5 TYR CD1 1 1 19 2970 1 1 5 TYR CD2 C 5.607 -3.329 -3.948 1.00 . A A . 5 TYR CD2 1 1 19 2971 1 1 5 TYR CE1 C 8.163 -3.787 -3.016 1.00 . A A . 5 TYR CE1 1 1 19 2972 1 1 5 TYR CE2 C 6.523 -2.296 -3.919 1.00 . A A . 5 TYR CE2 1 1 19 2973 1 1 5 TYR CG C 5.948 -4.605 -3.515 1.00 . A A . 5 TYR CG 1 1 19 2974 1 1 5 TYR CZ C 7.800 -2.530 -3.452 1.00 . A A . 5 TYR CZ 1 1 19 2975 1 1 5 TYR H H 3.077 -4.414 -4.645 1.00 . A A . 5 TYR H 1 1 19 2976 1 1 5 TYR HA H 5.204 -5.906 -5.665 1.00 . A A . 5 TYR HA 1 1 19 2977 1 1 5 TYR HB2 H 4.119 -5.461 -2.906 1.00 . A A . 5 TYR HB2 1 1 19 2978 1 1 5 TYR HB3 H 5.422 -6.618 -3.157 1.00 . A A . 5 TYR HB3 1 1 19 2979 1 1 5 TYR HD1 H 7.522 -5.800 -2.708 1.00 . A A . 5 TYR HD1 1 1 19 2980 1 1 5 TYR HD2 H 4.606 -3.150 -4.312 1.00 . A A . 5 TYR HD2 1 1 19 2981 1 1 5 TYR HE1 H 9.163 -3.969 -2.651 1.00 . A A . 5 TYR HE1 1 1 19 2982 1 1 5 TYR HE2 H 6.239 -1.312 -4.261 1.00 . A A . 5 TYR HE2 1 1 19 2983 1 1 5 TYR HH H 9.433 -1.731 -2.825 1.00 . A A . 5 TYR HH 1 1 19 2984 1 1 5 TYR N N 3.342 -5.097 -5.295 1.00 . A A . 5 TYR N 1 1 19 2985 1 1 5 TYR O O 4.695 -8.409 -5.155 1.00 . A A . 5 TYR O 1 1 19 2986 1 1 5 TYR OH O 8.716 -1.503 -3.421 1.00 . A A . 5 TYR OH 1 1 19 2987 1 1 6 SER C C 1.748 -9.407 -6.407 1.00 . A A . 6 SER C 1 1 19 2988 1 1 6 SER CA C 1.987 -8.969 -4.965 1.00 . A A . 6 SER CA 1 1 19 2989 1 1 6 SER CB C 0.667 -8.978 -4.192 1.00 . A A . 6 SER CB 1 1 19 2990 1 1 6 SER H H 2.016 -6.858 -4.809 1.00 . A A . 6 SER H 1 1 19 2991 1 1 6 SER HA H 2.672 -9.662 -4.500 1.00 . A A . 6 SER HA 1 1 19 2992 1 1 6 SER HB2 H 0.618 -8.105 -3.559 1.00 . A A . 6 SER HB2 1 1 19 2993 1 1 6 SER HB3 H -0.156 -8.962 -4.891 1.00 . A A . 6 SER HB3 1 1 19 2994 1 1 6 SER HG H -0.213 -10.059 -2.816 1.00 . A A . 6 SER HG 1 1 19 2995 1 1 6 SER N N 2.592 -7.643 -4.919 1.00 . A A . 6 SER N 1 1 19 2996 1 1 6 SER O O 1.694 -10.600 -6.704 1.00 . A A . 6 SER O 1 1 19 2997 1 1 6 SER OG O 0.557 -10.136 -3.383 1.00 . A A . 6 SER OG 1 1 19 2998 1 1 7 ARG C C 2.650 -9.194 -9.388 1.00 . A A . 7 ARG C 1 1 19 2999 1 1 7 ARG CA C 1.370 -8.715 -8.710 1.00 . A A . 7 ARG CA 1 1 19 3000 1 1 7 ARG CB C 0.840 -7.468 -9.420 1.00 . A A . 7 ARG CB 1 1 19 3001 1 1 7 ARG CD C -0.540 -5.372 -9.288 1.00 . A A . 