NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
526854 | 2l8e | 17396 | cing | 4-filtered-FRED | STAR | entry | full | 502 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2l8e # This FRED archive file contains, for PDB entry <2l8e>: # # - 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_2l8e _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2l8e _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "free and other bound" _Assembly.Molecular_mass 5546.64 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 $Polyhomeotic_like_protein_1 A . 1 1 2 . 2 $ZINC_ION B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 ZN 1 ZN 1 1 stop_ save_ save_Polyhomeotic_like_protein_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Polyhomeotic like protein 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GTRGVDSPSAELDKKANLLKCEYCGKYAPAEQFRGSKRFCSMTCAKRYN _Entity.Number_of_monomers 49 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 GLY . 1 1 2 THR . 1 1 3 ARG . 1 1 4 GLY . 1 1 5 VAL . 1 1 6 ASP . 1 1 7 SER . 1 1 8 PRO . 1 1 9 SER . 1 1 10 ALA . 1 1 11 GLU . 1 1 12 LEU . 1 1 13 ASP . 1 1 14 LYS . 1 1 15 LYS . 1 1 16 ALA . 1 1 17 ASN . 1 1 18 LEU . 1 1 19 LEU . 1 1 20 LYS . 1 1 21 CYS . 1 1 22 GLU . 1 1 23 TYR . 1 1 24 CYS . 1 1 25 GLY . 1 1 26 LYS . 1 1 27 TYR . 1 1 28 ALA . 1 1 29 PRO . 1 1 30 ALA . 1 1 31 GLU . 1 1 32 GLN . 1 1 33 PHE . 1 1 34 ARG . 1 1 35 GLY . 1 1 36 SER . 1 1 37 LYS . 1 1 38 ARG . 1 1 39 PHE . 1 1 40 CYS . 1 1 41 SER . 1 1 42 MET . 1 1 43 THR . 1 1 44 CYS . 1 1 45 ALA . 1 1 46 LYS . 1 1 47 ARG . 1 1 48 TYR . 1 1 49 ASN . 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 GLY 1 1 1 1 THR 2 2 1 1 ARG 3 3 1 1 GLY 4 4 1 1 VAL 5 5 1 1 ASP 6 6 1 1 SER 7 7 1 1 PRO 8 8 1 1 SER 9 9 1 1 ALA 10 10 1 1 GLU 11 11 1 1 LEU 12 12 1 1 ASP 13 13 1 1 LYS 14 14 1 1 LYS 15 15 1 1 ALA 16 16 1 1 ASN 17 17 1 1 LEU 18 18 1 1 LEU 19 19 1 1 LYS 20 20 1 1 CYS 21 21 1 1 GLU 22 22 1 1 TYR 23 23 1 1 CYS 24 24 1 1 GLY 25 25 1 1 LYS 26 26 1 1 TYR 27 27 1 1 ALA 28 28 1 1 PRO 29 29 1 1 ALA 30 30 1 1 GLU 31 31 1 1 GLN 32 32 1 1 PHE 33 33 1 1 ARG 34 34 1 1 GLY 35 35 1 1 SER 36 36 1 1 LYS 37 37 1 1 ARG 38 38 1 1 PHE 39 39 1 1 CYS 40 40 1 1 SER 41 41 1 1 MET 42 42 1 1 THR 43 43 1 1 CYS 44 44 1 1 ALA 45 45 1 1 LYS 46 46 1 1 ARG 47 47 1 1 TYR 48 48 1 1 ASN 49 49 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _Entity.Type non-polymer 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 ZN $ZN 1 2 stop_ save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_8_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 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 17 ASN QD . 17 ASN QD2 1 1 1 1 2 1 1 29 PRO QG . 29 PRO QG 1 1 2 1 1 1 1 17 ASN H . 17 ASN HN 1 1 2 1 2 1 1 17 ASN QD . 17 ASN QD2 1 1 3 1 1 1 1 17 ASN QD . 17 ASN QD2 1 1 3 1 2 1 1 30 ALA MB . 30 ALA QB 1 1 4 1 1 1 1 17 ASN QB . 17 ASN QB 1 1 4 1 2 1 1 17 ASN QD . 17 ASN QD2 1 1 5 1 1 1 1 15 LYS HA . 15 LYS HA 1 1 5 1 2 1 1 17 ASN QD . 17 ASN QD2 1 1 6 1 1 1 1 16 ALA H . 16 ALA HN 1 1 6 1 2 1 1 17 ASN QD . 17 ASN QD2 1 1 7 1 1 1 1 28 ALA MB . 28 ALA QB 1 1 7 1 2 1 1 32 GLN QE . 32 GLN QE2 1 1 8 1 1 1 1 32 GLN QB . 32 GLN QB 1 1 8 1 2 1 1 32 GLN QE . 32 GLN QE2 1 1 9 1 1 1 1 32 GLN QE . 32 GLN QE2 1 1 9 1 2 1 1 32 GLN QG . 32 GLN QG 1 1 10 1 1 1 1 32 GLN QE . 32 GLN QE2 1 1 10 1 2 1 1 40 CYS HB2 . 40 CYO HB2 1 1 11 1 1 1 1 32 GLN QE . 32 GLN QE2 1 1 11 1 2 1 1 40 CYS HB3 . 40 CYO HB1 1 1 12 1 1 1 1 32 GLN H . 32 GLN HN 1 1 12 1 2 1 1 32 GLN QE . 32 GLN QE2 1 1 13 1 1 1 1 30 ALA HA . 30 ALA HA 1 1 13 1 2 1 1 32 GLN QE . 32 GLN QE2 1 1 14 1 1 1 1 32 GLN QE . 32 GLN QE2 1 1 14 1 2 1 1 33 PHE HA . 33 PHE HA 1 1 15 1 1 1 1 49 ASN QB . 49 ASN QB 1 1 15 1 2 1 1 49 ASN QD . 49 ASN QD2 1 1 16 1 1 1 1 48 TYR HA . 48 TYR HA 1 1 16 1 2 1 1 49 ASN QD . 49 ASN QD2 1 1 17 1 1 1 1 46 LYS HA . 46 LYS HA 1 1 17 1 2 1 1 49 ASN QD . 49 ASN QD2 1 1 18 1 1 1 1 24 CYS H . 24 CYO HN 1 1 18 1 2 1 1 26 LYS QB . 26 LYS QB 1 1 19 1 1 1 1 30 ALA MB . 30 ALA QB 1 1 19 1 2 1 1 31 GLU H . 31 GLU HN 1 1 20 1 1 1 1 16 ALA MB . 16 ALA QB 1 1 20 1 2 1 1 17 ASN H . 17 ASN HN 1 1 21 1 1 1 1 17 ASN H . 17 ASN HN 1 1 21 1 2 1 1 17 ASN QB . 17 ASN QB 1 1 22 1 1 1 1 43 THR H . 43 THR HN 1 1 22 1 2 1 1 44 CYS H . 44 CYO HN 1 1 23 1 1 1 1 43 THR HB . 43 THR HB 1 1 23 1 2 1 1 44 CYS H . 44 CYO HN 1 1 24 1 1 1 1 38 ARG H . 38 ARG HN 1 1 24 1 2 1 1 39 PHE H . 39 PHE HN 1 1 25 1 1 1 1 12 LEU H . 12 LEU HN 1 1 25 1 2 1 1 13 ASP H . 13 ASP HN 1 1 26 1 1 1 1 47 ARG H . 47 ARG HN 1 1 26 1 2 1 1 49 ASN H . 49 ASN HN 1 1 27 1 1 1 1 22 GLU H . 22 GLU HN 1 1 27 1 2 1 1 23 TYR H . 23 TYR HN 1 1 28 1 1 1 1 35 GLY QA . 35 GLY QA 1 1 28 1 2 1 1 36 SER H . 36 SER HN 1 1 29 1 1 1 1 23 TYR QD . 23 TYR QD 1 1 29 1 2 1 1 24 CYS H . 24 CYO HN 1 1 30 1 1 1 1 41 SER H . 41 SER HN 1 1 30 1 2 1 1 44 CYS H . 44 CYO HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 0.0 6.0 1 1 2 1 . . . . . . 1.9 6.0 1 1 3 1 . . . . . . 2.0 6.0 1 1 4 1 . . . . . . 2.0 5.2 1 1 5 1 . . . . . . 1.6 6.0 1 1 6 1 . . . . . . 1.6 6.0 1 1 7 1 . . . . . . 2.0 4.1 1 1 8 1 . . . . . . 2.0 5.4 1 1 9 1 . . . . . . 2.0 5.0 1 1 10 1 . . . . . . 2.0 6.0 1 1 11 1 . . . . . . 2.0 4.3 1 1 12 1 . . . . . . 1.3 6.0 1 1 13 1 . . . . . . 0.0 6.0 1 1 14 1 . . . . . . 0.3 6.0 1 1 15 1 . . . . . . 2.0 6.0 1 1 16 1 . . . . . . 1.8 6.0 1 1 17 1 . . . . . . 1.4 6.0 1 1 18 1 . . . . . . 1.3 6.0 1 1 19 1 . . . . . . 1.9 3.8 1 1 20 1 . . . . . . 2.0 4.3 1 1 21 1 . . . . . . 2.0 4.9 1 1 22 1 . . . . . . 1.9 4.1 1 1 23 1 . . . . . . 1.8 3.3 1 1 24 1 . . . . . . 1.7 2.8 1 1 25 1 . . . . . . 1.8 3.8 1 1 26 1 . . . . . . 1.7 6.0 1 1 27 1 . . . . . . 1.7 3.5 1 1 28 1 . . . . . . 2.0 6.0 1 1 29 1 . . . . . . 1.9 4.5 1 1 30 1 . . . . . . 2.0 5.2 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type 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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 18 LEU H . 18 LEU HN 1 2 1 1 2 1 1 18 LEU QB . 18 LEU QB 1 2 2 1 1 1 1 18 LEU HA . 18 LEU HA 1 2 2 1 2 1 1 18 LEU QB . 18 LEU QB 1 2 3 1 1 1 1 18 LEU QB . 18 LEU QB 1 2 3 1 2 1 1 19 LEU H . 19 LEU HN 1 2 4 1 1 1 1 19 LEU HA . 19 LEU HA 1 2 4 1 2 1 1 19 LEU QB . 19 LEU QB 1 2 5 1 1 1 1 19 LEU QB . 19 LEU QB 1 2 5 1 2 1 1 20 LYS H . 20 LYS HN 1 2 6 1 1 1 1 39 PHE QB . 39 PHE QB 1 2 6 1 2 1 1 40 CYS H . 40 CYO HN 1 2 7 1 1 1 1 39 PHE HA . 39 PHE HA 1 2 7 1 2 1 1 39 PHE QB . 39 PHE QB 1 2 8 1 1 1 1 39 PHE H . 39 PHE HN 1 2 8 1 2 1 1 39 PHE QB . 39 PHE QB 1 2 9 1 1 1 1 12 LEU H . 12 LEU HN 1 2 9 1 2 1 1 12 LEU QB . 12 LEU QB 1 2 10 1 1 1 1 12 LEU HA . 12 LEU HA 1 2 10 1 2 1 1 12 LEU QB . 12 LEU QB 1 2 11 1 1 1 1 20 LYS QE . 20 LYS QE 1 2 11 1 2 1 1 25 GLY QA . 25 GLY QA 1 2 12 1 1 1 1 13 ASP H . 13 ASP HN 1 2 12 1 2 1 1 13 ASP QB . 13 ASP QB 1 2 13 1 1 1 1 13 ASP HA . 13 ASP HA 1 2 13 1 2 1 1 13 ASP QB . 13 ASP QB 1 2 14 1 1 1 1 23 TYR H . 23 TYR HN 1 2 14 1 2 1 1 23 TYR QB . 23 TYR QB 1 2 15 1 1 1 1 23 TYR QB . 23 TYR QB 1 2 15 1 2 1 1 48 TYR QD . 48 TYR QD 1 2 16 1 1 1 1 23 TYR HA . 23 TYR HA 1 2 16 1 2 1 1 23 TYR QB . 23 TYR QB 1 2 17 1 1 1 1 23 TYR QB . 23 TYR QB 1 2 17 1 2 1 1 24 CYS H . 24 CYO HN 1 2 18 1 1 1 1 27 TYR H . 27 TYR HN 1 2 18 1 2 1 1 27 TYR QB . 27 TYR QB 1 2 19 1 1 1 1 27 TYR HA . 27 TYR HA 1 2 19 1 2 1 1 27 TYR QB . 27 TYR QB 1 2 20 1 1 1 1 48 TYR HA . 48 TYR HA 1 2 20 1 2 1 1 48 TYR QB . 48 TYR QB 1 2 21 1 1 1 1 33 PHE HA . 33 PHE HA 1 2 21 1 2 1 1 33 PHE QB . 33 PHE QB 1 2 22 1 1 1 1 33 PHE QB . 33 PHE QB 1 2 22 1 2 1 1 37 LYS HA . 37 LYS HA 1 2 23 1 1 1 1 33 PHE H . 33 PHE HN 1 2 23 1 2 1 1 33 PHE QB . 33 PHE QB 1 2 24 1 1 1 1 17 ASN HA . 17 ASN HA 1 2 24 1 2 1 1 17 ASN QB . 17 ASN QB 1 2 25 1 1 1 1 22 GLU H . 22 GLU HN 1 2 25 1 2 1 1 22 GLU QG . 22 GLU QG 1 2 26 1 1 1 1 22 GLU HA . 22 GLU HA 1 2 26 1 2 1 1 22 GLU QG . 22 GLU QG 1 2 27 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 27 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 28 1 1 1 1 20 LYS H . 20 LYS HN 1 2 28 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 29 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 29 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 30 1 1 1 1 26 LYS QB . 26 LYS QB 1 2 30 1 2 1 1 27 TYR H . 27 TYR HN 1 2 31 1 1 1 1 26 LYS H . 26 LYS HN 1 2 31 1 2 1 1 26 LYS QB . 26 LYS QB 1 2 32 1 1 1 1 26 LYS HA . 26 LYS HA 1 2 32 1 2 1 1 26 LYS QB . 26 LYS QB 1 2 33 1 1 1 1 29 PRO QB . 29 PRO QB 1 2 33 1 2 1 1 29 PRO QD . 29 PRO QD 1 2 34 1 1 1 1 14 LYS H . 14 LYS HN 1 2 34 1 2 1 1 14 LYS QB . 14 LYS QB 1 2 35 1 1 1 1 14 LYS QB . 14 LYS QB 1 2 35 1 2 1 1 15 LYS H . 15 LYS HN 1 2 36 1 1 1 1 38 ARG H . 38 ARG HN 1 2 36 1 2 1 1 38 ARG QB . 38 ARG QB 1 2 37 1 1 1 1 38 ARG HA . 38 ARG HA 1 2 37 1 2 1 1 38 ARG QB . 38 ARG QB 1 2 38 1 1 1 1 24 CYS H . 24 CYO HN 1 2 38 1 2 1 1 24 CYS HB2 . 24 CYO HB2 1 2 39 1 1 1 1 23 TYR QD . 23 TYR QD 1 2 39 1 2 1 1 24 CYS HB2 . 24 CYO HB2 1 2 40 1 1 1 1 24 CYS HA . 24 CYO HA 1 2 40 1 2 1 1 24 CYS HB2 . 24 CYO HB2 1 2 41 1 1 1 1 24 CYS H . 24 CYO HN 1 2 41 1 2 1 1 24 CYS HB3 . 24 CYO HB1 1 2 42 1 1 1 1 23 TYR QD . 23 TYR QD 1 2 42 1 2 1 1 24 CYS HB3 . 24 CYO HB1 1 2 43 1 1 1 1 24 CYS HA . 24 CYO HA 1 2 43 1 2 1 1 24 CYS HB3 . 24 CYO HB1 1 2 44 1 1 1 1 21 CYS H . 21 CZN HN 1 2 44 1 2 1 1 21 CYS HB3 . 21 CZN HB1 1 2 45 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 2 45 1 2 1 1 26 LYS H . 26 LYS HN 1 2 46 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 2 46 1 2 1 1 25 GLY H . 25 GLY HN 1 2 47 1 1 1 1 40 CYS H . 40 CYO HN 1 2 47 1 2 1 1 40 CYS HB3 . 40 CYO HB1 1 2 48 1 1 1 1 40 CYS H . 40 CYO HN 1 2 48 1 2 1 1 40 CYS HB2 . 40 CYO HB2 1 2 49 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 2 49 1 2 1 1 40 CYS H . 40 CYO HN 1 2 50 1 1 1 1 34 ARG HA . 34 ARG HA 1 2 50 1 2 1 1 34 ARG QB . 34 ARG QB 1 2 51 1 1 1 1 37 LYS HA . 37 LYS HA 1 2 51 1 2 1 1 37 LYS QB . 37 LYS QB 1 2 52 1 1 1 1 34 ARG H . 34 ARG HN 1 2 52 1 2 1 1 34 ARG QB . 34 ARG QB 1 2 53 1 1 1 1 40 CYS H . 40 CYO HN 1 2 53 1 2 1 1 44 CYS HB3 . 44 CYO HB1 1 2 54 1 1 1 1 44 CYS HB3 . 44 CYO HB1 1 2 54 1 2 1 1 45 ALA H . 45 ALA HN 1 2 55 1 1 1 1 22 GLU H . 22 GLU HN 1 2 55 1 2 1 1 22 GLU QB . 22 GLU QB 1 2 56 1 1 1 1 22 GLU HA . 22 GLU HA 1 2 56 1 2 1 1 22 GLU QB . 22 GLU QB 1 2 57 1 1 1 1 11 GLU QB . 11 GLU QB 1 2 57 1 2 1 1 12 LEU HA . 12 LEU HA 1 2 58 1 1 1 1 47 ARG H . 47 ARG HN 1 2 58 1 2 1 1 47 ARG QB . 47 ARG QB 1 2 59 1 1 1 1 47 ARG HA . 47 ARG HA 1 2 59 1 2 1 1 47 ARG QB . 47 ARG QB 1 2 60 1 1 1 1 32 GLN H . 32 GLN HN 1 2 60 1 2 1 1 32 GLN QB . 32 GLN QB 1 2 61 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 61 1 2 1 1 32 GLN QB . 32 GLN QB 1 2 62 1 1 1 1 29 PRO QD . 29 PRO QD 1 2 62 1 2 1 1 29 PRO QG . 29 PRO QG 1 2 63 1 1 1 1 47 ARG H . 47 ARG HN 1 2 63 1 2 1 1 47 ARG QG . 47 ARG QG 1 2 64 1 1 1 1 47 ARG HA . 47 ARG HA 1 2 64 1 2 1 1 47 ARG QG . 47 ARG QG 1 2 65 1 1 1 1 12 LEU H . 12 LEU HN 1 2 65 1 2 1 1 12 LEU HG . 12 LEU HG 1 2 66 1 1 1 1 18 LEU H . 18 LEU HN 1 2 66 1 2 1 1 18 LEU HG . 18 LEU HG 1 2 67 1 1 1 1 38 ARG H . 38 ARG HN 1 2 67 1 2 1 1 38 ARG QG . 38 ARG QG 1 2 68 1 1 1 1 38 ARG HA . 38 ARG HA 1 2 68 1 2 1 1 38 ARG QG . 38 ARG QG 1 2 69 1 1 1 1 19 LEU HG . 19 LEU HG 1 2 69 1 2 1 1 30 ALA HA . 30 ALA HA 1 2 70 1 1 1 1 19 LEU QD . 19 LEU QD1 1 2 70 1 2 1 1 30 ALA HA . 30 ALA HA 1 2 71 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 71 1 2 1 1 20 LYS QG . 20 LYS QG 1 2 72 1 1 1 1 12 LEU HA . 12 LEU HA 1 2 72 1 2 1 1 12 LEU MD2 . 12 LEU QD2 1 2 73 1 1 1 1 19 LEU QD . 19 LEU QD2 1 2 73 1 2 1 1 20 LYS H . 20 LYS HN 1 2 74 1 1 1 1 19 LEU HA . 19 LEU HA 1 2 74 1 2 1 1 19 LEU QD . 19 LEU QD2 1 2 75 1 1 1 1 18 LEU MD2 . 18 LEU QD2 1 2 75 1 2 1 1 19 LEU H . 19 LEU HN 1 2 76 1 1 1 1 18 LEU MD2 . 18 LEU QD2 1 2 76 1 2 1 1 28 ALA HA . 28 ALA HA 1 2 77 1 1 1 1 18 LEU HA . 18 LEU HA 1 2 77 1 2 1 1 18 LEU MD2 . 18 LEU QD2 1 2 78 1 1 1 1 18 LEU MD2 . 18 LEU QD2 1 2 78 1 2 1 1 29 PRO HA . 29 PRO HA 1 2 79 1 1 1 1 43 THR MG . 43 THR QG2 1 2 79 1 2 1 1 44 CYS H . 44 CYO HN 1 2 80 1 1 1 1 43 THR HA . 43 THR HA 1 2 80 1 2 1 1 43 THR MG . 43 THR QG2 1 2 81 1 1 1 1 28 ALA H . 28 ALA HN 1 2 81 1 2 1 1 28 ALA MB . 28 ALA QB 1 2 82 1 1 1 1 28 ALA HA . 28 ALA HA 1 2 82 1 2 1 1 28 ALA MB . 28 ALA QB 1 2 83 1 1 1 1 28 ALA MB . 28 ALA QB 1 2 83 1 2 1 1 29 PRO QD . 29 PRO QD 1 2 84 1 1 1 1 16 ALA H . 16 ALA HN 1 2 84 1 2 1 1 16 ALA MB . 16 ALA QB 1 2 85 1 1 1 1 16 ALA HA . 16 ALA HA 1 2 85 1 2 1 1 16 ALA MB . 16 ALA QB 1 2 86 1 1 1 1 45 ALA MB . 45 ALA QB 1 2 86 1 2 1 1 46 LYS H . 46 LYS HN 1 2 87 1 1 1 1 42 MET HA . 42 MET HA 1 2 87 1 2 1 1 45 ALA MB . 45 ALA QB 1 2 88 1 1 1 1 30 ALA H . 30 ALA HN 1 2 88 1 2 1 1 30 ALA MB . 30 ALA QB 1 2 89 1 1 1 1 17 ASN HA . 17 ASN HA 1 2 89 1 2 1 1 30 ALA MB . 30 ALA QB 1 2 90 1 1 1 1 29 PRO HA . 29 PRO HA 1 2 90 1 2 1 1 30 ALA MB . 30 ALA QB 1 2 91 1 1 1 1 42 MET HA . 42 MET HA 1 2 91 1 2 1 1 42 MET ME . 42 MET QE 1 2 92 1 1 1 1 18 LEU QB . 18 LEU QB 1 2 92 1 2 1 1 27 TYR QB . 27 TYR QB 1 2 93 1 1 1 1 18 LEU MD1 . 18 LEU QD1 1 2 93 1 2 1 1 27 TYR QB . 27 TYR QB 1 2 94 1 1 1 1 19 LEU QD . 19 LEU QD1 1 2 94 1 2 1 1 33 PHE QB . 33 PHE QB 1 2 95 1 1 1 1 28 ALA MB . 28 ALA QB 1 2 95 1 2 1 1 40 CYS HB3 . 40 CYO HB1 1 2 96 1 1 1 1 39 PHE QB . 39 PHE QB 1 2 96 1 2 1 1 45 ALA MB . 45 ALA QB 1 2 97 1 1 1 1 38 ARG QB . 38 ARG QB 1 2 97 1 2 1 1 38 ARG QG . 38 ARG QG 1 2 98 1 1 1 1 18 LEU QB . 18 LEU QB 1 2 98 1 2 1 1 18 LEU MD1 . 18 LEU QD1 1 2 99 1 1 1 1 19 LEU QD . 19 LEU QD1 1 2 99 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 100 1 1 1 1 18 LEU QB . 18 LEU QB 1 2 100 1 2 1 1 18 LEU MD2 . 18 LEU QD2 1 2 101 1 1 1 1 5 VAL HB . 5 VAL HB 1 2 101 1 2 1 1 5 VAL MG1 . 5 VAL QG1 1 2 102 1 1 1 1 18 LEU MD1 . 18 LEU QD1 1 2 102 1 2 1 1 18 LEU HG . 18 LEU HG 1 2 103 1 1 1 1 19 LEU QD . 19 LEU QD2 1 2 103 1 2 1 1 28 ALA MB . 28 ALA QB 1 2 104 1 1 1 1 16 ALA MB . 16 ALA QB 1 2 104 1 2 1 1 18 LEU MD2 . 18 LEU QD2 1 2 105 1 1 1 1 19 LEU QD . 19 LEU QD1 1 2 105 1 2 1 1 30 ALA MB . 30 ALA QB 1 2 106 1 1 1 1 22 GLU QB . 22 GLU QB 1 2 106 1 2 1 1 22 GLU QG . 22 GLU QG 1 2 107 1 1 1 1 26 LYS QB . 26 LYS QB 1 2 107 1 2 1 1 26 LYS QG . 26 LYS QG 1 2 108 1 1 1 1 28 ALA MB . 28 ALA QB 1 2 108 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 109 1 1 1 1 25 GLY H . 25 GLY HN 1 2 109 1 2 1 1 25 GLY QA . 25 GLY QA 1 2 110 1 1 1 1 21 CYS HB2 . 21 CZN HB2 1 2 110 1 2 1 1 40 CYS H . 40 CYO HN 1 2 111 1 1 1 1 21 CYS H . 21 CZN HN 1 2 111 1 2 1 1 21 CYS HB2 . 21 CZN HB2 1 2 112 1 1 1 1 21 CYS HB2 . 21 CZN HB2 1 2 112 1 2 1 1 24 CYS H . 24 CYO HN 1 2 113 1 1 1 1 21 CYS HB2 . 21 CZN HB2 1 2 113 1 2 1 1 26 LYS H . 26 LYS HN 1 2 114 1 1 1 1 21 CYS HB2 . 21 CZN HB2 1 2 114 1 2 1 1 25 GLY H . 25 GLY HN 1 2 115 1 1 1 1 23 TYR QB . 23 TYR QB 1 2 115 1 2 1 1 48 TYR QB . 48 TYR QB 1 2 116 1 1 1 1 21 CYS HB2 . 21 CZN HB2 1 2 116 1 2 1 1 40 CYS HB2 . 40 CYO HB2 1 2 117 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 117 1 2 1 1 25 GLY QA . 25 GLY QA 1 2 118 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 118 1 2 1 1 27 TYR QE . 27 TYR QE 1 2 119 1 1 1 1 19 LEU QD . 19 LEU QD1 1 2 119 1 2 1 1 33 PHE QD . 33 PHE QD 1 2 120 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 120 1 2 1 1 21 CYS H . 21 CZN HN 1 2 121 1 1 1 1 18 LEU MD2 . 18 LEU QD2 1 2 121 1 2 1 1 28 ALA H . 28 ALA HN 1 2 122 1 1 1 1 27 TYR HA . 27 TYR HA 1 2 122 1 2 1 1 28 ALA MB . 28 ALA QB 1 2 123 1 1 1 1 18 LEU MD2 . 18 LEU QD2 1 2 123 1 2 1 1 29 PRO QD . 29 PRO QD 1 2 124 1 1 1 1 28 ALA MB . 28 ALA QB 1 2 124 1 2 1 1 40 CYS HB2 . 40 CYO HB2 1 2 125 1 1 1 1 28 ALA MB . 28 ALA QB 1 2 125 1 2 1 1 29 PRO QG . 29 PRO QG 1 2 126 1 1 1 1 32 GLN H . 32 GLN HN 1 2 126 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 2.0 3.1 1 2 2 1 . . . . . . 2.0 3.4 1 2 3 1 . . . . . . 1.9 3.6 1 2 4 1 . . . . . . 1.9 3.5 1 2 5 1 . . . . . . 1.9 3.9 1 2 6 1 . . . . . . 2.0 4.6 1 2 7 1 . . . . . . 1.9 3.3 1 2 8 1 . . . . . . 1.9 4.5 1 2 9 1 . . . . . . 1.9 3.8 1 2 10 1 . . . . . . 2.0 4.4 1 2 11 1 . . . . . . 2.0 5.2 1 2 12 1 . . . . . . 1.9 3.6 1 2 13 1 . . . . . . 1.9 3.8 1 2 14 1 . . . . . . 1.8 3.8 1 2 15 1 . . . . . . 0.0 6.0 1 2 16 1 . . . . . . 1.9 3.1 1 2 17 1 . . . . . . 1.7 3.3 1 2 18 1 . . . . . . 2.0 2.8 1 2 19 1 . . . . . . 1.9 3.1 1 2 20 1 . . . . . . 1.9 3.4 1 2 21 1 . . . . . . 2.0 3.5 1 2 22 1 . . . . . . 2.0 3.1 1 2 23 1 . . . . . . 2.0 3.0 1 2 24 1 . . . . . . 2.0 3.4 1 2 25 1 . . . . . . 2.0 4.9 1 2 26 1 . . . . . . 2.0 4.1 1 2 27 1 . . . . . . 2.0 4.4 1 2 28 1 . . . . . . 1.9 3.8 1 2 29 1 . . . . . . 1.9 3.5 1 2 30 1 . . . . . . 2.0 3.6 1 2 31 1 . . . . . . 2.0 2.8 1 2 32 1 . . . . . . 1.9 3.3 1 2 33 1 . . . . . . 2.0 4.3 1 2 34 1 . . . . . . 2.0 3.8 1 2 35 1 . . . . . . 1.9 3.1 1 2 36 1 . . . . . . 2.0 3.9 1 2 37 1 . . . . . . 1.9 3.1 1 2 38 1 . . . . . . 2.0 4.6 1 2 39 1 . . . . . . 2.0 5.6 1 2 40 1 . . . . . . 1.7 3.0 1 2 41 1 . . . . . . 1.8 3.6 1 2 42 1 . . . . . . 1.8 3.6 1 2 43 1 . . . . . . 1.7 2.8 1 2 44 1 . . . . . . 1.6 2.8 1 2 45 1 . . . . . . 1.9 3.6 1 2 46 1 . . . . . . 1.8 3.4 1 2 47 1 . . . . . . 1.9 3.9 1 2 48 1 . . . . . . 1.8 3.4 1 2 49 1 . . . . . . 2.0 5.8 1 2 50 1 . . . . . . 1.9 3.6 1 2 51 1 . . . . . . 1.9 3.3 1 2 52 1 . . . . . . 2.0 4.3 1 2 53 1 . . . . . . 1.8 4.0 1 2 54 1 . . . . . . 0.0 6.0 1 2 55 1 . . . . . . 1.8 3.4 1 2 56 1 . . . . . . 1.9 3.3 1 2 57 1 . . . . . . 1.9 4.3 1 2 58 1 . . . . . . 1.8 3.4 1 2 59 1 . . . . . . 1.9 3.3 1 2 60 1 . . . . . . 1.9 3.3 1 2 61 1 . . . . . . 1.8 2.7 1 2 62 1 . . . . . . 1.9 3.0 1 2 63 1 . . . . . . 2.0 5.4 1 2 64 1 . . . . . . 1.9 3.8 1 2 65 1 . . . . . . 1.9 4.1 1 2 66 1 . . . . . . 1.8 3.1 1 2 67 1 . . . . . . 2.0 4.1 1 2 68 1 . . . . . . 2.0 3.8 1 2 69 1 . . . . . . 1.9 4.5 1 2 70 1 . . . . . . 2.0 3.3 1 2 71 1 . . . . . . 2.0 4.5 1 2 72 1 . . . . . . 1.9 4.0 1 2 73 1 . . . . . . 1.9 4.3 1 2 74 1 . . . . . . 1.7 3.3 1 2 75 1 . . . . . . 1.9 4.9 1 2 76 1 . . . . . . 1.8 3.6 1 2 77 1 . . . . . . 1.7 3.0 1 2 78 1 . . . . . . 1.7 2.8 1 2 79 1 . . . . . . 2.0 5.0 1 2 80 1 . . . . . . 1.8 3.4 1 2 81 1 . . . . . . 1.8 3.4 1 2 82 1 . . . . . . 1.5 2.5 1 2 83 1 . . . . . . 1.9 2.5 1 2 84 1 . . . . . . 1.7 3.3 1 2 85 1 . . . . . . 1.7 2.6 1 2 86 1 . . . . . . 1.8 3.3 1 2 87 1 . . . . . . 1.7 3.1 1 2 88 1 . . . . . . 1.6 2.8 1 2 89 1 . . . . . . 0.0 6.0 1 2 90 1 . . . . . . 2.0 6.0 1 2 91 1 . . . . . . 1.9 4.3 1 2 92 1 . . . . . . 2.0 3.4 1 2 93 1 . . . . . . 2.0 3.6 1 2 94 1 . . . . . . 1.9 4.3 1 2 95 1 . . . . . . 1.8 3.4 1 2 96 1 . . . . . . 2.0 3.4 1 2 97 1 . . . . . . 1.9 3.4 1 2 98 1 . . . . . . 1.7 3.1 1 2 99 1 . . . . . . 0.0 6.0 1 2 100 1 . . . . . . 2.0 3.1 1 2 101 1 . . . . . . 1.9 3.9 1 2 102 1 . . . . . . 1.9 4.1 1 2 103 1 . . . . . . 2.0 5.2 1 2 104 1 . . . . . . 1.9 4.1 1 2 105 1 . . . . . . 1.8 3.4 1 2 106 1 . . . . . . 1.9 3.8 1 2 107 1 . . . . . . 1.9 3.7 1 2 108 1 . . . . . . 2.0 4.8 1 2 109 1 . . . . . . 1.8 2.8 1 2 110 1 . . . . . . 1.8 3.1 1 2 111 1 . . . . . . 1.6 2.8 1 2 112 1 . . . . . . 2.0 4.9 1 2 113 1 . . . . . . 1.9 4.7 1 2 114 1 . . . . . . 2.0 5.2 1 2 115 1 . . . . . . 1.8 4.0 1 2 116 1 . . . . . . 1.9 4.1 1 2 117 1 . . . . . . 2.0 5.6 1 2 118 1 . . . . . . 1.9 4.9 1 2 119 1 . . . . . . 1.9 4.5 1 2 120 1 . . . . . . 2.0 5.0 1 2 121 1 . . . . . . 2.0 5.4 1 2 122 1 . . . . . . 2.0 5.4 1 2 123 1 . . . . . . 2.0 4.0 1 2 124 1 . . . . . . 0.0 6.0 1 2 125 1 . . . . . . 2.0 6.0 1 2 126 1 . . . . . . 2.0 5.8 1 2 stop_ save_ save_DYANA/DIANA_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 26 1 . . . 1 3 27 1 . . . 1 3 28 1 . . . 1 3 29 1 . . . 1 3 30 1 . . . 1 3 31 1 . . . 1 3 32 1 . . . 1 3 33 1 . . . 1 3 34 1 . . . 1 3 35 1 . . . 1 3 36 1 . . . 1 3 37 1 . . . 1 3 38 1 . . . 1 3 39 1 . . . 1 3 40 1 . . . 1 3 41 1 . . . 1 3 42 1 . . . 1 3 43 1 . . . 1 3 44 1 . . . 1 3 45 1 . . . 1 3 46 1 . . . 1 3 47 1 . . . 1 3 48 1 . . . 1 3 49 1 . . . 1 3 50 1 . . . 1 3 51 1 . . . 1 3 52 1 . . . 1 3 53 1 . . . 1 3 54 1 . . . 1 3 55 1 . . . 1 3 56 1 . . . 1 3 57 1 . . . 1 3 58 1 . . . 1 3 59 1 . . . 1 3 60 1 . . . 1 3 61 1 . . . 1 3 62 1 . . . 1 3 63 1 . . . 1 3 64 1 . . . 1 3 65 1 . . . 1 3 66 1 . . . 1 3 67 1 . . . 1 3 68 1 . . . 1 3 69 1 . . . 1 3 70 1 . . . 1 3 71 1 . . . 1 3 72 1 . . . 1 3 73 1 . . . 1 3 74 1 . . . 1 3 75 1 . . . 1 3 76 1 . . . 1 3 77 1 . . . 1 3 78 1 . . . 1 3 79 1 . . . 1 3 80 1 . . . 1 3 81 1 . . . 1 3 82 1 . . . 1 3 83 1 . . . 1 3 84 1 . . . 1 3 85 1 . . . 1 3 86 1 . . . 1 3 87 1 . . . 1 3 88 1 . . . 1 3 89 1 . . . 1 3 90 1 . . . 1 3 91 1 . . . 1 3 92 1 . . . 1 3 93 1 . . . 1 3 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 21 CYS HA . 21 CZN HA 1 3 1 1 2 1 1 22 GLU H . 22 GLU HN 1 3 2 1 1 1 1 36 SER HA . 36 SER HA 1 3 2 1 2 1 1 37 LYS H . 37 LYS HN 1 3 3 1 1 1 1 33 PHE HA . 33 PHE HA 1 3 3 1 2 1 1 34 ARG H . 34 ARG HN 1 3 4 1 1 1 1 46 LYS H . 46 LYS HN 1 3 4 1 2 1 1 46 LYS HA . 46 LYS HA 1 3 5 1 1 1 1 37 LYS HA . 37 LYS HA 1 3 5 1 2 1 1 38 ARG H . 38 ARG HN 1 3 6 1 1 1 1 15 LYS H . 15 LYS HN 1 3 6 1 2 1 1 15 LYS HA . 15 LYS HA 1 3 7 1 1 1 1 14 LYS H . 14 LYS HN 1 3 7 1 2 1 1 14 LYS HA . 14 LYS HA 1 3 8 1 1 1 1 12 LEU HA . 12 LEU HA 1 3 8 1 2 1 1 13 ASP H . 13 ASP HN 1 3 9 1 1 1 1 30 ALA HA . 30 ALA HA 1 3 9 1 2 1 1 33 PHE QD . 33 PHE QD 1 3 10 1 1 1 1 13 ASP HA . 13 ASP HA 1 3 10 1 2 1 1 14 LYS H . 14 LYS HN 1 3 11 1 1 1 1 20 LYS HA . 20 LYS HA 1 3 11 1 2 1 1 21 CYS H . 21 CZN HN 1 3 12 1 1 1 1 20 LYS HA . 20 LYS HA 1 3 12 1 2 1 1 27 TYR HA . 27 TYR HA 1 3 13 1 1 1 1 16 ALA HA . 16 ALA HA 1 3 13 1 2 1 1 17 ASN H . 17 ASN HN 1 3 14 1 1 1 1 28 ALA HA . 28 ALA HA 1 3 14 1 2 1 1 29 PRO QD . 29 PRO QD 1 3 15 1 1 1 1 37 LYS HA . 37 LYS HA 1 3 15 1 2 1 1 38 ARG QG . 38 ARG QG 1 3 16 1 1 1 1 5 VAL HA . 5 VAL HA 1 3 16 1 2 1 1 6 ASP H . 6 ASP HN 1 3 17 1 1 1 1 6 ASP HA . 6 ASP HA 1 3 17 1 2 1 1 7 SER H . 7 SER HN 1 3 18 1 1 1 1 9 SER HA . 9 SER HA 1 3 18 1 2 1 1 9 SER QB . 9 SER QB 1 3 19 1 1 1 1 17 ASN HA . 17 ASN HA 1 3 19 1 2 1 1 18 LEU H . 18 LEU HN 1 3 20 1 1 1 1 19 LEU HA . 19 LEU HA 1 3 20 1 2 1 1 19 LEU HG . 19 LEU HG 1 3 21 1 1 1 1 22 GLU HA . 22 GLU HA 1 3 21 1 2 1 1 23 TYR H . 23 TYR HN 1 3 22 1 1 1 1 23 TYR HA . 23 TYR HA 1 3 22 1 2 1 1 23 TYR QE . 23 TYR QE 1 3 23 1 1 1 1 23 TYR HA . 23 TYR HA 1 3 23 1 2 1 1 23 TYR QD . 23 TYR QD 1 3 24 1 1 1 1 27 TYR HA . 27 TYR HA 1 3 24 1 2 1 1 28 ALA H . 28 ALA HN 1 3 25 1 1 1 1 21 CYS H . 21 CZN HN 1 3 25 1 2 1 1 27 TYR HA . 27 TYR HA 1 3 26 1 1 1 1 18 LEU QB . 18 LEU QB 1 3 26 1 2 1 1 27 TYR HA . 27 TYR HA 1 3 27 1 1 1 1 20 LYS QB . 20 LYS QB 1 3 27 1 2 1 1 27 TYR HA . 27 TYR HA 1 3 28 1 1 1 1 30 ALA HA . 30 ALA HA 1 3 28 1 2 1 1 31 GLU H . 31 GLU HN 1 3 29 1 1 1 1 30 ALA HA . 30 ALA HA 1 3 29 1 2 1 1 32 GLN H . 32 GLN HN 1 3 30 1 1 1 1 18 LEU HA . 18 LEU HA 1 3 30 1 2 1 1 30 ALA HA . 30 ALA HA 1 3 31 1 1 1 1 30 ALA HA . 30 ALA HA 1 3 31 1 2 1 1 33 PHE QB . 33 PHE QB 1 3 32 1 1 1 1 31 GLU HA . 31 GLU HA 1 3 32 1 2 1 1 32 GLN H . 32 GLN HN 1 3 33 1 1 1 1 31 GLU HA . 31 GLU HA 1 3 33 1 2 1 1 33 PHE H . 33 PHE HN 1 3 34 1 1 1 1 39 PHE HA . 39 PHE HA 1 3 34 1 2 1 1 40 CYS H . 40 CYO HN 1 3 35 1 1 1 1 22 GLU H . 22 GLU HN 1 3 35 1 2 1 1 39 PHE HA . 39 PHE HA 1 3 36 1 1 1 1 39 PHE HA . 39 PHE HA 1 3 36 1 2 1 1 45 ALA H . 45 ALA HN 1 3 37 1 1 1 1 21 CYS HA . 21 CZN HA 1 3 37 1 2 1 1 39 PHE HA . 39 PHE HA 1 3 38 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 3 38 1 2 1 1 39 PHE HA . 39 PHE HA 1 3 39 1 1 1 1 39 PHE HA . 39 PHE HA 1 3 39 1 2 1 1 40 CYS HB2 . 40 CYO HB2 1 3 40 1 1 1 1 39 PHE HA . 39 PHE HA 1 3 40 1 2 1 1 39 PHE QD . 39 PHE QD 1 3 41 1 1 1 1 41 SER QB . 41 SER QB 1 3 41 1 2 1 1 43 THR H . 43 THR HN 1 3 42 1 1 1 1 41 SER H . 41 SER HN 1 3 42 1 2 1 1 41 SER QB . 41 SER QB 1 3 43 1 1 1 1 42 MET HA . 42 MET HA 1 3 43 1 2 1 1 42 MET QG . 42 MET QG 1 3 44 1 1 1 1 42 MET HA . 42 MET HA 1 3 44 1 2 1 1 45 ALA H . 45 ALA HN 1 3 45 1 1 1 1 42 MET HA . 42 MET HA 1 3 45 1 2 1 1 46 LYS H . 46 LYS HN 1 3 46 1 1 1 1 43 THR HA . 43 THR HA 1 3 46 1 2 1 1 46 LYS H . 46 LYS HN 1 3 47 1 1 1 1 43 THR HA . 43 THR HA 1 3 47 1 2 1 1 44 CYS H . 44 CYO HN 1 3 48 1 1 1 1 43 THR H . 43 THR HN 1 3 48 1 2 1 1 43 THR HB . 43 THR HB 1 3 49 1 1 1 1 43 THR HB . 43 THR HB 1 3 49 1 2 1 1 45 ALA H . 45 ALA HN 1 3 50 1 1 1 1 44 CYS HA . 44 CYO HA 1 3 50 1 2 1 1 47 ARG QB . 47 ARG QB 1 3 51 1 1 1 1 43 THR HB . 43 THR HB 1 3 51 1 2 1 1 44 CYS HA . 44 CYO HA 1 3 52 1 1 1 1 23 TYR QE . 23 TYR QE 1 3 52 1 2 1 1 44 CYS HA . 44 CYO HA 1 3 53 1 1 1 1 44 CYS HA . 44 CYO HA 1 3 53 1 2 1 1 47 ARG H . 47 ARG HN 1 3 54 1 1 1 1 45 ALA HA . 45 ALA HA 1 3 54 1 2 1 1 46 LYS H . 46 LYS HN 1 3 55 1 1 1 1 45 ALA HA . 45 ALA HA 1 3 55 1 2 1 1 46 LYS HA . 46 LYS HA 1 3 56 1 1 1 1 39 PHE QB . 39 PHE QB 1 3 56 1 2 1 1 45 ALA HA . 45 ALA HA 1 3 57 1 1 1 1 45 ALA HA . 45 ALA HA 1 3 57 1 2 1 1 48 TYR QB . 48 TYR QB 1 3 58 1 1 1 1 45 ALA MB . 45 ALA QB 1 3 58 1 2 1 1 46 LYS HA . 46 LYS HA 1 3 59 1 1 1 1 47 ARG HA . 47 ARG HA 1 3 59 1 2 1 1 48 TYR H . 48 TYR HN 1 3 60 1 1 1 1 26 LYS HA . 26 LYS HA 1 3 60 1 2 1 1 26 LYS QG . 26 LYS QG 1 3 61 1 1 1 1 26 LYS HA . 26 LYS HA 1 3 61 1 2 1 1 27 TYR HA . 27 TYR HA 1 3 62 1 1 1 1 29 PRO HA . 29 PRO HA 1 3 62 1 2 1 1 29 PRO QD . 29 PRO QD 1 3 63 1 1 1 1 30 ALA MB . 30 ALA QB 1 3 63 1 2 1 1 31 GLU HA . 31 GLU HA 1 3 64 1 1 1 1 33 PHE HA . 33 PHE HA 1 3 64 1 2 1 1 33 PHE QD . 33 PHE QD 1 3 65 1 1 1 1 21 CYS HA . 21 CZN HA 1 3 65 1 2 1 1 22 GLU HA . 22 GLU HA 1 3 66 1 1 1 1 28 ALA H . 28 ALA HN 1 3 66 1 2 1 1 29 PRO QD . 29 PRO QD 1 3 67 1 1 1 1 29 PRO QD . 29 PRO QD 1 3 67 1 2 1 1 32 GLN HA . 32 GLN HA 1 3 68 1 1 1 1 34 ARG HA . 34 ARG HA 1 3 68 1 2 1 1 35 GLY H . 35 GLY HN 1 3 69 1 1 1 1 42 MET HA . 42 MET HA 1 3 69 1 2 1 1 45 ALA HA . 45 ALA HA 1 3 70 1 1 1 1 19 LEU HA . 19 LEU HA 1 3 70 1 2 1 1 20 LYS QB . 20 LYS QB 1 3 71 1 1 1 1 20 LYS QG . 20 LYS QG 1 3 71 1 2 1 1 27 TYR HA . 27 TYR HA 1 3 72 1 1 1 1 29 PRO HA . 29 PRO HA 1 3 72 1 2 1 1 30 ALA HA . 30 ALA HA 1 3 73 1 1 1 1 46 LYS HA . 46 LYS HA 1 3 73 1 2 1 1 47 ARG QB . 47 ARG QB 1 3 74 1 1 1 1 18 LEU HA . 18 LEU HA 1 3 74 1 2 1 1 18 LEU HG . 18 LEU HG 1 3 75 1 1 1 1 41 SER QB . 41 SER QB 1 3 75 1 2 1 1 42 MET QG . 42 MET QG 1 3 76 1 1 1 1 20 LYS HA . 20 LYS HA 1 3 76 1 2 1 1 28 ALA H . 28 ALA HN 1 3 77 1 1 1 1 20 LYS HA . 20 LYS HA 1 3 77 1 2 1 1 21 CYS HB2 . 21 CZN HB2 1 3 78 1 1 1 1 19 LEU QD . 19 LEU QD1 1 3 78 1 2 1 1 37 LYS HA . 37 LYS HA 1 3 79 1 1 1 1 33 PHE QD . 33 PHE QD 1 3 79 1 2 1 1 37 LYS HA . 37 LYS HA 1 3 80 1 1 1 1 32 GLN HA . 32 GLN HA 1 3 80 1 2 1 1 33 PHE H . 33 PHE HN 1 3 81 1 1 1 1 26 LYS HA . 26 LYS HA 1 3 81 1 2 1 1 27 TYR H . 27 TYR HN 1 3 82 1 1 1 1 26 LYS HA . 26 LYS HA 1 3 82 1 2 1 1 27 TYR QD . 27 TYR QD 1 3 83 1 1 1 1 21 CYS HA . 21 CZN HA 1 3 83 1 2 1 1 40 CYS H . 40 CYO HN 1 3 84 1 1 1 1 8 PRO QB . 8 PRO QB 1 3 84 1 2 1 1 8 PRO QD . 8 PRO QD 1 3 85 1 1 1 1 8 PRO HA . 8 PRO HA 1 3 85 1 2 1 1 9 SER H . 9 SER HN 1 3 86 1 1 1 1 18 LEU HA . 18 LEU HA 1 3 86 1 2 1 1 29 PRO HA . 29 PRO HA 1 3 87 1 1 1 1 29 PRO HA . 29 PRO HA 1 3 87 1 2 1 1 30 ALA H . 30 ALA HN 1 3 88 1 1 1 1 7 SER HA . 7 SER HA 1 3 88 1 2 1 1 8 PRO QD . 8 PRO QD 1 3 89 1 1 1 1 12 LEU H . 12 LEU HN 1 3 89 1 2 1 1 12 LEU HA . 12 LEU HA 1 3 90 1 1 1 1 18 LEU H . 18 LEU HN 1 3 90 1 2 1 1 29 PRO HA . 29 PRO HA 1 3 91 1 1 1 1 7 SER HA . 7 SER HA 1 3 91 1 2 1 1 9 SER QB . 9 SER QB 1 3 92 1 1 1 1 46 LYS HA . 46 LYS HA 1 3 92 1 2 1 1 47 ARG H . 47 ARG HN 1 3 93 1 1 1 1 39 PHE HA . 39 PHE HA 1 3 93 1 2 1 1 45 ALA MB . 45 ALA QB 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 1.5 2.4 1 3 2 1 . . . . . . 1.8 3.8 1 3 3 1 . . . . . . 1.7 2.8 1 3 4 1 . . . . . . 1.8 3.1 1 3 5 1 . . . . . . 1.9 3.6 1 3 6 1 . . . . . . 1.6 2.8 1 3 7 1 . . . . . . 1.8 2.8 1 3 8 1 . . . . . . 0.0 6.0 1 3 9 1 . . . . . . 1.8 3.4 1 3 10 1 . . . . . . 1.7 3.1 1 3 11 1 . . . . . . 1.5 2.5 1 3 12 1 . . . . . . 1.6 2.8 1 3 13 1 . . . . . . 1.7 3.3 1 3 14 1 . . . . . . 1.9 2.6 1 3 15 1 . . . . . . 2.0 6.0 1 3 16 1 . . . . . . 2.0 3.8 1 3 17 1 . . . . . . 1.9 3.6 1 3 18 1 . . . . . . 2.0 4.5 1 3 19 1 . . . . . . 1.8 3.8 1 3 20 1 . . . . . . 2.0 6.0 1 3 21 1 . . . . . . 2.0 4.6 1 3 22 1 . . . . . . 2.0 6.0 1 3 23 1 . . . . . . 1.8 3.8 1 3 24 1 . . . . . . 1.6 2.7 1 3 25 1 . . . . . . 2.0 5.8 1 3 26 1 . . . . . . 2.0 6.0 1 3 27 1 . . . . . . 2.0 5.4 1 3 28 1 . . . . . . 1.9 4.9 1 3 29 1 . . . . . . 2.0 5.7 1 3 30 1 . . . . . . 1.7 6.0 1 3 31 1 . . . . . . 2.0 5.4 1 3 32 1 . . . . . . 2.0 4.7 1 3 33 1 . . . . . . 2.0 5.2 1 3 34 1 . . . . . . 1.5 2.7 1 3 35 1 . . . . . . 2.0 5.4 1 3 36 1 . . . . . . 2.0 5.8 1 3 37 1 . . . . . . 1.8 3.6 1 3 38 1 . . . . . . 1.8 6.0 1 3 39 1 . . . . . . 2.0 6.0 1 3 40 1 . . . . . . 1.9 4.3 1 3 41 1 . . . . . . 2.0 5.8 1 3 42 1 . . . . . . 2.0 5.0 1 3 43 1 . . . . . . 2.0 5.0 1 3 44 1 . . . . . . 1.9 4.7 1 3 45 1 . . . . . . 2.0 5.4 1 3 46 1 . . . . . . 2.0 4.9 1 3 47 1 . . . . . . 2.0 5.8 1 3 48 1 . . . . . . 1.8 4.0 1 3 49 1 . . . . . . 2.0 6.0 1 3 50 1 . . . . . . 1.8 4.0 1 3 51 1 . . . . . . 1.5 6.0 1 3 52 1 . . . . . . 1.9 6.0 1 3 53 1 . . . . . . 1.9 4.5 1 3 54 1 . . . . . . 2.0 5.1 1 3 55 1 . . . . . . 1.9 6.0 1 3 56 1 . . . . . . 1.9 4.5 1 3 57 1 . . . . . . 2.0 5.4 1 3 58 1 . . . . . . 2.0 6.0 1 3 59 1 . . . . . . 2.0 4.6 1 3 60 1 . . . . . . 1.9 4.5 1 3 61 1 . . . . . . 2.0 6.0 1 3 62 1 . . . . . . 2.0 6.0 1 3 63 1 . . . . . . 2.0 5.8 1 3 64 1 . . . . . . 2.0 5.8 1 3 65 1 . . . . . . 1.8 6.0 1 3 66 1 . . . . . . 1.8 6.0 1 3 67 1 . . . . . . 0.6 6.0 1 3 68 1 . . . . . . 2.0 5.3 1 3 69 1 . . . . . . 1.8 6.0 1 3 70 1 . . . . . . 1.8 6.0 1 3 71 1 . . . . . . 1.5 6.0 1 3 72 1 . . . . . . 2.0 6.0 1 3 73 1 . . . . . . 1.6 6.0 1 3 74 1 . . . . . . 1.8 3.8 1 3 75 1 . . . . . . 1.8 6.0 1 3 76 1 . . . . . . 2.0 5.2 1 3 77 1 . . . . . . 1.9 6.0 1 3 78 1 . . . . . . 1.9 6.0 1 3 79 1 . . . . . . 2.0 5.2 1 3 80 1 . . . . . . 2.0 4.3 1 3 81 1 . . . . . . 1.5 2.5 1 3 82 1 . . . . . . 2.0 6.0 1 3 83 1 . . . . . . 2.0 6.0 1 3 84 1 . . . . . . 1.9 6.0 1 3 85 1 . . . . . . 1.9 3.6 1 3 86 1 . . . . . . 1.9 3.7 1 3 87 1 . . . . . . 1.5 2.4 1 3 88 1 . . . . . . 1.8 3.6 1 3 89 1 . . . . . . 1.9 2.9 1 3 90 1 . . . . . . 1.9 6.0 1 3 91 1 . . . . . . 2.0 6.0 1 3 92 1 . . . . . . 1.9 4.0 1 3 93 1 . . . . . . 0.9 6.0 1 3 stop_ save_ save_DYANA/DIANA_distance_constraints_7_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _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 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 5 1 . . . 1 4 6 1 . . . 1 4 7 1 . . . 1 4 8 1 . . . 1 4 9 1 . . . 1 4 10 1 . . . 1 4 11 1 . . . 1 4 12 1 . . . 1 4 13 1 . . . 1 4 14 1 . . . 1 4 15 1 . . . 1 4 16 1 . . . 1 4 17 1 . . . 1 4 18 1 . . . 1 4 19 1 . . . 1 4 20 1 . . . 1 4 21 1 . . . 1 4 22 1 . . . 1 4 23 1 . . . 1 4 24 1 . . . 1 4 25 1 . . . 1 4 26 1 . . . 1 4 27 1 . . . 1 4 28 1 . . . 1 4 29 1 . . . 1 4 30 1 . . . 1 4 31 1 . . . 1 4 32 1 . . . 1 4 33 1 . . . 1 4 34 1 . . . 1 4 35 1 . . . 1 4 36 1 . . . 1 4 37 1 . . . 1 4 38 1 . . . 1 4 39 1 . . . 1 4 40 1 . . . 1 4 41 1 . . . 1 4 42 1 . . . 1 4 43 1 . . . 1 4 44 1 . . . 1 4 45 1 . . . 1 4 46 1 . . . 1 4 47 1 . . . 1 4 48 1 . . . 1 4 49 1 . . . 1 4 50 1 . . . 1 4 51 1 . . . 1 4 52 1 . . . 1 4 53 1 . . . 1 4 54 1 . . . 1 4 55 1 . . . 1 4 56 1 . . . 1 4 57 1 . . . 1 4 58 1 . . . 1 4 59 1 . . . 1 4 60 1 . . . 1 4 61 1 . . . 1 4 62 1 . . . 1 4 63 1 . . . 1 4 64 1 . . . 1 4 65 1 . . . 1 4 66 1 . . . 1 4 67 1 . . . 1 4 68 1 . . . 1 4 69 1 . . . 1 4 70 1 . . . 1 4 71 1 . . . 1 4 72 1 . . . 1 4 73 1 . . . 1 4 74 1 . . . 1 4 75 1 . . . 1 4 76 1 . . . 1 4 77 1 . . . 1 4 78 1 . . . 1 4 79 1 . . . 1 4 80 1 . . . 1 4 81 1 . . . 1 4 82 1 . . . 1 4 83 1 . . . 1 4 84 1 . . . 1 4 85 1 . . . 1 4 86 1 . . . 1 4 87 1 . . . 1 4 88 1 . . . 1 4 89 1 . . . 1 4 90 1 . . . 1 4 91 1 . . . 1 4 92 1 . . . 1 4 93 1 . . . 1 4 94 1 . . . 1 4 95 1 . . . 1 4 96 1 . . . 1 4 97 1 . . . 1 4 98 1 . . . 1 4 99 1 . . . 1 4 100 1 . . . 1 4 101 1 . . . 1 4 102 1 . . . 1 4 103 1 . . . 1 4 104 1 . . . 1 4 105 1 . . . 1 4 106 1 . . . 1 4 107 1 . . . 1 4 108 1 . . . 1 4 109 1 . . . 1 4 110 1 . . . 1 4 111 1 . . . 1 4 112 1 . . . 1 4 113 1 . . . 1 4 114 1 . . . 1 4 115 1 . . . 1 4 116 1 . . . 1 4 117 1 . . . 1 4 118 1 . . . 1 4 119 1 . . . 1 4 120 1 . . . 1 4 121 1 . . . 1 4 122 1 . . . 1 4 123 1 . . . 1 4 124 1 . . . 1 4 125 1 . . . 1 4 126 1 . . . 1 4 127 1 . . . 1 4 128 1 . . . 1 4 129 1 . . . 1 4 130 1 . . . 1 4 131 1 . . . 1 4 132 1 . . . 1 4 133 1 . . . 1 4 134 1 . . . 1 4 135 1 . . . 1 4 136 1 . . . 1 4 137 1 . . . 1 4 138 1 . . . 1 4 139 1 . . . 1 4 140 1 . . . 1 4 141 1 . . . 1 4 142 1 . . . 1 4 143 1 . . . 1 4 144 1 . . . 1 4 145 1 . . . 1 4 146 1 . . . 1 4 147 1 . . . 1 4 148 1 . . . 1 4 149 1 . . . 1 4 150 1 . . . 1 4 151 1 . . . 1 4 152 1 . . . 1 4 153 1 . . . 1 4 154 1 . . . 1 4 155 1 . . . 1 4 156 1 . . . 1 4 157 1 . . . 1 4 158 1 . . . 1 4 159 1 . . . 1 4 160 1 . . . 1 4 161 1 . . . 1 4 162 1 . . . 1 4 163 1 . . . 1 4 164 1 . . . 1 4 165 1 . . . 1 4 166 1 . . . 1 4 167 1 . . . 1 4 168 1 . . . 1 4 169 1 . . . 1 4 170 1 . . . 1 4 171 1 . . . 1 4 172 1 . . . 1 4 173 1 . . . 1 4 174 1 . . . 1 4 175 1 . . . 1 4 176 1 . . . 1 4 177 1 . . . 1 4 178 1 . . . 1 4 179 1 . . . 1 4 180 1 . . . 1 4 181 1 . . . 1 4 182 1 . . . 1 4 183 1 . . . 1 4 184 1 . . . 1 4 185 1 . . . 1 4 186 1 . . . 1 4 187 1 . . . 1 4 188 1 . . . 1 4 189 1 . . . 1 4 190 1 . . . 1 4 191 1 . . . 1 4 192 1 . . . 1 4 193 1 . . . 1 4 194 1 . . . 1 4 195 1 . . . 1 4 196 1 . . . 1 4 197 1 . . . 1 4 198 1 . . . 1 4 199 1 . . . 1 4 200 1 . . . 1 4 201 1 . . . 1 4 202 1 . . . 1 4 203 1 . . . 1 4 204 1 . . . 1 4 205 1 . . . 1 4 206 1 . . . 1 4 207 1 . . . 1 4 208 1 . . . 1 4 209 1 . . . 1 4 210 1 . . . 1 4 211 1 . . . 1 4 212 1 . . . 1 4 213 1 . . . 1 4 214 1 . . . 1 4 215 1 . . . 1 4 216 1 . . . 1 4 217 1 . . . 1 4 218 1 . . . 1 4 219 1 . . . 1 4 220 1 . . . 1 4 221 1 . . . 1 4 222 1 . . . 1 4 223 1 . . . 1 4 224 1 . . . 1 4 225 1 . . . 1 4 226 1 . . . 1 4 227 1 . . . 1 4 228 1 . . . 1 4 229 1 . . . 1 4 230 1 . . . 1 4 231 1 . . . 1 4 232 1 . . . 1 4 233 1 . . . 1 4 234 1 . . . 1 4 235 1 . . . 1 4 236 1 . . . 1 4 237 1 . . . 1 4 238 1 . . . 1 4 239 1 . . . 1 4 240 1 . . . 1 4 241 1 . . . 1 4 242 1 . . . 1 4 243 1 . . . 1 4 244 1 . . . 1 4 245 1 . . . 1 4 246 1 . . . 1 4 247 1 . . . 1 4 248 1 . . . 1 4 249 1 . . . 1 4 250 1 . . . 1 4 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 9 SER HA . 9 SER HA 1 4 1 1 2 1 1 10 ALA H . 10 ALA HN 1 4 2 1 1 1 1 10 ALA H . 10 ALA HN 1 4 2 1 2 1 1 10 ALA MB . 10 ALA QB 1 4 3 1 1 1 1 27 TYR QB . 27 TYR QB 1 4 3 1 2 1 1 28 ALA H . 28 ALA HN 1 4 4 1 1 1 1 18 LEU HA . 18 LEU HA 1 4 4 1 2 1 1 30 ALA H . 30 ALA HN 1 4 5 1 1 1 1 29 PRO QB . 29 PRO QB 1 4 5 1 2 1 1 30 ALA H . 30 ALA HN 1 4 6 1 1 1 1 19 LEU QD . 19 LEU QD2 1 4 6 1 2 1 1 30 ALA H . 30 ALA HN 1 4 7 1 1 1 1 6 ASP H . 6 ASP HN 1 4 7 1 2 1 1 7 SER HA . 7 SER HA 1 4 8 1 1 1 1 6 ASP H . 6 ASP HN 1 4 8 1 2 1 1 6 ASP QB . 6 ASP QB 1 4 9 1 1 1 1 18 LEU HA . 18 LEU HA 1 4 9 1 2 1 1 19 LEU H . 19 LEU HN 1 4 10 1 1 1 1 19 LEU H . 19 LEU HN 1 4 10 1 2 1 1 19 LEU HG . 19 LEU HG 1 4 11 1 1 1 1 25 GLY QA . 25 GLY QA 1 4 11 1 2 1 1 26 LYS H . 26 LYS HN 1 4 12 1 1 1 1 26 LYS H . 26 LYS HN 1 4 12 1 2 1 1 26 LYS QG . 26 LYS QG 1 4 13 1 1 1 1 18 LEU H . 18 LEU HN 1 4 13 1 2 1 1 18 LEU MD1 . 18 LEU QD1 1 4 14 1 1 1 1 18 LEU H . 18 LEU HN 1 4 14 1 2 1 1 18 LEU MD2 . 18 LEU QD2 1 4 15 1 1 1 1 19 LEU HA . 19 LEU HA 1 4 15 1 2 1 1 20 LYS H . 20 LYS HN 1 4 16 1 1 1 1 12 LEU QB . 12 LEU QB 1 4 16 1 2 1 1 13 ASP H . 13 ASP HN 1 4 17 1 1 1 1 10 ALA HA . 10 ALA HA 1 4 17 1 2 1 1 11 GLU H . 11 GLU HN 1 4 18 1 1 1 1 11 GLU H . 11 GLU HN 1 4 18 1 2 1 1 12 LEU HA . 12 LEU HA 1 4 19 1 1 1 1 11 GLU H . 11 GLU HN 1 4 19 1 2 1 1 11 GLU QB . 11 GLU QB 1 4 20 1 1 1 1 10 ALA MB . 10 ALA QB 1 4 20 1 2 1 1 11 GLU H . 11 GLU HN 1 4 21 1 1 1 1 37 LYS H . 37 LYS HN 1 4 21 1 2 1 1 38 ARG QG . 38 ARG QG 1 4 22 1 1 1 1 37 LYS H . 37 LYS HN 1 4 22 1 2 1 1 37 LYS QB . 37 LYS QB 1 4 23 1 1 1 1 29 PRO QB . 29 PRO QB 1 4 23 1 2 1 1 32 GLN H . 32 GLN HN 1 4 24 1 1 1 1 7 SER HA . 7 SER HA 1 4 24 1 2 1 1 9 SER H . 9 SER HN 1 4 25 1 1 1 1 38 ARG HA . 38 ARG HA 1 4 25 1 2 1 1 39 PHE H . 39 PHE HN 1 4 26 1 1 1 1 48 TYR QB . 48 TYR QB 1 4 26 1 2 1 1 49 ASN H . 49 ASN HN 1 4 27 1 1 1 1 49 ASN H . 49 ASN HN 1 4 27 1 2 1 1 49 ASN QB . 49 ASN QB 1 4 28 1 1 1 1 48 TYR H . 48 TYR HN 1 4 28 1 2 1 1 48 TYR QB . 48 TYR QB 1 4 29 1 1 1 1 47 ARG QB . 47 ARG QB 1 4 29 1 2 1 1 48 TYR H . 48 TYR HN 1 4 30 1 1 1 1 39 PHE QB . 39 PHE QB 1 4 30 1 2 1 1 45 ALA H . 45 ALA HN 1 4 31 1 1 1 1 45 ALA H . 45 ALA HN 1 4 31 1 2 1 1 45 ALA MB . 45 ALA QB 1 4 32 1 1 1 1 40 CYS HB3 . 40 CYO HB1 1 4 32 1 2 1 1 41 SER H . 41 SER HN 1 4 33 1 1 1 1 21 CYS H . 21 CZN HN 1 4 33 1 2 1 1 27 TYR QD . 27 TYR QD 1 4 34 1 1 1 1 19 LEU H . 19 LEU HN 1 4 34 1 2 1 1 27 TYR QD . 27 TYR QD 1 4 35 1 1 1 1 25 GLY H . 25 GLY HN 1 4 35 1 2 1 1 26 LYS H . 26 LYS HN 1 4 36 1 1 1 1 33 PHE H . 33 PHE HN 1 4 36 1 2 1 1 34 ARG H . 34 ARG HN 1 4 37 1 1 1 1 27 TYR H . 27 TYR HN 1 4 37 1 2 1 1 27 TYR QD . 27 TYR QD 1 4 38 1 1 1 1 23 TYR H . 23 TYR HN 1 4 38 1 2 1 1 39 PHE QD . 39 PHE QD 1 4 39 1 1 1 1 37 LYS H . 37 LYS HN 1 4 39 1 2 1 1 38 ARG H . 38 ARG HN 1 4 40 1 1 1 1 24 CYS H . 24 CYO HN 1 4 40 1 2 1 1 25 GLY H . 25 GLY HN 1 4 41 1 1 1 1 40 CYS H . 40 CYO HN 1 4 41 1 2 1 1 41 SER H . 41 SER HN 1 4 42 1 1 1 1 3 ARG HA . 3 ARG HA 1 4 42 1 2 1 1 4 GLY H . 4 GLY HN 1 4 43 1 1 1 1 4 GLY H . 4 GLY HN 1 4 43 1 2 1 1 5 VAL H . 5 VAL HN 1 4 44 1 1 1 1 5 VAL H . 5 VAL HN 1 4 44 1 2 1 1 6 ASP H . 6 ASP HN 1 4 45 1 1 1 1 5 VAL HB . 5 VAL HB 1 4 45 1 2 1 1 6 ASP H . 6 ASP HN 1 4 46 1 1 1 1 6 ASP QB . 6 ASP QB 1 4 46 1 2 1 1 7 SER H . 7 SER HN 1 4 47 1 1 1 1 7 SER H . 7 SER HN 1 4 47 1 2 1 1 8 PRO QD . 8 PRO QD 1 4 48 1 1 1 1 8 PRO QD . 8 PRO QD 1 4 48 1 2 1 1 9 SER H . 9 SER HN 1 4 49 1 1 1 1 8 PRO QB . 8 PRO QB 1 4 49 1 2 1 1 9 SER H . 9 SER HN 1 4 50 1 1 1 1 9 SER H . 9 SER HN 1 4 50 1 2 1 1 10 ALA MB . 10 ALA QB 1 4 51 1 1 1 1 9 SER QB . 9 SER QB 1 4 51 1 2 1 1 10 ALA H . 10 ALA HN 1 4 52 1 1 1 1 10 ALA H . 10 ALA HN 1 4 52 1 2 1 1 11 GLU QB . 11 GLU QB 1 4 53 1 1 1 1 9 SER QB . 9 SER QB 1 4 53 1 2 1 1 11 GLU H . 11 GLU HN 1 4 54 1 1 1 1 12 LEU H . 12 LEU HN 1 4 54 1 2 1 1 12 LEU MD1 . 12 LEU QD1 1 4 55 1 1 1 1 11 GLU QB . 11 GLU QB 1 4 55 1 2 1 1 12 LEU H . 12 LEU HN 1 4 56 1 1 1 1 11 GLU H . 11 GLU HN 1 4 56 1 2 1 1 12 LEU H . 12 LEU HN 1 4 57 1 1 1 1 12 LEU MD1 . 12 LEU QD1 1 4 57 1 2 1 1 13 ASP H . 13 ASP HN 1 4 58 1 1 1 1 11 GLU QB . 11 GLU QB 1 4 58 1 2 1 1 13 ASP H . 13 ASP HN 1 4 59 1 1 1 1 13 ASP H . 13 ASP HN 1 4 59 1 2 1 1 14 LYS QB . 14 LYS QB 1 4 60 1 1 1 1 13 ASP QB . 13 ASP QB 1 4 60 1 2 1 1 14 LYS H . 14 LYS HN 1 4 61 1 1 1 1 13 ASP HA . 13 ASP HA 1 4 61 1 2 1 1 15 LYS H . 15 LYS HN 1 4 62 1 1 1 1 16 ALA H . 16 ALA HN 1 4 62 1 2 1 1 18 LEU MD2 . 18 LEU QD2 1 4 63 1 1 1 1 16 ALA H . 16 ALA HN 1 4 63 1 2 1 1 29 PRO HA . 29 PRO HA 1 4 64 1 1 1 1 15 LYS H . 15 LYS HN 1 4 64 1 2 1 1 16 ALA H . 16 ALA HN 1 4 65 1 1 1 1 16 ALA H . 16 ALA HN 1 4 65 1 2 1 1 17 ASN H . 17 ASN HN 1 4 66 1 1 1 1 17 ASN H . 17 ASN HN 1 4 66 1 2 1 1 18 LEU MD2 . 18 LEU QD2 1 4 67 1 1 1 1 17 ASN H . 17 ASN HN 1 4 67 1 2 1 1 18 LEU HG . 18 LEU HG 1 4 68 1 1 1 1 17 ASN QB . 17 ASN QB 1 4 68 1 2 1 1 18 LEU H . 18 LEU HN 1 4 69 1 1 1 1 16 ALA HA . 16 ALA HA 1 4 69 1 2 1 1 18 LEU H . 18 LEU HN 1 4 70 1 1 1 1 17 ASN H . 17 ASN HN 1 4 70 1 2 1 1 18 LEU H . 18 LEU HN 1 4 71 1 1 1 1 18 LEU H . 18 LEU HN 1 4 71 1 2 1 1 28 ALA H . 28 ALA HN 1 4 72 1 1 1 1 19 LEU H . 19 LEU HN 1 4 72 1 2 1 1 27 TYR QB . 27 TYR QB 1 4 73 1 1 1 1 19 LEU H . 19 LEU HN 1 4 73 1 2 1 1 30 ALA HA . 30 ALA HA 1 4 74 1 1 1 1 19 LEU H . 19 LEU HN 1 4 74 1 2 1 1 20 LYS HA . 20 LYS HA 1 4 75 1 1 1 1 19 LEU H . 19 LEU HN 1 4 75 1 2 1 1 27 TYR HA . 27 TYR HA 1 4 76 1 1 1 1 19 LEU H . 19 LEU HN 1 4 76 1 2 1 1 33 PHE QD . 33 PHE QD 1 4 77 1 1 1 1 19 LEU H . 19 LEU HN 1 4 77 1 2 1 1 28 ALA HA . 28 ALA HA 1 4 78 1 1 1 1 18 LEU HG . 18 LEU HG 1 4 78 1 2 1 1 19 LEU H . 19 LEU HN 1 4 79 1 1 1 1 19 LEU H . 19 LEU HN 1 4 79 1 2 1 1 28 ALA MB . 28 ALA QB 1 4 80 1 1 1 1 6 ASP H . 6 ASP HN 1 4 80 1 2 1 1 7 SER H . 7 SER HN 1 4 81 1 1 1 1 20 LYS H . 20 LYS HN 1 4 81 1 2 1 1 27 TYR HA . 27 TYR HA 1 4 82 1 1 1 1 20 LYS H . 20 LYS HN 1 4 82 1 2 1 1 27 TYR QE . 27 TYR QE 1 4 83 1 1 1 1 20 LYS H . 20 LYS HN 1 4 83 1 2 1 1 21 CYS H . 21 CZN HN 1 4 84 1 1 1 1 19 LEU H . 19 LEU HN 1 4 84 1 2 1 1 20 LYS H . 20 LYS HN 1 4 85 1 1 1 1 20 LYS QB . 20 LYS QB 1 4 85 1 2 1 1 21 CYS H . 21 CZN HN 1 4 86 1 1 1 1 21 CYS H . 21 CZN HN 1 4 86 1 2 1 1 40 CYS HB2 . 40 CYO HB2 1 4 87 1 1 1 1 21 CYS H . 21 CZN HN 1 4 87 1 2 1 1 40 CYS HB3 . 40 CYO HB1 1 4 88 1 1 1 1 21 CYS H . 21 CZN HN 1 4 88 1 2 1 1 25 GLY QA . 25 GLY QA 1 4 89 1 1 1 1 21 CYS H . 21 CZN HN 1 4 89 1 2 1 1 25 GLY H . 25 GLY HN 1 4 90 1 1 1 1 21 CYS H . 21 CZN HN 1 4 90 1 2 1 1 26 LYS H . 26 LYS HN 1 4 91 1 1 1 1 21 CYS H . 21 CZN HN 1 4 91 1 2 1 1 28 ALA H . 28 ALA HN 1 4 92 1 1 1 1 20 LYS QG . 20 LYS QG 1 4 92 1 2 1 1 22 GLU H . 22 GLU HN 1 4 93 1 1 1 1 22 GLU H . 22 GLU HN 1 4 93 1 2 1 1 38 ARG QB . 38 ARG QB 1 4 94 1 1 1 1 22 GLU H . 22 GLU HN 1 4 94 1 2 1 1 39 PHE QB . 39 PHE QB 1 4 95 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 4 95 1 2 1 1 22 GLU H . 22 GLU HN 1 4 96 1 1 1 1 21 CYS HB2 . 21 CZN HB2 1 4 96 1 2 1 1 22 GLU H . 22 GLU HN 1 4 97 1 1 1 1 22 GLU H . 22 GLU HN 1 4 97 1 2 1 1 38 ARG HA . 38 ARG HA 1 4 98 1 1 1 1 22 GLU H . 22 GLU HN 1 4 98 1 2 1 1 23 TYR HA . 23 TYR HA 1 4 99 1 1 1 1 22 GLU H . 22 GLU HN 1 4 99 1 2 1 1 39 PHE QD . 39 PHE QD 1 4 100 1 1 1 1 22 GLU H . 22 GLU HN 1 4 100 1 2 1 1 25 GLY H . 25 GLY HN 1 4 101 1 1 1 1 22 GLU H . 22 GLU HN 1 4 101 1 2 1 1 39 PHE H . 39 PHE HN 1 4 102 1 1 1 1 22 GLU H . 22 GLU HN 1 4 102 1 2 1 1 38 ARG H . 38 ARG HN 1 4 103 1 1 1 1 21 CYS H . 21 CZN HN 1 4 103 1 2 1 1 22 GLU H . 22 GLU HN 1 4 104 1 1 1 1 22 GLU H . 22 GLU HN 1 4 104 1 2 1 1 40 CYS H . 40 CYO HN 1 4 105 1 1 1 1 22 GLU QB . 22 GLU QB 1 4 105 1 2 1 1 23 TYR H . 23 TYR HN 1 4 106 1 1 1 1 22 GLU QG . 22 GLU QG 1 4 106 1 2 1 1 23 TYR H . 23 TYR HN 1 4 107 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 4 107 1 2 1 1 23 TYR H . 23 TYR HN 1 4 108 1 1 1 1 23 TYR H . 23 TYR HN 1 4 108 1 2 1 1 44 CYS HB3 . 44 CYO HB1 1 4 109 1 1 1 1 23 TYR H . 23 TYR HN 1 4 109 1 2 1 1 39 PHE HA . 39 PHE HA 1 4 110 1 1 1 1 23 TYR H . 23 TYR HN 1 4 110 1 2 1 1 24 CYS H . 24 CYO HN 1 4 111 1 1 1 1 23 TYR H . 23 TYR HN 1 4 111 1 2 1 1 40 CYS H . 40 CYO HN 1 4 112 1 1 1 1 21 CYS HB3 . 21 CZN HB1 1 4 112 1 2 1 1 24 CYS H . 24 CYO HN 1 4 113 1 1 1 1 23 TYR HA . 23 TYR HA 1 4 113 1 2 1 1 24 CYS H . 24 CYO HN 1 4 114 1 1 1 1 24 CYS H . 24 CYO HN 1 4 114 1 2 1 1 39 PHE HA . 39 PHE HA 1 4 115 1 1 1 1 24 CYS H . 24 CYO HN 1 4 115 1 2 1 1 39 PHE QE . 39 PHE QE 1 4 116 1 1 1 1 21 CYS H . 21 CZN HN 1 4 116 1 2 1 1 24 CYS H . 24 CYO HN 1 4 117 1 1 1 1 22 GLU H . 22 GLU HN 1 4 117 1 2 1 1 24 CYS H . 24 CYO HN 1 4 118 1 1 1 1 24 CYS H . 24 CYO HN 1 4 118 1 2 1 1 40 CYS H . 40 CYO HN 1 4 119 1 1 1 1 20 LYS QG . 20 LYS QG 1 4 119 1 2 1 1 25 GLY H . 25 GLY HN 1 4 120 1 1 1 1 25 GLY H . 25 GLY HN 1 4 120 1 2 1 1 26 LYS QG . 26 LYS QG 1 4 121 1 1 1 1 25 GLY H . 25 GLY HN 1 4 121 1 2 1 1 26 LYS QB . 26 LYS QB 1 4 122 1 1 1 1 23 TYR H . 23 TYR HN 1 4 122 1 2 1 1 25 GLY H . 25 GLY HN 1 4 123 1 1 1 1 26 LYS H . 26 LYS HN 1 4 123 1 2 1 1 27 TYR HA . 27 TYR HA 1 4 124 1 1 1 1 26 LYS H . 26 LYS HN 1 4 124 1 2 1 1 27 TYR H . 27 TYR HN 1 4 125 1 1 1 1 23 TYR H . 23 TYR HN 1 4 125 1 2 1 1 26 LYS H . 26 LYS HN 1 4 126 1 1 1 1 18 LEU MD1 . 18 LEU QD1 1 4 126 1 2 1 1 27 TYR H . 27 TYR HN 1 4 127 1 1 1 1 18 LEU QB . 18 LEU QB 1 4 127 1 2 1 1 27 TYR H . 27 TYR HN 1 4 128 1 1 1 1 26 LYS QG . 26 LYS QG 1 4 128 1 2 1 1 27 TYR H . 27 TYR HN 1 4 129 1 1 1 1 20 LYS HA . 20 LYS HA 1 4 129 1 2 1 1 27 TYR H . 27 TYR HN 1 4 130 1 1 1 1 27 TYR H . 27 TYR HN 1 4 130 1 2 1 1 28 ALA HA . 28 ALA HA 1 4 131 1 1 1 1 27 TYR H . 27 TYR HN 1 4 131 1 2 1 1 27 TYR QE . 27 TYR QE 1 4 132 1 1 1 1 21 CYS H . 21 CZN HN 1 4 132 1 2 1 1 27 TYR H . 27 TYR HN 1 4 133 1 1 1 1 27 TYR H . 27 TYR HN 1 4 133 1 2 1 1 28 ALA H . 28 ALA HN 1 4 134 1 1 1 1 19 LEU H . 19 LEU HN 1 4 134 1 2 1 1 28 ALA H . 28 ALA HN 1 4 135 1 1 1 1 20 LYS H . 20 LYS HN 1 4 135 1 2 1 1 28 ALA H . 28 ALA HN 1 4 136 1 1 1 1 18 LEU HA . 18 LEU HA 1 4 136 1 2 1 1 28 ALA H . 28 ALA HN 1 4 137 1 1 1 1 19 LEU HA . 19 LEU HA 1 4 137 1 2 1 1 28 ALA H . 28 ALA HN 1 4 138 1 1 1 1 18 LEU QB . 18 LEU QB 1 4 138 1 2 1 1 28 ALA H . 28 ALA HN 1 4 139 1 1 1 1 19 LEU QD . 19 LEU QD1 1 4 139 1 2 1 1 28 ALA H . 28 ALA HN 1 4 140 1 1 1 1 18 LEU MD1 . 18 LEU QD1 1 4 140 1 2 1 1 28 ALA H . 28 ALA HN 1 4 141 1 1 1 1 19 LEU HG . 19 LEU HG 1 4 141 1 2 1 1 30 ALA H . 30 ALA HN 1 4 142 1 1 1 1 28 ALA MB . 28 ALA QB 1 4 142 1 2 1 1 30 ALA H . 30 ALA HN 1 4 143 1 1 1 1 18 LEU HG . 18 LEU HG 1 4 143 1 2 1 1 30 ALA H . 30 ALA HN 1 4 144 1 1 1 1 18 LEU QB . 18 LEU QB 1 4 144 1 2 1 1 30 ALA H . 30 ALA HN 1 4 145 1 1 1 1 17 ASN QB . 17 ASN QB 1 4 145 1 2 1 1 30 ALA H . 30 ALA HN 1 4 146 1 1 1 1 17 ASN QD . 17 ASN QD2 1 4 146 1 2 1 1 30 ALA H . 30 ALA HN 1 4 147 1 1 1 1 30 ALA H . 30 ALA HN 1 4 147 1 2 1 1 33 PHE QD . 33 PHE QD 1 4 148 1 1 1 1 18 LEU H . 18 LEU HN 1 4 148 1 2 1 1 30 ALA H . 30 ALA HN 1 4 149 1 1 1 1 30 ALA H . 30 ALA HN 1 4 149 1 2 1 1 31 GLU H . 31 GLU HN 1 4 150 1 1 1 1 29 PRO HA . 29 PRO HA 1 4 150 1 2 1 1 31 GLU H . 31 GLU HN 1 4 151 1 1 1 1 29 PRO QB . 29 PRO QB 1 4 151 1 2 1 1 31 GLU H . 31 GLU HN 1 4 152 1 1 1 1 30 ALA MB . 30 ALA QB 1 4 152 1 2 1 1 32 GLN H . 32 GLN HN 1 4 153 1 1 1 1 32 GLN H . 32 GLN HN 1 4 153 1 2 1 1 33 PHE QB . 33 PHE QB 1 4 154 1 1 1 1 32 GLN H . 32 GLN HN 1 4 154 1 2 1 1 33 PHE QD . 33 PHE QD 1 4 155 1 1 1 1 32 GLN H . 32 GLN HN 1 4 155 1 2 1 1 33 PHE H . 33 PHE HN 1 4 156 1 1 1 1 30 ALA H . 30 ALA HN 1 4 156 1 2 1 1 32 GLN H . 32 GLN HN 1 4 157 1 1 1 1 31 GLU H . 31 GLU HN 1 4 157 1 2 1 1 32 GLN H . 32 GLN HN 1 4 158 1 1 1 1 31 GLU H . 31 GLU HN 1 4 158 1 2 1 1 33 PHE H . 33 PHE HN 1 4 159 1 1 1 1 19 LEU QD . 19 LEU QD1 1 4 159 1 2 1 1 33 PHE H . 33 PHE HN 1 4 160 1 1 1 1 30 ALA MB . 30 ALA QB 1 4 160 1 2 1 1 33 PHE H . 33 PHE HN 1 4 161 1 1 1 1 32 GLN QB . 32 GLN QB 1 4 161 1 2 1 1 33 PHE H . 33 PHE HN 1 4 162 1 1 1 1 32 GLN QG . 32 GLN QG 1 4 162 1 2 1 1 33 PHE H . 33 PHE HN 1 4 163 1 1 1 1 30 ALA HA . 30 ALA HA 1 4 163 1 2 1 1 33 PHE H . 33 PHE HN 1 4 164 1 1 1 1 33 PHE H . 33 PHE HN 1 4 164 1 2 1 1 37 LYS HA . 37 LYS HA 1 4 165 1 1 1 1 30 ALA H . 30 ALA HN 1 4 165 1 2 1 1 33 PHE H . 33 PHE HN 1 4 166 1 1 1 1 34 ARG H . 34 ARG HN 1 4 166 1 2 1 1 35 GLY H . 35 GLY HN 1 4 167 1 1 1 1 33 PHE QD . 33 PHE QD 1 4 167 1 2 1 1 34 ARG H . 34 ARG HN 1 4 168 1 1 1 1 31 GLU HA . 31 GLU HA 1 4 168 1 2 1 1 34 ARG H . 34 ARG HN 1 4 169 1 1 1 1 33 PHE QB . 33 PHE QB 1 4 169 1 2 1 1 34 ARG H . 34 ARG HN 1 4 170 1 1 1 1 34 ARG QB . 34 ARG QB 1 4 170 1 2 1 1 35 GLY H . 35 GLY HN 1 4 171 1 1 1 1 35 GLY H . 35 GLY HN 1 4 171 1 2 1 1 35 GLY QA . 35 GLY QA 1 4 172 1 1 1 1 37 LYS QB . 37 LYS QB 1 4 172 1 2 1 1 38 ARG H . 38 ARG HN 1 4 173 1 1 1 1 38 ARG H . 38 ARG HN 1 4 173 1 2 1 1 39 PHE QB . 39 PHE QB 1 4 174 1 1 1 1 38 ARG H . 38 ARG HN 1 4 174 1 2 1 1 38 ARG QD . 38 ARG QD 1 4 175 1 1 1 1 36 SER HA . 36 SER HA 1 4 175 1 2 1 1 38 ARG H . 38 ARG HN 1 4 176 1 1 1 1 38 ARG H . 38 ARG HN 1 4 176 1 2 1 1 39 PHE HA . 39 PHE HA 1 4 177 1 1 1 1 33 PHE QD . 33 PHE QD 1 4 177 1 2 1 1 38 ARG H . 38 ARG HN 1 4 178 1 1 1 1 38 ARG H . 38 ARG HN 1 4 178 1 2 1 1 39 PHE QD . 39 PHE QD 1 4 179 1 1 1 1 38 ARG QB . 38 ARG QB 1 4 179 1 2 1 1 39 PHE H . 39 PHE HN 1 4 180 1 1 1 1 38 ARG QG . 38 ARG QG 1 4 180 1 2 1 1 39 PHE H . 39 PHE HN 1 4 181 1 1 1 1 37 LYS QB . 37 LYS QB 1 4 181 1 2 1 1 39 PHE H . 39 PHE HN 1 4 182 1 1 1 1 38 ARG QD . 38 ARG QD 1 4 182 1 2 1 1 39 PHE H . 39 PHE HN 1 4 183 1 1 1 1 33 PHE QD . 33 PHE QD 1 4 183 1 2 1 1 39 PHE H . 39 PHE HN 1 4 184 1 1 1 1 39 PHE H . 39 PHE HN 1 4 184 1 2 1 1 39 PHE QD . 39 PHE QD 1 4 185 1 1 1 1 37 LYS H . 37 LYS HN 1 4 185 1 2 1 1 39 PHE H . 39 PHE HN 1 4 186 1 1 1 1 39 PHE H . 39 PHE HN 1 4 186 1 2 1 1 40 CYS H . 40 CYO HN 1 4 187 1 1 1 1 32 GLN QE . 32 GLN QE2 1 4 187 1 2 1 1 40 CYS H . 40 CYO HN 1 4 188 1 1 1 1 33 PHE QD . 33 PHE QD 1 4 188 1 2 1 1 40 CYS H . 40 CYO HN 1 4 189 1 1 1 1 40 CYS H . 40 CYO HN 1 4 189 1 2 1 1 44 CYS H . 44 CYO HN 1 4 190 1 1 1 1 21 CYS H . 21 CZN HN 1 4 190 1 2 1 1 40 CYS H . 40 CYO HN 1 4 191 1 1 1 1 28 ALA MB . 28 ALA QB 1 4 191 1 2 1 1 41 SER H . 41 SER HN 1 4 192 1 1 1 1 40 CYS HB2 . 40 CYO HB2 1 4 192 1 2 1 1 41 SER H . 41 SER HN 1 4 193 1 1 1 1 42 MET QG . 42 MET QG 1 4 193 1 2 1 1 43 THR H . 43 THR HN 1 4 194 1 1 1 1 43 THR H . 43 THR HN 1 4 194 1 2 1 1 45 ALA H . 45 ALA HN 1 4 195 1 1 1 1 44 CYS H . 44 CYO HN 1 4 195 1 2 1 1 47 ARG QB . 47 ARG QB 1 4 196 1 1 1 1 44 CYS H . 44 CYO HN 1 4 196 1 2 1 1 46 LYS QB . 46 LYS QB 1 4 197 1 1 1 1 42 MET QB . 42 MET QB 1 4 197 1 2 1 1 44 CYS H . 44 CYO HN 1 4 198 1 1 1 1 44 CYS H . 44 CYO HN 1 4 198 1 2 1 1 45 ALA HA . 45 ALA HA 1 4 199 1 1 1 1 44 CYS H . 44 CYO HN 1 4 199 1 2 1 1 45 ALA H . 45 ALA HN 1 4 200 1 1 1 1 42 MET QB . 42 MET QB 1 4 200 1 2 1 1 45 ALA H . 45 ALA HN 1 4 201 1 1 1 1 44 CYS HA . 44 CYO HA 1 4 201 1 2 1 1 45 ALA H . 45 ALA HN 1 4 202 1 1 1 1 43 THR HA . 43 THR HA 1 4 202 1 2 1 1 45 ALA H . 45 ALA HN 1 4 203 1 1 1 1 45 ALA H . 45 ALA HN 1 4 203 1 2 1 1 46 LYS HA . 46 LYS HA 1 4 204 1 1 1 1 45 ALA H . 45 ALA HN 1 4 204 1 2 1 1 46 LYS H . 46 LYS HN 1 4 205 1 1 1 1 40 CYS H . 40 CYO HN 1 4 205 1 2 1 1 45 ALA H . 45 ALA HN 1 4 206 1 1 1 1 46 LYS H . 46 LYS HN 1 4 206 1 2 1 1 47 ARG QB . 47 ARG QB 1 4 207 1 1 1 1 44 CYS HA . 44 CYO HA 1 4 207 1 2 1 1 46 LYS H . 46 LYS HN 1 4 208 1 1 1 1 43 THR H . 43 THR HN 1 4 208 1 2 1 1 46 LYS H . 46 LYS HN 1 4 209 1 1 1 1 45 ALA HA . 45 ALA HA 1 4 209 1 2 1 1 47 ARG H . 47 ARG HN 1 4 210 1 1 1 1 47 ARG H . 47 ARG HN 1 4 210 1 2 1 1 48 TYR HA . 48 TYR HA 1 4 211 1 1 1 1 45 ALA HA . 45 ALA HA 1 4 211 1 2 1 1 48 TYR H . 48 TYR HN 1 4 212 1 1 1 1 44 CYS HA . 44 CYO HA 1 4 212 1 2 1 1 48 TYR H . 48 TYR HN 1 4 213 1 1 1 1 46 LYS H . 46 LYS HN 1 4 213 1 2 1 1 48 TYR H . 48 TYR HN 1 4 214 1 1 1 1 47 ARG QB . 47 ARG QB 1 4 214 1 2 1 1 49 ASN H . 49 ASN HN 1 4 215 1 1 1 1 45 ALA MB . 45 ALA QB 1 4 215 1 2 1 1 49 ASN H . 49 ASN HN 1 4 216 1 1 1 1 45 ALA HA . 45 ALA HA 1 4 216 1 2 1 1 49 ASN H . 49 ASN HN 1 4 217 1 1 1 1 47 ARG HA . 47 ARG HA 1 4 217 1 2 1 1 49 ASN H . 49 ASN HN 1 4 218 1 1 1 1 46 LYS HA . 46 LYS HA 1 4 218 1 2 1 1 49 ASN H . 49 ASN HN 1 4 219 1 1 1 1 5 VAL H . 5 VAL HN 1 4 219 1 2 1 1 7 SER HA . 7 SER HA 1 4 220 1 1 1 1 10 ALA H . 10 ALA HN 1 4 220 1 2 1 1 11 GLU QG . 11 GLU QG 1 4 221 1 1 1 1 9 SER HA . 9 SER HA 1 4 221 1 2 1 1 11 GLU H . 11 GLU HN 1 4 222 1 1 1 1 17 ASN H . 17 ASN HN 1 4 222 1 2 1 1 30 ALA H . 30 ALA HN 1 4 223 1 1 1 1 29 PRO QD . 29 PRO QD 1 4 223 1 2 1 1 30 ALA H . 30 ALA HN 1 4 224 1 1 1 1 19 LEU HG . 19 LEU HG 1 4 224 1 2 1 1 20 LYS H . 20 LYS HN 1 4 225 1 1 1 1 21 CYS H . 21 CZN HN 1 4 225 1 2 1 1 26 LYS HA . 26 LYS HA 1 4 226 1 1 1 1 23 TYR H . 23 TYR HN 1 4 226 1 2 1 1 39 PHE QE . 39 PHE QE 1 4 227 1 1 1 1 24 CYS H . 24 CYO HN 1 4 227 1 2 1 1 25 GLY QA . 25 GLY QA 1 4 228 1 1 1 1 25 GLY H . 25 GLY HN 1 4 228 1 2 1 1 26 LYS HA . 26 LYS HA 1 4 229 1 1 1 1 20 LYS QB . 20 LYS QB 1 4 229 1 2 1 1 26 LYS H . 26 LYS HN 1 4 230 1 1 1 1 20 LYS HA . 20 LYS HA 1 4 230 1 2 1 1 26 LYS H . 26 LYS HN 1 4 231 1 1 1 1 30 ALA H . 30 ALA HN 1 4 231 1 2 1 1 33 PHE QB . 33 PHE QB 1 4 232 1 1 1 1 28 ALA HA . 28 ALA HA 1 4 232 1 2 1 1 30 ALA H . 30 ALA HN 1 4 233 1 1 1 1 31 GLU H . 31 GLU HN 1 4 233 1 2 1 1 33 PHE QD . 33 PHE QD 1 4 234 1 1 1 1 29 PRO QD . 29 PRO QD 1 4 234 1 2 1 1 32 GLN H . 32 GLN HN 1 4 235 1 1 1 1 32 GLN QB . 32 GLN QB 1 4 235 1 2 1 1 34 ARG H . 34 ARG HN 1 4 236 1 1 1 1 26 LYS H . 26 LYS HN 1 4 236 1 2 1 1 40 CYS H . 40 CYO HN 1 4 237 1 1 1 1 40 CYS HA . 40 CYO HA 1 4 237 1 2 1 1 41 SER H . 41 SER HN 1 4 238 1 1 1 1 41 SER H . 41 SER HN 1 4 238 1 2 1 1 42 MET H . 42 MET HN 1 4 239 1 1 1 1 43 THR H . 43 THR HN 1 4 239 1 2 1 1 44 CYS HA . 44 CYO HA 1 4 240 1 1 1 1 42 MET H . 42 MET HN 1 4 240 1 2 1 1 43 THR H . 43 THR HN 1 4 241 1 1 1 1 39 PHE H . 39 PHE HN 1 4 241 1 2 1 1 45 ALA H . 45 ALA HN 1 4 242 1 1 1 1 44 CYS H . 44 CYO HN 1 4 242 1 2 1 1 46 LYS H . 46 LYS HN 1 4 243 1 1 1 1 46 LYS H . 46 LYS HN 1 4 243 1 2 1 1 47 ARG H . 47 ARG HN 1 4 244 1 1 1 1 44 CYS H . 44 CYO HN 1 4 244 1 2 1 1 47 ARG H . 47 ARG HN 1 4 245 1 1 1 1 46 LYS HA . 46 LYS HA 1 4 245 1 2 1 1 48 TYR H . 48 TYR HN 1 4 246 1 1 1 1 47 ARG H . 47 ARG HN 1 4 246 1 2 1 1 48 TYR H . 48 TYR HN 1 4 247 1 1 1 1 48 TYR H . 48 TYR HN 1 4 247 1 2 1 1 49 ASN H . 49 ASN HN 1 4 248 1 1 1 1 48 TYR HA . 48 TYR HA 1 4 248 1 2 1 1 49 ASN H . 49 ASN HN 1 4 249 1 1 1 1 14 LYS H . 14 LYS HN 1 4 249 1 2 1 1 15 LYS H . 15 LYS HN 1 4 250 1 1 1 1 13 ASP QB . 13 ASP QB 1 4 250 1 2 1 1 15 LYS H . 15 LYS HN 1 4 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 1.8 3.6 1 4 2 1 . . . . . . 1.9 3.8 1 4 3 1 . . . . . . 2.0 4.5 1 4 4 1 . . . . . . 1.8 3.8 1 4 5 1 . . . . . . 1.9 5.5 1 4 6 1 . . . . . . 2.0 5.8 1 4 7 1 . . . . . . 0.0 6.0 1 4 8 1 . . . . . . 2.0 5.6 1 4 9 1 . . . . . . 1.5 2.5 1 4 10 1 . . . . . . 2.0 5.8 1 4 11 1 . . . . . . 2.0 5.6 1 4 12 1 . . . . . . 1.9 4.3 1 4 13 1 . . . . . . 2.0 6.0 1 4 14 1 . . . . . . 2.0 5.6 1 4 15 1 . . . . . . 1.5 2.7 1 4 16 1 . . . . . . 2.0 5.4 1 4 17 1 . . . . . . 1.8 3.6 1 4 18 1 . . . . . . 0.0 6.0 1 4 19 1 . . . . . . 2.0 3.4 1 4 20 1 . . . . . . 2.0 5.0 1 4 21 1 . . . . . . 1.9 6.0 1 4 22 1 . . . . . . 1.9 4.5 1 4 23 1 . . . . . . 1.9 6.0 1 4 24 1 . . . . . . 1.9 4.3 1 4 25 1 . . . . . . 2.0 4.4 1 4 26 1 . . . . . . 1.9 5.1 1 4 27 1 . . . . . . 2.0 5.2 1 4 28 1 . . . . . . 1.7 3.1 1 4 29 1 . . . . . . 1.8 6.0 1 4 30 1 . . . . . . 2.0 5.8 1 4 31 1 . . . . . . 1.6 3.0 1 4 32 1 . . . . . . 1.9 6.0 1 4 33 1 . . . . . . 0.0 6.0 1 4 34 1 . . . . . . 0.0 6.0 1 4 35 1 . . . . . . 1.7 3.3 1 4 36 1 . . . . . . 2.0 4.3 1 4 37 1 . . . . . . 1.8 3.8 1 4 38 1 . . . . . . 1.8 3.6 1 4 39 1 . . . . . . 1.9 3.8 1 4 40 1 . . . . . . 1.6 2.8 1 4 41 1 . . . . . . 1.9 4.9 1 4 42 1 . . . . . . 2.0 5.4 1 4 43 1 . . . . . . 1.8 6.0 1 4 44 1 . . . . . . 1.9 5.5 1 4 45 1 . . . . . . 2.0 6.0 1 4 46 1 . . . . . . 2.0 6.0 1 4 47 1 . . . . . . 1.0 6.0 1 4 48 1 . . . . . . 2.0 6.0 1 4 49 1 . . . . . . 2.0 6.0 1 4 50 1 . . . . . . 0.0 6.0 1 4 51 1 . . . . . . 2.0 5.8 1 4 52 1 . . . . . . 1.8 6.0 1 4 53 1 . . . . . . 2.0 6.0 1 4 54 1 . . . . . . 2.0 6.0 1 4 55 1 . . . . . . 2.0 4.3 1 4 56 1 . . . . . . 2.0 4.0 1 4 57 1 . . . . . . 2.0 5.0 1 4 58 1 . . . . . . 1.9 6.0 1 4 59 1 . . . . . . 1.9 6.0 1 4 60 1 . . . . . . 2.0 5.6 1 4 61 1 . . . . . . 1.9 5.1 1 4 62 1 . . . . . . 1.9 6.0 1 4 63 1 . . . . . . 1.9 6.0 1 4 64 1 . . . . . . 1.9 4.3 1 4 65 1 . . . . . . 2.0 4.6 1 4 66 1 . . . . . . 1.9 6.0 1 4 67 1 . . . . . . 2.0 6.0 1 4 68 1 . . . . . . 2.0 5.8 1 4 69 1 . . . . . . 2.0 5.6 1 4 70 1 . . . . . . 1.9 4.3 1 4 71 1 . . . . . . 0.0 6.0 1 4 72 1 . . . . . . 2.0 6.0 1 4 73 1 . . . . . . 2.0 6.0 1 4 74 1 . . . . . . 2.0 6.0 1 4 75 1 . . . . . . 2.0 6.0 1 4 76 1 . . . . . . 2.0 6.0 1 4 77 1 . . . . . . 2.0 6.0 1 4 78 1 . . . . . . 1.9 6.0 1 4 79 1 . . . . . . 2.0 6.0 1 4 80 1 . . . . . . 2.0 5.6 1 4 81 1 . . . . . . 1.9 6.0 1 4 82 1 . . . . . . 2.0 6.0 1 4 83 1 . . . . . . 2.0 6.0 1 4 84 1 . . . . . . 2.0 6.0 1 4 85 1 . . . . . . 2.0 4.3 1 4 86 1 . . . . . . 2.0 6.0 1 4 87 1 . . . . . . 2.0 5.8 1 4 88 1 . . . . . . 1.8 6.0 1 4 89 1 . . . . . . 2.0 6.0 1 4 90 1 . . . . . . 1.9 4.7 1 4 91 1 . . . . . . 1.9 6.0 1 4 92 1 . . . . . . 1.9 6.0 1 4 93 1 . . . . . . 2.0 6.0 1 4 94 1 . . . . . . 1.6 6.0 1 4 95 1 . . . . . . 2.0 6.0 1 4 96 1 . . . . . . 1.9 6.0 1 4 97 1 . . . . . . 2.0 6.0 1 4 98 1 . . . . . . 1.5 6.0 1 4 99 1 . . . . . . 2.0 5.0 1 4 100 1 . . . . . . 1.7 6.0 1 4 101 1 . . . . . . 1.7 6.0 1 4 102 1 . . . . . . 1.7 6.0 1 4 103 1 . . . . . . 1.9 6.0 1 4 104 1 . . . . . . 1.5 6.0 1 4 105 1 . . . . . . 2.0 5.2 1 4 106 1 . . . . . . 2.0 5.3 1 4 107 1 . . . . . . 2.0 5.8 1 4 108 1 . . . . . . 0.0 6.0 1 4 109 1 . . . . . . 2.0 6.0 1 4 110 1 . . . . . . 1.7 3.1 1 4 111 1 . . . . . . 1.6 6.0 1 4 112 1 . . . . . . 1.9 4.5 1 4 113 1 . . . . . . 2.0 5.4 1 4 114 1 . . . . . . 0.0 6.0 1 4 115 1 . . . . . . 0.0 6.0 1 4 116 1 . . . . . . 1.7 6.0 1 4 117 1 . . . . . . 1.9 6.0 1 4 118 1 . . . . . . 0.0 6.0 1 4 119 1 . . . . . . 2.0 6.0 1 4 120 1 . . . . . . 0.6 6.0 1 4 121 1 . . . . . . 1.9 6.0 1 4 122 1 . . . . . . 2.0 5.8 1 4 123 1 . . . . . . 0.0 6.0 1 4 124 1 . . . . . . 2.0 6.0 1 4 125 1 . . . . . . 2.0 6.0 1 4 126 1 . . . . . . 1.8 6.0 1 4 127 1 . . . . . . 1.9 6.0 1 4 128 1 . . . . . . 2.0 6.0 1 4 129 1 . . . . . . 1.9 6.0 1 4 130 1 . . . . . . 0.4 6.0 1 4 131 1 . . . . . . 1.8 6.0 1 4 132 1 . . . . . . 1.8 6.0 1 4 133 1 . . . . . . 1.9 6.0 1 4 134 1 . . . . . . 1.8 3.6 1 4 135 1 . . . . . . 1.8 6.0 1 4 136 1 . . . . . . 1.9 6.0 1 4 137 1 . . . . . . 2.0 6.0 1 4 138 1 . . . . . . 1.9 4.2 1 4 139 1 . . . . . . 2.0 5.4 1 4 140 1 . . . . . . 2.0 6.0 1 4 141 1 . . . . . . 2.0 6.0 1 4 142 1 . . . . . . 0.0 6.0 1 4 143 1 . . . . . . 2.0 5.8 1 4 144 1 . . . . . . 2.0 6.0 1 4 145 1 . . . . . . 2.0 4.7 1 4 146 1 . . . . . . 2.0 6.0 1 4 147 1 . . . . . . 2.0 6.0 1 4 148 1 . . . . . . 2.0 6.0 1 4 149 1 . . . . . . 1.9 4.1 1 4 150 1 . . . . . . 2.0 6.0 1 4 151 1 . . . . . . 2.0 5.4 1 4 152 1 . . . . . . 2.0 6.0 1 4 153 1 . . . . . . 2.0 6.0 1 4 154 1 . . . . . . 1.9 4.9 1 4 155 1 . . . . . . 1.7 3.3 1 4 156 1 . . . . . . 2.0 6.0 1 4 157 1 . . . . . . 1.7 3.5 1 4 158 1 . . . . . . 2.0 6.0 1 4 159 1 . . . . . . 2.0 6.0 1 4 160 1 . . . . . . 2.0 6.0 1 4 161 1 . . . . . . 2.0 4.7 1 4 162 1 . . . . . . 1.9 6.0 1 4 163 1 . . . . . . 2.0 5.6 1 4 164 1 . . . . . . 0.4 6.0 1 4 165 1 . . . . . . 1.7 6.0 1 4 166 1 . . . . . . 2.0 6.0 1 4 167 1 . . . . . . 1.9 6.0 1 4 168 1 . . . . . . 0.0 6.0 1 4 169 1 . . . . . . 1.9 5.1 1 4 170 1 . . . . . . 2.0 6.0 1 4 171 1 . . . . . . 2.0 5.1 1 4 172 1 . . . . . . 2.0 5.1 1 4 173 1 . . . . . . 1.8 6.0 1 4 174 1 . . . . . . 1.9 6.0 1 4 175 1 . . . . . . 2.0 6.0 1 4 176 1 . . . . . . 1.6 6.0 1 4 177 1 . . . . . . 2.0 5.6 1 4 178 1 . . . . . . 1.9 6.0 1 4 179 1 . . . . . . 2.0 5.2 1 4 180 1 . . . . . . 2.0 6.0 1 4 181 1 . . . . . . 2.0 6.0 1 4 182 1 . . . . . . 1.7 6.0 1 4 183 1 . . . . . . 1.9 4.3 1 4 184 1 . . . . . . 1.8 4.0 1 4 185 1 . . . . . . 1.9 6.0 1 4 186 1 . . . . . . 2.0 6.0 1 4 187 1 . . . . . . 2.0 5.8 1 4 188 1 . . . . . . 1.2 6.0 1 4 189 1 . . . . . . 1.7 6.0 1 4 190 1 . . . . . . 1.8 6.0 1 4 191 1 . . . . . . 1.9 6.0 1 4 192 1 . . . . . . 2.0 6.0 1 4 193 1 . . . . . . 1.8 6.0 1 4 194 1 . . . . . . 2.0 6.0 1 4 195 1 . . . . . . 1.9 6.0 1 4 196 1 . . . . . . 1.9 6.0 1 4 197 1 . . . . . . 0.0 6.0 1 4 198 1 . . . . . . 1.6 6.0 1 4 199 1 . . . . . . 1.8 3.6 1 4 200 1 . . . . . . 0.0 6.0 1 4 201 1 . . . . . . 2.0 5.4 1 4 202 1 . . . . . . 2.0 6.0 1 4 203 1 . . . . . . 1.8 6.0 1 4 204 1 . . . . . . 1.7 3.5 1 4 205 1 . . . . . . 1.8 6.0 1 4 206 1 . . . . . . 1.8 6.0 1 4 207 1 . . . . . . 2.0 6.0 1 4 208 1 . . . . . . 1.9 6.0 1 4 209 1 . . . . . . 2.0 6.0 1 4 210 1 . . . . . . 1.6 6.0 1 4 211 1 . . . . . . 1.9 5.1 1 4 212 1 . . . . . . 2.0 6.0 1 4 213 1 . . . . . . 2.0 5.8 1 4 214 1 . . . . . . 2.0 5.6 1 4 215 1 . . . . . . 1.6 6.0 1 4 216 1 . . . . . . 2.0 6.0 1 4 217 1 . . . . . . 2.0 6.0 1 4 218 1 . . . . . . 2.0 6.0 1 4 219 1 . . . . . . 0.0 6.0 1 4 220 1 . . . . . . 1.3 6.0 1 4 221 1 . . . . . . 1.7 6.0 1 4 222 1 . . . . . . 1.6 6.0 1 4 223 1 . . . . . . 1.9 6.0 1 4 224 1 . . . . . . 2.0 6.0 1 4 225 1 . . . . . . 1.9 6.0 1 4 226 1 . . . . . . 2.0 5.2 1 4 227 1 . . . . . . 2.0 6.0 1 4 228 1 . . . . . . 0.9 6.0 1 4 229 1 . . . . . . 1.9 6.0 1 4 230 1 . . . . . . 1.9 6.0 1 4 231 1 . . . . . . 1.2 6.0 1 4 232 1 . . . . . . 1.6 6.0 1 4 233 1 . . . . . . 1.8 6.0 1 4 234 1 . . . . . . 2.0 6.0 1 4 235 1 . . . . . . 1.8 6.0 1 4 236 1 . . . . . . 1.8 6.0 1 4 237 1 . . . . . . 0.0 6.0 1 4 238 1 . . . . . . 1.5 6.0 1 4 239 1 . . . . . . 0.8 6.0 1 4 240 1 . . . . . . 1.9 6.0 1 4 241 1 . . . . . . 1.6 6.0 1 4 242 1 . . . . . . 1.9 6.0 1 4 243 1 . . . . . . 1.7 3.3 1 4 244 1 . . . . . . 2.0 6.0 1 4 245 1 . . . . . . 2.0 6.0 1 4 246 1 . . . . . . 0.0 6.0 1 4 247 1 . . . . . . 1.7 3.3 1 4 248 1 . . . . . . 0.0 6.0 1 4 249 1 . . . . . . 1.9 3.9 1 4 250 1 . . . . . . 0.0 6.0 1 4 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 5 _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 5 2 1 . . . 1 5 3 1 . . . 1 5 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 12 LEU QB . 12 LEU QB 1 5 1 1 2 1 1 15 LYS H . 15 LYS HN 1 5 2 1 1 1 1 12 LEU HG . 12 LEU HG 1 5 2 1 2 1 1 15 LYS H . 15 LYS HN 1 5 3 1 1 1 1 28 ALA H . 28 ALA HN 1 5 3 1 2 1 1 33 PHE HZ . 33 PHE HZ 1 5 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 . . . . . . 6.0 . 1 5 2 1 . . . . . . 6.0 . 1 5 3 1 . . . . . . 3.9 . 1 5 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 GLY C C -18.811 5.110 4.597 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -18.802 5.604 6.028 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -19.511 5.052 7.909 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -18.909 3.760 6.991 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -20.417 4.429 6.618 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -19.321 6.547 6.076 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -17.779 5.749 6.344 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -19.456 4.646 6.949 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -19.314 4.021 4.317 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 THR C C -16.975 4.826 1.866 1.00 . A A . 2 THR C 1 1 1 11 1 1 2 THR CA C -18.249 5.559 2.277 1.00 . A A . 2 THR CA 1 1 1 12 1 1 2 THR CB C -18.418 6.824 1.417 1.00 . A A . 2 THR CB 1 1 1 13 1 1 2 THR CG2 C -19.876 7.257 1.379 1.00 . A A . 2 THR CG2 1 1 1 14 1 1 2 THR H H -17.834 6.740 3.980 1.00 . A A . 2 THR H 1 1 1 15 1 1 2 THR HA H -19.094 4.915 2.092 1.00 . A A . 2 THR HA 1 1 1 16 1 1 2 THR HB H -18.096 6.603 0.411 1.00 . A A . 2 THR HB 1 1 1 17 1 1 2 THR HG1 H -18.088 8.724 1.873 1.00 . A A . 2 THR HG1 1 1 1 18 1 1 2 THR HG21 H -20.200 7.521 2.376 1.00 . A A . 2 THR HG21 1 1 1 19 1 1 2 THR HG22 H -20.483 6.447 1.007 1.00 . A A . 2 THR HG22 1 1 1 20 1 1 2 THR HG23 H -19.981 8.115 0.728 1.00 . A A . 2 THR HG23 1 1 1 21 1 1 2 THR N N -18.251 5.898 3.693 1.00 . A A . 2 THR N 1 1 1 22 1 1 2 THR O O -16.477 4.998 0.755 1.00 . A A . 2 THR O 1 1 1 23 1 1 2 THR OG1 O -17.608 7.886 1.948 1.00 . A A . 2 THR OG1 1 1 1 24 1 1 3 ARG C C -15.637 1.742 2.365 1.00 . A A . 3 ARG C 1 1 1 25 1 1 3 ARG CA C -15.267 3.216 2.478 1.00 . A A . 3 ARG CA 1 1 1 26 1 1 3 ARG CB C -14.211 3.422 3.564 1.00 . A A . 3 ARG CB 1 1 1 27 1 1 3 ARG CD C -12.676 5.013 4.762 1.00 . A A . 3 ARG CD 1 1 1 28 1 1 3 ARG CG C -13.689 4.849 3.643 1.00 . A A . 3 ARG CG 1 1 1 29 1 1 3 ARG CZ C -10.498 4.083 5.451 1.00 . A A . 3 ARG CZ 1 1 1 30 1 1 3 ARG H H -16.873 3.929 3.645 1.00 . A A . 3 ARG H 1 1 1 31 1 1 3 ARG HA H -14.871 3.547 1.531 1.00 . A A . 3 ARG HA 1 1 1 32 1 1 3 ARG HB2 H -14.644 3.167 4.521 1.00 . A A . 3 ARG HB2 1 1 1 33 1 1 3 ARG HB3 H -13.376 2.766 3.372 1.00 . A A . 3 ARG HB3 1 1 1 34 1 1 3 ARG HD2 H -12.348 6.042 4.785 1.00 . A A . 3 ARG HD2 1 1 1 35 1 1 3 ARG HD3 H -13.154 4.768 5.700 1.00 . A A . 3 ARG HD3 1 1 1 36 1 1 3 ARG HE H -11.479 3.576 3.778 1.00 . A A . 3 ARG HE 1 1 1 37 1 1 3 ARG HG2 H -13.218 5.103 2.704 1.00 . A A . 3 ARG HG2 1 1 1 38 1 1 3 ARG HG3 H -14.520 5.515 3.821 1.00 . A A . 3 ARG HG3 1 1 1 39 1 1 3 ARG HH11 H -11.249 5.476 6.718 1.00 . A A . 3 ARG HH11 1 1 1 40 1 1 3 ARG HH12 H -9.728 4.787 7.190 1.00 . A A . 3 ARG HH12 1 1 1 41 1 1 3 ARG HH21 H -9.494 2.687 4.382 1.00 . A A . 3 ARG HH21 1 1 1 42 1 1 3 ARG HH22 H -8.725 3.192 5.864 1.00 . A A . 3 ARG HH22 1 1 1 43 1 1 3 ARG N N -16.451 4.008 2.767 1.00 . A A . 3 ARG N 1 1 1 44 1 1 3 ARG NE N -11.509 4.150 4.587 1.00 . A A . 3 ARG NE 1 1 1 45 1 1 3 ARG NH1 N -10.491 4.843 6.537 1.00 . A A . 3 ARG NH1 1 1 1 46 1 1 3 ARG NH2 N -9.489 3.258 5.216 1.00 . A A . 3 ARG NH2 1 1 1 47 1 1 3 ARG O O -15.950 1.091 3.365 1.00 . A A . 3 ARG O 1 1 1 48 1 1 4 GLY C C -17.401 -0.364 0.511 1.00 . A A . 783 GLY C 1 1 1 49 1 1 4 GLY CA C -15.952 -0.160 0.913 1.00 . A A . 783 GLY CA 1 1 1 50 1 1 4 GLY H H -15.392 1.813 0.379 1.00 . A A . 783 GLY H 1 1 1 51 1 1 4 GLY HA2 H -15.315 -0.543 0.128 1.00 . A A . 783 GLY HA2 1 1 1 52 1 1 4 GLY HA3 H -15.762 -0.715 1.819 1.00 . A A . 783 GLY HA3 1 1 1 53 1 1 4 GLY N N -15.629 1.233 1.142 1.00 . A A . 783 GLY N 1 1 1 54 1 1 4 GLY O O -17.996 -1.398 0.816 1.00 . A A . 783 GLY O 1 1 1 55 1 1 5 VAL C C -19.450 -0.268 -1.924 1.00 . A A . 784 VAL C 1 1 1 56 1 1 5 VAL CA C -19.363 0.522 -0.622 1.00 . A A . 784 VAL CA 1 1 1 57 1 1 5 VAL CB C -20.007 1.915 -0.819 1.00 . A A . 784 VAL CB 1 1 1 58 1 1 5 VAL CG1 C -21.464 1.786 -1.251 1.00 . A A . 784 VAL CG1 1 1 1 59 1 1 5 VAL CG2 C -19.901 2.739 0.455 1.00 . A A . 784 VAL CG2 1 1 1 60 1 1 5 VAL H H -17.456 1.424 -0.387 1.00 . A A . 784 VAL H 1 1 1 61 1 1 5 VAL HA H -19.919 -0.004 0.140 1.00 . A A . 784 VAL HA 1 1 1 62 1 1 5 VAL HB H -19.469 2.430 -1.601 1.00 . A A . 784 VAL HB 1 1 1 63 1 1 5 VAL HG11 H -21.514 1.274 -2.201 1.00 . A A . 784 VAL HG11 1 1 1 64 1 1 5 VAL HG12 H -21.896 2.771 -1.349 1.00 . A A . 784 VAL HG12 1 1 1 65 1 1 5 VAL HG13 H -22.011 1.226 -0.508 1.00 . A A . 784 VAL HG13 1 1 1 66 1 1 5 VAL HG21 H -18.859 2.888 0.700 1.00 . A A . 784 VAL HG21 1 1 1 67 1 1 5 VAL HG22 H -20.388 2.215 1.263 1.00 . A A . 784 VAL HG22 1 1 1 68 1 1 5 VAL HG23 H -20.378 3.696 0.305 1.00 . A A . 784 VAL HG23 1 1 1 69 1 1 5 VAL N N -17.975 0.619 -0.176 1.00 . A A . 784 VAL N 1 1 1 70 1 1 5 VAL O O -19.964 -1.386 -1.947 1.00 . A A . 784 VAL O 1 1 1 71 1 1 6 ASP C C -17.649 -1.207 -4.448 1.00 . A A . 785 ASP C 1 1 1 72 1 1 6 ASP CA C -18.909 -0.362 -4.299 1.00 . A A . 785 ASP CA 1 1 1 73 1 1 6 ASP CB C -18.998 0.671 -5.435 1.00 . A A . 785 ASP CB 1 1 1 74 1 1 6 ASP CG C -17.834 1.653 -5.450 1.00 . A A . 785 ASP CG 1 1 1 75 1 1 6 ASP H H -18.522 1.197 -2.913 1.00 . A A . 785 ASP H 1 1 1 76 1 1 6 ASP HA H -19.772 -1.011 -4.347 1.00 . A A . 785 ASP HA 1 1 1 77 1 1 6 ASP HB2 H -19.010 0.151 -6.382 1.00 . A A . 785 ASP HB2 1 1 1 78 1 1 6 ASP HB3 H -19.916 1.232 -5.330 1.00 . A A . 785 ASP HB3 1 1 1 79 1 1 6 ASP N N -18.919 0.302 -2.996 1.00 . A A . 785 ASP N 1 1 1 80 1 1 6 ASP O O -16.991 -1.205 -5.490 1.00 . A A . 785 ASP O 1 1 1 81 1 1 6 ASP OD1 O -17.908 2.684 -4.748 1.00 . A A . 785 ASP OD1 1 1 1 82 1 1 6 ASP OD2 O -16.845 1.413 -6.172 1.00 . A A . 785 ASP OD2 1 1 1 83 1 1 7 SER C C -16.229 -4.137 -3.148 1.00 . A A . 786 SER C 1 1 1 84 1 1 7 SER CA C -16.047 -2.640 -3.358 1.00 . A A . 786 SER CA 1 1 1 85 1 1 7 SER CB C -15.207 -2.066 -2.225 1.00 . A A . 786 SER CB 1 1 1 86 1 1 7 SER H H -17.937 -2.015 -2.645 1.00 . A A . 786 SER H 1 1 1 87 1 1 7 SER HA H -15.535 -2.475 -4.295 1.00 . A A . 786 SER HA 1 1 1 88 1 1 7 SER HB2 H -15.595 -2.416 -1.280 1.00 . A A . 786 SER HB2 1 1 1 89 1 1 7 SER HB3 H -14.181 -2.389 -2.338 1.00 . A A . 786 SER HB3 1 1 1 90 1 1 7 SER HG H -15.990 -0.364 -2.786 1.00 . A A . 786 SER HG 1 1 1 91 1 1 7 SER N N -17.312 -1.936 -3.401 1.00 . A A . 786 SER N 1 1 1 92 1 1 7 SER O O -16.783 -4.572 -2.141 1.00 . A A . 786 SER O 1 1 1 93 1 1 7 SER OG O -15.248 -0.652 -2.244 1.00 . A A . 786 SER OG 1 1 1 94 1 1 8 PRO C C -14.502 -6.705 -2.960 1.00 . A A . 787 PRO C 1 1 1 95 1 1 8 PRO CA C -15.629 -6.390 -3.932 1.00 . A A . 787 PRO CA 1 1 1 96 1 1 8 PRO CB C -15.288 -6.911 -5.336 1.00 . A A . 787 PRO CB 1 1 1 97 1 1 8 PRO CD C -15.300 -4.518 -5.433 1.00 . A A . 787 PRO CD 1 1 1 98 1 1 8 PRO CG C -15.490 -5.754 -6.259 1.00 . A A . 787 PRO CG 1 1 1 99 1 1 8 PRO HA H -16.551 -6.833 -3.582 1.00 . A A . 787 PRO HA 1 1 1 100 1 1 8 PRO HB2 H -14.263 -7.252 -5.355 1.00 . A A . 787 PRO HB2 1 1 1 101 1 1 8 PRO HB3 H -15.945 -7.731 -5.585 1.00 . A A . 787 PRO HB3 1 1 1 102 1 1 8 PRO HD2 H -14.258 -4.230 -5.418 1.00 . A A . 787 PRO HD2 1 1 1 103 1 1 8 PRO HD3 H -15.914 -3.714 -5.806 1.00 . A A . 787 PRO HD3 1 1 1 104 1 1 8 PRO HG2 H -14.760 -5.787 -7.054 1.00 . A A . 787 PRO HG2 1 1 1 105 1 1 8 PRO HG3 H -16.489 -5.780 -6.666 1.00 . A A . 787 PRO HG3 1 1 1 106 1 1 8 PRO N N -15.746 -4.945 -4.104 1.00 . A A . 787 PRO N 1 1 1 107 1 1 8 PRO O O -14.620 -7.571 -2.095 1.00 . A A . 787 PRO O 1 1 1 108 1 1 9 SER C C -12.535 -5.066 -1.024 1.00 . A A . 788 SER C 1 1 1 109 1 1 9 SER CA C -12.301 -6.035 -2.182 1.00 . A A . 788 SER CA 1 1 1 110 1 1 9 SER CB C -10.995 -5.688 -2.905 1.00 . A A . 788 SER CB 1 1 1 111 1 1 9 SER H H -13.353 -5.360 -3.874 1.00 . A A . 788 SER H 1 1 1 112 1 1 9 SER HA H -12.244 -7.043 -1.796 1.00 . A A . 788 SER HA 1 1 1 113 1 1 9 SER HB2 H -11.012 -4.649 -3.196 1.00 . A A . 788 SER HB2 1 1 1 114 1 1 9 SER HB3 H -10.160 -5.862 -2.240 1.00 . A A . 788 SER HB3 1 1 1 115 1 1 9 SER HG H -10.548 -7.375 -3.801 1.00 . A A . 788 SER HG 1 1 1 116 1 1 9 SER N N -13.412 -5.965 -3.107 1.00 . A A . 788 SER N 1 1 1 117 1 1 9 SER O O -11.688 -4.223 -0.725 1.00 . A A . 788 SER O 1 1 1 118 1 1 9 SER OG O -10.830 -6.483 -4.066 1.00 . A A . 788 SER OG 1 1 1 119 1 1 10 ALA C C -13.080 -4.426 1.861 1.00 . A A . 789 ALA C 1 1 1 120 1 1 10 ALA CA C -14.072 -4.303 0.714 1.00 . A A . 789 ALA CA 1 1 1 121 1 1 10 ALA CB C -15.481 -4.624 1.188 1.00 . A A . 789 ALA CB 1 1 1 122 1 1 10 ALA H H -14.333 -5.879 -0.678 1.00 . A A . 789 ALA H 1 1 1 123 1 1 10 ALA HA H -14.063 -3.284 0.351 1.00 . A A . 789 ALA HA 1 1 1 124 1 1 10 ALA HB1 H -15.780 -3.909 1.940 1.00 . A A . 789 ALA HB1 1 1 1 125 1 1 10 ALA HB2 H -15.501 -5.619 1.609 1.00 . A A . 789 ALA HB2 1 1 1 126 1 1 10 ALA HB3 H -16.164 -4.573 0.352 1.00 . A A . 789 ALA HB3 1 1 1 127 1 1 10 ALA N N -13.701 -5.181 -0.391 1.00 . A A . 789 ALA N 1 1 1 128 1 1 10 ALA O O -12.771 -3.444 2.537 1.00 . A A . 789 ALA O 1 1 1 129 1 1 11 GLU C C -10.332 -5.058 2.885 1.00 . A A . 790 GLU C 1 1 1 130 1 1 11 GLU CA C -11.576 -5.903 3.085 1.00 . A A . 790 GLU CA 1 1 1 131 1 1 11 GLU CB C -11.185 -7.372 3.078 1.00 . A A . 790 GLU CB 1 1 1 132 1 1 11 GLU CD C -11.885 -9.750 3.480 1.00 . A A . 790 GLU CD 1 1 1 133 1 1 11 GLU CG C -12.325 -8.307 3.432 1.00 . A A . 790 GLU CG 1 1 1 134 1 1 11 GLU H H -12.866 -6.372 1.482 1.00 . A A . 790 GLU H 1 1 1 135 1 1 11 GLU HA H -12.015 -5.659 4.040 1.00 . A A . 790 GLU HA 1 1 1 136 1 1 11 GLU HB2 H -10.831 -7.632 2.090 1.00 . A A . 790 GLU HB2 1 1 1 137 1 1 11 GLU HB3 H -10.385 -7.520 3.788 1.00 . A A . 790 GLU HB3 1 1 1 138 1 1 11 GLU HG2 H -12.714 -8.033 4.403 1.00 . A A . 790 GLU HG2 1 1 1 139 1 1 11 GLU HG3 H -13.103 -8.205 2.689 1.00 . A A . 790 GLU HG3 1 1 1 140 1 1 11 GLU N N -12.564 -5.635 2.049 1.00 . A A . 790 GLU N 1 1 1 141 1 1 11 GLU O O -9.722 -4.594 3.842 1.00 . A A . 790 GLU O 1 1 1 142 1 1 11 GLU OE1 O -11.422 -10.193 4.548 1.00 . A A . 790 GLU OE1 1 1 1 143 1 1 11 GLU OE2 O -11.983 -10.443 2.446 1.00 . A A . 790 GLU OE2 1 1 1 144 1 1 12 LEU C C -9.195 -2.604 1.093 1.00 . A A . 791 LEU C 1 1 1 145 1 1 12 LEU CA C -8.796 -4.056 1.316 1.00 . A A . 791 LEU CA 1 1 1 146 1 1 12 LEU CB C -8.079 -4.620 0.089 1.00 . A A . 791 LEU CB 1 1 1 147 1 1 12 LEU CD1 C -6.853 -6.508 -1.020 1.00 . A A . 791 LEU CD1 1 1 1 148 1 1 12 LEU CD2 C -6.595 -6.131 1.440 1.00 . A A . 791 LEU CD2 1 1 1 149 1 1 12 LEU CG C -7.545 -6.048 0.252 1.00 . A A . 791 LEU CG 1 1 1 150 1 1 12 LEU H H -10.499 -5.232 0.905 1.00 . A A . 791 LEU H 1 1 1 151 1 1 12 LEU HA H -8.139 -4.110 2.169 1.00 . A A . 791 LEU HA 1 1 1 152 1 1 12 LEU HB2 H -8.769 -4.607 -0.742 1.00 . A A . 791 LEU HB2 1 1 1 153 1 1 12 LEU HB3 H -7.247 -3.973 -0.143 1.00 . A A . 791 LEU HB3 1 1 1 154 1 1 12 LEU HD11 H -6.026 -5.849 -1.241 1.00 . A A . 791 LEU HD11 1 1 1 155 1 1 12 LEU HD12 H -7.555 -6.492 -1.840 1.00 . A A . 791 LEU HD12 1 1 1 156 1 1 12 LEU HD13 H -6.483 -7.515 -0.883 1.00 . A A . 791 LEU HD13 1 1 1 157 1 1 12 LEU HD21 H -6.261 -7.151 1.565 1.00 . A A . 791 LEU HD21 1 1 1 158 1 1 12 LEU HD22 H -7.108 -5.808 2.335 1.00 . A A . 791 LEU HD22 1 1 1 159 1 1 12 LEU HD23 H -5.742 -5.493 1.265 1.00 . A A . 791 LEU HD23 1 1 1 160 1 1 12 LEU HG H -8.374 -6.714 0.440 1.00 . A A . 791 LEU HG 1 1 1 161 1 1 12 LEU N N -9.966 -4.850 1.631 1.00 . A A . 791 LEU N 1 1 1 162 1 1 12 LEU O O -8.458 -1.825 0.485 1.00 . A A . 791 LEU O 1 1 1 163 1 1 13 ASP C C -10.959 -0.346 0.149 1.00 . A A . 792 ASP C 1 1 1 164 1 1 13 ASP CA C -10.923 -0.917 1.567 1.00 . A A . 792 ASP CA 1 1 1 165 1 1 13 ASP CB C -10.098 -0.017 2.495 1.00 . A A . 792 ASP CB 1 1 1 166 1 1 13 ASP CG C -10.849 1.228 2.923 1.00 . A A . 792 ASP CG 1 1 1 167 1 1 13 ASP H H -10.929 -2.988 1.983 1.00 . A A . 792 ASP H 1 1 1 168 1 1 13 ASP HA H -11.935 -0.964 1.943 1.00 . A A . 792 ASP HA 1 1 1 169 1 1 13 ASP HB2 H -9.833 -0.573 3.381 1.00 . A A . 792 ASP HB2 1 1 1 170 1 1 13 ASP HB3 H -9.198 0.286 1.983 1.00 . A A . 792 ASP HB3 1 1 1 171 1 1 13 ASP N N -10.386 -2.277 1.583 1.00 . A A . 792 ASP N 1 1 1 172 1 1 13 ASP O O -10.583 0.808 -0.074 1.00 . A A . 792 ASP O 1 1 1 173 1 1 13 ASP OD1 O -11.968 1.093 3.460 1.00 . A A . 792 ASP OD1 1 1 1 174 1 1 13 ASP OD2 O -10.315 2.342 2.751 1.00 . A A . 792 ASP OD2 1 1 1 175 1 1 14 LYS C C -10.187 -0.595 -2.924 1.00 . A A . 793 LYS C 1 1 1 176 1 1 14 LYS CA C -11.535 -0.782 -2.224 1.00 . A A . 793 LYS CA 1 1 1 177 1 1 14 LYS CB C -12.352 0.518 -2.301 1.00 . A A . 793 LYS CB 1 1 1 178 1 1 14 LYS CD C -13.393 0.353 -4.602 1.00 . A A . 793 LYS CD 1 1 1 179 1 1 14 LYS CE C -13.460 0.988 -5.984 1.00 . A A . 793 LYS CE 1 1 1 180 1 1 14 LYS CG C -12.455 1.129 -3.692 1.00 . A A . 793 LYS CG 1 1 1 181 1 1 14 LYS H H -11.556 -2.121 -0.574 1.00 . A A . 793 LYS H 1 1 1 182 1 1 14 LYS HA H -12.079 -1.565 -2.731 1.00 . A A . 793 LYS HA 1 1 1 183 1 1 14 LYS HB2 H -13.353 0.318 -1.948 1.00 . A A . 793 LYS HB2 1 1 1 184 1 1 14 LYS HB3 H -11.892 1.245 -1.648 1.00 . A A . 793 LYS HB3 1 1 1 185 1 1 14 LYS HD2 H -13.032 -0.661 -4.697 1.00 . A A . 793 LYS HD2 1 1 1 186 1 1 14 LYS HD3 H -14.382 0.349 -4.168 1.00 . A A . 793 LYS HD3 1 1 1 187 1 1 14 LYS HE2 H -13.688 2.037 -5.871 1.00 . A A . 793 LYS HE2 1 1 1 188 1 1 14 LYS HE3 H -12.496 0.882 -6.461 1.00 . A A . 793 LYS HE3 1 1 1 189 1 1 14 LYS HG2 H -12.820 2.141 -3.601 1.00 . A A . 793 LYS HG2 1 1 1 190 1 1 14 LYS HG3 H -11.471 1.145 -4.138 1.00 . A A . 793 LYS HG3 1 1 1 191 1 1 14 LYS HZ1 H -14.363 -0.671 -6.885 1.00 . A A . 793 LYS HZ1 1 1 1 192 1 1 14 LYS HZ2 H -14.430 0.747 -7.813 1.00 . A A . 793 LYS HZ2 1 1 1 193 1 1 14 LYS HZ3 H -15.451 0.569 -6.470 1.00 . A A . 793 LYS HZ3 1 1 1 194 1 1 14 LYS N N -11.366 -1.191 -0.818 1.00 . A A . 793 LYS N 1 1 1 195 1 1 14 LYS NZ N -14.496 0.364 -6.845 1.00 . A A . 793 LYS NZ 1 1 1 196 1 1 14 LYS O O -10.081 -0.716 -4.150 1.00 . A A . 793 LYS O 1 1 1 197 1 1 15 LYS C C -8.072 1.389 -3.413 1.00 . A A . 794 LYS C 1 1 1 198 1 1 15 LYS CA C -7.870 0.118 -2.600 1.00 . A A . 794 LYS CA 1 1 1 199 1 1 15 LYS CB C -7.132 -0.942 -3.429 1.00 . A A . 794 LYS CB 1 1 1 200 1 1 15 LYS CD C -7.904 -3.341 -3.351 1.00 . A A . 794 LYS CD 1 1 1 201 1 1 15 LYS CE C -7.522 -3.642 -4.793 1.00 . A A . 794 LYS CE 1 1 1 202 1 1 15 LYS CG C -6.992 -2.290 -2.735 1.00 . A A . 794 LYS CG 1 1 1 203 1 1 15 LYS H H -9.292 -0.445 -1.153 1.00 . A A . 794 LYS H 1 1 1 204 1 1 15 LYS HA H -7.273 0.360 -1.731 1.00 . A A . 794 LYS HA 1 1 1 205 1 1 15 LYS HB2 H -7.660 -1.090 -4.359 1.00 . A A . 794 LYS HB2 1 1 1 206 1 1 15 LYS HB3 H -6.138 -0.572 -3.645 1.00 . A A . 794 LYS HB3 1 1 1 207 1 1 15 LYS HD2 H -7.831 -4.249 -2.774 1.00 . A A . 794 LYS HD2 1 1 1 208 1 1 15 LYS HD3 H -8.921 -2.978 -3.327 1.00 . A A . 794 LYS HD3 1 1 1 209 1 1 15 LYS HE2 H -8.249 -4.326 -5.209 1.00 . A A . 794 LYS HE2 1 1 1 210 1 1 15 LYS HE3 H -7.537 -2.719 -5.355 1.00 . A A . 794 LYS HE3 1 1 1 211 1 1 15 LYS HG2 H -5.969 -2.624 -2.820 1.00 . A A . 794 LYS HG2 1 1 1 212 1 1 15 LYS HG3 H -7.249 -2.171 -1.692 1.00 . A A . 794 LYS HG3 1 1 1 213 1 1 15 LYS HZ1 H -5.460 -3.661 -4.409 1.00 . A A . 794 LYS HZ1 1 1 1 214 1 1 15 LYS HZ2 H -5.890 -4.333 -5.901 1.00 . A A . 794 LYS HZ2 1 1 1 215 1 1 15 LYS HZ3 H -6.165 -5.205 -4.472 1.00 . A A . 794 LYS HZ3 1 1 1 216 1 1 15 LYS N N -9.163 -0.338 -2.120 1.00 . A A . 794 LYS N 1 1 1 217 1 1 15 LYS NZ N -6.168 -4.252 -4.899 1.00 . A A . 794 LYS NZ 1 1 1 218 1 1 15 LYS O O -7.592 1.515 -4.538 1.00 . A A . 794 LYS O 1 1 1 219 1 1 16 ALA C C -7.848 4.497 -3.265 1.00 . A A . 795 ALA C 1 1 1 220 1 1 16 ALA CA C -9.065 3.611 -3.443 1.00 . A A . 795 ALA CA 1 1 1 221 1 1 16 ALA CB C -10.279 4.259 -2.810 1.00 . A A . 795 ALA CB 1 1 1 222 1 1 16 ALA H H -9.308 2.079 -2.010 1.00 . A A . 795 ALA H 1 1 1 223 1 1 16 ALA HA H -9.257 3.485 -4.490 1.00 . A A . 795 ALA HA 1 1 1 224 1 1 16 ALA HB1 H -10.461 5.214 -3.275 1.00 . A A . 795 ALA HB1 1 1 1 225 1 1 16 ALA HB2 H -10.092 4.399 -1.755 1.00 . A A . 795 ALA HB2 1 1 1 226 1 1 16 ALA HB3 H -11.136 3.619 -2.944 1.00 . A A . 795 ALA HB3 1 1 1 227 1 1 16 ALA N N -8.851 2.300 -2.852 1.00 . A A . 795 ALA N 1 1 1 228 1 1 16 ALA O O -7.199 4.911 -4.224 1.00 . A A . 795 ALA O 1 1 1 229 1 1 17 ASN C C -5.107 4.955 -1.753 1.00 . A A . 796 ASN C 1 1 1 230 1 1 17 ASN CA C -6.458 5.650 -1.632 1.00 . A A . 796 ASN CA 1 1 1 231 1 1 17 ASN CB C -6.677 6.182 -0.204 1.00 . A A . 796 ASN CB 1 1 1 232 1 1 17 ASN CG C -7.202 5.140 0.784 1.00 . A A . 796 ASN CG 1 1 1 233 1 1 17 ASN H H -8.093 4.349 -1.313 1.00 . A A . 796 ASN H 1 1 1 234 1 1 17 ASN HA H -6.470 6.487 -2.313 1.00 . A A . 796 ASN HA 1 1 1 235 1 1 17 ASN HB2 H -5.738 6.558 0.173 1.00 . A A . 796 ASN HB2 1 1 1 236 1 1 17 ASN HB3 H -7.386 6.996 -0.245 1.00 . A A . 796 ASN HB3 1 1 1 237 1 1 17 ASN HD21 H -6.104 3.706 -0.041 1.00 . A A . 796 ASN HD21 1 1 1 238 1 1 17 ASN HD22 H -7.088 3.225 1.299 1.00 . A A . 796 ASN HD22 1 1 1 239 1 1 17 ASN N N -7.551 4.764 -2.012 1.00 . A A . 796 ASN N 1 1 1 240 1 1 17 ASN ND2 N -6.752 3.898 0.668 1.00 . A A . 796 ASN ND2 1 1 1 241 1 1 17 ASN O O -4.525 4.504 -0.764 1.00 . A A . 796 ASN O 1 1 1 242 1 1 17 ASN OD1 O -7.994 5.461 1.664 1.00 . A A . 796 ASN OD1 1 1 1 243 1 1 18 LEU C C -2.228 5.151 -3.394 1.00 . A A . 797 LEU C 1 1 1 244 1 1 18 LEU CA C -3.374 4.171 -3.237 1.00 . A A . 797 LEU CA 1 1 1 245 1 1 18 LEU CB C -3.472 3.311 -4.494 1.00 . A A . 797 LEU CB 1 1 1 246 1 1 18 LEU CD1 C -4.482 1.332 -5.648 1.00 . A A . 797 LEU CD1 1 1 1 247 1 1 18 LEU CD2 C -4.823 1.647 -3.190 1.00 . A A . 797 LEU CD2 1 1 1 248 1 1 18 LEU CG C -4.651 2.345 -4.528 1.00 . A A . 797 LEU CG 1 1 1 249 1 1 18 LEU H H -5.127 5.189 -3.735 1.00 . A A . 797 LEU H 1 1 1 250 1 1 18 LEU HA H -3.158 3.525 -2.400 1.00 . A A . 797 LEU HA 1 1 1 251 1 1 18 LEU HB2 H -3.548 3.969 -5.346 1.00 . A A . 797 LEU HB2 1 1 1 252 1 1 18 LEU HB3 H -2.563 2.736 -4.584 1.00 . A A . 797 LEU HB3 1 1 1 253 1 1 18 LEU HD11 H -4.445 1.847 -6.596 1.00 . A A . 797 LEU HD11 1 1 1 254 1 1 18 LEU HD12 H -5.318 0.646 -5.645 1.00 . A A . 797 LEU HD12 1 1 1 255 1 1 18 LEU HD13 H -3.566 0.781 -5.500 1.00 . A A . 797 LEU HD13 1 1 1 256 1 1 18 LEU HD21 H -5.645 0.950 -3.254 1.00 . A A . 797 LEU HD21 1 1 1 257 1 1 18 LEU HD22 H -5.039 2.384 -2.428 1.00 . A A . 797 LEU HD22 1 1 1 258 1 1 18 LEU HD23 H -3.917 1.118 -2.937 1.00 . A A . 797 LEU HD23 1 1 1 259 1 1 18 LEU HG H -5.554 2.905 -4.724 1.00 . A A . 797 LEU HG 1 1 1 260 1 1 18 LEU N N -4.627 4.833 -2.978 1.00 . A A . 797 LEU N 1 1 1 261 1 1 18 LEU O O -2.405 6.310 -3.773 1.00 . A A . 797 LEU O 1 1 1 262 1 1 19 LEU C C 1.111 4.074 -3.630 1.00 . A A . 798 LEU C 1 1 1 263 1 1 19 LEU CA C 0.210 5.253 -3.374 1.00 . A A . 798 LEU CA 1 1 1 264 1 1 19 LEU CB C 0.713 6.117 -2.217 1.00 . A A . 798 LEU CB 1 1 1 265 1 1 19 LEU CD1 C 2.869 5.518 -1.143 1.00 . A A . 798 LEU CD1 1 1 1 266 1 1 19 LEU CD2 C 0.832 5.833 0.256 1.00 . A A . 798 LEU CD2 1 1 1 267 1 1 19 LEU CG C 1.365 5.354 -1.074 1.00 . A A . 798 LEU CG 1 1 1 268 1 1 19 LEU H H -1.066 3.793 -2.577 1.00 . A A . 798 LEU H 1 1 1 269 1 1 19 LEU HA H 0.155 5.826 -4.283 1.00 . A A . 798 LEU HA 1 1 1 270 1 1 19 LEU HB2 H 1.433 6.821 -2.607 1.00 . A A . 798 LEU HB2 1 1 1 271 1 1 19 LEU HB3 H -0.125 6.671 -1.817 1.00 . A A . 798 LEU HB3 1 1 1 272 1 1 19 LEU HD11 H 3.339 4.887 -0.406 1.00 . A A . 798 LEU HD11 1 1 1 273 1 1 19 LEU HD12 H 3.127 6.550 -0.957 1.00 . A A . 798 LEU HD12 1 1 1 274 1 1 19 LEU HD13 H 3.209 5.237 -2.132 1.00 . A A . 798 LEU HD13 1 1 1 275 1 1 19 LEU HD21 H 1.292 5.269 1.052 1.00 . A A . 798 LEU HD21 1 1 1 276 1 1 19 LEU HD22 H -0.238 5.691 0.284 1.00 . A A . 798 LEU HD22 1 1 1 277 1 1 19 LEU HD23 H 1.061 6.881 0.375 1.00 . A A . 798 LEU HD23 1 1 1 278 1 1 19 LEU HG H 1.135 4.301 -1.173 1.00 . A A . 798 LEU HG 1 1 1 279 1 1 19 LEU N N -1.070 4.647 -3.067 1.00 . A A . 798 LEU N 1 1 1 280 1 1 19 LEU O O 0.632 2.939 -3.548 1.00 . A A . 798 LEU O 1 1 1 281 1 1 20 LYS C C 4.588 3.174 -3.807 1.00 . A A . 799 LYS C 1 1 1 282 1 1 20 LYS CA C 3.148 3.089 -4.261 1.00 . A A . 799 LYS CA 1 1 1 283 1 1 20 LYS CB C 3.052 2.777 -5.755 1.00 . A A . 799 LYS CB 1 1 1 284 1 1 20 LYS CD C 3.662 5.085 -6.615 1.00 . A A . 799 LYS CD 1 1 1 285 1 1 20 LYS CE C 4.562 5.883 -7.553 1.00 . A A . 799 LYS CE 1 1 1 286 1 1 20 LYS CG C 3.984 3.598 -6.649 1.00 . A A . 799 LYS CG 1 1 1 287 1 1 20 LYS H H 2.770 5.163 -3.978 1.00 . A A . 799 LYS H 1 1 1 288 1 1 20 LYS HA H 2.683 2.304 -3.688 1.00 . A A . 799 LYS HA 1 1 1 289 1 1 20 LYS HB2 H 3.274 1.732 -5.908 1.00 . A A . 799 LYS HB2 1 1 1 290 1 1 20 LYS HB3 H 2.036 2.969 -6.065 1.00 . A A . 799 LYS HB3 1 1 1 291 1 1 20 LYS HD2 H 2.634 5.226 -6.911 1.00 . A A . 799 LYS HD2 1 1 1 292 1 1 20 LYS HD3 H 3.799 5.447 -5.605 1.00 . A A . 799 LYS HD3 1 1 1 293 1 1 20 LYS HE2 H 4.422 5.517 -8.559 1.00 . A A . 799 LYS HE2 1 1 1 294 1 1 20 LYS HE3 H 4.271 6.922 -7.509 1.00 . A A . 799 LYS HE3 1 1 1 295 1 1 20 LYS HG2 H 4.999 3.456 -6.314 1.00 . A A . 799 LYS HG2 1 1 1 296 1 1 20 LYS HG3 H 3.889 3.243 -7.665 1.00 . A A . 799 LYS HG3 1 1 1 297 1 1 20 LYS HZ1 H 6.325 4.782 -7.291 1.00 . A A . 799 LYS HZ1 1 1 1 298 1 1 20 LYS HZ2 H 6.160 6.074 -6.205 1.00 . A A . 799 LYS HZ2 1 1 1 299 1 1 20 LYS HZ3 H 6.580 6.368 -7.820 1.00 . A A . 799 LYS HZ3 1 1 1 300 1 1 20 LYS N N 2.374 4.264 -3.945 1.00 . A A . 799 LYS N 1 1 1 301 1 1 20 LYS NZ N 6.004 5.767 -7.194 1.00 . A A . 799 LYS NZ 1 1 1 302 1 1 20 LYS O O 5.188 4.242 -3.724 1.00 . A A . 799 LYS O 1 1 1 303 1 1 21 CYS C C 7.439 2.394 -3.961 1.00 . A A . 800 CYS C 1 1 1 304 1 1 21 CYS CA C 6.426 1.756 -3.025 1.00 . A A . 800 CYS CA 1 1 1 305 1 1 21 CYS CB C 6.560 0.237 -3.017 1.00 . A A . 800 CYS CB 1 1 1 306 1 1 21 CYS H H 4.478 1.223 -3.505 1.00 . A A . 800 CYS H 1 1 1 307 1 1 21 CYS HA H 6.547 2.140 -2.026 1.00 . A A . 800 CYS HA 1 1 1 308 1 1 21 CYS HB2 H 5.808 -0.167 -2.360 1.00 . A A . 800 CYS HB2 1 1 1 309 1 1 21 CYS HB3 H 6.365 -0.125 -4.019 1.00 . A A . 800 CYS HB3 1 1 1 310 1 1 21 CYS N N 5.078 1.998 -3.471 1.00 . A A . 800 CYS N 1 1 1 311 1 1 21 CYS O O 7.583 1.961 -5.098 1.00 . A A . 800 CYS O 1 1 1 312 1 1 21 CYS SG S 8.124 -0.468 -2.492 1.00 . A A . 800 CYS SG 1 1 1 313 1 1 22 GLU C C 10.358 3.166 -4.578 1.00 . A A . 801 GLU C 1 1 1 314 1 1 22 GLU CA C 9.180 4.096 -4.254 1.00 . A A . 801 GLU CA 1 1 1 315 1 1 22 GLU CB C 9.679 5.332 -3.504 1.00 . A A . 801 GLU CB 1 1 1 316 1 1 22 GLU CD C 8.084 6.959 -4.604 1.00 . A A . 801 GLU CD 1 1 1 317 1 1 22 GLU CG C 8.613 6.398 -3.298 1.00 . A A . 801 GLU CG 1 1 1 318 1 1 22 GLU H H 7.899 3.792 -2.597 1.00 . A A . 801 GLU H 1 1 1 319 1 1 22 GLU HA H 8.756 4.412 -5.195 1.00 . A A . 801 GLU HA 1 1 1 320 1 1 22 GLU HB2 H 10.043 5.026 -2.536 1.00 . A A . 801 GLU HB2 1 1 1 321 1 1 22 GLU HB3 H 10.493 5.772 -4.062 1.00 . A A . 801 GLU HB3 1 1 1 322 1 1 22 GLU HG2 H 7.788 5.962 -2.753 1.00 . A A . 801 GLU HG2 1 1 1 323 1 1 22 GLU HG3 H 9.038 7.205 -2.719 1.00 . A A . 801 GLU HG3 1 1 1 324 1 1 22 GLU N N 8.129 3.428 -3.481 1.00 . A A . 801 GLU N 1 1 1 325 1 1 22 GLU O O 11.416 3.623 -5.012 1.00 . A A . 801 GLU O 1 1 1 326 1 1 22 GLU OE1 O 8.853 7.636 -5.322 1.00 . A A . 801 GLU OE1 1 1 1 327 1 1 22 GLU OE2 O 6.900 6.724 -4.925 1.00 . A A . 801 GLU OE2 1 1 1 328 1 1 23 TYR C C 10.581 0.168 -6.053 1.00 . A A . 802 TYR C 1 1 1 329 1 1 23 TYR CA C 11.147 0.891 -4.823 1.00 . A A . 802 TYR CA 1 1 1 330 1 1 23 TYR CB C 11.513 -0.106 -3.701 1.00 . A A . 802 TYR CB 1 1 1 331 1 1 23 TYR CD1 C 14.015 -0.425 -3.657 1.00 . A A . 802 TYR CD1 1 1 1 332 1 1 23 TYR CD2 C 12.678 -2.166 -4.590 1.00 . A A . 802 TYR CD2 1 1 1 333 1 1 23 TYR CE1 C 15.158 -1.155 -3.918 1.00 . A A . 802 TYR CE1 1 1 1 334 1 1 23 TYR CE2 C 13.818 -2.903 -4.854 1.00 . A A . 802 TYR CE2 1 1 1 335 1 1 23 TYR CG C 12.756 -0.916 -3.990 1.00 . A A . 802 TYR CG 1 1 1 336 1 1 23 TYR CZ C 15.056 -2.393 -4.515 1.00 . A A . 802 TYR CZ 1 1 1 337 1 1 23 TYR H H 9.352 1.566 -3.949 1.00 . A A . 802 TYR H 1 1 1 338 1 1 23 TYR HA H 12.039 1.430 -5.119 1.00 . A A . 802 TYR HA 1 1 1 339 1 1 23 TYR HB2 H 11.685 0.435 -2.779 1.00 . A A . 802 TYR HB2 1 1 1 340 1 1 23 TYR HB3 H 10.695 -0.797 -3.554 1.00 . A A . 802 TYR HB3 1 1 1 341 1 1 23 TYR HD1 H 14.093 0.545 -3.190 1.00 . A A . 802 TYR HD1 1 1 1 342 1 1 23 TYR HD2 H 11.708 -2.563 -4.853 1.00 . A A . 802 TYR HD2 1 1 1 343 1 1 23 TYR HE1 H 16.126 -0.755 -3.653 1.00 . A A . 802 TYR HE1 1 1 1 344 1 1 23 TYR HE2 H 13.736 -3.873 -5.322 1.00 . A A . 802 TYR HE2 1 1 1 345 1 1 23 TYR HH H 16.166 -3.449 -5.678 1.00 . A A . 802 TYR HH 1 1 1 346 1 1 23 TYR N N 10.178 1.868 -4.373 1.00 . A A . 802 TYR N 1 1 1 347 1 1 23 TYR O O 10.806 0.590 -7.185 1.00 . A A . 802 TYR O 1 1 1 348 1 1 23 TYR OH O 16.192 -3.121 -4.773 1.00 . A A . 802 TYR OH 1 1 1 349 1 1 24 CYS C C 8.118 -0.907 -7.632 1.00 . A A . 803 CYS C 1 1 1 350 1 1 24 CYS CA C 9.219 -1.681 -6.908 1.00 . A A . 803 CYS CA 1 1 1 351 1 1 24 CYS CB C 8.681 -3.003 -6.366 1.00 . A A . 803 CYS CB 1 1 1 352 1 1 24 CYS H H 9.883 -1.322 -4.932 1.00 . A A . 803 CYS H 1 1 1 353 1 1 24 CYS HA H 9.974 -1.893 -7.650 1.00 . A A . 803 CYS HA 1 1 1 354 1 1 24 CYS HB2 H 7.988 -3.425 -7.081 1.00 . A A . 803 CYS HB2 1 1 1 355 1 1 24 CYS HB3 H 9.504 -3.687 -6.223 1.00 . A A . 803 CYS HB3 1 1 1 356 1 1 24 CYS N N 9.859 -0.927 -5.822 1.00 . A A . 803 CYS N 1 1 1 357 1 1 24 CYS O O 7.909 -1.101 -8.827 1.00 . A A . 803 CYS O 1 1 1 358 1 1 24 CYS SG S 7.813 -2.847 -4.780 1.00 . A A . 803 CYS SG 1 1 1 359 1 1 25 GLY C C 5.042 0.175 -7.639 1.00 . A A . 804 GLY C 1 1 1 360 1 1 25 GLY CA C 6.423 0.792 -7.586 1.00 . A A . 804 GLY CA 1 1 1 361 1 1 25 GLY H H 7.563 0.032 -5.962 1.00 . A A . 804 GLY H 1 1 1 362 1 1 25 GLY HA2 H 6.360 1.731 -7.057 1.00 . A A . 804 GLY HA2 1 1 1 363 1 1 25 GLY HA3 H 6.757 0.984 -8.594 1.00 . A A . 804 GLY HA3 1 1 1 364 1 1 25 GLY N N 7.407 -0.052 -6.925 1.00 . A A . 804 GLY N 1 1 1 365 1 1 25 GLY O O 4.213 0.565 -8.465 1.00 . A A . 804 GLY O 1 1 1 366 1 1 26 LYS C C 2.509 -0.616 -5.897 1.00 . A A . 805 LYS C 1 1 1 367 1 1 26 LYS CA C 3.489 -1.445 -6.711 1.00 . A A . 805 LYS CA 1 1 1 368 1 1 26 LYS CB C 3.614 -2.850 -6.119 1.00 . A A . 805 LYS CB 1 1 1 369 1 1 26 LYS CD C 4.312 -5.230 -6.468 1.00 . A A . 805 LYS CD 1 1 1 370 1 1 26 LYS CE C 4.867 -6.237 -7.464 1.00 . A A . 805 LYS CE 1 1 1 371 1 1 26 LYS CG C 4.350 -3.820 -7.025 1.00 . A A . 805 LYS CG 1 1 1 372 1 1 26 LYS H H 5.471 -1.040 -6.118 1.00 . A A . 805 LYS H 1 1 1 373 1 1 26 LYS HA H 3.092 -1.524 -7.713 1.00 . A A . 805 LYS HA 1 1 1 374 1 1 26 LYS HB2 H 4.147 -2.787 -5.181 1.00 . A A . 805 LYS HB2 1 1 1 375 1 1 26 LYS HB3 H 2.625 -3.243 -5.936 1.00 . A A . 805 LYS HB3 1 1 1 376 1 1 26 LYS HD2 H 4.905 -5.266 -5.567 1.00 . A A . 805 LYS HD2 1 1 1 377 1 1 26 LYS HD3 H 3.288 -5.489 -6.241 1.00 . A A . 805 LYS HD3 1 1 1 378 1 1 26 LYS HE2 H 5.899 -5.989 -7.671 1.00 . A A . 805 LYS HE2 1 1 1 379 1 1 26 LYS HE3 H 4.817 -7.223 -7.024 1.00 . A A . 805 LYS HE3 1 1 1 380 1 1 26 LYS HG2 H 3.879 -3.817 -7.998 1.00 . A A . 805 LYS HG2 1 1 1 381 1 1 26 LYS HG3 H 5.379 -3.506 -7.119 1.00 . A A . 805 LYS HG3 1 1 1 382 1 1 26 LYS HZ1 H 3.083 -6.336 -8.553 1.00 . A A . 805 LYS HZ1 1 1 1 383 1 1 26 LYS HZ2 H 4.409 -7.032 -9.344 1.00 . A A . 805 LYS HZ2 1 1 1 384 1 1 26 LYS HZ3 H 4.263 -5.345 -9.260 1.00 . A A . 805 LYS HZ3 1 1 1 385 1 1 26 LYS N N 4.788 -0.791 -6.771 1.00 . A A . 805 LYS N 1 1 1 386 1 1 26 LYS NZ N 4.104 -6.237 -8.742 1.00 . A A . 805 LYS NZ 1 1 1 387 1 1 26 LYS O O 2.851 -0.110 -4.824 1.00 . A A . 805 LYS O 1 1 1 388 1 1 27 TYR C C -0.506 -0.516 -4.760 1.00 . A A . 806 TYR C 1 1 1 389 1 1 27 TYR CA C 0.251 0.312 -5.777 1.00 . A A . 806 TYR CA 1 1 1 390 1 1 27 TYR CB C -0.741 0.860 -6.804 1.00 . A A . 806 TYR CB 1 1 1 391 1 1 27 TYR CD1 C 0.001 3.090 -7.721 1.00 . A A . 806 TYR CD1 1 1 1 392 1 1 27 TYR CD2 C 0.315 1.152 -9.075 1.00 . A A . 806 TYR CD2 1 1 1 393 1 1 27 TYR CE1 C 0.547 3.880 -8.714 1.00 . A A . 806 TYR CE1 1 1 1 394 1 1 27 TYR CE2 C 0.859 1.934 -10.075 1.00 . A A . 806 TYR CE2 1 1 1 395 1 1 27 TYR CG C -0.124 1.716 -7.885 1.00 . A A . 806 TYR CG 1 1 1 396 1 1 27 TYR CZ C 0.973 3.297 -9.890 1.00 . A A . 806 TYR CZ 1 1 1 397 1 1 27 TYR H H 1.046 -1.036 -7.193 1.00 . A A . 806 TYR H 1 1 1 398 1 1 27 TYR HA H 0.717 1.132 -5.252 1.00 . A A . 806 TYR HA 1 1 1 399 1 1 27 TYR HB2 H -1.239 0.031 -7.284 1.00 . A A . 806 TYR HB2 1 1 1 400 1 1 27 TYR HB3 H -1.478 1.459 -6.290 1.00 . A A . 806 TYR HB3 1 1 1 401 1 1 27 TYR HD1 H -0.332 3.543 -6.799 1.00 . A A . 806 TYR HD1 1 1 1 402 1 1 27 TYR HD2 H 0.223 0.084 -9.217 1.00 . A A . 806 TYR HD2 1 1 1 403 1 1 27 TYR HE1 H 0.637 4.947 -8.570 1.00 . A A . 806 TYR HE1 1 1 1 404 1 1 27 TYR HE2 H 1.196 1.476 -10.994 1.00 . A A . 806 TYR HE2 1 1 1 405 1 1 27 TYR HH H 1.049 3.879 -11.724 1.00 . A A . 806 TYR HH 1 1 1 406 1 1 27 TYR N N 1.285 -0.502 -6.407 1.00 . A A . 806 TYR N 1 1 1 407 1 1 27 TYR O O -0.831 -1.679 -5.003 1.00 . A A . 806 TYR O 1 1 1 408 1 1 27 TYR OH O 1.506 4.078 -10.890 1.00 . A A . 806 TYR OH 1 1 1 409 1 1 28 ALA C C -2.114 0.421 -1.639 1.00 . A A . 807 ALA C 1 1 1 410 1 1 28 ALA CA C -1.428 -0.589 -2.529 1.00 . A A . 807 ALA CA 1 1 1 411 1 1 28 ALA CB C -0.391 -1.385 -1.743 1.00 . A A . 807 ALA CB 1 1 1 412 1 1 28 ALA H H -0.519 1.042 -3.526 1.00 . A A . 807 ALA H 1 1 1 413 1 1 28 ALA HA H -2.160 -1.275 -2.929 1.00 . A A . 807 ALA HA 1 1 1 414 1 1 28 ALA HB1 H 0.078 -2.106 -2.397 1.00 . A A . 807 ALA HB1 1 1 1 415 1 1 28 ALA HB2 H -0.875 -1.901 -0.929 1.00 . A A . 807 ALA HB2 1 1 1 416 1 1 28 ALA HB3 H 0.360 -0.713 -1.350 1.00 . A A . 807 ALA HB3 1 1 1 417 1 1 28 ALA N N -0.785 0.096 -3.630 1.00 . A A . 807 ALA N 1 1 1 418 1 1 28 ALA O O -1.812 1.616 -1.712 1.00 . A A . 807 ALA O 1 1 1 419 1 1 29 PRO C C -2.713 1.400 1.128 1.00 . A A . 808 PRO C 1 1 1 420 1 1 29 PRO CA C -3.725 0.875 0.128 1.00 . A A . 808 PRO CA 1 1 1 421 1 1 29 PRO CB C -4.789 0.007 0.810 1.00 . A A . 808 PRO CB 1 1 1 422 1 1 29 PRO CD C -3.596 -1.388 -0.730 1.00 . A A . 808 PRO CD 1 1 1 423 1 1 29 PRO CG C -4.924 -1.204 -0.052 1.00 . A A . 808 PRO CG 1 1 1 424 1 1 29 PRO HA H -4.184 1.704 -0.388 1.00 . A A . 808 PRO HA 1 1 1 425 1 1 29 PRO HB2 H -4.459 -0.252 1.805 1.00 . A A . 808 PRO HB2 1 1 1 426 1 1 29 PRO HB3 H -5.719 0.555 0.866 1.00 . A A . 808 PRO HB3 1 1 1 427 1 1 29 PRO HD2 H -2.949 -2.013 -0.132 1.00 . A A . 808 PRO HD2 1 1 1 428 1 1 29 PRO HD3 H -3.727 -1.810 -1.715 1.00 . A A . 808 PRO HD3 1 1 1 429 1 1 29 PRO HG2 H -5.152 -2.066 0.557 1.00 . A A . 808 PRO HG2 1 1 1 430 1 1 29 PRO HG3 H -5.700 -1.048 -0.787 1.00 . A A . 808 PRO HG3 1 1 1 431 1 1 29 PRO N N -3.073 -0.017 -0.813 1.00 . A A . 808 PRO N 1 1 1 432 1 1 29 PRO O O -1.975 0.626 1.735 1.00 . A A . 808 PRO O 1 1 1 433 1 1 30 ALA C C -1.524 2.809 3.473 1.00 . A A . 809 ALA C 1 1 1 434 1 1 30 ALA CA C -1.703 3.447 2.092 1.00 . A A . 809 ALA CA 1 1 1 435 1 1 30 ALA CB C -2.127 4.902 2.235 1.00 . A A . 809 ALA CB 1 1 1 436 1 1 30 ALA H H -3.258 3.249 0.650 1.00 . A A . 809 ALA H 1 1 1 437 1 1 30 ALA HA H -0.742 3.430 1.599 1.00 . A A . 809 ALA HA 1 1 1 438 1 1 30 ALA HB1 H -2.264 5.335 1.254 1.00 . A A . 809 ALA HB1 1 1 1 439 1 1 30 ALA HB2 H -1.362 5.450 2.765 1.00 . A A . 809 ALA HB2 1 1 1 440 1 1 30 ALA HB3 H -3.055 4.957 2.785 1.00 . A A . 809 ALA HB3 1 1 1 441 1 1 30 ALA N N -2.659 2.726 1.228 1.00 . A A . 809 ALA N 1 1 1 442 1 1 30 ALA O O -0.471 2.941 4.093 1.00 . A A . 809 ALA O 1 1 1 443 1 1 31 GLU C C -1.426 0.345 5.270 1.00 . A A . 810 GLU C 1 1 1 444 1 1 31 GLU CA C -2.517 1.423 5.216 1.00 . A A . 810 GLU CA 1 1 1 445 1 1 31 GLU CB C -3.884 0.798 5.471 1.00 . A A . 810 GLU CB 1 1 1 446 1 1 31 GLU CD C -5.649 0.248 7.181 1.00 . A A . 810 GLU CD 1 1 1 447 1 1 31 GLU CG C -4.238 0.738 6.938 1.00 . A A . 810 GLU CG 1 1 1 448 1 1 31 GLU H H -3.342 2.031 3.373 1.00 . A A . 810 GLU H 1 1 1 449 1 1 31 GLU HA H -2.319 2.132 6.003 1.00 . A A . 810 GLU HA 1 1 1 450 1 1 31 GLU HB2 H -4.636 1.381 4.961 1.00 . A A . 810 GLU HB2 1 1 1 451 1 1 31 GLU HB3 H -3.889 -0.208 5.078 1.00 . A A . 810 GLU HB3 1 1 1 452 1 1 31 GLU HG2 H -3.550 0.071 7.434 1.00 . A A . 810 GLU HG2 1 1 1 453 1 1 31 GLU HG3 H -4.141 1.730 7.352 1.00 . A A . 810 GLU HG3 1 1 1 454 1 1 31 GLU N N -2.545 2.114 3.934 1.00 . A A . 810 GLU N 1 1 1 455 1 1 31 GLU O O -0.922 0.015 6.344 1.00 . A A . 810 GLU O 1 1 1 456 1 1 31 GLU OE1 O -5.844 -0.983 7.310 1.00 . A A . 810 GLU OE1 1 1 1 457 1 1 31 GLU OE2 O -6.564 1.093 7.257 1.00 . A A . 810 GLU OE2 1 1 1 458 1 1 32 GLN C C 1.331 -0.663 3.958 1.00 . A A . 811 GLN C 1 1 1 459 1 1 32 GLN CA C -0.075 -1.258 4.034 1.00 . A A . 811 GLN CA 1 1 1 460 1 1 32 GLN CB C -0.393 -2.154 2.825 1.00 . A A . 811 GLN CB 1 1 1 461 1 1 32 GLN CD C 1.440 -3.022 1.295 1.00 . A A . 811 GLN CD 1 1 1 462 1 1 32 GLN CG C 0.622 -3.257 2.557 1.00 . A A . 811 GLN CG 1 1 1 463 1 1 32 GLN H H -1.424 0.169 3.279 1.00 . A A . 811 GLN H 1 1 1 464 1 1 32 GLN HA H -0.159 -1.839 4.941 1.00 . A A . 811 GLN HA 1 1 1 465 1 1 32 GLN HB2 H -1.351 -2.623 2.994 1.00 . A A . 811 GLN HB2 1 1 1 466 1 1 32 GLN HB3 H -0.464 -1.538 1.943 1.00 . A A . 811 GLN HB3 1 1 1 467 1 1 32 GLN HE21 H 1.349 -1.050 1.531 1.00 . A A . 811 GLN HE21 1 1 1 468 1 1 32 GLN HE22 H 2.195 -1.601 0.137 1.00 . A A . 811 GLN HE22 1 1 1 469 1 1 32 GLN HG2 H 1.298 -3.317 3.396 1.00 . A A . 811 GLN HG2 1 1 1 470 1 1 32 GLN HG3 H 0.093 -4.192 2.456 1.00 . A A . 811 GLN HG3 1 1 1 471 1 1 32 GLN N N -1.057 -0.190 4.113 1.00 . A A . 811 GLN N 1 1 1 472 1 1 32 GLN NE2 N 1.690 -1.764 0.957 1.00 . A A . 811 GLN NE2 1 1 1 473 1 1 32 GLN O O 2.335 -1.374 3.975 1.00 . A A . 811 GLN O 1 1 1 474 1 1 32 GLN OE1 O 1.856 -3.969 0.632 1.00 . A A . 811 GLN OE1 1 1 1 475 1 1 33 PHE C C 3.225 1.641 5.170 1.00 . A A . 812 PHE C 1 1 1 476 1 1 33 PHE CA C 2.665 1.347 3.793 1.00 . A A . 812 PHE CA 1 1 1 477 1 1 33 PHE CB C 2.535 2.605 2.934 1.00 . A A . 812 PHE CB 1 1 1 478 1 1 33 PHE CD1 C 1.112 1.950 0.978 1.00 . A A . 812 PHE CD1 1 1 1 479 1 1 33 PHE CD2 C 3.442 2.290 0.622 1.00 . A A . 812 PHE CD2 1 1 1 480 1 1 33 PHE CE1 C 0.953 1.633 -0.354 1.00 . A A . 812 PHE CE1 1 1 1 481 1 1 33 PHE CE2 C 3.288 1.977 -0.711 1.00 . A A . 812 PHE CE2 1 1 1 482 1 1 33 PHE CG C 2.356 2.283 1.480 1.00 . A A . 812 PHE CG 1 1 1 483 1 1 33 PHE CZ C 2.043 1.646 -1.198 1.00 . A A . 812 PHE CZ 1 1 1 484 1 1 33 PHE H H 0.593 1.178 4.167 1.00 . A A . 812 PHE H 1 1 1 485 1 1 33 PHE HA H 3.350 0.659 3.319 1.00 . A A . 812 PHE HA 1 1 1 486 1 1 33 PHE HB2 H 1.675 3.174 3.261 1.00 . A A . 812 PHE HB2 1 1 1 487 1 1 33 PHE HB3 H 3.426 3.205 3.039 1.00 . A A . 812 PHE HB3 1 1 1 488 1 1 33 PHE HD1 H 0.258 1.940 1.641 1.00 . A A . 812 PHE HD1 1 1 1 489 1 1 33 PHE HD2 H 4.418 2.547 1.004 1.00 . A A . 812 PHE HD2 1 1 1 490 1 1 33 PHE HE1 H -0.025 1.375 -0.736 1.00 . A A . 812 PHE HE1 1 1 1 491 1 1 33 PHE HE2 H 4.143 1.988 -1.371 1.00 . A A . 812 PHE HE2 1 1 1 492 1 1 33 PHE HZ H 1.920 1.398 -2.243 1.00 . A A . 812 PHE HZ 1 1 1 493 1 1 33 PHE N N 1.395 0.661 3.934 1.00 . A A . 812 PHE N 1 1 1 494 1 1 33 PHE O O 3.429 2.791 5.563 1.00 . A A . 812 PHE O 1 1 1 495 1 1 34 ARG C C 5.451 1.043 7.261 1.00 . A A . 813 ARG C 1 1 1 496 1 1 34 ARG CA C 3.998 0.586 7.240 1.00 . A A . 813 ARG CA 1 1 1 497 1 1 34 ARG CB C 3.878 -0.807 7.856 1.00 . A A . 813 ARG CB 1 1 1 498 1 1 34 ARG CD C 1.606 -0.758 8.922 1.00 . A A . 813 ARG CD 1 1 1 499 1 1 34 ARG CG C 2.463 -1.355 7.822 1.00 . A A . 813 ARG CG 1 1 1 500 1 1 34 ARG CZ C 1.172 -1.983 11.007 1.00 . A A . 813 ARG CZ 1 1 1 501 1 1 34 ARG H H 3.303 -0.320 5.463 1.00 . A A . 813 ARG H 1 1 1 502 1 1 34 ARG HA H 3.396 1.281 7.804 1.00 . A A . 813 ARG HA 1 1 1 503 1 1 34 ARG HB2 H 4.518 -1.487 7.310 1.00 . A A . 813 ARG HB2 1 1 1 504 1 1 34 ARG HB3 H 4.204 -0.766 8.885 1.00 . A A . 813 ARG HB3 1 1 1 505 1 1 34 ARG HD2 H 1.729 0.316 8.919 1.00 . A A . 