7 ARG CD 1 1 19 3002 1 1 7 ARG CG C -0.121 -6.648 -8.576 1.00 . A A . 7 ARG CG 1 1 19 3003 1 1 7 ARG CZ C -2.144 -4.687 -11.021 1.00 . A A . 7 ARG CZ 1 1 19 3004 1 1 7 ARG H H 1.658 -7.499 -7.001 1.00 . A A . 7 ARG H 1 1 19 3005 1 1 7 ARG HA H 0.629 -9.497 -8.772 1.00 . A A . 7 ARG HA 1 1 19 3006 1 1 7 ARG HB2 H 1.675 -6.838 -9.689 1.00 . A A . 7 ARG HB2 1 1 19 3007 1 1 7 ARG HB3 H 0.325 -7.773 -10.319 1.00 . A A . 7 ARG HB3 1 1 19 3008 1 1 7 ARG HD2 H -0.766 -4.619 -8.548 1.00 . A A . 7 ARG HD2 1 1 19 3009 1 1 7 ARG HD3 H 0.280 -5.034 -9.905 1.00 . A A . 7 ARG HD3 1 1 19 3010 1 1 7 ARG HE H -2.207 -6.416 -10.028 1.00 . A A . 7 ARG HE 1 1 19 3011 1 1 7 ARG HG2 H -1.002 -7.239 -8.373 1.00 . A A . 7 ARG HG2 1 1 19 3012 1 1 7 ARG HG3 H 0.363 -6.389 -7.646 1.00 . A A . 7 ARG HG3 1 1 19 3013 1 1 7 ARG HH11 H -0.686 -3.344 -10.635 1.00 . A A . 7 ARG HH11 1 1 19 3014 1 1 7 ARG HH12 H -1.823 -2.874 -11.854 1.00 . A A . 7 ARG HH12 1 1 19 3015 1 1 7 ARG HH21 H -3.711 -5.809 -11.632 1.00 . A A . 7 ARG HH21 1 1 19 3016 1 1 7 ARG HH22 H -3.544 -4.276 -12.420 1.00 . A A . 7 ARG HH22 1 1 19 3017 1 1 7 ARG N N 1.605 -8.431 -7.299 1.00 . A A . 7 ARG N 1 1 19 3018 1 1 7 ARG NE N -1.715 -5.576 -10.131 1.00 . A A . 7 ARG NE 1 1 19 3019 1 1 7 ARG NH1 N -1.498 -3.541 -11.183 1.00 . A A . 7 ARG NH1 1 1 19 3020 1 1 7 ARG NH2 N -3.222 -4.945 -11.751 1.00 . A A . 7 ARG NH2 1 1 19 3021 1 1 7 ARG O O 2.671 -10.248 -10.023 1.00 . A A . 7 ARG O 1 1 19 3022 1 1 8 VAL C C 5.357 -10.215 -9.582 1.00 . A A . 8 VAL C 1 1 19 3023 1 1 8 VAL CA C 5.000 -8.757 -9.848 1.00 . A A . 8 VAL CA 1 1 19 3024 1 1 8 VAL CB C 6.130 -7.858 -9.311 1.00 . A A . 8 VAL CB 1 1 19 3025 1 1 8 VAL CG1 C 7.431 -8.138 -10.045 1.00 . A A . 8 VAL CG1 1 1 19 3026 1 1 8 VAL CG2 C 5.745 -6.391 -9.432 1.00 . A A . 8 VAL CG2 1 1 19 3027 1 1 8 VAL H H 3.638 -7.584 -8.731 1.00 . A A . 8 VAL H 1 1 19 3028 1 1 8 VAL HA H 4.923 -8.604 -10.915 1.00 . A A . 8 VAL HA 1 1 19 3029 1 1 8 VAL HB H 6.276 -8.084 -8.265 1.00 . A A . 8 VAL HB 1 1 19 3030 1 1 8 VAL HG11 H 8.059 -7.260 -10.014 1.00 . A A . 8 VAL HG11 1 1 19 3031 1 1 8 VAL HG12 H 7.942 -8.964 -9.572 1.00 . A A . 8 VAL HG12 1 1 19 3032 1 1 8 VAL HG13 H 7.217 -8.390 -11.074 1.00 . A A . 8 VAL HG13 1 1 19 3033 1 1 8 VAL HG21 H 4.937 -6.288 -10.141 1.00 . A A . 8 VAL HG21 1 1 19 3034 1 1 8 VAL HG22 H 5.426 -6.021 -8.468 1.00 . A A . 8 VAL HG22 1 1 19 3035 1 1 8 VAL HG23 H 6.597 -5.822 -9.771 1.00 . A A . 8 VAL HG23 1 1 19 3036 1 1 8 VAL N N 3.716 -8.412 -9.249 1.00 . A A . 8 VAL N 1 1 19 3037 1 1 8 VAL O O 5.453 -11.021 -10.508 1.00 . A A . 8 VAL O 1 1 19 3038 1 1 9 LYS C C 4.777 -12.880 -8.285 1.00 . A A . 9 LYS C 1 1 19 3039 1 1 9 LYS CA C 5.896 -11.911 -7.921 1.00 . A A . 9 LYS CA 1 1 19 3040 1 1 9 LYS CB C 6.174 -11.978 -6.417 1.00 . A A . 9 LYS CB 1 1 19 3041 1 1 9 LYS CD C 7.606 -10.282 -5.241 1.00 . A A . 9 LYS CD 1 1 19 3042 1 1 9 LYS CE C 8.859 -10.172 -4.387 1.00 . A A . 9 LYS CE 1 1 19 3043 1 1 9 LYS CG C 7.589 -11.573 -6.042 1.00 . A A . 9 LYS CG 1 1 19 3044 1 1 9 LYS H H 5.461 -9.861 -7.617 1.00 . A A . 9 LYS H 1 1 19 3045 1 1 9 LYS HA H 6.790 -12.193 -8.456 1.00 . A A . 9 LYS HA 1 1 19 3046 1 1 9 LYS HB2 H 5.486 -11.320 -5.907 1.00 . A A . 9 LYS HB2 1 1 19 3047 1 1 9 LYS HB3 H 6.009 -12.990 -6.078 1.00 . A A . 9 LYS HB3 1 1 19 3048 1 1 9 LYS HD2 H 7.575 -9.445 -5.923 1.00 . A A . 9 LYS HD2 1 1 19 3049 1 1 9 LYS HD3 H 6.738 -10.256 -4.597 1.00 . A A . 9 LYS HD3 1 1 19 3050 1 1 9 LYS HE2 H 8.783 -9.290 -3.770 1.00 . A A . 9 LYS HE2 1 1 19 3051 1 1 9 LYS HE3 H 8.927 -11.047 -3.757 1.00 . A A . 9 LYS HE3 1 1 19 3052 1 1 9 LYS HG2 H 8.032 -12.358 -5.447 1.00 . A A . 9 LYS HG2 1 1 19 3053 1 1 9 LYS HG3 H 8.166 -11.434 -6.945 1.00 . A A . 9 LYS HG3 1 1 19 3054 1 1 9 LYS HZ1 H 10.869 -9.671 -4.659 1.00 . A A . 9 LYS HZ1 1 1 19 3055 1 1 9 LYS HZ2 H 9.919 -9.468 -6.043 1.00 . A A . 9 LYS HZ2 1 1 19 3056 1 1 9 LYS HZ3 H 10.373 -11.021 -5.550 1.00 . A A . 9 LYS HZ3 1 1 19 3057 1 1 9 LYS N N 5.552 -10.548 -8.311 1.00 . A A . 9 LYS N 1 1 19 3058 1 1 9 LYS NZ N 10.091 -10.076 -5.218 1.00 . A A . 9 LYS NZ 1 1 19 3059 1 1 9 LYS O O 3.887 -12.550 -9.070 1.00 . A A . 9 LYS O 1 1 20 3060 1 1 1 THR C C 2.525 -1.510 -1.758 1.00 . A A . 1 THR C 1 1 20 3061 1 1 1 THR CA C 2.175 -0.120 -1.238 1.00 . A A . 1 THR CA 1 1 20 3062 1 1 1 THR CB C 3.471 0.698 -1.078 1.00 . A A . 1 THR CB 1 1 20 3063 1 1 1 THR CG2 C 3.754 1.514 -2.330 1.00 . A A . 