813 ARG HD2 1 1 1 506 1 1 34 ARG HD3 H 0.570 -1.002 8.732 1.00 . A A . 813 ARG HD3 1 1 1 507 1 1 34 ARG HE H 2.919 -1.130 10.522 1.00 . A A . 813 ARG HE 1 1 1 508 1 1 34 ARG HG2 H 2.020 -1.119 6.866 1.00 . A A . 813 ARG HG2 1 1 1 509 1 1 34 ARG HG3 H 2.500 -2.427 7.949 1.00 . A A . 813 ARG HG3 1 1 1 510 1 1 34 ARG HH11 H -0.477 -1.650 9.865 1.00 . A A . 813 ARG HH11 1 1 1 511 1 1 34 ARG HH12 H -0.726 -2.656 11.261 1.00 . A A . 813 ARG HH12 1 1 1 512 1 1 34 ARG HH21 H 2.609 -2.439 12.367 1.00 . A A . 813 ARG HH21 1 1 1 513 1 1 34 ARG HH22 H 1.023 -3.069 12.711 1.00 . A A . 813 ARG HH22 1 1 1 514 1 1 34 ARG N N 3.491 0.551 5.877 1.00 . A A . 813 ARG N 1 1 1 515 1 1 34 ARG NE N 1.985 -1.278 10.230 1.00 . A A . 813 ARG NE 1 1 1 516 1 1 34 ARG NH1 N -0.113 -2.099 10.692 1.00 . A A . 813 ARG NH1 1 1 1 517 1 1 34 ARG NH2 N 1.634 -2.540 12.117 1.00 . A A . 813 ARG NH2 1 1 1 518 1 1 34 ARG O O 6.033 1.259 8.325 1.00 . A A . 813 ARG O 1 1 1 519 1 1 35 GLY C C 7.302 3.299 6.017 1.00 . A A . 814 GLY C 1 1 1 520 1 1 35 GLY CA C 7.347 1.782 5.958 1.00 . A A . 814 GLY CA 1 1 1 521 1 1 35 GLY H H 5.518 0.963 5.272 1.00 . A A . 814 GLY H 1 1 1 522 1 1 35 GLY HA2 H 7.959 1.414 6.767 1.00 . A A . 814 GLY HA2 1 1 1 523 1 1 35 GLY HA3 H 7.780 1.479 5.016 1.00 . A A . 814 GLY HA3 1 1 1 524 1 1 35 GLY N N 6.018 1.216 6.075 1.00 . A A . 814 GLY N 1 1 1 525 1 1 35 GLY O O 8.081 3.982 5.348 1.00 . A A . 814 GLY O 1 1 1 526 1 1 36 SER C C 5.895 5.927 5.646 1.00 . A A . 815 SER C 1 1 1 527 1 1 36 SER CA C 6.147 5.242 6.986 1.00 . A A . 815 SER CA 1 1 1 528 1 1 36 SER CB C 7.328 5.865 7.731 1.00 . A A . 815 SER CB 1 1 1 529 1 1 36 SER H H 5.780 3.193 7.304 1.00 . A A . 815 SER H 1 1 1 530 1 1 36 SER HA H 5.247 5.379 7.568 1.00 . A A . 815 SER HA 1 1 1 531 1 1 36 SER HB2 H 8.205 5.826 7.105 1.00 . A A . 815 SER HB2 1 1 1 532 1 1 36 SER HB3 H 7.100 6.893 7.974 1.00 . A A . 815 SER HB3 1 1 1 533 1 1 36 SER HG H 8.515 4.871 8.939 1.00 . A A . 815 SER HG 1 1 1 534 1 1 36 SER N N 6.356 3.810 6.810 1.00 . A A . 815 SER N 1 1 1 535 1 1 36 SER O O 6.491 6.959 5.336 1.00 . A A . 815 SER O 1 1 1 536 1 1 36 SER OG O 7.590 5.155 8.935 1.00 . A A . 815 SER OG 1 1 1 537 1 1 37 LYS C C 5.625 6.286 2.676 1.00 . A A . 816 LYS C 1 1 1 538 1 1 37 LYS CA C 4.489 5.905 3.623 1.00 . A A . 816 LYS CA 1 1 1 539 1 1 37 LYS CB C 3.634 7.134 3.932 1.00 . A A . 816 LYS CB 1 1 1 540 1 1 37 LYS CD C 1.540 5.845 4.490 1.00 . A A . 816 LYS CD 1 1 1 541 1 1 37 LYS CE C 0.453 5.605 5.528 1.00 . A A . 816 LYS CE 1 1 1 542 1 1 37 LYS CG C 2.541 6.886 4.962 1.00 . A A . 816 LYS CG 1 1 1 543 1 1 37 LYS H H 4.706 4.410 5.103 1.00 . A A . 816 LYS H 1 1 1 544 1 1 37 LYS HA H 3.872 5.156 3.135 1.00 . A A . 816 LYS HA 1 1 1 545 1 1 37 LYS HB2 H 4.279 7.916 4.306 1.00 . A A . 816 LYS HB2 1 1 1 546 1 1 37 LYS HB3 H 3.170 7.471 3.018 1.00 . A A . 816 LYS HB3 1 1 1 547 1 1 37 LYS HD2 H 1.080 6.193 3.576 1.00 . A A . 816 LYS HD2 1 1 1 548 1 1 37 LYS HD3 H 2.060 4.917 4.304 1.00 . A A . 816 LYS HD3 1 1 1 549 1 1 37 LYS HE2 H -0.226 4.855 5.151 1.00 . A A . 816 LYS HE2 1 1 1 550 1 1 37 LYS HE3 H 0.916 5.249 6.435 1.00 . A A . 816 LYS HE3 1 1 1 551 1 1 37 LYS HG2 H 2.996 6.540 5.878 1.00 . A A . 816 LYS HG2 1 1 1 552 1 1 37 LYS HG3 H 2.021 7.815 5.146 1.00 . A A . 816 LYS HG3 1 1 1 553 1 1 37 LYS HZ1 H -1.162 6.614 6.395 1.00 . A A . 816 LYS HZ1 1 1 1 554 1 1 37 LYS HZ2 H -0.614 7.304 4.944 1.00 . A A . 816 LYS HZ2 1 1 1 555 1 1 37 LYS HZ3 H 0.278 7.508 6.371 1.00 . A A . 816 LYS HZ3 1 1 1 556 1 1 37 LYS N N 5.003 5.314 4.859 1.00 . A A . 816 LYS N 1 1 1 557 1 1 37 LYS NZ N -0.314 6.842 5.829 1.00 . A A . 816 LYS NZ 1 1 1 558 1 1 37 LYS O O 5.766 7.442 2.272 1.00 . A A . 816 LYS O 1 1 1 559 1 1 38 ARG C C 7.638 4.193 0.572 1.00 . A A . 817 ARG C 1 1 1 560 1 1 38 ARG CA C 7.535 5.455 1.402 1.00 . A A . 817 ARG CA 1 1 1 561 1 1 38 ARG CB C 8.857 5.641 2.156 1.00 . A A . 817 ARG CB 1 1 1 562 1 1 38 ARG CD C 10.413 7.062 3.491 1.00 . A A . 817 ARG CD 1 1 1 563 1 1 38 ARG CG C 9.075 7.014 2.766 1.00 . A A . 817 ARG CG 1 1 1 564 1 1 38 ARG CZ C 10.913 8.703 5.262 1.00 . A A . 817 ARG CZ 1 1 1 565 1 1 38 ARG H H 6.250 4.399 2.677 1.00 . A A . 817 ARG H 1 1 1 566 1 1 38 ARG HA H 7.358 6.301 0.753 1.00 . A A . 817 ARG HA 1 1 1 567 1 1 38 ARG HB2 H 8.898 4.915 2.953 1.00 . A A . 817 ARG HB2 1 1 1 568 1 1 38 ARG HB3 H 9.670 5.446 1.471 1.00 . A A . 817 ARG HB3 1 1 1 569 1 1 38 ARG HD2 H 10.372 6.390 4.334 1.00 . A A . 817 ARG HD2 1 1 1 570 1 1 38 ARG HD3 H 11.185 6.734 2.811 1.00 . A A . 817 ARG HD3 1 1 1 571 1 1 38 ARG HE H 10.893 9.103 3.295 1.00 . A A . 817 ARG HE 1 1 1 572 1 1 38 ARG HG2 H 9.065 7.757 1.983 1.00 . A A . 817 ARG HG2 1 1 1 573 1 1 38 ARG HG3 H 8.284 7.217 3.473 1.00 . A A . 817 ARG HG3 1 1 1 574 1 1 38 ARG HH11 H 10.430 6.855 5.928 1.00 . A A . 817 ARG HH11 1 1 1 575 1 1 38 ARG HH12 H 10.851 7.997 7.166 1.00 . A A . 817 ARG HH12 1 1 1 576 1 1 38 ARG HH21 H 11.451 10.633 4.924 1.00 . A A . 817 ARG HH21 1 1 1 577 1 1 38 ARG HH22 H 11.388 10.155 6.600 1.00 . A A . 817 ARG HH22 1 1 1 578 1 1 38 ARG N N 6.419 5.294 2.323 1.00 . A A . 817 ARG N 1 1 1 579 1 1 38 ARG NE N 10.749 8.400 3.976 1.00 . A A . 817 ARG NE 1 1 1 580 1 1 38 ARG NH1 N 10.709 7.777 6.192 1.00 . A A . 817 ARG NH1 1 1 1 581 1 1 38 ARG NH2 N 11.283 9.925 5.621 1.00 . A A . 817 ARG NH2 1 1 1 582 1 1 38 ARG O O 7.838 4.225 -0.641 1.00 . A A . 817 ARG O 1 1 1 583 1 1 39 PHE C C 6.413 0.931 1.206 1.00 . A A . 818 PHE C 1 1 1 584 1 1 39 PHE CA C 7.547 1.771 0.659 1.00 . A A . 818 PHE CA 1 1 1 585 1 1 39 PHE CB C 8.893 1.111 0.986 1.00 . A A . 818 PHE CB 1 1 1 586 1 1 39 PHE CD1 C 10.507 1.763 -0.814 1.00 . A A . 818 PHE CD1 1 1 1 587 1 1 39 PHE CD2 C 10.717 2.805 1.314 1.00 . A A . 818 PHE CD2 1 1 1 588 1 1 39 PHE CE1 C 11.572 2.503 -1.286 1.00 . A A . 818 PHE CE1 1 1 1 589 1 1 39 PHE CE2 C 11.778 3.551 0.849 1.00 . A A . 818 PHE CE2 1 1 1 590 1 1 39 PHE CG C 10.069 1.904 0.488 1.00 . A A . 818 PHE CG 1 1 1 591 1 1 39 PHE CZ C 12.209 3.399 -0.452 1.00 . A A . 818 PHE CZ 1 1 1 592 1 1 39 PHE H H 7.319 3.126 2.224 1.00 . A A . 818 PHE H 1 1 1 593 1 1 39 PHE HA H 7.468 1.871 -0.412 1.00 . A A . 818 PHE HA 1 1 1 594 1 1 39 PHE HB2 H 8.989 1.006 2.057 1.00 . A A . 818 PHE HB2 1 1 1 595 1 1 39 PHE HB3 H 8.931 0.135 0.526 1.00 . A A . 818 PHE HB3 1 1 1 596 1 1 39 PHE HD1 H 10.008 1.060 -1.467 1.00 . A A . 818 PHE HD1 1 1 1 597 1 1 39 PHE HD2 H 10.381 2.921 2.334 1.00 . A A . 818 PHE HD2 1 1 1 598 1 1 39 PHE HE1 H 11.907 2.382 -2.305 1.00 . A A . 818 PHE HE1 1 1 1 599 1 1 39 PHE HE2 H 12.274 4.250 1.504 1.00 . A A . 818 PHE HE2 1 1 1 600 1 1 39 PHE HZ H 13.042 3.982 -0.820 1.00 . A A . 818 PHE HZ 1 1 1 601 1 1 39 PHE N N 7.483 3.075 1.261 1.00 . A A . 818 PHE N 1 1 1 602 1 1 39 PHE O O 5.811 1.286 2.225 1.00 . A A . 818 PHE O 1 1 1 603 1 1 40 CYS C C 5.850 -1.858 2.234 1.00 . A A . 819 CYS C 1 1 1 604 1 1 40 CYS CA C 5.192 -1.146 1.036 1.00 . A A . 819 CYS CA 1 1 1 605 1 1 40 CYS CB C 4.728 -2.068 -0.098 1.00 . A A . 819 CYS CB 1 1 1 606 1 1 40 CYS H H 6.594 -0.354 -0.293 1.00 . A A . 819 CYS H 1 1 1 607 1 1 40 CYS HA H 4.342 -0.636 1.468 1.00 . A A . 819 CYS HA 1 1 1 608 1 1 40 CYS HB2 H 4.314 -2.961 0.317 1.00 . A A . 819 CYS HB2 1 1 1 609 1 1 40 CYS HB3 H 3.963 -1.559 -0.668 1.00 . A A . 819 CYS HB3 1 1 1 610 1 1 40 CYS N N 6.107 -0.151 0.525 1.00 . A A . 819 CYS N 1 1 1 611 1 1 40 CYS O O 6.737 -1.289 2.864 1.00 . A A . 819 CYS O 1 1 1 612 1 1 40 CYS SG S 6.026 -2.554 -1.252 1.00 . A A . 819 CYS SG 1 1 1 613 1 1 41 SER C C 7.126 -4.001 4.153 1.00 . A A . 820 SER C 1 1 1 614 1 1 41 SER CA C 5.640 -3.656 3.877 1.00 . A A . 820 SER CA 1 1 1 615 1 1 41 SER CB C 4.742 -4.885 3.988 1.00 . A A . 820 SER CB 1 1 1 616 1 1 41 SER H H 4.983 -3.607 1.877 1.00 . A A . 820 SER H 1 1 1 617 1 1 41 SER HA H 5.329 -2.953 4.635 1.00 . A A . 820 SER HA 1 1 1 618 1 1 41 SER HB2 H 4.977 -5.426 4.893 1.00 . A A . 820 SER HB2 1 1 1 619 1 1 41 SER HB3 H 3.708 -4.560 4.013 1.00 . A A . 820 SER HB3 1 1 1 620 1 1 41 SER HG H 4.227 -6.413 2.869 1.00 . A A . 820 SER HG 1 1 1 621 1 1 41 SER N N 5.408 -3.063 2.562 1.00 . A A . 820 SER N 1 1 1 622 1 1 41 SER O O 8.013 -3.182 3.922 1.00 . A A . 820 SER O 1 1 1 623 1 1 41 SER OG O 4.920 -5.746 2.873 1.00 . A A . 820 SER OG 1 1 1 624 1 1 42 MET C C 9.830 -5.633 4.284 1.00 . A A . 821 MET C 1 1 1 625 1 1 42 MET CA C 8.700 -5.467 5.279 1.00 . A A . 821 MET CA 1 1 1 626 1 1 42 MET CB C 8.609 -6.712 6.162 1.00 . A A . 821 MET CB 1 1 1 627 1 1 42 MET CE C 7.797 -3.842 8.180 1.00 . A A . 821 MET CE 1 1 1 628 1 1 42 MET CG C 7.761 -6.522 7.409 1.00 . A A . 821 MET CG 1 1 1 629 1 1 42 MET H H 6.779 -5.946 4.490 1.00 . A A . 821 MET H 1 1 1 630 1 1 42 MET HA H 8.922 -4.624 5.914 1.00 . A A . 821 MET HA 1 1 1 631 1 1 42 MET HB2 H 8.181 -7.517 5.584 1.00 . A A . 821 MET HB2 1 1 1 632 1 1 42 MET HB3 H 9.605 -6.995 6.470 1.00 . A A . 821 MET HB3 1 1 1 633 1 1 42 MET HE1 H 6.720 -3.920 8.194 1.00 . A A . 821 MET HE1 1 1 1 634 1 1 42 MET HE2 H 8.124 -3.560 7.191 1.00 . A A . 821 MET HE2 1 1 1 635 1 1 42 MET HE3 H 8.111 -3.091 8.888 1.00 . A A . 821 MET HE3 1 1 1 636 1 1 42 MET HG2 H 6.818 -6.095 7.111 1.00 . A A . 821 MET HG2 1 1 1 637 1 1 42 MET HG3 H 7.591 -7.487 7.867 1.00 . A A . 821 MET HG3 1 1 1 638 1 1 42 MET N N 7.416 -5.210 4.619 1.00 . A A . 821 MET N 1 1 1 639 1 1 42 MET O O 10.802 -4.884 4.334 1.00 . A A . 821 MET O 1 1 1 640 1 1 42 MET SD S 8.516 -5.425 8.631 1.00 . A A . 821 MET SD 1 1 1 641 1 1 43 THR C C 11.227 -5.589 1.713 1.00 . A A . 822 THR C 1 1 1 642 1 1 43 THR CA C 10.691 -6.870 2.358 1.00 . A A . 822 THR CA 1 1 1 643 1 1 43 THR CB C 10.076 -7.744 1.248 1.00 . A A . 822 THR CB 1 1 1 644 1 1 43 THR CG2 C 11.161 -8.390 0.404 1.00 . A A . 822 THR CG2 1 1 1 645 1 1 43 THR H H 8.882 -7.158 3.418 1.00 . A A . 822 THR H 1 1 1 646 1 1 43 THR HA H 11.525 -7.414 2.780 1.00 . A A . 822 THR HA 1 1 1 647 1 1 43 THR HB H 9.468 -7.119 0.612 1.00 . A A . 822 THR HB 1 1 1 648 1 1 43 THR HG1 H 8.644 -9.105 1.143 1.00 . A A . 822 THR HG1 1 1 1 649 1 1 43 THR HG21 H 10.706 -8.971 -0.384 1.00 . A A . 822 THR HG21 1 1 1 650 1 1 43 THR HG22 H 11.763 -9.034 1.028 1.00 . A A . 822 THR HG22 1 1 1 651 1 1 43 THR HG23 H 11.784 -7.621 -0.029 1.00 . A A . 822 THR HG23 1 1 1 652 1 1 43 THR N N 9.685 -6.590 3.379 1.00 . A A . 822 THR N 1 1 1 653 1 1 43 THR O O 12.437 -5.369 1.645 1.00 . A A . 822 THR O 1 1 1 654 1 1 43 THR OG1 O 9.250 -8.765 1.827 1.00 . A A . 822 THR OG1 1 1 1 655 1 1 44 CYS C C 11.257 -2.445 1.430 1.00 . A A . 823 CYS C 1 1 1 656 1 1 44 CYS CA C 10.681 -3.543 0.533 1.00 . A A . 823 CYS CA 1 1 1 657 1 1 44 CYS CB C 9.471 -3.061 -0.233 1.00 . A A . 823 CYS CB 1 1 1 658 1 1 44 CYS H H 9.375 -4.954 1.399 1.00 . A A . 823 CYS H 1 1 1 659 1 1 44 CYS HA H 11.433 -3.809 -0.194 1.00 . A A . 823 CYS HA 1 1 1 660 1 1 44 CYS HB2 H 8.629 -2.970 0.442 1.00 . A A . 823 CYS HB2 1 1 1 661 1 1 44 CYS HB3 H 9.684 -2.103 -0.681 1.00 . A A . 823 CYS HB3 1 1 1 662 1 1 44 CYS N N 10.321 -4.754 1.248 1.00 . A A . 823 CYS N 1 1 1 663 1 1 44 CYS O O 12.349 -1.940 1.158 1.00 . A A . 823 CYS O 1 1 1 664 1 1 44 CYS SG S 9.012 -4.209 -1.554 1.00 . A A . 823 CYS SG 1 1 1 665 1 1 45 ALA C C 12.350 -1.305 3.974 1.00 . A A . 824 ALA C 1 1 1 666 1 1 45 ALA CA C 10.988 -0.992 3.367 1.00 . A A . 824 ALA CA 1 1 1 667 1 1 45 ALA CB C 9.970 -0.736 4.464 1.00 . A A . 824 ALA CB 1 1 1 668 1 1 45 ALA H H 9.706 -2.540 2.717 1.00 . A A . 824 ALA H 1 1 1 669 1 1 45 ALA HA H 11.074 -0.093 2.771 1.00 . A A . 824 ALA HA 1 1 1 670 1 1 45 ALA HB1 H 10.309 0.079 5.086 1.00 . A A . 824 ALA HB1 1 1 1 671 1 1 45 ALA HB2 H 9.857 -1.628 5.064 1.00 . A A . 824 ALA HB2 1 1 1 672 1 1 45 ALA HB3 H 9.020 -0.477 4.020 1.00 . A A . 824 ALA HB3 1 1 1 673 1 1 45 ALA N N 10.536 -2.067 2.490 1.00 . A A . 824 ALA N 1 1 1 674 1 1 45 ALA O O 13.239 -0.452 3.996 1.00 . A A . 824 ALA O 1 1 1 675 1 1 46 LYS C C 14.909 -2.953 4.017 1.00 . A A . 825 LYS C 1 1 1 676 1 1 46 LYS CA C 13.790 -2.933 5.055 1.00 . A A . 825 LYS CA 1 1 1 677 1 1 46 LYS CB C 13.692 -4.315 5.707 1.00 . A A . 825 LYS CB 1 1 1 678 1 1 46 LYS CD C 13.932 -6.793 5.375 1.00 . A A . 825 LYS CD 1 1 1 679 1 1 46 LYS CE C 15.363 -6.849 5.888 1.00 . A A . 825 LYS CE 1 1 1 680 1 1 46 LYS CG C 13.638 -5.463 4.711 1.00 . A A . 825 LYS CG 1 1 1 681 1 1 46 LYS H H 11.776 -3.182 4.422 1.00 . A A . 825 LYS H 1 1 1 682 1 1 46 LYS HA H 14.035 -2.208 5.819 1.00 . A A . 825 LYS HA 1 1 1 683 1 1 46 LYS HB2 H 14.549 -4.459 6.345 1.00 . A A . 825 LYS HB2 1 1 1 684 1 1 46 LYS HB3 H 12.795 -4.349 6.310 1.00 . A A . 825 LYS HB3 1 1 1 685 1 1 46 LYS HD2 H 13.254 -6.926 6.206 1.00 . A A . 825 LYS HD2 1 1 1 686 1 1 46 LYS HD3 H 13.783 -7.585 4.655 1.00 . A A . 825 LYS HD3 1 1 1 687 1 1 46 LYS HE2 H 16.034 -6.609 5.077 1.00 . A A . 825 LYS HE2 1 1 1 688 1 1 46 LYS HE3 H 15.477 -6.116 6.673 1.00 . A A . 825 LYS HE3 1 1 1 689 1 1 46 LYS HG2 H 12.652 -5.503 4.277 1.00 . A A . 825 LYS HG2 1 1 1 690 1 1 46 LYS HG3 H 14.368 -5.289 3.935 1.00 . A A . 825 LYS HG3 1 1 1 691 1 1 46 LYS HZ1 H 15.549 -8.920 5.698 1.00 . A A . 825 LYS HZ1 1 1 1 692 1 1 46 LYS HZ2 H 15.133 -8.411 7.262 1.00 . A A . 825 LYS HZ2 1 1 1 693 1 1 46 LYS HZ3 H 16.720 -8.212 6.699 1.00 . A A . 825 LYS HZ3 1 1 1 694 1 1 46 LYS N N 12.524 -2.534 4.455 1.00 . A A . 825 LYS N 1 1 1 695 1 1 46 LYS NZ N 15.713 -8.189 6.424 1.00 . A A . 825 LYS NZ 1 1 1 696 1 1 46 LYS O O 16.071 -2.766 4.359 1.00 . A A . 825 LYS O 1 1 1 697 1 1 47 ARG C C 16.202 -2.019 1.371 1.00 . A A . 826 ARG C 1 1 1 698 1 1 47 ARG CA C 15.569 -3.360 1.714 1.00 . A A . 826 ARG CA 1 1 1 699 1 1 47 ARG CB C 14.925 -4.000 0.483 1.00 . A A . 826 ARG CB 1 1 1 700 1 1 47 ARG CD C 15.145 -5.205 -1.687 1.00 . A A . 826 ARG CD 1 1 1 701 1 1 47 ARG CG C 15.892 -4.454 -0.595 1.00 . A A . 826 ARG CG 1 1 1 702 1 1 47 ARG CZ C 15.654 -6.546 -3.685 1.00 . A A . 826 ARG CZ 1 1 1 703 1 1 47 ARG H H 13.608 -3.287 2.511 1.00 . A A . 826 ARG H 1 1 1 704 1 1 47 ARG HA H 16.310 -4.028 2.128 1.00 . A A . 826 ARG HA 1 1 1 705 1 1 47 ARG HB2 H 14.357 -4.860 0.803 1.00 . A A . 826 ARG HB2 1 1 1 706 1 1 47 ARG HB3 H 14.246 -3.284 0.043 1.00 . A A . 826 ARG HB3 1 1 1 707 1 1 47 ARG HD2 H 14.689 -6.080 -1.251 1.00 . A A . 826 ARG HD2 1 1 1 708 1 1 47 ARG HD3 H 14.373 -4.560 -2.079 1.00 . A A . 826 ARG HD3 1 1 1 709 1 1 47 ARG HE H 16.888 -5.193 -2.865 1.00 . A A . 826 ARG HE 1 1 1 710 1 1 47 ARG HG2 H 16.374 -3.588 -1.025 1.00 . A A . 826 ARG HG2 1 1 1 711 1 1 47 ARG HG3 H 16.633 -5.107 -0.157 1.00 . A A . 826 ARG HG3 1 1 1 712 1 1 47 ARG HH11 H 13.888 -6.985 -2.799 1.00 . A A . 826 ARG HH11 1 1 1 713 1 1 47 ARG HH12 H 14.217 -7.862 -4.263 1.00 . A A . 826 ARG HH12 1 1 1 714 1 1 47 ARG HH21 H 17.350 -6.367 -4.793 1.00 . A A . 826 ARG HH21 1 1 1 715 1 1 47 ARG HH22 H 16.195 -7.536 -5.370 1.00 . A A . 826 ARG HH22 1 1 1 716 1 1 47 ARG N N 14.560 -3.186 2.748 1.00 . A A . 826 ARG N 1 1 1 717 1 1 47 ARG NE N 16.008 -5.628 -2.785 1.00 . A A . 826 ARG NE 1 1 1 718 1 1 47 ARG NH1 N 14.495 -7.182 -3.569 1.00 . A A . 826 ARG NH1 1 1 1 719 1 1 47 ARG NH2 N 16.461 -6.839 -4.697 1.00 . A A . 826 ARG NH2 1 1 1 720 1 1 47 ARG O O 17.330 -1.947 0.879 1.00 . A A . 826 ARG O 1 1 1 721 1 1 48 TYR C C 16.740 0.862 2.646 1.00 . A A . 827 TYR C 1 1 1 722 1 1 48 TYR CA C 15.947 0.393 1.428 1.00 . A A . 827 TYR CA 1 1 1 723 1 1 48 TYR CB C 14.793 1.347 1.116 1.00 . A A . 827 TYR CB 1 1 1 724 1 1 48 TYR CD1 C 15.863 3.325 -0.043 1.00 . A A . 827 TYR CD1 1 1 1 725 1 1 48 TYR CD2 C 14.878 3.671 2.103 1.00 . A A . 827 TYR CD2 1 1 1 726 1 1 48 TYR CE1 C 16.212 4.661 -0.100 1.00 . A A . 827 TYR CE1 1 1 1 727 1 1 48 TYR CE2 C 15.226 5.006 2.052 1.00 . A A . 827 TYR CE2 1 1 1 728 1 1 48 TYR CG C 15.191 2.807 1.058 1.00 . A A . 827 TYR CG 1 1 1 729 1 1 48 TYR CZ C 15.891 5.496 0.950 1.00 . A A . 827 TYR CZ 1 1 1 730 1 1 48 TYR H H 14.580 -1.096 2.076 1.00 . A A . 827 TYR H 1 1 1 731 1 1 48 TYR HA H 16.629 0.354 0.593 1.00 . A A . 827 TYR HA 1 1 1 732 1 1 48 TYR HB2 H 14.366 1.082 0.159 1.00 . A A . 827 TYR HB2 1 1 1 733 1 1 48 TYR HB3 H 14.038 1.241 1.881 1.00 . A A . 827 TYR HB3 1 1 1 734 1 1 48 TYR HD1 H 16.114 2.667 -0.862 1.00 . A A . 827 TYR HD1 1 1 1 735 1 1 48 TYR HD2 H 14.358 3.285 2.967 1.00 . A A . 827 TYR HD2 1 1 1 736 1 1 48 TYR HE1 H 16.734 5.047 -0.965 1.00 . A A . 827 TYR HE1 1 1 1 737 1 1 48 TYR HE2 H 14.977 5.660 2.875 1.00 . A A . 827 TYR HE2 1 1 1 738 1 1 48 TYR HH H 16.569 7.112 1.764 1.00 . A A . 827 TYR HH 1 1 1 739 1 1 48 TYR N N 15.454 -0.958 1.644 1.00 . A A . 827 TYR N 1 1 1 740 1 1 48 TYR O O 17.727 1.585 2.512 1.00 . A A . 827 TYR O 1 1 1 741 1 1 48 TYR OH O 16.233 6.829 0.895 1.00 . A A . 827 TYR OH 1 1 1 742 1 1 49 ASN C C 16.791 2.294 5.332 1.00 . A A . 828 ASN C 1 1 1 743 1 1 49 ASN CA C 16.924 0.796 5.094 1.00 . A A . 828 ASN CA 1 1 1 744 1 1 49 ASN CB C 18.404 0.389 5.153 1.00 . A A . 828 ASN CB 1 1 1 745 1 1 49 ASN CG C 18.605 -1.102 5.323 1.00 . A A . 828 ASN CG 1 1 1 746 1 1 49 ASN H H 15.535 -0.191 3.841 1.00 . A A . 828 ASN H 1 1 1 747 1 1 49 ASN HA H 16.391 0.280 5.879 1.00 . A A . 828 ASN HA 1 1 1 748 1 1 49 ASN HB2 H 18.887 0.693 4.238 1.00 . A A . 828 ASN HB2 1 1 1 749 1 1 49 ASN HB3 H 18.876 0.894 5.984 1.00 . A A . 828 ASN HB3 1 1 1 750 1 1 49 ASN HD21 H 18.771 -1.329 3.358 1.00 . A A . 828 ASN HD21 1 1 1 751 1 1 49 ASN HD22 H 18.898 -2.774 4.296 1.00 . A A . 828 ASN HD22 1 1 1 752 1 1 49 ASN N N 16.306 0.414 3.824 1.00 . A A . 828 ASN N 1 1 1 753 1 1 49 ASN ND2 N 18.779 -1.806 4.215 1.00 . A A . 828 ASN ND2 1 1 1 754 1 1 49 ASN O O 17.791 3.025 5.151 1.00 . A A . 828 ASN O 1 1 1 755 1 1 49 ASN OXT O 15.687 2.737 5.702 1.00 . A A . 828 ASN OXT 1 1 1 756 1 1 49 ASN OD1 O 18.628 -1.615 6.444 1.00 . A A . 828 ASN OD1 1 1 1 757 2 2 1 ZN ZN ZN 7.789 -2.759 -2.571 1.00 . B A . 829 ZN ZN 1 1 2 758 1 1 1 GLY C C -25.999 1.187 -3.419 1.00 . A A . 1 GLY C 1 1 2 759 1 1 1 GLY CA C -27.341 0.913 -4.062 1.00 . A A . 1 GLY CA 1 1 2 760 1 1 1 GLY H1 H -29.181 1.857 -4.372 1.00 . A A . 1 GLY H1 1 1 2 761 1 1 1 GLY H2 H -27.848 2.907 -4.408 1.00 . A A . 1 GLY H2 1 1 2 762 1 1 1 GLY H3 H -28.407 2.300 -2.927 1.00 . A A . 1 GLY H3 1 1 2 763 1 1 1 GLY HA2 H -27.790 0.054 -3.584 1.00 . A A . 1 GLY HA2 1 1 2 764 1 1 1 GLY HA3 H -27.192 0.695 -5.111 1.00 . A A . 1 GLY HA3 1 1 2 765 1 1 1 GLY N N -28.259 2.073 -3.935 1.00 . A A . 1 GLY N 1 1 2 766 1 1 1 GLY O O -25.602 2.344 -3.272 1.00 . A A . 1 GLY O 1 1 2 767 1 1 2 THR C C -23.020 -0.760 -2.945 1.00 . A A . 2 THR C 1 1 2 768 1 1 2 THR CA C -24.007 0.270 -2.388 1.00 . A A . 2 THR CA 1 1 2 769 1 1 2 THR CB C -24.131 0.104 -0.857 1.00 . A A . 2 THR CB 1 1 2 770 1 1 2 THR CG2 C -22.824 0.453 -0.162 1.00 . A A . 2 THR CG2 1 1 2 771 1 1 2 THR H H -25.665 -0.771 -3.183 1.00 . A A . 2 THR H 1 1 2 772 1 1 2 THR HA H -23.632 1.263 -2.595 1.00 . A A . 2 THR HA 1 1 2 773 1 1 2 THR HB H -24.376 -0.926 -0.639 1.00 . A A . 2 THR HB 1 1 2 774 1 1 2 THR HG1 H -25.963 0.418 -0.161 1.00 . A A . 2 THR HG1 1 1 2 775 1 1 2 THR HG21 H -22.046 -0.216 -0.502 1.00 . A A . 2 THR HG21 1 1 2 776 1 1 2 THR HG22 H -22.945 0.350 0.906 1.00 . A A . 2 THR HG22 1 1 2 777 1 1 2 THR HG23 H -22.552 1.471 -0.398 1.00 . A A . 2 THR HG23 1 1 2 778 1 1 2 THR N N -25.300 0.133 -3.031 1.00 . A A . 2 THR N 1 1 2 779 1 1 2 THR O O -22.911 -1.877 -2.435 1.00 . A A . 2 THR O 1 1 2 780 1 1 2 THR OG1 O -25.178 0.951 -0.355 1.00 . A A . 2 THR OG1 1 1 2 781 1 1 3 ARG C C -20.117 -1.437 -3.721 1.00 . A A . 3 ARG C 1 1 2 782 1 1 3 ARG CA C -21.330 -1.255 -4.629 1.00 . A A . 3 ARG CA 1 1 2 783 1 1 3 ARG CB C -20.917 -0.692 -5.993 1.00 . A A . 3 ARG CB 1 1 2 784 1 1 3 ARG CD C -19.795 -1.275 -8.158 1.00 . A A . 3 ARG CD 1 1 2 785 1 1 3 ARG CG C -19.764 -1.430 -6.650 1.00 . A A . 3 ARG CG 1 1 2 786 1 1 3 ARG CZ C -21.417 -1.831 -9.939 1.00 . A A . 3 ARG CZ 1 1 2 787 1 1 3 ARG H H -22.497 0.497 -4.412 1.00 . A A . 3 ARG H 1 1 2 788 1 1 3 ARG HA H -21.792 -2.221 -4.781 1.00 . A A . 3 ARG HA 1 1 2 789 1 1 3 ARG HB2 H -21.766 -0.736 -6.658 1.00 . A A . 3 ARG HB2 1 1 2 790 1 1 3 ARG HB3 H -20.627 0.340 -5.866 1.00 . A A . 3 ARG HB3 1 1 2 791 1 1 3 ARG HD2 H -19.983 -0.239 -8.398 1.00 . A A . 3 ARG HD2 1 1 2 792 1 1 3 ARG HD3 H -18.835 -1.568 -8.557 1.00 . A A . 3 ARG HD3 1 1 2 793 1 1 3 ARG HE H -21.092 -2.936 -8.295 1.00 . A A . 3 ARG HE 1 1 2 794 1 1 3 ARG HG2 H -18.834 -1.030 -6.274 1.00 . A A . 3 ARG HG2 1 1 2 795 1 1 3 ARG HG3 H -19.836 -2.479 -6.402 1.00 . A A . 3 ARG HG3 1 1 2 796 1 1 3 ARG HH11 H -20.510 -0.024 -10.159 1.00 . A A . 3 ARG HH11 1 1 2 797 1 1 3 ARG HH12 H -21.577 -0.489 -11.453 1.00 . A A . 3 ARG HH12 1 1 2 798 1 1 3 ARG HH21 H -22.508 -3.538 -9.980 1.00 . A A . 3 ARG HH21 1 1 2 799 1 1 3 ARG HH22 H -22.704 -2.504 -11.360 1.00 . A A . 3 ARG HH22 1 1 2 800 1 1 3 ARG N N -22.325 -0.385 -4.014 1.00 . A A . 3 ARG N 1 1 2 801 1 1 3 ARG NE N -20.837 -2.102 -8.771 1.00 . A A . 3 ARG NE 1 1 2 802 1 1 3 ARG NH1 N -21.151 -0.692 -10.567 1.00 . A A . 3 ARG NH1 1 1 2 803 1 1 3 ARG NH2 N -22.285 -2.689 -10.466 1.00 . A A . 3 ARG NH2 1 1 2 804 1 1 3 ARG O O -19.799 -0.571 -2.904 1.00 . A A . 3 ARG O 1 1 2 805 1 1 4 GLY C C -18.373 -4.279 -2.476 1.00 . A A . 783 GLY C 1 1 2 806 1 1 4 GLY CA C -18.305 -2.877 -3.032 1.00 . A A . 783 GLY CA 1 1 2 807 1 1 4 GLY H H -19.769 -3.228 -4.527 1.00 . A A . 783 GLY H 1 1 2 808 1 1 4 GLY HA2 H -17.411 -2.777 -3.629 1.00 . A A . 783 GLY HA2 1 1 2 809 1 1 4 GLY HA3 H -18.264 -2.175 -2.214 1.00 . A A . 783 GLY HA3 1 1 2 810 1 1 4 GLY N N -19.462 -2.579 -3.854 1.00 . A A . 783 GLY N 1 1 2 811 1 1 4 GLY O O -17.405 -4.792 -1.922 1.00 . A A . 783 GLY O 1 1 2 812 1 1 5 VAL C C -20.240 -7.119 -3.353 1.00 . A A . 784 VAL C 1 1 2 813 1 1 5 VAL CA C -19.753 -6.262 -2.182 1.00 . A A . 784 VAL CA 1 1 2 814 1 1 5 VAL CB C -20.773 -6.314 -1.017 1.00 . A A . 784 VAL CB 1 1 2 815 1 1 5 VAL CG1 C -22.144 -5.822 -1.466 1.00 . A A . 784 VAL CG1 1 1 2 816 1 1 5 VAL CG2 C -20.862 -7.715 -0.428 1.00 . A A . 784 VAL CG2 1 1 2 817 1 1 5 VAL H H -20.266 -4.404 -3.046 1.00 . A A . 784 VAL H 1 1 2 818 1 1 5 VAL HA H -18.809 -6.655 -1.828 1.00 . A A . 784 VAL HA 1 1 2 819 1 1 5 VAL HB H -20.422 -5.648 -0.241 1.00 . A A . 784 VAL HB 1 1 2 820 1 1 5 VAL HG11 H -22.480 -6.413 -2.306 1.00 . A A . 784 VAL HG11 1 1 2 821 1 1 5 VAL HG12 H -22.079 -4.785 -1.759 1.00 . A A . 784 VAL HG12 1 1 2 822 1 1 5 VAL HG13 H -22.845 -5.923 -0.653 1.00 . A A . 784 VAL HG13 1 1 2 823 1 1 5 VAL HG21 H -21.594 -7.727 0.366 1.00 . A A . 784 VAL HG21 1 1 2 824 1 1 5 VAL HG22 H -19.898 -8.001 -0.032 1.00 . A A . 784 VAL HG22 1 1 2 825 1 1 5 VAL HG23 H -21.155 -8.412 -1.200 1.00 . A A . 784 VAL HG23 1 1 2 826 1 1 5 VAL N N -19.534 -4.892 -2.626 1.00 . A A . 784 VAL N 1 1 2 827 1 1 5 VAL O O -20.102 -8.342 -3.357 1.00 . A A . 784 VAL O 1 1 2 828 1 1 6 ASP C C -20.072 -7.383 -6.473 1.00 . A A . 785 ASP C 1 1 2 829 1 1 6 ASP CA C -21.261 -7.093 -5.573 1.00 . A A . 785 ASP CA 1 1 2 830 1 1 6 ASP CB C -22.219 -6.155 -6.306 1.00 . A A . 785 ASP CB 1 1 2 831 1 1 6 ASP CG C -21.537 -4.851 -6.683 1.00 . A A . 785 ASP CG 1 1 2 832 1 1 6 ASP H H -20.948 -5.491 -4.259 1.00 . A A . 785 ASP H 1 1 2 833 1 1 6 ASP HA H -21.767 -8.012 -5.324 1.00 . A A . 785 ASP HA 1 1 2 834 1 1 6 ASP HB2 H -22.570 -6.634 -7.208 1.00 . A A . 785 ASP HB2 1 1 2 835 1 1 6 ASP HB3 H -23.057 -5.933 -5.665 1.00 . A A . 785 ASP HB3 1 1 2 836 1 1 6 ASP N N -20.811 -6.453 -4.348 1.00 . A A . 785 ASP N 1 1 2 837 1 1 6 ASP O O -20.099 -8.301 -7.289 1.00 . A A . 785 ASP O 1 1 2 838 1 1 6 ASP OD1 O -21.116 -4.112 -5.765 1.00 . A A . 785 ASP OD1 1 1 2 839 1 1 6 ASP OD2 O -21.380 -4.579 -7.894 1.00 . A A . 785 ASP OD2 1 1 2 840 1 1 7 SER C C -16.639 -7.113 -6.374 1.00 . A A . 786 SER C 1 1 2 841 1 1 7 SER CA C -17.866 -6.670 -7.166 1.00 . A A . 786 SER CA 1 1 2 842 1 1 7 SER CB C -17.598 -5.309 -7.821 1.00 . A A . 786 SER CB 1 1 2 843 1 1 7 SER H H -19.045 -5.926 -5.589 1.00 . A A . 786 SER H 1 1 2 844 1 1 7 SER HA H -18.074 -7.394 -7.930 1.00 . A A . 786 SER HA 1 1 2 845 1 1 7 SER HB2 H -17.417 -4.572 -7.053 1.00 . A A . 786 SER HB2 1 1 2 846 1 1 7 SER HB3 H -16.730 -5.386 -8.457 1.00 . A A . 786 SER HB3 1 1 2 847 1 1 7 SER HG H -19.511 -4.914 -8.074 1.00 . A A . 786 SER HG 1 1 2 848 1 1 7 SER N N -19.031 -6.584 -6.313 1.00 . A A . 786 SER N 1 1 2 849 1 1 7 SER O O -16.464 -6.725 -5.217 1.00 . A A . 786 SER O 1 1 2 850 1 1 7 SER OG O -18.701 -4.881 -8.606 1.00 . A A . 786 SER OG 1 1 2 851 1 1 8 PRO C C -13.560 -7.163 -6.266 1.00 . A A . 787 PRO C 1 1 2 852 1 1 8 PRO CA C -14.498 -8.355 -6.411 1.00 . A A . 787 PRO CA 1 1 2 853 1 1 8 PRO CB C -13.938 -9.368 -7.416 1.00 . A A . 787 PRO CB 1 1 2 854 1 1 8 PRO CD C -16.023 -8.601 -8.294 1.00 . A A . 787 PRO CD 1 1 2 855 1 1 8 PRO CG C -14.658 -9.091 -8.689 1.00 . A A . 787 PRO CG 1 1 2 856 1 1 8 PRO HA H -14.627 -8.826 -5.449 1.00 . A A . 787 PRO HA 1 1 2 857 1 1 8 PRO HB2 H -12.875 -9.222 -7.524 1.00 . A A . 787 PRO HB2 1 1 2 858 1 1 8 PRO HB3 H -14.135 -10.372 -7.064 1.00 . A A . 787 PRO HB3 1 1 2 859 1 1 8 PRO HD2 H -16.392 -7.890 -9.019 1.00 . A A . 787 PRO HD2 1 1 2 860 1 1 8 PRO HD3 H -16.708 -9.431 -8.195 1.00 . A A . 787 PRO HD3 1 1 2 861 1 1 8 PRO HG2 H -14.134 -8.331 -9.248 1.00 . A A . 787 PRO HG2 1 1 2 862 1 1 8 PRO HG3 H -14.739 -9.998 -9.270 1.00 . A A . 787 PRO HG3 1 1 2 863 1 1 8 PRO N N -15.786 -7.955 -6.992 1.00 . A A . 787 PRO N 1 1 2 864 1 1 8 PRO O O -12.569 -7.214 -5.538 1.00 . A A . 787 PRO O 1 1 2 865 1 1 9 SER C C -13.841 -4.101 -5.601 1.00 . A A . 788 SER C 1 1 2 866 1 1 9 SER CA C -13.212 -4.814 -6.794 1.00 . A A . 788 SER CA 1 1 2 867 1 1 9 SER CB C -13.357 -3.960 -8.051 1.00 . A A . 788 SER CB 1 1 2 868 1 1 9 SER H H -14.575 -6.167 -7.664 1.00 . A A . 788 SER H 1 1 2 869 1 1 9 SER HA H -12.167 -4.996 -6.595 1.00 . A A . 788 SER HA 1 1 2 870 1 1 9 SER HB2 H -14.385 -3.649 -8.159 1.00 . A A . 788 SER HB2 1 1 2 871 1 1 9 SER HB3 H -12.722 -3.091 -7.967 1.00 . A A . 788 SER HB3 1 1 2 872 1 1 9 SER HG H -12.014 -4.691 -9.284 1.00 . A A . 788 SER HG 1 1 2 873 1 1 9 SER N N -13.876 -6.092 -6.983 1.00 . A A . 788 SER N 1 1 2 874 1 1 9 SER O O -14.407 -3.016 -5.733 1.00 . A A . 788 SER O 1 1 2 875 1 1 9 SER OG O -12.981 -4.690 -9.207 1.00 . A A . 788 SER OG 1 1 2 876 1 1 10 ALA C C -13.946 -2.883 -2.828 1.00 . A A . 789 ALA C 1 1 2 877 1 1 10 ALA CA C -14.413 -4.271 -3.238 1.00 . A A . 789 ALA CA 1 1 2 878 1 1 10 ALA CB C -14.188 -5.256 -2.102 1.00 . A A . 789 ALA CB 1 1 2 879 1 1 10 ALA H H -13.182 -5.542 -4.392 1.00 . A A . 789 ALA H 1 1 2 880 1 1 10 ALA HA H -15.473 -4.236 -3.443 1.00 . A A . 789 ALA HA 1 1 2 881 1 1 10 ALA HB1 H -14.749 -4.939 -1.235 1.00 . A A . 789 ALA HB1 1 1 2 882 1 1 10 ALA HB2 H -13.137 -5.291 -1.857 1.00 . A A . 789 ALA HB2 1 1 2 883 1 1 10 ALA HB3 H -14.521 -6.237 -2.406 1.00 . A A . 789 ALA HB3 1 1 2 884 1 1 10 ALA N N -13.740 -4.734 -4.441 1.00 . A A . 789 ALA N 1 1 2 885 1 1 10 ALA O O -14.760 -1.993 -2.576 1.00 . A A . 789 ALA O 1 1 2 886 1 1 11 GLU C C -12.230 -0.318 -3.321 1.00 . A A . 790 GLU C 1 1 2 887 1 1 11 GLU CA C -12.073 -1.439 -2.312 1.00 . A A . 790 GLU CA 1 1 2 888 1 1 11 GLU CB C -10.598 -1.578 -1.974 1.00 . A A . 790 GLU CB 1 1 2 889 1 1 11 GLU CD C -8.859 -2.432 -0.371 1.00 . A A . 790 GLU CD 1 1 2 890 1 1 11 GLU CG C -10.316 -2.458 -0.772 1.00 . A A . 790 GLU CG 1 1 2 891 1 1 11 GLU H H -12.032 -3.411 -3.088 1.00 . A A . 790 GLU H 1 1 2 892 1 1 11 GLU HA H -12.605 -1.166 -1.414 1.00 . A A . 790 GLU HA 1 1 2 893 1 1 11 GLU HB2 H -10.079 -1.992 -2.828 1.00 . A A . 790 GLU HB2 1 1 2 894 1 1 11 GLU HB3 H -10.211 -0.589 -1.773 1.00 . A A . 790 GLU HB3 1 1 2 895 1 1 11 GLU HG2 H -10.907 -2.109 0.061 1.00 . A A . 790 GLU HG2 1 1 2 896 1 1 11 GLU HG3 H -10.592 -3.475 -1.012 1.00 . A A . 790 GLU HG3 1 1 2 897 1 1 11 GLU N N -12.636 -2.691 -2.788 1.00 . A A . 790 GLU N 1 1 2 898 1 1 11 GLU O O -11.937 0.835 -3.000 1.00 . A A . 790 GLU O 1 1 2 899 1 1 11 GLU OE1 O -8.347 -1.333 -0.062 1.00 . A A . 790 GLU OE1 1 1 2 900 1 1 11 GLU OE2 O -8.223 -3.510 -0.336 1.00 . A A . 790 GLU OE2 1 1 2 901 1 1 12 LEU C C -14.058 1.236 -5.346 1.00 . A A . 791 LEU C 1 1 2 902 1 1 12 LEU CA C -12.829 0.345 -5.576 1.00 . A A . 791 LEU CA 1 1 2 903 1 1 12 LEU CB C -12.895 -0.388 -6.920 1.00 . A A . 791 LEU CB 1 1 2 904 1 1 12 LEU CD1 C -11.710 1.340 -8.290 1.00 . A A . 791 LEU CD1 1 1 2 905 1 1 12 LEU CD2 C -13.221 -0.328 -9.397 1.00 . A A . 791 LEU CD2 1 1 2 906 1 1 12 LEU CG C -12.972 0.502 -8.147 1.00 . A A . 791 LEU CG 1 1 2 907 1 1 12 LEU H H -13.021 -1.545 -4.690 1.00 . A A . 791 LEU H 1 1 2 908 1 1 12 LEU HA H -11.939 0.959 -5.547 1.00 . A A . 791 LEU HA 1 1 2 909 1 1 12 LEU HB2 H -12.016 -1.008 -7.010 1.00 . A A . 791 LEU HB2 1 1 2 910 1 1 12 LEU HB3 H -13.764 -1.027 -6.914 1.00 . A A . 791 LEU HB3 1 1 2 911 1 1 12 LEU HD11 H -11.788 1.960 -9.170 1.00 . A A . 791 LEU HD11 1 1 2 912 1 1 12 LEU HD12 H -10.852 0.689 -8.381 1.00 . A A . 791 LEU HD12 1 1 2 913 1 1 12 LEU HD13 H -11.596 1.965 -7.417 1.00 . A A . 791 LEU HD13 1 1 2 914 1 1 12 LEU HD21 H -13.293 0.325 -10.255 1.00 . A A . 791 LEU HD21 1 1 2 915 1 1 12 LEU HD22 H -14.143 -0.877 -9.284 1.00 . A A . 791 LEU HD22 1 1 2 916 1 1 12 LEU HD23 H -12.403 -1.020 -9.539 1.00 . A A . 791 LEU HD23 1 1 2 917 1 1 12 LEU HG H -13.803 1.170 -8.017 1.00 . A A . 791 LEU HG 1 1 2 918 1 1 12 LEU N N -12.715 -0.634 -4.516 1.00 . A A . 791 LEU N 1 1 2 919 1 1 12 LEU O O -14.794 1.592 -6.268 1.00 . A A . 791 LEU O 1 1 2 920 1 1 13 ASP C C -15.240 2.581 -2.124 1.00 . A A . 792 ASP C 1 1 2 921 1 1 13 ASP CA C -15.344 2.434 -3.626 1.00 . A A . 792 ASP CA 1 1 2 922 1 1 13 ASP CB C -16.706 1.838 -3.992 1.00 . A A . 792 ASP CB 1 1 2 923 1 1 13 ASP CG C -17.852 2.789 -3.691 1.00 . A A . 792 ASP CG 1 1 2 924 1 1 13 ASP H H -13.579 1.300 -3.429 1.00 . A A . 792 ASP H 1 1 2 925 1 1 13 ASP HA H -15.237 3.397 -4.074 1.00 . A A . 792 ASP HA 1 1 2 926 1 1 13 ASP HB2 H -16.718 1.608 -5.046 1.00 . A A . 792 ASP HB2 1 1 2 927 1 1 13 ASP HB3 H -16.858 0.929 -3.427 1.00 . A A . 792 ASP HB3 1 1 2 928 1 1 13 ASP N N -14.242 1.597 -4.086 1.00 . A A . 792 ASP N 1 1 2 929 1 1 13 ASP O O -15.565 3.618 -1.549 1.00 . A A . 792 ASP O 1 1 2 930 1 1 13 ASP OD1 O -18.383 2.744 -2.560 1.00 . A A . 792 ASP OD1 1 1 2 931 1 1 13 ASP OD2 O -18.232 3.580 -4.576 1.00 . A A . 792 ASP OD2 1 1 2 932 1 1 14 LYS C C -13.393 2.393 0.342 1.00 . A A . 793 LYS C 1 1 2 933 1 1 14 LYS CA C -14.536 1.476 -0.070 1.00 . A A . 793 LYS CA 1 1 2 934 1 1 14 LYS CB C -14.236 0.044 0.386 1.00 . A A . 793 LYS CB 1 1 2 935 1 1 14 LYS CD C -16.593 -0.514 1.073 1.00 . A A . 793 LYS CD 1 1 2 936 1 1 14 LYS CE C -16.249 -0.491 2.551 1.00 . A A . 793 LYS CE 1 1 2 937 1 1 14 LYS CG C -15.401 -0.917 0.222 1.00 . A A . 793 LYS CG 1 1 2 938 1 1 14 LYS H H -14.552 0.736 -2.048 1.00 . A A . 793 LYS H 1 1 2 939 1 1 14 LYS HA H -15.437 1.811 0.404 1.00 . A A . 793 LYS HA 1 1 2 940 1 1 14 LYS HB2 H -13.404 -0.337 -0.187 1.00 . A A . 793 LYS HB2 1 1 2 941 1 1 14 LYS HB3 H -13.958 0.064 1.432 1.00 . A A . 793 LYS HB3 1 1 2 942 1 1 14 LYS HD2 H -16.914 0.471 0.775 1.00 . A A . 793 LYS HD2 1 1 2 943 1 1 14 LYS HD3 H -17.392 -1.221 0.910 1.00 . A A . 793 LYS HD3 1 1 2 944 1 1 14 LYS HE2 H -15.921 -1.476 2.846 1.00 . A A . 793 LYS HE2 1 1 2 945 1 1 14 LYS HE3 H -15.450 0.216 2.709 1.00 . A A . 793 LYS HE3 1 1 2 946 1 1 14 LYS HG2 H -15.702 -0.926 -0.814 1.00 . A A . 793 LYS HG2 1 1 2 947 1 1 14 LYS HG3 H -15.080 -1.907 0.514 1.00 . A A . 793 LYS HG3 1 1 2 948 1 1 14 LYS HZ1 H -17.117 0.060 4.368 1.00 . A A . 793 LYS HZ1 1 1 2 949 1 1 14 LYS HZ2 H -18.137 -0.852 3.366 1.00 . A A . 793 LYS HZ2 1 1 2 950 1 1 14 LYS HZ3 H -17.841 0.781 3.014 1.00 . A A . 793 LYS HZ3 1 1 2 951 1 1 14 LYS N N -14.749 1.523 -1.511 1.00 . A A . 793 LYS N 1 1 2 952 1 1 14 LYS NZ N -17.415 -0.099 3.383 1.00 . A A . 793 LYS NZ 1 1 2 953 1 1 14 LYS O O -13.518 3.162 1.294 1.00 . A A . 793 LYS O 1 1 2 954 1 1 15 LYS C C -10.159 3.141 -1.280 1.00 . A A . 794 LYS C 1 1 2 955 1 1 15 LYS CA C -11.118 3.129 -0.095 1.00 . A A . 794 LYS CA 1 1 2 956 1 1 15 LYS CB C -10.418 2.690 1.205 1.00 . A A . 794 LYS CB 1 1 2 957 1 1 15 LYS CD C -9.962 0.828 2.821 1.00 . A A . 794 LYS CD 1 1 2 958 1 1 15 LYS CE C -9.667 -0.654 3.008 1.00 . A A . 794 LYS CE 1 1 2 959 1 1 15 LYS CG C -10.231 1.186 1.366 1.00 . A A . 794 LYS CG 1 1 2 960 1 1 15 LYS H H -12.243 1.666 -1.121 1.00 . A A . 794 LYS H 1 1 2 961 1 1 15 LYS HA H -11.478 4.136 0.043 1.00 . A A . 794 LYS HA 1 1 2 962 1 1 15 LYS HB2 H -9.440 3.149 1.239 1.00 . A A . 794 LYS HB2 1 1 2 963 1 1 15 LYS HB3 H -10.998 3.049 2.042 1.00 . A A . 794 LYS HB3 1 1 2 964 1 1 15 LYS HD2 H -9.112 1.397 3.166 1.00 . A A . 794 LYS HD2 1 1 2 965 1 1 15 LYS HD3 H -10.830 1.090 3.409 1.00 . A A . 794 LYS HD3 1 1 2 966 1 1 15 LYS HE2 H -9.753 -0.892 4.056 1.00 . A A . 794 LYS HE2 1 1 2 967 1 1 15 LYS HE3 H -10.393 -1.226 2.448 1.00 . A A . 794 LYS HE3 1 1 2 968 1 1 15 LYS HG2 H -11.131 0.681 1.041 1.00 . A A . 794 LYS HG2 1 1 2 969 1 1 15 LYS HG3 H -9.395 0.866 0.763 1.00 . A A . 794 LYS HG3 1 1 2 970 1 1 15 LYS HZ1 H -8.090 -2.007 2.794 1.00 . A A . 794 LYS HZ1 1 1 2 971 1 1 15 LYS HZ2 H -7.591 -0.396 2.989 1.00 . A A . 794 LYS HZ2 1 1 2 972 1 1 15 LYS HZ3 H -8.235 -0.917 1.501 1.00 . A A . 794 LYS HZ3 1 1 2 973 1 1 15 LYS N N -12.279 2.299 -0.373 1.00 . A A . 794 LYS N 1 1 2 974 1 1 15 LYS NZ N -8.303 -1.019 2.541 1.00 . A A . 794 LYS NZ 1 1 2 975 1 1 15 LYS O O -10.149 4.102 -2.050 1.00 . A A . 794 LYS O 1 1 2 976 1 1 16 ALA C C -7.543 3.243 -2.598 1.00 . A A . 795 ALA C 1 1 2 977 1 1 16 ALA CA C -8.381 1.966 -2.500 1.00 . A A . 795 ALA CA 1 1 2 978 1 1 16 ALA CB C -9.028 1.648 -3.842 1.00 . A A . 795 ALA CB 1 1 2 979 1 1 16 ALA H H -9.517 1.296 -0.846 1.00 . A A . 795 ALA H 1 1 2 980 1 1 16 ALA HA H -7.725 1.144 -2.247 1.00 . A A . 795 ALA HA 1 1 2 981 1 1 16 ALA HB1 H -8.260 1.472 -4.580 1.00 . A A . 795 ALA HB1 1 1 2 982 1 1 16 ALA HB2 H -9.641 2.483 -4.151 1.00 . A A . 795 ALA HB2 1 1 2 983 1 1 16 ALA HB3 H -9.644 0.766 -3.745 1.00 . A A . 795 ALA HB3 1 1 2 984 1 1 16 ALA N N -9.393 2.061 -1.446 1.00 . A A . 795 ALA N 1 1 2 985 1 1 16 ALA O O -7.213 3.705 -3.692 1.00 . A A . 795 ALA O 1 1 2 986 1 1 17 ASN C C -4.886 4.516 -1.595 1.00 . A A . 796 ASN C 1 1 2 987 1 1 17 ASN CA C -6.329 4.968 -1.376 1.00 . A A . 796 ASN CA 1 1 2 988 1 1 17 ASN CB C -6.501 5.726 -0.036 1.00 . A A . 796 ASN CB 1 1 2 989 1 1 17 ASN CG C -6.094 4.958 1.227 1.00 . A A . 796 ASN CG 1 1 2 990 1 1 17 ASN H H -7.627 3.475 -0.620 1.00 . A A . 796 ASN H 1 1 2 991 1 1 17 ASN HA H -6.602 5.630 -2.187 1.00 . A A . 796 ASN HA 1 1 2 992 1 1 17 ASN HB2 H -5.907 6.626 -0.075 1.00 . A A . 796 ASN HB2 1 1 2 993 1 1 17 ASN HB3 H -7.540 6.007 0.066 1.00 . A A . 796 ASN HB3 1 1 2 994 1 1 17 ASN HD21 H -6.333 3.194 0.343 1.00 . A A . 796 ASN HD21 1 1 2 995 1 1 17 ASN HD22 H -5.831 3.133 1.994 1.00 . A A . 796 ASN HD22 1 1 2 996 1 1 17 ASN N N -7.222 3.816 -1.442 1.00 . A A . 796 ASN N 1 1 2 997 1 1 17 ASN ND2 N -6.088 3.628 1.178 1.00 . A A . 796 ASN ND2 1 1 2 998 1 1 17 ASN O O -4.080 4.435 -0.669 1.00 . A A . 796 ASN O 1 1 2 999 1 1 17 ASN OD1 O -5.763 5.568 2.246 1.00 . A A . 796 ASN OD1 1 1 2 1000 1 1 18 LEU C C -2.250 4.636 -3.486 1.00 . A A . 797 LEU C 1 1 2 1001 1 1 18 LEU CA C -3.305 3.587 -3.170 1.00 . A A . 797 LEU CA 1 1 2 1002 1 1 18 LEU CB C -3.465 2.666 -4.384 1.00 . A A . 797 LEU CB 1 1 2 1003 1 1 18 LEU CD1 C -4.783 0.984 -5.689 1.00 . A A . 797 LEU CD1 1 1 2 1004 1 1 18 LEU CD2 C -4.715 0.828 -3.203 1.00 . A A . 797 LEU CD2 1 1 2 1005 1 1 18 LEU CG C -4.711 1.772 -4.392 1.00 . A A . 797 LEU CG 1 1 2 1006 1 1 18 LEU H H -5.178 4.405 -3.579 1.00 . A A . 797 LEU H 1 1 2 1007 1 1 18 LEU HA H -2.981 3.004 -2.323 1.00 . A A . 797 LEU HA 1 1 2 1008 1 1 18 LEU HB2 H -3.490 3.284 -5.263 1.00 . A A . 797 LEU HB2 1 1 2 1009 1 1 18 LEU HB3 H -2.596 2.028 -4.442 1.00 . A A . 797 LEU HB3 1 1 2 1010 1 1 18 LEU HD11 H -5.666 0.363 -5.685 1.00 . A A . 797 LEU HD11 1 1 2 1011 1 1 18 LEU HD12 H -3.905 0.362 -5.781 1.00 . A A . 797 LEU HD12 1 1 2 1012 1 1 18 LEU HD13 H -4.828 1.669 -6.524 1.00 . A A . 797 LEU HD13 1 1 2 1013 1 1 18 LEU HD21 H -5.600 0.211 -3.233 1.00 . A A . 797 LEU HD21 1 1 2 1014 1 1 18 LEU HD22 H -4.707 1.402 -2.288 1.00 . A A . 797 LEU HD22 1 1 2 1015 1 1 18 LEU HD23 H -3.836 0.200 -3.239 1.00 . A A . 797 LEU HD23 1 1 2 1016 1 1 18 LEU HG H -5.592 2.394 -4.331 1.00 . A A . 797 LEU HG 1 1 2 1017 1 1 18 LEU N N -4.568 4.200 -2.840 1.00 . A A . 797 LEU N 1 1 2 1018 1 1 18 LEU O O -2.542 5.701 -4.032 1.00 . A A . 797 LEU O 1 1 2 1019 1 1 19 LEU C C 1.214 3.970 -3.740 1.00 . A A . 798 LEU C 1 1 2 1020 1 1 19 LEU CA C 0.153 5.030 -3.545 1.00 . A A . 798 LEU CA 1 1 2 1021 1 1 19 LEU CB C 0.537 6.132 -2.518 1.00 . A A . 798 LEU CB 1 1 2 1022 1 1 19 LEU CD1 C 0.253 4.644 -0.473 1.00 . A A . 798 LEU CD1 1 1 2 1023 1 1 19 LEU CD2 C 2.547 5.272 -1.271 1.00 . A A . 798 LEU CD2 1 1 2 1024 1 1 19 LEU CG C 1.100 5.712 -1.144 1.00 . A A . 798 LEU CG 1 1 2 1025 1 1 19 LEU H H -0.913 3.488 -2.595 1.00 . A A . 798 LEU H 1 1 2 1026 1 1 19 LEU HA H -0.034 5.482 -4.503 1.00 . A A . 798 LEU HA 1 1 2 1027 1 1 19 LEU HB2 H 1.269 6.771 -2.985 1.00 . A A . 798 LEU HB2 1 1 2 1028 1 1 19 LEU HB3 H -0.350 6.725 -2.340 1.00 . A A . 798 LEU HB3 1 1 2 1029 1 1 19 LEU HD11 H -0.740 5.031 -0.293 1.00 . A A . 798 LEU HD11 1 1 2 1030 1 1 19 LEU HD12 H 0.706 4.362 0.465 1.00 . A A . 798 LEU HD12 1 1 2 1031 1 1 19 LEU HD13 H 0.190 3.778 -1.118 1.00 . A A . 798 LEU HD13 1 1 2 1032 1 1 19 LEU HD21 H 3.153 6.116 -1.561 1.00 . A A . 798 LEU HD21 1 1 2 1033 1 1 19 LEU HD22 H 2.615 4.504 -2.030 1.00 . A A . 798 LEU HD22 1 1 2 1034 1 1 19 LEU HD23 H 2.893 4.883 -0.326 1.00 . A A . 798 LEU HD23 1 1 2 1035 1 1 19 LEU HG H 1.086 6.578 -0.495 1.00 . A A . 798 LEU HG 1 1 2 1036 1 1 19 LEU N N -1.033 4.298 -3.142 1.00 . A A . 798 LEU N 1 1 2 1037 1 1 19 LEU O O 0.954 2.810 -3.405 1.00 . A A . 798 LEU O 1 1 2 1038 1 1 20 LYS C C 4.711 3.402 -4.202 1.00 . A A . 799 LYS C 1 1 2 1039 1 1 20 LYS CA C 3.263 3.179 -4.603 1.00 . A A . 799 LYS CA 1 1 2 1040 1 1 20 LYS CB C 3.156 2.776 -6.082 1.00 . A A . 799 LYS CB 1 1 2 1041 1 1 20 LYS CD C 3.150 5.066 -7.162 1.00 . A A . 799 LYS CD 1 1 2 1042 1 1 20 LYS CE C 3.781 5.947 -8.230 1.00 . A A . 799 LYS CE 1 1 2 1043 1 1 20 LYS CG C 3.846 3.718 -7.065 1.00 . A A . 799 LYS CG 1 1 2 1044 1 1 20 LYS H H 2.642 5.219 -4.438 1.00 . A A . 799 LYS H 1 1 2 1045 1 1 20 LYS HA H 2.898 2.379 -3.984 1.00 . A A . 799 LYS HA 1 1 2 1046 1 1 20 LYS HB2 H 3.591 1.796 -6.201 1.00 . A A . 799 LYS HB2 1 1 2 1047 1 1 20 LYS HB3 H 2.107 2.722 -6.347 1.00 . A A . 799 LYS HB3 1 1 2 1048 1 1 20 LYS HD2 H 2.109 4.907 -7.405 1.00 . A A . 799 LYS HD2 1 1 2 1049 1 1 20 LYS HD3 H 3.224 5.565 -6.206 1.00 . A A . 799 LYS HD3 1 1 2 1050 1 1 20 LYS HE2 H 3.755 5.423 -9.175 1.00 . A A . 799 LYS HE2 1 1 2 1051 1 1 20 LYS HE3 H 3.206 6.860 -8.311 1.00 . A A . 799 LYS HE3 1 1 2 1052 1 1 20 LYS HG2 H 4.861 3.879 -6.735 1.00 . A A . 799 LYS HG2 1 1 2 1053 1 1 20 LYS HG3 H 3.854 3.256 -8.042 1.00 . A A . 799 LYS HG3 1 1 2 1054 1 1 20 LYS HZ1 H 5.568 6.967 -8.609 1.00 . A A . 799 LYS HZ1 1 1 2 1055 1 1 20 LYS HZ2 H 5.787 5.434 -7.914 1.00 . A A . 799 LYS HZ2 1 1 2 1056 1 1 20 LYS HZ3 H 5.246 6.726 -6.962 1.00 . A A . 799 LYS HZ3 1 1 2 1057 1 1 20 LYS N N 2.381 4.282 -4.281 1.00 . A A . 799 LYS N 1 1 2 1058 1 1 20 LYS NZ N 5.192 6.291 -7.907 1.00 . A A . 799 LYS NZ 1 1 2 1059 1 1 20 LYS O O 5.280 4.489 -4.315 1.00 . A A . 799 LYS O 1 1 2 1060 1 1 21 CYS C C 7.633 2.781 -4.192 1.00 . A A . 800 CYS C 1 1 2 1061 1 1 21 CYS CA C 6.618 2.133 -3.259 1.00 . A A . 800 CYS CA 1 1 2 1062 1 1 21 CYS CB C 6.820 0.629 -3.213 1.00 . A A . 800 CYS CB 1 1 2 1063 1 1 21 CYS H H 4.661 1.517 -3.600 1.00 . A A . 800 CYS H 1 1 2 1064 1 1 21 CYS HA H 6.726 2.544 -2.268 1.00 . A A . 800 CYS HA 1 1 2 1065 1 1 21 CYS HB2 H 6.023 0.202 -2.626 1.00 . A A . 800 CYS HB2 1 1 2 1066 1 1 21 CYS HB3 H 6.738 0.250 -4.224 1.00 . A A . 800 CYS HB3 1 1 2 1067 1 1 21 CYS N N 5.250 2.296 -3.706 1.00 . A A . 800 CYS N 1 1 2 1068 1 1 21 CYS O O 7.769 2.395 -5.349 1.00 . A A . 800 CYS O 1 1 2 1069 1 1 21 CYS SG S 8.354 -0.002 -2.527 1.00 . A A . 800 CYS SG 1 1 2 1070 1 1 22 GLU C C 10.550 3.527 -4.803 1.00 . A A . 801 GLU C 1 1 2 1071 1 1 22 GLU CA C 9.410 4.471 -4.373 1.00 . A A . 801 GLU CA 1 1 2 1072 1 1 22 GLU CB C 9.949 5.585 -3.465 1.00 . A A . 801 GLU CB 1 1 2 1073 1 1 22 GLU CD C 11.208 7.757 -3.268 1.00 . A A . 801 GLU CD 1 1 2 1074 1 1 22 GLU CG C 10.885 6.567 -4.150 1.00 . A A . 801 GLU CG 1 1 2 1075 1 1 22 GLU H H 8.072 4.115 -2.780 1.00 . A A . 801 GLU H 1 1 2 1076 1 1 22 GLU HA H 8.994 4.920 -5.262 1.00 . A A . 801 GLU HA 1 1 2 1077 1 1 22 GLU HB2 H 9.114 6.141 -3.068 1.00 . A A . 801 GLU HB2 1 1 2 1078 1 1 22 GLU HB3 H 10.484 5.129 -2.642 1.00 . A A . 801 GLU HB3 1 1 2 1079 1 1 22 GLU HG2 H 11.804 6.059 -4.398 1.00 . A A . 801 GLU HG2 1 1 2 1080 1 1 22 GLU HG3 H 10.413 6.924 -5.055 1.00 . A A . 801 GLU HG3 1 1 2 1081 1 1 22 GLU N N 8.334 3.775 -3.664 1.00 . A A . 801 GLU N 1 1 2 1082 1 1 22 GLU O O 11.484 3.947 -5.491 1.00 . A A . 801 GLU O 1 1 2 1083 1 1 22 GLU OE1 O 10.430 8.733 -3.258 1.00 . A A . 801 GLU OE1 1 1 2 1084 1 1 22 GLU OE2 O 12.251 7.723 -2.581 1.00 . A A . 801 GLU OE2 1 1 2 1085 1 1 23 TYR C C 11.080 0.435 -5.976 1.00 . A A . 802 TYR C 1 1 2 1086 1 1 23 TYR CA C 11.521 1.316 -4.804 1.00 . A A . 802 TYR CA 1 1 2 1087 1 1 23 TYR CB C 11.947 0.461 -3.603 1.00 . A A . 802 TYR CB 1 1 2 1088 1 1 23 TYR CD1 C 14.474 0.547 -3.576 1.00 . A A . 802 TYR CD1 1 1 2 1089 1 1 23 TYR CD2 C 13.419 -1.521 -4.117 1.00 . A A . 802 TYR CD2 1 1 2 1090 1 1 23 TYR CE1 C 15.715 -0.044 -3.727 1.00 . A A . 802 TYR CE1 1 1 2 1091 1 1 23 TYR CE2 C 14.656 -2.118 -4.269 1.00 . A A . 802 TYR CE2 1 1 2 1092 1 1 23 TYR CG C 13.307 -0.181 -3.767 1.00 . A A . 802 TYR CG 1 1 2 1093 1 1 23 TYR CZ C 15.814 -1.346 -4.065 1.00 . A A . 802 TYR CZ 1 1 2 1094 1 1 23 TYR H H 9.682 1.944 -3.947 1.00 . A A . 802 TYR H 1 1 2 1095 1 1 23 TYR HA H 12.360 1.904 -5.141 1.00 . A A . 802 TYR HA 1 1 2 1096 1 1 23 TYR HB2 H 11.979 1.082 -2.719 1.00 . A A . 802 TYR HB2 1 1 2 1097 1 1 23 TYR HB3 H 11.225 -0.329 -3.452 1.00 . A A . 802 TYR HB3 1 1 2 1098 1 1 23 TYR HD1 H 14.404 1.589 -3.306 1.00 . A A . 802 TYR HD1 1 1 2 1099 1 1 23 TYR HD2 H 12.522 -2.102 -4.271 1.00 . A A . 802 TYR HD2 1 1 2 1100 1 1 23 TYR HE1 H 16.612 0.537 -3.573 1.00 . A A . 802 TYR HE1 1 1 2 1101 1 1 23 TYR HE2 H 14.723 -3.161 -4.539 1.00 . A A . 802 TYR HE2 1 1 2 1102 1 1 23 TYR HH H 17.002 -2.574 -4.992 1.00 . A A . 802 TYR HH 1 1 2 1103 1 1 23 TYR N N 10.470 2.254 -4.435 1.00 . A A . 802 TYR N 1 1 2 1104 1 1 23 TYR O O 11.800 0.303 -6.966 1.00 . A A . 802 TYR O 1 1 2 1105 1 1 23 TYR OH O 17.031 -1.971 -4.228 1.00 . A A . 802 TYR OH 1 1 2 1106 1 1 24 CYS C C 8.212 -0.515 -7.681 1.00 . A A . 803 CYS C 1 1 2 1107 1 1 24 CYS CA C 9.415 -1.071 -6.916 1.00 . A A . 803 CYS CA 1 1 2 1108 1 1 24 CYS CB C 9.090 -2.438 -6.309 1.00 . A A . 803 CYS CB 1 1 2 1109 1 1 24 CYS H H 9.344 0.002 -5.085 1.00 . A A . 803 CYS H 1 1 2 1110 1 1 24 CYS HA H 10.188 -1.179 -7.659 1.00 . A A . 803 CYS HA 1 1 2 1111 1 1 24 CYS HB2 H 8.581 -3.041 -7.047 1.00 . A A . 803 CYS HB2 1 1 2 1112 1 1 24 CYS HB3 H 10.008 -2.926 -6.024 1.00 . A A . 803 CYS HB3 1 1 2 1113 1 1 24 CYS N N 9.896 -0.158 -5.875 1.00 . A A . 803 CYS N 1 1 2 1114 1 1 24 CYS O O 8.004 -0.864 -8.842 1.00 . A A . 803 CYS O 1 1 2 1115 1 1 24 CYS SG S 8.030 -2.353 -4.837 1.00 . A A . 803 CYS SG 1 1 2 1116 1 1 25 GLY C C 5.045 0.224 -7.703 1.00 . A A . 804 GLY C 1 1 2 1117 1 1 25 GLY CA C 6.345 0.994 -7.773 1.00 . A A . 804 GLY CA 1 1 2 1118 1 1 25 GLY H H 7.572 0.538 -6.109 1.00 . A A . 804 GLY H 1 1 2 1119 1 1 25 GLY HA2 H 6.189 1.977 -7.350 1.00 . A A . 804 GLY HA2 1 1 2 1120 1 1 25 GLY HA3 H 6.629 1.103 -8.810 1.00 . A A . 804 GLY HA3 1 1 2 1121 1 1 25 GLY N N 7.423 0.340 -7.055 1.00 . A A . 804 GLY N 1 1 2 1122 1 1 25 GLY O O 4.149 0.432 -8.522 1.00 . A A . 804 GLY O 1 1 2 1123 1 1 26 LYS C C 2.672 -0.598 -5.824 1.00 . A A . 805 LYS C 1 1 2 1124 1 1 26 LYS CA C 3.713 -1.441 -6.547 1.00 . A A . 805 LYS CA 1 1 2 1125 1 1 26 LYS CB C 3.992 -2.714 -5.746 1.00 . A A . 805 LYS CB 1 1 2 1126 1 1 26 LYS CD C 4.770 -4.087 -7.731 1.00 . A A . 805 LYS CD 1 1 2 1127 1 1 26 LYS CE C 3.559 -5.005 -7.740 1.00 . A A . 805 LYS CE 1 1 2 1128 1 1 26 LYS CG C 5.098 -3.584 -6.330 1.00 . A A . 805 LYS CG 1 1 2 1129 1 1 26 LYS H H 5.673 -0.790 -6.104 1.00 . A A . 805 LYS H 1 1 2 1130 1 1 26 LYS HA H 3.316 -1.712 -7.513 1.00 . A A . 805 LYS HA 1 1 2 1131 1 1 26 LYS HB2 H 4.275 -2.436 -4.740 1.00 . A A . 805 LYS HB2 1 1 2 1132 1 1 26 LYS HB3 H 3.086 -3.302 -5.704 1.00 . A A . 805 LYS HB3 1 1 2 1133 1 1 26 LYS HD2 H 4.568 -3.240 -8.371 1.00 . A A . 805 LYS HD2 1 1 2 1134 1 1 26 LYS HD3 H 5.623 -4.630 -8.114 1.00 . A A . 805 LYS HD3 1 1 2 1135 1 1 26 LYS HE2 H 3.690 -5.761 -6.980 1.00 . A A . 805 LYS HE2 1 1 2 1136 1 1 26 LYS HE3 H 2.680 -4.418 -7.520 1.00 . A A . 805 LYS HE3 1 1 2 1137 1 1 26 LYS HG2 H 6.008 -3.004 -6.377 1.00 . A A . 805 LYS HG2 1 1 2 1138 1 1 26 LYS HG3 H 5.250 -4.434 -5.682 1.00 . A A . 805 LYS HG3 1 1 2 1139 1 1 26 LYS HZ1 H 2.526 -6.267 -9.050 1.00 . A A . 805 LYS HZ1 1 1 2 1140 1 1 26 LYS HZ2 H 4.206 -6.270 -9.271 1.00 . A A . 805 LYS HZ2 1 1 2 1141 1 1 26 LYS HZ3 H 3.285 -4.957 -9.815 1.00 . A A . 805 LYS HZ3 1 1 2 1142 1 1 26 LYS N N 4.935 -0.669 -6.734 1.00 . A A . 805 LYS N 1 1 2 1143 1 1 26 LYS NZ N 3.381 -5.670 -9.058 1.00 . A A . 805 LYS NZ 1 1 2 1144 1 1 26 LYS O O 2.973 0.022 -4.802 1.00 . A A . 805 LYS O 1 1 2 1145 1 1 27 TYR C C -0.363 -0.652 -4.735 1.00 . A A . 806 TYR C 1 1 2 1146 1 1 27 TYR CA C 0.368 0.189 -5.762 1.00 . A A . 806 TYR CA 1 1 2 1147 1 1 27 TYR CB C -0.630 0.665 -6.821 1.00 . A A . 806 TYR CB 1 1 2 1148 1 1 27 TYR CD1 C 0.686 1.395 -8.852 1.00 . A A . 806 TYR CD1 1 1 2 1149 1 1 27 TYR CD2 C -0.419 3.067 -7.562 1.00 . A A . 806 TYR CD2 1 1 2 1150 1 1 27 TYR CE1 C 1.151 2.364 -9.718 1.00 . A A . 806 TYR CE1 1 1 2 1151 1 1 27 TYR CE2 C 0.044 4.042 -8.423 1.00 . A A . 806 TYR CE2 1 1 2 1152 1 1 27 TYR CG C -0.105 1.728 -7.760 1.00 . A A . 806 TYR CG 1 1 2 1153 1 1 27 TYR CZ C 0.828 3.685 -9.499 1.00 . A A . 806 TYR CZ 1 1 2 1154 1 1 27 TYR H H 1.252 -1.178 -7.116 1.00 . A A . 806 TYR H 1 1 2 1155 1 1 27 TYR HA H 0.782 1.044 -5.249 1.00 . A A . 806 TYR HA 1 1 2 1156 1 1 27 TYR HB2 H -0.932 -0.180 -7.419 1.00 . A A . 806 TYR HB2 1 1 2 1157 1 1 27 TYR HB3 H -1.500 1.067 -6.323 1.00 . A A . 806 TYR HB3 1 1 2 1158 1 1 27 TYR HD1 H 0.940 0.358 -9.020 1.00 . A A . 806 TYR HD1 1 1 2 1159 1 1 27 TYR HD2 H -1.034 3.343 -6.719 1.00 . A A . 806 TYR HD2 1 1 2 1160 1 1 27 TYR HE1 H 1.767 2.083 -10.561 1.00 . A A . 806 TYR HE1 1 1 2 1161 1 1 27 TYR HE2 H -0.209 5.078 -8.254 1.00 . A A . 806 TYR HE2 1 1 2 1162 1 1 27 TYR HH H 1.226 4.333 -11.270 1.00 . A A . 806 TYR HH 1 1 2 1163 1 1 27 TYR N N 1.452 -0.589 -6.351 1.00 . A A . 806 TYR N 1 1 2 1164 1 1 27 TYR O O -0.748 -1.792 -5.008 1.00 . A A . 806 TYR O 1 1 2 1165 1 1 27 TYR OH O 1.292 4.655 -10.359 1.00 . A A . 806 TYR OH 1 1 2 1166 1 1 28 ALA C C -1.813 0.220 -1.508 1.00 . A A . 807 ALA C 1 1 2 1167 1 1 28 ALA CA C -1.190 -0.778 -2.468 1.00 . A A . 807 ALA CA 1 1 2 1168 1 1 28 ALA CB C -0.163 -1.647 -1.755 1.00 . A A . 807 ALA CB 1 1 2 1169 1 1 28 ALA H H -0.265 0.850 -3.433 1.00 . A A . 807 ALA H 1 1 2 1170 1 1 28 ALA HA H -1.963 -1.418 -2.870 1.00 . A A . 807 ALA HA 1 1 2 1171 1 1 28 ALA HB1 H 0.618 -1.021 -1.349 1.00 . A A . 807 ALA HB1 1 1 2 1172 1 1 28 ALA HB2 H 0.265 -2.346 -2.456 1.00 . A A . 807 ALA HB2 1 1 2 1173 1 1 28 ALA HB3 H -0.646 -2.190 -0.956 1.00 . A A . 807 ALA HB3 1 1 2 1174 1 1 28 ALA N N -0.563 -0.077 -3.565 1.00 . A A . 807 ALA N 1 1 2 1175 1 1 28 ALA O O -1.436 1.394 -1.495 1.00 . A A . 807 ALA O 1 1 2 1176 1 1 29 PRO C C -2.509 1.225 1.255 1.00 . A A . 808 PRO C 1 1 2 1177 1 1 29 PRO CA C -3.486 0.634 0.244 1.00 . A A . 808 PRO CA 1 1 2 1178 1 1 29 PRO CB C -4.478 -0.314 0.924 1.00 . A A . 808 PRO CB 1 1 2 1179 1 1 29 PRO CD C -3.354 -1.590 -0.728 1.00 . A A . 808 PRO CD 1 1 2 1180 1 1 29 PRO CG C -4.676 -1.418 -0.049 1.00 . A A . 808 PRO CG 1 1 2 1181 1 1 29 PRO HA H -4.017 1.433 -0.252 1.00 . A A . 808 PRO HA 1 1 2 1182 1 1 29 PRO HB2 H -4.054 -0.677 1.850 1.00 . A A . 808 PRO HB2 1 1 2 1183 1 1 29 PRO HB3 H -5.402 0.209 1.125 1.00 . A A . 808 PRO HB3 1 1 2 1184 1 1 29 PRO HD2 H -2.723 -2.263 -0.165 1.00 . A A . 808 PRO HD2 1 1 2 1185 1 1 29 PRO HD3 H -3.488 -1.949 -1.738 1.00 . A A . 808 PRO HD3 1 1 2 1186 1 1 29 PRO HG2 H -4.955 -2.323 0.470 1.00 . A A . 808 PRO HG2 1 1 2 1187 1 1 29 PRO HG3 H -5.433 -1.145 -0.768 1.00 . A A . 808 PRO HG3 1 1 2 1188 1 1 29 PRO N N -2.805 -0.223 -0.724 1.00 . A A . 808 PRO N 1 1 2 1189 1 1 29 PRO O O -1.719 0.506 1.869 1.00 . A A . 808 PRO O 1 1 2 1190 1 1 30 ALA C C -1.499 2.715 3.650 1.00 . A A . 809 ALA C 1 1 2 1191 1 1 30 ALA CA C -1.669 3.325 2.257 1.00 . A A . 809 ALA CA 1 1 2 1192 1 1 30 ALA CB C -2.195 4.747 2.387 1.00 . A A . 809 ALA CB 1 1 2 1193 1 1 30 ALA H H -3.206 3.047 0.818 1.00 . A A . 809 ALA H 1 1 2 1194 1 1 30 ALA HA H -0.713 3.385 1.748 1.00 . A A . 809 ALA HA 1 1 2 1195 1 1 30 ALA HB1 H -3.141 4.732 2.906 1.00 . A A . 809 ALA HB1 1 1 2 1196 1 1 30 ALA HB2 H -2.328 5.175 1.404 1.00 . A A . 809 ALA HB2 1 1 2 1197 1 1 30 ALA HB3 H -1.487 5.341 2.947 1.00 . A A . 809 ALA HB3 1 1 2 1198 1 1 30 ALA N N -2.560 2.554 1.378 1.00 . A A . 809 ALA N 1 1 2 1199 1 1 30 ALA O O -0.437 2.835 4.261 1.00 . A A . 809 ALA O 1 1 2 1200 1 1 31 GLU C C -1.476 0.351 5.554 1.00 . A A . 810 GLU C 1 1 2 1201 1 1 31 GLU CA C -2.560 1.427 5.455 1.00 . A A . 810 GLU CA 1 1 2 1202 1 1 31 GLU CB C -3.933 0.808 5.751 1.00 . A A . 810 GLU CB 1 1 2 1203 1 1 31 GLU CD C -5.538 0.964 3.799 1.00 . A A . 810 GLU CD 1 1 2 1204 1 1 31 GLU CG C -4.561 0.090 4.566 1.00 . A A . 810 GLU CG 1 1 2 1205 1 1 31 GLU H H -3.360 2.003 3.570 1.00 . A A . 810 GLU H 1 1 2 1206 1 1 31 GLU HA H -2.363 2.172 6.215 1.00 . A A . 810 GLU HA 1 1 2 1207 1 1 31 GLU HB2 H -3.826 0.096 6.555 1.00 . A A . 810 GLU HB2 1 1 2 1208 1 1 31 GLU HB3 H -4.607 1.593 6.067 1.00 . A A . 810 GLU HB3 1 1 2 1209 1 1 31 GLU HG2 H -3.773 -0.219 3.894 1.00 . A A . 810 GLU HG2 1 1 2 1210 1 1 31 GLU HG3 H -5.085 -0.782 4.928 1.00 . A A . 810 GLU HG3 1 1 2 1211 1 1 31 GLU N N -2.558 2.077 4.141 1.00 . A A . 810 GLU N 1 1 2 1212 1 1 31 GLU O O -0.962 0.069 6.639 1.00 . A A . 810 GLU O 1 1 2 1213 1 1 31 GLU OE1 O -5.101 1.937 3.148 1.00 . A A . 810 GLU OE1 1 1 2 1214 1 1 31 GLU OE2 O -6.753 0.684 3.849 1.00 . A A . 810 GLU OE2 1 1 2 1215 1 1 32 GLN C C 1.272 -0.677 4.422 1.00 . A A . 811 GLN C 1 1 2 1216 1 1 32 GLN CA C -0.125 -1.283 4.372 1.00 . A A . 811 GLN CA 1 1 2 1217 1 1 32 GLN CB C -0.290 -2.109 3.098 1.00 . A A . 811 GLN CB 1 1 2 1218 1 1 32 GLN CD C 0.877 -3.627 1.468 1.00 . A A . 811 GLN CD 1 1 2 1219 1 1 32 GLN CG C 0.821 -3.120 2.887 1.00 . A A . 811 GLN CG 1 1 2 1220 1 1 32 GLN H H -1.567 0.042 3.586 1.00 . A A . 811 GLN H 1 1 2 1221 1 1 32 GLN HA H -0.262 -1.924 5.230 1.00 . A A . 811 GLN HA 1 1 2 1222 1 1 32 GLN HB2 H -1.229 -2.641 3.146 1.00 . A A . 811 GLN HB2 1 1 2 1223 1 1 32 GLN HB3 H -0.308 -1.442 2.249 1.00 . A A . 811 GLN HB3 1 1 2 1224 1 1 32 GLN HE21 H 1.968 -2.057 0.944 1.00 . A A . 811 GLN HE21 1 1 2 1225 1 1 32 GLN HE22 H 1.630 -3.198 -0.319 1.00 . A A . 811 GLN HE22 1 1 2 1226 1 1 32 GLN HG2 H 1.764 -2.655 3.127 1.00 . A A . 811 GLN HG2 1 1 2 1227 1 1 32 GLN HG3 H 0.655 -3.957 3.548 1.00 . A A . 811 GLN HG3 1 1 2 1228 1 1 32 GLN N N -1.133 -0.241 4.421 1.00 . A A . 811 GLN N 1 1 2 1229 1 1 32 GLN NE2 N 1.557 -2.884 0.615 1.00 . A A . 811 GLN NE2 1 1 2 1230 1 1 32 GLN O O 2.218 -1.311 4.896 1.00 . A A . 811 GLN O 1 1 2 1231 1 1 32 GLN OE1 O 0.286 -4.653 1.135 1.00 . A A . 811 GLN OE1 1 1 2 1232 1 1 33 PHE C C 3.161 1.686 5.254 1.00 . A A . 812 PHE C 1 1 2 1233 1 1 33 PHE CA C 2.683 1.243 3.871 1.00 . A A . 812 PHE CA 1 1 2 1234 1 1 33 PHE CB C 2.567 2.459 2.958 1.00 . A A . 812 PHE CB 1 1 2 1235 1 1 33 PHE CD1 C 1.556 1.500 0.866 1.00 . A A . 812 PHE CD1 1 1 2 1236 1 1 33 PHE CD2 C 3.761 2.394 0.758 1.00 . A A . 812 PHE CD2 1 1 2 1237 1 1 33 PHE CE1 C 1.618 1.177 -0.476 1.00 . A A . 812 PHE CE1 1 1 2 1238 1 1 33 PHE CE2 C 3.828 2.074 -0.584 1.00 . A A . 812 PHE CE2 1 1 2 1239 1 1 33 PHE CG C 2.627 2.112 1.497 1.00 . A A . 812 PHE CG 1 1 2 1240 1 1 33 PHE CZ C 2.755 1.464 -1.201 1.00 . A A . 812 PHE CZ 1 1 2 1241 1 1 33 PHE H H 0.651 0.942 3.421 1.00 . A A . 812 PHE H 1 1 2 1242 1 1 33 PHE HA H 3.401 0.572 3.422 1.00 . A A . 812 PHE HA 1 1 2 1243 1 1 33 PHE HB2 H 1.628 2.957 3.147 1.00 . A A . 812 PHE HB2 1 1 2 1244 1 1 33 PHE HB3 H 3.378 3.133 3.172 1.00 . A A . 812 PHE HB3 1 1 2 1245 1 1 33 PHE HD1 H 0.666 1.275 1.432 1.00 . A A . 812 PHE HD1 1 1 2 1246 1 1 33 PHE HD2 H 4.602 2.870 1.240 1.00 . A A . 812 PHE HD2 1 1 2 1247 1 1 33 PHE HE1 H 0.776 0.700 -0.957 1.00 . A A . 812 PHE HE1 1 1 2 1248 1 1 33 PHE HE2 H 4.720 2.300 -1.151 1.00 . A A . 812 PHE HE2 1 1 2 1249 1 1 33 PHE HZ H 2.804 1.212 -2.249 1.00 . A A . 812 PHE HZ 1 1 2 1250 1 1 33 PHE N N 1.404 0.541 3.903 1.00 . A A . 812 PHE N 1 1 2 1251 1 1 33 PHE O O 3.472 2.856 5.476 1.00 . A A . 812 PHE O 1 1 2 1252 1 1 34 ARG C C 5.295 0.989 7.496 1.00 . A A . 813 ARG C 1 1 2 1253 1 1 34 ARG CA C 3.771 0.961 7.503 1.00 . A A . 813 ARG CA 1 1 2 1254 1 1 34 ARG CB C 3.255 -0.115 8.453 1.00 . A A . 813 ARG CB 1 1 2 1255 1 1 34 ARG CD C 1.255 -1.159 9.561 1.00 . A A . 813 ARG CD 1 1 2 1256 1 1 34 ARG CG C 1.751 -0.060 8.640 1.00 . A A . 813 ARG CG 1 1 2 1257 1 1 34 ARG CZ C 0.635 -3.288 8.492 1.00 . A A . 813 ARG CZ 1 1 2 1258 1 1 34 ARG H H 2.937 -0.169 5.926 1.00 . A A . 813 ARG H 1 1 2 1259 1 1 34 ARG HA H 3.444 1.923 7.870 1.00 . A A . 813 ARG HA 1 1 2 1260 1 1 34 ARG HB2 H 3.516 -1.086 8.058 1.00 . A A . 813 ARG HB2 1 1 2 1261 1 1 34 ARG HB3 H 3.724 0.013 9.417 1.00 . A A . 813 ARG HB3 1 1 2 1262 1 1 34 ARG HD2 H 1.729 -1.047 10.525 1.00 . A A . 813 ARG HD2 1 1 2 1263 1 1 34 ARG HD3 H 0.185 -1.056 9.672 1.00 . A A . 813 ARG HD3 1 1 2 1264 1 1 34 ARG HE H 2.481 -2.812 9.124 1.00 . A A . 813 ARG HE 1 1 2 1265 1 1 34 ARG HG2 H 1.487 0.896 9.067 1.00 . A A . 813 ARG HG2 1 1 2 1266 1 1 34 ARG HG3 H 1.274 -0.169 7.676 1.00 . A A . 813 ARG HG3 1 1 2 1267 1 1 34 ARG HH11 H -0.876 -1.939 8.618 1.00 . A A . 813 ARG HH11 1 1 2 1268 1 1 34 ARG HH12 H -1.301 -3.459 7.892 1.00 . A A . 813 ARG HH12 1 1 2 1269 1 1 34 ARG HH21 H 1.913 -4.838 8.207 1.00 . A A . 813 ARG HH21 1 1 2 1270 1 1 34 ARG HH22 H 0.271 -5.119 7.706 1.00 . A A . 813 ARG HH22 1 1 2 1271 1 1 34 ARG N N 3.249 0.733 6.163 1.00 . A A . 813 ARG N 1 1 2 1272 1 1 34 ARG NE N 1.550 -2.489 9.040 1.00 . A A . 813 ARG NE 1 1 2 1273 1 1 34 ARG NH1 N -0.615 -2.862 8.328 1.00 . A A . 813 ARG NH1 1 1 2 1274 1 1 34 ARG NH2 N 0.968 -4.508 8.100 1.00 . A A . 813 ARG NH2 1 1 2 1275 1 1 34 ARG O O 5.937 0.919 8.542 1.00 . A A . 813 ARG O 1 1 2 1276 1 1 35 GLY C C 7.468 2.909 6.031 1.00 . A A . 814 GLY C 1 1 2 1277 1 1 35 GLY CA C 7.274 1.416 6.194 1.00 . A A . 814 GLY CA 1 1 2 1278 1 1 35 GLY H H 5.335 0.980 5.500 1.00 . A A . 814 GLY H 1 1 2 1279 1 1 35 GLY HA2 H 7.788 1.082 7.084 1.00 . A A . 814 GLY HA2 1 1 2 1280 1 1 35 GLY HA3 H 7.683 0.910 5.333 1.00 . A A . 814 GLY HA3 1 1 2 1281 1 1 35 GLY N N 5.868 1.106 6.309 1.00 . A A . 814 GLY N 1 1 2 1282 1 1 35 GLY O O 8.252 3.356 5.192 1.00 . A A . 814 GLY O 1 1 2 1283 1 1 36 SER C C 6.315 5.653 5.397 1.00 . A A . 815 SER C 1 1 2 1284 1 1 36 SER CA C 6.731 5.137 6.777 1.00 . A A . 815 SER CA 1 1 2 1285 1 1 36 SER CB C 8.115 5.661 7.185 1.00 . A A . 815 SER CB 1 1 2 1286 1 1 36 SER H H 6.114 3.234 7.472 1.00 . A A . 815 SER H 1 1 2 1287 1 1 36 SER HA H 5.989 5.506 7.470 1.00 . A A . 815 SER HA 1 1 2 1288 1 1 36 SER HB2 H 8.462 5.121 8.051 1.00 . A A . 815 SER HB2 1 1 2 1289 1 1 36 SER HB3 H 8.805 5.511 6.368 1.00 . A A . 815 SER HB3 1 1 2 1290 1 1 36 SER HG H 7.818 7.155 8.429 1.00 . A A . 815 SER HG 1 1 2 1291 1 1 36 SER N N 6.708 3.674 6.822 1.00 . A A . 815 SER N 1 1 2 1292 1 1 36 SER O O 6.893 6.607 4.867 1.00 . A A . 815 SER O 1 1 2 1293 1 1 36 SER OG O 8.080 7.045 7.501 1.00 . A A . 815 SER OG 1 1 2 1294 1 1 37 LYS C C 5.452 5.972 2.566 1.00 . A A . 816 LYS C 1 1 2 1295 1 1 37 LYS CA C 4.542 5.464 3.673 1.00 . A A . 816 LYS CA 1 1 2 1296 1 1 37 LYS CB C 3.520 6.520 4.107 1.00 . A A . 816 LYS CB 1 1 2 1297 1 1 37 LYS CD C 1.410 6.963 5.430 1.00 . A A . 816 LYS CD 1 1 2 1298 1 1 37 LYS CE C 0.379 6.339 6.356 1.00 . A A . 816 LYS CE 1 1 2 1299 1 1 37 LYS CG C 2.498 5.962 5.085 1.00 . A A . 816 LYS CG 1 1 2 1300 1 1 37 LYS H H 5.103 4.078 5.165 1.00 . A A . 816 LYS H 1 1 2 1301 1 1 37 LYS HA H 4.006 4.616 3.278 1.00 . A A . 816 LYS HA 1 1 2 1302 1 1 37 LYS HB2 H 4.039 7.341 4.579 1.00 . A A . 816 LYS HB2 1 1 2 1303 1 1 37 LYS HB3 H 2.998 6.883 3.236 1.00 . A A . 816 LYS HB3 1 1 2 1304 1 1 37 LYS HD2 H 1.856 7.815 5.921 1.00 . A A . 816 LYS HD2 1 1 2 1305 1 1 37 LYS HD3 H 0.921 7.280 4.522 1.00 . A A . 816 LYS HD3 1 1 2 1306 1 1 37 LYS HE2 H -0.005 5.441 5.893 1.00 . A A . 816 LYS HE2 1 1 2 1307 1 1 37 LYS HE3 H 0.864 6.083 7.287 1.00 . A A . 816 LYS HE3 1 1 2 1308 1 1 37 LYS HG2 H 2.037 5.092 4.645 1.00 . A A . 816 LYS HG2 1 1 2 1309 1 1 37 LYS HG3 H 3.009 5.676 5.993 1.00 . A A . 816 LYS HG3 1 1 2 1310 1 1 37 LYS HZ1 H -0.421 8.107 7.134 1.00 . A A . 816 LYS HZ1 1 1 2 1311 1 1 37 LYS HZ2 H -1.464 6.778 7.232 1.00 . A A . 816 LYS HZ2 1 1 2 1312 1 1 37 LYS HZ3 H -1.215 7.544 5.745 1.00 . A A . 816 LYS HZ3 1 1 2 1313 1 1 37 LYS N N 5.303 4.979 4.831 1.00 . A A . 816 LYS N 1 1 2 1314 1 1 37 LYS NZ N -0.755 7.256 6.638 1.00 . A A . 816 LYS NZ 1 1 2 1315 1 1 37 LYS O O 5.360 7.116 2.122 1.00 . A A . 816 LYS O 1 1 2 1316 1 1 38 ARG C C 7.676 3.975 0.455 1.00 . A A . 817 ARG C 1 1 2 1317 1 1 38 ARG CA C 7.312 5.307 1.101 1.00 . A A . 817 ARG CA 1 1 2 1318 1 1 38 ARG CB C 8.561 5.983 1.674 1.00 . A A . 817 ARG CB 1 1 2 1319 1 1 38 ARG CD C 9.617 8.130 2.462 1.00 . A A . 817 ARG CD 1 1 2 1320 1 1 38 ARG CG C 8.473 7.502 1.688 1.00 . A A . 817 ARG CG 1 1 2 1321 1 1 38 ARG CZ C 10.450 8.189 4.782 1.00 . A A . 817 ARG CZ 1 1 2 1322 1 1 38 ARG H H 6.320 4.192 2.568 1.00 . A A . 817 ARG H 1 1 2 1323 1 1 38 ARG HA H 6.895 5.941 0.329 1.00 . A A . 817 ARG HA 1 1 2 1324 1 1 38 ARG HB2 H 8.705 5.642 2.689 1.00 . A A . 817 ARG HB2 1 1 2 1325 1 1 38 ARG HB3 H 9.417 5.697 1.083 1.00 . A A . 817 ARG HB3 1 1 2 1326 1 1 38 ARG HD2 H 10.545 7.683 2.137 1.00 . A A . 817 ARG HD2 1 1 2 1327 1 1 38 ARG HD3 H 9.636 9.189 2.253 1.00 . A A . 817 ARG HD3 1 1 2 1328 1 1 38 ARG HE H 8.602 7.624 4.239 1.00 . A A . 817 ARG HE 1 1 2 1329 1 1 38 ARG HG2 H 8.501 7.864 0.670 1.00 . A A . 817 ARG HG2 1 1 2 1330 1 1 38 ARG HG3 H 7.539 7.791 2.147 1.00 . A A . 817 ARG HG3 1 1 2 1331 1 1 38 ARG HH11 H 11.825 8.656 3.364 1.00 . A A . 817 ARG HH11 1 1 2 1332 1 1 38 ARG HH12 H 12.385 8.765 5.006 1.00 . A A . 817 ARG HH12 1 1 2 1333 1 1 38 ARG HH21 H 9.325 7.759 6.423 1.00 . A A . 817 ARG HH21 1 1 2 1334 1 1 38 ARG HH22 H 10.970 8.244 6.745 1.00 . A A . 817 ARG HH22 1 1 2 1335 1 1 38 ARG N N 6.330 5.074 2.150 1.00 . A A . 817 ARG N 1 1 2 1336 1 1 38 ARG NE N 9.478 7.936 3.906 1.00 . A A . 817 ARG NE 1 1 2 1337 1 1 38 ARG NH1 N 11.648 8.566 4.352 1.00 . A A . 817 ARG NH1 1 1 2 1338 1 1 38 ARG NH2 N 10.229 8.054 6.084 1.00 . A A . 817 ARG NH2 1 1 2 1339 1 1 38 ARG O O 7.976 3.907 -0.738 1.00 . A A . 817 ARG O 1 1 2 1340 1 1 39 PHE C C 6.788 0.635 1.292 1.00 . A A . 818 PHE C 1 1 2 1341 1 1 39 PHE CA C 7.865 1.567 0.755 1.00 . A A . 818 PHE CA 1 1 2 1342 1 1 39 PHE CB C 9.253 1.086 1.176 1.00 . A A . 818 PHE CB 1 1 2 1343 1 1 39 PHE CD1 C 10.801 1.976 -0.591 1.00 . A A . 818 PHE CD1 1 1 2 1344 1 1 39 PHE CD2 C 10.957 2.882 1.607 1.00 . A A . 818 PHE CD2 1 1 2 1345 1 1 39 PHE CE1 C 11.824 2.805 -1.010 1.00 . A A . 818 PHE CE1 1 1 2 1346 1 1 39 PHE CE2 C 11.982 3.711 1.196 1.00 . A A . 818 PHE CE2 1 1 2 1347 1 1 39 PHE CG C 10.355 2.005 0.721 1.00 . A A . 818 PHE CG 1 1 2 1348 1 1 39 PHE CZ C 12.362 3.730 -0.128 1.00 . A A . 818 PHE CZ 1 1 2 1349 1 1 39 PHE H H 7.460 3.027 2.208 1.00 . A A . 818 PHE H 1 1 2 1350 1 1 39 PHE HA H 7.803 1.591 -0.322 1.00 . A A . 818 PHE HA 1 1 2 1351 1 1 39 PHE HB2 H 9.291 1.026 2.253 1.00 . A A . 818 PHE HB2 1 1 2 1352 1 1 39 PHE HB3 H 9.431 0.108 0.760 1.00 . A A . 818 PHE HB3 1 1 2 1353 1 1 39 PHE HD1 H 10.338 1.295 -1.292 1.00 . A A . 818 PHE HD1 1 1 2 1354 1 1 39 PHE HD2 H 10.618 2.915 2.633 1.00 . A A . 818 PHE HD2 1 1 2 1355 1 1 39 PHE HE1 H 12.162 2.771 -2.034 1.00 . A A . 818 PHE HE1 1 1 2 1356 1 1 39 PHE HE2 H 12.443 4.390 1.897 1.00 . A A . 818 PHE HE2 1 1 2 1357 1 1 39 PHE HZ H 13.144 4.400 -0.458 1.00 . A A . 818 PHE HZ 1 1 2 1358 1 1 39 PHE N N 7.629 2.910 1.252 1.00 . A A . 818 PHE N 1 1 2 1359 1 1 39 PHE O O 6.410 0.717 2.461 1.00 . A A . 818 PHE O 1 1 2 1360 1 1 40 CYS C C 5.564 -2.194 1.715 1.00 . A A . 819 CYS C 1 1 2 1361 1 1 40 CYS CA C 5.150 -1.066 0.771 1.00 . A A . 819 CYS CA 1 1 2 1362 1 1 40 CYS CB C 4.542 -1.630 -0.515 1.00 . A A . 819 CYS CB 1 1 2 1363 1 1 40 CYS H H 6.747 -0.392 -0.415 1.00 . A A . 819 CYS H 1 1 2 1364 1 1 40 CYS HA H 4.413 -0.449 1.262 1.00 . A A . 819 CYS HA 1 1 2 1365 1 1 40 CYS HB2 H 4.093 -2.586 -0.301 1.00 . A A . 819 CYS HB2 1 1 2 1366 1 1 40 CYS HB3 H 3.782 -0.953 -0.875 1.00 . A A . 819 CYS HB3 1 1 2 1367 1 1 40 CYS N N 6.277 -0.226 0.425 1.00 . A A . 819 CYS N 1 1 2 1368 1 1 40 CYS O O 6.217 -3.137 1.287 1.00 . A A . 819 CYS O 1 1 2 1369 1 1 40 CYS SG S 5.746 -1.874 -1.850 1.00 . A A . 819 CYS SG 1 1 2 1370 1 1 41 SER C C 6.660 -3.366 4.520 1.00 . A A . 820 SER C 1 1 2 1371 1 1 41 SER CA C 5.240 -3.145 3.983 1.00 . A A . 820 SER CA 1 1 2 1372 1 1 41 SER CB C 4.599 -4.449 3.458 1.00 . A A . 820 SER CB 1 1 2 1373 1 1 41 SER H H 5.183 -1.160 3.384 1.00 . A A . 820 SER H 1 1 2 1374 1 1 41 SER HA H 4.607 -2.764 4.775 1.00 . A A . 820 SER HA 1 1 2 1375 1 1 41 SER HB2 H 4.428 -5.110 4.295 1.00 . A A . 820 SER HB2 1 1 2 1376 1 1 41 SER HB3 H 3.649 -4.208 2.993 1.00 . A A . 820 SER HB3 1 1 2 1377 1 1 41 SER HG H 5.711 -4.511 1.840 1.00 . A A . 820 SER HG 1 1 2 1378 1 1 41 SER N N 5.239 -2.054 2.999 1.00 . A A . 820 SER N 1 1 2 1379 1 1 41 SER O O 7.484 -2.448 4.478 1.00 . A A . 820 SER O 1 1 2 1380 1 1 41 SER OG O 5.412 -5.131 2.518 1.00 . A A . 820 SER OG 1 1 2 1381 1 1 42 MET C C 9.339 -5.156 4.644 1.00 . A A . 821 MET C 1 1 2 1382 1 1 42 MET CA C 8.239 -4.825 5.656 1.00 . A A . 821 MET CA 1 1 2 1383 1 1 42 MET CB C 8.083 -5.981 6.647 1.00 . A A . 821 MET CB 1 1 2 1384 1 1 42 MET CE C 11.754 -5.524 8.470 1.00 . A A . 821 MET CE 1 1 2 1385 1 1 42 MET CG C 9.110 -5.948 7.765 1.00 . A A . 821 MET CG 1 1 2 1386 1 1 42 MET H H 6.321 -5.307 4.875 1.00 . A A . 821 MET H 1 1 2 1387 1 1 42 MET HA H 8.511 -3.938 6.211 1.00 . A A . 821 MET HA 1 1 2 1388 1 1 42 MET HB2 H 7.098 -5.937 7.088 1.00 . A A . 821 MET HB2 1 1 2 1389 1 1 42 MET HB3 H 8.191 -6.913 6.114 1.00 . A A . 821 MET HB3 1 1 2 1390 1 1 42 MET HE1 H 12.803 -5.709 8.292 1.00 . A A . 821 MET HE1 1 1 2 1391 1 1 42 MET HE2 H 11.480 -5.916 9.437 1.00 . A A . 821 MET HE2 1 1 2 1392 1 1 42 MET HE3 H 11.567 -4.459 8.445 1.00 . A A . 821 MET HE3 1 1 2 1393 1 1 42 MET HG2 H 9.109 -4.961 8.197 1.00 . A A . 821 MET HG2 1 1 2 1394 1 1 42 MET HG3 H 8.826 -6.669 8.518 1.00 . A A . 821 MET HG3 1 1 2 1395 1 1 42 MET N N 6.965 -4.571 4.985 1.00 . A A . 821 MET N 1 1 2 1396 1 1 42 MET O O 10.345 -4.453 4.553 1.00 . A A . 821 MET O 1 1 2 1397 1 1 42 MET SD S 10.781 -6.328 7.200 1.00 . A A . 821 MET SD 1 1 2 1398 1 1 43 THR C C 10.526 -5.563 1.928 1.00 . A A . 822 THR C 1 1 2 1399 1 1 43 THR CA C 10.030 -6.687 2.844 1.00 . A A . 822 THR CA 1 1 2 1400 1 1 43 THR CB C 9.310 -7.748 1.999 1.00 . A A . 822 THR CB 1 1 2 1401 1 1 43 THR CG2 C 9.670 -9.149 2.463 1.00 . A A . 822 THR CG2 1 1 2 1402 1 1 43 THR H H 8.324 -6.767 4.069 1.00 . A A . 822 THR H 1 1 2 1403 1 1 43 THR HA H 10.908 -7.153 3.264 1.00 . A A . 822 THR HA 1 1 2 1404 1 1 43 THR HB H 9.612 -7.633 0.973 1.00 . A A . 822 THR HB 1 1 2 1405 1 1 43 THR HG1 H 7.550 -7.225 1.248 1.00 . A A . 822 THR HG1 1 1 2 1406 1 1 43 THR HG21 H 9.369 -9.273 3.492 1.00 . A A . 822 THR HG21 1 1 2 1407 1 1 43 THR HG22 H 10.737 -9.295 2.380 1.00 . A A . 822 THR HG22 1 1 2 1408 1 1 43 THR HG23 H 9.159 -9.874 1.848 1.00 . A A . 822 THR HG23 1 1 2 1409 1 1 43 THR N N 9.123 -6.230 3.894 1.00 . A A . 822 THR N 1 1 2 1410 1 1 43 THR O O 11.702 -5.528 1.567 1.00 . A A . 822 THR O 1 1 2 1411 1 1 43 THR OG1 O 7.892 -7.555 2.097 1.00 . A A . 822 THR OG1 1 1 2 1412 1 1 44 CYS C C 10.866 -2.502 1.462 1.00 . A A . 823 CYS C 1 1 2 1413 1 1 44 CYS CA C 10.061 -3.552 0.701 1.00 . A A . 823 CYS CA 1 1 2 1414 1 1 44 CYS CB C 8.845 -2.945 0.038 1.00 . A A . 823 CYS CB 1 1 2 1415 1 1 44 CYS H H 8.727 -4.722 1.866 1.00 . A A . 823 CYS H 1 1 2 1416 1 1 44 CYS HA H 10.688 -3.954 -0.085 1.00 . A A . 823 CYS HA 1 1 2 1417 1 1 44 CYS HB2 H 8.091 -2.747 0.786 1.00 . A A . 823 CYS HB2 1 1 2 1418 1 1 44 CYS HB3 H 9.124 -2.023 -0.450 1.00 . A A . 823 CYS HB3 1 1 2 1419 1 1 44 CYS N N 9.654 -4.658 1.548 1.00 . A A . 823 CYS N 1 1 2 1420 1 1 44 CYS O O 11.887 -2.011 0.969 1.00 . A A . 823 CYS O 1 1 2 1421 1 1 44 CYS SG S 8.130 -4.044 -1.208 1.00 . A A . 823 CYS SG 1 1 2 1422 1 1 45 ALA C C 12.505 -1.645 3.836 1.00 . A A . 824 ALA C 1 1 2 1423 1 1 45 ALA CA C 11.098 -1.180 3.480 1.00 . A A . 824 ALA CA 1 1 2 1424 1 1 45 ALA CB C 10.293 -0.883 4.728 1.00 . A A . 824 ALA CB 1 1 2 1425 1 1 45 ALA H H 9.603 -2.593 3.017 1.00 . A A . 824 ALA H 1 1 2 1426 1 1 45 ALA HA H 11.168 -0.265 2.914 1.00 . A A . 824 ALA HA 1 1 2 1427 1 1 45 ALA HB1 H 10.804 -0.136 5.314 1.00 . A A . 824 ALA HB1 1 1 2 1428 1 1 45 ALA HB2 H 10.182 -1.786 5.309 1.00 . A A . 824 ALA HB2 1 1 2 1429 1 1 45 ALA HB3 H 9.319 -0.513 4.441 1.00 . A A . 824 ALA HB3 1 1 2 1430 1 1 45 ALA N N 10.410 -2.160 2.659 1.00 . A A . 824 ALA N 1 1 2 1431 1 1 45 ALA O O 13.460 -0.872 3.757 1.00 . A A . 824 ALA O 1 1 2 1432 1 1 46 LYS C C 14.840 -3.507 3.331 1.00 . A A . 825 LYS C 1 1 2 1433 1 1 46 LYS CA C 13.940 -3.474 4.561 1.00 . A A . 825 LYS CA 1 1 2 1434 1 1 46 LYS CB C 13.796 -4.891 5.132 1.00 . A A . 825 LYS CB 1 1 2 1435 1 1 46 LYS CD C 13.147 -7.309 4.744 1.00 . A A . 825 LYS CD 1 1 2 1436 1 1 46 LYS CE C 14.456 -8.087 4.648 1.00 . A A . 825 LYS CE 1 1 2 1437 1 1 46 LYS CG C 13.250 -5.912 4.143 1.00 . A A . 825 LYS CG 1 1 2 1438 1 1 46 LYS H H 11.834 -3.478 4.348 1.00 . A A . 825 LYS H 1 1 2 1439 1 1 46 LYS HA H 14.364 -2.841 5.327 1.00 . A A . 825 LYS HA 1 1 2 1440 1 1 46 LYS HB2 H 14.766 -5.231 5.464 1.00 . A A . 825 LYS HB2 1 1 2 1441 1 1 46 LYS HB3 H 13.127 -4.852 5.979 1.00 . A A . 825 LYS HB3 1 1 2 1442 1 1 46 LYS HD2 H 12.875 -7.218 5.783 1.00 . A A . 825 LYS HD2 1 1 2 1443 1 1 46 LYS HD3 H 12.378 -7.857 4.219 1.00 . A A . 825 LYS HD3 1 1 2 1444 1 1 46 LYS HE2 H 14.270 -9.105 4.949 1.00 . A A . 825 LYS HE2 1 1 2 1445 1 1 46 LYS HE3 H 14.788 -8.074 3.619 1.00 . A A . 825 LYS HE3 1 1 2 1446 1 1 46 LYS HG2 H 12.268 -5.599 3.828 1.00 . A A . 825 LYS HG2 1 1 2 1447 1 1 46 LYS HG3 H 13.908 -5.947 3.286 1.00 . A A . 825 LYS HG3 1 1 2 1448 1 1 46 LYS HZ1 H 15.157 -7.320 6.459 1.00 . A A . 825 LYS HZ1 1 1 2 1449 1 1 46 LYS HZ2 H 15.907 -6.649 5.093 1.00 . A A . 825 LYS HZ2 1 1 2 1450 1 1 46 LYS HZ3 H 16.308 -8.215 5.599 1.00 . A A . 825 LYS HZ3 1 1 2 1451 1 1 46 LYS N N 12.635 -2.914 4.228 1.00 . A A . 825 LYS N 1 1 2 1452 1 1 46 LYS NZ N 15.530 -7.526 5.508 1.00 . A A . 825 LYS NZ 1 1 2 1453 1 1 46 LYS O O 16.061 -3.464 3.441 1.00 . A A . 825 LYS O 1 1 2 1454 1 1 47 ARG C C 15.703 -2.427 0.611 1.00 . A A . 826 ARG C 1 1 2 1455 1 1 47 ARG CA C 14.941 -3.711 0.909 1.00 . A A . 826 ARG CA 1 1 2 1456 1 1 47 ARG CB C 13.976 -4.020 -0.239 1.00 . A A . 826 ARG CB 1 1 2 1457 1 1 47 ARG CD C 15.197 -5.989 -1.212 1.00 . A A . 826 ARG CD 1 1 2 1458 1 1 47 ARG CG C 14.657 -4.590 -1.473 1.00 . A A . 826 ARG CG 1 1 2 1459 1 1 47 ARG CZ C 14.190 -7.822 0.111 1.00 . A A . 826 ARG CZ 1 1 2 1460 1 1 47 ARG H H 13.235 -3.679 2.159 1.00 . A A . 826 ARG H 1 1 2 1461 1 1 47 ARG HA H 15.634 -4.535 1.005 1.00 . A A . 826 ARG HA 1 1 2 1462 1 1 47 ARG HB2 H 13.243 -4.734 0.106 1.00 . A A . 826 ARG HB2 1 1 2 1463 1 1 47 ARG HB3 H 13.469 -3.107 -0.522 1.00 . A A . 826 ARG HB3 1 1 2 1464 1 1 47 ARG HD2 H 15.709 -6.331 -2.098 1.00 . A A . 826 ARG HD2 1 1 2 1465 1 1 47 ARG HD3 H 15.892 -5.944 -0.388 1.00 . A A . 826 ARG HD3 1 1 2 1466 1 1 47 ARG HE H 13.323 -6.918 -1.455 1.00 . A A . 826 ARG HE 1 1 2 1467 1 1 47 ARG HG2 H 13.941 -4.635 -2.280 1.00 . A A . 826 ARG HG2 1 1 2 1468 1 1 47 ARG HG3 H 15.476 -3.943 -1.749 1.00 . A A . 826 ARG HG3 1 1 2 1469 1 1 47 ARG HH11 H 16.032 -7.249 0.747 1.00 . A A . 826 ARG HH11 1 1 2 1470 1 1 47 ARG HH12 H 15.313 -8.564 1.634 1.00 . A A . 826 ARG HH12 1 1 2 1471 1 1 47 ARG HH21 H 12.369 -8.622 -0.282 1.00 . A A . 826 ARG HH21 1 1 2 1472 1 1 47 ARG HH22 H 13.205 -9.314 1.077 1.00 . A A . 826 ARG HH22 1 1 2 1473 1 1 47 ARG N N 14.213 -3.602 2.161 1.00 . A A . 826 ARG N 1 1 2 1474 1 1 47 ARG NE N 14.131 -6.937 -0.885 1.00 . A A . 826 ARG NE 1 1 2 1475 1 1 47 ARG NH1 N 15.259 -7.878 0.895 1.00 . A A . 826 ARG NH1 1 1 2 1476 1 1 47 ARG NH2 N 13.175 -8.653 0.315 1.00 . A A . 826 ARG NH2 1 1 2 1477 1 1 47 ARG O O 16.761 -2.454 -0.015 1.00 . A A . 826 ARG O 1 1 2 1478 1 1 48 TYR C C 16.808 0.254 2.012 1.00 . A A . 827 TYR C 1 1 2 1479 1 1 48 TYR CA C 15.834 -0.020 0.861 1.00 . A A . 827 TYR CA 1 1 2 1480 1 1 48 TYR CB C 14.820 1.117 0.699 1.00 . A A . 827 TYR CB 1 1 2 1481 1 1 48 TYR CD1 C 15.933 2.822 -0.800 1.00 . A A . 827 TYR CD1 1 1 2 1482 1 1 48 TYR CD2 C 15.558 3.409 1.480 1.00 . A A . 827 TYR CD2 1 1 2 1483 1 1 48 TYR CE1 C 16.510 4.058 -1.028 1.00 . A A . 827 TYR CE1 1 1 2 1484 1 1 48 TYR CE2 C 16.132 4.647 1.259 1.00 . A A . 827 TYR CE2 1 1 2 1485 1 1 48 TYR CG C 15.445 2.476 0.454 1.00 . A A . 827 TYR CG 1 1 2 1486 1 1 48 TYR CZ C 16.580 4.979 0.006 1.00 . A A . 827 TYR CZ 1 1 2 1487 1 1 48 TYR H H 14.334 -1.343 1.596 1.00 . A A . 827 TYR H 1 1 2 1488 1 1 48 TYR HA H 16.431 -0.115 -0.034 1.00 . A A . 827 TYR HA 1 1 2 1489 1 1 48 TYR HB2 H 14.175 0.895 -0.139 1.00 . A A . 827 TYR HB2 1 1 2 1490 1 1 48 TYR HB3 H 14.219 1.184 1.596 1.00 . A A . 827 TYR HB3 1 1 2 1491 1 1 48 TYR HD1 H 15.855 2.110 -1.610 1.00 . A A . 827 TYR HD1 1 1 2 1492 1 1 48 TYR HD2 H 15.186 3.158 2.463 1.00 . A A . 827 TYR HD2 1 1 2 1493 1 1 48 TYR HE1 H 16.882 4.309 -2.012 1.00 . A A . 827 TYR HE1 1 1 2 1494 1 1 48 TYR HE2 H 16.210 5.358 2.067 1.00 . A A . 827 TYR HE2 1 1 2 1495 1 1 48 TYR HH H 16.806 6.587 -1.025 1.00 . A A . 827 TYR HH 1 1 2 1496 1 1 48 TYR N N 15.161 -1.299 1.057 1.00 . A A . 827 TYR N 1 1 2 1497 1 1 48 TYR O O 17.665 1.132 1.913 1.00 . A A . 827 TYR O 1 1 2 1498 1 1 48 TYR OH O 17.184 6.199 -0.217 1.00 . A A . 827 TYR OH 1 1 2 1499 1 1 49 ASN C C 17.292 0.956 4.949 1.00 . A A . 828 ASN C 1 1 2 1500 1 1 49 ASN CA C 17.528 -0.389 4.271 1.00 . A A . 828 ASN CA 1 1 2 1501 1 1 49 ASN CB C 19.017 -0.544 3.923 1.00 . A A . 828 ASN CB 1 1 2 1502 1 1 49 ASN CG C 19.402 -1.958 3.520 1.00 . A A . 828 ASN CG 1 1 2 1503 1 1 49 ASN H H 15.996 -1.227 3.076 1.00 . A A . 828 ASN H 1 1 2 1504 1 1 49 ASN HA H 17.250 -1.172 4.963 1.00 . A A . 828 ASN HA 1 1 2 1505 1 1 49 ASN HB2 H 19.252 0.114 3.101 1.00 . A A . 828 ASN HB2 1 1 2 1506 1 1 49 ASN HB3 H 19.606 -0.261 4.781 1.00 . A A . 828 ASN HB3 1 1 2 1507 1 1 49 ASN HD21 H 18.049 -2.729 4.757 1.00 . A A . 828 ASN HD21 1 1 2 1508 1 1 49 ASN HD22 H 18.989 -3.874 3.857 1.00 . A A . 828 ASN HD22 1 1 2 1509 1 1 49 ASN N N 16.682 -0.529 3.084 1.00 . A A . 828 ASN N 1 1 2 1510 1 1 49 ASN ND2 N 18.747 -2.952 4.100 1.00 . A A . 828 ASN ND2 1 1 2 1511 1 1 49 ASN O O 18.098 1.888 4.735 1.00 . A A . 828 ASN O 1 1 2 1512 1 1 49 ASN OXT O 16.294 1.082 5.690 1.00 . A A . 828 ASN OXT 1 1 2 1513 1 1 49 ASN OD1 O 20.302 -2.159 2.702 1.00 . A A . 828 ASN OD1 1 1 2 1514 2 2 1 ZN ZN ZN 8.141 -2.316 -2.607 1.00 . B A . 829 ZN ZN 1 1 3 1515 1 1 1 GLY C C -14.751 2.868 11.910 1.00 . A A . 1 GLY C 1 1 3 1516 1 1 1 GLY CA C -14.089 1.991 12.948 1.00 . A A . 1 GLY CA 1 1 3 1517 1 1 1 GLY H1 H -15.069 0.208 12.474 1.00 . A A . 1 GLY H1 1 1 3 1518 1 1 1 GLY H2 H -15.875 1.156 13.632 1.00 . A A . 1 GLY H2 1 1 3 1519 1 1 1 GLY H3 H -14.494 0.278 14.071 1.00 . A A . 1 GLY H3 1 1 3 1520 1 1 1 GLY HA2 H -13.902 2.577 13.837 1.00 . A A . 1 GLY HA2 1 1 3 1521 1 1 1 GLY HA3 H -13.146 1.632 12.559 1.00 . A A . 1 GLY HA3 1 1 3 1522 1 1 1 GLY N N -14.939 0.828 13.306 1.00 . A A . 1 GLY N 1 1 3 1523 1 1 1 GLY O O -14.661 4.097 11.978 1.00 . A A . 1 GLY O 1 1 3 1524 1 1 2 THR C C -15.333 3.613 8.872 1.00 . A A . 2 THR C 1 1 3 1525 1 1 2 THR CA C -16.199 2.909 9.920 1.00 . A A . 2 THR CA 1 1 3 1526 1 1 2 THR CB C -17.182 3.908 10.569 1.00 . A A . 2 THR CB 1 1 3 1527 1 1 2 THR CG2 C -18.080 4.559 9.526 1.00 . A A . 2 THR CG2 1 1 3 1528 1 1 2 THR H H -15.321 1.241 10.885 1.00 . A A . 2 THR H 1 1 3 1529 1 1 2 THR HA H -16.786 2.153 9.416 1.00 . A A . 2 THR HA 1 1 3 1530 1 1 2 THR HB H -16.614 4.680 11.069 1.00 . A A . 2 THR HB 1 1 3 1531 1 1 2 THR HG1 H -17.637 2.323 11.673 1.00 . A A . 2 THR HG1 1 1 3 1532 1 1 2 THR HG21 H -18.605 3.793 8.973 1.00 . A A . 2 THR HG21 1 1 3 1533 1 1 2 THR HG22 H -17.478 5.147 8.849 1.00 . A A . 2 THR HG22 1 1 3 1534 1 1 2 THR HG23 H -18.796 5.199 10.020 1.00 . A A . 2 THR HG23 1 1 3 1535 1 1 2 THR N N -15.396 2.226 10.933 1.00 . A A . 2 THR N 1 1 3 1536 1 1 2 THR O O -15.558 3.459 7.675 1.00 . A A . 2 THR O 1 1 3 1537 1 1 2 THR OG1 O -17.993 3.220 11.534 1.00 . A A . 2 THR OG1 1 1 3 1538 1 1 3 ARG C C -12.285 4.147 8.005 1.00 . A A . 3 ARG C 1 1 3 1539 1 1 3 ARG CA C -13.447 5.053 8.394 1.00 . A A . 3 ARG CA 1 1 3 1540 1 1 3 ARG CB C -12.922 6.351 9.007 1.00 . A A . 3 ARG CB 1 1 3 1541 1 1 3 ARG CD C -13.466 8.620 9.950 1.00 . A A . 3 ARG CD 1 1 3 1542 1 1 3 ARG CG C -13.991 7.416 9.183 1.00 . A A . 3 ARG CG 1 1 3 1543 1 1 3 ARG CZ C -11.896 10.479 9.534 1.00 . A A . 3 ARG CZ 1 1 3 1544 1 1 3 ARG H H -14.212 4.472 10.282 1.00 . A A . 3 ARG H 1 1 3 1545 1 1 3 ARG HA H -14.009 5.290 7.503 1.00 . A A . 3 ARG HA 1 1 3 1546 1 1 3 ARG HB2 H -12.499 6.134 9.976 1.00 . A A . 3 ARG HB2 1 1 3 1547 1 1 3 ARG HB3 H -12.148 6.750 8.368 1.00 . A A . 3 ARG HB3 1 1 3 1548 1 1 3 ARG HD2 H -14.251 9.359 10.011 1.00 . A A . 3 ARG HD2 1 1 3 1549 1 1 3 ARG HD3 H -13.196 8.302 10.948 1.00 . A A . 3 ARG HD3 1 1 3 1550 1 1 3 ARG HE H -11.776 8.668 8.693 1.00 . A A . 3 ARG HE 1 1 3 1551 1 1 3 ARG HG2 H -14.326 7.740 8.208 1.00 . A A . 3 ARG HG2 1 1 3 1552 1 1 3 ARG HG3 H -14.822 6.990 9.726 1.00 . A A . 3 ARG HG3 1 1 3 1553 1 1 3 ARG HH11 H -13.428 10.946 10.783 1.00 . A A . 3 ARG HH11 1 1 3 1554 1 1 3 ARG HH12 H -12.286 12.223 10.490 1.00 . A A . 3 ARG HH12 1 1 3 1555 1 1 3 ARG HH21 H -10.281 10.337 8.318 1.00 . A A . 3 ARG HH21 1 1 3 1556 1 1 3 ARG HH22 H -10.486 11.878 9.111 1.00 . A A . 3 ARG HH22 1 1 3 1557 1 1 3 ARG N N -14.343 4.371 9.314 1.00 . A A . 3 ARG N 1 1 3 1558 1 1 3 ARG NE N -12.299 9.227 9.312 1.00 . A A . 3 ARG NE 1 1 3 1559 1 1 3 ARG NH1 N -12.591 11.278 10.335 1.00 . A A . 3 ARG NH1 1 1 3 1560 1 1 3 ARG NH2 N -10.803 10.935 8.938 1.00 . A A . 3 ARG NH2 1 1 3 1561 1 1 3 ARG O O -12.250 3.605 6.896 1.00 . A A . 3 ARG O 1 1 3 1562 1 1 4 GLY C C -8.928 3.715 9.251 1.00 . A A . 783 GLY C 1 1 3 1563 1 1 4 GLY CA C -10.195 3.135 8.658 1.00 . A A . 783 GLY CA 1 1 3 1564 1 1 4 GLY H H -11.442 4.400 9.803 1.00 . A A . 783 GLY H 1 1 3 1565 1 1 4 GLY HA2 H -10.362 2.153 9.078 1.00 . A A . 783 GLY HA2 1 1 3 1566 1 1 4 GLY HA3 H -10.071 3.044 7.589 1.00 . A A . 783 GLY HA3 1 1 3 1567 1 1 4 GLY N N -11.351 3.963 8.929 1.00 . A A . 783 GLY N 1 1 3 1568 1 1 4 GLY O O -8.994 4.587 10.122 1.00 . A A . 783 GLY O 1 1 3 1569 1 1 5 VAL C C -6.119 3.121 10.591 1.00 . A A . 784 VAL C 1 1 3 1570 1 1 5 VAL CA C -6.461 3.690 9.218 1.00 . A A . 784 VAL CA 1 1 3 1571 1 1 5 VAL CB C -6.359 5.235 9.236 1.00 . A A . 784 VAL CB 1 1 3 1572 1 1 5 VAL CG1 C -4.990 5.684 9.718 1.00 . A A . 784 VAL CG1 1 1 3 1573 1 1 5 VAL CG2 C -6.644 5.807 7.854 1.00 . A A . 784 VAL CG2 1 1 3 1574 1 1 5 VAL H H -7.824 2.482 8.144 1.00 . A A . 784 VAL H 1 1 3 1575 1 1 5 VAL HA H -5.737 3.315 8.507 1.00 . A A . 784 VAL HA 1 1 3 1576 1 1 5 VAL HB H -7.102 5.619 9.920 1.00 . A A . 784 VAL HB 1 1 3 1577 1 1 5 VAL HG11 H -4.817 5.303 10.712 1.00 . A A . 784 VAL HG11 1 1 3 1578 1 1 5 VAL HG12 H -4.950 6.762 9.733 1.00 . A A . 784 VAL HG12 1 1 3 1579 1 1 5 VAL HG13 H -4.232 5.305 9.047 1.00 . A A . 784 VAL HG13 1 1 3 1580 1 1 5 VAL HG21 H -7.638 5.520 7.544 1.00 . A A . 784 VAL HG21 1 1 3 1581 1 1 5 VAL HG22 H -5.922 5.422 7.151 1.00 . A A . 784 VAL HG22 1 1 3 1582 1 1 5 VAL HG23 H -6.574 6.885 7.890 1.00 . A A . 784 VAL HG23 1 1 3 1583 1 1 5 VAL N N -7.782 3.216 8.786 1.00 . A A . 784 VAL N 1 1 3 1584 1 1 5 VAL O O -5.096 2.457 10.769 1.00 . A A . 784 VAL O 1 1 3 1585 1 1 6 ASP C C -8.187 1.968 13.083 1.00 . A A . 785 ASP C 1 1 3 1586 1 1 6 ASP CA C -6.905 2.745 12.853 1.00 . A A . 785 ASP CA 1 1 3 1587 1 1 6 ASP CB C -6.694 3.771 13.969 1.00 . A A . 785 ASP CB 1 1 3 1588 1 1 6 ASP CG C -6.672 3.126 15.343 1.00 . A A . 785 ASP CG 1 1 3 1589 1 1 6 ASP H H -7.707 4.026 11.380 1.00 . A A . 785 ASP H 1 1 3 1590 1 1 6 ASP HA H -6.073 2.055 12.836 1.00 . A A . 785 ASP HA 1 1 3 1591 1 1 6 ASP HB2 H -5.752 4.277 13.813 1.00 . A A . 785 ASP HB2 1 1 3 1592 1 1 6 ASP HB3 H -7.497 4.494 13.944 1.00 . A A . 785 ASP HB3 1 1 3 1593 1 1 6 ASP N N -6.982 3.384 11.554 1.00 . A A . 785 ASP N 1 1 3 1594 1 1 6 ASP O O -9.204 2.532 13.490 1.00 . A A . 785 ASP O 1 1 3 1595 1 1 6 ASP OD1 O -5.703 2.400 15.652 1.00 . A A . 785 ASP OD1 1 1 3 1596 1 1 6 ASP OD2 O -7.615 3.352 16.128 1.00 . A A . 785 ASP OD2 1 1 3 1597 1 1 7 SER C C -9.052 -1.487 13.508 1.00 . A A . 786 SER C 1 1 3 1598 1 1 7 SER CA C -9.345 -0.135 12.861 1.00 . A A . 786 SER CA 1 1 3 1599 1 1 7 SER CB C -9.934 -0.332 11.465 1.00 . A A . 786 SER CB 1 1 3 1600 1 1 7 SER H H -7.307 0.276 12.485 1.00 . A A . 786 SER H 1 1 3 1601 1 1 7 SER HA H -10.063 0.395 13.463 1.00 . A A . 786 SER HA 1 1 3 1602 1 1 7 SER HB2 H -9.204 -0.818 10.833 1.00 . A A . 786 SER HB2 1 1 3 1603 1 1 7 SER HB3 H -10.820 -0.947 11.531 1.00 . A A . 786 SER HB3 1 1 3 1604 1 1 7 SER HG H -10.233 1.599 11.568 1.00 . A A . 786 SER HG 1 1 3 1605 1 1 7 SER N N -8.156 0.686 12.777 1.00 . A A . 786 SER N 1 1 3 1606 1 1 7 SER O O -8.075 -2.152 13.164 1.00 . A A . 786 SER O 1 1 3 1607 1 1 7 SER OG O -10.282 0.916 10.890 1.00 . A A . 786 SER OG 1 1 3 1608 1 1 8 PRO C C -10.636 -4.236 14.292 1.00 . A A . 787 PRO C 1 1 3 1609 1 1 8 PRO CA C -9.823 -3.219 15.088 1.00 . A A . 787 PRO CA 1 1 3 1610 1 1 8 PRO CB C -10.440 -3.005 16.480 1.00 . A A . 787 PRO CB 1 1 3 1611 1 1 8 PRO CD C -10.967 -1.108 15.071 1.00 . A A . 787 PRO CD 1 1 3 1612 1 1 8 PRO CG C -10.996 -1.610 16.490 1.00 . A A . 787 PRO CG 1 1 3 1613 1 1 8 PRO HA H -8.804 -3.564 15.186 1.00 . A A . 787 PRO HA 1 1 3 1614 1 1 8 PRO HB2 H -11.220 -3.736 16.644 1.00 . A A . 787 PRO HB2 1 1 3 1615 1 1 8 PRO HB3 H -9.673 -3.125 17.231 1.00 . A A . 787 PRO HB3 1 1 3 1616 1 1 8 PRO HD2 H -11.910 -1.303 14.581 1.00 . A A . 787 PRO HD2 1 1 3 1617 1 1 8 PRO HD3 H -10.732 -0.055 15.046 1.00 . A A . 787 PRO HD3 1 1 3 1618 1 1 8 PRO HG2 H -12.012 -1.627 16.855 1.00 . A A . 787 PRO HG2 1 1 3 1619 1 1 8 PRO HG3 H -10.386 -0.979 17.122 1.00 . A A . 787 PRO HG3 1 1 3 1620 1 1 8 PRO N N -9.891 -1.900 14.474 1.00 . A A . 787 PRO N 1 1 3 1621 1 1 8 PRO O O -10.805 -5.388 14.694 1.00 . A A . 787 PRO O 1 1 3 1622 1 1 9 SER C C -11.473 -4.358 10.846 1.00 . A A . 788 SER C 1 1 3 1623 1 1 9 SER CA C -11.934 -4.605 12.276 1.00 . A A . 788 SER CA 1 1 3 1624 1 1 9 SER CB C -13.421 -4.267 12.437 1.00 . A A . 788 SER CB 1 1 3 1625 1 1 9 SER H H -10.977 -2.851 12.912 1.00 . A A . 788 SER H 1 1 3 1626 1 1 9 SER HA H -11.768 -5.641 12.532 1.00 . A A . 788 SER HA 1 1 3 1627 1 1 9 SER HB2 H -13.684 -4.312 13.483 1.00 . A A . 788 SER HB2 1 1 3 1628 1 1 9 SER HB3 H -13.601 -3.269 12.064 1.00 . A A . 788 SER HB3 1 1 3 1629 1 1 9 SER HG H -13.767 -6.011 11.582 1.00 . A A . 788 SER HG 1 1 3 1630 1 1 9 SER N N -11.146 -3.781 13.163 1.00 . A A . 788 SER N 1 1 3 1631 1 1 9 SER O O -10.885 -3.313 10.553 1.00 . A A . 788 SER O 1 1 3 1632 1 1 9 SER OG O -14.245 -5.176 11.722 1.00 . A A . 788 SER OG 1 1 3 1633 1 1 10 ALA C C -12.170 -4.277 7.784 1.00 . A A . 789 ALA C 1 1 3 1634 1 1 10 ALA CA C -11.285 -5.227 8.587 1.00 . A A . 789 ALA CA 1 1 3 1635 1 1 10 ALA CB C -11.268 -6.609 7.956 1.00 . A A . 789 ALA CB 1 1 3 1636 1 1 10 ALA H H -12.222 -6.115 10.262 1.00 . A A . 789 ALA H 1 1 3 1637 1 1 10 ALA HA H -10.275 -4.847 8.582 1.00 . A A . 789 ALA HA 1 1 3 1638 1 1 10 ALA HB1 H -10.857 -6.545 6.960 1.00 . A A . 789 ALA HB1 1 1 3 1639 1 1 10 ALA HB2 H -12.275 -6.997 7.908 1.00 . A A . 789 ALA HB2 1 1 3 1640 1 1 10 ALA HB3 H -10.658 -7.268 8.556 1.00 . A A . 789 ALA HB3 1 1 3 1641 1 1 10 ALA N N -11.722 -5.317 9.970 1.00 . A A . 789 ALA N 1 1 3 1642 1 1 10 ALA O O -12.919 -4.703 6.904 1.00 . A A . 789 ALA O 1 1 3 1643 1 1 11 GLU C C -11.951 -1.006 6.654 1.00 . A A . 790 GLU C 1 1 3 1644 1 1 11 GLU CA C -12.852 -1.976 7.397 1.00 . A A . 790 GLU CA 1 1 3 1645 1 1 11 GLU CB C -13.712 -1.172 8.361 1.00 . A A . 790 GLU CB 1 1 3 1646 1 1 11 GLU CD C -15.475 -1.178 10.173 1.00 . A A . 790 GLU CD 1 1 3 1647 1 1 11 GLU CG C -14.698 -2.006 9.168 1.00 . A A . 790 GLU CG 1 1 3 1648 1 1 11 GLU H H -11.487 -2.720 8.836 1.00 . A A . 790 GLU H 1 1 3 1649 1 1 11 GLU HA H -13.492 -2.476 6.685 1.00 . A A . 790 GLU HA 1 1 3 1650 1 1 11 GLU HB2 H -13.064 -0.652 9.051 1.00 . A A . 790 GLU HB2 1 1 3 1651 1 1 11 GLU HB3 H -14.264 -0.443 7.782 1.00 . A A . 790 GLU HB3 1 1 3 1652 1 1 11 GLU HG2 H -15.398 -2.470 8.490 1.00 . A A . 790 GLU HG2 1 1 3 1653 1 1 11 GLU HG3 H -14.151 -2.771 9.700 1.00 . A A . 790 GLU HG3 1 1 3 1654 1 1 11 GLU N N -12.080 -2.989 8.100 1.00 . A A . 790 GLU N 1 1 3 1655 1 1 11 GLU O O -12.434 -0.161 5.897 1.00 . A A . 790 GLU O 1 1 3 1656 1 1 11 GLU OE1 O -14.846 -0.471 10.991 1.00 . A A . 790 GLU OE1 1 1 3 1657 1 1 11 GLU OE2 O -16.722 -1.233 10.158 1.00 . A A . 790 GLU OE2 1 1 3 1658 1 1 12 LEU C C -9.392 -0.590 4.835 1.00 . A A . 791 LEU C 1 1 3 1659 1 1 12 LEU CA C -9.748 -0.147 6.242 1.00 . A A . 791 LEU CA 1 1 3 1660 1 1 12 LEU CB C -8.502 0.107 7.108 1.00 . A A . 791 LEU CB 1 1 3 1661 1 1 12 LEU CD1 C -6.769 -1.578 6.373 1.00 . A A . 791 LEU CD1 1 1 3 1662 1 1 12 LEU CD2 C -6.847 -0.811 8.750 1.00 . A A . 791 LEU CD2 1 1 3 1663 1 1 12 LEU CG C -7.672 -1.120 7.511 1.00 . A A . 791 LEU CG 1 1 3 1664 1 1 12 LEU H H -10.287 -1.834 7.411 1.00 . A A . 791 LEU H 1 1 3 1665 1 1 12 LEU HA H -10.308 0.766 6.163 1.00 . A A . 791 LEU HA 1 1 3 1666 1 1 12 LEU HB2 H -7.855 0.781 6.566 1.00 . A A . 791 LEU HB2 1 1 3 1667 1 1 12 LEU HB3 H -8.821 0.603 8.013 1.00 . A A . 791 LEU HB3 1 1 3 1668 1 1 12 LEU HD11 H -6.210 -2.447 6.684 1.00 . A A . 791 LEU HD11 1 1 3 1669 1 1 12 LEU HD12 H -6.087 -0.781 6.117 1.00 . A A . 791 LEU HD12 1 1 3 1670 1 1 12 LEU HD13 H -7.373 -1.826 5.511 1.00 . A A . 791 LEU HD13 1 1 3 1671 1 1 12 LEU HD21 H -6.208 0.038 8.552 1.00 . A A . 791 LEU HD21 1 1 3 1672 1 1 12 LEU HD22 H -6.240 -1.668 9.002 1.00 . A A . 791 LEU HD22 1 1 3 1673 1 1 12 LEU HD23 H -7.505 -0.581 9.574 1.00 . A A . 791 LEU HD23 1 1 3 1674 1 1 12 LEU HG H -8.340 -1.935 7.751 1.00 . A A . 791 LEU HG 1 1 3 1675 1 1 12 LEU N N -10.647 -1.105 6.858 1.00 . A A . 791 LEU N 1 1 3 1676 1 1 12 LEU O O -8.727 0.121 4.085 1.00 . A A . 791 LEU O 1 1 3 1677 1 1 13 ASP C C -10.940 -1.794 2.295 1.00 . A A . 792 ASP C 1 1 3 1678 1 1 13 ASP CA C -9.770 -2.282 3.127 1.00 . A A . 792 ASP CA 1 1 3 1679 1 1 13 ASP CB C -9.736 -3.817 3.114 1.00 . A A . 792 ASP CB 1 1 3 1680 1 1 13 ASP CG C -8.446 -4.397 3.656 1.00 . A A . 792 ASP CG 1 1 3 1681 1 1 13 ASP H H -10.360 -2.284 5.160 1.00 . A A . 792 ASP H 1 1 3 1682 1 1 13 ASP HA H -8.857 -1.899 2.703 1.00 . A A . 792 ASP HA 1 1 3 1683 1 1 13 ASP HB2 H -10.550 -4.190 3.717 1.00 . A A . 792 ASP HB2 1 1 3 1684 1 1 13 ASP HB3 H -9.864 -4.161 2.098 1.00 . A A . 792 ASP HB3 1 1 3 1685 1 1 13 ASP N N -9.889 -1.760 4.483 1.00 . A A . 792 ASP N 1 1 3 1686 1 1 13 ASP O O -11.096 -2.165 1.135 1.00 . A A . 792 ASP O 1 1 3 1687 1 1 13 ASP OD1 O -7.487 -4.562 2.874 1.00 . A A . 792 ASP OD1 1 1 3 1688 1 1 13 ASP OD2 O -8.372 -4.660 4.874 1.00 . A A . 792 ASP OD2 1 1 3 1689 1 1 14 LYS C C -12.515 0.703 1.288 1.00 . A A . 793 LYS C 1 1 3 1690 1 1 14 LYS CA C -12.935 -0.406 2.251 1.00 . A A . 793 LYS CA 1 1 3 1691 1 1 14 LYS CB C -13.918 0.149 3.280 1.00 . A A . 793 LYS CB 1 1 3 1692 1 1 14 LYS CD C -16.087 1.380 3.708 1.00 . A A . 793 LYS CD 1 1 3 1693 1 1 14 LYS CE C -15.414 2.446 4.564 1.00 . A A . 793 LYS CE 1 1 3 1694 1 1 14 LYS CG C -15.143 0.806 2.660 1.00 . A A . 793 LYS CG 1 1 3 1695 1 1 14 LYS H H -11.609 -0.759 3.854 1.00 . A A . 793 LYS H 1 1 3 1696 1 1 14 LYS HA H -13.416 -1.193 1.704 1.00 . A A . 793 LYS HA 1 1 3 1697 1 1 14 LYS HB2 H -14.252 -0.661 3.914 1.00 . A A . 793 LYS HB2 1 1 3 1698 1 1 14 LYS HB3 H -13.410 0.884 3.888 1.00 . A A . 793 LYS HB3 1 1 3 1699 1 1 14 LYS HD2 H -16.933 1.824 3.204 1.00 . A A . 793 LYS HD2 1 1 3 1700 1 1 14 LYS HD3 H -16.429 0.579 4.348 1.00 . A A . 793 LYS HD3 1 1 3 1701 1 1 14 LYS HE2 H -14.741 3.015 3.941 1.00 . A A . 793 LYS HE2 1 1 3 1702 1 1 14 LYS HE3 H -16.175 3.102 4.960 1.00 . A A . 793 LYS HE3 1 1 3 1703 1 1 14 LYS HG2 H -14.819 1.606 2.010 1.00 . A A . 793 LYS HG2 1 1 3 1704 1 1 14 LYS HG3 H -15.676 0.068 2.078 1.00 . A A . 793 LYS HG3 1 1 3 1705 1 1 14 LYS HZ1 H -13.869 1.267 5.339 1.00 . A A . 793 LYS HZ1 1 1 3 1706 1 1 14 LYS HZ2 H -15.273 1.276 6.286 1.00 . A A . 793 LYS HZ2 1 1 3 1707 1 1 14 LYS HZ3 H -14.245 2.622 6.284 1.00 . A A . 793 LYS HZ3 1 1 3 1708 1 1 14 LYS N N -11.776 -0.977 2.916 1.00 . A A . 793 LYS N 1 1 3 1709 1 1 14 LYS NZ N -14.642 1.862 5.694 1.00 . A A . 793 LYS NZ 1 1 3 1710 1 1 14 LYS O O -13.135 0.909 0.242 1.00 . A A . 793 LYS O 1 1 3 1711 1 1 15 LYS C C -10.178 2.082 -0.320 1.00 . A A . 794 LYS C 1 1 3 1712 1 1 15 LYS CA C -10.965 2.545 0.897 1.00 . A A . 794 LYS CA 1 1 3 1713 1 1 15 LYS CB C -10.092 3.437 1.792 1.00 . A A . 794 LYS CB 1 1 3 1714 1 1 15 LYS CD C -11.980 4.851 2.725 1.00 . A A . 794 LYS CD 1 1 3 1715 1 1 15 LYS CE C -11.574 6.324 2.684 1.00 . A A . 794 LYS CE 1 1 3 1716 1 1 15 LYS CG C -10.805 3.928 3.049 1.00 . A A . 794 LYS CG 1 1 3 1717 1 1 15 LYS H H -10.964 1.144 2.457 1.00 . A A . 794 LYS H 1 1 3 1718 1 1 15 LYS HA H -11.815 3.112 0.567 1.00 . A A . 794 LYS HA 1 1 3 1719 1 1 15 LYS HB2 H -9.217 2.880 2.094 1.00 . A A . 794 LYS HB2 1 1 3 1720 1 1 15 LYS HB3 H -9.781 4.298 1.224 1.00 . A A . 794 LYS HB3 1 1 3 1721 1 1 15 LYS HD2 H -12.382 4.576 1.760 1.00 . A A . 794 LYS HD2 1 1 3 1722 1 1 15 LYS HD3 H -12.743 4.720 3.479 1.00 . A A . 794 LYS HD3 1 1 3 1723 1 1 15 LYS HE2 H -12.464 6.924 2.566 1.00 . A A . 794 LYS HE2 1 1 3 1724 1 1 15 LYS HE3 H -11.100 6.576 3.620 1.00 . A A . 794 LYS HE3 1 1 3 1725 1 1 15 LYS HG2 H -11.175 3.073 3.595 1.00 . A A . 794 LYS HG2 1 1 3 1726 1 1 15 LYS HG3 H -10.096 4.466 3.663 1.00 . A A . 794 LYS HG3 1 1 3 1727 1 1 15 LYS HZ1 H -10.432 7.662 1.551 1.00 . A A . 794 LYS HZ1 1 1 3 1728 1 1 15 LYS HZ2 H -11.054 6.362 0.659 1.00 . A A . 794 LYS HZ2 1 1 3 1729 1 1 15 LYS HZ3 H -9.741 6.123 1.697 1.00 . A A . 794 LYS HZ3 1 1 3 1730 1 1 15 LYS N N -11.450 1.409 1.658 1.00 . A A . 794 LYS N 1 1 3 1731 1 1 15 LYS NZ N -10.638 6.637 1.573 1.00 . A A . 794 LYS NZ 1 1 3 1732 1 1 15 LYS O O -10.083 0.888 -0.600 1.00 . A A . 794 LYS O 1 1 3 1733 1 1 16 ALA C C -7.923 3.931 -2.540 1.00 . A A . 795 ALA C 1 1 3 1734 1 1 16 ALA CA C -8.826 2.753 -2.218 1.00 . A A . 795 ALA CA 1 1 3 1735 1 1 16 ALA CB C -9.739 2.440 -3.397 1.00 . A A . 795 ALA CB 1 1 3 1736 1 1 16 ALA H H -9.726 3.966 -0.740 1.00 . A A . 795 ALA H 1 1 3 1737 1 1 16 ALA HA H -8.215 1.884 -2.022 1.00 . A A . 795 ALA HA 1 1 3 1738 1 1 16 ALA HB1 H -10.348 1.579 -3.163 1.00 . A A . 795 ALA HB1 1 1 3 1739 1 1 16 ALA HB2 H -9.138 2.229 -4.270 1.00 . A A . 795 ALA HB2 1 1 3 1740 1 1 16 ALA HB3 H -10.375 3.290 -3.594 1.00 . A A . 795 ALA HB3 1 1 3 1741 1 1 16 ALA N N -9.602 3.034 -1.021 1.00 . A A . 795 ALA N 1 1 3 1742 1 1 16 ALA O O -7.651 4.235 -3.703 1.00 . A A . 795 ALA O 1 1 3 1743 1 1 17 ASN C C -5.091 5.007 -1.740 1.00 . A A . 796 ASN C 1 1 3 1744 1 1 17 ASN CA C -6.467 5.641 -1.592 1.00 . A A . 796 ASN CA 1 1 3 1745 1 1 17 ASN CB C -6.517 6.555 -0.358 1.00 . A A . 796 ASN CB 1 1 3 1746 1 1 17 ASN CG C -6.930 5.813 0.903 1.00 . A A . 796 ASN CG 1 1 3 1747 1 1 17 ASN H H -7.818 4.366 -0.599 1.00 . A A . 796 ASN H 1 1 3 1748 1 1 17 ASN HA H -6.680 6.222 -2.475 1.00 . A A . 796 ASN HA 1 1 3 1749 1 1 17 ASN HB2 H -5.539 6.983 -0.194 1.00 . A A . 796 ASN HB2 1 1 3 1750 1 1 17 ASN HB3 H -7.227 7.349 -0.534 1.00 . A A . 796 ASN HB3 1 1 3 1751 1 1 17 ASN HD21 H -5.060 5.255 1.236 1.00 . A A . 796 ASN HD21 1 1 3 1752 1 1 17 ASN HD22 H -6.228 4.724 2.397 1.00 . A A . 796 ASN HD22 1 1 3 1753 1 1 17 ASN N N -7.469 4.593 -1.485 1.00 . A A . 796 ASN N 1 1 3 1754 1 1 17 ASN ND2 N -5.977 5.203 1.579 1.00 . A A . 796 ASN ND2 1 1 3 1755 1 1 17 ASN O O -4.379 4.781 -0.754 1.00 . A A . 796 ASN O 1 1 3 1756 1 1 17 ASN OD1 O -8.110 5.769 1.252 1.00 . A A . 796 ASN OD1 1 1 3 1757 1 1 18 LEU C C -2.359 4.864 -3.542 1.00 . A A . 797 LEU C 1 1 3 1758 1 1 18 LEU CA C -3.535 3.943 -3.260 1.00 . A A . 797 LEU CA 1 1 3 1759 1 1 18 LEU CB C -3.765 3.048 -4.477 1.00 . A A . 797 LEU CB 1 1 3 1760 1 1 18 LEU CD1 C -5.258 1.532 -5.800 1.00 . A A . 797 LEU CD1 1 1 3 1761 1 1 18 LEU CD2 C -5.090 1.249 -3.326 1.00 . A A . 797 LEU CD2 1 1 3 1762 1 1 18 LEU CG C -5.071 2.247 -4.471 1.00 . A A . 797 LEU CG 1 1 3 1763 1 1 18 LEU H H -5.249 5.014 -3.742 1.00 . A A . 797 LEU H 1 1 3 1764 1 1 18 LEU HA H -3.296 3.323 -2.411 1.00 . A A . 797 LEU HA 1 1 3 1765 1 1 18 LEU HB2 H -3.757 3.673 -5.355 1.00 . A A . 797 LEU HB2 1 1 3 1766 1 1 18 LEU HB3 H -2.944 2.350 -4.545 1.00 . A A . 797 LEU HB3 1 1 3 1767 1 1 18 LEU HD11 H -4.423 0.870 -5.972 1.00 . A A . 797 LEU HD11 1 1 3 1768 1 1 18 LEU HD12 H -5.312 2.260 -6.596 1.00 . A A . 797 LEU HD12 1 1 3 1769 1 1 18 LEU HD13 H -6.174 0.958 -5.775 1.00 . A A . 797 LEU HD13 1 1 3 1770 1 1 18 LEU HD21 H -6.027 0.714 -3.333 1.00 . A A . 797 LEU HD21 1 1 3 1771 1 1 18 LEU HD22 H -4.983 1.774 -2.387 1.00 . A A . 797 LEU HD22 1 1 3 1772 1 1 18 LEU HD23 H -4.274 0.551 -3.442 1.00 . A A . 797 LEU HD23 1 1 3 1773 1 1 18 LEU HG H -5.901 2.928 -4.337 1.00 . A A . 797 LEU HG 1 1 3 1774 1 1 18 LEU N N -4.730 4.696 -2.976 1.00 . A A . 797 LEU N 1 1 3 1775 1 1 18 LEU O O -2.519 6.007 -3.978 1.00 . A A . 797 LEU O 1 1 3 1776 1 1 19 LEU C C 1.017 3.778 -3.831 1.00 . A A . 798 LEU C 1 1 3 1777 1 1 19 LEU CA C 0.077 4.937 -3.627 1.00 . A A . 798 LEU CA 1 1 3 1778 1 1 19 LEU CB C 0.591 5.907 -2.547 1.00 . A A . 798 LEU CB 1 1 3 1779 1 1 19 LEU CD1 C 1.710 6.332 -0.346 1.00 . A A . 798 LEU CD1 1 1 3 1780 1 1 19 LEU CD2 C 0.296 4.300 -0.654 1.00 . A A . 798 LEU CD2 1 1 3 1781 1 1 19 LEU CG C 1.247 5.266 -1.324 1.00 . A A . 798 LEU CG 1 1 3 1782 1 1 19 LEU H H -1.181 3.457 -2.822 1.00 . A A . 798 LEU H 1 1 3 1783 1 1 19 LEU HA H -0.018 5.448 -4.567 1.00 . A A . 798 LEU HA 1 1 3 1784 1 1 19 LEU HB2 H 1.315 6.566 -3.006 1.00 . A A . 798 LEU HB2 1 1 3 1785 1 1 19 LEU HB3 H -0.243 6.503 -2.208 1.00 . A A . 798 LEU HB3 1 1 3 1786 1 1 19 LEU HD11 H 2.189 5.861 0.499 1.00 . A A . 798 LEU HD11 1 1 3 1787 1 1 19 LEU HD12 H 0.858 6.903 -0.006 1.00 . A A . 798 LEU HD12 1 1 3 1788 1 1 19 LEU HD13 H 2.411 6.987 -0.838 1.00 . A A . 798 LEU HD13 1 1 3 1789 1 1 19 LEU HD21 H -0.581 4.829 -0.317 1.00 . A A . 798 LEU HD21 1 1 3 1790 1 1 19 LEU HD22 H 0.788 3.832 0.187 1.00 . A A . 798 LEU HD22 1 1 3 1791 1 1 19 LEU HD23 H 0.008 3.542 -1.370 1.00 . A A . 798 LEU HD23 1 1 3 1792 1 1 19 LEU HG H 2.116 4.711 -1.644 1.00 . A A . 798 LEU HG 1 1 3 1793 1 1 19 LEU N N -1.194 4.333 -3.274 1.00 . A A . 798 LEU N 1 1 3 1794 1 1 19 LEU O O 0.564 2.630 -3.785 1.00 . A A . 798 LEU O 1 1 3 1795 1 1 20 LYS C C 4.558 2.994 -3.915 1.00 . A A . 799 LYS C 1 1 3 1796 1 1 20 LYS CA C 3.117 2.864 -4.365 1.00 . A A . 799 LYS CA 1 1 3 1797 1 1 20 LYS CB C 3.025 2.541 -5.855 1.00 . A A . 799 LYS CB 1 1 3 1798 1 1 20 LYS CD C 3.074 4.885 -6.821 1.00 . A A . 799 LYS CD 1 1 3 1799 1 1 20 LYS CE C 3.575 5.730 -7.984 1.00 . A A . 799 LYS CE 1 1 3 1800 1 1 20 LYS CG C 3.736 3.516 -6.793 1.00 . A A . 799 LYS CG 1 1 3 1801 1 1 20 LYS H H 2.668 4.913 -4.007 1.00 . A A . 799 LYS H 1 1 3 1802 1 1 20 LYS HA H 2.683 2.054 -3.801 1.00 . A A . 799 LYS HA 1 1 3 1803 1 1 20 LYS HB2 H 3.442 1.558 -6.021 1.00 . A A . 799 LYS HB2 1 1 3 1804 1 1 20 LYS HB3 H 1.978 2.523 -6.120 1.00 . A A . 799 LYS HB3 1 1 3 1805 1 1 20 LYS HD2 H 2.007 4.752 -6.919 1.00 . A A . 799 LYS HD2 1 1 3 1806 1 1 20 LYS HD3 H 3.291 5.396 -5.895 1.00 . A A . 799 LYS HD3 1 1 3 1807 1 1 20 LYS HE2 H 3.262 5.269 -8.908 1.00 . A A . 799 LYS HE2 1 1 3 1808 1 1 20 LYS HE3 H 3.136 6.714 -7.909 1.00 . A A . 799 LYS HE3 1 1 3 1809 1 1 20 LYS HG2 H 4.758 3.633 -6.464 1.00 . A A . 799 LYS HG2 1 1 3 1810 1 1 20 LYS HG3 H 3.727 3.103 -7.792 1.00 . A A . 799 LYS HG3 1 1 3 1811 1 1 20 LYS HZ1 H 5.346 6.610 -8.661 1.00 . A A . 799 LYS HZ1 1 1 3 1812 1 1 20 LYS HZ2 H 5.496 4.964 -8.293 1.00 . A A . 799 LYS HZ2 1 1 3 1813 1 1 20 LYS HZ3 H 5.407 6.107 -7.042 1.00 . A A . 799 LYS HZ3 1 1 3 1814 1 1 20 LYS N N 2.292 4.004 -4.050 1.00 . A A . 799 LYS N 1 1 3 1815 1 1 20 LYS NZ N 5.058 5.862 -7.993 1.00 . A A . 799 LYS NZ 1 1 3 1816 1 1 20 LYS O O 5.167 4.065 -3.943 1.00 . A A . 799 LYS O 1 1 3 1817 1 1 21 CYS C C 7.434 2.282 -3.908 1.00 . A A . 800 CYS C 1 1 3 1818 1 1 21 CYS CA C 6.402 1.626 -3.012 1.00 . A A . 800 CYS CA 1 1 3 1819 1 1 21 CYS CB C 6.575 0.115 -3.008 1.00 . A A . 800 CYS CB 1 1 3 1820 1 1 21 CYS H H 4.449 1.066 -3.459 1.00 . A A . 800 CYS H 1 1 3 1821 1 1 21 CYS HA H 6.482 1.997 -2.007 1.00 . A A . 800 CYS HA 1 1 3 1822 1 1 21 CYS HB2 H 5.879 -0.304 -2.299 1.00 . A A . 800 CYS HB2 1 1 3 1823 1 1 21 CYS HB3 H 6.319 -0.254 -3.993 1.00 . A A . 800 CYS HB3 1 1 3 1824 1 1 21 CYS N N 5.053 1.841 -3.485 1.00 . A A . 800 CYS N 1 1 3 1825 1 1 21 CYS O O 7.670 1.824 -5.019 1.00 . A A . 800 CYS O 1 1 3 1826 1 1 21 CYS SG S 8.193 -0.550 -2.592 1.00 . A A . 800 CYS SG 1 1 3 1827 1 1 22 GLU C C 10.328 3.275 -4.417 1.00 . A A . 801 GLU C 1 1 3 1828 1 1 22 GLU CA C 9.053 4.096 -4.162 1.00 . A A . 801 GLU CA 1 1 3 1829 1 1 22 GLU CB C 9.384 5.398 -3.424 1.00 . A A . 801 GLU CB 1 1 3 1830 1 1 22 GLU CD C 8.537 7.669 -2.663 1.00 . A A . 801 GLU CD 1 1 3 1831 1 1 22 GLU CG C 8.193 6.336 -3.301 1.00 . A A . 801 GLU CG 1 1 3 1832 1 1 22 GLU H H 7.766 3.694 -2.535 1.00 . A A . 801 GLU H 1 1 3 1833 1 1 22 GLU HA H 8.638 4.349 -5.126 1.00 . A A . 801 GLU HA 1 1 3 1834 1 1 22 GLU HB2 H 9.731 5.159 -2.431 1.00 . A A . 801 GLU HB2 1 1 3 1835 1 1 22 GLU HB3 H 10.169 5.914 -3.959 1.00 . A A . 801 GLU HB3 1 1 3 1836 1 1 22 GLU HG2 H 7.797 6.522 -4.288 1.00 . A A . 801 GLU HG2 1 1 3 1837 1 1 22 GLU HG3 H 7.437 5.852 -2.700 1.00 . A A . 801 GLU HG3 1 1 3 1838 1 1 22 GLU N N 8.037 3.356 -3.419 1.00 . A A . 801 GLU N 1 1 3 1839 1 1 22 GLU O O 11.369 3.833 -4.763 1.00 . A A . 801 GLU O 1 1 3 1840 1 1 22 GLU OE1 O 9.540 8.294 -3.079 1.00 . A A . 801 GLU OE1 1 1 3 1841 1 1 22 GLU OE2 O 7.827 8.080 -1.722 1.00 . A A . 801 GLU OE2 1 1 3 1842 1 1 23 TYR C C 10.978 0.235 -5.831 1.00 . A A . 802 TYR C 1 1 3 1843 1 1 23 TYR CA C 11.348 1.077 -4.604 1.00 . A A . 802 TYR CA 1 1 3 1844 1 1 23 TYR CB C 11.707 0.171 -3.418 1.00 . A A . 802 TYR CB 1 1 3 1845 1 1 23 TYR CD1 C 14.215 0.237 -3.141 1.00 . A A . 802 TYR CD1 1 1 3 1846 1 1 23 TYR CD2 C 13.235 -1.757 -4.008 1.00 . A A . 802 TYR CD2 1 1 3 1847 1 1 23 TYR CE1 C 15.470 -0.334 -3.233 1.00 . A A . 802 TYR CE1 1 1 3 1848 1 1 23 TYR CE2 C 14.486 -2.334 -4.100 1.00 . A A . 802 TYR CE2 1 1 3 1849 1 1 23 TYR CG C 13.077 -0.462 -3.527 1.00 . A A . 802 TYR CG 1 1 3 1850 1 1 23 TYR CZ C 15.599 -1.619 -3.711 1.00 . A A . 802 TYR CZ 1 1 3 1851 1 1 23 TYR H H 9.424 1.577 -3.887 1.00 . A A . 802 TYR H 1 1 3 1852 1 1 23 TYR HA H 12.202 1.692 -4.848 1.00 . A A . 802 TYR HA 1 1 3 1853 1 1 23 TYR HB2 H 11.685 0.751 -2.508 1.00 . A A . 802 TYR HB2 1 1 3 1854 1 1 23 TYR HB3 H 10.981 -0.625 -3.346 1.00 . A A . 802 TYR HB3 1 1 3 1855 1 1 23 TYR HD1 H 14.111 1.243 -2.766 1.00 . A A . 802 TYR HD1 1 1 3 1856 1 1 23 TYR HD2 H 12.363 -2.314 -4.313 1.00 . A A . 802 TYR HD2 1 1 3 1857 1 1 23 TYR HE1 H 16.344 0.226 -2.931 1.00 . A A . 802 TYR HE1 1 1 3 1858 1 1 23 TYR HE2 H 14.589 -3.341 -4.479 1.00 . A A . 802 TYR HE2 1 1 3 1859 1 1 23 TYR HH H 16.884 -2.762 -4.584 1.00 . A A . 802 TYR HH 1 1 3 1860 1 1 23 TYR N N 10.246 1.959 -4.254 1.00 . A A . 802 TYR N 1 1 3 1861 1 1 23 TYR O O 11.801 0.023 -6.721 1.00 . A A . 