1 THR CG2 1 1 20 3064 1 1 1 THR H1 H 1.921 -0.402 0.844 1.00 . A A . 1 THR H1 1 1 20 3065 1 1 1 THR HA H 1.547 0.378 -1.963 1.00 . A A . 1 THR HA 1 1 20 3066 1 1 1 THR HB H 4.292 0.014 -0.919 1.00 . A A . 1 THR HB 1 1 20 3067 1 1 1 THR HG1 H 4.199 1.585 0.525 1.00 . A A . 1 THR HG1 1 1 20 3068 1 1 1 THR HG21 H 2.831 1.934 -2.702 1.00 . A A . 1 THR HG21 1 1 20 3069 1 1 1 THR HG22 H 4.189 0.876 -3.085 1.00 . A A . 1 THR HG22 1 1 20 3070 1 1 1 THR HG23 H 4.441 2.311 -2.092 1.00 . A A . 1 THR HG23 1 1 20 3071 1 1 1 THR N N 1.438 -0.198 0.017 1.00 . A A . 1 THR N 1 1 20 3072 1 1 1 THR O O 3.201 -1.650 -2.777 1.00 . A A . 1 THR O 1 1 20 3073 1 1 1 THR OG1 O 3.363 1.570 0.052 1.00 . A A . 1 THR OG1 1 1 20 3074 1 1 2 VAL C C 1.436 -4.334 -2.608 1.00 . A A . 2 VAL C 1 1 20 3075 1 1 2 VAL CA C 2.324 -3.915 -1.442 1.00 . A A . 2 VAL CA 1 1 20 3076 1 1 2 VAL CB C 2.099 -4.884 -0.266 1.00 . A A . 2 VAL CB 1 1 20 3077 1 1 2 VAL CG1 C 2.718 -6.241 -0.567 1.00 . A A . 2 VAL CG1 1 1 20 3078 1 1 2 VAL CG2 C 2.669 -4.302 1.019 1.00 . A A . 2 VAL CG2 1 1 20 3079 1 1 2 VAL H H 1.528 -2.359 -0.247 1.00 . A A . 2 VAL H 1 1 20 3080 1 1 2 VAL HA H 3.358 -3.984 -1.746 1.00 . A A . 2 VAL HA 1 1 20 3081 1 1 2 VAL HB H 1.036 -5.019 -0.135 1.00 . A A . 2 VAL HB 1 1 20 3082 1 1 2 VAL HG11 H 3.794 -6.164 -0.519 1.00 . A A . 2 VAL HG11 1 1 20 3083 1 1 2 VAL HG12 H 2.374 -6.962 0.160 1.00 . A A . 2 VAL HG12 1 1 20 3084 1 1 2 VAL HG13 H 2.424 -6.558 -1.556 1.00 . A A . 2 VAL HG13 1 1 20 3085 1 1 2 VAL HG21 H 2.125 -3.407 1.280 1.00 . A A . 2 VAL HG21 1 1 20 3086 1 1 2 VAL HG22 H 2.573 -5.026 1.816 1.00 . A A . 2 VAL HG22 1 1 20 3087 1 1 2 VAL HG23 H 3.711 -4.062 0.875 1.00 . A A . 2 VAL HG23 1 1 20 3088 1 1 2 VAL N N 2.061 -2.535 -1.050 1.00 . A A . 2 VAL N 1 1 20 3089 1 1 2 VAL O O 1.756 -5.270 -3.341 1.00 . A A . 2 VAL O 1 1 20 3090 1 1 3 TYR C C 0.122 -4.175 -5.165 1.00 . A A . 3 TYR C 1 1 20 3091 1 1 3 TYR CA C -0.617 -3.935 -3.852 1.00 . A A . 3 TYR CA 1 1 20 3092 1 1 3 TYR CB C -1.619 -2.791 -4.018 1.00 . A A . 3 TYR CB 1 1 20 3093 1 1 3 TYR CD1 C -1.402 -1.061 -5.845 1.00 . A A . 3 TYR CD1 1 1 20 3094 1 1 3 TYR CD2 C -0.047 -0.819 -3.899 1.00 . A A . 3 TYR CD2 1 1 20 3095 1 1 3 TYR CE1 C -0.850 0.087 -6.379 1.00 . A A . 