802 TYR O 1 1 3 1862 1 1 23 TYR OH O 16.845 -2.196 -3.797 1.00 . A A . 802 TYR OH 1 1 3 1863 1 1 24 CYS C C 8.124 -0.443 -7.760 1.00 . A A . 803 CYS C 1 1 3 1864 1 1 24 CYS CA C 9.264 -1.089 -6.971 1.00 . A A . 803 CYS CA 1 1 3 1865 1 1 24 CYS CB C 8.828 -2.454 -6.436 1.00 . A A . 803 CYS CB 1 1 3 1866 1 1 24 CYS H H 9.137 -0.068 -5.116 1.00 . A A . 803 CYS H 1 1 3 1867 1 1 24 CYS HA H 10.073 -1.221 -7.673 1.00 . A A . 803 CYS HA 1 1 3 1868 1 1 24 CYS HB2 H 8.349 -3.009 -7.226 1.00 . A A . 803 CYS HB2 1 1 3 1869 1 1 24 CYS HB3 H 9.697 -2.992 -6.100 1.00 . A A . 803 CYS HB3 1 1 3 1870 1 1 24 CYS N N 9.737 -0.249 -5.867 1.00 . A A . 803 CYS N 1 1 3 1871 1 1 24 CYS O O 8.037 -0.607 -8.977 1.00 . A A . 803 CYS O 1 1 3 1872 1 1 24 CYS SG S 7.666 -2.365 -5.041 1.00 . A A . 803 CYS SG 1 1 3 1873 1 1 25 GLY C C 4.887 0.191 -7.748 1.00 . A A . 804 GLY C 1 1 3 1874 1 1 25 GLY CA C 6.182 0.973 -7.758 1.00 . A A . 804 GLY CA 1 1 3 1875 1 1 25 GLY H H 7.359 0.370 -6.109 1.00 . A A . 804 GLY H 1 1 3 1876 1 1 25 GLY HA2 H 6.018 1.921 -7.272 1.00 . A A . 804 GLY HA2 1 1 3 1877 1 1 25 GLY HA3 H 6.473 1.153 -8.784 1.00 . A A . 804 GLY HA3 1 1 3 1878 1 1 25 GLY N N 7.259 0.282 -7.080 1.00 . A A . 804 GLY N 1 1 3 1879 1 1 25 GLY O O 4.019 0.407 -8.592 1.00 . A A . 804 GLY O 1 1 3 1880 1 1 26 LYS C C 2.469 -0.741 -5.916 1.00 . A A . 805 LYS C 1 1 3 1881 1 1 26 LYS CA C 3.525 -1.510 -6.697 1.00 . A A . 805 LYS CA 1 1 3 1882 1 1 26 LYS CB C 3.802 -2.868 -6.048 1.00 . A A . 805 LYS CB 1 1 3 1883 1 1 26 LYS CD C 4.042 -3.962 -8.286 1.00 . A A . 805 LYS CD 1 1 3 1884 1 1 26 LYS CE C 4.905 -4.819 -9.194 1.00 . A A . 805 LYS CE 1 1 3 1885 1 1 26 LYS CG C 4.660 -3.781 -6.909 1.00 . A A . 805 LYS CG 1 1 3 1886 1 1 26 LYS H H 5.441 -0.829 -6.121 1.00 . A A . 805 LYS H 1 1 3 1887 1 1 26 LYS HA H 3.167 -1.671 -7.704 1.00 . A A . 805 LYS HA 1 1 3 1888 1 1 26 LYS HB2 H 4.310 -2.710 -5.110 1.00 . A A . 805 LYS HB2 1 1 3 1889 1 1 26 LYS HB3 H 2.861 -3.365 -5.862 1.00 . A A . 805 LYS HB3 1 1 3 1890 1 1 26 LYS HD2 H 3.079 -4.433 -8.177 1.00 . A A . 805 LYS HD2 1 1 3 1891 1 1 26 LYS HD3 H 3.917 -2.989 -8.742 1.00 . A A . 805 LYS HD3 1 1 3 1892 1 1 26 LYS HE2 H 4.459 -4.835 -10.177 1.00 . A A . 805 LYS HE2 1 1 3 1893 1 1 26 LYS HE3 H 5.888 -4.377 -9.254 1.00 . A A . 805 LYS HE3 1 1 3 1894 1 1 26 LYS HG2 H 5.642 -3.345 -7.017 1.00 . A A . 805 LYS HG2 1 1 3 1895 1 1 26 LYS HG3 H 4.739 -4.745 -6.428 1.00 . A A . 805 LYS HG3 1 1 3 1896 1 1 26 LYS HZ1 H 5.667 -6.250 -7.870 1.00 . A A . 805 LYS HZ1 1 1 3 1897 1 1 26 LYS HZ2 H 5.421 -6.830 -9.447 1.00 . A A . 805 LYS HZ2 1 1 3 1898 1 1 26 LYS HZ3 H 4.100 -6.586 -8.418 1.00 . A A . 805 LYS HZ3 1 1 3 1899 1 1 26 LYS N N 4.745 -0.720 -6.799 1.00 . A A . 805 LYS N 1 1 3 1900 1 1 26 LYS NZ N 5.031 -6.217 -8.697 1.00 . A A . 805 LYS NZ 1 1 3 1901 1 1 26 LYS O O 2.741 -0.254 -4.815 1.00 . A A . 805 LYS O 1 1 3 1902 1 1 27 TYR C C -0.551 -0.591 -4.835 1.00 . A A . 806 TYR C 1 1 3 1903 1 1 27 TYR CA C 0.205 0.166 -5.908 1.00 . A A . 806 TYR CA 1 1 3 1904 1 1 27 TYR CB C -0.766 0.629 -6.991 1.00 . A A . 806 TYR CB 1 1 3 1905 1 1 27 TYR CD1 C 0.767 1.484 -8.795 1.00 . A A . 806 TYR CD1 1 1 3 1906 1 1 27 TYR CD2 C -0.706 3.039 -7.747 1.00 . A A . 806 TYR CD2 1 1 3 1907 1 1 27 TYR CE1 C 1.264 2.490 -9.596 1.00 . A A . 806 TYR CE1 1 1 3 1908 1 1 27 TYR CE2 C -0.213 4.051 -8.547 1.00 . A A . 806 TYR CE2 1 1 3 1909 1 1 27 TYR CG C -0.226 1.740 -7.859 1.00 . A A . 806 TYR CG 1 1 3 1910 1 1 27 TYR CZ C 0.761 3.797 -9.442 1.00 . A A . 806 TYR CZ 1 1 3 1911 1 1 27 TYR H H 1.075 -1.184 -7.276 1.00 . A A . 806 TYR H 1 1 3 1912 1 1 27 TYR HA H 0.646 1.037 -5.445 1.00 . A A . 806 TYR HA 1 1 3 1913 1 1 27 TYR HB2 H -1.001 -0.204 -7.631 1.00 . A A . 806 TYR HB2 1 1 3 1914 1 1 27 TYR HB3 H -1.672 0.983 -6.522 1.00 . A A . 806 TYR HB3 1 1 3 1915 1 1 27 TYR HD1 H 1.151 0.478 -8.892 1.00 . A A . 806 TYR HD1 1 1 3 1916 1 1 27 TYR HD2 H -1.480 3.254 -7.024 1.00 . A A . 806 TYR HD2 1 1 3 1917 1 1 27 TYR HE1 H 2.036 2.272 -10.317 1.00 . A A . 806 TYR HE1 1 1 3 1918 1 1 27 TYR HE2 H -0.597 5.055 -8.445 1.00 . A A . 806 TYR HE2 1 1 3 1919 1 1 27 TYR HH H 1.324 5.596 -9.761 1.00 . A A . 806 TYR HH 1 1 3 1920 1 1 27 TYR N N 1.269 -0.652 -6.480 1.00 . A A . 806 TYR N 1 1 3 1921 1 1 27 TYR O O -0.884 -1.768 -4.995 1.00 . A A . 806 TYR O 1 1 3 1922 1 1 27 TYR OH O 1.263 4.774 -10.273 1.00 . A A . 806 TYR OH 1 1 3 1923 1 1 28 ALA C C -2.026 0.618 -1.711 1.00 . A A . 807 ALA C 1 1 3 1924 1 1 28 ALA CA C -1.458 -0.479 -2.588 1.00 . A A . 807 ALA CA 1 1 3 1925 1 1 28 ALA CB C -0.460 -1.315 -1.807 1.00 . A A . 807 ALA CB 1 1 3 1926 1 1 28 ALA H H -0.552 1.058 -3.717 1.00 . A A . 807 ALA H 1 1 3 1927 1 1 28 ALA HA H -2.259 -1.120 -2.926 1.00 . A A . 807 ALA HA 1 1 3 1928 1 1 28 ALA HB1 H -0.954 -1.774 -0.963 1.00 . A A . 807 ALA HB1 1 1 3 1929 1 1 28 ALA HB2 H 0.342 -0.684 -1.454 1.00 . A A . 807 ALA HB2 1 1 3 1930 1 1 28 ALA HB3 H -0.057 -2.084 -2.449 1.00 . A A . 807 ALA HB3 1 1 3 1931 1 1 28 ALA N N -0.814 0.107 -3.742 1.00 . A A . 807 ALA N 1 1 3 1932 1 1 28 ALA O O -1.601 1.771 -1.802 1.00 . A A . 807 ALA O 1 1 3 1933 1 1 29 PRO C C -2.473 1.695 1.064 1.00 . A A . 808 PRO C 1 1 3 1934 1 1 29 PRO CA C -3.554 1.223 0.104 1.00 . A A . 808 PRO CA 1 1 3 1935 1 1 29 PRO CB C -4.606 0.400 0.853 1.00 . A A . 808 PRO CB 1 1 3 1936 1 1 29 PRO CD C -3.684 -1.024 -0.812 1.00 . A A . 808 PRO CD 1 1 3 1937 1 1 29 PRO CG C -4.949 -0.715 -0.070 1.00 . A A . 808 PRO CG 1 1 3 1938 1 1 29 PRO HA H -4.018 2.075 -0.376 1.00 . A A . 808 PRO HA 1 1 3 1939 1 1 29 PRO HB2 H -4.179 0.029 1.771 1.00 . A A . 808 PRO HB2 1 1 3 1940 1 1 29 PRO HB3 H -5.466 1.017 1.068 1.00 . A A . 808 PRO HB3 1 1 3 1941 1 1 29 PRO HD2 H -3.090 -1.739 -0.261 1.00 . A A . 808 PRO HD2 1 1 3 1942 1 1 29 PRO HD3 H -3.904 -1.391 -1.802 1.00 . A A . 808 PRO HD3 1 1 3 1943 1 1 29 PRO HG2 H -5.272 -1.574 0.498 1.00 . A A . 808 PRO HG2 1 1 3 1944 1 1 29 PRO HG3 H -5.721 -0.401 -0.756 1.00 . A A . 808 PRO HG3 1 1 3 1945 1 1 29 PRO N N -3.012 0.286 -0.871 1.00 . A A . 808 PRO N 1 1 3 1946 1 1 29 PRO O O -1.699 0.887 1.586 1.00 . A A . 808 PRO O 1 1 3 1947 1 1 30 ALA C C -1.340 2.949 3.532 1.00 . A A . 809 ALA C 1 1 3 1948 1 1 30 ALA CA C -1.462 3.657 2.173 1.00 . A A . 809 ALA CA 1 1 3 1949 1 1 30 ALA CB C -1.865 5.108 2.381 1.00 . A A . 809 ALA CB 1 1 3 1950 1 1 30 ALA H H -2.978 3.585 0.683 1.00 . A A . 809 ALA H 1 1 3 1951 1 1 30 ALA HA H -0.493 3.656 1.698 1.00 . A A . 809 ALA HA 1 1 3 1952 1 1 30 ALA HB1 H -1.927 5.605 1.422 1.00 . A A . 809 ALA HB1 1 1 3 1953 1 1 30 ALA HB2 H -1.128 5.603 2.997 1.00 . A A . 809 ALA HB2 1 1 3 1954 1 1 30 ALA HB3 H -2.828 5.148 2.868 1.00 . A A . 809 ALA HB3 1 1 3 1955 1 1 30 ALA N N -2.406 3.011 1.245 1.00 . A A . 809 ALA N 1 1 3 1956 1 1 30 ALA O O -0.353 3.135 4.243 1.00 . A A . 809 ALA O 1 1 3 1957 1 1 31 GLU C C -1.240 0.384 5.237 1.00 . A A . 810 GLU C 1 1 3 1958 1 1 31 GLU CA C -2.356 1.420 5.151 1.00 . A A . 810 GLU CA 1 1 3 1959 1 1 31 GLU CB C -3.702 0.734 5.360 1.00 . A A . 810 GLU CB 1 1 3 1960 1 1 31 GLU CD C -4.388 3.053 6.105 1.00 . A A . 810 GLU CD 1 1 3 1961 1 1 31 GLU CG C -4.849 1.708 5.572 1.00 . A A . 810 GLU CG 1 1 3 1962 1 1 31 GLU H H -3.099 2.055 3.277 1.00 . A A . 810 GLU H 1 1 3 1963 1 1 31 GLU HA H -2.221 2.120 5.962 1.00 . A A . 810 GLU HA 1 1 3 1964 1 1 31 GLU HB2 H -3.926 0.131 4.492 1.00 . A A . 810 GLU HB2 1 1 3 1965 1 1 31 GLU HB3 H -3.637 0.092 6.226 1.00 . A A . 810 GLU HB3 1 1 3 1966 1 1 31 GLU HG2 H -5.353 1.861 4.634 1.00 . A A . 810 GLU HG2 1 1 3 1967 1 1 31 GLU HG3 H -5.534 1.274 6.286 1.00 . A A . 810 GLU HG3 1 1 3 1968 1 1 31 GLU N N -2.347 2.163 3.892 1.00 . A A . 810 GLU N 1 1 3 1969 1 1 31 GLU O O -0.812 0.032 6.330 1.00 . A A . 810 GLU O 1 1 3 1970 1 1 31 GLU OE1 O -4.039 3.132 7.302 1.00 . A A . 810 GLU OE1 1 1 3 1971 1 1 31 GLU OE2 O -4.398 4.038 5.339 1.00 . A A . 810 GLU OE2 1 1 3 1972 1 1 32 GLN C C 1.601 -0.476 4.403 1.00 . A A . 811 GLN C 1 1 3 1973 1 1 32 GLN CA C 0.267 -1.131 4.103 1.00 . A A . 811 GLN CA 1 1 3 1974 1 1 32 GLN CB C 0.328 -1.857 2.759 1.00 . A A . 811 GLN CB 1 1 3 1975 1 1 32 GLN CD C 1.424 -3.712 1.394 1.00 . A A . 811 GLN CD 1 1 3 1976 1 1 32 GLN CG C 1.339 -2.996 2.733 1.00 . A A . 811 GLN CG 1 1 3 1977 1 1 32 GLN H H -1.126 0.215 3.246 1.00 . A A . 811 GLN H 1 1 3 1978 1 1 32 GLN HA H 0.033 -1.837 4.886 1.00 . A A . 811 GLN HA 1 1 3 1979 1 1 32 GLN HB2 H -0.649 -2.262 2.533 1.00 . A A . 811 GLN HB2 1 1 3 1980 1 1 32 GLN HB3 H 0.598 -1.142 2.000 1.00 . A A . 811 GLN HB3 1 1 3 1981 1 1 32 GLN HE21 H 1.068 -2.026 0.396 1.00 . A A . 811 GLN HE21 1 1 3 1982 1 1 32 GLN HE22 H 1.293 -3.438 -0.576 1.00 . A A . 811 GLN HE22 1 1 3 1983 1 1 32 GLN HG2 H 2.313 -2.595 2.964 1.00 . A A . 811 GLN HG2 1 1 3 1984 1 1 32 GLN HG3 H 1.062 -3.714 3.491 1.00 . A A . 811 GLN HG3 1 1 3 1985 1 1 32 GLN N N -0.773 -0.114 4.098 1.00 . A A . 811 GLN N 1 1 3 1986 1 1 32 GLN NE2 N 1.245 -2.983 0.298 1.00 . A A . 811 GLN NE2 1 1 3 1987 1 1 32 GLN O O 2.508 -1.093 4.958 1.00 . A A . 811 GLN O 1 1 3 1988 1 1 32 GLN OE1 O 1.675 -4.916 1.344 1.00 . A A . 811 GLN OE1 1 1 3 1989 1 1 33 PHE C C 3.110 1.970 5.701 1.00 . A A . 812 PHE C 1 1 3 1990 1 1 33 PHE CA C 2.878 1.609 4.225 1.00 . A A . 812 PHE CA 1 1 3 1991 1 1 33 PHE CB C 2.721 2.886 3.395 1.00 . A A . 812 PHE CB 1 1 3 1992 1 1 33 PHE CD1 C 2.070 1.684 1.275 1.00 . A A . 812 PHE CD1 1 1 3 1993 1 1 33 PHE CD2 C 3.708 3.411 1.148 1.00 . A A . 812 PHE CD2 1 1 3 1994 1 1 33 PHE CE1 C 2.185 1.468 -0.085 1.00 . A A . 812 PHE CE1 1 1 3 1995 1 1 33 PHE CE2 C 3.825 3.203 -0.212 1.00 . A A . 812 PHE CE2 1 1 3 1996 1 1 33 PHE CG C 2.831 2.657 1.909 1.00 . A A . 812 PHE CG 1 1 3 1997 1 1 33 PHE CZ C 3.064 2.230 -0.829 1.00 . A A . 812 PHE CZ 1 1 3 1998 1 1 33 PHE H H 0.972 1.161 3.474 1.00 . A A . 812 PHE H 1 1 3 1999 1 1 33 PHE HA H 3.720 1.069 3.819 1.00 . A A . 812 PHE HA 1 1 3 2000 1 1 33 PHE HB2 H 1.755 3.324 3.594 1.00 . A A . 812 PHE HB2 1 1 3 2001 1 1 33 PHE HB3 H 3.491 3.579 3.680 1.00 . A A . 812 PHE HB3 1 1 3 2002 1 1 33 PHE HD1 H 1.381 1.090 1.857 1.00 . A A . 812 PHE HD1 1 1 3 2003 1 1 33 PHE HD2 H 4.304 4.173 1.628 1.00 . A A . 812 PHE HD2 1 1 3 2004 1 1 33 PHE HE1 H 1.586 0.708 -0.567 1.00 . A A . 812 PHE HE1 1 1 3 2005 1 1 33 PHE HE2 H 4.513 3.800 -0.792 1.00 . A A . 812 PHE HE2 1 1 3 2006 1 1 33 PHE HZ H 3.156 2.067 -1.893 1.00 . A A . 812 PHE HZ 1 1 3 2007 1 1 33 PHE N N 1.691 0.788 4.020 1.00 . A A . 812 PHE N 1 1 3 2008 1 1 33 PHE O O 3.376 3.125 6.040 1.00 . A A . 812 PHE O 1 1 3 2009 1 1 34 ARG C C 4.784 0.945 8.175 1.00 . A A . 813 ARG C 1 1 3 2010 1 1 34 ARG CA C 3.288 1.124 7.980 1.00 . A A . 813 ARG CA 1 1 3 2011 1 1 34 ARG CB C 2.497 0.106 8.805 1.00 . A A . 813 ARG CB 1 1 3 2012 1 1 34 ARG CD C 0.229 -0.843 9.358 1.00 . A A . 813 ARG CD 1 1 3 2013 1 1 34 ARG CG C 0.989 0.317 8.734 1.00 . A A . 813 ARG CG 1 1 3 2014 1 1 34 ARG CZ C -2.068 -1.721 9.465 1.00 . A A . 813 ARG CZ 1 1 3 2015 1 1 34 ARG H H 2.672 0.106 6.235 1.00 . A A . 813 ARG H 1 1 3 2016 1 1 34 ARG HA H 3.036 2.122 8.308 1.00 . A A . 813 ARG HA 1 1 3 2017 1 1 34 ARG HB2 H 2.721 -0.888 8.443 1.00 . A A . 813 ARG HB2 1 1 3 2018 1 1 34 ARG HB3 H 2.803 0.181 9.838 1.00 . A A . 813 ARG HB3 1 1 3 2019 1 1 34 ARG HD2 H 0.551 -1.757 8.887 1.00 . A A . 813 ARG HD2 1 1 3 2020 1 1 34 ARG HD3 H 0.458 -0.882 10.410 1.00 . A A . 813 ARG HD3 1 1 3 2021 1 1 34 ARG HE H -1.573 0.119 8.844 1.00 . A A . 813 ARG HE 1 1 3 2022 1 1 34 ARG HG2 H 0.738 1.223 9.263 1.00 . A A . 813 ARG HG2 1 1 3 2023 1 1 34 ARG HG3 H 0.699 0.410 7.697 1.00 . A A . 813 ARG HG3 1 1 3 2024 1 1 34 ARG HH11 H -0.643 -2.969 10.194 1.00 . A A . 813 ARG HH11 1 1 3 2025 1 1 34 ARG HH12 H -2.256 -3.609 10.194 1.00 . A A . 813 ARG HH12 1 1 3 2026 1 1 34 ARG HH21 H -3.710 -0.693 8.865 1.00 . A A . 813 ARG HH21 1 1 3 2027 1 1 34 ARG HH22 H -4.007 -2.319 9.424 1.00 . A A . 813 ARG HH22 1 1 3 2028 1 1 34 ARG N N 2.974 0.981 6.567 1.00 . A A . 813 ARG N 1 1 3 2029 1 1 34 ARG NE N -1.219 -0.730 9.195 1.00 . A A . 813 ARG NE 1 1 3 2030 1 1 34 ARG NH1 N -1.620 -2.856 9.992 1.00 . A A . 813 ARG NH1 1 1 3 2031 1 1 34 ARG NH2 N -3.365 -1.566 9.237 1.00 . A A . 813 ARG NH2 1 1 3 2032 1 1 34 ARG O O 5.422 0.171 7.465 1.00 . A A . 813 ARG O 1 1 3 2033 1 1 35 GLY C C 7.339 2.932 8.493 1.00 . A A . 814 GLY C 1 1 3 2034 1 1 35 GLY CA C 6.782 1.744 9.248 1.00 . A A . 814 GLY CA 1 1 3 2035 1 1 35 GLY H H 4.777 2.168 9.761 1.00 . A A . 814 GLY H 1 1 3 2036 1 1 35 GLY HA2 H 7.043 1.831 10.293 1.00 . A A . 814 GLY HA2 1 1 3 2037 1 1 35 GLY HA3 H 7.214 0.840 8.847 1.00 . A A . 814 GLY HA3 1 1 3 2038 1 1 35 GLY N N 5.344 1.679 9.122 1.00 . A A . 814 GLY N 1 1 3 2039 1 1 35 GLY O O 8.233 3.628 8.976 1.00 . A A . 814 GLY O 1 1 3 2040 1 1 36 SER C C 6.232 4.421 5.279 1.00 . A A . 815 SER C 1 1 3 2041 1 1 36 SER CA C 7.177 4.292 6.472 1.00 . A A . 815 SER CA 1 1 3 2042 1 1 36 SER CB C 8.624 4.139 5.994 1.00 . A A . 815 SER CB 1 1 3 2043 1 1 36 SER H H 6.103 2.548 6.974 1.00 . A A . 815 SER H 1 1 3 2044 1 1 36 SER HA H 7.095 5.190 7.065 1.00 . A A . 815 SER HA 1 1 3 2045 1 1 36 SER HB2 H 8.823 4.864 5.218 1.00 . A A . 815 SER HB2 1 1 3 2046 1 1 36 SER HB3 H 9.294 4.308 6.823 1.00 . A A . 815 SER HB3 1 1 3 2047 1 1 36 SER HG H 8.031 2.344 5.474 1.00 . A A . 815 SER HG 1 1 3 2048 1 1 36 SER N N 6.793 3.163 7.304 1.00 . A A . 815 SER N 1 1 3 2049 1 1 36 SER O O 6.052 3.470 4.516 1.00 . A A . 815 SER O 1 1 3 2050 1 1 36 SER OG O 8.857 2.840 5.475 1.00 . A A . 815 SER OG 1 1 3 2051 1 1 37 LYS C C 5.492 6.111 2.726 1.00 . A A . 816 LYS C 1 1 3 2052 1 1 37 LYS CA C 4.712 5.878 4.022 1.00 . A A . 816 LYS CA 1 1 3 2053 1 1 37 LYS CB C 3.860 7.107 4.348 1.00 . A A . 816 LYS CB 1 1 3 2054 1 1 37 LYS CD C 1.789 6.004 5.272 1.00 . A A . 816 LYS CD 1 1 3 2055 1 1 37 LYS CE C 0.916 5.810 6.504 1.00 . A A . 816 LYS CE 1 1 3 2056 1 1 37 LYS CG C 2.961 6.931 5.563 1.00 . A A . 816 LYS CG 1 1 3 2057 1 1 37 LYS H H 5.849 6.329 5.756 1.00 . A A . 816 LYS H 1 1 3 2058 1 1 37 LYS HA H 4.065 5.022 3.902 1.00 . A A . 816 LYS HA 1 1 3 2059 1 1 37 LYS HB2 H 4.517 7.943 4.530 1.00 . A A . 816 LYS HB2 1 1 3 2060 1 1 37 LYS HB3 H 3.237 7.331 3.495 1.00 . A A . 816 LYS HB3 1 1 3 2061 1 1 37 LYS HD2 H 1.190 6.433 4.482 1.00 . A A . 816 LYS HD2 1 1 3 2062 1 1 37 LYS HD3 H 2.172 5.044 4.958 1.00 . A A . 816 LYS HD3 1 1 3 2063 1 1 37 LYS HE2 H 1.481 5.270 7.248 1.00 . A A . 816 LYS HE2 1 1 3 2064 1 1 37 LYS HE3 H 0.647 6.781 6.893 1.00 . A A . 816 LYS HE3 1 1 3 2065 1 1 37 LYS HG2 H 3.543 6.514 6.370 1.00 . A A . 816 LYS HG2 1 1 3 2066 1 1 37 LYS HG3 H 2.578 7.898 5.856 1.00 . A A . 816 LYS HG3 1 1 3 2067 1 1 37 LYS HZ1 H -0.983 5.639 5.641 1.00 . A A . 816 LYS HZ1 1 1 3 2068 1 1 37 LYS HZ2 H -0.806 4.767 7.083 1.00 . A A . 816 LYS HZ2 1 1 3 2069 1 1 37 LYS HZ3 H -0.101 4.193 5.651 1.00 . A A . 816 LYS HZ3 1 1 3 2070 1 1 37 LYS N N 5.635 5.601 5.124 1.00 . A A . 816 LYS N 1 1 3 2071 1 1 37 LYS NZ N -0.327 5.050 6.199 1.00 . A A . 816 LYS NZ 1 1 3 2072 1 1 37 LYS O O 5.329 7.134 2.057 1.00 . A A . 816 LYS O 1 1 3 2073 1 1 38 ARG C C 7.374 3.955 0.517 1.00 . A A . 817 ARG C 1 1 3 2074 1 1 38 ARG CA C 7.291 5.267 1.288 1.00 . A A . 817 ARG CA 1 1 3 2075 1 1 38 ARG CB C 8.678 5.596 1.853 1.00 . A A . 817 ARG CB 1 1 3 2076 1 1 38 ARG CD C 8.563 8.051 1.364 1.00 . A A . 817 ARG CD 1 1 3 2077 1 1 38 ARG CG C 8.791 6.996 2.432 1.00 . A A . 817 ARG CG 1 1 3 2078 1 1 38 ARG CZ C 8.557 10.506 1.146 1.00 . A A . 817 ARG CZ 1 1 3 2079 1 1 38 ARG H H 6.345 4.305 2.884 1.00 . A A . 817 ARG H 1 1 3 2080 1 1 38 ARG HA H 7.015 6.048 0.596 1.00 . A A . 817 ARG HA 1 1 3 2081 1 1 38 ARG HB2 H 8.913 4.889 2.634 1.00 . A A . 817 ARG HB2 1 1 3 2082 1 1 38 ARG HB3 H 9.406 5.499 1.061 1.00 . A A . 817 ARG HB3 1 1 3 2083 1 1 38 ARG HD2 H 9.290 7.911 0.578 1.00 . A A . 817 ARG HD2 1 1 3 2084 1 1 38 ARG HD3 H 7.570 7.925 0.959 1.00 . A A . 817 ARG HD3 1 1 3 2085 1 1 38 ARG HE H 8.887 9.504 2.857 1.00 . A A . 817 ARG HE 1 1 3 2086 1 1 38 ARG HG2 H 8.049 7.116 3.206 1.00 . A A . 817 ARG HG2 1 1 3 2087 1 1 38 ARG HG3 H 9.777 7.125 2.850 1.00 . A A . 817 ARG HG3 1 1 3 2088 1 1 38 ARG HH11 H 8.230 9.492 -0.586 1.00 . A A . 817 ARG HH11 1 1 3 2089 1 1 38 ARG HH12 H 8.234 11.231 -0.723 1.00 . A A . 817 ARG HH12 1 1 3 2090 1 1 38 ARG HH21 H 8.836 11.795 2.695 1.00 . A A . 817 ARG HH21 1 1 3 2091 1 1 38 ARG HH22 H 8.546 12.543 1.148 1.00 . A A . 817 ARG HH22 1 1 3 2092 1 1 38 ARG N N 6.336 5.149 2.382 1.00 . A A . 817 ARG N 1 1 3 2093 1 1 38 ARG NE N 8.692 9.409 1.889 1.00 . A A . 817 ARG NE 1 1 3 2094 1 1 38 ARG NH1 N 8.316 10.402 -0.156 1.00 . A A . 817 ARG NH1 1 1 3 2095 1 1 38 ARG NH2 N 8.656 11.708 1.707 1.00 . A A . 817 ARG NH2 1 1 3 2096 1 1 38 ARG O O 7.620 3.948 -0.689 1.00 . A A . 817 ARG O 1 1 3 2097 1 1 39 PHE C C 6.102 0.672 1.053 1.00 . A A . 818 PHE C 1 1 3 2098 1 1 39 PHE CA C 7.258 1.536 0.601 1.00 . A A . 818 PHE CA 1 1 3 2099 1 1 39 PHE CB C 8.571 0.859 1.002 1.00 . A A . 818 PHE CB 1 1 3 2100 1 1 39 PHE CD1 C 10.268 1.896 -0.532 1.00 . A A . 818 PHE CD1 1 1 3 2101 1 1 39 PHE CD2 C 10.446 2.318 1.809 1.00 . A A . 818 PHE CD2 1 1 3 2102 1 1 39 PHE CE1 C 11.383 2.681 -0.760 1.00 . A A . 818 PHE CE1 1 1 3 2103 1 1 39 PHE CE2 C 11.560 3.102 1.587 1.00 . A A . 818 PHE CE2 1 1 3 2104 1 1 39 PHE CG C 9.789 1.705 0.754 1.00 . A A . 818 PHE CG 1 1 3 2105 1 1 39 PHE CZ C 12.029 3.286 0.300 1.00 . A A . 818 PHE CZ 1 1 3 2106 1 1 39 PHE H H 6.916 2.903 2.160 1.00 . A A . 818 PHE H 1 1 3 2107 1 1 39 PHE HA H 7.242 1.645 -0.466 1.00 . A A . 818 PHE HA 1 1 3 2108 1 1 39 PHE HB2 H 8.535 0.623 2.050 1.00 . A A . 818 PHE HB2 1 1 3 2109 1 1 39 PHE HB3 H 8.682 -0.056 0.436 1.00 . A A . 818 PHE HB3 1 1 3 2110 1 1 39 PHE HD1 H 9.763 1.426 -1.362 1.00 . A A . 818 PHE HD1 1 1 3 2111 1 1 39 PHE HD2 H 10.081 2.176 2.816 1.00 . A A . 818 PHE HD2 1 1 3 2112 1 1 39 PHE HE1 H 11.748 2.823 -1.767 1.00 . A A . 818 PHE HE1 1 1 3 2113 1 1 39 PHE HE2 H 12.063 3.574 2.417 1.00 . A A . 818 PHE HE2 1 1 3 2114 1 1 39 PHE HZ H 12.901 3.899 0.126 1.00 . A A . 818 PHE HZ 1 1 3 2115 1 1 39 PHE N N 7.157 2.847 1.211 1.00 . A A . 818 PHE N 1 1 3 2116 1 1 39 PHE O O 5.424 1.004 2.022 1.00 . A A . 818 PHE O 1 1 3 2117 1 1 40 CYS C C 5.649 -2.149 2.037 1.00 . A A . 819 CYS C 1 1 3 2118 1 1 40 CYS CA C 4.995 -1.467 0.817 1.00 . A A . 819 CYS CA 1 1 3 2119 1 1 40 CYS CB C 4.604 -2.409 -0.339 1.00 . A A . 819 CYS CB 1 1 3 2120 1 1 40 CYS H H 6.404 -0.593 -0.455 1.00 . A A . 819 CYS H 1 1 3 2121 1 1 40 CYS HA H 4.109 -0.997 1.223 1.00 . A A . 819 CYS HA 1 1 3 2122 1 1 40 CYS HB2 H 4.442 -3.396 0.041 1.00 . A A . 819 CYS HB2 1 1 3 2123 1 1 40 CYS HB3 H 3.684 -2.053 -0.782 1.00 . A A . 819 CYS HB3 1 1 3 2124 1 1 40 CYS N N 5.877 -0.422 0.347 1.00 . A A . 819 CYS N 1 1 3 2125 1 1 40 CYS O O 6.480 -1.533 2.697 1.00 . A A . 819 CYS O 1 1 3 2126 1 1 40 CYS SG S 5.826 -2.539 -1.665 1.00 . A A . 819 CYS SG 1 1 3 2127 1 1 41 SER C C 6.979 -4.188 4.029 1.00 . A A . 820 SER C 1 1 3 2128 1 1 41 SER CA C 5.488 -3.957 3.682 1.00 . A A . 820 SER CA 1 1 3 2129 1 1 41 SER CB C 4.689 -5.257 3.755 1.00 . A A . 820 SER CB 1 1 3 2130 1 1 41 SER H H 4.931 -3.961 1.649 1.00 . A A . 820 SER H 1 1 3 2131 1 1 41 SER HA H 5.090 -3.281 4.426 1.00 . A A . 820 SER HA 1 1 3 2132 1 1 41 SER HB2 H 4.858 -5.735 4.709 1.00 . A A . 820 SER HB2 1 1 3 2133 1 1 41 SER HB3 H 3.637 -5.020 3.651 1.00 . A A . 820 SER HB3 1 1 3 2134 1 1 41 SER HG H 4.283 -6.668 2.447 1.00 . A A . 820 SER HG 1 1 3 2135 1 1 41 SER N N 5.275 -3.385 2.352 1.00 . A A . 820 SER N 1 1 3 2136 1 1 41 SER O O 7.841 -3.360 3.735 1.00 . A A . 820 SER O 1 1 3 2137 1 1 41 SER OG O 5.060 -6.150 2.715 1.00 . A A . 820 SER OG 1 1 3 2138 1 1 42 MET C C 9.744 -5.533 4.427 1.00 . A A . 821 MET C 1 1 3 2139 1 1 42 MET CA C 8.552 -5.446 5.369 1.00 . A A . 821 MET CA 1 1 3 2140 1 1 42 MET CB C 8.505 -6.682 6.276 1.00 . A A . 821 MET CB 1 1 3 2141 1 1 42 MET CE C 11.879 -5.675 8.385 1.00 . A A . 821 MET CE 1 1 3 2142 1 1 42 MET CG C 9.420 -6.576 7.490 1.00 . A A . 821 MET CG 1 1 3 2143 1 1 42 MET H H 6.698 -6.094 4.564 1.00 . A A . 821 MET H 1 1 3 2144 1 1 42 MET HA H 8.660 -4.574 6.002 1.00 . A A . 821 MET HA 1 1 3 2145 1 1 42 MET HB2 H 7.493 -6.824 6.623 1.00 . A A . 821 MET HB2 1 1 3 2146 1 1 42 MET HB3 H 8.804 -7.547 5.700 1.00 . A A . 821 MET HB3 1 1 3 2147 1 1 42 MET HE1 H 11.535 -4.653 8.301 1.00 . A A . 821 MET HE1 1 1 3 2148 1 1 42 MET HE2 H 12.954 -5.700 8.311 1.00 . A A . 821 MET HE2 1 1 3 2149 1 1 42 MET HE3 H 11.574 -6.081 9.337 1.00 . A A . 821 MET HE3 1 1 3 2150 1 1 42 MET HG2 H 9.227 -5.639 7.988 1.00 . A A . 821 MET HG2 1 1 3 2151 1 1 42 MET HG3 H 9.194 -7.391 8.162 1.00 . A A . 821 MET HG3 1 1 3 2152 1 1 42 MET N N 7.301 -5.326 4.626 1.00 . A A . 821 MET N 1 1 3 2153 1 1 42 MET O O 10.682 -4.753 4.550 1.00 . A A . 821 MET O 1 1 3 2154 1 1 42 MET SD S 11.169 -6.650 7.063 1.00 . A A . 821 MET SD 1 1 3 2155 1 1 43 THR C C 11.202 -5.296 1.891 1.00 . A A . 822 THR C 1 1 3 2156 1 1 43 THR CA C 10.713 -6.627 2.465 1.00 . A A . 822 THR CA 1 1 3 2157 1 1 43 THR CB C 10.170 -7.472 1.295 1.00 . A A . 822 THR CB 1 1 3 2158 1 1 43 THR CG2 C 11.304 -7.942 0.399 1.00 . A A . 822 THR CG2 1 1 3 2159 1 1 43 THR H H 8.924 -7.070 3.478 1.00 . A A . 822 THR H 1 1 3 2160 1 1 43 THR HA H 11.558 -7.151 2.888 1.00 . A A . 822 THR HA 1 1 3 2161 1 1 43 THR HB H 9.500 -6.859 0.709 1.00 . A A . 822 THR HB 1 1 3 2162 1 1 43 THR HG1 H 9.852 -8.894 2.643 1.00 . A A . 822 THR HG1 1 1 3 2163 1 1 43 THR HG21 H 11.976 -8.568 0.968 1.00 . A A . 822 THR HG21 1 1 3 2164 1 1 43 THR HG22 H 11.842 -7.086 0.019 1.00 . A A . 822 THR HG22 1 1 3 2165 1 1 43 THR HG23 H 10.899 -8.507 -0.427 1.00 . A A . 822 THR HG23 1 1 3 2166 1 1 43 THR N N 9.674 -6.450 3.472 1.00 . A A . 822 THR N 1 1 3 2167 1 1 43 THR O O 12.404 -5.046 1.844 1.00 . A A . 822 THR O 1 1 3 2168 1 1 43 THR OG1 O 9.451 -8.606 1.800 1.00 . A A . 822 THR OG1 1 1 3 2169 1 1 44 CYS C C 11.247 -2.173 1.647 1.00 . A A . 823 CYS C 1 1 3 2170 1 1 44 CYS CA C 10.626 -3.239 0.751 1.00 . A A . 823 CYS CA 1 1 3 2171 1 1 44 CYS CB C 9.404 -2.719 0.029 1.00 . A A . 823 CYS CB 1 1 3 2172 1 1 44 CYS H H 9.332 -4.652 1.639 1.00 . A A . 823 CYS H 1 1 3 2173 1 1 44 CYS HA H 11.367 -3.520 0.020 1.00 . A A . 823 CYS HA 1 1 3 2174 1 1 44 CYS HB2 H 8.632 -2.482 0.751 1.00 . A A . 823 CYS HB2 1 1 3 2175 1 1 44 CYS HB3 H 9.663 -1.834 -0.531 1.00 . A A . 823 CYS HB3 1 1 3 2176 1 1 44 CYS N N 10.276 -4.456 1.464 1.00 . A A . 823 CYS N 1 1 3 2177 1 1 44 CYS O O 12.271 -1.588 1.288 1.00 . A A . 823 CYS O 1 1 3 2178 1 1 44 CYS SG S 8.741 -3.934 -1.123 1.00 . A A . 823 CYS SG 1 1 3 2179 1 1 45 ALA C C 12.589 -1.475 4.206 1.00 . A A . 824 ALA C 1 1 3 2180 1 1 45 ALA CA C 11.219 -0.978 3.758 1.00 . A A . 824 ALA CA 1 1 3 2181 1 1 45 ALA CB C 10.292 -0.794 4.947 1.00 . A A . 824 ALA CB 1 1 3 2182 1 1 45 ALA H H 9.809 -2.379 3.039 1.00 . A A . 824 ALA H 1 1 3 2183 1 1 45 ALA HA H 11.341 -0.028 3.264 1.00 . A A . 824 ALA HA 1 1 3 2184 1 1 45 ALA HB1 H 10.722 -0.079 5.631 1.00 . A A . 824 ALA HB1 1 1 3 2185 1 1 45 ALA HB2 H 10.162 -1.742 5.451 1.00 . A A . 824 ALA HB2 1 1 3 2186 1 1 45 ALA HB3 H 9.334 -0.436 4.605 1.00 . A A . 824 ALA HB3 1 1 3 2187 1 1 45 ALA N N 10.640 -1.914 2.801 1.00 . A A . 824 ALA N 1 1 3 2188 1 1 45 ALA O O 13.559 -0.719 4.256 1.00 . A A . 824 ALA O 1 1 3 2189 1 1 46 LYS C C 14.936 -3.352 3.779 1.00 . A A . 825 LYS C 1 1 3 2190 1 1 46 LYS CA C 13.884 -3.448 4.880 1.00 . A A . 825 LYS CA 1 1 3 2191 1 1 46 LYS CB C 13.534 -4.915 5.139 1.00 . A A . 825 LYS CB 1 1 3 2192 1 1 46 LYS CD C 14.256 -7.280 5.396 1.00 . A A . 825 LYS CD 1 1 3 2193 1 1 46 LYS CE C 15.319 -8.238 5.910 1.00 . A A . 825 LYS CE 1 1 3 2194 1 1 46 LYS CG C 14.697 -5.827 5.467 1.00 . A A . 825 LYS CG 1 1 3 2195 1 1 46 LYS H H 11.818 -3.291 4.543 1.00 . A A . 825 LYS H 1 1 3 2196 1 1 46 LYS HA H 14.268 -3.007 5.785 1.00 . A A . 825 LYS HA 1 1 3 2197 1 1 46 LYS HB2 H 12.844 -4.959 5.966 1.00 . A A . 825 LYS HB2 1 1 3 2198 1 1 46 LYS HB3 H 13.041 -5.306 4.260 1.00 . A A . 825 LYS HB3 1 1 3 2199 1 1 46 LYS HD2 H 13.363 -7.399 5.992 1.00 . A A . 825 LYS HD2 1 1 3 2200 1 1 46 LYS HD3 H 14.032 -7.524 4.368 1.00 . A A . 825 LYS HD3 1 1 3 2201 1 1 46 LYS HE2 H 15.034 -9.246 5.646 1.00 . A A . 825 LYS HE2 1 1 3 2202 1 1 46 LYS HE3 H 16.261 -7.995 5.440 1.00 . A A . 825 LYS HE3 1 1 3 2203 1 1 46 LYS HG2 H 15.489 -5.660 4.754 1.00 . A A . 825 LYS HG2 1 1 3 2204 1 1 46 LYS HG3 H 15.043 -5.610 6.463 1.00 . A A . 825 LYS HG3 1 1 3 2205 1 1 46 LYS HZ1 H 16.065 -8.948 7.726 1.00 . A A . 825 LYS HZ1 1 1 3 2206 1 1 46 LYS HZ2 H 14.543 -8.213 7.852 1.00 . A A . 825 LYS HZ2 1 1 3 2207 1 1 46 LYS HZ3 H 15.932 -7.258 7.654 1.00 . A A . 825 LYS HZ3 1 1 3 2208 1 1 46 LYS N N 12.649 -2.766 4.512 1.00 . A A . 825 LYS N 1 1 3 2209 1 1 46 LYS NZ N 15.474 -8.156 7.387 1.00 . A A . 825 LYS NZ 1 1 3 2210 1 1 46 LYS O O 16.125 -3.212 4.059 1.00 . A A . 825 LYS O 1 1 3 2211 1 1 47 ARG C C 16.134 -2.099 1.247 1.00 . A A . 826 ARG C 1 1 3 2212 1 1 47 ARG CA C 15.393 -3.429 1.388 1.00 . A A . 826 ARG CA 1 1 3 2213 1 1 47 ARG CB C 14.606 -3.719 0.105 1.00 . A A . 826 ARG CB 1 1 3 2214 1 1 47 ARG CD C 16.410 -5.026 -1.072 1.00 . A A . 826 ARG CD 1 1 3 2215 1 1 47 ARG CG C 15.473 -3.830 -1.137 1.00 . A A . 826 ARG CG 1 1 3 2216 1 1 47 ARG CZ C 18.331 -5.926 -2.335 1.00 . A A . 826 ARG CZ 1 1 3 2217 1 1 47 ARG H H 13.523 -3.548 2.380 1.00 . A A . 826 ARG H 1 1 3 2218 1 1 47 ARG HA H 16.094 -4.235 1.547 1.00 . A A . 826 ARG HA 1 1 3 2219 1 1 47 ARG HB2 H 14.071 -4.648 0.226 1.00 . A A . 826 ARG HB2 1 1 3 2220 1 1 47 ARG HB3 H 13.895 -2.923 -0.052 1.00 . A A . 826 ARG HB3 1 1 3 2221 1 1 47 ARG HD2 H 16.955 -4.990 -0.138 1.00 . A A . 826 ARG HD2 1 1 3 2222 1 1 47 ARG HD3 H 15.823 -5.932 -1.112 1.00 . A A . 826 ARG HD3 1 1 3 2223 1 1 47 ARG HE H 17.294 -4.284 -2.830 1.00 . A A . 826 ARG HE 1 1 3 2224 1 1 47 ARG HG2 H 14.835 -3.935 -2.002 1.00 . A A . 826 ARG HG2 1 1 3 2225 1 1 47 ARG HG3 H 16.064 -2.930 -1.232 1.00 . A A . 826 ARG HG3 1 1 3 2226 1 1 47 ARG HH11 H 17.730 -7.108 -0.794 1.00 . A A . 826 ARG HH11 1 1 3 2227 1 1 47 ARG HH12 H 19.149 -7.656 -1.641 1.00 . A A . 826 ARG HH12 1 1 3 2228 1 1 47 ARG HH21 H 19.141 -5.013 -3.953 1.00 . A A . 826 ARG HH21 1 1 3 2229 1 1 47 ARG HH22 H 19.959 -6.456 -3.429 1.00 . A A . 826 ARG HH22 1 1 3 2230 1 1 47 ARG N N 14.488 -3.420 2.530 1.00 . A A . 826 ARG N 1 1 3 2231 1 1 47 ARG NE N 17.363 -5.023 -2.180 1.00 . A A . 826 ARG NE 1 1 3 2232 1 1 47 ARG NH1 N 18.407 -6.978 -1.528 1.00 . A A . 826 ARG NH1 1 1 3 2233 1 1 47 ARG NH2 N 19.209 -5.791 -3.322 1.00 . A A . 826 ARG NH2 1 1 3 2234 1 1 47 ARG O O 17.288 -2.061 0.814 1.00 . A A . 826 ARG O 1 1 3 2235 1 1 48 TYR C C 16.922 0.661 2.665 1.00 . A A . 827 TYR C 1 1 3 2236 1 1 48 TYR CA C 16.044 0.319 1.457 1.00 . A A . 827 TYR CA 1 1 3 2237 1 1 48 TYR CB C 14.940 1.360 1.224 1.00 . A A . 827 TYR CB 1 1 3 2238 1 1 48 TYR CD1 C 15.679 3.005 -0.548 1.00 . A A . 827 TYR CD1 1 1 3 2239 1 1 48 TYR CD2 C 15.569 3.760 1.711 1.00 . A A . 827 TYR CD2 1 1 3 2240 1 1 48 TYR CE1 C 16.078 4.265 -0.953 1.00 . A A . 827 TYR CE1 1 1 3 2241 1 1 48 TYR CE2 C 15.975 5.020 1.316 1.00 . A A . 827 TYR CE2 1 1 3 2242 1 1 48 TYR CG C 15.416 2.731 0.789 1.00 . A A . 827 TYR CG 1 1 3 2243 1 1 48 TYR CZ C 16.226 5.269 -0.017 1.00 . A A . 827 TYR CZ 1 1 3 2244 1 1 48 TYR H H 14.600 -1.114 2.075 1.00 . A A . 827 TYR H 1 1 3 2245 1 1 48 TYR HA H 16.707 0.264 0.608 1.00 . A A . 827 TYR HA 1 1 3 2246 1 1 48 TYR HB2 H 14.275 0.993 0.459 1.00 . A A . 827 TYR HB2 1 1 3 2247 1 1 48 TYR HB3 H 14.382 1.481 2.142 1.00 . A A . 827 TYR HB3 1 1 3 2248 1 1 48 TYR HD1 H 15.565 2.216 -1.278 1.00 . A A . 827 TYR HD1 1 1 3 2249 1 1 48 TYR HD2 H 15.374 3.561 2.754 1.00 . A A . 827 TYR HD2 1 1 3 2250 1 1 48 TYR HE1 H 16.277 4.457 -2.000 1.00 . A A . 827 TYR HE1 1 1 3 2251 1 1 48 TYR HE2 H 16.090 5.804 2.050 1.00 . A A . 827 TYR HE2 1 1 3 2252 1 1 48 TYR HH H 16.004 6.848 -1.105 1.00 . A A . 827 TYR HH 1 1 3 2253 1 1 48 TYR N N 15.467 -1.011 1.619 1.00 . A A . 827 TYR N 1 1 3 2254 1 1 48 TYR O O 17.551 1.719 2.705 1.00 . A A . 827 TYR O 1 1 3 2255 1 1 48 TYR OH O 16.618 6.529 -0.418 1.00 . A A . 827 TYR OH 1 1 3 2256 1 1 49 ASN C C 17.673 1.132 5.557 1.00 . A A . 828 ASN C 1 1 3 2257 1 1 49 ASN CA C 17.879 -0.164 4.777 1.00 . A A . 828 ASN CA 1 1 3 2258 1 1 49 ASN CB C 19.337 -0.266 4.309 1.00 . A A . 828 ASN CB 1 1 3 2259 1 1 49 ASN CG C 19.636 -1.556 3.563 1.00 . A A . 828 ASN CG 1 1 3 2260 1 1 49 ASN H H 16.357 -1.025 3.579 1.00 . A A . 828 ASN H 1 1 3 2261 1 1 49 ASN HA H 17.668 -0.997 5.432 1.00 . A A . 828 ASN HA 1 1 3 2262 1 1 49 ASN HB2 H 19.554 0.561 3.650 1.00 . A A . 828 ASN HB2 1 1 3 2263 1 1 49 ASN HB3 H 19.988 -0.211 5.170 1.00 . A A . 828 ASN HB3 1 1 3 2264 1 1 49 ASN HD21 H 18.313 -2.548 4.662 1.00 . A A . 828 ASN HD21 1 1 3 2265 1 1 49 ASN HD22 H 19.135 -3.478 3.460 1.00 . A A . 828 ASN HD22 1 1 3 2266 1 1 49 ASN N N 16.967 -0.257 3.632 1.00 . A A . 828 ASN N 1 1 3 2267 1 1 49 ASN ND2 N 18.962 -2.635 3.933 1.00 . A A . 828 ASN ND2 1 1 3 2268 1 1 49 ASN O O 18.529 2.038 5.460 1.00 . A A . 828 ASN O 1 1 3 2269 1 1 49 ASN OXT O 16.645 1.246 6.254 1.00 . A A . 828 ASN OXT 1 1 3 2270 1 1 49 ASN OD1 O 20.472 -1.582 2.657 1.00 . A A . 828 ASN OD1 1 1 3 2271 2 2 1 ZN ZN ZN 7.986 -2.854 -2.868 1.00 . B A . 829 ZN ZN 1 1 4 2272 1 1 1 GLY C C -15.428 -3.898 -7.423 1.00 . A A . 1 GLY C 1 1 4 2273 1 1 1 GLY CA C -16.851 -4.410 -7.379 1.00 . A A . 1 GLY CA 1 1 4 2274 1 1 1 GLY H1 H -16.771 -5.424 -9.201 1.00 . A A . 1 GLY H1 1 1 4 2275 1 1 1 GLY H2 H -17.999 -5.971 -8.166 1.00 . A A . 1 GLY H2 1 1 4 2276 1 1 1 GLY H3 H -16.385 -6.385 -7.860 1.00 . A A . 1 GLY H3 1 1 4 2277 1 1 1 GLY HA2 H -17.511 -3.639 -7.747 1.00 . A A . 1 GLY HA2 1 1 4 2278 1 1 1 GLY HA3 H -17.113 -4.641 -6.357 1.00 . A A . 1 GLY HA3 1 1 4 2279 1 1 1 GLY N N -17.015 -5.629 -8.206 1.00 . A A . 1 GLY N 1 1 4 2280 1 1 1 GLY O O -14.670 -4.061 -6.466 1.00 . A A . 1 GLY O 1 1 4 2281 1 1 2 THR C C -13.531 -1.378 -8.295 1.00 . A A . 2 THR C 1 1 4 2282 1 1 2 THR CA C -13.700 -2.833 -8.742 1.00 . A A . 2 THR CA 1 1 4 2283 1 1 2 THR CB C -13.291 -2.991 -10.226 1.00 . A A . 2 THR CB 1 1 4 2284 1 1 2 THR CG2 C -14.007 -1.973 -11.108 1.00 . A A . 2 THR CG2 1 1 4 2285 1 1 2 THR H H -15.736 -3.115 -9.236 1.00 . A A . 2 THR H 1 1 4 2286 1 1 2 THR HA H -13.053 -3.456 -8.145 1.00 . A A . 2 THR HA 1 1 4 2287 1 1 2 THR HB H -13.571 -3.983 -10.553 1.00 . A A . 2 THR HB 1 1 4 2288 1 1 2 THR HG1 H -11.670 -2.479 -11.248 1.00 . A A . 2 THR HG1 1 1 4 2289 1 1 2 THR HG21 H -15.073 -2.137 -11.053 1.00 . A A . 2 THR HG21 1 1 4 2290 1 1 2 THR HG22 H -13.679 -2.088 -12.131 1.00 . A A . 2 THR HG22 1 1 4 2291 1 1 2 THR HG23 H -13.778 -0.974 -10.765 1.00 . A A . 2 THR HG23 1 1 4 2292 1 1 2 THR N N -15.064 -3.281 -8.535 1.00 . A A . 2 THR N 1 1 4 2293 1 1 2 THR O O -14.508 -0.692 -7.984 1.00 . A A . 2 THR O 1 1 4 2294 1 1 2 THR OG1 O -11.871 -2.844 -10.369 1.00 . A A . 2 THR OG1 1 1 4 2295 1 1 3 ARG C C -11.712 1.324 -9.013 1.00 . A A . 3 ARG C 1 1 4 2296 1 1 3 ARG CA C -11.975 0.429 -7.810 1.00 . A A . 3 ARG CA 1 1 4 2297 1 1 3 ARG CB C -10.762 0.413 -6.879 1.00 . A A . 3 ARG CB 1 1 4 2298 1 1 3 ARG CD C -9.711 -0.540 -4.802 1.00 . A A . 3 ARG CD 1 1 4 2299 1 1 3 ARG CG C -10.989 -0.388 -5.608 1.00 . A A . 3 ARG CG 1 1 4 2300 1 1 3 ARG CZ C -7.627 -1.861 -4.943 1.00 . A A . 3 ARG CZ 1 1 4 2301 1 1 3 ARG H H -11.556 -1.510 -8.539 1.00 . A A . 3 ARG H 1 1 4 2302 1 1 3 ARG HA H -12.830 0.808 -7.270 1.00 . A A . 3 ARG HA 1 1 4 2303 1 1 3 ARG HB2 H -9.921 -0.016 -7.404 1.00 . A A . 3 ARG HB2 1 1 4 2304 1 1 3 ARG HB3 H -10.521 1.430 -6.600 1.00 . A A . 3 ARG HB3 1 1 4 2305 1 1 3 ARG HD2 H -9.316 0.443 -4.590 1.00 . A A . 3 ARG HD2 1 1 4 2306 1 1 3 ARG HD3 H -9.944 -1.042 -3.875 1.00 . A A . 3 ARG HD3 1 1 4 2307 1 1 3 ARG HE H -8.827 -1.439 -6.493 1.00 . A A . 3 ARG HE 1 1 4 2308 1 1 3 ARG HG2 H -11.725 0.119 -5.004 1.00 . A A . 3 ARG HG2 1 1 4 2309 1 1 3 ARG HG3 H -11.353 -1.369 -5.875 1.00 . A A . 3 ARG HG3 1 1 4 2310 1 1 3 ARG HH11 H -8.068 -1.196 -3.071 1.00 . A A . 3 ARG HH11 1 1 4 2311 1 1 3 ARG HH12 H -6.610 -2.135 -3.216 1.00 . A A . 3 ARG HH12 1 1 4 2312 1 1 3 ARG HH21 H -6.917 -2.676 -6.656 1.00 . A A . 3 ARG HH21 1 1 4 2313 1 1 3 ARG HH22 H -5.959 -2.979 -5.235 1.00 . A A . 3 ARG HH22 1 1 4 2314 1 1 3 ARG N N -12.288 -0.924 -8.249 1.00 . A A . 3 ARG N 1 1 4 2315 1 1 3 ARG NE N -8.697 -1.315 -5.520 1.00 . A A . 3 ARG NE 1 1 4 2316 1 1 3 ARG NH1 N -7.417 -1.720 -3.641 1.00 . A A . 3 ARG NH1 1 1 4 2317 1 1 3 ARG NH2 N -6.767 -2.559 -5.672 1.00 . A A . 3 ARG NH2 1 1 4 2318 1 1 3 ARG O O -10.755 1.111 -9.759 1.00 . A A . 3 ARG O 1 1 4 2319 1 1 4 GLY C C -13.737 3.176 -11.165 1.00 . A A . 783 GLY C 1 1 4 2320 1 1 4 GLY CA C -12.461 3.190 -10.352 1.00 . A A . 783 GLY CA 1 1 4 2321 1 1 4 GLY H H -13.267 2.480 -8.531 1.00 . A A . 783 GLY H 1 1 4 2322 1 1 4 GLY HA2 H -12.265 4.199 -10.022 1.00 . A A . 783 GLY HA2 1 1 4 2323 1 1 4 GLY HA3 H -11.644 2.857 -10.975 1.00 . A A . 783 GLY HA3 1 1 4 2324 1 1 4 GLY N N -12.562 2.322 -9.194 1.00 . A A . 783 GLY N 1 1 4 2325 1 1 4 GLY O O -13.707 3.083 -12.393 1.00 . A A . 783 GLY O 1 1 4 2326 1 1 5 VAL C C -16.750 4.592 -11.307 1.00 . A A . 784 VAL C 1 1 4 2327 1 1 5 VAL CA C -16.171 3.196 -11.115 1.00 . A A . 784 VAL CA 1 1 4 2328 1 1 5 VAL CB C -17.162 2.342 -10.294 1.00 . A A . 784 VAL CB 1 1 4 2329 1 1 5 VAL CG1 C -18.519 2.282 -10.977 1.00 . A A . 784 VAL CG1 1 1 4 2330 1 1 5 VAL CG2 C -16.610 0.939 -10.072 1.00 . A A . 784 VAL CG2 1 1 4 2331 1 1 5 VAL H H -14.814 3.385 -9.498 1.00 . A A . 784 VAL H 1 1 4 2332 1 1 5 VAL HA H -16.042 2.736 -12.083 1.00 . A A . 784 VAL HA 1 1 4 2333 1 1 5 VAL HB H -17.293 2.809 -9.329 1.00 . A A . 784 VAL HB 1 1 4 2334 1 1 5 VAL HG11 H -18.931 3.279 -11.048 1.00 . A A . 784 VAL HG11 1 1 4 2335 1 1 5 VAL HG12 H -19.185 1.658 -10.401 1.00 . A A . 784 VAL HG12 1 1 4 2336 1 1 5 VAL HG13 H -18.404 1.869 -11.968 1.00 . A A . 784 VAL HG13 1 1 4 2337 1 1 5 VAL HG21 H -17.338 0.348 -9.533 1.00 . A A . 784 VAL HG21 1 1 4 2338 1 1 5 VAL HG22 H -15.699 0.999 -9.496 1.00 . A A . 784 VAL HG22 1 1 4 2339 1 1 5 VAL HG23 H -16.405 0.477 -11.026 1.00 . A A . 784 VAL HG23 1 1 4 2340 1 1 5 VAL N N -14.865 3.262 -10.472 1.00 . A A . 784 VAL N 1 1 4 2341 1 1 5 VAL O O -17.115 4.981 -12.415 1.00 . A A . 784 VAL O 1 1 4 2342 1 1 6 ASP C C -16.235 7.648 -10.752 1.00 . A A . 785 ASP C 1 1 4 2343 1 1 6 ASP CA C -17.332 6.714 -10.264 1.00 . A A . 785 ASP CA 1 1 4 2344 1 1 6 ASP CB C -17.809 7.151 -8.876 1.00 . A A . 785 ASP CB 1 1 4 2345 1 1 6 ASP CG C -16.669 7.312 -7.889 1.00 . A A . 785 ASP CG 1 1 4 2346 1 1 6 ASP H H -16.531 4.978 -9.359 1.00 . A A . 785 ASP H 1 1 4 2347 1 1 6 ASP HA H -18.161 6.747 -10.955 1.00 . A A . 785 ASP HA 1 1 4 2348 1 1 6 ASP HB2 H -18.325 8.096 -8.958 1.00 . A A . 785 ASP HB2 1 1 4 2349 1 1 6 ASP HB3 H -18.492 6.408 -8.487 1.00 . A A . 785 ASP HB3 1 1 4 2350 1 1 6 ASP N N -16.827 5.346 -10.218 1.00 . A A . 785 ASP N 1 1 4 2351 1 1 6 ASP O O -16.458 8.835 -10.979 1.00 . A A . 785 ASP O 1 1 4 2352 1 1 6 ASP OD1 O -16.082 6.287 -7.480 1.00 . A A . 785 ASP OD1 1 1 4 2353 1 1 6 ASP OD2 O -16.359 8.462 -7.512 1.00 . A A . 785 ASP OD2 1 1 4 2354 1 1 7 SER C C -13.970 8.164 -12.827 1.00 . A A . 786 SER C 1 1 4 2355 1 1 7 SER CA C -13.881 7.808 -11.345 1.00 . A A . 786 SER CA 1 1 4 2356 1 1 7 SER CB C -12.666 6.931 -11.089 1.00 . A A . 786 SER CB 1 1 4 2357 1 1 7 SER H H -14.966 6.125 -10.723 1.00 . A A . 786 SER H 1 1 4 2358 1 1 7 SER HA H -13.798 8.711 -10.763 1.00 . A A . 786 SER HA 1 1 4 2359 1 1 7 SER HB2 H -12.653 6.116 -11.799 1.00 . A A . 786 SER HB2 1 1 4 2360 1 1 7 SER HB3 H -11.765 7.520 -11.198 1.00 . A A . 786 SER HB3 1 1 4 2361 1 1 7 SER HG H -12.436 7.073 -9.142 1.00 . A A . 786 SER HG 1 1 4 2362 1 1 7 SER N N -15.054 7.081 -10.910 1.00 . A A . 786 SER N 1 1 4 2363 1 1 7 SER O O -14.500 7.395 -13.630 1.00 . A A . 786 SER O 1 1 4 2364 1 1 7 SER OG O -12.706 6.393 -9.777 1.00 . A A . 786 SER OG 1 1 4 2365 1 1 8 PRO C C -12.350 9.114 -15.413 1.00 . A A . 787 PRO C 1 1 4 2366 1 1 8 PRO CA C -13.439 9.798 -14.596 1.00 . A A . 787 PRO CA 1 1 4 2367 1 1 8 PRO CB C -13.144 11.291 -14.474 1.00 . A A . 787 PRO CB 1 1 4 2368 1 1 8 PRO CD C -12.854 10.339 -12.296 1.00 . A A . 787 PRO CD 1 1 4 2369 1 1 8 PRO CG C -12.343 11.407 -13.227 1.00 . A A . 787 PRO CG 1 1 4 2370 1 1 8 PRO HA H -14.396 9.653 -15.074 1.00 . A A . 787 PRO HA 1 1 4 2371 1 1 8 PRO HB2 H -12.586 11.620 -15.338 1.00 . A A . 787 PRO HB2 1 1 4 2372 1 1 8 PRO HB3 H -14.069 11.842 -14.402 1.00 . A A . 787 PRO HB3 1 1 4 2373 1 1 8 PRO HD2 H -12.037 9.906 -11.738 1.00 . A A . 787 PRO HD2 1 1 4 2374 1 1 8 PRO HD3 H -13.596 10.746 -11.624 1.00 . A A . 787 PRO HD3 1 1 4 2375 1 1 8 PRO HG2 H -11.299 11.243 -13.448 1.00 . A A . 787 PRO HG2 1 1 4 2376 1 1 8 PRO HG3 H -12.484 12.384 -12.789 1.00 . A A . 787 PRO HG3 1 1 4 2377 1 1 8 PRO N N -13.455 9.345 -13.204 1.00 . A A . 787 PRO N 1 1 4 2378 1 1 8 PRO O O -12.366 9.155 -16.644 1.00 . A A . 787 PRO O 1 1 4 2379 1 1 9 SER C C -10.466 6.290 -15.101 1.00 . A A . 788 SER C 1 1 4 2380 1 1 9 SER CA C -10.317 7.782 -15.369 1.00 . A A . 788 SER CA 1 1 4 2381 1 1 9 SER CB C -8.967 8.268 -14.845 1.00 . A A . 788 SER CB 1 1 4 2382 1 1 9 SER H H -11.419 8.545 -13.738 1.00 . A A . 788 SER H 1 1 4 2383 1 1 9 SER HA H -10.379 7.963 -16.432 1.00 . A A . 788 SER HA 1 1 4 2384 1 1 9 SER HB2 H -8.738 7.755 -13.922 1.00 . A A . 788 SER HB2 1 1 4 2385 1 1 9 SER HB3 H -8.198 8.059 -15.576 1.00 . A A . 788 SER HB3 1 1 4 2386 1 1 9 SER HG H -9.294 9.807 -13.675 1.00 . A A . 788 SER HG 1 1 4 2387 1 1 9 SER N N -11.396 8.506 -14.718 1.00 . A A . 788 SER N 1 1 4 2388 1 1 9 SER O O -11.226 5.899 -14.214 1.00 . A A . 788 SER O 1 1 4 2389 1 1 9 SER OG O -8.990 9.664 -14.592 1.00 . A A . 788 SER OG 1 1 4 2390 1 1 10 ALA C C -9.082 3.603 -14.384 1.00 . A A . 789 ALA C 1 1 4 2391 1 1 10 ALA CA C -9.819 4.020 -15.659 1.00 . A A . 789 ALA CA 1 1 4 2392 1 1 10 ALA CB C -9.269 3.281 -16.873 1.00 . A A . 789 ALA CB 1 1 4 2393 1 1 10 ALA H H -9.202 5.829 -16.582 1.00 . A A . 789 ALA H 1 1 4 2394 1 1 10 ALA HA H -10.861 3.751 -15.554 1.00 . A A . 789 ALA HA 1 1 4 2395 1 1 10 ALA HB1 H -8.231 3.542 -17.016 1.00 . A A . 789 ALA HB1 1 1 4 2396 1 1 10 ALA HB2 H -9.832 3.560 -17.751 1.00 . A A . 789 ALA HB2 1 1 4 2397 1 1 10 ALA HB3 H -9.354 2.217 -16.715 1.00 . A A . 789 ALA HB3 1 1 4 2398 1 1 10 ALA N N -9.759 5.462 -15.858 1.00 . A A . 789 ALA N 1 1 4 2399 1 1 10 ALA O O -9.704 3.354 -13.353 1.00 . A A . 789 ALA O 1 1 4 2400 1 1 11 GLU C C -6.258 4.286 -12.627 1.00 . A A . 790 GLU C 1 1 4 2401 1 1 11 GLU CA C -6.963 3.120 -13.297 1.00 . A A . 790 GLU CA 1 1 4 2402 1 1 11 GLU CB C -5.926 2.079 -13.709 1.00 . A A . 790 GLU CB 1 1 4 2403 1 1 11 GLU CD C -5.466 -0.332 -14.284 1.00 . A A . 790 GLU CD 1 1 4 2404 1 1 11 GLU CG C -6.522 0.724 -14.044 1.00 . A A . 790 GLU CG 1 1 4 2405 1 1 11 GLU H H -7.296 3.776 -15.285 1.00 . A A . 790 GLU H 1 1 4 2406 1 1 11 GLU HA H -7.637 2.671 -12.585 1.00 . A A . 790 GLU HA 1 1 4 2407 1 1 11 GLU HB2 H -5.400 2.442 -14.580 1.00 . A A . 790 GLU HB2 1 1 4 2408 1 1 11 GLU HB3 H -5.220 1.956 -12.901 1.00 . A A . 790 GLU HB3 1 1 4 2409 1 1 11 GLU HG2 H -7.145 0.406 -13.222 1.00 . A A . 790 GLU HG2 1 1 4 2410 1 1 11 GLU HG3 H -7.125 0.819 -14.936 1.00 . A A . 790 GLU HG3 1 1 4 2411 1 1 11 GLU N N -7.754 3.545 -14.446 1.00 . A A . 790 GLU N 1 1 4 2412 1 1 11 GLU O O -5.587 4.110 -11.610 1.00 . A A . 790 GLU O 1 1 4 2413 1 1 11 GLU OE1 O -5.002 -0.945 -13.299 1.00 . A A . 790 GLU OE1 1 1 4 2414 1 1 11 GLU OE2 O -5.102 -0.560 -15.456 1.00 . A A . 790 GLU OE2 1 1 4 2415 1 1 12 LEU C C -6.403 7.135 -11.376 1.00 . A A . 791 LEU C 1 1 4 2416 1 1 12 LEU CA C -5.718 6.638 -12.634 1.00 . A A . 791 LEU CA 1 1 4 2417 1 1 12 LEU CB C -5.604 7.769 -13.665 1.00 . A A . 791 LEU CB 1 1 4 2418 1 1 12 LEU CD1 C -3.333 6.951 -14.359 1.00 . A A . 791 LEU CD1 1 1 4 2419 1 1 12 LEU CD2 C -5.310 6.549 -15.850 1.00 . A A . 791 LEU CD2 1 1 4 2420 1 1 12 LEU CG C -4.667 7.500 -14.849 1.00 . A A . 791 LEU CG 1 1 4 2421 1 1 12 LEU H H -6.997 5.581 -13.953 1.00 . A A . 791 LEU H 1 1 4 2422 1 1 12 LEU HA H -4.735 6.307 -12.367 1.00 . A A . 791 LEU HA 1 1 4 2423 1 1 12 LEU HB2 H -6.592 7.969 -14.055 1.00 . A A . 791 LEU HB2 1 1 4 2424 1 1 12 LEU HB3 H -5.254 8.653 -13.155 1.00 . A A . 791 LEU HB3 1 1 4 2425 1 1 12 LEU HD11 H -2.871 7.669 -13.696 1.00 . A A . 791 LEU HD11 1 1 4 2426 1 1 12 LEU HD12 H -2.683 6.771 -15.203 1.00 . A A . 791 LEU HD12 1 1 4 2427 1 1 12 LEU HD13 H -3.497 6.025 -13.828 1.00 . A A . 791 LEU HD13 1 1 4 2428 1 1 12 LEU HD21 H -4.634 6.387 -16.678 1.00 . A A . 791 LEU HD21 1 1 4 2429 1 1 12 LEU HD22 H -6.231 6.978 -16.216 1.00 . A A . 791 LEU HD22 1 1 4 2430 1 1 12 LEU HD23 H -5.519 5.607 -15.366 1.00 . A A . 791 LEU HD23 1 1 4 2431 1 1 12 LEU HG H -4.471 8.433 -15.360 1.00 . A A . 791 LEU HG 1 1 4 2432 1 1 12 LEU N N -6.413 5.479 -13.176 1.00 . A A . 791 LEU N 1 1 4 2433 1 1 12 LEU O O -5.843 7.903 -10.600 1.00 . A A . 791 LEU O 1 1 4 2434 1 1 13 ASP C C -8.647 5.699 -9.207 1.00 . A A . 792 ASP C 1 1 4 2435 1 1 13 ASP CA C -8.369 6.974 -9.977 1.00 . A A . 792 ASP CA 1 1 4 2436 1 1 13 ASP CB C -9.683 7.674 -10.322 1.00 . A A . 792 ASP CB 1 1 4 2437 1 1 13 ASP CG C -9.496 9.068 -10.882 1.00 . A A . 792 ASP CG 1 1 4 2438 1 1 13 ASP H H -7.985 6.052 -11.838 1.00 . A A . 792 ASP H 1 1 4 2439 1 1 13 ASP HA H -7.769 7.629 -9.364 1.00 . A A . 792 ASP HA 1 1 4 2440 1 1 13 ASP HB2 H -10.212 7.082 -11.054 1.00 . A A . 792 ASP HB2 1 1 4 2441 1 1 13 ASP HB3 H -10.285 7.743 -9.427 1.00 . A A . 792 ASP HB3 1 1 4 2442 1 1 13 ASP N N -7.606 6.655 -11.172 1.00 . A A . 792 ASP N 1 1 4 2443 1 1 13 ASP O O -9.515 5.651 -8.336 1.00 . A A . 792 ASP O 1 1 4 2444 1 1 13 ASP OD1 O -9.125 9.981 -10.114 1.00 . A A . 792 ASP OD1 1 1 4 2445 1 1 13 ASP OD2 O -9.704 9.254 -12.099 1.00 . A A . 792 ASP OD2 1 1 4 2446 1 1 14 LYS C C -7.459 3.481 -7.457 1.00 . A A . 793 LYS C 1 1 4 2447 1 1 14 LYS CA C -8.000 3.377 -8.879 1.00 . A A . 793 LYS CA 1 1 4 2448 1 1 14 LYS CB C -7.231 2.314 -9.671 1.00 . A A . 793 LYS CB 1 1 4 2449 1 1 14 LYS CD C -6.422 -0.063 -9.857 1.00 . A A . 793 LYS CD 1 1 4 2450 1 1 14 LYS CE C -4.978 0.384 -10.018 1.00 . A A . 793 LYS CE 1 1 4 2451 1 1 14 LYS CG C -7.229 0.933 -9.034 1.00 . A A . 793 LYS CG 1 1 4 2452 1 1 14 LYS H H -7.222 4.773 -10.251 1.00 . A A . 793 LYS H 1 1 4 2453 1 1 14 LYS HA H -9.043 3.112 -8.847 1.00 . A A . 793 LYS HA 1 1 4 2454 1 1 14 LYS HB2 H -7.672 2.230 -10.654 1.00 . A A . 793 LYS HB2 1 1 4 2455 1 1 14 LYS HB3 H -6.206 2.638 -9.776 1.00 . A A . 793 LYS HB3 1 1 4 2456 1 1 14 LYS HD2 H -6.437 -1.021 -9.358 1.00 . A A . 793 LYS HD2 1 1 4 2457 1 1 14 LYS HD3 H -6.873 -0.158 -10.834 1.00 . A A . 793 LYS HD3 1 1 4 2458 1 1 14 LYS HE2 H -4.964 1.329 -10.541 1.00 . A A . 793 LYS HE2 1 1 4 2459 1 1 14 LYS HE3 H -4.544 0.510 -9.037 1.00 . A A . 793 LYS HE3 1 1 4 2460 1 1 14 LYS HG2 H -6.795 1.005 -8.050 1.00 . A A . 793 LYS HG2 1 1 4 2461 1 1 14 LYS HG3 H -8.248 0.580 -8.958 1.00 . A A . 793 LYS HG3 1 1 4 2462 1 1 14 LYS HZ1 H -4.560 -0.723 -11.746 1.00 . A A . 793 LYS HZ1 1 1 4 2463 1 1 14 LYS HZ2 H -4.184 -1.525 -10.296 1.00 . A A . 793 LYS HZ2 1 1 4 2464 1 1 14 LYS HZ3 H -3.184 -0.279 -10.857 1.00 . A A . 793 LYS HZ3 1 1 4 2465 1 1 14 LYS N N -7.883 4.664 -9.539 1.00 . A A . 793 LYS N 1 1 4 2466 1 1 14 LYS NZ N -4.172 -0.602 -10.782 1.00 . A A . 793 LYS NZ 1 1 4 2467 1 1 14 LYS O O -7.835 2.716 -6.569 1.00 . A A . 793 LYS O 1 1 4 2468 1 1 15 LYS C C -7.052 5.418 -5.048 1.00 . A A . 794 LYS C 1 1 4 2469 1 1 15 LYS CA C -6.031 4.705 -5.931 1.00 . A A . 794 LYS CA 1 1 4 2470 1 1 15 LYS CB C -4.713 5.499 -6.015 1.00 . A A . 794 LYS CB 1 1 4 2471 1 1 15 LYS CD C -3.436 7.488 -6.873 1.00 . A A . 794 LYS CD 1 1 4 2472 1 1 15 LYS CE C -3.484 8.799 -7.649 1.00 . A A . 794 LYS CE 1 1 4 2473 1 1 15 LYS CG C -4.779 6.767 -6.861 1.00 . A A . 794 LYS CG 1 1 4 2474 1 1 15 LYS H H -6.302 5.015 -7.996 1.00 . A A . 794 LYS H 1 1 4 2475 1 1 15 LYS HA H -5.821 3.743 -5.488 1.00 . A A . 794 LYS HA 1 1 4 2476 1 1 15 LYS HB2 H -4.421 5.781 -5.012 1.00 . A A . 794 LYS HB2 1 1 4 2477 1 1 15 LYS HB3 H -3.949 4.856 -6.428 1.00 . A A . 794 LYS HB3 1 1 4 2478 1 1 15 LYS HD2 H -3.147 7.701 -5.854 1.00 . A A . 794 LYS HD2 1 1 4 2479 1 1 15 LYS HD3 H -2.699 6.841 -7.328 1.00 . A A . 794 LYS HD3 1 1 4 2480 1 1 15 LYS HE2 H -4.269 9.417 -7.237 1.00 . A A . 794 LYS HE2 1 1 4 2481 1 1 15 LYS HE3 H -2.536 9.304 -7.533 1.00 . A A . 794 LYS HE3 1 1 4 2482 1 1 15 LYS HG2 H -5.044 6.499 -7.873 1.00 . A A . 794 LYS HG2 1 1 4 2483 1 1 15 LYS HG3 H -5.530 7.424 -6.449 1.00 . A A . 794 LYS HG3 1 1 4 2484 1 1 15 LYS HZ1 H -3.090 7.878 -9.482 1.00 . A A . 794 LYS HZ1 1 1 4 2485 1 1 15 LYS HZ2 H -3.615 9.483 -9.621 1.00 . A A . 794 LYS HZ2 1 1 4 2486 1 1 15 LYS HZ3 H -4.724 8.263 -9.246 1.00 . A A . 794 LYS HZ3 1 1 4 2487 1 1 15 LYS N N -6.580 4.454 -7.247 1.00 . A A . 794 LYS N 1 1 4 2488 1 1 15 LYS NZ N -3.747 8.589 -9.096 1.00 . A A . 794 LYS NZ 1 1 4 2489 1 1 15 LYS O O -7.075 6.646 -4.957 1.00 . A A . 794 LYS O 1 1 4 2490 1 1 16 ALA C C -8.169 5.652 -2.235 1.00 . A A . 795 ALA C 1 1 4 2491 1 1 16 ALA CA C -8.888 5.166 -3.477 1.00 . A A . 795 ALA CA 1 1 4 2492 1 1 16 ALA CB C -9.930 4.113 -3.129 1.00 . A A . 795 ALA CB 1 1 4 2493 1 1 16 ALA H H -7.880 3.661 -4.573 1.00 . A A . 795 ALA H 1 1 4 2494 1 1 16 ALA HA H -9.383 6.000 -3.946 1.00 . A A . 795 ALA HA 1 1 4 2495 1 1 16 ALA HB1 H -10.415 3.775 -4.033 1.00 . A A . 795 ALA HB1 1 1 4 2496 1 1 16 ALA HB2 H -10.666 4.541 -2.464 1.00 . A A . 795 ALA HB2 1 1 4 2497 1 1 16 ALA HB3 H -9.448 3.276 -2.644 1.00 . A A . 795 ALA HB3 1 1 4 2498 1 1 16 ALA N N -7.912 4.630 -4.413 1.00 . A A . 795 ALA N 1 1 4 2499 1 1 16 ALA O O -8.624 6.552 -1.527 1.00 . A A . 795 ALA O 1 1 4 2500 1 1 17 ASN C C -4.760 4.807 -1.202 1.00 . A A . 796 ASN C 1 1 4 2501 1 1 17 ASN CA C -6.135 5.401 -0.923 1.00 . A A . 796 ASN CA 1 1 4 2502 1 1 17 ASN CB C -6.665 4.906 0.433 1.00 . A A . 796 ASN CB 1 1 4 2503 1 1 17 ASN CG C -6.664 3.390 0.570 1.00 . A A . 796 ASN CG 1 1 4 2504 1 1 17 ASN H H -6.789 4.281 -2.574 1.00 . A A . 796 ASN H 1 1 4 2505 1 1 17 ASN HA H -6.058 6.480 -0.907 1.00 . A A . 796 ASN HA 1 1 4 2506 1 1 17 ASN HB2 H -6.047 5.314 1.218 1.00 . A A . 796 ASN HB2 1 1 4 2507 1 1 17 ASN HB3 H -7.679 5.259 0.563 1.00 . A A . 796 ASN HB3 1 1 4 2508 1 1 17 ASN HD21 H -8.526 3.287 -0.127 1.00 . A A . 796 ASN HD21 1 1 4 2509 1 1 17 ASN HD22 H -7.791 1.780 0.304 1.00 . A A . 796 ASN HD22 1 1 4 2510 1 1 17 ASN N N -7.033 5.028 -1.997 1.00 . A A . 796 ASN N 1 1 4 2511 1 1 17 ASN ND2 N -7.769 2.756 0.208 1.00 . A A . 796 ASN ND2 1 1 4 2512 1 1 17 ASN O O -3.961 4.600 -0.289 1.00 . A A . 796 ASN O 1 1 4 2513 1 1 17 ASN OD1 O -5.684 2.795 1.010 1.00 . A A . 796 ASN OD1 1 1 4 2514 1 1 18 LEU C C -2.131 4.756 -3.117 1.00 . A A . 797 LEU C 1 1 4 2515 1 1 18 LEU CA C -3.284 3.804 -2.838 1.00 . A A . 797 LEU CA 1 1 4 2516 1 1 18 LEU CB C -3.524 2.943 -4.087 1.00 . A A . 797 LEU CB 1 1 4 2517 1 1 18 LEU CD1 C -4.925 1.363 -5.431 1.00 . A A . 797 LEU CD1 1 1 4 2518 1 1 18 LEU CD2 C -4.916 1.181 -2.949 1.00 . A A . 797 LEU CD2 1 1 4 2519 1 1 18 LEU CG C -4.827 2.136 -4.125 1.00 . A A . 797 LEU CG 1 1 4 2520 1 1 18 LEU H H -5.003 4.919 -3.205 1.00 . A A . 797 LEU H 1 1 4 2521 1 1 18 LEU HA H -3.027 3.164 -2.008 1.00 . A A . 797 LEU HA 1 1 4 2522 1 1 18 LEU HB2 H -3.513 3.595 -4.947 1.00 . A A . 797 LEU HB2 1 1 4 2523 1 1 18 LEU HB3 H -2.700 2.250 -4.180 1.00 . A A . 797 LEU HB3 1 1 4 2524 1 1 18 LEU HD11 H -4.903 2.053 -6.262 1.00 . A A . 797 LEU HD11 1 1 4 2525 1 1 18 LEU HD12 H -5.850 0.805 -5.453 1.00 . A A . 797 LEU HD12 1 1 4 2526 1 1 18 LEU HD13 H -4.092 0.680 -5.508 1.00 . A A . 797 LEU HD13 1 1 4 2527 1 1 18 LEU HD21 H -5.842 0.628 -3.001 1.00 . A A . 797 LEU HD21 1 1 4 2528 1 1 18 LEU HD22 H -4.881 1.740 -2.026 1.00 . A A . 797 LEU HD22 1 1 4 2529 1 1 18 LEU HD23 H -4.082 0.492 -2.983 1.00 . A A . 797 LEU HD23 1 1 4 2530 1 1 18 LEU HG H -5.667 2.816 -4.074 1.00 . A A . 797 LEU HG 1 1 4 2531 1 1 18 LEU N N -4.473 4.543 -2.477 1.00 . A A . 797 LEU N 1 1 4 2532 1 1 18 LEU O O -2.325 5.870 -3.610 1.00 . A A . 797 LEU O 1 1 4 2533 1 1 19 LEU C C 1.281 3.849 -3.410 1.00 . A A . 798 LEU C 1 1 4 2534 1 1 19 LEU CA C 0.297 4.958 -3.153 1.00 . A A . 798 LEU CA 1 1 4 2535 1 1 19 LEU CB C 0.761 5.883 -2.030 1.00 . A A . 798 LEU CB 1 1 4 2536 1 1 19 LEU CD1 C 2.934 5.345 -0.949 1.00 . A A . 798 LEU CD1 1 1 4 2537 1 1 19 LEU CD2 C 0.907 5.741 0.446 1.00 . A A . 798 LEU CD2 1 1 4 2538 1 1 19 LEU CG C 1.430 5.188 -0.856 1.00 . A A . 798 LEU CG 1 1 4 2539 1 1 19 LEU H H -0.900 3.435 -2.321 1.00 . A A . 798 LEU H 1 1 4 2540 1 1 19 LEU HA H 0.194 5.507 -4.071 1.00 . A A . 798 LEU HA 1 1 4 2541 1 1 19 LEU HB2 H 1.459 6.595 -2.445 1.00 . A A . 798 LEU HB2 1 1 4 2542 1 1 19 LEU HB3 H -0.099 6.423 -1.657 1.00 . A A . 798 LEU HB3 1 1 4 2543 1 1 19 LEU HD11 H 3.410 4.747 -0.188 1.00 . A A . 798 LEU HD11 1 1 4 2544 1 1 19 LEU HD12 H 3.198 6.383 -0.814 1.00 . A A . 798 LEU HD12 1 1 4 2545 1 1 19 LEU HD13 H 3.258 5.014 -1.926 1.00 . A A . 798 LEU HD13 1 1 4 2546 1 1 19 LEU HD21 H 1.099 6.802 0.486 1.00 . A A . 798 LEU HD21 1 1 4 2547 1 1 19 LEU HD22 H 1.403 5.250 1.267 1.00 . A A . 798 LEU HD22 1 1 4 2548 1 1 19 LEU HD23 H -0.154 5.564 0.504 1.00 . A A . 798 LEU HD23 1 1 4 2549 1 1 19 LEU HG H 1.199 4.134 -0.892 1.00 . A A . 798 LEU HG 1 1 4 2550 1 1 19 LEU N N -0.949 4.292 -2.809 1.00 . A A . 798 LEU N 1 1 4 2551 1 1 19 LEU O O 0.900 2.680 -3.295 1.00 . A A . 798 LEU O 1 1 4 2552 1 1 20 LYS C C 4.786 3.130 -3.726 1.00 . A A . 799 LYS C 1 1 4 2553 1 1 20 LYS CA C 3.341 3.028 -4.177 1.00 . A A . 799 LYS CA 1 1 4 2554 1 1 20 LYS CB C 3.259 2.870 -5.684 1.00 . A A . 799 LYS CB 1 1 4 2555 1 1 20 LYS CD C 3.981 3.794 -7.924 1.00 . A A . 799 LYS CD 1 1 4 2556 1 1 20 LYS CE C 5.039 4.616 -8.646 1.00 . A A . 799 LYS CE 1 1 4 2557 1 1 20 LYS CG C 4.157 3.858 -6.422 1.00 . A A . 799 LYS CG 1 1 4 2558 1 1 20 LYS H H 2.857 5.061 -3.776 1.00 . A A . 799 LYS H 1 1 4 2559 1 1 20 LYS HA H 2.907 2.191 -3.663 1.00 . A A . 799 LYS HA 1 1 4 2560 1 1 20 LYS HB2 H 3.546 1.865 -5.957 1.00 . A A . 799 LYS HB2 1 1 4 2561 1 1 20 LYS HB3 H 2.238 3.050 -5.982 1.00 . A A . 799 LYS HB3 1 1 4 2562 1 1 20 LYS HD2 H 4.058 2.765 -8.243 1.00 . A A . 799 LYS HD2 1 1 4 2563 1 1 20 LYS HD3 H 3.004 4.178 -8.176 1.00 . A A . 799 LYS HD3 1 1 4 2564 1 1 20 LYS HE2 H 6.002 4.150 -8.497 1.00 . A A . 799 LYS HE2 1 1 4 2565 1 1 20 LYS HE3 H 4.808 4.625 -9.702 1.00 . A A . 799 LYS HE3 1 1 4 2566 1 1 20 LYS HG2 H 3.921 4.856 -6.090 1.00 . A A . 799 LYS HG2 1 1 4 2567 1 1 20 LYS HG3 H 5.186 3.636 -6.181 1.00 . A A . 799 LYS HG3 1 1 4 2568 1 1 20 LYS HZ1 H 5.541 6.049 -7.202 1.00 . A A . 799 LYS HZ1 1 1 4 2569 1 1 20 LYS HZ2 H 4.142 6.421 -8.090 1.00 . A A . 799 LYS HZ2 1 1 4 2570 1 1 20 LYS HZ3 H 5.668 6.604 -8.804 1.00 . A A . 799 LYS HZ3 1 1 4 2571 1 1 20 LYS N N 2.518 4.137 -3.770 1.00 . A A . 799 LYS N 1 1 4 2572 1 1 20 LYS NZ N 5.100 6.019 -8.152 1.00 . A A . 799 LYS NZ 1 1 4 2573 1 1 20 LYS O O 5.365 4.206 -3.580 1.00 . A A . 799 LYS O 1 1 4 2574 1 1 21 CYS C C 7.631 2.304 -4.130 1.00 . A A . 800 CYS C 1 1 4 2575 1 1 21 CYS CA C 6.681 1.683 -3.121 1.00 . A A . 800 CYS CA 1 1 4 2576 1 1 21 CYS CB C 6.795 0.163 -3.152 1.00 . A A . 800 CYS CB 1 1 4 2577 1 1 21 CYS H H 4.704 1.165 -3.474 1.00 . A A . 800 CYS H 1 1 4 2578 1 1 21 CYS HA H 6.859 2.038 -2.121 1.00 . A A . 800 CYS HA 1 1 4 2579 1 1 21 CYS HB2 H 6.087 -0.241 -2.448 1.00 . A A . 800 CYS HB2 1 1 4 2580 1 1 21 CYS HB3 H 6.516 -0.171 -4.141 1.00 . A A . 800 CYS HB3 1 1 4 2581 1 1 21 CYS N N 5.304 1.940 -3.467 1.00 . A A . 800 CYS N 1 1 4 2582 1 1 21 CYS O O 7.806 1.763 -5.211 1.00 . A A . 800 CYS O 1 1 4 2583 1 1 21 CYS SG S 8.384 -0.593 -2.768 1.00 . A A . 800 CYS SG 1 1 4 2584 1 1 22 GLU C C 10.468 3.306 -4.918 1.00 . A A . 801 GLU C 1 1 4 2585 1 1 22 GLU CA C 9.176 4.102 -4.692 1.00 . A A . 801 GLU CA 1 1 4 2586 1 1 22 GLU CB C 9.485 5.509 -4.185 1.00 . A A . 801 GLU CB 1 1 4 2587 1 1 22 GLU CD C 7.748 6.486 -5.728 1.00 . A A . 801 GLU CD 1 1 4 2588 1 1 22 GLU CG C 8.303 6.454 -4.316 1.00 . A A . 801 GLU CG 1 1 4 2589 1 1 22 GLU H H 8.052 3.827 -2.909 1.00 . A A . 801 GLU H 1 1 4 2590 1 1 22 GLU HA H 8.690 4.191 -5.652 1.00 . A A . 801 GLU HA 1 1 4 2591 1 1 22 GLU HB2 H 9.766 5.453 -3.142 1.00 . A A . 801 GLU HB2 1 1 4 2592 1 1 22 GLU HB3 H 10.309 5.915 -4.751 1.00 . A A . 801 GLU HB3 1 1 4 2593 1 1 22 GLU HG2 H 7.520 6.134 -3.643 1.00 . A A . 801 GLU HG2 1 1 4 2594 1 1 22 GLU HG3 H 8.624 7.446 -4.047 1.00 . A A . 801 GLU HG3 1 1 4 2595 1 1 22 GLU N N 8.240 3.428 -3.791 1.00 . A A . 801 GLU N 1 1 4 2596 1 1 22 GLU O O 11.482 3.854 -5.355 1.00 . A A . 801 GLU O 1 1 4 2597 1 1 22 GLU OE1 O 8.538 6.635 -6.686 1.00 . A A . 801 GLU OE1 1 1 4 2598 1 1 22 GLU OE2 O 6.516 6.358 -5.890 1.00 . A A . 801 GLU OE2 1 1 4 2599 1 1 23 TYR C C 11.102 0.257 -6.164 1.00 . A A . 802 TYR C 1 1 4 2600 1 1 23 TYR CA C 11.508 1.120 -4.968 1.00 . A A . 802 TYR CA 1 1 4 2601 1 1 23 TYR CB C 11.890 0.237 -3.771 1.00 . A A . 802 TYR CB 1 1 4 2602 1 1 23 TYR CD1 C 14.399 -0.050 -3.781 1.00 . A A . 802 TYR CD1 1 1 4 2603 1 1 23 TYR CD2 C 13.045 -1.899 -4.445 1.00 . A A . 802 TYR CD2 1 1 4 2604 1 1 23 TYR CE1 C 15.537 -0.801 -3.993 1.00 . A A . 802 TYR CE1 1 1 4 2605 1 1 23 TYR CE2 C 14.180 -2.656 -4.660 1.00 . A A . 802 TYR CE2 1 1 4 2606 1 1 23 TYR CG C 13.135 -0.585 -4.003 1.00 . A A . 802 TYR CG 1 1 4 2607 1 1 23 TYR CZ C 15.430 -2.091 -4.429 1.00 . A A . 802 TYR CZ 1 1 4 2608 1 1 23 TYR H H 9.618 1.663 -4.204 1.00 . A A . 802 TYR H 1 1 4 2609 1 1 23 TYR HA H 12.357 1.725 -5.254 1.00 . A A . 802 TYR HA 1 1 4 2610 1 1 23 TYR HB2 H 12.065 0.863 -2.906 1.00 . A A . 802 TYR HB2 1 1 4 2611 1 1 23 TYR HB3 H 11.079 -0.443 -3.556 1.00 . A A . 802 TYR HB3 1 1 4 2612 1 1 23 TYR HD1 H 14.485 0.969 -3.435 1.00 . A A . 802 TYR HD1 1 1 4 2613 1 1 23 TYR HD2 H 12.072 -2.329 -4.620 1.00 . A A . 802 TYR HD2 1 1 4 2614 1 1 23 TYR HE1 H 16.511 -0.370 -3.816 1.00 . A A . 802 TYR HE1 1 1 4 2615 1 1 23 TYR HE2 H 14.093 -3.674 -5.005 1.00 . A A . 802 TYR HE2 1 1 4 2616 1 1 23 TYR HH H 16.439 -3.378 -5.459 1.00 . A A . 802 TYR HH 1 1 4 2617 1 1 23 TYR N N 10.422 2.018 -4.630 1.00 . A A . 802 TYR N 1 1 4 2618 1 1 23 TYR O O 11.879 0.069 -7.097 1.00 . A A . 802 TYR O 1 1 4 2619 1 1 23 TYR OH O 16.552 -2.854 -4.649 1.00 . A A . 802 TYR OH 1 1 4 2620 1 1 24 CYS C C 8.218 -0.488 -7.973 1.00 . A A . 803 CYS C 1 1 4 2621 1 1 24 CYS CA C 9.370 -1.126 -7.194 1.00 . A A . 803 CYS CA 1 1 4 2622 1 1 24 CYS CB C 8.932 -2.462 -6.601 1.00 . A A . 803 CYS CB 1 1 4 2623 1 1 24 CYS H H 9.304 -0.068 -5.358 1.00 . A A . 803 CYS H 1 1 4 2624 1 1 24 CYS HA H 10.150 -1.282 -7.920 1.00 . A A . 803 CYS HA 1 1 4 2625 1 1 24 CYS HB2 H 8.485 -3.067 -7.374 1.00 . A A . 803 CYS HB2 1 1 4 2626 1 1 24 CYS HB3 H 9.795 -2.971 -6.204 1.00 . A A . 803 CYS HB3 1 1 4 2627 1 1 24 CYS N N 9.874 -0.256 -6.131 1.00 . A A . 803 CYS N 1 1 4 2628 1 1 24 CYS O O 8.001 -0.816 -9.139 1.00 . A A . 803 CYS O 1 1 4 2629 1 1 24 CYS SG S 7.727 -2.303 -5.252 1.00 . A A . 803 CYS SG 1 1 4 2630 1 1 25 GLY C C 5.108 0.455 -8.008 1.00 . A A . 804 GLY C 1 1 4 2631 1 1 25 GLY CA C 6.454 1.138 -8.059 1.00 . A A . 804 GLY CA 1 1 4 2632 1 1 25 GLY H H 7.609 0.559 -6.383 1.00 . A A . 804 GLY H 1 1 4 2633 1 1 25 GLY HA2 H 6.361 2.122 -7.622 1.00 . A A . 804 GLY HA2 1 1 4 2634 1 1 25 GLY HA3 H 6.755 1.240 -9.091 1.00 . A A . 804 GLY HA3 1 1 4 2635 1 1 25 GLY N N 7.474 0.400 -7.343 1.00 . A A . 804 GLY N 1 1 4 2636 1 1 25 GLY O O 4.228 0.742 -8.817 1.00 . A A . 804 GLY O 1 1 4 2637 1 1 26 LYS C C 2.709 -0.457 -6.097 1.00 . A A . 805 LYS C 1 1 4 2638 1 1 26 LYS CA C 3.710 -1.213 -6.961 1.00 . A A . 805 LYS CA 1 1 4 2639 1 1 26 LYS CB C 3.990 -2.607 -6.398 1.00 . A A . 805 LYS CB 1 1 4 2640 1 1 26 LYS CD C 4.317 -3.695 -8.637 1.00 . A A . 805 LYS CD 1 1 4 2641 1 1 26 LYS CE C 5.339 -4.261 -9.612 1.00 . A A . 805 LYS CE 1 1 4 2642 1 1 26 LYS CG C 4.930 -3.421 -7.274 1.00 . A A . 805 LYS CG 1 1 4 2643 1 1 26 LYS H H 5.656 -0.608 -6.411 1.00 . A A . 805 LYS H 1 1 4 2644 1 1 26 LYS HA H 3.307 -1.312 -7.957 1.00 . A A . 805 LYS HA 1 1 4 2645 1 1 26 LYS HB2 H 4.435 -2.510 -5.418 1.00 . A A . 805 LYS HB2 1 1 4 2646 1 1 26 LYS HB3 H 3.058 -3.143 -6.312 1.00 . A A . 805 LYS HB3 1 1 4 2647 1 1 26 LYS HD2 H 3.513 -4.404 -8.523 1.00 . A A . 805 LYS HD2 1 1 4 2648 1 1 26 LYS HD3 H 3.928 -2.768 -9.036 1.00 . A A . 805 LYS HD3 1 1 4 2649 1 1 26 LYS HE2 H 5.861 -5.075 -9.132 1.00 . A A . 805 LYS HE2 1 1 4 2650 1 1 26 LYS HE3 H 4.819 -4.630 -10.483 1.00 . A A . 805 LYS HE3 1 1 4 2651 1 1 26 LYS HG2 H 5.851 -2.872 -7.409 1.00 . A A . 805 LYS HG2 1 1 4 2652 1 1 26 LYS HG3 H 5.136 -4.362 -6.787 1.00 . A A . 805 LYS HG3 1 1 4 2653 1 1 26 LYS HZ1 H 6.951 -3.619 -10.779 1.00 . A A . 805 LYS HZ1 1 1 4 2654 1 1 26 LYS HZ2 H 6.914 -2.941 -9.230 1.00 . A A . 805 LYS HZ2 1 1 4 2655 1 1 26 LYS HZ3 H 5.837 -2.394 -10.413 1.00 . A A . 805 LYS HZ3 1 1 4 2656 1 1 26 LYS N N 4.947 -0.463 -7.071 1.00 . A A . 805 LYS N 1 1 4 2657 1 1 26 LYS NZ N 6.330 -3.234 -10.036 1.00 . A A . 805 LYS NZ 1 1 4 2658 1 1 26 LYS O O 3.045 -0.019 -4.994 1.00 . A A . 805 LYS O 1 1 4 2659 1 1 27 TYR C C -0.303 -0.414 -4.940 1.00 . A A . 806 TYR C 1 1 4 2660 1 1 27 TYR CA C 0.454 0.459 -5.918 1.00 . A A . 806 TYR CA 1 1 4 2661 1 1 27 TYR CB C -0.533 1.059 -6.921 1.00 . A A . 806 TYR CB 1 1 4 2662 1 1 27 TYR CD1 C 0.897 1.544 -8.939 1.00 . A A . 806 TYR CD1 1 1 4 2663 1 1 27 TYR CD2 C -0.143 3.380 -7.833 1.00 . A A . 806 TYR CD2 1 1 4 2664 1 1 27 TYR CE1 C 1.476 2.412 -9.846 1.00 . A A . 806 TYR CE1 1 1 4 2665 1 1 27 TYR CE2 C 0.428 4.253 -8.736 1.00 . A A . 806 TYR CE2 1 1 4 2666 1 1 27 TYR CG C 0.081 2.012 -7.918 1.00 . A A . 806 TYR CG 1 1 4 2667 1 1 27 TYR CZ C 1.186 3.769 -9.768 1.00 . A A . 806 TYR CZ 1 1 4 2668 1 1 27 TYR H H 1.235 -0.819 -7.394 1.00 . A A . 806 TYR H 1 1 4 2669 1 1 27 TYR HA H 0.913 1.256 -5.351 1.00 . A A . 806 TYR HA 1 1 4 2670 1 1 27 TYR HB2 H -0.999 0.259 -7.474 1.00 . A A . 806 TYR HB2 1 1 4 2671 1 1 27 TYR HB3 H -1.296 1.598 -6.379 1.00 . A A . 806 TYR HB3 1 1 4 2672 1 1 27 TYR HD1 H 1.078 0.482 -9.021 1.00 . A A . 806 TYR HD1 1 1 4 2673 1 1 27 TYR HD2 H -0.780 3.759 -7.050 1.00 . A A . 806 TYR HD2 1 1 4 2674 1 1 27 TYR HE1 H 2.110 2.029 -10.632 1.00 . A A . 806 TYR HE1 1 1 4 2675 1 1 27 TYR HE2 H 0.243 5.315 -8.651 1.00 . A A . 806 TYR HE2 1 1 4 2676 1 1 27 TYR HH H 1.976 5.487 -10.204 1.00 . A A . 806 TYR HH 1 1 4 2677 1 1 27 TYR N N 1.484 -0.323 -6.591 1.00 . A A . 806 TYR N 1 1 4 2678 1 1 27 TYR O O -0.636 -1.563 -5.242 1.00 . A A . 806 TYR O 1 1 4 2679 1 1 27 TYR OH O 1.805 4.637 -10.644 1.00 . A A . 806 TYR OH 1 1 4 2680 1 1 28 ALA C C -1.829 0.383 -1.708 1.00 . A A . 807 ALA C 1 1 4 2681 1 1 28 ALA CA C -1.221 -0.588 -2.707 1.00 . A A . 807 ALA CA 1 1 4 2682 1 1 28 ALA CB C -0.209 -1.498 -2.037 1.00 . A A . 807 ALA CB 1 1 4 2683 1 1 28 ALA H H -0.294 1.078 -3.616 1.00 . A A . 807 ALA H 1 1 4 2684 1 1 28 ALA HA H -2.001 -1.198 -3.137 1.00 . A A . 807 ALA HA 1 1 4 2685 1 1 28 ALA HB1 H 0.580 -0.902 -1.602 1.00 . A A . 807 ALA HB1 1 1 4 2686 1 1 28 ALA HB2 H 0.211 -2.172 -2.770 1.00 . A A . 807 ALA HB2 1 1 4 2687 1 1 28 ALA HB3 H -0.697 -2.068 -1.260 1.00 . A A . 807 ALA HB3 1 1 4 2688 1 1 28 ALA N N -0.570 0.143 -3.772 1.00 . A A . 807 ALA N 1 1 4 2689 1 1 28 ALA O O -1.470 1.563 -1.696 1.00 . A A . 807 ALA O 1 1 4 2690 1 1 29 PRO C C -2.476 1.274 1.165 1.00 . A A . 808 PRO C 1 1 4 2691 1 1 29 PRO CA C -3.443 0.770 0.103 1.00 . A A . 808 PRO CA 1 1 4 2692 1 1 29 PRO CB C -4.494 -0.148 0.737 1.00 . A A . 808 PRO CB 1 1 4 2693 1 1 29 PRO CD C -3.241 -1.475 -0.795 1.00 . A A . 808 PRO CD 1 1 4 2694 1 1 29 PRO CG C -4.594 -1.327 -0.171 1.00 . A A . 808 PRO CG 1 1 4 2695 1 1 29 PRO HA H -3.927 1.611 -0.383 1.00 . A A . 808 PRO HA 1 1 4 2696 1 1 29 PRO HB2 H -4.162 -0.437 1.722 1.00 . A A . 808 PRO HB2 1 1 4 2697 1 1 29 PRO HB3 H -5.435 0.375 0.809 1.00 . A A . 808 PRO HB3 1 1 4 2698 1 1 29 PRO HD2 H -2.595 -2.070 -0.164 1.00 . A A . 808 PRO HD2 1 1 4 2699 1 1 29 PRO HD3 H -3.321 -1.911 -1.780 1.00 . A A . 808 PRO HD3 1 1 4 2700 1 1 29 PRO HG2 H -4.841 -2.208 0.399 1.00 . A A . 808 PRO HG2 1 1 4 2701 1 1 29 PRO HG3 H -5.339 -1.146 -0.930 1.00 . A A . 808 PRO HG3 1 1 4 2702 1 1 29 PRO N N -2.766 -0.084 -0.871 1.00 . A A . 808 PRO N 1 1 4 2703 1 1 29 PRO O O -1.728 0.492 1.758 1.00 . A A . 808 PRO O 1 1 4 2704 1 1 30 ALA C C -1.493 2.557 3.673 1.00 . A A . 809 ALA C 1 1 4 2705 1 1 30 ALA CA C -1.614 3.279 2.324 1.00 . A A . 809 ALA CA 1 1 4 2706 1 1 30 ALA CB C -2.123 4.692 2.551 1.00 . A A . 809 ALA CB 1 1 4 2707 1 1 30 ALA H H -3.084 3.144 0.799 1.00 . A A . 809 ALA H 1 1 4 2708 1 1 30 ALA HA H -0.640 3.357 1.864 1.00 . A A . 809 ALA HA 1 1 4 2709 1 1 30 ALA HB1 H -2.175 5.211 1.605 1.00 . A A . 809 ALA HB1 1 1 4 2710 1 1 30 ALA HB2 H -1.449 5.215 3.213 1.00 . A A . 809 ALA HB2 1 1 4 2711 1 1 30 ALA HB3 H -3.106 4.653 2.995 1.00 . A A . 809 ALA HB3 1 1 4 2712 1 1 30 ALA N N -2.487 2.593 1.364 1.00 . A A . 809 ALA N 1 1 4 2713 1 1 30 ALA O O -0.470 2.663 4.348 1.00 . A A . 809 ALA O 1 1 4 2714 1 1 31 GLU C C -1.474 0.121 5.499 1.00 . A A . 810 GLU C 1 1 4 2715 1 1 31 GLU CA C -2.615 1.130 5.330 1.00 . A A . 810 GLU CA 1 1 4 2716 1 1 31 GLU CB C -3.969 0.419 5.444 1.00 . A A . 810 GLU CB 1 1 4 2717 1 1 31 GLU CD C -4.070 0.676 7.961 1.00 . A A . 810 GLU CD 1 1 4 2718 1 1 31 GLU CG C -4.203 -0.266 6.782 1.00 . A A . 810 GLU CG 1 1 4 2719 1 1 31 GLU H H -3.309 1.782 3.440 1.00 . A A . 810 GLU H 1 1 4 2720 1 1 31 GLU HA H -2.540 1.850 6.130 1.00 . A A . 810 GLU HA 1 1 4 2721 1 1 31 GLU HB2 H -4.755 1.144 5.298 1.00 . A A . 810 GLU HB2 1 1 4 2722 1 1 31 GLU HB3 H -4.034 -0.330 4.668 1.00 . A A . 810 GLU HB3 1 1 4 2723 1 1 31 GLU HG2 H -5.199 -0.684 6.787 1.00 . A A . 810 GLU HG2 1 1 4 2724 1 1 31 GLU HG3 H -3.482 -1.063 6.893 1.00 . A A . 810 GLU HG3 1 1 4 2725 1 1 31 GLU N N -2.548 1.843 4.052 1.00 . A A . 810 GLU N 1 1 4 2726 1 1 31 GLU O O -0.923 -0.015 6.593 1.00 . A A . 810 GLU O 1 1 4 2727 1 1 31 GLU OE1 O -4.666 1.775 7.924 1.00 . A A . 810 GLU OE1 1 1 4 2728 1 1 31 GLU OE2 O -3.362 0.324 8.929 1.00 . A A . 810 GLU OE2 1 1 4 2729 1 1 32 GLN C C 1.308 -0.969 4.581 1.00 . A A . 811 GLN C 1 1 4 2730 1 1 32 GLN CA C -0.080 -1.594 4.499 1.00 . A A . 811 GLN CA 1 1 4 2731 1 1 32 GLN CB C -0.148 -2.531 3.296 1.00 . A A . 811 GLN CB 1 1 4 2732 1 1 32 GLN CD C 0.584 -2.952 0.946 1.00 . A A . 811 GLN CD 1 1 4 2733 1 1 32 GLN CG C 0.310 -1.909 1.998 1.00 . A A . 811 GLN CG 1 1 4 2734 1 1 32 GLN H H -1.541 -0.380 3.562 1.00 . A A . 811 GLN H 1 1 4 2735 1 1 32 GLN HA H -0.227 -2.192 5.387 1.00 . A A . 811 GLN HA 1 1 4 2736 1 1 32 GLN HB2 H 0.477 -3.389 3.491 1.00 . A A . 811 GLN HB2 1 1 4 2737 1 1 32 GLN HB3 H -1.167 -2.863 3.170 1.00 . A A . 811 GLN HB3 1 1 4 2738 1 1 32 GLN HE21 H 2.008 -1.816 0.183 1.00 . A A . 811 GLN HE21 1 1 4 2739 1 1 32 GLN HE22 H 1.735 -3.325 -0.611 1.00 . A A . 811 GLN HE22 1 1 4 2740 1 1 32 GLN HG2 H -0.463 -1.244 1.638 1.00 . A A . 811 GLN HG2 1 1 4 2741 1 1 32 GLN HG3 H 1.215 -1.349 2.178 1.00 . A A . 811 GLN HG3 1 1 4 2742 1 1 32 GLN N N -1.113 -0.570 4.425 1.00 . A A . 811 GLN N 1 1 4 2743 1 1 32 GLN NE2 N 1.540 -2.672 0.090 1.00 . A A . 811 GLN NE2 1 1 4 2744 1 1 32 GLN O O 2.273 -1.637 4.962 1.00 . A A . 811 GLN O 1 1 4 2745 1 1 32 GLN OE1 O -0.046 -4.004 0.912 1.00 . A A . 811 GLN OE1 1 1 4 2746 1 1 33 PHE C C 3.010 1.335 5.786 1.00 . A A . 812 PHE C 1 1 4 2747 1 1 33 PHE CA C 2.668 1.043 4.324 1.00 . A A . 812 PHE CA 1 1 4 2748 1 1 33 PHE CB C 2.580 2.343 3.525 1.00 . A A . 812 PHE CB 1 1 4 2749 1 1 33 PHE CD1 C 1.383 1.781 1.389 1.00 . A A . 812 PHE CD1 1 1 4 2750 1 1 33 PHE CD2 C 3.718 2.235 1.295 1.00 . A A . 812 PHE CD2 1 1 4 2751 1 1 33 PHE CE1 C 1.366 1.563 0.026 1.00 . A A . 812 PHE CE1 1 1 4 2752 1 1 33 PHE CE2 C 3.709 2.021 -0.070 1.00 . A A . 812 PHE CE2 1 1 4 2753 1 1 33 PHE CG C 2.558 2.119 2.040 1.00 . A A . 812 PHE CG 1 1 4 2754 1 1 33 PHE CZ C 2.530 1.683 -0.704 1.00 . A A . 812 PHE CZ 1 1 4 2755 1 1 33 PHE H H 0.687 0.713 3.685 1.00 . A A . 812 PHE H 1 1 4 2756 1 1 33 PHE HA H 3.444 0.438 3.880 1.00 . A A . 812 PHE HA 1 1 4 2757 1 1 33 PHE HB2 H 1.676 2.866 3.797 1.00 . A A . 812 PHE HB2 1 1 4 2758 1 1 33 PHE HB3 H 3.434 2.963 3.757 1.00 . A A . 812 PHE HB3 1 1 4 2759 1 1 33 PHE HD1 H 0.471 1.689 1.959 1.00 . A A . 812 PHE HD1 1 1 4 2760 1 1 33 PHE HD2 H 4.641 2.500 1.792 1.00 . A A . 812 PHE HD2 1 1 4 2761 1 1 33 PHE HE1 H 0.443 1.300 -0.469 1.00 . A A . 812 PHE HE1 1 1 4 2762 1 1 33 PHE HE2 H 4.621 2.115 -0.639 1.00 . A A . 812 PHE HE2 1 1 4 2763 1 1 33 PHE HZ H 2.519 1.515 -1.771 1.00 . A A . 812 PHE HZ 1 1 4 2764 1 1 33 PHE N N 1.417 0.300 4.191 1.00 . A A . 812 PHE N 1 1 4 2765 1 1 33 PHE O O 3.069 2.486 6.220 1.00 . A A . 812 PHE O 1 1 4 2766 1 1 34 ARG C C 5.147 0.666 7.979 1.00 . A A . 813 ARG C 1 1 4 2767 1 1 34 ARG CA C 3.663 0.337 7.915 1.00 . A A . 813 ARG CA 1 1 4 2768 1 1 34 ARG CB C 3.383 -1.002 8.595 1.00 . A A . 813 ARG CB 1 1 4 2769 1 1 34 ARG CD C 1.641 -2.761 9.060 1.00 . A A . 813 ARG CD 1 1 4 2770 1 1 34 ARG CG C 1.903 -1.331 8.627 1.00 . A A . 813 ARG CG 1 1 4 2771 1 1 34 ARG CZ C -0.359 -4.212 8.975 1.00 . A A . 813 ARG CZ 1 1 4 2772 1 1 34 ARG H H 3.039 -0.615 6.138 1.00 . A A . 813 ARG H 1 1 4 2773 1 1 34 ARG HA H 3.116 1.109 8.437 1.00 . A A . 813 ARG HA 1 1 4 2774 1 1 34 ARG HB2 H 3.899 -1.785 8.057 1.00 . A A . 813 ARG HB2 1 1 4 2775 1 1 34 ARG HB3 H 3.748 -0.966 9.611 1.00 . A A . 813 ARG HB3 1 1 4 2776 1 1 34 ARG HD2 H 2.062 -3.431 8.324 1.00 . A A . 813 ARG HD2 1 1 4 2777 1 1 34 ARG HD3 H 2.112 -2.929 10.016 1.00 . A A . 813 ARG HD3 1 1 4 2778 1 1 34 ARG HE H -0.368 -2.257 9.439 1.00 . A A . 813 ARG HE 1 1 4 2779 1 1 34 ARG HG2 H 1.413 -0.662 9.318 1.00 . A A . 813 ARG HG2 1 1 4 2780 1 1 34 ARG HG3 H 1.496 -1.187 7.637 1.00 . A A . 813 ARG HG3 1 1 4 2781 1 1 34 ARG HH11 H 1.367 -5.142 8.434 1.00 . A A . 813 ARG HH11 1 1 4 2782 1 1 34 ARG HH12 H -0.055 -6.144 8.441 1.00 . A A . 813 ARG HH12 1 1 4 2783 1 1 34 ARG HH21 H -2.236 -3.573 9.415 1.00 . A A . 813 ARG HH21 1 1 4 2784 1 1 34 ARG HH22 H -2.099 -5.253 8.992 1.00 . A A . 813 ARG HH22 1 1 4 2785 1 1 34 ARG N N 3.220 0.267 6.532 1.00 . A A . 813 ARG N 1 1 4 2786 1 1 34 ARG NE N 0.207 -3.024 9.178 1.00 . A A . 813 ARG NE 1 1 4 2787 1 1 34 ARG NH1 N 0.375 -5.249 8.583 1.00 . A A . 813 ARG NH1 1 1 4 2788 1 1 34 ARG NH2 N -1.669 -4.358 9.139 1.00 . A A . 813 ARG NH2 1 1 4 2789 1 1 34 ARG O O 5.620 1.269 8.942 1.00 . A A . 813 ARG O 1 1 4 2790 1 1 35 GLY C C 7.435 1.981 6.097 1.00 . A A . 814 GLY C 1 1 4 2791 1 1 35 GLY CA C 7.271 0.664 6.830 1.00 . A A . 814 GLY CA 1 1 4 2792 1 1 35 GLY H H 5.459 -0.244 6.229 1.00 . A A . 814 GLY H 1 1 4 2793 1 1 35 GLY HA2 H 7.687 0.755 7.822 1.00 . A A . 814 GLY HA2 1 1 4 2794 1 1 35 GLY HA3 H 7.803 -0.106 6.291 1.00 . A A . 814 GLY HA3 1 1 4 2795 1 1 35 GLY N N 5.874 0.290 6.935 1.00 . A A . 814 GLY N 1 1 4 2796 1 1 35 GLY O O 8.215 2.074 5.150 1.00 . A A . 814 GLY O 1 1 4 2797 1 1 36 SER C C 5.834 4.262 4.615 1.00 . A A . 815 SER C 1 1 4 2798 1 1 36 SER CA C 6.630 4.312 5.919 1.00 . A A . 815 SER CA 1 1 4 2799 1 1 36 SER CB C 8.037 4.870 5.671 1.00 . A A . 815 SER CB 1 1 4 2800 1 1 36 SER H H 6.149 2.843 7.361 1.00 . A A . 815 SER H 1 1 4 2801 1 1 36 SER HA H 6.111 4.977 6.595 1.00 . A A . 815 SER HA 1 1 4 2802 1 1 36 SER HB2 H 8.561 4.225 4.981 1.00 . A A . 815 SER HB2 1 1 4 2803 1 1 36 SER HB3 H 7.962 5.863 5.252 1.00 . A A . 815 SER HB3 1 1 4 2804 1 1 36 SER HG H 9.430 4.224 6.896 1.00 . A A . 815 SER HG 1 1 4 2805 1 1 36 SER N N 6.686 2.992 6.555 1.00 . A A . 815 SER N 1 1 4 2806 1 1 36 SER O O 5.898 3.284 3.865 1.00 . A A . 815 SER O 1 1 4 2807 1 1 36 SER OG O 8.782 4.941 6.878 1.00 . A A . 815 SER OG 1 1 4 2808 1 1 37 LYS C C 5.189 5.784 1.961 1.00 . A A . 816 LYS C 1 1 4 2809 1 1 37 LYS CA C 4.282 5.425 3.131 1.00 . A A . 816 LYS CA 1 1 4 2810 1 1 37 LYS CB C 3.180 6.479 3.286 1.00 . A A . 816 LYS CB 1 1 4 2811 1 1 37 LYS CD C 2.187 5.492 5.397 1.00 . A A . 816 LYS CD 1 1 4 2812 1 1 37 LYS CE C 0.929 4.939 6.049 1.00 . A A . 816 LYS CE 1 1 4 2813 1 1 37 LYS CG C 1.916 5.976 3.981 1.00 . A A . 816 LYS CG 1 1 4 2814 1 1 37 LYS H H 5.060 6.079 4.985 1.00 . A A . 816 LYS H 1 1 4 2815 1 1 37 LYS HA H 3.828 4.463 2.943 1.00 . A A . 816 LYS HA 1 1 4 2816 1 1 37 LYS HB2 H 3.575 7.301 3.862 1.00 . A A . 816 LYS HB2 1 1 4 2817 1 1 37 LYS HB3 H 2.906 6.840 2.306 1.00 . A A . 816 LYS HB3 1 1 4 2818 1 1 37 LYS HD2 H 2.935 4.712 5.362 1.00 . A A . 816 LYS HD2 1 1 4 2819 1 1 37 LYS HD3 H 2.554 6.319 5.986 1.00 . A A . 816 LYS HD3 1 1 4 2820 1 1 37 LYS HE2 H 0.226 5.747 6.188 1.00 . A A . 816 LYS HE2 1 1 4 2821 1 1 37 LYS HE3 H 0.497 4.194 5.397 1.00 . A A . 816 LYS HE3 1 1 4 2822 1 1 37 LYS HG2 H 1.198 6.782 4.021 1.00 . A A . 816 LYS HG2 1 1 4 2823 1 1 37 LYS HG3 H 1.505 5.160 3.404 1.00 . A A . 816 LYS HG3 1 1 4 2824 1 1 37 LYS HZ1 H 1.556 5.041 8.043 1.00 . A A . 816 LYS HZ1 1 1 4 2825 1 1 37 LYS HZ2 H 1.952 3.585 7.268 1.00 . A A . 816 LYS HZ2 1 1 4 2826 1 1 37 LYS HZ3 H 0.354 3.875 7.756 1.00 . A A . 816 LYS HZ3 1 1 4 2827 1 1 37 LYS N N 5.070 5.319 4.353 1.00 . A A . 816 LYS N 1 1 4 2828 1 1 37 LYS NZ N 1.217 4.318 7.370 1.00 . A A . 816 LYS NZ 1 1 4 2829 1 1 37 LYS O O 5.016 6.814 1.311 1.00 . A A . 816 LYS O 1 1 4 2830 1 1 38 ARG C C 7.585 3.840 0.072 1.00 . A A . 817 ARG C 1 1 4 2831 1 1 38 ARG CA C 7.202 5.161 0.722 1.00 . A A . 817 ARG CA 1 1 4 2832 1 1 38 ARG CB C 8.436 5.777 1.397 1.00 . A A . 817 ARG CB 1 1 4 2833 1 1 38 ARG CD C 9.360 7.590 2.885 1.00 . A A . 817 ARG CD 1 1 4 2834 1 1 38 ARG CG C 8.175 7.127 2.052 1.00 . A A . 817 ARG CG 1 1 4 2835 1 1 38 ARG CZ C 11.769 8.013 2.587 1.00 . A A . 817 ARG CZ 1 1 4 2836 1 1 38 ARG H H 6.182 4.070 2.191 1.00 . A A . 817 ARG H 1 1 4 2837 1 1 38 ARG HA H 6.844 5.831 -0.045 1.00 . A A . 817 ARG HA 1 1 4 2838 1 1 38 ARG HB2 H 8.791 5.098 2.158 1.00 . A A . 817 ARG HB2 1 1 4 2839 1 1 38 ARG HB3 H 9.209 5.906 0.654 1.00 . A A . 817 ARG HB3 1 1 4 2840 1 1 38 ARG HD2 H 9.092 8.507 3.387 1.00 . A A . 817 ARG HD2 1 1 4 2841 1 1 38 ARG HD3 H 9.579 6.830 3.621 1.00 . A A . 817 ARG HD3 1 1 4 2842 1 1 38 ARG HE H 10.441 7.856 1.095 1.00 . A A . 817 ARG HE 1 1 4 2843 1 1 38 ARG HG2 H 7.985 7.858 1.280 1.00 . A A . 817 ARG HG2 1 1 4 2844 1 1 38 ARG HG3 H 7.309 7.043 2.691 1.00 . A A . 817 ARG HG3 1 1 4 2845 1 1 38 ARG HH11 H 11.182 7.822 4.519 1.00 . A A . 817 ARG HH11 1 1 4 2846 1 1 38 ARG HH12 H 12.874 8.128 4.286 1.00 . A A . 817 ARG HH12 1 1 4 2847 1 1 38 ARG HH21 H 12.660 8.258 0.785 1.00 . A A . 817 ARG HH21 1 1 4 2848 1 1 38 ARG HH22 H 13.717 8.380 2.161 1.00 . A A . 817 ARG HH22 1 1 4 2849 1 1 38 ARG N N 6.158 4.922 1.708 1.00 . A A . 817 ARG N 1 1 4 2850 1 1 38 ARG NE N 10.555 7.826 2.078 1.00 . A A . 817 ARG NE 1 1 4 2851 1 1 38 ARG NH1 N 11.956 7.984 3.903 1.00 . A A . 817 ARG NH1 1 1 4 2852 1 1 38 ARG NH2 N 12.797 8.233 1.780 1.00 . A A . 817 ARG NH2 1 1 4 2853 1 1 38 ARG O O 7.949 3.797 -1.101 1.00 . A A . 817 ARG O 1 1 4 2854 1 1 39 PHE C C 6.753 0.465 0.953 1.00 . A A . 818 PHE C 1 1 4 2855 1 1 39 PHE CA C 7.782 1.415 0.361 1.00 . A A . 818 PHE CA 1 1 4 2856 1 1 39 PHE CB C 9.187 0.987 0.785 1.00 . A A . 818 PHE CB 1 1 4 2857 1 1 39 PHE CD1 C 10.713 2.034 -0.912 1.00 . A A . 818 PHE CD1 1 1 4 2858 1 1 39 PHE CD2 C 10.784 2.848 1.328 1.00 . A A . 818 PHE CD2 1 1 4 2859 1 1 39 PHE CE1 C 11.681 2.949 -1.278 1.00 . A A . 818 PHE CE1 1 1 4 2860 1 1 39 PHE CE2 C 11.750 3.768 0.965 1.00 . A A . 818 PHE CE2 1 1 4 2861 1 1 39 PHE CG C 10.255 1.971 0.394 1.00 . A A . 818 PHE CG 1 1 4 2862 1 1 39 PHE CZ C 12.197 3.818 -0.339 1.00 . A A . 818 PHE CZ 1 1 4 2863 1 1 39 PHE H H 7.238 2.866 1.789 1.00 . A A . 818 PHE H 1 1 4 2864 1 1 39 PHE HA H 7.723 1.415 -0.717 1.00 . A A . 818 PHE HA 1 1 4 2865 1 1 39 PHE HB2 H 9.208 0.876 1.854 1.00 . A A . 818 PHE HB2 1 1 4 2866 1 1 39 PHE HB3 H 9.421 0.038 0.325 1.00 . A A . 818 PHE HB3 1 1 4 2867 1 1 39 PHE HD1 H 10.310 1.355 -1.648 1.00 . A A . 818 PHE HD1 1 1 4 2868 1 1 39 PHE HD2 H 10.438 2.808 2.350 1.00 . A A . 818 PHE HD2 1 1 4 2869 1 1 39 PHE HE1 H 12.030 2.988 -2.299 1.00 . A A . 818 PHE HE1 1 1 4 2870 1 1 39 PHE HE2 H 12.155 4.448 1.702 1.00 . A A . 818 PHE HE2 1 1 4 2871 1 1 39 PHE HZ H 12.950 4.537 -0.625 1.00 . A A . 818 PHE HZ 1 1 4 2872 1 1 39 PHE N N 7.496 2.763 0.847 1.00 . A A . 818 PHE N 1 1 4 2873 1 1 39 PHE O O 6.437 0.570 2.139 1.00 . A A . 818 PHE O 1 1 4 2874 1 1 40 CYS C C 5.483 -2.274 1.649 1.00 . A A . 819 CYS C 1 1 4 2875 1 1 40 CYS CA C 5.079 -1.218 0.615 1.00 . A A . 819 CYS CA 1 1 4 2876 1 1 40 CYS CB C 4.366 -1.859 -0.577 1.00 . A A . 819 CYS CB 1 1 4 2877 1 1 40 CYS H H 6.642 -0.683 -0.686 1.00 . A A . 819 CYS H 1 1 4 2878 1 1 40 CYS HA H 4.392 -0.531 1.085 1.00 . A A . 819 CYS HA 1 1 4 2879 1 1 40 CYS HB2 H 3.885 -2.761 -0.243 1.00 . A A . 819 CYS HB2 1 1 4 2880 1 1 40 CYS HB3 H 3.615 -1.173 -0.942 1.00 . A A . 819 CYS HB3 1 1 4 2881 1 1 40 CYS N N 6.208 -0.442 0.154 1.00 . A A . 819 CYS N 1 1 4 2882 1 1 40 CYS O O 6.057 -3.307 1.302 1.00 . A A . 819 CYS O 1 1 4 2883 1 1 40 CYS SG S 5.430 -2.303 -1.971 1.00 . A A . 819 CYS SG 1 1 4 2884 1 1 41 SER C C 6.583 -3.169 4.579 1.00 . A A . 820 SER C 1 1 4 2885 1 1 41 SER CA C 5.178 -2.968 3.993 1.00 . A A . 820 SER CA 1 1 4 2886 1 1 41 SER CB C 4.582 -4.297 3.510 1.00 . A A . 820 SER CB 1 1 4 2887 1 1 41 SER H H 5.252 -1.036 3.194 1.00 . A A . 820 SER H 1 1 4 2888 1 1 41 SER HA H 4.532 -2.556 4.756 1.00 . A A . 820 SER HA 1 1 4 2889 1 1 41 SER HB2 H 3.742 -4.100 2.860 1.00 . A A . 820 SER HB2 1 1 4 2890 1 1 41 SER HB3 H 5.341 -4.848 2.970 1.00 . A A . 820 SER HB3 1 1 4 2891 1 1 41 SER HG H 3.299 -5.507 4.376 1.00 . A A . 820 SER HG 1 1 4 2892 1 1 41 SER N N 5.215 -1.972 2.920 1.00 . A A . 820 SER N 1 1 4 2893 1 1 41 SER O O 7.391 -2.235 4.595 1.00 . A A . 820 SER O 1 1 4 2894 1 1 41 SER OG O 4.143 -5.088 4.602 1.00 . A A . 820 SER OG 1 1 4 2895 1 1 42 MET C C 9.282 -4.942 4.797 1.00 . A A . 821 MET C 1 1 4 2896 1 1 42 MET CA C 8.123 -4.652 5.749 1.00 . A A . 821 MET CA 1 1 4 2897 1 1 42 MET CB C 7.937 -5.840 6.691 1.00 . A A . 821 MET CB 1 1 4 2898 1 1 42 MET CE C 11.587 -5.444 8.608 1.00 . A A . 821 MET CE 1 1 4 2899 1 1 42 MET CG C 9.225 -6.233 7.386 1.00 . A A . 821 MET CG 1 1 4 2900 1 1 42 MET H H 6.250 -5.120 4.871 1.00 . A A . 821 MET H 1 1 4 2901 1 1 42 MET HA H 8.361 -3.787 6.351 1.00 . A A . 821 MET HA 1 1 4 2902 1 1 42 MET HB2 H 7.206 -5.581 7.444 1.00 . A A . 821 MET HB2 1 1 4 2903 1 1 42 MET HB3 H 7.581 -6.687 6.125 1.00 . A A . 821 MET HB3 1 1 4 2904 1 1 42 MET HE1 H 12.071 -5.520 7.645 1.00 . A A . 821 MET HE1 1 1 4 2905 1 1 42 MET HE2 H 11.586 -6.410 9.091 1.00 . A A . 821 MET HE2 1 1 4 2906 1 1 42 MET HE3 H 12.120 -4.734 9.224 1.00 . A A . 821 MET HE3 1 1 4 2907 1 1 42 MET HG2 H 9.034 -7.081 8.026 1.00 . A A . 821 MET HG2 1 1 4 2908 1 1 42 MET HG3 H 9.947 -6.504 6.631 1.00 . A A . 821 MET HG3 1 1 4 2909 1 1 42 MET N N 6.881 -4.381 5.031 1.00 . A A . 821 MET N 1 1 4 2910 1 1 42 MET O O 10.278 -4.229 4.788 1.00 . A A . 821 MET O 1 1 4 2911 1 1 42 MET SD S 9.901 -4.888 8.381 1.00 . A A . 821 MET SD 1 1 4 2912 1 1 43 THR C C 10.619 -5.236 2.168 1.00 . A A . 822 THR C 1 1 4 2913 1 1 43 THR CA C 10.114 -6.410 3.010 1.00 . A A . 822 THR CA 1 1 4 2914 1 1 43 THR CB C 9.491 -7.471 2.081 1.00 . A A . 822 THR CB 1 1 4 2915 1 1 43 THR CG2 C 10.535 -8.055 1.139 1.00 . A A . 822 THR CG2 1 1 4 2916 1 1 43 THR H H 8.330 -6.560 4.131 1.00 . A A . 822 THR H 1 1 4 2917 1 1 43 THR HA H 10.982 -6.861 3.470 1.00 . A A . 822 THR HA 1 1 4 2918 1 1 43 THR HB H 8.713 -7.004 1.492 1.00 . A A . 822 THR HB 1 1 4 2919 1 1 43 THR HG1 H 9.554 -8.787 3.563 1.00 . A A . 822 THR HG1 1 1 4 2920 1 1 43 THR HG21 H 10.067 -8.779 0.489 1.00 . A A . 822 THR HG21 1 1 4 2921 1 1 43 THR HG22 H 11.310 -8.538 1.717 1.00 . A A . 822 THR HG22 1 1 4 2922 1 1 43 THR HG23 H 10.968 -7.262 0.548 1.00 . A A . 822 THR HG23 1 1 4 2923 1 1 43 THR N N 9.133 -6.003 4.014 1.00 . A A . 822 THR N 1 1 4 2924 1 1 43 THR O O 11.823 -5.114 1.940 1.00 . A A . 822 THR O 1 1 4 2925 1 1 43 THR OG1 O 8.920 -8.523 2.875 1.00 . A A . 822 THR OG1 1 1 4 2926 1 1 44 CYS C C 10.885 -2.186 1.733 1.00 . A A . 823 CYS C 1 1 4 2927 1 1 44 CYS CA C 10.135 -3.233 0.919 1.00 . A A . 823 CYS CA 1 1 4 2928 1 1 44 CYS CB C 8.944 -2.630 0.210 1.00 . A A . 823 CYS CB 1 1 4 2929 1 1 44 CYS H H 8.782 -4.504 1.947 1.00 . A A . 823 CYS H 1 1 4 2930 1 1 44 CYS HA H 10.809 -3.602 0.158 1.00 . A A . 823 CYS HA 1 1 4 2931 1 1 44 CYS HB2 H 8.123 -2.533 0.905 1.00 . A A . 823 CYS HB2 1 1 4 2932 1 1 44 CYS HB3 H 9.209 -1.657 -0.177 1.00 . A A . 823 CYS HB3 1 1 4 2933 1 1 44 CYS N N 9.727 -4.376 1.720 1.00 . A A . 823 CYS N 1 1 4 2934 1 1 44 CYS O O 11.882 -1.635 1.260 1.00 . A A . 823 CYS O 1 1 4 2935 1 1 44 CYS SG S 8.395 -3.649 -1.171 1.00 . A A . 823 CYS SG 1 1 4 2936 1 1 45 ALA C C 12.516 -1.524 4.132 1.00 . A A . 824 ALA C 1 1 4 2937 1 1 45 ALA CA C 11.130 -0.985 3.825 1.00 . A A . 824 ALA CA 1 1 4 2938 1 1 45 ALA CB C 10.354 -0.749 5.108 1.00 . A A . 824 ALA CB 1 1 4 2939 1 1 45 ALA H H 9.596 -2.342 3.269 1.00 . A A . 824 ALA H 1 1 4 2940 1 1 45 ALA HA H 11.231 -0.045 3.308 1.00 . A A . 824 ALA HA 1 1 4 2941 1 1 45 ALA HB1 H 10.900 -0.058 5.733 1.00 . A A . 824 ALA HB1 1 1 4 2942 1 1 45 ALA HB2 H 10.232 -1.685 5.630 1.00 . A A . 824 ALA HB2 1 1 4 2943 1 1 45 ALA HB3 H 9.386 -0.335 4.872 1.00 . A A . 824 ALA HB3 1 1 4 2944 1 1 45 ALA N N 10.419 -1.907 2.947 1.00 . A A . 824 ALA N 1 1 4 2945 1 1 45 ALA O O 13.505 -0.791 4.122 1.00 . A A . 824 ALA O 1 1 4 2946 1 1 46 LYS C C 14.723 -3.443 3.413 1.00 . A A . 825 LYS C 1 1 4 2947 1 1 46 LYS CA C 13.821 -3.512 4.643 1.00 . A A . 825 LYS CA 1 1 4 2948 1 1 46 LYS CB C 13.505 -4.972 5.015 1.00 . A A . 825 LYS CB 1 1 4 2949 1 1 46 LYS CD C 15.171 -6.494 3.894 1.00 . A A . 825 LYS CD 1 1 4 2950 1 1 46 LYS CE C 16.385 -7.385 4.074 1.00 . A A . 825 LYS CE 1 1 4 2951 1 1 46 LYS CG C 14.718 -5.874 5.208 1.00 . A A . 825 LYS CG 1 1 4 2952 1 1 46 LYS H H 11.737 -3.326 4.500 1.00 . A A . 825 LYS H 1 1 4 2953 1 1 46 LYS HA H 14.281 -3.034 5.495 1.00 . A A . 825 LYS HA 1 1 4 2954 1 1 46 LYS HB2 H 12.943 -4.975 5.936 1.00 . A A . 825 LYS HB2 1 1 4 2955 1 1 46 LYS HB3 H 12.891 -5.399 4.236 1.00 . A A . 825 LYS HB3 1 1 4 2956 1 1 46 LYS HD2 H 14.363 -7.085 3.491 1.00 . A A . 825 LYS HD2 1 1 4 2957 1 1 46 LYS HD3 H 15.417 -5.701 3.202 1.00 . A A . 825 LYS HD3 1 1 4 2958 1 1 46 LYS HE2 H 17.201 -6.790 4.457 1.00 . A A . 825 LYS HE2 1 1 4 2959 1 1 46 LYS HE3 H 16.143 -8.163 4.784 1.00 . A A . 825 LYS HE3 1 1 4 2960 1 1 46 LYS HG2 H 15.528 -5.289 5.617 1.00 . A A . 825 LYS HG2 1 1 4 2961 1 1 46 LYS HG3 H 14.459 -6.665 5.897 1.00 . A A . 825 LYS HG3 1 1 4 2962 1 1 46 LYS HZ1 H 17.636 -8.620 2.939 1.00 . A A . 825 LYS HZ1 1 1 4 2963 1 1 46 LYS HZ2 H 17.045 -7.275 2.092 1.00 . A A . 825 LYS HZ2 1 1 4 2964 1 1 46 LYS HZ3 H 16.026 -8.594 2.406 1.00 . A A . 825 LYS HZ3 1 1 4 2965 1 1 46 LYS N N 12.571 -2.819 4.401 1.00 . A A . 825 LYS N 1 1 4 2966 1 1 46 LYS NZ N 16.801 -8.012 2.791 1.00 . A A . 825 LYS NZ 1 1 4 2967 1 1 46 LYS O O 15.934 -3.300 3.522 1.00 . A A . 825 LYS O 1 1 4 2968 1 1 47 ARG C C 15.651 -2.349 0.732 1.00 . A A . 826 ARG C 1 1 4 2969 1 1 47 ARG CA C 14.851 -3.618 0.992 1.00 . A A . 826 ARG CA 1 1 4 2970 1 1 47 ARG CB C 13.885 -3.875 -0.169 1.00 . A A . 826 ARG CB 1 1 4 2971 1 1 47 ARG CD C 15.469 -5.366 -1.446 1.00 . A A . 826 ARG CD 1 1 4 2972 1 1 47 ARG CG C 14.575 -4.133 -1.501 1.00 . A A . 826 ARG CG 1 1 4 2973 1 1 47 ARG CZ C 17.454 -5.846 -2.826 1.00 . A A . 826 ARG CZ 1 1 4 2974 1 1 47 ARG H H 13.130 -3.594 2.224 1.00 . A A . 826 ARG H 1 1 4 2975 1 1 47 ARG HA H 15.521 -4.461 1.071 1.00 . A A . 826 ARG HA 1 1 4 2976 1 1 47 ARG HB2 H 13.280 -4.736 0.068 1.00 . A A . 826 ARG HB2 1 1 4 2977 1 1 47 ARG HB3 H 13.243 -3.015 -0.283 1.00 . A A . 826 ARG HB3 1 1 4 2978 1 1 47 ARG HD2 H 16.210 -5.222 -0.674 1.00 . A A . 826 ARG HD2 1 1 4 2979 1 1 47 ARG HD3 H 14.861 -6.225 -1.205 1.00 . A A . 826 ARG HD3 1 1 4 2980 1 1 47 ARG HE H 15.601 -5.565 -3.541 1.00 . A A . 826 ARG HE 1 1 4 2981 1 1 47 ARG HG2 H 13.822 -4.281 -2.261 1.00 . A A . 826 ARG HG2 1 1 4 2982 1 1 47 ARG HG3 H 15.179 -3.274 -1.753 1.00 . A A . 826 ARG HG3 1 1 4 2983 1 1 47 ARG HH11 H 17.799 -5.860 -0.827 1.00 . A A . 826 ARG HH11 1 1 4 2984 1 1 47 ARG HH12 H 19.194 -6.124 -1.824 1.00 . A A . 826 ARG HH12 1 1 4 2985 1 1 47 ARG HH21 H 17.441 -5.931 -4.854 1.00 . A A . 826 ARG HH21 1 1 4 2986 1 1 47 ARG HH22 H 18.988 -6.187 -4.106 1.00 . A A . 826 ARG HH22 1 1 4 2987 1 1 47 ARG N N 14.109 -3.528 2.239 1.00 . A A . 826 ARG N 1 1 4 2988 1 1 47 ARG NE N 16.150 -5.604 -2.717 1.00 . A A . 826 ARG NE 1 1 4 2989 1 1 47 ARG NH1 N 18.207 -5.954 -1.737 1.00 . A A . 826 ARG NH1 1 1 4 2990 1 1 47 ARG NH2 N 18.003 -6.000 -4.024 1.00 . A A . 826 ARG NH2 1 1 4 2991 1 1 47 ARG O O 16.742 -2.401 0.169 1.00 . A A . 826 ARG O 1 1 4 2992 1 1 48 TYR C C 16.714 0.425 2.072 1.00 . A A . 827 TYR C 1 1 4 2993 1 1 48 TYR CA C 15.785 0.060 0.909 1.00 . A A . 827 TYR CA 1 1 4 2994 1 1 48 TYR CB C 14.765 1.173 0.628 1.00 . A A . 827 TYR CB 1 1 4 2995 1 1 48 TYR CD1 C 15.885 2.425 -1.266 1.00 . A A . 827 TYR CD1 1 1 4 2996 1 1 48 TYR CD2 C 15.426 3.608 0.754 1.00 . A A . 827 TYR CD2 1 1 4 2997 1 1 48 TYR CE1 C 16.436 3.566 -1.814 1.00 . A A . 827 TYR CE1 1 1 4 2998 1 1 48 TYR CE2 C 15.975 4.754 0.212 1.00 . A A . 827 TYR CE2 1 1 4 2999 1 1 48 TYR CG C 15.371 2.425 0.027 1.00 . A A . 827 TYR CG 1 1 4 3000 1 1 48 TYR CZ C 16.489 4.719 -1.080 1.00 . A A . 827 TYR CZ 1 1 4 3001 1 1 48 TYR H H 14.278 -1.229 1.670 1.00 . A A . 827 TYR H 1 1 4 3002 1 1 48 TYR HA H 16.405 -0.080 0.037 1.00 . A A . 827 TYR HA 1 1 4 3003 1 1 48 TYR HB2 H 14.023 0.803 -0.063 1.00 . A A . 827 TYR HB2 1 1 4 3004 1 1 48 TYR HB3 H 14.282 1.450 1.553 1.00 . A A . 827 TYR HB3 1 1 4 3005 1 1 48 TYR HD1 H 15.851 1.514 -1.844 1.00 . A A . 827 TYR HD1 1 1 4 3006 1 1 48 TYR HD2 H 15.031 3.624 1.758 1.00 . A A . 827 TYR HD2 1 1 4 3007 1 1 48 TYR HE1 H 16.829 3.546 -2.820 1.00 . A A . 827 TYR HE1 1 1 4 3008 1 1 48 TYR HE2 H 16.009 5.664 0.794 1.00 . A A . 827 TYR HE2 1 1 4 3009 1 1 48 TYR HH H 17.582 6.300 -0.961 1.00 . A A . 827 TYR HH 1 1 4 3010 1 1 48 TYR N N 15.114 -1.209 1.147 1.00 . A A . 827 TYR N 1 1 4 3011 1 1 48 TYR O O 17.011 1.595 2.306 1.00 . A A . 827 TYR O 1 1 4 3012 1 1 48 TYR OH O 17.026 5.865 -1.619 1.00 . A A . 827 TYR OH 1 1 4 3013 1 1 49 ASN C C 19.524 -0.162 3.288 1.00 . A A . 828 ASN C 1 1 4 3014 1 1 49 ASN CA C 18.126 -0.335 3.881 1.00 . A A . 828 ASN CA 1 1 4 3015 1 1 49 ASN CB C 18.098 -1.469 4.922 1.00 . A A . 828 ASN CB 1 1 4 3016 1 1 49 ASN CG C 19.015 -2.629 4.581 1.00 . A A . 828 ASN CG 1 1 4 3017 1 1 49 ASN H H 16.853 -1.485 2.636 1.00 . A A . 828 ASN H 1 1 4 3018 1 1 49 ASN HA H 17.845 0.590 4.365 1.00 . A A . 828 ASN HA 1 1 4 3019 1 1 49 ASN HB2 H 18.402 -1.073 5.878 1.00 . A A . 828 ASN HB2 1 1 4 3020 1 1 49 ASN HB3 H 17.087 -1.845 5.003 1.00 . A A . 828 ASN HB3 1 1 4 3021 1 1 49 ASN HD21 H 17.610 -3.440 3.437 1.00 . A A . 828 ASN HD21 1 1 4 3022 1 1 49 ASN HD22 H 19.111 -4.298 3.512 1.00 . A A . 828 ASN HD22 1 1 4 3023 1 1 49 ASN N N 17.169 -0.574 2.809 1.00 . A A . 828 ASN N 1 1 4 3024 1 1 49 ASN ND2 N 18.532 -3.550 3.766 1.00 . A A . 828 ASN ND2 1 1 4 3025 1 1 49 ASN O O 19.918 -0.979 2.427 1.00 . A A . 828 ASN O 1 1 4 3026 1 1 49 ASN OXT O 20.216 0.808 3.656 1.00 . A A . 828 ASN OXT 1 1 4 3027 1 1 49 ASN OD1 O 20.151 -2.694 5.052 1.00 . A A . 828 ASN OD1 1 1 4 3028 2 2 1 ZN ZN ZN 8.073 -2.872 -3.147 1.00 . B A . 829 ZN ZN 1 1 5 3029 1 1 1 GLY C C -19.791 1.344 7.010 1.00 . A A . 1 GLY C 1 1 5 3030 1 1 1 GLY CA C -20.026 1.239 8.497 1.00 . A A . 1 GLY CA 1 1 5 3031 1 1 1 GLY H1 H -19.252 0.277 10.177 1.00 . A A . 1 GLY H1 1 1 5 3032 1 1 1 GLY H2 H -18.074 0.766 9.063 1.00 . A A . 1 GLY H2 1 1 5 3033 1 1 1 GLY H3 H -19.044 -0.585 8.731 1.00 . A A . 1 GLY H3 1 1 5 3034 1 1 1 GLY HA2 H -21.014 0.839 8.668 1.00 . A A . 1 GLY HA2 1 1 5 3035 1 1 1 GLY HA3 H -19.968 2.227 8.930 1.00 . A A . 1 GLY HA3 1 1 5 3036 1 1 1 GLY N N -19.031 0.364 9.162 1.00 . A A . 1 GLY N 1 1 5 3037 1 1 1 GLY O O -18.997 0.585 6.450 1.00 . A A . 1 GLY O 1 1 5 3038 1 1 2 THR C C -19.037 3.175 4.557 1.00 . A A . 2 THR C 1 1 5 3039 1 1 2 THR CA C -20.346 2.474 4.929 1.00 . A A . 2 THR CA 1 1 5 3040 1 1 2 THR CB C -21.539 3.272 4.375 1.00 . A A . 2 THR CB 1 1 5 3041 1 1 2 THR CG2 C -22.704 2.347 4.053 1.00 . A A . 2 THR CG2 1 1 5 3042 1 1 2 THR H H -21.075 2.874 6.875 1.00 . A A . 2 THR H 1 1 5 3043 1 1 2 THR HA H -20.355 1.496 4.471 1.00 . A A . 2 THR HA 1 1 5 3044 1 1 2 THR HB H -21.227 3.764 3.464 1.00 . A A . 2 THR HB 1 1 5 3045 1 1 2 THR HG1 H -22.900 4.420 5.247 1.00 . A A . 2 THR HG1 1 1 5 3046 1 1 2 THR HG21 H -23.540 2.931 3.700 1.00 . A A . 2 THR HG21 1 1 5 3047 1 1 2 THR HG22 H -22.990 1.804 4.942 1.00 . A A . 2 THR HG22 1 1 5 3048 1 1 2 THR HG23 H -22.405 1.647 3.285 1.00 . A A . 2 THR HG23 1 1 5 3049 1 1 2 THR N N -20.468 2.287 6.369 1.00 . A A . 2 THR N 1 1 5 3050 1 1 2 THR O O -19.030 4.314 4.089 1.00 . A A . 2 THR O 1 1 5 3051 1 1 2 THR OG1 O -21.944 4.271 5.326 1.00 . A A . 2 THR OG1 1 1 5 3052 1 1 3 ARG C C -15.690 1.823 4.110 1.00 . A A . 3 ARG C 1 1 5 3053 1 1 3 ARG CA C -16.617 2.988 4.419 1.00 . A A . 3 ARG CA 1 1 5 3054 1 1 3 ARG CB C -16.040 3.845 5.551 1.00 . A A . 3 ARG CB 1 1 5 3055 1 1 3 ARG CD C -15.206 3.948 7.913 1.00 . A A . 3 ARG CD 1 1 5 3056 1 1 3 ARG CG C -15.961 3.125 6.887 1.00 . A A . 3 ARG CG 1 1 5 3057 1 1 3 ARG CZ C -12.854 4.580 8.329 1.00 . A A . 3 ARG CZ 1 1 5 3058 1 1 3 ARG H H -18.005 1.595 5.196 1.00 . A A . 3 ARG H 1 1 5 3059 1 1 3 ARG HA H -16.723 3.596 3.531 1.00 . A A . 3 ARG HA 1 1 5 3060 1 1 3 ARG HB2 H -15.044 4.158 5.277 1.00 . A A . 3 ARG HB2 1 1 5 3061 1 1 3 ARG HB3 H -16.661 4.720 5.673 1.00 . A A . 3 ARG HB3 1 1 5 3062 1 1 3 ARG HD2 H -15.702 4.903 8.027 1.00 . A A . 3 ARG HD2 1 1 5 3063 1 1 3 ARG HD3 H -15.215 3.422 8.854 1.00 . A A . 3 ARG HD3 1 1 5 3064 1 1 3 ARG HE H -13.594 4.008 6.560 1.00 . A A . 3 ARG HE 1 1 5 3065 1 1 3 ARG HG2 H -16.963 2.948 7.251 1.00 . A A . 3 ARG HG2 1 1 5 3066 1 1 3 ARG HG3 H -15.452 2.183 6.750 1.00 . A A . 3 ARG HG3 1 1 5 3067 1 1 3 ARG HH11 H -14.062 4.772 9.953 1.00 . A A . 3 ARG HH11 1 1 5 3068 1 1 3 ARG HH12 H -12.381 5.156 10.217 1.00 . A A . 3 ARG HH12 1 1 5 3069 1 1 3 ARG HH21 H -11.419 4.524 6.899 1.00 . A A . 3 ARG HH21 1 1 5 3070 1 1 3 ARG HH22 H -10.874 5.015 8.476 1.00 . A A . 3 ARG HH22 1 1 5 3071 1 1 3 ARG N N -17.933 2.482 4.774 1.00 . A A . 3 ARG N 1 1 5 3072 1 1 3 ARG NE N -13.820 4.176 7.506 1.00 . A A . 3 ARG NE 1 1 5 3073 1 1 3 ARG NH1 N -13.121 4.859 9.600 1.00 . A A . 3 ARG NH1 1 1 5 3074 1 1 3 ARG NH2 N -11.619 4.720 7.865 1.00 . A A . 3 ARG NH2 1 1 5 3075 1 1 3 ARG O O -14.467 1.917 4.249 1.00 . A A . 3 ARG O 1 1 5 3076 1 1 4 GLY C C -15.447 -1.318 4.708 1.00 . A A . 783 GLY C 1 1 5 3077 1 1 4 GLY CA C -15.533 -0.489 3.447 1.00 . A A . 783 GLY CA 1 1 5 3078 1 1 4 GLY H H -17.253 0.739 3.484 1.00 . A A . 783 GLY H 1 1 5 3079 1 1 4 GLY HA2 H -16.019 -1.068 2.674 1.00 . A A . 783 GLY HA2 1 1 5 3080 1 1 4 GLY HA3 H -14.535 -0.233 3.125 1.00 . A A . 783 GLY HA3 1 1 5 3081 1 1 4 GLY N N -16.284 0.725 3.668 1.00 . A A . 783 GLY N 1 1 5 3082 1 1 4 GLY O O -15.530 -0.781 5.810 1.00 . A A . 783 GLY O 1 1 5 3083 1 1 5 VAL C C -13.803 -4.078 5.828 1.00 . A A . 784 VAL C 1 1 5 3084 1 1 5 VAL CA C -15.207 -3.510 5.707 1.00 . A A . 784 VAL CA 1 1 5 3085 1 1 5 VAL CB C -16.234 -4.660 5.618 1.00 . A A . 784 VAL CB 1 1 5 3086 1 1 5 VAL CG1 C -17.647 -4.124 5.781 1.00 . A A . 784 VAL CG1 1 1 5 3087 1 1 5 VAL CG2 C -16.102 -5.400 4.297 1.00 . A A . 784 VAL CG2 1 1 5 3088 1 1 5 VAL H H -15.229 -3.001 3.657 1.00 . A A . 784 VAL H 1 1 5 3089 1 1 5 VAL HA H -15.425 -2.928 6.592 1.00 . A A . 784 VAL HA 1 1 5 3090 1 1 5 VAL HB H -16.038 -5.356 6.422 1.00 . A A . 784 VAL HB 1 1 5 3091 1 1 5 VAL HG11 H -18.350 -4.940 5.720 1.00 . A A . 784 VAL HG11 1 1 5 3092 1 1 5 VAL HG12 H -17.853 -3.410 4.998 1.00 . A A . 784 VAL HG12 1 1 5 3093 1 1 5 VAL HG13 H -17.740 -3.643 6.743 1.00 . A A . 784 VAL HG13 1 1 5 3094 1 1 5 VAL HG21 H -16.340 -4.732 3.483 1.00 . A A . 784 VAL HG21 1 1 5 3095 1 1 5 VAL HG22 H -16.780 -6.240 4.286 1.00 . A A . 784 VAL HG22 1 1 5 3096 1 1 5 VAL HG23 H -15.088 -5.755 4.185 1.00 . A A . 784 VAL HG23 1 1 5 3097 1 1 5 VAL N N -15.292 -2.622 4.558 1.00 . A A . 784 VAL N 1 1 5 3098 1 1 5 VAL O O -13.528 -4.910 6.691 1.00 . A A . 784 VAL O 1 1 5 3099 1 1 6 ASP C C -11.406 -5.539 4.585 1.00 . A A . 785 ASP C 1 1 5 3100 1 1 6 ASP CA C -11.522 -4.047 4.885 1.00 . A A . 785 ASP CA 1 1 5 3101 1 1 6 ASP CB C -10.786 -3.703 6.185 1.00 . A A . 785 ASP CB 1 1 5 3102 1 1 6 ASP CG C -10.386 -2.240 6.264 1.00 . A A . 785 ASP CG 1 1 5 3103 1 1 6 ASP H H -13.224 -2.932 4.300 1.00 . A A . 785 ASP H 1 1 5 3104 1 1 6 ASP HA H -11.053 -3.506 4.075 1.00 . A A . 785 ASP HA 1 1 5 3105 1 1 6 ASP HB2 H -11.431 -3.925 7.022 1.00 . A A . 785 ASP HB2 1 1 5 3106 1 1 6 ASP HB3 H -9.893 -4.307 6.257 1.00 . A A . 785 ASP HB3 1 1 5 3107 1 1 6 ASP N N -12.923 -3.611 4.937 1.00 . A A . 785 ASP N 1 1 5 3108 1 1 6 ASP O O -10.327 -6.121 4.687 1.00 . A A . 785 ASP O 1 1 5 3109 1 1 6 ASP OD1 O -11.283 -1.364 6.261 1.00 . A A . 785 ASP OD1 1 1 5 3110 1 1 6 ASP OD2 O -9.171 -1.956 6.318 1.00 . A A . 785 ASP OD2 1 1 5 3111 1 1 7 SER C C -11.974 -7.704 2.414 1.00 . A A . 786 SER C 1 1 5 3112 1 1 7 SER CA C -12.529 -7.549 3.828 1.00 . A A . 786 SER CA 1 1 5 3113 1 1 7 SER CB C -13.951 -8.102 3.912 1.00 . A A . 786 SER CB 1 1 5 3114 1 1 7 SER H H -13.358 -5.651 4.206 1.00 . A A . 786 SER H 1 1 5 3115 1 1 7 SER HA H -11.899 -8.083 4.516 1.00 . A A . 786 SER HA 1 1 5 3116 1 1 7 SER HB2 H -14.597 -7.528 3.262 1.00 . A A . 786 SER HB2 1 1 5 3117 1 1 7 SER HB3 H -13.951 -9.135 3.600 1.00 . A A . 786 SER HB3 1 1 5 3118 1 1 7 SER HG H -13.921 -8.612 5.809 1.00 . A A . 786 SER HG 1 1 5 3119 1 1 7 SER N N -12.519 -6.151 4.212 1.00 . A A . 786 SER N 1 1 5 3120 1 1 7 SER O O -12.089 -6.783 1.605 1.00 . A A . 786 SER O 1 1 5 3121 1 1 7 SER OG O -14.446 -8.022 5.240 1.00 . A A . 786 SER OG 1 1 5 3122 1 1 8 PRO C C -11.685 -9.210 -0.382 1.00 . A A . 787 PRO C 1 1 5 3123 1 1 8 PRO CA C -10.716 -9.133 0.806 1.00 . A A . 787 PRO CA 1 1 5 3124 1 1 8 PRO CB C -10.030 -10.491 1.013 1.00 . A A . 787 PRO CB 1 1 5 3125 1 1 8 PRO CD C -11.273 -10.033 2.995 1.00 . A A . 787 PRO CD 1 1 5 3126 1 1 8 PRO CG C -10.048 -10.728 2.485 1.00 . A A . 787 PRO CG 1 1 5 3127 1 1 8 PRO HA H -9.964 -8.385 0.597 1.00 . A A . 787 PRO HA 1 1 5 3128 1 1 8 PRO HB2 H -10.582 -11.255 0.485 1.00 . A A . 787 PRO HB2 1 1 5 3129 1 1 8 PRO HB3 H -9.018 -10.445 0.632 1.00 . A A . 787 PRO HB3 1 1 5 3130 1 1 8 PRO HD2 H -12.140 -10.671 2.901 1.00 . A A . 787 PRO HD2 1 1 5 3131 1 1 8 PRO HD3 H -11.137 -9.723 4.021 1.00 . A A . 787 PRO HD3 1 1 5 3132 1 1 8 PRO HG2 H -10.107 -11.787 2.687 1.00 . A A . 787 PRO HG2 1 1 5 3133 1 1 8 PRO HG3 H -9.164 -10.308 2.936 1.00 . A A . 787 PRO HG3 1 1 5 3134 1 1 8 PRO N N -11.374 -8.871 2.103 1.00 . A A . 787 PRO N 1 1 5 3135 1 1 8 PRO O O -11.491 -9.992 -1.311 1.00 . A A . 787 PRO O 1 1 5 3136 1 1 9 SER C C -13.392 -6.947 -2.154 1.00 . A A . 788 SER C 1 1 5 3137 1 1 9 SER CA C -13.657 -8.270 -1.436 1.00 . A A . 788 SER CA 1 1 5 3138 1 1 9 SER CB C -15.091 -8.334 -0.895 1.00 . A A . 788 SER CB 1 1 5 3139 1 1 9 SER H H -12.845 -7.834 0.455 1.00 . A A . 788 SER H 1 1 5 3140 1 1 9 SER HA H -13.491 -9.087 -2.123 1.00 . A A . 788 SER HA 1 1 5 3141 1 1 9 SER HB2 H -15.213 -9.238 -0.319 1.00 . A A . 788 SER HB2 1 1 5 3142 1 1 9 SER HB3 H -15.270 -7.478 -0.263 1.00 . A A . 788 SER HB3 1 1 5 3143 1 1 9 SER HG H -16.471 -9.206 -1.993 1.00 . A A . 788 SER HG 1 1 5 3144 1 1 9 SER N N -12.719 -8.392 -0.341 1.00 . A A . 788 SER N 1 1 5 3145 1 1 9 SER O O -12.303 -6.382 -2.020 1.00 . A A . 788 SER O 1 1 5 3146 1 1 9 SER OG O -16.046 -8.334 -1.944 1.00 . A A . 788 SER OG 1 1 5 3147 1 1 10 ALA C C -13.940 -4.042 -2.617 1.00 . A A . 789 ALA C 1 1 5 3148 1 1 10 ALA CA C -14.223 -5.175 -3.598 1.00 . A A . 789 ALA CA 1 1 5 3149 1 1 10 ALA CB C -15.472 -4.870 -4.412 1.00 . A A . 789 ALA CB 1 1 5 3150 1 1 10 ALA H H -15.221 -6.941 -2.961 1.00 . A A . 789 ALA H 1 1 5 3151 1 1 10 ALA HA H -13.390 -5.265 -4.277 1.00 . A A . 789 ALA HA 1 1 5 3152 1 1 10 ALA HB1 H -16.324 -4.804 -3.752 1.00 . A A . 789 ALA HB1 1 1 5 3153 1 1 10 ALA HB2 H -15.635 -5.660 -5.131 1.00 . A A . 789 ALA HB2 1 1 5 3154 1 1 10 ALA HB3 H -15.345 -3.931 -4.929 1.00 . A A . 789 ALA HB3 1 1 5 3155 1 1 10 ALA N N -14.371 -6.445 -2.892 1.00 . A A . 789 ALA N 1 1 5 3156 1 1 10 ALA O O -13.306 -3.047 -2.963 1.00 . A A . 789 ALA O 1 1 5 3157 1 1 11 GLU C C -12.762 -2.994 0.020 1.00 . A A . 790 GLU C 1 1 5 3158 1 1 11 GLU CA C -14.226 -3.218 -0.338 1.00 . A A . 790 GLU CA 1 1 5 3159 1 1 11 GLU CB C -14.946 -3.626 0.936 1.00 . A A . 790 GLU CB 1 1 5 3160 1 1 11 GLU CD C -17.297 -2.787 0.484 1.00 . A A . 790 GLU CD 1 1 5 3161 1 1 11 GLU CG C -16.415 -3.985 0.760 1.00 . A A . 790 GLU CG 1 1 5 3162 1 1 11 GLU H H -14.860 -5.055 -1.166 1.00 . A A . 790 GLU H 1 1 5 3163 1 1 11 GLU HA H -14.646 -2.291 -0.697 1.00 . A A . 790 GLU HA 1 1 5 3164 1 1 11 GLU HB2 H -14.440 -4.479 1.363 1.00 . A A . 790 GLU HB2 1 1 5 3165 1 1 11 GLU HB3 H -14.877 -2.800 1.624 1.00 . A A . 790 GLU HB3 1 1 5 3166 1 1 11 GLU HG2 H -16.503 -4.672 -0.068 1.00 . A A . 790 GLU HG2 1 1 5 3167 1 1 11 GLU HG3 H -16.762 -4.470 1.663 1.00 . A A . 790 GLU HG3 1 1 5 3168 1 1 11 GLU N N -14.392 -4.224 -1.380 1.00 . A A . 790 GLU N 1 1 5 3169 1 1 11 GLU O O -12.404 -1.928 0.521 1.00 . A A . 790 GLU O 1 1 5 3170 1 1 11 GLU OE1 O -17.544 -2.001 1.420 1.00 . A A . 790 GLU OE1 1 1 5 3171 1 1 11 GLU OE2 O -17.730 -2.619 -0.678 1.00 . A A . 790 GLU OE2 1 1 5 3172 1 1 12 LEU C C -9.772 -2.856 -0.513 1.00 . A A . 791 LEU C 1 1 5 3173 1 1 12 LEU CA C -10.543 -3.931 0.232 1.00 . A A . 791 LEU CA 1 1 5 3174 1 1 12 LEU CB C -9.878 -5.296 0.056 1.00 . A A . 791 LEU CB 1 1 5 3175 1 1 12 LEU CD1 C -8.173 -5.053 1.873 1.00 . A A . 791 LEU CD1 1 1 5 3176 1 1 12 LEU CD2 C -7.791 -6.681 0.010 1.00 . A A . 791 LEU CD2 1 1 5 3177 1 1 12 LEU CG C -8.395 -5.339 0.396 1.00 . A A . 791 LEU CG 1 1 5 3178 1 1 12 LEU H H -12.214 -4.775 -0.719 1.00 . A A . 791 LEU H 1 1 5 3179 1 1 12 LEU HA H -10.565 -3.676 1.269 1.00 . A A . 791 LEU HA 1 1 5 3180 1 1 12 LEU HB2 H -10.392 -6.008 0.686 1.00 . A A . 791 LEU HB2 1 1 5 3181 1 1 12 LEU HB3 H -9.998 -5.598 -0.973 1.00 . A A . 791 LEU HB3 1 1 5 3182 1 1 12 LEU HD11 H -8.551 -4.069 2.109 1.00 . A A . 791 LEU HD11 1 1 5 3183 1 1 12 LEU HD12 H -7.117 -5.096 2.095 1.00 . A A . 791 LEU HD12 1 1 5 3184 1 1 12 LEU HD13 H -8.695 -5.791 2.464 1.00 . A A . 791 LEU HD13 1 1 5 3185 1 1 12 LEU HD21 H -8.310 -7.472 0.531 1.00 . A A . 791 LEU HD21 1 1 5 3186 1 1 12 LEU HD22 H -6.747 -6.696 0.280 1.00 . A A . 791 LEU HD22 1 1 5 3187 1 1 12 LEU HD23 H -7.889 -6.826 -1.057 1.00 . A A . 791 LEU HD23 1 1 5 3188 1 1 12 LEU HG H -7.901 -4.571 -0.171 1.00 . A A . 791 LEU HG 1 1 5 3189 1 1 12 LEU N N -11.916 -3.990 -0.219 1.00 . A A . 791 LEU N 1 1 5 3190 1 1 12 LEU O O -8.851 -2.236 0.020 1.00 . A A . 791 LEU O 1 1 5 3191 1 1 13 ASP C C -10.568 -0.493 -2.812 1.00 . A A . 792 ASP C 1 1 5 3192 1 1 13 ASP CA C -9.573 -1.607 -2.567 1.00 . A A . 792 ASP CA 1 1 5 3193 1 1 13 ASP CB C -9.084 -2.193 -3.901 1.00 . A A . 792 ASP CB 1 1 5 3194 1 1 13 ASP CG C -10.211 -2.675 -4.798 1.00 . A A . 792 ASP CG 1 1 5 3195 1 1 13 ASP H H -10.950 -3.134 -2.070 1.00 . A A . 792 ASP H 1 1 5 3196 1 1 13 ASP HA H -8.729 -1.205 -2.026 1.00 . A A . 792 ASP HA 1 1 5 3197 1 1 13 ASP HB2 H -8.531 -1.433 -4.433 1.00 . A A . 792 ASP HB2 1 1 5 3198 1 1 13 ASP HB3 H -8.429 -3.029 -3.699 1.00 . A A . 792 ASP HB3 1 1 5 3199 1 1 13 ASP N N -10.188 -2.623 -1.732 1.00 . A A . 792 ASP N 1 1 5 3200 1 1 13 ASP O O -10.313 0.424 -3.592 1.00 . A A . 792 ASP O 1 1 5 3201 1 1 13 ASP OD1 O -10.750 -1.858 -5.577 1.00 . A A . 792 ASP OD1 1 1 5 3202 1 1 13 ASP OD2 O -10.548 -3.880 -4.746 1.00 . A A . 792 ASP OD2 1 1 5 3203 1 1 14 LYS C C -12.360 1.776 -1.781 1.00 . A A . 793 LYS C 1 1 5 3204 1 1 14 LYS CA C -12.767 0.399 -2.287 1.00 . A A . 793 LYS CA 1 1 5 3205 1 1 14 LYS CB C -14.037 -0.047 -1.567 1.00 . A A . 793 LYS CB 1 1 5 3206 1 1 14 LYS CD C -16.482 0.372 -1.160 1.00 . A A . 793 LYS CD 1 1 5 3207 1 1 14 LYS CE C -16.325 1.007 0.211 1.00 . A A . 793 LYS CE 1 1 5 3208 1 1 14 LYS CG C -15.289 0.676 -2.047 1.00 . A A . 793 LYS CG 1 1 5 3209 1 1 14 LYS H H -11.782 -1.258 -1.421 1.00 . A A . 793 LYS H 1 1 5 3210 1 1 14 LYS HA H -12.968 0.448 -3.337 1.00 . A A . 793 LYS HA 1 1 5 3211 1 1 14 LYS HB2 H -14.176 -1.107 -1.725 1.00 . A A . 