3 TYR CE1 1 1 20 3096 1 1 3 TYR CE2 C 0.510 0.331 -4.425 1.00 . A A . 3 TYR CE2 1 1 20 3097 1 1 3 TYR CG C -1.012 -1.534 -4.598 1.00 . A A . 3 TYR CG 1 1 20 3098 1 1 3 TYR CZ C 0.106 0.780 -5.665 1.00 . A A . 3 TYR CZ 1 1 20 3099 1 1 3 TYR H H 0.118 -2.900 -2.159 1.00 . A A . 3 TYR H 1 1 20 3100 1 1 3 TYR HA H -1.153 -4.834 -3.584 1.00 . A A . 3 TYR HA 1 1 20 3101 1 1 3 TYR HB2 H -2.412 -3.110 -4.677 1.00 . A A . 3 TYR HB2 1 1 20 3102 1 1 3 TYR HB3 H -2.037 -2.544 -3.053 1.00 . A A . 3 TYR HB3 1 1 20 3103 1 1 3 TYR HD1 H -2.151 -1.606 -6.402 1.00 . A A . 3 TYR HD1 1 1 20 3104 1 1 3 TYR HD2 H 0.268 -1.174 -2.928 1.00 . A A . 3 TYR HD2 1 1 20 3105 1 1 3 TYR HE1 H -1.166 0.439 -7.350 1.00 . A A . 3 TYR HE1 1 1 20 3106 1 1 3 TYR HE2 H 1.258 0.873 -3.866 1.00 . A A . 3 TYR HE2 1 1 20 3107 1 1 3 TYR HH H 0.390 2.681 -5.666 1.00 . A A . 3 TYR HH 1 1 20 3108 1 1 3 TYR N N 0.319 -3.635 -2.775 1.00 . A A . 3 TYR N 1 1 20 3109 1 1 3 TYR O O -0.255 -5.041 -5.954 1.00 . A A . 3 TYR O 1 1 20 3110 1 1 3 TYR OH O 0.659 1.924 -6.192 1.00 . A A . 3 TYR OH 1 1 20 3111 1 1 4 VAL C C 2.979 -4.665 -6.490 1.00 . A A . 4 VAL C 1 1 20 3112 1 1 4 VAL CA C 1.971 -3.527 -6.608 1.00 . A A . 4 VAL CA 1 1 20 3113 1 1 4 VAL CB C 2.724 -2.221 -6.927 1.00 . A A . 4 VAL CB 1 1 20 3114 1 1 4 VAL CG1 C 1.800 -1.227 -7.615 1.00 . A A . 4 VAL CG1 1 1 20 3115 1 1 4 VAL CG2 C 3.314 -1.624 -5.658 1.00 . A A . 4 VAL CG2 1 1 20 3116 1 1 4 VAL H H 1.428 -2.726 -4.726 1.00 . A A . 4 VAL H 1 1 20 3117 1 1 4 VAL HA H 1.298 -3.739 -7.426 1.00 . A A . 4 VAL HA 1 1 20 3118 1 1 4 VAL HB H 3.535 -2.452 -7.602 1.00 . A A . 4 VAL HB 1 1 20 3119 1 1 4 VAL HG11 H 1.915 -0.255 -7.159 1.00 . A A . 4 VAL HG11 1 1 20 3120 1 1 4 VAL HG12 H 2.053 -1.167 -8.663 1.00 . A A . 4 VAL HG12 1 1 20 3121 1 1 4 VAL HG13 H 0.777 -1.555 -7.509 1.00 . A A . 4 VAL HG13 1 1 20 3122 1 1 4 VAL HG21 H 3.781 -2.405 -5.077 1.00 . A A . 4 VAL HG21 1 1 20 3123 1 1 4 VAL HG22 H 4.052 -0.879 -5.920 1.00 . A A . 4 VAL HG22 1 1 20 3124 1 1 4 VAL HG23 H 2.529 -1.163 -5.078 1.00 . A A . 4 VAL HG23 1 1 20 3125 1 1 4 VAL N N 1.177 -3.400 -5.392 1.00 . A A . 4 VAL N 1 1 20 3126 1 1 4 VAL O O 3.228 -5.391 -7.453 1.00 . A A . 4 VAL O 1 1 20 3127 1 1 5 TYR C C 3.975 -7.235 -5.423 1.00 . A A . 5 TYR C 1 1 20 3128 1 1 5 TYR CA C 4.538 -5.865 -5.058 1.00 . A A . 5 TYR CA 1 1 20 3129 1 1 5 TYR CB C 4.972 -5.854 -3.591 1.00 . A A . 5 TYR CB 1 1 20 3130 1 1 5 TYR CD1 C 5.807 -3.490 -3.295 1.00 . A A . 5 TYR CD1 1 1 20 3131 1 1 5 TYR CD2 C 7.359 -5.275 -3.004 1.00 . A A . 5 TYR CD2 1 1 20 3132 1 1 5 TYR CE1 C 6.803 -2.572 -3.021 1.00 . A A . 5 TYR CE1 1 1 20 3133 1 1 5 TYR CE2 C 8.361 -4.365 -2.729 1.00 . A A . 5 TYR CE2 1 1 20 3134 1 1 5 TYR CG C 6.066 -4.855 -3.291 1.00 . A A . 5 TYR CG 1 1 20 3135 1 1 5 TYR CZ C 8.078 -3.015 -2.739 1.00 . A A . 5 TYR CZ 1 1 20 3136 1 1 5 TYR H H 3.316 -4.207 -4.574 1.00 . A A . 5 TYR H 1 1 20 3137 1 1 5 TYR HA H 5.399 -5.665 -5.679 1.00 . A A . 5 TYR HA 1 1 20 3138 1 1 5 TYR HB2 H 4.122 -5.610 -2.973 1.00 . A A . 5 TYR HB2 1 1 20 3139 1 1 5 TYR HB3 H 5.336 -6.836 -3.324 1.00 . A A . 5 TYR HB3 1 1 20 3140 1 1 5 TYR HD1 H 4.806 -3.146 -3.517 1.00 . A A . 5 TYR HD1 1 1 20 3141 1 1 5 TYR HD2 H 7.577 -6.333 -2.998 1.00 . A A . 5 TYR HD2 1 1 20 3142 1 1 5 TYR HE1 H 6.582 -1.515 -3.029 1.00 . A A . 5 TYR HE1 1 1 20 3143 1 1 5 TYR HE2 H 9.360 -4.711 -2.508 1.00 . A A . 5 TYR HE2 1 1 20 3144 1 1 5 TYR HH H 8.742 -1.440 -1.858 1.00 . A A . 5 TYR HH 1 1 20 3145 1 1 5 TYR N N 3.555 -4.816 -5.303 1.00 . A A . 5 TYR N 1 1 20 3146 1 1 5 TYR O O 4.718 -8.151 -5.776 1.00 . A A . 5 TYR O 1 1 20 3147 1 1 5 TYR OH O 9.074 -2.105 -2.466 1.00 . A A . 5 TYR OH 1 1 20 3148 1 1 6 SER C C 1.862 -8.806 -7.164 1.00 . A A . 6 SER C 1 1 20 3149 1 1 6 SER CA C 1.990 -8.626 -5.654 1.00 . A A . 6 SER CA 1 1 20 3150 1 1 6 SER CB C 0.606 -8.674 -5.004 1.00 . A A . 6 SER CB 1 1 20 3151 1 1 6 SER H H 2.116 -6.601 -5.049 1.00 . A A . 6 SER H 1 1 20 3152 1 1 6 SER HA H 2.593 -9.429 -5.257 1.00 . A A . 6 SER HA 1 1 20 3153 1 1 6 SER HB2 H 0.539 -7.907 -4.248 1.00 . A A . 6 SER HB2 1 1 20 3154 1 1 6 SER HB3 H -0.149 -8.503 -5.758 1.00 . A A . 6 SER HB3 1 1 20 3155 1 1 6 SER HG H 0.471 -9.855 -3.447 1.00 . A A . 6 SER HG 1 1 20 3156 1 1 6 SER N N 2.655 -7.367 -5.336 1.00 . A A . 6 SER N 1 1 20 3157 1 1 6 SER O O 1.825 -9.930 -7.664 1.00 . A A . 6 SER O 1 1 20 3158 1 1 6 SER OG O 0.371 -9.933 -4.399 1.00 . A A . 6 SER OG 1 1 20 3159 1 1 7 ARG C C 3.031 -7.933 -9.993 1.00 . A A . 