793 LYS HB2 1 1 5 3212 1 1 14 LYS HB3 H -13.922 0.140 -0.510 1.00 . A A . 793 LYS HB3 1 1 5 3213 1 1 14 LYS HD2 H -17.376 0.761 -1.627 1.00 . A A . 793 LYS HD2 1 1 5 3214 1 1 14 LYS HD3 H -16.569 -0.699 -1.045 1.00 . A A . 793 LYS HD3 1 1 5 3215 1 1 14 LYS HE2 H -17.120 0.654 0.850 1.00 . A A . 793 LYS HE2 1 1 5 3216 1 1 14 LYS HE3 H -15.371 0.714 0.625 1.00 . A A . 793 LYS HE3 1 1 5 3217 1 1 14 LYS HG2 H -15.104 1.741 -2.035 1.00 . A A . 793 LYS HG2 1 1 5 3218 1 1 14 LYS HG3 H -15.511 0.360 -3.056 1.00 . A A . 793 LYS HG3 1 1 5 3219 1 1 14 LYS HZ1 H -16.244 2.907 1.083 1.00 . A A . 793 LYS HZ1 1 1 5 3220 1 1 14 LYS HZ2 H -17.315 2.795 -0.220 1.00 . A A . 793 LYS HZ2 1 1 5 3221 1 1 14 LYS HZ3 H -15.645 2.857 -0.500 1.00 . A A . 793 LYS HZ3 1 1 5 3222 1 1 14 LYS N N -11.686 -0.553 -2.094 1.00 . A A . 793 LYS N 1 1 5 3223 1 1 14 LYS NZ N -16.385 2.492 0.139 1.00 . A A . 793 LYS NZ 1 1 5 3224 1 1 14 LYS O O -12.938 2.791 -2.168 1.00 . A A . 793 LYS O 1 1 5 3225 1 1 15 LYS C C -10.164 3.886 -1.418 1.00 . A A . 794 LYS C 1 1 5 3226 1 1 15 LYS CA C -10.850 3.037 -0.352 1.00 . A A . 794 LYS CA 1 1 5 3227 1 1 15 LYS CB C -9.864 2.732 0.780 1.00 . A A . 794 LYS CB 1 1 5 3228 1 1 15 LYS CD C -9.333 1.406 2.842 1.00 . A A . 794 LYS CD 1 1 5 3229 1 1 15 LYS CE C -9.826 0.373 3.847 1.00 . A A . 794 LYS CE 1 1 5 3230 1 1 15 LYS CG C -10.421 1.820 1.865 1.00 . A A . 794 LYS CG 1 1 5 3231 1 1 15 LYS H H -10.912 0.955 -0.689 1.00 . A A . 794 LYS H 1 1 5 3232 1 1 15 LYS HA H -11.693 3.578 0.048 1.00 . A A . 794 LYS HA 1 1 5 3233 1 1 15 LYS HB2 H -8.992 2.254 0.358 1.00 . A A . 794 LYS HB2 1 1 5 3234 1 1 15 LYS HB3 H -9.564 3.663 1.238 1.00 . A A . 794 LYS HB3 1 1 5 3235 1 1 15 LYS HD2 H -8.515 0.980 2.284 1.00 . A A . 794 LYS HD2 1 1 5 3236 1 1 15 LYS HD3 H -8.991 2.280 3.375 1.00 . A A . 794 LYS HD3 1 1 5 3237 1 1 15 LYS HE2 H -10.296 -0.435 3.306 1.00 . A A . 794 LYS HE2 1 1 5 3238 1 1 15 LYS HE3 H -8.974 -0.012 4.392 1.00 . A A . 794 LYS HE3 1 1 5 3239 1 1 15 LYS HG2 H -11.198 2.345 2.401 1.00 . A A . 794 LYS HG2 1 1 5 3240 1 1 15 LYS HG3 H -10.833 0.936 1.401 1.00 . A A . 794 LYS HG3 1 1 5 3241 1 1 15 LYS HZ1 H -11.674 1.228 4.329 1.00 . A A . 794 LYS HZ1 1 1 5 3242 1 1 15 LYS HZ2 H -10.399 1.762 5.305 1.00 . A A . 794 LYS HZ2 1 1 5 3243 1 1 15 LYS HZ3 H -11.051 0.208 5.533 1.00 . A A . 794 LYS HZ3 1 1 5 3244 1 1 15 LYS N N -11.339 1.798 -0.934 1.00 . A A . 794 LYS N 1 1 5 3245 1 1 15 LYS NZ N -10.807 0.934 4.818 1.00 . A A . 794 LYS NZ 1 1 5 3246 1 1 15 LYS O O -10.192 5.115 -1.361 1.00 . A A . 794 LYS O 1 1 5 3247 1 1 16 ALA C C -7.715 4.708 -3.203 1.00 . A A . 795 ALA C 1 1 5 3248 1 1 16 ALA CA C -8.911 3.823 -3.551 1.00 . A A . 795 ALA CA 1 1 5 3249 1 1 16 ALA CB C -9.937 4.609 -4.347 1.00 . A A . 795 ALA CB 1 1 5 3250 1 1 16 ALA H H -9.491 2.223 -2.296 1.00 . A A . 795 ALA H 1 1 5 3251 1 1 16 ALA HA H -8.558 3.021 -4.184 1.00 . A A . 795 ALA HA 1 1 5 3252 1 1 16 ALA HB1 H -9.487 4.958 -5.264 1.00 . A A . 795 ALA HB1 1 1 5 3253 1 1 16 ALA HB2 H -10.272 5.453 -3.765 1.00 . A A . 795 ALA HB2 1 1 5 3254 1 1 16 ALA HB3 H -10.776 3.971 -4.579 1.00 . A A . 795 ALA HB3 1 1 5 3255 1 1 16 ALA N N -9.528 3.199 -2.375 1.00 . A A . 795 ALA N 1 1 5 3256 1 1 16 ALA O O -7.049 5.235 -4.097 1.00 . A A . 795 ALA O 1 1 5 3257 1 1 17 ASN C C -5.010 4.856 -1.614 1.00 . A A . 796 ASN C 1 1 5 3258 1 1 17 ASN CA C -6.303 5.651 -1.452 1.00 . A A . 796 ASN CA 1 1 5 3259 1 1 17 ASN CB C -6.507 6.117 0.009 1.00 . A A . 796 ASN CB 1 1 5 3260 1 1 17 ASN CG C -7.039 5.041 0.954 1.00 . A A . 796 ASN CG 1 1 5 3261 1 1 17 ASN H H -8.026 4.444 -1.251 1.00 . A A . 796 ASN H 1 1 5 3262 1 1 17 ASN HA H -6.243 6.525 -2.088 1.00 . A A . 796 ASN HA 1 1 5 3263 1 1 17 ASN HB2 H -5.563 6.462 0.399 1.00 . A A . 796 ASN HB2 1 1 5 3264 1 1 17 ASN HB3 H -7.207 6.944 0.013 1.00 . A A . 796 ASN HB3 1 1 5 3265 1 1 17 ASN HD21 H -5.892 3.647 0.126 1.00 . A A . 796 ASN HD21 1 1 5 3266 1 1 17 ASN HD22 H -6.904 3.119 1.428 1.00 . A A . 796 ASN HD22 1 1 5 3267 1 1 17 ASN N N -7.440 4.863 -1.912 1.00 . A A . 796 ASN N 1 1 5 3268 1 1 17 ASN ND2 N -6.566 3.811 0.821 1.00 . A A . 796 ASN ND2 1 1 5 3269 1 1 17 ASN O O -4.391 4.422 -0.639 1.00 . A A . 796 ASN O 1 1 5 3270 1 1 17 ASN OD1 O -7.852 5.327 1.831 1.00 . A A . 796 ASN OD1 1 1 5 3271 1 1 18 LEU C C -2.327 4.768 -3.648 1.00 . A A . 797 LEU C 1 1 5 3272 1 1 18 LEU CA C -3.457 3.853 -3.189 1.00 . A A . 797 LEU CA 1 1 5 3273 1 1 18 LEU CB C -3.775 2.846 -4.301 1.00 . A A . 797 LEU CB 1 1 5 3274 1 1 18 LEU CD1 C -5.384 1.303 -5.450 1.00 . A A . 797 LEU CD1 1 1 5 3275 1 1 18 LEU CD2 C -5.404 1.467 -2.966 1.00 . A A . 797 LEU CD2 1 1 5 3276 1 1 18 LEU CG C -5.178 2.226 -4.260 1.00 . A A . 797 LEU CG 1 1 5 3277 1 1 18 LEU H H -5.137 5.033 -3.604 1.00 . A A . 797 LEU H 1 1 5 3278 1 1 18 LEU HA H -3.141 3.319 -2.305 1.00 . A A . 797 LEU HA 1 1 5 3279 1 1 18 LEU HB2 H -3.656 3.348 -5.245 1.00 . A A . 797 LEU HB2 1 1 5 3280 1 1 18 LEU HB3 H -3.052 2.046 -4.247 1.00 . A A . 797 LEU HB3 1 1 5 3281 1 1 18 LEU HD11 H -6.384 0.896 -5.420 1.00 . A A . 797 LEU HD11 1 1 5 3282 1 1 18 LEU HD12 H -4.666 0.498 -5.410 1.00 . A A . 797 LEU HD12 1 1 5 3283 1 1 18 LEU HD13 H -5.250 1.859 -6.367 1.00 . A A . 797 LEU HD13 1 1 5 3284 1 1 18 LEU HD21 H -6.422 1.107 -2.938 1.00 . A A . 797 LEU HD21 1 1 5 3285 1 1 18 LEU HD22 H -5.232 2.127 -2.127 1.00 . A A . 797 LEU HD22 1 1 5 3286 1 1 18 LEU HD23 H -4.723 0.630 -2.913 1.00 . A A . 797 LEU HD23 1 1 5 3287 1 1 18 LEU HG H -5.913 3.015 -4.319 1.00 . A A . 797 LEU HG 1 1 5 3288 1 1 18 LEU N N -4.630 4.636 -2.865 1.00 . A A . 797 LEU N 1 1 5 3289 1 1 18 LEU O O -2.563 5.811 -4.261 1.00 . A A . 797 LEU O 1 1 5 3290 1 1 19 LEU C C 1.129 3.931 -3.984 1.00 . A A . 798 LEU C 1 1 5 3291 1 1 19 LEU CA C 0.097 5.022 -3.808 1.00 . A A . 798 LEU CA 1 1 5 3292 1 1 19 LEU CB C 0.546 6.160 -2.847 1.00 . A A . 798 LEU CB 1 1 5 3293 1 1 19 LEU CD1 C 0.070 4.880 -0.697 1.00 . A A . 798 LEU CD1 1 1 5 3294 1 1 19 LEU CD2 C 2.424 5.181 -1.483 1.00 . A A . 798 LEU CD2 1 1 5 3295 1 1 19 LEU CG C 1.039 5.792 -1.430 1.00 . A A . 798 LEU CG 1 1 5 3296 1 1 19 LEU H H -1.020 3.546 -2.803 1.00 . A A . 798 LEU H 1 1 5 3297 1 1 19 LEU HA H -0.084 5.434 -4.786 1.00 . A A . 798 LEU HA 1 1 5 3298 1 1 19 LEU HB2 H 1.345 6.697 -3.333 1.00 . A A . 798 LEU HB2 1 1 5 3299 1 1 19 LEU HB3 H -0.288 6.839 -2.738 1.00 . A A . 798 LEU HB3 1 1 5 3300 1 1 19 LEU HD11 H 0.463 4.647 0.281 1.00 . A A . 798 LEU HD11 1 1 5 3301 1 1 19 LEU HD12 H -0.059 3.966 -1.261 1.00 . A A . 798 LEU HD12 1 1 5 3302 1 1 19 LEU HD13 H -0.883 5.377 -0.594 1.00 . A A . 798 LEU HD13 1 1 5 3303 1 1 19 LEU HD21 H 2.671 4.757 -0.523 1.00 . A A . 798 LEU HD21 1 1 5 3304 1 1 19 LEU HD22 H 3.143 5.946 -1.738 1.00 . A A . 798 LEU HD22 1 1 5 3305 1 1 19 LEU HD23 H 2.439 4.407 -2.240 1.00 . A A . 798 LEU HD23 1 1 5 3306 1 1 19 LEU HG H 1.112 6.702 -0.852 1.00 . A A . 798 LEU HG 1 1 5 3307 1 1 19 LEU N N -1.116 4.358 -3.350 1.00 . A A . 798 LEU N 1 1 5 3308 1 1 19 LEU O O 0.821 2.773 -3.691 1.00 . A A . 798 LEU O 1 1 5 3309 1 1 20 LYS C C 4.637 3.314 -4.306 1.00 . A A . 799 LYS C 1 1 5 3310 1 1 20 LYS CA C 3.210 3.129 -4.795 1.00 . A A . 799 LYS CA 1 1 5 3311 1 1 20 LYS CB C 3.172 2.796 -6.293 1.00 . A A . 799 LYS CB 1 1 5 3312 1 1 20 LYS CD C 3.015 5.151 -7.239 1.00 . A A . 799 LYS CD 1 1 5 3313 1 1 20 LYS CE C 3.464 6.064 -8.373 1.00 . A A . 799 LYS CE 1 1 5 3314 1 1 20 LYS CG C 3.801 3.846 -7.215 1.00 . A A . 799 LYS CG 1 1 5 3315 1 1 20 LYS H H 2.609 5.161 -4.586 1.00 . A A . 799 LYS H 1 1 5 3316 1 1 20 LYS HA H 2.802 2.314 -4.223 1.00 . A A . 799 LYS HA 1 1 5 3317 1 1 20 LYS HB2 H 3.691 1.863 -6.449 1.00 . A A . 799 LYS HB2 1 1 5 3318 1 1 20 LYS HB3 H 2.140 2.668 -6.588 1.00 . A A . 799 LYS HB3 1 1 5 3319 1 1 20 LYS HD2 H 1.968 4.924 -7.369 1.00 . A A . 799 LYS HD2 1 1 5 3320 1 1 20 LYS HD3 H 3.159 5.662 -6.298 1.00 . A A . 799 LYS HD3 1 1 5 3321 1 1 20 LYS HE2 H 3.384 5.523 -9.303 1.00 . A A . 799 LYS HE2 1 1 5 3322 1 1 20 LYS HE3 H 2.806 6.921 -8.402 1.00 . A A . 799 LYS HE3 1 1 5 3323 1 1 20 LYS HG2 H 4.803 4.054 -6.870 1.00 . A A . 799 LYS HG2 1 1 5 3324 1 1 20 LYS HG3 H 3.845 3.446 -8.218 1.00 . A A . 799 LYS HG3 1 1 5 3325 1 1 20 LYS HZ1 H 5.177 7.024 -9.086 1.00 . A A . 799 LYS HZ1 1 1 5 3326 1 1 20 LYS HZ2 H 5.508 5.739 -8.033 1.00 . A A . 799 LYS HZ2 1 1 5 3327 1 1 20 LYS HZ3 H 4.933 7.213 -7.419 1.00 . A A . 799 LYS HZ3 1 1 5 3328 1 1 20 LYS N N 2.328 4.232 -4.468 1.00 . A A . 799 LYS N 1 1 5 3329 1 1 20 LYS NZ N 4.867 6.539 -8.213 1.00 . A A . 799 LYS NZ 1 1 5 3330 1 1 20 LYS O O 5.242 4.382 -4.403 1.00 . A A . 799 LYS O 1 1 5 3331 1 1 21 CYS C C 7.544 2.610 -4.117 1.00 . A A . 800 CYS C 1 1 5 3332 1 1 21 CYS CA C 6.457 2.041 -3.209 1.00 . A A . 800 CYS CA 1 1 5 3333 1 1 21 CYS CB C 6.646 0.536 -3.031 1.00 . A A . 800 CYS CB 1 1 5 3334 1 1 21 CYS H H 4.515 1.434 -3.694 1.00 . A A . 800 CYS H 1 1 5 3335 1 1 21 CYS HA H 6.494 2.514 -2.242 1.00 . A A . 800 CYS HA 1 1 5 3336 1 1 21 CYS HB2 H 5.950 0.184 -2.278 1.00 . A A . 800 CYS HB2 1 1 5 3337 1 1 21 CYS HB3 H 6.408 0.052 -3.968 1.00 . A A . 800 CYS HB3 1 1 5 3338 1 1 21 CYS N N 5.121 2.205 -3.760 1.00 . A A . 800 CYS N 1 1 5 3339 1 1 21 CYS O O 7.714 2.158 -5.242 1.00 . A A . 800 CYS O 1 1 5 3340 1 1 21 CYS SG S 8.280 -0.040 -2.532 1.00 . A A . 800 CYS SG 1 1 5 3341 1 1 22 GLU C C 10.509 3.250 -4.704 1.00 . A A . 801 GLU C 1 1 5 3342 1 1 22 GLU CA C 9.376 4.231 -4.339 1.00 . A A . 801 GLU CA 1 1 5 3343 1 1 22 GLU CB C 9.930 5.384 -3.492 1.00 . A A . 801 GLU CB 1 1 5 3344 1 1 22 GLU CD C 11.428 7.402 -3.342 1.00 . A A . 801 GLU CD 1 1 5 3345 1 1 22 GLU CG C 10.920 6.281 -4.219 1.00 . A A . 801 GLU CG 1 1 5 3346 1 1 22 GLU H H 8.036 3.958 -2.729 1.00 . A A . 801 GLU H 1 1 5 3347 1 1 22 GLU HA H 8.977 4.638 -5.256 1.00 . A A . 801 GLU HA 1 1 5 3348 1 1 22 GLU HB2 H 9.105 5.994 -3.161 1.00 . A A . 801 GLU HB2 1 1 5 3349 1 1 22 GLU HB3 H 10.426 4.969 -2.625 1.00 . A A . 801 GLU HB3 1 1 5 3350 1 1 22 GLU HG2 H 11.763 5.687 -4.539 1.00 . A A . 801 GLU HG2 1 1 5 3351 1 1 22 GLU HG3 H 10.433 6.710 -5.083 1.00 . A A . 801 GLU HG3 1 1 5 3352 1 1 22 GLU N N 8.275 3.596 -3.608 1.00 . A A . 801 GLU N 1 1 5 3353 1 1 22 GLU O O 11.472 3.632 -5.369 1.00 . A A . 801 GLU O 1 1 5 3354 1 1 22 GLU OE1 O 10.781 8.467 -3.290 1.00 . A A . 801 GLU OE1 1 1 5 3355 1 1 22 GLU OE2 O 12.493 7.233 -2.716 1.00 . A A . 801 GLU OE2 1 1 5 3356 1 1 23 TYR C C 11.025 0.113 -5.770 1.00 . A A . 802 TYR C 1 1 5 3357 1 1 23 TYR CA C 11.449 1.029 -4.618 1.00 . A A . 802 TYR CA 1 1 5 3358 1 1 23 TYR CB C 11.832 0.207 -3.381 1.00 . A A . 802 TYR CB 1 1 5 3359 1 1 23 TYR CD1 C 14.357 0.276 -3.451 1.00 . A A . 802 TYR CD1 1 1 5 3360 1 1 23 TYR CD2 C 13.283 -1.838 -3.661 1.00 . A A . 802 TYR CD2 1 1 5 3361 1 1 23 TYR CE1 C 15.592 -0.336 -3.564 1.00 . A A . 802 TYR CE1 1 1 5 3362 1 1 23 TYR CE2 C 14.513 -2.459 -3.775 1.00 . A A . 802 TYR CE2 1 1 5 3363 1 1 23 TYR CG C 13.185 -0.463 -3.494 1.00 . A A . 802 TYR CG 1 1 5 3364 1 1 23 TYR CZ C 15.677 -1.686 -3.673 1.00 . A A . 802 TYR CZ 1 1 5 3365 1 1 23 TYR H H 9.593 1.704 -3.832 1.00 . A A . 802 TYR H 1 1 5 3366 1 1 23 TYR HA H 12.312 1.594 -4.942 1.00 . A A . 802 TYR HA 1 1 5 3367 1 1 23 TYR HB2 H 11.857 0.852 -2.517 1.00 . A A . 802 TYR HB2 1 1 5 3368 1 1 23 TYR HB3 H 11.093 -0.566 -3.224 1.00 . A A . 802 TYR HB3 1 1 5 3369 1 1 23 TYR HD1 H 14.298 1.347 -3.321 1.00 . A A . 802 TYR HD1 1 1 5 3370 1 1 23 TYR HD2 H 12.379 -2.427 -3.696 1.00 . A A . 802 TYR HD2 1 1 5 3371 1 1 23 TYR HE1 H 16.493 0.258 -3.526 1.00 . A A . 802 TYR HE1 1 1 5 3372 1 1 23 TYR HE2 H 14.568 -3.529 -3.905 1.00 . A A . 802 TYR HE2 1 1 5 3373 1 1 23 TYR HH H 16.820 -3.076 -4.445 1.00 . A A . 802 TYR HH 1 1 5 3374 1 1 23 TYR N N 10.401 1.991 -4.303 1.00 . A A . 802 TYR N 1 1 5 3375 1 1 23 TYR O O 11.799 -0.119 -6.697 1.00 . A A . 802 TYR O 1 1 5 3376 1 1 23 TYR OH O 16.894 -2.316 -3.847 1.00 . A A . 802 TYR OH 1 1 5 3377 1 1 24 CYS C C 8.134 -0.741 -7.536 1.00 . A A . 803 CYS C 1 1 5 3378 1 1 24 CYS CA C 9.311 -1.316 -6.750 1.00 . A A . 803 CYS CA 1 1 5 3379 1 1 24 CYS CB C 8.930 -2.663 -6.136 1.00 . A A . 803 CYS CB 1 1 5 3380 1 1 24 CYS H H 9.238 -0.207 -4.940 1.00 . A A . 803 CYS H 1 1 5 3381 1 1 24 CYS HA H 10.094 -1.459 -7.477 1.00 . A A . 803 CYS HA 1 1 5 3382 1 1 24 CYS HB2 H 8.419 -3.258 -6.878 1.00 . A A . 803 CYS HB2 1 1 5 3383 1 1 24 CYS HB3 H 9.825 -3.177 -5.820 1.00 . A A . 803 CYS HB3 1 1 5 3384 1 1 24 CYS N N 9.803 -0.407 -5.712 1.00 . A A . 803 CYS N 1 1 5 3385 1 1 24 CYS O O 7.983 -1.037 -8.724 1.00 . A A . 803 CYS O 1 1 5 3386 1 1 24 CYS SG S 7.835 -2.520 -4.692 1.00 . A A . 803 CYS SG 1 1 5 3387 1 1 25 GLY C C 4.910 -0.068 -7.456 1.00 . A A . 804 GLY C 1 1 5 3388 1 1 25 GLY CA C 6.212 0.689 -7.609 1.00 . A A . 804 GLY CA 1 1 5 3389 1 1 25 GLY H H 7.444 0.260 -5.956 1.00 . A A . 804 GLY H 1 1 5 3390 1 1 25 GLY HA2 H 6.077 1.695 -7.234 1.00 . A A . 804 GLY HA2 1 1 5 3391 1 1 25 GLY HA3 H 6.465 0.739 -8.652 1.00 . A A . 804 GLY HA3 1 1 5 3392 1 1 25 GLY N N 7.307 0.069 -6.900 1.00 . A A . 804 GLY N 1 1 5 3393 1 1 25 GLY O O 4.043 -0.002 -8.325 1.00 . A A . 804 GLY O 1 1 5 3394 1 1 26 LYS C C 2.456 -0.524 -5.608 1.00 . A A . 805 LYS C 1 1 5 3395 1 1 26 LYS CA C 3.530 -1.499 -6.072 1.00 . A A . 805 LYS CA 1 1 5 3396 1 1 26 LYS CB C 3.739 -2.558 -4.985 1.00 . A A . 805 LYS CB 1 1 5 3397 1 1 26 LYS CD C 4.831 -4.674 -4.218 1.00 . A A . 805 LYS CD 1 1 5 3398 1 1 26 LYS CE C 5.746 -5.837 -4.571 1.00 . A A . 805 LYS CE 1 1 5 3399 1 1 26 LYS CG C 4.669 -3.694 -5.372 1.00 . A A . 805 LYS CG 1 1 5 3400 1 1 26 LYS H H 5.501 -0.828 -5.710 1.00 . A A . 805 LYS H 1 1 5 3401 1 1 26 LYS HA H 3.205 -1.980 -6.983 1.00 . A A . 805 LYS HA 1 1 5 3402 1 1 26 LYS HB2 H 4.150 -2.078 -4.109 1.00 . A A . 805 LYS HB2 1 1 5 3403 1 1 26 LYS HB3 H 2.778 -2.983 -4.729 1.00 . A A . 805 LYS HB3 1 1 5 3404 1 1 26 LYS HD2 H 5.250 -4.149 -3.374 1.00 . A A . 805 LYS HD2 1 1 5 3405 1 1 26 LYS HD3 H 3.858 -5.061 -3.953 1.00 . A A . 805 LYS HD3 1 1 5 3406 1 1 26 LYS HE2 H 6.707 -5.443 -4.866 1.00 . A A . 805 LYS HE2 1 1 5 3407 1 1 26 LYS HE3 H 5.867 -6.460 -3.695 1.00 . A A . 805 LYS HE3 1 1 5 3408 1 1 26 LYS HG2 H 4.258 -4.213 -6.225 1.00 . A A . 805 LYS HG2 1 1 5 3409 1 1 26 LYS HG3 H 5.637 -3.286 -5.625 1.00 . A A . 805 LYS HG3 1 1 5 3410 1 1 26 LYS HZ1 H 4.201 -6.883 -5.513 1.00 . A A . 805 LYS HZ1 1 1 5 3411 1 1 26 LYS HZ2 H 5.738 -7.557 -5.749 1.00 . A A . 805 LYS HZ2 1 1 5 3412 1 1 26 LYS HZ3 H 5.296 -6.150 -6.588 1.00 . A A . 805 LYS HZ3 1 1 5 3413 1 1 26 LYS N N 4.768 -0.785 -6.353 1.00 . A A . 805 LYS N 1 1 5 3414 1 1 26 LYS NZ N 5.207 -6.663 -5.682 1.00 . A A . 805 LYS NZ 1 1 5 3415 1 1 26 LYS O O 2.656 0.194 -4.627 1.00 . A A . 805 LYS O 1 1 5 3416 1 1 27 TYR C C -0.627 -0.427 -4.891 1.00 . A A . 806 TYR C 1 1 5 3417 1 1 27 TYR CA C 0.205 0.330 -5.901 1.00 . A A . 806 TYR CA 1 1 5 3418 1 1 27 TYR CB C -0.671 0.726 -7.092 1.00 . A A . 806 TYR CB 1 1 5 3419 1 1 27 TYR CD1 C 0.857 0.988 -9.084 1.00 . A A . 806 TYR CD1 1 1 5 3420 1 1 27 TYR CD2 C -0.187 2.939 -8.199 1.00 . A A . 806 TYR CD2 1 1 5 3421 1 1 27 TYR CE1 C 1.466 1.754 -10.058 1.00 . A A . 806 TYR CE1 1 1 5 3422 1 1 27 TYR CE2 C 0.423 3.710 -9.168 1.00 . A A . 806 TYR CE2 1 1 5 3423 1 1 27 TYR CG C 0.020 1.567 -8.140 1.00 . A A . 806 TYR CG 1 1 5 3424 1 1 27 TYR CZ C 1.248 3.113 -10.095 1.00 . A A . 806 TYR CZ 1 1 5 3425 1 1 27 TYR H H 1.214 -1.125 -7.050 1.00 . A A . 806 TYR H 1 1 5 3426 1 1 27 TYR HA H 0.589 1.214 -5.415 1.00 . A A . 806 TYR HA 1 1 5 3427 1 1 27 TYR HB2 H -1.026 -0.169 -7.576 1.00 . A A . 806 TYR HB2 1 1 5 3428 1 1 27 TYR HB3 H -1.520 1.287 -6.729 1.00 . A A . 806 TYR HB3 1 1 5 3429 1 1 27 TYR HD1 H 1.028 -0.077 -9.052 1.00 . A A . 806 TYR HD1 1 1 5 3430 1 1 27 TYR HD2 H -0.834 3.405 -7.471 1.00 . A A . 806 TYR HD2 1 1 5 3431 1 1 27 TYR HE1 H 2.113 1.285 -10.785 1.00 . A A . 806 TYR HE1 1 1 5 3432 1 1 27 TYR HE2 H 0.250 4.775 -9.198 1.00 . A A . 806 TYR HE2 1 1 5 3433 1 1 27 TYR HH H 1.579 3.549 -11.938 1.00 . A A . 806 TYR HH 1 1 5 3434 1 1 27 TYR N N 1.324 -0.511 -6.298 1.00 . A A . 806 TYR N 1 1 5 3435 1 1 27 TYR O O -1.076 -1.544 -5.150 1.00 . A A . 806 TYR O 1 1 5 3436 1 1 27 TYR OH O 1.847 3.876 -11.068 1.00 . A A . 806 TYR OH 1 1 5 3437 1 1 28 ALA C C -2.046 0.533 -1.675 1.00 . A A . 807 ALA C 1 1 5 3438 1 1 28 ALA CA C -1.461 -0.488 -2.634 1.00 . A A . 807 ALA CA 1 1 5 3439 1 1 28 ALA CB C -0.451 -1.389 -1.932 1.00 . A A . 807 ALA CB 1 1 5 3440 1 1 28 ALA H H -0.493 1.105 -3.630 1.00 . A A . 807 ALA H 1 1 5 3441 1 1 28 ALA HA H -2.255 -1.104 -3.027 1.00 . A A . 807 ALA HA 1 1 5 3442 1 1 28 ALA HB1 H -0.027 -2.079 -2.645 1.00 . A A . 807 ALA HB1 1 1 5 3443 1 1 28 ALA HB2 H -0.947 -1.942 -1.148 1.00 . A A . 807 ALA HB2 1 1 5 3444 1 1 28 ALA HB3 H 0.338 -0.785 -1.504 1.00 . A A . 807 ALA HB3 1 1 5 3445 1 1 28 ALA N N -0.814 0.180 -3.739 1.00 . A A . 807 ALA N 1 1 5 3446 1 1 28 ALA O O -1.688 1.713 -1.728 1.00 . A A . 807 ALA O 1 1 5 3447 1 1 29 PRO C C -2.567 1.516 1.175 1.00 . A A . 808 PRO C 1 1 5 3448 1 1 29 PRO CA C -3.585 1.001 0.170 1.00 . A A . 808 PRO CA 1 1 5 3449 1 1 29 PRO CB C -4.644 0.129 0.856 1.00 . A A . 808 PRO CB 1 1 5 3450 1 1 29 PRO CD C -3.454 -1.282 -0.667 1.00 . A A . 808 PRO CD 1 1 5 3451 1 1 29 PRO CG C -4.188 -1.275 0.643 1.00 . A A . 808 PRO CG 1 1 5 3452 1 1 29 PRO HA H -4.062 1.840 -0.317 1.00 . A A . 808 PRO HA 1 1 5 3453 1 1 29 PRO HB2 H -4.689 0.374 1.907 1.00 . A A . 808 PRO HB2 1 1 5 3454 1 1 29 PRO HB3 H -5.608 0.304 0.399 1.00 . A A . 808 PRO HB3 1 1 5 3455 1 1 29 PRO HD2 H -2.629 -1.978 -0.631 1.00 . A A . 808 PRO HD2 1 1 5 3456 1 1 29 PRO HD3 H -4.121 -1.531 -1.477 1.00 . A A . 808 PRO HD3 1 1 5 3457 1 1 29 PRO HG2 H -3.527 -1.571 1.445 1.00 . A A . 808 PRO HG2 1 1 5 3458 1 1 29 PRO HG3 H -5.042 -1.936 0.597 1.00 . A A . 808 PRO HG3 1 1 5 3459 1 1 29 PRO N N -2.964 0.105 -0.796 1.00 . A A . 808 PRO N 1 1 5 3460 1 1 29 PRO O O -1.763 0.751 1.708 1.00 . A A . 808 PRO O 1 1 5 3461 1 1 30 ALA C C -1.595 2.796 3.668 1.00 . A A . 809 ALA C 1 1 5 3462 1 1 30 ALA CA C -1.716 3.527 2.328 1.00 . A A . 809 ALA CA 1 1 5 3463 1 1 30 ALA CB C -2.227 4.940 2.557 1.00 . A A . 809 ALA CB 1 1 5 3464 1 1 30 ALA H H -3.201 3.370 0.822 1.00 . A A . 809 ALA H 1 1 5 3465 1 1 30 ALA HA H -0.745 3.603 1.859 1.00 . A A . 809 ALA HA 1 1 5 3466 1 1 30 ALA HB1 H -1.540 5.472 3.200 1.00 . A A . 809 ALA HB1 1 1 5 3467 1 1 30 ALA HB2 H -3.199 4.901 3.025 1.00 . A A . 809 ALA HB2 1 1 5 3468 1 1 30 ALA HB3 H -2.304 5.454 1.610 1.00 . A A . 809 ALA HB3 1 1 5 3469 1 1 30 ALA N N -2.596 2.832 1.379 1.00 . A A . 809 ALA N 1 1 5 3470 1 1 30 ALA O O -0.586 2.914 4.362 1.00 . A A . 809 ALA O 1 1 5 3471 1 1 31 GLU C C -1.541 0.256 5.293 1.00 . A A . 810 GLU C 1 1 5 3472 1 1 31 GLU CA C -2.694 1.266 5.239 1.00 . A A . 810 GLU CA 1 1 5 3473 1 1 31 GLU CB C -4.049 0.548 5.306 1.00 . A A . 810 GLU CB 1 1 5 3474 1 1 31 GLU CD C -4.090 -0.220 7.723 1.00 . A A . 810 GLU CD 1 1 5 3475 1 1 31 GLU CG C -4.104 -0.631 6.265 1.00 . A A . 810 GLU CG 1 1 5 3476 1 1 31 GLU H H -3.409 2.026 3.405 1.00 . A A . 810 GLU H 1 1 5 3477 1 1 31 GLU HA H -2.609 1.953 6.065 1.00 . A A . 810 GLU HA 1 1 5 3478 1 1 31 GLU HB2 H -4.801 1.260 5.611 1.00 . A A . 810 GLU HB2 1 1 5 3479 1 1 31 GLU HB3 H -4.296 0.187 4.317 1.00 . A A . 810 GLU HB3 1 1 5 3480 1 1 31 GLU HG2 H -5.007 -1.187 6.072 1.00 . A A . 810 GLU HG2 1 1 5 3481 1 1 31 GLU HG3 H -3.248 -1.261 6.077 1.00 . A A . 810 GLU HG3 1 1 5 3482 1 1 31 GLU N N -2.644 2.056 4.014 1.00 . A A . 810 GLU N 1 1 5 3483 1 1 31 GLU O O -0.959 0.010 6.351 1.00 . A A . 810 GLU O 1 1 5 3484 1 1 31 GLU OE1 O -5.112 0.303 8.212 1.00 . A A . 810 GLU OE1 1 1 5 3485 1 1 31 GLU OE2 O -3.047 -0.401 8.382 1.00 . A A . 810 GLU OE2 1 1 5 3486 1 1 32 GLN C C 1.188 -0.774 4.074 1.00 . A A . 811 GLN C 1 1 5 3487 1 1 32 GLN CA C -0.216 -1.358 4.055 1.00 . A A . 811 GLN CA 1 1 5 3488 1 1 32 GLN CB C -0.456 -2.180 2.788 1.00 . A A . 811 GLN CB 1 1 5 3489 1 1 32 GLN CD C 1.558 -3.153 1.554 1.00 . A A . 811 GLN CD 1 1 5 3490 1 1 32 GLN CG C 0.491 -3.364 2.621 1.00 . A A . 811 GLN CG 1 1 5 3491 1 1 32 GLN H H -1.578 0.058 3.309 1.00 . A A . 811 GLN H 1 1 5 3492 1 1 32 GLN HA H -0.344 -1.991 4.918 1.00 . A A . 811 GLN HA 1 1 5 3493 1 1 32 GLN HB2 H -1.469 -2.557 2.806 1.00 . A A . 811 GLN HB2 1 1 5 3494 1 1 32 GLN HB3 H -0.346 -1.527 1.941 1.00 . A A . 811 GLN HB3 1 1 5 3495 1 1 32 GLN HE21 H 0.292 -2.162 0.388 1.00 . A A . 811 GLN HE21 1 1 5 3496 1 1 32 GLN HE22 H 1.890 -2.340 -0.223 1.00 . A A . 811 GLN HE22 1 1 5 3497 1 1 32 GLN HG2 H 0.985 -3.544 3.564 1.00 . A A . 811 GLN HG2 1 1 5 3498 1 1 32 GLN HG3 H -0.093 -4.234 2.355 1.00 . A A . 811 GLN HG3 1 1 5 3499 1 1 32 GLN N N -1.195 -0.294 4.138 1.00 . A A . 811 GLN N 1 1 5 3500 1 1 32 GLN NE2 N 1.210 -2.484 0.466 1.00 . A A . 811 GLN NE2 1 1 5 3501 1 1 32 GLN O O 2.139 -1.433 4.490 1.00 . A A . 811 GLN O 1 1 5 3502 1 1 32 GLN OE1 O 2.681 -3.638 1.683 1.00 . A A . 811 GLN OE1 1 1 5 3503 1 1 33 PHE C C 2.975 1.573 5.062 1.00 . A A . 812 PHE C 1 1 5 3504 1 1 33 PHE CA C 2.571 1.197 3.640 1.00 . A A . 812 PHE CA 1 1 5 3505 1 1 33 PHE CB C 2.456 2.452 2.773 1.00 . A A . 812 PHE CB 1 1 5 3506 1 1 33 PHE CD1 C 1.304 1.648 0.696 1.00 . A A . 812 PHE CD1 1 1 5 3507 1 1 33 PHE CD2 C 3.583 2.316 0.545 1.00 . A A . 812 PHE CD2 1 1 5 3508 1 1 33 PHE CE1 C 1.301 1.340 -0.648 1.00 . A A . 812 PHE CE1 1 1 5 3509 1 1 33 PHE CE2 C 3.586 2.012 -0.800 1.00 . A A . 812 PHE CE2 1 1 5 3510 1 1 33 PHE CG C 2.445 2.139 1.307 1.00 . A A . 812 PHE CG 1 1 5 3511 1 1 33 PHE CZ C 2.444 1.521 -1.398 1.00 . A A . 812 PHE CZ 1 1 5 3512 1 1 33 PHE H H 0.569 0.857 3.093 1.00 . A A . 812 PHE H 1 1 5 3513 1 1 33 PHE HA H 3.325 0.560 3.198 1.00 . A A . 812 PHE HA 1 1 5 3514 1 1 33 PHE HB2 H 1.539 2.966 3.013 1.00 . A A . 812 PHE HB2 1 1 5 3515 1 1 33 PHE HB3 H 3.296 3.101 2.971 1.00 . A A . 812 PHE HB3 1 1 5 3516 1 1 33 PHE HD1 H 0.407 1.506 1.282 1.00 . A A . 812 PHE HD1 1 1 5 3517 1 1 33 PHE HD2 H 4.479 2.700 1.014 1.00 . A A . 812 PHE HD2 1 1 5 3518 1 1 33 PHE HE1 H 0.404 0.958 -1.112 1.00 . A A . 812 PHE HE1 1 1 5 3519 1 1 33 PHE HE2 H 4.483 2.156 -1.383 1.00 . A A . 812 PHE HE2 1 1 5 3520 1 1 33 PHE HZ H 2.445 1.281 -2.450 1.00 . A A . 812 PHE HZ 1 1 5 3521 1 1 33 PHE N N 1.309 0.466 3.599 1.00 . A A . 812 PHE N 1 1 5 3522 1 1 33 PHE O O 3.201 2.740 5.385 1.00 . A A . 812 PHE O 1 1 5 3523 1 1 34 ARG C C 5.052 0.790 7.334 1.00 . A A . 813 ARG C 1 1 5 3524 1 1 34 ARG CA C 3.536 0.691 7.269 1.00 . A A . 813 ARG CA 1 1 5 3525 1 1 34 ARG CB C 3.021 -0.484 8.100 1.00 . A A . 813 ARG CB 1 1 5 3526 1 1 34 ARG CD C 0.998 -1.503 9.214 1.00 . A A . 813 ARG CD 1 1 5 3527 1 1 34 ARG CG C 1.508 -0.472 8.226 1.00 . A A . 813 ARG CG 1 1 5 3528 1 1 34 ARG CZ C -0.975 -1.352 10.694 1.00 . A A . 813 ARG CZ 1 1 5 3529 1 1 34 ARG H H 2.851 -0.342 5.563 1.00 . A A . 813 ARG H 1 1 5 3530 1 1 34 ARG HA H 3.146 1.603 7.701 1.00 . A A . 813 ARG HA 1 1 5 3531 1 1 34 ARG HB2 H 3.320 -1.407 7.627 1.00 . A A . 813 ARG HB2 1 1 5 3532 1 1 34 ARG HB3 H 3.449 -0.434 9.088 1.00 . A A . 813 ARG HB3 1 1 5 3533 1 1 34 ARG HD2 H 1.167 -2.488 8.805 1.00 . A A . 813 ARG HD2 1 1 5 3534 1 1 34 ARG HD3 H 1.542 -1.398 10.142 1.00 . A A . 813 ARG HD3 1 1 5 3535 1 1 34 ARG HE H -1.022 -1.193 8.697 1.00 . A A . 813 ARG HE 1 1 5 3536 1 1 34 ARG HG2 H 1.194 0.507 8.556 1.00 . A A . 813 ARG HG2 1 1 5 3537 1 1 34 ARG HG3 H 1.080 -0.676 7.256 1.00 . A A . 813 ARG HG3 1 1 5 3538 1 1 34 ARG HH11 H 0.795 -1.554 11.673 1.00 . A A . 813 ARG HH11 1 1 5 3539 1 1 34 ARG HH12 H -0.621 -1.494 12.688 1.00 . A A . 813 ARG HH12 1 1 5 3540 1 1 34 ARG HH21 H -2.874 -1.071 10.021 1.00 . A A . 813 ARG HH21 1 1 5 3541 1 1 34 ARG HH22 H -2.704 -1.226 11.752 1.00 . A A . 813 ARG HH22 1 1 5 3542 1 1 34 ARG N N 3.087 0.556 5.894 1.00 . A A . 813 ARG N 1 1 5 3543 1 1 34 ARG NE N -0.433 -1.333 9.477 1.00 . A A . 813 ARG NE 1 1 5 3544 1 1 34 ARG NH1 N -0.205 -1.477 11.770 1.00 . A A . 813 ARG NH1 1 1 5 3545 1 1 34 ARG NH2 N -2.287 -1.204 10.836 1.00 . A A . 813 ARG NH2 1 1 5 3546 1 1 34 ARG O O 5.660 0.611 8.388 1.00 . A A . 813 ARG O 1 1 5 3547 1 1 35 GLY C C 7.040 3.066 6.245 1.00 . A A . 814 GLY C 1 1 5 3548 1 1 35 GLY CA C 7.014 1.554 6.167 1.00 . A A . 814 GLY CA 1 1 5 3549 1 1 35 GLY H H 5.145 1.013 5.358 1.00 . A A . 814 GLY H 1 1 5 3550 1 1 35 GLY HA2 H 7.551 1.138 7.007 1.00 . A A . 814 GLY HA2 1 1 5 3551 1 1 35 GLY HA3 H 7.481 1.239 5.246 1.00 . A A . 814 GLY HA3 1 1 5 3552 1 1 35 GLY N N 5.647 1.095 6.193 1.00 . A A . 814 GLY N 1 1 5 3553 1 1 35 GLY O O 7.855 3.720 5.596 1.00 . A A . 814 GLY O 1 1 5 3554 1 1 36 SER C C 5.618 5.738 5.854 1.00 . A A . 815 SER C 1 1 5 3555 1 1 36 SER CA C 5.921 5.049 7.187 1.00 . A A . 815 SER CA 1 1 5 3556 1 1 36 SER CB C 7.136 5.684 7.870 1.00 . A A . 815 SER CB 1 1 5 3557 1 1 36 SER H H 5.515 3.005 7.535 1.00 . A A . 815 SER H 1 1 5 3558 1 1 36 SER HA H 5.047 5.207 7.800 1.00 . A A . 815 SER HA 1 1 5 3559 1 1 36 SER HB2 H 7.999 5.591 7.228 1.00 . A A . 815 SER HB2 1 1 5 3560 1 1 36 SER HB3 H 6.938 6.729 8.061 1.00 . A A . 815 SER HB3 1 1 5 3561 1 1 36 SER HG H 8.025 5.584 9.621 1.00 . A A . 815 SER HG 1 1 5 3562 1 1 36 SER N N 6.102 3.608 7.028 1.00 . A A . 815 SER N 1 1 5 3563 1 1 36 SER O O 6.126 6.826 5.574 1.00 . A A . 815 SER O 1 1 5 3564 1 1 36 SER OG O 7.413 5.038 9.101 1.00 . A A . 815 SER OG 1 1 5 3565 1 1 37 LYS C C 5.340 6.175 2.918 1.00 . A A . 816 LYS C 1 1 5 3566 1 1 37 LYS CA C 4.218 5.686 3.826 1.00 . A A . 816 LYS CA 1 1 5 3567 1 1 37 LYS CB C 3.263 6.841 4.144 1.00 . A A . 816 LYS CB 1 1 5 3568 1 1 37 LYS CD C 1.917 5.576 5.877 1.00 . A A . 816 LYS CD 1 1 5 3569 1 1 37 LYS CE C 0.526 5.363 6.453 1.00 . A A . 816 LYS CE 1 1 5 3570 1 1 37 LYS CG C 1.874 6.415 4.610 1.00 . A A . 816 LYS CG 1 1 5 3571 1 1 37 LYS H H 4.490 4.177 5.290 1.00 . A A . 816 LYS H 1 1 5 3572 1 1 37 LYS HA H 3.668 4.909 3.306 1.00 . A A . 816 LYS HA 1 1 5 3573 1 1 37 LYS HB2 H 3.705 7.445 4.921 1.00 . A A . 816 LYS HB2 1 1 5 3574 1 1 37 LYS HB3 H 3.148 7.445 3.257 1.00 . A A . 816 LYS HB3 1 1 5 3575 1 1 37 LYS HD2 H 2.349 4.613 5.645 1.00 . A A . 816 LYS HD2 1 1 5 3576 1 1 37 LYS HD3 H 2.530 6.081 6.612 1.00 . A A . 816 LYS HD3 1 1 5 3577 1 1 37 LYS HE2 H -0.113 4.962 5.680 1.00 . A A . 816 LYS HE2 1 1 5 3578 1 1 37 LYS HE3 H 0.594 4.658 7.269 1.00 . A A . 816 LYS HE3 1 1 5 3579 1 1 37 LYS HG2 H 1.284 7.300 4.802 1.00 . A A . 816 LYS HG2 1 1 5 3580 1 1 37 LYS HG3 H 1.407 5.838 3.826 1.00 . A A . 816 LYS HG3 1 1 5 3581 1 1 37 LYS HZ1 H 0.571 7.067 7.661 1.00 . A A . 816 LYS HZ1 1 1 5 3582 1 1 37 LYS HZ2 H -0.987 6.448 7.407 1.00 . A A . 816 LYS HZ2 1 1 5 3583 1 1 37 LYS HZ3 H -0.203 7.305 6.170 1.00 . A A . 816 LYS HZ3 1 1 5 3584 1 1 37 LYS N N 4.755 5.096 5.057 1.00 . A A . 816 LYS N 1 1 5 3585 1 1 37 LYS NZ N -0.064 6.632 6.956 1.00 . A A . 816 LYS NZ 1 1 5 3586 1 1 37 LYS O O 5.391 7.340 2.527 1.00 . A A . 816 LYS O 1 1 5 3587 1 1 38 ARG C C 7.606 4.314 0.889 1.00 . A A . 817 ARG C 1 1 5 3588 1 1 38 ARG CA C 7.373 5.535 1.742 1.00 . A A . 817 ARG CA 1 1 5 3589 1 1 38 ARG CB C 8.615 5.820 2.592 1.00 . A A . 817 ARG CB 1 1 5 3590 1 1 38 ARG CD C 9.152 8.200 2.010 1.00 . A A . 817 ARG CD 1 1 5 3591 1 1 38 ARG CG C 8.702 7.246 3.104 1.00 . A A . 817 ARG CG 1 1 5 3592 1 1 38 ARG CZ C 10.896 7.918 0.282 1.00 . A A . 817 ARG CZ 1 1 5 3593 1 1 38 ARG H H 6.110 4.350 2.926 1.00 . A A . 817 ARG H 1 1 5 3594 1 1 38 ARG HA H 7.159 6.381 1.105 1.00 . A A . 817 ARG HA 1 1 5 3595 1 1 38 ARG HB2 H 8.611 5.156 3.442 1.00 . A A . 817 ARG HB2 1 1 5 3596 1 1 38 ARG HB3 H 9.495 5.620 1.997 1.00 . A A . 817 ARG HB3 1 1 5 3597 1 1 38 ARG HD2 H 8.478 8.110 1.171 1.00 . A A . 817 ARG HD2 1 1 5 3598 1 1 38 ARG HD3 H 9.117 9.209 2.393 1.00 . A A . 817 ARG HD3 1 1 5 3599 1 1 38 ARG HE H 11.180 7.693 2.255 1.00 . A A . 817 ARG HE 1 1 5 3600 1 1 38 ARG HG2 H 7.729 7.551 3.460 1.00 . A A . 817 ARG HG2 1 1 5 3601 1 1 38 ARG HG3 H 9.412 7.281 3.917 1.00 . A A . 817 ARG HG3 1 1 5 3602 1 1 38 ARG HH11 H 9.067 8.413 -0.446 1.00 . A A . 817 ARG HH11 1 1 5 3603 1 1 38 ARG HH12 H 10.328 8.236 -1.640 1.00 . A A . 817 ARG HH12 1 1 5 3604 1 1 38 ARG HH21 H 12.830 7.426 0.667 1.00 . A A . 817 ARG HH21 1 1 5 3605 1 1 38 ARG HH22 H 12.431 7.632 -1.018 1.00 . A A . 817 ARG HH22 1 1 5 3606 1 1 38 ARG N N 6.228 5.263 2.593 1.00 . A A . 817 ARG N 1 1 5 3607 1 1 38 ARG NE N 10.514 7.907 1.559 1.00 . A A . 817 ARG NE 1 1 5 3608 1 1 38 ARG NH1 N 10.027 8.208 -0.675 1.00 . A A . 817 ARG NH1 1 1 5 3609 1 1 38 ARG NH2 N 12.152 7.641 -0.045 1.00 . A A . 817 ARG NH2 1 1 5 3610 1 1 38 ARG O O 7.843 4.398 -0.320 1.00 . A A . 817 ARG O 1 1 5 3611 1 1 39 PHE C C 6.463 1.022 1.387 1.00 . A A . 818 PHE C 1 1 5 3612 1 1 39 PHE CA C 7.588 1.896 0.890 1.00 . A A . 818 PHE CA 1 1 5 3613 1 1 39 PHE CB C 8.944 1.258 1.200 1.00 . A A . 818 PHE CB 1 1 5 3614 1 1 39 PHE CD1 C 10.493 2.168 -0.552 1.00 . A A . 818 PHE CD1 1 1 5 3615 1 1 39 PHE CD2 C 10.786 2.878 1.708 1.00 . A A . 818 PHE CD2 1 1 5 3616 1 1 39 PHE CE1 C 11.564 2.945 -0.937 1.00 . A A . 818 PHE CE1 1 1 5 3617 1 1 39 PHE CE2 C 11.862 3.654 1.328 1.00 . A A . 818 PHE CE2 1 1 5 3618 1 1 39 PHE CG C 10.090 2.128 0.774 1.00 . A A . 818 PHE CG 1 1 5 3619 1 1 39 PHE CZ C 12.163 3.788 -0.028 1.00 . A A . 818 PHE CZ 1 1 5 3620 1 1 39 PHE H H 7.340 3.185 2.508 1.00 . A A . 818 PHE H 1 1 5 3621 1 1 39 PHE HA H 7.511 2.037 -0.176 1.00 . A A . 818 PHE HA 1 1 5 3622 1 1 39 PHE HB2 H 9.025 1.085 2.264 1.00 . A A . 818 PHE HB2 1 1 5 3623 1 1 39 PHE HB3 H 9.025 0.317 0.677 1.00 . A A . 818 PHE HB3 1 1 5 3624 1 1 39 PHE HD1 H 9.956 1.589 -1.288 1.00 . A A . 818 PHE HD1 1 1 5 3625 1 1 39 PHE HD2 H 10.480 2.853 2.743 1.00 . A A . 818 PHE HD2 1 1 5 3626 1 1 39 PHE HE1 H 11.868 2.971 -1.974 1.00 . A A . 818 PHE HE1 1 1 5 3627 1 1 39 PHE HE2 H 12.398 4.235 2.063 1.00 . A A . 818 PHE HE2 1 1 5 3628 1 1 39 PHE HZ H 12.970 4.434 -0.339 1.00 . A A . 818 PHE HZ 1 1 5 3629 1 1 39 PHE N N 7.489 3.172 1.538 1.00 . A A . 818 PHE N 1 1 5 3630 1 1 39 PHE O O 5.854 1.325 2.417 1.00 . A A . 818 PHE O 1 1 5 3631 1 1 40 CYS C C 5.854 -1.797 2.280 1.00 . A A . 819 CYS C 1 1 5 3632 1 1 40 CYS CA C 5.231 -1.036 1.090 1.00 . A A . 819 CYS CA 1 1 5 3633 1 1 40 CYS CB C 4.803 -1.907 -0.103 1.00 . A A . 819 CYS CB 1 1 5 3634 1 1 40 CYS H H 6.677 -0.188 -0.167 1.00 . A A . 819 CYS H 1 1 5 3635 1 1 40 CYS HA H 4.375 -0.536 1.522 1.00 . A A . 819 CYS HA 1 1 5 3636 1 1 40 CYS HB2 H 4.597 -2.901 0.230 1.00 . A A . 819 CYS HB2 1 1 5 3637 1 1 40 CYS HB3 H 3.904 -1.489 -0.543 1.00 . A A . 819 CYS HB3 1 1 5 3638 1 1 40 CYS N N 6.166 -0.023 0.648 1.00 . A A . 819 CYS N 1 1 5 3639 1 1 40 CYS O O 6.734 -1.255 2.950 1.00 . A A . 819 CYS O 1 1 5 3640 1 1 40 CYS SG S 6.048 -2.025 -1.414 1.00 . A A . 819 CYS SG 1 1 5 3641 1 1 41 SER C C 7.129 -3.977 4.104 1.00 . A A . 820 SER C 1 1 5 3642 1 1 41 SER CA C 5.634 -3.628 3.868 1.00 . A A . 820 SER CA 1 1 5 3643 1 1 41 SER CB C 4.715 -4.848 3.968 1.00 . A A . 820 SER CB 1 1 5 3644 1 1 41 SER H H 4.968 -3.530 1.869 1.00 . A A . 820 SER H 1 1 5 3645 1 1 41 SER HA H 5.336 -2.916 4.623 1.00 . A A . 820 SER HA 1 1 5 3646 1 1 41 SER HB2 H 4.965 -5.425 4.843 1.00 . A A . 820 SER HB2 1 1 5 3647 1 1 41 SER HB3 H 3.688 -4.505 4.044 1.00 . A A . 820 SER HB3 1 1 5 3648 1 1 41 SER HG H 3.945 -5.982 2.559 1.00 . A A . 820 SER HG 1 1 5 3649 1 1 41 SER N N 5.399 -3.007 2.568 1.00 . A A . 820 SER N 1 1 5 3650 1 1 41 SER O O 8.025 -3.356 3.523 1.00 . A A . 820 SER O 1 1 5 3651 1 1 41 SER OG O 4.830 -5.671 2.815 1.00 . A A . 820 SER OG 1 1 5 3652 1 1 42 MET C C 9.814 -5.476 4.525 1.00 . A A . 821 MET C 1 1 5 3653 1 1 42 MET CA C 8.730 -5.126 5.530 1.00 . A A . 821 MET CA 1 1 5 3654 1 1 42 MET CB C 8.694 -6.197 6.621 1.00 . A A . 821 MET CB 1 1 5 3655 1 1 42 MET CE C 9.252 -3.251 8.186 1.00 . A A . 821 MET CE 1 1 5 3656 1 1 42 MET CG C 7.993 -5.759 7.900 1.00 . A A . 821 MET CG 1 1 5 3657 1 1 42 MET H H 6.732 -5.688 5.072 1.00 . A A . 821 MET H 1 1 5 3658 1 1 42 MET HA H 8.974 -4.193 6.008 1.00 . A A . 821 MET HA 1 1 5 3659 1 1 42 MET HB2 H 8.184 -7.067 6.238 1.00 . A A . 821 MET HB2 1 1 5 3660 1 1 42 MET HB3 H 9.710 -6.470 6.871 1.00 . A A . 821 MET HB3 1 1 5 3661 1 1 42 MET HE1 H 9.930 -3.375 7.356 1.00 . A A . 821 MET HE1 1 1 5 3662 1 1 42 MET HE2 H 9.653 -2.521 8.871 1.00 . A A . 821 MET HE2 1 1 5 3663 1 1 42 MET HE3 H 8.292 -2.912 7.821 1.00 . A A . 821 MET HE3 1 1 5 3664 1 1 42 MET HG2 H 7.150 -5.141 7.633 1.00 . A A . 821 MET HG2 1 1 5 3665 1 1 42 MET HG3 H 7.637 -6.641 8.413 1.00 . A A . 821 MET HG3 1 1 5 3666 1 1 42 MET N N 7.411 -4.997 4.907 1.00 . A A . 821 MET N 1 1 5 3667 1 1 42 MET O O 10.861 -4.831 4.501 1.00 . A A . 821 MET O 1 1 5 3668 1 1 42 MET SD S 9.049 -4.820 9.037 1.00 . A A . 821 MET SD 1 1 5 3669 1 1 43 THR C C 10.973 -5.663 1.840 1.00 . A A . 822 THR C 1 1 5 3670 1 1 43 THR CA C 10.461 -6.873 2.628 1.00 . A A . 822 THR CA 1 1 5 3671 1 1 43 THR CB C 9.736 -7.817 1.652 1.00 . A A . 822 THR CB 1 1 5 3672 1 1 43 THR CG2 C 10.722 -8.487 0.709 1.00 . A A . 822 THR CG2 1 1 5 3673 1 1 43 THR H H 8.738 -7.006 3.846 1.00 . A A . 822 THR H 1 1 5 3674 1 1 43 THR HA H 11.315 -7.397 3.029 1.00 . A A . 822 THR HA 1 1 5 3675 1 1 43 THR HB H 9.035 -7.239 1.066 1.00 . A A . 822 THR HB 1 1 5 3676 1 1 43 THR HG1 H 9.650 -9.367 2.878 1.00 . A A . 822 THR HG1 1 1 5 3677 1 1 43 THR HG21 H 11.278 -7.734 0.171 1.00 . A A . 822 THR HG21 1 1 5 3678 1 1 43 THR HG22 H 10.183 -9.106 0.007 1.00 . A A . 822 THR HG22 1 1 5 3679 1 1 43 THR HG23 H 11.404 -9.100 1.279 1.00 . A A . 822 THR HG23 1 1 5 3680 1 1 43 THR N N 9.553 -6.480 3.703 1.00 . A A . 822 THR N 1 1 5 3681 1 1 43 THR O O 12.178 -5.508 1.634 1.00 . A A . 822 THR O 1 1 5 3682 1 1 43 THR OG1 O 9.022 -8.820 2.391 1.00 . A A . 822 THR OG1 1 1 5 3683 1 1 44 CYS C C 11.145 -2.579 1.361 1.00 . A A . 823 CYS C 1 1 5 3684 1 1 44 CYS CA C 10.413 -3.672 0.583 1.00 . A A . 823 CYS CA 1 1 5 3685 1 1 44 CYS CB C 9.167 -3.133 -0.087 1.00 . A A . 823 CYS CB 1 1 5 3686 1 1 44 CYS H H 9.121 -4.961 1.650 1.00 . A A . 823 CYS H 1 1 5 3687 1 1 44 CYS HA H 11.080 -4.035 -0.182 1.00 . A A . 823 CYS HA 1 1 5 3688 1 1 44 CYS HB2 H 8.410 -2.948 0.661 1.00 . A A . 823 CYS HB2 1 1 5 3689 1 1 44 CYS HB3 H 9.405 -2.211 -0.594 1.00 . A A . 823 CYS HB3 1 1 5 3690 1 1 44 CYS N N 10.060 -4.816 1.406 1.00 . A A . 823 CYS N 1 1 5 3691 1 1 44 CYS O O 12.232 -2.151 0.954 1.00 . A A . 823 CYS O 1 1 5 3692 1 1 44 CYS SG S 8.480 -4.278 -1.309 1.00 . A A . 823 CYS SG 1 1 5 3693 1 1 45 ALA C C 12.572 -1.455 3.722 1.00 . A A . 824 ALA C 1 1 5 3694 1 1 45 ALA CA C 11.162 -1.076 3.273 1.00 . A A . 824 ALA CA 1 1 5 3695 1 1 45 ALA CB C 10.292 -0.782 4.482 1.00 . A A . 824 ALA CB 1 1 5 3696 1 1 45 ALA H H 9.721 -2.533 2.784 1.00 . A A . 824 ALA H 1 1 5 3697 1 1 45 ALA HA H 11.208 -0.177 2.674 1.00 . A A . 824 ALA HA 1 1 5 3698 1 1 45 ALA HB1 H 10.731 0.023 5.051 1.00 . A A . 824 ALA HB1 1 1 5 3699 1 1 45 ALA HB2 H 10.223 -1.666 5.099 1.00 . A A . 824 ALA HB2 1 1 5 3700 1 1 45 ALA HB3 H 9.304 -0.495 4.153 1.00 . A A . 824 ALA HB3 1 1 5 3701 1 1 45 ALA N N 10.558 -2.128 2.469 1.00 . A A . 824 ALA N 1 1 5 3702 1 1 45 ALA O O 13.509 -0.671 3.568 1.00 . A A . 824 ALA O 1 1 5 3703 1 1 46 LYS C C 15.073 -3.177 3.694 1.00 . A A . 825 LYS C 1 1 5 3704 1 1 46 LYS CA C 14.013 -3.113 4.784 1.00 . A A . 825 LYS CA 1 1 5 3705 1 1 46 LYS CB C 13.902 -4.491 5.460 1.00 . A A . 825 LYS CB 1 1 5 3706 1 1 46 LYS CD C 13.780 -6.999 5.220 1.00 . A A . 825 LYS CD 1 1 5 3707 1 1 46 LYS CE C 15.052 -7.262 6.024 1.00 . A A . 825 LYS CE 1 1 5 3708 1 1 46 LYS CG C 13.824 -5.663 4.491 1.00 . A A . 825 LYS CG 1 1 5 3709 1 1 46 LYS H H 11.963 -3.294 4.283 1.00 . A A . 825 LYS H 1 1 5 3710 1 1 46 LYS HA H 14.312 -2.394 5.533 1.00 . A A . 825 LYS HA 1 1 5 3711 1 1 46 LYS HB2 H 14.765 -4.638 6.090 1.00 . A A . 825 LYS HB2 1 1 5 3712 1 1 46 LYS HB3 H 13.015 -4.505 6.076 1.00 . A A . 825 LYS HB3 1 1 5 3713 1 1 46 LYS HD2 H 12.936 -7.002 5.895 1.00 . A A . 825 LYS HD2 1 1 5 3714 1 1 46 LYS HD3 H 13.660 -7.787 4.492 1.00 . A A . 825 LYS HD3 1 1 5 3715 1 1 46 LYS HE2 H 15.216 -6.433 6.696 1.00 . A A . 825 LYS HE2 1 1 5 3716 1 1 46 LYS HE3 H 14.916 -8.167 6.600 1.00 . A A . 825 LYS HE3 1 1 5 3717 1 1 46 LYS HG2 H 12.931 -5.564 3.892 1.00 . A A . 825 LYS HG2 1 1 5 3718 1 1 46 LYS HG3 H 14.692 -5.644 3.848 1.00 . A A . 825 LYS HG3 1 1 5 3719 1 1 46 LYS HZ1 H 17.063 -7.750 5.722 1.00 . A A . 825 LYS HZ1 1 1 5 3720 1 1 46 LYS HZ2 H 16.502 -6.509 4.715 1.00 . A A . 825 LYS HZ2 1 1 5 3721 1 1 46 LYS HZ3 H 16.062 -8.114 4.403 1.00 . A A . 825 LYS HZ3 1 1 5 3722 1 1 46 LYS N N 12.729 -2.677 4.244 1.00 . A A . 825 LYS N 1 1 5 3723 1 1 46 LYS NZ N 16.250 -7.420 5.155 1.00 . A A . 825 LYS NZ 1 1 5 3724 1 1 46 LYS O O 16.252 -2.954 3.956 1.00 . A A . 825 LYS O 1 1 5 3725 1 1 47 ARG C C 16.201 -2.357 0.946 1.00 . A A . 826 ARG C 1 1 5 3726 1 1 47 ARG CA C 15.614 -3.693 1.387 1.00 . A A . 826 ARG CA 1 1 5 3727 1 1 47 ARG CB C 14.945 -4.413 0.214 1.00 . A A . 826 ARG CB 1 1 5 3728 1 1 47 ARG CD C 15.184 -5.678 -1.934 1.00 . A A . 826 ARG CD 1 1 5 3729 1 1 47 ARG CG C 15.895 -4.818 -0.902 1.00 . A A . 826 ARG CG 1 1 5 3730 1 1 47 ARG CZ C 15.750 -6.981 -3.949 1.00 . A A . 826 ARG CZ 1 1 5 3731 1 1 47 ARG H H 13.701 -3.651 2.303 1.00 . A A . 826 ARG H 1 1 5 3732 1 1 47 ARG HA H 16.392 -4.322 1.797 1.00 . A A . 826 ARG HA 1 1 5 3733 1 1 47 ARG HB2 H 14.463 -5.305 0.584 1.00 . A A . 826 ARG HB2 1 1 5 3734 1 1 47 ARG HB3 H 14.194 -3.759 -0.205 1.00 . A A . 826 ARG HB3 1 1 5 3735 1 1 47 ARG HD2 H 14.852 -6.587 -1.458 1.00 . A A . 826 ARG HD2 1 1 5 3736 1 1 47 ARG HD3 H 14.326 -5.135 -2.303 1.00 . A A . 826 ARG HD3 1 1 5 3737 1 1 47 ARG HE H 16.875 -5.511 -3.178 1.00 . A A . 826 ARG HE 1 1 5 3738 1 1 47 ARG HG2 H 16.272 -3.929 -1.384 1.00 . A A . 826 ARG HG2 1 1 5 3739 1 1 47 ARG HG3 H 16.716 -5.380 -0.481 1.00 . A A . 826 ARG HG3 1 1 5 3740 1 1 47 ARG HH11 H 14.040 -7.553 -3.027 1.00 . A A . 826 ARG HH11 1 1 5 3741 1 1 47 ARG HH12 H 14.427 -8.436 -4.470 1.00 . A A . 826 ARG HH12 1 1 5 3742 1 1 47 ARG HH21 H 17.405 -6.671 -5.077 1.00 . A A . 826 ARG HH21 1 1 5 3743 1 1 47 ARG HH22 H 16.345 -7.924 -5.649 1.00 . A A . 826 ARG HH22 1 1 5 3744 1 1 47 ARG N N 14.658 -3.494 2.468 1.00 . A A . 826 ARG N 1 1 5 3745 1 1 47 ARG NE N 16.042 -6.028 -3.064 1.00 . A A . 826 ARG NE 1 1 5 3746 1 1 47 ARG NH1 N 14.652 -7.713 -3.802 1.00 . A A . 826 ARG NH1 1 1 5 3747 1 1 47 ARG NH2 N 16.566 -7.211 -4.969 1.00 . A A . 826 ARG NH2 1 1 5 3748 1 1 47 ARG O O 17.292 -2.294 0.382 1.00 . A A . 826 ARG O 1 1 5 3749 1 1 48 TYR C C 16.802 0.542 2.108 1.00 . A A . 827 TYR C 1 1 5 3750 1 1 48 TYR CA C 15.950 0.052 0.933 1.00 . A A . 827 TYR CA 1 1 5 3751 1 1 48 TYR CB C 14.780 0.998 0.645 1.00 . A A . 827 TYR CB 1 1 5 3752 1 1 48 TYR CD1 C 15.515 2.651 -1.121 1.00 . A A . 827 TYR CD1 1 1 5 3753 1 1 48 TYR CD2 C 15.250 3.436 1.114 1.00 . A A . 827 TYR CD2 1 1 5 3754 1 1 48 TYR CE1 C 15.903 3.914 -1.523 1.00 . A A . 827 TYR CE1 1 1 5 3755 1 1 48 TYR CE2 C 15.633 4.703 0.719 1.00 . A A . 827 TYR CE2 1 1 5 3756 1 1 48 TYR CG C 15.185 2.390 0.204 1.00 . A A . 827 TYR CG 1 1 5 3757 1 1 48 TYR CZ C 15.899 4.950 -0.612 1.00 . A A . 827 TYR CZ 1 1 5 3758 1 1 48 TYR H H 14.608 -1.408 1.695 1.00 . A A . 827 TYR H 1 1 5 3759 1 1 48 TYR HA H 16.597 -0.019 0.069 1.00 . A A . 827 TYR HA 1 1 5 3760 1 1 48 TYR HB2 H 14.171 0.574 -0.138 1.00 . A A . 827 TYR HB2 1 1 5 3761 1 1 48 TYR HB3 H 14.184 1.097 1.540 1.00 . A A . 827 TYR HB3 1 1 5 3762 1 1 48 TYR HD1 H 15.472 1.848 -1.843 1.00 . A A . 827 TYR HD1 1 1 5 3763 1 1 48 TYR HD2 H 14.995 3.250 2.148 1.00 . A A . 827 TYR HD2 1 1 5 3764 1 1 48 TYR HE1 H 16.156 4.097 -2.559 1.00 . A A . 827 TYR HE1 1 1 5 3765 1 1 48 TYR HE2 H 15.675 5.505 1.442 1.00 . A A . 827 TYR HE2 1 1 5 3766 1 1 48 TYR HH H 16.965 6.564 -0.341 1.00 . A A . 827 TYR HH 1 1 5 3767 1 1 48 TYR N N 15.464 -1.289 1.218 1.00 . A A . 827 TYR N 1 1 5 3768 1 1 48 TYR O O 17.525 1.530 1.993 1.00 . A A . 827 TYR O 1 1 5 3769 1 1 48 TYR OH O 16.347 6.197 -0.997 1.00 . A A . 827 TYR OH 1 1 5 3770 1 1 49 ASN C C 16.993 1.375 5.108 1.00 . A A . 828 ASN C 1 1 5 3771 1 1 49 ASN CA C 17.486 0.105 4.438 1.00 . A A . 828 ASN CA 1 1 5 3772 1 1 49 ASN CB C 18.993 0.209 4.138 1.00 . A A . 828 ASN CB 1 1 5 3773 1 1 49 ASN CG C 19.662 -1.140 3.936 1.00 . A A . 828 ASN CG 1 1 5 3774 1 1 49 ASN H H 16.070 -0.928 3.253 1.00 . A A . 828 ASN H 1 1 5 3775 1 1 49 ASN HA H 17.329 -0.718 5.121 1.00 . A A . 828 ASN HA 1 1 5 3776 1 1 49 ASN HB2 H 19.132 0.790 3.241 1.00 . A A . 828 ASN HB2 1 1 5 3777 1 1 49 ASN HB3 H 19.479 0.711 4.962 1.00 . A A . 828 ASN HB3 1 1 5 3778 1 1 49 ASN HD21 H 17.963 -1.933 3.287 1.00 . A A . 828 ASN HD21 1 1 5 3779 1 1 49 ASN HD22 H 19.323 -3.003 3.333 1.00 . A A . 828 ASN HD22 1 1 5 3780 1 1 49 ASN N N 16.707 -0.182 3.229 1.00 . A A . 828 ASN N 1 1 5 3781 1 1 49 ASN ND2 N 18.909 -2.123 3.471 1.00 . A A . 828 ASN ND2 1 1 5 3782 1 1 49 ASN O O 16.080 1.280 5.951 1.00 . A A . 828 ASN O 1 1 5 3783 1 1 49 ASN OXT O 17.511 2.465 4.791 1.00 . A A . 828 ASN OXT 1 1 5 3784 1 1 49 ASN OD1 O 20.852 -1.303 4.212 1.00 . A A . 828 ASN OD1 1 1 5 3785 2 2 1 ZN ZN ZN 8.151 -2.362 -2.466 1.00 . B A . 829 ZN ZN 1 1 6 3786 1 1 1 GLY C C -18.233 -8.871 -9.849 1.00 . A A . 1 GLY C 1 1 6 3787 1 1 1 GLY CA C -18.362 -9.130 -11.333 1.00 . A A . 1 GLY CA 1 1 6 3788 1 1 1 GLY H1 H -20.435 -9.311 -11.327 1.00 . A A . 1 GLY H1 1 1 6 3789 1 1 1 GLY H2 H -19.614 -10.793 -11.213 1.00 . A A . 1 GLY H2 1 1 6 3790 1 1 1 GLY H3 H -19.690 -9.969 -12.698 1.00 . A A . 1 GLY H3 1 1 6 3791 1 1 1 GLY HA2 H -17.517 -9.717 -11.662 1.00 . A A . 1 GLY HA2 1 1 6 3792 1 1 1 GLY HA3 H -18.358 -8.183 -11.855 1.00 . A A . 1 GLY HA3 1 1 6 3793 1 1 1 GLY N N -19.610 -9.852 -11.665 1.00 . A A . 1 GLY N 1 1 6 3794 1 1 1 GLY O O -19.214 -8.528 -9.185 1.00 . A A . 1 GLY O 1 1 6 3795 1 1 2 THR C C -16.375 -7.349 -7.687 1.00 . A A . 2 THR C 1 1 6 3796 1 1 2 THR CA C -16.777 -8.800 -7.915 1.00 . A A . 2 THR CA 1 1 6 3797 1 1 2 THR CB C -15.661 -9.721 -7.380 1.00 . A A . 2 THR CB 1 1 6 3798 1 1 2 THR CG2 C -15.525 -9.591 -5.869 1.00 . A A . 2 THR CG2 1 1 6 3799 1 1 2 THR H H -16.284 -9.309 -9.902 1.00 . A A . 2 THR H 1 1 6 3800 1 1 2 THR HA H -17.685 -9.007 -7.369 1.00 . A A . 2 THR HA 1 1 6 3801 1 1 2 THR HB H -14.724 -9.432 -7.837 1.00 . A A . 2 THR HB 1 1 6 3802 1 1 2 THR HG1 H -16.621 -11.433 -7.108 1.00 . A A . 2 THR HG1 1 1 6 3803 1 1 2 THR HG21 H -15.298 -8.566 -5.614 1.00 . A A . 2 THR HG21 1 1 6 3804 1 1 2 THR HG22 H -14.729 -10.233 -5.522 1.00 . A A . 2 THR HG22 1 1 6 3805 1 1 2 THR HG23 H -16.453 -9.881 -5.400 1.00 . A A . 2 THR HG23 1 1 6 3806 1 1 2 THR N N -17.028 -9.034 -9.324 1.00 . A A . 2 THR N 1 1 6 3807 1 1 2 THR O O -15.224 -6.975 -7.905 1.00 . A A . 2 THR O 1 1 6 3808 1 1 2 THR OG1 O -15.947 -11.086 -7.719 1.00 . A A . 2 THR OG1 1 1 6 3809 1 1 3 ARG C C -16.806 -5.014 -5.460 1.00 . A A . 3 ARG C 1 1 6 3810 1 1 3 ARG CA C -17.052 -5.143 -6.956 1.00 . A A . 3 ARG CA 1 1 6 3811 1 1 3 ARG CB C -18.206 -4.233 -7.390 1.00 . A A . 3 ARG CB 1 1 6 3812 1 1 3 ARG CD C -19.064 -1.886 -7.672 1.00 . A A . 3 ARG CD 1 1 6 3813 1 1 3 ARG CG C -17.916 -2.754 -7.188 1.00 . A A . 3 ARG CG 1 1 6 3814 1 1 3 ARG CZ C -19.646 0.516 -7.758 1.00 . A A . 3 ARG CZ 1 1 6 3815 1 1 3 ARG H H -18.252 -6.872 -7.188 1.00 . A A . 3 ARG H 1 1 6 3816 1 1 3 ARG HA H -16.155 -4.854 -7.484 1.00 . A A . 3 ARG HA 1 1 6 3817 1 1 3 ARG HB2 H -18.407 -4.398 -8.438 1.00 . A A . 3 ARG HB2 1 1 6 3818 1 1 3 ARG HB3 H -19.086 -4.487 -6.818 1.00 . A A . 3 ARG HB3 1 1 6 3819 1 1 3 ARG HD2 H -19.254 -2.108 -8.712 1.00 . A A . 3 ARG HD2 1 1 6 3820 1 1 3 ARG HD3 H -19.943 -2.120 -7.088 1.00 . A A . 3 ARG HD3 1 1 6 3821 1 1 3 ARG HE H -17.849 -0.220 -7.255 1.00 . A A . 3 ARG HE 1 1 6 3822 1 1 3 ARG HG2 H -17.759 -2.566 -6.135 1.00 . A A . 3 ARG HG2 1 1 6 3823 1 1 3 ARG HG3 H -17.023 -2.493 -7.738 1.00 . A A . 3 ARG HG3 1 1 6 3824 1 1 3 ARG HH11 H -21.168 -0.735 -8.240 1.00 . A A . 3 ARG HH11 1 1 6 3825 1 1 3 ARG HH12 H -21.548 0.959 -8.307 1.00 . A A . 3 ARG HH12 1 1 6 3826 1 1 3 ARG HH21 H -18.345 2.020 -7.327 1.00 . A A . 3 ARG HH21 1 1 6 3827 1 1 3 ARG HH22 H -19.948 2.528 -7.786 1.00 . A A . 3 ARG HH22 1 1 6 3828 1 1 3 ARG N N -17.334 -6.531 -7.279 1.00 . A A . 3 ARG N 1 1 6 3829 1 1 3 ARG NE N -18.765 -0.461 -7.533 1.00 . A A . 3 ARG NE 1 1 6 3830 1 1 3 ARG NH1 N -20.884 0.222 -8.129 1.00 . A A . 3 ARG NH1 1 1 6 3831 1 1 3 ARG NH2 N -19.285 1.785 -7.612 1.00 . A A . 3 ARG NH2 1 1 6 3832 1 1 3 ARG O O -15.914 -4.287 -5.025 1.00 . A A . 3 ARG O 1 1 6 3833 1 1 4 GLY C C -18.633 -6.295 -2.515 1.00 . A A . 783 GLY C 1 1 6 3834 1 1 4 GLY CA C -17.429 -5.730 -3.238 1.00 . A A . 783 GLY CA 1 1 6 3835 1 1 4 GLY H H -18.294 -6.299 -5.083 1.00 . A A . 783 GLY H 1 1 6 3836 1 1 4 GLY HA2 H -16.561 -6.315 -2.978 1.00 . A A . 783 GLY HA2 1 1 6 3837 1 1 4 GLY HA3 H -17.274 -4.711 -2.914 1.00 . A A . 783 GLY HA3 1 1 6 3838 1 1 4 GLY N N -17.591 -5.744 -4.677 1.00 . A A . 783 GLY N 1 1 6 3839 1 1 4 GLY O O -19.711 -5.700 -2.535 1.00 . A A . 783 GLY O 1 1 6 3840 1 1 5 VAL C C -19.432 -7.763 0.336 1.00 . A A . 784 VAL C 1 1 6 3841 1 1 5 VAL CA C -19.530 -8.092 -1.150 1.00 . A A . 784 VAL CA 1 1 6 3842 1 1 5 VAL CB C -19.502 -9.626 -1.334 1.00 . A A . 784 VAL CB 1 1 6 3843 1 1 5 VAL CG1 C -20.703 -10.272 -0.656 1.00 . A A . 784 VAL CG1 1 1 6 3844 1 1 5 VAL CG2 C -19.454 -9.989 -2.809 1.00 . A A . 784 VAL CG2 1 1 6 3845 1 1 5 VAL H H -17.564 -7.857 -1.889 1.00 . A A . 784 VAL H 1 1 6 3846 1 1 5 VAL HA H -20.467 -7.717 -1.534 1.00 . A A . 784 VAL HA 1 1 6 3847 1 1 5 VAL HB H -18.607 -10.008 -0.863 1.00 . A A . 784 VAL HB 1 1 6 3848 1 1 5 VAL HG11 H -20.695 -10.033 0.397 1.00 . A A . 784 VAL HG11 1 1 6 3849 1 1 5 VAL HG12 H -20.654 -11.343 -0.783 1.00 . A A . 784 VAL HG12 1 1 6 3850 1 1 5 VAL HG13 H -21.612 -9.897 -1.102 1.00 . A A . 784 VAL HG13 1 1 6 3851 1 1 5 VAL HG21 H -20.324 -9.585 -3.308 1.00 . A A . 784 VAL HG21 1 1 6 3852 1 1 5 VAL HG22 H -19.445 -11.063 -2.916 1.00 . A A . 784 VAL HG22 1 1 6 3853 1 1 5 VAL HG23 H -18.562 -9.575 -3.253 1.00 . A A . 784 VAL HG23 1 1 6 3854 1 1 5 VAL N N -18.451 -7.443 -1.879 1.00 . A A . 784 VAL N 1 1 6 3855 1 1 5 VAL O O -18.770 -8.480 1.087 1.00 . A A . 784 VAL O 1 1 6 3856 1 1 6 ASP C C -18.704 -5.727 2.552 1.00 . A A . 785 ASP C 1 1 6 3857 1 1 6 ASP CA C -20.092 -6.188 2.117 1.00 . A A . 785 ASP CA 1 1 6 3858 1 1 6 ASP CB C -20.625 -7.254 3.080 1.00 . A A . 785 ASP CB 1 1 6 3859 1 1 6 ASP CG C -20.756 -6.731 4.499 1.00 . A A . 785 ASP CG 1 1 6 3860 1 1 6 ASP H H -20.586 -6.161 0.058 1.00 . A A . 785 ASP H 1 1 6 3861 1 1 6 ASP HA H -20.756 -5.334 2.154 1.00 . A A . 785 ASP HA 1 1 6 3862 1 1 6 ASP HB2 H -21.598 -7.581 2.744 1.00 . A A . 785 ASP HB2 1 1 6 3863 1 1 6 ASP HB3 H -19.949 -8.097 3.087 1.00 . A A . 785 ASP HB3 1 1 6 3864 1 1 6 ASP N N -20.086 -6.669 0.728 1.00 . A A . 785 ASP N 1 1 6 3865 1 1 6 ASP O O -17.770 -6.523 2.653 1.00 . A A . 785 ASP O 1 1 6 3866 1 1 6 ASP OD1 O -21.583 -5.824 4.737 1.00 . A A . 785 ASP OD1 1 1 6 3867 1 1 6 ASP OD2 O -20.015 -7.210 5.384 1.00 . A A . 785 ASP OD2 1 1 6 3868 1 1 7 SER C C -16.683 -4.532 4.388 1.00 . A A . 786 SER C 1 1 6 3869 1 1 7 SER CA C -17.304 -3.833 3.176 1.00 . A A . 786 SER CA 1 1 6 3870 1 1 7 SER CB C -17.510 -2.351 3.481 1.00 . A A . 786 SER CB 1 1 6 3871 1 1 7 SER H H -19.371 -3.851 2.722 1.00 . A A . 786 SER H 1 1 6 3872 1 1 7 SER HA H -16.634 -3.927 2.335 1.00 . A A . 786 SER HA 1 1 6 3873 1 1 7 SER HB2 H -18.163 -2.247 4.336 1.00 . A A . 786 SER HB2 1 1 6 3874 1 1 7 SER HB3 H -16.556 -1.894 3.697 1.00 . A A . 786 SER HB3 1 1 6 3875 1 1 7 SER HG H -17.398 -1.221 1.876 1.00 . A A . 786 SER HG 1 1 6 3876 1 1 7 SER N N -18.579 -4.431 2.801 1.00 . A A . 786 SER N 1 1 6 3877 1 1 7 SER O O -17.279 -4.569 5.463 1.00 . A A . 786 SER O 1 1 6 3878 1 1 7 SER OG O -18.099 -1.683 2.376 1.00 . A A . 786 SER OG 1 1 6 3879 1 1 8 PRO C C -14.139 -4.763 6.299 1.00 . A A . 787 PRO C 1 1 6 3880 1 1 8 PRO CA C -14.752 -5.759 5.319 1.00 . A A . 787 PRO CA 1 1 6 3881 1 1 8 PRO CB C -13.661 -6.545 4.589 1.00 . A A . 787 PRO CB 1 1 6 3882 1 1 8 PRO CD C -14.710 -5.131 2.959 1.00 . A A . 787 PRO CD 1 1 6 3883 1 1 8 PRO CG C -13.396 -5.762 3.346 1.00 . A A . 787 PRO CG 1 1 6 3884 1 1 8 PRO HA H -15.398 -6.440 5.854 1.00 . A A . 787 PRO HA 1 1 6 3885 1 1 8 PRO HB2 H -12.781 -6.608 5.213 1.00 . A A . 787 PRO HB2 1 1 6 3886 1 1 8 PRO HB3 H -14.019 -7.538 4.362 1.00 . A A . 787 PRO HB3 1 1 6 3887 1 1 8 PRO HD2 H -14.550 -4.135 2.574 1.00 . A A . 787 PRO HD2 1 1 6 3888 1 1 8 PRO HD3 H -15.221 -5.741 2.229 1.00 . A A . 787 PRO HD3 1 1 6 3889 1 1 8 PRO HG2 H -12.657 -5.000 3.542 1.00 . A A . 787 PRO HG2 1 1 6 3890 1 1 8 PRO HG3 H -13.055 -6.423 2.564 1.00 . A A . 787 PRO HG3 1 1 6 3891 1 1 8 PRO N N -15.468 -5.089 4.228 1.00 . A A . 787 PRO N 1 1 6 3892 1 1 8 PRO O O -13.644 -5.138 7.364 1.00 . A A . 787 PRO O 1 1 6 3893 1 1 9 SER C C -14.300 -1.101 6.282 1.00 . A A . 788 SER C 1 1 6 3894 1 1 9 SER CA C -13.647 -2.408 6.725 1.00 . A A . 788 SER CA 1 1 6 3895 1 1 9 SER CB C -12.124 -2.320 6.579 1.00 . A A . 788 SER CB 1 1 6 3896 1 1 9 SER H H -14.568 -3.278 5.046 1.00 . A A . 788 SER H 1 1 6 3897 1 1 9 SER HA H -13.900 -2.600 7.756 1.00 . A A . 788 SER HA 1 1 6 3898 1 1 9 SER HB2 H -11.871 -2.186 5.539 1.00 . A A . 788 SER HB2 1 1 6 3899 1 1 9 SER HB3 H -11.756 -1.479 7.149 1.00 . A A . 788 SER HB3 1 1 6 3900 1 1 9 SER HG H -12.172 -4.160 7.265 1.00 . A A . 788 SER HG 1 1 6 3901 1 1 9 SER N N -14.169 -3.496 5.914 1.00 . A A . 788 SER N 1 1 6 3902 1 1 9 SER O O -14.645 -0.940 5.111 1.00 . A A . 788 SER O 1 1 6 3903 1 1 9 SER OG O -11.493 -3.503 7.052 1.00 . A A . 788 SER OG 1 1 6 3904 1 1 10 ALA C C -14.224 2.060 6.255 1.00 . A A . 789 ALA C 1 1 6 3905 1 1 10 ALA CA C -15.155 1.077 6.954 1.00 . A A . 789 ALA CA 1 1 6 3906 1 1 10 ALA CB C -15.689 1.681 8.242 1.00 . A A . 789 ALA CB 1 1 6 3907 1 1 10 ALA H H -14.162 -0.374 8.139 1.00 . A A . 789 ALA H 1 1 6 3908 1 1 10 ALA HA H -15.995 0.876 6.306 1.00 . A A . 789 ALA HA 1 1 6 3909 1 1 10 ALA HB1 H -16.356 0.978 8.719 1.00 . A A . 789 ALA HB1 1 1 6 3910 1 1 10 ALA HB2 H -16.226 2.592 8.018 1.00 . A A . 789 ALA HB2 1 1 6 3911 1 1 10 ALA HB3 H -14.866 1.902 8.905 1.00 . A A . 789 ALA HB3 1 1 6 3912 1 1 10 ALA N N -14.484 -0.189 7.226 1.00 . A A . 789 ALA N 1 1 6 3913 1 1 10 ALA O O -14.627 2.755 5.320 1.00 . A A . 789 ALA O 1 1 6 3914 1 1 11 GLU C C -11.350 2.256 4.921 1.00 . A A . 790 GLU C 1 1 6 3915 1 1 11 GLU CA C -11.983 2.977 6.095 1.00 . A A . 790 GLU CA 1 1 6 3916 1 1 11 GLU CB C -10.902 3.370 7.099 1.00 . A A . 790 GLU CB 1 1 6 3917 1 1 11 GLU CD C -12.113 5.474 7.791 1.00 . A A . 790 GLU CD 1 1 6 3918 1 1 11 GLU CG C -11.413 4.215 8.252 1.00 . A A . 790 GLU CG 1 1 6 3919 1 1 11 GLU H H -12.727 1.568 7.488 1.00 . A A . 790 GLU H 1 1 6 3920 1 1 11 GLU HA H -12.479 3.868 5.739 1.00 . A A . 790 GLU HA 1 1 6 3921 1 1 11 GLU HB2 H -10.468 2.469 7.508 1.00 . A A . 790 GLU HB2 1 1 6 3922 1 1 11 GLU HB3 H -10.134 3.924 6.581 1.00 . A A . 790 GLU HB3 1 1 6 3923 1 1 11 GLU HG2 H -12.111 3.625 8.829 1.00 . A A . 790 GLU HG2 1 1 6 3924 1 1 11 GLU HG3 H -10.576 4.493 8.876 1.00 . A A . 790 GLU HG3 1 1 6 3925 1 1 11 GLU N N -12.982 2.121 6.715 1.00 . A A . 790 GLU N 1 1 6 3926 1 1 11 GLU O O -11.284 2.782 3.806 1.00 . A A . 790 GLU O 1 1 6 3927 1 1 11 GLU OE1 O -11.431 6.376 7.265 1.00 . A A . 790 GLU OE1 1 1 6 3928 1 1 11 GLU OE2 O -13.348 5.567 7.950 1.00 . A A . 790 GLU OE2 1 1 6 3929 1 1 12 LEU C C -11.417 -0.484 3.330 1.00 . A A . 791 LEU C 1 1 6 3930 1 1 12 LEU CA C -10.322 0.210 4.131 1.00 . A A . 791 LEU CA 1 1 6 3931 1 1 12 LEU CB C -9.370 -0.823 4.737 1.00 . A A . 791 LEU CB 1 1 6 3932 1 1 12 LEU CD1 C -7.291 -1.344 6.026 1.00 . A A . 791 LEU CD1 1 1 6 3933 1 1 12 LEU CD2 C -7.329 0.590 4.443 1.00 . A A . 791 LEU CD2 1 1 6 3934 1 1 12 LEU CG C -8.141 -0.237 5.427 1.00 . A A . 791 LEU CG 1 1 6 3935 1 1 12 LEU H H -10.979 0.677 6.087 1.00 . A A . 791 LEU H 1 1 6 3936 1 1 12 LEU HA H -9.765 0.863 3.476 1.00 . A A . 791 LEU HA 1 1 6 3937 1 1 12 LEU HB2 H -9.921 -1.409 5.459 1.00 . A A . 791 LEU HB2 1 1 6 3938 1 1 12 LEU HB3 H -9.034 -1.478 3.947 1.00 . A A . 791 LEU HB3 1 1 6 3939 1 1 12 LEU HD11 H -6.415 -0.914 6.490 1.00 . A A . 791 LEU HD11 1 1 6 3940 1 1 12 LEU HD12 H -6.988 -2.028 5.248 1.00 . A A . 791 LEU HD12 1 1 6 3941 1 1 12 LEU HD13 H -7.867 -1.876 6.769 1.00 . A A . 791 LEU HD13 1 1 6 3942 1 1 12 LEU HD21 H -7.934 1.404 4.073 1.00 . A A . 791 LEU HD21 1 1 6 3943 1 1 12 LEU HD22 H -7.021 -0.033 3.618 1.00 . A A . 791 LEU HD22 1 1 6 3944 1 1 12 LEU HD23 H -6.457 0.987 4.941 1.00 . A A . 791 LEU HD23 1 1 6 3945 1 1 12 LEU HG H -8.460 0.412 6.228 1.00 . A A . 791 LEU HG 1 1 6 3946 1 1 12 LEU N N -10.909 1.033 5.173 1.00 . A A . 791 LEU N 1 1 6 3947 1 1 12 LEU O O -11.387 -1.698 3.130 1.00 . A A . 791 LEU O 1 1 6 3948 1 1 13 ASP C C -13.043 -0.695 0.742 1.00 . A A . 792 ASP C 1 1 6 3949 1 1 13 ASP CA C -13.507 -0.214 2.108 1.00 . A A . 792 ASP CA 1 1 6 3950 1 1 13 ASP CB C -14.587 0.860 1.943 1.00 . A A . 792 ASP CB 1 1 6 3951 1 1 13 ASP CG C -15.621 0.484 0.899 1.00 . A A . 792 ASP CG 1 1 6 3952 1 1 13 ASP H H -12.352 1.261 3.085 1.00 . A A . 792 ASP H 1 1 6 3953 1 1 13 ASP HA H -13.924 -1.050 2.646 1.00 . A A . 792 ASP HA 1 1 6 3954 1 1 13 ASP HB2 H -15.092 1.001 2.886 1.00 . A A . 792 ASP HB2 1 1 6 3955 1 1 13 ASP HB3 H -14.122 1.788 1.645 1.00 . A A . 792 ASP HB3 1 1 6 3956 1 1 13 ASP N N -12.388 0.301 2.884 1.00 . A A . 792 ASP N 1 1 6 3957 1 1 13 ASP O O -12.901 0.100 -0.188 1.00 . A A . 792 ASP O 1 1 6 3958 1 1 13 ASP OD1 O -16.260 -0.578 1.040 1.00 . A A . 792 ASP OD1 1 1 6 3959 1 1 13 ASP OD2 O -15.779 1.233 -0.087 1.00 . A A . 792 ASP OD2 1 1 6 3960 1 1 14 LYS C C -11.059 -2.172 -1.154 1.00 . A A . 793 LYS C 1 1 6 3961 1 1 14 LYS CA C -12.403 -2.648 -0.608 1.00 . A A . 793 LYS CA 1 1 6 3962 1 1 14 LYS CB C -13.502 -2.394 -1.633 1.00 . A A . 793 LYS CB 1 1 6 3963 1 1 14 LYS CD C -15.898 -2.823 -2.316 1.00 . A A . 793 LYS CD 1 1 6 3964 1 1 14 LYS CE C -16.350 -1.391 -2.532 1.00 . A A . 793 LYS CE 1 1 6 3965 1 1 14 LYS CG C -14.864 -2.940 -1.207 1.00 . A A . 793 LYS CG 1 1 6 3966 1 1 14 LYS H H -12.717 -2.522 1.483 1.00 . A A . 793 LYS H 1 1 6 3967 1 1 14 LYS HA H -12.342 -3.709 -0.420 1.00 . A A . 793 LYS HA 1 1 6 3968 1 1 14 LYS HB2 H -13.584 -1.325 -1.770 1.00 . A A . 793 LYS HB2 1 1 6 3969 1 1 14 LYS HB3 H -13.225 -2.852 -2.571 1.00 . A A . 793 LYS HB3 1 1 6 3970 1 1 14 LYS HD2 H -15.470 -3.195 -3.234 1.00 . A A . 793 LYS HD2 1 1 6 3971 1 1 14 LYS HD3 H -16.758 -3.424 -2.052 1.00 . A A . 793 LYS HD3 1 1 6 3972 1 1 14 LYS HE2 H -15.476 -0.760 -2.599 1.00 . A A . 793 LYS HE2 1 1 6 3973 1 1 14 LYS HE3 H -16.901 -1.337 -3.459 1.00 . A A . 793 LYS HE3 1 1 6 3974 1 1 14 LYS HG2 H -14.756 -3.980 -0.939 1.00 . A A . 793 LYS HG2 1 1 6 3975 1 1 14 LYS HG3 H -15.208 -2.381 -0.349 1.00 . A A . 793 LYS HG3 1 1 6 3976 1 1 14 LYS HZ1 H -16.658 -0.824 -0.541 1.00 . A A . 793 LYS HZ1 1 1 6 3977 1 1 14 LYS HZ2 H -18.007 -1.558 -1.261 1.00 . A A . 793 LYS HZ2 1 1 6 3978 1 1 14 LYS HZ3 H -17.596 0.040 -1.659 1.00 . A A . 793 LYS HZ3 1 1 6 3979 1 1 14 LYS N N -12.735 -1.991 0.658 1.00 . A A . 793 LYS N 1 1 6 3980 1 1 14 LYS NZ N -17.213 -0.901 -1.425 1.00 . A A . 793 LYS NZ 1 1 6 3981 1 1 14 LYS O O -10.574 -2.668 -2.168 1.00 . A A . 793 LYS O 1 1 6 3982 1 1 15 LYS C C -9.336 0.366 -1.963 1.00 . A A . 794 LYS C 1 1 6 3983 1 1 15 LYS CA C -9.205 -0.584 -0.779 1.00 . A A . 794 LYS CA 1 1 6 3984 1 1 15 LYS CB C -8.087 -1.615 -1.030 1.00 . A A . 794 LYS CB 1 1 6 3985 1 1 15 LYS CD C -8.476 -3.515 0.627 1.00 . A A . 794 LYS CD 1 1 6 3986 1 1 15 LYS CE C -8.182 -4.762 -0.202 1.00 . A A . 794 LYS CE 1 1 6 3987 1 1 15 LYS CG C -7.596 -2.334 0.226 1.00 . A A . 794 LYS CG 1 1 6 3988 1 1 15 LYS H H -11.001 -0.840 0.300 1.00 . A A . 794 LYS H 1 1 6 3989 1 1 15 LYS HA H -8.925 0.009 0.079 1.00 . A A . 794 LYS HA 1 1 6 3990 1 1 15 LYS HB2 H -8.448 -2.359 -1.724 1.00 . A A . 794 LYS HB2 1 1 6 3991 1 1 15 LYS HB3 H -7.242 -1.104 -1.472 1.00 . A A . 794 LYS HB3 1 1 6 3992 1 1 15 LYS HD2 H -8.299 -3.742 1.669 1.00 . A A . 794 LYS HD2 1 1 6 3993 1 1 15 LYS HD3 H -9.511 -3.240 0.490 1.00 . A A . 794 LYS HD3 1 1 6 3994 1 1 15 LYS HE2 H -7.113 -4.858 -0.312 1.00 . A A . 794 LYS HE2 1 1 6 3995 1 1 15 LYS HE3 H -8.566 -5.624 0.326 1.00 . A A . 794 LYS HE3 1 1 6 3996 1 1 15 LYS HG2 H -6.598 -2.701 0.046 1.00 . A A . 794 LYS HG2 1 1 6 3997 1 1 15 LYS HG3 H -7.573 -1.624 1.041 1.00 . A A . 794 LYS HG3 1 1 6 3998 1 1 15 LYS HZ1 H -8.541 -5.564 -2.101 1.00 . A A . 794 LYS HZ1 1 1 6 3999 1 1 15 LYS HZ2 H -8.474 -3.872 -2.080 1.00 . A A . 794 LYS HZ2 1 1 6 4000 1 1 15 LYS HZ3 H -9.838 -4.674 -1.473 1.00 . A A . 794 LYS HZ3 1 1 6 4001 1 1 15 LYS N N -10.493 -1.196 -0.455 1.00 . A A . 794 LYS N 1 1 6 4002 1 1 15 LYS NZ N -8.799 -4.712 -1.556 1.00 . A A . 794 LYS NZ 1 1 6 4003 1 1 15 LYS O O -9.640 -0.044 -3.083 1.00 . A A . 794 LYS O 1 1 6 4004 1 1 16 ALA C C -8.567 3.969 -2.166 1.00 . A A . 795 ALA C 1 1 6 4005 1 1 16 ALA CA C -9.212 2.695 -2.692 1.00 . A A . 795 ALA CA 1 1 6 4006 1 1 16 ALA CB C -10.671 2.934 -3.048 1.00 . A A . 795 ALA CB 1 1 6 4007 1 1 16 ALA H H -8.832 1.891 -0.782 1.00 . A A . 795 ALA H 1 1 6 4008 1 1 16 ALA HA H -8.687 2.376 -3.585 1.00 . A A . 795 ALA HA 1 1 6 4009 1 1 16 ALA HB1 H -11.205 3.269 -2.171 1.00 . A A . 795 ALA HB1 1 1 6 4010 1 1 16 ALA HB2 H -11.105 2.011 -3.404 1.00 . A A . 795 ALA HB2 1 1 6 4011 1 1 16 ALA HB3 H -10.734 3.684 -3.820 1.00 . A A . 795 ALA HB3 1 1 6 4012 1 1 16 ALA N N -9.093 1.643 -1.693 1.00 . A A . 795 ALA N 1 1 6 4013 1 1 16 ALA O O -9.191 5.023 -2.065 1.00 . A A . 795 ALA O 1 1 6 4014 1 1 17 ASN C C -5.038 4.560 -1.516 1.00 . A A . 796 ASN C 1 1 6 4015 1 1 17 ASN CA C -6.494 4.918 -1.285 1.00 . A A . 796 ASN CA 1 1 6 4016 1 1 17 ASN CB C -6.778 5.143 0.218 1.00 . A A . 796 ASN CB 1 1 6 4017 1 1 17 ASN CG C -6.720 3.866 1.048 1.00 . A A . 796 ASN CG 1 1 6 4018 1 1 17 ASN H H -6.880 2.955 -1.934 1.00 . A A . 796 ASN H 1 1 6 4019 1 1 17 ASN HA H -6.732 5.815 -1.838 1.00 . A A . 796 ASN HA 1 1 6 4020 1 1 17 ASN HB2 H -6.049 5.835 0.614 1.00 . A A . 796 ASN HB2 1 1 6 4021 1 1 17 ASN HB3 H -7.764 5.573 0.327 1.00 . A A . 796 ASN HB3 1 1 6 4022 1 1 17 ASN HD21 H -8.697 3.658 0.925 1.00 . A A . 796 ASN HD21 1 1 6 4023 1 1 17 ASN HD22 H -7.862 2.448 1.835 1.00 . A A . 796 ASN HD22 1 1 6 4024 1 1 17 ASN N N -7.303 3.831 -1.818 1.00 . A A . 796 ASN N 1 1 6 4025 1 1 17 ASN ND2 N -7.874 3.259 1.289 1.00 . A A . 796 ASN ND2 1 1 6 4026 1 1 17 ASN O O -4.244 4.430 -0.583 1.00 . A A . 796 ASN O 1 1 6 4027 1 1 17 ASN OD1 O -5.657 3.437 1.496 1.00 . A A . 796 ASN OD1 1 1 6 4028 1 1 18 LEU C C -2.345 4.756 -3.381 1.00 . A A . 797 LEU C 1 1 6 4029 1 1 18 LEU CA C -3.447 3.736 -3.127 1.00 . A A . 797 LEU CA 1 1 6 4030 1 1 18 LEU CB C -3.645 2.871 -4.374 1.00 . A A . 797 LEU CB 1 1 6 4031 1 1 18 LEU CD1 C -5.057 1.307 -5.734 1.00 . A A . 797 LEU CD1 1 1 6 4032 1 1 18 LEU CD2 C -5.098 1.140 -3.248 1.00 . A A . 797 LEU CD2 1 1 6 4033 1 1 18 LEU CG C -4.961 2.084 -4.433 1.00 . A A . 797 LEU CG 1 1 6 4034 1 1 18 LEU H H -5.223 4.749 -3.512 1.00 . A A . 797 LEU H 1 1 6 4035 1 1 18 LEU HA H -3.153 3.099 -2.306 1.00 . A A . 797 LEU HA 1 1 6 4036 1 1 18 LEU HB2 H -3.593 3.514 -5.240 1.00 . A A . 797 LEU HB2 1 1 6 4037 1 1 18 LEU HB3 H -2.829 2.165 -4.426 1.00 . A A . 797 LEU HB3 1 1 6 4038 1 1 18 LEU HD11 H -5.992 0.769 -5.763 1.00 . A A . 797 LEU HD11 1 1 6 4039 1 1 18 LEU HD12 H -4.236 0.607 -5.795 1.00 . A A . 797 LEU HD12 1 1 6 4040 1 1 18 LEU HD13 H -5.009 1.991 -6.568 1.00 . A A . 797 LEU HD13 1 1 6 4041 1 1 18 LEU HD21 H -4.324 0.386 -3.294 1.00 . A A . 797 LEU HD21 1 1 6 4042 1 1 18 LEU HD22 H -6.068 0.664 -3.277 1.00 . A A . 797 LEU HD22 1 1 6 4043 1 1 18 LEU HD23 H -5.001 1.700 -2.328 1.00 . A A . 797 LEU HD23 1 1 6 4044 1 1 18 LEU HG H -5.786 2.781 -4.400 1.00 . A A . 797 LEU HG 1 1 6 4045 1 1 18 LEU N N -4.690 4.377 -2.778 1.00 . A A . 797 LEU N 1 1 6 4046 1 1 18 LEU O O -2.586 5.872 -3.852 1.00 . A A . 797 LEU O 1 1 6 4047 1 1 19 LEU C C 1.096 3.969 -3.622 1.00 . A A . 798 LEU C 1 1 6 4048 1 1 19 LEU CA C 0.077 5.052 -3.392 1.00 . A A . 798 LEU CA 1 1 6 4049 1 1 19 LEU CB C 0.476 6.009 -2.265 1.00 . A A . 798 LEU CB 1 1 6 4050 1 1 19 LEU CD1 C 2.527 5.252 -1.068 1.00 . A A . 798 LEU CD1 1 1 6 4051 1 1 19 LEU CD2 C 0.596 6.158 0.209 1.00 . A A . 798 LEU CD2 1 1 6 4052 1 1 19 LEU CG C 1.016 5.359 -0.999 1.00 . A A . 798 LEU CG 1 1 6 4053 1 1 19 LEU H H -1.055 3.472 -2.612 1.00 . A A . 798 LEU H 1 1 6 4054 1 1 19 LEU HA H -0.051 5.594 -4.312 1.00 . A A . 798 LEU HA 1 1 6 4055 1 1 19 LEU HB2 H 1.231 6.683 -2.646 1.00 . A A . 798 LEU HB2 1 1 6 4056 1 1 19 LEU HB3 H -0.393 6.593 -1.998 1.00 . A A . 798 LEU HB3 1 1 6 4057 1 1 19 LEU HD11 H 2.802 4.789 -2.007 1.00 . A A . 798 LEU HD11 1 1 6 4058 1 1 19 LEU HD12 H 2.886 4.650 -0.247 1.00 . A A . 798 LEU HD12 1 1 6 4059 1 1 19 LEU HD13 H 2.962 6.239 -1.013 1.00 . A A . 798 LEU HD13 1 1 6 4060 1 1 19 LEU HD21 H 1.003 7.154 0.130 1.00 . A A . 798 LEU HD21 1 1 6 4061 1 1 19 LEU HD22 H 0.969 5.682 1.102 1.00 . A A . 798 LEU HD22 1 1 6 4062 1 1 19 LEU HD23 H -0.479 6.210 0.245 1.00 . A A . 798 LEU HD23 1 1 6 4063 1 1 19 LEU HG H 0.610 4.363 -0.905 1.00 . A A . 798 LEU HG 1 1 6 4064 1 1 19 LEU N N -1.143 4.338 -3.069 1.00 . A A . 798 LEU N 1 1 6 4065 1 1 19 LEU O O 0.740 2.792 -3.505 1.00 . A A . 798 LEU O 1 1 6 4066 1 1 20 LYS C C 4.642 3.331 -3.840 1.00 . A A . 799 LYS C 1 1 6 4067 1 1 20 LYS CA C 3.200 3.179 -4.287 1.00 . A A . 799 LYS CA 1 1 6 4068 1 1 20 LYS CB C 3.098 2.894 -5.780 1.00 . A A . 799 LYS CB 1 1 6 4069 1 1 20 LYS CD C 3.753 5.186 -6.615 1.00 . A A . 799 LYS CD 1 1 6 4070 1 1 20 LYS CE C 4.739 5.975 -7.457 1.00 . A A . 799 LYS CE 1 1 6 4071 1 1 20 LYS CG C 4.051 3.698 -6.657 1.00 . A A . 799 LYS CG 1 1 6 4072 1 1 20 LYS H H 2.650 5.213 -3.953 1.00 . A A . 799 LYS H 1 1 6 4073 1 1 20 LYS HA H 2.802 2.349 -3.730 1.00 . A A . 799 LYS HA 1 1 6 4074 1 1 20 LYS HB2 H 3.283 1.843 -5.952 1.00 . A A . 799 LYS HB2 1 1 6 4075 1 1 20 LYS HB3 H 2.087 3.128 -6.081 1.00 . A A . 799 LYS HB3 1 1 6 4076 1 1 20 LYS HD2 H 2.756 5.354 -6.995 1.00 . A A . 799 LYS HD2 1 1 6 4077 1 1 20 LYS HD3 H 3.813 5.525 -5.592 1.00 . A A . 799 LYS HD3 1 1 6 4078 1 1 20 LYS HE2 H 4.523 7.027 -7.348 1.00 . A A . 799 LYS HE2 1 1 6 4079 1 1 20 LYS HE3 H 5.738 5.775 -7.098 1.00 . A A . 799 LYS HE3 1 1 6 4080 1 1 20 LYS HG2 H 5.061 3.537 -6.311 1.00 . A A . 799 LYS HG2 1 1 6 4081 1 1 20 LYS HG3 H 3.963 3.351 -7.677 1.00 . A A . 799 LYS HG3 1 1 6 4082 1 1 20 LYS HZ1 H 5.344 6.186 -9.442 1.00 . A A . 799 LYS HZ1 1 1 6 4083 1 1 20 LYS HZ2 H 3.704 5.803 -9.263 1.00 . A A . 799 LYS HZ2 1 1 6 4084 1 1 20 LYS HZ3 H 4.885 4.608 -9.034 1.00 . A A . 799 LYS HZ3 1 1 6 4085 1 1 20 LYS N N 2.334 4.279 -3.942 1.00 . A A . 799 LYS N 1 1 6 4086 1 1 20 LYS NZ N 4.661 5.617 -8.898 1.00 . A A . 799 LYS NZ 1 1 6 4087 1 1 20 LYS O O 5.236 4.410 -3.833 1.00 . A A . 799 LYS O 1 1 6 4088 1 1 21 CYS C C 7.512 2.484 -3.985 1.00 . A A . 800 CYS C 1 1 6 4089 1 1 21 CYS CA C 6.492 1.911 -3.008 1.00 . A A . 800 CYS CA 1 1 6 4090 1 1 21 CYS CB C 6.571 0.392 -2.997 1.00 . A A . 800 CYS CB 1 1 6 4091 1 1 21 CYS H H 4.502 1.427 -3.316 1.00 . A A . 800 CYS H 1 1 6 4092 1 1 21 CYS HA H 6.632 2.280 -2.004 1.00 . A A . 800 CYS HA 1 1 6 4093 1 1 21 CYS HB2 H 5.769 0.017 -2.382 1.00 . A A . 800 CYS HB2 1 1 6 4094 1 1 21 CYS HB3 H 6.412 0.041 -4.009 1.00 . A A . 800 CYS HB3 1 1 6 4095 1 1 21 CYS N N 5.129 2.176 -3.415 1.00 . A A . 800 CYS N 1 1 6 4096 1 1 21 CYS O O 7.737 1.903 -5.040 1.00 . A A . 800 CYS O 1 1 6 4097 1 1 21 CYS SG S 8.077 -0.386 -2.399 1.00 . A A . 800 CYS SG 1 1 6 4098 1 1 22 GLU C C 10.403 3.489 -4.687 1.00 . A A . 801 GLU C 1 1 6 4099 1 1 22 GLU CA C 9.095 4.267 -4.516 1.00 . A A . 801 GLU CA 1 1 6 4100 1 1 22 GLU CB C 9.369 5.685 -4.022 1.00 . A A . 801 GLU CB 1 1 6 4101 1 1 22 GLU CD C 8.200 6.934 -5.881 1.00 . A A . 801 GLU CD 1 1 6 4102 1 1 22 GLU CG C 8.260 6.655 -4.389 1.00 . A A . 801 GLU CG 1 1 6 4103 1 1 22 GLU H H 7.934 3.996 -2.754 1.00 . A A . 801 GLU H 1 1 6 4104 1 1 22 GLU HA H 8.636 4.339 -5.493 1.00 . A A . 801 GLU HA 1 1 6 4105 1 1 22 GLU HB2 H 9.471 5.670 -2.947 1.00 . A A . 801 GLU HB2 1 1 6 4106 1 1 22 GLU HB3 H 10.291 6.038 -4.462 1.00 . A A . 801 GLU HB3 1 1 6 4107 1 1 22 GLU HG2 H 7.316 6.231 -4.081 1.00 . A A . 801 GLU HG2 1 1 6 4108 1 1 22 GLU HG3 H 8.426 7.582 -3.867 1.00 . A A . 801 GLU HG3 1 1 6 4109 1 1 22 GLU N N 8.131 3.601 -3.633 1.00 . A A . 801 GLU N 1 1 6 4110 1 1 22 GLU O O 11.431 4.063 -5.045 1.00 . A A . 801 GLU O 1 1 6 4111 1 1 22 GLU OE1 O 7.844 6.017 -6.647 1.00 . A A . 801 GLU OE1 1 1 6 4112 1 1 22 GLU OE2 O 8.487 8.077 -6.298 1.00 . A A . 801 GLU OE2 1 1 6 4113 1 1 23 TYR C C 11.117 0.424 -5.937 1.00 . A A . 802 TYR C 1 1 6 4114 1 1 23 TYR CA C 11.488 1.326 -4.759 1.00 . A A . 802 TYR CA 1 1 6 4115 1 1 23 TYR CB C 11.935 0.487 -3.552 1.00 . A A . 802 TYR CB 1 1 6 4116 1 1 23 TYR CD1 C 14.337 -0.138 -3.999 1.00 . A A . 802 TYR CD1 1 1 6 4117 1 1 23 TYR CD2 C 12.697 -1.870 -4.075 1.00 . A A . 802 TYR CD2 1 1 6 4118 1 1 23 TYR CE1 C 15.325 -1.055 -4.295 1.00 . A A . 802 TYR CE1 1 1 6 4119 1 1 23 TYR CE2 C 13.682 -2.794 -4.369 1.00 . A A . 802 TYR CE2 1 1 6 4120 1 1 23 TYR CG C 13.008 -0.528 -3.885 1.00 . A A . 802 TYR CG 1 1 6 4121 1 1 23 TYR CZ C 14.967 -2.399 -4.511 1.00 . A A . 802 TYR CZ 1 1 6 4122 1 1 23 TYR H H 9.580 1.821 -3.983 1.00 . A A . 802 TYR H 1 1 6 4123 1 1 23 TYR HA H 12.300 1.964 -5.075 1.00 . A A . 802 TYR HA 1 1 6 4124 1 1 23 TYR HB2 H 12.324 1.141 -2.787 1.00 . A A . 802 TYR HB2 1 1 6 4125 1 1 23 TYR HB3 H 11.082 -0.050 -3.159 1.00 . A A . 802 TYR HB3 1 1 6 4126 1 1 23 TYR HD1 H 14.593 0.901 -3.851 1.00 . A A . 802 TYR HD1 1 1 6 4127 1 1 23 TYR HD2 H 11.667 -2.190 -3.989 1.00 . A A . 802 TYR HD2 1 1 6 4128 1 1 23 TYR HE1 H 16.351 -0.731 -4.380 1.00 . A A . 802 TYR HE1 1 1 6 4129 1 1 23 TYR HE2 H 13.423 -3.834 -4.511 1.00 . A A . 802 TYR HE2 1 1 6 4130 1 1 23 TYR HH H 15.674 -3.890 -5.480 1.00 . A A . 802 TYR HH 1 1 6 4131 1 1 23 TYR N N 10.370 2.195 -4.421 1.00 . A A . 802 TYR N 1 1 6 4132 1 1 23 TYR O O 11.824 0.378 -6.942 1.00 . A A . 802 TYR O 1 1 6 4133 1 1 23 TYR OH O 15.981 -3.299 -4.770 1.00 . A A . 802 TYR OH 1 1 6 4134 1 1 24 CYS C C 8.375 -0.642 -7.657 1.00 . A A . 803 CYS C 1 1 6 4135 1 1 24 CYS CA C 9.560 -1.197 -6.865 1.00 . A A . 803 CYS CA 1 1 6 4136 1 1 24 CYS CB C 9.231 -2.563 -6.254 1.00 . A A . 803 CYS CB 1 1 6 4137 1 1 24 CYS H H 9.413 -0.124 -5.050 1.00 . A A . 803 CYS H 1 1 6 4138 1 1 24 CYS HA H 10.359 -1.302 -7.585 1.00 . A A . 803 CYS HA 1 1 6 4139 1 1 24 CYS HB2 H 8.739 -3.172 -6.997 1.00 . A A . 803 CYS HB2 1 1 6 4140 1 1 24 CYS HB3 H 10.151 -3.041 -5.953 1.00 . A A . 803 CYS HB3 1 1 6 4141 1 1 24 CYS N N 9.987 -0.266 -5.827 1.00 . A A . 803 CYS N 1 1 6 4142 1 1 24 CYS O O 8.155 -1.031 -8.808 1.00 . A A . 803 CYS O 1 1 6 4143 1 1 24 CYS SG S 8.148 -2.485 -4.796 1.00 . A A . 803 CYS SG 1 1 6 4144 1 1 25 GLY C C 5.256 0.355 -7.770 1.00 . A A . 804 GLY C 1 1 6 4145 1 1 25 GLY CA C 6.618 0.999 -7.791 1.00 . A A . 804 GLY CA 1 1 6 4146 1 1 25 GLY H H 7.725 0.415 -6.090 1.00 . A A . 804 GLY H 1 1 6 4147 1 1 25 GLY HA2 H 6.539 1.988 -7.366 1.00 . A A . 804 GLY HA2 1 1 6 4148 1 1 25 GLY HA3 H 6.944 1.088 -8.816 1.00 . A A . 804 GLY HA3 1 1 6 4149 1 1 25 GLY N N 7.617 0.255 -7.051 1.00 . A A . 804 GLY N 1 1 6 4150 1 1 25 GLY O O 4.402 0.677 -8.596 1.00 . A A . 804 GLY O 1 1 6 4151 1 1 26 LYS C C 2.752 -0.443 -5.964 1.00 . A A . 805 LYS C 1 1 6 4152 1 1 26 LYS CA C 3.763 -1.251 -6.764 1.00 . A A . 805 LYS CA 1 1 6 4153 1 1 26 LYS CB C 3.927 -2.652 -6.176 1.00 . A A . 805 LYS CB 1 1 6 4154 1 1 26 LYS CD C 4.546 -5.044 -6.640 1.00 . A A . 805 LYS CD 1 1 6 4155 1 1 26 LYS CE C 5.135 -6.007 -7.660 1.00 . A A . 805 LYS CE 1 1 6 4156 1 1 26 LYS CG C 4.665 -3.603 -7.104 1.00 . A A . 805 LYS CG 1 1 6 4157 1 1 26 LYS H H 5.719 -0.739 -6.163 1.00 . A A . 805 LYS H 1 1 6 4158 1 1 26 LYS HA H 3.396 -1.345 -7.777 1.00 . A A . 805 LYS HA 1 1 6 4159 1 1 26 LYS HB2 H 4.480 -2.583 -5.251 1.00 . A A . 805 LYS HB2 1 1 6 4160 1 1 26 LYS HB3 H 2.948 -3.064 -5.974 1.00 . A A . 805 LYS HB3 1 1 6 4161 1 1 26 LYS HD2 H 5.077 -5.157 -5.705 1.00 . A A . 805 LYS HD2 1 1 6 4162 1 1 26 LYS HD3 H 3.501 -5.281 -6.494 1.00 . A A . 805 LYS HD3 1 1 6 4163 1 1 26 LYS HE2 H 4.696 -5.805 -8.625 1.00 . A A . 805 LYS HE2 1 1 6 4164 1 1 26 LYS HE3 H 6.203 -5.850 -7.710 1.00 . A A . 805 LYS HE3 1 1 6 4165 1 1 26 LYS HG2 H 4.244 -3.521 -8.096 1.00 . A A . 805 LYS HG2 1 1 6 4166 1 1 26 LYS HG3 H 5.709 -3.327 -7.130 1.00 . A A . 805 LYS HG3 1 1 6 4167 1 1 26 LYS HZ1 H 5.252 -8.065 -8.028 1.00 . A A . 805 LYS HZ1 1 1 6 4168 1 1 26 LYS HZ2 H 3.843 -7.583 -7.212 1.00 . A A . 805 LYS HZ2 1 1 6 4169 1 1 26 LYS HZ3 H 5.319 -7.650 -6.382 1.00 . A A . 805 LYS HZ3 1 1 6 4170 1 1 26 LYS N N 5.038 -0.560 -6.839 1.00 . A A . 805 LYS N 1 1 6 4171 1 1 26 LYS NZ N 4.872 -7.423 -7.295 1.00 . A A . 805 LYS NZ 1 1 6 4172 1 1 26 LYS O O 3.057 0.042 -4.869 1.00 . A A . 805 LYS O 1 1 6 4173 1 1 27 TYR C C -0.331 -0.446 -4.969 1.00 . A A . 806 TYR C 1 1 6 4174 1 1 27 TYR CA C 0.472 0.441 -5.899 1.00 . A A . 806 TYR CA 1 1 6 4175 1 1 27 TYR CB C -0.445 1.047 -6.963 1.00 . A A . 806 TYR CB 1 1 6 4176 1 1 27 TYR CD1 C 1.004 2.049 -8.780 1.00 . A A . 806 TYR CD1 1 1 6 4177 1 1 27 TYR CD2 C -0.115 3.530 -7.281 1.00 . A A . 806 TYR CD2 1 1 6 4178 1 1 27 TYR CE1 C 1.562 3.128 -9.438 1.00 . A A . 806 TYR CE1 1 1 6 4179 1 1 27 TYR CE2 C 0.436 4.617 -7.937 1.00 . A A . 806 TYR CE2 1 1 6 4180 1 1 27 TYR CG C 0.159 2.229 -7.691 1.00 . A A . 806 TYR CG 1 1 6 4181 1 1 27 TYR CZ C 1.275 4.410 -9.016 1.00 . A A . 806 TYR CZ 1 1 6 4182 1 1 27 TYR H H 1.351 -0.819 -7.335 1.00 . A A . 806 TYR H 1 1 6 4183 1 1 27 TYR HA H 0.878 1.237 -5.292 1.00 . A A . 806 TYR HA 1 1 6 4184 1 1 27 TYR HB2 H -0.677 0.291 -7.696 1.00 . A A . 806 TYR HB2 1 1 6 4185 1 1 27 TYR HB3 H -1.360 1.377 -6.491 1.00 . A A . 806 TYR HB3 1 1 6 4186 1 1 27 TYR HD1 H 1.229 1.045 -9.110 1.00 . A A . 806 TYR HD1 1 1 6 4187 1 1 27 TYR HD2 H -0.769 3.688 -6.435 1.00 . A A . 806 TYR HD2 1 1 6 4188 1 1 27 TYR HE1 H 2.216 2.967 -10.283 1.00 . A A . 806 TYR HE1 1 1 6 4189 1 1 27 TYR HE2 H 0.211 5.621 -7.603 1.00 . A A . 806 TYR HE2 1 1 6 4190 1 1 27 TYR HH H 1.716 5.387 -10.624 1.00 . A A . 806 TYR HH 1 1 6 4191 1 1 27 TYR N N 1.551 -0.321 -6.514 1.00 . A A . 806 TYR N 1 1 6 4192 1 1 27 TYR O O -0.661 -1.587 -5.301 1.00 . A A . 806 TYR O 1 1 6 4193 1 1 27 TYR OH O 1.838 5.489 -9.663 1.00 . A A . 806 TYR OH 1 1 6 4194 1 1 28 ALA C C -1.922 0.339 -1.758 1.00 . A A . 807 ALA C 1 1 6 4195 1 1 28 ALA CA C -1.293 -0.635 -2.744 1.00 . A A . 807 ALA CA 1 1 6 4196 1 1 28 ALA CB C -0.278 -1.529 -2.045 1.00 . A A . 807 ALA CB 1 1 6 4197 1 1 28 ALA H H -0.407 1.048 -3.658 1.00 . A A . 807 ALA H 1 1 6 4198 1 1 28 ALA HA H -2.061 -1.259 -3.178 1.00 . A A . 807 ALA HA 1 1 6 4199 1 1 28 ALA HB1 H 0.473 -0.917 -1.565 1.00 . A A . 807 ALA HB1 1 1 6 4200 1 1 28 ALA HB2 H 0.196 -2.172 -2.772 1.00 . A A . 807 ALA HB2 1 1 6 4201 1 1 28 ALA HB3 H -0.780 -2.134 -1.303 1.00 . A A . 807 ALA HB3 1 1 6 4202 1 1 28 ALA N N -0.636 0.100 -3.805 1.00 . A A . 807 ALA N 1 1 6 4203 1 1 28 ALA O O -1.634 1.538 -1.812 1.00 . A A . 807 ALA O 1 1 6 4204 1 1 29 PRO C C -2.389 1.292 1.112 1.00 . A A . 808 PRO C 1 1 6 4205 1 1 29 PRO CA C -3.421 0.718 0.150 1.00 . A A . 808 PRO CA 1 1 6 4206 1 1 29 PRO CB C -4.384 -0.217 0.889 1.00 . A A . 808 PRO CB 1 1 6 4207 1 1 29 PRO CD C -3.240 -1.543 -0.734 1.00 . A A . 808 PRO CD 1 1 6 4208 1 1 29 PRO CG C -3.873 -1.590 0.628 1.00 . A A . 808 PRO CG 1 1 6 4209 1 1 29 PRO HA H -3.975 1.523 -0.310 1.00 . A A . 808 PRO HA 1 1 6 4210 1 1 29 PRO HB2 H -4.372 0.014 1.944 1.00 . A A . 808 PRO HB2 1 1 6 4211 1 1 29 PRO HB3 H -5.383 -0.090 0.501 1.00 . A A . 808 PRO HB3 1 1 6 4212 1 1 29 PRO HD2 H -2.398 -2.219 -0.781 1.00 . A A . 808 PRO HD2 1 1 6 4213 1 1 29 PRO HD3 H -3.966 -1.784 -1.496 1.00 . A A . 808 PRO HD3 1 1 6 4214 1 1 29 PRO HG2 H -3.137 -1.856 1.374 1.00 . A A . 808 PRO HG2 1 1 6 4215 1 1 29 PRO HG3 H -4.691 -2.295 0.638 1.00 . A A . 808 PRO HG3 1 1 6 4216 1 1 29 PRO N N -2.796 -0.141 -0.853 1.00 . A A . 808 PRO N 1 1 6 4217 1 1 29 PRO O O -1.543 0.566 1.637 1.00 . A A . 808 PRO O 1 1 6 4218 1 1 30 ALA C C -1.389 2.685 3.546 1.00 . A A . 809 ALA C 1 1 6 4219 1 1 30 ALA CA C -1.558 3.362 2.189 1.00 . A A . 809 ALA CA 1 1 6 4220 1 1 30 ALA CB C -2.091 4.774 2.385 1.00 . A A . 809 ALA CB 1 1 6 4221 1 1 30 ALA H H -3.098 3.119 0.749 1.00 . A A . 809 ALA H 1 1 6 4222 1 1 30 ALA HA H -0.599 3.440 1.695 1.00 . A A . 809 ALA HA 1 1 6 4223 1 1 30 ALA HB1 H -1.390 5.342 2.979 1.00 . A A . 809 ALA HB1 1 1 6 4224 1 1 30 ALA HB2 H -3.042 4.733 2.892 1.00 . A A . 809 ALA HB2 1 1 6 4225 1 1 30 ALA HB3 H -2.216 5.249 1.422 1.00 . A A . 809 ALA HB3 1 1 6 4226 1 1 30 ALA N N -2.454 2.613 1.291 1.00 . A A . 809 ALA N 1 1 6 4227 1 1 30 ALA O O -0.367 2.846 4.216 1.00 . A A . 809 ALA O 1 1 6 4228 1 1 31 GLU C C -1.351 0.159 5.281 1.00 . A A . 810 GLU C 1 1 6 4229 1 1 31 GLU CA C -2.448 1.222 5.190 1.00 . A A . 810 GLU CA 1 1 6 4230 1 1 31 GLU CB C -3.821 0.580 5.349 1.00 . A A . 810 GLU CB 1 1 6 4231 1 1 31 GLU CD C -4.378 2.153 7.243 1.00 . A A . 810 GLU CD 1 1 6 4232 1 1 31 GLU CG C -4.377 0.717 6.752 1.00 . A A . 810 GLU CG 1 1 6 4233 1 1 31 GLU H H -3.146 1.819 3.294 1.00 . A A . 810 GLU H 1 1 6 4234 1 1 31 GLU HA H -2.314 1.928 5.995 1.00 . A A . 810 GLU HA 1 1 6 4235 1 1 31 GLU HB2 H -4.509 1.049 4.660 1.00 . A A . 810 GLU HB2 1 1 6 4236 1 1 31 GLU HB3 H -3.746 -0.472 5.113 1.00 . A A . 810 GLU HB3 1 1 6 4237 1 1 31 GLU HG2 H -5.390 0.351 6.756 1.00 . A A . 810 GLU HG2 1 1 6 4238 1 1 31 GLU HG3 H -3.774 0.123 7.421 1.00 . A A . 810 GLU HG3 1 1 6 4239 1 1 31 GLU N N -2.407 1.933 3.925 1.00 . A A . 810 GLU N 1 1 6 4240 1 1 31 GLU O O -0.884 -0.170 6.370 1.00 . A A . 810 GLU O 1 1 6 4241 1 1 31 GLU OE1 O -5.175 2.966 6.723 1.00 . A A . 810 GLU OE1 1 1 6 4242 1 1 31 GLU OE2 O -3.583 2.474 8.147 1.00 . A A . 810 GLU OE2 1 1 6 4243 1 1 32 GLN C C 1.434 -0.851 4.446 1.00 . A A . 811 GLN C 1 1 6 4244 1 1 32 GLN CA C 0.068 -1.424 4.109 1.00 . A A . 811 GLN CA 1 1 6 4245 1 1 32 GLN CB C 0.122 -2.094 2.732 1.00 . A A . 811 GLN CB 1 1 6 4246 1 1 32 GLN CD C 1.250 -3.903 1.308 1.00 . A A . 811 GLN CD 1 1 6 4247 1 1 32 GLN CG C 1.063 -3.294 2.690 1.00 . A A . 811 GLN CG 1 1 6 4248 1 1 32 GLN H H -1.313 -0.040 3.294 1.00 . A A . 811 GLN H 1 1 6 4249 1 1 32 GLN HA H -0.202 -2.160 4.852 1.00 . A A . 811 GLN HA 1 1 6 4250 1 1 32 GLN HB2 H -0.869 -2.425 2.462 1.00 . A A . 811 GLN HB2 1 1 6 4251 1 1 32 GLN HB3 H 0.461 -1.368 2.011 1.00 . A A . 811 GLN HB3 1 1 6 4252 1 1 32 GLN HE21 H 1.156 -2.125 0.428 1.00 . A A . 811 GLN HE21 1 1 6 4253 1 1 32 GLN HE22 H 1.397 -3.471 -0.631 1.00 . A A . 811 GLN HE22 1 1 6 4254 1 1 32 GLN HG2 H 2.032 -2.980 3.052 1.00 . A A . 811 GLN HG2 1 1 6 4255 1 1 32 GLN HG3 H 0.673 -4.056 3.348 1.00 . A A . 811 GLN HG3 1 1 6 4256 1 1 32 GLN N N -0.933 -0.367 4.136 1.00 . A A . 811 GLN N 1 1 6 4257 1 1 32 GLN NE2 N 1.264 -3.080 0.269 1.00 . A A . 811 GLN NE2 1 1 6 4258 1 1 32 GLN O O 2.299 -1.545 4.987 1.00 . A A . 811 GLN O 1 1 6 4259 1 1 32 GLN OE1 O 1.427 -5.113 1.182 1.00 . A A . 811 GLN OE1 1 1 6 4260 1 1 33 PHE C C 3.120 1.411 5.809 1.00 . A A . 812 PHE C 1 1 6 4261 1 1 33 PHE CA C 2.883 1.100 4.328 1.00 . A A . 812 PHE CA 1 1 6 4262 1 1 33 PHE CB C 2.895 2.392 3.507 1.00 . A A . 812 PHE CB 1 1 6 4263 1 1 33 PHE CD1 C 1.513 1.852 1.473 1.00 . A A . 812 PHE CD1 1 1 6 4264 1 1 33 PHE CD2 C 3.838 2.276 1.182 1.00 . A A . 812 PHE CD2 1 1 6 4265 1 1 33 PHE CE1 C 1.376 1.643 0.115 1.00 . A A . 812 PHE CE1 1 1 6 4266 1 1 33 PHE CE2 C 3.707 2.068 -0.178 1.00 . A A . 812 PHE CE2 1 1 6 4267 1 1 33 PHE CG C 2.745 2.168 2.025 1.00 . A A . 812 PHE CG 1 1 6 4268 1 1 33 PHE CZ C 2.474 1.752 -0.712 1.00 . A A . 812 PHE CZ 1 1 6 4269 1 1 33 PHE H H 0.914 0.897 3.627 1.00 . A A . 812 PHE H 1 1 6 4270 1 1 33 PHE HA H 3.656 0.456 3.940 1.00 . A A . 812 PHE HA 1 1 6 4271 1 1 33 PHE HB2 H 2.084 3.027 3.829 1.00 . A A . 812 PHE HB2 1 1 6 4272 1 1 33 PHE HB3 H 3.833 2.900 3.672 1.00 . A A . 812 PHE HB3 1 1 6 4273 1 1 33 PHE HD1 H 0.651 1.765 2.118 1.00 . A A . 812 PHE HD1 1 1 6 4274 1 1 33 PHE HD2 H 4.805 2.524 1.598 1.00 . A A . 812 PHE HD2 1 1 6 4275 1 1 33 PHE HE1 H 0.411 1.395 -0.299 1.00 . A A . 812 PHE HE1 1 1 6 4276 1 1 33 PHE HE2 H 4.569 2.154 -0.823 1.00 . A A . 812 PHE HE2 1 1 6 4277 1 1 33 PHE HZ H 2.369 1.588 -1.775 1.00 . A A . 812 PHE HZ 1 1 6 4278 1 1 33 PHE N N 1.620 0.419 4.113 1.00 . A A . 812 PHE N 1 1 6 4279 1 1 33 PHE O O 3.114 2.573 6.223 1.00 . A A . 812 PHE O 1 1 6 4280 1 1 34 ARG C C 5.087 0.809 8.205 1.00 . A A . 813 ARG C 1 1 6 4281 1 1 34 ARG CA C 3.613 0.481 8.015 1.00 . A A . 813 ARG CA 1 1 6 4282 1 1 34 ARG CB C 3.280 -0.820 8.747 1.00 . A A . 813 ARG CB 1 1 6 4283 1 1 34 ARG CD C 1.022 -0.024 9.520 1.00 . A A . 813 ARG CD 1 1 6 4284 1 1 34 ARG CG C 1.794 -1.126 8.808 1.00 . A A . 813 ARG CG 1 1 6 4285 1 1 34 ARG CZ C -1.391 0.468 9.402 1.00 . A A . 813 ARG CZ 1 1 6 4286 1 1 34 ARG H H 3.171 -0.536 6.213 1.00 . A A . 813 ARG H 1 1 6 4287 1 1 34 ARG HA H 3.041 1.281 8.464 1.00 . A A . 813 ARG HA 1 1 6 4288 1 1 34 ARG HB2 H 3.773 -1.637 8.243 1.00 . A A . 813 ARG HB2 1 1 6 4289 1 1 34 ARG HB3 H 3.654 -0.754 9.758 1.00 . A A . 813 ARG HB3 1 1 6 4290 1 1 34 ARG HD2 H 1.454 0.130 10.499 1.00 . A A . 813 ARG HD2 1 1 6 4291 1 1 34 ARG HD3 H 1.102 0.886 8.945 1.00 . A A . 813 ARG HD3 1 1 6 4292 1 1 34 ARG HE H -0.599 -1.281 9.981 1.00 . A A . 813 ARG HE 1 1 6 4293 1 1 34 ARG HG2 H 1.416 -1.223 7.800 1.00 . A A . 813 ARG HG2 1 1 6 4294 1 1 34 ARG HG3 H 1.651 -2.055 9.338 1.00 . A A . 813 ARG HG3 1 1 6 4295 1 1 34 ARG HH11 H -0.208 2.045 8.920 1.00 . A A . 813 ARG HH11 1 1 6 4296 1 1 34 ARG HH12 H -1.922 2.327 8.800 1.00 . A A . 813 ARG HH12 1 1 6 4297 1 1 34 ARG HH21 H -2.845 -0.890 9.806 1.00 . A A . 813 ARG HH21 1 1 6 4298 1 1 34 ARG HH22 H -3.397 0.685 9.310 1.00 . A A . 813 ARG HH22 1 1 6 4299 1 1 34 ARG N N 3.288 0.360 6.599 1.00 . A A . 813 ARG N 1 1 6 4300 1 1 34 ARG NE N -0.389 -0.365 9.671 1.00 . A A . 813 ARG NE 1 1 6 4301 1 1 34 ARG NH1 N -1.152 1.712 9.014 1.00 . A A . 813 ARG NH1 1 1 6 4302 1 1 34 ARG NH2 N -2.643 0.056 9.517 1.00 . A A . 813 ARG NH2 1 1 6 4303 1 1 34 ARG O O 5.449 1.576 9.102 1.00 . A A . 813 ARG O 1 1 6 4304 1 1 35 GLY C C 7.674 1.815 6.657 1.00 . A A . 814 GLY C 1 1 6 4305 1 1 35 GLY CA C 7.349 0.548 7.415 1.00 . A A . 814 GLY CA 1 1 6 4306 1 1 35 GLY H H 5.596 -0.360 6.671 1.00 . A A . 814 GLY H 1 1 6 4307 1 1 35 GLY HA2 H 7.642 0.670 8.448 1.00 . A A . 814 GLY HA2 1 1 6 4308 1 1 35 GLY HA3 H 7.901 -0.272 6.984 1.00 . A A . 814 GLY HA3 1 1 6 4309 1 1 35 GLY N N 5.933 0.249 7.355 1.00 . A A . 814 GLY N 1 1 6 4310 1 1 35 GLY O O 8.506 1.800 5.746 1.00 . A A . 814 GLY O 1 1 6 4311 1 1 36 SER C C 6.267 4.166 5.075 1.00 . A A . 815 SER C 1 1 6 4312 1 1 36 SER CA C 7.095 4.191 6.362 1.00 . A A . 815 SER CA 1 1 6 4313 1 1 36 SER CB C 8.554 4.578 6.075 1.00 . A A . 815 SER CB 1 1 6 4314 1 1 36 SER H H 6.427 2.836 7.840 1.00 . A A . 815 SER H 1 1 6 4315 1 1 36 SER HA H 6.657 4.945 7.002 1.00 . A A . 815 SER HA 1 1 6 4316 1 1 36 SER HB2 H 9.109 4.589 7.002 1.00 . A A . 815 SER HB2 1 1 6 4317 1 1 36 SER HB3 H 8.990 3.851 5.406 1.00 . A A . 815 SER HB3 1 1 6 4318 1 1 36 SER HG H 7.973 6.446 5.858 1.00 . A A . 815 SER HG 1 1 6 4319 1 1 36 SER N N 7.007 2.906 7.051 1.00 . A A . 815 SER N 1 1 6 4320 1 1 36 SER O O 6.216 3.163 4.361 1.00 . A A . 815 SER O 1 1 6 4321 1 1 36 SER OG O 8.647 5.861 5.477 1.00 . A A . 815 SER OG 1 1 6 4322 1 1 37 LYS C C 5.379 5.476 2.336 1.00 . A A . 816 LYS C 1 1 6 4323 1 1 37 LYS CA C 4.667 5.409 3.691 1.00 . A A . 816 LYS CA 1 1 6 4324 1 1 37 LYS CB C 3.801 6.660 3.903 1.00 . A A . 816 LYS CB 1 1 6 4325 1 1 37 LYS CD C 1.597 5.446 4.101 1.00 . A A . 816 LYS CD 1 1 6 4326 1 1 37 LYS CE C 1.564 5.675 5.608 1.00 . A A . 816 LYS CE 1 1 6 4327 1 1 37 LYS CG C 2.377 6.536 3.375 1.00 . A A . 816 LYS CG 1 1 6 4328 1 1 37 LYS H H 5.795 6.090 5.349 1.00 . A A . 816 LYS H 1 1 6 4329 1 1 37 LYS HA H 4.033 4.539 3.707 1.00 . A A . 816 LYS HA 1 1 6 4330 1 1 37 LYS HB2 H 3.747 6.870 4.961 1.00 . A A . 816 LYS HB2 1 1 6 4331 1 1 37 LYS HB3 H 4.273 7.495 3.405 1.00 . A A . 816 LYS HB3 1 1 6 4332 1 1 37 LYS HD2 H 0.583 5.437 3.730 1.00 . A A . 816 LYS HD2 1 1 6 4333 1 1 37 LYS HD3 H 2.060 4.490 3.901 1.00 . A A . 816 LYS HD3 1 1 6 4334 1 1 37 LYS HE2 H 2.576 5.803 5.961 1.00 . A A . 816 LYS HE2 1 1 6 4335 1 1 37 LYS HE3 H 0.998 6.572 5.809 1.00 . A A . 816 LYS HE3 1 1 6 4336 1 1 37 LYS HG2 H 1.870 7.479 3.509 1.00 . A A . 816 LYS HG2 1 1 6 4337 1 1 37 LYS HG3 H 2.416 6.296 2.322 1.00 . A A . 816 LYS HG3 1 1 6 4338 1 1 37 LYS HZ1 H 0.954 4.713 7.362 1.00 . A A . 816 LYS HZ1 1 1 6 4339 1 1 37 LYS HZ2 H 1.460 3.657 6.145 1.00 . A A . 816 LYS HZ2 1 1 6 4340 1 1 37 LYS HZ3 H -0.053 4.411 6.034 1.00 . A A . 816 LYS HZ3 1 1 6 4341 1 1 37 LYS N N 5.619 5.295 4.794 1.00 . A A . 816 LYS N 1 1 6 4342 1 1 37 LYS NZ N 0.938 4.536 6.336 1.00 . A A . 816 LYS NZ 1 1 6 4343 1 1 37 LYS O O 4.784 5.849 1.327 1.00 . A A . 816 LYS O 1 1 6 4344 1 1 38 ARG C C 7.504 3.760 0.450 1.00 . A A . 817 ARG C 1 1 6 4345 1 1 38 ARG CA C 7.475 5.125 1.127 1.00 . A A . 817 ARG CA 1 1 6 4346 1 1 38 ARG CB C 8.903 5.520 1.507 1.00 . A A . 817 ARG CB 1 1 6 4347 1 1 38 ARG CD C 10.442 7.261 2.467 1.00 . A A . 817 ARG CD 1 1 6 4348 1 1 38 ARG CG C 9.063 6.985 1.888 1.00 . A A . 817 ARG CG 1 1 6 4349 1 1 38 ARG CZ C 11.771 6.213 4.282 1.00 . A A . 817 ARG CZ 1 1 6 4350 1 1 38 ARG H H 7.059 4.754 3.140 1.00 . A A . 817 ARG H 1 1 6 4351 1 1 38 ARG HA H 7.102 5.854 0.423 1.00 . A A . 817 ARG HA 1 1 6 4352 1 1 38 ARG HB2 H 9.219 4.918 2.347 1.00 . A A . 817 ARG HB2 1 1 6 4353 1 1 38 ARG HB3 H 9.553 5.319 0.669 1.00 . A A . 817 ARG HB3 1 1 6 4354 1 1 38 ARG HD2 H 11.188 6.871 1.790 1.00 . A A . 817 ARG HD2 1 1 6 4355 1 1 38 ARG HD3 H 10.572 8.329 2.571 1.00 . A A . 817 ARG HD3 1 1 6 4356 1 1 38 ARG HE H 9.788 6.511 4.320 1.00 . A A . 817 ARG HE 1 1 6 4357 1 1 38 ARG HG2 H 8.925 7.593 1.007 1.00 . A A . 817 ARG HG2 1 1 6 4358 1 1 38 ARG HG3 H 8.314 7.239 2.625 1.00 . A A . 817 ARG HG3 1 1 6 4359 1 1 38 ARG HH11 H 12.901 6.761 2.674 1.00 . A A . 817 ARG HH11 1 1 6 4360 1 1 38 ARG HH12 H 13.777 6.025 3.993 1.00 . A A . 817 ARG HH12 1 1 6 4361 1 1 38 ARG HH21 H 10.946 5.557 6.010 1.00 . A A . 817 ARG HH21 1 1 6 4362 1 1 38 ARG HH22 H 12.665 5.336 5.880 1.00 . A A . 817 ARG HH22 1 1 6 4363 1 1 38 ARG N N 6.650 5.099 2.323 1.00 . A A . 817 ARG N 1 1 6 4364 1 1 38 ARG NE N 10.609 6.631 3.776 1.00 . A A . 817 ARG NE 1 1 6 4365 1 1 38 ARG NH1 N 12.904 6.345 3.595 1.00 . A A . 817 ARG NH1 1 1 6 4366 1 1 38 ARG NH2 N 11.795 5.661 5.487 1.00 . A A . 817 ARG NH2 1 1 6 4367 1 1 38 ARG O O 7.645 3.670 -0.769 1.00 . A A . 817 ARG O 1 1 6 4368 1 1 39 PHE C C 6.498 0.417 1.268 1.00 . A A . 818 PHE C 1 1 6 4369 1 1 39 PHE CA C 7.582 1.345 0.745 1.00 . A A . 818 PHE CA 1 1 6 4370 1 1 39 PHE CB C 8.958 0.850 1.193 1.00 . A A . 818 PHE CB 1 1 6 4371 1 1 39 PHE CD1 C 10.433 1.859 -0.562 1.00 . A A . 818 PHE CD1 1 1 6 4372 1 1 39 PHE CD2 C 10.748 2.526 1.703 1.00 . A A . 818 PHE CD2 1 1 6 4373 1 1 39 PHE CE1 C 11.468 2.683 -0.953 1.00 . A A . 818 PHE CE1 1 1 6 4374 1 1 39 PHE CE2 C 11.787 3.348 1.320 1.00 . A A . 818 PHE CE2 1 1 6 4375 1 1 39 PHE CG C 10.063 1.771 0.768 1.00 . A A . 818 PHE CG 1 1 6 4376 1 1 39 PHE CZ C 12.063 3.519 -0.025 1.00 . A A . 818 PHE CZ 1 1 6 4377 1 1 39 PHE H H 7.127 2.815 2.185 1.00 . A A . 818 PHE H 1 1 6 4378 1 1 39 PHE HA H 7.551 1.369 -0.333 1.00 . A A . 818 PHE HA 1 1 6 4379 1 1 39 PHE HB2 H 8.975 0.785 2.269 1.00 . A A . 818 PHE HB2 1 1 6 4380 1 1 39 PHE HB3 H 9.145 -0.125 0.773 1.00 . A A . 818 PHE HB3 1 1 6 4381 1 1 39 PHE HD1 H 9.901 1.276 -1.299 1.00 . A A . 818 PHE HD1 1 1 6 4382 1 1 39 PHE HD2 H 10.467 2.464 2.744 1.00 . A A . 818 PHE HD2 1 1 6 4383 1 1 39 PHE HE1 H 11.748 2.744 -1.994 1.00 . A A . 818 PHE HE1 1 1 6 4384 1 1 39 PHE HE2 H 12.315 3.933 2.058 1.00 . A A . 818 PHE HE2 1 1 6 4385 1 1 39 PHE HZ H 12.842 4.202 -0.336 1.00 . A A . 818 PHE HZ 1 1 6 4386 1 1 39 PHE N N 7.373 2.698 1.241 1.00 . A A . 818 PHE N 1 1 6 4387 1 1 39 PHE O O 6.092 0.519 2.425 1.00 . A A . 818 PHE O 1 1 6 4388 1 1 40 CYS C C 5.372 -2.400 1.787 1.00 . A A . 819 CYS C 1 1 6 4389 1 1 40 CYS CA C 4.921 -1.344 0.777 1.00 . A A . 819 CYS CA 1 1 6 4390 1 1 40 CYS CB C 4.348 -2.002 -0.484 1.00 . A A . 819 CYS CB 1 1 6 4391 1 1 40 CYS H H 6.511 -0.657 -0.409 1.00 . A A . 819 CYS H 1 1 6 4392 1 1 40 CYS HA H 4.152 -0.727 1.217 1.00 . A A . 819 CYS HA 1 1 6 4393 1 1 40 CYS HB2 H 3.919 -2.951 -0.215 1.00 . A A . 819 CYS HB2 1 1 6 4394 1 1 40 CYS HB3 H 3.577 -1.367 -0.894 1.00 . A A . 819 CYS HB3 1 1 6 4395 1 1 40 CYS N N 6.027 -0.483 0.413 1.00 . A A . 819 CYS N 1 1 6 4396 1 1 40 CYS O O 6.012 -3.387 1.422 1.00 . A A . 819 CYS O 1 1 6 4397 1 1 40 CYS SG S 5.566 -2.309 -1.793 1.00 . A A . 819 CYS SG 1 1 6 4398 1 1 41 SER C C 6.667 -3.135 4.582 1.00 . A A . 820 SER C 1 1 6 4399 1 1 41 SER CA C 5.204 -3.126 4.127 1.00 . A A . 820 SER CA 1 1 6 4400 1 1 41 SER CB C 4.719 -4.519 3.708 1.00 . A A . 820 SER CB 1 1 6 4401 1 1 41 SER H H 4.971 -1.222 3.334 1.00 . A A . 820 SER H 1 1 6 4402 1 1 41 SER HA H 4.552 -2.737 4.898 1.00 . A A . 820 SER HA 1 1 6 4403 1 1 41 SER HB2 H 3.771 -4.428 3.198 1.00 . A A . 820 SER HB2 1 1 6 4404 1 1 41 SER HB3 H 5.445 -4.961 3.045 1.00 . A A . 820 SER HB3 1 1 6 4405 1 1 41 SER HG H 3.640 -5.299 5.152 1.00 . A A . 820 SER HG 1 1 6 4406 1 1 41 SER N N 5.074 -2.148 3.053 1.00 . A A . 820 SER N 1 1 6 4407 1 1 41 SER O O 7.409 -2.218 4.227 1.00 . A A . 820 SER O 1 1 6 4408 1 1 41 SER OG O 4.555 -5.367 4.833 1.00 . A A . 820 SER OG 1 1 6 4409 1 1 42 MET C C 9.466 -4.801 4.852 1.00 . A A . 821 MET C 1 1 6 4410 1 1 42 MET CA C 8.501 -4.105 5.802 1.00 . A A . 821 MET CA 1 1 6 4411 1 1 42 MET CB C 8.657 -4.664 7.206 1.00 . A A . 821 MET CB 1 1 6 4412 1 1 42 MET CE C 5.769 -3.011 9.707 1.00 . A A . 821 MET CE 1 1 6 4413 1 1 42 MET CG C 7.975 -3.828 8.266 1.00 . A A . 821 MET CG 1 1 6 4414 1 1 42 MET H H 6.529 -4.883 5.561 1.00 . A A . 821 MET H 1 1 6 4415 1 1 42 MET HA H 8.796 -3.067 5.809 1.00 . A A . 821 MET HA 1 1 6 4416 1 1 42 MET HB2 H 8.243 -5.662 7.237 1.00 . A A . 821 MET HB2 1 1 6 4417 1 1 42 MET HB3 H 9.710 -4.709 7.437 1.00 . A A . 821 MET HB3 1 1 6 4418 1 1 42 MET HE1 H 6.308 -3.295 10.597 1.00 . A A . 821 MET HE1 1 1 6 4419 1 1 42 MET HE2 H 4.707 -3.066 9.895 1.00 . A A . 821 MET HE2 1 1 6 4420 1 1 42 MET HE3 H 6.034 -2.000 9.434 1.00 . A A . 821 MET HE3 1 1 6 4421 1 1 42 MET HG2 H 8.421 -4.049 9.220 1.00 . A A . 821 MET HG2 1 1 6 4422 1 1 42 MET HG3 H 8.136 -2.787 8.028 1.00 . A A . 821 MET HG3 1 1 6 4423 1 1 42 MET N N 7.117 -4.131 5.331 1.00 . A A . 821 MET N 1 1 6 4424 1 1 42 MET O O 10.560 -4.303 4.645 1.00 . A A . 821 MET O 1 1 6 4425 1 1 42 MET SD S 6.198 -4.119 8.367 1.00 . A A . 821 MET SD 1 1 6 4426 1 1 43 THR C C 10.448 -5.631 2.224 1.00 . A A . 822 THR C 1 1 6 4427 1 1 43 THR CA C 9.925 -6.613 3.284 1.00 . A A . 822 THR CA 1 1 6 4428 1 1 43 THR CB C 9.155 -7.756 2.593 1.00 . A A . 822 THR CB 1 1 6 4429 1 1 43 THR CG2 C 10.079 -8.567 1.693 1.00 . A A . 822 THR CG2 1 1 6 4430 1 1 43 THR H H 8.241 -6.355 4.562 1.00 . A A . 822 THR H 1 1 6 4431 1 1 43 THR HA H 10.807 -7.031 3.750 1.00 . A A . 822 THR HA 1 1 6 4432 1 1 43 THR HB H 8.370 -7.328 1.987 1.00 . A A . 822 THR HB 1 1 6 4433 1 1 43 THR HG1 H 8.657 -9.540 3.302 1.00 . A A . 822 THR HG1 1 1 6 4434 1 1 43 THR HG21 H 10.510 -7.921 0.942 1.00 . A A . 822 THR HG21 1 1 6 4435 1 1 43 THR HG22 H 9.514 -9.351 1.211 1.00 . A A . 822 THR HG22 1 1 6 4436 1 1 43 THR HG23 H 10.867 -9.004 2.288 1.00 . A A . 822 THR HG23 1 1 6 4437 1 1 43 THR N N 9.084 -5.935 4.282 1.00 . A A . 822 THR N 1 1 6 4438 1 1 43 THR O O 11.635 -5.648 1.888 1.00 . A A . 822 THR O 1 1 6 4439 1 1 43 THR OG1 O 8.571 -8.613 3.585 1.00 . A A . 822 THR OG1 1 1 6 4440 1 1 44 CYS C C 10.812 -2.643 1.439 1.00 . A A . 823 CYS C 1 1 6 4441 1 1 44 CYS CA C 10.003 -3.751 0.775 1.00 . A A . 823 CYS CA 1 1 6 4442 1 1 44 CYS CB C 8.794 -3.192 0.055 1.00 . A A . 823 CYS CB 1 1 6 4443 1 1 44 CYS H H 8.667 -4.770 2.068 1.00 . A A . 823 CYS H 1 1 6 4444 1 1 44 CYS HA H 10.622 -4.223 0.023 1.00 . A A . 823 CYS HA 1 1 6 4445 1 1 44 CYS HB2 H 7.985 -3.056 0.758 1.00 . A A . 823 CYS HB2 1 1 6 4446 1 1 44 CYS HB3 H 9.050 -2.243 -0.392 1.00 . A A . 823 CYS HB3 1 1 6 4447 1 1 44 CYS N N 9.588 -4.763 1.735 1.00 . A A . 823 CYS N 1 1 6 4448 1 1 44 CYS O O 11.795 -2.155 0.878 1.00 . A A . 823 CYS O 1 1 6 4449 1 1 44 CYS SG S 8.221 -4.292 -1.260 1.00 . A A . 823 CYS SG 1 1 6 4450 1 1 45 ALA C C 12.519 -1.610 3.683 1.00 . A A . 824 ALA C 1 1 6 4451 1 1 45 ALA CA C 11.067 -1.225 3.401 1.00 . A A . 824 ALA CA 1 1 6 4452 1 1 45 ALA CB C 10.323 -0.977 4.696 1.00 . A A . 824 ALA CB 1 1 6 4453 1 1 45 ALA H H 9.577 -2.663 3.009 1.00 . A A . 824 ALA H 1 1 6 4454 1 1 45 ALA HA H 11.039 -0.310 2.838 1.00 . A A . 824 ALA HA 1 1 6 4455 1 1 45 ALA HB1 H 9.304 -0.697 4.468 1.00 . A A . 824 ALA HB1 1 1 6 4456 1 1 45 ALA HB2 H 10.805 -0.181 5.242 1.00 . A A . 824 ALA HB2 1 1 6 4457 1 1 45 ALA HB3 H 10.327 -1.878 5.289 1.00 . A A . 824 ALA HB3 1 1 6 4458 1 1 45 ALA N N 10.383 -2.251 2.630 1.00 . A A . 824 ALA N 1 1 6 4459 1 1 45 ALA O O 13.420 -0.770 3.603 1.00 . A A . 824 ALA O 1 1 6 4460 1 1 46 LYS C C 14.938 -3.306 3.058 1.00 . A A . 825 LYS C 1 1 6 4461 1 1 46 LYS CA C 14.070 -3.396 4.300 1.00 . A A . 825 LYS CA 1 1 6 4462 1 1 46 LYS CB C 14.006 -4.870 4.725 1.00 . A A . 825 LYS CB 1 1 6 4463 1 1 46 LYS CD C 13.369 -4.247 7.088 1.00 . A A . 825 LYS CD 1 1 6 4464 1 1 46 LYS CE C 14.816 -4.333 7.561 1.00 . A A . 825 LYS CE 1 1 6 4465 1 1 46 LYS CG C 13.093 -5.159 5.906 1.00 . A A . 825 LYS CG 1 1 6 4466 1 1 46 LYS H H 11.966 -3.483 4.142 1.00 . A A . 825 LYS H 1 1 6 4467 1 1 46 LYS HA H 14.458 -2.814 5.124 1.00 . A A . 825 LYS HA 1 1 6 4468 1 1 46 LYS HB2 H 13.655 -5.455 3.888 1.00 . A A . 825 LYS HB2 1 1 6 4469 1 1 46 LYS HB3 H 15.002 -5.199 4.984 1.00 . A A . 825 LYS HB3 1 1 6 4470 1 1 46 LYS HD2 H 13.159 -3.231 6.790 1.00 . A A . 825 LYS HD2 1 1 6 4471 1 1 46 LYS HD3 H 12.714 -4.525 7.901 1.00 . A A . 825 LYS HD3 1 1 6 4472 1 1 46 LYS HE2 H 15.452 -3.903 6.802 1.00 . A A . 825 LYS HE2 1 1 6 4473 1 1 46 LYS HE3 H 14.915 -3.763 8.472 1.00 . A A . 825 LYS HE3 1 1 6 4474 1 1 46 LYS HG2 H 12.069 -5.024 5.596 1.00 . A A . 825 LYS HG2 1 1 6 4475 1 1 46 LYS HG3 H 13.243 -6.183 6.215 1.00 . A A . 825 LYS HG3 1 1 6 4476 1 1 46 LYS HZ1 H 16.152 -5.735 8.353 1.00 . A A . 825 LYS HZ1 1 1 6 4477 1 1 46 LYS HZ2 H 15.414 -6.230 6.915 1.00 . A A . 825 LYS HZ2 1 1 6 4478 1 1 46 LYS HZ3 H 14.534 -6.251 8.365 1.00 . A A . 825 LYS HZ3 1 1 6 4479 1 1 46 LYS N N 12.734 -2.882 4.023 1.00 . A A . 825 LYS N 1 1 6 4480 1 1 46 LYS NZ N 15.256 -5.734 7.818 1.00 . A A . 825 LYS NZ 1 1 6 4481 1 1 46 LYS O O 16.124 -2.980 3.114 1.00 . A A . 825 LYS O 1 1 6 4482 1 1 47 ARG C C 15.555 -2.407 0.197 1.00 . A A . 826 ARG C 1 1 6 4483 1 1 47 ARG CA C 14.979 -3.740 0.650 1.00 . A A . 826 ARG CA 1 1 6 4484 1 1 47 ARG CB C 13.990 -4.255 -0.399 1.00 . A A . 826 ARG CB 1 1 6 4485 1 1 47 ARG CD C 15.291 -6.176 -1.411 1.00 . A A . 826 ARG CD 1 1 6 4486 1 1 47 ARG CG C 14.645 -4.815 -1.655 1.00 . A A . 826 ARG CG 1 1 6 4487 1 1 47 ARG CZ C 17.680 -6.518 -0.883 1.00 . A A . 826 ARG CZ 1 1 6 4488 1 1 47 ARG H H 13.330 -3.757 1.969 1.00 . A A . 826 ARG H 1 1 6 4489 1 1 47 ARG HA H 15.769 -4.469 0.766 1.00 . A A . 826 ARG HA 1 1 6 4490 1 1 47 ARG HB2 H 13.389 -5.037 0.043 1.00 . A A . 826 ARG HB2 1 1 6 4491 1 1 47 ARG HB3 H 13.344 -3.441 -0.691 1.00 . A A . 826 ARG HB3 1 1 6 4492 1 1 47 ARG HD2 H 14.561 -6.826 -0.952 1.00 . A A . 826 ARG HD2 1 1 6 4493 1 1 47 ARG HD3 H 15.589 -6.592 -2.362 1.00 . A A . 826 ARG HD3 1 1 6 4494 1 1 47 ARG HE H 16.337 -5.698 0.354 1.00 . A A . 826 ARG HE 1 1 6 4495 1 1 47 ARG HG2 H 13.894 -4.920 -2.424 1.00 . A A . 826 ARG HG2 1 1 6 4496 1 1 47 ARG HG3 H 15.405 -4.123 -1.987 1.00 . A A . 826 ARG HG3 1 1 6 4497 1 1 47 ARG HH11 H 17.136 -7.209 -2.713 1.00 . A A . 826 ARG HH11 1 1 6 4498 1 1 47 ARG HH12 H 18.822 -7.392 -2.315 1.00 . A A . 826 ARG HH12 1 1 6 4499 1 1 47 ARG HH21 H 18.528 -5.971 0.871 1.00 . A A . 826 ARG HH21 1 1 6 4500 1 1 47 ARG HH22 H 19.604 -6.700 -0.283 1.00 . A A . 826 ARG HH22 1 1 6 4501 1 1 47 ARG N N 14.299 -3.600 1.928 1.00 . A A . 826 ARG N 1 1 6 4502 1 1 47 ARG NE N 16.464 -6.095 -0.541 1.00 . A A . 826 ARG NE 1 1 6 4503 1 1 47 ARG NH1 N 17.893 -7.086 -2.061 1.00 . A A . 826 ARG NH1 1 1 6 4504 1 1 47 ARG NH2 N 18.684 -6.389 -0.032 1.00 . A A . 826 ARG NH2 1 1 6 4505 1 1 47 ARG O O 16.470 -2.359 -0.625 1.00 . A A . 826 ARG O 1 1 6 4506 1 1 48 TYR C C 16.963 0.148 0.827 1.00 . A A . 827 TYR C 1 1 6 4507 1 1 48 TYR CA C 15.490 0.010 0.454 1.00 . A A . 827 TYR CA 1 1 6 4508 1 1 48 TYR CB C 14.679 1.020 1.265 1.00 . A A . 827 TYR CB 1 1 6 4509 1 1 48 TYR CD1 C 15.210 2.964 -0.263 1.00 . A A . 827 TYR CD1 1 1 6 4510 1 1 48 TYR CD2 C 15.291 3.328 2.092 1.00 . A A . 827 TYR CD2 1 1 6 4511 1 1 48 TYR CE1 C 15.546 4.285 -0.483 1.00 . A A . 827 TYR CE1 1 1 6 4512 1 1 48 TYR CE2 C 15.633 4.650 1.878 1.00 . A A . 827 TYR CE2 1 1 6 4513 1 1 48 TYR CG C 15.075 2.463 1.027 1.00 . A A . 827 TYR CG 1 1 6 4514 1 1 48 TYR CZ C 15.757 5.122 0.590 1.00 . A A . 827 TYR CZ 1 1 6 4515 1 1 48 TYR H H 14.184 -1.431 1.277 1.00 . A A . 827 TYR H 1 1 6 4516 1 1 48 TYR HA H 15.312 0.211 -0.592 1.00 . A A . 827 TYR HA 1 1 6 4517 1 1 48 TYR HB2 H 13.634 0.918 1.008 1.00 . A A . 827 TYR HB2 1 1 6 4518 1 1 48 TYR HB3 H 14.805 0.809 2.318 1.00 . A A . 827 TYR HB3 1 1 6 4519 1 1 48 TYR HD1 H 15.047 2.304 -1.103 1.00 . A A . 827 TYR HD1 1 1 6 4520 1 1 48 TYR HD2 H 15.191 2.954 3.102 1.00 . A A . 827 TYR HD2 1 1 6 4521 1 1 48 TYR HE1 H 15.647 4.656 -1.492 1.00 . A A . 827 TYR HE1 1 1 6 4522 1 1 48 TYR HE2 H 15.797 5.307 2.719 1.00 . A A . 827 TYR HE2 1 1 6 4523 1 1 48 TYR HH H 16.777 6.712 0.986 1.00 . A A . 827 TYR HH 1 1 6 4524 1 1 48 TYR N N 15.001 -1.329 0.738 1.00 . A A . 827 TYR N 1 1 6 4525 1 1 48 TYR O O 17.760 0.708 0.075 1.00 . A A . 827 TYR O 1 1 6 4526 1 1 48 TYR OH O 16.077 6.443 0.372 1.00 . A A . 827 TYR OH 1 1 6 4527 1 1 49 ASN C C 18.907 -1.311 3.611 1.00 . A A . 828 ASN C 1 1 6 4528 1 1 49 ASN CA C 18.636 -0.230 2.567 1.00 . A A . 828 ASN CA 1 1 6 4529 1 1 49 ASN CB C 18.823 1.173 3.181 1.00 . A A . 828 ASN CB 1 1 6 4530 1 1 49 ASN CG C 17.861 1.511 4.321 1.00 . A A . 828 ASN CG 1 1 6 4531 1 1 49 ASN H H 16.652 -0.946 2.474 1.00 . A A . 828 ASN H 1 1 6 4532 1 1 49 ASN HA H 19.349 -0.351 1.764 1.00 . A A . 828 ASN HA 1 1 6 4533 1 1 49 ASN HB2 H 19.829 1.252 3.563 1.00 . A A . 828 ASN HB2 1 1 6 4534 1 1 49 ASN HB3 H 18.691 1.910 2.400 1.00 . A A . 828 ASN HB3 1 1 6 4535 1 1 49 ASN HD21 H 16.368 0.550 3.428 1.00 . A A . 828 ASN HD21 1 1 6 4536 1 1 49 ASN HD22 H 15.988 1.287 4.946 1.00 . A A . 828 ASN HD22 1 1 6 4537 1 1 49 ASN N N 17.306 -0.392 1.994 1.00 . A A . 828 ASN N 1 1 6 4538 1 1 49 ASN ND2 N 16.613 1.070 4.223 1.00 . A A . 828 ASN ND2 1 1 6 4539 1 1 49 ASN O O 18.260 -1.299 4.679 1.00 . A A . 828 ASN O 1 1 6 4540 1 1 49 ASN OXT O 19.759 -2.179 3.355 1.00 . A A . 828 ASN OXT 1 1 6 4541 1 1 49 ASN OD1 O 18.238 2.190 5.277 1.00 . A A . 828 ASN OD1 1 1 6 4542 2 2 1 ZN ZN ZN 7.674 -2.662 -2.610 1.00 . B A . 829 ZN ZN 1 1 7 4543 1 1 1 GLY C C -24.865 -2.203 -2.739 1.00 . A A . 1 GLY C 1 1 7 4544 1 1 1 GLY CA C -26.218 -2.614 -3.281 1.00 . A A . 1 GLY CA 1 1 7 4545 1 1 1 GLY H1 H -25.472 -4.291 -4.278 1.00 . A A . 1 GLY H1 1 1 7 4546 1 1 1 GLY H2 H -27.156 -4.273 -4.123 1.00 . A A . 1 GLY H2 1 1 7 4547 1 1 1 GLY H3 H -26.190 -4.639 -2.781 1.00 . A A . 1 GLY H3 1 1 7 4548 1 1 1 GLY HA2 H -26.436 -2.026 -4.161 1.00 . A A . 1 GLY HA2 1 1 7 4549 1 1 1 GLY HA3 H -26.972 -2.417 -2.533 1.00 . A A . 1 GLY HA3 1 1 7 4550 1 1 1 GLY N N -26.263 -4.053 -3.640 1.00 . A A . 1 GLY N 1 1 7 4551 1 1 1 GLY O O -23.884 -2.933 -2.893 1.00 . A A . 1 GLY O 1 1 7 4552 1 1 2 THR C C -23.117 -1.267 -0.324 1.00 . A A . 2 THR C 1 1 7 4553 1 1 2 THR CA C -23.555 -0.520 -1.582 1.00 . A A . 2 THR CA 1 1 7 4554 1 1 2 THR CB C -23.663 0.990 -1.277 1.00 . A A . 2 THR CB 1 1 7 4555 1 1 2 THR CG2 C -22.371 1.522 -0.673 1.00 . A A . 2 THR CG2 1 1 7 4556 1 1 2 THR H H -25.639 -0.542 -1.940 1.00 . A A . 2 THR H 1 1 7 4557 1 1 2 THR HA H -22.804 -0.657 -2.347 1.00 . A A . 2 THR HA 1 1 7 4558 1 1 2 THR HB H -24.465 1.143 -0.569 1.00 . A A . 2 THR HB 1 1 7 4559 1 1 2 THR HG1 H -24.142 1.080 -3.200 1.00 . A A . 2 THR HG1 1 1 7 4560 1 1 2 THR HG21 H -22.161 0.996 0.247 1.00 . A A . 2 THR HG21 1 1 7 4561 1 1 2 THR HG22 H -22.475 2.576 -0.469 1.00 . A A . 2 THR HG22 1 1 7 4562 1 1 2 THR HG23 H -21.560 1.370 -1.370 1.00 . A A . 2 THR HG23 1 1 7 4563 1 1 2 THR N N -24.809 -1.047 -2.092 1.00 . A A . 2 THR N 1 1 7 4564 1 1 2 THR O O -23.779 -1.207 0.715 1.00 . A A . 2 THR O 1 1 7 4565 1 1 2 THR OG1 O -23.958 1.711 -2.482 1.00 . A A . 2 THR OG1 1 1 7 4566 1 1 3 ARG C C -20.093 -2.002 1.064 1.00 . A A . 3 ARG C 1 1 7 4567 1 1 3 ARG CA C -21.411 -2.671 0.697 1.00 . A A . 3 ARG CA 1 1 7 4568 1 1 3 ARG CB C -21.177 -4.149 0.367 1.00 . A A . 3 ARG CB 1 1 7 4569 1 1 3 ARG CD C -22.142 -6.404 -0.150 1.00 . A A . 3 ARG CD 1 1 7 4570 1 1 3 ARG CG C -22.452 -4.950 0.165 1.00 . A A . 3 ARG CG 1 1 7 4571 1 1 3 ARG CZ C -23.500 -8.237 -1.099 1.00 . A A . 3 ARG CZ 1 1 7 4572 1 1 3 ARG H H -21.560 -2.030 -1.311 1.00 . A A . 3 ARG H 1 1 7 4573 1 1 3 ARG HA H -22.090 -2.595 1.534 1.00 . A A . 3 ARG HA 1 1 7 4574 1 1 3 ARG HB2 H -20.595 -4.213 -0.541 1.00 . A A . 3 ARG HB2 1 1 7 4575 1 1 3 ARG HB3 H -20.618 -4.601 1.172 1.00 . A A . 3 ARG HB3 1 1 7 4576 1 1 3 ARG HD2 H -21.618 -6.450 -1.092 1.00 . A A . 3 ARG HD2 1 1 7 4577 1 1 3 ARG HD3 H -21.511 -6.800 0.631 1.00 . A A . 3 ARG HD3 1 1 7 4578 1 1 3 ARG HE H -24.088 -7.013 0.377 1.00 . A A . 3 ARG HE 1 1 7 4579 1 1 3 ARG HG2 H -23.043 -4.903 1.068 1.00 . A A . 3 ARG HG2 1 1 7 4580 1 1 3 ARG HG3 H -23.009 -4.524 -0.656 1.00 . A A . 3 ARG HG3 1 1 7 4581 1 1 3 ARG HH11 H -21.693 -7.987 -1.978 1.00 . A A . 3 ARG HH11 1 1 7 4582 1 1 3 ARG HH12 H -22.645 -9.288 -2.620 1.00 . A A . 3 ARG HH12 1 1 7 4583 1 1 3 ARG HH21 H -25.357 -8.725 -0.440 1.00 . A A . 3 ARG HH21 1 1 7 4584 1 1 3 ARG HH22 H -24.736 -9.724 -1.728 1.00 . A A . 3 ARG HH22 1 1 7 4585 1 1 3 ARG N N -22.006 -1.979 -0.436 1.00 . A A . 3 ARG N 1 1 7 4586 1 1 3 ARG NE N -23.351 -7.224 -0.244 1.00 . A A . 3 ARG NE 1 1 7 4587 1 1 3 ARG NH1 N -22.533 -8.528 -1.965 1.00 . A A . 3 ARG NH1 1 1 7 4588 1 1 3 ARG NH2 N -24.619 -8.951 -1.089 1.00 . A A . 3 ARG NH2 1 1 7 4589 1 1 3 ARG O O -19.022 -2.484 0.710 1.00 . A A . 3 ARG O 1 1 7 4590 1 1 4 GLY C C -18.561 -0.353 3.537 1.00 . A A . 783 GLY C 1 1 7 4591 1 1 4 GLY CA C -18.989 -0.129 2.104 1.00 . A A . 783 GLY CA 1 1 7 4592 1 1 4 GLY H H -21.060 -0.572 2.073 1.00 . A A . 783 GLY H 1 1 7 4593 1 1 4 GLY HA2 H -18.186 -0.425 1.446 1.00 . A A . 783 GLY HA2 1 1 7 4594 1 1 4 GLY HA3 H -19.189 0.922 1.961 1.00 . A A . 783 GLY HA3 1 1 7 4595 1 1 4 GLY N N -20.178 -0.883 1.766 1.00 . A A . 783 GLY N 1 1 7 4596 1 1 4 GLY O O -17.881 0.484 4.133 1.00 . A A . 783 GLY O 1 1 7 4597 1 1 5 VAL C C -17.782 -3.081 5.495 1.00 . A A . 784 VAL C 1 1 7 4598 1 1 5 VAL CA C -18.638 -1.823 5.467 1.00 . A A . 784 VAL CA 1 1 7 4599 1 1 5 VAL CB C -19.906 -2.045 6.324 1.00 . A A . 784 VAL CB 1 1 7 4600 1 1 5 VAL CG1 C -19.538 -2.309 7.777 1.00 . A A . 784 VAL CG1 1 1 7 4601 1 1 5 VAL CG2 C -20.842 -0.849 6.217 1.00 . A A . 784 VAL CG2 1 1 7 4602 1 1 5 VAL H H -19.489 -2.116 3.560 1.00 . A A . 784 VAL H 1 1 7 4603 1 1 5 VAL HA H -18.075 -1.004 5.891 1.00 . A A . 784 VAL HA 1 1 7 4604 1 1 5 VAL HB H -20.424 -2.912 5.945 1.00 . A A . 784 VAL HB 1 1 7 4605 1 1 5 VAL HG11 H -20.437 -2.481 8.351 1.00 . A A . 784 VAL HG11 1 1 7 4606 1 1 5 VAL HG12 H -19.014 -1.453 8.178 1.00 . A A . 784 VAL HG12 1 1 7 4607 1 1 5 VAL HG13 H -18.902 -3.180 7.834 1.00 . A A . 784 VAL HG13 1 1 7 4608 1 1 5 VAL HG21 H -21.717 -1.020 6.828 1.00 . A A . 784 VAL HG21 1 1 7 4609 1 1 5 VAL HG22 H -21.142 -0.716 5.189 1.00 . A A . 784 VAL HG22 1 1 7 4610 1 1 5 VAL HG23 H -20.333 0.039 6.560 1.00 . A A . 784 VAL HG23 1 1 7 4611 1 1 5 VAL N N -18.968 -1.483 4.094 1.00 . A A . 784 VAL N 1 1 7 4612 1 1 5 VAL O O -18.306 -4.195 5.476 1.00 . A A . 784 VAL O 1 1 7 4613 1 1 6 ASP C C -15.636 -4.877 4.330 1.00 . A A . 785 ASP C 1 1 7 4614 1 1 6 ASP CA C -15.495 -3.972 5.552 1.00 . A A . 785 ASP CA 1 1 7 4615 1 1 6 ASP CB C -15.655 -4.778 6.845 1.00 . A A . 785 ASP CB 1 1 7 4616 1 1 6 ASP CG C -14.515 -5.747 7.074 1.00 . A A . 785 ASP CG 1 1 7 4617 1 1 6 ASP H H -16.132 -1.958 5.461 1.00 . A A . 785 ASP H 1 1 7 4618 1 1 6 ASP HA H -14.510 -3.529 5.538 1.00 . A A . 785 ASP HA 1 1 7 4619 1 1 6 ASP HB2 H -15.696 -4.096 7.682 1.00 . A A . 785 ASP HB2 1 1 7 4620 1 1 6 ASP HB3 H -16.578 -5.339 6.798 1.00 . A A . 785 ASP HB3 1 1 7 4621 1 1 6 ASP N N -16.466 -2.879 5.502 1.00 . A A . 785 ASP N 1 1 7 4622 1 1 6 ASP O O -16.246 -5.946 4.388 1.00 . A A . 785 ASP O 1 1 7 4623 1 1 6 ASP OD1 O -13.441 -5.307 7.536 1.00 . A A . 785 ASP OD1 1 1 7 4624 1 1 6 ASP OD2 O -14.688 -6.953 6.818 1.00 . A A . 785 ASP OD2 1 1 7 4625 1 1 7 SER C C -13.914 -4.961 1.118 1.00 . A A . 786 SER C 1 1 7 4626 1 1 7 SER CA C -15.174 -5.162 1.961 1.00 . A A . 786 SER CA 1 1 7 4627 1 1 7 SER CB C -16.413 -4.706 1.188 1.00 . A A . 786 SER CB 1 1 7 4628 1 1 7 SER H H -14.585 -3.575 3.236 1.00 . A A . 786 SER H 1 1 7 4629 1 1 7 SER HA H -15.274 -6.210 2.196 1.00 . A A . 786 SER HA 1 1 7 4630 1 1 7 SER HB2 H -16.367 -3.637 1.032 1.00 . A A . 786 SER HB2 1 1 7 4631 1 1 7 SER HB3 H -16.442 -5.206 0.231 1.00 . A A . 786 SER HB3 1 1 7 4632 1 1 7 SER HG H -17.377 -5.219 2.818 1.00 . A A . 786 SER HG 1 1 7 4633 1 1 7 SER N N -15.081 -4.429 3.216 1.00 . A A . 786 SER N 1 1 7 4634 1 1 7 SER O O -13.564 -3.839 0.767 1.00 . A A . 786 SER O 1 1 7 4635 1 1 7 SER OG O -17.600 -5.015 1.901 1.00 . A A . 786 SER OG 1 1 7 4636 1 1 8 PRO C C -12.141 -5.535 -1.421 1.00 . A A . 787 PRO C 1 1 7 4637 1 1 8 PRO CA C -11.961 -6.007 0.026 1.00 . A A . 787 PRO CA 1 1 7 4638 1 1 8 PRO CB C -11.461 -7.453 0.060 1.00 . A A . 787 PRO CB 1 1 7 4639 1 1 8 PRO CD C -13.607 -7.446 1.110 1.00 . A A . 787 PRO CD 1 1 7 4640 1 1 8 PRO CG C -12.685 -8.277 0.267 1.00 . A A . 787 PRO CG 1 1 7 4641 1 1 8 PRO HA H -11.242 -5.368 0.518 1.00 . A A . 787 PRO HA 1 1 7 4642 1 1 8 PRO HB2 H -10.979 -7.692 -0.876 1.00 . A A . 787 PRO HB2 1 1 7 4643 1 1 8 PRO HB3 H -10.763 -7.576 0.873 1.00 . A A . 787 PRO HB3 1 1 7 4644 1 1 8 PRO HD2 H -14.635 -7.635 0.842 1.00 . A A . 787 PRO HD2 1 1 7 4645 1 1 8 PRO HD3 H -13.445 -7.648 2.159 1.00 . A A . 787 PRO HD3 1 1 7 4646 1 1 8 PRO HG2 H -13.145 -8.496 -0.686 1.00 . A A . 787 PRO HG2 1 1 7 4647 1 1 8 PRO HG3 H -12.431 -9.192 0.781 1.00 . A A . 787 PRO HG3 1 1 7 4648 1 1 8 PRO N N -13.222 -6.061 0.777 1.00 . A A . 787 PRO N 1 1 7 4649 1 1 8 PRO O O -11.204 -5.027 -2.039 1.00 . A A . 787 PRO O 1 1 7 4650 1 1 9 SER C C -14.591 -4.054 -3.272 1.00 . A A . 788 SER C 1 1 7 4651 1 1 9 SER CA C -13.637 -5.243 -3.308 1.00 . A A . 788 SER CA 1 1 7 4652 1 1 9 SER CB C -14.248 -6.371 -4.147 1.00 . A A . 788 SER CB 1 1 7 4653 1 1 9 SER H H -14.039 -6.168 -1.443 1.00 . A A . 788 SER H 1 1 7 4654 1 1 9 SER HA H -12.710 -4.930 -3.764 1.00 . A A . 788 SER HA 1 1 7 4655 1 1 9 SER HB2 H -15.145 -6.731 -3.665 1.00 . A A . 788 SER HB2 1 1 7 4656 1 1 9 SER HB3 H -14.500 -5.986 -5.126 1.00 . A A . 788 SER HB3 1 1 7 4657 1 1 9 SER HG H -12.746 -7.506 -3.549 1.00 . A A . 788 SER HG 1 1 7 4658 1 1 9 SER N N -13.339 -5.709 -1.961 1.00 . A A . 788 SER N 1 1 7 4659 1 1 9 SER O O -14.408 -3.071 -3.992 1.00 . A A . 788 SER O 1 1 7 4660 1 1 9 SER OG O -13.351 -7.461 -4.305 1.00 . A A . 788 SER OG 1 1 7 4661 1 1 10 ALA C C -16.323 -1.912 -1.570 1.00 . A A . 789 ALA C 1 1 7 4662 1 1 10 ALA CA C -16.667 -3.153 -2.394 1.00 . A A . 789 ALA CA 1 1 7 4663 1 1 10 ALA CB C -17.949 -3.795 -1.890 1.00 . A A . 789 ALA CB 1 1 7 4664 1 1 10 ALA H H -15.607 -4.871 -1.758 1.00 . A A . 789 ALA H 1 1 7 4665 1 1 10 ALA HA H -16.835 -2.845 -3.414 1.00 . A A . 789 ALA HA 1 1 7 4666 1 1 10 ALA HB1 H -17.830 -4.072 -0.852 1.00 . A A . 789 ALA HB1 1 1 7 4667 1 1 10 ALA HB2 H -18.164 -4.678 -2.473 1.00 . A A . 789 ALA HB2 1 1 7 4668 1 1 10 ALA HB3 H -18.766 -3.094 -1.985 1.00 . A A . 789 ALA HB3 1 1 7 4669 1 1 10 ALA N N -15.590 -4.131 -2.406 1.00 . A A . 789 ALA N 1 1 7 4670 1 1 10 ALA O O -17.192 -1.088 -1.296 1.00 . A A . 789 ALA O 1 1 7 4671 1 1 11 GLU C C -13.530 0.125 -1.306 1.00 . A A . 790 GLU C 1 1 7 4672 1 1 11 GLU CA C -14.611 -0.564 -0.505 1.00 . A A . 790 GLU CA 1 1 7 4673 1 1 11 GLU CB C -14.061 -0.833 0.886 1.00 . A A . 790 GLU CB 1 1 7 4674 1 1 11 GLU CD C -14.564 -0.997 3.338 1.00 . A A . 790 GLU CD 1 1 7 4675 1 1 11 GLU CG C -15.123 -1.088 1.937 1.00 . A A . 790 GLU CG 1 1 7 4676 1 1 11 GLU H H -14.434 -2.517 -1.309 1.00 . A A . 790 GLU H 1 1 7 4677 1 1 11 GLU HA H -15.459 0.098 -0.422 1.00 . A A . 790 GLU HA 1 1 7 4678 1 1 11 GLU HB2 H -13.414 -1.696 0.840 1.00 . A A . 790 GLU HB2 1 1 7 4679 1 1 11 GLU HB3 H -13.476 0.022 1.193 1.00 . A A . 790 GLU HB3 1 1 7 4680 1 1 11 GLU HG2 H -15.907 -0.354 1.827 1.00 . A A . 790 GLU HG2 1 1 7 4681 1 1 11 GLU HG3 H -15.530 -2.076 1.790 1.00 . A A . 790 GLU HG3 1 1 7 4682 1 1 11 GLU N N -15.065 -1.782 -1.167 1.00 . A A . 790 GLU N 1 1 7 4683 1 1 11 GLU O O -12.867 1.032 -0.803 1.00 . A A . 790 GLU O 1 1 7 4684 1 1 11 GLU OE1 O -13.965 -1.987 3.808 1.00 . A A . 790 GLU OE1 1 1 7 4685 1 1 11 GLU OE2 O -14.721 0.060 3.978 1.00 . A A . 790 GLU OE2 1 1 7 4686 1 1 12 LEU C C -12.701 1.663 -3.888 1.00 . A A . 791 LEU C 1 1 7 4687 1 1 12 LEU CA C -12.284 0.300 -3.358 1.00 . A A . 791 LEU CA 1 1 7 4688 1 1 12 LEU CB C -11.882 -0.627 -4.507 1.00 . A A . 791 LEU CB 1 1 7 4689 1 1 12 LEU CD1 C -10.886 -2.786 -5.296 1.00 . A A . 791 LEU CD1 1 1 7 4690 1 1 12 LEU CD2 C -10.035 -1.718 -3.203 1.00 . A A . 791 LEU CD2 1 1 7 4691 1 1 12 LEU CG C -11.257 -1.957 -4.079 1.00 . A A . 791 LEU CG 1 1 7 4692 1 1 12 LEU H H -13.933 -0.970 -2.933 1.00 . A A . 791 LEU H 1 1 7 4693 1 1 12 LEU HA H -11.443 0.436 -2.701 1.00 . A A . 791 LEU HA 1 1 7 4694 1 1 12 LEU HB2 H -12.763 -0.839 -5.095 1.00 . A A . 791 LEU HB2 1 1 7 4695 1 1 12 LEU HB3 H -11.171 -0.106 -5.131 1.00 . A A . 791 LEU HB3 1 1 7 4696 1 1 12 LEU HD11 H -10.155 -2.255 -5.888 1.00 . A A . 791 LEU HD11 1 1 7 4697 1 1 12 LEU HD12 H -11.768 -2.966 -5.893 1.00 . A A . 791 LEU HD12 1 1 7 4698 1 1 12 LEU HD13 H -10.470 -3.731 -4.975 1.00 . A A . 791 LEU HD13 1 1 7 4699 1 1 12 LEU HD21 H -9.312 -1.128 -3.746 1.00 . A A . 791 LEU HD21 1 1 7 4700 1 1 12 LEU HD22 H -9.594 -2.667 -2.934 1.00 . A A . 791 LEU HD22 1 1 7 4701 1 1 12 LEU HD23 H -10.329 -1.191 -2.307 1.00 . A A . 791 LEU HD23 1 1 7 4702 1 1 12 LEU HG H -11.979 -2.516 -3.503 1.00 . A A . 791 LEU HG 1 1 7 4703 1 1 12 LEU N N -13.346 -0.281 -2.551 1.00 . A A . 791 LEU N 1 1 7 4704 1 1 12 LEU O O -12.005 2.287 -4.690 1.00 . A A . 791 LEU O 1 1 7 4705 1 1 13 ASP C C -14.280 4.306 -2.488 1.00 . A A . 792 ASP C 1 1 7 4706 1 1 13 ASP CA C -14.378 3.420 -3.717 1.00 . A A . 792 ASP CA 1 1 7 4707 1 1 13 ASP CB C -15.840 3.319 -4.139 1.00 . A A . 792 ASP CB 1 1 7 4708 1 1 13 ASP CG C -16.700 2.603 -3.113 1.00 . A A . 792 ASP CG 1 1 7 4709 1 1 13 ASP H H -14.359 1.507 -2.827 1.00 . A A . 792 ASP H 1 1 7 4710 1 1 13 ASP HA H -13.798 3.851 -4.519 1.00 . A A . 792 ASP HA 1 1 7 4711 1 1 13 ASP HB2 H -16.226 4.314 -4.260 1.00 . A A . 792 ASP HB2 1 1 7 4712 1 1 13 ASP HB3 H -15.907 2.788 -5.076 1.00 . A A . 792 ASP HB3 1 1 7 4713 1 1 13 ASP N N -13.845 2.102 -3.415 1.00 . A A . 792 ASP N 1 1 7 4714 1 1 13 ASP O O -14.998 5.297 -2.357 1.00 . A A . 792 ASP O 1 1 7 4715 1 1 13 ASP OD1 O -16.591 1.366 -3.006 1.00 . A A . 792 ASP OD1 1 1 7 4716 1 1 13 ASP OD2 O -17.488 3.271 -2.411 1.00 . A A . 792 ASP OD2 1 1 7 4717 1 1 14 LYS C C -11.920 4.341 0.319 1.00 . A A . 793 LYS C 1 1 7 4718 1 1 14 LYS CA C -13.284 4.604 -0.303 1.00 . A A . 793 LYS CA 1 1 7 4719 1 1 14 LYS CB C -14.411 4.100 0.607 1.00 . A A . 793 LYS CB 1 1 7 4720 1 1 14 LYS CD C -15.840 4.575 2.609 1.00 . A A . 793 LYS CD 1 1 7 4721 1 1 14 LYS CE C -16.154 3.106 2.859 1.00 . A A . 793 LYS CE 1 1 7 4722 1 1 14 LYS CG C -14.473 4.771 1.968 1.00 . A A . 793 LYS CG 1 1 7 4723 1 1 14 LYS H H -12.756 3.223 -1.802 1.00 . A A . 793 LYS H 1 1 7 4724 1 1 14 LYS HA H -13.401 5.663 -0.462 1.00 . A A . 793 LYS HA 1 1 7 4725 1 1 14 LYS HB2 H -15.356 4.266 0.111 1.00 . A A . 793 LYS HB2 1 1 7 4726 1 1 14 LYS HB3 H -14.282 3.038 0.761 1.00 . A A . 793 LYS HB3 1 1 7 4727 1 1 14 LYS HD2 H -15.861 5.099 3.552 1.00 . A A . 793 LYS HD2 1 1 7 4728 1 1 14 LYS HD3 H -16.596 4.985 1.953 1.00 . A A . 793 LYS HD3 1 1 7 4729 1 1 14 LYS HE2 H -17.218 3.001 3.012 1.00 . A A . 793 LYS HE2 1 1 7 4730 1 1 14 LYS HE3 H -15.860 2.533 1.990 1.00 . A A . 793 LYS HE3 1 1 7 4731 1 1 14 LYS HG2 H -13.717 4.341 2.608 1.00 . A A . 793 LYS HG2 1 1 7 4732 1 1 14 LYS HG3 H -14.289 5.828 1.849 1.00 . A A . 793 LYS HG3 1 1 7 4733 1 1 14 LYS HZ1 H -14.425 2.787 3.983 1.00 . A A . 793 LYS HZ1 1 1 7 4734 1 1 14 LYS HZ2 H -15.563 1.543 4.115 1.00 . A A . 793 LYS HZ2 1 1 7 4735 1 1 14 LYS HZ3 H -15.817 3.020 4.915 1.00 . A A . 793 LYS HZ3 1 1 7 4736 1 1 14 LYS N N -13.378 3.945 -1.590 1.00 . A A . 793 LYS N 1 1 7 4737 1 1 14 LYS NZ N -15.440 2.579 4.049 1.00 . A A . 793 LYS NZ 1 1 7 4738 1 1 14 LYS O O -11.241 5.264 0.763 1.00 . A A . 793 LYS O 1 1 7 4739 1 1 15 LYS C C -9.148 2.712 -0.217 1.00 . A A . 794 LYS C 1 1 7 4740 1 1 15 LYS CA C -10.211 2.699 0.868 1.00 . A A . 794 LYS CA 1 1 7 4741 1 1 15 LYS CB C -10.236 1.322 1.537 1.00 . A A . 794 LYS CB 1 1 7 4742 1 1 15 LYS CD C -10.938 2.376 3.722 1.00 . A A . 794 LYS CD 1 1 7 4743 1 1 15 LYS CE C -9.477 2.495 4.139 1.00 . A A . 794 LYS CE 1 1 7 4744 1 1 15 LYS CG C -11.165 1.228 2.741 1.00 . A A . 794 LYS CG 1 1 7 4745 1 1 15 LYS H H -12.103 2.384 -0.046 1.00 . A A . 794 LYS H 1 1 7 4746 1 1 15 LYS HA H -9.949 3.433 1.608 1.00 . A A . 794 LYS HA 1 1 7 4747 1 1 15 LYS HB2 H -10.549 0.588 0.809 1.00 . A A . 794 LYS HB2 1 1 7 4748 1 1 15 LYS HB3 H -9.230 1.083 1.865 1.00 . A A . 794 LYS HB3 1 1 7 4749 1 1 15 LYS HD2 H -11.241 3.300 3.254 1.00 . A A . 794 LYS HD2 1 1 7 4750 1 1 15 LYS HD3 H -11.541 2.205 4.602 1.00 . A A . 794 LYS HD3 1 1 7 4751 1 1 15 LYS HE2 H -8.871 2.605 3.253 1.00 . A A . 794 LYS HE2 1 1 7 4752 1 1 15 LYS HE3 H -9.364 3.374 4.758 1.00 . A A . 794 LYS HE3 1 1 7 4753 1 1 15 LYS HG2 H -12.188 1.259 2.397 1.00 . A A . 794 LYS HG2 1 1 7 4754 1 1 15 LYS HG3 H -10.984 0.292 3.248 1.00 . A A . 794 LYS HG3 1 1 7 4755 1 1 15 LYS HZ1 H -7.981 1.390 5.079 1.00 . A A . 794 LYS HZ1 1 1 7 4756 1 1 15 LYS HZ2 H -9.177 0.440 4.354 1.00 . A A . 794 LYS HZ2 1 1 7 4757 1 1 15 LYS HZ3 H -9.505 1.242 5.810 1.00 . A A . 794 LYS HZ3 1 1 7 4758 1 1 15 LYS N N -11.518 3.077 0.335 1.00 . A A . 794 LYS N 1 1 7 4759 1 1 15 LYS NZ N -9.003 1.309 4.897 1.00 . A A . 794 LYS NZ 1 1 7 4760 1 1 15 LYS O O -8.248 1.875 -0.219 1.00 . A A . 794 LYS O 1 1 7 4761 1 1 16 ALA C C -7.032 4.355 -1.680 1.00 . A A . 795 ALA C 1 1 7 4762 1 1 16 ALA CA C -8.313 3.761 -2.221 1.00 . A A . 795 ALA CA 1 1 7 4763 1 1 16 ALA CB C -8.874 4.583 -3.374 1.00 . A A . 795 ALA CB 1 1 7 4764 1 1 16 ALA H H -9.997 4.279 -1.086 1.00 . A A . 795 ALA H 1 1 7 4765 1 1 16 ALA HA H -8.100 2.775 -2.588 1.00 . A A . 795 ALA HA 1 1 7 4766 1 1 16 ALA HB1 H -9.709 4.059 -3.813 1.00 . A A . 795 ALA HB1 1 1 7 4767 1 1 16 ALA HB2 H -8.107 4.728 -4.121 1.00 . A A . 795 ALA HB2 1 1 7 4768 1 1 16 ALA HB3 H -9.205 5.543 -3.008 1.00 . A A . 795 ALA HB3 1 1 7 4769 1 1 16 ALA N N -9.274 3.637 -1.150 1.00 . A A . 795 ALA N 1 1 7 4770 1 1 16 ALA O O -6.141 3.621 -1.254 1.00 . A A . 795 ALA O 1 1 7 4771 1 1 17 ASN C C -4.520 5.734 -1.426 1.00 . A A . 796 ASN C 1 1 7 4772 1 1 17 ASN CA C -5.839 6.452 -1.152 1.00 . A A . 796 ASN CA 1 1 7 4773 1 1 17 ASN CB C -6.001 6.769 0.351 1.00 . A A . 796 ASN CB 1 1 7 4774 1 1 17 ASN CG C -6.390 5.571 1.208 1.00 . A A . 796 ASN CG 1 1 7 4775 1 1 17 ASN H H -7.762 6.177 -1.995 1.00 . A A . 796 ASN H 1 1 7 4776 1 1 17 ASN HA H -5.823 7.386 -1.692 1.00 . A A . 796 ASN HA 1 1 7 4777 1 1 17 ASN HB2 H -5.067 7.156 0.729 1.00 . A A . 796 ASN HB2 1 1 7 4778 1 1 17 ASN HB3 H -6.765 7.525 0.465 1.00 . A A . 796 ASN HB3 1 1 7 4779 1 1 17 ASN HD21 H -4.494 5.047 1.375 1.00 . A A . 796 ASN HD21 1 1 7 4780 1 1 17 ASN HD22 H -5.627 4.026 2.192 1.00 . A A . 796 ASN HD22 1 1 7 4781 1 1 17 ASN N N -6.984 5.688 -1.663 1.00 . A A . 796 ASN N 1 1 7 4782 1 1 17 ASN ND2 N -5.405 4.804 1.636 1.00 . A A . 796 ASN ND2 1 1 7 4783 1 1 17 ASN O O -3.721 5.489 -0.515 1.00 . A A . 796 ASN O 1 1 7 4784 1 1 17 ASN OD1 O -7.569 5.337 1.478 1.00 . A A . 796 ASN OD1 1 1 7 4785 1 1 18 LEU C C -1.939 5.412 -3.309 1.00 . A A . 797 LEU C 1 1 7 4786 1 1 18 LEU CA C -3.178 4.567 -3.071 1.00 . A A . 797 LEU CA 1 1 7 4787 1 1 18 LEU CB C -3.504 3.809 -4.358 1.00 . A A . 797 LEU CB 1 1 7 4788 1 1 18 LEU CD1 C -5.173 2.652 -5.817 1.00 . A A . 797 LEU CD1 1 1 7 4789 1 1 18 LEU CD2 C -4.828 1.859 -3.488 1.00 . A A . 797 LEU CD2 1 1 7 4790 1 1 18 LEU CG C -4.848 3.076 -4.396 1.00 . A A . 797 LEU CG 1 1 7 4791 1 1 18 LEU H H -4.846 5.752 -3.412 1.00 . A A . 797 LEU H 1 1 7 4792 1 1 18 LEU HA H -2.978 3.857 -2.282 1.00 . A A . 797 LEU HA 1 1 7 4793 1 1 18 LEU HB2 H -3.491 4.518 -5.163 1.00 . A A . 797 LEU HB2 1 1 7 4794 1 1 18 LEU HB3 H -2.721 3.084 -4.528 1.00 . A A . 797 LEU HB3 1 1 7 4795 1 1 18 LEU HD11 H -6.121 2.135 -5.831 1.00 . A A . 797 LEU HD11 1 1 7 4796 1 1 18 LEU HD12 H -4.398 1.994 -6.182 1.00 . A A . 797 LEU HD12 1 1 7 4797 1 1 18 LEU HD13 H -5.230 3.527 -6.449 1.00 . A A . 797 LEU HD13 1 1 7 4798 1 1 18 LEU HD21 H -4.044 1.187 -3.805 1.00 . A A . 797 LEU HD21 1 1 7 4799 1 1 18 LEU HD22 H -5.780 1.352 -3.543 1.00 . A A . 797 LEU HD22 1 1 7 4800 1 1 18 LEU HD23 H -4.646 2.171 -2.469 1.00 . A A . 797 LEU HD23 1 1 7 4801 1 1 18 LEU HG H -5.627 3.741 -4.055 1.00 . A A . 797 LEU HG 1 1 7 4802 1 1 18 LEU N N -4.292 5.399 -2.691 1.00 . A A . 797 LEU N 1 1 7 4803 1 1 18 LEU O O -2.018 6.580 -3.693 1.00 . A A . 797 LEU O 1 1 7 4804 1 1 19 LEU C C 1.361 4.154 -3.687 1.00 . A A . 798 LEU C 1 1 7 4805 1 1 19 LEU CA C 0.484 5.350 -3.419 1.00 . A A . 798 LEU CA 1 1 7 4806 1 1 19 LEU CB C 1.029 6.315 -2.325 1.00 . A A . 798 LEU CB 1 1 7 4807 1 1 19 LEU CD1 C 0.233 4.949 -0.329 1.00 . A A . 798 LEU CD1 1 1 7 4808 1 1 19 LEU CD2 C 2.652 4.939 -0.982 1.00 . A A . 798 LEU CD2 1 1 7 4809 1 1 19 LEU CG C 1.375 5.752 -0.930 1.00 . A A . 798 LEU CG 1 1 7 4810 1 1 19 LEU H H -0.842 3.917 -2.640 1.00 . A A . 798 LEU H 1 1 7 4811 1 1 19 LEU HA H 0.380 5.889 -4.344 1.00 . A A . 798 LEU HA 1 1 7 4812 1 1 19 LEU HB2 H 1.921 6.777 -2.714 1.00 . A A . 798 LEU HB2 1 1 7 4813 1 1 19 LEU HB3 H 0.291 7.093 -2.186 1.00 . A A . 798 LEU HB3 1 1 7 4814 1 1 19 LEU HD11 H -0.020 4.131 -0.989 1.00 . A A . 798 LEU HD11 1 1 7 4815 1 1 19 LEU HD12 H -0.628 5.588 -0.203 1.00 . A A . 798 LEU HD12 1 1 7 4816 1 1 19 LEU HD13 H 0.534 4.556 0.630 1.00 . A A . 798 LEU HD13 1 1 7 4817 1 1 19 LEU HD21 H 2.578 4.223 -1.789 1.00 . A A . 798 LEU HD21 1 1 7 4818 1 1 19 LEU HD22 H 2.790 4.418 -0.047 1.00 . A A . 798 LEU HD22 1 1 7 4819 1 1 19 LEU HD23 H 3.488 5.597 -1.159 1.00 . A A . 798 LEU HD23 1 1 7 4820 1 1 19 LEU HG H 1.553 6.586 -0.268 1.00 . A A . 798 LEU HG 1 1 7 4821 1 1 19 LEU N N -0.810 4.803 -3.070 1.00 . A A . 798 LEU N 1 1 7 4822 1 1 19 LEU O O 0.881 3.026 -3.534 1.00 . A A . 798 LEU O 1 1 7 4823 1 1 20 LYS C C 4.770 3.149 -3.916 1.00 . A A . 799 LYS C 1 1 7 4824 1 1 20 LYS CA C 3.352 3.135 -4.438 1.00 . A A . 799 LYS CA 1 1 7 4825 1 1 20 LYS CB C 3.345 2.874 -5.947 1.00 . A A . 799 LYS CB 1 1 7 4826 1 1 20 LYS CD C 4.223 3.552 -8.209 1.00 . A A . 799 LYS CD 1 1 7 4827 1 1 20 LYS CE C 4.854 4.676 -9.013 1.00 . A A . 799 LYS CE 1 1 7 4828 1 1 20 LYS CG C 4.124 3.912 -6.738 1.00 . A A . 799 LYS CG 1 1 7 4829 1 1 20 LYS H H 3.010 5.217 -4.136 1.00 . A A . 799 LYS H 1 1 7 4830 1 1 20 LYS HA H 2.846 2.341 -3.917 1.00 . A A . 799 LYS HA 1 1 7 4831 1 1 20 LYS HB2 H 3.782 1.905 -6.135 1.00 . A A . 799 LYS HB2 1 1 7 4832 1 1 20 LYS HB3 H 2.323 2.875 -6.298 1.00 . A A . 799 LYS HB3 1 1 7 4833 1 1 20 LYS HD2 H 4.830 2.665 -8.314 1.00 . A A . 799 LYS HD2 1 1 7 4834 1 1 20 LYS HD3 H 3.230 3.360 -8.592 1.00 . A A . 799 LYS HD3 1 1 7 4835 1 1 20 LYS HE2 H 5.792 4.948 -8.553 1.00 . A A . 799 LYS HE2 1 1 7 4836 1 1 20 LYS HE3 H 5.035 4.325 -10.018 1.00 . A A . 799 LYS HE3 1 1 7 4837 1 1 20 LYS HG2 H 3.630 4.863 -6.643 1.00 . A A . 799 LYS HG2 1 1 7 4838 1 1 20 LYS HG3 H 5.121 3.982 -6.326 1.00 . A A . 799 LYS HG3 1 1 7 4839 1 1 20 LYS HZ1 H 4.484 6.670 -9.522 1.00 . A A . 799 LYS HZ1 1 1 7 4840 1 1 20 LYS HZ2 H 3.697 6.165 -8.107 1.00 . A A . 799 LYS HZ2 1 1 7 4841 1 1 20 LYS HZ3 H 3.120 5.666 -9.623 1.00 . A A . 799 LYS HZ3 1 1 7 4842 1 1 20 LYS N N 2.603 4.323 -4.091 1.00 . A A . 799 LYS N 1 1 7 4843 1 1 20 LYS NZ N 3.979 5.877 -9.070 1.00 . A A . 799 LYS NZ 1 1 7 4844 1 1 20 LYS O O 5.453 4.174 -3.858 1.00 . A A . 799 LYS O 1 1 7 4845 1 1 21 CYS C C 7.545 2.125 -4.000 1.00 . A A . 800 CYS C 1 1 7 4846 1 1 21 CYS CA C 6.470 1.595 -3.052 1.00 . A A . 800 CYS CA 1 1 7 4847 1 1 21 CYS CB C 6.469 0.068 -3.018 1.00 . A A . 800 CYS CB 1 1 7 4848 1 1 21 CYS H H 4.456 1.256 -3.457 1.00 . A A . 800 CYS H 1 1 7 4849 1 1 21 CYS HA H 6.614 1.971 -2.052 1.00 . A A . 800 CYS HA 1 1 7 4850 1 1 21 CYS HB2 H 5.765 -0.260 -2.264 1.00 . A A . 800 CYS HB2 1 1 7 4851 1 1 21 CYS HB3 H 6.131 -0.293 -3.981 1.00 . A A . 800 CYS HB3 1 1 7 4852 1 1 21 CYS N N 5.143 1.955 -3.499 1.00 . A A . 800 CYS N 1 1 7 4853 1 1 21 CYS O O 7.667 1.650 -5.124 1.00 . A A . 800 CYS O 1 1 7 4854 1 1 21 CYS SG S 8.024 -0.758 -2.657 1.00 . A A . 800 CYS SG 1 1 7 4855 1 1 22 GLU C C 10.484 2.707 -4.720 1.00 . A A . 801 GLU C 1 1 7 4856 1 1 22 GLU CA C 9.397 3.721 -4.324 1.00 . A A . 801 GLU CA 1 1 7 4857 1 1 22 GLU CB C 10.028 4.868 -3.521 1.00 . A A . 801 GLU CB 1 1 7 4858 1 1 22 GLU CD C 11.877 6.598 -3.456 1.00 . A A . 801 GLU CD 1 1 7 4859 1 1 22 GLU CG C 10.979 5.745 -4.328 1.00 . A A . 801 GLU CG 1 1 7 4860 1 1 22 GLU H H 8.136 3.459 -2.635 1.00 . A A . 801 GLU H 1 1 7 4861 1 1 22 GLU HA H 8.974 4.121 -5.232 1.00 . A A . 801 GLU HA 1 1 7 4862 1 1 22 GLU HB2 H 9.238 5.496 -3.135 1.00 . A A . 801 GLU HB2 1 1 7 4863 1 1 22 GLU HB3 H 10.578 4.450 -2.693 1.00 . A A . 801 GLU HB3 1 1 7 4864 1 1 22 GLU HG2 H 11.601 5.107 -4.940 1.00 . A A . 801 GLU HG2 1 1 7 4865 1 1 22 GLU HG3 H 10.398 6.395 -4.966 1.00 . A A . 801 GLU HG3 1 1 7 4866 1 1 22 GLU N N 8.316 3.106 -3.535 1.00 . A A . 801 GLU N 1 1 7 4867 1 1 22 GLU O O 11.447 3.049 -5.410 1.00 . A A . 801 GLU O 1 1 7 4868 1 1 22 GLU OE1 O 11.368 7.553 -2.828 1.00 . A A . 801 GLU OE1 1 1 7 4869 1 1 22 GLU OE2 O 13.091 6.322 -3.386 1.00 . A A . 801 GLU OE2 1 1 7 4870 1 1 23 TYR C C 10.863 -0.371 -5.852 1.00 . A A . 802 TYR C 1 1 7 4871 1 1 23 TYR CA C 11.309 0.440 -4.632 1.00 . A A . 802 TYR CA 1 1 7 4872 1 1 23 TYR CB C 11.553 -0.462 -3.410 1.00 . A A . 802 TYR CB 1 1 7 4873 1 1 23 TYR CD1 C 13.954 -1.247 -3.317 1.00 . A A . 802 TYR CD1 1 1 7 4874 1 1 23 TYR CD2 C 12.294 -2.788 -4.060 1.00 . A A . 802 TYR CD2 1 1 7 4875 1 1 23 TYR CE1 C 14.928 -2.211 -3.485 1.00 . A A . 802 TYR CE1 1 1 7 4876 1 1 23 TYR CE2 C 13.264 -3.757 -4.227 1.00 . A A . 802 TYR CE2 1 1 7 4877 1 1 23 TYR CG C 12.621 -1.518 -3.603 1.00 . A A . 802 TYR CG 1 1 7 4878 1 1 23 TYR CZ C 14.579 -3.463 -3.940 1.00 . A A . 802 TYR CZ 1 1 7 4879 1 1 23 TYR H H 9.495 1.211 -3.853 1.00 . A A . 802 TYR H 1 1 7 4880 1 1 23 TYR HA H 12.214 0.961 -4.900 1.00 . A A . 802 TYR HA 1 1 7 4881 1 1 23 TYR HB2 H 11.853 0.152 -2.575 1.00 . A A . 802 TYR HB2 1 1 7 4882 1 1 23 TYR HB3 H 10.632 -0.967 -3.160 1.00 . A A . 802 TYR HB3 1 1 7 4883 1 1 23 TYR HD1 H 14.225 -0.266 -2.960 1.00 . A A . 802 TYR HD1 1 1 7 4884 1 1 23 TYR HD2 H 11.262 -3.015 -4.284 1.00 . A A . 802 TYR HD2 1 1 7 4885 1 1 23 TYR HE1 H 15.959 -1.981 -3.260 1.00 . A A . 802 TYR HE1 1 1 7 4886 1 1 23 TYR HE2 H 12.990 -4.738 -4.584 1.00 . A A . 802 TYR HE2 1 1 7 4887 1 1 23 TYR HH H 15.479 -4.810 -4.984 1.00 . A A . 802 TYR HH 1 1 7 4888 1 1 23 TYR N N 10.320 1.456 -4.322 1.00 . A A . 802 TYR N 1 1 7 4889 1 1 23 TYR O O 11.643 -0.573 -6.782 1.00 . A A . 802 TYR O 1 1 7 4890 1 1 23 TYR OH O 15.547 -4.427 -4.100 1.00 . A A . 802 TYR OH 1 1 7 4891 1 1 24 CYS C C 7.955 -0.959 -7.717 1.00 . A A . 803 CYS C 1 1 7 4892 1 1 24 CYS CA C 9.104 -1.633 -6.957 1.00 . A A . 803 CYS CA 1 1 7 4893 1 1 24 CYS CB C 8.674 -3.001 -6.438 1.00 . A A . 803 CYS CB 1 1 7 4894 1 1 24 CYS H H 9.051 -0.661 -5.072 1.00 . A A . 803 CYS H 1 1 7 4895 1 1 24 CYS HA H 9.887 -1.751 -7.685 1.00 . A A . 803 CYS HA 1 1 7 4896 1 1 24 CYS HB2 H 8.091 -3.503 -7.197 1.00 . A A . 803 CYS HB2 1 1 7 4897 1 1 24 CYS HB3 H 9.552 -3.588 -6.215 1.00 . A A . 803 CYS HB3 1 1 7 4898 1 1 24 CYS N N 9.617 -0.826 -5.851 1.00 . A A . 803 CYS N 1 1 7 4899 1 1 24 CYS O O 7.765 -1.230 -8.903 1.00 . A A . 803 CYS O 1 1 7 4900 1 1 24 CYS SG S 7.668 -2.909 -4.930 1.00 . A A . 803 CYS SG 1 1 7 4901 1 1 25 GLY C C 4.796 0.018 -7.670 1.00 . A A . 804 GLY C 1 1 7 4902 1 1 25 GLY CA C 6.170 0.647 -7.784 1.00 . A A . 804 GLY CA 1 1 7 4903 1 1 25 GLY H H 7.333 0.073 -6.113 1.00 . A A . 804 GLY H 1 1 7 4904 1 1 25 GLY HA2 H 6.127 1.653 -7.393 1.00 . A A . 804 GLY HA2 1 1 7 4905 1 1 25 GLY HA3 H 6.445 0.694 -8.828 1.00 . A A . 804 GLY HA3 1 1 7 4906 1 1 25 GLY N N 7.195 -0.088 -7.069 1.00 . A A . 804 GLY N 1 1 7 4907 1 1 25 GLY O O 3.913 0.298 -8.480 1.00 . A A . 804 GLY O 1 1 7 4908 1 1 26 LYS C C 2.341 -0.498 -5.793 1.00 . A A . 805 LYS C 1 1 7 4909 1 1 26 LYS CA C 3.316 -1.469 -6.451 1.00 . A A . 805 LYS CA 1 1 7 4910 1 1 26 LYS CB C 3.469 -2.715 -5.572 1.00 . A A . 805 LYS CB 1 1 7 4911 1 1 26 LYS CD C 4.107 -4.272 -7.472 1.00 . A A . 805 LYS CD 1 1 7 4912 1 1 26 LYS CE C 2.965 -5.285 -7.419 1.00 . A A . 805 LYS CE 1 1 7 4913 1 1 26 LYS CG C 4.476 -3.728 -6.094 1.00 . A A . 805 LYS CG 1 1 7 4914 1 1 26 LYS H H 5.334 -0.993 -6.038 1.00 . A A . 805 LYS H 1 1 7 4915 1 1 26 LYS HA H 2.918 -1.762 -7.411 1.00 . A A . 805 LYS HA 1 1 7 4916 1 1 26 LYS HB2 H 3.786 -2.405 -4.586 1.00 . A A . 805 LYS HB2 1 1 7 4917 1 1 26 LYS HB3 H 2.509 -3.203 -5.492 1.00 . A A . 805 LYS HB3 1 1 7 4918 1 1 26 LYS HD2 H 3.811 -3.447 -8.101 1.00 . A A . 805 LYS HD2 1 1 7 4919 1 1 26 LYS HD3 H 4.977 -4.750 -7.897 1.00 . A A . 805 LYS HD3 1 1 7 4920 1 1 26 LYS HE2 H 2.973 -5.858 -8.335 1.00 . A A . 805 LYS HE2 1 1 7 4921 1 1 26 LYS HE3 H 3.136 -5.951 -6.584 1.00 . A A . 805 LYS HE3 1 1 7 4922 1 1 26 LYS HG2 H 5.443 -3.253 -6.159 1.00 . A A . 805 LYS HG2 1 1 7 4923 1 1 26 LYS HG3 H 4.529 -4.551 -5.397 1.00 . A A . 805 LYS HG3 1 1 7 4924 1 1 26 LYS HZ1 H 1.529 -3.848 -7.926 1.00 . A A . 805 LYS HZ1 1 1 7 4925 1 1 26 LYS HZ2 H 1.494 -4.303 -6.292 1.00 . A A . 805 LYS HZ2 1 1 7 4926 1 1 26 LYS HZ3 H 0.881 -5.345 -7.474 1.00 . A A . 805 LYS HZ3 1 1 7 4927 1 1 26 LYS N N 4.606 -0.823 -6.665 1.00 . A A . 805 LYS N 1 1 7 4928 1 1 26 LYS NZ N 1.627 -4.650 -7.266 1.00 . A A . 805 LYS NZ 1 1 7 4929 1 1 26 LYS O O 2.652 0.086 -4.752 1.00 . A A . 805 LYS O 1 1 7 4930 1 1 27 TYR C C -0.710 -0.229 -4.857 1.00 . A A . 806 TYR C 1 1 7 4931 1 1 27 TYR CA C 0.143 0.545 -5.841 1.00 . A A . 806 TYR CA 1 1 7 4932 1 1 27 TYR CB C -0.753 1.137 -6.932 1.00 . A A . 806 TYR CB 1 1 7 4933 1 1 27 TYR CD1 C 0.036 3.439 -7.580 1.00 . A A . 806 TYR CD1 1 1 7 4934 1 1 27 TYR CD2 C 0.500 1.633 -9.067 1.00 . A A . 806 TYR CD2 1 1 7 4935 1 1 27 TYR CE1 C 0.659 4.316 -8.444 1.00 . A A . 806 TYR CE1 1 1 7 4936 1 1 27 TYR CE2 C 1.124 2.505 -9.938 1.00 . A A . 806 TYR CE2 1 1 7 4937 1 1 27 TYR CG C -0.054 2.086 -7.876 1.00 . A A . 806 TYR CG 1 1 7 4938 1 1 27 TYR CZ C 1.201 3.844 -9.622 1.00 . A A . 806 TYR CZ 1 1 7 4939 1 1 27 TYR H H 0.957 -0.874 -7.187 1.00 . A A . 806 TYR H 1 1 7 4940 1 1 27 TYR HA H 0.626 1.342 -5.296 1.00 . A A . 806 TYR HA 1 1 7 4941 1 1 27 TYR HB2 H -1.164 0.336 -7.520 1.00 . A A . 806 TYR HB2 1 1 7 4942 1 1 27 TYR HB3 H -1.562 1.678 -6.461 1.00 . A A . 806 TYR HB3 1 1 7 4943 1 1 27 TYR HD1 H -0.390 3.807 -6.656 1.00 . A A . 806 TYR HD1 1 1 7 4944 1 1 27 TYR HD2 H 0.439 0.583 -9.310 1.00 . A A . 806 TYR HD2 1 1 7 4945 1 1 27 TYR HE1 H 0.719 5.367 -8.197 1.00 . A A . 806 TYR HE1 1 1 7 4946 1 1 27 TYR HE2 H 1.548 2.136 -10.860 1.00 . A A . 806 TYR HE2 1 1 7 4947 1 1 27 TYR HH H 1.496 4.555 -11.389 1.00 . A A . 806 TYR HH 1 1 7 4948 1 1 27 TYR N N 1.167 -0.337 -6.392 1.00 . A A . 806 TYR N 1 1 7 4949 1 1 27 TYR O O -1.148 -1.348 -5.138 1.00 . A A . 806 TYR O 1 1 7 4950 1 1 27 TYR OH O 1.821 4.716 -10.488 1.00 . A A . 806 TYR OH 1 1 7 4951 1 1 28 ALA C C -2.240 0.723 -1.686 1.00 . A A . 807 ALA C 1 1 7 4952 1 1 28 ALA CA C -1.629 -0.298 -2.628 1.00 . A A . 807 ALA CA 1 1 7 4953 1 1 28 ALA CB C -0.651 -1.214 -1.889 1.00 . A A . 807 ALA CB 1 1 7 4954 1 1 28 ALA H H -0.617 1.297 -3.583 1.00 . A A . 807 ALA H 1 1 7 4955 1 1 28 ALA HA H -2.415 -0.906 -3.050 1.00 . A A . 807 ALA HA 1 1 7 4956 1 1 28 ALA HB1 H -0.284 -1.969 -2.567 1.00 . A A . 807 ALA HB1 1 1 7 4957 1 1 28 ALA HB2 H -1.154 -1.689 -1.060 1.00 . A A . 807 ALA HB2 1 1 7 4958 1 1 28 ALA HB3 H 0.187 -0.634 -1.516 1.00 . A A . 807 ALA HB3 1 1 7 4959 1 1 28 ALA N N -0.941 0.373 -3.707 1.00 . A A . 807 ALA N 1 1 7 4960 1 1 28 ALA O O -1.813 1.881 -1.664 1.00 . A A . 807 ALA O 1 1 7 4961 1 1 29 PRO C C -2.867 1.535 1.147 1.00 . A A . 808 PRO C 1 1 7 4962 1 1 29 PRO CA C -3.885 1.185 0.076 1.00 . A A . 808 PRO CA 1 1 7 4963 1 1 29 PRO CB C -5.013 0.328 0.661 1.00 . A A . 808 PRO CB 1 1 7 4964 1 1 29 PRO CD C -3.912 -1.002 -0.972 1.00 . A A . 808 PRO CD 1 1 7 4965 1 1 29 PRO CG C -5.251 -0.734 -0.358 1.00 . A A . 808 PRO CG 1 1 7 4966 1 1 29 PRO HA H -4.297 2.091 -0.361 1.00 . A A . 808 PRO HA 1 1 7 4967 1 1 29 PRO HB2 H -4.699 -0.089 1.609 1.00 . A A . 808 PRO HB2 1 1 7 4968 1 1 29 PRO HB3 H -5.889 0.939 0.804 1.00 . A A . 808 PRO HB3 1 1 7 4969 1 1 29 PRO HD2 H -3.361 -1.723 -0.383 1.00 . A A . 808 PRO HD2 1 1 7 4970 1 1 29 PRO HD3 H -4.017 -1.344 -1.989 1.00 . A A . 808 PRO HD3 1 1 7 4971 1 1 29 PRO HG2 H -5.634 -1.623 0.120 1.00 . A A . 808 PRO HG2 1 1 7 4972 1 1 29 PRO HG3 H -5.941 -0.376 -1.109 1.00 . A A . 808 PRO HG3 1 1 7 4973 1 1 29 PRO N N -3.269 0.322 -0.926 1.00 . A A . 808 PRO N 1 1 7 4974 1 1 29 PRO O O -2.171 0.654 1.661 1.00 . A A . 808 PRO O 1 1 7 4975 1 1 30 ALA C C -1.604 2.547 3.668 1.00 . A A . 809 ALA C 1 1 7 4976 1 1 30 ALA CA C -1.760 3.369 2.374 1.00 . A A . 809 ALA CA 1 1 7 4977 1 1 30 ALA CB C -2.105 4.808 2.714 1.00 . A A . 809 ALA CB 1 1 7 4978 1 1 30 ALA H H -3.308 3.458 0.904 1.00 . A A . 809 ALA H 1 1 7 4979 1 1 30 ALA HA H -0.802 3.378 1.873 1.00 . A A . 809 ALA HA 1 1 7 4980 1 1 30 ALA HB1 H -3.035 4.834 3.261 1.00 . A A . 809 ALA HB1 1 1 7 4981 1 1 30 ALA HB2 H -2.207 5.379 1.802 1.00 . A A . 809 ALA HB2 1 1 7 4982 1 1 30 ALA HB3 H -1.318 5.234 3.320 1.00 . A A . 809 ALA HB3 1 1 7 4983 1 1 30 ALA N N -2.747 2.827 1.419 1.00 . A A . 809 ALA N 1 1 7 4984 1 1 30 ALA O O -0.555 2.605 4.313 1.00 . A A . 809 ALA O 1 1 7 4985 1 1 31 GLU C C -1.499 -0.119 5.145 1.00 . A A . 810 GLU C 1 1 7 4986 1 1 31 GLU CA C -2.579 0.958 5.246 1.00 . A A . 810 GLU CA 1 1 7 4987 1 1 31 GLU CB C -3.939 0.296 5.508 1.00 . A A . 810 GLU CB 1 1 7 4988 1 1 31 GLU CD C -5.509 2.183 4.882 1.00 . A A . 810 GLU CD 1 1 7 4989 1 1 31 GLU CG C -5.027 1.253 5.974 1.00 . A A . 810 GLU CG 1 1 7 4990 1 1 31 GLU H H -3.432 1.775 3.485 1.00 . A A . 810 GLU H 1 1 7 4991 1 1 31 GLU HA H -2.335 1.588 6.087 1.00 . A A . 810 GLU HA 1 1 7 4992 1 1 31 GLU HB2 H -4.276 -0.172 4.594 1.00 . A A . 810 GLU HB2 1 1 7 4993 1 1 31 GLU HB3 H -3.814 -0.466 6.262 1.00 . A A . 810 GLU HB3 1 1 7 4994 1 1 31 GLU HG2 H -5.869 0.675 6.326 1.00 . A A . 810 GLU HG2 1 1 7 4995 1 1 31 GLU HG3 H -4.637 1.847 6.787 1.00 . A A . 810 GLU HG3 1 1 7 4996 1 1 31 GLU N N -2.629 1.796 4.047 1.00 . A A . 810 GLU N 1 1 7 4997 1 1 31 GLU O O -0.934 -0.533 6.157 1.00 . A A . 810 GLU O 1 1 7 4998 1 1 31 GLU OE1 O -6.392 1.778 4.094 1.00 . A A . 810 GLU OE1 1 1 7 4999 1 1 31 GLU OE2 O -5.003 3.320 4.814 1.00 . A A . 810 GLU OE2 1 1 7 5000 1 1 32 GLN C C 1.159 -1.134 3.720 1.00 . A A . 811 GLN C 1 1 7 5001 1 1 32 GLN CA C -0.275 -1.656 3.723 1.00 . A A . 811 GLN CA 1 1 7 5002 1 1 32 GLN CB C -0.635 -2.389 2.418 1.00 . A A . 811 GLN CB 1 1 7 5003 1 1 32 GLN CD C 1.116 -3.125 0.736 1.00 . A A . 811 GLN CD 1 1 7 5004 1 1 32 GLN CG C 0.342 -3.478 1.996 1.00 . A A . 811 GLN CG 1 1 7 5005 1 1 32 GLN H H -1.544 -0.072 3.144 1.00 . A A . 811 GLN H 1 1 7 5006 1 1 32 GLN HA H -0.407 -2.326 4.562 1.00 . A A . 811 GLN HA 1 1 7 5007 1 1 32 GLN HB2 H -1.603 -2.849 2.545 1.00 . A A . 811 GLN HB2 1 1 7 5008 1 1 32 GLN HB3 H -0.702 -1.665 1.623 1.00 . A A . 811 GLN HB3 1 1 7 5009 1 1 32 GLN HE21 H 1.092 -1.193 1.198 1.00 . A A . 811 GLN HE21 1 1 7 5010 1 1 32 GLN HE22 H 1.857 -1.594 -0.289 1.00 . A A . 811 GLN HE22 1 1 7 5011 1 1 32 GLN HG2 H 1.045 -3.642 2.798 1.00 . A A . 811 GLN HG2 1 1 7 5012 1 1 32 GLN HG3 H -0.214 -4.387 1.816 1.00 . A A . 811 GLN HG3 1 1 7 5013 1 1 32 GLN N N -1.192 -0.546 3.929 1.00 . A A . 811 GLN N 1 1 7 5014 1 1 32 GLN NE2 N 1.388 -1.842 0.531 1.00 . A A . 811 GLN NE2 1 1 7 5015 1 1 32 GLN O O 2.126 -1.891 3.634 1.00 . A A . 811 GLN O 1 1 7 5016 1 1 32 GLN OE1 O 1.485 -4.004 -0.042 1.00 . A A . 811 GLN OE1 1 1 7 5017 1 1 33 PHE C C 3.092 1.024 5.239 1.00 . A A . 812 PHE C 1 1 7 5018 1 1 33 PHE CA C 2.575 0.825 3.824 1.00 . A A . 812 PHE CA 1 1 7 5019 1 1 33 PHE CB C 2.496 2.135 3.045 1.00 . A A . 812 PHE CB 1 1 7 5020 1 1 33 PHE CD1 C 1.028 1.701 1.061 1.00 . A A . 812 PHE CD1 1 1 7 5021 1 1 33 PHE CD2 C 3.371 1.918 0.707 1.00 . A A . 812 PHE CD2 1 1 7 5022 1 1 33 PHE CE1 C 0.835 1.520 -0.294 1.00 . A A . 812 PHE CE1 1 1 7 5023 1 1 33 PHE CE2 C 3.185 1.733 -0.646 1.00 . A A . 812 PHE CE2 1 1 7 5024 1 1 33 PHE CG C 2.296 1.903 1.576 1.00 . A A . 812 PHE CG 1 1 7 5025 1 1 33 PHE CZ C 1.939 1.415 -1.133 1.00 . A A . 812 PHE CZ 1 1 7 5026 1 1 33 PHE H H 0.498 0.694 4.146 1.00 . A A . 812 PHE H 1 1 7 5027 1 1 33 PHE HA H 3.252 0.155 3.315 1.00 . A A . 812 PHE HA 1 1 7 5028 1 1 33 PHE HB2 H 1.666 2.719 3.413 1.00 . A A . 812 PHE HB2 1 1 7 5029 1 1 33 PHE HB3 H 3.415 2.686 3.178 1.00 . A A . 812 PHE HB3 1 1 7 5030 1 1 33 PHE HD1 H 0.182 1.689 1.731 1.00 . A A . 812 PHE HD1 1 1 7 5031 1 1 33 PHE HD2 H 4.368 2.075 1.096 1.00 . A A . 812 PHE HD2 1 1 7 5032 1 1 33 PHE HE1 H -0.159 1.362 -0.682 1.00 . A A . 812 PHE HE1 1 1 7 5033 1 1 33 PHE HE2 H 4.034 1.744 -1.314 1.00 . A A . 812 PHE HE2 1 1 7 5034 1 1 33 PHE HZ H 1.798 1.223 -2.186 1.00 . A A . 812 PHE HZ 1 1 7 5035 1 1 33 PHE N N 1.281 0.176 3.869 1.00 . A A . 812 PHE N 1 1 7 5036 1 1 33 PHE O O 3.169 2.142 5.750 1.00 . A A . 812 PHE O 1 1 7 5037 1 1 34 ARG C C 5.390 0.315 7.216 1.00 . A A . 813 ARG C 1 1 7 5038 1 1 34 ARG CA C 3.932 -0.119 7.218 1.00 . A A . 813 ARG CA 1 1 7 5039 1 1 34 ARG CB C 3.812 -1.526 7.809 1.00 . A A . 813 ARG CB 1 1 7 5040 1 1 34 ARG CD C 1.556 -1.139 8.836 1.00 . A A . 813 ARG CD 1 1 7 5041 1 1 34 ARG CG C 2.381 -2.021 7.916 1.00 . A A . 813 ARG CG 1 1 7 5042 1 1 34 ARG CZ C 1.330 -1.137 11.293 1.00 . A A . 813 ARG CZ 1 1 7 5043 1 1 34 ARG H H 3.232 -0.944 5.406 1.00 . A A . 813 ARG H 1 1 7 5044 1 1 34 ARG HA H 3.360 0.569 7.820 1.00 . A A . 813 ARG HA 1 1 7 5045 1 1 34 ARG HB2 H 4.363 -2.213 7.187 1.00 . A A . 813 ARG HB2 1 1 7 5046 1 1 34 ARG HB3 H 4.242 -1.524 8.799 1.00 . A A . 813 ARG HB3 1 1 7 5047 1 1 34 ARG HD2 H 1.558 -0.133 8.443 1.00 . A A . 813 ARG HD2 1 1 7 5048 1 1 34 ARG HD3 H 0.543 -1.513 8.860 1.00 . A A . 813 ARG HD3 1 1 7 5049 1 1 34 ARG HE H 3.073 -1.089 10.298 1.00 . A A . 813 ARG HE 1 1 7 5050 1 1 34 ARG HG2 H 1.934 -2.018 6.932 1.00 . A A . 813 ARG HG2 1 1 7 5051 1 1 34 ARG HG3 H 2.387 -3.028 8.307 1.00 . A A . 813 ARG HG3 1 1 7 5052 1 1 34 ARG HH11 H -0.435 -1.194 10.289 1.00 . A A . 813 ARG HH11 1 1 7 5053 1 1 34 ARG HH12 H -0.560 -1.188 12.023 1.00 . A A . 813 ARG HH12 1 1 7 5054 1 1 34 ARG HH21 H 2.901 -1.105 12.575 1.00 . A A . 813 ARG HH21 1 1 7 5055 1 1 34 ARG HH22 H 1.334 -1.145 13.318 1.00 . A A . 813 ARG HH22 1 1 7 5056 1 1 34 ARG N N 3.395 -0.098 5.869 1.00 . A A . 813 ARG N 1 1 7 5057 1 1 34 ARG NE N 2.087 -1.118 10.197 1.00 . A A . 813 ARG NE 1 1 7 5058 1 1 34 ARG NH1 N 0.006 -1.176 11.194 1.00 . A A . 813 ARG NH1 1 1 7 5059 1 1 34 ARG NH2 N 1.900 -1.126 12.491 1.00 . A A . 813 ARG NH2 1 1 7 5060 1 1 34 ARG O O 6.158 -0.060 6.333 1.00 . A A . 813 ARG O 1 1 7 5061 1 1 35 GLY C C 7.235 3.004 7.719 1.00 . A A . 814 GLY C 1 1 7 5062 1 1 35 GLY CA C 7.113 1.610 8.284 1.00 . A A . 814 GLY CA 1 1 7 5063 1 1 35 GLY H H 5.088 1.425 8.846 1.00 . A A . 814 GLY H 1 1 7 5064 1 1 35 GLY HA2 H 7.418 1.621 9.320 1.00 . A A . 814 GLY HA2 1 1 7 5065 1 1 35 GLY HA3 H 7.763 0.948 7.732 1.00 . A A . 814 GLY HA3 1 1 7 5066 1 1 35 GLY N N 5.756 1.127 8.193 1.00 . A A . 814 GLY N 1 1 7 5067 1 1 35 GLY O O 7.915 3.858 8.286 1.00 . A A . 814 GLY O 1 1 7 5068 1 1 36 SER C C 5.590 4.464 4.752 1.00 . A A . 815 SER C 1 1 7 5069 1 1 36 SER CA C 6.543 4.515 5.939 1.00 . A A . 815 SER CA 1 1 7 5070 1 1 36 SER CB C 7.953 4.890 5.464 1.00 . A A . 815 SER CB 1 1 7 5071 1 1 36 SER H H 6.055 2.481 6.198 1.00 . A A . 815 SER H 1 1 7 5072 1 1 36 SER HA H 6.195 5.252 6.647 1.00 . A A . 815 SER HA 1 1 7 5073 1 1 36 SER HB2 H 8.638 4.838 6.297 1.00 . A A . 815 SER HB2 1 1 7 5074 1 1 36 SER HB3 H 8.269 4.196 4.700 1.00 . A A . 815 SER HB3 1 1 7 5075 1 1 36 SER HG H 8.580 6.748 5.467 1.00 . A A . 815 SER HG 1 1 7 5076 1 1 36 SER N N 6.559 3.224 6.601 1.00 . A A . 815 SER N 1 1 7 5077 1 1 36 SER O O 5.580 3.483 4.007 1.00 . A A . 815 SER O 1 1 7 5078 1 1 36 SER OG O 7.989 6.200 4.930 1.00 . A A . 815 SER OG 1 1 7 5079 1 1 37 LYS C C 4.654 5.963 2.176 1.00 . A A . 816 LYS C 1 1 7 5080 1 1 37 LYS CA C 3.867 5.601 3.439 1.00 . A A . 816 LYS CA 1 1 7 5081 1 1 37 LYS CB C 2.783 6.653 3.702 1.00 . A A . 816 LYS CB 1 1 7 5082 1 1 37 LYS CD C 1.528 5.058 5.185 1.00 . A A . 816 LYS CD 1 1 7 5083 1 1 37 LYS CE C 0.747 4.902 6.474 1.00 . A A . 816 LYS CE 1 1 7 5084 1 1 37 LYS CG C 2.053 6.473 5.024 1.00 . A A . 816 LYS CG 1 1 7 5085 1 1 37 LYS H H 4.826 6.257 5.218 1.00 . A A . 816 LYS H 1 1 7 5086 1 1 37 LYS HA H 3.396 4.628 3.302 1.00 . A A . 816 LYS HA 1 1 7 5087 1 1 37 LYS HB2 H 3.242 7.631 3.702 1.00 . A A . 816 LYS HB2 1 1 7 5088 1 1 37 LYS HB3 H 2.056 6.608 2.905 1.00 . A A . 816 LYS HB3 1 1 7 5089 1 1 37 LYS HD2 H 0.883 4.826 4.352 1.00 . A A . 816 LYS HD2 1 1 7 5090 1 1 37 LYS HD3 H 2.365 4.377 5.197 1.00 . A A . 816 LYS HD3 1 1 7 5091 1 1 37 LYS HE2 H 1.351 5.263 7.292 1.00 . A A . 816 LYS HE2 1 1 7 5092 1 1 37 LYS HE3 H -0.157 5.490 6.409 1.00 . A A . 816 LYS HE3 1 1 7 5093 1 1 37 LYS HG2 H 2.735 6.684 5.833 1.00 . A A . 816 LYS HG2 1 1 7 5094 1 1 37 LYS HG3 H 1.221 7.162 5.062 1.00 . A A . 816 LYS HG3 1 1 7 5095 1 1 37 LYS HZ1 H 0.054 3.036 5.855 1.00 . A A . 816 LYS HZ1 1 1 7 5096 1 1 37 LYS HZ2 H -0.377 3.436 7.443 1.00 . A A . 816 LYS HZ2 1 1 7 5097 1 1 37 LYS HZ3 H 1.217 2.964 7.093 1.00 . A A . 816 LYS HZ3 1 1 7 5098 1 1 37 LYS N N 4.786 5.511 4.578 1.00 . A A . 816 LYS N 1 1 7 5099 1 1 37 LYS NZ N 0.386 3.487 6.733 1.00 . A A . 816 LYS NZ 1 1 7 5100 1 1 37 LYS O O 4.354 6.943 1.493 1.00 . A A . 816 LYS O 1 1 7 5101 1 1 38 ARG C C 7.088 4.057 0.256 1.00 . A A . 817 ARG C 1 1 7 5102 1 1 38 ARG CA C 6.635 5.390 0.830 1.00 . A A . 817 ARG CA 1 1 7 5103 1 1 38 ARG CB C 7.859 6.147 1.365 1.00 . A A . 817 ARG CB 1 1 7 5104 1 1 38 ARG CD C 8.800 8.213 2.427 1.00 . A A . 817 ARG CD 1 1 7 5105 1 1 38 ARG CG C 7.552 7.540 1.885 1.00 . A A . 817 ARG CG 1 1 7 5106 1 1 38 ARG CZ C 9.371 10.197 3.774 1.00 . A A . 817 ARG CZ 1 1 7 5107 1 1 38 ARG H H 5.760 4.334 2.431 1.00 . A A . 817 ARG H 1 1 7 5108 1 1 38 ARG HA H 6.199 5.957 0.022 1.00 . A A . 817 ARG HA 1 1 7 5109 1 1 38 ARG HB2 H 8.295 5.577 2.171 1.00 . A A . 817 ARG HB2 1 1 7 5110 1 1 38 ARG HB3 H 8.584 6.237 0.569 1.00 . A A . 817 ARG HB3 1 1 7 5111 1 1 38 ARG HD2 H 9.263 7.557 3.149 1.00 . A A . 817 ARG HD2 1 1 7 5112 1 1 38 ARG HD3 H 9.484 8.389 1.609 1.00 . A A . 817 ARG HD3 1 1 7 5113 1 1 38 ARG HE H 7.565 9.823 2.987 1.00 . A A . 817 ARG HE 1 1 7 5114 1 1 38 ARG HG2 H 7.157 8.138 1.076 1.00 . A A . 817 ARG HG2 1 1 7 5115 1 1 38 ARG HG3 H 6.819 7.470 2.675 1.00 . A A . 817 ARG HG3 1 1 7 5116 1 1 38 ARG HH11 H 10.936 8.953 3.403 1.00 . A A . 817 ARG HH11 1 1 7 5117 1 1 38 ARG HH12 H 11.298 10.323 4.415 1.00 . A A . 817 ARG HH12 1 1 7 5118 1 1 38 ARG HH21 H 8.036 11.629 4.290 1.00 . A A . 817 ARG HH21 1 1 7 5119 1 1 38 ARG HH22 H 9.646 11.871 4.883 1.00 . A A . 817 ARG HH22 1 1 7 5120 1 1 38 ARG N N 5.662 5.152 1.894 1.00 . A A . 817 ARG N 1 1 7 5121 1 1 38 ARG NE N 8.492 9.487 3.071 1.00 . A A . 817 ARG NE 1 1 7 5122 1 1 38 ARG NH1 N 10.633 9.795 3.870 1.00 . A A . 817 ARG NH1 1 1 7 5123 1 1 38 ARG NH2 N 8.985 11.319 4.368 1.00 . A A . 817 ARG NH2 1 1 7 5124 1 1 38 ARG O O 7.422 3.957 -0.926 1.00 . A A . 817 ARG O 1 1 7 5125 1 1 39 PHE C C 6.359 0.773 1.255 1.00 . A A . 818 PHE C 1 1 7 5126 1 1 39 PHE CA C 7.392 1.694 0.653 1.00 . A A . 818 PHE CA 1 1 7 5127 1 1 39 PHE CB C 8.794 1.286 1.115 1.00 . A A . 818 PHE CB 1 1 7 5128 1 1 39 PHE CD1 C 10.423 1.948 -0.673 1.00 . A A . 818 PHE CD1 1 1 7 5129 1 1 39 PHE CD2 C 10.332 3.255 1.320 1.00 . A A . 818 PHE CD2 1 1 7 5130 1 1 39 PHE CE1 C 11.406 2.778 -1.173 1.00 . A A . 818 PHE CE1 1 1 7 5131 1 1 39 PHE CE2 C 11.312 4.089 0.823 1.00 . A A . 818 PHE CE2 1 1 7 5132 1 1 39 PHE CG C 9.876 2.176 0.579 1.00 . A A . 818 PHE CG 1 1 7 5133 1 1 39 PHE CZ C 11.849 3.851 -0.425 1.00 . A A . 818 PHE CZ 1 1 7 5134 1 1 39 PHE H H 6.892 3.155 2.041 1.00 . A A . 818 PHE H 1 1 7 5135 1 1 39 PHE HA H 7.340 1.660 -0.425 1.00 . A A . 818 PHE HA 1 1 7 5136 1 1 39 PHE HB2 H 8.835 1.329 2.193 1.00 . A A . 818 PHE HB2 1 1 7 5137 1 1 39 PHE HB3 H 8.998 0.276 0.790 1.00 . A A . 818 PHE HB3 1 1 7 5138 1 1 39 PHE HD1 H 10.077 1.109 -1.257 1.00 . A A . 818 PHE HD1 1 1 7 5139 1 1 39 PHE HD2 H 9.914 3.443 2.297 1.00 . A A . 818 PHE HD2 1 1 7 5140 1 1 39 PHE HE1 H 11.826 2.590 -2.151 1.00 . A A . 818 PHE HE1 1 1 7 5141 1 1 39 PHE HE2 H 11.660 4.927 1.409 1.00 . A A . 818 PHE HE2 1 1 7 5142 1 1 39 PHE HZ H 12.616 4.504 -0.815 1.00 . A A . 818 PHE HZ 1 1 7 5143 1 1 39 PHE N N 7.092 3.029 1.090 1.00 . A A . 818 PHE N 1 1 7 5144 1 1 39 PHE O O 5.832 1.058 2.328 1.00 . A A . 818 PHE O 1 1 7 5145 1 1 40 CYS C C 5.902 -2.039 2.243 1.00 . A A . 819 CYS C 1 1 7 5146 1 1 40 CYS CA C 5.165 -1.315 1.098 1.00 . A A . 819 CYS CA 1 1 7 5147 1 1 40 CYS CB C 4.635 -2.224 -0.028 1.00 . A A . 819 CYS CB 1 1 7 5148 1 1 40 CYS H H 6.493 -0.484 -0.283 1.00 . A A . 819 CYS H 1 1 7 5149 1 1 40 CYS HA H 4.333 -0.815 1.579 1.00 . A A . 819 CYS HA 1 1 7 5150 1 1 40 CYS HB2 H 4.328 -3.157 0.385 1.00 . A A . 819 CYS HB2 1 1 7 5151 1 1 40 CYS HB3 H 3.775 -1.748 -0.493 1.00 . A A . 819 CYS HB3 1 1 7 5152 1 1 40 CYS N N 6.038 -0.299 0.557 1.00 . A A . 819 CYS N 1 1 7 5153 1 1 40 CYS O O 6.871 -1.505 2.768 1.00 . A A . 819 CYS O 1 1 7 5154 1 1 40 CYS SG S 5.830 -2.584 -1.336 1.00 . A A . 819 CYS SG 1 1 7 5155 1 1 41 SER C C 7.225 -4.073 4.238 1.00 . A A . 820 SER C 1 1 7 5156 1 1 41 SER CA C 5.735 -3.838 3.905 1.00 . A A . 820 SER CA 1 1 7 5157 1 1 41 SER CB C 4.959 -5.147 3.961 1.00 . A A . 820 SER CB 1 1 7 5158 1 1 41 SER H H 5.048 -3.793 1.913 1.00 . A A . 820 SER H 1 1 7 5159 1 1 41 SER HA H 5.345 -3.206 4.689 1.00 . A A . 820 SER HA 1 1 7 5160 1 1 41 SER HB2 H 5.260 -5.712 4.830 1.00 . A A . 820 SER HB2 1 1 7 5161 1 1 41 SER HB3 H 3.904 -4.924 4.020 1.00 . A A . 820 SER HB3 1 1 7 5162 1 1 41 SER HG H 5.067 -6.864 3.012 1.00 . A A . 820 SER HG 1 1 7 5163 1 1 41 SER N N 5.477 -3.243 2.591 1.00 . A A . 820 SER N 1 1 7 5164 1 1 41 SER O O 8.030 -3.145 4.244 1.00 . A A . 820 SER O 1 1 7 5165 1 1 41 SER OG O 5.196 -5.926 2.801 1.00 . A A . 820 SER OG 1 1 7 5166 1 1 42 MET C C 10.037 -5.571 4.305 1.00 . A A . 821 MET C 1 1 7 5167 1 1 42 MET CA C 8.857 -5.527 5.255 1.00 . A A . 821 MET CA 1 1 7 5168 1 1 42 MET CB C 8.787 -6.832 6.054 1.00 . A A . 821 MET CB 1 1 7 5169 1 1 42 MET CE C 8.050 -4.405 8.283 1.00 . A A . 821 MET CE 1 1 7 5170 1 1 42 MET CG C 7.641 -6.902 7.062 1.00 . A A . 821 MET CG 1 1 7 5171 1 1 42 MET H H 7.053 -6.066 4.267 1.00 . A A . 821 MET H 1 1 7 5172 1 1 42 MET HA H 9.005 -4.705 5.943 1.00 . A A . 821 MET HA 1 1 7 5173 1 1 42 MET HB2 H 8.673 -7.652 5.362 1.00 . A A . 821 MET HB2 1 1 7 5174 1 1 42 MET HB3 H 9.717 -6.956 6.592 1.00 . A A . 821 MET HB3 1 1 7 5175 1 1 42 MET HE1 H 8.050 -3.836 9.201 1.00 . A A . 821 MET HE1 1 1 7 5176 1 1 42 MET HE2 H 7.179 -4.148 7.699 1.00 . A A . 821 MET HE2 1 1 7 5177 1 1 42 MET HE3 H 8.942 -4.173 7.721 1.00 . A A . 821 MET HE3 1 1 7 5178 1 1 42 MET HG2 H 6.786 -6.392 6.646 1.00 . A A . 821 MET HG2 1 1 7 5179 1 1 42 MET HG3 H 7.391 -7.942 7.219 1.00 . A A . 821 MET HG3 1 1 7 5180 1 1 42 MET N N 7.603 -5.301 4.544 1.00 . A A . 821 MET N 1 1 7 5181 1 1 42 MET O O 10.998 -4.827 4.485 1.00 . A A . 821 MET O 1 1 7 5182 1 1 42 MET SD S 8.024 -6.155 8.667 1.00 . A A . 821 MET SD 1 1 7 5183 1 1 43 THR C C 11.438 -5.180 1.785 1.00 . A A . 822 THR C 1 1 7 5184 1 1 43 THR CA C 10.976 -6.547 2.279 1.00 . A A . 822 THR CA 1 1 7 5185 1 1 43 THR CB C 10.433 -7.353 1.082 1.00 . A A . 822 THR CB 1 1 7 5186 1 1 43 THR CG2 C 11.485 -7.491 -0.006 1.00 . A A . 822 THR CG2 1 1 7 5187 1 1 43 THR H H 9.174 -7.038 3.268 1.00 . A A . 822 THR H 1 1 7 5188 1 1 43 THR HA H 11.833 -7.079 2.666 1.00 . A A . 822 THR HA 1 1 7 5189 1 1 43 THR HB H 9.578 -6.835 0.675 1.00 . A A . 822 THR HB 1 1 7 5190 1 1 43 THR HG1 H 10.655 -8.975 2.190 1.00 . A A . 822 THR HG1 1 1 7 5191 1 1 43 THR HG21 H 11.768 -6.509 -0.357 1.00 . A A . 822 THR HG21 1 1 7 5192 1 1 43 THR HG22 H 11.080 -8.064 -0.827 1.00 . A A . 822 THR HG22 1 1 7 5193 1 1 43 THR HG23 H 12.352 -7.995 0.393 1.00 . A A . 822 THR HG23 1 1 7 5194 1 1 43 THR N N 9.948 -6.432 3.304 1.00 . A A . 822 THR N 1 1 7 5195 1 1 43 THR O O 12.615 -4.849 1.867 1.00 . A A . 822 THR O 1 1 7 5196 1 1 43 THR OG1 O 10.024 -8.654 1.526 1.00 . A A . 822 THR OG1 1 1 7 5197 1 1 44 CYS C C 11.380 -2.072 1.624 1.00 . A A . 823 CYS C 1 1 7 5198 1 1 44 CYS CA C 10.820 -3.124 0.673 1.00 . A A . 823 CYS CA 1 1 7 5199 1 1 44 CYS CB C 9.581 -2.629 -0.036 1.00 . A A . 823 CYS CB 1 1 7 5200 1 1 44 CYS H H 9.563 -4.640 1.421 1.00 . A A . 823 CYS H 1 1 7 5201 1 1 44 CYS HA H 11.570 -3.332 -0.074 1.00 . A A . 823 CYS HA 1 1 7 5202 1 1 44 CYS HB2 H 8.754 -2.593 0.668 1.00 . A A . 823 CYS HB2 1 1 7 5203 1 1 44 CYS HB3 H 9.758 -1.647 -0.444 1.00 . A A . 823 CYS HB3 1 1 7 5204 1 1 44 CYS N N 10.502 -4.382 1.320 1.00 . A A . 823 CYS N 1 1 7 5205 1 1 44 CYS O O 12.458 -1.527 1.374 1.00 . A A . 823 CYS O 1 1 7 5206 1 1 44 CYS SG S 9.116 -3.724 -1.389 1.00 . A A . 823 CYS SG 1 1 7 5207 1 1 45 ALA C C 12.475 -1.080 4.229 1.00 . A A . 824 ALA C 1 1 7 5208 1 1 45 ALA CA C 11.105 -0.758 3.639 1.00 . A A . 824 ALA CA 1 1 7 5209 1 1 45 ALA CB C 10.090 -0.583 4.747 1.00 . A A . 824 ALA CB 1 1 7 5210 1 1 45 ALA H H 9.845 -2.282 2.908 1.00 . A A . 824 ALA H 1 1 7 5211 1 1 45 ALA HA H 11.184 0.166 3.091 1.00 . A A . 824 ALA HA 1 1 7 5212 1 1 45 ALA HB1 H 10.456 0.146 5.452 1.00 . A A . 824 ALA HB1 1 1 7 5213 1 1 45 ALA HB2 H 9.937 -1.533 5.249 1.00 . A A . 824 ALA HB2 1 1 7 5214 1 1 45 ALA HB3 H 9.156 -0.243 4.325 1.00 . A A . 824 ALA HB3 1 1 7 5215 1 1 45 ALA N N 10.667 -1.783 2.708 1.00 . A A . 824 ALA N 1 1 7 5216 1 1 45 ALA O O 13.330 -0.198 4.344 1.00 . A A . 824 ALA O 1 1 7 5217 1 1 46 LYS C C 15.078 -2.742 4.198 1.00 . A A . 825 LYS C 1 1 7 5218 1 1 46 LYS CA C 13.944 -2.725 5.222 1.00 . A A . 825 LYS CA 1 1 7 5219 1 1 46 LYS CB C 13.822 -4.089 5.913 1.00 . A A . 825 LYS CB 1 1 7 5220 1 1 46 LYS CD C 13.814 -6.585 5.775 1.00 . A A . 825 LYS CD 1 1 7 5221 1 1 46 LYS CE C 13.949 -7.804 4.880 1.00 . A A . 825 LYS CE 1 1 7 5222 1 1 46 LYS CG C 13.917 -5.291 4.989 1.00 . A A . 825 LYS CG 1 1 7 5223 1 1 46 LYS H H 11.976 -3.005 4.492 1.00 . A A . 825 LYS H 1 1 7 5224 1 1 46 LYS HA H 14.175 -1.995 5.985 1.00 . A A . 825 LYS HA 1 1 7 5225 1 1 46 LYS HB2 H 14.608 -4.170 6.647 1.00 . A A . 825 LYS HB2 1 1 7 5226 1 1 46 LYS HB3 H 12.868 -4.129 6.419 1.00 . A A . 825 LYS HB3 1 1 7 5227 1 1 46 LYS HD2 H 14.600 -6.608 6.515 1.00 . A A . 825 LYS HD2 1 1 7 5228 1 1 46 LYS HD3 H 12.853 -6.618 6.269 1.00 . A A . 825 LYS HD3 1 1 7 5229 1 1 46 LYS HE2 H 13.194 -7.758 4.110 1.00 . A A . 825 LYS HE2 1 1 7 5230 1 1 46 LYS HE3 H 14.931 -7.792 4.425 1.00 . A A . 825 LYS HE3 1 1 7 5231 1 1 46 LYS HG2 H 13.111 -5.247 4.271 1.00 . A A . 825 LYS HG2 1 1 7 5232 1 1 46 LYS HG3 H 14.867 -5.266 4.474 1.00 . A A . 825 LYS HG3 1 1 7 5233 1 1 46 LYS HZ1 H 12.893 -9.045 6.184 1.00 . A A . 825 LYS HZ1 1 1 7 5234 1 1 46 LYS HZ2 H 14.577 -9.177 6.322 1.00 . A A . 825 LYS HZ2 1 1 7 5235 1 1 46 LYS HZ3 H 13.775 -9.883 5.006 1.00 . A A . 825 LYS HZ3 1 1 7 5236 1 1 46 LYS N N 12.683 -2.332 4.614 1.00 . A A . 825 LYS N 1 1 7 5237 1 1 46 LYS NZ N 13.788 -9.063 5.650 1.00 . A A . 825 LYS NZ 1 1 7 5238 1 1 46 LYS O O 16.199 -2.369 4.509 1.00 . A A . 825 LYS O 1 1 7 5239 1 1 47 ARG C C 16.329 -1.994 1.454 1.00 . A A . 826 ARG C 1 1 7 5240 1 1 47 ARG CA C 15.801 -3.337 1.945 1.00 . A A . 826 ARG CA 1 1 7 5241 1 1 47 ARG CB C 15.223 -4.162 0.781 1.00 . A A . 826 ARG CB 1 1 7 5242 1 1 47 ARG CD C 17.380 -5.249 0.013 1.00 . A A . 826 ARG CD 1 1 7 5243 1 1 47 ARG CG C 16.169 -4.420 -0.386 1.00 . A A . 826 ARG CG 1 1 7 5244 1 1 47 ARG CZ C 19.465 -4.141 -0.685 1.00 . A A . 826 ARG CZ 1 1 7 5245 1 1 47 ARG H H 13.828 -3.291 2.726 1.00 . A A . 826 ARG H 1 1 7 5246 1 1 47 ARG HA H 16.605 -3.888 2.407 1.00 . A A . 826 ARG HA 1 1 7 5247 1 1 47 ARG HB2 H 14.910 -5.119 1.167 1.00 . A A . 826 ARG HB2 1 1 7 5248 1 1 47 ARG HB3 H 14.354 -3.646 0.398 1.00 . A A . 826 ARG HB3 1 1 7 5249 1 1 47 ARG HD2 H 17.149 -5.789 0.918 1.00 . A A . 826 ARG HD2 1 1 7 5250 1 1 47 ARG HD3 H 17.600 -5.951 -0.778 1.00 . A A . 826 ARG HD3 1 1 7 5251 1 1 47 ARG HE H 18.645 -3.998 1.135 1.00 . A A . 826 ARG HE 1 1 7 5252 1 1 47 ARG HG2 H 15.630 -4.947 -1.157 1.00 . A A . 826 ARG HG2 1 1 7 5253 1 1 47 ARG HG3 H 16.508 -3.471 -0.772 1.00 . A A . 826 ARG HG3 1 1 7 5254 1 1 47 ARG HH11 H 18.683 -5.396 -2.072 1.00 . A A . 826 ARG HH11 1 1 7 5255 1 1 47 ARG HH12 H 20.087 -4.511 -2.575 1.00 . A A . 826 ARG HH12 1 1 7 5256 1 1 47 ARG HH21 H 20.505 -2.854 0.488 1.00 . A A . 826 ARG HH21 1 1 7 5257 1 1 47 ARG HH22 H 21.134 -3.071 -1.127 1.00 . A A . 826 ARG HH22 1 1 7 5258 1 1 47 ARG N N 14.771 -3.139 2.964 1.00 . A A . 826 ARG N 1 1 7 5259 1 1 47 ARG NE N 18.553 -4.412 0.245 1.00 . A A . 826 ARG NE 1 1 7 5260 1 1 47 ARG NH1 N 19.410 -4.733 -1.869 1.00 . A A . 826 ARG NH1 1 1 7 5261 1 1 47 ARG NH2 N 20.448 -3.295 -0.421 1.00 . A A . 826 ARG NH2 1 1 7 5262 1 1 47 ARG O O 17.436 -1.903 0.924 1.00 . A A . 826 ARG O 1 1 7 5263 1 1 48 TYR C C 16.871 1.049 2.215 1.00 . A A . 827 TYR C 1 1 7 5264 1 1 48 TYR CA C 15.937 0.375 1.197 1.00 . A A . 827 TYR CA 1 1 7 5265 1 1 48 TYR CB C 14.690 1.219 0.908 1.00 . A A . 827 TYR CB 1 1 7 5266 1 1 48 TYR CD1 C 15.028 2.404 -1.299 1.00 . A A . 827 TYR CD1 1 1 7 5267 1 1 48 TYR CD2 C 15.092 3.704 0.698 1.00 . A A . 827 TYR CD2 1 1 7 5268 1 1 48 TYR CE1 C 15.277 3.535 -2.047 1.00 . A A . 827 TYR CE1 1 1 7 5269 1 1 48 TYR CE2 C 15.335 4.842 -0.046 1.00 . A A . 827 TYR CE2 1 1 7 5270 1 1 48 TYR CG C 14.931 2.466 0.085 1.00 . A A . 827 TYR CG 1 1 7 5271 1 1 48 TYR CZ C 15.319 4.763 -1.434 1.00 . A A . 827 TYR CZ 1 1 7 5272 1 1 48 TYR H H 14.687 -1.069 2.124 1.00 . A A . 827 TYR H 1 1 7 5273 1 1 48 TYR HA H 16.503 0.222 0.295 1.00 . A A . 827 TYR HA 1 1 7 5274 1 1 48 TYR HB2 H 13.977 0.611 0.373 1.00 . A A . 827 TYR HB2 1 1 7 5275 1 1 48 TYR HB3 H 14.253 1.523 1.849 1.00 . A A . 827 TYR HB3 1 1 7 5276 1 1 48 TYR HD1 H 14.905 1.450 -1.791 1.00 . A A . 827 TYR HD1 1 1 7 5277 1 1 48 TYR HD2 H 15.018 3.770 1.774 1.00 . A A . 827 TYR HD2 1 1 7 5278 1 1 48 TYR HE1 H 15.349 3.466 -3.122 1.00 . A A . 827 TYR HE1 1 1 7 5279 1 1 48 TYR HE2 H 15.453 5.795 0.448 1.00 . A A . 827 TYR HE2 1 1 7 5280 1 1 48 TYR HH H 16.547 6.247 -1.882 1.00 . A A . 827 TYR HH 1 1 7 5281 1 1 48 TYR N N 15.542 -0.948 1.650 1.00 . A A . 827 TYR N 1 1 7 5282 1 1 48 TYR O O 17.160 2.242 2.117 1.00 . A A . 827 TYR O 1 1 7 5283 1 1 48 TYR OH O 15.694 5.876 -2.164 1.00 . A A . 827 TYR OH 1 1 7 5284 1 1 49 ASN C C 19.684 1.034 3.432 1.00 . A A . 828 ASN C 1 1 7 5285 1 1 49 ASN CA C 18.341 0.811 4.134 1.00 . A A . 828 ASN CA 1 1 7 5286 1 1 49 ASN CB C 18.513 -0.119 5.356 1.00 . A A . 828 ASN CB 1 1 7 5287 1 1 49 ASN CG C 19.390 -1.335 5.085 1.00 . A A . 828 ASN CG 1 1 7 5288 1 1 49 ASN H H 17.059 -0.648 3.261 1.00 . A A . 828 ASN H 1 1 7 5289 1 1 49 ASN HA H 17.971 1.768 4.473 1.00 . A A . 828 ASN HA 1 1 7 5290 1 1 49 ASN HB2 H 18.960 0.442 6.164 1.00 . A A . 828 ASN HB2 1 1 7 5291 1 1 49 ASN HB3 H 17.538 -0.466 5.669 1.00 . A A . 828 ASN HB3 1 1 7 5292 1 1 49 ASN HD21 H 17.804 -2.391 4.517 1.00 . A A . 828 ASN HD21 1 1 7 5293 1 1 49 ASN HD22 H 19.326 -3.212 4.436 1.00 . A A . 828 ASN HD22 1 1 7 5294 1 1 49 ASN N N 17.368 0.280 3.178 1.00 . A A . 828 ASN N 1 1 7 5295 1 1 49 ASN ND2 N 18.782 -2.422 4.639 1.00 . A A . 828 ASN ND2 1 1 7 5296 1 1 49 ASN O O 20.197 2.171 3.485 1.00 . A A . 828 ASN O 1 1 7 5297 1 1 49 ASN OXT O 20.188 0.095 2.774 1.00 . A A . 828 ASN OXT 1 1 7 5298 1 1 49 ASN OD1 O 20.606 -1.299 5.290 1.00 . A A . 828 ASN OD1 1 1 7 5299 2 2 1 ZN ZN ZN 7.548 -3.041 -2.706 1.00 . B A . 829 ZN ZN 1 1 8 5300 1 1 1 GLY C C -10.326 -2.783 5.453 1.00 . A A . 1 GLY C 1 1 8 5301 1 1 1 GLY CA C -10.046 -2.833 3.965 1.00 . A A . 1 GLY CA 1 1 8 5302 1 1 1 GLY H1 H -11.072 -4.609 3.590 1.00 . A A . 1 GLY H1 1 1 8 5303 1 1 1 GLY H2 H -9.415 -4.818 3.889 1.00 . A A . 1 GLY H2 1 1 8 5304 1 1 1 GLY H3 H -9.936 -4.199 2.397 1.00 . A A . 1 GLY H3 1 1 8 5305 1 1 1 GLY HA2 H -9.056 -2.441 3.782 1.00 . A A . 1 GLY HA2 1 1 8 5306 1 1 1 GLY HA3 H -10.768 -2.214 3.452 1.00 . A A . 1 GLY HA3 1 1 8 5307 1 1 1 GLY N N -10.124 -4.209 3.424 1.00 . A A . 1 GLY N 1 1 8 5308 1 1 1 GLY O O -9.416 -2.547 6.248 1.00 . A A . 1 GLY O 1 1 8 5309 1 1 2 THR C C -11.706 -1.654 7.871 1.00 . A A . 2 THR C 1 1 8 5310 1 1 2 THR CA C -12.010 -3.004 7.220 1.00 . A A . 2 THR CA 1 1 8 5311 1 1 2 THR CB C -11.329 -4.139 8.015 1.00 . A A . 2 THR CB 1 1 8 5312 1 1 2 THR CG2 C -12.073 -4.419 9.315 1.00 . A A . 2 THR CG2 1 1 8 5313 1 1 2 THR H H -12.258 -3.190 5.127 1.00 . A A . 2 THR H 1 1 8 5314 1 1 2 THR HA H -13.079 -3.168 7.243 1.00 . A A . 2 THR HA 1 1 8 5315 1 1 2 THR HB H -10.318 -3.841 8.249 1.00 . A A . 2 THR HB 1 1 8 5316 1 1 2 THR HG1 H -11.798 -5.203 6.407 1.00 . A A . 2 THR HG1 1 1 8 5317 1 1 2 THR HG21 H -12.087 -3.524 9.920 1.00 . A A . 2 THR HG21 1 1 8 5318 1 1 2 THR HG22 H -11.572 -5.208 9.854 1.00 . A A . 2 THR HG22 1 1 8 5319 1 1 2 THR HG23 H -13.086 -4.720 9.093 1.00 . A A . 2 THR HG23 1 1 8 5320 1 1 2 THR N N -11.587 -3.009 5.822 1.00 . A A . 2 THR N 1 1 8 5321 1 1 2 THR O O -11.060 -1.575 8.917 1.00 . A A . 2 THR O 1 1 8 5322 1 1 2 THR OG1 O -11.298 -5.341 7.224 1.00 . A A . 2 THR OG1 1 1 8 5323 1 1 3 ARG C C -13.106 1.667 7.431 1.00 . A A . 3 ARG C 1 1 8 5324 1 1 3 ARG CA C -11.933 0.754 7.754 1.00 . A A . 3 ARG CA 1 1 8 5325 1 1 3 ARG CB C -10.643 1.337 7.176 1.00 . A A . 3 ARG CB 1 1 8 5326 1 1 3 ARG CD C -10.023 2.705 9.188 1.00 . A A . 3 ARG CD 1 1 8 5327 1 1 3 ARG CG C -10.317 2.725 7.699 1.00 . A A . 3 ARG CG 1 1 8 5328 1 1 3 ARG CZ C -8.471 1.512 10.691 1.00 . A A . 3 ARG CZ 1 1 8 5329 1 1 3 ARG H H -12.666 -0.695 6.404 1.00 . A A . 3 ARG H 1 1 8 5330 1 1 3 ARG HA H -11.834 0.680 8.826 1.00 . A A . 3 ARG HA 1 1 8 5331 1 1 3 ARG HB2 H -9.821 0.681 7.424 1.00 . A A . 3 ARG HB2 1 1 8 5332 1 1 3 ARG HB3 H -10.736 1.394 6.102 1.00 . A A . 3 ARG HB3 1 1 8 5333 1 1 3 ARG HD2 H -9.969 3.723 9.544 1.00 . A A . 3 ARG HD2 1 1 8 5334 1 1 3 ARG HD3 H -10.828 2.191 9.693 1.00 . A A . 3 ARG HD3 1 1 8 5335 1 1 3 ARG HE H -8.087 1.981 8.780 1.00 . A A . 3 ARG HE 1 1 8 5336 1 1 3 ARG HG2 H -9.451 3.101 7.176 1.00 . A A . 3 ARG HG2 1 1 8 5337 1 1 3 ARG HG3 H -11.161 3.374 7.515 1.00 . A A . 3 ARG HG3 1 1 8 5338 1 1 3 ARG HH11 H -10.306 1.880 11.484 1.00 . A A . 3 ARG HH11 1 1 8 5339 1 1 3 ARG HH12 H -9.173 1.119 12.557 1.00 . A A . 3 ARG HH12 1 1 8 5340 1 1 3 ARG HH21 H -6.579 0.980 10.175 1.00 . A A . 3 ARG HH21 1 1 8 5341 1 1 3 ARG HH22 H -7.043 0.599 11.811 1.00 . A A . 3 ARG HH22 1 1 8 5342 1 1 3 ARG N N -12.163 -0.584 7.236 1.00 . A A . 3 ARG N 1 1 8 5343 1 1 3 ARG NE N -8.762 2.027 9.497 1.00 . A A . 3 ARG NE 1 1 8 5344 1 1 3 ARG NH1 N -9.387 1.502 11.654 1.00 . A A . 3 ARG NH1 1 1 8 5345 1 1 3 ARG NH2 N -7.270 0.988 10.911 1.00 . A A . 3 ARG NH2 1 1 8 5346 1 1 3 ARG O O -13.265 2.116 6.294 1.00 . A A . 3 ARG O 1 1 8 5347 1 1 4 GLY C C -15.151 3.737 9.499 1.00 . A A . 783 GLY C 1 1 8 5348 1 1 4 GLY CA C -15.022 2.851 8.282 1.00 . A A . 783 GLY CA 1 1 8 5349 1 1 4 GLY H H -13.797 1.461 9.293 1.00 . A A . 783 GLY H 1 1 8 5350 1 1 4 GLY HA2 H -14.847 3.465 7.411 1.00 . A A . 783 GLY HA2 1 1 8 5351 1 1 4 GLY HA3 H -15.942 2.300 8.150 1.00 . A A . 783 GLY HA3 1 1 8 5352 1 1 4 GLY N N -13.930 1.919 8.431 1.00 . A A . 783 GLY N 1 1 8 5353 1 1 4 GLY O O -14.657 3.389 10.575 1.00 . A A . 783 GLY O 1 1 8 5354 1 1 5 VAL C C -16.992 5.220 11.434 1.00 . A A . 784 VAL C 1 1 8 5355 1 1 5 VAL CA C -15.985 5.808 10.451 1.00 . A A . 784 VAL CA 1 1 8 5356 1 1 5 VAL CB C -16.467 7.193 9.962 1.00 . A A . 784 VAL CB 1 1 8 5357 1 1 5 VAL CG1 C -16.544 8.182 11.117 1.00 . A A . 784 VAL CG1 1 1 8 5358 1 1 5 VAL CG2 C -15.556 7.718 8.863 1.00 . A A . 784 VAL CG2 1 1 8 5359 1 1 5 VAL H H -16.140 5.122 8.453 1.00 . A A . 784 VAL H 1 1 8 5360 1 1 5 VAL HA H -15.035 5.934 10.952 1.00 . A A . 784 VAL HA 1 1 8 5361 1 1 5 VAL HB H -17.460 7.082 9.550 1.00 . A A . 784 VAL HB 1 1 8 5362 1 1 5 VAL HG11 H -16.898 9.135 10.752 1.00 . A A . 784 VAL HG11 1 1 8 5363 1 1 5 VAL HG12 H -15.564 8.306 11.552 1.00 . A A . 784 VAL HG12 1 1 8 5364 1 1 5 VAL HG13 H -17.226 7.807 11.866 1.00 . A A . 784 VAL HG13 1 1 8 5365 1 1 5 VAL HG21 H -15.554 7.020 8.038 1.00 . A A . 784 VAL HG21 1 1 8 5366 1 1 5 VAL HG22 H -14.554 7.825 9.246 1.00 . A A . 784 VAL HG22 1 1 8 5367 1 1 5 VAL HG23 H -15.918 8.678 8.522 1.00 . A A . 784 VAL HG23 1 1 8 5368 1 1 5 VAL N N -15.790 4.887 9.337 1.00 . A A . 784 VAL N 1 1 8 5369 1 1 5 VAL O O -16.644 4.854 12.557 1.00 . A A . 784 VAL O 1 1 8 5370 1 1 6 ASP C C -20.301 3.876 10.795 1.00 . A A . 785 ASP C 1 1 8 5371 1 1 6 ASP CA C -19.282 4.459 11.757 1.00 . A A . 785 ASP CA 1 1 8 5372 1 1 6 ASP CB C -19.963 5.433 12.725 1.00 . A A . 785 ASP CB 1 1 8 5373 1 1 6 ASP CG C -20.970 4.736 13.623 1.00 . A A . 785 ASP CG 1 1 8 5374 1 1 6 ASP H H -18.459 5.487 10.105 1.00 . A A . 785 ASP H 1 1 8 5375 1 1 6 ASP HA H -18.831 3.655 12.318 1.00 . A A . 785 ASP HA 1 1 8 5376 1 1 6 ASP HB2 H -19.213 5.898 13.348 1.00 . A A . 785 ASP HB2 1 1 8 5377 1 1 6 ASP HB3 H -20.479 6.194 12.158 1.00 . A A . 785 ASP HB3 1 1 8 5378 1 1 6 ASP N N -18.235 5.115 10.989 1.00 . A A . 785 ASP N 1 1 8 5379 1 1 6 ASP O O -21.403 4.402 10.630 1.00 . A A . 785 ASP O 1 1 8 5380 1 1 6 ASP OD1 O -20.545 3.952 14.498 1.00 . A A . 785 ASP OD1 1 1 8 5381 1 1 6 ASP OD2 O -22.191 4.970 13.463 1.00 . A A . 785 ASP OD2 1 1 8 5382 1 1 7 SER C C -21.257 0.859 9.466 1.00 . A A . 786 SER C 1 1 8 5383 1 1 7 SER CA C -20.723 2.234 9.078 1.00 . A A . 786 SER CA 1 1 8 5384 1 1 7 SER CB C -19.885 2.124 7.805 1.00 . A A . 786 SER CB 1 1 8 5385 1 1 7 SER H H -19.057 2.384 10.358 1.00 . A A . 786 SER H 1 1 8 5386 1 1 7 SER HA H -21.554 2.898 8.896 1.00 . A A . 786 SER HA 1 1 8 5387 1 1 7 SER HB2 H -19.127 1.366 7.939 1.00 . A A . 786 SER HB2 1 1 8 5388 1 1 7 SER HB3 H -20.525 1.852 6.977 1.00 . A A . 786 SER HB3 1 1 8 5389 1 1 7 SER HG H -19.530 3.654 6.620 1.00 . A A . 786 SER HG 1 1 8 5390 1 1 7 SER N N -19.912 2.804 10.132 1.00 . A A . 786 SER N 1 1 8 5391 1 1 7 SER O O -20.485 -0.060 9.737 1.00 . A A . 786 SER O 1 1 8 5392 1 1 7 SER OG O -19.247 3.356 7.506 1.00 . A A . 786 SER OG 1 1 8 5393 1 1 8 PRO C C -23.347 -1.340 8.357 1.00 . A A . 787 PRO C 1 1 8 5394 1 1 8 PRO CA C -23.237 -0.588 9.682 1.00 . A A . 787 PRO CA 1 1 8 5395 1 1 8 PRO CB C -24.620 -0.211 10.207 1.00 . A A . 787 PRO CB 1 1 8 5396 1 1 8 PRO CD C -23.572 1.805 9.408 1.00 . A A . 787 PRO CD 1 1 8 5397 1 1 8 PRO CG C -24.902 1.126 9.611 1.00 . A A . 787 PRO CG 1 1 8 5398 1 1 8 PRO HA H -22.718 -1.199 10.408 1.00 . A A . 787 PRO HA 1 1 8 5399 1 1 8 PRO HB2 H -25.343 -0.947 9.886 1.00 . A A . 787 PRO HB2 1 1 8 5400 1 1 8 PRO HB3 H -24.600 -0.165 11.284 1.00 . A A . 787 PRO HB3 1 1 8 5401 1 1 8 PRO HD2 H -23.533 2.272 8.436 1.00 . A A . 787 PRO HD2 1 1 8 5402 1 1 8 PRO HD3 H -23.402 2.537 10.184 1.00 . A A . 787 PRO HD3 1 1 8 5403 1 1 8 PRO HG2 H -25.405 1.002 8.664 1.00 . A A . 787 PRO HG2 1 1 8 5404 1 1 8 PRO HG3 H -25.515 1.704 10.287 1.00 . A A . 787 PRO HG3 1 1 8 5405 1 1 8 PRO N N -22.590 0.709 9.501 1.00 . A A . 787 PRO N 1 1 8 5406 1 1 8 PRO O O -23.606 -2.543 8.324 1.00 . A A . 787 PRO O 1 1 8 5407 1 1 9 SER C C -21.825 -1.673 5.508 1.00 . A A . 788 SER C 1 1 8 5408 1 1 9 SER CA C -23.204 -1.178 5.935 1.00 . A A . 788 SER CA 1 1 8 5409 1 1 9 SER CB C -23.728 -0.117 4.966 1.00 . A A . 788 SER CB 1 1 8 5410 1 1 9 SER H H -22.944 0.342 7.366 1.00 . A A . 788 SER H 1 1 8 5411 1 1 9 SER HA H -23.888 -2.013 5.952 1.00 . A A . 788 SER HA 1 1 8 5412 1 1 9 SER HB2 H -23.523 -0.425 3.951 1.00 . A A . 788 SER HB2 1 1 8 5413 1 1 9 SER HB3 H -24.794 -0.004 5.101 1.00 . A A . 788 SER HB3 1 1 8 5414 1 1 9 SER HG H -23.784 1.805 5.377 1.00 . A A . 788 SER HG 1 1 8 5415 1 1 9 SER N N -23.147 -0.611 7.269 1.00 . A A . 788 SER N 1 1 8 5416 1 1 9 SER O O -20.852 -1.545 6.255 1.00 . A A . 788 SER O 1 1 8 5417 1 1 9 SER OG O -23.102 1.135 5.199 1.00 . A A . 788 SER OG 1 1 8 5418 1 1 10 ALA C C -19.574 -1.746 3.234 1.00 . A A . 789 ALA C 1 1 8 5419 1 1 10 ALA CA C -20.497 -2.813 3.821 1.00 . A A . 789 ALA CA 1 1 8 5420 1 1 10 ALA CB C -20.796 -3.888 2.785 1.00 . A A . 789 ALA CB 1 1 8 5421 1 1 10 ALA H H -22.528 -2.234 3.722 1.00 . A A . 789 ALA H 1 1 8 5422 1 1 10 ALA HA H -20.000 -3.283 4.659 1.00 . A A . 789 ALA HA 1 1 8 5423 1 1 10 ALA HB1 H -19.873 -4.350 2.469 1.00 . A A . 789 ALA HB1 1 1 8 5424 1 1 10 ALA HB2 H -21.285 -3.442 1.934 1.00 . A A . 789 ALA HB2 1 1 8 5425 1 1 10 ALA HB3 H -21.441 -4.637 3.219 1.00 . A A . 789 ALA HB3 1 1 8 5426 1 1 10 ALA N N -21.738 -2.229 4.307 1.00 . A A . 789 ALA N 1 1 8 5427 1 1 10 ALA O O -19.089 -1.874 2.111 1.00 . A A . 789 ALA O 1 1 8 5428 1 1 11 GLU C C -17.009 0.122 3.903 1.00 . A A . 790 GLU C 1 1 8 5429 1 1 11 GLU CA C -18.463 0.395 3.573 1.00 . A A . 790 GLU CA 1 1 8 5430 1 1 11 GLU CB C -18.872 1.712 4.222 1.00 . A A . 790 GLU CB 1 1 8 5431 1 1 11 GLU CD C -20.404 3.720 4.084 1.00 . A A . 790 GLU CD 1 1 8 5432 1 1 11 GLU CG C -20.179 2.273 3.693 1.00 . A A . 790 GLU CG 1 1 8 5433 1 1 11 GLU H H -19.734 -0.654 4.904 1.00 . A A . 790 GLU H 1 1 8 5434 1 1 11 GLU HA H -18.565 0.489 2.501 1.00 . A A . 790 GLU HA 1 1 8 5435 1 1 11 GLU HB2 H -18.977 1.552 5.285 1.00 . A A . 790 GLU HB2 1 1 8 5436 1 1 11 GLU HB3 H -18.088 2.434 4.053 1.00 . A A . 790 GLU HB3 1 1 8 5437 1 1 11 GLU HG2 H -20.175 2.206 2.617 1.00 . A A . 790 GLU HG2 1 1 8 5438 1 1 11 GLU HG3 H -20.992 1.679 4.086 1.00 . A A . 790 GLU HG3 1 1 8 5439 1 1 11 GLU N N -19.324 -0.696 4.010 1.00 . A A . 790 GLU N 1 1 8 5440 1 1 11 GLU O O -16.152 0.989 3.738 1.00 . A A . 790 GLU O 1 1 8 5441 1 1 11 GLU OE1 O -19.984 4.109 5.195 1.00 . A A . 790 GLU OE1 1 1 8 5442 1 1 11 GLU OE2 O -21.008 4.473 3.296 1.00 . A A . 790 GLU OE2 1 1 8 5443 1 1 12 LEU C C -14.500 -1.713 3.532 1.00 . A A . 791 LEU C 1 1 8 5444 1 1 12 LEU CA C -15.362 -1.410 4.751 1.00 . A A . 791 LEU CA 1 1 8 5445 1 1 12 LEU CB C -15.354 -2.593 5.720 1.00 . A A . 791 LEU CB 1 1 8 5446 1 1 12 LEU CD1 C -16.141 -3.663 7.845 1.00 . A A . 791 LEU CD1 1 1 8 5447 1 1 12 LEU CD2 C -15.717 -1.203 7.778 1.00 . A A . 791 LEU CD2 1 1 8 5448 1 1 12 LEU CG C -16.193 -2.410 6.987 1.00 . A A . 791 LEU CG 1 1 8 5449 1 1 12 LEU H H -17.418 -1.767 4.405 1.00 . A A . 791 LEU H 1 1 8 5450 1 1 12 LEU HA H -14.968 -0.538 5.243 1.00 . A A . 791 LEU HA 1 1 8 5451 1 1 12 LEU HB2 H -15.724 -3.462 5.195 1.00 . A A . 791 LEU HB2 1 1 8 5452 1 1 12 LEU HB3 H -14.332 -2.782 6.017 1.00 . A A . 791 LEU HB3 1 1 8 5453 1 1 12 LEU HD11 H -16.529 -4.499 7.282 1.00 . A A . 791 LEU HD11 1 1 8 5454 1 1 12 LEU HD12 H -16.740 -3.518 8.730 1.00 . A A . 791 LEU HD12 1 1 8 5455 1 1 12 LEU HD13 H -15.119 -3.862 8.130 1.00 . A A . 791 LEU HD13 1 1 8 5456 1 1 12 LEU HD21 H -16.326 -1.090 8.661 1.00 . A A . 791 LEU HD21 1 1 8 5457 1 1 12 LEU HD22 H -15.800 -0.316 7.166 1.00 . A A . 791 LEU HD22 1 1 8 5458 1 1 12 LEU HD23 H -14.686 -1.346 8.066 1.00 . A A . 791 LEU HD23 1 1 8 5459 1 1 12 LEU HG H -17.223 -2.241 6.706 1.00 . A A . 791 LEU HG 1 1 8 5460 1 1 12 LEU N N -16.716 -1.085 4.349 1.00 . A A . 791 LEU N 1 1 8 5461 1 1 12 LEU O O -13.343 -2.119 3.653 1.00 . A A . 791 LEU O 1 1 8 5462 1 1 13 ASP C C -14.170 -0.395 0.380 1.00 . A A . 792 ASP C 1 1 8 5463 1 1 13 ASP CA C -14.407 -1.721 1.095 1.00 . A A . 792 ASP CA 1 1 8 5464 1 1 13 ASP CB C -15.253 -2.662 0.228 1.00 . A A . 792 ASP CB 1 1 8 5465 1 1 13 ASP CG C -14.540 -3.119 -1.030 1.00 . A A . 792 ASP CG 1 1 8 5466 1 1 13 ASP H H -15.991 -1.129 2.360 1.00 . A A . 792 ASP H 1 1 8 5467 1 1 13 ASP HA H -13.456 -2.183 1.303 1.00 . A A . 792 ASP HA 1 1 8 5468 1 1 13 ASP HB2 H -15.508 -3.536 0.807 1.00 . A A . 792 ASP HB2 1 1 8 5469 1 1 13 ASP HB3 H -16.160 -2.152 -0.061 1.00 . A A . 792 ASP HB3 1 1 8 5470 1 1 13 ASP N N -15.078 -1.483 2.365 1.00 . A A . 792 ASP N 1 1 8 5471 1 1 13 ASP O O -13.719 -0.348 -0.764 1.00 . A A . 792 ASP O 1 1 8 5472 1 1 13 ASP OD1 O -13.517 -3.829 -0.911 1.00 . A A . 792 ASP OD1 1 1 8 5473 1 1 13 ASP OD2 O -15.001 -2.782 -2.142 1.00 . A A . 792 ASP OD2 1 1 8 5474 1 1 14 LYS C C -12.870 2.449 0.396 1.00 . A A . 793 LYS C 1 1 8 5475 1 1 14 LYS CA C -14.329 2.034 0.531 1.00 . A A . 793 LYS CA 1 1 8 5476 1 1 14 LYS CB C -15.048 3.049 1.412 1.00 . A A . 793 LYS CB 1 1 8 5477 1 1 14 LYS CD C -17.204 4.097 2.140 1.00 . A A . 793 LYS CD 1 1 8 5478 1 1 14 LYS CE C -16.643 5.472 1.816 1.00 . A A . 793 LYS CE 1 1 8 5479 1 1 14 LYS CG C -16.561 3.018 1.286 1.00 . A A . 793 LYS CG 1 1 8 5480 1 1 14 LYS H H -14.786 0.584 2.001 1.00 . A A . 793 LYS H 1 1 8 5481 1 1 14 LYS HA H -14.784 2.035 -0.446 1.00 . A A . 793 LYS HA 1 1 8 5482 1 1 14 LYS HB2 H -14.791 2.852 2.443 1.00 . A A . 793 LYS HB2 1 1 8 5483 1 1 14 LYS HB3 H -14.707 4.039 1.151 1.00 . A A . 793 LYS HB3 1 1 8 5484 1 1 14 LYS HD2 H -18.268 4.101 1.956 1.00 . A A . 793 LYS HD2 1 1 8 5485 1 1 14 LYS HD3 H -17.017 3.878 3.181 1.00 . A A . 793 LYS HD3 1 1 8 5486 1 1 14 LYS HE2 H -15.580 5.467 2.007 1.00 . A A . 793 LYS HE2 1 1 8 5487 1 1 14 LYS HE3 H -16.817 5.681 0.770 1.00 . A A . 793 LYS HE3 1 1 8 5488 1 1 14 LYS HG2 H -16.831 3.180 0.253 1.00 . A A . 793 LYS HG2 1 1 8 5489 1 1 14 LYS HG3 H -16.920 2.052 1.609 1.00 . A A . 793 LYS HG3 1 1 8 5490 1 1 14 LYS HZ1 H -17.216 6.296 3.647 1.00 . A A . 793 LYS HZ1 1 1 8 5491 1 1 14 LYS HZ2 H -18.277 6.646 2.372 1.00 . A A . 793 LYS HZ2 1 1 8 5492 1 1 14 LYS HZ3 H -16.786 7.447 2.476 1.00 . A A . 793 LYS HZ3 1 1 8 5493 1 1 14 LYS N N -14.462 0.690 1.085 1.00 . A A . 793 LYS N 1 1 8 5494 1 1 14 LYS NZ N -17.274 6.539 2.633 1.00 . A A . 793 LYS NZ 1 1 8 5495 1 1 14 LYS O O -12.548 3.387 -0.336 1.00 . A A . 793 LYS O 1 1 8 5496 1 1 15 LYS C C -9.969 1.628 -0.228 1.00 . A A . 794 LYS C 1 1 8 5497 1 1 15 LYS CA C -10.588 2.100 1.079 1.00 . A A . 794 LYS CA 1 1 8 5498 1 1 15 LYS CB C -9.838 1.495 2.274 1.00 . A A . 794 LYS CB 1 1 8 5499 1 1 15 LYS CD C -10.675 3.371 3.775 1.00 . A A . 794 LYS CD 1 1 8 5500 1 1 15 LYS CE C -9.424 4.214 3.558 1.00 . A A . 794 LYS CE 1 1 8 5501 1 1 15 LYS CG C -10.411 1.874 3.638 1.00 . A A . 794 LYS CG 1 1 8 5502 1 1 15 LYS H H -12.303 1.036 1.673 1.00 . A A . 794 LYS H 1 1 8 5503 1 1 15 LYS HA H -10.508 3.174 1.127 1.00 . A A . 794 LYS HA 1 1 8 5504 1 1 15 LYS HB2 H -9.862 0.419 2.187 1.00 . A A . 794 LYS HB2 1 1 8 5505 1 1 15 LYS HB3 H -8.810 1.824 2.238 1.00 . A A . 794 LYS HB3 1 1 8 5506 1 1 15 LYS HD2 H -11.416 3.660 3.045 1.00 . A A . 794 LYS HD2 1 1 8 5507 1 1 15 LYS HD3 H -11.059 3.564 4.766 1.00 . A A . 794 LYS HD3 1 1 8 5508 1 1 15 LYS HE2 H -9.003 3.964 2.597 1.00 . A A . 794 LYS HE2 1 1 8 5509 1 1 15 LYS HE3 H -9.709 5.257 3.559 1.00 . A A . 794 LYS HE3 1 1 8 5510 1 1 15 LYS HG2 H -11.340 1.345 3.783 1.00 . A A . 794 LYS HG2 1 1 8 5511 1 1 15 LYS HG3 H -9.707 1.574 4.403 1.00 . A A . 794 LYS HG3 1 1 8 5512 1 1 15 LYS HZ1 H -8.014 3.022 4.553 1.00 . A A . 794 LYS HZ1 1 1 8 5513 1 1 15 LYS HZ2 H -8.791 4.156 5.551 1.00 . A A . 794 LYS HZ2 1 1 8 5514 1 1 15 LYS HZ3 H -7.596 4.665 4.467 1.00 . A A . 794 LYS HZ3 1 1 8 5515 1 1 15 LYS N N -11.996 1.770 1.115 1.00 . A A . 794 LYS N 1 1 8 5516 1 1 15 LYS NZ N -8.388 3.998 4.605 1.00 . A A . 794 LYS NZ 1 1 8 5517 1 1 15 LYS O O -9.939 0.434 -0.530 1.00 . A A . 794 LYS O 1 1 8 5518 1 1 16 ALA C C -7.955 3.505 -2.651 1.00 . A A . 795 ALA C 1 1 8 5519 1 1 16 ALA CA C -8.837 2.324 -2.272 1.00 . A A . 795 ALA CA 1 1 8 5520 1 1 16 ALA CB C -9.876 2.059 -3.354 1.00 . A A . 795 ALA CB 1 1 8 5521 1 1 16 ALA H H -9.601 3.516 -0.705 1.00 . A A . 795 ALA H 1 1 8 5522 1 1 16 ALA HA H -8.221 1.442 -2.162 1.00 . A A . 795 ALA HA 1 1 8 5523 1 1 16 ALA HB1 H -9.377 1.889 -4.296 1.00 . A A . 795 ALA HB1 1 1 8 5524 1 1 16 ALA HB2 H -10.531 2.912 -3.443 1.00 . A A . 795 ALA HB2 1 1 8 5525 1 1 16 ALA HB3 H -10.453 1.186 -3.091 1.00 . A A . 795 ALA HB3 1 1 8 5526 1 1 16 ALA N N -9.484 2.588 -0.993 1.00 . A A . 795 ALA N 1 1 8 5527 1 1 16 ALA O O -7.744 3.811 -3.826 1.00 . A A . 795 ALA O 1 1 8 5528 1 1 17 ASN C C -5.097 4.676 -1.932 1.00 . A A . 796 ASN C 1 1 8 5529 1 1 17 ASN CA C -6.494 5.251 -1.766 1.00 . A A . 796 ASN CA 1 1 8 5530 1 1 17 ASN CB C -6.554 6.156 -0.528 1.00 . A A . 796 ASN CB 1 1 8 5531 1 1 17 ASN CG C -6.770 5.360 0.747 1.00 . A A . 796 ASN CG 1 1 8 5532 1 1 17 ASN H H -7.711 3.891 -0.719 1.00 . A A . 796 ASN H 1 1 8 5533 1 1 17 ASN HA H -6.755 5.821 -2.643 1.00 . A A . 796 ASN HA 1 1 8 5534 1 1 17 ASN HB2 H -5.627 6.702 -0.439 1.00 . A A . 796 ASN HB2 1 1 8 5535 1 1 17 ASN HB3 H -7.370 6.855 -0.637 1.00 . A A . 796 ASN HB3 1 1 8 5536 1 1 17 ASN HD21 H -4.818 5.111 0.965 1.00 . A A . 796 ASN HD21 1 1 8 5537 1 1 17 ASN HD22 H -5.803 4.347 2.163 1.00 . A A . 796 ASN HD22 1 1 8 5538 1 1 17 ASN N N -7.450 4.163 -1.622 1.00 . A A . 796 ASN N 1 1 8 5539 1 1 17 ASN ND2 N -5.690 4.904 1.360 1.00 . A A . 796 ASN ND2 1 1 8 5540 1 1 17 ASN O O -4.378 4.462 -0.953 1.00 . A A . 796 ASN O 1 1 8 5541 1 1 17 ASN OD1 O -7.905 5.143 1.165 1.00 . A A . 796 ASN OD1 1 1 8 5542 1 1 18 LEU C C -2.318 4.656 -3.604 1.00 . A A . 797 LEU C 1 1 8 5543 1 1 18 LEU CA C -3.475 3.691 -3.401 1.00 . A A . 797 LEU CA 1 1 8 5544 1 1 18 LEU CB C -3.618 2.807 -4.638 1.00 . A A . 797 LEU CB 1 1 8 5545 1 1 18 LEU CD1 C -4.962 1.206 -6.020 1.00 . A A . 797 LEU CD1 1 1 8 5546 1 1 18 LEU CD2 C -4.916 0.964 -3.539 1.00 . A A . 797 LEU CD2 1 1 8 5547 1 1 18 LEU CG C -4.881 1.947 -4.695 1.00 . A A . 797 LEU CG 1 1 8 5548 1 1 18 LEU H H -5.183 4.749 -3.939 1.00 . A A . 797 LEU H 1 1 8 5549 1 1 18 LEU HA H -3.279 3.070 -2.540 1.00 . A A . 797 LEU HA 1 1 8 5550 1 1 18 LEU HB2 H -3.604 3.447 -5.503 1.00 . A A . 797 LEU HB2 1 1 8 5551 1 1 18 LEU HB3 H -2.763 2.152 -4.684 1.00 . A A . 797 LEU HB3 1 1 8 5552 1 1 18 LEU HD11 H -5.863 0.611 -6.045 1.00 . A A . 797 LEU HD11 1 1 8 5553 1 1 18 LEU HD12 H -4.102 0.561 -6.123 1.00 . A A . 797 LEU HD12 1 1 8 5554 1 1 18 LEU HD13 H -4.977 1.919 -6.830 1.00 . A A . 797 LEU HD13 1 1 8 5555 1 1 18 LEU HD21 H -4.924 1.506 -2.607 1.00 . A A . 797 LEU HD21 1 1 8 5556 1 1 18 LEU HD22 H -4.041 0.329 -3.579 1.00 . A A . 797 LEU HD22 1 1 8 5557 1 1 18 LEU HD23 H -5.806 0.355 -3.610 1.00 . A A . 797 LEU HD23 1 1 8 5558 1 1 18 LEU HG H -5.747 2.589 -4.614 1.00 . A A . 797 LEU HG 1 1 8 5559 1 1 18 LEU N N -4.700 4.408 -3.161 1.00 . A A . 797 LEU N 1 1 8 5560 1 1 18 LEU O O -2.478 5.729 -4.183 1.00 . A A . 797 LEU O 1 1 8 5561 1 1 19 LEU C C 1.089 3.824 -3.515 1.00 . A A . 798 LEU C 1 1 8 5562 1 1 19 LEU CA C 0.086 4.934 -3.375 1.00 . A A . 798 LEU CA 1 1 8 5563 1 1 19 LEU CB C 0.437 5.883 -2.227 1.00 . A A . 798 LEU CB 1 1 8 5564 1 1 19 LEU CD1 C 2.610 5.537 -1.060 1.00 . A A . 798 LEU CD1 1 1 8 5565 1 1 19 LEU CD2 C 0.508 5.711 0.254 1.00 . A A . 798 LEU CD2 1 1 8 5566 1 1 19 LEU CG C 1.127 5.233 -1.036 1.00 . A A . 798 LEU CG 1 1 8 5567 1 1 19 LEU H H -1.151 3.427 -2.590 1.00 . A A . 798 LEU H 1 1 8 5568 1 1 19 LEU HA H 0.054 5.465 -4.312 1.00 . A A . 798 LEU HA 1 1 8 5569 1 1 19 LEU HB2 H 1.085 6.657 -2.614 1.00 . A A . 798 LEU HB2 1 1 8 5570 1 1 19 LEU HB3 H -0.475 6.344 -1.879 1.00 . A A . 798 LEU HB3 1 1 8 5571 1 1 19 LEU HD11 H 2.764 6.593 -0.895 1.00 . A A . 798 LEU HD11 1 1 8 5572 1 1 19 LEU HD12 H 3.006 5.264 -2.028 1.00 . A A . 798 LEU HD12 1 1 8 5573 1 1 19 LEU HD13 H 3.108 4.970 -0.289 1.00 . A A . 798 LEU HD13 1 1 8 5574 1 1 19 LEU HD21 H 1.012 5.243 1.084 1.00 . A A . 798 LEU HD21 1 1 8 5575 1 1 19 LEU HD22 H -0.538 5.444 0.266 1.00 . A A . 798 LEU HD22 1 1 8 5576 1 1 19 LEU HD23 H 0.610 6.783 0.323 1.00 . A A . 798 LEU HD23 1 1 8 5577 1 1 19 LEU HG H 1.001 4.163 -1.094 1.00 . A A . 798 LEU HG 1 1 8 5578 1 1 19 LEU N N -1.172 4.252 -3.129 1.00 . A A . 798 LEU N 1 1 8 5579 1 1 19 LEU O O 0.704 2.659 -3.360 1.00 . A A . 798 LEU O 1 1 8 5580 1 1 20 LYS C C 4.596 3.134 -3.539 1.00 . A A . 799 LYS C 1 1 8 5581 1 1 20 LYS CA C 3.196 2.975 -4.080 1.00 . A A . 799 LYS CA 1 1 8 5582 1 1 20 LYS CB C 3.245 2.704 -5.572 1.00 . A A . 799 LYS CB 1 1 8 5583 1 1 20 LYS CD C 4.312 3.371 -7.770 1.00 . A A . 799 LYS CD 1 1 8 5584 1 1 20 LYS CE C 5.201 4.392 -8.465 1.00 . A A . 799 LYS CE 1 1 8 5585 1 1 20 LYS CG C 4.110 3.720 -6.311 1.00 . A A . 799 LYS CG 1 1 8 5586 1 1 20 LYS H H 2.668 5.023 -3.880 1.00 . A A . 799 LYS H 1 1 8 5587 1 1 20 LYS HA H 2.738 2.171 -3.538 1.00 . A A . 799 LYS HA 1 1 8 5588 1 1 20 LYS HB2 H 3.640 1.713 -5.745 1.00 . A A . 799 LYS HB2 1 1 8 5589 1 1 20 LYS HB3 H 2.239 2.768 -5.957 1.00 . A A . 799 LYS HB3 1 1 8 5590 1 1 20 LYS HD2 H 4.775 2.400 -7.838 1.00 . A A . 799 LYS HD2 1 1 8 5591 1 1 20 LYS HD3 H 3.350 3.350 -8.262 1.00 . A A . 799 LYS HD3 1 1 8 5592 1 1 20 LYS HE2 H 5.398 4.051 -9.472 1.00 . A A . 799 LYS HE2 1 1 8 5593 1 1 20 LYS HE3 H 4.677 5.335 -8.504 1.00 . A A . 799 LYS HE3 1 1 8 5594 1 1 20 LYS HG2 H 3.643 4.685 -6.249 1.00 . A A . 799 LYS HG2 1 1 8 5595 1 1 20 LYS HG3 H 5.076 3.761 -5.828 1.00 . A A . 799 LYS HG3 1 1 8 5596 1 1 20 LYS HZ1 H 6.350 5.080 -6.846 1.00 . A A . 799 LYS HZ1 1 1 8 5597 1 1 20 LYS HZ2 H 7.146 5.165 -8.345 1.00 . A A . 799 LYS HZ2 1 1 8 5598 1 1 20 LYS HZ3 H 6.951 3.675 -7.574 1.00 . A A . 799 LYS HZ3 1 1 8 5599 1 1 20 LYS N N 2.339 4.099 -3.817 1.00 . A A . 799 LYS N 1 1 8 5600 1 1 20 LYS NZ N 6.500 4.589 -7.760 1.00 . A A . 799 LYS NZ 1 1 8 5601 1 1 20 LYS O O 5.120 4.233 -3.357 1.00 . A A . 799 LYS O 1 1 8 5602 1 1 21 CYS C C 7.445 2.424 -3.863 1.00 . A A . 800 CYS C 1 1 8 5603 1 1 21 CYS CA C 6.510 1.763 -2.864 1.00 . A A . 800 CYS CA 1 1 8 5604 1 1 21 CYS CB C 6.691 0.248 -2.866 1.00 . A A . 800 CYS CB 1 1 8 5605 1 1 21 CYS H H 4.569 1.175 -3.260 1.00 . A A . 800 CYS H 1 1 8 5606 1 1 21 CYS HA H 6.654 2.148 -1.869 1.00 . A A . 800 CYS HA 1 1 8 5607 1 1 21 CYS HB2 H 5.969 -0.187 -2.192 1.00 . A A . 800 CYS HB2 1 1 8 5608 1 1 21 CYS HB3 H 6.480 -0.111 -3.866 1.00 . A A . 800 CYS HB3 1 1 8 5609 1 1 21 CYS N N 5.142 1.966 -3.250 1.00 . A A . 800 CYS N 1 1 8 5610 1 1 21 CYS O O 7.663 1.891 -4.945 1.00 . A A . 800 CYS O 1 1 8 5611 1 1 21 CYS SG S 8.286 -0.426 -2.393 1.00 . A A . 800 CYS SG 1 1 8 5612 1 1 22 GLU C C 10.235 3.603 -4.520 1.00 . A A . 801 GLU C 1 1 8 5613 1 1 22 GLU CA C 8.899 4.337 -4.354 1.00 . A A . 801 GLU CA 1 1 8 5614 1 1 22 GLU CB C 9.120 5.729 -3.771 1.00 . A A . 801 GLU CB 1 1 8 5615 1 1 22 GLU CD C 7.157 6.945 -4.833 1.00 . A A . 801 GLU CD 1 1 8 5616 1 1 22 GLU CG C 7.828 6.500 -3.545 1.00 . A A . 801 GLU CG 1 1 8 5617 1 1 22 GLU H H 7.665 4.010 -2.667 1.00 . A A . 801 GLU H 1 1 8 5618 1 1 22 GLU HA H 8.474 4.438 -5.340 1.00 . A A . 801 GLU HA 1 1 8 5619 1 1 22 GLU HB2 H 9.629 5.634 -2.822 1.00 . A A . 801 GLU HB2 1 1 8 5620 1 1 22 GLU HB3 H 9.740 6.298 -4.447 1.00 . A A . 801 GLU HB3 1 1 8 5621 1 1 22 GLU HG2 H 7.141 5.868 -3.001 1.00 . A A . 801 GLU HG2 1 1 8 5622 1 1 22 GLU HG3 H 8.048 7.376 -2.952 1.00 . A A . 801 GLU HG3 1 1 8 5623 1 1 22 GLU N N 7.957 3.597 -3.513 1.00 . A A . 801 GLU N 1 1 8 5624 1 1 22 GLU O O 11.266 4.215 -4.798 1.00 . A A . 801 GLU O 1 1 8 5625 1 1 22 GLU OE1 O 6.641 6.087 -5.584 1.00 . A A . 801 GLU OE1 1 1 8 5626 1 1 22 GLU OE2 O 7.120 8.167 -5.086 1.00 . A A . 801 GLU OE2 1 1 8 5627 1 1 23 TYR C C 10.836 0.635 -5.971 1.00 . A A . 802 TYR C 1 1 8 5628 1 1 23 TYR CA C 11.297 1.444 -4.753 1.00 . A A . 802 TYR CA 1 1 8 5629 1 1 23 TYR CB C 11.754 0.517 -3.611 1.00 . A A . 802 TYR CB 1 1 8 5630 1 1 23 TYR CD1 C 13.211 -1.312 -4.572 1.00 . A A . 802 TYR CD1 1 1 8 5631 1 1 23 TYR CD2 C 14.272 0.456 -3.377 1.00 . A A . 802 TYR CD2 1 1 8 5632 1 1 23 TYR CE1 C 14.439 -1.906 -4.796 1.00 . A A . 802 TYR CE1 1 1 8 5633 1 1 23 TYR CE2 C 15.504 -0.131 -3.599 1.00 . A A . 802 TYR CE2 1 1 8 5634 1 1 23 TYR CG C 13.105 -0.123 -3.859 1.00 . A A . 802 TYR CG 1 1 8 5635 1 1 23 TYR CZ C 15.594 -1.285 -4.319 1.00 . A A . 802 TYR CZ 1 1 8 5636 1 1 23 TYR H H 9.404 1.888 -3.956 1.00 . A A . 802 TYR H 1 1 8 5637 1 1 23 TYR HA H 12.123 2.081 -5.040 1.00 . A A . 802 TYR HA 1 1 8 5638 1 1 23 TYR HB2 H 11.825 1.088 -2.691 1.00 . A A . 802 TYR HB2 1 1 8 5639 1 1 23 TYR HB3 H 11.030 -0.273 -3.484 1.00 . A A . 802 TYR HB3 1 1 8 5640 1 1 23 TYR HD1 H 12.314 -1.777 -4.953 1.00 . A A . 802 TYR HD1 1 1 8 5641 1 1 23 TYR HD2 H 14.210 1.378 -2.821 1.00 . A A . 802 TYR HD2 1 1 8 5642 1 1 23 TYR HE1 H 14.499 -2.830 -5.354 1.00 . A A . 802 TYR HE1 1 1 8 5643 1 1 23 TYR HE2 H 16.399 0.337 -3.218 1.00 . A A . 802 TYR HE2 1 1 8 5644 1 1 23 TYR HH H 16.869 -2.207 -5.448 1.00 . A A . 802 TYR HH 1 1 8 5645 1 1 23 TYR N N 10.205 2.293 -4.344 1.00 . A A . 802 TYR N 1 1 8 5646 1 1 23 TYR O O 11.072 1.031 -7.113 1.00 . A A . 802 TYR O 1 1 8 5647 1 1 23 TYR OH O 16.813 -1.897 -4.526 1.00 . A A . 802 TYR OH 1 1 8 5648 1 1 24 CYS C C 8.529 -0.621 -7.607 1.00 . A A . 803 CYS C 1 1 8 5649 1 1 24 CYS CA C 9.631 -1.321 -6.807 1.00 . A A . 803 CYS CA 1 1 8 5650 1 1 24 CYS CB C 9.131 -2.663 -6.257 1.00 . A A . 803 CYS CB 1 1 8 5651 1 1 24 CYS H H 10.161 -0.851 -4.814 1.00 . A A . 803 CYS H 1 1 8 5652 1 1 24 CYS HA H 10.441 -1.516 -7.494 1.00 . A A . 803 CYS HA 1 1 8 5653 1 1 24 CYS HB2 H 8.518 -3.145 -7.005 1.00 . A A . 803 CYS HB2 1 1 8 5654 1 1 24 CYS HB3 H 9.982 -3.294 -6.040 1.00 . A A . 803 CYS HB3 1 1 8 5655 1 1 24 CYS N N 10.167 -0.495 -5.723 1.00 . A A . 803 CYS N 1 1 8 5656 1 1 24 CYS O O 8.478 -0.736 -8.830 1.00 . A A . 803 CYS O 1 1 8 5657 1 1 24 CYS SG S 8.143 -2.526 -4.742 1.00 . A A . 803 CYS SG 1 1 8 5658 1 1 25 GLY C C 5.286 0.082 -7.610 1.00 . A A . 804 GLY C 1 1 8 5659 1 1 25 GLY CA C 6.607 0.823 -7.621 1.00 . A A . 804 GLY CA 1 1 8 5660 1 1 25 GLY H H 7.765 0.211 -5.956 1.00 . A A . 804 GLY H 1 1 8 5661 1 1 25 GLY HA2 H 6.465 1.783 -7.148 1.00 . A A . 804 GLY HA2 1 1 8 5662 1 1 25 GLY HA3 H 6.910 0.981 -8.645 1.00 . A A . 804 GLY HA3 1 1 8 5663 1 1 25 GLY N N 7.664 0.115 -6.928 1.00 . A A . 804 GLY N 1 1 8 5664 1 1 25 GLY O O 4.463 0.266 -8.505 1.00 . A A . 804 GLY O 1 1 8 5665 1 1 26 LYS C C 2.773 -0.627 -5.779 1.00 . A A . 805 LYS C 1 1 8 5666 1 1 26 LYS CA C 3.820 -1.485 -6.481 1.00 . A A . 805 LYS CA 1 1 8 5667 1 1 26 LYS CB C 4.026 -2.786 -5.706 1.00 . A A . 805 LYS CB 1 1 8 5668 1 1 26 LYS CD C 5.098 -5.052 -5.598 1.00 . A A . 805 LYS CD 1 1 8 5669 1 1 26 LYS CE C 3.773 -5.799 -5.604 1.00 . A A . 805 LYS CE 1 1 8 5670 1 1 26 LYS CG C 5.007 -3.742 -6.363 1.00 . A A . 805 LYS CG 1 1 8 5671 1 1 26 LYS H H 5.747 -0.840 -5.901 1.00 . A A . 805 LYS H 1 1 8 5672 1 1 26 LYS HA H 3.471 -1.716 -7.476 1.00 . A A . 805 LYS HA 1 1 8 5673 1 1 26 LYS HB2 H 4.396 -2.549 -4.720 1.00 . A A . 805 LYS HB2 1 1 8 5674 1 1 26 LYS HB3 H 3.075 -3.288 -5.613 1.00 . A A . 805 LYS HB3 1 1 8 5675 1 1 26 LYS HD2 H 5.850 -5.674 -6.061 1.00 . A A . 805 LYS HD2 1 1 8 5676 1 1 26 LYS HD3 H 5.381 -4.842 -4.578 1.00 . A A . 805 LYS HD3 1 1 8 5677 1 1 26 LYS HE2 H 3.858 -6.660 -4.957 1.00 . A A . 805 LYS HE2 1 1 8 5678 1 1 26 LYS HE3 H 3.002 -5.143 -5.224 1.00 . A A . 805 LYS HE3 1 1 8 5679 1 1 26 LYS HG2 H 4.677 -3.946 -7.371 1.00 . A A . 805 LYS HG2 1 1 8 5680 1 1 26 LYS HG3 H 5.983 -3.281 -6.388 1.00 . A A . 805 LYS HG3 1 1 8 5681 1 1 26 LYS HZ1 H 2.484 -6.771 -6.929 1.00 . A A . 805 LYS HZ1 1 1 8 5682 1 1 26 LYS HZ2 H 4.125 -6.896 -7.343 1.00 . A A . 805 LYS HZ2 1 1 8 5683 1 1 26 LYS HZ3 H 3.295 -5.442 -7.612 1.00 . A A . 805 LYS HZ3 1 1 8 5684 1 1 26 LYS N N 5.074 -0.750 -6.603 1.00 . A A . 805 LYS N 1 1 8 5685 1 1 26 LYS NZ N 3.393 -6.257 -6.965 1.00 . A A . 805 LYS NZ 1 1 8 5686 1 1 26 LYS O O 3.029 -0.109 -4.690 1.00 . A A . 805 LYS O 1 1 8 5687 1 1 27 TYR C C -0.301 -0.481 -4.836 1.00 . A A . 806 TYR C 1 1 8 5688 1 1 27 TYR CA C 0.525 0.322 -5.825 1.00 . A A . 806 TYR CA 1 1 8 5689 1 1 27 TYR CB C -0.399 0.858 -6.922 1.00 . A A . 806 TYR CB 1 1 8 5690 1 1 27 TYR CD1 C 0.147 3.262 -7.460 1.00 . A A . 806 TYR CD1 1 1 8 5691 1 1 27 TYR CD2 C 0.864 1.572 -8.979 1.00 . A A . 806 TYR CD2 1 1 8 5692 1 1 27 TYR CE1 C 0.722 4.230 -8.259 1.00 . A A . 806 TYR CE1 1 1 8 5693 1 1 27 TYR CE2 C 1.445 2.532 -9.782 1.00 . A A . 806 TYR CE2 1 1 8 5694 1 1 27 TYR CG C 0.207 1.920 -7.807 1.00 . A A . 806 TYR CG 1 1 8 5695 1 1 27 TYR CZ C 1.271 3.887 -9.451 1.00 . A A . 806 TYR CZ 1 1 8 5696 1 1 27 TYR H H 1.396 -1.055 -7.174 1.00 . A A . 806 TYR H 1 1 8 5697 1 1 27 TYR HA H 0.952 1.152 -5.282 1.00 . A A . 806 TYR HA 1 1 8 5698 1 1 27 TYR HB2 H -0.697 0.039 -7.556 1.00 . A A . 806 TYR HB2 1 1 8 5699 1 1 27 TYR HB3 H -1.280 1.280 -6.458 1.00 . A A . 806 TYR HB3 1 1 8 5700 1 1 27 TYR HD1 H -0.359 3.549 -6.552 1.00 . A A . 806 TYR HD1 1 1 8 5701 1 1 27 TYR HD2 H 0.918 0.531 -9.261 1.00 . A A . 806 TYR HD2 1 1 8 5702 1 1 27 TYR HE1 H 0.665 5.271 -7.975 1.00 . A A . 806 TYR HE1 1 1 8 5703 1 1 27 TYR HE2 H 1.950 2.242 -10.689 1.00 . A A . 806 TYR HE2 1 1 8 5704 1 1 27 TYR HH H 1.785 4.605 -11.147 1.00 . A A . 806 TYR HH 1 1 8 5705 1 1 27 TYR N N 1.593 -0.508 -6.379 1.00 . A A . 806 TYR N 1 1 8 5706 1 1 27 TYR O O -0.693 -1.615 -5.114 1.00 . A A . 806 TYR O 1 1 8 5707 1 1 27 TYR OH O 1.948 4.817 -10.214 1.00 . A A . 806 TYR OH 1 1 8 5708 1 1 28 ALA C C -1.924 0.492 -1.704 1.00 . A A . 807 ALA C 1 1 8 5709 1 1 28 ALA CA C -1.267 -0.540 -2.609 1.00 . A A . 807 ALA CA 1 1 8 5710 1 1 28 ALA CB C -0.279 -1.393 -1.824 1.00 . A A . 807 ALA CB 1 1 8 5711 1 1 28 ALA H H -0.298 1.070 -3.580 1.00 . A A . 807 ALA H 1 1 8 5712 1 1 28 ALA HA H -2.024 -1.187 -3.031 1.00 . A A . 807 ALA HA 1 1 8 5713 1 1 28 ALA HB1 H 0.507 -0.766 -1.425 1.00 . A A . 807 ALA HB1 1 1 8 5714 1 1 28 ALA HB2 H 0.155 -2.137 -2.475 1.00 . A A . 807 ALA HB2 1 1 8 5715 1 1 28 ALA HB3 H -0.793 -1.883 -1.011 1.00 . A A . 807 ALA HB3 1 1 8 5716 1 1 28 ALA N N -0.578 0.129 -3.696 1.00 . A A . 807 ALA N 1 1 8 5717 1 1 28 ALA O O -1.554 1.667 -1.732 1.00 . A A . 807 ALA O 1 1 8 5718 1 1 29 PRO C C -2.643 1.530 1.067 1.00 . A A . 808 PRO C 1 1 8 5719 1 1 29 PRO CA C -3.601 0.989 0.017 1.00 . A A . 808 PRO CA 1 1 8 5720 1 1 29 PRO CB C -4.679 0.119 0.668 1.00 . A A . 808 PRO CB 1 1 8 5721 1 1 29 PRO CD C -3.499 -1.269 -0.862 1.00 . A A . 808 PRO CD 1 1 8 5722 1 1 29 PRO CG C -4.850 -1.034 -0.253 1.00 . A A . 808 PRO CG 1 1 8 5723 1 1 29 PRO HA H -4.057 1.814 -0.509 1.00 . A A . 808 PRO HA 1 1 8 5724 1 1 29 PRO HB2 H -4.341 -0.202 1.642 1.00 . A A . 808 PRO HB2 1 1 8 5725 1 1 29 PRO HB3 H -5.591 0.685 0.766 1.00 . A A . 808 PRO HB3 1 1 8 5726 1 1 29 PRO HD2 H -2.906 -1.917 -0.232 1.00 . A A . 808 PRO HD2 1 1 8 5727 1 1 29 PRO HD3 H -3.594 -1.686 -1.854 1.00 . A A . 808 PRO HD3 1 1 8 5728 1 1 29 PRO HG2 H -5.169 -1.905 0.301 1.00 . A A . 808 PRO HG2 1 1 8 5729 1 1 29 PRO HG3 H -5.570 -0.787 -1.018 1.00 . A A . 808 PRO HG3 1 1 8 5730 1 1 29 PRO N N -2.927 0.084 -0.912 1.00 . A A . 808 PRO N 1 1 8 5731 1 1 29 PRO O O -1.907 0.770 1.702 1.00 . A A . 808 PRO O 1 1 8 5732 1 1 30 ALA C C -1.709 2.935 3.544 1.00 . A A . 809 ALA C 1 1 8 5733 1 1 30 ALA CA C -1.808 3.590 2.155 1.00 . A A . 809 ALA CA 1 1 8 5734 1 1 30 ALA CB C -2.328 5.008 2.295 1.00 . A A . 809 ALA CB 1 1 8 5735 1 1 30 ALA H H -3.213 3.373 0.580 1.00 . A A . 809 ALA H 1 1 8 5736 1 1 30 ALA HA H -0.819 3.652 1.727 1.00 . A A . 809 ALA HA 1 1 8 5737 1 1 30 ALA HB1 H -3.312 4.988 2.738 1.00 . A A . 809 ALA HB1 1 1 8 5738 1 1 30 ALA HB2 H -2.377 5.471 1.321 1.00 . A A . 809 ALA HB2 1 1 8 5739 1 1 30 ALA HB3 H -1.660 5.574 2.928 1.00 . A A . 809 ALA HB3 1 1 8 5740 1 1 30 ALA N N -2.649 2.855 1.199 1.00 . A A . 809 ALA N 1 1 8 5741 1 1 30 ALA O O -0.723 3.131 4.254 1.00 . A A . 809 ALA O 1 1 8 5742 1 1 31 GLU C C -1.594 0.487 5.359 1.00 . A A . 810 GLU C 1 1 8 5743 1 1 31 GLU CA C -2.746 1.490 5.221 1.00 . A A . 810 GLU CA 1 1 8 5744 1 1 31 GLU CB C -4.084 0.775 5.469 1.00 . A A . 810 GLU CB 1 1 8 5745 1 1 31 GLU CD C -5.768 1.733 3.834 1.00 . A A . 810 GLU CD 1 1 8 5746 1 1 31 GLU CG C -4.933 0.526 4.229 1.00 . A A . 810 GLU CG 1 1 8 5747 1 1 31 GLU H H -3.480 2.051 3.304 1.00 . A A . 810 GLU H 1 1 8 5748 1 1 31 GLU HA H -2.625 2.238 5.992 1.00 . A A . 810 GLU HA 1 1 8 5749 1 1 31 GLU HB2 H -3.879 -0.181 5.926 1.00 . A A . 810 GLU HB2 1 1 8 5750 1 1 31 GLU HB3 H -4.666 1.370 6.158 1.00 . A A . 810 GLU HB3 1 1 8 5751 1 1 31 GLU HG2 H -4.283 0.269 3.407 1.00 . A A . 810 GLU HG2 1 1 8 5752 1 1 31 GLU HG3 H -5.596 -0.301 4.430 1.00 . A A . 810 GLU HG3 1 1 8 5753 1 1 31 GLU N N -2.731 2.179 3.929 1.00 . A A . 810 GLU N 1 1 8 5754 1 1 31 GLU O O -1.176 0.177 6.473 1.00 . A A . 810 GLU O 1 1 8 5755 1 1 31 GLU OE1 O -6.887 1.884 4.374 1.00 . A A . 810 GLU OE1 1 1 8 5756 1 1 31 GLU OE2 O -5.313 2.532 2.990 1.00 . A A . 810 GLU OE2 1 1 8 5757 1 1 32 GLN C C 1.341 -0.329 4.426 1.00 . A A . 811 GLN C 1 1 8 5758 1 1 32 GLN CA C -0.014 -1.014 4.273 1.00 . A A . 811 GLN CA 1 1 8 5759 1 1 32 GLN CB C -0.030 -1.860 2.994 1.00 . A A . 811 GLN CB 1 1 8 5760 1 1 32 GLN CD C 1.237 -3.643 1.655 1.00 . A A . 811 GLN CD 1 1 8 5761 1 1 32 GLN CG C 0.953 -3.030 3.022 1.00 . A A . 811 GLN CG 1 1 8 5762 1 1 32 GLN H H -1.406 0.305 3.369 1.00 . A A . 811 GLN H 1 1 8 5763 1 1 32 GLN HA H -0.197 -1.641 5.130 1.00 . A A . 811 GLN HA 1 1 8 5764 1 1 32 GLN HB2 H -1.027 -2.257 2.855 1.00 . A A . 811 GLN HB2 1 1 8 5765 1 1 32 GLN HB3 H 0.213 -1.223 2.163 1.00 . A A . 811 GLN HB3 1 1 8 5766 1 1 32 GLN HE21 H 1.222 -1.861 0.774 1.00 . A A . 811 GLN HE21 1 1 8 5767 1 1 32 GLN HE22 H 1.510 -3.208 -0.260 1.00 . A A . 811 GLN HE22 1 1 8 5768 1 1 32 GLN HG2 H 1.887 -2.680 3.435 1.00 . A A . 811 GLN HG2 1 1 8 5769 1 1 32 GLN HG3 H 0.549 -3.799 3.664 1.00 . A A . 811 GLN HG3 1 1 8 5770 1 1 32 GLN N N -1.078 -0.015 4.237 1.00 . A A . 811 GLN N 1 1 8 5771 1 1 32 GLN NE2 N 1.334 -2.820 0.620 1.00 . A A . 811 GLN NE2 1 1 8 5772 1 1 32 GLN O O 2.370 -0.976 4.608 1.00 . A A . 811 GLN O 1 1 8 5773 1 1 32 GLN OE1 O 1.432 -4.853 1.541 1.00 . A A . 811 GLN OE1 1 1 8 5774 1 1 33 PHE C C 2.927 2.218 5.752 1.00 . A A . 812 PHE C 1 1 8 5775 1 1 33 PHE CA C 2.552 1.762 4.349 1.00 . A A . 812 PHE CA 1 1 8 5776 1 1 33 PHE CB C 2.413 2.941 3.384 1.00 . A A . 812 PHE CB 1 1 8 5777 1 1 33 PHE CD1 C 1.174 1.989 1.425 1.00 . A A . 812 PHE CD1 1 1 8 5778 1 1 33 PHE CD2 C 3.436 2.660 1.107 1.00 . A A . 812 PHE CD2 1 1 8 5779 1 1 33 PHE CE1 C 1.095 1.613 0.099 1.00 . A A . 812 PHE CE1 1 1 8 5780 1 1 33 PHE CE2 C 3.365 2.284 -0.219 1.00 . A A . 812 PHE CE2 1 1 8 5781 1 1 33 PHE CG C 2.342 2.516 1.944 1.00 . A A . 812 PHE CG 1 1 8 5782 1 1 33 PHE CZ C 2.230 1.701 -0.709 1.00 . A A . 812 PHE CZ 1 1 8 5783 1 1 33 PHE H H 0.473 1.458 4.532 1.00 . A A . 812 PHE H 1 1 8 5784 1 1 33 PHE HA H 3.331 1.106 3.987 1.00 . A A . 812 PHE HA 1 1 8 5785 1 1 33 PHE HB2 H 1.512 3.488 3.617 1.00 . A A . 812 PHE HB2 1 1 8 5786 1 1 33 PHE HB3 H 3.266 3.592 3.498 1.00 . A A . 812 PHE HB3 1 1 8 5787 1 1 33 PHE HD1 H 0.315 1.873 2.070 1.00 . A A . 812 PHE HD1 1 1 8 5788 1 1 33 PHE HD2 H 4.355 3.069 1.501 1.00 . A A . 812 PHE HD2 1 1 8 5789 1 1 33 PHE HE1 H 0.176 1.203 -0.293 1.00 . A A . 812 PHE HE1 1 1 8 5790 1 1 33 PHE HE2 H 4.225 2.402 -0.861 1.00 . A A . 812 PHE HE2 1 1 8 5791 1 1 33 PHE HZ H 2.187 1.382 -1.740 1.00 . A A . 812 PHE HZ 1 1 8 5792 1 1 33 PHE N N 1.323 0.991 4.389 1.00 . A A . 812 PHE N 1 1 8 5793 1 1 33 PHE O O 3.219 3.386 5.994 1.00 . A A . 812 PHE O 1 1 8 5794 1 1 34 ARG C C 4.739 1.503 8.273 1.00 . A A . 813 ARG C 1 1 8 5795 1 1 34 ARG CA C 3.229 1.530 8.072 1.00 . A A . 813 ARG CA 1 1 8 5796 1 1 34 ARG CB C 2.543 0.512 8.980 1.00 . A A . 813 ARG CB 1 1 8 5797 1 1 34 ARG CD C 0.353 -0.330 9.885 1.00 . A A . 813 ARG CD 1 1 8 5798 1 1 34 ARG CG C 1.033 0.497 8.811 1.00 . A A . 813 ARG CG 1 1 8 5799 1 1 34 ARG CZ C 0.480 -0.404 12.350 1.00 . A A . 813 ARG CZ 1 1 8 5800 1 1 34 ARG H H 2.624 0.364 6.414 1.00 . A A . 813 ARG H 1 1 8 5801 1 1 34 ARG HA H 2.894 2.517 8.354 1.00 . A A . 813 ARG HA 1 1 8 5802 1 1 34 ARG HB2 H 2.923 -0.473 8.751 1.00 . A A . 813 ARG HB2 1 1 8 5803 1 1 34 ARG HB3 H 2.768 0.749 10.008 1.00 . A A . 813 ARG HB3 1 1 8 5804 1 1 34 ARG HD2 H -0.695 -0.425 9.638 1.00 . A A . 813 ARG HD2 1 1 8 5805 1 1 34 ARG HD3 H 0.807 -1.309 9.907 1.00 . A A . 813 ARG HD3 1 1 8 5806 1 1 34 ARG HE H 0.548 1.267 11.243 1.00 . A A . 813 ARG HE 1 1 8 5807 1 1 34 ARG HG2 H 0.666 1.511 8.865 1.00 . A A . 813 ARG HG2 1 1 8 5808 1 1 34 ARG HG3 H 0.794 0.080 7.842 1.00 . A A . 813 ARG HG3 1 1 8 5809 1 1 34 ARG HH11 H 0.377 -2.233 11.461 1.00 . A A . 813 ARG HH11 1 1 8 5810 1 1 34 ARG HH12 H 0.438 -2.246 13.200 1.00 . A A . 813 ARG HH12 1 1 8 5811 1 1 34 ARG HH21 H 0.627 1.243 13.524 1.00 . A A . 813 ARG HH21 1 1 8 5812 1 1 34 ARG HH22 H 0.546 -0.274 14.376 1.00 . A A . 813 ARG HH22 1 1 8 5813 1 1 34 ARG N N 2.888 1.273 6.679 1.00 . A A . 813 ARG N 1 1 8 5814 1 1 34 ARG NE N 0.478 0.282 11.208 1.00 . A A . 813 ARG NE 1 1 8 5815 1 1 34 ARG NH1 N 0.423 -1.731 12.338 1.00 . A A . 813 ARG NH1 1 1 8 5816 1 1 34 ARG NH2 N 0.561 0.239 13.506 1.00 . A A . 813 ARG NH2 1 1 8 5817 1 1 34 ARG O O 5.238 1.803 9.358 1.00 . A A . 813 ARG O 1 1 8 5818 1 1 35 GLY C C 7.261 2.639 6.543 1.00 . A A . 814 GLY C 1 1 8 5819 1 1 35 GLY CA C 6.897 1.337 7.221 1.00 . A A . 814 GLY CA 1 1 8 5820 1 1 35 GLY H H 5.014 0.798 6.430 1.00 . A A . 814 GLY H 1 1 8 5821 1 1 35 GLY HA2 H 7.257 1.348 8.240 1.00 . A A . 814 GLY HA2 1 1 8 5822 1 1 35 GLY HA3 H 7.357 0.520 6.687 1.00 . A A . 814 GLY HA3 1 1 8 5823 1 1 35 GLY N N 5.461 1.165 7.221 1.00 . A A . 814 GLY N 1 1 8 5824 1 1 35 GLY O O 8.141 2.672 5.680 1.00 . A A . 814 GLY O 1 1 8 5825 1 1 36 SER C C 5.879 4.922 4.932 1.00 . A A . 815 SER C 1 1 8 5826 1 1 36 SER CA C 6.608 5.001 6.271 1.00 . A A . 815 SER CA 1 1 8 5827 1 1 36 SER CB C 8.047 5.488 6.069 1.00 . A A . 815 SER CB 1 1 8 5828 1 1 36 SER H H 6.003 3.620 7.752 1.00 . A A . 815 SER H 1 1 8 5829 1 1 36 SER HA H 6.078 5.723 6.874 1.00 . A A . 815 SER HA 1 1 8 5830 1 1 36 SER HB2 H 8.611 4.728 5.551 1.00 . A A . 815 SER HB2 1 1 8 5831 1 1 36 SER HB3 H 8.039 6.393 5.481 1.00 . A A . 815 SER HB3 1 1 8 5832 1 1 36 SER HG H 8.100 5.472 8.035 1.00 . A A . 815 SER HG 1 1 8 5833 1 1 36 SER N N 6.565 3.709 6.954 1.00 . A A . 815 SER N 1 1 8 5834 1 1 36 SER O O 5.950 3.919 4.217 1.00 . A A . 815 SER O 1 1 8 5835 1 1 36 SER OG O 8.680 5.755 7.309 1.00 . A A . 815 SER OG 1 1 8 5836 1 1 37 LYS C C 5.294 6.268 2.174 1.00 . A A . 816 LYS C 1 1 8 5837 1 1 37 LYS CA C 4.379 6.063 3.376 1.00 . A A . 816 LYS CA 1 1 8 5838 1 1 37 LYS CB C 3.386 7.221 3.469 1.00 . A A . 816 LYS CB 1 1 8 5839 1 1 37 LYS CD C 1.412 6.011 4.460 1.00 . A A . 816 LYS CD 1 1 8 5840 1 1 37 LYS CE C 0.555 5.816 5.701 1.00 . A A . 816 LYS CE 1 1 8 5841 1 1 37 LYS CG C 2.424 7.128 4.646 1.00 . A A . 816 LYS CG 1 1 8 5842 1 1 37 LYS H H 5.204 6.794 5.178 1.00 . A A . 816 LYS H 1 1 8 5843 1 1 37 LYS HA H 3.838 5.134 3.266 1.00 . A A . 816 LYS HA 1 1 8 5844 1 1 37 LYS HB2 H 3.944 8.137 3.564 1.00 . A A . 816 LYS HB2 1 1 8 5845 1 1 37 LYS HB3 H 2.806 7.255 2.558 1.00 . A A . 816 LYS HB3 1 1 8 5846 1 1 37 LYS HD2 H 0.770 6.256 3.628 1.00 . A A . 816 LYS HD2 1 1 8 5847 1 1 37 LYS HD3 H 1.940 5.094 4.249 1.00 . A A . 816 LYS HD3 1 1 8 5848 1 1 37 LYS HE2 H -0.142 5.012 5.517 1.00 . A A . 816 LYS HE2 1 1 8 5849 1 1 37 LYS HE3 H 1.199 5.550 6.526 1.00 . A A . 816 LYS HE3 1 1 8 5850 1 1 37 LYS HG2 H 2.989 6.939 5.545 1.00 . A A . 816 LYS HG2 1 1 8 5851 1 1 37 LYS HG3 H 1.898 8.067 4.741 1.00 . A A . 816 LYS HG3 1 1 8 5852 1 1 37 LYS HZ1 H -0.839 6.846 6.871 1.00 . A A . 816 LYS HZ1 1 1 8 5853 1 1 37 LYS HZ2 H -0.791 7.359 5.254 1.00 . A A . 816 LYS HZ2 1 1 8 5854 1 1 37 LYS HZ3 H 0.447 7.807 6.330 1.00 . A A . 816 LYS HZ3 1 1 8 5855 1 1 37 LYS N N 5.168 5.995 4.600 1.00 . A A . 816 LYS N 1 1 8 5856 1 1 37 LYS NZ N -0.209 7.041 6.061 1.00 . A A . 816 LYS NZ 1 1 8 5857 1 1 37 LYS O O 5.172 7.251 1.440 1.00 . A A . 816 LYS O 1 1 8 5858 1 1 38 ARG C C 7.458 4.071 0.345 1.00 . A A . 817 ARG C 1 1 8 5859 1 1 38 ARG CA C 7.246 5.434 0.970 1.00 . A A . 817 ARG CA 1 1 8 5860 1 1 38 ARG CB C 8.569 5.887 1.593 1.00 . A A . 817 ARG CB 1 1 8 5861 1 1 38 ARG CD C 9.877 7.643 2.811 1.00 . A A . 817 ARG CD 1 1 8 5862 1 1 38 ARG CG C 8.515 7.242 2.274 1.00 . A A . 817 ARG CG 1 1 8 5863 1 1 38 ARG CZ C 11.127 7.015 4.847 1.00 . A A . 817 ARG CZ 1 1 8 5864 1 1 38 ARG H H 6.203 4.519 2.533 1.00 . A A . 817 ARG H 1 1 8 5865 1 1 38 ARG HA H 6.965 6.130 0.193 1.00 . A A . 817 ARG HA 1 1 8 5866 1 1 38 ARG HB2 H 8.874 5.157 2.327 1.00 . A A . 817 ARG HB2 1 1 8 5867 1 1 38 ARG HB3 H 9.319 5.930 0.816 1.00 . A A . 817 ARG HB3 1 1 8 5868 1 1 38 ARG HD2 H 10.568 7.717 1.984 1.00 . A A . 817 ARG HD2 1 1 8 5869 1 1 38 ARG HD3 H 9.789 8.609 3.291 1.00 . A A . 817 ARG HD3 1 1 8 5870 1 1 38 ARG HE H 10.203 5.728 3.621 1.00 . A A . 817 ARG HE 1 1 8 5871 1 1 38 ARG HG2 H 8.189 7.981 1.558 1.00 . A A . 817 ARG HG2 1 1 8 5872 1 1 38 ARG HG3 H 7.813 7.196 3.094 1.00 . A A . 817 ARG HG3 1 1 8 5873 1 1 38 ARG HH11 H 11.024 9.012 4.497 1.00 . A A . 817 ARG HH11 1 1 8 5874 1 1 38 ARG HH12 H 11.925 8.543 5.909 1.00 . A A . 817 ARG HH12 1 1 8 5875 1 1 38 ARG HH21 H 11.387 5.117 5.509 1.00 . A A . 817 ARG HH21 1 1 8 5876 1 1 38 ARG HH22 H 12.129 6.354 6.482 1.00 . A A . 817 ARG HH22 1 1 8 5877 1 1 38 ARG N N 6.210 5.336 1.982 1.00 . A A . 817 ARG N 1 1 8 5878 1 1 38 ARG NE N 10.399 6.676 3.782 1.00 . A A . 817 ARG NE 1 1 8 5879 1 1 38 ARG NH1 N 11.381 8.289 5.103 1.00 . A A . 817 ARG NH1 1 1 8 5880 1 1 38 ARG NH2 N 11.583 6.084 5.674 1.00 . A A . 817 ARG NH2 1 1 8 5881 1 1 38 ARG O O 7.709 3.962 -0.850 1.00 . A A . 817 ARG O 1 1 8 5882 1 1 39 PHE C C 6.421 0.818 1.237 1.00 . A A . 818 PHE C 1 1 8 5883 1 1 39 PHE CA C 7.538 1.680 0.693 1.00 . A A . 818 PHE CA 1 1 8 5884 1 1 39 PHE CB C 8.890 1.140 1.169 1.00 . A A . 818 PHE CB 1 1 8 5885 1 1 39 PHE CD1 C 10.538 1.955 -0.543 1.00 . A A . 818 PHE CD1 1 1 8 5886 1 1 39 PHE CD2 C 10.648 2.861 1.657 1.00 . A A . 818 PHE CD2 1 1 8 5887 1 1 39 PHE CE1 C 11.596 2.756 -0.930 1.00 . A A . 818 PHE CE1 1 1 8 5888 1 1 39 PHE CE2 C 11.704 3.665 1.275 1.00 . A A . 818 PHE CE2 1 1 8 5889 1 1 39 PHE CG C 10.053 1.998 0.754 1.00 . A A . 818 PHE CG 1 1 8 5890 1 1 39 PHE CZ C 12.179 3.612 -0.019 1.00 . A A . 818 PHE CZ 1 1 8 5891 1 1 39 PHE H H 7.140 3.164 2.109 1.00 . A A . 818 PHE H 1 1 8 5892 1 1 39 PHE HA H 7.520 1.679 -0.386 1.00 . A A . 818 PHE HA 1 1 8 5893 1 1 39 PHE HB2 H 8.888 1.084 2.249 1.00 . A A . 818 PHE HB2 1 1 8 5894 1 1 39 PHE HB3 H 9.041 0.151 0.763 1.00 . A A . 818 PHE HB3 1 1 8 5895 1 1 39 PHE HD1 H 10.083 1.284 -1.257 1.00 . A A . 818 PHE HD1 1 1 8 5896 1 1 39 PHE HD2 H 10.281 2.901 2.671 1.00 . A A . 818 PHE HD2 1 1 8 5897 1 1 39 PHE HE1 H 11.965 2.713 -1.944 1.00 . A A . 818 PHE HE1 1 1 8 5898 1 1 39 PHE HE2 H 12.160 4.334 1.989 1.00 . A A . 818 PHE HE2 1 1 8 5899 1 1 39 PHE HZ H 13.003 4.240 -0.319 1.00 . A A . 818 PHE HZ 1 1 8 5900 1 1 39 PHE N N 7.353 3.030 1.160 1.00 . A A . 818 PHE N 1 1 8 5901 1 1 39 PHE O O 5.778 1.184 2.220 1.00 . A A . 818 PHE O 1 1 8 5902 1 1 40 CYS C C 5.866 -1.914 2.404 1.00 . A A . 819 CYS C 1 1 8 5903 1 1 40 CYS CA C 5.257 -1.294 1.126 1.00 . A A . 819 CYS CA 1 1 8 5904 1 1 40 CYS CB C 4.873 -2.299 0.025 1.00 . A A . 819 CYS CB 1 1 8 5905 1 1 40 CYS H H 6.716 -0.545 -0.180 1.00 . A A . 819 CYS H 1 1 8 5906 1 1 40 CYS HA H 4.376 -0.773 1.473 1.00 . A A . 819 CYS HA 1 1 8 5907 1 1 40 CYS HB2 H 4.762 -3.272 0.447 1.00 . A A . 819 CYS HB2 1 1 8 5908 1 1 40 CYS HB3 H 3.932 -1.994 -0.413 1.00 . A A . 819 CYS HB3 1 1 8 5909 1 1 40 CYS N N 6.179 -0.309 0.598 1.00 . A A . 819 CYS N 1 1 8 5910 1 1 40 CYS O O 6.782 -1.335 2.976 1.00 . A A . 819 CYS O 1 1 8 5911 1 1 40 CYS SG S 6.079 -2.436 -1.321 1.00 . A A . 819 CYS SG 1 1 8 5912 1 1 41 SER C C 7.021 -3.840 4.591 1.00 . A A . 