7 ARG C 1 1 20 3160 1 1 7 ARG CA C 1.670 -7.725 -9.335 1.00 . A A . 7 ARG CA 1 1 20 3161 1 1 7 ARG CB C 1.038 -6.428 -9.844 1.00 . A A . 7 ARG CB 1 1 20 3162 1 1 7 ARG CD C -0.978 -6.729 -8.374 1.00 . A A . 7 ARG CD 1 1 20 3163 1 1 7 ARG CG C 0.106 -5.769 -8.840 1.00 . A A . 7 ARG CG 1 1 20 3164 1 1 7 ARG CZ C -3.103 -7.657 -9.191 1.00 . A A . 7 ARG CZ 1 1 20 3165 1 1 7 ARG H H 1.829 -6.824 -7.426 1.00 . A A . 7 ARG H 1 1 20 3166 1 1 7 ARG HA H 1.028 -8.553 -9.594 1.00 . A A . 7 ARG HA 1 1 20 3167 1 1 7 ARG HB2 H 1.824 -5.728 -10.084 1.00 . A A . 7 ARG HB2 1 1 20 3168 1 1 7 ARG HB3 H 0.474 -6.644 -10.739 1.00 . A A . 7 ARG HB3 1 1 20 3169 1 1 7 ARG HD2 H -0.532 -7.697 -8.199 1.00 . A A . 7 ARG HD2 1 1 20 3170 1 1 7 ARG HD3 H -1.398 -6.355 -7.452 1.00 . A A . 7 ARG HD3 1 1 20 3171 1 1 7 ARG HE H -1.971 -6.352 -10.187 1.00 . A A . 7 ARG HE 1 1 20 3172 1 1 7 ARG HG2 H 0.681 -5.450 -7.984 1.00 . A A . 7 ARG HG2 1 1 20 3173 1 1 7 ARG HG3 H -0.360 -4.912 -9.304 1.00 . A A . 7 ARG HG3 1 1 20 3174 1 1 7 ARG HH11 H -2.532 -8.315 -7.368 1.00 . A A . 7 ARG HH11 1 1 20 3175 1 1 7 ARG HH12 H -4.029 -8.962 -7.955 1.00 . A A . 7 ARG HH12 1 1 20 3176 1 1 7 ARG HH21 H -3.939 -7.196 -10.972 1.00 . A A . 7 ARG HH21 1 1 20 3177 1 1 7 ARG HH22 H -4.828 -8.325 -10.006 1.00 . A A . 7 ARG HH22 1 1 20 3178 1 1 7 ARG N N 1.795 -7.691 -7.883 1.00 . A A . 7 ARG N 1 1 20 3179 1 1 7 ARG NE N -2.046 -6.870 -9.359 1.00 . A A . 7 ARG NE 1 1 20 3180 1 1 7 ARG NH1 N -3.232 -8.370 -8.080 1.00 . A A . 7 ARG NH1 1 1 20 3181 1 1 7 ARG NH2 N -4.033 -7.732 -10.134 1.00 . A A . 7 ARG NH2 1 1 20 3182 1 1 7 ARG O O 3.133 -8.565 -11.045 1.00 . A A . 7 ARG O 1 1 20 3183 1 1 8 VAL C C 5.795 -8.985 -10.117 1.00 . A A . 8 VAL C 1 1 20 3184 1 1 8 VAL CA C 5.428 -7.522 -9.892 1.00 . A A . 8 VAL CA 1 1 20 3185 1 1 8 VAL CB C 6.459 -6.886 -8.941 1.00 . A A . 8 VAL CB 1 1 20 3186 1 1 8 VAL CG1 C 7.847 -6.916 -9.562 1.00 . A A . 8 VAL CG1 1 1 20 3187 1 1 8 VAL CG2 C 6.053 -5.462 -8.591 1.00 . A A . 8 VAL CG2 1 1 20 3188 1 1 8 VAL H H 3.928 -6.903 -8.533 1.00 . A A . 8 VAL H 1 1 20 3189 1 1 8 VAL HA H 5.470 -7.001 -10.837 1.00 . A A . 8 VAL HA 1 1 20 3190 1 1 8 VAL HB H 6.484 -7.465 -8.030 1.00 . A A . 