820 SER C 1 1 8 5913 1 1 41 SER CA C 5.552 -3.524 4.221 1.00 . A A . 820 SER CA 1 1 8 5914 1 1 41 SER CB C 4.637 -4.732 4.464 1.00 . A A . 820 SER CB 1 1 8 5915 1 1 41 SER H H 5.015 -3.691 2.182 1.00 . A A . 820 SER H 1 1 8 5916 1 1 41 SER HA H 5.232 -2.736 4.888 1.00 . A A . 820 SER HA 1 1 8 5917 1 1 41 SER HB2 H 3.624 -4.470 4.177 1.00 . A A . 820 SER HB2 1 1 8 5918 1 1 41 SER HB3 H 4.976 -5.565 3.866 1.00 . A A . 820 SER HB3 1 1 8 5919 1 1 41 SER HG H 4.252 -4.396 6.364 1.00 . A A . 820 SER HG 1 1 8 5920 1 1 41 SER N N 5.389 -3.078 2.833 1.00 . A A . 820 SER N 1 1 8 5921 1 1 41 SER O O 7.876 -2.959 4.573 1.00 . A A . 820 SER O 1 1 8 5922 1 1 41 SER OG O 4.631 -5.117 5.829 1.00 . A A . 820 SER OG 1 1 8 5923 1 1 42 MET C C 9.730 -5.542 4.529 1.00 . A A . 821 MET C 1 1 8 5924 1 1 42 MET CA C 8.631 -5.354 5.552 1.00 . A A . 821 MET CA 1 1 8 5925 1 1 42 MET CB C 8.538 -6.576 6.462 1.00 . A A . 821 MET CB 1 1 8 5926 1 1 42 MET CE C 9.438 -4.199 8.571 1.00 . A A . 821 MET CE 1 1 8 5927 1 1 42 MET CG C 7.784 -6.304 7.754 1.00 . A A . 821 MET CG 1 1 8 5928 1 1 42 MET H H 6.708 -5.815 4.761 1.00 . A A . 821 MET H 1 1 8 5929 1 1 42 MET HA H 8.876 -4.499 6.164 1.00 . A A . 821 MET HA 1 1 8 5930 1 1 42 MET HB2 H 8.029 -7.366 5.931 1.00 . A A . 821 MET HB2 1 1 8 5931 1 1 42 MET HB3 H 9.535 -6.903 6.712 1.00 . A A . 821 MET HB3 1 1 8 5932 1 1 42 MET HE1 H 8.594 -3.566 8.338 1.00 . A A . 821 MET HE1 1 1 8 5933 1 1 42 MET HE2 H 10.051 -4.323 7.690 1.00 . A A . 821 MET HE2 1 1 8 5934 1 1 42 MET HE3 H 10.025 -3.742 9.354 1.00 . A A . 821 MET HE3 1 1 8 5935 1 1 42 MET HG2 H 7.078 -5.511 7.569 1.00 . A A . 821 MET HG2 1 1 8 5936 1 1 42 MET HG3 H 7.251 -7.200 8.041 1.00 . A A . 821 MET HG3 1 1 8 5937 1 1 42 MET N N 7.340 -5.080 4.926 1.00 . A A . 821 MET N 1 1 8 5938 1 1 42 MET O O 10.687 -4.777 4.507 1.00 . A A . 821 MET O 1 1 8 5939 1 1 42 MET SD S 8.854 -5.800 9.126 1.00 . A A . 821 MET SD 1 1 8 5940 1 1 43 THR C C 11.032 -5.637 1.894 1.00 . A A . 822 THR C 1 1 8 5941 1 1 43 THR CA C 10.558 -6.874 2.662 1.00 . A A . 822 THR CA 1 1 8 5942 1 1 43 THR CB C 9.955 -7.884 1.668 1.00 . A A . 822 THR CB 1 1 8 5943 1 1 43 THR CG2 C 11.029 -8.466 0.756 1.00 . A A . 822 THR CG2 1 1 8 5944 1 1 43 THR H H 8.796 -7.130 3.790 1.00 . A A . 822 THR H 1 1 8 5945 1 1 43 THR HA H 11.419 -7.336 3.125 1.00 . A A . 822 THR HA 1 1 8 5946 1 1 43 THR HB H 9.223 -7.374 1.059 1.00 . A A . 822 THR HB 1 1 8 5947 1 1 43 THR HG1 H 8.899 -9.551 1.768 1.00 . A A . 822 THR HG1 1 1 8 5948 1 1 43 THR HG21 H 11.487 -7.671 0.186 1.00 . A A . 822 THR HG21 1 1 8 5949 1 1 43 THR HG22 H 10.581 -9.180 0.083 1.00 . A A . 822 THR HG22 1 1 8 5950 1 1 43 THR HG23 H 11.782 -8.958 1.355 1.00 . A A . 822 THR HG23 1 1 8 5951 1 1 43 THR N N 9.578 -6.550 3.690 1.00 . A A . 822 THR N 1 1 8 5952 1 1 43 THR O O 12.230 -5.432 1.725 1.00 . A A . 822 THR O 1 1 8 5953 1 1 43 THR OG1 O 9.308 -8.941 2.392 1.00 . A A . 822 THR OG1 1 1 8 5954 1 1 44 CYS C C 11.075 -2.509 1.397 1.00 . A A . 823 CYS C 1 1 8 5955 1 1 44 CYS CA C 10.453 -3.668 0.614 1.00 . A A . 823 CYS CA 1 1 8 5956 1 1 44 CYS CB C 9.256 -3.220 -0.191 1.00 . A A . 823 CYS CB 1 1 8 5957 1 1 44 CYS H H 9.159 -4.996 1.634 1.00 . A A . 823 CYS H 1 1 8 5958 1 1 44 CYS HA H 11.205 -4.019 -0.077 1.00 . A A . 823 CYS HA 1 1 8 5959 1 1 44 CYS HB2 H 8.413 -3.075 0.469 1.00 . A A . 823 CYS HB2 1 1 8 5960 1 1 44 CYS HB3 H 9.489 -2.292 -0.691 1.00 . A A . 823 CYS HB3 1 1 8 5961 1 1 44 CYS N N 10.101 -4.820 1.431 1.00 . A A . 823 CYS N 1 1 8 5962 1 1 44 CYS O O 12.053 -1.928 0.931 1.00 . A A . 823 CYS O 1 1 8 5963 1 1 44 CYS SG S 8.785 -4.431 -1.450 1.00 . A A . 823 CYS SG 1 1 8 5964 1 1 45 ALA C C 12.547 -1.616 3.812 1.00 . A A . 824 ALA C 1 1 8 5965 1 1 45 ALA CA C 11.159 -1.136 3.392 1.00 . A A . 824 ALA CA 1 1 8 5966 1 1 45 ALA CB C 10.301 -0.827 4.608 1.00 . A A . 824 ALA CB 1 1 8 5967 1 1 45 ALA H H 9.682 -2.551 2.860 1.00 . A A . 824 ALA H 1 1 8 5968 1 1 45 ALA HA H 11.265 -0.234 2.807 1.00 . A A . 824 ALA HA 1 1 8 5969 1 1 45 ALA HB1 H 10.756 -0.030 5.178 1.00 . A A . 824 ALA HB1 1 1 8 5970 1 1 45 ALA HB2 H 10.216 -1.710 5.226 1.00 . A A . 824 ALA HB2 1 1 8 5971 1 1 45 ALA HB3 H 9.317 -0.520 4.283 1.00 . A A . 824 ALA HB3 1 1 8 5972 1 1 45 ALA N N 10.519 -2.143 2.552 1.00 . A A . 824 ALA N 1 1 8 5973 1 1 45 ALA O O 13.487 -0.830 3.923 1.00 . A A . 824 ALA O 1 1 8 5974 1 1 46 LYS C C 14.866 -3.446 3.080 1.00 . A A . 825 LYS C 1 1 8 5975 1 1 46 LYS CA C 13.943 -3.559 4.301 1.00 . A A . 825 LYS CA 1 1 8 5976 1 1 46 LYS CB C 13.684 -5.031 4.638 1.00 . A A . 825 LYS CB 1 1 8 5977 1 1 46 LYS CD C 14.463 -7.403 4.591 1.00 . A A . 825 LYS CD 1 1 8 5978 1 1 46 LYS CE C 15.608 -8.347 4.258 1.00 . A A . 825 LYS CE 1 1 8 5979 1 1 46 LYS CG C 14.872 -5.950 4.436 1.00 . A A . 825 LYS CG 1 1 8 5980 1 1 46 LYS H H 11.842 -3.466 4.135 1.00 . A A . 825 LYS H 1 1 8 5981 1 1 46 LYS HA H 14.373 -3.074 5.163 1.00 . A A . 825 LYS HA 1 1 8 5982 1 1 46 LYS HB2 H 13.383 -5.101 5.672 1.00 . A A . 825 LYS HB2 1 1 8 5983 1 1 46 LYS HB3 H 12.874 -5.388 4.016 1.00 . A A . 825 LYS HB3 1 1 8 5984 1 1 46 LYS HD2 H 14.156 -7.573 5.611 1.00 . A A . 825 LYS HD2 1 1 8 5985 1 1 46 LYS HD3 H 13.635 -7.605 3.926 1.00 . A A . 825 LYS HD3 1 1 8 5986 1 1 46 LYS HE2 H 15.950 -8.139 3.255 1.00 . A A . 825 LYS HE2 1 1 8 5987 1 1 46 LYS HE3 H 16.416 -8.173 4.955 1.00 . A A . 825 LYS HE3 1 1 8 5988 1 1 46 LYS HG2 H 15.263 -5.801 3.441 1.00 . A A . 825 LYS HG2 1 1 8 5989 1 1 46 LYS HG3 H 15.628 -5.714 5.168 1.00 . A A . 825 LYS HG3 1 1 8 5990 1 1 46 LYS HZ1 H 14.422 -9.966 3.665 1.00 . A A . 825 LYS HZ1 1 1 8 5991 1 1 46 LYS HZ2 H 14.854 -9.997 5.302 1.00 . A A . 825 LYS HZ2 1 1 8 5992 1 1 46 LYS HZ3 H 16.000 -10.394 4.119 1.00 . A A . 825 LYS HZ3 1 1 8 5993 1 1 46 LYS N N 12.659 -2.917 4.053 1.00 . A A . 825 LYS N 1 1 8 5994 1 1 46 LYS NZ N 15.194 -9.772 4.341 1.00 . A A . 825 LYS NZ 1 1 8 5995 1 1 46 LYS O O 16.069 -3.208 3.206 1.00 . A A . 825 LYS O 1 1 8 5996 1 1 47 ARG C C 15.561 -2.231 0.309 1.00 . A A . 826 ARG C 1 1 8 5997 1 1 47 ARG CA C 14.987 -3.607 0.629 1.00 . A A . 826 ARG CA 1 1 8 5998 1 1 47 ARG CB C 14.032 -4.034 -0.488 1.00 . A A . 826 ARG CB 1 1 8 5999 1 1 47 ARG CD C 13.771 -4.871 -2.844 1.00 . A A . 826 ARG CD 1 1 8 6000 1 1 47 ARG CG C 14.725 -4.292 -1.812 1.00 . A A . 826 ARG CG 1 1 8 6001 1 1 47 ARG CZ C 13.779 -5.315 -5.279 1.00 . A A . 826 ARG CZ 1 1 8 6002 1 1 47 ARG H H 13.294 -3.719 1.887 1.00 . A A . 826 ARG H 1 1 8 6003 1 1 47 ARG HA H 15.783 -4.337 0.681 1.00 . A A . 826 ARG HA 1 1 8 6004 1 1 47 ARG HB2 H 13.527 -4.939 -0.188 1.00 . A A . 826 ARG HB2 1 1 8 6005 1 1 47 ARG HB3 H 13.299 -3.255 -0.636 1.00 . A A . 826 ARG HB3 1 1 8 6006 1 1 47 ARG HD2 H 13.427 -5.835 -2.498 1.00 . A A . 826 ARG HD2 1 1 8 6007 1 1 47 ARG HD3 H 12.929 -4.205 -2.956 1.00 . A A . 826 ARG HD3 1 1 8 6008 1 1 47 ARG HE H 15.407 -4.918 -4.168 1.00 . A A . 826 ARG HE 1 1 8 6009 1 1 47 ARG HG2 H 15.121 -3.359 -2.187 1.00 . A A . 826 ARG HG2 1 1 8 6010 1 1 47 ARG HG3 H 15.534 -4.989 -1.653 1.00 . A A . 826 ARG HG3 1 1 8 6011 1 1 47 ARG HH11 H 11.951 -5.523 -4.415 1.00 . A A . 826 ARG HH11 1 1 8 6012 1 1 47 ARG HH12 H 11.987 -5.739 -6.142 1.00 . A A . 826 ARG HH12 1 1 8 6013 1 1 47 ARG HH21 H 15.451 -5.214 -6.425 1.00 . A A . 826 ARG HH21 1 1 8 6014 1 1 47 ARG HH22 H 13.981 -5.594 -7.280 1.00 . A A . 826 ARG HH22 1 1 8 6015 1 1 47 ARG N N 14.267 -3.594 1.900 1.00 . A A . 826 ARG N 1 1 8 6016 1 1 47 ARG NE N 14.421 -5.040 -4.142 1.00 . A A . 826 ARG NE 1 1 8 6017 1 1 47 ARG NH1 N 12.471 -5.546 -5.277 1.00 . A A . 826 ARG NH1 1 1 8 6018 1 1 47 ARG NH2 N 14.455 -5.379 -6.416 1.00 . A A . 826 ARG NH2 1 1 8 6019 1 1 47 ARG O O 16.528 -2.101 -0.442 1.00 . A A . 826 ARG O 1 1 8 6020 1 1 48 TYR C C 16.852 0.298 1.290 1.00 . A A . 827 TYR C 1 1 8 6021 1 1 48 TYR CA C 15.419 0.165 0.773 1.00 . A A . 827 TYR CA 1 1 8 6022 1 1 48 TYR CB C 14.481 1.070 1.588 1.00 . A A . 827 TYR CB 1 1 8 6023 1 1 48 TYR CD1 C 15.418 3.340 0.953 1.00 . A A . 827 TYR CD1 1 1 8 6024 1 1 48 TYR CD2 C 15.223 2.803 3.267 1.00 . A A . 827 TYR CD2 1 1 8 6025 1 1 48 TYR CE1 C 15.936 4.578 1.281 1.00 . A A . 827 TYR CE1 1 1 8 6026 1 1 48 TYR CE2 C 15.738 4.041 3.601 1.00 . A A . 827 TYR CE2 1 1 8 6027 1 1 48 TYR CG C 15.055 2.431 1.939 1.00 . A A . 827 TYR CG 1 1 8 6028 1 1 48 TYR CZ C 16.094 4.925 2.606 1.00 . A A . 827 TYR CZ 1 1 8 6029 1 1 48 TYR H H 14.088 -1.371 1.343 1.00 . A A . 827 TYR H 1 1 8 6030 1 1 48 TYR HA H 15.337 0.470 -0.260 1.00 . A A . 827 TYR HA 1 1 8 6031 1 1 48 TYR HB2 H 13.578 1.235 1.013 1.00 . A A . 827 TYR HB2 1 1 8 6032 1 1 48 TYR HB3 H 14.225 0.569 2.509 1.00 . A A . 827 TYR HB3 1 1 8 6033 1 1 48 TYR HD1 H 15.295 3.065 -0.083 1.00 . A A . 827 TYR HD1 1 1 8 6034 1 1 48 TYR HD2 H 14.944 2.109 4.046 1.00 . A A . 827 TYR HD2 1 1 8 6035 1 1 48 TYR HE1 H 16.211 5.271 0.501 1.00 . A A . 827 TYR HE1 1 1 8 6036 1 1 48 TYR HE2 H 15.863 4.310 4.640 1.00 . A A . 827 TYR HE2 1 1 8 6037 1 1 48 TYR HH H 16.266 6.829 2.333 1.00 . A A . 827 TYR HH 1 1 8 6038 1 1 48 TYR N N 14.941 -1.208 0.885 1.00 . A A . 827 TYR N 1 1 8 6039 1 1 48 TYR O O 17.620 1.139 0.817 1.00 . A A . 827 TYR O 1 1 8 6040 1 1 48 TYR OH O 16.612 6.157 2.940 1.00 . A A . 827 TYR OH 1 1 8 6041 1 1 49 ASN C C 18.509 0.587 3.941 1.00 . A A . 828 ASN C 1 1 8 6042 1 1 49 ASN CA C 18.480 -0.559 2.942 1.00 . A A . 828 ASN CA 1 1 8 6043 1 1 49 ASN CB C 19.675 -0.440 1.982 1.00 . A A . 828 ASN CB 1 1 8 6044 1 1 49 ASN CG C 19.741 -1.541 0.938 1.00 . A A . 828 ASN CG 1 1 8 6045 1 1 49 ASN H H 16.542 -1.269 2.487 1.00 . A A . 828 ASN H 1 1 8 6046 1 1 49 ASN HA H 18.563 -1.486 3.490 1.00 . A A . 828 ASN HA 1 1 8 6047 1 1 49 ASN HB2 H 19.613 0.507 1.466 1.00 . A A . 828 ASN HB2 1 1 8 6048 1 1 49 ASN HB3 H 20.586 -0.465 2.560 1.00 . A A . 828 ASN HB3 1 1 8 6049 1 1 49 ASN HD21 H 18.953 -2.866 2.195 1.00 . A A . 828 ASN HD21 1 1 8 6050 1 1 49 ASN HD22 H 19.328 -3.455 0.609 1.00 . A A . 828 ASN HD22 1 1 8 6051 1 1 49 ASN N N 17.193 -0.577 2.242 1.00 . A A . 828 ASN N 1 1 8 6052 1 1 49 ASN ND2 N 19.299 -2.739 1.283 1.00 . A A . 828 ASN ND2 1 1 8 6053 1 1 49 ASN O O 17.988 0.411 5.062 1.00 . A A . 828 ASN O 1 1 8 6054 1 1 49 ASN OXT O 19.036 1.663 3.603 1.00 . A A . 828 ASN OXT 1 1 8 6055 1 1 49 ASN OD1 O 20.208 -1.314 -0.178 1.00 . A A . 828 ASN OD1 1 1 8 6056 2 2 1 ZN ZN ZN 7.989 -2.720 -2.550 1.00 . B A . 829 ZN ZN 1 1 9 6057 1 1 1 GLY C C -23.042 9.586 8.912 1.00 . A A . 1 GLY C 1 1 9 6058 1 1 1 GLY CA C -24.055 10.685 9.155 1.00 . A A . 1 GLY CA 1 1 9 6059 1 1 1 GLY H1 H -23.420 11.822 7.526 1.00 . A A . 1 GLY H1 1 1 9 6060 1 1 1 GLY H2 H -24.906 12.316 8.173 1.00 . A A . 1 GLY H2 1 1 9 6061 1 1 1 GLY H3 H -24.820 10.913 7.228 1.00 . A A . 1 GLY H3 1 1 9 6062 1 1 1 GLY HA2 H -23.681 11.338 9.929 1.00 . A A . 1 GLY HA2 1 1 9 6063 1 1 1 GLY HA3 H -24.981 10.240 9.489 1.00 . A A . 1 GLY HA3 1 1 9 6064 1 1 1 GLY N N -24.320 11.488 7.937 1.00 . A A . 1 GLY N 1 1 9 6065 1 1 1 GLY O O -22.271 9.238 9.804 1.00 . A A . 1 GLY O 1 1 9 6066 1 1 2 THR C C -21.671 8.150 5.893 1.00 . A A . 2 THR C 1 1 9 6067 1 1 2 THR CA C -22.091 7.991 7.353 1.00 . A A . 2 THR CA 1 1 9 6068 1 1 2 THR CB C -22.699 6.589 7.593 1.00 . A A . 2 THR CB 1 1 9 6069 1 1 2 THR CG2 C -23.799 6.283 6.584 1.00 . A A . 2 THR CG2 1 1 9 6070 1 1 2 THR H H -23.691 9.335 7.034 1.00 . A A . 2 THR H 1 1 9 6071 1 1 2 THR HA H -21.219 8.101 7.983 1.00 . A A . 2 THR HA 1 1 9 6072 1 1 2 THR HB H -23.130 6.572 8.584 1.00 . A A . 2 THR HB 1 1 9 6073 1 1 2 THR HG1 H -21.513 5.232 8.407 1.00 . A A . 2 THR HG1 1 1 9 6074 1 1 2 THR HG21 H -24.569 7.039 6.649 1.00 . A A . 2 THR HG21 1 1 9 6075 1 1 2 THR HG22 H -24.226 5.317 6.801 1.00 . A A . 2 THR HG22 1 1 9 6076 1 1 2 THR HG23 H -23.381 6.278 5.588 1.00 . A A . 2 THR HG23 1 1 9 6077 1 1 2 THR N N -23.038 9.035 7.707 1.00 . A A . 2 THR N 1 1 9 6078 1 1 2 THR O O -22.103 9.091 5.220 1.00 . A A . 2 THR O 1 1 9 6079 1 1 2 THR OG1 O -21.679 5.583 7.515 1.00 . A A . 2 THR OG1 1 1 9 6080 1 1 3 ARG C C -20.452 5.931 3.393 1.00 . A A . 3 ARG C 1 1 9 6081 1 1 3 ARG CA C -20.350 7.304 4.035 1.00 . A A . 3 ARG CA 1 1 9 6082 1 1 3 ARG CB C -18.891 7.751 3.960 1.00 . A A . 3 ARG CB 1 1 9 6083 1 1 3 ARG CD C -17.105 9.384 4.517 1.00 . A A . 3 ARG CD 1 1 9 6084 1 1 3 ARG CG C -18.558 9.015 4.732 1.00 . A A . 3 ARG CG 1 1 9 6085 1 1 3 ARG CZ C -15.382 10.314 5.990 1.00 . A A . 3 ARG CZ 1 1 9 6086 1 1 3 ARG H H -20.510 6.525 5.994 1.00 . A A . 3 ARG H 1 1 9 6087 1 1 3 ARG HA H -20.967 8.001 3.487 1.00 . A A . 3 ARG HA 1 1 9 6088 1 1 3 ARG HB2 H -18.274 6.955 4.345 1.00 . A A . 3 ARG HB2 1 1 9 6089 1 1 3 ARG HB3 H -18.637 7.915 2.923 1.00 . A A . 3 ARG HB3 1 1 9 6090 1 1 3 ARG HD2 H -16.507 8.488 4.584 1.00 . A A . 3 ARG HD2 1 1 9 6091 1 1 3 ARG HD3 H -16.999 9.808 3.530 1.00 . A A . 3 ARG HD3 1 1 9 6092 1 1 3 ARG HE H -17.230 11.057 5.785 1.00 . A A . 3 ARG HE 1 1 9 6093 1 1 3 ARG HG2 H -19.186 9.822 4.381 1.00 . A A . 3 ARG HG2 1 1 9 6094 1 1 3 ARG HG3 H -18.730 8.847 5.783 1.00 . A A . 3 ARG HG3 1 1 9 6095 1 1 3 ARG HH11 H -14.820 8.653 4.951 1.00 . A A . 3 ARG HH11 1 1 9 6096 1 1 3 ARG HH12 H -13.603 9.344 5.990 1.00 . A A . 3 ARG HH12 1 1 9 6097 1 1 3 ARG HH21 H -15.631 11.954 7.151 1.00 . A A . 3 ARG HH21 1 1 9 6098 1 1 3 ARG HH22 H -14.063 11.213 7.239 1.00 . A A . 3 ARG HH22 1 1 9 6099 1 1 3 ARG N N -20.819 7.254 5.412 1.00 . A A . 3 ARG N 1 1 9 6100 1 1 3 ARG NE N -16.613 10.346 5.493 1.00 . A A . 3 ARG NE 1 1 9 6101 1 1 3 ARG NH1 N -14.534 9.363 5.615 1.00 . A A . 3 ARG NH1 1 1 9 6102 1 1 3 ARG NH2 N -14.995 11.234 6.863 1.00 . A A . 3 ARG NH2 1 1 9 6103 1 1 3 ARG O O -20.357 4.909 4.078 1.00 . A A . 3 ARG O 1 1 9 6104 1 1 4 GLY C C -21.869 3.882 1.405 1.00 . A A . 783 GLY C 1 1 9 6105 1 1 4 GLY CA C -20.587 4.683 1.333 1.00 . A A . 783 GLY CA 1 1 9 6106 1 1 4 GLY H H -20.835 6.762 1.619 1.00 . A A . 783 GLY H 1 1 9 6107 1 1 4 GLY HA2 H -20.381 4.915 0.297 1.00 . A A . 783 GLY HA2 1 1 9 6108 1 1 4 GLY HA3 H -19.779 4.080 1.720 1.00 . A A . 783 GLY HA3 1 1 9 6109 1 1 4 GLY N N -20.641 5.919 2.083 1.00 . A A . 783 GLY N 1 1 9 6110 1 1 4 GLY O O -22.709 4.097 2.281 1.00 . A A . 783 GLY O 1 1 9 6111 1 1 5 VAL C C -22.783 0.761 1.158 1.00 . A A . 784 VAL C 1 1 9 6112 1 1 5 VAL CA C -23.164 2.059 0.462 1.00 . A A . 784 VAL CA 1 1 9 6113 1 1 5 VAL CB C -23.637 1.759 -0.977 1.00 . A A . 784 VAL CB 1 1 9 6114 1 1 5 VAL CG1 C -24.837 0.826 -0.975 1.00 . A A . 784 VAL CG1 1 1 9 6115 1 1 5 VAL CG2 C -23.967 3.052 -1.707 1.00 . A A . 784 VAL CG2 1 1 9 6116 1 1 5 VAL H H -21.342 2.874 -0.234 1.00 . A A . 784 VAL H 1 1 9 6117 1 1 5 VAL HA H -23.972 2.531 1.003 1.00 . A A . 784 VAL HA 1 1 9 6118 1 1 5 VAL HB H -22.832 1.269 -1.505 1.00 . A A . 784 VAL HB 1 1 9 6119 1 1 5 VAL HG11 H -25.643 1.278 -0.416 1.00 . A A . 784 VAL HG11 1 1 9 6120 1 1 5 VAL HG12 H -24.561 -0.111 -0.512 1.00 . A A . 784 VAL HG12 1 1 9 6121 1 1 5 VAL HG13 H -25.154 0.647 -1.991 1.00 . A A . 784 VAL HG13 1 1 9 6122 1 1 5 VAL HG21 H -23.095 3.685 -1.725 1.00 . A A . 784 VAL HG21 1 1 9 6123 1 1 5 VAL HG22 H -24.772 3.559 -1.195 1.00 . A A . 784 VAL HG22 1 1 9 6124 1 1 5 VAL HG23 H -24.272 2.825 -2.718 1.00 . A A . 784 VAL HG23 1 1 9 6125 1 1 5 VAL N N -22.022 2.959 0.469 1.00 . A A . 784 VAL N 1 1 9 6126 1 1 5 VAL O O -23.551 0.201 1.939 1.00 . A A . 784 VAL O 1 1 9 6127 1 1 6 ASP C C -19.664 -0.525 2.117 1.00 . A A . 785 ASP C 1 1 9 6128 1 1 6 ASP CA C -21.019 -0.872 1.514 1.00 . A A . 785 ASP CA 1 1 9 6129 1 1 6 ASP CB C -20.881 -2.023 0.513 1.00 . A A . 785 ASP CB 1 1 9 6130 1 1 6 ASP CG C -20.281 -3.266 1.136 1.00 . A A . 785 ASP CG 1 1 9 6131 1 1 6 ASP H H -21.042 0.766 0.183 1.00 . A A . 785 ASP H 1 1 9 6132 1 1 6 ASP HA H -21.690 -1.169 2.307 1.00 . A A . 785 ASP HA 1 1 9 6133 1 1 6 ASP HB2 H -21.858 -2.274 0.124 1.00 . A A . 785 ASP HB2 1 1 9 6134 1 1 6 ASP HB3 H -20.245 -1.707 -0.301 1.00 . A A . 785 ASP HB3 1 1 9 6135 1 1 6 ASP N N -21.578 0.301 0.867 1.00 . A A . 785 ASP N 1 1 9 6136 1 1 6 ASP O O -18.617 -0.776 1.520 1.00 . A A . 785 ASP O 1 1 9 6137 1 1 6 ASP OD1 O -20.882 -3.809 2.087 1.00 . A A . 785 ASP OD1 1 1 9 6138 1 1 6 ASP OD2 O -19.200 -3.701 0.684 1.00 . A A . 785 ASP OD2 1 1 9 6139 1 1 7 SER C C -18.547 0.146 5.449 1.00 . A A . 786 SER C 1 1 9 6140 1 1 7 SER CA C -18.465 0.487 3.961 1.00 . A A . 786 SER CA 1 1 9 6141 1 1 7 SER CB C -18.224 1.987 3.765 1.00 . A A . 786 SER CB 1 1 9 6142 1 1 7 SER H H -20.551 0.305 3.698 1.00 . A A . 786 SER H 1 1 9 6143 1 1 7 SER HA H -17.650 -0.063 3.517 1.00 . A A . 786 SER HA 1 1 9 6144 1 1 7 SER HB2 H -19.033 2.541 4.217 1.00 . A A . 786 SER HB2 1 1 9 6145 1 1 7 SER HB3 H -17.290 2.264 4.232 1.00 . A A . 786 SER HB3 1 1 9 6146 1 1 7 SER HG H -18.462 1.555 1.870 1.00 . A A . 786 SER HG 1 1 9 6147 1 1 7 SER N N -19.688 0.097 3.282 1.00 . A A . 786 SER N 1 1 9 6148 1 1 7 SER O O -19.461 0.587 6.147 1.00 . A A . 786 SER O 1 1 9 6149 1 1 7 SER OG O -18.161 2.311 2.385 1.00 . A A . 786 SER OG 1 1 9 6150 1 1 8 PRO C C -17.156 0.123 8.239 1.00 . A A . 787 PRO C 1 1 9 6151 1 1 8 PRO CA C -17.519 -1.063 7.351 1.00 . A A . 787 PRO CA 1 1 9 6152 1 1 8 PRO CB C -16.404 -2.123 7.385 1.00 . A A . 787 PRO CB 1 1 9 6153 1 1 8 PRO CD C -16.556 -1.332 5.137 1.00 . A A . 787 PRO CD 1 1 9 6154 1 1 8 PRO CG C -16.216 -2.540 5.963 1.00 . A A . 787 PRO CG 1 1 9 6155 1 1 8 PRO HA H -18.443 -1.497 7.698 1.00 . A A . 787 PRO HA 1 1 9 6156 1 1 8 PRO HB2 H -15.502 -1.685 7.790 1.00 . A A . 787 PRO HB2 1 1 9 6157 1 1 8 PRO HB3 H -16.712 -2.954 8.000 1.00 . A A . 787 PRO HB3 1 1 9 6158 1 1 8 PRO HD2 H -15.696 -0.687 5.033 1.00 . A A . 787 PRO HD2 1 1 9 6159 1 1 8 PRO HD3 H -16.933 -1.622 4.168 1.00 . A A . 787 PRO HD3 1 1 9 6160 1 1 8 PRO HG2 H -15.188 -2.833 5.798 1.00 . A A . 787 PRO HG2 1 1 9 6161 1 1 8 PRO HG3 H -16.884 -3.357 5.727 1.00 . A A . 787 PRO HG3 1 1 9 6162 1 1 8 PRO N N -17.603 -0.683 5.935 1.00 . A A . 787 PRO N 1 1 9 6163 1 1 8 PRO O O -17.799 0.376 9.259 1.00 . A A . 787 PRO O 1 1 9 6164 1 1 9 SER C C -16.336 3.267 7.915 1.00 . A A . 788 SER C 1 1 9 6165 1 1 9 SER CA C -15.716 2.039 8.562 1.00 . A A . 788 SER CA 1 1 9 6166 1 1 9 SER CB C -14.188 2.155 8.575 1.00 . A A . 788 SER CB 1 1 9 6167 1 1 9 SER H H -15.612 0.569 7.053 1.00 . A A . 788 SER H 1 1 9 6168 1 1 9 SER HA H -16.073 1.960 9.579 1.00 . A A . 788 SER HA 1 1 9 6169 1 1 9 SER HB2 H -13.777 1.358 9.175 1.00 . A A . 788 SER HB2 1 1 9 6170 1 1 9 SER HB3 H -13.818 2.070 7.565 1.00 . A A . 788 SER HB3 1 1 9 6171 1 1 9 SER HG H -13.227 3.242 9.908 1.00 . A A . 788 SER HG 1 1 9 6172 1 1 9 SER N N -16.120 0.844 7.849 1.00 . A A . 788 SER N 1 1 9 6173 1 1 9 SER O O -16.392 3.374 6.690 1.00 . A A . 788 SER O 1 1 9 6174 1 1 9 SER OG O -13.766 3.399 9.114 1.00 . A A . 788 SER OG 1 1 9 6175 1 1 10 ALA C C -16.328 6.421 7.886 1.00 . A A . 789 ALA C 1 1 9 6176 1 1 10 ALA CA C -17.409 5.418 8.272 1.00 . A A . 789 ALA CA 1 1 9 6177 1 1 10 ALA CB C -18.324 6.007 9.332 1.00 . A A . 789 ALA CB 1 1 9 6178 1 1 10 ALA H H -16.796 3.999 9.717 1.00 . A A . 789 ALA H 1 1 9 6179 1 1 10 ALA HA H -18.005 5.194 7.400 1.00 . A A . 789 ALA HA 1 1 9 6180 1 1 10 ALA HB1 H -17.744 6.273 10.204 1.00 . A A . 789 ALA HB1 1 1 9 6181 1 1 10 ALA HB2 H -19.072 5.278 9.607 1.00 . A A . 789 ALA HB2 1 1 9 6182 1 1 10 ALA HB3 H -18.808 6.889 8.940 1.00 . A A . 789 ALA HB3 1 1 9 6183 1 1 10 ALA N N -16.823 4.176 8.749 1.00 . A A . 789 ALA N 1 1 9 6184 1 1 10 ALA O O -16.616 7.462 7.296 1.00 . A A . 789 ALA O 1 1 9 6185 1 1 11 GLU C C -13.172 6.295 6.740 1.00 . A A . 790 GLU C 1 1 9 6186 1 1 11 GLU CA C -13.954 6.946 7.865 1.00 . A A . 790 GLU CA 1 1 9 6187 1 1 11 GLU CB C -13.035 7.188 9.054 1.00 . A A . 790 GLU CB 1 1 9 6188 1 1 11 GLU CD C -12.712 8.350 11.271 1.00 . A A . 790 GLU CD 1 1 9 6189 1 1 11 GLU CG C -13.669 8.032 10.145 1.00 . A A . 790 GLU CG 1 1 9 6190 1 1 11 GLU H H -14.934 5.304 8.777 1.00 . A A . 790 GLU H 1 1 9 6191 1 1 11 GLU HA H -14.339 7.892 7.517 1.00 . A A . 790 GLU HA 1 1 9 6192 1 1 11 GLU HB2 H -12.759 6.233 9.478 1.00 . A A . 790 GLU HB2 1 1 9 6193 1 1 11 GLU HB3 H -12.142 7.686 8.704 1.00 . A A . 790 GLU HB3 1 1 9 6194 1 1 11 GLU HG2 H -14.009 8.961 9.710 1.00 . A A . 790 GLU HG2 1 1 9 6195 1 1 11 GLU HG3 H -14.515 7.496 10.550 1.00 . A A . 790 GLU HG3 1 1 9 6196 1 1 11 GLU N N -15.088 6.114 8.244 1.00 . A A . 790 GLU N 1 1 9 6197 1 1 11 GLU O O -12.720 6.963 5.809 1.00 . A A . 790 GLU O 1 1 9 6198 1 1 11 GLU OE1 O -12.517 7.488 12.153 1.00 . A A . 790 GLU OE1 1 1 9 6199 1 1 11 GLU OE2 O -12.138 9.458 11.278 1.00 . A A . 790 GLU OE2 1 1 9 6200 1 1 12 LEU C C -13.371 3.692 4.819 1.00 . A A . 791 LEU C 1 1 9 6201 1 1 12 LEU CA C -12.335 4.240 5.797 1.00 . A A . 791 LEU CA 1 1 9 6202 1 1 12 LEU CB C -11.506 3.089 6.385 1.00 . A A . 791 LEU CB 1 1 9 6203 1 1 12 LEU CD1 C -9.311 4.309 6.192 1.00 . A A . 791 LEU CD1 1 1 9 6204 1 1 12 LEU CD2 C -10.495 4.229 8.403 1.00 . A A . 791 LEU CD2 1 1 9 6205 1 1 12 LEU CG C -10.208 3.482 7.106 1.00 . A A . 791 LEU CG 1 1 9 6206 1 1 12 LEU H H -13.332 4.517 7.634 1.00 . A A . 791 LEU H 1 1 9 6207 1 1 12 LEU HA H -11.680 4.922 5.278 1.00 . A A . 791 LEU HA 1 1 9 6208 1 1 12 LEU HB2 H -12.128 2.553 7.087 1.00 . A A . 791 LEU HB2 1 1 9 6209 1 1 12 LEU HB3 H -11.249 2.417 5.578 1.00 . A A . 791 LEU HB3 1 1 9 6210 1 1 12 LEU HD11 H -9.810 5.231 5.935 1.00 . A A . 791 LEU HD11 1 1 9 6211 1 1 12 LEU HD12 H -9.102 3.751 5.292 1.00 . A A . 791 LEU HD12 1 1 9 6212 1 1 12 LEU HD13 H -8.386 4.531 6.701 1.00 . A A . 791 LEU HD13 1 1 9 6213 1 1 12 LEU HD21 H -9.563 4.494 8.877 1.00 . A A . 791 LEU HD21 1 1 9 6214 1 1 12 LEU HD22 H -11.066 3.593 9.067 1.00 . A A . 791 LEU HD22 1 1 9 6215 1 1 12 LEU HD23 H -11.058 5.124 8.188 1.00 . A A . 791 LEU HD23 1 1 9 6216 1 1 12 LEU HG H -9.671 2.581 7.359 1.00 . A A . 791 LEU HG 1 1 9 6217 1 1 12 LEU N N -13.003 4.990 6.837 1.00 . A A . 791 LEU N 1 1 9 6218 1 1 12 LEU O O -13.473 2.479 4.617 1.00 . A A . 791 LEU O 1 1 9 6219 1 1 13 ASP C C -14.726 3.759 1.975 1.00 . A A . 792 ASP C 1 1 9 6220 1 1 13 ASP CA C -15.239 4.231 3.335 1.00 . A A . 792 ASP CA 1 1 9 6221 1 1 13 ASP CB C -16.208 5.414 3.173 1.00 . A A . 792 ASP CB 1 1 9 6222 1 1 13 ASP CG C -15.510 6.721 2.834 1.00 . A A . 792 ASP CG 1 1 9 6223 1 1 13 ASP H H -13.985 5.549 4.415 1.00 . A A . 792 ASP H 1 1 9 6224 1 1 13 ASP HA H -15.772 3.414 3.796 1.00 . A A . 792 ASP HA 1 1 9 6225 1 1 13 ASP HB2 H -16.904 5.189 2.380 1.00 . A A . 792 ASP HB2 1 1 9 6226 1 1 13 ASP HB3 H -16.755 5.550 4.095 1.00 . A A . 792 ASP HB3 1 1 9 6227 1 1 13 ASP N N -14.146 4.597 4.233 1.00 . A A . 792 ASP N 1 1 9 6228 1 1 13 ASP O O -14.820 4.479 0.978 1.00 . A A . 792 ASP O 1 1 9 6229 1 1 13 ASP OD1 O -14.874 7.321 3.730 1.00 . A A . 792 ASP OD1 1 1 9 6230 1 1 13 ASP OD2 O -15.578 7.154 1.664 1.00 . A A . 792 ASP OD2 1 1 9 6231 1 1 14 LYS C C -12.377 2.578 0.278 1.00 . A A . 793 LYS C 1 1 9 6232 1 1 14 LYS CA C -13.666 1.901 0.738 1.00 . A A . 793 LYS CA 1 1 9 6233 1 1 14 LYS CB C -14.714 1.909 -0.381 1.00 . A A . 793 LYS CB 1 1 9 6234 1 1 14 LYS CD C -17.074 1.334 -1.060 1.00 . A A . 793 LYS CD 1 1 9 6235 1 1 14 LYS CE C -16.687 0.904 -2.466 1.00 . A A . 793 LYS CE 1 1 9 6236 1 1 14 LYS CG C -15.957 1.093 -0.055 1.00 . A A . 793 LYS CG 1 1 9 6237 1 1 14 LYS H H -14.126 2.042 2.800 1.00 . A A . 793 LYS H 1 1 9 6238 1 1 14 LYS HA H -13.436 0.874 0.987 1.00 . A A . 793 LYS HA 1 1 9 6239 1 1 14 LYS HB2 H -15.016 2.931 -0.567 1.00 . A A . 793 LYS HB2 1 1 9 6240 1 1 14 LYS HB3 H -14.269 1.506 -1.277 1.00 . A A . 793 LYS HB3 1 1 9 6241 1 1 14 LYS HD2 H -17.945 0.774 -0.755 1.00 . A A . 793 LYS HD2 1 1 9 6242 1 1 14 LYS HD3 H -17.311 2.390 -1.069 1.00 . A A . 793 LYS HD3 1 1 9 6243 1 1 14 LYS HE2 H -17.509 1.115 -3.133 1.00 . A A . 793 LYS HE2 1 1 9 6244 1 1 14 LYS HE3 H -15.822 1.471 -2.773 1.00 . A A . 793 LYS HE3 1 1 9 6245 1 1 14 LYS HG2 H -15.700 0.045 -0.065 1.00 . A A . 793 LYS HG2 1 1 9 6246 1 1 14 LYS HG3 H -16.307 1.369 0.931 1.00 . A A . 793 LYS HG3 1 1 9 6247 1 1 14 LYS HZ1 H -15.408 -0.720 -2.160 1.00 . A A . 793 LYS HZ1 1 1 9 6248 1 1 14 LYS HZ2 H -16.399 -0.871 -3.528 1.00 . A A . 793 LYS HZ2 1 1 9 6249 1 1 14 LYS HZ3 H -17.051 -1.100 -1.983 1.00 . A A . 793 LYS HZ3 1 1 9 6250 1 1 14 LYS N N -14.186 2.535 1.955 1.00 . A A . 793 LYS N 1 1 9 6251 1 1 14 LYS NZ N -16.363 -0.545 -2.541 1.00 . A A . 793 LYS NZ 1 1 9 6252 1 1 14 LYS O O -11.291 2.005 0.396 1.00 . A A . 793 LYS O 1 1 9 6253 1 1 15 LYS C C -10.664 4.073 -1.861 1.00 . A A . 794 LYS C 1 1 9 6254 1 1 15 LYS CA C -11.393 4.636 -0.643 1.00 . A A . 794 LYS CA 1 1 9 6255 1 1 15 LYS CB C -10.407 4.841 0.515 1.00 . A A . 794 LYS CB 1 1 9 6256 1 1 15 LYS CD C -11.697 6.863 1.243 1.00 . A A . 794 LYS CD 1 1 9 6257 1 1 15 LYS CE C -12.106 7.724 2.421 1.00 . A A . 794 LYS CE 1 1 9 6258 1 1 15 LYS CG C -10.996 5.593 1.696 1.00 . A A . 794 LYS CG 1 1 9 6259 1 1 15 LYS H H -13.425 4.163 -0.327 1.00 . A A . 794 LYS H 1 1 9 6260 1 1 15 LYS HA H -11.800 5.600 -0.913 1.00 . A A . 794 LYS HA 1 1 9 6261 1 1 15 LYS HB2 H -10.072 3.873 0.863 1.00 . A A . 794 LYS HB2 1 1 9 6262 1 1 15 LYS HB3 H -9.555 5.395 0.151 1.00 . A A . 794 LYS HB3 1 1 9 6263 1 1 15 LYS HD2 H -11.027 7.429 0.614 1.00 . A A . 794 LYS HD2 1 1 9 6264 1 1 15 LYS HD3 H -12.579 6.592 0.682 1.00 . A A . 794 LYS HD3 1 1 9 6265 1 1 15 LYS HE2 H -12.671 7.121 3.113 1.00 . A A . 794 LYS HE2 1 1 9 6266 1 1 15 LYS HE3 H -11.215 8.092 2.908 1.00 . A A . 794 LYS HE3 1 1 9 6267 1 1 15 LYS HG2 H -11.710 4.958 2.199 1.00 . A A . 794 LYS HG2 1 1 9 6268 1 1 15 LYS HG3 H -10.200 5.856 2.376 1.00 . A A . 794 LYS HG3 1 1 9 6269 1 1 15 LYS HZ1 H -12.500 9.342 1.165 1.00 . A A . 794 LYS HZ1 1 1 9 6270 1 1 15 LYS HZ2 H -13.003 9.575 2.768 1.00 . A A . 794 LYS HZ2 1 1 9 6271 1 1 15 LYS HZ3 H -13.891 8.558 1.741 1.00 . A A . 794 LYS HZ3 1 1 9 6272 1 1 15 LYS N N -12.517 3.800 -0.232 1.00 . A A . 794 LYS N 1 1 9 6273 1 1 15 LYS NZ N -12.934 8.878 1.994 1.00 . A A . 794 LYS NZ 1 1 9 6274 1 1 15 LYS O O -10.795 4.608 -2.963 1.00 . A A . 794 LYS O 1 1 9 6275 1 1 16 ALA C C -7.970 3.520 -3.060 1.00 . A A . 795 ALA C 1 1 9 6276 1 1 16 ALA CA C -9.010 2.471 -2.683 1.00 . A A . 795 ALA CA 1 1 9 6277 1 1 16 ALA CB C -9.779 1.992 -3.909 1.00 . A A . 795 ALA CB 1 1 9 6278 1 1 16 ALA H H -9.963 2.534 -0.793 1.00 . A A . 795 ALA H 1 1 9 6279 1 1 16 ALA HA H -8.497 1.620 -2.257 1.00 . A A . 795 ALA HA 1 1 9 6280 1 1 16 ALA HB1 H -10.506 1.250 -3.612 1.00 . A A . 795 ALA HB1 1 1 9 6281 1 1 16 ALA HB2 H -9.089 1.556 -4.617 1.00 . A A . 795 ALA HB2 1 1 9 6282 1 1 16 ALA HB3 H -10.284 2.828 -4.368 1.00 . A A . 795 ALA HB3 1 1 9 6283 1 1 16 ALA N N -9.906 2.998 -1.659 1.00 . A A . 795 ALA N 1 1 9 6284 1 1 16 ALA O O -7.547 3.620 -4.210 1.00 . A A . 795 ALA O 1 1 9 6285 1 1 17 ASN C C -5.164 4.638 -2.217 1.00 . A A . 796 ASN C 1 1 9 6286 1 1 17 ASN CA C -6.530 5.307 -2.259 1.00 . A A . 796 ASN CA 1 1 9 6287 1 1 17 ASN CB C -6.631 6.447 -1.222 1.00 . A A . 796 ASN CB 1 1 9 6288 1 1 17 ASN CG C -6.964 6.001 0.200 1.00 . A A . 796 ASN CG 1 1 9 6289 1 1 17 ASN H H -8.005 4.230 -1.195 1.00 . A A . 796 ASN H 1 1 9 6290 1 1 17 ASN HA H -6.665 5.728 -3.245 1.00 . A A . 796 ASN HA 1 1 9 6291 1 1 17 ASN HB2 H -5.681 6.962 -1.189 1.00 . A A . 796 ASN HB2 1 1 9 6292 1 1 17 ASN HB3 H -7.390 7.143 -1.546 1.00 . A A . 796 ASN HB3 1 1 9 6293 1 1 17 ASN HD21 H -5.863 4.362 0.014 1.00 . A A . 796 ASN HD21 1 1 9 6294 1 1 17 ASN HD22 H -6.657 4.569 1.539 1.00 . A A . 796 ASN HD22 1 1 9 6295 1 1 17 ASN N N -7.578 4.315 -2.070 1.00 . A A . 796 ASN N 1 1 9 6296 1 1 17 ASN ND2 N -6.445 4.862 0.628 1.00 . A A . 796 ASN ND2 1 1 9 6297 1 1 17 ASN O O -4.555 4.480 -1.157 1.00 . A A . 796 ASN O 1 1 9 6298 1 1 17 ASN OD1 O -7.669 6.703 0.925 1.00 . A A . 796 ASN OD1 1 1 9 6299 1 1 18 LEU C C -2.338 4.475 -3.805 1.00 . A A . 797 LEU C 1 1 9 6300 1 1 18 LEU CA C -3.455 3.498 -3.488 1.00 . A A . 797 LEU CA 1 1 9 6301 1 1 18 LEU CB C -3.545 2.458 -4.600 1.00 . A A . 797 LEU CB 1 1 9 6302 1 1 18 LEU CD1 C -4.871 0.756 -5.866 1.00 . A A . 797 LEU CD1 1 1 9 6303 1 1 18 LEU CD2 C -4.916 0.744 -3.371 1.00 . A A . 797 LEU CD2 1 1 9 6304 1 1 18 LEU CG C -4.821 1.614 -4.613 1.00 . A A . 797 LEU CG 1 1 9 6305 1 1 18 LEU H H -5.202 4.387 -4.197 1.00 . A A . 797 LEU H 1 1 9 6306 1 1 18 LEU HA H -3.233 3.002 -2.556 1.00 . A A . 797 LEU HA 1 1 9 6307 1 1 18 LEU HB2 H -3.470 2.974 -5.541 1.00 . A A . 797 LEU HB2 1 1 9 6308 1 1 18 LEU HB3 H -2.699 1.791 -4.508 1.00 . A A . 797 LEU HB3 1 1 9 6309 1 1 18 LEU HD11 H -4.844 1.393 -6.738 1.00 . A A . 797 LEU HD11 1 1 9 6310 1 1 18 LEU HD12 H -5.784 0.178 -5.872 1.00 . A A . 797 LEU HD12 1 1 9 6311 1 1 18 LEU HD13 H -4.022 0.089 -5.882 1.00 . A A . 797 LEU HD13 1 1 9 6312 1 1 18 LEU HD21 H -5.831 0.169 -3.403 1.00 . A A . 797 LEU HD21 1 1 9 6313 1 1 18 LEU HD22 H -4.914 1.369 -2.490 1.00 . A A . 797 LEU HD22 1 1 9 6314 1 1 18 LEU HD23 H -4.072 0.070 -3.334 1.00 . A A . 797 LEU HD23 1 1 9 6315 1 1 18 LEU HG H -5.676 2.274 -4.624 1.00 . A A . 797 LEU HG 1 1 9 6316 1 1 18 LEU N N -4.710 4.204 -3.373 1.00 . A A . 797 LEU N 1 1 9 6317 1 1 18 LEU O O -2.552 5.486 -4.472 1.00 . A A . 797 LEU O 1 1 9 6318 1 1 19 LEU C C 1.190 3.926 -3.663 1.00 . A A . 798 LEU C 1 1 9 6319 1 1 19 LEU CA C 0.045 4.910 -3.645 1.00 . A A . 798 LEU CA 1 1 9 6320 1 1 19 LEU CB C 0.272 6.111 -2.686 1.00 . A A . 798 LEU CB 1 1 9 6321 1 1 19 LEU CD1 C -0.085 4.754 -0.568 1.00 . A A . 798 LEU CD1 1 1 9 6322 1 1 19 LEU CD2 C 2.226 5.489 -1.218 1.00 . A A . 798 LEU CD2 1 1 9 6323 1 1 19 LEU CG C 0.745 5.832 -1.244 1.00 . A A . 798 LEU CG 1 1 9 6324 1 1 19 LEU H H -1.090 3.376 -2.725 1.00 . A A . 798 LEU H 1 1 9 6325 1 1 19 LEU HA H -0.041 5.278 -4.654 1.00 . A A . 798 LEU HA 1 1 9 6326 1 1 19 LEU HB2 H 1.004 6.758 -3.145 1.00 . A A . 798 LEU HB2 1 1 9 6327 1 1 19 LEU HB3 H -0.659 6.657 -2.627 1.00 . A A . 798 LEU HB3 1 1 9 6328 1 1 19 LEU HD11 H 0.003 3.832 -1.122 1.00 . A A . 798 LEU HD11 1 1 9 6329 1 1 19 LEU HD12 H -1.121 5.062 -0.542 1.00 . A A . 798 LEU HD12 1 1 9 6330 1 1 19 LEU HD13 H 0.272 4.603 0.440 1.00 . A A . 798 LEU HD13 1 1 9 6331 1 1 19 LEU HD21 H 2.489 5.098 -0.246 1.00 . A A . 798 LEU HD21 1 1 9 6332 1 1 19 LEU HD22 H 2.805 6.379 -1.417 1.00 . A A . 798 LEU HD22 1 1 9 6333 1 1 19 LEU HD23 H 2.431 4.747 -1.978 1.00 . A A . 798 LEU HD23 1 1 9 6334 1 1 19 LEU HG H 0.616 6.738 -0.668 1.00 . A A . 798 LEU HG 1 1 9 6335 1 1 19 LEU N N -1.160 4.160 -3.323 1.00 . A A . 798 LEU N 1 1 9 6336 1 1 19 LEU O O 1.188 2.955 -2.907 1.00 . A A . 798 LEU O 1 1 9 6337 1 1 20 LYS C C 4.400 3.227 -4.161 1.00 . A A . 799 LYS C 1 1 9 6338 1 1 20 LYS CA C 3.051 3.028 -4.836 1.00 . A A . 799 LYS CA 1 1 9 6339 1 1 20 LYS CB C 3.196 2.758 -6.327 1.00 . A A . 799 LYS CB 1 1 9 6340 1 1 20 LYS CD C 3.737 3.749 -8.586 1.00 . A A . 799 LYS CD 1 1 9 6341 1 1 20 LYS CE C 4.089 5.036 -9.316 1.00 . A A . 799 LYS CE 1 1 9 6342 1 1 20 LYS CG C 3.749 3.954 -7.083 1.00 . A A . 799 LYS CG 1 1 9 6343 1 1 20 LYS H H 2.161 4.961 -5.068 1.00 . A A . 799 LYS H 1 1 9 6344 1 1 20 LYS HA H 2.590 2.205 -4.323 1.00 . A A . 799 LYS HA 1 1 9 6345 1 1 20 LYS HB2 H 3.863 1.920 -6.471 1.00 . A A . 799 LYS HB2 1 1 9 6346 1 1 20 LYS HB3 H 2.227 2.515 -6.732 1.00 . A A . 799 LYS HB3 1 1 9 6347 1 1 20 LYS HD2 H 4.462 2.991 -8.841 1.00 . A A . 799 LYS HD2 1 1 9 6348 1 1 20 LYS HD3 H 2.752 3.429 -8.889 1.00 . A A . 799 LYS HD3 1 1 9 6349 1 1 20 LYS HE2 H 5.076 5.351 -9.010 1.00 . A A . 799 LYS HE2 1 1 9 6350 1 1 20 LYS HE3 H 4.086 4.844 -10.379 1.00 . A A . 799 LYS HE3 1 1 9 6351 1 1 20 LYS HG2 H 3.156 4.821 -6.847 1.00 . A A . 799 LYS HG2 1 1 9 6352 1 1 20 LYS HG3 H 4.769 4.122 -6.763 1.00 . A A . 799 LYS HG3 1 1 9 6353 1 1 20 LYS HZ1 H 3.390 6.999 -9.517 1.00 . A A . 799 LYS HZ1 1 1 9 6354 1 1 20 LYS HZ2 H 3.102 6.320 -7.993 1.00 . A A . 799 LYS HZ2 1 1 9 6355 1 1 20 LYS HZ3 H 2.160 5.847 -9.321 1.00 . A A . 799 LYS HZ3 1 1 9 6356 1 1 20 LYS N N 2.118 4.105 -4.583 1.00 . A A . 799 LYS N 1 1 9 6357 1 1 20 LYS NZ N 3.119 6.124 -9.016 1.00 . A A . 799 LYS NZ 1 1 9 6358 1 1 20 LYS O O 4.978 4.315 -4.151 1.00 . A A . 799 LYS O 1 1 9 6359 1 1 21 CYS C C 7.272 2.516 -3.846 1.00 . A A . 800 CYS C 1 1 9 6360 1 1 21 CYS CA C 6.152 1.987 -2.953 1.00 . A A . 800 CYS CA 1 1 9 6361 1 1 21 CYS CB C 6.341 0.496 -2.706 1.00 . A A . 800 CYS CB 1 1 9 6362 1 1 21 CYS H H 4.248 1.353 -3.526 1.00 . A A . 800 CYS H 1 1 9 6363 1 1 21 CYS HA H 6.142 2.498 -2.003 1.00 . A A . 800 CYS HA 1 1 9 6364 1 1 21 CYS HB2 H 5.784 0.216 -1.823 1.00 . A A . 800 CYS HB2 1 1 9 6365 1 1 21 CYS HB3 H 5.945 -0.047 -3.553 1.00 . A A . 800 CYS HB3 1 1 9 6366 1 1 21 CYS N N 4.848 2.127 -3.574 1.00 . A A . 800 CYS N 1 1 9 6367 1 1 21 CYS O O 7.554 1.938 -4.893 1.00 . A A . 800 CYS O 1 1 9 6368 1 1 21 CYS SG S 8.032 -0.048 -2.459 1.00 . A A . 800 CYS SG 1 1 9 6369 1 1 22 GLU C C 10.253 3.446 -4.325 1.00 . A A . 801 GLU C 1 1 9 6370 1 1 22 GLU CA C 8.957 4.267 -4.208 1.00 . A A . 801 GLU CA 1 1 9 6371 1 1 22 GLU CB C 9.261 5.640 -3.615 1.00 . A A . 801 GLU CB 1 1 9 6372 1 1 22 GLU CD C 8.394 7.948 -3.109 1.00 . A A . 801 GLU CD 1 1 9 6373 1 1 22 GLU CG C 8.055 6.561 -3.597 1.00 . A A . 801 GLU CG 1 1 9 6374 1 1 22 GLU H H 7.630 4.026 -2.577 1.00 . A A . 801 GLU H 1 1 9 6375 1 1 22 GLU HA H 8.581 4.412 -5.212 1.00 . A A . 801 GLU HA 1 1 9 6376 1 1 22 GLU HB2 H 9.608 5.515 -2.600 1.00 . A A . 801 GLU HB2 1 1 9 6377 1 1 22 GLU HB3 H 10.038 6.112 -4.198 1.00 . A A . 801 GLU HB3 1 1 9 6378 1 1 22 GLU HG2 H 7.655 6.633 -4.599 1.00 . A A . 801 GLU HG2 1 1 9 6379 1 1 22 GLU HG3 H 7.306 6.138 -2.943 1.00 . A A . 801 GLU HG3 1 1 9 6380 1 1 22 GLU N N 7.901 3.612 -3.430 1.00 . A A . 801 GLU N 1 1 9 6381 1 1 22 GLU O O 11.322 4.002 -4.578 1.00 . A A . 801 GLU O 1 1 9 6382 1 1 22 GLU OE1 O 8.898 8.758 -3.908 1.00 . A A . 801 GLU OE1 1 1 9 6383 1 1 22 GLU OE2 O 8.159 8.235 -1.915 1.00 . A A . 801 GLU OE2 1 1 9 6384 1 1 23 TYR C C 10.985 0.413 -5.661 1.00 . A A . 802 TYR C 1 1 9 6385 1 1 23 TYR CA C 11.312 1.280 -4.445 1.00 . A A . 802 TYR CA 1 1 9 6386 1 1 23 TYR CB C 11.698 0.397 -3.250 1.00 . A A . 802 TYR CB 1 1 9 6387 1 1 23 TYR CD1 C 14.217 0.183 -3.169 1.00 . A A . 802 TYR CD1 1 1 9 6388 1 1 23 TYR CD2 C 12.960 -1.677 -3.976 1.00 . A A . 802 TYR CD2 1 1 9 6389 1 1 23 TYR CE1 C 15.392 -0.518 -3.371 1.00 . A A . 802 TYR CE1 1 1 9 6390 1 1 23 TYR CE2 C 14.131 -2.381 -4.181 1.00 . A A . 802 TYR CE2 1 1 9 6391 1 1 23 TYR CG C 12.981 -0.383 -3.465 1.00 . A A . 802 TYR CG 1 1 9 6392 1 1 23 TYR CZ C 15.344 -1.799 -3.878 1.00 . A A . 802 TYR CZ 1 1 9 6393 1 1 23 TYR H H 9.353 1.747 -3.777 1.00 . A A . 802 TYR H 1 1 9 6394 1 1 23 TYR HA H 12.149 1.919 -4.691 1.00 . A A . 802 TYR HA 1 1 9 6395 1 1 23 TYR HB2 H 11.833 1.020 -2.374 1.00 . A A . 802 TYR HB2 1 1 9 6396 1 1 23 TYR HB3 H 10.904 -0.312 -3.063 1.00 . A A . 802 TYR HB3 1 1 9 6397 1 1 23 TYR HD1 H 14.252 1.186 -2.772 1.00 . A A . 802 TYR HD1 1 1 9 6398 1 1 23 TYR HD2 H 12.008 -2.133 -4.210 1.00 . A A . 802 TYR HD2 1 1 9 6399 1 1 23 TYR HE1 H 16.340 -0.061 -3.135 1.00 . A A . 802 TYR HE1 1 1 9 6400 1 1 23 TYR HE2 H 14.092 -3.385 -4.577 1.00 . A A . 802 TYR HE2 1 1 9 6401 1 1 23 TYR HH H 17.160 -2.261 -3.410 1.00 . A A . 802 TYR HH 1 1 9 6402 1 1 23 TYR N N 10.179 2.139 -4.133 1.00 . A A . 802 TYR N 1 1 9 6403 1 1 23 TYR O O 11.817 0.221 -6.545 1.00 . A A . 802 TYR O 1 1 9 6404 1 1 23 TYR OH O 16.511 -2.501 -4.089 1.00 . A A . 802 TYR OH 1 1 9 6405 1 1 24 CYS C C 8.247 -0.365 -7.655 1.00 . A A . 803 CYS C 1 1 9 6406 1 1 24 CYS CA C 9.337 -0.984 -6.780 1.00 . A A . 803 CYS CA 1 1 9 6407 1 1 24 CYS CB C 8.866 -2.314 -6.192 1.00 . A A . 803 CYS CB 1 1 9 6408 1 1 24 CYS H H 9.126 0.126 -4.994 1.00 . A A . 803 CYS H 1 1 9 6409 1 1 24 CYS HA H 10.182 -1.160 -7.428 1.00 . A A . 803 CYS HA 1 1 9 6410 1 1 24 CYS HB2 H 8.397 -2.899 -6.970 1.00 . A A . 803 CYS HB2 1 1 9 6411 1 1 24 CYS HB3 H 9.719 -2.851 -5.808 1.00 . A A . 803 CYS HB3 1 1 9 6412 1 1 24 CYS N N 9.759 -0.094 -5.705 1.00 . A A . 803 CYS N 1 1 9 6413 1 1 24 CYS O O 8.197 -0.612 -8.861 1.00 . A A . 803 CYS O 1 1 9 6414 1 1 24 CYS SG S 7.671 -2.137 -4.836 1.00 . A A . 803 CYS SG 1 1 9 6415 1 1 25 GLY C C 5.047 0.332 -7.752 1.00 . A A . 804 GLY C 1 1 9 6416 1 1 25 GLY CA C 6.344 1.090 -7.830 1.00 . A A . 804 GLY CA 1 1 9 6417 1 1 25 GLY H H 7.445 0.602 -6.099 1.00 . A A . 804 GLY H 1 1 9 6418 1 1 25 GLY HA2 H 6.194 2.089 -7.449 1.00 . A A . 804 GLY HA2 1 1 9 6419 1 1 25 GLY HA3 H 6.654 1.150 -8.863 1.00 . A A . 804 GLY HA3 1 1 9 6420 1 1 25 GLY N N 7.383 0.443 -7.063 1.00 . A A . 804 GLY N 1 1 9 6421 1 1 25 GLY O O 4.164 0.504 -8.592 1.00 . A A . 804 GLY O 1 1 9 6422 1 1 26 LYS C C 2.651 -0.566 -5.890 1.00 . A A . 805 LYS C 1 1 9 6423 1 1 26 LYS CA C 3.751 -1.344 -6.592 1.00 . A A . 805 LYS CA 1 1 9 6424 1 1 26 LYS CB C 4.091 -2.592 -5.788 1.00 . A A . 805 LYS CB 1 1 9 6425 1 1 26 LYS CD C 3.740 -5.056 -5.443 1.00 . A A . 805 LYS CD 1 1 9 6426 1 1 26 LYS CE C 5.191 -5.450 -5.677 1.00 . A A . 805 LYS CE 1 1 9 6427 1 1 26 LYS CG C 3.353 -3.832 -6.258 1.00 . A A . 805 LYS CG 1 1 9 6428 1 1 26 LYS H H 5.602 -0.511 -6.029 1.00 . A A . 805 LYS H 1 1 9 6429 1 1 26 LYS HA H 3.426 -1.628 -7.582 1.00 . A A . 805 LYS HA 1 1 9 6430 1 1 26 LYS HB2 H 5.153 -2.778 -5.856 1.00 . A A . 805 LYS HB2 1 1 9 6431 1 1 26 LYS HB3 H 3.827 -2.417 -4.759 1.00 . A A . 805 LYS HB3 1 1 9 6432 1 1 26 LYS HD2 H 3.603 -4.835 -4.394 1.00 . A A . 805 LYS HD2 1 1 9 6433 1 1 26 LYS HD3 H 3.102 -5.880 -5.724 1.00 . A A . 805 LYS HD3 1 1 9 6434 1 1 26 LYS HE2 H 5.813 -4.581 -5.527 1.00 . A A . 805 LYS HE2 1 1 9 6435 1 1 26 LYS HE3 H 5.462 -6.213 -4.962 1.00 . A A . 805 LYS HE3 1 1 9 6436 1 1 26 LYS HG2 H 2.290 -3.667 -6.167 1.00 . A A . 805 LYS HG2 1 1 9 6437 1 1 26 LYS HG3 H 3.606 -4.006 -7.293 1.00 . A A . 805 LYS HG3 1 1 9 6438 1 1 26 LYS HZ1 H 4.845 -6.830 -7.214 1.00 . A A . 805 LYS HZ1 1 1 9 6439 1 1 26 LYS HZ2 H 6.427 -6.215 -7.178 1.00 . A A . 805 LYS HZ2 1 1 9 6440 1 1 26 LYS HZ3 H 5.160 -5.251 -7.764 1.00 . A A . 805 LYS HZ3 1 1 9 6441 1 1 26 LYS N N 4.924 -0.504 -6.734 1.00 . A A . 805 LYS N 1 1 9 6442 1 1 26 LYS NZ N 5.420 -5.972 -7.053 1.00 . A A . 805 LYS NZ 1 1 9 6443 1 1 26 LYS O O 2.896 0.049 -4.849 1.00 . A A . 805 LYS O 1 1 9 6444 1 1 27 TYR C C -0.318 -0.652 -4.756 1.00 . A A . 806 TYR C 1 1 9 6445 1 1 27 TYR CA C 0.341 0.141 -5.862 1.00 . A A . 806 TYR CA 1 1 9 6446 1 1 27 TYR CB C -0.699 0.524 -6.917 1.00 . A A . 806 TYR CB 1 1 9 6447 1 1 27 TYR CD1 C -0.365 3.001 -7.198 1.00 . A A . 806 TYR CD1 1 1 9 6448 1 1 27 TYR CD2 C 0.079 1.594 -9.069 1.00 . A A . 806 TYR CD2 1 1 9 6449 1 1 27 TYR CE1 C -0.023 4.110 -7.943 1.00 . A A . 806 TYR CE1 1 1 9 6450 1 1 27 TYR CE2 C 0.424 2.701 -9.823 1.00 . A A . 806 TYR CE2 1 1 9 6451 1 1 27 TYR CG C -0.317 1.727 -7.745 1.00 . A A . 806 TYR CG 1 1 9 6452 1 1 27 TYR CZ C 0.367 3.956 -9.256 1.00 . A A . 806 TYR CZ 1 1 9 6453 1 1 27 TYR H H 1.285 -1.210 -7.192 1.00 . A A . 806 TYR H 1 1 9 6454 1 1 27 TYR HA H 0.732 1.043 -5.416 1.00 . A A . 806 TYR HA 1 1 9 6455 1 1 27 TYR HB2 H -0.841 -0.305 -7.586 1.00 . A A . 806 TYR HB2 1 1 9 6456 1 1 27 TYR HB3 H -1.634 0.745 -6.425 1.00 . A A . 806 TYR HB3 1 1 9 6457 1 1 27 TYR HD1 H -0.671 3.119 -6.170 1.00 . A A . 806 TYR HD1 1 1 9 6458 1 1 27 TYR HD2 H 0.121 0.608 -9.509 1.00 . A A . 806 TYR HD2 1 1 9 6459 1 1 27 TYR HE1 H -0.068 5.093 -7.499 1.00 . A A . 806 TYR HE1 1 1 9 6460 1 1 27 TYR HE2 H 0.728 2.578 -10.851 1.00 . A A . 806 TYR HE2 1 1 9 6461 1 1 27 TYR HH H 0.113 5.148 -10.749 1.00 . A A . 806 TYR HH 1 1 9 6462 1 1 27 TYR N N 1.448 -0.610 -6.431 1.00 . A A . 806 TYR N 1 1 9 6463 1 1 27 TYR O O -0.633 -1.834 -4.911 1.00 . A A . 806 TYR O 1 1 9 6464 1 1 27 TYR OH O 0.717 5.063 -9.995 1.00 . A A . 806 TYR OH 1 1 9 6465 1 1 28 ALA C C -1.796 0.447 -1.635 1.00 . A A . 807 ALA C 1 1 9 6466 1 1 28 ALA CA C -1.074 -0.598 -2.461 1.00 . A A . 807 ALA CA 1 1 9 6467 1 1 28 ALA CB C 0.032 -1.255 -1.645 1.00 . A A . 807 ALA CB 1 1 9 6468 1 1 28 ALA H H -0.233 0.962 -3.601 1.00 . A A . 807 ALA H 1 1 9 6469 1 1 28 ALA HA H -1.775 -1.359 -2.773 1.00 . A A . 807 ALA HA 1 1 9 6470 1 1 28 ALA HB1 H -0.397 -1.739 -0.780 1.00 . A A . 807 ALA HB1 1 1 9 6471 1 1 28 ALA HB2 H 0.738 -0.504 -1.325 1.00 . A A . 807 ALA HB2 1 1 9 6472 1 1 28 ALA HB3 H 0.540 -1.990 -2.252 1.00 . A A . 807 ALA HB3 1 1 9 6473 1 1 28 ALA N N -0.510 0.019 -3.639 1.00 . A A . 807 ALA N 1 1 9 6474 1 1 28 ALA O O -1.481 1.637 -1.716 1.00 . A A . 807 ALA O 1 1 9 6475 1 1 29 PRO C C -2.640 1.501 1.090 1.00 . A A . 808 PRO C 1 1 9 6476 1 1 29 PRO CA C -3.541 0.929 0.009 1.00 . A A . 808 PRO CA 1 1 9 6477 1 1 29 PRO CB C -4.632 0.050 0.625 1.00 . A A . 808 PRO CB 1 1 9 6478 1 1 29 PRO CD C -3.290 -1.357 -0.763 1.00 . A A . 808 PRO CD 1 1 9 6479 1 1 29 PRO CG C -4.674 -1.184 -0.212 1.00 . A A . 808 PRO CG 1 1 9 6480 1 1 29 PRO HA H -3.988 1.737 -0.554 1.00 . A A . 808 PRO HA 1 1 9 6481 1 1 29 PRO HB2 H -4.372 -0.176 1.647 1.00 . A A . 808 PRO HB2 1 1 9 6482 1 1 29 PRO HB3 H -5.575 0.575 0.599 1.00 . A A . 808 PRO HB3 1 1 9 6483 1 1 29 PRO HD2 H -2.684 -1.938 -0.084 1.00 . A A . 808 PRO HD2 1 1 9 6484 1 1 29 PRO HD3 H -3.324 -1.822 -1.737 1.00 . A A . 808 PRO HD3 1 1 9 6485 1 1 29 PRO HG2 H -4.943 -2.032 0.397 1.00 . A A . 808 PRO HG2 1 1 9 6486 1 1 29 PRO HG3 H -5.383 -1.055 -1.016 1.00 . A A . 808 PRO HG3 1 1 9 6487 1 1 29 PRO N N -2.800 0.026 -0.858 1.00 . A A . 808 PRO N 1 1 9 6488 1 1 29 PRO O O -1.903 0.764 1.748 1.00 . A A . 808 PRO O 1 1 9 6489 1 1 30 ALA C C -1.826 2.915 3.590 1.00 . A A . 809 ALA C 1 1 9 6490 1 1 30 ALA CA C -1.891 3.578 2.204 1.00 . A A . 809 ALA CA 1 1 9 6491 1 1 30 ALA CB C -2.452 4.985 2.337 1.00 . A A . 809 ALA CB 1 1 9 6492 1 1 30 ALA H H -3.229 3.336 0.566 1.00 . A A . 809 ALA H 1 1 9 6493 1 1 30 ALA HA H -0.884 3.662 1.817 1.00 . A A . 809 ALA HA 1 1 9 6494 1 1 30 ALA HB1 H -2.476 5.457 1.367 1.00 . A A . 809 ALA HB1 1 1 9 6495 1 1 30 ALA HB2 H -1.825 5.560 3.003 1.00 . A A . 809 ALA HB2 1 1 9 6496 1 1 30 ALA HB3 H -3.453 4.935 2.739 1.00 . A A . 809 ALA HB3 1 1 9 6497 1 1 30 ALA N N -2.680 2.827 1.215 1.00 . A A . 809 ALA N 1 1 9 6498 1 1 30 ALA O O -0.880 3.141 4.345 1.00 . A A . 809 ALA O 1 1 9 6499 1 1 31 GLU C C -1.725 0.433 5.389 1.00 . A A . 810 GLU C 1 1 9 6500 1 1 31 GLU CA C -2.886 1.416 5.203 1.00 . A A . 810 GLU CA 1 1 9 6501 1 1 31 GLU CB C -4.222 0.692 5.357 1.00 . A A . 810 GLU CB 1 1 9 6502 1 1 31 GLU CD C -5.060 2.211 7.175 1.00 . A A . 810 GLU CD 1 1 9 6503 1 1 31 GLU CG C -5.344 1.607 5.816 1.00 . A A . 810 GLU CG 1 1 9 6504 1 1 31 GLU H H -3.552 1.972 3.275 1.00 . A A . 810 GLU H 1 1 9 6505 1 1 31 GLU HA H -2.817 2.159 5.983 1.00 . A A . 810 GLU HA 1 1 9 6506 1 1 31 GLU HB2 H -4.499 0.262 4.404 1.00 . A A . 810 GLU HB2 1 1 9 6507 1 1 31 GLU HB3 H -4.110 -0.100 6.082 1.00 . A A . 810 GLU HB3 1 1 9 6508 1 1 31 GLU HG2 H -5.459 2.406 5.097 1.00 . A A . 810 GLU HG2 1 1 9 6509 1 1 31 GLU HG3 H -6.260 1.037 5.872 1.00 . A A . 810 GLU HG3 1 1 9 6510 1 1 31 GLU N N -2.835 2.117 3.923 1.00 . A A . 810 GLU N 1 1 9 6511 1 1 31 GLU O O -1.345 0.129 6.519 1.00 . A A . 810 GLU O 1 1 9 6512 1 1 31 GLU OE1 O -4.424 3.284 7.239 1.00 . A A . 810 GLU OE1 1 1 9 6513 1 1 31 GLU OE2 O -5.447 1.599 8.193 1.00 . A A . 810 GLU OE2 1 1 9 6514 1 1 32 GLN C C 1.250 -0.349 4.605 1.00 . A A . 811 GLN C 1 1 9 6515 1 1 32 GLN CA C -0.088 -1.046 4.372 1.00 . A A . 811 GLN CA 1 1 9 6516 1 1 32 GLN CB C -0.034 -1.874 3.087 1.00 . A A . 811 GLN CB 1 1 9 6517 1 1 32 GLN CD C 1.242 -3.694 1.831 1.00 . A A . 811 GLN CD 1 1 9 6518 1 1 32 GLN CG C 0.889 -3.084 3.180 1.00 . A A . 811 GLN CG 1 1 9 6519 1 1 32 GLN H H -1.446 0.262 3.413 1.00 . A A . 811 GLN H 1 1 9 6520 1 1 32 GLN HA H -0.309 -1.686 5.213 1.00 . A A . 811 GLN HA 1 1 9 6521 1 1 32 GLN HB2 H -1.029 -2.224 2.858 1.00 . A A . 811 GLN HB2 1 1 9 6522 1 1 32 GLN HB3 H 0.306 -1.240 2.288 1.00 . A A . 811 GLN HB3 1 1 9 6523 1 1 32 GLN HE21 H 1.367 -1.899 0.974 1.00 . A A . 811 GLN HE21 1 1 9 6524 1 1 32 GLN HE22 H 1.665 -3.250 -0.058 1.00 . A A . 811 GLN HE22 1 1 9 6525 1 1 32 GLN HG2 H 1.803 -2.778 3.665 1.00 . A A . 811 GLN HG2 1 1 9 6526 1 1 32 GLN HG3 H 0.405 -3.840 3.781 1.00 . A A . 811 GLN HG3 1 1 9 6527 1 1 32 GLN N N -1.156 -0.059 4.292 1.00 . A A . 811 GLN N 1 1 9 6528 1 1 32 GLN NE2 N 1.447 -2.863 0.816 1.00 . A A . 811 GLN NE2 1 1 9 6529 1 1 32 GLN O O 2.277 -0.988 4.828 1.00 . A A . 811 GLN O 1 1 9 6530 1 1 32 GLN OE1 O 1.388 -4.911 1.715 1.00 . A A . 811 GLN OE1 1 1 9 6531 1 1 33 PHE C C 2.754 2.173 6.060 1.00 . A A . 812 PHE C 1 1 9 6532 1 1 33 PHE CA C 2.432 1.763 4.629 1.00 . A A . 812 PHE CA 1 1 9 6533 1 1 33 PHE CB C 2.310 2.971 3.699 1.00 . A A . 812 PHE CB 1 1 9 6534 1 1 33 PHE CD1 C 1.335 1.852 1.671 1.00 . A A . 812 PHE CD1 1 1 9 6535 1 1 33 PHE CD2 C 3.428 2.972 1.453 1.00 . A A . 812 PHE CD2 1 1 9 6536 1 1 33 PHE CE1 C 1.386 1.489 0.342 1.00 . A A . 812 PHE CE1 1 1 9 6537 1 1 33 PHE CE2 C 3.484 2.613 0.122 1.00 . A A . 812 PHE CE2 1 1 9 6538 1 1 33 PHE CG C 2.354 2.594 2.243 1.00 . A A . 812 PHE CG 1 1 9 6539 1 1 33 PHE CZ C 2.463 1.872 -0.434 1.00 . A A . 812 PHE CZ 1 1 9 6540 1 1 33 PHE H H 0.354 1.425 4.723 1.00 . A A . 812 PHE H 1 1 9 6541 1 1 33 PHE HA H 3.234 1.129 4.282 1.00 . A A . 812 PHE HA 1 1 9 6542 1 1 33 PHE HB2 H 1.372 3.471 3.886 1.00 . A A . 812 PHE HB2 1 1 9 6543 1 1 33 PHE HB3 H 3.124 3.654 3.893 1.00 . A A . 812 PHE HB3 1 1 9 6544 1 1 33 PHE HD1 H 0.492 1.552 2.279 1.00 . A A . 812 PHE HD1 1 1 9 6545 1 1 33 PHE HD2 H 4.227 3.553 1.887 1.00 . A A . 812 PHE HD2 1 1 9 6546 1 1 33 PHE HE1 H 0.585 0.909 -0.092 1.00 . A A . 812 PHE HE1 1 1 9 6547 1 1 33 PHE HE2 H 4.326 2.914 -0.484 1.00 . A A . 812 PHE HE2 1 1 9 6548 1 1 33 PHE HZ H 2.507 1.590 -1.474 1.00 . A A . 812 PHE HZ 1 1 9 6549 1 1 33 PHE N N 1.215 0.973 4.603 1.00 . A A . 812 PHE N 1 1 9 6550 1 1 33 PHE O O 2.991 3.346 6.358 1.00 . A A . 812 PHE O 1 1 9 6551 1 1 34 ARG C C 4.623 1.357 8.436 1.00 . A A . 813 ARG C 1 1 9 6552 1 1 34 ARG CA C 3.105 1.379 8.334 1.00 . A A . 813 ARG CA 1 1 9 6553 1 1 34 ARG CB C 2.508 0.275 9.210 1.00 . A A . 813 ARG CB 1 1 9 6554 1 1 34 ARG CD C 0.279 1.397 9.687 1.00 . A A . 813 ARG CD 1 1 9 6555 1 1 34 ARG CG C 0.989 0.162 9.143 1.00 . A A . 813 ARG CG 1 1 9 6556 1 1 34 ARG CZ C -1.241 2.782 8.314 1.00 . A A . 813 ARG CZ 1 1 9 6557 1 1 34 ARG H H 2.456 0.297 6.644 1.00 . A A . 813 ARG H 1 1 9 6558 1 1 34 ARG HA H 2.746 2.339 8.677 1.00 . A A . 813 ARG HA 1 1 9 6559 1 1 34 ARG HB2 H 2.925 -0.672 8.903 1.00 . A A . 813 ARG HB2 1 1 9 6560 1 1 34 ARG HB3 H 2.784 0.462 10.238 1.00 . A A . 813 ARG HB3 1 1 9 6561 1 1 34 ARG HD2 H -0.652 1.090 10.138 1.00 . A A . 813 ARG HD2 1 1 9 6562 1 1 34 ARG HD3 H 0.909 1.851 10.440 1.00 . A A . 813 ARG HD3 1 1 9 6563 1 1 34 ARG HE H 0.761 2.785 8.177 1.00 . A A . 813 ARG HE 1 1 9 6564 1 1 34 ARG HG2 H 0.697 0.025 8.113 1.00 . A A . 813 ARG HG2 1 1 9 6565 1 1 34 ARG HG3 H 0.680 -0.699 9.719 1.00 . A A . 813 ARG HG3 1 1 9 6566 1 1 34 ARG HH11 H -2.179 1.589 9.667 1.00 . A A . 813 ARG HH11 1 1 9 6567 1 1 34 ARG HH12 H -3.229 2.567 8.677 1.00 . A A . 813 ARG HH12 1 1 9 6568 1 1 34 ARG HH21 H -0.644 4.095 6.888 1.00 . A A . 813 ARG HH21 1 1 9 6569 1 1 34 ARG HH22 H -2.359 3.970 7.113 1.00 . A A . 813 ARG HH22 1 1 9 6570 1 1 34 ARG N N 2.726 1.189 6.945 1.00 . A A . 813 ARG N 1 1 9 6571 1 1 34 ARG NE N -0.005 2.391 8.647 1.00 . A A . 813 ARG NE 1 1 9 6572 1 1 34 ARG NH1 N -2.298 2.272 8.937 1.00 . A A . 813 ARG NH1 1 1 9 6573 1 1 34 ARG NH2 N -1.426 3.689 7.364 1.00 . A A . 813 ARG NH2 1 1 9 6574 1 1 34 ARG O O 5.282 0.554 7.775 1.00 . A A . 813 ARG O 1 1 9 6575 1 1 35 GLY C C 7.095 3.514 8.458 1.00 . A A . 814 GLY C 1 1 9 6576 1 1 35 GLY CA C 6.611 2.379 9.331 1.00 . A A . 814 GLY CA 1 1 9 6577 1 1 35 GLY H H 4.599 2.796 9.825 1.00 . A A . 814 GLY H 1 1 9 6578 1 1 35 GLY HA2 H 6.890 2.579 10.356 1.00 . A A . 814 GLY HA2 1 1 9 6579 1 1 35 GLY HA3 H 7.079 1.462 9.009 1.00 . A A . 814 GLY HA3 1 1 9 6580 1 1 35 GLY N N 5.174 2.236 9.253 1.00 . A A . 814 GLY N 1 1 9 6581 1 1 35 GLY O O 7.783 4.424 8.927 1.00 . A A . 814 GLY O 1 1 9 6582 1 1 36 SER C C 6.108 4.543 5.068 1.00 . A A . 815 SER C 1 1 9 6583 1 1 36 SER CA C 7.069 4.527 6.252 1.00 . A A . 815 SER CA 1 1 9 6584 1 1 36 SER CB C 8.510 4.340 5.763 1.00 . A A . 815 SER CB 1 1 9 6585 1 1 36 SER H H 6.179 2.714 6.873 1.00 . A A . 815 SER H 1 1 9 6586 1 1 36 SER HA H 6.994 5.473 6.768 1.00 . A A . 815 SER HA 1 1 9 6587 1 1 36 SER HB2 H 8.747 5.116 5.052 1.00 . A A . 815 SER HB2 1 1 9 6588 1 1 36 SER HB3 H 9.183 4.405 6.605 1.00 . A A . 815 SER HB3 1 1 9 6589 1 1 36 SER HG H 7.888 2.550 5.245 1.00 . A A . 815 SER HG 1 1 9 6590 1 1 36 SER N N 6.714 3.474 7.188 1.00 . A A . 815 SER N 1 1 9 6591 1 1 36 SER O O 5.830 3.506 4.471 1.00 . A A . 815 SER O 1 1 9 6592 1 1 36 SER OG O 8.686 3.080 5.134 1.00 . A A . 815 SER OG 1 1 9 6593 1 1 37 LYS C C 5.525 5.923 2.288 1.00 . A A . 816 LYS C 1 1 9 6594 1 1 37 LYS CA C 4.721 5.923 3.594 1.00 . A A . 816 LYS CA 1 1 9 6595 1 1 37 LYS CB C 3.984 7.255 3.749 1.00 . A A . 816 LYS CB 1 1 9 6596 1 1 37 LYS CD C 1.715 6.311 4.236 1.00 . A A . 816 LYS CD 1 1 9 6597 1 1 37 LYS CE C 0.229 6.448 3.977 1.00 . A A . 816 LYS CE 1 1 9 6598 1 1 37 LYS CG C 2.528 7.216 3.326 1.00 . A A . 816 LYS CG 1 1 9 6599 1 1 37 LYS H H 5.852 6.517 5.285 1.00 . A A . 816 LYS H 1 1 9 6600 1 1 37 LYS HA H 4.001 5.109 3.576 1.00 . A A . 816 LYS HA 1 1 9 6601 1 1 37 LYS HB2 H 4.023 7.550 4.787 1.00 . A A . 816 LYS HB2 1 1 9 6602 1 1 37 LYS HB3 H 4.488 8.004 3.156 1.00 . A A . 816 LYS HB3 1 1 9 6603 1 1 37 LYS HD2 H 2.007 5.286 4.063 1.00 . A A . 816 LYS HD2 1 1 9 6604 1 1 37 LYS HD3 H 1.918 6.576 5.263 1.00 . A A . 816 LYS HD3 1 1 9 6605 1 1 37 LYS HE2 H 0.040 6.263 2.930 1.00 . A A . 816 LYS HE2 1 1 9 6606 1 1 37 LYS HE3 H -0.297 5.717 4.572 1.00 . A A . 816 LYS HE3 1 1 9 6607 1 1 37 LYS HG2 H 2.122 8.215 3.372 1.00 . A A . 816 LYS HG2 1 1 9 6608 1 1 37 LYS HG3 H 2.465 6.844 2.313 1.00 . A A . 816 LYS HG3 1 1 9 6609 1 1 37 LYS HZ1 H 0.009 8.057 5.293 1.00 . A A . 816 LYS HZ1 1 1 9 6610 1 1 37 LYS HZ2 H -1.316 7.825 4.262 1.00 . A A . 816 LYS HZ2 1 1 9 6611 1 1 37 LYS HZ3 H 0.113 8.514 3.662 1.00 . A A . 816 LYS HZ3 1 1 9 6612 1 1 37 LYS N N 5.611 5.730 4.737 1.00 . A A . 816 LYS N 1 1 9 6613 1 1 37 LYS NZ N -0.273 7.804 4.322 1.00 . A A . 816 LYS NZ 1 1 9 6614 1 1 37 LYS O O 5.033 6.326 1.237 1.00 . A A . 816 LYS O 1 1 9 6615 1 1 38 ARG C C 7.727 4.154 0.573 1.00 . A A . 817 ARG C 1 1 9 6616 1 1 38 ARG CA C 7.718 5.493 1.283 1.00 . A A . 817 ARG CA 1 1 9 6617 1 1 38 ARG CB C 9.117 5.779 1.835 1.00 . A A . 817 ARG CB 1 1 9 6618 1 1 38 ARG CD C 10.623 7.387 3.045 1.00 . A A . 817 ARG CD 1 1 9 6619 1 1 38 ARG CG C 9.196 7.069 2.633 1.00 . A A . 817 ARG CG 1 1 9 6620 1 1 38 ARG CZ C 12.370 8.695 1.894 1.00 . A A . 817 ARG CZ 1 1 9 6621 1 1 38 ARG H H 7.068 5.084 3.223 1.00 . A A . 817 ARG H 1 1 9 6622 1 1 38 ARG HA H 7.488 6.258 0.556 1.00 . A A . 817 ARG HA 1 1 9 6623 1 1 38 ARG HB2 H 9.412 4.963 2.478 1.00 . A A . 817 ARG HB2 1 1 9 6624 1 1 38 ARG HB3 H 9.813 5.848 1.012 1.00 . A A . 817 ARG HB3 1 1 9 6625 1 1 38 ARG HD2 H 10.610 8.226 3.726 1.00 . A A . 817 ARG HD2 1 1 9 6626 1 1 38 ARG HD3 H 11.041 6.524 3.546 1.00 . A A . 817 ARG HD3 1 1 9 6627 1 1 38 ARG HE H 11.336 7.189 1.075 1.00 . A A . 817 ARG HE 1 1 9 6628 1 1 38 ARG HG2 H 8.820 7.880 2.027 1.00 . A A . 817 ARG HG2 1 1 9 6629 1 1 38 ARG HG3 H 8.589 6.971 3.520 1.00 . A A . 817 ARG HG3 1 1 9 6630 1 1 38 ARG HH11 H 12.033 9.262 3.816 1.00 . A A . 817 ARG HH11 1 1 9 6631 1 1 38 ARG HH12 H 13.257 10.167 2.971 1.00 . A A . 817 ARG HH12 1 1 9 6632 1 1 38 ARG HH21 H 12.941 8.366 -0.019 1.00 . A A . 817 ARG HH21 1 1 9 6633 1 1 38 ARG HH22 H 13.766 9.667 0.788 1.00 . A A . 817 ARG HH22 1 1 9 6634 1 1 38 ARG N N 6.769 5.480 2.383 1.00 . A A . 817 ARG N 1 1 9 6635 1 1 38 ARG NE N 11.461 7.720 1.895 1.00 . A A . 817 ARG NE 1 1 9 6636 1 1 38 ARG NH1 N 12.568 9.432 2.979 1.00 . A A . 817 ARG NH1 1 1 9 6637 1 1 38 ARG NH2 N 13.085 8.927 0.802 1.00 . A A . 817 ARG NH2 1 1 9 6638 1 1 38 ARG O O 7.853 4.087 -0.651 1.00 . A A . 817 ARG O 1 1 9 6639 1 1 39 PHE C C 6.455 0.965 1.272 1.00 . A A . 818 PHE C 1 1 9 6640 1 1 39 PHE CA C 7.653 1.757 0.803 1.00 . A A . 818 PHE CA 1 1 9 6641 1 1 39 PHE CB C 8.939 1.071 1.274 1.00 . A A . 818 PHE CB 1 1 9 6642 1 1 39 PHE CD1 C 10.641 2.019 -0.307 1.00 . A A . 818 PHE CD1 1 1 9 6643 1 1 39 PHE CD2 C 10.861 2.499 2.019 1.00 . A A . 818 PHE CD2 1 1 9 6644 1 1 39 PHE CE1 C 11.770 2.770 -0.570 1.00 . A A . 818 PHE CE1 1 1 9 6645 1 1 39 PHE CE2 C 11.988 3.253 1.761 1.00 . A A . 818 PHE CE2 1 1 9 6646 1 1 39 PHE CG C 10.176 1.873 0.990 1.00 . A A . 818 PHE CG 1 1 9 6647 1 1 39 PHE CZ C 12.442 3.390 0.464 1.00 . A A . 818 PHE CZ 1 1 9 6648 1 1 39 PHE H H 7.417 3.186 2.300 1.00 . A A . 818 PHE H 1 1 9 6649 1 1 39 PHE HA H 7.669 1.815 -0.274 1.00 . A A . 818 PHE HA 1 1 9 6650 1 1 39 PHE HB2 H 8.883 0.909 2.340 1.00 . A A . 818 PHE HB2 1 1 9 6651 1 1 39 PHE HB3 H 9.035 0.118 0.776 1.00 . A A . 818 PHE HB3 1 1 9 6652 1 1 39 PHE HD1 H 10.114 1.535 -1.117 1.00 . A A . 818 PHE HD1 1 1 9 6653 1 1 39 PHE HD2 H 10.507 2.391 3.035 1.00 . A A . 818 PHE HD2 1 1 9 6654 1 1 39 PHE HE1 H 12.123 2.874 -1.585 1.00 . A A . 818 PHE HE1 1 1 9 6655 1 1 39 PHE HE2 H 12.513 3.735 2.572 1.00 . A A . 818 PHE HE2 1 1 9 6656 1 1 39 PHE HZ H 13.324 3.979 0.261 1.00 . A A . 818 PHE HZ 1 1 9 6657 1 1 39 PHE N N 7.587 3.086 1.342 1.00 . A A . 818 PHE N 1 1 9 6658 1 1 39 PHE O O 5.755 1.375 2.197 1.00 . A A . 818 PHE O 1 1 9 6659 1 1 40 CYS C C 5.848 -1.763 2.392 1.00 . A A . 819 CYS C 1 1 9 6660 1 1 40 CYS CA C 5.281 -1.134 1.106 1.00 . A A . 819 CYS CA 1 1 9 6661 1 1 40 CYS CB C 4.952 -2.129 -0.018 1.00 . A A . 819 CYS CB 1 1 9 6662 1 1 40 CYS H H 6.777 -0.383 -0.132 1.00 . A A . 819 CYS H 1 1 9 6663 1 1 40 CYS HA H 4.385 -0.620 1.424 1.00 . A A . 819 CYS HA 1 1 9 6664 1 1 40 CYS HB2 H 4.593 -3.044 0.404 1.00 . A A . 819 CYS HB2 1 1 9 6665 1 1 40 CYS HB3 H 4.179 -1.705 -0.644 1.00 . A A . 819 CYS HB3 1 1 9 6666 1 1 40 CYS N N 6.221 -0.151 0.627 1.00 . A A . 819 CYS N 1 1 9 6667 1 1 40 CYS O O 6.681 -1.149 3.050 1.00 . A A . 819 CYS O 1 1 9 6668 1 1 40 CYS SG S 6.355 -2.530 -1.090 1.00 . A A . 819 CYS SG 1 1 9 6669 1 1 41 SER C C 7.001 -3.746 4.522 1.00 . A A . 820 SER C 1 1 9 6670 1 1 41 SER CA C 5.537 -3.449 4.119 1.00 . A A . 820 SER CA 1 1 9 6671 1 1 41 SER CB C 4.653 -4.684 4.241 1.00 . A A . 820 SER CB 1 1 9 6672 1 1 41 SER H H 5.066 -3.560 2.071 1.00 . A A . 820 SER H 1 1 9 6673 1 1 41 SER HA H 5.158 -2.701 4.797 1.00 . A A . 820 SER HA 1 1 9 6674 1 1 41 SER HB2 H 4.856 -5.187 5.175 1.00 . A A . 820 SER HB2 1 1 9 6675 1 1 41 SER HB3 H 3.613 -4.376 4.208 1.00 . A A . 820 SER HB3 1 1 9 6676 1 1 41 SER HG H 4.311 -6.348 3.249 1.00 . A A . 820 SER HG 1 1 9 6677 1 1 41 SER N N 5.404 -2.955 2.754 1.00 . A A . 820 SER N 1 1 9 6678 1 1 41 SER O O 7.880 -2.892 4.399 1.00 . A A . 820 SER O 1 1 9 6679 1 1 41 SER OG O 4.897 -5.579 3.165 1.00 . A A . 820 SER OG 1 1 9 6680 1 1 42 MET C C 9.668 -5.435 4.628 1.00 . A A . 821 MET C 1 1 9 6681 1 1 42 MET CA C 8.574 -5.182 5.639 1.00 . A A . 821 MET CA 1 1 9 6682 1 1 42 MET CB C 8.486 -6.361 6.603 1.00 . A A . 821 MET CB 1 1 9 6683 1 1 42 MET CE C 9.786 -3.908 8.448 1.00 . A A . 821 MET CE 1 1 9 6684 1 1 42 MET CG C 7.958 -5.981 7.975 1.00 . A A . 821 MET CG 1 1 9 6685 1 1 42 MET H H 6.653 -5.684 4.881 1.00 . A A . 821 MET H 1 1 9 6686 1 1 42 MET HA H 8.814 -4.300 6.213 1.00 . A A . 821 MET HA 1 1 9 6687 1 1 42 MET HB2 H 7.829 -7.108 6.183 1.00 . A A . 821 MET HB2 1 1 9 6688 1 1 42 MET HB3 H 9.471 -6.786 6.724 1.00 . A A . 821 MET HB3 1 1 9 6689 1 1 42 MET HE1 H 10.492 -3.443 9.120 1.00 . A A . 821 MET HE1 1 1 9 6690 1 1 42 MET HE2 H 8.930 -3.263 8.324 1.00 . A A . 821 MET HE2 1 1 9 6691 1 1 42 MET HE3 H 10.257 -4.073 7.490 1.00 . A A . 821 MET HE3 1 1 9 6692 1 1 42 MET HG2 H 7.277 -5.155 7.855 1.00 . A A . 821 MET HG2 1 1 9 6693 1 1 42 MET HG3 H 7.431 -6.826 8.391 1.00 . A A . 821 MET HG3 1 1 9 6694 1 1 42 MET N N 7.291 -4.945 4.992 1.00 . A A . 821 MET N 1 1 9 6695 1 1 42 MET O O 10.646 -4.693 4.575 1.00 . A A . 821 MET O 1 1 9 6696 1 1 42 MET SD S 9.256 -5.480 9.133 1.00 . A A . 821 MET SD 1 1 9 6697 1 1 43 THR C C 11.010 -5.669 2.033 1.00 . A A . 822 THR C 1 1 9 6698 1 1 43 THR CA C 10.461 -6.863 2.817 1.00 . A A . 822 THR CA 1 1 9 6699 1 1 43 THR CB C 9.836 -7.867 1.831 1.00 . A A . 822 THR CB 1 1 9 6700 1 1 43 THR CG2 C 10.874 -8.400 0.854 1.00 . A A . 822 THR CG2 1 1 9 6701 1 1 43 THR H H 8.657 -6.999 3.916 1.00 . A A . 822 THR H 1 1 9 6702 1 1 43 THR HA H 11.291 -7.350 3.309 1.00 . A A . 822 THR HA 1 1 9 6703 1 1 43 THR HB H 9.064 -7.360 1.268 1.00 . A A . 822 THR HB 1 1 9 6704 1 1 43 THR HG1 H 9.882 -9.693 2.591 1.00 . A A . 822 THR HG1 1 1 9 6705 1 1 43 THR HG21 H 11.287 -7.579 0.287 1.00 . A A . 822 THR HG21 1 1 9 6706 1 1 43 THR HG22 H 10.406 -9.104 0.181 1.00 . A A . 822 THR HG22 1 1 9 6707 1 1 43 THR HG23 H 11.664 -8.893 1.401 1.00 . A A . 822 THR HG23 1 1 9 6708 1 1 43 THR N N 9.480 -6.462 3.817 1.00 . A A . 822 THR N 1 1 9 6709 1 1 43 THR O O 12.224 -5.520 1.899 1.00 . A A . 822 THR O 1 1 9 6710 1 1 43 THR OG1 O 9.250 -8.960 2.551 1.00 . A A . 822 THR OG1 1 1 9 6711 1 1 44 CYS C C 11.296 -2.635 1.436 1.00 . A A . 823 CYS C 1 1 9 6712 1 1 44 CYS CA C 10.573 -3.734 0.665 1.00 . A A . 823 CYS CA 1 1 9 6713 1 1 44 CYS CB C 9.419 -3.157 -0.126 1.00 . A A . 823 CYS CB 1 1 9 6714 1 1 44 CYS H H 9.186 -4.898 1.750 1.00 . A A . 823 CYS H 1 1 9 6715 1 1 44 CYS HA H 11.282 -4.167 -0.023 1.00 . A A . 823 CYS HA 1 1 9 6716 1 1 44 CYS HB2 H 8.757 -3.957 -0.426 1.00 . A A . 823 CYS HB2 1 1 9 6717 1 1 44 CYS HB3 H 8.876 -2.458 0.493 1.00 . A A . 823 CYS HB3 1 1 9 6718 1 1 44 CYS N N 10.134 -4.813 1.531 1.00 . A A . 823 CYS N 1 1 9 6719 1 1 44 CYS O O 12.350 -2.167 1.001 1.00 . A A . 823 CYS O 1 1 9 6720 1 1 44 CYS SG S 9.956 -2.286 -1.613 1.00 . A A . 823 CYS SG 1 1 9 6721 1 1 45 ALA C C 12.792 -1.769 3.822 1.00 . A A . 824 ALA C 1 1 9 6722 1 1 45 ALA CA C 11.419 -1.238 3.410 1.00 . A A . 824 ALA CA 1 1 9 6723 1 1 45 ALA CB C 10.574 -0.902 4.628 1.00 . A A . 824 ALA CB 1 1 9 6724 1 1 45 ALA H H 9.869 -2.554 2.869 1.00 . A A . 824 ALA H 1 1 9 6725 1 1 45 ALA HA H 11.552 -0.333 2.833 1.00 . A A . 824 ALA HA 1 1 9 6726 1 1 45 ALA HB1 H 11.071 -0.142 5.213 1.00 . A A . 824 ALA HB1 1 1 9 6727 1 1 45 ALA HB2 H 10.439 -1.788 5.227 1.00 . A A . 824 ALA HB2 1 1 9 6728 1 1 45 ALA HB3 H 9.610 -0.533 4.303 1.00 . A A . 824 ALA HB3 1 1 9 6729 1 1 45 ALA N N 10.740 -2.207 2.572 1.00 . A A . 824 ALA N 1 1 9 6730 1 1 45 ALA O O 13.764 -1.011 3.888 1.00 . A A . 824 ALA O 1 1 9 6731 1 1 46 LYS C C 15.088 -3.661 3.181 1.00 . A A . 825 LYS C 1 1 9 6732 1 1 46 LYS CA C 14.161 -3.709 4.394 1.00 . A A . 825 LYS CA 1 1 9 6733 1 1 46 LYS CB C 13.974 -5.175 4.808 1.00 . A A . 825 LYS CB 1 1 9 6734 1 1 46 LYS CD C 13.428 -4.420 7.156 1.00 . A A . 825 LYS CD 1 1 9 6735 1 1 46 LYS CE C 14.871 -4.569 7.617 1.00 . A A . 825 LYS CE 1 1 9 6736 1 1 46 LYS CG C 13.088 -5.380 6.030 1.00 . A A . 825 LYS CG 1 1 9 6737 1 1 46 LYS H H 12.051 -3.622 4.163 1.00 . A A . 825 LYS H 1 1 9 6738 1 1 46 LYS HA H 14.570 -3.168 5.233 1.00 . A A . 825 LYS HA 1 1 9 6739 1 1 46 LYS HB2 H 13.534 -5.714 3.982 1.00 . A A . 825 LYS HB2 1 1 9 6740 1 1 46 LYS HB3 H 14.946 -5.600 5.021 1.00 . A A . 825 LYS HB3 1 1 9 6741 1 1 46 LYS HD2 H 13.272 -3.411 6.804 1.00 . A A . 825 LYS HD2 1 1 9 6742 1 1 46 LYS HD3 H 12.768 -4.616 7.988 1.00 . A A . 825 LYS HD3 1 1 9 6743 1 1 46 LYS HE2 H 15.523 -4.383 6.777 1.00 . A A . 825 LYS HE2 1 1 9 6744 1 1 46 LYS HE3 H 15.065 -3.839 8.389 1.00 . A A . 825 LYS HE3 1 1 9 6745 1 1 46 LYS HG2 H 12.058 -5.228 5.743 1.00 . A A . 825 LYS HG2 1 1 9 6746 1 1 46 LYS HG3 H 13.214 -6.393 6.385 1.00 . A A . 825 LYS HG3 1 1 9 6747 1 1 46 LYS HZ1 H 15.037 -6.647 7.407 1.00 . A A . 825 LYS HZ1 1 1 9 6748 1 1 46 LYS HZ2 H 14.511 -6.151 8.939 1.00 . A A . 825 LYS HZ2 1 1 9 6749 1 1 46 LYS HZ3 H 16.138 -5.970 8.507 1.00 . A A . 825 LYS HZ3 1 1 9 6750 1 1 46 LYS N N 12.875 -3.079 4.096 1.00 . A A . 825 LYS N 1 1 9 6751 1 1 46 LYS NZ N 15.157 -5.926 8.153 1.00 . A A . 825 LYS NZ 1 1 9 6752 1 1 46 LYS O O 16.303 -3.496 3.305 1.00 . A A . 825 LYS O 1 1 9 6753 1 1 47 ARG C C 15.859 -2.600 0.365 1.00 . A A . 826 ARG C 1 1 9 6754 1 1 47 ARG CA C 15.197 -3.919 0.741 1.00 . A A . 826 ARG CA 1 1 9 6755 1 1 47 ARG CB C 14.223 -4.347 -0.365 1.00 . A A . 826 ARG CB 1 1 9 6756 1 1 47 ARG CD C 15.948 -5.600 -1.709 1.00 . A A . 826 ARG CD 1 1 9 6757 1 1 47 ARG CG C 14.873 -4.527 -1.730 1.00 . A A . 826 ARG CG 1 1 9 6758 1 1 47 ARG CZ C 17.403 -6.717 -3.365 1.00 . A A . 826 ARG CZ 1 1 9 6759 1 1 47 ARG H H 13.498 -3.884 1.996 1.00 . A A . 826 ARG H 1 1 9 6760 1 1 47 ARG HA H 15.949 -4.689 0.837 1.00 . A A . 826 ARG HA 1 1 9 6761 1 1 47 ARG HB2 H 13.767 -5.284 -0.084 1.00 . A A . 826 ARG HB2 1 1 9 6762 1 1 47 ARG HB3 H 13.451 -3.596 -0.457 1.00 . A A . 826 ARG HB3 1 1 9 6763 1 1 47 ARG HD2 H 16.639 -5.381 -0.911 1.00 . A A . 826 ARG HD2 1 1 9 6764 1 1 47 ARG HD3 H 15.482 -6.558 -1.528 1.00 . A A . 826 ARG HD3 1 1 9 6765 1 1 47 ARG HE H 16.655 -4.867 -3.551 1.00 . A A . 826 ARG HE 1 1 9 6766 1 1 47 ARG HG2 H 14.114 -4.811 -2.442 1.00 . A A . 826 ARG HG2 1 1 9 6767 1 1 47 ARG HG3 H 15.318 -3.590 -2.031 1.00 . A A . 826 ARG HG3 1 1 9 6768 1 1 47 ARG HH11 H 17.002 -7.829 -1.712 1.00 . A A . 826 ARG HH11 1 1 9 6769 1 1 47 ARG HH12 H 18.016 -8.599 -2.905 1.00 . A A . 826 ARG HH12 1 1 9 6770 1 1 47 ARG HH21 H 18.031 -5.854 -5.092 1.00 . A A . 826 ARG HH21 1 1 9 6771 1 1 47 ARG HH22 H 18.588 -7.480 -4.825 1.00 . A A . 826 ARG HH22 1 1 9 6772 1 1 47 ARG N N 14.480 -3.816 2.007 1.00 . A A . 826 ARG N 1 1 9 6773 1 1 47 ARG NE N 16.689 -5.661 -2.970 1.00 . A A . 826 ARG NE 1 1 9 6774 1 1 47 ARG NH1 N 17.479 -7.798 -2.600 1.00 . A A . 826 ARG NH1 1 1 9 6775 1 1 47 ARG NH2 N 18.062 -6.683 -4.517 1.00 . A A . 826 ARG NH2 1 1 9 6776 1 1 47 ARG O O 16.839 -2.579 -0.379 1.00 . A A . 826 ARG O 1 1 9 6777 1 1 48 TYR C C 17.369 -0.173 1.143 1.00 . A A . 827 TYR C 1 1 9 6778 1 1 48 TYR CA C 15.919 -0.187 0.664 1.00 . A A . 827 TYR CA 1 1 9 6779 1 1 48 TYR CB C 15.120 0.876 1.423 1.00 . A A . 827 TYR CB 1 1 9 6780 1 1 48 TYR CD1 C 15.711 2.957 0.113 1.00 . A A . 827 TYR CD1 1 1 9 6781 1 1 48 TYR CD2 C 16.258 2.895 2.435 1.00 . A A . 827 TYR CD2 1 1 9 6782 1 1 48 TYR CE1 C 16.245 4.228 0.019 1.00 . A A . 827 TYR CE1 1 1 9 6783 1 1 48 TYR CE2 C 16.793 4.165 2.347 1.00 . A A . 827 TYR CE2 1 1 9 6784 1 1 48 TYR CG C 15.711 2.269 1.320 1.00 . A A . 827 TYR CG 1 1 9 6785 1 1 48 TYR CZ C 16.803 4.816 1.124 1.00 . A A . 827 TYR CZ 1 1 9 6786 1 1 48 TYR H H 14.457 -1.558 1.345 1.00 . A A . 827 TYR H 1 1 9 6787 1 1 48 TYR HA H 15.843 0.040 -0.390 1.00 . A A . 827 TYR HA 1 1 9 6788 1 1 48 TYR HB2 H 14.115 0.913 1.019 1.00 . A A . 827 TYR HB2 1 1 9 6789 1 1 48 TYR HB3 H 15.074 0.607 2.469 1.00 . A A . 827 TYR HB3 1 1 9 6790 1 1 48 TYR HD1 H 15.288 2.484 -0.763 1.00 . A A . 827 TYR HD1 1 1 9 6791 1 1 48 TYR HD2 H 16.265 2.373 3.382 1.00 . A A . 827 TYR HD2 1 1 9 6792 1 1 48 TYR HE1 H 16.236 4.747 -0.927 1.00 . A A . 827 TYR HE1 1 1 9 6793 1 1 48 TYR HE2 H 17.214 4.634 3.223 1.00 . A A . 827 TYR HE2 1 1 9 6794 1 1 48 TYR HH H 16.681 6.678 0.631 1.00 . A A . 827 TYR HH 1 1 9 6795 1 1 48 TYR N N 15.322 -1.498 0.881 1.00 . A A . 827 TYR N 1 1 9 6796 1 1 48 TYR O O 18.208 0.563 0.619 1.00 . A A . 827 TYR O 1 1 9 6797 1 1 48 TYR OH O 17.321 6.089 1.052 1.00 . A A . 827 TYR OH 1 1 9 6798 1 1 49 ASN C C 19.354 0.160 3.417 1.00 . A A . 828 ASN C 1 1 9 6799 1 1 49 ASN CA C 18.954 -1.144 2.752 1.00 . A A . 828 ASN CA 1 1 9 6800 1 1 49 ASN CB C 20.002 -1.566 1.720 1.00 . A A . 828 ASN CB 1 1 9 6801 1 1 49 ASN CG C 19.725 -2.935 1.132 1.00 . A A . 828 ASN CG 1 1 9 6802 1 1 49 ASN H H 16.910 -1.584 2.478 1.00 . A A . 828 ASN H 1 1 9 6803 1 1 49 ASN HA H 18.886 -1.909 3.513 1.00 . A A . 828 ASN HA 1 1 9 6804 1 1 49 ASN HB2 H 20.014 -0.847 0.915 1.00 . A A . 828 ASN HB2 1 1 9 6805 1 1 49 ASN HB3 H 20.974 -1.587 2.190 1.00 . A A . 828 ASN HB3 1 1 9 6806 1 1 49 ASN HD21 H 18.952 -3.552 2.852 1.00 . A A . 828 ASN HD21 1 1 9 6807 1 1 49 ASN HD22 H 18.951 -4.712 1.572 1.00 . A A . 828 ASN HD22 1 1 9 6808 1 1 49 ASN N N 17.636 -1.018 2.141 1.00 . A A . 828 ASN N 1 1 9 6809 1 1 49 ASN ND2 N 19.155 -3.824 1.933 1.00 . A A . 828 ASN ND2 1 1 9 6810 1 1 49 ASN O O 18.599 0.615 4.298 1.00 . A A . 828 ASN O 1 1 9 6811 1 1 49 ASN OXT O 20.416 0.718 3.064 1.00 . A A . 828 ASN OXT 1 1 9 6812 1 1 49 ASN OD1 O 20.034 -3.197 -0.030 1.00 . A A . 828 ASN OD1 1 1 9 6813 2 2 1 ZN ZN ZN 8.017 -2.368 -2.602 1.00 . B A . 829 ZN ZN 1 1 10 6814 1 1 1 GLY C C -22.099 -3.422 3.551 1.00 . A A . 1 GLY C 1 1 10 6815 1 1 1 GLY CA C -22.517 -4.628 4.365 1.00 . A A . 1 GLY CA 1 1 10 6816 1 1 1 GLY H1 H -22.465 -6.710 4.264 1.00 . A A . 1 GLY H1 1 1 10 6817 1 1 1 GLY H2 H -21.235 -5.946 3.382 1.00 . A A . 1 GLY H2 1 1 10 6818 1 1 1 GLY H3 H -22.825 -5.957 2.790 1.00 . A A . 1 GLY H3 1 1 10 6819 1 1 1 GLY HA2 H -23.575 -4.562 4.567 1.00 . A A . 1 GLY HA2 1 1 10 6820 1 1 1 GLY HA3 H -21.979 -4.625 5.303 1.00 . A A . 1 GLY HA3 1 1 10 6821 1 1 1 GLY N N -22.243 -5.897 3.652 1.00 . A A . 1 GLY N 1 1 10 6822 1 1 1 GLY O O -22.609 -3.198 2.450 1.00 . A A . 1 GLY O 1 1 10 6823 1 1 2 THR C C -19.625 -1.850 2.355 1.00 . A A . 2 THR C 1 1 10 6824 1 1 2 THR CA C -20.671 -1.468 3.400 1.00 . A A . 2 THR CA 1 1 10 6825 1 1 2 THR CB C -20.057 -0.467 4.399 1.00 . A A . 2 THR CB 1 1 10 6826 1 1 2 THR CG2 C -19.731 0.857 3.717 1.00 . A A . 2 THR CG2 1 1 10 6827 1 1 2 THR H H -20.785 -2.888 4.961 1.00 . A A . 2 THR H 1 1 10 6828 1 1 2 THR HA H -21.508 -0.993 2.906 1.00 . A A . 2 THR HA 1 1 10 6829 1 1 2 THR HB H -19.144 -0.889 4.790 1.00 . A A . 2 THR HB 1 1 10 6830 1 1 2 THR HG1 H -21.783 -0.746 5.345 1.00 . A A . 2 THR HG1 1 1 10 6831 1 1 2 THR HG21 H -18.996 0.692 2.943 1.00 . A A . 2 THR HG21 1 1 10 6832 1 1 2 THR HG22 H -19.337 1.549 4.445 1.00 . A A . 2 THR HG22 1 1 10 6833 1 1 2 THR HG23 H -20.629 1.269 3.278 1.00 . A A . 2 THR HG23 1 1 10 6834 1 1 2 THR N N -21.163 -2.650 4.081 1.00 . A A . 2 THR N 1 1 10 6835 1 1 2 THR O O -18.468 -2.120 2.687 1.00 . A A . 2 THR O 1 1 10 6836 1 1 2 THR OG1 O -20.968 -0.233 5.484 1.00 . A A . 2 THR OG1 1 1 10 6837 1 1 3 ARG C C -18.996 -1.087 -0.949 1.00 . A A . 3 ARG C 1 1 10 6838 1 1 3 ARG CA C -19.154 -2.262 0.007 1.00 . A A . 3 ARG CA 1 1 10 6839 1 1 3 ARG CB C -19.708 -3.469 -0.752 1.00 . A A . 3 ARG CB 1 1 10 6840 1 1 3 ARG CD C -20.474 -5.860 -0.698 1.00 . A A . 3 ARG CD 1 1 10 6841 1 1 3 ARG CG C -20.023 -4.667 0.130 1.00 . A A . 3 ARG CG 1 1 10 6842 1 1 3 ARG CZ C -21.645 -5.800 -2.871 1.00 . A A . 3 ARG CZ 1 1 10 6843 1 1 3 ARG H H -20.979 -1.681 0.899 1.00 . A A . 3 ARG H 1 1 10 6844 1 1 3 ARG HA H -18.191 -2.512 0.424 1.00 . A A . 3 ARG HA 1 1 10 6845 1 1 3 ARG HB2 H -20.618 -3.175 -1.256 1.00 . A A . 3 ARG HB2 1 1 10 6846 1 1 3 ARG HB3 H -18.984 -3.776 -1.491 1.00 . A A . 3 ARG HB3 1 1 10 6847 1 1 3 ARG HD2 H -19.649 -6.190 -1.310 1.00 . A A . 3 ARG HD2 1 1 10 6848 1 1 3 ARG HD3 H -20.768 -6.655 -0.029 1.00 . A A . 3 ARG HD3 1 1 10 6849 1 1 3 ARG HE H -22.378 -5.072 -1.149 1.00 . A A . 3 ARG HE 1 1 10 6850 1 1 3 ARG HG2 H -19.135 -4.939 0.681 1.00 . A A . 3 ARG HG2 1 1 10 6851 1 1 3 ARG HG3 H -20.810 -4.399 0.819 1.00 . A A . 3 ARG HG3 1 1 10 6852 1 1 3 ARG HH11 H -19.860 -6.771 -2.896 1.00 . A A . 3 ARG HH11 1 1 10 6853 1 1 3 ARG HH12 H -20.674 -6.665 -4.433 1.00 . A A . 3 ARG HH12 1 1 10 6854 1 1 3 ARG HH21 H -23.467 -4.959 -3.159 1.00 . A A . 3 ARG HH21 1 1 10 6855 1 1 3 ARG HH22 H -22.723 -5.621 -4.582 1.00 . A A . 3 ARG HH22 1 1 10 6856 1 1 3 ARG N N -20.044 -1.900 1.100 1.00 . A A . 3 ARG N 1 1 10 6857 1 1 3 ARG NE N -21.604 -5.530 -1.566 1.00 . A A . 3 ARG NE 1 1 10 6858 1 1 3 ARG NH1 N -20.649 -6.464 -3.447 1.00 . A A . 3 ARG NH1 1 1 10 6859 1 1 3 ARG NH2 N -22.697 -5.433 -3.593 1.00 . A A . 3 ARG NH2 1 1 10 6860 1 1 3 ARG O O -19.865 -0.213 -1.021 1.00 . A A . 3 ARG O 1 1 10 6861 1 1 4 GLY C C -18.505 -0.245 -3.898 1.00 . A A . 783 GLY C 1 1 10 6862 1 1 4 GLY CA C -17.663 -0.029 -2.657 1.00 . A A . 783 GLY CA 1 1 10 6863 1 1 4 GLY H H -17.198 -1.754 -1.523 1.00 . A A . 783 GLY H 1 1 10 6864 1 1 4 GLY HA2 H -17.913 0.928 -2.223 1.00 . A A . 783 GLY HA2 1 1 10 6865 1 1 4 GLY HA3 H -16.619 -0.028 -2.937 1.00 . A A . 783 GLY HA3 1 1 10 6866 1 1 4 GLY N N -17.885 -1.062 -1.669 1.00 . A A . 783 GLY N 1 1 10 6867 1 1 4 GLY O O -18.183 -1.089 -4.736 1.00 . A A . 783 GLY O 1 1 10 6868 1 1 5 VAL C C -20.748 1.829 -5.662 1.00 . A A . 784 VAL C 1 1 10 6869 1 1 5 VAL CA C -20.490 0.417 -5.148 1.00 . A A . 784 VAL CA 1 1 10 6870 1 1 5 VAL CB C -21.838 -0.265 -4.808 1.00 . A A . 784 VAL CB 1 1 10 6871 1 1 5 VAL CG1 C -22.681 -0.455 -6.062 1.00 . A A . 784 VAL CG1 1 1 10 6872 1 1 5 VAL CG2 C -21.617 -1.601 -4.111 1.00 . A A . 784 VAL CG2 1 1 10 6873 1 1 5 VAL H H -19.834 1.097 -3.256 1.00 . A A . 784 VAL H 1 1 10 6874 1 1 5 VAL HA H -19.992 -0.156 -5.919 1.00 . A A . 784 VAL HA 1 1 10 6875 1 1 5 VAL HB H -22.381 0.380 -4.134 1.00 . A A . 784 VAL HB 1 1 10 6876 1 1 5 VAL HG11 H -22.917 0.510 -6.489 1.00 . A A . 784 VAL HG11 1 1 10 6877 1 1 5 VAL HG12 H -23.596 -0.968 -5.808 1.00 . A A . 784 VAL HG12 1 1 10 6878 1 1 5 VAL HG13 H -22.129 -1.041 -6.783 1.00 . A A . 784 VAL HG13 1 1 10 6879 1 1 5 VAL HG21 H -22.571 -2.041 -3.859 1.00 . A A . 784 VAL HG21 1 1 10 6880 1 1 5 VAL HG22 H -21.041 -1.446 -3.209 1.00 . A A . 784 VAL HG22 1 1 10 6881 1 1 5 VAL HG23 H -21.077 -2.267 -4.771 1.00 . A A . 784 VAL HG23 1 1 10 6882 1 1 5 VAL N N -19.607 0.485 -3.990 1.00 . A A . 784 VAL N 1 1 10 6883 1 1 5 VAL O O -21.798 2.417 -5.389 1.00 . A A . 784 VAL O 1 1 10 6884 1 1 6 ASP C C -20.096 4.706 -5.686 1.00 . A A . 785 ASP C 1 1 10 6885 1 1 6 ASP CA C -19.808 3.763 -6.845 1.00 . A A . 785 ASP CA 1 1 10 6886 1 1 6 ASP CB C -20.842 3.961 -7.959 1.00 . A A . 785 ASP CB 1 1 10 6887 1 1 6 ASP CG C -20.322 3.523 -9.308 1.00 . A A . 785 ASP CG 1 1 10 6888 1 1 6 ASP H H -18.990 1.817 -6.623 1.00 . A A . 785 ASP H 1 1 10 6889 1 1 6 ASP HA H -18.829 3.998 -7.241 1.00 . A A . 785 ASP HA 1 1 10 6890 1 1 6 ASP HB2 H -21.726 3.384 -7.729 1.00 . A A . 785 ASP HB2 1 1 10 6891 1 1 6 ASP HB3 H -21.105 5.008 -8.014 1.00 . A A . 785 ASP HB3 1 1 10 6892 1 1 6 ASP N N -19.768 2.373 -6.384 1.00 . A A . 785 ASP N 1 1 10 6893 1 1 6 ASP O O -20.867 5.660 -5.814 1.00 . A A . 785 ASP O 1 1 10 6894 1 1 6 ASP OD1 O -19.430 4.209 -9.857 1.00 . A A . 785 ASP OD1 1 1 10 6895 1 1 6 ASP OD2 O -20.799 2.497 -9.833 1.00 . A A . 785 ASP OD2 1 1 10 6896 1 1 7 SER C C -19.041 6.593 -3.529 1.00 . A A . 786 SER C 1 1 10 6897 1 1 7 SER CA C -19.656 5.206 -3.349 1.00 . A A . 786 SER CA 1 1 10 6898 1 1 7 SER CB C -19.002 4.482 -2.170 1.00 . A A . 786 SER CB 1 1 10 6899 1 1 7 SER H H -18.883 3.641 -4.522 1.00 . A A . 786 SER H 1 1 10 6900 1 1 7 SER HA H -20.714 5.307 -3.163 1.00 . A A . 786 SER HA 1 1 10 6901 1 1 7 SER HB2 H -17.929 4.505 -2.289 1.00 . A A . 786 SER HB2 1 1 10 6902 1 1 7 SER HB3 H -19.275 4.975 -1.250 1.00 . A A . 786 SER HB3 1 1 10 6903 1 1 7 SER HG H -19.295 2.790 -1.214 1.00 . A A . 786 SER HG 1 1 10 6904 1 1 7 SER N N -19.477 4.417 -4.552 1.00 . A A . 786 SER N 1 1 10 6905 1 1 7 SER O O -17.923 6.722 -4.026 1.00 . A A . 786 SER O 1 1 10 6906 1 1 7 SER OG O -19.427 3.126 -2.106 1.00 . A A . 786 SER OG 1 1 10 6907 1 1 8 PRO C C -18.194 9.403 -2.263 1.00 . A A . 787 PRO C 1 1 10 6908 1 1 8 PRO CA C -19.311 9.044 -3.254 1.00 . A A . 787 PRO CA 1 1 10 6909 1 1 8 PRO CB C -20.574 9.866 -2.955 1.00 . A A . 787 PRO CB 1 1 10 6910 1 1 8 PRO CD C -21.114 7.579 -2.555 1.00 . A A . 787 PRO CD 1 1 10 6911 1 1 8 PRO CG C -21.704 8.888 -2.976 1.00 . A A . 787 PRO CG 1 1 10 6912 1 1 8 PRO HA H -18.974 9.256 -4.260 1.00 . A A . 787 PRO HA 1 1 10 6913 1 1 8 PRO HB2 H -20.477 10.333 -1.986 1.00 . A A . 787 PRO HB2 1 1 10 6914 1 1 8 PRO HB3 H -20.699 10.625 -3.714 1.00 . A A . 787 PRO HB3 1 1 10 6915 1 1 8 PRO HD2 H -21.076 7.507 -1.478 1.00 . A A . 787 PRO HD2 1 1 10 6916 1 1 8 PRO HD3 H -21.672 6.755 -2.975 1.00 . A A . 787 PRO HD3 1 1 10 6917 1 1 8 PRO HG2 H -22.471 9.196 -2.280 1.00 . A A . 787 PRO HG2 1 1 10 6918 1 1 8 PRO HG3 H -22.109 8.813 -3.974 1.00 . A A . 787 PRO HG3 1 1 10 6919 1 1 8 PRO N N -19.767 7.649 -3.129 1.00 . A A . 787 PRO N 1 1 10 6920 1 1 8 PRO O O -18.020 10.567 -1.891 1.00 . A A . 787 PRO O 1 1 10 6921 1 1 9 SER C C -15.276 7.516 -1.287 1.00 . A A . 788 SER C 1 1 10 6922 1 1 9 SER CA C -16.321 8.571 -0.953 1.00 . A A . 788 SER CA 1 1 10 6923 1 1 9 SER CB C -16.779 8.443 0.503 1.00 . A A . 788 SER CB 1 1 10 6924 1 1 9 SER H H -17.647 7.496 -2.176 1.00 . A A . 788 SER H 1 1 10 6925 1 1 9 SER HA H -15.900 9.553 -1.115 1.00 . A A . 788 SER HA 1 1 10 6926 1 1 9 SER HB2 H -17.592 9.130 0.681 1.00 . A A . 788 SER HB2 1 1 10 6927 1 1 9 SER HB3 H -17.116 7.433 0.683 1.00 . A A . 788 SER HB3 1 1 10 6928 1 1 9 SER HG H -15.053 9.271 0.959 1.00 . A A . 788 SER HG 1 1 10 6929 1 1 9 SER N N -17.444 8.398 -1.851 1.00 . A A . 788 SER N 1 1 10 6930 1 1 9 SER O O -15.553 6.315 -1.226 1.00 . A A . 788 SER O 1 1 10 6931 1 1 9 SER OG O -15.728 8.740 1.406 1.00 . A A . 788 SER OG 1 1 10 6932 1 1 10 ALA C C -12.622 6.083 -1.093 1.00 . A A . 789 ALA C 1 1 10 6933 1 1 10 ALA CA C -13.029 7.103 -2.145 1.00 . A A . 789 ALA CA 1 1 10 6934 1 1 10 ALA CB C -11.823 7.924 -2.577 1.00 . A A . 789 ALA CB 1 1 10 6935 1 1 10 ALA H H -13.917 8.945 -1.607 1.00 . A A . 789 ALA H 1 1 10 6936 1 1 10 ALA HA H -13.402 6.578 -3.012 1.00 . A A . 789 ALA HA 1 1 10 6937 1 1 10 ALA HB1 H -11.066 7.267 -2.979 1.00 . A A . 789 ALA HB1 1 1 10 6938 1 1 10 ALA HB2 H -11.424 8.454 -1.726 1.00 . A A . 789 ALA HB2 1 1 10 6939 1 1 10 ALA HB3 H -12.123 8.635 -3.335 1.00 . A A . 789 ALA HB3 1 1 10 6940 1 1 10 ALA N N -14.089 7.978 -1.662 1.00 . A A . 789 ALA N 1 1 10 6941 1 1 10 ALA O O -12.252 4.965 -1.425 1.00 . A A . 789 ALA O 1 1 10 6942 1 1 11 GLU C C -13.118 4.305 1.295 1.00 . A A . 790 GLU C 1 1 10 6943 1 1 11 GLU CA C -12.333 5.609 1.293 1.00 . A A . 790 GLU CA 1 1 10 6944 1 1 11 GLU CB C -12.554 6.312 2.636 1.00 . A A . 790 GLU CB 1 1 10 6945 1 1 11 GLU CD C -12.535 8.814 2.280 1.00 . A A . 790 GLU CD 1 1 10 6946 1 1 11 GLU CG C -11.777 7.609 2.802 1.00 . A A . 790 GLU CG 1 1 10 6947 1 1 11 GLU H H -13.016 7.394 0.369 1.00 . A A . 790 GLU H 1 1 10 6948 1 1 11 GLU HA H -11.283 5.381 1.191 1.00 . A A . 790 GLU HA 1 1 10 6949 1 1 11 GLU HB2 H -13.606 6.542 2.735 1.00 . A A . 790 GLU HB2 1 1 10 6950 1 1 11 GLU HB3 H -12.270 5.638 3.431 1.00 . A A . 790 GLU HB3 1 1 10 6951 1 1 11 GLU HG2 H -11.569 7.759 3.851 1.00 . A A . 790 GLU HG2 1 1 10 6952 1 1 11 GLU HG3 H -10.846 7.525 2.260 1.00 . A A . 790 GLU HG3 1 1 10 6953 1 1 11 GLU N N -12.709 6.476 0.175 1.00 . A A . 790 GLU N 1 1 10 6954 1 1 11 GLU O O -12.655 3.297 1.828 1.00 . A A . 790 GLU O 1 1 10 6955 1 1 11 GLU OE1 O -12.604 8.997 1.048 1.00 . A A . 790 GLU OE1 1 1 10 6956 1 1 11 GLU OE2 O -13.079 9.576 3.105 1.00 . A A . 790 GLU OE2 1 1 10 6957 1 1 12 LEU C C -14.813 2.127 -0.321 1.00 . A A . 791 LEU C 1 1 10 6958 1 1 12 LEU CA C -15.175 3.156 0.743 1.00 . A A . 791 LEU CA 1 1 10 6959 1 1 12 LEU CB C -16.636 3.584 0.598 1.00 . A A . 791 LEU CB 1 1 10 6960 1 1 12 LEU CD1 C -18.585 4.922 1.419 1.00 . A A . 791 LEU CD1 1 1 10 6961 1 1 12 LEU CD2 C -17.036 3.849 3.056 1.00 . A A . 791 LEU CD2 1 1 10 6962 1 1 12 LEU CG C -17.148 4.518 1.695 1.00 . A A . 791 LEU CG 1 1 10 6963 1 1 12 LEU H H -14.572 5.107 0.181 1.00 . A A . 791 LEU H 1 1 10 6964 1 1 12 LEU HA H -15.038 2.702 1.710 1.00 . A A . 791 LEU HA 1 1 10 6965 1 1 12 LEU HB2 H -16.751 4.080 -0.355 1.00 . A A . 791 LEU HB2 1 1 10 6966 1 1 12 LEU HB3 H -17.250 2.697 0.600 1.00 . A A . 791 LEU HB3 1 1 10 6967 1 1 12 LEU HD11 H -19.207 4.040 1.400 1.00 . A A . 791 LEU HD11 1 1 10 6968 1 1 12 LEU HD12 H -18.642 5.424 0.464 1.00 . A A . 791 LEU HD12 1 1 10 6969 1 1 12 LEU HD13 H -18.926 5.586 2.197 1.00 . A A . 791 LEU HD13 1 1 10 6970 1 1 12 LEU HD21 H -17.378 4.529 3.823 1.00 . A A . 791 LEU HD21 1 1 10 6971 1 1 12 LEU HD22 H -16.005 3.585 3.243 1.00 . A A . 791 LEU HD22 1 1 10 6972 1 1 12 LEU HD23 H -17.643 2.957 3.067 1.00 . A A . 791 LEU HD23 1 1 10 6973 1 1 12 LEU HG H -16.544 5.414 1.708 1.00 . A A . 791 LEU HG 1 1 10 6974 1 1 12 LEU N N -14.294 4.312 0.688 1.00 . A A . 791 LEU N 1 1 10 6975 1 1 12 LEU O O -15.589 1.221 -0.614 1.00 . A A . 791 LEU O 1 1 10 6976 1 1 13 ASP C C -12.290 0.246 -1.114 1.00 . A A . 792 ASP C 1 1 10 6977 1 1 13 ASP CA C -13.103 1.310 -1.849 1.00 . A A . 792 ASP CA 1 1 10 6978 1 1 13 ASP CB C -12.244 2.030 -2.900 1.00 . A A . 792 ASP CB 1 1 10 6979 1 1 13 ASP CG C -11.689 1.100 -3.967 1.00 . A A . 792 ASP CG 1 1 10 6980 1 1 13 ASP H H -13.080 3.048 -0.637 1.00 . A A . 792 ASP H 1 1 10 6981 1 1 13 ASP HA H -13.940 0.837 -2.332 1.00 . A A . 792 ASP HA 1 1 10 6982 1 1 13 ASP HB2 H -12.846 2.782 -3.389 1.00 . A A . 792 ASP HB2 1 1 10 6983 1 1 13 ASP HB3 H -11.414 2.512 -2.403 1.00 . A A . 792 ASP HB3 1 1 10 6984 1 1 13 ASP N N -13.625 2.271 -0.883 1.00 . A A . 792 ASP N 1 1 10 6985 1 1 13 ASP O O -11.781 -0.702 -1.711 1.00 . A A . 792 ASP O 1 1 10 6986 1 1 13 ASP OD1 O -12.395 0.846 -4.968 1.00 . A A . 792 ASP OD1 1 1 10 6987 1 1 13 ASP OD2 O -10.546 0.616 -3.809 1.00 . A A . 792 ASP OD2 1 1 10 6988 1 1 14 LYS C C -9.958 -0.229 0.977 1.00 . A A . 793 LYS C 1 1 10 6989 1 1 14 LYS CA C -11.458 -0.470 1.099 1.00 . A A . 793 LYS CA 1 1 10 6990 1 1 14 LYS CB C -11.792 -1.946 0.856 1.00 . A A . 793 LYS CB 1 1 10 6991 1 1 14 LYS CD C -13.607 -2.009 2.592 1.00 . A A . 793 LYS CD 1 1 10 6992 1 1 14 LYS CE C -15.016 -2.474 2.918 1.00 . A A . 793 LYS CE 1 1 10 6993 1 1 14 LYS CG C -13.242 -2.302 1.147 1.00 . A A . 793 LYS CG 1 1 10 6994 1 1 14 LYS H H -12.676 1.186 0.592 1.00 . A A . 793 LYS H 1 1 10 6995 1 1 14 LYS HA H -11.750 -0.214 2.107 1.00 . A A . 793 LYS HA 1 1 10 6996 1 1 14 LYS HB2 H -11.584 -2.188 -0.175 1.00 . A A . 793 LYS HB2 1 1 10 6997 1 1 14 LYS HB3 H -11.163 -2.550 1.491 1.00 . A A . 793 LYS HB3 1 1 10 6998 1 1 14 LYS HD2 H -12.910 -2.519 3.242 1.00 . A A . 793 LYS HD2 1 1 10 6999 1 1 14 LYS HD3 H -13.543 -0.944 2.758 1.00 . A A . 793 LYS HD3 1 1 10 7000 1 1 14 LYS HE2 H -15.710 -1.953 2.275 1.00 . A A . 793 LYS HE2 1 1 10 7001 1 1 14 LYS HE3 H -15.083 -3.537 2.734 1.00 . A A . 793 LYS HE3 1 1 10 7002 1 1 14 LYS HG2 H -13.882 -1.719 0.503 1.00 . A A . 793 LYS HG2 1 1 10 7003 1 1 14 LYS HG3 H -13.393 -3.354 0.953 1.00 . A A . 793 LYS HG3 1 1 10 7004 1 1 14 LYS HZ1 H -16.269 -2.675 4.577 1.00 . A A . 793 LYS HZ1 1 1 10 7005 1 1 14 LYS HZ2 H -15.490 -1.174 4.484 1.00 . A A . 793 LYS HZ2 1 1 10 7006 1 1 14 LYS HZ3 H -14.622 -2.550 4.971 1.00 . A A . 793 LYS HZ3 1 1 10 7007 1 1 14 LYS N N -12.208 0.419 0.203 1.00 . A A . 793 LYS N 1 1 10 7008 1 1 14 LYS NZ N -15.373 -2.201 4.334 1.00 . A A . 793 LYS NZ 1 1 10 7009 1 1 14 LYS O O -9.337 0.290 1.901 1.00 . A A . 793 LYS O 1 1 10 7010 1 1 15 LYS C C -7.848 1.194 -0.754 1.00 . A A . 794 LYS C 1 1 10 7011 1 1 15 LYS CA C -7.976 -0.281 -0.402 1.00 . A A . 794 LYS CA 1 1 10 7012 1 1 15 LYS CB C -7.365 -1.171 -1.497 1.00 . A A . 794 LYS CB 1 1 10 7013 1 1 15 LYS CD C -9.032 -2.691 -2.610 1.00 . A A . 794 LYS CD 1 1 10 7014 1 1 15 LYS CE C -9.876 -2.946 -3.850 1.00 . A A . 794 LYS CE 1 1 10 7015 1 1 15 LYS CG C -8.250 -1.390 -2.716 1.00 . A A . 794 LYS CG 1 1 10 7016 1 1 15 LYS H H -9.889 -1.071 -0.835 1.00 . A A . 794 LYS H 1 1 10 7017 1 1 15 LYS HA H -7.445 -0.456 0.522 1.00 . A A . 794 LYS HA 1 1 10 7018 1 1 15 LYS HB2 H -6.444 -0.718 -1.831 1.00 . A A . 794 LYS HB2 1 1 10 7019 1 1 15 LYS HB3 H -7.138 -2.138 -1.066 1.00 . A A . 794 LYS HB3 1 1 10 7020 1 1 15 LYS HD2 H -8.338 -3.508 -2.488 1.00 . A A . 794 LYS HD2 1 1 10 7021 1 1 15 LYS HD3 H -9.684 -2.640 -1.747 1.00 . A A . 794 LYS HD3 1 1 10 7022 1 1 15 LYS HE2 H -9.250 -2.841 -4.723 1.00 . A A . 794 LYS HE2 1 1 10 7023 1 1 15 LYS HE3 H -10.263 -3.954 -3.805 1.00 . A A . 794 LYS HE3 1 1 10 7024 1 1 15 LYS HG2 H -8.948 -0.569 -2.796 1.00 . A A . 794 LYS HG2 1 1 10 7025 1 1 15 LYS HG3 H -7.629 -1.427 -3.597 1.00 . A A . 794 LYS HG3 1 1 10 7026 1 1 15 LYS HZ1 H -11.664 -2.134 -3.155 1.00 . A A . 794 LYS HZ1 1 1 10 7027 1 1 15 LYS HZ2 H -11.529 -2.148 -4.845 1.00 . A A . 794 LYS HZ2 1 1 10 7028 1 1 15 LYS HZ3 H -10.662 -1.009 -3.934 1.00 . A A . 794 LYS HZ3 1 1 10 7029 1 1 15 LYS N N -9.373 -0.595 -0.155 1.00 . A A . 794 LYS N 1 1 10 7030 1 1 15 LYS NZ N -11.010 -1.998 -3.954 1.00 . A A . 794 LYS NZ 1 1 10 7031 1 1 15 LYS O O -6.983 1.894 -0.225 1.00 . A A . 794 LYS O 1 1 10 7032 1 1 16 ALA C C -7.706 3.855 -2.194 1.00 . A A . 795 ALA C 1 1 10 7033 1 1 16 ALA CA C -8.976 3.065 -1.894 1.00 . A A . 795 ALA CA 1 1 10 7034 1 1 16 ALA CB C -9.709 3.669 -0.707 1.00 . A A . 795 ALA CB 1 1 10 7035 1 1 16 ALA H H -9.264 0.990 -2.152 1.00 . A A . 795 ALA H 1 1 10 7036 1 1 16 ALA HA H -9.626 3.141 -2.743 1.00 . A A . 795 ALA HA 1 1 10 7037 1 1 16 ALA HB1 H -9.159 3.462 0.198 1.00 . A A . 795 ALA HB1 1 1 10 7038 1 1 16 ALA HB2 H -10.695 3.235 -0.637 1.00 . A A . 795 ALA HB2 1 1 10 7039 1 1 16 ALA HB3 H -9.792 4.737 -0.843 1.00 . A A . 795 ALA HB3 1 1 10 7040 1 1 16 ALA N N -8.741 1.645 -1.638 1.00 . A A . 795 ALA N 1 1 10 7041 1 1 16 ALA O O -7.254 3.918 -3.338 1.00 . A A . 795 ALA O 1 1 10 7042 1 1 17 ASN C C -4.714 4.518 -1.508 1.00 . A A . 796 ASN C 1 1 10 7043 1 1 17 ASN CA C -5.990 5.325 -1.280 1.00 . A A . 796 ASN CA 1 1 10 7044 1 1 17 ASN CB C -5.867 6.238 -0.041 1.00 . A A . 796 ASN CB 1 1 10 7045 1 1 17 ASN CG C -5.527 5.540 1.288 1.00 . A A . 796 ASN CG 1 1 10 7046 1 1 17 ASN H H -7.568 4.344 -0.283 1.00 . A A . 796 ASN H 1 1 10 7047 1 1 17 ASN HA H -6.150 5.949 -2.147 1.00 . A A . 796 ASN HA 1 1 10 7048 1 1 17 ASN HB2 H -5.096 6.967 -0.230 1.00 . A A . 796 ASN HB2 1 1 10 7049 1 1 17 ASN HB3 H -6.806 6.759 0.089 1.00 . A A . 796 ASN HB3 1 1 10 7050 1 1 17 ASN HD21 H -6.207 3.766 0.675 1.00 . A A . 796 ASN HD21 1 1 10 7051 1 1 17 ASN HD22 H -5.591 3.811 2.286 1.00 . A A . 796 ASN HD22 1 1 10 7052 1 1 17 ASN N N -7.157 4.462 -1.157 1.00 . A A . 796 ASN N 1 1 10 7053 1 1 17 ASN ND2 N -5.806 4.242 1.426 1.00 . A A . 796 ASN ND2 1 1 10 7054 1 1 17 ASN O O -4.051 4.069 -0.574 1.00 . A A . 796 ASN O 1 1 10 7055 1 1 17 ASN OD1 O -4.977 6.175 2.183 1.00 . A A . 796 ASN OD1 1 1 10 7056 1 1 18 LEU C C -2.076 4.518 -3.498 1.00 . A A . 797 LEU C 1 1 10 7057 1 1 18 LEU CA C -3.183 3.560 -3.087 1.00 . A A . 797 LEU CA 1 1 10 7058 1 1 18 LEU CB C -3.462 2.579 -4.226 1.00 . A A . 797 LEU CB 1 1 10 7059 1 1 18 LEU CD1 C -4.956 0.906 -5.346 1.00 . A A . 797 LEU CD1 1 1 10 7060 1 1 18 LEU CD2 C -4.828 0.976 -2.852 1.00 . A A . 797 LEU CD2 1 1 10 7061 1 1 18 LEU CG C -4.778 1.800 -4.127 1.00 . A A . 797 LEU CG 1 1 10 7062 1 1 18 LEU H H -4.870 4.705 -3.504 1.00 . A A . 797 LEU H 1 1 10 7063 1 1 18 LEU HA H -2.886 3.015 -2.203 1.00 . A A . 797 LEU HA 1 1 10 7064 1 1 18 LEU HB2 H -3.471 3.137 -5.142 1.00 . A A . 797 LEU HB2 1 1 10 7065 1 1 18 LEU HB3 H -2.651 1.868 -4.265 1.00 . A A . 797 LEU HB3 1 1 10 7066 1 1 18 LEU HD11 H -4.989 1.516 -6.236 1.00 . A A . 797 LEU HD11 1 1 10 7067 1 1 18 LEU HD12 H -5.878 0.353 -5.253 1.00 . A A . 797 LEU HD12 1 1 10 7068 1 1 18 LEU HD13 H -4.127 0.218 -5.412 1.00 . A A . 797 LEU HD13 1 1 10 7069 1 1 18 LEU HD21 H -4.765 1.634 -1.997 1.00 . A A . 797 LEU HD21 1 1 10 7070 1 1 18 LEU HD22 H -3.997 0.285 -2.837 1.00 . A A . 797 LEU HD22 1 1 10 7071 1 1 18 LEU HD23 H -5.757 0.427 -2.814 1.00 . A A . 797 LEU HD23 1 1 10 7072 1 1 18 LEU HG H -5.599 2.502 -4.104 1.00 . A A . 797 LEU HG 1 1 10 7073 1 1 18 LEU N N -4.366 4.311 -2.766 1.00 . A A . 797 LEU N 1 1 10 7074 1 1 18 LEU O O -2.325 5.508 -4.185 1.00 . A A . 797 LEU O 1 1 10 7075 1 1 19 LEU C C 1.444 3.985 -3.606 1.00 . A A . 798 LEU C 1 1 10 7076 1 1 19 LEU CA C 0.306 4.972 -3.483 1.00 . A A . 798 LEU CA 1 1 10 7077 1 1 19 LEU CB C 0.606 6.154 -2.522 1.00 . A A . 798 LEU CB 1 1 10 7078 1 1 19 LEU CD1 C 0.387 4.770 -0.399 1.00 . A A . 798 LEU CD1 1 1 10 7079 1 1 19 LEU CD2 C 2.651 5.502 -1.209 1.00 . A A . 798 LEU CD2 1 1 10 7080 1 1 19 LEU CG C 1.176 5.851 -1.121 1.00 . A A . 798 LEU CG 1 1 10 7081 1 1 19 LEU H H -0.750 3.446 -2.484 1.00 . A A . 798 LEU H 1 1 10 7082 1 1 19 LEU HA H 0.139 5.362 -4.473 1.00 . A A . 798 LEU HA 1 1 10 7083 1 1 19 LEU HB2 H 1.309 6.802 -3.018 1.00 . A A . 798 LEU HB2 1 1 10 7084 1 1 19 LEU HB3 H -0.314 6.707 -2.389 1.00 . A A . 798 LEU HB3 1 1 10 7085 1 1 19 LEU HD11 H -0.642 5.083 -0.294 1.00 . A A . 798 LEU HD11 1 1 10 7086 1 1 19 LEU HD12 H 0.815 4.609 0.579 1.00 . A A . 798 LEU HD12 1 1 10 7087 1 1 19 LEU HD13 H 0.429 3.853 -0.966 1.00 . A A . 798 LEU HD13 1 1 10 7088 1 1 19 LEU HD21 H 2.782 4.703 -1.924 1.00 . A A . 798 LEU HD21 1 1 10 7089 1 1 19 LEU HD22 H 3.009 5.186 -0.241 1.00 . A A . 798 LEU HD22 1 1 10 7090 1 1 19 LEU HD23 H 3.205 6.369 -1.536 1.00 . A A . 798 LEU HD23 1 1 10 7091 1 1 19 LEU HG H 1.095 6.748 -0.525 1.00 . A A . 798 LEU HG 1 1 10 7092 1 1 19 LEU N N -0.869 4.219 -3.080 1.00 . A A . 798 LEU N 1 1 10 7093 1 1 19 LEU O O 1.485 2.994 -2.878 1.00 . A A . 798 LEU O 1 1 10 7094 1 1 20 LYS C C 4.589 3.262 -4.230 1.00 . A A . 799 LYS C 1 1 10 7095 1 1 20 LYS CA C 3.234 3.117 -4.905 1.00 . A A . 799 LYS CA 1 1 10 7096 1 1 20 LYS CB C 3.372 2.896 -6.412 1.00 . A A . 799 LYS CB 1 1 10 7097 1 1 20 LYS CD C 4.155 3.809 -8.622 1.00 . A A . 799 LYS CD 1 1 10 7098 1 1 20 LYS CE C 4.599 5.056 -9.369 1.00 . A A . 799 LYS CE 1 1 10 7099 1 1 20 LYS CG C 4.020 4.066 -7.132 1.00 . A A . 799 LYS CG 1 1 10 7100 1 1 20 LYS H H 2.319 5.044 -5.055 1.00 . A A . 799 LYS H 1 1 10 7101 1 1 20 LYS HA H 2.769 2.271 -4.430 1.00 . A A . 799 LYS HA 1 1 10 7102 1 1 20 LYS HB2 H 3.975 2.016 -6.582 1.00 . A A . 799 LYS HB2 1 1 10 7103 1 1 20 LYS HB3 H 2.392 2.738 -6.834 1.00 . A A . 799 LYS HB3 1 1 10 7104 1 1 20 LYS HD2 H 4.889 3.032 -8.777 1.00 . A A . 799 LYS HD2 1 1 10 7105 1 1 20 LYS HD3 H 3.198 3.486 -9.012 1.00 . A A . 799 LYS HD3 1 1 10 7106 1 1 20 LYS HE2 H 5.520 5.415 -8.931 1.00 . A A . 799 LYS HE2 1 1 10 7107 1 1 20 LYS HE3 H 4.770 4.801 -10.406 1.00 . A A . 799 LYS HE3 1 1 10 7108 1 1 20 LYS HG2 H 3.417 4.945 -6.981 1.00 . A A . 799 LYS HG2 1 1 10 7109 1 1 20 LYS HG3 H 5.002 4.227 -6.715 1.00 . A A . 799 LYS HG3 1 1 10 7110 1 1 20 LYS HZ1 H 2.656 5.777 -9.621 1.00 . A A . 799 LYS HZ1 1 1 10 7111 1 1 20 LYS HZ2 H 3.859 6.934 -9.907 1.00 . A A . 799 LYS HZ2 1 1 10 7112 1 1 20 LYS HZ3 H 3.488 6.478 -8.317 1.00 . A A . 799 LYS HZ3 1 1 10 7113 1 1 20 LYS N N 2.314 4.185 -4.582 1.00 . A A . 799 LYS N 1 1 10 7114 1 1 20 LYS NZ N 3.581 6.134 -9.297 1.00 . A A . 799 LYS NZ 1 1 10 7115 1 1 20 LYS O O 5.178 4.341 -4.154 1.00 . A A . 799 LYS O 1 1 10 7116 1 1 21 CYS C C 7.414 2.444 -4.069 1.00 . A A . 800 CYS C 1 1 10 7117 1 1 21 CYS CA C 6.327 1.859 -3.177 1.00 . A A . 800 CYS CA 1 1 10 7118 1 1 21 CYS CB C 6.398 0.336 -3.158 1.00 . A A . 800 CYS CB 1 1 10 7119 1 1 21 CYS H H 4.371 1.377 -3.672 1.00 . A A . 800 CYS H 1 1 10 7120 1 1 21 CYS HA H 6.391 2.240 -2.173 1.00 . A A . 800 CYS HA 1 1 10 7121 1 1 21 CYS HB2 H 5.601 -0.029 -2.532 1.00 . A A . 800 CYS HB2 1 1 10 7122 1 1 21 CYS HB3 H 6.220 -0.015 -4.166 1.00 . A A . 800 CYS HB3 1 1 10 7123 1 1 21 CYS N N 5.011 2.117 -3.715 1.00 . A A . 800 CYS N 1 1 10 7124 1 1 21 CYS O O 7.681 1.904 -5.135 1.00 . A A . 800 CYS O 1 1 10 7125 1 1 21 CYS SG S 7.900 -0.466 -2.578 1.00 . A A . 800 CYS SG 1 1 10 7126 1 1 22 GLU C C 10.320 3.400 -4.634 1.00 . A A . 801 GLU C 1 1 10 7127 1 1 22 GLU CA C 9.048 4.236 -4.435 1.00 . A A . 801 GLU CA 1 1 10 7128 1 1 22 GLU CB C 9.400 5.591 -3.808 1.00 . A A . 801 GLU CB 1 1 10 7129 1 1 22 GLU CD C 10.386 6.844 -1.854 1.00 . A A . 801 GLU CD 1 1 10 7130 1 1 22 GLU CG C 9.898 5.508 -2.377 1.00 . A A . 801 GLU CG 1 1 10 7131 1 1 22 GLU H H 7.794 3.907 -2.751 1.00 . A A . 801 GLU H 1 1 10 7132 1 1 22 GLU HA H 8.610 4.420 -5.406 1.00 . A A . 801 GLU HA 1 1 10 7133 1 1 22 GLU HB2 H 10.168 6.059 -4.404 1.00 . A A . 801 GLU HB2 1 1 10 7134 1 1 22 GLU HB3 H 8.520 6.217 -3.821 1.00 . A A . 801 GLU HB3 1 1 10 7135 1 1 22 GLU HG2 H 9.092 5.164 -1.747 1.00 . A A . 801 GLU HG2 1 1 10 7136 1 1 22 GLU HG3 H 10.714 4.803 -2.336 1.00 . A A . 801 GLU HG3 1 1 10 7137 1 1 22 GLU N N 8.033 3.542 -3.634 1.00 . A A . 801 GLU N 1 1 10 7138 1 1 22 GLU O O 11.348 3.919 -5.063 1.00 . A A . 801 GLU O 1 1 10 7139 1 1 22 GLU OE1 O 9.549 7.674 -1.450 1.00 . A A . 801 GLU OE1 1 1 10 7140 1 1 22 GLU OE2 O 11.617 7.073 -1.859 1.00 . A A . 801 GLU OE2 1 1 10 7141 1 1 23 TYR C C 11.067 0.348 -5.786 1.00 . A A . 802 TYR C 1 1 10 7142 1 1 23 TYR CA C 11.358 1.210 -4.557 1.00 . A A . 802 TYR CA 1 1 10 7143 1 1 23 TYR CB C 11.625 0.331 -3.321 1.00 . A A . 802 TYR CB 1 1 10 7144 1 1 23 TYR CD1 C 14.124 -0.020 -3.158 1.00 . A A . 802 TYR CD1 1 1 10 7145 1 1 23 TYR CD2 C 12.773 -1.871 -3.812 1.00 . A A . 802 TYR CD2 1 1 10 7146 1 1 23 TYR CE1 C 15.255 -0.804 -3.254 1.00 . A A . 802 TYR CE1 1 1 10 7147 1 1 23 TYR CE2 C 13.902 -2.662 -3.907 1.00 . A A . 802 TYR CE2 1 1 10 7148 1 1 23 TYR CG C 12.863 -0.536 -3.435 1.00 . A A . 802 TYR CG 1 1 10 7149 1 1 23 TYR CZ C 15.138 -2.123 -3.629 1.00 . A A . 802 TYR CZ 1 1 10 7150 1 1 23 TYR H H 9.413 1.765 -3.947 1.00 . A A . 802 TYR H 1 1 10 7151 1 1 23 TYR HA H 12.227 1.814 -4.767 1.00 . A A . 802 TYR HA 1 1 10 7152 1 1 23 TYR HB2 H 11.748 0.964 -2.452 1.00 . A A . 802 TYR HB2 1 1 10 7153 1 1 23 TYR HB3 H 10.779 -0.323 -3.161 1.00 . A A . 802 TYR HB3 1 1 10 7154 1 1 23 TYR HD1 H 14.214 1.017 -2.863 1.00 . A A . 802 TYR HD1 1 1 10 7155 1 1 23 TYR HD2 H 11.802 -2.290 -4.031 1.00 . A A . 802 TYR HD2 1 1 10 7156 1 1 23 TYR HE1 H 16.225 -0.382 -3.037 1.00 . A A . 802 TYR HE1 1 1 10 7157 1 1 23 TYR HE2 H 13.813 -3.699 -4.200 1.00 . A A . 802 TYR HE2 1 1 10 7158 1 1 23 TYR HH H 16.328 -3.275 -4.609 1.00 . A A . 802 TYR HH 1 1 10 7159 1 1 23 TYR N N 10.247 2.114 -4.320 1.00 . A A . 802 TYR N 1 1 10 7160 1 1 23 TYR O O 11.912 0.197 -6.667 1.00 . A A . 802 TYR O 1 1 10 7161 1 1 23 TYR OH O 16.264 -2.908 -3.717 1.00 . A A . 802 TYR OH 1 1 10 7162 1 1 24 CYS C C 8.331 -0.490 -7.799 1.00 . A A . 803 CYS C 1 1 10 7163 1 1 24 CYS CA C 9.479 -1.067 -6.964 1.00 . A A . 803 CYS CA 1 1 10 7164 1 1 24 CYS CB C 9.125 -2.456 -6.442 1.00 . A A . 803 CYS CB 1 1 10 7165 1 1 24 CYS H H 9.240 -0.078 -5.105 1.00 . A A . 803 CYS H 1 1 10 7166 1 1 24 CYS HA H 10.315 -1.135 -7.641 1.00 . A A . 803 CYS HA 1 1 10 7167 1 1 24 CYS HB2 H 8.665 -3.028 -7.233 1.00 . A A . 803 CYS HB2 1 1 10 7168 1 1 24 CYS HB3 H 10.025 -2.951 -6.117 1.00 . A A . 803 CYS HB3 1 1 10 7169 1 1 24 CYS N N 9.863 -0.207 -5.847 1.00 . A A . 803 CYS N 1 1 10 7170 1 1 24 CYS O O 8.191 -0.843 -8.968 1.00 . A A . 803 CYS O 1 1 10 7171 1 1 24 CYS SG S 7.978 -2.429 -5.036 1.00 . A A . 803 CYS SG 1 1 10 7172 1 1 25 GLY C C 5.155 0.355 -7.974 1.00 . A A . 804 GLY C 1 1 10 7173 1 1 25 GLY CA C 6.500 1.052 -8.013 1.00 . A A . 804 GLY CA 1 1 10 7174 1 1 25 GLY H H 7.587 0.566 -6.265 1.00 . A A . 804 GLY H 1 1 10 7175 1 1 25 GLY HA2 H 6.379 2.057 -7.637 1.00 . A A . 804 GLY HA2 1 1 10 7176 1 1 25 GLY HA3 H 6.837 1.102 -9.038 1.00 . A A . 804 GLY HA3 1 1 10 7177 1 1 25 GLY N N 7.513 0.376 -7.225 1.00 . A A . 804 GLY N 1 1 10 7178 1 1 25 GLY O O 4.287 0.624 -8.803 1.00 . A A . 804 GLY O 1 1 10 7179 1 1 26 LYS C C 2.723 -0.489 -6.068 1.00 . A A . 805 LYS C 1 1 10 7180 1 1 26 LYS CA C 3.724 -1.275 -6.906 1.00 . A A . 805 LYS CA 1 1 10 7181 1 1 26 LYS CB C 3.973 -2.661 -6.308 1.00 . A A . 805 LYS CB 1 1 10 7182 1 1 26 LYS CD C 5.114 -4.890 -6.565 1.00 . A A . 805 LYS CD 1 1 10 7183 1 1 26 LYS CE C 6.041 -5.723 -7.435 1.00 . A A . 805 LYS CE 1 1 10 7184 1 1 26 LYS CG C 4.902 -3.509 -7.158 1.00 . A A . 805 LYS CG 1 1 10 7185 1 1 26 LYS H H 5.674 -0.687 -6.353 1.00 . A A . 805 LYS H 1 1 10 7186 1 1 26 LYS HA H 3.344 -1.390 -7.912 1.00 . A A . 805 LYS HA 1 1 10 7187 1 1 26 LYS HB2 H 4.415 -2.548 -5.331 1.00 . A A . 805 LYS HB2 1 1 10 7188 1 1 26 LYS HB3 H 3.029 -3.178 -6.214 1.00 . A A . 805 LYS HB3 1 1 10 7189 1 1 26 LYS HD2 H 5.552 -4.787 -5.584 1.00 . A A . 805 LYS HD2 1 1 10 7190 1 1 26 LYS HD3 H 4.159 -5.391 -6.488 1.00 . A A . 805 LYS HD3 1 1 10 7191 1 1 26 LYS HE2 H 6.979 -5.199 -7.544 1.00 . A A . 805 LYS HE2 1 1 10 7192 1 1 26 LYS HE3 H 6.214 -6.672 -6.950 1.00 . A A . 805 LYS HE3 1 1 10 7193 1 1 26 LYS HG2 H 4.475 -3.617 -8.143 1.00 . A A . 805 LYS HG2 1 1 10 7194 1 1 26 LYS HG3 H 5.857 -3.010 -7.232 1.00 . A A . 805 LYS HG3 1 1 10 7195 1 1 26 LYS HZ1 H 5.264 -5.065 -9.265 1.00 . A A . 805 LYS HZ1 1 1 10 7196 1 1 26 LYS HZ2 H 4.582 -6.513 -8.708 1.00 . A A . 805 LYS HZ2 1 1 10 7197 1 1 26 LYS HZ3 H 6.142 -6.513 -9.370 1.00 . A A . 805 LYS HZ3 1 1 10 7198 1 1 26 LYS N N 4.974 -0.542 -7.017 1.00 . A A . 805 LYS N 1 1 10 7199 1 1 26 LYS NZ N 5.468 -5.969 -8.786 1.00 . A A . 805 LYS NZ 1 1 10 7200 1 1 26 LYS O O 3.075 0.040 -5.010 1.00 . A A . 805 LYS O 1 1 10 7201 1 1 27 TYR C C -0.200 -0.515 -4.765 1.00 . A A . 806 TYR C 1 1 10 7202 1 1 27 TYR CA C 0.452 0.336 -5.838 1.00 . A A . 806 TYR CA 1 1 10 7203 1 1 27 TYR CB C -0.612 0.834 -6.817 1.00 . A A . 806 TYR CB 1 1 10 7204 1 1 27 TYR CD1 C 0.453 1.646 -8.956 1.00 . A A . 806 TYR CD1 1 1 10 7205 1 1 27 TYR CD2 C -0.250 3.267 -7.357 1.00 . A A . 806 TYR CD2 1 1 10 7206 1 1 27 TYR CE1 C 0.904 2.654 -9.784 1.00 . A A . 806 TYR CE1 1 1 10 7207 1 1 27 TYR CE2 C 0.195 4.280 -8.181 1.00 . A A . 806 TYR CE2 1 1 10 7208 1 1 27 TYR CG C -0.129 1.935 -7.731 1.00 . A A . 806 TYR CG 1 1 10 7209 1 1 27 TYR CZ C 0.772 3.970 -9.391 1.00 . A A . 806 TYR CZ 1 1 10 7210 1 1 27 TYR H H 1.247 -0.911 -7.341 1.00 . A A . 806 TYR H 1 1 10 7211 1 1 27 TYR HA H 0.901 1.190 -5.351 1.00 . A A . 806 TYR HA 1 1 10 7212 1 1 27 TYR HB2 H -0.937 0.010 -7.433 1.00 . A A . 806 TYR HB2 1 1 10 7213 1 1 27 TYR HB3 H -1.455 1.212 -6.256 1.00 . A A . 806 TYR HB3 1 1 10 7214 1 1 27 TYR HD1 H 0.550 0.614 -9.261 1.00 . A A . 806 TYR HD1 1 1 10 7215 1 1 27 TYR HD2 H -0.704 3.506 -6.407 1.00 . A A . 806 TYR HD2 1 1 10 7216 1 1 27 TYR HE1 H 1.354 2.410 -10.733 1.00 . A A . 806 TYR HE1 1 1 10 7217 1 1 27 TYR HE2 H 0.091 5.311 -7.873 1.00 . A A . 806 TYR HE2 1 1 10 7218 1 1 27 TYR HH H 0.996 4.775 -11.126 1.00 . A A . 806 TYR HH 1 1 10 7219 1 1 27 TYR N N 1.487 -0.416 -6.531 1.00 . A A . 806 TYR N 1 1 10 7220 1 1 27 TYR O O -0.542 -1.678 -4.995 1.00 . A A . 806 TYR O 1 1 10 7221 1 1 27 TYR OH O 1.228 4.979 -10.207 1.00 . A A . 806 TYR OH 1 1 10 7222 1 1 28 ALA C C -1.555 0.415 -1.510 1.00 . A A . 807 ALA C 1 1 10 7223 1 1 28 ALA CA C -0.933 -0.598 -2.456 1.00 . A A . 807 ALA CA 1 1 10 7224 1 1 28 ALA CB C 0.150 -1.394 -1.748 1.00 . A A . 807 ALA CB 1 1 10 7225 1 1 28 ALA H H -0.049 1.015 -3.500 1.00 . A A . 807 ALA H 1 1 10 7226 1 1 28 ALA HA H -1.691 -1.282 -2.807 1.00 . A A . 807 ALA HA 1 1 10 7227 1 1 28 ALA HB1 H -0.282 -1.928 -0.916 1.00 . A A . 807 ALA HB1 1 1 10 7228 1 1 28 ALA HB2 H 0.913 -0.719 -1.387 1.00 . A A . 807 ALA HB2 1 1 10 7229 1 1 28 ALA HB3 H 0.590 -2.098 -2.440 1.00 . A A . 807 ALA HB3 1 1 10 7230 1 1 28 ALA N N -0.361 0.084 -3.599 1.00 . A A . 807 ALA N 1 1 10 7231 1 1 28 ALA O O -1.199 1.595 -1.548 1.00 . A A . 807 ALA O 1 1 10 7232 1 1 29 PRO C C -2.236 1.361 1.355 1.00 . A A . 808 PRO C 1 1 10 7233 1 1 29 PRO CA C -3.182 0.862 0.277 1.00 . A A . 808 PRO CA 1 1 10 7234 1 1 29 PRO CB C -4.277 -0.022 0.882 1.00 . A A . 808 PRO CB 1 1 10 7235 1 1 29 PRO CD C -2.960 -1.421 -0.537 1.00 . A A . 808 PRO CD 1 1 10 7236 1 1 29 PRO CG C -3.776 -1.412 0.726 1.00 . A A . 808 PRO CG 1 1 10 7237 1 1 29 PRO HA H -3.630 1.707 -0.230 1.00 . A A . 808 PRO HA 1 1 10 7238 1 1 29 PRO HB2 H -4.416 0.233 1.923 1.00 . A A . 808 PRO HB2 1 1 10 7239 1 1 29 PRO HB3 H -5.203 0.126 0.343 1.00 . A A . 808 PRO HB3 1 1 10 7240 1 1 29 PRO HD2 H -2.122 -2.095 -0.435 1.00 . A A . 808 PRO HD2 1 1 10 7241 1 1 29 PRO HD3 H -3.574 -1.700 -1.380 1.00 . A A . 808 PRO HD3 1 1 10 7242 1 1 29 PRO HG2 H -3.160 -1.673 1.573 1.00 . A A . 808 PRO HG2 1 1 10 7243 1 1 29 PRO HG3 H -4.606 -2.097 0.638 1.00 . A A . 808 PRO HG3 1 1 10 7244 1 1 29 PRO N N -2.498 -0.025 -0.661 1.00 . A A . 808 PRO N 1 1 10 7245 1 1 29 PRO O O -1.492 0.581 1.953 1.00 . A A . 808 PRO O 1 1 10 7246 1 1 30 ALA C C -1.361 2.650 3.903 1.00 . A A . 809 ALA C 1 1 10 7247 1 1 30 ALA CA C -1.403 3.357 2.540 1.00 . A A . 809 ALA CA 1 1 10 7248 1 1 30 ALA CB C -1.890 4.784 2.726 1.00 . A A . 809 ALA CB 1 1 10 7249 1 1 30 ALA H H -2.829 3.224 0.967 1.00 . A A . 809 ALA H 1 1 10 7250 1 1 30 ALA HA H -0.406 3.408 2.116 1.00 . A A . 809 ALA HA 1 1 10 7251 1 1 30 ALA HB1 H -1.880 5.294 1.772 1.00 . A A . 809 ALA HB1 1 1 10 7252 1 1 30 ALA HB2 H -1.240 5.300 3.417 1.00 . A A . 809 ALA HB2 1 1 10 7253 1 1 30 ALA HB3 H -2.897 4.772 3.115 1.00 . A A . 809 ALA HB3 1 1 10 7254 1 1 30 ALA N N -2.249 2.676 1.551 1.00 . A A . 809 ALA N 1 1 10 7255 1 1 30 ALA O O -0.378 2.759 4.639 1.00 . A A . 809 ALA O 1 1 10 7256 1 1 31 GLU C C -1.433 0.176 5.616 1.00 . A A . 810 GLU C 1 1 10 7257 1 1 31 GLU CA C -2.554 1.197 5.486 1.00 . A A . 810 GLU CA 1 1 10 7258 1 1 31 GLU CB C -3.900 0.468 5.567 1.00 . A A . 810 GLU CB 1 1 10 7259 1 1 31 GLU CD C -5.308 2.395 4.723 1.00 . A A . 810 GLU CD 1 1 10 7260 1 1 31 GLU CG C -5.097 1.373 5.818 1.00 . A A . 810 GLU CG 1 1 10 7261 1 1 31 GLU H H -3.199 1.934 3.604 1.00 . A A . 810 GLU H 1 1 10 7262 1 1 31 GLU HA H -2.485 1.889 6.309 1.00 . A A . 810 GLU HA 1 1 10 7263 1 1 31 GLU HB2 H -4.065 -0.055 4.638 1.00 . A A . 810 GLU HB2 1 1 10 7264 1 1 31 GLU HB3 H -3.852 -0.257 6.368 1.00 . A A . 810 GLU HB3 1 1 10 7265 1 1 31 GLU HG2 H -5.983 0.761 5.890 1.00 . A A . 810 GLU HG2 1 1 10 7266 1 1 31 GLU HG3 H -4.945 1.895 6.753 1.00 . A A . 810 GLU HG3 1 1 10 7267 1 1 31 GLU N N -2.446 1.951 4.233 1.00 . A A . 810 GLU N 1 1 10 7268 1 1 31 GLU O O -0.955 -0.104 6.715 1.00 . A A . 810 GLU O 1 1 10 7269 1 1 31 GLU OE1 O -5.587 1.988 3.579 1.00 . A A . 810 GLU OE1 1 1 10 7270 1 1 31 GLU OE2 O -5.208 3.607 5.009 1.00 . A A . 810 GLU OE2 1 1 10 7271 1 1 32 GLN C C 1.385 -0.780 4.654 1.00 . A A . 811 GLN C 1 1 10 7272 1 1 32 GLN CA C 0.003 -1.400 4.468 1.00 . A A . 811 GLN CA 1 1 10 7273 1 1 32 GLN CB C -0.071 -2.168 3.149 1.00 . A A . 811 GLN CB 1 1 10 7274 1 1 32 GLN CD C 1.060 -3.735 1.549 1.00 . A A . 811 GLN CD 1 1 10 7275 1 1 32 GLN CG C 1.092 -3.111 2.922 1.00 . A A . 811 GLN CG 1 1 10 7276 1 1 32 GLN H H -1.391 -0.054 3.635 1.00 . A A . 811 GLN H 1 1 10 7277 1 1 32 GLN HA H -0.194 -2.075 5.285 1.00 . A A . 811 GLN HA 1 1 10 7278 1 1 32 GLN HB2 H -0.984 -2.746 3.133 1.00 . A A . 811 GLN HB2 1 1 10 7279 1 1 32 GLN HB3 H -0.093 -1.458 2.336 1.00 . A A . 811 GLN HB3 1 1 10 7280 1 1 32 GLN HE21 H 1.912 -2.112 0.793 1.00 . A A . 811 GLN HE21 1 1 10 7281 1 1 32 GLN HE22 H 1.560 -3.376 -0.337 1.00 . A A . 811 GLN HE22 1 1 10 7282 1 1 32 GLN HG2 H 2.012 -2.557 3.028 1.00 . A A . 811 GLN HG2 1 1 10 7283 1 1 32 GLN HG3 H 1.055 -3.895 3.663 1.00 . A A . 811 GLN HG3 1 1 10 7284 1 1 32 GLN N N -1.014 -0.370 4.487 1.00 . A A . 811 GLN N 1 1 10 7285 1 1 32 GLN NE2 N 1.562 -3.003 0.571 1.00 . A A . 811 GLN NE2 1 1 10 7286 1 1 32 GLN O O 2.312 -1.432 5.135 1.00 . A A . 811 GLN O 1 1 10 7287 1 1 32 GLN OE1 O 0.551 -4.839 1.362 1.00 . A A . 811 GLN OE1 1 1 10 7288 1 1 33 PHE C C 3.102 1.550 5.850 1.00 . A A . 812 PHE C 1 1 10 7289 1 1 33 PHE CA C 2.758 1.230 4.392 1.00 . A A . 812 PHE CA 1 1 10 7290 1 1 33 PHE CB C 2.654 2.520 3.578 1.00 . A A . 812 PHE CB 1 1 10 7291 1 1 33 PHE CD1 C 1.725 1.623 1.426 1.00 . A A . 812 PHE CD1 1 1 10 7292 1 1 33 PHE CD2 C 3.850 2.689 1.385 1.00 . A A . 812 PHE CD2 1 1 10 7293 1 1 33 PHE CE1 C 1.818 1.380 0.069 1.00 . A A . 812 PHE CE1 1 1 10 7294 1 1 33 PHE CE2 C 3.949 2.454 0.027 1.00 . A A . 812 PHE CE2 1 1 10 7295 1 1 33 PHE CG C 2.740 2.279 2.097 1.00 . A A . 812 PHE CG 1 1 10 7296 1 1 33 PHE CZ C 2.932 1.796 -0.631 1.00 . A A . 812 PHE CZ 1 1 10 7297 1 1 33 PHE H H 0.789 0.886 3.732 1.00 . A A . 812 PHE H 1 1 10 7298 1 1 33 PHE HA H 3.542 0.634 3.947 1.00 . A A . 812 PHE HA 1 1 10 7299 1 1 33 PHE HB2 H 1.708 2.995 3.786 1.00 . A A . 812 PHE HB2 1 1 10 7300 1 1 33 PHE HB3 H 3.460 3.184 3.857 1.00 . A A . 812 PHE HB3 1 1 10 7301 1 1 33 PHE HD1 H 0.855 1.299 1.972 1.00 . A A . 812 PHE HD1 1 1 10 7302 1 1 33 PHE HD2 H 4.646 3.203 1.897 1.00 . A A . 812 PHE HD2 1 1 10 7303 1 1 33 PHE HE1 H 1.017 0.866 -0.444 1.00 . A A . 812 PHE HE1 1 1 10 7304 1 1 33 PHE HE2 H 4.822 2.782 -0.518 1.00 . A A . 812 PHE HE2 1 1 10 7305 1 1 33 PHE HZ H 3.007 1.608 -1.690 1.00 . A A . 812 PHE HZ 1 1 10 7306 1 1 33 PHE N N 1.512 0.480 4.253 1.00 . A A . 812 PHE N 1 1 10 7307 1 1 33 PHE O O 3.159 2.710 6.252 1.00 . A A . 812 PHE O 1 1 10 7308 1 1 34 ARG C C 5.306 0.848 7.964 1.00 . A A . 813 ARG C 1 1 10 7309 1 1 34 ARG CA C 3.807 0.612 7.990 1.00 . A A . 813 ARG CA 1 1 10 7310 1 1 34 ARG CB C 3.494 -0.662 8.781 1.00 . A A . 813 ARG CB 1 1 10 7311 1 1 34 ARG CD C 1.183 0.140 9.469 1.00 . A A . 813 ARG CD 1 1 10 7312 1 1 34 ARG CG C 2.006 -0.999 8.870 1.00 . A A . 813 ARG CG 1 1 10 7313 1 1 34 ARG CZ C 0.571 2.449 8.813 1.00 . A A . 813 ARG CZ 1 1 10 7314 1 1 34 ARG H H 3.115 -0.389 6.260 1.00 . A A . 813 ARG H 1 1 10 7315 1 1 34 ARG HA H 3.343 1.449 8.494 1.00 . A A . 813 ARG HA 1 1 10 7316 1 1 34 ARG HB2 H 3.996 -1.496 8.311 1.00 . A A . 813 ARG HB2 1 1 10 7317 1 1 34 ARG HB3 H 3.873 -0.548 9.785 1.00 . A A . 813 ARG HB3 1 1 10 7318 1 1 34 ARG HD2 H 0.244 -0.261 9.819 1.00 . A A . 813 ARG HD2 1 1 10 7319 1 1 34 ARG HD3 H 1.726 0.561 10.302 1.00 . A A . 813 ARG HD3 1 1 10 7320 1 1 34 ARG HE H 0.987 0.959 7.545 1.00 . A A . 813 ARG HE 1 1 10 7321 1 1 34 ARG HG2 H 1.639 -1.206 7.878 1.00 . A A . 813 ARG HG2 1 1 10 7322 1 1 34 ARG HG3 H 1.887 -1.880 9.486 1.00 . A A . 813 ARG HG3 1 1 10 7323 1 1 34 ARG HH11 H 0.591 2.128 10.822 1.00 . A A . 813 ARG HH11 1 1 10 7324 1 1 34 ARG HH12 H 0.183 3.745 10.328 1.00 . A A . 813 ARG HH12 1 1 10 7325 1 1 34 ARG HH21 H 0.450 3.079 6.889 1.00 . A A . 813 ARG HH21 1 1 10 7326 1 1 34 ARG HH22 H 0.105 4.289 8.088 1.00 . A A . 813 ARG HH22 1 1 10 7327 1 1 34 ARG N N 3.310 0.502 6.626 1.00 . A A . 813 ARG N 1 1 10 7328 1 1 34 ARG NE N 0.911 1.199 8.494 1.00 . A A . 813 ARG NE 1 1 10 7329 1 1 34 ARG NH1 N 0.438 2.802 10.087 1.00 . A A . 813 ARG NH1 1 1 10 7330 1 1 34 ARG NH2 N 0.357 3.341 7.853 1.00 . A A . 813 ARG NH2 1 1 10 7331 1 1 34 ARG O O 6.022 0.268 7.149 1.00 . A A . 813 ARG O 1 1 10 7332 1 1 35 GLY C C 7.373 3.374 8.065 1.00 . A A . 814 GLY C 1 1 10 7333 1 1 35 GLY CA C 7.165 2.096 8.847 1.00 . A A . 814 GLY CA 1 1 10 7334 1 1 35 GLY H H 5.154 2.111 9.498 1.00 . A A . 814 GLY H 1 1 10 7335 1 1 35 GLY HA2 H 7.492 2.244 9.865 1.00 . A A . 814 GLY HA2 1 1 10 7336 1 1 35 GLY HA3 H 7.749 1.307 8.397 1.00 . A A . 814 GLY HA3 1 1 10 7337 1 1 35 GLY N N 5.771 1.713 8.847 1.00 . A A . 814 GLY N 1 1 10 7338 1 1 35 GLY O O 7.847 4.376 8.602 1.00 . A A . 814 GLY O 1 1 10 7339 1 1 36 SER C C 6.040 4.460 4.830 1.00 . A A . 815 SER C 1 1 10 7340 1 1 36 SER CA C 7.066 4.529 5.951 1.00 . A A . 815 SER CA 1 1 10 7341 1 1 36 SER CB C 8.469 4.669 5.352 1.00 . A A . 815 SER CB 1 1 10 7342 1 1 36 SER H H 6.639 2.514 6.418 1.00 . A A . 815 SER H 1 1 10 7343 1 1 36 SER HA H 6.861 5.390 6.571 1.00 . A A . 815 SER HA 1 1 10 7344 1 1 36 SER HB2 H 8.744 3.745 4.868 1.00 . A A . 815 SER HB2 1 1 10 7345 1 1 36 SER HB3 H 8.470 5.469 4.623 1.00 . A A . 815 SER HB3 1 1 10 7346 1 1 36 SER HG H 9.050 4.795 7.224 1.00 . A A . 815 SER HG 1 1 10 7347 1 1 36 SER N N 6.988 3.351 6.798 1.00 . A A . 815 SER N 1 1 10 7348 1 1 36 SER O O 5.906 3.430 4.164 1.00 . A A . 815 SER O 1 1 10 7349 1 1 36 SER OG O 9.433 4.963 6.350 1.00 . A A . 815 SER OG 1 1 10 7350 1 1 37 LYS C C 5.228 5.950 2.215 1.00 . A A . 816 LYS C 1 1 10 7351 1 1 37 LYS CA C 4.420 5.702 3.483 1.00 . A A . 816 LYS CA 1 1 10 7352 1 1 37 LYS CB C 3.441 6.855 3.717 1.00 . A A . 816 LYS CB 1 1 10 7353 1 1 37 LYS CD C 2.281 5.813 5.725 1.00 . A A . 816 LYS CD 1 1 10 7354 1 1 37 LYS CE C 2.849 6.787 6.748 1.00 . A A . 816 LYS CE 1 1 10 7355 1 1 37 LYS CG C 2.113 6.444 4.348 1.00 . A A . 816 LYS CG 1 1 10 7356 1 1 37 LYS H H 5.442 6.327 5.230 1.00 . A A . 816 LYS H 1 1 10 7357 1 1 37 LYS HA H 3.868 4.779 3.369 1.00 . A A . 816 LYS HA 1 1 10 7358 1 1 37 LYS HB2 H 3.912 7.574 4.365 1.00 . A A . 816 LYS HB2 1 1 10 7359 1 1 37 LYS HB3 H 3.231 7.327 2.767 1.00 . A A . 816 LYS HB3 1 1 10 7360 1 1 37 LYS HD2 H 1.318 5.471 6.073 1.00 . A A . 816 LYS HD2 1 1 10 7361 1 1 37 LYS HD3 H 2.950 4.970 5.639 1.00 . A A . 816 LYS HD3 1 1 10 7362 1 1 37 LYS HE2 H 2.855 6.304 7.714 1.00 . A A . 816 LYS HE2 1 1 10 7363 1 1 37 LYS HE3 H 3.862 7.033 6.465 1.00 . A A . 816 LYS HE3 1 1 10 7364 1 1 37 LYS HG2 H 1.492 7.323 4.447 1.00 . A A . 816 LYS HG2 1 1 10 7365 1 1 37 LYS HG3 H 1.625 5.736 3.695 1.00 . A A . 816 LYS HG3 1 1 10 7366 1 1 37 LYS HZ1 H 2.332 8.701 6.083 1.00 . A A . 816 LYS HZ1 1 1 10 7367 1 1 37 LYS HZ2 H 2.195 8.495 7.763 1.00 . A A . 816 LYS HZ2 1 1 10 7368 1 1 37 LYS HZ3 H 1.035 7.823 6.728 1.00 . A A . 816 LYS HZ3 1 1 10 7369 1 1 37 LYS N N 5.329 5.563 4.616 1.00 . A A . 816 LYS N 1 1 10 7370 1 1 37 LYS NZ N 2.049 8.037 6.838 1.00 . A A . 816 LYS NZ 1 1 10 7371 1 1 37 LYS O O 5.009 6.923 1.497 1.00 . A A . 816 LYS O 1 1 10 7372 1 1 38 ARG C C 7.396 3.826 0.272 1.00 . A A . 817 ARG C 1 1 10 7373 1 1 38 ARG CA C 7.131 5.189 0.890 1.00 . A A . 817 ARG CA 1 1 10 7374 1 1 38 ARG CB C 8.449 5.744 1.439 1.00 . A A . 817 ARG CB 1 1 10 7375 1 1 38 ARG CD C 9.701 7.681 2.447 1.00 . A A . 817 ARG CD 1 1 10 7376 1 1 38 ARG CG C 8.358 7.176 1.945 1.00 . A A . 817 ARG CG 1 1 10 7377 1 1 38 ARG CZ C 11.431 6.758 3.941 1.00 . A A . 817 ARG CZ 1 1 10 7378 1 1 38 ARG H H 6.217 4.249 2.512 1.00 . A A . 817 ARG H 1 1 10 7379 1 1 38 ARG HA H 6.778 5.846 0.109 1.00 . A A . 817 ARG HA 1 1 10 7380 1 1 38 ARG HB2 H 8.774 5.118 2.255 1.00 . A A . 817 ARG HB2 1 1 10 7381 1 1 38 ARG HB3 H 9.192 5.709 0.656 1.00 . A A . 817 ARG HB3 1 1 10 7382 1 1 38 ARG HD2 H 10.435 7.554 1.667 1.00 . A A . 817 ARG HD2 1 1 10 7383 1 1 38 ARG HD3 H 9.609 8.732 2.685 1.00 . A A . 817 ARG HD3 1 1 10 7384 1 1 38 ARG HE H 9.458 6.636 4.252 1.00 . A A . 817 ARG HE 1 1 10 7385 1 1 38 ARG HG2 H 8.024 7.813 1.141 1.00 . A A . 817 ARG HG2 1 1 10 7386 1 1 38 ARG HG3 H 7.645 7.214 2.757 1.00 . A A . 817 ARG HG3 1 1 10 7387 1 1 38 ARG HH11 H 12.151 7.664 2.267 1.00 . A A . 817 ARG HH11 1 1 10 7388 1 1 38 ARG HH12 H 13.359 7.032 3.347 1.00 . A A . 817 ARG HH12 1 1 10 7389 1 1 38 ARG HH21 H 11.028 5.791 5.685 1.00 . A A . 817 ARG HH21 1 1 10 7390 1 1 38 ARG HH22 H 12.720 5.963 5.296 1.00 . A A . 817 ARG HH22 1 1 10 7391 1 1 38 ARG N N 6.160 5.057 1.959 1.00 . A A . 817 ARG N 1 1 10 7392 1 1 38 ARG NE N 10.149 6.965 3.638 1.00 . A A . 817 ARG NE 1 1 10 7393 1 1 38 ARG NH1 N 12.388 7.185 3.121 1.00 . A A . 817 ARG NH1 1 1 10 7394 1 1 38 ARG NH2 N 11.749 6.120 5.061 1.00 . A A . 817 ARG NH2 1 1 10 7395 1 1 38 ARG O O 7.645 3.718 -0.924 1.00 . A A . 817 ARG O 1 1 10 7396 1 1 39 PHE C C 6.538 0.487 1.115 1.00 . A A . 818 PHE C 1 1 10 7397 1 1 39 PHE CA C 7.615 1.433 0.622 1.00 . A A . 818 PHE CA 1 1 10 7398 1 1 39 PHE CB C 8.975 0.977 1.151 1.00 . A A . 818 PHE CB 1 1 10 7399 1 1 39 PHE CD1 C 10.586 2.232 -0.300 1.00 . A A . 818 PHE CD1 1 1 10 7400 1 1 39 PHE CD2 C 10.574 2.693 2.038 1.00 . A A . 818 PHE CD2 1 1 10 7401 1 1 39 PHE CE1 C 11.599 3.152 -0.481 1.00 . A A . 818 PHE CE1 1 1 10 7402 1 1 39 PHE CE2 C 11.590 3.611 1.865 1.00 . A A . 818 PHE CE2 1 1 10 7403 1 1 39 PHE CG C 10.062 1.994 0.960 1.00 . A A . 818 PHE CG 1 1 10 7404 1 1 39 PHE CZ C 12.041 3.907 0.610 1.00 . A A . 818 PHE CZ 1 1 10 7405 1 1 39 PHE H H 7.054 2.902 2.022 1.00 . A A . 818 PHE H 1 1 10 7406 1 1 39 PHE HA H 7.631 1.437 -0.458 1.00 . A A . 818 PHE HA 1 1 10 7407 1 1 39 PHE HB2 H 8.893 0.770 2.208 1.00 . A A . 818 PHE HB2 1 1 10 7408 1 1 39 PHE HB3 H 9.261 0.075 0.635 1.00 . A A . 818 PHE HB3 1 1 10 7409 1 1 39 PHE HD1 H 10.191 1.693 -1.148 1.00 . A A . 818 PHE HD1 1 1 10 7410 1 1 39 PHE HD2 H 10.173 2.514 3.024 1.00 . A A . 818 PHE HD2 1 1 10 7411 1 1 39 PHE HE1 H 11.998 3.329 -1.469 1.00 . A A . 818 PHE HE1 1 1 10 7412 1 1 39 PHE HE2 H 11.982 4.151 2.715 1.00 . A A . 818 PHE HE2 1 1 10 7413 1 1 39 PHE HZ H 12.810 4.651 0.473 1.00 . A A . 818 PHE HZ 1 1 10 7414 1 1 39 PHE N N 7.321 2.780 1.087 1.00 . A A . 818 PHE N 1 1 10 7415 1 1 39 PHE O O 6.130 0.563 2.276 1.00 . A A . 818 PHE O 1 1 10 7416 1 1 40 CYS C C 5.422 -2.336 1.578 1.00 . A A . 819 CYS C 1 1 10 7417 1 1 40 CYS CA C 4.959 -1.238 0.624 1.00 . A A . 819 CYS CA 1 1 10 7418 1 1 40 CYS CB C 4.311 -1.835 -0.629 1.00 . A A . 819 CYS CB 1 1 10 7419 1 1 40 CYS H H 6.547 -0.580 -0.576 1.00 . A A . 819 CYS H 1 1 10 7420 1 1 40 CYS HA H 4.223 -0.613 1.113 1.00 . A A . 819 CYS HA 1 1 10 7421 1 1 40 CYS HB2 H 3.735 -2.691 -0.338 1.00 . A A . 819 CYS HB2 1 1 10 7422 1 1 40 CYS HB3 H 3.653 -1.099 -1.069 1.00 . A A . 819 CYS HB3 1 1 10 7423 1 1 40 CYS N N 6.061 -0.394 0.249 1.00 . A A . 819 CYS N 1 1 10 7424 1 1 40 CYS O O 6.094 -3.274 1.154 1.00 . A A . 819 CYS O 1 1 10 7425 1 1 40 CYS SG S 5.467 -2.377 -1.910 1.00 . A A . 819 CYS SG 1 1 10 7426 1 1 41 SER C C 6.553 -3.455 4.414 1.00 . A A . 820 SER C 1 1 10 7427 1 1 41 SER CA C 5.132 -3.233 3.868 1.00 . A A . 820 SER CA 1 1 10 7428 1 1 41 SER CB C 4.488 -4.536 3.353 1.00 . A A . 820 SER CB 1 1 10 7429 1 1 41 SER H H 5.130 -1.256 3.231 1.00 . A A . 820 SER H 1 1 10 7430 1 1 41 SER HA H 4.495 -2.828 4.646 1.00 . A A . 820 SER HA 1 1 10 7431 1 1 41 SER HB2 H 4.275 -5.177 4.194 1.00 . A A . 820 SER HB2 1 1 10 7432 1 1 41 SER HB3 H 3.562 -4.292 2.851 1.00 . A A . 820 SER HB3 1 1 10 7433 1 1 41 SER HG H 5.711 -4.631 1.818 1.00 . A A . 820 SER HG 1 1 10 7434 1 1 41 SER N N 5.137 -2.161 2.865 1.00 . A A . 820 SER N 1 1 10 7435 1 1 41 SER O O 7.394 -2.553 4.342 1.00 . A A . 820 SER O 1 1 10 7436 1 1 41 SER OG O 5.320 -5.250 2.451 1.00 . A A . 820 SER OG 1 1 10 7437 1 1 42 MET C C 9.255 -5.153 4.645 1.00 . A A . 821 MET C 1 1 10 7438 1 1 42 MET CA C 8.097 -4.912 5.611 1.00 . A A . 821 MET CA 1 1 10 7439 1 1 42 MET CB C 7.942 -6.127 6.525 1.00 . A A . 821 MET CB 1 1 10 7440 1 1 42 MET CE C 6.217 -3.286 7.872 1.00 . A A . 821 MET CE 1 1 10 7441 1 1 42 MET CG C 7.376 -5.817 7.910 1.00 . A A . 821 MET CG 1 1 10 7442 1 1 42 MET H H 6.194 -5.390 4.792 1.00 . A A . 821 MET H 1 1 10 7443 1 1 42 MET HA H 8.318 -4.056 6.232 1.00 . A A . 821 MET HA 1 1 10 7444 1 1 42 MET HB2 H 7.281 -6.835 6.048 1.00 . A A . 821 MET HB2 1 1 10 7445 1 1 42 MET HB3 H 8.911 -6.586 6.653 1.00 . A A . 821 MET HB3 1 1 10 7446 1 1 42 MET HE1 H 5.327 -2.675 7.863 1.00 . A A . 821 MET HE1 1 1 10 7447 1 1 42 MET HE2 H 6.806 -3.079 6.991 1.00 . A A . 821 MET HE2 1 1 10 7448 1 1 42 MET HE3 H 6.797 -3.061 8.754 1.00 . A A . 821 MET HE3 1 1 10 7449 1 1 42 MET HG2 H 7.289 -6.742 8.456 1.00 . A A . 821 MET HG2 1 1 10 7450 1 1 42 MET HG3 H 8.070 -5.168 8.426 1.00 . A A . 821 MET HG3 1 1 10 7451 1 1 42 MET N N 6.841 -4.656 4.905 1.00 . A A . 821 MET N 1 1 10 7452 1 1 42 MET O O 10.269 -4.460 4.704 1.00 . A A . 821 MET O 1 1 10 7453 1 1 42 MET SD S 5.753 -5.019 7.885 1.00 . A A . 821 MET SD 1 1 10 7454 1 1 43 THR C C 10.666 -5.264 2.037 1.00 . A A . 822 THR C 1 1 10 7455 1 1 43 THR CA C 10.081 -6.488 2.750 1.00 . A A . 822 THR CA 1 1 10 7456 1 1 43 THR CB C 9.441 -7.403 1.691 1.00 . A A . 822 THR CB 1 1 10 7457 1 1 43 THR CG2 C 10.486 -7.911 0.712 1.00 . A A . 822 THR CG2 1 1 10 7458 1 1 43 THR H H 8.267 -6.674 3.820 1.00 . A A . 822 THR H 1 1 10 7459 1 1 43 THR HA H 10.906 -7.031 3.190 1.00 . A A . 822 THR HA 1 1 10 7460 1 1 43 THR HB H 8.702 -6.835 1.146 1.00 . A A . 822 THR HB 1 1 10 7461 1 1 43 THR HG1 H 9.367 -8.847 3.044 1.00 . A A . 822 THR HG1 1 1 10 7462 1 1 43 THR HG21 H 11.011 -7.072 0.280 1.00 . A A . 822 THR HG21 1 1 10 7463 1 1 43 THR HG22 H 10.003 -8.475 -0.072 1.00 . A A . 822 THR HG22 1 1 10 7464 1 1 43 THR HG23 H 11.190 -8.547 1.231 1.00 . A A . 822 THR HG23 1 1 10 7465 1 1 43 THR N N 9.085 -6.137 3.765 1.00 . A A . 822 THR N 1 1 10 7466 1 1 43 THR O O 11.881 -5.082 2.002 1.00 . A A . 822 THR O 1 1 10 7467 1 1 43 THR OG1 O 8.799 -8.516 2.331 1.00 . A A . 822 THR OG1 1 1 10 7468 1 1 44 CYS C C 10.972 -2.239 1.514 1.00 . A A . 823 CYS C 1 1 10 7469 1 1 44 CYS CA C 10.255 -3.300 0.694 1.00 . A A . 823 CYS CA 1 1 10 7470 1 1 44 CYS CB C 9.075 -2.719 -0.041 1.00 . A A . 823 CYS CB 1 1 10 7471 1 1 44 CYS H H 8.852 -4.569 1.647 1.00 . A A . 823 CYS H 1 1 10 7472 1 1 44 CYS HA H 10.939 -3.668 -0.059 1.00 . A A . 823 CYS HA 1 1 10 7473 1 1 44 CYS HB2 H 8.271 -2.532 0.659 1.00 . A A . 823 CYS HB2 1 1 10 7474 1 1 44 CYS HB3 H 9.363 -1.798 -0.523 1.00 . A A . 823 CYS HB3 1 1 10 7475 1 1 44 CYS N N 9.810 -4.430 1.490 1.00 . A A . 823 CYS N 1 1 10 7476 1 1 44 CYS O O 12.037 -1.764 1.118 1.00 . A A . 823 CYS O 1 1 10 7477 1 1 44 CYS SG S 8.477 -3.852 -1.307 1.00 . A A . 823 CYS SG 1 1 10 7478 1 1 45 ALA C C 12.373 -1.362 3.986 1.00 . A A . 824 ALA C 1 1 10 7479 1 1 45 ALA CA C 11.008 -0.877 3.518 1.00 . A A . 824 ALA CA 1 1 10 7480 1 1 45 ALA CB C 10.101 -0.596 4.699 1.00 . A A . 824 ALA CB 1 1 10 7481 1 1 45 ALA H H 9.544 -2.285 2.922 1.00 . A A . 824 ALA H 1 1 10 7482 1 1 45 ALA HA H 11.120 0.046 2.965 1.00 . A A . 824 ALA HA 1 1 10 7483 1 1 45 ALA HB1 H 9.975 -1.497 5.279 1.00 . A A . 824 ALA HB1 1 1 10 7484 1 1 45 ALA HB2 H 9.141 -0.262 4.332 1.00 . A A . 824 ALA HB2 1 1 10 7485 1 1 45 ALA HB3 H 10.539 0.174 5.316 1.00 . A A . 824 ALA HB3 1 1 10 7486 1 1 45 ALA N N 10.393 -1.868 2.648 1.00 . A A . 824 ALA N 1 1 10 7487 1 1 45 ALA O O 13.349 -0.609 4.012 1.00 . A A . 824 ALA O 1 1 10 7488 1 1 46 LYS C C 14.684 -3.318 3.654 1.00 . A A . 825 LYS C 1 1 10 7489 1 1 46 LYS CA C 13.642 -3.300 4.769 1.00 . A A . 825 LYS CA 1 1 10 7490 1 1 46 LYS CB C 13.278 -4.738 5.210 1.00 . A A . 825 LYS CB 1 1 10 7491 1 1 46 LYS CD C 14.899 -6.358 4.142 1.00 . A A . 825 LYS CD 1 1 10 7492 1 1 46 LYS CE C 15.799 -7.557 4.393 1.00 . A A . 825 LYS CE 1 1 10 7493 1 1 46 LYS CG C 14.447 -5.697 5.438 1.00 . A A . 825 LYS CG 1 1 10 7494 1 1 46 LYS H H 11.590 -3.164 4.351 1.00 . A A . 825 LYS H 1 1 10 7495 1 1 46 LYS HA H 14.023 -2.763 5.628 1.00 . A A . 825 LYS HA 1 1 10 7496 1 1 46 LYS HB2 H 12.722 -4.676 6.131 1.00 . A A . 825 LYS HB2 1 1 10 7497 1 1 46 LYS HB3 H 12.637 -5.168 4.454 1.00 . A A . 825 LYS HB3 1 1 10 7498 1 1 46 LYS HD2 H 14.026 -6.685 3.597 1.00 . A A . 825 LYS HD2 1 1 10 7499 1 1 46 LYS HD3 H 15.438 -5.632 3.552 1.00 . A A . 825 LYS HD3 1 1 10 7500 1 1 46 LYS HE2 H 16.323 -7.793 3.481 1.00 . A A . 825 LYS HE2 1 1 10 7501 1 1 46 LYS HE3 H 16.515 -7.296 5.163 1.00 . A A . 825 LYS HE3 1 1 10 7502 1 1 46 LYS HG2 H 15.275 -5.144 5.854 1.00 . A A . 825 LYS HG2 1 1 10 7503 1 1 46 LYS HG3 H 14.141 -6.463 6.135 1.00 . A A . 825 LYS HG3 1 1 10 7504 1 1 46 LYS HZ1 H 14.580 -8.582 5.757 1.00 . A A . 825 LYS HZ1 1 1 10 7505 1 1 46 LYS HZ2 H 15.668 -9.577 4.915 1.00 . A A . 825 LYS HZ2 1 1 10 7506 1 1 46 LYS HZ3 H 14.290 -8.978 4.132 1.00 . A A . 825 LYS HZ3 1 1 10 7507 1 1 46 LYS N N 12.422 -2.639 4.340 1.00 . A A . 825 LYS N 1 1 10 7508 1 1 46 LYS NZ N 15.030 -8.753 4.831 1.00 . A A . 825 LYS NZ 1 1 10 7509 1 1 46 LYS O O 15.859 -3.026 3.883 1.00 . A A . 825 LYS O 1 1 10 7510 1 1 47 ARG C C 15.776 -2.700 0.768 1.00 . A A . 826 ARG C 1 1 10 7511 1 1 47 ARG CA C 15.183 -3.967 1.372 1.00 . A A . 826 ARG CA 1 1 10 7512 1 1 47 ARG CB C 14.501 -4.813 0.293 1.00 . A A . 826 ARG CB 1 1 10 7513 1 1 47 ARG CD C 14.773 -6.319 -1.702 1.00 . A A . 826 ARG CD 1 1 10 7514 1 1 47 ARG CG C 15.436 -5.287 -0.807 1.00 . A A . 826 ARG CG 1 1 10 7515 1 1 47 ARG CZ C 12.482 -6.438 -2.600 1.00 . A A . 826 ARG CZ 1 1 10 7516 1 1 47 ARG H H 13.281 -3.771 2.286 1.00 . A A . 826 ARG H 1 1 10 7517 1 1 47 ARG HA H 15.967 -4.550 1.831 1.00 . A A . 826 ARG HA 1 1 10 7518 1 1 47 ARG HB2 H 14.064 -5.683 0.760 1.00 . A A . 826 ARG HB2 1 1 10 7519 1 1 47 ARG HB3 H 13.716 -4.227 -0.160 1.00 . A A . 826 ARG HB3 1 1 10 7520 1 1 47 ARG HD2 H 15.501 -6.677 -2.411 1.00 . A A . 826 ARG HD2 1 1 10 7521 1 1 47 ARG HD3 H 14.437 -7.144 -1.088 1.00 . A A . 826 ARG HD3 1 1 10 7522 1 1 47 ARG HE H 13.739 -4.902 -2.857 1.00 . A A . 826 ARG HE 1 1 10 7523 1 1 47 ARG HG2 H 15.726 -4.439 -1.411 1.00 . A A . 826 ARG HG2 1 1 10 7524 1 1 47 ARG HG3 H 16.315 -5.726 -0.356 1.00 . A A . 826 ARG HG3 1 1 10 7525 1 1 47 ARG HH11 H 13.026 -8.009 -1.431 1.00 . A A . 826 ARG HH11 1 1 10 7526 1 1 47 ARG HH12 H 11.443 -8.114 -2.136 1.00 . A A . 826 ARG HH12 1 1 10 7527 1 1 47 ARG HH21 H 11.651 -5.049 -3.821 1.00 . A A . 826 ARG HH21 1 1 10 7528 1 1 47 ARG HH22 H 10.661 -6.441 -3.493 1.00 . A A . 826 ARG HH22 1 1 10 7529 1 1 47 ARG N N 14.248 -3.670 2.445 1.00 . A A . 826 ARG N 1 1 10 7530 1 1 47 ARG NE N 13.628 -5.780 -2.433 1.00 . A A . 826 ARG NE 1 1 10 7531 1 1 47 ARG NH1 N 12.300 -7.612 -2.006 1.00 . A A . 826 ARG NH1 1 1 10 7532 1 1 47 ARG NH2 N 11.522 -5.932 -3.359 1.00 . A A . 826 ARG NH2 1 1 10 7533 1 1 47 ARG O O 16.771 -2.763 0.043 1.00 . A A . 826 ARG O 1 1 10 7534 1 1 48 TYR C C 17.092 -0.035 0.878 1.00 . A A . 827 TYR C 1 1 10 7535 1 1 48 TYR CA C 15.630 -0.288 0.517 1.00 . A A . 827 TYR CA 1 1 10 7536 1 1 48 TYR CB C 14.771 0.857 1.063 1.00 . A A . 827 TYR CB 1 1 10 7537 1 1 48 TYR CD1 C 14.849 2.344 -0.969 1.00 . A A . 827 TYR CD1 1 1 10 7538 1 1 48 TYR CD2 C 15.449 3.289 1.132 1.00 . A A . 827 TYR CD2 1 1 10 7539 1 1 48 TYR CE1 C 15.071 3.559 -1.584 1.00 . A A . 827 TYR CE1 1 1 10 7540 1 1 48 TYR CE2 C 15.675 4.510 0.523 1.00 . A A . 827 TYR CE2 1 1 10 7541 1 1 48 TYR CG C 15.033 2.188 0.396 1.00 . A A . 827 TYR CG 1 1 10 7542 1 1 48 TYR CZ C 15.483 4.638 -0.836 1.00 . A A . 827 TYR CZ 1 1 10 7543 1 1 48 TYR H H 14.340 -1.565 1.599 1.00 . A A . 827 TYR H 1 1 10 7544 1 1 48 TYR HA H 15.478 -0.340 -0.551 1.00 . A A . 827 TYR HA 1 1 10 7545 1 1 48 TYR HB2 H 13.728 0.616 0.919 1.00 . A A . 827 TYR HB2 1 1 10 7546 1 1 48 TYR HB3 H 14.966 0.972 2.118 1.00 . A A . 827 TYR HB3 1 1 10 7547 1 1 48 TYR HD1 H 14.524 1.498 -1.555 1.00 . A A . 827 TYR HD1 1 1 10 7548 1 1 48 TYR HD2 H 15.599 3.183 2.196 1.00 . A A . 827 TYR HD2 1 1 10 7549 1 1 48 TYR HE1 H 14.920 3.658 -2.649 1.00 . A A . 827 TYR HE1 1 1 10 7550 1 1 48 TYR HE2 H 15.998 5.356 1.111 1.00 . A A . 827 TYR HE2 1 1 10 7551 1 1 48 TYR HH H 14.978 6.023 -2.077 1.00 . A A . 827 TYR HH 1 1 10 7552 1 1 48 TYR N N 15.169 -1.555 1.069 1.00 . A A . 827 TYR N 1 1 10 7553 1 1 48 TYR O O 17.890 0.374 0.038 1.00 . A A . 827 TYR O 1 1 10 7554 1 1 48 TYR OH O 15.699 5.850 -1.451 1.00 . A A . 827 TYR OH 1 1 10 7555 1 1 49 ASN C C 19.276 1.294 2.380 1.00 . A A . 828 ASN C 1 1 10 7556 1 1 49 ASN CA C 18.752 -0.100 2.705 1.00 . A A . 828 ASN CA 1 1 10 7557 1 1 49 ASN CB C 19.734 -1.171 2.215 1.00 . A A . 828 ASN CB 1 1 10 7558 1 1 49 ASN CG C 19.426 -2.548 2.777 1.00 . A A . 828 ASN CG 1 1 10 7559 1 1 49 ASN H H 16.720 -0.671 2.733 1.00 . A A . 828 ASN H 1 1 10 7560 1 1 49 ASN HA H 18.665 -0.184 3.781 1.00 . A A . 828 ASN HA 1 1 10 7561 1 1 49 ASN HB2 H 19.686 -1.226 1.138 1.00 . A A . 828 ASN HB2 1 1 10 7562 1 1 49 ASN HB3 H 20.735 -0.896 2.513 1.00 . A A . 828 ASN HB3 1 1 10 7563 1 1 49 ASN HD21 H 18.464 -3.055 1.113 1.00 . A A . 828 ASN HD21 1 1 10 7564 1 1 49 ASN HD22 H 18.542 -4.270 2.342 1.00 . A A . 828 ASN HD22 1 1 10 7565 1 1 49 ASN N N 17.415 -0.311 2.148 1.00 . A A . 828 ASN N 1 1 10 7566 1 1 49 ASN ND2 N 18.740 -3.374 2.003 1.00 . A A . 828 ASN ND2 1 1 10 7567 1 1 49 ASN O O 18.732 2.270 2.937 1.00 . A A . 828 ASN O 1 1 10 7568 1 1 49 ASN OXT O 20.234 1.409 1.587 1.00 . A A . 828 ASN OXT 1 1 10 7569 1 1 49 ASN OD1 O 19.812 -2.874 3.901 1.00 . A A . 828 ASN OD1 1 1 10 7570 2 2 1 ZN ZN ZN 7.486 -2.742 -2.879 1.00 . B A . 829 ZN ZN 1 1 11 7571 1 1 1 GLY C C -15.340 -9.890 2.181 1.00 . A A . 1 GLY C 1 1 11 7572 1 1 1 GLY CA C -15.007 -11.353 2.371 1.00 . A A . 1 GLY CA 1 1 11 7573 1 1 1 GLY H1 H -16.166 -11.627 4.080 1.00 . A A . 1 GLY H1 1 1 11 7574 1 1 1 GLY H2 H -14.547 -11.235 4.399 1.00 . A A . 1 GLY H2 1 1 11 7575 1 1 1 GLY H3 H -14.955 -12.796 3.873 1.00 . A A . 1 GLY H3 1 1 11 7576 1 1 1 GLY HA2 H -13.981 -11.520 2.079 1.00 . A A . 1 GLY HA2 1 1 11 7577 1 1 1 GLY HA3 H -15.654 -11.947 1.743 1.00 . A A . 1 GLY HA3 1 1 11 7578 1 1 1 GLY N N -15.180 -11.782 3.778 1.00 . A A . 1 GLY N 1 1 11 7579 1 1 1 GLY O O -14.801 -9.027 2.879 1.00 . A A . 1 GLY O 1 1 11 7580 1 1 2 THR C C -17.731 -7.813 1.960 1.00 . A A . 2 THR C 1 1 11 7581 1 1 2 THR CA C -16.641 -8.235 0.979 1.00 . A A . 2 THR CA 1 1 11 7582 1 1 2 THR CB C -17.158 -8.073 -0.463 1.00 . A A . 2 THR CB 1 1 11 7583 1 1 2 THR CG2 C -17.391 -6.605 -0.796 1.00 . A A . 2 THR CG2 1 1 11 7584 1 1 2 THR H H -16.629 -10.331 0.716 1.00 . A A . 2 THR H 1 1 11 7585 1 1 2 THR HA H -15.782 -7.592 1.111 1.00 . A A . 2 THR HA 1 1 11 7586 1 1 2 THR HB H -18.098 -8.601 -0.556 1.00 . A A . 2 THR HB 1 1 11 7587 1 1 2 THR HG1 H -16.663 -8.825 -2.223 1.00 . A A . 2 THR HG1 1 1 11 7588 1 1 2 THR HG21 H -16.454 -6.070 -0.748 1.00 . A A . 2 THR HG21 1 1 11 7589 1 1 2 THR HG22 H -18.085 -6.182 -0.083 1.00 . A A . 2 THR HG22 1 1 11 7590 1 1 2 THR HG23 H -17.804 -6.521 -1.790 1.00 . A A . 2 THR HG23 1 1 11 7591 1 1 2 THR N N -16.231 -9.602 1.243 1.00 . A A . 2 THR N 1 1 11 7592 1 1 2 THR O O -18.915 -8.073 1.744 1.00 . A A . 2 THR O 1 1 11 7593 1 1 2 THR OG1 O -16.212 -8.629 -1.388 1.00 . A A . 2 THR OG1 1 1 11 7594 1 1 3 ARG C C -18.605 -5.243 3.782 1.00 . A A . 3 ARG C 1 1 11 7595 1 1 3 ARG CA C -18.272 -6.701 4.039 1.00 . A A . 3 ARG CA 1 1 11 7596 1 1 3 ARG CB C -17.737 -6.861 5.459 1.00 . A A . 3 ARG CB 1 1 11 7597 1 1 3 ARG CD C -18.092 -8.277 7.479 1.00 . A A . 3 ARG CD 1 1 11 7598 1 1 3 ARG CG C -17.820 -8.282 5.987 1.00 . A A . 3 ARG CG 1 1 11 7599 1 1 3 ARG CZ C -19.428 -6.780 8.915 1.00 . A A . 3 ARG CZ 1 1 11 7600 1 1 3 ARG H H -16.365 -7.061 3.204 1.00 . A A . 3 ARG H 1 1 11 7601 1 1 3 ARG HA H -19.176 -7.283 3.941 1.00 . A A . 3 ARG HA 1 1 11 7602 1 1 3 ARG HB2 H -16.702 -6.552 5.479 1.00 . A A . 3 ARG HB2 1 1 11 7603 1 1 3 ARG HB3 H -18.305 -6.224 6.119 1.00 . A A . 3 ARG HB3 1 1 11 7604 1 1 3 ARG HD2 H -18.245 -9.294 7.811 1.00 . A A . 3 ARG HD2 1 1 11 7605 1 1 3 ARG HD3 H -17.240 -7.852 7.988 1.00 . A A . 3 ARG HD3 1 1 11 7606 1 1 3 ARG HE H -19.995 -7.457 7.119 1.00 . A A . 3 ARG HE 1 1 11 7607 1 1 3 ARG HG2 H -18.621 -8.801 5.480 1.00 . A A . 3 ARG HG2 1 1 11 7608 1 1 3 ARG HG3 H -16.883 -8.785 5.799 1.00 . A A . 3 ARG HG3 1 1 11 7609 1 1 3 ARG HH11 H -17.698 -7.435 9.752 1.00 . A A . 3 ARG HH11 1 1 11 7610 1 1 3 ARG HH12 H -18.622 -6.321 10.722 1.00 . A A . 3 ARG HH12 1 1 11 7611 1 1 3 ARG HH21 H -21.208 -5.979 8.361 1.00 . A A . 3 ARG HH21 1 1 11 7612 1 1 3 ARG HH22 H -20.610 -5.470 9.915 1.00 . A A . 3 ARG HH22 1 1 11 7613 1 1 3 ARG N N -17.324 -7.194 3.055 1.00 . A A . 3 ARG N 1 1 11 7614 1 1 3 ARG NE N -19.280 -7.485 7.796 1.00 . A A . 3 ARG NE 1 1 11 7615 1 1 3 ARG NH1 N -18.510 -6.849 9.870 1.00 . A A . 3 ARG NH1 1 1 11 7616 1 1 3 ARG NH2 N -20.502 -6.021 9.081 1.00 . A A . 3 ARG NH2 1 1 11 7617 1 1 3 ARG O O -17.842 -4.348 4.144 1.00 . A A . 3 ARG O 1 1 11 7618 1 1 4 GLY C C -21.430 -3.290 3.614 1.00 . A A . 783 GLY C 1 1 11 7619 1 1 4 GLY CA C -20.167 -3.663 2.875 1.00 . A A . 783 GLY CA 1 1 11 7620 1 1 4 GLY H H -20.319 -5.769 2.901 1.00 . A A . 783 GLY H 1 1 11 7621 1 1 4 GLY HA2 H -19.378 -2.982 3.162 1.00 . A A . 783 GLY HA2 1 1 11 7622 1 1 4 GLY HA3 H -20.342 -3.569 1.814 1.00 . A A . 783 GLY HA3 1 1 11 7623 1 1 4 GLY N N -19.746 -5.011 3.163 1.00 . A A . 783 GLY N 1 1 11 7624 1 1 4 GLY O O -21.745 -3.872 4.657 1.00 . A A . 783 GLY O 1 1 11 7625 1 1 5 VAL C C -24.544 -2.200 2.658 1.00 . A A . 784 VAL C 1 1 11 7626 1 1 5 VAL CA C -23.417 -1.892 3.643 1.00 . A A . 784 VAL CA 1 1 11 7627 1 1 5 VAL CB C -23.408 -0.382 3.990 1.00 . A A . 784 VAL CB 1 1 11 7628 1 1 5 VAL CG1 C -22.360 -0.089 5.050 1.00 . A A . 784 VAL CG1 1 1 11 7629 1 1 5 VAL CG2 C -23.165 0.463 2.749 1.00 . A A . 784 VAL CG2 1 1 11 7630 1 1 5 VAL H H -21.816 -1.875 2.267 1.00 . A A . 784 VAL H 1 1 11 7631 1 1 5 VAL HA H -23.583 -2.453 4.553 1.00 . A A . 784 VAL HA 1 1 11 7632 1 1 5 VAL HB H -24.372 -0.118 4.396 1.00 . A A . 784 VAL HB 1 1 11 7633 1 1 5 VAL HG11 H -21.384 -0.370 4.680 1.00 . A A . 784 VAL HG11 1 1 11 7634 1 1 5 VAL HG12 H -22.582 -0.655 5.943 1.00 . A A . 784 VAL HG12 1 1 11 7635 1 1 5 VAL HG13 H -22.367 0.965 5.280 1.00 . A A . 784 VAL HG13 1 1 11 7636 1 1 5 VAL HG21 H -23.158 1.508 3.024 1.00 . A A . 784 VAL HG21 1 1 11 7637 1 1 5 VAL HG22 H -23.953 0.286 2.032 1.00 . A A . 784 VAL HG22 1 1 11 7638 1 1 5 VAL HG23 H -22.213 0.200 2.312 1.00 . A A . 784 VAL HG23 1 1 11 7639 1 1 5 VAL N N -22.147 -2.317 3.078 1.00 . A A . 784 VAL N 1 1 11 7640 1 1 5 VAL O O -24.325 -2.929 1.688 1.00 . A A . 784 VAL O 1 1 11 7641 1 1 6 ASP C C -26.538 -1.770 0.578 1.00 . A A . 785 ASP C 1 1 11 7642 1 1 6 ASP CA C -26.910 -1.848 2.056 1.00 . A A . 785 ASP CA 1 1 11 7643 1 1 6 ASP CB C -27.964 -0.789 2.371 1.00 . A A . 785 ASP CB 1 1 11 7644 1 1 6 ASP CG C -29.212 -0.963 1.535 1.00 . A A . 785 ASP CG 1 1 11 7645 1 1 6 ASP H H -25.851 -1.160 3.757 1.00 . A A . 785 ASP H 1 1 11 7646 1 1 6 ASP HA H -27.324 -2.824 2.259 1.00 . A A . 785 ASP HA 1 1 11 7647 1 1 6 ASP HB2 H -28.238 -0.858 3.413 1.00 . A A . 785 ASP HB2 1 1 11 7648 1 1 6 ASP HB3 H -27.552 0.191 2.174 1.00 . A A . 785 ASP HB3 1 1 11 7649 1 1 6 ASP N N -25.740 -1.668 2.925 1.00 . A A . 785 ASP N 1 1 11 7650 1 1 6 ASP O O -26.804 -2.699 -0.188 1.00 . A A . 785 ASP O 1 1 11 7651 1 1 6 ASP OD1 O -30.115 -1.717 1.951 1.00 . A A . 785 ASP OD1 1 1 11 7652 1 1 6 ASP OD2 O -29.289 -0.352 0.451 1.00 . A A . 785 ASP OD2 1 1 11 7653 1 1 7 SER C C -24.017 -1.120 -1.256 1.00 . A A . 786 SER C 1 1 11 7654 1 1 7 SER CA C -25.418 -0.519 -1.165 1.00 . A A . 786 SER CA 1 1 11 7655 1 1 7 SER CB C -25.378 0.960 -1.557 1.00 . A A . 786 SER CB 1 1 11 7656 1 1 7 SER H H -25.806 0.069 0.820 1.00 . A A . 786 SER H 1 1 11 7657 1 1 7 SER HA H -26.077 -1.052 -1.835 1.00 . A A . 786 SER HA 1 1 11 7658 1 1 7 SER HB2 H -24.668 1.476 -0.928 1.00 . A A . 786 SER HB2 1 1 11 7659 1 1 7 SER HB3 H -25.074 1.048 -2.590 1.00 . A A . 786 SER HB3 1 1 11 7660 1 1 7 SER HG H -27.256 1.218 -2.082 1.00 . A A . 786 SER HG 1 1 11 7661 1 1 7 SER N N -25.924 -0.664 0.185 1.00 . A A . 786 SER N 1 1 11 7662 1 1 7 SER O O -23.104 -0.683 -0.556 1.00 . A A . 786 SER O 1 1 11 7663 1 1 7 SER OG O -26.652 1.565 -1.401 1.00 . A A . 786 SER OG 1 1 11 7664 1 1 8 PRO C C -21.517 -1.910 -3.024 1.00 . A A . 787 PRO C 1 1 11 7665 1 1 8 PRO CA C -22.526 -2.792 -2.295 1.00 . A A . 787 PRO CA 1 1 11 7666 1 1 8 PRO CB C -22.858 -4.032 -3.142 1.00 . A A . 787 PRO CB 1 1 11 7667 1 1 8 PRO CD C -24.845 -2.700 -3.006 1.00 . A A . 787 PRO CD 1 1 11 7668 1 1 8 PRO CG C -24.350 -4.104 -3.194 1.00 . A A . 787 PRO CG 1 1 11 7669 1 1 8 PRO HA H -22.113 -3.100 -1.347 1.00 . A A . 787 PRO HA 1 1 11 7670 1 1 8 PRO HB2 H -22.439 -3.913 -4.130 1.00 . A A . 787 PRO HB2 1 1 11 7671 1 1 8 PRO HB3 H -22.438 -4.910 -2.674 1.00 . A A . 787 PRO HB3 1 1 11 7672 1 1 8 PRO HD2 H -24.884 -2.181 -3.953 1.00 . A A . 787 PRO HD2 1 1 11 7673 1 1 8 PRO HD3 H -25.812 -2.697 -2.528 1.00 . A A . 787 PRO HD3 1 1 11 7674 1 1 8 PRO HG2 H -24.665 -4.487 -4.154 1.00 . A A . 787 PRO HG2 1 1 11 7675 1 1 8 PRO HG3 H -24.714 -4.739 -2.399 1.00 . A A . 787 PRO HG3 1 1 11 7676 1 1 8 PRO N N -23.822 -2.123 -2.129 1.00 . A A . 787 PRO N 1 1 11 7677 1 1 8 PRO O O -20.336 -2.243 -3.132 1.00 . A A . 787 PRO O 1 1 11 7678 1 1 9 SER C C -20.426 1.092 -3.278 1.00 . A A . 788 SER C 1 1 11 7679 1 1 9 SER CA C -21.148 0.157 -4.242 1.00 . A A . 788 SER CA 1 1 11 7680 1 1 9 SER CB C -21.997 0.967 -5.218 1.00 . A A . 788 SER CB 1 1 11 7681 1 1 9 SER H H -22.942 -0.571 -3.407 1.00 . A A . 788 SER H 1 1 11 7682 1 1 9 SER HA H -20.416 -0.411 -4.797 1.00 . A A . 788 SER HA 1 1 11 7683 1 1 9 SER HB2 H -22.620 1.655 -4.665 1.00 . A A . 788 SER HB2 1 1 11 7684 1 1 9 SER HB3 H -21.348 1.520 -5.880 1.00 . A A . 788 SER HB3 1 1 11 7685 1 1 9 SER HG H -22.448 -0.779 -6.001 1.00 . A A . 788 SER HG 1 1 11 7686 1 1 9 SER N N -21.993 -0.778 -3.522 1.00 . A A . 788 SER N 1 1 11 7687 1 1 9 SER O O -19.672 1.972 -3.697 1.00 . A A . 788 SER O 1 1 11 7688 1 1 9 SER OG O -22.828 0.114 -5.991 1.00 . A A . 788 SER OG 1 1 11 7689 1 1 10 ALA C C -18.527 1.477 -0.907 1.00 . A A . 789 ALA C 1 1 11 7690 1 1 10 ALA CA C -20.026 1.726 -0.967 1.00 . A A . 789 ALA CA 1 1 11 7691 1 1 10 ALA CB C -20.658 1.471 0.389 1.00 . A A . 789 ALA CB 1 1 11 7692 1 1 10 ALA H H -21.245 0.164 -1.706 1.00 . A A . 789 ALA H 1 1 11 7693 1 1 10 ALA HA H -20.201 2.759 -1.231 1.00 . A A . 789 ALA HA 1 1 11 7694 1 1 10 ALA HB1 H -21.717 1.675 0.337 1.00 . A A . 789 ALA HB1 1 1 11 7695 1 1 10 ALA HB2 H -20.202 2.118 1.124 1.00 . A A . 789 ALA HB2 1 1 11 7696 1 1 10 ALA HB3 H -20.504 0.441 0.671 1.00 . A A . 789 ALA HB3 1 1 11 7697 1 1 10 ALA N N -20.649 0.893 -1.984 1.00 . A A . 789 ALA N 1 1 11 7698 1 1 10 ALA O O -17.747 2.403 -0.708 1.00 . A A . 789 ALA O 1 1 11 7699 1 1 11 GLU C C -15.925 0.507 -2.151 1.00 . A A . 790 GLU C 1 1 11 7700 1 1 11 GLU CA C -16.726 -0.165 -1.045 1.00 . A A . 790 GLU CA 1 1 11 7701 1 1 11 GLU CB C -16.560 -1.676 -1.164 1.00 . A A . 790 GLU CB 1 1 11 7702 1 1 11 GLU CD C -18.150 -1.969 0.807 1.00 . A A . 790 GLU CD 1 1 11 7703 1 1 11 GLU CG C -16.916 -2.473 0.089 1.00 . A A . 790 GLU CG 1 1 11 7704 1 1 11 GLU H H -18.816 -0.478 -1.223 1.00 . A A . 790 GLU H 1 1 11 7705 1 1 11 GLU HA H -16.329 0.153 -0.092 1.00 . A A . 790 GLU HA 1 1 11 7706 1 1 11 GLU HB2 H -17.170 -2.034 -1.980 1.00 . A A . 790 GLU HB2 1 1 11 7707 1 1 11 GLU HB3 H -15.524 -1.867 -1.391 1.00 . A A . 790 GLU HB3 1 1 11 7708 1 1 11 GLU HG2 H -17.086 -3.501 -0.194 1.00 . A A . 790 GLU HG2 1 1 11 7709 1 1 11 GLU HG3 H -16.080 -2.427 0.771 1.00 . A A . 790 GLU HG3 1 1 11 7710 1 1 11 GLU N N -18.134 0.220 -1.088 1.00 . A A . 790 GLU N 1 1 11 7711 1 1 11 GLU O O -14.718 0.711 -2.012 1.00 . A A . 790 GLU O 1 1 11 7712 1 1 11 GLU OE1 O -19.232 -1.983 0.184 1.00 . A A . 790 GLU OE1 1 1 11 7713 1 1 11 GLU OE2 O -18.043 -1.560 1.980 1.00 . A A . 790 GLU OE2 1 1 11 7714 1 1 12 LEU C C -15.541 2.955 -3.989 1.00 . A A . 791 LEU C 1 1 11 7715 1 1 12 LEU CA C -15.939 1.536 -4.360 1.00 . A A . 791 LEU CA 1 1 11 7716 1 1 12 LEU CB C -16.855 1.553 -5.585 1.00 . A A . 791 LEU CB 1 1 11 7717 1 1 12 LEU CD1 C -18.246 0.325 -7.273 1.00 . A A . 791 LEU CD1 1 1 11 7718 1 1 12 LEU CD2 C -16.086 -0.657 -6.495 1.00 . A A . 791 LEU CD2 1 1 11 7719 1 1 12 LEU CG C -17.294 0.177 -6.096 1.00 . A A . 791 LEU CG 1 1 11 7720 1 1 12 LEU H H -17.562 0.702 -3.283 1.00 . A A . 791 LEU H 1 1 11 7721 1 1 12 LEU HA H -15.049 0.981 -4.586 1.00 . A A . 791 LEU HA 1 1 11 7722 1 1 12 LEU HB2 H -17.740 2.120 -5.334 1.00 . A A . 791 LEU HB2 1 1 11 7723 1 1 12 LEU HB3 H -16.339 2.062 -6.386 1.00 . A A . 791 LEU HB3 1 1 11 7724 1 1 12 LEU HD11 H -17.749 0.851 -8.074 1.00 . A A . 791 LEU HD11 1 1 11 7725 1 1 12 LEU HD12 H -19.120 0.882 -6.964 1.00 . A A . 791 LEU HD12 1 1 11 7726 1 1 12 LEU HD13 H -18.548 -0.654 -7.616 1.00 . A A . 791 LEU HD13 1 1 11 7727 1 1 12 LEU HD21 H -15.541 -0.150 -7.276 1.00 . A A . 791 LEU HD21 1 1 11 7728 1 1 12 LEU HD22 H -16.418 -1.619 -6.853 1.00 . A A . 791 LEU HD22 1 1 11 7729 1 1 12 LEU HD23 H -15.442 -0.795 -5.636 1.00 . A A . 791 LEU HD23 1 1 11 7730 1 1 12 LEU HG H -17.816 -0.343 -5.307 1.00 . A A . 791 LEU HG 1 1 11 7731 1 1 12 LEU N N -16.598 0.876 -3.236 1.00 . A A . 791 LEU N 1 1 11 7732 1 1 12 LEU O O -14.963 3.689 -4.789 1.00 . A A . 791 LEU O 1 1 11 7733 1 1 13 ASP C C -15.249 4.486 -0.732 1.00 . A A . 792 ASP C 1 1 11 7734 1 1 13 ASP CA C -15.512 4.616 -2.226 1.00 . A A . 792 ASP CA 1 1 11 7735 1 1 13 ASP CB C -16.640 5.615 -2.499 1.00 . A A . 792 ASP CB 1 1 11 7736 1 1 13 ASP CG C -16.310 7.016 -2.026 1.00 . A A . 792 ASP CG 1 1 11 7737 1 1 13 ASP H H -16.333 2.677 -2.198 1.00 . A A . 792 ASP H 1 1 11 7738 1 1 13 ASP HA H -14.608 4.950 -2.714 1.00 . A A . 792 ASP HA 1 1 11 7739 1 1 13 ASP HB2 H -16.831 5.649 -3.560 1.00 . A A . 792 ASP HB2 1 1 11 7740 1 1 13 ASP HB3 H -17.532 5.284 -1.988 1.00 . A A . 792 ASP HB3 1 1 11 7741 1 1 13 ASP N N -15.854 3.316 -2.765 1.00 . A A . 792 ASP N 1 1 11 7742 1 1 13 ASP O O -15.104 5.478 -0.016 1.00 . A A . 792 ASP O 1 1 11 7743 1 1 13 ASP OD1 O -15.315 7.596 -2.505 1.00 . A A . 792 ASP OD1 1 1 11 7744 1 1 13 ASP OD2 O -17.057 7.552 -1.178 1.00 . A A . 792 ASP OD2 1 1 11 7745 1 1 14 LYS C C -13.526 3.389 1.473 1.00 . A A . 793 LYS C 1 1 11 7746 1 1 14 LYS CA C -14.945 2.987 1.141 1.00 . A A . 793 LYS CA 1 1 11 7747 1 1 14 LYS CB C -15.228 1.514 1.474 1.00 . A A . 793 LYS CB 1 1 11 7748 1 1 14 LYS CD C -14.409 -0.785 2.045 1.00 . A A . 793 LYS CD 1 1 11 7749 1 1 14 LYS CE C -15.234 -0.834 3.319 1.00 . A A . 793 LYS CE 1 1 11 7750 1 1 14 LYS CG C -14.005 0.638 1.701 1.00 . A A . 793 LYS CG 1 1 11 7751 1 1 14 LYS H H -15.194 2.492 -0.885 1.00 . A A . 793 LYS H 1 1 11 7752 1 1 14 LYS HA H -15.630 3.606 1.684 1.00 . A A . 793 LYS HA 1 1 11 7753 1 1 14 LYS HB2 H -15.836 1.470 2.362 1.00 . A A . 793 LYS HB2 1 1 11 7754 1 1 14 LYS HB3 H -15.784 1.090 0.652 1.00 . A A . 793 LYS HB3 1 1 11 7755 1 1 14 LYS HD2 H -14.995 -1.188 1.233 1.00 . A A . 793 LYS HD2 1 1 11 7756 1 1 14 LYS HD3 H -13.519 -1.379 2.179 1.00 . A A . 793 LYS HD3 1 1 11 7757 1 1 14 LYS HE2 H -14.598 -0.582 4.153 1.00 . A A . 793 LYS HE2 1 1 11 7758 1 1 14 LYS HE3 H -16.031 -0.111 3.243 1.00 . A A . 793 LYS HE3 1 1 11 7759 1 1 14 LYS HG2 H -13.409 0.625 0.802 1.00 . A A . 793 LYS HG2 1 1 11 7760 1 1 14 LYS HG3 H -13.425 1.046 2.516 1.00 . A A . 793 LYS HG3 1 1 11 7761 1 1 14 LYS HZ1 H -15.091 -2.912 3.435 1.00 . A A . 793 LYS HZ1 1 1 11 7762 1 1 14 LYS HZ2 H -16.593 -2.351 2.869 1.00 . A A . 793 LYS HZ2 1 1 11 7763 1 1 14 LYS HZ3 H -16.208 -2.237 4.518 1.00 . A A . 793 LYS HZ3 1 1 11 7764 1 1 14 LYS N N -15.152 3.244 -0.266 1.00 . A A . 793 LYS N 1 1 11 7765 1 1 14 LYS NZ N -15.821 -2.178 3.549 1.00 . A A . 793 LYS NZ 1 1 11 7766 1 1 14 LYS O O -13.245 3.986 2.513 1.00 . A A . 793 LYS O 1 1 11 7767 1 1 15 LYS C C -10.635 3.119 -0.792 1.00 . A A . 794 LYS C 1 1 11 7768 1 1 15 LYS CA C -11.288 3.531 0.514 1.00 . A A . 794 LYS CA 1 1 11 7769 1 1 15 LYS CB C -10.469 3.044 1.705 1.00 . A A . 794 LYS CB 1 1 11 7770 1 1 15 LYS CD C -9.728 1.192 3.178 1.00 . A A . 794 LYS CD 1 1 11 7771 1 1 15 LYS CE C -9.903 -0.252 3.609 1.00 . A A . 794 LYS CE 1 1 11 7772 1 1 15 LYS CG C -10.589 1.559 1.981 1.00 . A A . 794 LYS CG 1 1 11 7773 1 1 15 LYS H H -12.932 2.402 -0.142 1.00 . A A . 794 LYS H 1 1 11 7774 1 1 15 LYS HA H -11.338 4.610 0.542 1.00 . A A . 794 LYS HA 1 1 11 7775 1 1 15 LYS HB2 H -9.427 3.267 1.523 1.00 . A A . 794 LYS HB2 1 1 11 7776 1 1 15 LYS HB3 H -10.792 3.578 2.586 1.00 . A A . 794 LYS HB3 1 1 11 7777 1 1 15 LYS HD2 H -8.693 1.351 2.923 1.00 . A A . 794 LYS HD2 1 1 11 7778 1 1 15 LYS HD3 H -9.997 1.835 4.003 1.00 . A A . 794 LYS HD3 1 1 11 7779 1 1 15 LYS HE2 H -10.918 -0.394 3.952 1.00 . A A . 794 LYS HE2 1 1 11 7780 1 1 15 LYS HE3 H -9.711 -0.897 2.765 1.00 . A A . 794 LYS HE3 1 1 11 7781 1 1 15 LYS HG2 H -11.626 1.325 2.189 1.00 . A A . 794 LYS HG2 1 1 11 7782 1 1 15 LYS HG3 H -10.257 1.006 1.113 1.00 . A A . 794 LYS HG3 1 1 11 7783 1 1 15 LYS HZ1 H -9.115 -1.576 5.027 1.00 . A A . 794 LYS HZ1 1 1 11 7784 1 1 15 LYS HZ2 H -9.102 0.047 5.516 1.00 . A A . 794 LYS HZ2 1 1 11 7785 1 1 15 LYS HZ3 H -7.978 -0.500 4.373 1.00 . A A . 794 LYS HZ3 1 1 11 7786 1 1 15 LYS N N -12.647 3.035 0.552 1.00 . A A . 794 LYS N 1 1 11 7787 1 1 15 LYS NZ N -8.964 -0.595 4.709 1.00 . A A . 794 LYS NZ 1 1 11 7788 1 1 15 LYS O O -11.023 2.120 -1.407 1.00 . A A . 794 LYS O 1 1 11 7789 1 1 16 ALA C C -7.679 4.522 -2.455 1.00 . A A . 795 ALA C 1 1 11 7790 1 1 16 ALA CA C -8.920 3.647 -2.434 1.00 . A A . 795 ALA CA 1 1 11 7791 1 1 16 ALA CB C -9.801 3.931 -3.645 1.00 . A A . 795 ALA CB 1 1 11 7792 1 1 16 ALA H H -9.395 4.664 -0.651 1.00 . A A . 795 ALA H 1 1 11 7793 1 1 16 ALA HA H -8.627 2.606 -2.455 1.00 . A A . 795 ALA HA 1 1 11 7794 1 1 16 ALA HB1 H -10.080 4.974 -3.653 1.00 . A A . 795 ALA HB1 1 1 11 7795 1 1 16 ALA HB2 H -10.691 3.318 -3.594 1.00 . A A . 795 ALA HB2 1 1 11 7796 1 1 16 ALA HB3 H -9.255 3.696 -4.548 1.00 . A A . 795 ALA HB3 1 1 11 7797 1 1 16 ALA N N -9.646 3.887 -1.200 1.00 . A A . 795 ALA N 1 1 11 7798 1 1 16 ALA O O -7.214 4.954 -3.509 1.00 . A A . 795 ALA O 1 1 11 7799 1 1 17 ASN C C -4.708 4.851 -1.431 1.00 . A A . 796 ASN C 1 1 11 7800 1 1 17 ASN CA C -5.978 5.619 -1.100 1.00 . A A . 796 ASN CA 1 1 11 7801 1 1 17 ASN CB C -5.917 6.200 0.330 1.00 . A A . 796 ASN CB 1 1 11 7802 1 1 17 ASN CG C -6.202 5.194 1.452 1.00 . A A . 796 ASN CG 1 1 11 7803 1 1 17 ASN H H -7.518 4.322 -0.478 1.00 . A A . 796 ASN H 1 1 11 7804 1 1 17 ASN HA H -6.075 6.436 -1.801 1.00 . A A . 796 ASN HA 1 1 11 7805 1 1 17 ASN HB2 H -4.931 6.603 0.495 1.00 . A A . 796 ASN HB2 1 1 11 7806 1 1 17 ASN HB3 H -6.636 7.004 0.405 1.00 . A A . 796 ASN HB3 1 1 11 7807 1 1 17 ASN HD21 H -5.475 3.689 0.376 1.00 . A A . 796 ASN HD21 1 1 11 7808 1 1 17 ASN HD22 H -6.052 3.274 1.954 1.00 . A A . 796 ASN HD22 1 1 11 7809 1 1 17 ASN N N -7.141 4.763 -1.266 1.00 . A A . 796 ASN N 1 1 11 7810 1 1 17 ASN ND2 N -5.879 3.926 1.242 1.00 . A A . 796 ASN ND2 1 1 11 7811 1 1 17 ASN O O -3.971 4.419 -0.541 1.00 . A A . 796 ASN O 1 1 11 7812 1 1 17 ASN OD1 O -6.713 5.564 2.510 1.00 . A A . 796 ASN OD1 1 1 11 7813 1 1 18 LEU C C -2.153 4.805 -3.441 1.00 . A A . 797 LEU C 1 1 11 7814 1 1 18 LEU CA C -3.323 3.885 -3.138 1.00 . A A . 797 LEU CA 1 1 11 7815 1 1 18 LEU CB C -3.678 3.078 -4.386 1.00 . A A . 797 LEU CB 1 1 11 7816 1 1 18 LEU CD1 C -5.240 1.568 -5.642 1.00 . A A . 797 LEU CD1 1 1 11 7817 1 1 18 LEU CD2 C -4.952 1.270 -3.180 1.00 . A A . 797 LEU CD2 1 1 11 7818 1 1 18 LEU CG C -4.985 2.276 -4.320 1.00 . A A . 797 LEU CG 1 1 11 7819 1 1 18 LEU H H -4.992 5.091 -3.408 1.00 . A A . 797 LEU H 1 1 11 7820 1 1 18 LEU HA H -3.049 3.213 -2.340 1.00 . A A . 797 LEU HA 1 1 11 7821 1 1 18 LEU HB2 H -3.749 3.766 -5.209 1.00 . A A . 797 LEU HB2 1 1 11 7822 1 1 18 LEU HB3 H -2.869 2.390 -4.585 1.00 . A A . 797 LEU HB3 1 1 11 7823 1 1 18 LEU HD11 H -5.306 2.297 -6.435 1.00 . A A . 797 LEU HD11 1 1 11 7824 1 1 18 LEU HD12 H -6.166 1.016 -5.582 1.00 . A A . 797 LEU HD12 1 1 11 7825 1 1 18 LEU HD13 H -4.426 0.886 -5.848 1.00 . A A . 797 LEU HD13 1 1 11 7826 1 1 18 LEU HD21 H -4.126 0.587 -3.324 1.00 . A A . 797 LEU HD21 1 1 11 7827 1 1 18 LEU HD22 H -5.879 0.715 -3.162 1.00 . A A . 797 LEU HD22 1 1 11 7828 1 1 18 LEU HD23 H -4.826 1.791 -2.243 1.00 . A A . 797 LEU HD23 1 1 11 7829 1 1 18 LEU HG H -5.807 2.957 -4.143 1.00 . A A . 797 LEU HG 1 1 11 7830 1 1 18 LEU N N -4.456 4.659 -2.711 1.00 . A A . 797 LEU N 1 1 11 7831 1 1 18 LEU O O -2.329 5.917 -3.942 1.00 . A A . 797 LEU O 1 1 11 7832 1 1 19 LEU C C 1.254 3.899 -3.738 1.00 . A A . 798 LEU C 1 1 11 7833 1 1 19 LEU CA C 0.272 4.999 -3.449 1.00 . A A . 798 LEU CA 1 1 11 7834 1 1 19 LEU CB C 0.726 5.867 -2.279 1.00 . A A . 798 LEU CB 1 1 11 7835 1 1 19 LEU CD1 C 2.894 5.417 -1.170 1.00 . A A . 798 LEU CD1 1 1 11 7836 1 1 19 LEU CD2 C 0.803 5.484 0.182 1.00 . A A . 798 LEU CD2 1 1 11 7837 1 1 19 LEU CG C 1.412 5.117 -1.151 1.00 . A A . 798 LEU CG 1 1 11 7838 1 1 19 LEU H H -0.931 3.443 -2.699 1.00 . A A . 798 LEU H 1 1 11 7839 1 1 19 LEU HA H 0.165 5.595 -4.336 1.00 . A A . 798 LEU HA 1 1 11 7840 1 1 19 LEU HB2 H 1.409 6.614 -2.658 1.00 . A A . 798 LEU HB2 1 1 11 7841 1 1 19 LEU HB3 H -0.140 6.370 -1.873 1.00 . A A . 798 LEU HB3 1 1 11 7842 1 1 19 LEU HD11 H 3.263 5.277 -2.177 1.00 . A A . 798 LEU HD11 1 1 11 7843 1 1 19 LEU HD12 H 3.406 4.747 -0.499 1.00 . A A . 798 LEU HD12 1 1 11 7844 1 1 19 LEU HD13 H 3.059 6.438 -0.864 1.00 . A A . 798 LEU HD13 1 1 11 7845 1 1 19 LEU HD21 H 1.312 4.948 0.967 1.00 . A A . 798 LEU HD21 1 1 11 7846 1 1 19 LEU HD22 H -0.242 5.215 0.180 1.00 . A A . 798 LEU HD22 1 1 11 7847 1 1 19 LEU HD23 H 0.904 6.546 0.341 1.00 . A A . 798 LEU HD23 1 1 11 7848 1 1 19 LEU HG H 1.282 4.054 -1.302 1.00 . A A . 798 LEU HG 1 1 11 7849 1 1 19 LEU N N -0.975 4.322 -3.142 1.00 . A A . 798 LEU N 1 1 11 7850 1 1 19 LEU O O 0.873 2.729 -3.635 1.00 . A A . 798 LEU O 1 1 11 7851 1 1 20 LYS C C 4.784 3.231 -4.073 1.00 . A A . 799 LYS C 1 1 11 7852 1 1 20 LYS CA C 3.327 3.082 -4.479 1.00 . A A . 799 LYS CA 1 1 11 7853 1 1 20 LYS CB C 3.193 2.817 -5.972 1.00 . A A . 799 LYS CB 1 1 11 7854 1 1 20 LYS CD C 3.672 3.585 -8.325 1.00 . A A . 799 LYS CD 1 1 11 7855 1 1 20 LYS CE C 4.368 4.626 -9.185 1.00 . A A . 799 LYS CE 1 1 11 7856 1 1 20 LYS CG C 3.850 3.878 -6.845 1.00 . A A . 799 LYS CG 1 1 11 7857 1 1 20 LYS H H 2.824 5.115 -4.113 1.00 . A A . 799 LYS H 1 1 11 7858 1 1 20 LYS HA H 2.926 2.256 -3.919 1.00 . A A . 799 LYS HA 1 1 11 7859 1 1 20 LYS HB2 H 3.636 1.860 -6.203 1.00 . A A . 799 LYS HB2 1 1 11 7860 1 1 20 LYS HB3 H 2.140 2.790 -6.210 1.00 . A A . 799 LYS HB3 1 1 11 7861 1 1 20 LYS HD2 H 4.093 2.614 -8.543 1.00 . A A . 799 LYS HD2 1 1 11 7862 1 1 20 LYS HD3 H 2.617 3.584 -8.557 1.00 . A A . 799 LYS HD3 1 1 11 7863 1 1 20 LYS HE2 H 3.902 5.585 -9.015 1.00 . A A . 799 LYS HE2 1 1 11 7864 1 1 20 LYS HE3 H 5.406 4.675 -8.896 1.00 . A A . 799 LYS HE3 1 1 11 7865 1 1 20 LYS HG2 H 3.410 4.834 -6.624 1.00 . A A . 799 LYS HG2 1 1 11 7866 1 1 20 LYS HG3 H 4.908 3.909 -6.619 1.00 . A A . 799 LYS HG3 1 1 11 7867 1 1 20 LYS HZ1 H 4.712 5.068 -11.196 1.00 . A A . 799 LYS HZ1 1 1 11 7868 1 1 20 LYS HZ2 H 3.294 4.180 -10.927 1.00 . A A . 799 LYS HZ2 1 1 11 7869 1 1 20 LYS HZ3 H 4.805 3.415 -10.833 1.00 . A A . 799 LYS HZ3 1 1 11 7870 1 1 20 LYS N N 2.492 4.190 -4.098 1.00 . A A . 799 LYS N 1 1 11 7871 1 1 20 LYS NZ N 4.286 4.301 -10.633 1.00 . A A . 799 LYS NZ 1 1 11 7872 1 1 20 LYS O O 5.385 4.306 -4.114 1.00 . A A . 799 LYS O 1 1 11 7873 1 1 21 CYS C C 7.674 2.534 -4.156 1.00 . A A . 800 CYS C 1 1 11 7874 1 1 21 CYS CA C 6.656 1.809 -3.275 1.00 . A A . 800 CYS CA 1 1 11 7875 1 1 21 CYS CB C 6.778 0.301 -3.436 1.00 . A A . 800 CYS CB 1 1 11 7876 1 1 21 CYS H H 4.649 1.338 -3.527 1.00 . A A . 800 CYS H 1 1 11 7877 1 1 21 CYS HA H 6.821 2.078 -2.245 1.00 . A A . 800 CYS HA 1 1 11 7878 1 1 21 CYS HB2 H 5.863 -0.149 -3.074 1.00 . A A . 800 CYS HB2 1 1 11 7879 1 1 21 CYS HB3 H 6.872 0.078 -4.491 1.00 . A A . 800 CYS HB3 1 1 11 7880 1 1 21 CYS N N 5.280 2.082 -3.641 1.00 . A A . 800 CYS N 1 1 11 7881 1 1 21 CYS O O 7.810 2.243 -5.338 1.00 . A A . 800 CYS O 1 1 11 7882 1 1 21 CYS SG S 8.117 -0.545 -2.590 1.00 . A A . 800 CYS SG 1 1 11 7883 1 1 22 GLU C C 10.611 3.236 -4.653 1.00 . A A . 801 GLU C 1 1 11 7884 1 1 22 GLU CA C 9.502 4.192 -4.168 1.00 . A A . 801 GLU CA 1 1 11 7885 1 1 22 GLU CB C 10.059 5.195 -3.141 1.00 . A A . 801 GLU CB 1 1 11 7886 1 1 22 GLU CD C 10.974 6.863 -4.811 1.00 . A A . 801 GLU CD 1 1 11 7887 1 1 22 GLU CG C 11.265 5.998 -3.606 1.00 . A A . 801 GLU CG 1 1 11 7888 1 1 22 GLU H H 8.072 3.792 -2.661 1.00 . A A . 801 GLU H 1 1 11 7889 1 1 22 GLU HA H 9.132 4.738 -5.022 1.00 . A A . 801 GLU HA 1 1 11 7890 1 1 22 GLU HB2 H 9.277 5.895 -2.888 1.00 . A A . 801 GLU HB2 1 1 11 7891 1 1 22 GLU HB3 H 10.341 4.651 -2.250 1.00 . A A . 801 GLU HB3 1 1 11 7892 1 1 22 GLU HG2 H 11.588 6.633 -2.797 1.00 . A A . 801 GLU HG2 1 1 11 7893 1 1 22 GLU HG3 H 12.059 5.312 -3.860 1.00 . A A . 801 GLU HG3 1 1 11 7894 1 1 22 GLU N N 8.373 3.486 -3.547 1.00 . A A . 801 GLU N 1 1 11 7895 1 1 22 GLU O O 11.551 3.657 -5.331 1.00 . A A . 801 GLU O 1 1 11 7896 1 1 22 GLU OE1 O 10.076 7.722 -4.729 1.00 . A A . 801 GLU OE1 1 1 11 7897 1 1 22 GLU OE2 O 11.662 6.705 -5.840 1.00 . A A . 801 GLU OE2 1 1 11 7898 1 1 23 TYR C C 11.041 0.201 -6.002 1.00 . A A . 802 TYR C 1 1 11 7899 1 1 23 TYR CA C 11.515 1.007 -4.787 1.00 . A A . 802 TYR CA 1 1 11 7900 1 1 23 TYR CB C 11.937 0.079 -3.638 1.00 . A A . 802 TYR CB 1 1 11 7901 1 1 23 TYR CD1 C 12.560 -2.194 -4.551 1.00 . A A . 802 TYR CD1 1 1 11 7902 1 1 23 TYR CD2 C 14.319 -0.714 -3.922 1.00 . A A . 802 TYR CD2 1 1 11 7903 1 1 23 TYR CE1 C 13.490 -3.147 -4.917 1.00 . A A . 802 TYR CE1 1 1 11 7904 1 1 23 TYR CE2 C 15.251 -1.663 -4.287 1.00 . A A . 802 TYR CE2 1 1 11 7905 1 1 23 TYR CG C 12.957 -0.962 -4.047 1.00 . A A . 802 TYR CG 1 1 11 7906 1 1 23 TYR CZ C 14.826 -2.871 -4.815 1.00 . A A . 802 TYR CZ 1 1 11 7907 1 1 23 TYR H H 9.705 1.639 -3.874 1.00 . A A . 802 TYR H 1 1 11 7908 1 1 23 TYR HA H 12.364 1.592 -5.108 1.00 . A A . 802 TYR HA 1 1 11 7909 1 1 23 TYR HB2 H 12.369 0.671 -2.840 1.00 . A A . 802 TYR HB2 1 1 11 7910 1 1 23 TYR HB3 H 11.065 -0.437 -3.264 1.00 . A A . 802 TYR HB3 1 1 11 7911 1 1 23 TYR HD1 H 11.506 -2.404 -4.657 1.00 . A A . 802 TYR HD1 1 1 11 7912 1 1 23 TYR HD2 H 14.648 0.239 -3.533 1.00 . A A . 802 TYR HD2 1 1 11 7913 1 1 23 TYR HE1 H 13.162 -4.099 -5.307 1.00 . A A . 802 TYR HE1 1 1 11 7914 1 1 23 TYR HE2 H 16.305 -1.452 -4.179 1.00 . A A . 802 TYR HE2 1 1 11 7915 1 1 23 TYR HH H 16.477 -3.830 -4.490 1.00 . A A . 802 TYR HH 1 1 11 7916 1 1 23 TYR N N 10.499 1.952 -4.352 1.00 . A A . 802 TYR N 1 1 11 7917 1 1 23 TYR O O 11.764 0.084 -6.992 1.00 . A A . 802 TYR O 1 1 11 7918 1 1 23 TYR OH O 15.763 -3.821 -5.145 1.00 . A A . 802 TYR OH 1 1 11 7919 1 1 24 CYS C C 8.158 -0.588 -7.766 1.00 . A A . 803 CYS C 1 1 11 7920 1 1 24 CYS CA C 9.344 -1.200 -7.016 1.00 . A A . 803 CYS CA 1 1 11 7921 1 1 24 CYS CB C 8.992 -2.584 -6.472 1.00 . A A . 803 CYS CB 1 1 11 7922 1 1 24 CYS H H 9.282 -0.195 -5.149 1.00 . A A . 803 CYS H 1 1 11 7923 1 1 24 CYS HA H 10.122 -1.295 -7.756 1.00 . A A . 803 CYS HA 1 1 11 7924 1 1 24 CYS HB2 H 8.415 -3.121 -7.211 1.00 . A A . 803 CYS HB2 1 1 11 7925 1 1 24 CYS HB3 H 9.905 -3.124 -6.271 1.00 . A A . 803 CYS HB3 1 1 11 7926 1 1 24 CYS N N 9.839 -0.347 -5.938 1.00 . A A . 803 CYS N 1 1 11 7927 1 1 24 CYS O O 7.952 -0.889 -8.945 1.00 . A A . 803 CYS O 1 1 11 7928 1 1 24 CYS SG S 8.026 -2.540 -4.939 1.00 . A A . 803 CYS SG 1 1 11 7929 1 1 25 GLY C C 5.017 0.266 -7.801 1.00 . A A . 804 GLY C 1 1 11 7930 1 1 25 GLY CA C 6.347 0.979 -7.836 1.00 . A A . 804 GLY CA 1 1 11 7931 1 1 25 GLY H H 7.507 0.412 -6.159 1.00 . A A . 804 GLY H 1 1 11 7932 1 1 25 GLY HA2 H 6.230 1.959 -7.395 1.00 . A A . 804 GLY HA2 1 1 11 7933 1 1 25 GLY HA3 H 6.654 1.094 -8.865 1.00 . A A . 804 GLY HA3 1 1 11 7934 1 1 25 GLY N N 7.382 0.263 -7.118 1.00 . A A . 804 GLY N 1 1 11 7935 1 1 25 GLY O O 4.137 0.537 -8.615 1.00 . A A . 804 GLY O 1 1 11 7936 1 1 26 LYS C C 2.613 -0.534 -5.938 1.00 . A A . 805 LYS C 1 1 11 7937 1 1 26 LYS CA C 3.623 -1.371 -6.705 1.00 . A A . 805 LYS CA 1 1 11 7938 1 1 26 LYS CB C 3.857 -2.705 -5.996 1.00 . A A . 805 LYS CB 1 1 11 7939 1 1 26 LYS CD C 2.930 -4.517 -4.501 1.00 . A A . 805 LYS CD 1 1 11 7940 1 1 26 LYS CE C 3.191 -5.635 -5.495 1.00 . A A . 805 LYS CE 1 1 11 7941 1 1 26 LYS CG C 2.660 -3.192 -5.194 1.00 . A A . 805 LYS CG 1 1 11 7942 1 1 26 LYS H H 5.587 -0.797 -6.214 1.00 . A A . 805 LYS H 1 1 11 7943 1 1 26 LYS HA H 3.228 -1.563 -7.691 1.00 . A A . 805 LYS HA 1 1 11 7944 1 1 26 LYS HB2 H 4.078 -3.448 -6.743 1.00 . A A . 805 LYS HB2 1 1 11 7945 1 1 26 LYS HB3 H 4.700 -2.607 -5.330 1.00 . A A . 805 LYS HB3 1 1 11 7946 1 1 26 LYS HD2 H 3.794 -4.409 -3.863 1.00 . A A . 805 LYS HD2 1 1 11 7947 1 1 26 LYS HD3 H 2.070 -4.778 -3.901 1.00 . A A . 805 LYS HD3 1 1 11 7948 1 1 26 LYS HE2 H 2.370 -5.682 -6.193 1.00 . A A . 805 LYS HE2 1 1 11 7949 1 1 26 LYS HE3 H 4.106 -5.419 -6.027 1.00 . A A . 805 LYS HE3 1 1 11 7950 1 1 26 LYS HG2 H 2.428 -2.451 -4.445 1.00 . A A . 805 LYS HG2 1 1 11 7951 1 1 26 LYS HG3 H 1.818 -3.309 -5.861 1.00 . A A . 805 LYS HG3 1 1 11 7952 1 1 26 LYS HZ1 H 3.579 -7.689 -5.500 1.00 . A A . 805 LYS HZ1 1 1 11 7953 1 1 26 LYS HZ2 H 2.426 -7.204 -4.357 1.00 . A A . 805 LYS HZ2 1 1 11 7954 1 1 26 LYS HZ3 H 4.069 -6.896 -4.087 1.00 . A A . 805 LYS HZ3 1 1 11 7955 1 1 26 LYS N N 4.867 -0.644 -6.857 1.00 . A A . 805 LYS N 1 1 11 7956 1 1 26 LYS NZ N 3.326 -6.946 -4.813 1.00 . A A . 805 LYS NZ 1 1 11 7957 1 1 26 LYS O O 2.939 0.053 -4.902 1.00 . A A . 805 LYS O 1 1 11 7958 1 1 27 TYR C C -0.356 -0.577 -4.753 1.00 . A A . 806 TYR C 1 1 11 7959 1 1 27 TYR CA C 0.309 0.245 -5.832 1.00 . A A . 806 TYR CA 1 1 11 7960 1 1 27 TYR CB C -0.749 0.657 -6.858 1.00 . A A . 806 TYR CB 1 1 11 7961 1 1 27 TYR CD1 C -0.596 3.172 -6.871 1.00 . A A . 806 TYR CD1 1 1 11 7962 1 1 27 TYR CD2 C -0.108 1.999 -8.889 1.00 . A A . 806 TYR CD2 1 1 11 7963 1 1 27 TYR CE1 C -0.359 4.373 -7.505 1.00 . A A . 806 TYR CE1 1 1 11 7964 1 1 27 TYR CE2 C 0.128 3.197 -9.530 1.00 . A A . 806 TYR CE2 1 1 11 7965 1 1 27 TYR CG C -0.472 1.966 -7.552 1.00 . A A . 806 TYR CG 1 1 11 7966 1 1 27 TYR CZ C 0.001 4.378 -8.835 1.00 . A A . 806 TYR CZ 1 1 11 7967 1 1 27 TYR H H 1.192 -1.093 -7.216 1.00 . A A . 806 TYR H 1 1 11 7968 1 1 27 TYR HA H 0.716 1.131 -5.359 1.00 . A A . 806 TYR HA 1 1 11 7969 1 1 27 TYR HB2 H -0.815 -0.104 -7.615 1.00 . A A . 806 TYR HB2 1 1 11 7970 1 1 27 TYR HB3 H -1.705 0.743 -6.361 1.00 . A A . 806 TYR HB3 1 1 11 7971 1 1 27 TYR HD1 H -0.876 3.161 -5.827 1.00 . A A . 806 TYR HD1 1 1 11 7972 1 1 27 TYR HD2 H -0.009 1.072 -9.432 1.00 . A A . 806 TYR HD2 1 1 11 7973 1 1 27 TYR HE1 H -0.458 5.303 -6.961 1.00 . A A . 806 TYR HE1 1 1 11 7974 1 1 27 TYR HE2 H 0.410 3.204 -10.572 1.00 . A A . 806 TYR HE2 1 1 11 7975 1 1 27 TYR HH H -0.073 5.499 -10.397 1.00 . A A . 806 TYR HH 1 1 11 7976 1 1 27 TYR N N 1.391 -0.516 -6.442 1.00 . A A . 806 TYR N 1 1 11 7977 1 1 27 TYR O O -0.598 -1.778 -4.919 1.00 . A A . 806 TYR O 1 1 11 7978 1 1 27 TYR OH O 0.233 5.569 -9.478 1.00 . A A . 806 TYR OH 1 1 11 7979 1 1 28 ALA C C -1.930 0.428 -1.617 1.00 . A A . 807 ALA C 1 1 11 7980 1 1 28 ALA CA C -1.228 -0.578 -2.508 1.00 . A A . 807 ALA CA 1 1 11 7981 1 1 28 ALA CB C -0.145 -1.311 -1.735 1.00 . A A . 807 ALA CB 1 1 11 7982 1 1 28 ALA H H -0.427 1.043 -3.602 1.00 . A A . 807 ALA H 1 1 11 7983 1 1 28 ALA HA H -1.944 -1.304 -2.864 1.00 . A A . 807 ALA HA 1 1 11 7984 1 1 28 ALA HB1 H 0.316 -2.049 -2.375 1.00 . A A . 807 ALA HB1 1 1 11 7985 1 1 28 ALA HB2 H -0.583 -1.800 -0.876 1.00 . A A . 807 ALA HB2 1 1 11 7986 1 1 28 ALA HB3 H 0.601 -0.606 -1.405 1.00 . A A . 807 ALA HB3 1 1 11 7987 1 1 28 ALA N N -0.644 0.080 -3.649 1.00 . A A . 807 ALA N 1 1 11 7988 1 1 28 ALA O O -1.643 1.628 -1.672 1.00 . A A . 807 ALA O 1 1 11 7989 1 1 29 PRO C C -2.620 1.309 1.227 1.00 . A A . 808 PRO C 1 1 11 7990 1 1 29 PRO CA C -3.583 0.785 0.167 1.00 . A A . 808 PRO CA 1 1 11 7991 1 1 29 PRO CB C -4.602 -0.174 0.786 1.00 . A A . 808 PRO CB 1 1 11 7992 1 1 29 PRO CD C -3.303 -1.462 -0.735 1.00 . A A . 808 PRO CD 1 1 11 7993 1 1 29 PRO CG C -4.053 -1.537 0.559 1.00 . A A . 808 PRO CG 1 1 11 7994 1 1 29 PRO HA H -4.105 1.613 -0.303 1.00 . A A . 808 PRO HA 1 1 11 7995 1 1 29 PRO HB2 H -4.701 0.039 1.839 1.00 . A A . 808 PRO HB2 1 1 11 7996 1 1 29 PRO HB3 H -5.558 -0.049 0.297 1.00 . A A . 808 PRO HB3 1 1 11 7997 1 1 29 PRO HD2 H -2.448 -2.122 -0.710 1.00 . A A . 808 PRO HD2 1 1 11 7998 1 1 29 PRO HD3 H -3.947 -1.707 -1.562 1.00 . A A . 808 PRO HD3 1 1 11 7999 1 1 29 PRO HG2 H -3.385 -1.803 1.366 1.00 . A A . 808 PRO HG2 1 1 11 8000 1 1 29 PRO HG3 H -4.859 -2.251 0.485 1.00 . A A . 808 PRO HG3 1 1 11 8001 1 1 29 PRO N N -2.874 -0.052 -0.799 1.00 . A A . 808 PRO N 1 1 11 8002 1 1 29 PRO O O -1.850 0.542 1.808 1.00 . A A . 808 PRO O 1 1 11 8003 1 1 30 ALA C C -1.583 2.625 3.711 1.00 . A A . 809 ALA C 1 1 11 8004 1 1 30 ALA CA C -1.750 3.322 2.355 1.00 . A A . 809 ALA CA 1 1 11 8005 1 1 30 ALA CB C -2.256 4.735 2.572 1.00 . A A . 809 ALA CB 1 1 11 8006 1 1 30 ALA H H -3.266 3.164 0.877 1.00 . A A . 809 ALA H 1 1 11 8007 1 1 30 ALA HA H -0.790 3.397 1.857 1.00 . A A . 809 ALA HA 1 1 11 8008 1 1 30 ALA HB1 H -2.389 5.221 1.616 1.00 . A A . 809 ALA HB1 1 1 11 8009 1 1 30 ALA HB2 H -1.537 5.288 3.161 1.00 . A A . 809 ALA HB2 1 1 11 8010 1 1 30 ALA HB3 H -3.201 4.704 3.092 1.00 . A A . 809 ALA HB3 1 1 11 8011 1 1 30 ALA N N -2.644 2.624 1.422 1.00 . A A . 809 ALA N 1 1 11 8012 1 1 30 ALA O O -0.524 2.721 4.329 1.00 . A A . 809 ALA O 1 1 11 8013 1 1 31 GLU C C -1.565 0.121 5.465 1.00 . A A . 810 GLU C 1 1 11 8014 1 1 31 GLU CA C -2.617 1.227 5.449 1.00 . A A . 810 GLU CA 1 1 11 8015 1 1 31 GLU CB C -3.989 0.616 5.761 1.00 . A A . 810 GLU CB 1 1 11 8016 1 1 31 GLU CD C -5.537 0.408 3.786 1.00 . A A . 810 GLU CD 1 1 11 8017 1 1 31 GLU CG C -4.530 -0.291 4.672 1.00 . A A . 810 GLU CG 1 1 11 8018 1 1 31 GLU H H -3.426 1.860 3.582 1.00 . A A . 810 GLU H 1 1 11 8019 1 1 31 GLU HA H -2.385 1.925 6.238 1.00 . A A . 810 GLU HA 1 1 11 8020 1 1 31 GLU HB2 H -3.907 0.037 6.668 1.00 . A A . 810 GLU HB2 1 1 11 8021 1 1 31 GLU HB3 H -4.698 1.415 5.918 1.00 . A A . 810 GLU HB3 1 1 11 8022 1 1 31 GLU HG2 H -3.706 -0.628 4.060 1.00 . A A . 810 GLU HG2 1 1 11 8023 1 1 31 GLU HG3 H -5.005 -1.142 5.136 1.00 . A A . 810 GLU HG3 1 1 11 8024 1 1 31 GLU N N -2.634 1.939 4.165 1.00 . A A . 810 GLU N 1 1 11 8025 1 1 31 GLU O O -1.094 -0.291 6.527 1.00 . A A . 810 GLU O 1 1 11 8026 1 1 31 GLU OE1 O -5.244 1.532 3.327 1.00 . A A . 810 GLU OE1 1 1 11 8027 1 1 31 GLU OE2 O -6.632 -0.156 3.555 1.00 . A A . 810 GLU OE2 1 1 11 8028 1 1 32 GLN C C 1.163 -0.878 4.314 1.00 . A A . 811 GLN C 1 1 11 8029 1 1 32 GLN CA C -0.241 -1.437 4.175 1.00 . A A . 811 GLN CA 1 1 11 8030 1 1 32 GLN CB C -0.391 -2.149 2.836 1.00 . A A . 811 GLN CB 1 1 11 8031 1 1 32 GLN CD C 0.757 -3.611 1.136 1.00 . A A . 811 GLN CD 1 1 11 8032 1 1 32 GLN CG C 0.682 -3.193 2.585 1.00 . A A . 811 GLN CG 1 1 11 8033 1 1 32 GLN H H -1.609 0.009 3.472 1.00 . A A . 811 GLN H 1 1 11 8034 1 1 32 GLN HA H -0.426 -2.137 4.973 1.00 . A A . 811 GLN HA 1 1 11 8035 1 1 32 GLN HB2 H -1.354 -2.639 2.808 1.00 . A A . 811 GLN HB2 1 1 11 8036 1 1 32 GLN HB3 H -0.344 -1.416 2.045 1.00 . A A . 811 GLN HB3 1 1 11 8037 1 1 32 GLN HE21 H 1.882 -2.027 0.738 1.00 . A A . 811 GLN HE21 1 1 11 8038 1 1 32 GLN HE22 H 1.556 -3.074 -0.599 1.00 . A A . 811 GLN HE22 1 1 11 8039 1 1 32 GLN HG2 H 1.638 -2.784 2.873 1.00 . A A . 811 GLN HG2 1 1 11 8040 1 1 32 GLN HG3 H 0.466 -4.065 3.186 1.00 . A A . 811 GLN HG3 1 1 11 8041 1 1 32 GLN N N -1.214 -0.371 4.288 1.00 . A A . 811 GLN N 1 1 11 8042 1 1 32 GLN NE2 N 1.468 -2.826 0.346 1.00 . A A . 811 GLN NE2 1 1 11 8043 1 1 32 GLN O O 2.081 -1.567 4.766 1.00 . A A . 811 GLN O 1 1 11 8044 1 1 32 GLN OE1 O 0.144 -4.591 0.723 1.00 . A A . 811 GLN OE1 1 1 11 8045 1 1 33 PHE C C 3.001 1.379 5.417 1.00 . A A . 812 PHE C 1 1 11 8046 1 1 33 PHE CA C 2.608 1.052 3.980 1.00 . A A . 812 PHE CA 1 1 11 8047 1 1 33 PHE CB C 2.569 2.338 3.164 1.00 . A A . 812 PHE CB 1 1 11 8048 1 1 33 PHE CD1 C 1.409 1.760 1.023 1.00 . A A . 812 PHE CD1 1 1 11 8049 1 1 33 PHE CD2 C 3.737 2.265 0.942 1.00 . A A . 812 PHE CD2 1 1 11 8050 1 1 33 PHE CE1 C 1.402 1.557 -0.343 1.00 . A A . 812 PHE CE1 1 1 11 8051 1 1 33 PHE CE2 C 3.736 2.063 -0.423 1.00 . A A . 812 PHE CE2 1 1 11 8052 1 1 33 PHE CG C 2.575 2.117 1.680 1.00 . A A . 812 PHE CG 1 1 11 8053 1 1 33 PHE CZ C 2.603 1.706 -1.066 1.00 . A A . 812 PHE CZ 1 1 11 8054 1 1 33 PHE H H 0.597 0.822 3.420 1.00 . A A . 812 PHE H 1 1 11 8055 1 1 33 PHE HA H 3.342 0.400 3.531 1.00 . A A . 812 PHE HA 1 1 11 8056 1 1 33 PHE HB2 H 1.678 2.891 3.412 1.00 . A A . 812 PHE HB2 1 1 11 8057 1 1 33 PHE HB3 H 3.435 2.927 3.414 1.00 . A A . 812 PHE HB3 1 1 11 8058 1 1 33 PHE HD1 H 0.497 1.643 1.590 1.00 . A A . 812 PHE HD1 1 1 11 8059 1 1 33 PHE HD2 H 4.652 2.540 1.443 1.00 . A A . 812 PHE HD2 1 1 11 8060 1 1 33 PHE HE1 H 0.484 1.279 -0.845 1.00 . A A . 812 PHE HE1 1 1 11 8061 1 1 33 PHE HE2 H 4.649 2.180 -0.987 1.00 . A A . 812 PHE HE2 1 1 11 8062 1 1 33 PHE HZ H 2.610 1.546 -2.135 1.00 . A A . 812 PHE HZ 1 1 11 8063 1 1 33 PHE N N 1.328 0.372 3.895 1.00 . A A . 812 PHE N 1 1 11 8064 1 1 33 PHE O O 3.084 2.544 5.808 1.00 . A A . 812 PHE O 1 1 11 8065 1 1 34 ARG C C 5.227 0.879 7.544 1.00 . A A . 813 ARG C 1 1 11 8066 1 1 34 ARG CA C 3.758 0.468 7.544 1.00 . A A . 813 ARG CA 1 1 11 8067 1 1 34 ARG CB C 3.572 -0.856 8.290 1.00 . A A . 813 ARG CB 1 1 11 8068 1 1 34 ARG CD C 1.898 -2.531 9.160 1.00 . A A . 813 ARG CD 1 1 11 8069 1 1 34 ARG CG C 2.161 -1.414 8.166 1.00 . A A . 813 ARG CG 1 1 11 8070 1 1 34 ARG CZ C 3.340 -4.251 10.176 1.00 . A A . 813 ARG CZ 1 1 11 8071 1 1 34 ARG H H 3.113 -0.563 5.816 1.00 . A A . 813 ARG H 1 1 11 8072 1 1 34 ARG HA H 3.197 1.232 8.066 1.00 . A A . 813 ARG HA 1 1 11 8073 1 1 34 ARG HB2 H 4.263 -1.584 7.891 1.00 . A A . 813 ARG HB2 1 1 11 8074 1 1 34 ARG HB3 H 3.785 -0.701 9.337 1.00 . A A . 813 ARG HB3 1 1 11 8075 1 1 34 ARG HD2 H 1.872 -2.114 10.155 1.00 . A A . 813 ARG HD2 1 1 11 8076 1 1 34 ARG HD3 H 0.937 -2.971 8.931 1.00 . A A . 813 ARG HD3 1 1 11 8077 1 1 34 ARG HE H 3.320 -3.774 8.228 1.00 . A A . 813 ARG HE 1 1 11 8078 1 1 34 ARG HG2 H 1.455 -0.617 8.344 1.00 . A A . 813 ARG HG2 1 1 11 8079 1 1 34 ARG HG3 H 2.027 -1.797 7.164 1.00 . A A . 813 ARG HG3 1 1 11 8080 1 1 34 ARG HH11 H 2.113 -3.306 11.478 1.00 . A A . 813 ARG HH11 1 1 11 8081 1 1 34 ARG HH12 H 3.142 -4.519 12.178 1.00 . A A . 813 ARG HH12 1 1 11 8082 1 1 34 ARG HH21 H 4.677 -5.367 9.147 1.00 . A A . 813 ARG HH21 1 1 11 8083 1 1 34 ARG HH22 H 4.591 -5.692 10.848 1.00 . A A . 813 ARG HH22 1 1 11 8084 1 1 34 ARG N N 3.274 0.337 6.179 1.00 . A A . 813 ARG N 1 1 11 8085 1 1 34 ARG NE N 2.921 -3.573 9.110 1.00 . A A . 813 ARG NE 1 1 11 8086 1 1 34 ARG NH1 N 2.820 -4.004 11.369 1.00 . A A . 813 ARG NH1 1 1 11 8087 1 1 34 ARG NH2 N 4.277 -5.179 10.047 1.00 . A A . 813 ARG NH2 1 1 11 8088 1 1 34 ARG O O 5.834 1.068 8.596 1.00 . A A . 813 ARG O 1 1 11 8089 1 1 35 GLY C C 7.090 3.070 5.957 1.00 . A A . 814 GLY C 1 1 11 8090 1 1 35 GLY CA C 7.122 1.571 6.210 1.00 . A A . 814 GLY CA 1 1 11 8091 1 1 35 GLY H H 5.288 0.769 5.550 1.00 . A A . 814 GLY H 1 1 11 8092 1 1 35 GLY HA2 H 7.678 1.376 7.116 1.00 . A A . 814 GLY HA2 1 1 11 8093 1 1 35 GLY HA3 H 7.614 1.086 5.381 1.00 . A A . 814 GLY HA3 1 1 11 8094 1 1 35 GLY N N 5.787 1.032 6.349 1.00 . A A . 814 GLY N 1 1 11 8095 1 1 35 GLY O O 7.740 3.565 5.035 1.00 . A A . 814 GLY O 1 1 11 8096 1 1 36 SER C C 5.720 5.725 5.315 1.00 . A A . 815 SER C 1 1 11 8097 1 1 36 SER CA C 6.172 5.236 6.696 1.00 . A A . 815 SER CA 1 1 11 8098 1 1 36 SER CB C 7.499 5.895 7.090 1.00 . A A . 815 SER CB 1 1 11 8099 1 1 36 SER H H 5.750 3.294 7.423 1.00 . A A . 815 SER H 1 1 11 8100 1 1 36 SER HA H 5.399 5.552 7.380 1.00 . A A . 815 SER HA 1 1 11 8101 1 1 36 SER HB2 H 8.219 5.744 6.300 1.00 . A A . 815 SER HB2 1 1 11 8102 1 1 36 SER HB3 H 7.344 6.954 7.239 1.00 . A A . 815 SER HB3 1 1 11 8103 1 1 36 SER HG H 8.855 4.877 8.088 1.00 . A A . 815 SER HG 1 1 11 8104 1 1 36 SER N N 6.284 3.775 6.759 1.00 . A A . 815 SER N 1 1 11 8105 1 1 36 SER O O 6.108 6.806 4.871 1.00 . A A . 815 SER O 1 1 11 8106 1 1 36 SER OG O 8.020 5.335 8.290 1.00 . A A . 815 SER OG 1 1 11 8107 1 1 37 LYS C C 5.178 5.814 2.365 1.00 . A A . 816 LYS C 1 1 11 8108 1 1 37 LYS CA C 4.204 5.306 3.421 1.00 . A A . 816 LYS CA 1 1 11 8109 1 1 37 LYS CB C 3.110 6.335 3.727 1.00 . A A . 816 LYS CB 1 1 11 8110 1 1 37 LYS CD C 0.854 6.726 4.809 1.00 . A A . 816 LYS CD 1 1 11 8111 1 1 37 LYS CE C -0.223 6.099 5.680 1.00 . A A . 816 LYS CE 1 1 11 8112 1 1 37 LYS CG C 2.026 5.776 4.641 1.00 . A A . 816 LYS CG 1 1 11 8113 1 1 37 LYS H H 4.788 3.990 4.972 1.00 . A A . 816 LYS H 1 1 11 8114 1 1 37 LYS HA H 3.733 4.420 3.024 1.00 . A A . 816 LYS HA 1 1 11 8115 1 1 37 LYS HB2 H 3.557 7.196 4.204 1.00 . A A . 816 LYS HB2 1 1 11 8116 1 1 37 LYS HB3 H 2.649 6.644 2.801 1.00 . A A . 816 LYS HB3 1 1 11 8117 1 1 37 LYS HD2 H 1.199 7.638 5.273 1.00 . A A . 816 LYS HD2 1 1 11 8118 1 1 37 LYS HD3 H 0.438 6.944 3.836 1.00 . A A . 816 LYS HD3 1 1 11 8119 1 1 37 LYS HE2 H -0.491 5.141 5.262 1.00 . A A . 816 LYS HE2 1 1 11 8120 1 1 37 LYS HE3 H 0.176 5.957 6.675 1.00 . A A . 816 LYS HE3 1 1 11 8121 1 1 37 LYS HG2 H 1.660 4.853 4.218 1.00 . A A . 816 LYS HG2 1 1 11 8122 1 1 37 LYS HG3 H 2.456 5.578 5.612 1.00 . A A . 816 LYS HG3 1 1 11 8123 1 1 37 LYS HZ1 H -2.184 6.446 6.301 1.00 . A A . 816 LYS HZ1 1 1 11 8124 1 1 37 LYS HZ2 H -1.803 7.154 4.808 1.00 . A A . 816 LYS HZ2 1 1 11 8125 1 1 37 LYS HZ3 H -1.227 7.845 6.244 1.00 . A A . 816 LYS HZ3 1 1 11 8126 1 1 37 LYS N N 4.896 4.908 4.651 1.00 . A A . 816 LYS N 1 1 11 8127 1 1 37 LYS NZ N -1.442 6.943 5.764 1.00 . A A . 816 LYS NZ 1 1 11 8128 1 1 37 LYS O O 4.970 6.857 1.743 1.00 . A A . 816 LYS O 1 1 11 8129 1 1 38 ARG C C 7.630 4.003 0.476 1.00 . A A . 817 ARG C 1 1 11 8130 1 1 38 ARG CA C 7.247 5.312 1.154 1.00 . A A . 817 ARG CA 1 1 11 8131 1 1 38 ARG CB C 8.491 5.929 1.807 1.00 . A A . 817 ARG CB 1 1 11 8132 1 1 38 ARG CD C 7.870 8.314 1.321 1.00 . A A . 817 ARG CD 1 1 11 8133 1 1 38 ARG CG C 8.270 7.314 2.392 1.00 . A A . 817 ARG CG 1 1 11 8134 1 1 38 ARG CZ C 7.672 10.758 1.075 1.00 . A A . 817 ARG CZ 1 1 11 8135 1 1 38 ARG H H 6.324 4.210 2.669 1.00 . A A . 817 ARG H 1 1 11 8136 1 1 38 ARG HA H 6.857 5.991 0.410 1.00 . A A . 817 ARG HA 1 1 11 8137 1 1 38 ARG HB2 H 8.823 5.279 2.603 1.00 . A A . 817 ARG HB2 1 1 11 8138 1 1 38 ARG HB3 H 9.274 5.998 1.065 1.00 . A A . 817 ARG HB3 1 1 11 8139 1 1 38 ARG HD2 H 8.601 8.282 0.527 1.00 . A A . 817 ARG HD2 1 1 11 8140 1 1 38 ARG HD3 H 6.903 8.032 0.930 1.00 . A A . 817 ARG HD3 1 1 11 8141 1 1 38 ARG HE H 7.860 9.792 2.818 1.00 . A A . 817 ARG HE 1 1 11 8142 1 1 38 ARG HG2 H 7.485 7.261 3.131 1.00 . A A . 817 ARG HG2 1 1 11 8143 1 1 38 ARG HG3 H 9.185 7.647 2.858 1.00 . A A . 817 ARG HG3 1 1 11 8144 1 1 38 ARG HH11 H 7.439 9.718 -0.650 1.00 . A A . 817 ARG HH11 1 1 11 8145 1 1 38 ARG HH12 H 7.420 11.448 -0.820 1.00 . A A . 817 ARG HH12 1 1 11 8146 1 1 38 ARG HH21 H 7.793 12.061 2.625 1.00 . A A . 817 ARG HH21 1 1 11 8147 1 1 38 ARG HH22 H 7.609 12.789 1.051 1.00 . A A . 817 ARG HH22 1 1 11 8148 1 1 38 ARG N N 6.222 5.030 2.149 1.00 . A A . 817 ARG N 1 1 11 8149 1 1 38 ARG NE N 7.793 9.677 1.843 1.00 . A A . 817 ARG NE 1 1 11 8150 1 1 38 ARG NH1 N 7.494 10.630 -0.236 1.00 . A A . 817 ARG NH1 1 1 11 8151 1 1 38 ARG NH2 N 7.691 11.963 1.626 1.00 . A A . 817 ARG NH2 1 1 11 8152 1 1 38 ARG O O 7.918 3.961 -0.721 1.00 . A A . 817 ARG O 1 1 11 8153 1 1 39 PHE C C 6.795 0.648 1.290 1.00 . A A . 818 PHE C 1 1 11 8154 1 1 39 PHE CA C 7.863 1.587 0.754 1.00 . A A . 818 PHE CA 1 1 11 8155 1 1 39 PHE CB C 9.248 1.110 1.187 1.00 . A A . 818 PHE CB 1 1 11 8156 1 1 39 PHE CD1 C 10.855 1.740 -0.634 1.00 . A A . 818 PHE CD1 1 1 11 8157 1 1 39 PHE CD2 C 10.903 2.985 1.398 1.00 . A A . 818 PHE CD2 1 1 11 8158 1 1 39 PHE CE1 C 11.870 2.528 -1.142 1.00 . A A . 818 PHE CE1 1 1 11 8159 1 1 39 PHE CE2 C 11.915 3.777 0.894 1.00 . A A . 818 PHE CE2 1 1 11 8160 1 1 39 PHE CG C 10.362 1.958 0.641 1.00 . A A . 818 PHE CG 1 1 11 8161 1 1 39 PHE CZ C 12.398 3.548 -0.377 1.00 . A A . 818 PHE CZ 1 1 11 8162 1 1 39 PHE H H 7.428 3.033 2.213 1.00 . A A . 818 PHE H 1 1 11 8163 1 1 39 PHE HA H 7.813 1.611 -0.323 1.00 . A A . 818 PHE HA 1 1 11 8164 1 1 39 PHE HB2 H 9.308 1.133 2.265 1.00 . A A . 818 PHE HB2 1 1 11 8165 1 1 39 PHE HB3 H 9.395 0.097 0.845 1.00 . A A . 818 PHE HB3 1 1 11 8166 1 1 39 PHE HD1 H 10.440 0.942 -1.233 1.00 . A A . 818 PHE HD1 1 1 11 8167 1 1 39 PHE HD2 H 10.527 3.164 2.394 1.00 . A A . 818 PHE HD2 1 1 11 8168 1 1 39 PHE HE1 H 12.247 2.349 -2.137 1.00 . A A . 818 PHE HE1 1 1 11 8169 1 1 39 PHE HE2 H 12.328 4.575 1.494 1.00 . A A . 818 PHE HE2 1 1 11 8170 1 1 39 PHE HZ H 13.191 4.165 -0.773 1.00 . A A . 818 PHE HZ 1 1 11 8171 1 1 39 PHE N N 7.608 2.928 1.258 1.00 . A A . 818 PHE N 1 1 11 8172 1 1 39 PHE O O 6.426 0.733 2.466 1.00 . A A . 818 PHE O 1 1 11 8173 1 1 40 CYS C C 5.594 -2.178 1.749 1.00 . A A . 819 CYS C 1 1 11 8174 1 1 40 CYS CA C 5.156 -1.044 0.822 1.00 . A A . 819 CYS CA 1 1 11 8175 1 1 40 CYS CB C 4.478 -1.597 -0.436 1.00 . A A . 819 CYS CB 1 1 11 8176 1 1 40 CYS H H 6.726 -0.401 -0.407 1.00 . A A . 819 CYS H 1 1 11 8177 1 1 40 CYS HA H 4.438 -0.411 1.322 1.00 . A A . 819 CYS HA 1 1 11 8178 1 1 40 CYS HB2 H 3.908 -2.461 -0.169 1.00 . A A . 819 CYS HB2 1 1 11 8179 1 1 40 CYS HB3 H 3.815 -0.844 -0.836 1.00 . A A . 819 CYS HB3 1 1 11 8180 1 1 40 CYS N N 6.272 -0.217 0.437 1.00 . A A . 819 CYS N 1 1 11 8181 1 1 40 CYS O O 6.226 -3.132 1.296 1.00 . A A . 819 CYS O 1 1 11 8182 1 1 40 CYS SG S 5.609 -2.089 -1.753 1.00 . A A . 819 CYS SG 1 1 11 8183 1 1 41 SER C C 6.728 -3.390 4.545 1.00 . A A . 820 SER C 1 1 11 8184 1 1 41 SER CA C 5.312 -3.180 3.971 1.00 . A A . 820 SER CA 1 1 11 8185 1 1 41 SER CB C 4.760 -4.446 3.295 1.00 . A A . 820 SER CB 1 1 11 8186 1 1 41 SER H H 5.274 -1.169 3.447 1.00 . A A . 820 SER H 1 1 11 8187 1 1 41 SER HA H 4.622 -2.882 4.748 1.00 . A A . 820 SER HA 1 1 11 8188 1 1 41 SER HB2 H 3.790 -4.223 2.867 1.00 . A A . 820 SER HB2 1 1 11 8189 1 1 41 SER HB3 H 5.435 -4.756 2.512 1.00 . A A . 820 SER HB3 1 1 11 8190 1 1 41 SER HG H 4.900 -6.337 3.801 1.00 . A A . 820 SER HG 1 1 11 8191 1 1 41 SER N N 5.308 -2.051 3.042 1.00 . A A . 820 SER N 1 1 11 8192 1 1 41 SER O O 7.534 -2.456 4.561 1.00 . A A . 820 SER O 1 1 11 8193 1 1 41 SER OG O 4.609 -5.511 4.220 1.00 . A A . 820 SER OG 1 1 11 8194 1 1 42 MET C C 9.440 -5.156 4.645 1.00 . A A . 821 MET C 1 1 11 8195 1 1 42 MET CA C 8.318 -4.892 5.646 1.00 . A A . 821 MET CA 1 1 11 8196 1 1 42 MET CB C 8.160 -6.116 6.553 1.00 . A A . 821 MET CB 1 1 11 8197 1 1 42 MET CE C 9.155 -3.904 8.703 1.00 . A A . 821 MET CE 1 1 11 8198 1 1 42 MET CG C 7.353 -5.850 7.814 1.00 . A A . 821 MET CG 1 1 11 8199 1 1 42 MET H H 6.403 -5.341 4.837 1.00 . A A . 821 MET H 1 1 11 8200 1 1 42 MET HA H 8.572 -4.042 6.263 1.00 . A A . 821 MET HA 1 1 11 8201 1 1 42 MET HB2 H 7.669 -6.899 5.995 1.00 . A A . 821 MET HB2 1 1 11 8202 1 1 42 MET HB3 H 9.142 -6.459 6.846 1.00 . A A . 821 MET HB3 1 1 11 8203 1 1 42 MET HE1 H 9.780 -3.517 9.496 1.00 . A A . 821 MET HE1 1 1 11 8204 1 1 42 MET HE2 H 8.391 -3.180 8.462 1.00 . A A . 821 MET HE2 1 1 11 8205 1 1 42 MET HE3 H 9.760 -4.095 7.830 1.00 . A A . 821 MET HE3 1 1 11 8206 1 1 42 MET HG2 H 6.681 -5.028 7.624 1.00 . A A . 821 MET HG2 1 1 11 8207 1 1 42 MET HG3 H 6.778 -6.734 8.049 1.00 . A A . 821 MET HG3 1 1 11 8208 1 1 42 MET N N 7.046 -4.608 4.974 1.00 . A A . 821 MET N 1 1 11 8209 1 1 42 MET O O 10.423 -4.413 4.589 1.00 . A A . 821 MET O 1 1 11 8210 1 1 42 MET SD S 8.385 -5.431 9.240 1.00 . A A . 821 MET SD 1 1 11 8211 1 1 43 THR C C 10.703 -5.458 1.968 1.00 . A A . 822 THR C 1 1 11 8212 1 1 43 THR CA C 10.209 -6.628 2.823 1.00 . A A . 822 THR CA 1 1 11 8213 1 1 43 THR CB C 9.524 -7.654 1.903 1.00 . A A . 822 THR CB 1 1 11 8214 1 1 43 THR CG2 C 10.546 -8.541 1.210 1.00 . A A . 822 THR CG2 1 1 11 8215 1 1 43 THR H H 8.475 -6.776 4.015 1.00 . A A . 822 THR H 1 1 11 8216 1 1 43 THR HA H 11.083 -7.099 3.246 1.00 . A A . 822 THR HA 1 1 11 8217 1 1 43 THR HB H 8.957 -7.124 1.152 1.00 . A A . 822 THR HB 1 1 11 8218 1 1 43 THR HG1 H 8.322 -9.215 2.142 1.00 . A A . 822 THR HG1 1 1 11 8219 1 1 43 THR HG21 H 11.225 -7.928 0.634 1.00 . A A . 822 THR HG21 1 1 11 8220 1 1 43 THR HG22 H 10.037 -9.229 0.551 1.00 . A A . 822 THR HG22 1 1 11 8221 1 1 43 THR HG23 H 11.103 -9.097 1.950 1.00 . A A . 822 THR HG23 1 1 11 8222 1 1 43 THR N N 9.266 -6.215 3.864 1.00 . A A . 822 THR N 1 1 11 8223 1 1 43 THR O O 11.892 -5.354 1.683 1.00 . A A . 822 THR O 1 1 11 8224 1 1 43 THR OG1 O 8.632 -8.470 2.679 1.00 . A A . 822 THR OG1 1 1 11 8225 1 1 44 CYS C C 10.914 -2.369 1.501 1.00 . A A . 823 CYS C 1 1 11 8226 1 1 44 CYS CA C 10.181 -3.458 0.730 1.00 . A A . 823 CYS CA 1 1 11 8227 1 1 44 CYS CB C 8.953 -2.917 0.038 1.00 . A A . 823 CYS CB 1 1 11 8228 1 1 44 CYS H H 8.877 -4.687 1.862 1.00 . A A . 823 CYS H 1 1 11 8229 1 1 44 CYS HA H 10.839 -3.822 -0.046 1.00 . A A . 823 CYS HA 1 1 11 8230 1 1 44 CYS HB2 H 8.172 -2.747 0.764 1.00 . A A . 823 CYS HB2 1 1 11 8231 1 1 44 CYS HB3 H 9.195 -1.991 -0.462 1.00 . A A . 823 CYS HB3 1 1 11 8232 1 1 44 CYS N N 9.808 -4.586 1.566 1.00 . A A . 823 CYS N 1 1 11 8233 1 1 44 CYS O O 11.901 -1.815 1.012 1.00 . A A . 823 CYS O 1 1 11 8234 1 1 44 CYS SG S 8.336 -4.078 -1.201 1.00 . A A . 823 CYS SG 1 1 11 8235 1 1 45 ALA C C 12.504 -1.442 3.865 1.00 . A A . 824 ALA C 1 1 11 8236 1 1 45 ALA CA C 11.073 -1.044 3.522 1.00 . A A . 824 ALA CA 1 1 11 8237 1 1 45 ALA CB C 10.274 -0.800 4.783 1.00 . A A . 824 ALA CB 1 1 11 8238 1 1 45 ALA H H 9.631 -2.514 3.039 1.00 . A A . 824 ALA H 1 1 11 8239 1 1 45 ALA HA H 11.093 -0.120 2.959 1.00 . A A . 824 ALA HA 1 1 11 8240 1 1 45 ALA HB1 H 10.777 -0.060 5.387 1.00 . A A . 824 ALA HB1 1 1 11 8241 1 1 45 ALA HB2 H 10.185 -1.723 5.338 1.00 . A A . 824 ALA HB2 1 1 11 8242 1 1 45 ALA HB3 H 9.293 -0.441 4.515 1.00 . A A . 824 ALA HB3 1 1 11 8243 1 1 45 ALA N N 10.432 -2.053 2.697 1.00 . A A . 824 ALA N 1 1 11 8244 1 1 45 ALA O O 13.418 -0.619 3.787 1.00 . A A . 824 ALA O 1 1 11 8245 1 1 46 LYS C C 14.929 -3.184 3.346 1.00 . A A . 825 LYS C 1 1 11 8246 1 1 46 LYS CA C 14.035 -3.189 4.586 1.00 . A A . 825 LYS CA 1 1 11 8247 1 1 46 LYS CB C 13.942 -4.602 5.209 1.00 . A A . 825 LYS CB 1 1 11 8248 1 1 46 LYS CD C 14.620 -6.359 3.510 1.00 . A A . 825 LYS CD 1 1 11 8249 1 1 46 LYS CE C 15.536 -7.147 4.438 1.00 . A A . 825 LYS CE 1 1 11 8250 1 1 46 LYS CG C 13.469 -5.706 4.267 1.00 . A A . 825 LYS CG 1 1 11 8251 1 1 46 LYS H H 11.936 -3.318 4.321 1.00 . A A . 825 LYS H 1 1 11 8252 1 1 46 LYS HA H 14.417 -2.518 5.343 1.00 . A A . 825 LYS HA 1 1 11 8253 1 1 46 LYS HB2 H 14.915 -4.880 5.583 1.00 . A A . 825 LYS HB2 1 1 11 8254 1 1 46 LYS HB3 H 13.252 -4.560 6.040 1.00 . A A . 825 LYS HB3 1 1 11 8255 1 1 46 LYS HD2 H 14.213 -7.032 2.770 1.00 . A A . 825 LYS HD2 1 1 11 8256 1 1 46 LYS HD3 H 15.195 -5.588 3.020 1.00 . A A . 825 LYS HD3 1 1 11 8257 1 1 46 LYS HE2 H 16.412 -7.448 3.884 1.00 . A A . 825 LYS HE2 1 1 11 8258 1 1 46 LYS HE3 H 15.831 -6.508 5.257 1.00 . A A . 825 LYS HE3 1 1 11 8259 1 1 46 LYS HG2 H 12.959 -6.465 4.843 1.00 . A A . 825 LYS HG2 1 1 11 8260 1 1 46 LYS HG3 H 12.780 -5.277 3.552 1.00 . A A . 825 LYS HG3 1 1 11 8261 1 1 46 LYS HZ1 H 14.640 -9.022 4.213 1.00 . A A . 825 LYS HZ1 1 1 11 8262 1 1 46 LYS HZ2 H 13.991 -8.102 5.480 1.00 . A A . 825 LYS HZ2 1 1 11 8263 1 1 46 LYS HZ3 H 15.504 -8.844 5.661 1.00 . A A . 825 LYS HZ3 1 1 11 8264 1 1 46 LYS N N 12.702 -2.704 4.244 1.00 . A A . 825 LYS N 1 1 11 8265 1 1 46 LYS NZ N 14.872 -8.361 4.986 1.00 . A A . 825 LYS NZ 1 1 11 8266 1 1 46 LYS O O 16.138 -2.959 3.418 1.00 . A A . 825 LYS O 1 1 11 8267 1 1 47 ARG C C 15.580 -2.248 0.457 1.00 . A A . 826 ARG C 1 1 11 8268 1 1 47 ARG CA C 14.956 -3.560 0.920 1.00 . A A . 826 ARG CA 1 1 11 8269 1 1 47 ARG CB C 13.925 -4.035 -0.101 1.00 . A A . 826 ARG CB 1 1 11 8270 1 1 47 ARG CD C 13.430 -5.316 -2.188 1.00 . A A . 826 ARG CD 1 1 11 8271 1 1 47 ARG CG C 14.513 -4.643 -1.362 1.00 . A A . 826 ARG CG 1 1 11 8272 1 1 47 ARG CZ C 13.199 -6.601 -4.278 1.00 . A A . 826 ARG CZ 1 1 11 8273 1 1 47 ARG H H 13.311 -3.513 2.240 1.00 . A A . 826 ARG H 1 1 11 8274 1 1 47 ARG HA H 15.706 -4.329 1.028 1.00 . A A . 826 ARG HA 1 1 11 8275 1 1 47 ARG HB2 H 13.296 -4.779 0.367 1.00 . A A . 826 ARG HB2 1 1 11 8276 1 1 47 ARG HB3 H 13.311 -3.193 -0.387 1.00 . A A . 826 ARG HB3 1 1 11 8277 1 1 47 ARG HD2 H 12.983 -6.103 -1.597 1.00 . A A . 826 ARG HD2 1 1 11 8278 1 1 47 ARG HD3 H 12.676 -4.584 -2.435 1.00 . A A . 826 ARG HD3 1 1 11 8279 1 1 47 ARG HE H 14.896 -5.745 -3.633 1.00 . A A . 826 ARG HE 1 1 11 8280 1 1 47 ARG HG2 H 14.971 -3.862 -1.950 1.00 . A A . 826 ARG HG2 1 1 11 8281 1 1 47 ARG HG3 H 15.256 -5.378 -1.088 1.00 . A A . 826 ARG HG3 1 1 11 8282 1 1 47 ARG HH11 H 11.532 -6.562 -3.126 1.00 . A A . 826 ARG HH11 1 1 11 8283 1 1 47 ARG HH12 H 11.370 -7.395 -4.635 1.00 . A A . 826 ARG HH12 1 1 11 8284 1 1 47 ARG HH21 H 14.696 -6.883 -5.612 1.00 . A A . 826 ARG HH21 1 1 11 8285 1 1 47 ARG HH22 H 13.162 -7.583 -6.051 1.00 . A A . 826 ARG HH22 1 1 11 8286 1 1 47 ARG N N 14.285 -3.405 2.204 1.00 . A A . 826 ARG N 1 1 11 8287 1 1 47 ARG NE N 13.945 -5.898 -3.424 1.00 . A A . 826 ARG NE 1 1 11 8288 1 1 47 ARG NH1 N 11.932 -6.875 -3.989 1.00 . A A . 826 ARG NH1 1 1 11 8289 1 1 47 ARG NH2 N 13.727 -7.060 -5.401 1.00 . A A . 826 ARG NH2 1 1 11 8290 1 1 47 ARG O O 16.508 -2.236 -0.351 1.00 . A A . 826 ARG O 1 1 11 8291 1 1 48 TYR C C 17.023 0.354 0.949 1.00 . A A . 827 TYR C 1 1 11 8292 1 1 48 TYR CA C 15.536 0.190 0.650 1.00 . A A . 827 TYR CA 1 1 11 8293 1 1 48 TYR CB C 14.729 1.217 1.455 1.00 . A A . 827 TYR CB 1 1 11 8294 1 1 48 TYR CD1 C 15.538 3.448 0.583 1.00 . A A . 827 TYR CD1 1 1 11 8295 1 1 48 TYR CD2 C 15.943 2.930 2.876 1.00 . A A . 827 TYR CD2 1 1 11 8296 1 1 48 TYR CE1 C 16.159 4.671 0.744 1.00 . A A . 827 TYR CE1 1 1 11 8297 1 1 48 TYR CE2 C 16.566 4.152 3.044 1.00 . A A . 827 TYR CE2 1 1 11 8298 1 1 48 TYR CG C 15.418 2.556 1.644 1.00 . A A . 827 TYR CG 1 1 11 8299 1 1 48 TYR CZ C 16.691 5.005 2.004 1.00 . A A . 827 TYR CZ 1 1 11 8300 1 1 48 TYR H H 14.248 -1.223 1.543 1.00 . A A . 827 TYR H 1 1 11 8301 1 1 48 TYR HA H 15.319 0.358 -0.391 1.00 . A A . 827 TYR HA 1 1 11 8302 1 1 48 TYR HB2 H 13.795 1.402 0.936 1.00 . A A . 827 TYR HB2 1 1 11 8303 1 1 48 TYR HB3 H 14.515 0.811 2.433 1.00 . A A . 827 TYR HB3 1 1 11 8304 1 1 48 TYR HD1 H 15.135 3.174 -0.381 1.00 . A A . 827 TYR HD1 1 1 11 8305 1 1 48 TYR HD2 H 15.858 2.248 3.712 1.00 . A A . 827 TYR HD2 1 1 11 8306 1 1 48 TYR HE1 H 16.244 5.348 -0.095 1.00 . A A . 827 TYR HE1 1 1 11 8307 1 1 48 TYR HE2 H 16.968 4.423 4.008 1.00 . A A . 827 TYR HE2 1 1 11 8308 1 1 48 TYR HH H 16.697 6.938 1.811 1.00 . A A . 827 TYR HH 1 1 11 8309 1 1 48 TYR N N 15.051 -1.146 0.981 1.00 . A A . 827 TYR N 1 1 11 8310 1 1 48 TYR O O 17.734 1.084 0.257 1.00 . A A . 827 TYR O 1 1 11 8311 1 1 48 TYR OH O 17.286 6.240 2.134 1.00 . A A . 827 TYR OH 1 1 11 8312 1 1 49 ASN C C 19.854 -0.846 1.581 1.00 . A A . 828 ASN C 1 1 11 8313 1 1 49 ASN CA C 18.834 -0.172 2.487 1.00 . A A . 828 ASN CA 1 1 11 8314 1 1 49 ASN CB C 18.945 -0.735 3.906 1.00 . A A . 828 ASN CB 1 1 11 8315 1 1 49 ASN CG C 17.958 -0.097 4.861 1.00 . A A . 828 ASN CG 1 1 11 8316 1 1 49 ASN H H 16.885 -0.995 2.406 1.00 . A A . 828 ASN H 1 1 11 8317 1 1 49 ASN HA H 19.043 0.885 2.514 1.00 . A A . 828 ASN HA 1 1 11 8318 1 1 49 ASN HB2 H 18.756 -1.797 3.880 1.00 . A A . 828 ASN HB2 1 1 11 8319 1 1 49 ASN HB3 H 19.944 -0.560 4.278 1.00 . A A . 828 ASN HB3 1 1 11 8320 1 1 49 ASN HD21 H 16.629 -1.527 4.477 1.00 . A A . 828 ASN HD21 1 1 11 8321 1 1 49 ASN HD22 H 16.123 -0.303 5.590 1.00 . A A . 828 ASN HD22 1 1 11 8322 1 1 49 ASN N N 17.478 -0.342 1.977 1.00 . A A . 828 ASN N 1 1 11 8323 1 1 49 ASN ND2 N 16.789 -0.704 4.994 1.00 . A A . 828 ASN ND2 1 1 11 8324 1 1 49 ASN O O 20.418 -0.155 0.706 1.00 . A A . 828 ASN O 1 1 11 8325 1 1 49 ASN OXT O 20.102 -2.056 1.754 1.00 . A A . 828 ASN OXT 1 1 11 8326 1 1 49 ASN OD1 O 18.245 0.924 5.487 1.00 . A A . 828 ASN OD1 1 1 11 8327 2 2 1 ZN ZN ZN 7.542 -2.800 -2.760 1.00 . B A . 829 ZN ZN 1 1 12 8328 1 1 1 GLY C C -14.584 1.484 -14.052 1.00 . A A . 1 GLY C 1 1 12 8329 1 1 1 GLY CA C -14.083 2.081 -15.345 1.00 . A A . 1 GLY CA 1 1 12 8330 1 1 1 GLY H1 H -15.349 0.996 -16.594 1.00 . A A . 1 GLY H1 1 1 12 8331 1 1 1 GLY H2 H -14.715 2.401 -17.302 1.00 . A A . 1 GLY H2 1 1 12 8332 1 1 1 GLY H3 H -15.951 2.518 -16.149 1.00 . A A . 1 GLY H3 1 1 12 8333 1 1 1 GLY HA2 H -13.194 1.553 -15.652 1.00 . A A . 1 GLY HA2 1 1 12 8334 1 1 1 GLY HA3 H -13.836 3.119 -15.179 1.00 . A A . 1 GLY HA3 1 1 12 8335 1 1 1 GLY N N -15.094 1.993 -16.422 1.00 . A A . 1 GLY N 1 1 12 8336 1 1 1 GLY O O -15.558 0.727 -14.047 1.00 . A A . 1 GLY O 1 1 12 8337 1 1 2 THR C C -15.382 2.097 -10.987 1.00 . A A . 2 THR C 1 1 12 8338 1 1 2 THR CA C -14.284 1.275 -11.658 1.00 . A A . 2 THR CA 1 1 12 8339 1 1 2 THR CB C -13.047 1.208 -10.740 1.00 . A A . 2 THR CB 1 1 12 8340 1 1 2 THR CG2 C -13.391 0.544 -9.420 1.00 . A A . 2 THR CG2 1 1 12 8341 1 1 2 THR H H -13.208 2.489 -13.010 1.00 . A A . 2 THR H 1 1 12 8342 1 1 2 THR HA H -14.644 0.270 -11.815 1.00 . A A . 2 THR HA 1 1 12 8343 1 1 2 THR HB H -12.702 2.213 -10.547 1.00 . A A . 2 THR HB 1 1 12 8344 1 1 2 THR HG1 H -12.389 -0.073 -12.097 1.00 . A A . 2 THR HG1 1 1 12 8345 1 1 2 THR HG21 H -12.512 0.513 -8.794 1.00 . A A . 2 THR HG21 1 1 12 8346 1 1 2 THR HG22 H -13.739 -0.462 -9.602 1.00 . A A . 2 THR HG22 1 1 12 8347 1 1 2 THR HG23 H -14.165 1.109 -8.924 1.00 . A A . 2 THR HG23 1 1 12 8348 1 1 2 THR N N -13.936 1.830 -12.952 1.00 . A A . 2 THR N 1 1 12 8349 1 1 2 THR O O -15.254 3.310 -10.816 1.00 . A A . 2 THR O 1 1 12 8350 1 1 2 THR OG1 O -12.004 0.469 -11.389 1.00 . A A . 2 THR OG1 1 1 12 8351 1 1 3 ARG C C -17.857 1.466 -8.602 1.00 . A A . 3 ARG C 1 1 12 8352 1 1 3 ARG CA C -17.585 2.086 -9.966 1.00 . A A . 3 ARG CA 1 1 12 8353 1 1 3 ARG CB C -18.843 2.011 -10.830 1.00 . A A . 3 ARG CB 1 1 12 8354 1 1 3 ARG CD C -20.159 2.923 -12.755 1.00 . A A . 3 ARG CD 1 1 12 8355 1 1 3 ARG CG C -18.863 3.012 -11.969 1.00 . A A . 3 ARG CG 1 1 12 8356 1 1 3 ARG CZ C -21.365 4.187 -14.498 1.00 . A A . 3 ARG CZ 1 1 12 8357 1 1 3 ARG H H -16.508 0.455 -10.783 1.00 . A A . 3 ARG H 1 1 12 8358 1 1 3 ARG HA H -17.319 3.124 -9.826 1.00 . A A . 3 ARG HA 1 1 12 8359 1 1 3 ARG HB2 H -18.917 1.019 -11.251 1.00 . A A . 3 ARG HB2 1 1 12 8360 1 1 3 ARG HB3 H -19.706 2.191 -10.205 1.00 . A A . 3 ARG HB3 1 1 12 8361 1 1 3 ARG HD2 H -20.154 2.008 -13.328 1.00 . A A . 3 ARG HD2 1 1 12 8362 1 1 3 ARG HD3 H -20.985 2.907 -12.059 1.00 . A A . 3 ARG HD3 1 1 12 8363 1 1 3 ARG HE H -19.645 4.766 -13.646 1.00 . A A . 3 ARG HE 1 1 12 8364 1 1 3 ARG HG2 H -18.763 4.008 -11.566 1.00 . A A . 3 ARG HG2 1 1 12 8365 1 1 3 ARG HG3 H -18.037 2.803 -12.631 1.00 . A A . 3 ARG HG3 1 1 12 8366 1 1 3 ARG HH11 H -22.178 2.381 -14.065 1.00 . A A . 3 ARG HH11 1 1 12 8367 1 1 3 ARG HH12 H -23.065 3.340 -15.210 1.00 . A A . 3 ARG HH12 1 1 12 8368 1 1 3 ARG HH21 H -20.784 6.004 -15.174 1.00 . A A . 3 ARG HH21 1 1 12 8369 1 1 3 ARG HH22 H -22.245 5.379 -15.882 1.00 . A A . 3 ARG HH22 1 1 12 8370 1 1 3 ARG N N -16.466 1.429 -10.621 1.00 . A A . 3 ARG N 1 1 12 8371 1 1 3 ARG NE N -20.332 4.051 -13.670 1.00 . A A . 3 ARG NE 1 1 12 8372 1 1 3 ARG NH1 N -22.271 3.224 -14.602 1.00 . A A . 3 ARG NH1 1 1 12 8373 1 1 3 ARG NH2 N -21.476 5.278 -15.241 1.00 . A A . 3 ARG NH2 1 1 12 8374 1 1 3 ARG O O -18.638 0.521 -8.477 1.00 . A A . 3 ARG O 1 1 12 8375 1 1 4 GLY C C -18.706 2.141 -5.666 1.00 . A A . 783 GLY C 1 1 12 8376 1 1 4 GLY CA C -17.437 1.546 -6.232 1.00 . A A . 783 GLY CA 1 1 12 8377 1 1 4 GLY H H -16.560 2.727 -7.753 1.00 . A A . 783 GLY H 1 1 12 8378 1 1 4 GLY HA2 H -17.520 0.469 -6.232 1.00 . A A . 783 GLY HA2 1 1 12 8379 1 1 4 GLY HA3 H -16.603 1.839 -5.610 1.00 . A A . 783 GLY HA3 1 1 12 8380 1 1 4 GLY N N -17.205 2.002 -7.583 1.00 . A A . 783 GLY N 1 1 12 8381 1 1 4 GLY O O -18.663 3.091 -4.889 1.00 . A A . 783 GLY O 1 1 12 8382 1 1 5 VAL C C -21.609 1.533 -4.335 1.00 . A A . 784 VAL C 1 1 12 8383 1 1 5 VAL CA C -21.142 2.113 -5.670 1.00 . A A . 784 VAL CA 1 1 12 8384 1 1 5 VAL CB C -22.217 1.862 -6.760 1.00 . A A . 784 VAL CB 1 1 12 8385 1 1 5 VAL CG1 C -21.942 2.723 -7.984 1.00 . A A . 784 VAL CG1 1 1 12 8386 1 1 5 VAL CG2 C -22.276 0.389 -7.153 1.00 . A A . 784 VAL CG2 1 1 12 8387 1 1 5 VAL H H -19.801 0.775 -6.622 1.00 . A A . 784 VAL H 1 1 12 8388 1 1 5 VAL HA H -21.031 3.183 -5.555 1.00 . A A . 784 VAL HA 1 1 12 8389 1 1 5 VAL HB H -23.181 2.145 -6.361 1.00 . A A . 784 VAL HB 1 1 12 8390 1 1 5 VAL HG11 H -20.963 2.489 -8.375 1.00 . A A . 784 VAL HG11 1 1 12 8391 1 1 5 VAL HG12 H -21.978 3.765 -7.707 1.00 . A A . 784 VAL HG12 1 1 12 8392 1 1 5 VAL HG13 H -22.687 2.525 -8.738 1.00 . A A . 784 VAL HG13 1 1 12 8393 1 1 5 VAL HG21 H -21.382 0.123 -7.698 1.00 . A A . 784 VAL HG21 1 1 12 8394 1 1 5 VAL HG22 H -23.142 0.218 -7.776 1.00 . A A . 784 VAL HG22 1 1 12 8395 1 1 5 VAL HG23 H -22.348 -0.216 -6.262 1.00 . A A . 784 VAL HG23 1 1 12 8396 1 1 5 VAL N N -19.840 1.577 -6.058 1.00 . A A . 784 VAL N 1 1 12 8397 1 1 5 VAL O O -22.758 1.113 -4.191 1.00 . A A . 784 VAL O 1 1 12 8398 1 1 6 ASP C C -21.559 -0.369 -2.051 1.00 . A A . 785 ASP C 1 1 12 8399 1 1 6 ASP CA C -20.987 1.041 -2.012 1.00 . A A . 785 ASP CA 1 1 12 8400 1 1 6 ASP CB C -21.944 1.993 -1.286 1.00 . A A . 785 ASP CB 1 1 12 8401 1 1 6 ASP CG C -21.303 3.332 -0.977 1.00 . A A . 785 ASP CG 1 1 12 8402 1 1 6 ASP H H -19.800 1.869 -3.558 1.00 . A A . 785 ASP H 1 1 12 8403 1 1 6 ASP HA H -20.052 1.012 -1.471 1.00 . A A . 785 ASP HA 1 1 12 8404 1 1 6 ASP HB2 H -22.811 2.167 -1.907 1.00 . A A . 785 ASP HB2 1 1 12 8405 1 1 6 ASP HB3 H -22.258 1.542 -0.357 1.00 . A A . 785 ASP HB3 1 1 12 8406 1 1 6 ASP N N -20.697 1.526 -3.362 1.00 . A A . 785 ASP N 1 1 12 8407 1 1 6 ASP O O -22.623 -0.648 -1.498 1.00 . A A . 785 ASP O 1 1 12 8408 1 1 6 ASP OD1 O -21.214 4.182 -1.889 1.00 . A A . 785 ASP OD1 1 1 12 8409 1 1 6 ASP OD2 O -20.885 3.547 0.181 1.00 . A A . 785 ASP OD2 1 1 12 8410 1 1 7 SER C C -20.188 -3.520 -2.204 1.00 . A A . 786 SER C 1 1 12 8411 1 1 7 SER CA C -21.246 -2.637 -2.844 1.00 . A A . 786 SER CA 1 1 12 8412 1 1 7 SER CB C -21.427 -3.008 -4.315 1.00 . A A . 786 SER CB 1 1 12 8413 1 1 7 SER H H -20.020 -0.955 -3.165 1.00 . A A . 786 SER H 1 1 12 8414 1 1 7 SER HA H -22.177 -2.769 -2.326 1.00 . A A . 786 SER HA 1 1 12 8415 1 1 7 SER HB2 H -20.463 -3.008 -4.806 1.00 . A A . 786 SER HB2 1 1 12 8416 1 1 7 SER HB3 H -21.866 -3.991 -4.383 1.00 . A A . 786 SER HB3 1 1 12 8417 1 1 7 SER HG H -22.628 -1.456 -4.319 1.00 . A A . 786 SER HG 1 1 12 8418 1 1 7 SER N N -20.849 -1.247 -2.732 1.00 . A A . 786 SER N 1 1 12 8419 1 1 7 SER O O -19.005 -3.227 -2.346 1.00 . A A . 786 SER O 1 1 12 8420 1 1 7 SER OG O -22.276 -2.078 -4.967 1.00 . A A . 786 SER OG 1 1 12 8421 1 1 8 PRO C C -18.367 -5.739 -1.507 1.00 . A A . 787 PRO C 1 1 12 8422 1 1 8 PRO CA C -19.674 -5.473 -0.753 1.00 . A A . 787 PRO CA 1 1 12 8423 1 1 8 PRO CB C -20.478 -6.773 -0.592 1.00 . A A . 787 PRO CB 1 1 12 8424 1 1 8 PRO CD C -21.977 -5.010 -1.289 1.00 . A A . 787 PRO CD 1 1 12 8425 1 1 8 PRO CG C -21.845 -6.501 -1.148 1.00 . A A . 787 PRO CG 1 1 12 8426 1 1 8 PRO HA H -19.442 -5.076 0.226 1.00 . A A . 787 PRO HA 1 1 12 8427 1 1 8 PRO HB2 H -19.989 -7.567 -1.136 1.00 . A A . 787 PRO HB2 1 1 12 8428 1 1 8 PRO HB3 H -20.529 -7.034 0.455 1.00 . A A . 787 PRO HB3 1 1 12 8429 1 1 8 PRO HD2 H -22.582 -4.762 -2.150 1.00 . A A . 787 PRO HD2 1 1 12 8430 1 1 8 PRO HD3 H -22.396 -4.580 -0.392 1.00 . A A . 787 PRO HD3 1 1 12 8431 1 1 8 PRO HG2 H -21.944 -6.974 -2.114 1.00 . A A . 787 PRO HG2 1 1 12 8432 1 1 8 PRO HG3 H -22.594 -6.880 -0.470 1.00 . A A . 787 PRO HG3 1 1 12 8433 1 1 8 PRO N N -20.591 -4.584 -1.479 1.00 . A A . 787 PRO N 1 1 12 8434 1 1 8 PRO O O -17.283 -5.703 -0.919 1.00 . A A . 787 PRO O 1 1 12 8435 1 1 9 SER C C -16.573 -4.931 -3.976 1.00 . A A . 788 SER C 1 1 12 8436 1 1 9 SER CA C -17.301 -6.230 -3.636 1.00 . A A . 788 SER CA 1 1 12 8437 1 1 9 SER CB C -17.713 -6.937 -4.925 1.00 . A A . 788 SER CB 1 1 12 8438 1 1 9 SER H H -19.365 -5.994 -3.220 1.00 . A A . 788 SER H 1 1 12 8439 1 1 9 SER HA H -16.633 -6.868 -3.084 1.00 . A A . 788 SER HA 1 1 12 8440 1 1 9 SER HB2 H -18.410 -6.313 -5.466 1.00 . A A . 788 SER HB2 1 1 12 8441 1 1 9 SER HB3 H -16.838 -7.114 -5.535 1.00 . A A . 788 SER HB3 1 1 12 8442 1 1 9 SER HG H -17.657 -8.876 -4.615 1.00 . A A . 788 SER HG 1 1 12 8443 1 1 9 SER N N -18.473 -5.981 -2.807 1.00 . A A . 788 SER N 1 1 12 8444 1 1 9 SER O O -15.356 -4.832 -3.837 1.00 . A A . 788 SER O 1 1 12 8445 1 1 9 SER OG O -18.337 -8.180 -4.647 1.00 . A A . 788 SER OG 1 1 12 8446 1 1 10 ALA C C -16.373 -1.695 -3.845 1.00 . A A . 789 ALA C 1 1 12 8447 1 1 10 ALA CA C -16.756 -2.701 -4.932 1.00 . A A . 789 ALA CA 1 1 12 8448 1 1 10 ALA CB C -17.726 -2.071 -5.921 1.00 . A A . 789 ALA CB 1 1 12 8449 1 1 10 ALA H H -18.303 -4.002 -4.311 1.00 . A A . 789 ALA H 1 1 12 8450 1 1 10 ALA HA H -15.864 -2.974 -5.477 1.00 . A A . 789 ALA HA 1 1 12 8451 1 1 10 ALA HB1 H -18.636 -1.794 -5.410 1.00 . A A . 789 ALA HB1 1 1 12 8452 1 1 10 ALA HB2 H -17.955 -2.782 -6.702 1.00 . A A . 789 ALA HB2 1 1 12 8453 1 1 10 ALA HB3 H -17.275 -1.190 -6.355 1.00 . A A . 789 ALA HB3 1 1 12 8454 1 1 10 ALA N N -17.330 -3.926 -4.387 1.00 . A A . 789 ALA N 1 1 12 8455 1 1 10 ALA O O -15.983 -0.569 -4.150 1.00 . A A . 789 ALA O 1 1 12 8456 1 1 11 GLU C C -14.570 -1.182 -1.337 1.00 . A A . 790 GLU C 1 1 12 8457 1 1 11 GLU CA C -16.080 -1.201 -1.494 1.00 . A A . 790 GLU CA 1 1 12 8458 1 1 11 GLU CB C -16.718 -1.600 -0.172 1.00 . A A . 790 GLU CB 1 1 12 8459 1 1 11 GLU CD C -18.796 -1.636 1.256 1.00 . A A . 790 GLU CD 1 1 12 8460 1 1 11 GLU CG C -18.201 -1.277 -0.088 1.00 . A A . 790 GLU CG 1 1 12 8461 1 1 11 GLU H H -16.840 -2.976 -2.379 1.00 . A A . 790 GLU H 1 1 12 8462 1 1 11 GLU HA H -16.408 -0.205 -1.751 1.00 . A A . 790 GLU HA 1 1 12 8463 1 1 11 GLU HB2 H -16.587 -2.663 -0.029 1.00 . A A . 790 GLU HB2 1 1 12 8464 1 1 11 GLU HB3 H -16.208 -1.073 0.620 1.00 . A A . 790 GLU HB3 1 1 12 8465 1 1 11 GLU HG2 H -18.337 -0.218 -0.250 1.00 . A A . 790 GLU HG2 1 1 12 8466 1 1 11 GLU HG3 H -18.724 -1.828 -0.855 1.00 . A A . 790 GLU HG3 1 1 12 8467 1 1 11 GLU N N -16.478 -2.086 -2.583 1.00 . A A . 790 GLU N 1 1 12 8468 1 1 11 GLU O O -14.004 -0.229 -0.805 1.00 . A A . 790 GLU O 1 1 12 8469 1 1 11 GLU OE1 O -18.514 -0.924 2.242 1.00 . A A . 790 GLU OE1 1 1 12 8470 1 1 11 GLU OE2 O -19.542 -2.632 1.337 1.00 . A A . 790 GLU OE2 1 1 12 8471 1 1 12 LEU C C -11.935 -1.314 -2.888 1.00 . A A . 791 LEU C 1 1 12 8472 1 1 12 LEU CA C -12.461 -2.232 -1.796 1.00 . A A . 791 LEU CA 1 1 12 8473 1 1 12 LEU CB C -11.903 -3.663 -1.916 1.00 . A A . 791 LEU CB 1 1 12 8474 1 1 12 LEU CD1 C -11.448 -4.130 -4.350 1.00 . A A . 791 LEU CD1 1 1 12 8475 1 1 12 LEU CD2 C -12.270 -5.958 -2.855 1.00 . A A . 791 LEU CD2 1 1 12 8476 1 1 12 LEU CG C -12.325 -4.467 -3.154 1.00 . A A . 791 LEU CG 1 1 12 8477 1 1 12 LEU H H -14.399 -2.992 -2.176 1.00 . A A . 791 LEU H 1 1 12 8478 1 1 12 LEU HA H -12.173 -1.820 -0.853 1.00 . A A . 791 LEU HA 1 1 12 8479 1 1 12 LEU HB2 H -10.825 -3.601 -1.917 1.00 . A A . 791 LEU HB2 1 1 12 8480 1 1 12 LEU HB3 H -12.208 -4.217 -1.039 1.00 . A A . 791 LEU HB3 1 1 12 8481 1 1 12 LEU HD11 H -10.420 -4.366 -4.119 1.00 . A A . 791 LEU HD11 1 1 12 8482 1 1 12 LEU HD12 H -11.535 -3.077 -4.576 1.00 . A A . 791 LEU HD12 1 1 12 8483 1 1 12 LEU HD13 H -11.768 -4.709 -5.205 1.00 . A A . 791 LEU HD13 1 1 12 8484 1 1 12 LEU HD21 H -11.268 -6.231 -2.559 1.00 . A A . 791 LEU HD21 1 1 12 8485 1 1 12 LEU HD22 H -12.547 -6.511 -3.739 1.00 . A A . 791 LEU HD22 1 1 12 8486 1 1 12 LEU HD23 H -12.957 -6.191 -2.055 1.00 . A A . 791 LEU HD23 1 1 12 8487 1 1 12 LEU HG H -13.345 -4.214 -3.406 1.00 . A A . 791 LEU HG 1 1 12 8488 1 1 12 LEU N N -13.909 -2.222 -1.817 1.00 . A A . 791 LEU N 1 1 12 8489 1 1 12 LEU O O -10.759 -0.952 -2.920 1.00 . A A . 791 LEU O 1 1 12 8490 1 1 13 ASP C C -13.051 1.418 -4.377 1.00 . A A . 792 ASP C 1 1 12 8491 1 1 13 ASP CA C -12.569 0.047 -4.812 1.00 . A A . 792 ASP CA 1 1 12 8492 1 1 13 ASP CB C -13.269 -0.339 -6.119 1.00 . A A . 792 ASP CB 1 1 12 8493 1 1 13 ASP CG C -12.872 -1.704 -6.641 1.00 . A A . 792 ASP CG 1 1 12 8494 1 1 13 ASP H H -13.751 -1.285 -3.672 1.00 . A A . 792 ASP H 1 1 12 8495 1 1 13 ASP HA H -11.506 0.079 -4.963 1.00 . A A . 792 ASP HA 1 1 12 8496 1 1 13 ASP HB2 H -14.336 -0.342 -5.952 1.00 . A A . 792 ASP HB2 1 1 12 8497 1 1 13 ASP HB3 H -13.034 0.397 -6.874 1.00 . A A . 792 ASP HB3 1 1 12 8498 1 1 13 ASP N N -12.849 -0.917 -3.756 1.00 . A A . 792 ASP N 1 1 12 8499 1 1 13 ASP O O -12.790 2.432 -5.028 1.00 . A A . 792 ASP O 1 1 12 8500 1 1 13 ASP OD1 O -11.781 -1.828 -7.235 1.00 . A A . 792 ASP OD1 1 1 12 8501 1 1 13 ASP OD2 O -13.667 -2.655 -6.481 1.00 . A A . 792 ASP OD2 1 1 12 8502 1 1 14 LYS C C -13.223 3.494 -2.087 1.00 . A A . 793 LYS C 1 1 12 8503 1 1 14 LYS CA C -14.325 2.645 -2.703 1.00 . A A . 793 LYS CA 1 1 12 8504 1 1 14 LYS CB C -15.383 2.299 -1.648 1.00 . A A . 793 LYS CB 1 1 12 8505 1 1 14 LYS CD C -16.921 3.077 0.175 1.00 . A A . 793 LYS CD 1 1 12 8506 1 1 14 LYS CE C -17.507 4.272 0.907 1.00 . A A . 793 LYS CE 1 1 12 8507 1 1 14 LYS CG C -16.019 3.504 -0.974 1.00 . A A . 793 LYS CG 1 1 12 8508 1 1 14 LYS H H -13.901 0.582 -2.799 1.00 . A A . 793 LYS H 1 1 12 8509 1 1 14 LYS HA H -14.791 3.192 -3.504 1.00 . A A . 793 LYS HA 1 1 12 8510 1 1 14 LYS HB2 H -16.169 1.729 -2.121 1.00 . A A . 793 LYS HB2 1 1 12 8511 1 1 14 LYS HB3 H -14.921 1.691 -0.884 1.00 . A A . 793 LYS HB3 1 1 12 8512 1 1 14 LYS HD2 H -17.730 2.481 -0.222 1.00 . A A . 793 LYS HD2 1 1 12 8513 1 1 14 LYS HD3 H -16.345 2.485 0.871 1.00 . A A . 793 LYS HD3 1 1 12 8514 1 1 14 LYS HE2 H -17.963 3.931 1.824 1.00 . A A . 793 LYS HE2 1 1 12 8515 1 1 14 LYS HE3 H -16.709 4.961 1.139 1.00 . A A . 793 LYS HE3 1 1 12 8516 1 1 14 LYS HG2 H -15.240 4.146 -0.592 1.00 . A A . 793 LYS HG2 1 1 12 8517 1 1 14 LYS HG3 H -16.610 4.042 -1.704 1.00 . A A . 793 LYS HG3 1 1 12 8518 1 1 14 LYS HZ1 H -18.783 5.887 0.552 1.00 . A A . 793 LYS HZ1 1 1 12 8519 1 1 14 LYS HZ2 H -19.398 4.396 0.025 1.00 . A A . 793 LYS HZ2 1 1 12 8520 1 1 14 LYS HZ3 H -18.176 5.169 -0.863 1.00 . A A . 793 LYS HZ3 1 1 12 8521 1 1 14 LYS N N -13.761 1.428 -3.263 1.00 . A A . 793 LYS N 1 1 12 8522 1 1 14 LYS NZ N -18.534 4.980 0.098 1.00 . A A . 793 LYS NZ 1 1 12 8523 1 1 14 LYS O O -13.254 4.723 -2.153 1.00 . A A . 793 LYS O 1 1 12 8524 1 1 15 LYS C C -10.154 4.006 -1.961 1.00 . A A . 794 LYS C 1 1 12 8525 1 1 15 LYS CA C -11.110 3.491 -0.889 1.00 . A A . 794 LYS CA 1 1 12 8526 1 1 15 LYS CB C -10.380 2.533 0.061 1.00 . A A . 794 LYS CB 1 1 12 8527 1 1 15 LYS CD C -11.713 3.108 2.116 1.00 . A A . 794 LYS CD 1 1 12 8528 1 1 15 LYS CE C -12.591 2.573 3.239 1.00 . A A . 794 LYS CE 1 1 12 8529 1 1 15 LYS CG C -11.252 1.997 1.186 1.00 . A A . 794 LYS CG 1 1 12 8530 1 1 15 LYS H H -12.281 1.843 -1.492 1.00 . A A . 794 LYS H 1 1 12 8531 1 1 15 LYS HA H -11.490 4.328 -0.326 1.00 . A A . 794 LYS HA 1 1 12 8532 1 1 15 LYS HB2 H -10.012 1.693 -0.507 1.00 . A A . 794 LYS HB2 1 1 12 8533 1 1 15 LYS HB3 H -9.541 3.053 0.501 1.00 . A A . 794 LYS HB3 1 1 12 8534 1 1 15 LYS HD2 H -10.846 3.586 2.548 1.00 . A A . 794 LYS HD2 1 1 12 8535 1 1 15 LYS HD3 H -12.277 3.830 1.544 1.00 . A A . 794 LYS HD3 1 1 12 8536 1 1 15 LYS HE2 H -12.880 3.397 3.874 1.00 . A A . 794 LYS HE2 1 1 12 8537 1 1 15 LYS HE3 H -13.474 2.125 2.807 1.00 . A A . 794 LYS HE3 1 1 12 8538 1 1 15 LYS HG2 H -12.120 1.515 0.758 1.00 . A A . 794 LYS HG2 1 1 12 8539 1 1 15 LYS HG3 H -10.685 1.276 1.755 1.00 . A A . 794 LYS HG3 1 1 12 8540 1 1 15 LYS HZ1 H -11.020 1.964 4.481 1.00 . A A . 794 LYS HZ1 1 1 12 8541 1 1 15 LYS HZ2 H -11.624 0.736 3.472 1.00 . A A . 794 LYS HZ2 1 1 12 8542 1 1 15 LYS HZ3 H -12.502 1.223 4.833 1.00 . A A . 794 LYS HZ3 1 1 12 8543 1 1 15 LYS N N -12.241 2.820 -1.506 1.00 . A A . 794 LYS N 1 1 12 8544 1 1 15 LYS NZ N -11.885 1.556 4.062 1.00 . A A . 794 LYS NZ 1 1 12 8545 1 1 15 LYS O O -10.088 5.212 -2.205 1.00 . A A . 794 LYS O 1 1 12 8546 1 1 16 ALA C C -7.554 4.576 -3.251 1.00 . A A . 795 ALA C 1 1 12 8547 1 1 16 ALA CA C -8.472 3.419 -3.659 1.00 . A A . 795 ALA CA 1 1 12 8548 1 1 16 ALA CB C -9.187 3.738 -4.966 1.00 . A A . 795 ALA CB 1 1 12 8549 1 1 16 ALA H H -9.592 2.140 -2.399 1.00 . A A . 795 ALA H 1 1 12 8550 1 1 16 ALA HA H -7.859 2.543 -3.825 1.00 . A A . 795 ALA HA 1 1 12 8551 1 1 16 ALA HB1 H -9.832 2.914 -5.232 1.00 . A A . 795 ALA HB1 1 1 12 8552 1 1 16 ALA HB2 H -8.458 3.889 -5.750 1.00 . A A . 795 ALA HB2 1 1 12 8553 1 1 16 ALA HB3 H -9.777 4.634 -4.846 1.00 . A A . 795 ALA HB3 1 1 12 8554 1 1 16 ALA N N -9.448 3.083 -2.617 1.00 . A A . 795 ALA N 1 1 12 8555 1 1 16 ALA O O -7.170 5.404 -4.079 1.00 . A A . 795 ALA O 1 1 12 8556 1 1 17 ASN C C -4.836 5.092 -1.686 1.00 . A A . 796 ASN C 1 1 12 8557 1 1 17 ASN CA C -6.250 5.614 -1.472 1.00 . A A . 796 ASN CA 1 1 12 8558 1 1 17 ASN CB C -6.490 5.913 0.019 1.00 . A A . 796 ASN CB 1 1 12 8559 1 1 17 ASN CG C -6.523 4.659 0.885 1.00 . A A . 796 ASN CG 1 1 12 8560 1 1 17 ASN H H -7.620 4.007 -1.338 1.00 . A A . 796 ASN H 1 1 12 8561 1 1 17 ASN HA H -6.375 6.524 -2.041 1.00 . A A . 796 ASN HA 1 1 12 8562 1 1 17 ASN HB2 H -5.698 6.553 0.381 1.00 . A A . 796 ASN HB2 1 1 12 8563 1 1 17 ASN HB3 H -7.434 6.427 0.126 1.00 . A A . 796 ASN HB3 1 1 12 8564 1 1 17 ASN HD21 H -8.511 4.600 0.772 1.00 . A A . 796 ASN HD21 1 1 12 8565 1 1 17 ASN HD22 H -7.762 3.320 1.687 1.00 . A A . 796 ASN HD22 1 1 12 8566 1 1 17 ASN N N -7.215 4.638 -1.968 1.00 . A A . 796 ASN N 1 1 12 8567 1 1 17 ASN ND2 N -7.717 4.145 1.142 1.00 . A A . 796 ASN ND2 1 1 12 8568 1 1 17 ASN O O -4.018 5.065 -0.763 1.00 . A A . 796 ASN O 1 1 12 8569 1 1 17 ASN OD1 O -5.492 4.174 1.349 1.00 . A A . 796 ASN OD1 1 1 12 8570 1 1 18 LEU C C -2.171 4.899 -3.512 1.00 . A A . 797 LEU C 1 1 12 8571 1 1 18 LEU CA C -3.316 3.953 -3.175 1.00 . A A . 797 LEU CA 1 1 12 8572 1 1 18 LEU CB C -3.525 2.986 -4.344 1.00 . A A . 797 LEU CB 1 1 12 8573 1 1 18 LEU CD1 C -4.929 1.316 -5.576 1.00 . A A . 797 LEU CD1 1 1 12 8574 1 1 18 LEU CD2 C -4.980 1.363 -3.085 1.00 . A A . 797 LEU CD2 1 1 12 8575 1 1 18 LEU CG C -4.842 2.200 -4.343 1.00 . A A . 797 LEU CG 1 1 12 8576 1 1 18 LEU H H -5.081 4.932 -3.682 1.00 . A A . 797 LEU H 1 1 12 8577 1 1 18 LEU HA H -3.062 3.389 -2.291 1.00 . A A . 797 LEU HA 1 1 12 8578 1 1 18 LEU HB2 H -3.477 3.556 -5.256 1.00 . A A . 797 LEU HB2 1 1 12 8579 1 1 18 LEU HB3 H -2.711 2.276 -4.342 1.00 . A A . 797 LEU HB3 1 1 12 8580 1 1 18 LEU HD11 H -5.849 0.753 -5.551 1.00 . A A . 797 LEU HD11 1 1 12 8581 1 1 18 LEU HD12 H -4.090 0.637 -5.594 1.00 . A A . 797 LEU HD12 1 1 12 8582 1 1 18 LEU HD13 H -4.911 1.933 -6.461 1.00 . A A . 797 LEU HD13 1 1 12 8583 1 1 18 LEU HD21 H -4.148 0.679 -3.014 1.00 . A A . 797 LEU HD21 1 1 12 8584 1 1 18 LEU HD22 H -5.902 0.803 -3.124 1.00 . A A . 797 LEU HD22 1 1 12 8585 1 1 18 LEU HD23 H -4.990 2.010 -2.220 1.00 . A A . 