8 VAL HB 1 1 20 3191 1 1 8 VAL HG11 H 7.760 -6.901 -10.639 1.00 . A A . 8 VAL HG11 1 1 20 3192 1 1 8 VAL HG12 H 8.408 -6.053 -9.233 1.00 . A A . 8 VAL HG12 1 1 20 3193 1 1 8 VAL HG13 H 8.359 -7.817 -9.256 1.00 . A A . 8 VAL HG13 1 1 20 3194 1 1 8 VAL HG21 H 5.513 -5.463 -7.656 1.00 . A A . 8 VAL HG21 1 1 20 3195 1 1 8 VAL HG22 H 6.937 -4.849 -8.496 1.00 . A A . 8 VAL HG22 1 1 20 3196 1 1 8 VAL HG23 H 5.423 -5.065 -9.372 1.00 . A A . 8 VAL HG23 1 1 20 3197 1 1 8 VAL N N 4.073 -7.396 -9.368 1.00 . A A . 8 VAL N 1 1 20 3198 1 1 8 VAL O O 6.007 -9.416 -11.251 1.00 . A A . 8 VAL O 1 1 20 3199 1 1 9 LYS C C 5.047 -11.969 -9.678 1.00 . A A . 9 LYS C 1 1 20 3200 1 1 9 LYS CA C 6.208 -11.161 -9.107 1.00 . A A . 9 LYS CA 1 1 20 3201 1 1 9 LYS CB C 6.582 -11.693 -7.722 1.00 . A A . 9 LYS CB 1 1 20 3202 1 1 9 LYS CD C 7.749 -10.316 -5.974 1.00 . A A . 9 LYS CD 1 1 20 3203 1 1 9 LYS CE C 7.714 -11.159 -4.708 1.00 . A A . 9 LYS CE 1 1 20 3204 1 1 9 LYS CG C 7.918 -11.180 -7.213 1.00 . A A . 9 LYS CG 1 1 20 3205 1 1 9 LYS H H 5.689 -9.344 -8.153 1.00 . A A . 9 LYS H 1 1 20 3206 1 1 9 LYS HA H 7.059 -11.262 -9.764 1.00 . A A . 9 LYS HA 1 1 20 3207 1 1 9 LYS HB2 H 5.816 -11.401 -7.019 1.00 . A A . 9 LYS HB2 1 1 20 3208 1 1 9 LYS HB3 H 6.627 -12.772 -7.764 1.00 . A A . 9 LYS HB3 1 1 20 3209 1 1 9 LYS HD2 H 8.577 -9.626 -5.911 1.00 . A A . 9 LYS HD2 1 1 20 3210 1 1 9 LYS HD3 H 6.823 -9.764 -6.055 1.00 . A A . 9 LYS HD3 1 1 20 3211 1 1 9 LYS HE2 H 7.356 -12.146 -4.958 1.00 . A A . 9 LYS HE2 1 1 20 3212 1 1 9 LYS HE3 H 8.716 -11.229 -4.311 1.00 . A A . 9 LYS HE3 1 1 20 3213 1 1 9 LYS HG2 H 8.547 -12.023 -6.968 1.00 . A A . 9 LYS HG2 1 1 20 3214 1 1 9 LYS HG3 H 8.387 -10.592 -7.990 1.00 . A A . 9 LYS HG3 1 1 20 3215 1 1 9 LYS HZ1 H 6.763 -11.199 -2.849 1.00 . A A . 9 LYS HZ1 1 1 20 3216 1 1 9 LYS HZ2 H 5.866 -10.431 -4.060 1.00 . A A . 9 LYS HZ2 1 1 20 3217 1 1 9 LYS HZ3 H 7.194 -9.646 -3.365 1.00 . A A . 9 LYS HZ3 1 1 20 3218 1 1 9 LYS N N 5.869 -9.745 -9.030 1.00 . A A . 9 LYS N 1 1 20 3219 1 1 9 LYS NZ N 6.822 -10.567 -3.673 1.00 . A A . 9 LYS NZ 1 1 20 3220 1 1 9 LYS O O 3.916 -11.870 -9.201 1.00 . A A . 9 LYS O 1 1 stop_ save_
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