797 LEU HD23 1 1 12 8586 1 1 18 LEU HG H -5.668 2.895 -4.375 1.00 . A A . 797 LEU HG 1 1 12 8587 1 1 18 LEU N N -4.532 4.685 -2.911 1.00 . A A . 797 LEU N 1 1 12 8588 1 1 18 LEU O O -2.371 5.973 -4.082 1.00 . A A . 797 LEU O 1 1 12 8589 1 1 19 LEU C C 1.274 4.023 -3.648 1.00 . A A . 798 LEU C 1 1 12 8590 1 1 19 LEU CA C 0.252 5.128 -3.541 1.00 . A A . 798 LEU CA 1 1 12 8591 1 1 19 LEU CB C 0.643 6.261 -2.555 1.00 . A A . 798 LEU CB 1 1 12 8592 1 1 19 LEU CD1 C 0.349 4.806 -0.487 1.00 . A A . 798 LEU CD1 1 1 12 8593 1 1 19 LEU CD2 C 2.643 5.473 -1.253 1.00 . A A . 798 LEU CD2 1 1 12 8594 1 1 19 LEU CG C 1.185 5.881 -1.163 1.00 . A A . 798 LEU CG 1 1 12 8595 1 1 19 LEU H H -0.928 3.658 -2.605 1.00 . A A . 798 LEU H 1 1 12 8596 1 1 19 LEU HA H 0.127 5.541 -4.528 1.00 . A A . 798 LEU HA 1 1 12 8597 1 1 19 LEU HB2 H 1.394 6.866 -3.039 1.00 . A A . 798 LEU HB2 1 1 12 8598 1 1 19 LEU HB3 H -0.232 6.878 -2.409 1.00 . A A . 798 LEU HB3 1 1 12 8599 1 1 19 LEU HD11 H -0.661 5.166 -0.356 1.00 . A A . 798 LEU HD11 1 1 12 8600 1 1 19 LEU HD12 H 0.775 4.569 0.477 1.00 . A A . 798 LEU HD12 1 1 12 8601 1 1 19 LEU HD13 H 0.339 3.919 -1.104 1.00 . A A . 798 LEU HD13 1 1 12 8602 1 1 19 LEU HD21 H 3.243 6.332 -1.506 1.00 . A A . 798 LEU HD21 1 1 12 8603 1 1 19 LEU HD22 H 2.751 4.723 -2.023 1.00 . A A . 798 LEU HD22 1 1 12 8604 1 1 19 LEU HD23 H 2.966 5.070 -0.306 1.00 . A A . 798 LEU HD23 1 1 12 8605 1 1 19 LEU HG H 1.136 6.759 -0.535 1.00 . A A . 798 LEU HG 1 1 12 8606 1 1 19 LEU N N -0.985 4.473 -3.155 1.00 . A A . 798 LEU N 1 1 12 8607 1 1 19 LEU O O 0.995 2.909 -3.196 1.00 . A A . 798 LEU O 1 1 12 8608 1 1 20 LYS C C 4.641 3.181 -3.983 1.00 . A A . 799 LYS C 1 1 12 8609 1 1 20 LYS CA C 3.246 3.109 -4.573 1.00 . A A . 799 LYS CA 1 1 12 8610 1 1 20 LYS CB C 3.305 2.862 -6.080 1.00 . A A . 799 LYS CB 1 1 12 8611 1 1 20 LYS CD C 4.043 3.734 -8.328 1.00 . A A . 799 LYS CD 1 1 12 8612 1 1 20 LYS CE C 4.743 4.870 -9.053 1.00 . A A . 799 LYS CE 1 1 12 8613 1 1 20 LYS CG C 4.047 3.960 -6.828 1.00 . A A . 799 LYS CG 1 1 12 8614 1 1 20 LYS H H 2.721 5.176 -4.443 1.00 . A A . 799 LYS H 1 1 12 8615 1 1 20 LYS HA H 2.753 2.303 -4.063 1.00 . A A . 799 LYS HA 1 1 12 8616 1 1 20 LYS HB2 H 3.806 1.924 -6.262 1.00 . A A . 799 LYS HB2 1 1 12 8617 1 1 20 LYS HB3 H 2.299 2.808 -6.467 1.00 . A A . 799 LYS HB3 1 1 12 8618 1 1 20 LYS HD2 H 4.560 2.810 -8.545 1.00 . A A . 799 LYS HD2 1 1 12 8619 1 1 20 LYS HD3 H 3.021 3.670 -8.671 1.00 . A A . 799 LYS HD3 1 1 12 8620 1 1 20 LYS HE2 H 4.305 5.806 -8.739 1.00 . A A . 799 LYS HE2 1 1 12 8621 1 1 20 LYS HE3 H 5.790 4.856 -8.785 1.00 . A A . 799 LYS HE3 1 1 12 8622 1 1 20 LYS HG2 H 3.575 4.905 -6.617 1.00 . A A . 799 LYS HG2 1 1 12 8623 1 1 20 LYS HG3 H 5.068 3.985 -6.481 1.00 . A A . 799 LYS HG3 1 1 12 8624 1 1 20 LYS HZ1 H 5.119 5.543 -10.990 1.00 . A A . 799 LYS HZ1 1 1 12 8625 1 1 20 LYS HZ2 H 3.618 4.783 -10.812 1.00 . A A . 799 LYS HZ2 1 1 12 8626 1 1 20 LYS HZ3 H 5.040 3.855 -10.859 1.00 . A A . 799 LYS HZ3 1 1 12 8627 1 1 20 LYS N N 2.423 4.255 -4.256 1.00 . A A . 799 LYS N 1 1 12 8628 1 1 20 LYS NZ N 4.621 4.755 -10.530 1.00 . A A . 799 LYS NZ 1 1 12 8629 1 1 20 LYS O O 5.286 4.229 -3.935 1.00 . A A . 799 LYS O 1 1 12 8630 1 1 21 CYS C C 7.439 2.217 -3.983 1.00 . A A . 800 CYS C 1 1 12 8631 1 1 21 CYS CA C 6.372 1.716 -3.015 1.00 . A A . 800 CYS CA 1 1 12 8632 1 1 21 CYS CB C 6.429 0.189 -2.901 1.00 . A A . 800 CYS CB 1 1 12 8633 1 1 21 CYS H H 4.371 1.295 -3.442 1.00 . A A . 800 CYS H 1 1 12 8634 1 1 21 CYS HA H 6.483 2.147 -2.033 1.00 . A A . 800 CYS HA 1 1 12 8635 1 1 21 CYS HB2 H 5.768 -0.123 -2.104 1.00 . A A . 800 CYS HB2 1 1 12 8636 1 1 21 CYS HB3 H 6.067 -0.230 -3.829 1.00 . A A . 800 CYS HB3 1 1 12 8637 1 1 21 CYS N N 5.039 2.011 -3.505 1.00 . A A . 800 CYS N 1 1 12 8638 1 1 21 CYS O O 7.665 1.596 -5.017 1.00 . A A . 800 CYS O 1 1 12 8639 1 1 21 CYS SG S 8.033 -0.563 -2.560 1.00 . A A . 800 CYS SG 1 1 12 8640 1 1 22 GLU C C 10.355 3.099 -4.717 1.00 . A A . 801 GLU C 1 1 12 8641 1 1 22 GLU CA C 9.087 3.947 -4.539 1.00 . A A . 801 GLU CA 1 1 12 8642 1 1 22 GLU CB C 9.449 5.350 -4.047 1.00 . A A . 801 GLU CB 1 1 12 8643 1 1 22 GLU CD C 8.751 7.779 -3.954 1.00 . A A . 801 GLU CD 1 1 12 8644 1 1 22 GLU CG C 8.312 6.348 -4.185 1.00 . A A . 801 GLU CG 1 1 12 8645 1 1 22 GLU H H 7.900 3.753 -2.785 1.00 . A A . 801 GLU H 1 1 12 8646 1 1 22 GLU HA H 8.636 4.043 -5.514 1.00 . A A . 801 GLU HA 1 1 12 8647 1 1 22 GLU HB2 H 9.726 5.290 -3.004 1.00 . A A . 801 GLU HB2 1 1 12 8648 1 1 22 GLU HB3 H 10.292 5.715 -4.616 1.00 . A A . 801 GLU HB3 1 1 12 8649 1 1 22 GLU HG2 H 7.904 6.271 -5.183 1.00 . A A . 801 GLU HG2 1 1 12 8650 1 1 22 GLU HG3 H 7.547 6.102 -3.466 1.00 . A A . 801 GLU HG3 1 1 12 8651 1 1 22 GLU N N 8.090 3.328 -3.653 1.00 . A A . 801 GLU N 1 1 12 8652 1 1 22 GLU O O 11.397 3.614 -5.125 1.00 . A A . 801 GLU O 1 1 12 8653 1 1 22 GLU OE1 O 9.473 8.331 -4.812 1.00 . A A . 801 GLU OE1 1 1 12 8654 1 1 22 GLU OE2 O 8.373 8.365 -2.915 1.00 . A A . 801 GLU OE2 1 1 12 8655 1 1 23 TYR C C 11.026 0.021 -5.916 1.00 . A A . 802 TYR C 1 1 12 8656 1 1 23 TYR CA C 11.377 0.904 -4.718 1.00 . A A . 802 TYR CA 1 1 12 8657 1 1 23 TYR CB C 11.718 0.041 -3.492 1.00 . A A . 802 TYR CB 1 1 12 8658 1 1 23 TYR CD1 C 14.236 -0.089 -3.260 1.00 . A A . 802 TYR CD1 1 1 12 8659 1 1 23 TYR CD2 C 13.076 -2.004 -4.078 1.00 . A A . 802 TYR CD2 1 1 12 8660 1 1 23 TYR CE1 C 15.436 -0.767 -3.370 1.00 . A A . 802 TYR CE1 1 1 12 8661 1 1 23 TYR CE2 C 14.271 -2.688 -4.191 1.00 . A A . 802 TYR CE2 1 1 12 8662 1 1 23 TYR CG C 13.037 -0.696 -3.611 1.00 . A A . 802 TYR CG 1 1 12 8663 1 1 23 TYR CZ C 15.467 -2.031 -3.826 1.00 . A A . 802 TYR CZ 1 1 12 8664 1 1 23 TYR H H 9.447 1.457 -4.039 1.00 . A A . 802 TYR H 1 1 12 8665 1 1 23 TYR HA H 12.236 1.509 -4.974 1.00 . A A . 802 TYR HA 1 1 12 8666 1 1 23 TYR HB2 H 11.776 0.675 -2.617 1.00 . A A . 802 TYR HB2 1 1 12 8667 1 1 23 TYR HB3 H 10.939 -0.692 -3.345 1.00 . A A . 802 TYR HB3 1 1 12 8668 1 1 23 TYR HD1 H 14.225 0.927 -2.894 1.00 . A A . 802 TYR HD1 1 1 12 8669 1 1 23 TYR HD2 H 12.150 -2.490 -4.355 1.00 . A A . 802 TYR HD2 1 1 12 8670 1 1 23 TYR HE1 H 16.358 -0.279 -3.092 1.00 . A A . 802 TYR HE1 1 1 12 8671 1 1 23 TYR HE2 H 14.280 -3.705 -4.559 1.00 . A A . 802 TYR HE2 1 1 12 8672 1 1 23 TYR HH H 17.168 -2.584 -3.143 1.00 . A A . 802 TYR HH 1 1 12 8673 1 1 23 TYR N N 10.272 1.808 -4.433 1.00 . A A . 802 TYR N 1 1 12 8674 1 1 23 TYR O O 11.863 -0.232 -6.782 1.00 . A A . 802 TYR O 1 1 12 8675 1 1 23 TYR OH O 16.643 -2.740 -3.944 1.00 . A A . 802 TYR OH 1 1 12 8676 1 1 24 CYS C C 8.173 -0.625 -7.845 1.00 . A A . 803 CYS C 1 1 12 8677 1 1 24 CYS CA C 9.294 -1.290 -7.038 1.00 . A A . 803 CYS CA 1 1 12 8678 1 1 24 CYS CB C 8.828 -2.629 -6.472 1.00 . A A . 803 CYS CB 1 1 12 8679 1 1 24 CYS H H 9.176 -0.233 -5.208 1.00 . A A . 803 CYS H 1 1 12 8680 1 1 24 CYS HA H 10.099 -1.453 -7.736 1.00 . A A . 803 CYS HA 1 1 12 8681 1 1 24 CYS HB2 H 8.274 -3.162 -7.231 1.00 . A A . 803 CYS HB2 1 1 12 8682 1 1 24 CYS HB3 H 9.692 -3.211 -6.184 1.00 . A A . 803 CYS HB3 1 1 12 8683 1 1 24 CYS N N 9.777 -0.440 -5.953 1.00 . A A . 803 CYS N 1 1 12 8684 1 1 24 CYS O O 8.089 -0.813 -9.060 1.00 . A A . 803 CYS O 1 1 12 8685 1 1 24 CYS SG S 7.756 -2.467 -5.015 1.00 . A A . 803 CYS SG 1 1 12 8686 1 1 25 GLY C C 4.937 0.208 -7.795 1.00 . A A . 804 GLY C 1 1 12 8687 1 1 25 GLY CA C 6.294 0.877 -7.899 1.00 . A A . 804 GLY CA 1 1 12 8688 1 1 25 GLY H H 7.439 0.289 -6.222 1.00 . A A . 804 GLY H 1 1 12 8689 1 1 25 GLY HA2 H 6.221 1.878 -7.498 1.00 . A A . 804 GLY HA2 1 1 12 8690 1 1 25 GLY HA3 H 6.567 0.941 -8.942 1.00 . A A . 804 GLY HA3 1 1 12 8691 1 1 25 GLY N N 7.336 0.165 -7.190 1.00 . A A . 804 GLY N 1 1 12 8692 1 1 25 GLY O O 4.065 0.449 -8.625 1.00 . A A . 804 GLY O 1 1 12 8693 1 1 26 LYS C C 2.451 -0.424 -5.916 1.00 . A A . 805 LYS C 1 1 12 8694 1 1 26 LYS CA C 3.474 -1.314 -6.608 1.00 . A A . 805 LYS CA 1 1 12 8695 1 1 26 LYS CB C 3.669 -2.597 -5.803 1.00 . A A . 805 LYS CB 1 1 12 8696 1 1 26 LYS CD C 4.495 -4.972 -5.763 1.00 . A A . 805 LYS CD 1 1 12 8697 1 1 26 LYS CE C 3.097 -5.517 -5.485 1.00 . A A . 805 LYS CE 1 1 12 8698 1 1 26 LYS CG C 4.449 -3.668 -6.548 1.00 . A A . 805 LYS CG 1 1 12 8699 1 1 26 LYS H H 5.436 -0.720 -6.099 1.00 . A A . 805 LYS H 1 1 12 8700 1 1 26 LYS HA H 3.108 -1.567 -7.593 1.00 . A A . 805 LYS HA 1 1 12 8701 1 1 26 LYS HB2 H 4.202 -2.360 -4.896 1.00 . A A . 805 LYS HB2 1 1 12 8702 1 1 26 LYS HB3 H 2.701 -3.000 -5.546 1.00 . A A . 805 LYS HB3 1 1 12 8703 1 1 26 LYS HD2 H 5.048 -5.704 -6.333 1.00 . A A . 805 LYS HD2 1 1 12 8704 1 1 26 LYS HD3 H 4.995 -4.796 -4.823 1.00 . A A . 805 LYS HD3 1 1 12 8705 1 1 26 LYS HE2 H 3.189 -6.446 -4.940 1.00 . A A . 805 LYS HE2 1 1 12 8706 1 1 26 LYS HE3 H 2.559 -4.800 -4.881 1.00 . A A . 805 LYS HE3 1 1 12 8707 1 1 26 LYS HG2 H 3.974 -3.849 -7.499 1.00 . A A . 805 LYS HG2 1 1 12 8708 1 1 26 LYS HG3 H 5.460 -3.318 -6.710 1.00 . A A . 805 LYS HG3 1 1 12 8709 1 1 26 LYS HZ1 H 2.151 -4.868 -7.233 1.00 . A A . 805 LYS HZ1 1 1 12 8710 1 1 26 LYS HZ2 H 1.416 -6.216 -6.511 1.00 . A A . 805 LYS HZ2 1 1 12 8711 1 1 26 LYS HZ3 H 2.871 -6.399 -7.368 1.00 . A A . 805 LYS HZ3 1 1 12 8712 1 1 26 LYS N N 4.741 -0.614 -6.777 1.00 . A A . 805 LYS N 1 1 12 8713 1 1 26 LYS NZ N 2.332 -5.767 -6.735 1.00 . A A . 805 LYS NZ 1 1 12 8714 1 1 26 LYS O O 2.732 0.138 -4.856 1.00 . A A . 805 LYS O 1 1 12 8715 1 1 27 TYR C C -0.589 -0.322 -4.934 1.00 . A A . 806 TYR C 1 1 12 8716 1 1 27 TYR CA C 0.200 0.496 -5.936 1.00 . A A . 806 TYR CA 1 1 12 8717 1 1 27 TYR CB C -0.745 1.021 -7.019 1.00 . A A . 806 TYR CB 1 1 12 8718 1 1 27 TYR CD1 C 0.004 3.319 -7.744 1.00 . A A . 806 TYR CD1 1 1 12 8719 1 1 27 TYR CD2 C 0.417 1.484 -9.206 1.00 . A A . 806 TYR CD2 1 1 12 8720 1 1 27 TYR CE1 C 0.599 4.178 -8.648 1.00 . A A . 806 TYR CE1 1 1 12 8721 1 1 27 TYR CE2 C 1.015 2.334 -10.115 1.00 . A A . 806 TYR CE2 1 1 12 8722 1 1 27 TYR CG C -0.098 1.961 -8.010 1.00 . A A . 806 TYR CG 1 1 12 8723 1 1 27 TYR CZ C 1.078 3.696 -9.833 1.00 . A A . 806 TYR CZ 1 1 12 8724 1 1 27 TYR H H 1.073 -0.870 -7.292 1.00 . A A . 806 TYR H 1 1 12 8725 1 1 27 TYR HA H 0.635 1.329 -5.403 1.00 . A A . 806 TYR HA 1 1 12 8726 1 1 27 TYR HB2 H -1.143 0.185 -7.567 1.00 . A A . 806 TYR HB2 1 1 12 8727 1 1 27 TYR HB3 H -1.557 1.549 -6.544 1.00 . A A . 806 TYR HB3 1 1 12 8728 1 1 27 TYR HD1 H -0.393 3.704 -6.818 1.00 . A A . 806 TYR HD1 1 1 12 8729 1 1 27 TYR HD2 H 0.343 0.428 -9.426 1.00 . A A . 806 TYR HD2 1 1 12 8730 1 1 27 TYR HE1 H 0.669 5.234 -8.423 1.00 . A A . 806 TYR HE1 1 1 12 8731 1 1 27 TYR HE2 H 1.411 1.945 -11.040 1.00 . A A . 806 TYR HE2 1 1 12 8732 1 1 27 TYR HH H 2.384 5.056 -10.295 1.00 . A A . 806 TYR HH 1 1 12 8733 1 1 27 TYR N N 1.265 -0.324 -6.501 1.00 . A A . 806 TYR N 1 1 12 8734 1 1 27 TYR O O -1.085 -1.404 -5.248 1.00 . A A . 806 TYR O 1 1 12 8735 1 1 27 TYR OH O 1.693 4.536 -10.738 1.00 . A A . 806 TYR OH 1 1 12 8736 1 1 28 ALA C C -1.931 0.515 -1.656 1.00 . A A . 807 ALA C 1 1 12 8737 1 1 28 ALA CA C -1.342 -0.489 -2.638 1.00 . A A . 807 ALA CA 1 1 12 8738 1 1 28 ALA CB C -0.312 -1.380 -1.953 1.00 . A A . 807 ALA CB 1 1 12 8739 1 1 28 ALA H H -0.357 1.121 -3.588 1.00 . A A . 807 ALA H 1 1 12 8740 1 1 28 ALA HA H -2.130 -1.111 -3.034 1.00 . A A . 807 ALA HA 1 1 12 8741 1 1 28 ALA HB1 H -0.781 -1.918 -1.143 1.00 . A A . 807 ALA HB1 1 1 12 8742 1 1 28 ALA HB2 H 0.490 -0.769 -1.562 1.00 . A A . 807 ALA HB2 1 1 12 8743 1 1 28 ALA HB3 H 0.089 -2.083 -2.669 1.00 . A A . 807 ALA HB3 1 1 12 8744 1 1 28 ALA N N -0.714 0.217 -3.738 1.00 . A A . 807 ALA N 1 1 12 8745 1 1 28 ALA O O -1.563 1.692 -1.683 1.00 . A A . 807 ALA O 1 1 12 8746 1 1 29 PRO C C -2.540 1.462 1.211 1.00 . A A . 808 PRO C 1 1 12 8747 1 1 29 PRO CA C -3.519 0.976 0.157 1.00 . A A . 808 PRO CA 1 1 12 8748 1 1 29 PRO CB C -4.625 0.120 0.781 1.00 . A A . 808 PRO CB 1 1 12 8749 1 1 29 PRO CD C -3.341 -1.311 -0.659 1.00 . A A . 808 PRO CD 1 1 12 8750 1 1 29 PRO CG C -4.195 -1.291 0.580 1.00 . A A . 808 PRO CG 1 1 12 8751 1 1 29 PRO HA H -3.959 1.829 -0.344 1.00 . A A . 808 PRO HA 1 1 12 8752 1 1 29 PRO HB2 H -4.715 0.357 1.832 1.00 . A A . 808 PRO HB2 1 1 12 8753 1 1 29 PRO HB3 H -5.562 0.320 0.283 1.00 . A A . 808 PRO HB3 1 1 12 8754 1 1 29 PRO HD2 H -2.508 -1.986 -0.525 1.00 . A A . 808 PRO HD2 1 1 12 8755 1 1 29 PRO HD3 H -3.926 -1.603 -1.516 1.00 . A A . 808 PRO HD3 1 1 12 8756 1 1 29 PRO HG2 H -3.623 -1.624 1.432 1.00 . A A . 808 PRO HG2 1 1 12 8757 1 1 29 PRO HG3 H -5.063 -1.921 0.445 1.00 . A A . 808 PRO HG3 1 1 12 8758 1 1 29 PRO N N -2.868 0.080 -0.792 1.00 . A A . 808 PRO N 1 1 12 8759 1 1 29 PRO O O -1.805 0.672 1.805 1.00 . A A . 808 PRO O 1 1 12 8760 1 1 30 ALA C C -1.531 2.761 3.701 1.00 . A A . 809 ALA C 1 1 12 8761 1 1 30 ALA CA C -1.616 3.451 2.337 1.00 . A A . 809 ALA CA 1 1 12 8762 1 1 30 ALA CB C -2.058 4.892 2.520 1.00 . A A . 809 ALA CB 1 1 12 8763 1 1 30 ALA H H -3.086 3.338 0.808 1.00 . A A . 809 ALA H 1 1 12 8764 1 1 30 ALA HA H -0.635 3.467 1.880 1.00 . A A . 809 ALA HA 1 1 12 8765 1 1 30 ALA HB1 H -1.363 5.402 3.169 1.00 . A A . 809 ALA HB1 1 1 12 8766 1 1 30 ALA HB2 H -3.044 4.912 2.963 1.00 . A A . 809 ALA HB2 1 1 12 8767 1 1 30 ALA HB3 H -2.085 5.388 1.559 1.00 . A A . 809 ALA HB3 1 1 12 8768 1 1 30 ALA N N -2.514 2.780 1.389 1.00 . A A . 809 ALA N 1 1 12 8769 1 1 30 ALA O O -0.529 2.890 4.400 1.00 . A A . 809 ALA O 1 1 12 8770 1 1 31 GLU C C -1.538 0.277 5.453 1.00 . A A . 810 GLU C 1 1 12 8771 1 1 31 GLU CA C -2.648 1.327 5.344 1.00 . A A . 810 GLU CA 1 1 12 8772 1 1 31 GLU CB C -4.011 0.645 5.498 1.00 . A A . 810 GLU CB 1 1 12 8773 1 1 31 GLU CD C -5.621 -1.088 4.607 1.00 . A A . 810 GLU CD 1 1 12 8774 1 1 31 GLU CG C -4.318 -0.351 4.389 1.00 . A A . 810 GLU CG 1 1 12 8775 1 1 31 GLU H H -3.339 1.972 3.447 1.00 . A A . 810 GLU H 1 1 12 8776 1 1 31 GLU HA H -2.526 2.039 6.145 1.00 . A A . 810 GLU HA 1 1 12 8777 1 1 31 GLU HB2 H -4.035 0.123 6.442 1.00 . A A . 810 GLU HB2 1 1 12 8778 1 1 31 GLU HB3 H -4.783 1.403 5.496 1.00 . A A . 810 GLU HB3 1 1 12 8779 1 1 31 GLU HG2 H -4.377 0.181 3.452 1.00 . A A . 810 GLU HG2 1 1 12 8780 1 1 31 GLU HG3 H -3.516 -1.073 4.343 1.00 . A A . 810 GLU HG3 1 1 12 8781 1 1 31 GLU N N -2.588 2.046 4.071 1.00 . A A . 810 GLU N 1 1 12 8782 1 1 31 GLU O O -1.113 -0.083 6.550 1.00 . A A . 810 GLU O 1 1 12 8783 1 1 31 GLU OE1 O -6.680 -0.579 4.182 1.00 . A A . 810 GLU OE1 1 1 12 8784 1 1 31 GLU OE2 O -5.592 -2.182 5.210 1.00 . A A . 810 GLU OE2 1 1 12 8785 1 1 32 GLN C C 1.297 -0.690 4.445 1.00 . A A . 811 GLN C 1 1 12 8786 1 1 32 GLN CA C -0.095 -1.276 4.270 1.00 . A A . 811 GLN CA 1 1 12 8787 1 1 32 GLN CB C -0.207 -2.038 2.951 1.00 . A A . 811 GLN CB 1 1 12 8788 1 1 32 GLN CD C 0.875 -3.590 1.297 1.00 . A A . 811 GLN CD 1 1 12 8789 1 1 32 GLN CG C 0.923 -3.015 2.694 1.00 . A A . 811 GLN CG 1 1 12 8790 1 1 32 GLN H H -1.413 0.161 3.464 1.00 . A A . 811 GLN H 1 1 12 8791 1 1 32 GLN HA H -0.310 -1.939 5.093 1.00 . A A . 811 GLN HA 1 1 12 8792 1 1 32 GLN HB2 H -1.135 -2.591 2.947 1.00 . A A . 811 GLN HB2 1 1 12 8793 1 1 32 GLN HB3 H -0.223 -1.324 2.142 1.00 . A A . 811 GLN HB3 1 1 12 8794 1 1 32 GLN HE21 H 1.784 -1.973 0.594 1.00 . A A . 811 GLN HE21 1 1 12 8795 1 1 32 GLN HE22 H 1.416 -3.195 -0.571 1.00 . A A . 811 GLN HE22 1 1 12 8796 1 1 32 GLN HG2 H 1.864 -2.502 2.827 1.00 . A A . 811 GLN HG2 1 1 12 8797 1 1 32 GLN HG3 H 0.850 -3.825 3.406 1.00 . A A . 811 GLN HG3 1 1 12 8798 1 1 32 GLN N N -1.085 -0.216 4.308 1.00 . A A . 811 GLN N 1 1 12 8799 1 1 32 GLN NE2 N 1.409 -2.843 0.343 1.00 . A A . 811 GLN NE2 1 1 12 8800 1 1 32 GLN O O 2.211 -1.357 4.934 1.00 . A A . 811 GLN O 1 1 12 8801 1 1 32 GLN OE1 O 0.318 -4.665 1.067 1.00 . A A . 811 GLN OE1 1 1 12 8802 1 1 33 PHE C C 2.975 1.650 5.620 1.00 . A A . 812 PHE C 1 1 12 8803 1 1 33 PHE CA C 2.691 1.305 4.160 1.00 . A A . 812 PHE CA 1 1 12 8804 1 1 33 PHE CB C 2.616 2.576 3.309 1.00 . A A . 812 PHE CB 1 1 12 8805 1 1 33 PHE CD1 C 1.546 1.626 1.238 1.00 . A A . 812 PHE CD1 1 1 12 8806 1 1 33 PHE CD2 C 3.671 2.682 1.036 1.00 . A A . 812 PHE CD2 1 1 12 8807 1 1 33 PHE CE1 C 1.551 1.350 -0.115 1.00 . A A . 812 PHE CE1 1 1 12 8808 1 1 33 PHE CE2 C 3.680 2.411 -0.317 1.00 . A A . 812 PHE CE2 1 1 12 8809 1 1 33 PHE CG C 2.607 2.295 1.831 1.00 . A A . 812 PHE CG 1 1 12 8810 1 1 33 PHE CZ C 2.621 1.742 -0.893 1.00 . A A . 812 PHE CZ 1 1 12 8811 1 1 33 PHE H H 0.739 0.959 3.467 1.00 . A A . 812 PHE H 1 1 12 8812 1 1 33 PHE HA H 3.484 0.688 3.762 1.00 . A A . 812 PHE HA 1 1 12 8813 1 1 33 PHE HB2 H 1.712 3.116 3.554 1.00 . A A . 812 PHE HB2 1 1 12 8814 1 1 33 PHE HB3 H 3.473 3.195 3.529 1.00 . A A . 812 PHE HB3 1 1 12 8815 1 1 33 PHE HD1 H 0.709 1.318 1.846 1.00 . A A . 812 PHE HD1 1 1 12 8816 1 1 33 PHE HD2 H 4.502 3.205 1.484 1.00 . A A . 812 PHE HD2 1 1 12 8817 1 1 33 PHE HE1 H 0.720 0.828 -0.563 1.00 . A A . 812 PHE HE1 1 1 12 8818 1 1 33 PHE HE2 H 4.519 2.719 -0.925 1.00 . A A . 812 PHE HE2 1 1 12 8819 1 1 33 PHE HZ H 2.628 1.527 -1.953 1.00 . A A . 812 PHE HZ 1 1 12 8820 1 1 33 PHE N N 1.446 0.560 4.010 1.00 . A A . 812 PHE N 1 1 12 8821 1 1 33 PHE O O 3.016 2.815 6.017 1.00 . A A . 812 PHE O 1 1 12 8822 1 1 34 ARG C C 4.957 1.028 7.996 1.00 . A A . 813 ARG C 1 1 12 8823 1 1 34 ARG CA C 3.487 0.695 7.806 1.00 . A A . 813 ARG CA 1 1 12 8824 1 1 34 ARG CB C 3.117 -0.634 8.461 1.00 . A A . 813 ARG CB 1 1 12 8825 1 1 34 ARG CD C 1.265 -2.352 8.641 1.00 . A A . 813 ARG CD 1 1 12 8826 1 1 34 ARG CG C 1.629 -0.912 8.338 1.00 . A A . 813 ARG CG 1 1 12 8827 1 1 34 ARG CZ C -0.628 -3.761 7.895 1.00 . A A . 813 ARG CZ 1 1 12 8828 1 1 34 ARG H H 3.059 -0.284 5.996 1.00 . A A . 813 ARG H 1 1 12 8829 1 1 34 ARG HA H 2.906 1.474 8.281 1.00 . A A . 813 ARG HA 1 1 12 8830 1 1 34 ARG HB2 H 3.661 -1.433 7.977 1.00 . A A . 813 ARG HB2 1 1 12 8831 1 1 34 ARG HB3 H 3.375 -0.603 9.508 1.00 . A A . 813 ARG HB3 1 1 12 8832 1 1 34 ARG HD2 H 1.877 -3.004 8.036 1.00 . A A . 813 ARG HD2 1 1 12 8833 1 1 34 ARG HD3 H 1.445 -2.548 9.688 1.00 . A A . 813 ARG HD3 1 1 12 8834 1 1 34 ARG HE H -0.763 -1.839 8.447 1.00 . A A . 813 ARG HE 1 1 12 8835 1 1 34 ARG HG2 H 1.100 -0.272 9.027 1.00 . A A . 813 ARG HG2 1 1 12 8836 1 1 34 ARG HG3 H 1.319 -0.680 7.328 1.00 . A A . 813 ARG HG3 1 1 12 8837 1 1 34 ARG HH11 H 1.125 -4.756 8.055 1.00 . A A . 813 ARG HH11 1 1 12 8838 1 1 34 ARG HH12 H -0.210 -5.694 7.471 1.00 . A A . 813 ARG HH12 1 1 12 8839 1 1 34 ARG HH21 H -2.521 -3.072 7.653 1.00 . A A . 813 ARG HH21 1 1 12 8840 1 1 34 ARG HH22 H -2.276 -4.738 7.213 1.00 . A A . 813 ARG HH22 1 1 12 8841 1 1 34 ARG N N 3.160 0.607 6.398 1.00 . A A . 813 ARG N 1 1 12 8842 1 1 34 ARG NE N -0.144 -2.602 8.340 1.00 . A A . 813 ARG NE 1 1 12 8843 1 1 34 ARG NH1 N 0.160 -4.821 7.796 1.00 . A A . 813 ARG NH1 1 1 12 8844 1 1 34 ARG NH2 N -1.909 -3.863 7.566 1.00 . A A . 813 ARG NH2 1 1 12 8845 1 1 34 ARG O O 5.830 0.517 7.292 1.00 . A A . 813 ARG O 1 1 12 8846 1 1 35 GLY C C 6.642 3.798 8.391 1.00 . A A . 814 GLY C 1 1 12 8847 1 1 35 GLY CA C 6.541 2.466 9.091 1.00 . A A . 814 GLY CA 1 1 12 8848 1 1 35 GLY H H 4.491 2.215 9.532 1.00 . A A . 814 GLY H 1 1 12 8849 1 1 35 GLY HA2 H 6.755 2.595 10.143 1.00 . A A . 814 GLY HA2 1 1 12 8850 1 1 35 GLY HA3 H 7.261 1.786 8.660 1.00 . A A . 814 GLY HA3 1 1 12 8851 1 1 35 GLY N N 5.217 1.916 8.938 1.00 . A A . 814 GLY N 1 1 12 8852 1 1 35 GLY O O 6.762 4.840 9.037 1.00 . A A . 814 GLY O 1 1 12 8853 1 1 36 SER C C 5.757 4.808 4.992 1.00 . A A . 815 SER C 1 1 12 8854 1 1 36 SER CA C 6.571 4.985 6.269 1.00 . A A . 815 SER CA 1 1 12 8855 1 1 36 SER CB C 8.009 5.366 5.909 1.00 . A A . 815 SER CB 1 1 12 8856 1 1 36 SER H H 6.446 2.901 6.614 1.00 . A A . 815 SER H 1 1 12 8857 1 1 36 SER HA H 6.142 5.766 6.880 1.00 . A A . 815 SER HA 1 1 12 8858 1 1 36 SER HB2 H 8.495 4.521 5.445 1.00 . A A . 815 SER HB2 1 1 12 8859 1 1 36 SER HB3 H 7.995 6.195 5.218 1.00 . A A . 815 SER HB3 1 1 12 8860 1 1 36 SER HG H 9.656 5.404 6.980 1.00 . A A . 815 SER HG 1 1 12 8861 1 1 36 SER N N 6.547 3.769 7.066 1.00 . A A . 815 SER N 1 1 12 8862 1 1 36 SER O O 5.875 3.783 4.316 1.00 . A A . 815 SER O 1 1 12 8863 1 1 36 SER OG O 8.749 5.740 7.057 1.00 . A A . 815 SER OG 1 1 12 8864 1 1 37 LYS C C 5.131 6.127 2.236 1.00 . A A . 816 LYS C 1 1 12 8865 1 1 37 LYS CA C 4.195 5.789 3.397 1.00 . A A . 816 LYS CA 1 1 12 8866 1 1 37 LYS CB C 3.023 6.774 3.445 1.00 . A A . 816 LYS CB 1 1 12 8867 1 1 37 LYS CD C 2.016 5.884 5.592 1.00 . A A . 816 LYS CD 1 1 12 8868 1 1 37 LYS CE C 0.804 5.214 6.222 1.00 . A A . 816 LYS CE 1 1 12 8869 1 1 37 LYS CG C 1.773 6.227 4.131 1.00 . A A . 816 LYS CG 1 1 12 8870 1 1 37 LYS H H 4.840 6.570 5.259 1.00 . A A . 816 LYS H 1 1 12 8871 1 1 37 LYS HA H 3.804 4.788 3.253 1.00 . A A . 816 LYS HA 1 1 12 8872 1 1 37 LYS HB2 H 3.342 7.654 3.977 1.00 . A A . 816 LYS HB2 1 1 12 8873 1 1 37 LYS HB3 H 2.762 7.050 2.435 1.00 . A A . 816 LYS HB3 1 1 12 8874 1 1 37 LYS HD2 H 2.859 5.212 5.657 1.00 . A A . 816 LYS HD2 1 1 12 8875 1 1 37 LYS HD3 H 2.235 6.792 6.133 1.00 . A A . 816 LYS HD3 1 1 12 8876 1 1 37 LYS HE2 H 0.537 4.352 5.630 1.00 . A A . 816 LYS HE2 1 1 12 8877 1 1 37 LYS HE3 H 1.064 4.899 7.222 1.00 . A A . 816 LYS HE3 1 1 12 8878 1 1 37 LYS HG2 H 0.993 6.972 4.075 1.00 . A A . 816 LYS HG2 1 1 12 8879 1 1 37 LYS HG3 H 1.454 5.335 3.613 1.00 . A A . 816 LYS HG3 1 1 12 8880 1 1 37 LYS HZ1 H -0.163 6.918 6.948 1.00 . A A . 816 LYS HZ1 1 1 12 8881 1 1 37 LYS HZ2 H -1.207 5.613 6.639 1.00 . A A . 816 LYS HZ2 1 1 12 8882 1 1 37 LYS HZ3 H -0.579 6.522 5.352 1.00 . A A . 816 LYS HZ3 1 1 12 8883 1 1 37 LYS N N 4.939 5.800 4.656 1.00 . A A . 816 LYS N 1 1 12 8884 1 1 37 LYS NZ N -0.366 6.129 6.294 1.00 . A A . 816 LYS NZ 1 1 12 8885 1 1 37 LYS O O 5.026 7.183 1.609 1.00 . A A . 816 LYS O 1 1 12 8886 1 1 38 ARG C C 7.375 4.038 0.332 1.00 . A A . 817 ARG C 1 1 12 8887 1 1 38 ARG CA C 7.093 5.382 0.973 1.00 . A A . 817 ARG CA 1 1 12 8888 1 1 38 ARG CB C 8.392 5.903 1.606 1.00 . A A . 817 ARG CB 1 1 12 8889 1 1 38 ARG CD C 9.665 7.813 2.629 1.00 . A A . 817 ARG CD 1 1 12 8890 1 1 38 ARG CG C 8.308 7.320 2.148 1.00 . A A . 817 ARG CG 1 1 12 8891 1 1 38 ARG CZ C 11.928 8.170 1.699 1.00 . A A . 817 ARG CZ 1 1 12 8892 1 1 38 ARG H H 6.036 4.372 2.475 1.00 . A A . 817 ARG H 1 1 12 8893 1 1 38 ARG HA H 6.781 6.067 0.197 1.00 . A A . 817 ARG HA 1 1 12 8894 1 1 38 ARG HB2 H 8.665 5.250 2.421 1.00 . A A . 817 ARG HB2 1 1 12 8895 1 1 38 ARG HB3 H 9.173 5.873 0.860 1.00 . A A . 817 ARG HB3 1 1 12 8896 1 1 38 ARG HD2 H 9.537 8.787 3.080 1.00 . A A . 817 ARG HD2 1 1 12 8897 1 1 38 ARG HD3 H 10.045 7.123 3.367 1.00 . A A . 817 ARG HD3 1 1 12 8898 1 1 38 ARG HE H 10.282 7.814 0.610 1.00 . A A . 817 ARG HE 1 1 12 8899 1 1 38 ARG HG2 H 7.959 7.973 1.363 1.00 . A A . 817 ARG HG2 1 1 12 8900 1 1 38 ARG HG3 H 7.612 7.341 2.973 1.00 . A A . 817 ARG HG3 1 1 12 8901 1 1 38 ARG HH11 H 11.868 8.110 3.729 1.00 . A A . 817 ARG HH11 1 1 12 8902 1 1 38 ARG HH12 H 13.426 8.447 3.035 1.00 . A A . 817 ARG HH12 1 1 12 8903 1 1 38 ARG HH21 H 12.339 8.235 -0.290 1.00 . A A . 817 ARG HH21 1 1 12 8904 1 1 38 ARG HH22 H 13.699 8.510 0.766 1.00 . A A . 817 ARG HH22 1 1 12 8905 1 1 38 ARG N N 6.050 5.217 1.976 1.00 . A A . 817 ARG N 1 1 12 8906 1 1 38 ARG NE N 10.631 7.920 1.533 1.00 . A A . 817 ARG NE 1 1 12 8907 1 1 38 ARG NH1 N 12.449 8.249 2.915 1.00 . A A . 817 ARG NH1 1 1 12 8908 1 1 38 ARG NH2 N 12.715 8.316 0.641 1.00 . A A . 817 ARG NH2 1 1 12 8909 1 1 38 ARG O O 7.659 3.952 -0.862 1.00 . A A . 817 ARG O 1 1 12 8910 1 1 39 PHE C C 6.407 0.749 1.212 1.00 . A A . 818 PHE C 1 1 12 8911 1 1 39 PHE CA C 7.496 1.639 0.652 1.00 . A A . 818 PHE CA 1 1 12 8912 1 1 39 PHE CB C 8.866 1.128 1.112 1.00 . A A . 818 PHE CB 1 1 12 8913 1 1 39 PHE CD1 C 10.496 1.894 -0.642 1.00 . A A . 818 PHE CD1 1 1 12 8914 1 1 39 PHE CD2 C 10.605 2.893 1.522 1.00 . A A . 818 PHE CD2 1 1 12 8915 1 1 39 PHE CE1 C 11.543 2.690 -1.065 1.00 . A A . 818 PHE CE1 1 1 12 8916 1 1 39 PHE CE2 C 11.650 3.693 1.103 1.00 . A A . 818 PHE CE2 1 1 12 8917 1 1 39 PHE CG C 10.015 1.986 0.656 1.00 . A A . 818 PHE CG 1 1 12 8918 1 1 39 PHE CZ C 12.120 3.591 -0.191 1.00 . A A . 818 PHE CZ 1 1 12 8919 1 1 39 PHE H H 7.048 3.103 2.077 1.00 . A A . 818 PHE H 1 1 12 8920 1 1 39 PHE HA H 7.464 1.644 -0.428 1.00 . A A . 818 PHE HA 1 1 12 8921 1 1 39 PHE HB2 H 8.886 1.096 2.193 1.00 . A A . 818 PHE HB2 1 1 12 8922 1 1 39 PHE HB3 H 9.018 0.131 0.726 1.00 . A A . 818 PHE HB3 1 1 12 8923 1 1 39 PHE HD1 H 10.044 1.191 -1.327 1.00 . A A . 818 PHE HD1 1 1 12 8924 1 1 39 PHE HD2 H 10.240 2.974 2.534 1.00 . A A . 818 PHE HD2 1 1 12 8925 1 1 39 PHE HE1 H 11.909 2.607 -2.078 1.00 . A A . 818 PHE HE1 1 1 12 8926 1 1 39 PHE HE2 H 12.103 4.397 1.787 1.00 . A A . 818 PHE HE2 1 1 12 8927 1 1 39 PHE HZ H 12.936 4.216 -0.522 1.00 . A A . 818 PHE HZ 1 1 12 8928 1 1 39 PHE N N 7.278 2.982 1.130 1.00 . A A . 818 PHE N 1 1 12 8929 1 1 39 PHE O O 5.820 1.073 2.243 1.00 . A A . 818 PHE O 1 1 12 8930 1 1 40 CYS C C 5.857 -2.029 2.280 1.00 . A A . 819 CYS C 1 1 12 8931 1 1 40 CYS CA C 5.210 -1.343 1.060 1.00 . A A . 819 CYS CA 1 1 12 8932 1 1 40 CYS CB C 4.763 -2.289 -0.064 1.00 . A A . 819 CYS CB 1 1 12 8933 1 1 40 CYS H H 6.629 -0.570 -0.266 1.00 . A A . 819 CYS H 1 1 12 8934 1 1 40 CYS HA H 4.350 -0.821 1.457 1.00 . A A . 819 CYS HA 1 1 12 8935 1 1 40 CYS HB2 H 4.476 -3.232 0.349 1.00 . A A . 819 CYS HB2 1 1 12 8936 1 1 40 CYS HB3 H 3.912 -1.854 -0.567 1.00 . A A . 819 CYS HB3 1 1 12 8937 1 1 40 CYS N N 6.123 -0.350 0.538 1.00 . A A . 819 CYS N 1 1 12 8938 1 1 40 CYS O O 6.792 -1.481 2.856 1.00 . A A . 819 CYS O 1 1 12 8939 1 1 40 CYS SG S 6.026 -2.609 -1.316 1.00 . A A . 819 CYS SG 1 1 12 8940 1 1 41 SER C C 7.011 -4.013 4.419 1.00 . A A . 820 SER C 1 1 12 8941 1 1 41 SER CA C 5.548 -3.751 4.004 1.00 . A A . 820 SER CA 1 1 12 8942 1 1 41 SER CB C 4.728 -5.035 4.107 1.00 . A A . 820 SER CB 1 1 12 8943 1 1 41 SER H H 5.019 -3.800 1.964 1.00 . A A . 820 SER H 1 1 12 8944 1 1 41 SER HA H 5.145 -3.050 4.717 1.00 . A A . 820 SER HA 1 1 12 8945 1 1 41 SER HB2 H 4.922 -5.511 5.056 1.00 . A A . 820 SER HB2 1 1 12 8946 1 1 41 SER HB3 H 3.679 -4.787 4.032 1.00 . A A . 820 SER HB3 1 1 12 8947 1 1 41 SER HG H 4.323 -6.558 2.934 1.00 . A A . 820 SER HG 1 1 12 8948 1 1 41 SER N N 5.393 -3.220 2.647 1.00 . A A . 820 SER N 1 1 12 8949 1 1 41 SER O O 7.817 -3.091 4.504 1.00 . A A . 820 SER O 1 1 12 8950 1 1 41 SER OG O 5.058 -5.938 3.063 1.00 . A A . 820 SER OG 1 1 12 8951 1 1 42 MET C C 9.792 -5.585 4.412 1.00 . A A . 821 MET C 1 1 12 8952 1 1 42 MET CA C 8.629 -5.513 5.379 1.00 . A A . 821 MET CA 1 1 12 8953 1 1 42 MET CB C 8.538 -6.798 6.206 1.00 . A A . 821 MET CB 1 1 12 8954 1 1 42 MET CE C 8.766 -4.456 8.545 1.00 . A A . 821 MET CE 1 1 12 8955 1 1 42 MET CG C 7.573 -6.707 7.379 1.00 . A A . 821 MET CG 1 1 12 8956 1 1 42 MET H H 6.796 -6.004 4.410 1.00 . A A . 821 MET H 1 1 12 8957 1 1 42 MET HA H 8.801 -4.681 6.046 1.00 . A A . 821 MET HA 1 1 12 8958 1 1 42 MET HB2 H 8.212 -7.602 5.563 1.00 . A A . 821 MET HB2 1 1 12 8959 1 1 42 MET HB3 H 9.519 -7.033 6.593 1.00 . A A . 821 MET HB3 1 1 12 8960 1 1 42 MET HE1 H 9.542 -4.429 7.795 1.00 . A A . 821 MET HE1 1 1 12 8961 1 1 42 MET HE2 H 9.115 -3.966 9.443 1.00 . A A . 821 MET HE2 1 1 12 8962 1 1 42 MET HE3 H 7.889 -3.943 8.174 1.00 . A A . 821 MET HE3 1 1 12 8963 1 1 42 MET HG2 H 6.795 -6.002 7.124 1.00 . A A . 821 MET HG2 1 1 12 8964 1 1 42 MET HG3 H 7.133 -7.680 7.540 1.00 . A A . 821 MET HG3 1 1 12 8965 1 1 42 MET N N 7.370 -5.256 4.688 1.00 . A A . 821 MET N 1 1 12 8966 1 1 42 MET O O 10.695 -4.759 4.485 1.00 . A A . 821 MET O 1 1 12 8967 1 1 42 MET SD S 8.351 -6.160 8.918 1.00 . A A . 821 MET SD 1 1 12 8968 1 1 43 THR C C 11.249 -5.442 1.862 1.00 . A A . 822 THR C 1 1 12 8969 1 1 43 THR CA C 10.805 -6.748 2.519 1.00 . A A . 822 THR CA 1 1 12 8970 1 1 43 THR CB C 10.337 -7.707 1.416 1.00 . A A . 822 THR CB 1 1 12 8971 1 1 43 THR CG2 C 11.531 -8.254 0.645 1.00 . A A . 822 THR CG2 1 1 12 8972 1 1 43 THR H H 8.990 -7.172 3.513 1.00 . A A . 822 THR H 1 1 12 8973 1 1 43 THR HA H 11.669 -7.196 2.990 1.00 . A A . 822 THR HA 1 1 12 8974 1 1 43 THR HB H 9.698 -7.167 0.732 1.00 . A A . 822 THR HB 1 1 12 8975 1 1 43 THR HG1 H 8.881 -9.047 1.396 1.00 . A A . 822 THR HG1 1 1 12 8976 1 1 43 THR HG21 H 12.141 -8.856 1.302 1.00 . A A . 822 THR HG21 1 1 12 8977 1 1 43 THR HG22 H 12.121 -7.431 0.265 1.00 . A A . 822 THR HG22 1 1 12 8978 1 1 43 THR HG23 H 11.182 -8.857 -0.181 1.00 . A A . 822 THR HG23 1 1 12 8979 1 1 43 THR N N 9.747 -6.548 3.504 1.00 . A A . 822 THR N 1 1 12 8980 1 1 43 THR O O 12.439 -5.149 1.809 1.00 . A A . 822 THR O 1 1 12 8981 1 1 43 THR OG1 O 9.598 -8.791 1.999 1.00 . A A . 822 THR OG1 1 1 12 8982 1 1 44 CYS C C 11.175 -2.331 1.543 1.00 . A A . 823 CYS C 1 1 12 8983 1 1 44 CYS CA C 10.631 -3.443 0.650 1.00 . A A . 823 CYS CA 1 1 12 8984 1 1 44 CYS CB C 9.437 -2.971 -0.154 1.00 . A A . 823 CYS CB 1 1 12 8985 1 1 44 CYS H H 9.364 -4.915 1.492 1.00 . A A . 823 CYS H 1 1 12 8986 1 1 44 CYS HA H 11.410 -3.702 -0.051 1.00 . A A . 823 CYS HA 1 1 12 8987 1 1 44 CYS HB2 H 8.545 -3.029 0.460 1.00 . A A . 823 CYS HB2 1 1 12 8988 1 1 44 CYS HB3 H 9.594 -1.951 -0.470 1.00 . A A . 823 CYS HB3 1 1 12 8989 1 1 44 CYS N N 10.303 -4.665 1.369 1.00 . A A . 823 CYS N 1 1 12 8990 1 1 44 CYS O O 12.212 -1.744 1.225 1.00 . A A . 823 CYS O 1 1 12 8991 1 1 44 CYS SG S 9.169 -3.977 -1.629 1.00 . A A . 823 CYS SG 1 1 12 8992 1 1 45 ALA C C 12.363 -1.372 4.094 1.00 . A A . 824 ALA C 1 1 12 8993 1 1 45 ALA CA C 10.985 -1.001 3.549 1.00 . A A . 824 ALA CA 1 1 12 8994 1 1 45 ALA CB C 9.999 -0.765 4.677 1.00 . A A . 824 ALA CB 1 1 12 8995 1 1 45 ALA H H 9.673 -2.508 2.876 1.00 . A A . 824 ALA H 1 1 12 8996 1 1 45 ALA HA H 11.084 -0.091 2.979 1.00 . A A . 824 ALA HA 1 1 12 8997 1 1 45 ALA HB1 H 10.376 0.010 5.329 1.00 . A A . 824 ALA HB1 1 1 12 8998 1 1 45 ALA HB2 H 9.868 -1.681 5.240 1.00 . A A . 824 ALA HB2 1 1 12 8999 1 1 45 ALA HB3 H 9.050 -0.457 4.264 1.00 . A A . 824 ALA HB3 1 1 12 9000 1 1 45 ALA N N 10.496 -2.026 2.645 1.00 . A A . 824 ALA N 1 1 12 9001 1 1 45 ALA O O 13.268 -0.534 4.131 1.00 . A A . 824 ALA O 1 1 12 9002 1 1 46 LYS C C 14.868 -3.105 3.901 1.00 . A A . 825 LYS C 1 1 12 9003 1 1 46 LYS CA C 13.819 -3.088 5.010 1.00 . A A . 825 LYS CA 1 1 12 9004 1 1 46 LYS CB C 13.701 -4.477 5.674 1.00 . A A . 825 LYS CB 1 1 12 9005 1 1 46 LYS CD C 14.812 -6.212 4.180 1.00 . A A . 825 LYS CD 1 1 12 9006 1 1 46 LYS CE C 15.700 -6.757 5.287 1.00 . A A . 825 LYS CE 1 1 12 9007 1 1 46 LYS CG C 13.500 -5.658 4.724 1.00 . A A . 825 LYS CG 1 1 12 9008 1 1 46 LYS H H 11.770 -3.259 4.484 1.00 . A A . 825 LYS H 1 1 12 9009 1 1 46 LYS HA H 14.120 -2.382 5.772 1.00 . A A . 825 LYS HA 1 1 12 9010 1 1 46 LYS HB2 H 14.600 -4.661 6.242 1.00 . A A . 825 LYS HB2 1 1 12 9011 1 1 46 LYS HB3 H 12.864 -4.453 6.357 1.00 . A A . 825 LYS HB3 1 1 12 9012 1 1 46 LYS HD2 H 14.595 -7.010 3.486 1.00 . A A . 825 LYS HD2 1 1 12 9013 1 1 46 LYS HD3 H 15.338 -5.421 3.666 1.00 . A A . 825 LYS HD3 1 1 12 9014 1 1 46 LYS HE2 H 16.634 -7.078 4.856 1.00 . A A . 825 LYS HE2 1 1 12 9015 1 1 46 LYS HE3 H 15.886 -5.967 6.000 1.00 . A A . 825 LYS HE3 1 1 12 9016 1 1 46 LYS HG2 H 12.993 -6.446 5.259 1.00 . A A . 825 LYS HG2 1 1 12 9017 1 1 46 LYS HG3 H 12.886 -5.337 3.894 1.00 . A A . 825 LYS HG3 1 1 12 9018 1 1 46 LYS HZ1 H 15.722 -8.277 6.719 1.00 . A A . 825 LYS HZ1 1 1 12 9019 1 1 46 LYS HZ2 H 14.865 -8.670 5.313 1.00 . A A . 825 LYS HZ2 1 1 12 9020 1 1 46 LYS HZ3 H 14.182 -7.616 6.452 1.00 . A A . 825 LYS HZ3 1 1 12 9021 1 1 46 LYS N N 12.531 -2.632 4.500 1.00 . A A . 825 LYS N 1 1 12 9022 1 1 46 LYS NZ N 15.075 -7.907 5.992 1.00 . A A . 825 LYS NZ 1 1 12 9023 1 1 46 LYS O O 16.061 -2.993 4.166 1.00 . A A . 825 LYS O 1 1 12 9024 1 1 47 ARG C C 16.052 -2.041 1.304 1.00 . A A . 826 ARG C 1 1 12 9025 1 1 47 ARG CA C 15.315 -3.354 1.517 1.00 . A A . 826 ARG CA 1 1 12 9026 1 1 47 ARG CB C 14.528 -3.710 0.251 1.00 . A A . 826 ARG CB 1 1 12 9027 1 1 47 ARG CD C 16.288 -5.210 -0.733 1.00 . A A . 826 ARG CD 1 1 12 9028 1 1 47 ARG CG C 15.401 -3.999 -0.959 1.00 . A A . 826 ARG CG 1 1 12 9029 1 1 47 ARG CZ C 16.025 -7.589 -0.139 1.00 . A A . 826 ARG CZ 1 1 12 9030 1 1 47 ARG H H 13.446 -3.375 2.518 1.00 . A A . 826 ARG H 1 1 12 9031 1 1 47 ARG HA H 16.008 -4.154 1.731 1.00 . A A . 826 ARG HA 1 1 12 9032 1 1 47 ARG HB2 H 13.927 -4.584 0.448 1.00 . A A . 826 ARG HB2 1 1 12 9033 1 1 47 ARG HB3 H 13.875 -2.885 0.007 1.00 . A A . 826 ARG HB3 1 1 12 9034 1 1 47 ARG HD2 H 16.954 -5.311 -1.575 1.00 . A A . 826 ARG HD2 1 1 12 9035 1 1 47 ARG HD3 H 16.865 -5.053 0.165 1.00 . A A . 826 ARG HD3 1 1 12 9036 1 1 47 ARG HE H 14.561 -6.413 -0.856 1.00 . A A . 826 ARG HE 1 1 12 9037 1 1 47 ARG HG2 H 14.766 -4.186 -1.812 1.00 . A A . 826 ARG HG2 1 1 12 9038 1 1 47 ARG HG3 H 16.024 -3.137 -1.153 1.00 . A A . 826 ARG HG3 1 1 12 9039 1 1 47 ARG HH11 H 17.884 -6.828 0.172 1.00 . A A . 826 ARG HH11 1 1 12 9040 1 1 47 ARG HH12 H 17.692 -8.511 0.572 1.00 . A A . 826 ARG HH12 1 1 12 9041 1 1 47 ARG HH21 H 14.307 -8.639 -0.358 1.00 . A A . 826 ARG HH21 1 1 12 9042 1 1 47 ARG HH22 H 15.652 -9.546 0.275 1.00 . A A . 826 ARG HH22 1 1 12 9043 1 1 47 ARG N N 14.412 -3.254 2.658 1.00 . A A . 826 ARG N 1 1 12 9044 1 1 47 ARG NE N 15.515 -6.443 -0.589 1.00 . A A . 826 ARG NE 1 1 12 9045 1 1 47 ARG NH1 N 17.300 -7.646 0.231 1.00 . A A . 826 ARG NH1 1 1 12 9046 1 1 47 ARG NH2 N 15.267 -8.675 -0.070 1.00 . A A . 826 ARG NH2 1 1 12 9047 1 1 47 ARG O O 17.200 -2.018 0.859 1.00 . A A . 826 ARG O 1 1 12 9048 1 1 48 TYR C C 16.836 0.696 2.709 1.00 . A A . 827 TYR C 1 1 12 9049 1 1 48 TYR CA C 15.977 0.370 1.487 1.00 . A A . 827 TYR CA 1 1 12 9050 1 1 48 TYR CB C 14.901 1.438 1.226 1.00 . A A . 827 TYR CB 1 1 12 9051 1 1 48 TYR CD1 C 16.188 3.502 0.557 1.00 . A A . 827 TYR CD1 1 1 12 9052 1 1 48 TYR CD2 C 14.953 3.568 2.593 1.00 . A A . 827 TYR CD2 1 1 12 9053 1 1 48 TYR CE1 C 16.603 4.802 0.757 1.00 . A A . 827 TYR CE1 1 1 12 9054 1 1 48 TYR CE2 C 15.365 4.871 2.803 1.00 . A A . 827 TYR CE2 1 1 12 9055 1 1 48 TYR CG C 15.357 2.862 1.468 1.00 . A A . 827 TYR CG 1 1 12 9056 1 1 48 TYR CZ C 16.200 5.470 1.945 1.00 . A A . 827 TYR CZ 1 1 12 9057 1 1 48 TYR H H 14.507 -1.044 2.086 1.00 . A A . 827 TYR H 1 1 12 9058 1 1 48 TYR HA H 16.657 0.308 0.652 1.00 . A A . 827 TYR HA 1 1 12 9059 1 1 48 TYR HB2 H 14.578 1.368 0.198 1.00 . A A . 827 TYR HB2 1 1 12 9060 1 1 48 TYR HB3 H 14.057 1.247 1.875 1.00 . A A . 827 TYR HB3 1 1 12 9061 1 1 48 TYR HD1 H 16.511 2.967 -0.321 1.00 . A A . 827 TYR HD1 1 1 12 9062 1 1 48 TYR HD2 H 14.310 3.084 3.313 1.00 . A A . 827 TYR HD2 1 1 12 9063 1 1 48 TYR HE1 H 17.251 5.280 0.033 1.00 . A A . 827 TYR HE1 1 1 12 9064 1 1 48 TYR HE2 H 15.041 5.405 3.684 1.00 . A A . 827 TYR HE2 1 1 12 9065 1 1 48 TYR HH H 16.622 7.244 1.223 1.00 . A A . 827 TYR HH 1 1 12 9066 1 1 48 TYR N N 15.382 -0.948 1.639 1.00 . A A . 827 TYR N 1 1 12 9067 1 1 48 TYR O O 17.754 1.510 2.629 1.00 . A A . 827 TYR O 1 1 12 9068 1 1 48 TYR OH O 16.597 6.784 2.079 1.00 . A A . 827 TYR OH 1 1 12 9069 1 1 49 ASN C C 17.270 1.610 5.550 1.00 . A A . 828 ASN C 1 1 12 9070 1 1 49 ASN CA C 17.311 0.171 5.060 1.00 . A A . 828 ASN CA 1 1 12 9071 1 1 49 ASN CB C 18.769 -0.277 4.872 1.00 . A A . 828 ASN CB 1 1 12 9072 1 1 49 ASN CG C 18.926 -1.783 4.786 1.00 . A A . 828 ASN CG 1 1 12 9073 1 1 49 ASN H H 15.799 -0.612 3.802 1.00 . A A . 828 ASN H 1 1 12 9074 1 1 49 ASN HA H 16.848 -0.457 5.805 1.00 . A A . 828 ASN HA 1 1 12 9075 1 1 49 ASN HB2 H 19.154 0.154 3.960 1.00 . A A . 828 ASN HB2 1 1 12 9076 1 1 49 ASN HB3 H 19.355 0.079 5.705 1.00 . A A . 828 ASN HB3 1 1 12 9077 1 1 49 ASN HD21 H 18.674 -1.735 2.815 1.00 . A A . 828 ASN HD21 1 1 12 9078 1 1 49 ASN HD22 H 18.917 -3.306 3.502 1.00 . A A . 828 ASN HD22 1 1 12 9079 1 1 49 ASN N N 16.550 0.015 3.817 1.00 . A A . 828 ASN N 1 1 12 9080 1 1 49 ASN ND2 N 18.834 -2.328 3.580 1.00 . A A . 828 ASN ND2 1 1 12 9081 1 1 49 ASN O O 18.318 2.292 5.499 1.00 . A A . 828 ASN O 1 1 12 9082 1 1 49 ASN OXT O 16.185 2.061 5.962 1.00 . A A . 828 ASN OXT 1 1 12 9083 1 1 49 ASN OD1 O 19.140 -2.454 5.796 1.00 . A A . 828 ASN OD1 1 1 12 9084 2 2 1 ZN ZN ZN 7.714 -2.858 -2.807 1.00 . B A . 829 ZN ZN 1 1 13 9085 1 1 1 GLY C C -12.510 4.614 16.360 1.00 . A A . 1 GLY C 1 1 13 9086 1 1 1 GLY CA C -13.503 5.752 16.291 1.00 . A A . 1 GLY CA 1 1 13 9087 1 1 1 GLY H1 H -13.378 6.316 18.293 1.00 . A A . 1 GLY H1 1 1 13 9088 1 1 1 GLY H2 H -13.950 7.541 17.268 1.00 . A A . 1 GLY H2 1 1 13 9089 1 1 1 GLY H3 H -12.302 7.141 17.276 1.00 . A A . 1 GLY H3 1 1 13 9090 1 1 1 GLY HA2 H -14.500 5.354 16.402 1.00 . A A . 1 GLY HA2 1 1 13 9091 1 1 1 GLY HA3 H -13.420 6.232 15.328 1.00 . A A . 1 GLY HA3 1 1 13 9092 1 1 1 GLY N N -13.267 6.759 17.353 1.00 . A A . 1 GLY N 1 1 13 9093 1 1 1 GLY O O -11.485 4.721 17.035 1.00 . A A . 1 GLY O 1 1 13 9094 1 1 2 THR C C -11.331 2.222 14.220 1.00 . A A . 2 THR C 1 1 13 9095 1 1 2 THR CA C -11.888 2.397 15.634 1.00 . A A . 2 THR CA 1 1 13 9096 1 1 2 THR CB C -12.567 1.100 16.143 1.00 . A A . 2 THR CB 1 1 13 9097 1 1 2 THR CG2 C -13.864 0.811 15.394 1.00 . A A . 2 THR CG2 1 1 13 9098 1 1 2 THR H H -13.645 3.481 15.168 1.00 . A A . 2 THR H 1 1 13 9099 1 1 2 THR HA H -11.065 2.627 16.296 1.00 . A A . 2 THR HA 1 1 13 9100 1 1 2 THR HB H -12.805 1.237 17.189 1.00 . A A . 2 THR HB 1 1 13 9101 1 1 2 THR HG1 H -10.776 0.280 16.266 1.00 . A A . 2 THR HG1 1 1 13 9102 1 1 2 THR HG21 H -13.659 0.729 14.336 1.00 . A A . 2 THR HG21 1 1 13 9103 1 1 2 THR HG22 H -14.564 1.614 15.566 1.00 . A A . 2 THR HG22 1 1 13 9104 1 1 2 THR HG23 H -14.288 -0.117 15.751 1.00 . A A . 2 THR HG23 1 1 13 9105 1 1 2 THR N N -12.800 3.525 15.673 1.00 . A A . 2 THR N 1 1 13 9106 1 1 2 THR O O -11.718 1.317 13.476 1.00 . A A . 2 THR O 1 1 13 9107 1 1 2 THR OG1 O -11.666 -0.011 16.024 1.00 . A A . 2 THR OG1 1 1 13 9108 1 1 3 ARG C C -11.031 3.381 11.530 1.00 . A A . 3 ARG C 1 1 13 9109 1 1 3 ARG CA C -9.875 3.188 12.509 1.00 . A A . 3 ARG CA 1 1 13 9110 1 1 3 ARG CB C -9.034 1.944 12.184 1.00 . A A . 3 ARG CB 1 1 13 9111 1 1 3 ARG CD C -7.019 1.221 10.859 1.00 . A A . 3 ARG CD 1 1 13 9112 1 1 3 ARG CG C -8.313 2.018 10.848 1.00 . A A . 3 ARG CG 1 1 13 9113 1 1 3 ARG CZ C -6.309 -1.129 11.048 1.00 . A A . 3 ARG CZ 1 1 13 9114 1 1 3 ARG H H -10.063 3.737 14.541 1.00 . A A . 3 ARG H 1 1 13 9115 1 1 3 ARG HA H -9.237 4.062 12.461 1.00 . A A . 3 ARG HA 1 1 13 9116 1 1 3 ARG HB2 H -8.294 1.815 12.959 1.00 . A A . 3 ARG HB2 1 1 13 9117 1 1 3 ARG HB3 H -9.684 1.080 12.173 1.00 . A A . 3 ARG HB3 1 1 13 9118 1 1 3 ARG HD2 H -6.595 1.242 9.867 1.00 . A A . 3 ARG HD2 1 1 13 9119 1 1 3 ARG HD3 H -6.334 1.691 11.550 1.00 . A A . 3 ARG HD3 1 1 13 9120 1 1 3 ARG HE H -8.047 -0.396 11.724 1.00 . A A . 3 ARG HE 1 1 13 9121 1 1 3 ARG HG2 H -8.960 1.622 10.079 1.00 . A A . 3 ARG HG2 1 1 13 9122 1 1 3 ARG HG3 H -8.085 3.049 10.630 1.00 . A A . 3 ARG HG3 1 1 13 9123 1 1 3 ARG HH11 H -5.023 0.072 10.014 1.00 . A A . 3 ARG HH11 1 1 13 9124 1 1 3 ARG HH12 H -4.510 -1.577 10.232 1.00 . A A . 3 ARG HH12 1 1 13 9125 1 1 3 ARG HH21 H -7.383 -2.588 11.967 1.00 . A A . 3 ARG HH21 1 1 13 9126 1 1 3 ARG HH22 H -5.844 -3.085 11.317 1.00 . A A . 3 ARG HH22 1 1 13 9127 1 1 3 ARG N N -10.405 3.112 13.865 1.00 . A A . 3 ARG N 1 1 13 9128 1 1 3 ARG NE N -7.212 -0.171 11.258 1.00 . A A . 3 ARG NE 1 1 13 9129 1 1 3 ARG NH1 N -5.192 -0.860 10.378 1.00 . A A . 3 ARG NH1 1 1 13 9130 1 1 3 ARG NH2 N -6.531 -2.363 11.479 1.00 . A A . 3 ARG NH2 1 1 13 9131 1 1 3 ARG O O -11.181 2.659 10.541 1.00 . A A . 3 ARG O 1 1 13 9132 1 1 4 GLY C C -14.293 4.557 11.948 1.00 . A A . 783 GLY C 1 1 13 9133 1 1 4 GLY CA C -13.055 4.625 11.077 1.00 . A A . 783 GLY CA 1 1 13 9134 1 1 4 GLY H H -11.663 4.925 12.632 1.00 . A A . 783 GLY H 1 1 13 9135 1 1 4 GLY HA2 H -12.985 5.610 10.633 1.00 . A A . 783 GLY HA2 1 1 13 9136 1 1 4 GLY HA3 H -13.136 3.889 10.291 1.00 . A A . 783 GLY HA3 1 1 13 9137 1 1 4 GLY N N -11.861 4.368 11.846 1.00 . A A . 783 GLY N 1 1 13 9138 1 1 4 GLY O O -14.276 3.930 13.009 1.00 . A A . 783 GLY O 1 1 13 9139 1 1 5 VAL C C -17.789 4.837 11.360 1.00 . A A . 784 VAL C 1 1 13 9140 1 1 5 VAL CA C -16.612 5.205 12.267 1.00 . A A . 784 VAL CA 1 1 13 9141 1 1 5 VAL CB C -16.848 6.567 12.972 1.00 . A A . 784 VAL CB 1 1 13 9142 1 1 5 VAL CG1 C -16.752 7.726 11.990 1.00 . A A . 784 VAL CG1 1 1 13 9143 1 1 5 VAL CG2 C -18.186 6.584 13.695 1.00 . A A . 784 VAL CG2 1 1 13 9144 1 1 5 VAL H H -15.311 5.703 10.674 1.00 . A A . 784 VAL H 1 1 13 9145 1 1 5 VAL HA H -16.526 4.446 13.033 1.00 . A A . 784 VAL HA 1 1 13 9146 1 1 5 VAL HB H -16.070 6.695 13.712 1.00 . A A . 784 VAL HB 1 1 13 9147 1 1 5 VAL HG11 H -16.842 8.659 12.526 1.00 . A A . 784 VAL HG11 1 1 13 9148 1 1 5 VAL HG12 H -17.547 7.651 11.264 1.00 . A A . 784 VAL HG12 1 1 13 9149 1 1 5 VAL HG13 H -15.798 7.693 11.485 1.00 . A A . 784 VAL HG13 1 1 13 9150 1 1 5 VAL HG21 H -18.210 5.791 14.426 1.00 . A A . 784 VAL HG21 1 1 13 9151 1 1 5 VAL HG22 H -18.982 6.439 12.979 1.00 . A A . 784 VAL HG22 1 1 13 9152 1 1 5 VAL HG23 H -18.317 7.535 14.191 1.00 . A A . 784 VAL HG23 1 1 13 9153 1 1 5 VAL N N -15.363 5.208 11.515 1.00 . A A . 784 VAL N 1 1 13 9154 1 1 5 VAL O O -18.642 4.026 11.723 1.00 . A A . 784 VAL O 1 1 13 9155 1 1 6 ASP C C -18.192 4.128 8.158 1.00 . A A . 785 ASP C 1 1 13 9156 1 1 6 ASP CA C -18.822 5.062 9.173 1.00 . A A . 785 ASP CA 1 1 13 9157 1 1 6 ASP CB C -19.360 6.306 8.461 1.00 . A A . 785 ASP CB 1 1 13 9158 1 1 6 ASP CG C -20.135 7.225 9.383 1.00 . A A . 785 ASP CG 1 1 13 9159 1 1 6 ASP H H -17.161 6.104 9.953 1.00 . A A . 785 ASP H 1 1 13 9160 1 1 6 ASP HA H -19.631 4.550 9.671 1.00 . A A . 785 ASP HA 1 1 13 9161 1 1 6 ASP HB2 H -18.533 6.862 8.048 1.00 . A A . 785 ASP HB2 1 1 13 9162 1 1 6 ASP HB3 H -20.016 5.997 7.659 1.00 . A A . 785 ASP HB3 1 1 13 9163 1 1 6 ASP N N -17.822 5.417 10.170 1.00 . A A . 785 ASP N 1 1 13 9164 1 1 6 ASP O O -17.007 4.263 7.847 1.00 . A A . 785 ASP O 1 1 13 9165 1 1 6 ASP OD1 O -19.504 8.014 10.113 1.00 . A A . 785 ASP OD1 1 1 13 9166 1 1 6 ASP OD2 O -21.381 7.166 9.376 1.00 . A A . 785 ASP OD2 1 1 13 9167 1 1 7 SER C C -19.502 1.699 5.754 1.00 . A A . 786 SER C 1 1 13 9168 1 1 7 SER CA C -18.422 2.227 6.690 1.00 . A A . 786 SER CA 1 1 13 9169 1 1 7 SER CB C -17.751 1.056 7.408 1.00 . A A . 786 SER CB 1 1 13 9170 1 1 7 SER H H -19.886 3.077 7.961 1.00 . A A . 786 SER H 1 1 13 9171 1 1 7 SER HA H -17.678 2.746 6.105 1.00 . A A . 786 SER HA 1 1 13 9172 1 1 7 SER HB2 H -18.482 0.537 8.010 1.00 . A A . 786 SER HB2 1 1 13 9173 1 1 7 SER HB3 H -17.337 0.375 6.677 1.00 . A A . 786 SER HB3 1 1 13 9174 1 1 7 SER HG H -16.787 2.472 8.358 1.00 . A A . 786 SER HG 1 1 13 9175 1 1 7 SER N N -18.954 3.164 7.664 1.00 . A A . 786 SER N 1 1 13 9176 1 1 7 SER O O -20.477 1.088 6.192 1.00 . A A . 786 SER O 1 1 13 9177 1 1 7 SER OG O -16.708 1.511 8.250 1.00 . A A . 786 SER OG 1 1 13 9178 1 1 8 PRO C C -19.538 -0.079 3.071 1.00 . A A . 787 PRO C 1 1 13 9179 1 1 8 PRO CA C -20.122 1.294 3.400 1.00 . A A . 787 PRO CA 1 1 13 9180 1 1 8 PRO CB C -19.991 2.243 2.196 1.00 . A A . 787 PRO CB 1 1 13 9181 1 1 8 PRO CD C -18.448 2.963 3.874 1.00 . A A . 787 PRO CD 1 1 13 9182 1 1 8 PRO CG C -19.253 3.443 2.703 1.00 . A A . 787 PRO CG 1 1 13 9183 1 1 8 PRO HA H -21.160 1.191 3.680 1.00 . A A . 787 PRO HA 1 1 13 9184 1 1 8 PRO HB2 H -19.443 1.750 1.407 1.00 . A A . 787 PRO HB2 1 1 13 9185 1 1 8 PRO HB3 H -20.976 2.511 1.841 1.00 . A A . 787 PRO HB3 1 1 13 9186 1 1 8 PRO HD2 H -17.517 2.524 3.546 1.00 . A A . 787 PRO HD2 1 1 13 9187 1 1 8 PRO HD3 H -18.271 3.767 4.571 1.00 . A A . 787 PRO HD3 1 1 13 9188 1 1 8 PRO HG2 H -18.599 3.825 1.933 1.00 . A A . 787 PRO HG2 1 1 13 9189 1 1 8 PRO HG3 H -19.955 4.203 3.014 1.00 . A A . 787 PRO HG3 1 1 13 9190 1 1 8 PRO N N -19.342 1.952 4.447 1.00 . A A . 787 PRO N 1 1 13 9191 1 1 8 PRO O O -20.194 -0.928 2.466 1.00 . A A . 787 PRO O 1 1 13 9192 1 1 9 SER C C -16.776 -1.830 4.567 1.00 . A A . 788 SER C 1 1 13 9193 1 1 9 SER CA C -17.603 -1.545 3.320 1.00 . A A . 788 SER CA 1 1 13 9194 1 1 9 SER CB C -16.708 -1.525 2.075 1.00 . A A . 788 SER CB 1 1 13 9195 1 1 9 SER H H -17.813 0.467 3.900 1.00 . A A . 788 SER H 1 1 13 9196 1 1 9 SER HA H -18.351 -2.317 3.209 1.00 . A A . 788 SER HA 1 1 13 9197 1 1 9 SER HB2 H -17.326 -1.466 1.193 1.00 . A A . 788 SER HB2 1 1 13 9198 1 1 9 SER HB3 H -16.064 -0.660 2.118 1.00 . A A . 788 SER HB3 1 1 13 9199 1 1 9 SER HG H -16.326 -3.331 1.398 1.00 . A A . 788 SER HG 1 1 13 9200 1 1 9 SER N N -18.290 -0.276 3.476 1.00 . A A . 788 SER N 1 1 13 9201 1 1 9 SER O O -16.245 -0.894 5.180 1.00 . A A . 788 SER O 1 1 13 9202 1 1 9 SER OG O -15.900 -2.690 1.987 1.00 . A A . 788 SER OG 1 1 13 9203 1 1 10 ALA C C -14.634 -2.915 6.331 1.00 . A A . 789 ALA C 1 1 13 9204 1 1 10 ALA CA C -16.042 -3.495 6.195 1.00 . A A . 789 ALA CA 1 1 13 9205 1 1 10 ALA CB C -16.007 -5.012 6.316 1.00 . A A . 789 ALA CB 1 1 13 9206 1 1 10 ALA H H -17.040 -3.798 4.347 1.00 . A A . 789 ALA H 1 1 13 9207 1 1 10 ALA HA H -16.649 -3.113 7.002 1.00 . A A . 789 ALA HA 1 1 13 9208 1 1 10 ALA HB1 H -15.647 -5.286 7.296 1.00 . A A . 789 ALA HB1 1 1 13 9209 1 1 10 ALA HB2 H -15.348 -5.419 5.563 1.00 . A A . 789 ALA HB2 1 1 13 9210 1 1 10 ALA HB3 H -17.002 -5.408 6.176 1.00 . A A . 789 ALA HB3 1 1 13 9211 1 1 10 ALA N N -16.677 -3.100 4.941 1.00 . A A . 789 ALA N 1 1 13 9212 1 1 10 ALA O O -14.346 -2.176 7.274 1.00 . A A . 789 ALA O 1 1 13 9213 1 1 11 GLU C C -11.995 -1.858 4.330 1.00 . A A . 790 GLU C 1 1 13 9214 1 1 11 GLU CA C -12.372 -2.813 5.460 1.00 . A A . 790 GLU CA 1 1 13 9215 1 1 11 GLU CB C -11.461 -4.042 5.399 1.00 . A A . 790 GLU CB 1 1 13 9216 1 1 11 GLU CD C -11.018 -6.385 6.220 1.00 . A A . 790 GLU CD 1 1 13 9217 1 1 11 GLU CG C -11.780 -5.096 6.446 1.00 . A A . 790 GLU CG 1 1 13 9218 1 1 11 GLU H H -14.075 -3.755 4.611 1.00 . A A . 790 GLU H 1 1 13 9219 1 1 11 GLU HA H -12.227 -2.314 6.407 1.00 . A A . 790 GLU HA 1 1 13 9220 1 1 11 GLU HB2 H -11.556 -4.496 4.424 1.00 . A A . 790 GLU HB2 1 1 13 9221 1 1 11 GLU HB3 H -10.437 -3.724 5.540 1.00 . A A . 790 GLU HB3 1 1 13 9222 1 1 11 GLU HG2 H -11.524 -4.707 7.420 1.00 . A A . 790 GLU HG2 1 1 13 9223 1 1 11 GLU HG3 H -12.838 -5.309 6.411 1.00 . A A . 790 GLU HG3 1 1 13 9224 1 1 11 GLU N N -13.770 -3.226 5.377 1.00 . A A . 790 GLU N 1 1 13 9225 1 1 11 GLU O O -11.295 -0.869 4.548 1.00 . A A . 790 GLU O 1 1 13 9226 1 1 11 GLU OE1 O -11.406 -7.166 5.330 1.00 . A A . 790 GLU OE1 1 1 13 9227 1 1 11 GLU OE2 O -10.021 -6.618 6.938 1.00 . A A . 790 GLU OE2 1 1 13 9228 1 1 12 LEU C C -12.406 -0.045 1.809 1.00 . A A . 791 LEU C 1 1 13 9229 1 1 12 LEU CA C -11.986 -1.497 1.921 1.00 . A A . 791 LEU CA 1 1 13 9230 1 1 12 LEU CB C -12.423 -2.266 0.663 1.00 . A A . 791 LEU CB 1 1 13 9231 1 1 12 LEU CD1 C -10.279 -3.588 0.644 1.00 . A A . 791 LEU CD1 1 1 13 9232 1 1 12 LEU CD2 C -12.400 -4.681 1.411 1.00 . A A . 791 LEU CD2 1 1 13 9233 1 1 12 LEU CG C -11.788 -3.654 0.464 1.00 . A A . 791 LEU CG 1 1 13 9234 1 1 12 LEU H H -13.197 -2.815 3.053 1.00 . A A . 791 LEU H 1 1 13 9235 1 1 12 LEU HA H -10.929 -1.517 1.978 1.00 . A A . 791 LEU HA 1 1 13 9236 1 1 12 LEU HB2 H -13.496 -2.391 0.701 1.00 . A A . 791 LEU HB2 1 1 13 9237 1 1 12 LEU HB3 H -12.183 -1.663 -0.200 1.00 . A A . 791 LEU HB3 1 1 13 9238 1 1 12 LEU HD11 H -9.850 -4.554 0.432 1.00 . A A . 791 LEU HD11 1 1 13 9239 1 1 12 LEU HD12 H -10.049 -3.310 1.662 1.00 . A A . 791 LEU HD12 1 1 13 9240 1 1 12 LEU HD13 H -9.864 -2.852 -0.031 1.00 . A A . 791 LEU HD13 1 1 13 9241 1 1 12 LEU HD21 H -12.230 -4.374 2.433 1.00 . A A . 791 LEU HD21 1 1 13 9242 1 1 12 LEU HD22 H -11.943 -5.646 1.242 1.00 . A A . 791 LEU HD22 1 1 13 9243 1 1 12 LEU HD23 H -13.462 -4.748 1.231 1.00 . A A . 791 LEU HD23 1 1 13 9244 1 1 12 LEU HG H -11.983 -3.983 -0.548 1.00 . A A . 791 LEU HG 1 1 13 9245 1 1 12 LEU N N -12.485 -2.148 3.131 1.00 . A A . 791 LEU N 1 1 13 9246 1 1 12 LEU O O -11.582 0.837 1.546 1.00 . A A . 791 LEU O 1 1 13 9247 1 1 13 ASP C C -14.155 2.406 2.995 1.00 . A A . 792 ASP C 1 1 13 9248 1 1 13 ASP CA C -14.241 1.512 1.772 1.00 . A A . 792 ASP CA 1 1 13 9249 1 1 13 ASP CB C -15.678 1.425 1.258 1.00 . A A . 792 ASP CB 1 1 13 9250 1 1 13 ASP CG C -16.044 2.641 0.430 1.00 . A A . 792 ASP CG 1 1 13 9251 1 1 13 ASP H H -14.195 -0.500 2.451 1.00 . A A . 792 ASP H 1 1 13 9252 1 1 13 ASP HA H -13.633 1.959 0.998 1.00 . A A . 792 ASP HA 1 1 13 9253 1 1 13 ASP HB2 H -15.787 0.542 0.644 1.00 . A A . 792 ASP HB2 1 1 13 9254 1 1 13 ASP HB3 H -16.354 1.363 2.097 1.00 . A A . 792 ASP HB3 1 1 13 9255 1 1 13 ASP N N -13.664 0.199 2.050 1.00 . A A . 792 ASP N 1 1 13 9256 1 1 13 ASP O O -15.134 2.659 3.695 1.00 . A A . 792 ASP O 1 1 13 9257 1 1 13 ASP OD1 O -15.291 2.965 -0.512 1.00 . A A . 792 ASP OD1 1 1 13 9258 1 1 13 ASP OD2 O -17.080 3.278 0.701 1.00 . A A . 792 ASP OD2 1 1 13 9259 1 1 14 LYS C C -11.172 4.248 3.925 1.00 . A A . 793 LYS C 1 1 13 9260 1 1 14 LYS CA C -12.564 3.778 4.269 1.00 . A A . 793 LYS CA 1 1 13 9261 1 1 14 LYS CB C -12.554 3.152 5.673 1.00 . A A . 793 LYS CB 1 1 13 9262 1 1 14 LYS CD C -13.744 2.808 7.862 1.00 . A A . 793 LYS CD 1 1 13 9263 1 1 14 LYS CE C -13.356 1.343 7.988 1.00 . A A . 793 LYS CE 1 1 13 9264 1 1 14 LYS CG C -13.884 3.233 6.406 1.00 . A A . 793 LYS CG 1 1 13 9265 1 1 14 LYS H H -12.222 2.490 2.657 1.00 . A A . 793 LYS H 1 1 13 9266 1 1 14 LYS HA H -13.249 4.612 4.235 1.00 . A A . 793 LYS HA 1 1 13 9267 1 1 14 LYS HB2 H -12.285 2.110 5.584 1.00 . A A . 793 LYS HB2 1 1 13 9268 1 1 14 LYS HB3 H -11.810 3.655 6.271 1.00 . A A . 793 LYS HB3 1 1 13 9269 1 1 14 LYS HD2 H -12.984 3.415 8.333 1.00 . A A . 793 LYS HD2 1 1 13 9270 1 1 14 LYS HD3 H -14.690 2.966 8.363 1.00 . A A . 793 LYS HD3 1 1 13 9271 1 1 14 LYS HE2 H -12.423 1.183 7.467 1.00 . A A . 793 LYS HE2 1 1 13 9272 1 1 14 LYS HE3 H -13.228 1.105 9.035 1.00 . A A . 793 LYS HE3 1 1 13 9273 1 1 14 LYS HG2 H -14.243 4.251 6.371 1.00 . A A . 793 LYS HG2 1 1 13 9274 1 1 14 LYS HG3 H -14.595 2.580 5.917 1.00 . A A . 793 LYS HG3 1 1 13 9275 1 1 14 LYS HZ1 H -14.142 -0.551 7.572 1.00 . A A . 793 LYS HZ1 1 1 13 9276 1 1 14 LYS HZ2 H -14.476 0.610 6.389 1.00 . A A . 793 LYS HZ2 1 1 13 9277 1 1 14 LYS HZ3 H -15.318 0.639 7.857 1.00 . A A . 793 LYS HZ3 1 1 13 9278 1 1 14 LYS N N -12.935 2.828 3.234 1.00 . A A . 793 LYS N 1 1 13 9279 1 1 14 LYS NZ N -14.392 0.449 7.411 1.00 . A A . 793 LYS NZ 1 1 13 9280 1 1 14 LYS O O -10.842 5.432 3.987 1.00 . A A . 793 LYS O 1 1 13 9281 1 1 15 LYS C C -9.175 3.862 1.527 1.00 . A A . 794 LYS C 1 1 13 9282 1 1 15 LYS CA C -9.054 3.531 3.010 1.00 . A A . 794 LYS CA 1 1 13 9283 1 1 15 LYS CB C -8.147 2.323 3.252 1.00 . A A . 794 LYS CB 1 1 13 9284 1 1 15 LYS CD C -7.273 3.121 5.453 1.00 . A A . 794 LYS CD 1 1 13 9285 1 1 15 LYS CE C -7.338 2.960 6.962 1.00 . A A . 794 LYS CE 1 1 13 9286 1 1 15 LYS CG C -7.995 1.998 4.723 1.00 . A A . 794 LYS CG 1 1 13 9287 1 1 15 LYS H H -10.647 2.347 3.667 1.00 . A A . 794 LYS H 1 1 13 9288 1 1 15 LYS HA H -8.648 4.386 3.526 1.00 . A A . 794 LYS HA 1 1 13 9289 1 1 15 LYS HB2 H -8.566 1.462 2.759 1.00 . A A . 794 LYS HB2 1 1 13 9290 1 1 15 LYS HB3 H -7.167 2.526 2.844 1.00 . A A . 794 LYS HB3 1 1 13 9291 1 1 15 LYS HD2 H -6.237 3.121 5.151 1.00 . A A . 794 LYS HD2 1 1 13 9292 1 1 15 LYS HD3 H -7.726 4.062 5.182 1.00 . A A . 794 LYS HD3 1 1 13 9293 1 1 15 LYS HE2 H -8.364 3.076 7.281 1.00 . A A . 794 LYS HE2 1 1 13 9294 1 1 15 LYS HE3 H -6.986 1.974 7.225 1.00 . A A . 794 LYS HE3 1 1 13 9295 1 1 15 LYS HG2 H -8.980 1.863 5.152 1.00 . A A . 794 LYS HG2 1 1 13 9296 1 1 15 LYS HG3 H -7.427 1.087 4.825 1.00 . A A . 794 LYS HG3 1 1 13 9297 1 1 15 LYS HZ1 H -6.731 4.935 7.302 1.00 . A A . 794 LYS HZ1 1 1 13 9298 1 1 15 LYS HZ2 H -5.484 3.789 7.459 1.00 . A A . 794 LYS HZ2 1 1 13 9299 1 1 15 LYS HZ3 H -6.650 3.943 8.676 1.00 . A A . 794 LYS HZ3 1 1 13 9300 1 1 15 LYS N N -10.357 3.273 3.557 1.00 . A A . 794 LYS N 1 1 13 9301 1 1 15 LYS NZ N -6.497 3.978 7.647 1.00 . A A . 794 LYS NZ 1 1 13 9302 1 1 15 LYS O O -9.177 5.034 1.165 1.00 . A A . 794 LYS O 1 1 13 9303 1 1 16 ALA C C -8.654 4.151 -1.296 1.00 . A A . 795 ALA C 1 1 13 9304 1 1 16 ALA CA C -9.412 2.933 -0.766 1.00 . A A . 795 ALA CA 1 1 13 9305 1 1 16 ALA CB C -10.857 2.957 -1.227 1.00 . A A . 795 ALA CB 1 1 13 9306 1 1 16 ALA H H -9.449 1.925 1.092 1.00 . A A . 795 ALA H 1 1 13 9307 1 1 16 ALA HA H -8.953 2.046 -1.180 1.00 . A A . 795 ALA HA 1 1 13 9308 1 1 16 ALA HB1 H -10.888 2.911 -2.304 1.00 . A A . 795 ALA HB1 1 1 13 9309 1 1 16 ALA HB2 H -11.328 3.867 -0.889 1.00 . A A . 795 ALA HB2 1 1 13 9310 1 1 16 ALA HB3 H -11.379 2.106 -0.816 1.00 . A A . 795 ALA HB3 1 1 13 9311 1 1 16 ALA N N -9.342 2.815 0.699 1.00 . A A . 795 ALA N 1 1 13 9312 1 1 16 ALA O O -9.244 5.095 -1.823 1.00 . A A . 795 ALA O 1 1 13 9313 1 1 17 ASN C C -5.086 4.648 -1.790 1.00 . A A . 796 ASN C 1 1 13 9314 1 1 17 ASN CA C -6.471 5.205 -1.536 1.00 . A A . 796 ASN CA 1 1 13 9315 1 1 17 ASN CB C -6.439 6.313 -0.458 1.00 . A A . 796 ASN CB 1 1 13 9316 1 1 17 ASN CG C -5.877 5.889 0.905 1.00 . A A . 796 ASN CG 1 1 13 9317 1 1 17 ASN H H -6.936 3.281 -0.818 1.00 . A A . 796 ASN H 1 1 13 9318 1 1 17 ASN HA H -6.850 5.620 -2.460 1.00 . A A . 796 ASN HA 1 1 13 9319 1 1 17 ASN HB2 H -5.828 7.124 -0.820 1.00 . A A . 796 ASN HB2 1 1 13 9320 1 1 17 ASN HB3 H -7.445 6.678 -0.309 1.00 . A A . 796 ASN HB3 1 1 13 9321 1 1 17 ASN HD21 H -6.637 4.061 0.742 1.00 . A A . 796 ASN HD21 1 1 13 9322 1 1 17 ASN HD22 H -5.752 4.380 2.189 1.00 . A A . 796 ASN HD22 1 1 13 9323 1 1 17 ASN N N -7.341 4.101 -1.158 1.00 . A A . 796 ASN N 1 1 13 9324 1 1 17 ASN ND2 N -6.113 4.649 1.320 1.00 . A A . 796 ASN ND2 1 1 13 9325 1 1 17 ASN O O -4.381 4.241 -0.863 1.00 . A A . 796 ASN O 1 1 13 9326 1 1 17 ASN OD1 O -5.248 6.688 1.596 1.00 . A A . 796 ASN OD1 1 1 13 9327 1 1 18 LEU C C -2.388 4.782 -3.750 1.00 . A A . 797 LEU C 1 1 13 9328 1 1 18 LEU CA C -3.522 3.831 -3.400 1.00 . A A . 797 LEU CA 1 1 13 9329 1 1 18 LEU CB C -3.803 2.894 -4.574 1.00 . A A . 797 LEU CB 1 1 13 9330 1 1 18 LEU CD1 C -5.333 1.303 -5.767 1.00 . A A . 797 LEU CD1 1 1 13 9331 1 1 18 LEU CD2 C -5.305 1.334 -3.272 1.00 . A A . 797 LEU CD2 1 1 13 9332 1 1 18 LEU CG C -5.159 2.173 -4.533 1.00 . A A . 797 LEU CG 1 1 13 9333 1 1 18 LEU H H -5.202 4.999 -3.774 1.00 . A A . 797 LEU H 1 1 13 9334 1 1 18 LEU HA H -3.242 3.245 -2.539 1.00 . A A . 797 LEU HA 1 1 13 9335 1 1 18 LEU HB2 H -3.756 3.476 -5.479 1.00 . A A . 797 LEU HB2 1 1 13 9336 1 1 18 LEU HB3 H -3.023 2.148 -4.605 1.00 . A A . 797 LEU HB3 1 1 13 9337 1 1 18 LEU HD11 H -6.290 0.800 -5.721 1.00 . A A . 797 LEU HD11 1 1 13 9338 1 1 18 LEU HD12 H -4.543 0.567 -5.804 1.00 . A A . 797 LEU HD12 1 1 13 9339 1 1 18 LEU HD13 H -5.293 1.919 -6.652 1.00 . A A . 797 LEU HD13 1 1 13 9340 1 1 18 LEU HD21 H -4.580 0.533 -3.288 1.00 . A A . 797 LEU HD21 1 1 13 9341 1 1 18 LEU HD22 H -6.305 0.921 -3.229 1.00 . A A . 797 LEU HD22 1 1 13 9342 1 1 18 LEU HD23 H -5.136 1.955 -2.406 1.00 . A A . 797 LEU HD23 1 1 13 9343 1 1 18 LEU HG H -5.947 2.913 -4.531 1.00 . A A . 797 LEU HG 1 1 13 9344 1 1 18 LEU N N -4.712 4.553 -3.052 1.00 . A A . 797 LEU N 1 1 13 9345 1 1 18 LEU O O -2.592 5.842 -4.345 1.00 . A A . 797 LEU O 1 1 13 9346 1 1 19 LEU C C 1.031 3.907 -3.878 1.00 . A A . 798 LEU C 1 1 13 9347 1 1 19 LEU CA C 0.042 5.024 -3.700 1.00 . A A . 798 LEU CA 1 1 13 9348 1 1 19 LEU CB C 0.494 5.987 -2.591 1.00 . A A . 798 LEU CB 1 1 13 9349 1 1 19 LEU CD1 C 1.560 6.376 -0.354 1.00 . A A . 798 LEU CD1 1 1 13 9350 1 1 19 LEU CD2 C 0.179 4.342 -0.729 1.00 . A A . 798 LEU CD2 1 1 13 9351 1 1 19 LEU CG C 1.134 5.330 -1.361 1.00 . A A . 798 LEU CG 1 1 13 9352 1 1 19 LEU H H -1.165 3.527 -2.860 1.00 . A A . 798 LEU H 1 1 13 9353 1 1 19 LEU HA H -0.053 5.542 -4.635 1.00 . A A . 798 LEU HA 1 1 13 9354 1 1 19 LEU HB2 H 1.209 6.677 -3.013 1.00 . A A . 798 LEU HB2 1 1 13 9355 1 1 19 LEU HB3 H -0.369 6.546 -2.261 1.00 . A A . 798 LEU HB3 1 1 13 9356 1 1 19 LEU HD11 H 1.982 5.889 0.511 1.00 . A A . 798 LEU HD11 1 1 13 9357 1 1 19 LEU HD12 H 0.703 6.961 -0.059 1.00 . A A . 798 LEU HD12 1 1 13 9358 1 1 19 LEU HD13 H 2.301 7.019 -0.803 1.00 . A A . 798 LEU HD13 1 1 13 9359 1 1 19 LEU HD21 H 0.002 3.536 -1.427 1.00 . A A . 798 LEU HD21 1 1 13 9360 1 1 19 LEU HD22 H -0.754 4.839 -0.507 1.00 . A A . 798 LEU HD22 1 1 13 9361 1 1 19 LEU HD23 H 0.610 3.949 0.179 1.00 . A A . 798 LEU HD23 1 1 13 9362 1 1 19 LEU HG H 2.017 4.788 -1.672 1.00 . A A . 798 LEU HG 1 1 13 9363 1 1 19 LEU N N -1.211 4.362 -3.376 1.00 . A A . 798 LEU N 1 1 13 9364 1 1 19 LEU O O 0.633 2.740 -3.778 1.00 . A A . 798 LEU O 1 1 13 9365 1 1 20 LYS C C 4.570 3.196 -3.884 1.00 . A A . 799 LYS C 1 1 13 9366 1 1 20 LYS CA C 3.150 3.056 -4.379 1.00 . A A . 799 LYS CA 1 1 13 9367 1 1 20 LYS CB C 3.092 2.680 -5.854 1.00 . A A . 799 LYS CB 1 1 13 9368 1 1 20 LYS CD C 4.956 3.925 -7.051 1.00 . A A . 799 LYS CD 1 1 13 9369 1 1 20 LYS CE C 5.255 4.946 -8.139 1.00 . A A . 799 LYS CE 1 1 13 9370 1 1 20 LYS CG C 3.460 3.809 -6.811 1.00 . A A . 799 LYS CG 1 1 13 9371 1 1 20 LYS H H 2.632 5.107 -4.159 1.00 . A A . 799 LYS H 1 1 13 9372 1 1 20 LYS HA H 2.709 2.268 -3.791 1.00 . A A . 799 LYS HA 1 1 13 9373 1 1 20 LYS HB2 H 3.761 1.851 -6.032 1.00 . A A . 799 LYS HB2 1 1 13 9374 1 1 20 LYS HB3 H 2.081 2.372 -6.071 1.00 . A A . 799 LYS HB3 1 1 13 9375 1 1 20 LYS HD2 H 5.436 4.236 -6.136 1.00 . A A . 799 LYS HD2 1 1 13 9376 1 1 20 LYS HD3 H 5.339 2.961 -7.355 1.00 . A A . 799 LYS HD3 1 1 13 9377 1 1 20 LYS HE2 H 4.854 4.585 -9.076 1.00 . A A . 799 LYS HE2 1 1 13 9378 1 1 20 LYS HE3 H 4.774 5.878 -7.879 1.00 . A A . 799 LYS HE3 1 1 13 9379 1 1 20 LYS HG2 H 2.969 3.640 -7.756 1.00 . A A . 799 LYS HG2 1 1 13 9380 1 1 20 LYS HG3 H 3.111 4.736 -6.386 1.00 . A A . 799 LYS HG3 1 1 13 9381 1 1 20 LYS HZ1 H 7.090 5.677 -7.461 1.00 . A A . 799 LYS HZ1 1 1 13 9382 1 1 20 LYS HZ2 H 6.891 5.770 -9.144 1.00 . A A . 799 LYS HZ2 1 1 13 9383 1 1 20 LYS HZ3 H 7.219 4.278 -8.417 1.00 . A A . 799 LYS HZ3 1 1 13 9384 1 1 20 LYS N N 2.294 4.182 -4.125 1.00 . A A . 799 LYS N 1 1 13 9385 1 1 20 LYS NZ N 6.713 5.183 -8.302 1.00 . A A . 799 LYS NZ 1 1 13 9386 1 1 20 LYS O O 5.192 4.258 -3.899 1.00 . A A . 799 LYS O 1 1 13 9387 1 1 21 CYS C C 7.401 2.306 -3.891 1.00 . A A . 800 CYS C 1 1 13 9388 1 1 21 CYS CA C 6.347 1.773 -2.929 1.00 . A A . 800 CYS CA 1 1 13 9389 1 1 21 CYS CB C 6.397 0.251 -2.832 1.00 . A A . 800 CYS CB 1 1 13 9390 1 1 21 CYS H H 4.356 1.317 -3.318 1.00 . A A . 800 CYS H 1 1 13 9391 1 1 21 CYS HA H 6.474 2.198 -1.948 1.00 . A A . 800 CYS HA 1 1 13 9392 1 1 21 CYS HB2 H 5.717 -0.062 -2.052 1.00 . A A . 800 CYS HB2 1 1 13 9393 1 1 21 CYS HB3 H 6.043 -0.156 -3.771 1.00 . A A . 800 CYS HB3 1 1 13 9394 1 1 21 CYS N N 5.008 2.049 -3.398 1.00 . A A . 800 CYS N 1 1 13 9395 1 1 21 CYS O O 7.630 1.725 -4.944 1.00 . A A . 800 CYS O 1 1 13 9396 1 1 21 CYS SG S 7.978 -0.534 -2.474 1.00 . A A . 800 CYS SG 1 1 13 9397 1 1 22 GLU C C 10.300 3.219 -4.585 1.00 . A A . 801 GLU C 1 1 13 9398 1 1 22 GLU CA C 9.049 4.065 -4.349 1.00 . A A . 801 GLU CA 1 1 13 9399 1 1 22 GLU CB C 9.449 5.405 -3.740 1.00 . A A . 801 GLU CB 1 1 13 9400 1 1 22 GLU CD C 8.411 6.639 -5.655 1.00 . A A . 801 GLU CD 1 1 13 9401 1 1 22 GLU CG C 8.534 6.537 -4.149 1.00 . A A . 801 GLU CG 1 1 13 9402 1 1 22 GLU H H 7.797 3.822 -2.655 1.00 . A A . 801 GLU H 1 1 13 9403 1 1 22 GLU HA H 8.596 4.257 -5.309 1.00 . A A . 801 GLU HA 1 1 13 9404 1 1 22 GLU HB2 H 9.428 5.321 -2.665 1.00 . A A . 801 GLU HB2 1 1 13 9405 1 1 22 GLU HB3 H 10.452 5.646 -4.058 1.00 . A A . 801 GLU HB3 1 1 13 9406 1 1 22 GLU HG2 H 7.553 6.365 -3.730 1.00 . A A . 801 GLU HG2 1 1 13 9407 1 1 22 GLU HG3 H 8.935 7.461 -3.768 1.00 . A A . 801 GLU HG3 1 1 13 9408 1 1 22 GLU N N 8.035 3.412 -3.515 1.00 . A A . 801 GLU N 1 1 13 9409 1 1 22 GLU O O 11.309 3.730 -5.074 1.00 . A A . 801 GLU O 1 1 13 9410 1 1 22 GLU OE1 O 9.456 6.685 -6.344 1.00 . A A . 801 GLU OE1 1 1 13 9411 1 1 22 GLU OE2 O 7.273 6.641 -6.162 1.00 . A A . 801 GLU OE2 1 1 13 9412 1 1 23 TYR C C 11.008 0.156 -5.726 1.00 . A A . 802 TYR C 1 1 13 9413 1 1 23 TYR CA C 11.353 1.051 -4.533 1.00 . A A . 802 TYR CA 1 1 13 9414 1 1 23 TYR CB C 11.706 0.217 -3.291 1.00 . A A . 802 TYR CB 1 1 13 9415 1 1 23 TYR CD1 C 14.216 0.157 -3.523 1.00 . A A . 802 TYR CD1 1 1 13 9416 1 1 23 TYR CD2 C 13.045 -1.913 -3.390 1.00 . A A . 802 TYR CD2 1 1 13 9417 1 1 23 TYR CE1 C 15.413 -0.522 -3.623 1.00 . A A . 802 TYR CE1 1 1 13 9418 1 1 23 TYR CE2 C 14.238 -2.598 -3.490 1.00 . A A . 802 TYR CE2 1 1 13 9419 1 1 23 TYR CG C 13.013 -0.528 -3.406 1.00 . A A . 802 TYR CG 1 1 13 9420 1 1 23 TYR CZ C 15.419 -1.899 -3.604 1.00 . A A . 802 TYR CZ 1 1 13 9421 1 1 23 TYR H H 9.433 1.601 -3.824 1.00 . A A . 802 TYR H 1 1 13 9422 1 1 23 TYR HA H 12.195 1.662 -4.808 1.00 . A A . 802 TYR HA 1 1 13 9423 1 1 23 TYR HB2 H 11.774 0.867 -2.433 1.00 . A A . 802 TYR HB2 1 1 13 9424 1 1 23 TYR HB3 H 10.925 -0.512 -3.118 1.00 . A A . 802 TYR HB3 1 1 13 9425 1 1 23 TYR HD1 H 14.207 1.236 -3.536 1.00 . A A . 802 TYR HD1 1 1 13 9426 1 1 23 TYR HD2 H 12.118 -2.458 -3.299 1.00 . A A . 802 TYR HD2 1 1 13 9427 1 1 23 TYR HE1 H 16.338 0.026 -3.715 1.00 . A A . 802 TYR HE1 1 1 13 9428 1 1 23 TYR HE2 H 14.243 -3.679 -3.477 1.00 . A A . 802 TYR HE2 1 1 13 9429 1 1 23 TYR HH H 17.317 -2.053 -3.298 1.00 . A A . 802 TYR HH 1 1 13 9430 1 1 23 TYR N N 10.243 1.946 -4.251 1.00 . A A . 802 TYR N 1 1 13 9431 1 1 23 TYR O O 11.840 -0.072 -6.603 1.00 . A A . 802 TYR O 1 1 13 9432 1 1 23 TYR OH O 16.610 -2.582 -3.703 1.00 . A A . 802 TYR OH 1 1 13 9433 1 1 24 CYS C C 8.165 -0.623 -7.655 1.00 . A A . 803 CYS C 1 1 13 9434 1 1 24 CYS CA C 9.336 -1.206 -6.848 1.00 . A A . 803 CYS CA 1 1 13 9435 1 1 24 CYS CB C 8.978 -2.585 -6.293 1.00 . A A . 803 CYS CB 1 1 13 9436 1 1 24 CYS H H 9.173 -0.163 -5.011 1.00 . A A . 803 CYS H 1 1 13 9437 1 1 24 CYS HA H 10.147 -1.307 -7.552 1.00 . A A . 803 CYS HA 1 1 13 9438 1 1 24 CYS HB2 H 8.449 -3.146 -7.048 1.00 . A A . 803 CYS HB2 1 1 13 9439 1 1 24 CYS HB3 H 9.886 -3.109 -6.030 1.00 . A A . 803 CYS HB3 1 1 13 9440 1 1 24 CYS N N 9.776 -0.337 -5.761 1.00 . A A . 803 CYS N 1 1 13 9441 1 1 24 CYS O O 7.994 -0.975 -8.821 1.00 . A A . 803 CYS O 1 1 13 9442 1 1 24 CYS SG S 7.927 -2.522 -4.815 1.00 . A A . 803 CYS SG 1 1 13 9443 1 1 25 GLY C C 4.990 0.179 -7.735 1.00 . A A . 804 GLY C 1 1 13 9444 1 1 25 GLY CA C 6.316 0.899 -7.834 1.00 . A A . 804 GLY CA 1 1 13 9445 1 1 25 GLY H H 7.490 0.483 -6.122 1.00 . A A . 804 GLY H 1 1 13 9446 1 1 25 GLY HA2 H 6.190 1.906 -7.468 1.00 . A A . 804 GLY HA2 1 1 13 9447 1 1 25 GLY HA3 H 6.616 0.940 -8.870 1.00 . A A . 804 GLY HA3 1 1 13 9448 1 1 25 GLY N N 7.367 0.255 -7.069 1.00 . A A . 804 GLY N 1 1 13 9449 1 1 25 GLY O O 4.102 0.385 -8.559 1.00 . A A . 804 GLY O 1 1 13 9450 1 1 26 LYS C C 2.574 -0.627 -5.840 1.00 . A A . 805 LYS C 1 1 13 9451 1 1 26 LYS CA C 3.637 -1.449 -6.551 1.00 . A A . 805 LYS CA 1 1 13 9452 1 1 26 LYS CB C 3.942 -2.722 -5.769 1.00 . A A . 805 LYS CB 1 1 13 9453 1 1 26 LYS CD C 4.356 -4.132 -7.806 1.00 . A A . 805 LYS CD 1 1 13 9454 1 1 26 LYS CE C 5.418 -4.836 -8.634 1.00 . A A . 805 LYS CE 1 1 13 9455 1 1 26 LYS CG C 4.919 -3.641 -6.484 1.00 . A A . 805 LYS CG 1 1 13 9456 1 1 26 LYS H H 5.570 -0.754 -6.072 1.00 . A A . 805 LYS H 1 1 13 9457 1 1 26 LYS HA H 3.255 -1.722 -7.526 1.00 . A A . 805 LYS HA 1 1 13 9458 1 1 26 LYS HB2 H 4.364 -2.453 -4.813 1.00 . A A . 805 LYS HB2 1 1 13 9459 1 1 26 LYS HB3 H 3.022 -3.264 -5.608 1.00 . A A . 805 LYS HB3 1 1 13 9460 1 1 26 LYS HD2 H 3.551 -4.824 -7.610 1.00 . A A . 805 LYS HD2 1 1 13 9461 1 1 26 LYS HD3 H 3.980 -3.288 -8.364 1.00 . A A . 805 LYS HD3 1 1 13 9462 1 1 26 LYS HE2 H 6.175 -4.120 -8.910 1.00 . A A . 805 LYS HE2 1 1 13 9463 1 1 26 LYS HE3 H 5.863 -5.618 -8.035 1.00 . A A . 805 LYS HE3 1 1 13 9464 1 1 26 LYS HG2 H 5.834 -3.099 -6.674 1.00 . A A . 805 LYS HG2 1 1 13 9465 1 1 26 LYS HG3 H 5.125 -4.490 -5.852 1.00 . A A . 805 LYS HG3 1 1 13 9466 1 1 26 LYS HZ1 H 4.176 -4.772 -10.312 1.00 . A A . 805 LYS HZ1 1 1 13 9467 1 1 26 LYS HZ2 H 4.342 -6.318 -9.637 1.00 . A A . 805 LYS HZ2 1 1 13 9468 1 1 26 LYS HZ3 H 5.607 -5.651 -10.547 1.00 . A A . 805 LYS HZ3 1 1 13 9469 1 1 26 LYS N N 4.852 -0.670 -6.733 1.00 . A A . 805 LYS N 1 1 13 9470 1 1 26 LYS NZ N 4.846 -5.436 -9.866 1.00 . A A . 805 LYS NZ 1 1 13 9471 1 1 26 LYS O O 2.812 -0.092 -4.753 1.00 . A A . 805 LYS O 1 1 13 9472 1 1 27 TYR C C -0.542 -0.508 -4.973 1.00 . A A . 806 TYR C 1 1 13 9473 1 1 27 TYR CA C 0.305 0.271 -5.955 1.00 . A A . 806 TYR CA 1 1 13 9474 1 1 27 TYR CB C -0.576 0.776 -7.099 1.00 . A A . 806 TYR CB 1 1 13 9475 1 1 27 TYR CD1 C 0.984 1.451 -8.968 1.00 . A A . 806 TYR CD1 1 1 13 9476 1 1 27 TYR CD2 C -0.223 3.159 -7.824 1.00 . A A . 806 TYR CD2 1 1 13 9477 1 1 27 TYR CE1 C 1.573 2.405 -9.774 1.00 . A A . 806 TYR CE1 1 1 13 9478 1 1 27 TYR CE2 C 0.359 4.114 -8.627 1.00 . A A . 806 TYR CE2 1 1 13 9479 1 1 27 TYR CG C 0.078 1.813 -7.978 1.00 . A A . 806 TYR CG 1 1 13 9480 1 1 27 TYR CZ C 1.257 3.734 -9.599 1.00 . A A . 806 TYR CZ 1 1 13 9481 1 1 27 TYR H H 1.227 -1.156 -7.211 1.00 . A A . 806 TYR H 1 1 13 9482 1 1 27 TYR HA H 0.723 1.115 -5.425 1.00 . A A . 806 TYR HA 1 1 13 9483 1 1 27 TYR HB2 H -0.850 -0.057 -7.723 1.00 . A A . 806 TYR HB2 1 1 13 9484 1 1 27 TYR HB3 H -1.472 1.214 -6.684 1.00 . A A . 806 TYR HB3 1 1 13 9485 1 1 27 TYR HD1 H 1.230 0.408 -9.100 1.00 . A A . 806 TYR HD1 1 1 13 9486 1 1 27 TYR HD2 H -0.928 3.457 -7.061 1.00 . A A . 806 TYR HD2 1 1 13 9487 1 1 27 TYR HE1 H 2.275 2.106 -10.539 1.00 . A A . 806 TYR HE1 1 1 13 9488 1 1 27 TYR HE2 H 0.112 5.157 -8.491 1.00 . A A . 806 TYR HE2 1 1 13 9489 1 1 27 TYR HH H 1.912 4.348 -11.303 1.00 . A A . 806 TYR HH 1 1 13 9490 1 1 27 TYR N N 1.396 -0.562 -6.449 1.00 . A A . 806 TYR N 1 1 13 9491 1 1 27 TYR O O -0.939 -1.650 -5.231 1.00 . A A . 806 TYR O 1 1 13 9492 1 1 27 TYR OH O 1.837 4.690 -10.399 1.00 . A A . 806 TYR OH 1 1 13 9493 1 1 28 ALA C C -2.093 0.522 -1.821 1.00 . A A . 807 ALA C 1 1 13 9494 1 1 28 ALA CA C -1.503 -0.522 -2.757 1.00 . A A . 807 ALA CA 1 1 13 9495 1 1 28 ALA CB C -0.522 -1.426 -2.030 1.00 . A A . 807 ALA CB 1 1 13 9496 1 1 28 ALA H H -0.517 1.061 -3.750 1.00 . A A . 807 ALA H 1 1 13 9497 1 1 28 ALA HA H -2.294 -1.131 -3.166 1.00 . A A . 807 ALA HA 1 1 13 9498 1 1 28 ALA HB1 H -1.021 -1.901 -1.198 1.00 . A A . 807 ALA HB1 1 1 13 9499 1 1 28 ALA HB2 H 0.312 -0.840 -1.665 1.00 . A A . 807 ALA HB2 1 1 13 9500 1 1 28 ALA HB3 H -0.157 -2.183 -2.710 1.00 . A A . 807 ALA HB3 1 1 13 9501 1 1 28 ALA N N -0.812 0.124 -3.850 1.00 . A A . 807 ALA N 1 1 13 9502 1 1 28 ALA O O -1.761 1.703 -1.931 1.00 . A A . 807 ALA O 1 1 13 9503 1 1 29 PRO C C -2.581 1.604 1.033 1.00 . A A . 808 PRO C 1 1 13 9504 1 1 29 PRO CA C -3.590 1.064 0.036 1.00 . A A . 808 PRO CA 1 1 13 9505 1 1 29 PRO CB C -4.664 0.244 0.752 1.00 . A A . 808 PRO CB 1 1 13 9506 1 1 29 PRO CD C -3.385 -1.273 -0.619 1.00 . A A . 808 PRO CD 1 1 13 9507 1 1 29 PRO CG C -4.250 -1.181 0.610 1.00 . A A . 808 PRO CG 1 1 13 9508 1 1 29 PRO HA H -4.061 1.888 -0.484 1.00 . A A . 808 PRO HA 1 1 13 9509 1 1 29 PRO HB2 H -4.706 0.539 1.790 1.00 . A A . 808 PRO HB2 1 1 13 9510 1 1 29 PRO HB3 H -5.621 0.422 0.286 1.00 . A A . 808 PRO HB3 1 1 13 9511 1 1 29 PRO HD2 H -2.520 -1.891 -0.413 1.00 . A A . 808 PRO HD2 1 1 13 9512 1 1 29 PRO HD3 H -3.946 -1.674 -1.450 1.00 . A A . 808 PRO HD3 1 1 13 9513 1 1 29 PRO HG2 H -3.690 -1.485 1.482 1.00 . A A . 808 PRO HG2 1 1 13 9514 1 1 29 PRO HG3 H -5.127 -1.800 0.496 1.00 . A A . 808 PRO HG3 1 1 13 9515 1 1 29 PRO N N -2.970 0.121 -0.882 1.00 . A A . 808 PRO N 1 1 13 9516 1 1 29 PRO O O -1.803 0.848 1.617 1.00 . A A . 808 PRO O 1 1 13 9517 1 1 30 ALA C C -1.560 2.966 3.476 1.00 . A A . 809 ALA C 1 1 13 9518 1 1 30 ALA CA C -1.715 3.648 2.110 1.00 . A A . 809 ALA CA 1 1 13 9519 1 1 30 ALA CB C -2.238 5.066 2.300 1.00 . A A . 809 ALA CB 1 1 13 9520 1 1 30 ALA H H -3.193 3.454 0.591 1.00 . A A . 809 ALA H 1 1 13 9521 1 1 30 ALA HA H -0.742 3.719 1.643 1.00 . A A . 809 ALA HA 1 1 13 9522 1 1 30 ALA HB1 H -1.552 5.621 2.924 1.00 . A A . 809 ALA HB1 1 1 13 9523 1 1 30 ALA HB2 H -3.210 5.032 2.772 1.00 . A A . 809 ALA HB2 1 1 13 9524 1 1 30 ALA HB3 H -2.323 5.551 1.339 1.00 . A A . 809 ALA HB3 1 1 13 9525 1 1 30 ALA N N -2.595 2.925 1.180 1.00 . A A . 809 ALA N 1 1 13 9526 1 1 30 ALA O O -0.536 3.134 4.135 1.00 . A A . 809 ALA O 1 1 13 9527 1 1 31 GLU C C -1.447 0.521 5.333 1.00 . A A . 810 GLU C 1 1 13 9528 1 1 31 GLU CA C -2.593 1.531 5.179 1.00 . A A . 810 GLU CA 1 1 13 9529 1 1 31 GLU CB C -3.933 0.818 5.379 1.00 . A A . 810 GLU CB 1 1 13 9530 1 1 31 GLU CD C -4.309 1.579 7.766 1.00 . A A . 810 GLU CD 1 1 13 9531 1 1 31 GLU CG C -4.181 0.397 6.819 1.00 . A A . 810 GLU CG 1 1 13 9532 1 1 31 GLU H H -3.343 2.103 3.290 1.00 . A A . 810 GLU H 1 1 13 9533 1 1 31 GLU HA H -2.492 2.275 5.956 1.00 . A A . 810 GLU HA 1 1 13 9534 1 1 31 GLU HB2 H -4.732 1.477 5.074 1.00 . A A . 810 GLU HB2 1 1 13 9535 1 1 31 GLU HB3 H -3.952 -0.067 4.760 1.00 . A A . 810 GLU HB3 1 1 13 9536 1 1 31 GLU HG2 H -5.095 -0.178 6.861 1.00 . A A . 810 GLU HG2 1 1 13 9537 1 1 31 GLU HG3 H -3.356 -0.217 7.146 1.00 . A A . 810 GLU HG3 1 1 13 9538 1 1 31 GLU N N -2.579 2.213 3.885 1.00 . A A . 810 GLU N 1 1 13 9539 1 1 31 GLU O O -0.876 0.390 6.413 1.00 . A A . 810 GLU O 1 1 13 9540 1 1 31 GLU OE1 O -4.188 2.737 7.308 1.00 . A A . 810 GLU OE1 1 1 13 9541 1 1 31 GLU OE2 O -4.559 1.357 8.969 1.00 . A A . 810 GLU OE2 1 1 13 9542 1 1 32 GLN C C 1.285 -0.587 4.374 1.00 . A A . 811 GLN C 1 1 13 9543 1 1 32 GLN CA C -0.091 -1.224 4.331 1.00 . A A . 811 GLN CA 1 1 13 9544 1 1 32 GLN CB C -0.189 -2.186 3.148 1.00 . A A . 811 GLN CB 1 1 13 9545 1 1 32 GLN CD C 0.582 -2.651 0.811 1.00 . A A . 811 GLN CD 1 1 13 9546 1 1 32 GLN CG C 0.247 -1.589 1.831 1.00 . A A . 811 GLN CG 1 1 13 9547 1 1 32 GLN H H -1.514 0.015 3.393 1.00 . A A . 811 GLN H 1 1 13 9548 1 1 32 GLN HA H -0.227 -1.794 5.234 1.00 . A A . 811 GLN HA 1 1 13 9549 1 1 32 GLN HB2 H 0.431 -3.047 3.348 1.00 . A A . 811 GLN HB2 1 1 13 9550 1 1 32 GLN HB3 H -1.216 -2.510 3.049 1.00 . A A . 811 GLN HB3 1 1 13 9551 1 1 32 GLN HE21 H 1.933 -1.453 0.004 1.00 . A A . 811 GLN HE21 1 1 13 9552 1 1 32 GLN HE22 H 1.775 -3.010 -0.727 1.00 . A A . 811 GLN HE22 1 1 13 9553 1 1 32 GLN HG2 H -0.553 -0.973 1.444 1.00 . A A . 811 GLN HG2 1 1 13 9554 1 1 32 GLN HG3 H 1.122 -0.980 1.999 1.00 . A A . 811 GLN HG3 1 1 13 9555 1 1 32 GLN N N -1.103 -0.186 4.256 1.00 . A A . 811 GLN N 1 1 13 9556 1 1 32 GLN NE2 N 1.522 -2.341 -0.057 1.00 . A A . 811 GLN NE2 1 1 13 9557 1 1 32 GLN O O 2.256 -1.207 4.809 1.00 . A A . 811 GLN O 1 1 13 9558 1 1 32 GLN OE1 O 0.007 -3.742 0.806 1.00 . A A . 811 GLN OE1 1 1 13 9559 1 1 33 PHE C C 2.871 1.896 5.422 1.00 . A A . 812 PHE C 1 1 13 9560 1 1 33 PHE CA C 2.569 1.458 3.990 1.00 . A A . 812 PHE CA 1 1 13 9561 1 1 33 PHE CB C 2.413 2.698 3.107 1.00 . A A . 812 PHE CB 1 1 13 9562 1 1 33 PHE CD1 C 1.622 1.529 1.025 1.00 . A A . 812 PHE CD1 1 1 13 9563 1 1 33 PHE CD2 C 3.486 3.007 0.862 1.00 . A A . 812 PHE CD2 1 1 13 9564 1 1 33 PHE CE1 C 1.719 1.255 -0.327 1.00 . A A . 812 PHE CE1 1 1 13 9565 1 1 33 PHE CE2 C 3.586 2.737 -0.488 1.00 . A A . 812 PHE CE2 1 1 13 9566 1 1 33 PHE CG C 2.507 2.405 1.635 1.00 . A A . 812 PHE CG 1 1 13 9567 1 1 33 PHE CZ C 2.701 1.860 -1.084 1.00 . A A . 812 PHE CZ 1 1 13 9568 1 1 33 PHE H H 0.613 1.004 3.374 1.00 . A A . 812 PHE H 1 1 13 9569 1 1 33 PHE HA H 3.374 0.870 3.580 1.00 . A A . 812 PHE HA 1 1 13 9570 1 1 33 PHE HB2 H 1.450 3.145 3.294 1.00 . A A . 812 PHE HB2 1 1 13 9571 1 1 33 PHE HB3 H 3.190 3.407 3.356 1.00 . A A . 812 PHE HB3 1 1 13 9572 1 1 33 PHE HD1 H 0.854 1.055 1.616 1.00 . A A . 812 PHE HD1 1 1 13 9573 1 1 33 PHE HD2 H 4.179 3.694 1.325 1.00 . A A . 812 PHE HD2 1 1 13 9574 1 1 33 PHE HE1 H 1.023 0.568 -0.789 1.00 . A A . 812 PHE HE1 1 1 13 9575 1 1 33 PHE HE2 H 4.355 3.213 -1.078 1.00 . A A . 812 PHE HE2 1 1 13 9576 1 1 33 PHE HZ H 2.779 1.647 -2.140 1.00 . A A . 812 PHE HZ 1 1 13 9577 1 1 33 PHE N N 1.357 0.655 3.903 1.00 . A A . 812 PHE N 1 1 13 9578 1 1 33 PHE O O 3.407 2.970 5.653 1.00 . A A . 812 PHE O 1 1 13 9579 1 1 34 ARG C C 4.218 1.043 8.085 1.00 . A A . 813 ARG C 1 1 13 9580 1 1 34 ARG CA C 2.760 1.333 7.771 1.00 . A A . 813 ARG CA 1 1 13 9581 1 1 34 ARG CB C 1.814 0.493 8.642 1.00 . A A . 813 ARG CB 1 1 13 9582 1 1 34 ARG CD C 0.689 -1.765 8.817 1.00 . A A . 813 ARG CD 1 1 13 9583 1 1 34 ARG CG C 1.955 -1.010 8.426 1.00 . A A . 813 ARG CG 1 1 13 9584 1 1 34 ARG CZ C -0.417 -2.486 10.907 1.00 . A A . 813 ARG CZ 1 1 13 9585 1 1 34 ARG H H 2.092 0.220 6.110 1.00 . A A . 813 ARG H 1 1 13 9586 1 1 34 ARG HA H 2.599 2.382 7.963 1.00 . A A . 813 ARG HA 1 1 13 9587 1 1 34 ARG HB2 H 2.015 0.706 9.681 1.00 . A A . 813 ARG HB2 1 1 13 9588 1 1 34 ARG HB3 H 0.795 0.771 8.418 1.00 . A A . 813 ARG HB3 1 1 13 9589 1 1 34 ARG HD2 H -0.133 -1.387 8.229 1.00 . A A . 813 ARG HD2 1 1 13 9590 1 1 34 ARG HD3 H 0.833 -2.813 8.594 1.00 . A A . 813 ARG HD3 1 1 13 9591 1 1 34 ARG HE H 0.720 -0.836 10.713 1.00 . A A . 813 ARG HE 1 1 13 9592 1 1 34 ARG HG2 H 2.161 -1.194 7.381 1.00 . A A . 813 ARG HG2 1 1 13 9593 1 1 34 ARG HG3 H 2.777 -1.372 9.023 1.00 . A A . 813 ARG HG3 1 1 13 9594 1 1 34 ARG HH11 H -0.761 -3.698 9.311 1.00 . A A . 813 ARG HH11 1 1 13 9595 1 1 34 ARG HH12 H -1.510 -4.191 10.800 1.00 . A A . 813 ARG HH12 1 1 13 9596 1 1 34 ARG HH21 H -0.314 -1.480 12.672 1.00 . A A . 813 ARG HH21 1 1 13 9597 1 1 34 ARG HH22 H -1.259 -2.942 12.696 1.00 . A A . 813 ARG HH22 1 1 13 9598 1 1 34 ARG N N 2.516 1.062 6.367 1.00 . A A . 813 ARG N 1 1 13 9599 1 1 34 ARG NE N 0.354 -1.625 10.235 1.00 . A A . 813 ARG NE 1 1 13 9600 1 1 34 ARG NH1 N -0.938 -3.542 10.290 1.00 . A A . 813 ARG NH1 1 1 13 9601 1 1 34 ARG NH2 N -0.686 -2.287 12.193 1.00 . A A . 813 ARG NH2 1 1 13 9602 1 1 34 ARG O O 4.888 0.322 7.346 1.00 . A A . 813 ARG O 1 1 13 9603 1 1 35 GLY C C 6.963 2.611 8.801 1.00 . A A . 814 GLY C 1 1 13 9604 1 1 35 GLY CA C 6.131 1.526 9.464 1.00 . A A . 814 GLY CA 1 1 13 9605 1 1 35 GLY H H 4.127 2.115 9.780 1.00 . A A . 814 GLY H 1 1 13 9606 1 1 35 GLY HA2 H 6.260 1.593 10.535 1.00 . A A . 814 GLY HA2 1 1 13 9607 1 1 35 GLY HA3 H 6.487 0.562 9.130 1.00 . A A . 814 GLY HA3 1 1 13 9608 1 1 35 GLY N N 4.721 1.636 9.156 1.00 . A A . 814 GLY N 1 1 13 9609 1 1 35 GLY O O 7.985 3.034 9.346 1.00 . A A . 814 GLY O 1 1 13 9610 1 1 36 SER C C 6.477 5.076 6.129 1.00 . A A . 815 SER C 1 1 13 9611 1 1 36 SER CA C 7.330 4.046 6.886 1.00 . A A . 815 SER CA 1 1 13 9612 1 1 36 SER CB C 8.241 3.299 5.906 1.00 . A A . 815 SER CB 1 1 13 9613 1 1 36 SER H H 5.674 2.763 7.271 1.00 . A A . 815 SER H 1 1 13 9614 1 1 36 SER HA H 7.942 4.573 7.600 1.00 . A A . 815 SER HA 1 1 13 9615 1 1 36 SER HB2 H 8.732 2.487 6.420 1.00 . A A . 815 SER HB2 1 1 13 9616 1 1 36 SER HB3 H 7.644 2.904 5.096 1.00 . A A . 815 SER HB3 1 1 13 9617 1 1 36 SER HG H 9.839 4.418 6.071 1.00 . A A . 815 SER HG 1 1 13 9618 1 1 36 SER N N 6.531 3.080 7.632 1.00 . A A . 815 SER N 1 1 13 9619 1 1 36 SER O O 6.772 6.273 6.189 1.00 . A A . 815 SER O 1 1 13 9620 1 1 36 SER OG O 9.227 4.157 5.368 1.00 . A A . 815 SER OG 1 1 13 9621 1 1 37 LYS C C 5.629 6.083 3.505 1.00 . A A . 816 LYS C 1 1 13 9622 1 1 37 LYS CA C 4.659 5.460 4.518 1.00 . A A . 816 LYS CA 1 1 13 9623 1 1 37 LYS CB C 3.828 6.505 5.275 1.00 . A A . 816 LYS CB 1 1 13 9624 1 1 37 LYS CD C 1.941 8.163 5.258 1.00 . A A . 816 LYS CD 1 1 13 9625 1 1 37 LYS CE C 1.010 7.310 6.117 1.00 . A A . 816 LYS CE 1 1 13 9626 1 1 37 LYS CG C 2.870 7.307 4.407 1.00 . A A . 816 LYS CG 1 1 13 9627 1 1 37 LYS H H 5.123 3.698 5.603 1.00 . A A . 816 LYS H 1 1 13 9628 1 1 37 LYS HA H 4.009 4.790 3.963 1.00 . A A . 816 LYS HA 1 1 13 9629 1 1 37 LYS HB2 H 3.249 5.998 6.031 1.00 . A A . 816 LYS HB2 1 1 13 9630 1 1 37 LYS HB3 H 4.503 7.197 5.761 1.00 . A A . 816 LYS HB3 1 1 13 9631 1 1 37 LYS HD2 H 2.539 8.787 5.904 1.00 . A A . 816 LYS HD2 1 1 13 9632 1 1 37 LYS HD3 H 1.347 8.786 4.605 1.00 . A A . 816 LYS HD3 1 1 13 9633 1 1 37 LYS HE2 H 1.599 6.570 6.637 1.00 . A A . 816 LYS HE2 1 1 13 9634 1 1 37 LYS HE3 H 0.519 7.949 6.839 1.00 . A A . 816 LYS HE3 1 1 13 9635 1 1 37 LYS HG2 H 3.440 7.952 3.755 1.00 . A A . 816 LYS HG2 1 1 13 9636 1 1 37 LYS HG3 H 2.276 6.625 3.815 1.00 . A A . 816 LYS HG3 1 1 13 9637 1 1 37 LYS HZ1 H -0.669 7.314 4.869 1.00 . A A . 816 LYS HZ1 1 1 13 9638 1 1 37 LYS HZ2 H -0.586 5.970 5.901 1.00 . A A . 816 LYS HZ2 1 1 13 9639 1 1 37 LYS HZ3 H 0.426 6.063 4.542 1.00 . A A . 816 LYS HZ3 1 1 13 9640 1 1 37 LYS N N 5.421 4.620 5.454 1.00 . A A . 816 LYS N 1 1 13 9641 1 1 37 LYS NZ N -0.024 6.615 5.303 1.00 . A A . 816 LYS NZ 1 1 13 9642 1 1 37 LYS O O 5.722 7.300 3.320 1.00 . A A . 816 LYS O 1 1 13 9643 1 1 38 ARG C C 7.531 4.211 1.005 1.00 . A A . 817 ARG C 1 1 13 9644 1 1 38 ARG CA C 7.402 5.431 1.897 1.00 . A A . 817 ARG CA 1 1 13 9645 1 1 38 ARG CB C 8.748 5.692 2.586 1.00 . A A . 817 ARG CB 1 1 13 9646 1 1 38 ARG CD C 10.274 7.349 3.694 1.00 . A A . 817 ARG CD 1 1 13 9647 1 1 38 ARG CG C 8.853 7.058 3.243 1.00 . A A . 817 ARG CG 1 1 13 9648 1 1 38 ARG CZ C 12.542 7.390 2.716 1.00 . A A . 817 ARG CZ 1 1 13 9649 1 1 38 ARG H H 6.158 4.235 3.089 1.00 . A A . 817 ARG H 1 1 13 9650 1 1 38 ARG HA H 7.169 6.273 1.262 1.00 . A A . 817 ARG HA 1 1 13 9651 1 1 38 ARG HB2 H 8.898 4.941 3.348 1.00 . A A . 817 ARG HB2 1 1 13 9652 1 1 38 ARG HB3 H 9.535 5.607 1.852 1.00 . A A . 817 ARG HB3 1 1 13 9653 1 1 38 ARG HD2 H 10.297 8.321 4.161 1.00 . A A . 817 ARG HD2 1 1 13 9654 1 1 38 ARG HD3 H 10.571 6.598 4.411 1.00 . A A . 817 ARG HD3 1 1 13 9655 1 1 38 ARG HE H 10.841 7.279 1.660 1.00 . A A . 817 ARG HE 1 1 13 9656 1 1 38 ARG HG2 H 8.548 7.815 2.534 1.00 . A A . 817 ARG HG2 1 1 13 9657 1 1 38 ARG HG3 H 8.200 7.083 4.102 1.00 . A A . 817 ARG HG3 1 1 13 9658 1 1 38 ARG HH11 H 12.486 7.520 4.745 1.00 . A A . 817 ARG HH11 1 1 13 9659 1 1 38 ARG HH12 H 14.081 7.519 4.038 1.00 . A A . 817 ARG HH12 1 1 13 9660 1 1 38 ARG HH21 H 12.929 7.282 0.722 1.00 . A A . 817 ARG HH21 1 1 13 9661 1 1 38 ARG HH22 H 14.332 7.387 1.750 1.00 . A A . 817 ARG HH22 1 1 13 9662 1 1 38 ARG N N 6.351 5.168 2.878 1.00 . A A . 817 ARG N 1 1 13 9663 1 1 38 ARG NE N 11.220 7.338 2.574 1.00 . A A . 817 ARG NE 1 1 13 9664 1 1 38 ARG NH1 N 13.077 7.484 3.927 1.00 . A A . 817 ARG NH1 1 1 13 9665 1 1 38 ARG NH2 N 13.329 7.350 1.646 1.00 . A A . 817 ARG NH2 1 1 13 9666 1 1 38 ARG O O 7.752 4.314 -0.204 1.00 . A A . 817 ARG O 1 1 13 9667 1 1 39 PHE C C 6.220 0.959 1.380 1.00 . A A . 818 PHE C 1 1 13 9668 1 1 39 PHE CA C 7.392 1.794 0.915 1.00 . A A . 818 PHE CA 1 1 13 9669 1 1 39 PHE CB C 8.702 1.052 1.204 1.00 . A A . 818 PHE CB 1 1 13 9670 1 1 39 PHE CD1 C 10.277 2.004 -0.492 1.00 . A A . 818 PHE CD1 1 1 13 9671 1 1 39 PHE CD2 C 10.677 2.463 1.813 1.00 . A A . 818 PHE CD2 1 1 13 9672 1 1 39 PHE CE1 C 11.381 2.753 -0.837 1.00 . A A . 818 PHE CE1 1 1 13 9673 1 1 39 PHE CE2 C 11.781 3.217 1.473 1.00 . A A . 818 PHE CE2 1 1 13 9674 1 1 39 PHE CG C 9.913 1.851 0.835 1.00 . A A . 818 PHE CG 1 1 13 9675 1 1 39 PHE CZ C 12.134 3.361 0.146 1.00 . A A . 818 PHE CZ 1 1 13 9676 1 1 39 PHE H H 7.254 3.036 2.589 1.00 . A A . 818 PHE H 1 1 13 9677 1 1 39 PHE HA H 7.333 1.976 -0.145 1.00 . A A . 818 PHE HA 1 1 13 9678 1 1 39 PHE HB2 H 8.759 0.824 2.258 1.00 . A A . 818 PHE HB2 1 1 13 9679 1 1 39 PHE HB3 H 8.720 0.133 0.638 1.00 . A A . 818 PHE HB3 1 1 13 9680 1 1 39 PHE HD1 H 9.686 1.528 -1.262 1.00 . A A . 818 PHE HD1 1 1 13 9681 1 1 39 PHE HD2 H 10.401 2.350 2.852 1.00 . A A . 818 PHE HD2 1 1 13 9682 1 1 39 PHE HE1 H 11.654 2.866 -1.876 1.00 . A A . 818 PHE HE1 1 1 13 9683 1 1 39 PHE HE2 H 12.370 3.692 2.244 1.00 . A A . 818 PHE HE2 1 1 13 9684 1 1 39 PHE HZ H 13.000 3.950 -0.123 1.00 . A A . 818 PHE HZ 1 1 13 9685 1 1 39 PHE N N 7.375 3.051 1.619 1.00 . A A . 818 PHE N 1 1 13 9686 1 1 39 PHE O O 5.543 1.325 2.341 1.00 . A A . 818 PHE O 1 1 13 9687 1 1 40 CYS C C 5.767 -1.824 2.422 1.00 . A A . 819 CYS C 1 1 13 9688 1 1 40 CYS CA C 5.081 -1.156 1.212 1.00 . A A . 819 CYS CA 1 1 13 9689 1 1 40 CYS CB C 4.660 -2.110 0.087 1.00 . A A . 819 CYS CB 1 1 13 9690 1 1 40 CYS H H 6.478 -0.332 -0.113 1.00 . A A . 819 CYS H 1 1 13 9691 1 1 40 CYS HA H 4.213 -0.666 1.630 1.00 . A A . 819 CYS HA 1 1 13 9692 1 1 40 CYS HB2 H 4.393 -3.056 0.504 1.00 . A A . 819 CYS HB2 1 1 13 9693 1 1 40 CYS HB3 H 3.795 -1.696 -0.424 1.00 . A A . 819 CYS HB3 1 1 13 9694 1 1 40 CYS N N 5.968 -0.138 0.698 1.00 . A A . 819 CYS N 1 1 13 9695 1 1 40 CYS O O 6.643 -1.214 3.032 1.00 . A A . 819 CYS O 1 1 13 9696 1 1 40 CYS SG S 5.939 -2.399 -1.152 1.00 . A A . 819 CYS SG 1 1 13 9697 1 1 41 SER C C 7.164 -3.887 4.336 1.00 . A A . 820 SER C 1 1 13 9698 1 1 41 SER CA C 5.663 -3.573 4.112 1.00 . A A . 820 SER CA 1 1 13 9699 1 1 41 SER CB C 4.791 -4.812 4.325 1.00 . A A . 820 SER CB 1 1 13 9700 1 1 41 SER H H 4.968 -3.618 2.116 1.00 . A A . 820 SER H 1 1 13 9701 1 1 41 SER HA H 5.374 -2.834 4.843 1.00 . A A . 820 SER HA 1 1 13 9702 1 1 41 SER HB2 H 5.007 -5.240 5.292 1.00 . A A . 820 SER HB2 1 1 13 9703 1 1 41 SER HB3 H 3.747 -4.516 4.281 1.00 . A A . 820 SER HB3 1 1 13 9704 1 1 41 SER HG H 4.412 -5.657 2.589 1.00 . A A . 820 SER HG 1 1 13 9705 1 1 41 SER N N 5.375 -3.037 2.783 1.00 . A A . 820 SER N 1 1 13 9706 1 1 41 SER O O 8.041 -3.104 3.966 1.00 . A A . 820 SER O 1 1 13 9707 1 1 41 SER OG O 5.030 -5.791 3.325 1.00 . A A . 820 SER OG 1 1 13 9708 1 1 42 MET C C 9.870 -5.486 4.464 1.00 . A A . 821 MET C 1 1 13 9709 1 1 42 MET CA C 8.789 -5.256 5.505 1.00 . A A . 821 MET CA 1 1 13 9710 1 1 42 MET CB C 8.746 -6.447 6.459 1.00 . A A . 821 MET CB 1 1 13 9711 1 1 42 MET CE C 8.107 -3.427 8.362 1.00 . A A . 821 MET CE 1 1 13 9712 1 1 42 MET CG C 8.038 -6.160 7.774 1.00 . A A . 821 MET CG 1 1 13 9713 1 1 42 MET H H 6.813 -5.768 4.906 1.00 . A A . 821 MET H 1 1 13 9714 1 1 42 MET HA H 9.038 -4.381 6.084 1.00 . A A . 821 MET HA 1 1 13 9715 1 1 42 MET HB2 H 8.234 -7.263 5.971 1.00 . A A . 821 MET HB2 1 1 13 9716 1 1 42 MET HB3 H 9.759 -6.752 6.680 1.00 . A A . 821 MET HB3 1 1 13 9717 1 1 42 MET HE1 H 8.541 -2.616 8.929 1.00 . A A . 821 MET HE1 1 1 13 9718 1 1 42 MET HE2 H 7.053 -3.496 8.583 1.00 . A A . 821 MET HE2 1 1 13 9719 1 1 42 MET HE3 H 8.241 -3.239 7.308 1.00 . A A . 821 MET HE3 1 1 13 9720 1 1 42 MET HG2 H 7.060 -5.762 7.551 1.00 . A A . 821 MET HG2 1 1 13 9721 1 1 42 MET HG3 H 7.935 -7.085 8.319 1.00 . A A . 821 MET HG3 1 1 13 9722 1 1 42 MET N N 7.471 -5.042 4.904 1.00 . A A . 821 MET N 1 1 13 9723 1 1 42 MET O O 10.844 -4.739 4.418 1.00 . A A . 821 MET O 1 1 13 9724 1 1 42 MET SD S 8.915 -4.966 8.811 1.00 . A A . 821 MET SD 1 1 13 9725 1 1 43 THR C C 11.123 -5.638 1.798 1.00 . A A . 822 THR C 1 1 13 9726 1 1 43 THR CA C 10.645 -6.859 2.593 1.00 . A A . 822 THR CA 1 1 13 9727 1 1 43 THR CB C 10.018 -7.882 1.628 1.00 . A A . 822 THR CB 1 1 13 9728 1 1 43 THR CG2 C 11.050 -8.403 0.639 1.00 . A A . 822 THR CG2 1 1 13 9729 1 1 43 THR H H 8.895 -7.071 3.755 1.00 . A A . 822 THR H 1 1 13 9730 1 1 43 THR HA H 11.517 -7.322 3.033 1.00 . A A . 822 THR HA 1 1 13 9731 1 1 43 THR HB H 9.219 -7.401 1.079 1.00 . A A . 822 THR HB 1 1 13 9732 1 1 43 THR HG1 H 9.204 -9.683 1.767 1.00 . A A . 822 THR HG1 1 1 13 9733 1 1 43 THR HG21 H 10.589 -9.136 -0.008 1.00 . A A . 822 THR HG21 1 1 13 9734 1 1 43 THR HG22 H 11.865 -8.862 1.178 1.00 . A A . 822 THR HG22 1 1 13 9735 1 1 43 THR HG23 H 11.427 -7.584 0.045 1.00 . A A . 822 THR HG23 1 1 13 9736 1 1 43 THR N N 9.689 -6.509 3.640 1.00 . A A . 822 THR N 1 1 13 9737 1 1 43 THR O O 12.322 -5.439 1.634 1.00 . A A . 822 THR O 1 1 13 9738 1 1 43 THR OG1 O 9.478 -8.980 2.380 1.00 . A A . 822 THR OG1 1 1 13 9739 1 1 44 CYS C C 11.250 -2.558 1.308 1.00 . A A . 823 CYS C 1 1 13 9740 1 1 44 CYS CA C 10.561 -3.666 0.513 1.00 . A A . 823 CYS CA 1 1 13 9741 1 1 44 CYS CB C 9.332 -3.150 -0.209 1.00 . A A . 823 CYS CB 1 1 13 9742 1 1 44 CYS H H 9.261 -4.984 1.542 1.00 . A A . 823 CYS H 1 1 13 9743 1 1 44 CYS HA H 11.258 -4.016 -0.233 1.00 . A A . 823 CYS HA 1 1 13 9744 1 1 44 CYS HB2 H 8.521 -3.034 0.500 1.00 . A A . 823 CYS HB2 1 1 13 9745 1 1 44 CYS HB3 H 9.555 -2.197 -0.663 1.00 . A A . 823 CYS HB3 1 1 13 9746 1 1 44 CYS N N 10.201 -4.818 1.329 1.00 . A A . 823 CYS N 1 1 13 9747 1 1 44 CYS O O 12.337 -2.107 0.925 1.00 . A A . 823 CYS O 1 1 13 9748 1 1 44 CYS SG S 8.777 -4.272 -1.511 1.00 . A A . 823 CYS SG 1 1 13 9749 1 1 45 ALA C C 12.614 -1.445 3.712 1.00 . A A . 824 ALA C 1 1 13 9750 1 1 45 ALA CA C 11.217 -1.068 3.228 1.00 . A A . 824 ALA CA 1 1 13 9751 1 1 45 ALA CB C 10.320 -0.767 4.413 1.00 . A A . 824 ALA CB 1 1 13 9752 1 1 45 ALA H H 9.806 -2.545 2.711 1.00 . A A . 824 ALA H 1 1 13 9753 1 1 45 ALA HA H 11.282 -0.173 2.626 1.00 . A A . 824 ALA HA 1 1 13 9754 1 1 45 ALA HB1 H 10.252 -1.641 5.042 1.00 . A A . 824 ALA HB1 1 1 13 9755 1 1 45 ALA HB2 H 9.336 -0.500 4.059 1.00 . A A . 824 ALA HB2 1 1 13 9756 1 1 45 ALA HB3 H 10.736 0.053 4.978 1.00 . A A . 824 ALA HB3 1 1 13 9757 1 1 45 ALA N N 10.639 -2.124 2.410 1.00 . A A . 824 ALA N 1 1 13 9758 1 1 45 ALA O O 13.554 -0.666 3.573 1.00 . A A . 824 ALA O 1 1 13 9759 1 1 46 LYS C C 15.080 -3.221 3.711 1.00 . A A . 825 LYS C 1 1 13 9760 1 1 46 LYS CA C 14.024 -3.107 4.810 1.00 . A A . 825 LYS CA 1 1 13 9761 1 1 46 LYS CB C 13.865 -4.467 5.511 1.00 . A A . 825 LYS CB 1 1 13 9762 1 1 46 LYS CD C 13.484 -6.953 5.296 1.00 . A A . 825 LYS CD 1 1 13 9763 1 1 46 LYS CE C 14.600 -7.279 6.275 1.00 . A A . 825 LYS CE 1 1 13 9764 1 1 46 LYS CG C 13.734 -5.647 4.559 1.00 . A A . 825 LYS CG 1 1 13 9765 1 1 46 LYS H H 11.964 -3.251 4.328 1.00 . A A . 825 LYS H 1 1 13 9766 1 1 46 LYS HA H 14.340 -2.383 5.546 1.00 . A A . 825 LYS HA 1 1 13 9767 1 1 46 LYS HB2 H 14.724 -4.635 6.141 1.00 . A A . 825 LYS HB2 1 1 13 9768 1 1 46 LYS HB3 H 12.980 -4.433 6.129 1.00 . A A . 825 LYS HB3 1 1 13 9769 1 1 46 LYS HD2 H 12.557 -6.872 5.840 1.00 . A A . 825 LYS HD2 1 1 13 9770 1 1 46 LYS HD3 H 13.408 -7.752 4.572 1.00 . A A . 825 LYS HD3 1 1 13 9771 1 1 46 LYS HE2 H 15.544 -7.239 5.752 1.00 . A A . 825 LYS HE2 1 1 13 9772 1 1 46 LYS HE3 H 14.595 -6.545 7.066 1.00 . A A . 825 LYS HE3 1 1 13 9773 1 1 46 LYS HG2 H 12.908 -5.462 3.887 1.00 . A A . 825 LYS HG2 1 1 13 9774 1 1 46 LYS HG3 H 14.646 -5.736 3.989 1.00 . A A . 825 LYS HG3 1 1 13 9775 1 1 46 LYS HZ1 H 14.691 -9.368 6.173 1.00 . A A . 825 LYS HZ1 1 1 13 9776 1 1 46 LYS HZ2 H 13.444 -8.783 7.157 1.00 . A A . 825 LYS HZ2 1 1 13 9777 1 1 46 LYS HZ3 H 15.050 -8.739 7.709 1.00 . A A . 825 LYS HZ3 1 1 13 9778 1 1 46 LYS N N 12.748 -2.655 4.265 1.00 . A A . 825 LYS N 1 1 13 9779 1 1 46 LYS NZ N 14.435 -8.634 6.870 1.00 . A A . 825 LYS NZ 1 1 13 9780 1 1 46 LYS O O 16.271 -3.020 3.952 1.00 . A A . 825 LYS O 1 1 13 9781 1 1 47 ARG C C 16.217 -2.540 0.914 1.00 . A A . 826 ARG C 1 1 13 9782 1 1 47 ARG CA C 15.552 -3.820 1.402 1.00 . A A . 826 ARG CA 1 1 13 9783 1 1 47 ARG CB C 14.794 -4.516 0.264 1.00 . A A . 826 ARG CB 1 1 13 9784 1 1 47 ARG CD C 14.838 -5.664 -1.961 1.00 . A A . 826 ARG CD 1 1 13 9785 1 1 47 ARG CG C 15.633 -4.835 -0.961 1.00 . A A . 826 ARG CG 1 1 13 9786 1 1 47 ARG CZ C 14.741 -5.848 -4.421 1.00 . A A . 826 ARG CZ 1 1 13 9787 1 1 47 ARG H H 13.672 -3.675 2.360 1.00 . A A . 826 ARG H 1 1 13 9788 1 1 47 ARG HA H 16.295 -4.499 1.792 1.00 . A A . 826 ARG HA 1 1 13 9789 1 1 47 ARG HB2 H 14.389 -5.444 0.637 1.00 . A A . 826 ARG HB2 1 1 13 9790 1 1 47 ARG HB3 H 13.978 -3.878 -0.044 1.00 . A A . 826 ARG HB3 1 1 13 9791 1 1 47 ARG HD2 H 14.810 -6.688 -1.615 1.00 . A A . 826 ARG HD2 1 1 13 9792 1 1 47 ARG HD3 H 13.831 -5.275 -2.010 1.00 . A A . 826 ARG HD3 1 1 13 9793 1 1 47 ARG HE H 16.382 -5.403 -3.363 1.00 . A A . 826 ARG HE 1 1 13 9794 1 1 47 ARG HG2 H 15.934 -3.910 -1.428 1.00 . A A . 826 ARG HG2 1 1 13 9795 1 1 47 ARG HG3 H 16.507 -5.391 -0.656 1.00 . A A . 826 ARG HG3 1 1 13 9796 1 1 47 ARG HH11 H 13.016 -6.360 -3.477 1.00 . A A . 826 ARG HH11 1 1 13 9797 1 1 47 ARG HH12 H 12.947 -6.376 -5.217 1.00 . A A . 826 ARG HH12 1 1 13 9798 1 1 47 ARG HH21 H 16.299 -5.433 -5.657 1.00 . A A . 826 ARG HH21 1 1 13 9799 1 1 47 ARG HH22 H 14.809 -5.853 -6.448 1.00 . A A . 826 ARG HH22 1 1 13 9800 1 1 47 ARG N N 14.636 -3.548 2.500 1.00 . A A . 826 ARG N 1 1 13 9801 1 1 47 ARG NE N 15.428 -5.632 -3.297 1.00 . A A . 826 ARG NE 1 1 13 9802 1 1 47 ARG NH1 N 13.469 -6.227 -4.364 1.00 . A A . 826 ARG NH1 1 1 13 9803 1 1 47 ARG NH2 N 15.330 -5.705 -5.603 1.00 . A A . 826 ARG NH2 1 1 13 9804 1 1 47 ARG O O 17.313 -2.573 0.355 1.00 . A A . 826 ARG O 1 1 13 9805 1 1 48 TYR C C 17.103 0.438 1.706 1.00 . A A . 827 TYR C 1 1 13 9806 1 1 48 TYR CA C 16.107 -0.133 0.687 1.00 . A A . 827 TYR CA 1 1 13 9807 1 1 48 TYR CB C 14.983 0.860 0.364 1.00 . A A . 827 TYR CB 1 1 13 9808 1 1 48 TYR CD1 C 16.059 2.408 -1.318 1.00 . A A . 827 TYR CD1 1 1 13 9809 1 1 48 TYR CD2 C 15.323 3.332 0.751 1.00 . A A . 827 TYR CD2 1 1 13 9810 1 1 48 TYR CE1 C 16.494 3.654 -1.723 1.00 . A A . 827 TYR CE1 1 1 13 9811 1 1 48 TYR CE2 C 15.755 4.581 0.353 1.00 . A A . 827 TYR CE2 1 1 13 9812 1 1 48 TYR CG C 15.464 2.226 -0.077 1.00 . A A . 827 TYR CG 1 1 13 9813 1 1 48 TYR CZ C 16.343 4.735 -0.883 1.00 . A A . 827 TYR CZ 1 1 13 9814 1 1 48 TYR H H 14.715 -1.430 1.650 1.00 . A A . 827 TYR H 1 1 13 9815 1 1 48 TYR HA H 16.670 -0.352 -0.207 1.00 . A A . 827 TYR HA 1 1 13 9816 1 1 48 TYR HB2 H 14.376 0.455 -0.431 1.00 . A A . 827 TYR HB2 1 1 13 9817 1 1 48 TYR HB3 H 14.368 0.993 1.244 1.00 . A A . 827 TYR HB3 1 1 13 9818 1 1 48 TYR HD1 H 16.179 1.558 -1.974 1.00 . A A . 827 TYR HD1 1 1 13 9819 1 1 48 TYR HD2 H 14.865 3.206 1.720 1.00 . A A . 827 TYR HD2 1 1 13 9820 1 1 48 TYR HE1 H 16.953 3.776 -2.694 1.00 . A A . 827 TYR HE1 1 1 13 9821 1 1 48 TYR HE2 H 15.636 5.428 1.011 1.00 . A A . 827 TYR HE2 1 1 13 9822 1 1 48 TYR HH H 16.638 6.058 -2.251 1.00 . A A . 827 TYR HH 1 1 13 9823 1 1 48 TYR N N 15.559 -1.407 1.136 1.00 . A A . 827 TYR N 1 1 13 9824 1 1 48 TYR O O 17.717 1.482 1.482 1.00 . A A . 827 TYR O 1 1 13 9825 1 1 48 TYR OH O 16.770 5.979 -1.290 1.00 . A A . 827 TYR OH 1 1 13 9826 1 1 49 ASN C C 18.798 -1.010 4.609 1.00 . A A . 828 ASN C 1 1 13 9827 1 1 49 ASN CA C 18.234 0.173 3.832 1.00 . A A . 828 ASN CA 1 1 13 9828 1 1 49 ASN CB C 17.592 1.208 4.779 1.00 . A A . 828 ASN CB 1 1 13 9829 1 1 49 ASN CG C 16.150 0.904 5.168 1.00 . A A . 828 ASN CG 1 1 13 9830 1 1 49 ASN H H 16.804 -1.106 2.935 1.00 . A A . 828 ASN H 1 1 13 9831 1 1 49 ASN HA H 19.055 0.650 3.319 1.00 . A A . 828 ASN HA 1 1 13 9832 1 1 49 ASN HB2 H 18.173 1.250 5.687 1.00 . A A . 828 ASN HB2 1 1 13 9833 1 1 49 ASN HB3 H 17.619 2.178 4.304 1.00 . A A . 828 ASN HB3 1 1 13 9834 1 1 49 ASN HD21 H 16.514 -1.047 5.202 1.00 . A A . 828 ASN HD21 1 1 13 9835 1 1 49 ASN HD22 H 14.888 -0.569 5.562 1.00 . A A . 828 ASN HD22 1 1 13 9836 1 1 49 ASN N N 17.298 -0.269 2.806 1.00 . A A . 828 ASN N 1 1 13 9837 1 1 49 ASN ND2 N 15.815 -0.362 5.330 1.00 . A A . 828 ASN ND2 1 1 13 9838 1 1 49 ASN O O 19.900 -1.470 4.253 1.00 . A A . 828 ASN O 1 1 13 9839 1 1 49 ASN OXT O 18.145 -1.486 5.556 1.00 . A A . 828 ASN OXT 1 1 13 9840 1 1 49 ASN OD1 O 15.345 1.820 5.346 1.00 . A A . 828 ASN OD1 1 1 13 9841 2 2 1 ZN ZN ZN 7.563 -2.825 -2.647 1.00 . B A . 829 ZN ZN 1 1 14 9842 1 1 1 GLY C C -15.360 -14.212 -4.833 1.00 . A A . 1 GLY C 1 1 14 9843 1 1 1 GLY CA C -15.594 -15.703 -4.857 1.00 . A A . 1 GLY CA 1 1 14 9844 1 1 1 GLY H1 H -16.616 -17.117 -5.998 1.00 . A A . 1 GLY H1 1 1 14 9845 1 1 1 GLY H2 H -16.107 -15.758 -6.875 1.00 . A A . 1 GLY H2 1 1 14 9846 1 1 1 GLY H3 H -17.432 -15.642 -5.828 1.00 . A A . 1 GLY H3 1 1 14 9847 1 1 1 GLY HA2 H -16.034 -16.005 -3.919 1.00 . A A . 1 GLY HA2 1 1 14 9848 1 1 1 GLY HA3 H -14.648 -16.207 -4.984 1.00 . A A . 1 GLY HA3 1 1 14 9849 1 1 1 GLY N N -16.498 -16.084 -5.964 1.00 . A A . 1 GLY N 1 1 14 9850 1 1 1 GLY O O -15.858 -13.494 -5.700 1.00 . A A . 1 GLY O 1 1 14 9851 1 1 2 THR C C -13.199 -11.988 -4.781 1.00 . A A . 2 THR C 1 1 14 9852 1 1 2 THR CA C -14.281 -12.329 -3.759 1.00 . A A . 2 THR CA 1 1 14 9853 1 1 2 THR CB C -13.806 -11.963 -2.341 1.00 . A A . 2 THR CB 1 1 14 9854 1 1 2 THR CG2 C -13.650 -10.457 -2.184 1.00 . A A . 2 THR CG2 1 1 14 9855 1 1 2 THR H H -14.292 -14.355 -3.148 1.00 . A A . 2 THR H 1 1 14 9856 1 1 2 THR HA H -15.171 -11.757 -3.982 1.00 . A A . 2 THR HA 1 1 14 9857 1 1 2 THR HB H -12.850 -12.434 -2.161 1.00 . A A . 2 THR HB 1 1 14 9858 1 1 2 THR HG1 H -14.345 -12.471 -0.504 1.00 . A A . 2 THR HG1 1 1 14 9859 1 1 2 THR HG21 H -12.933 -10.091 -2.905 1.00 . A A . 2 THR HG21 1 1 14 9860 1 1 2 THR HG22 H -13.302 -10.233 -1.186 1.00 . A A . 2 THR HG22 1 1 14 9861 1 1 2 THR HG23 H -14.603 -9.976 -2.348 1.00 . A A . 2 THR HG23 1 1 14 9862 1 1 2 THR N N -14.618 -13.739 -3.845 1.00 . A A . 2 THR N 1 1 14 9863 1 1 2 THR O O -12.002 -12.063 -4.495 1.00 . A A . 2 THR O 1 1 14 9864 1 1 2 THR OG1 O -14.756 -12.449 -1.383 1.00 . A A . 2 THR OG1 1 1 14 9865 1 1 3 ARG C C -12.274 -9.919 -7.091 1.00 . A A . 3 ARG C 1 1 14 9866 1 1 3 ARG CA C -12.726 -11.376 -7.085 1.00 . A A . 3 ARG CA 1 1 14 9867 1 1 3 ARG CB C -13.407 -11.747 -8.404 1.00 . A A . 3 ARG CB 1 1 14 9868 1 1 3 ARG CD C -13.172 -12.164 -10.865 1.00 . A A . 3 ARG CD 1 1 14 9869 1 1 3 ARG CG C -12.542 -11.535 -9.636 1.00 . A A . 3 ARG CG 1 1 14 9870 1 1 3 ARG CZ C -13.775 -14.425 -11.653 1.00 . A A . 3 ARG CZ 1 1 14 9871 1 1 3 ARG H H -14.603 -11.528 -6.124 1.00 . A A . 3 ARG H 1 1 14 9872 1 1 3 ARG HA H -11.859 -12.007 -6.950 1.00 . A A . 3 ARG HA 1 1 14 9873 1 1 3 ARG HB2 H -13.687 -12.790 -8.366 1.00 . A A . 3 ARG HB2 1 1 14 9874 1 1 3 ARG HB3 H -14.301 -11.150 -8.511 1.00 . A A . 3 ARG HB3 1 1 14 9875 1 1 3 ARG HD2 H -14.186 -11.803 -10.963 1.00 . A A . 3 ARG HD2 1 1 14 9876 1 1 3 ARG HD3 H -12.601 -11.876 -11.735 1.00 . A A . 3 ARG HD3 1 1 14 9877 1 1 3 ARG HE H -12.717 -14.031 -10.004 1.00 . A A . 3 ARG HE 1 1 14 9878 1 1 3 ARG HG2 H -12.427 -10.475 -9.805 1.00 . A A . 3 ARG HG2 1 1 14 9879 1 1 3 ARG HG3 H -11.573 -11.983 -9.467 1.00 . A A . 3 ARG HG3 1 1 14 9880 1 1 3 ARG HH11 H -14.567 -12.926 -12.766 1.00 . A A . 3 ARG HH11 1 1 14 9881 1 1 3 ARG HH12 H -14.924 -14.534 -13.320 1.00 . A A . 3 ARG HH12 1 1 14 9882 1 1 3 ARG HH21 H -13.169 -16.119 -10.724 1.00 . A A . 3 ARG HH21 1 1 14 9883 1 1 3 ARG HH22 H -14.098 -16.355 -12.177 1.00 . A A . 3 ARG HH22 1 1 14 9884 1 1 3 ARG N N -13.634 -11.630 -5.980 1.00 . A A . 3 ARG N 1 1 14 9885 1 1 3 ARG NE N -13.191 -13.623 -10.769 1.00 . A A . 3 ARG NE 1 1 14 9886 1 1 3 ARG NH1 N -14.473 -13.923 -12.662 1.00 . A A . 3 ARG NH1 1 1 14 9887 1 1 3 ARG NH2 N -13.679 -15.737 -11.507 1.00 . A A . 3 ARG NH2 1 1 14 9888 1 1 3 ARG O O -12.834 -9.074 -7.795 1.00 . A A . 3 ARG O 1 1 14 9889 1 1 4 GLY C C -9.271 -8.303 -5.772 1.00 . A A . 783 GLY C 1 1 14 9890 1 1 4 GLY CA C -10.719 -8.300 -6.213 1.00 . A A . 783 GLY CA 1 1 14 9891 1 1 4 GLY H H -10.866 -10.353 -5.747 1.00 . A A . 783 GLY H 1 1 14 9892 1 1 4 GLY HA2 H -10.790 -7.836 -7.187 1.00 . A A . 783 GLY HA2 1 1 14 9893 1 1 4 GLY HA3 H -11.302 -7.727 -5.506 1.00 . A A . 783 GLY HA3 1 1 14 9894 1 1 4 GLY N N -11.257 -9.638 -6.294 1.00 . A A . 783 GLY N 1 1 14 9895 1 1 4 GLY O O -8.947 -8.768 -4.676 1.00 . A A . 783 GLY O 1 1 14 9896 1 1 5 VAL C C -6.677 -6.257 -5.916 1.00 . A A . 784 VAL C 1 1 14 9897 1 1 5 VAL CA C -6.985 -7.700 -6.299 1.00 . A A . 784 VAL CA 1 1 14 9898 1 1 5 VAL CB C -6.077 -8.155 -7.465 1.00 . A A . 784 VAL CB 1 1 14 9899 1 1 5 VAL CG1 C -4.609 -8.048 -7.081 1.00 . A A . 784 VAL CG1 1 1 14 9900 1 1 5 VAL CG2 C -6.417 -9.578 -7.884 1.00 . A A . 784 VAL CG2 1 1 14 9901 1 1 5 VAL H H -8.706 -7.521 -7.519 1.00 . A A . 784 VAL H 1 1 14 9902 1 1 5 VAL HA H -6.794 -8.338 -5.446 1.00 . A A . 784 VAL HA 1 1 14 9903 1 1 5 VAL HB H -6.253 -7.508 -8.311 1.00 . A A . 784 VAL HB 1 1 14 9904 1 1 5 VAL HG11 H -4.378 -7.021 -6.836 1.00 . A A . 784 VAL HG11 1 1 14 9905 1 1 5 VAL HG12 H -3.996 -8.367 -7.909 1.00 . A A . 784 VAL HG12 1 1 14 9906 1 1 5 VAL HG13 H -4.415 -8.675 -6.224 1.00 . A A . 784 VAL HG13 1 1 14 9907 1 1 5 VAL HG21 H -5.772 -9.877 -8.697 1.00 . A A . 784 VAL HG21 1 1 14 9908 1 1 5 VAL HG22 H -7.447 -9.622 -8.206 1.00 . A A . 784 VAL HG22 1 1 14 9909 1 1 5 VAL HG23 H -6.272 -10.243 -7.046 1.00 . A A . 784 VAL HG23 1 1 14 9910 1 1 5 VAL N N -8.395 -7.817 -6.636 1.00 . A A . 784 VAL N 1 1 14 9911 1 1 5 VAL O O -6.466 -5.953 -4.748 1.00 . A A . 784 VAL O 1 1 14 9912 1 1 6 ASP C C -7.526 -3.279 -7.682 1.00 . A A . 785 ASP C 1 1 14 9913 1 1 6 ASP CA C -6.587 -3.937 -6.687 1.00 . A A . 785 ASP CA 1 1 14 9914 1 1 6 ASP CB C -5.157 -3.406 -6.860 1.00 . A A . 785 ASP CB 1 1 14 9915 1 1 6 ASP CG C -4.186 -3.973 -5.840 1.00 . A A . 785 ASP CG 1 1 14 9916 1 1 6 ASP H H -6.707 -5.704 -7.835 1.00 . A A . 785 ASP H 1 1 14 9917 1 1 6 ASP HA H -6.933 -3.732 -5.683 1.00 . A A . 785 ASP HA 1 1 14 9918 1 1 6 ASP HB2 H -4.801 -3.666 -7.846 1.00 . A A . 785 ASP HB2 1 1 14 9919 1 1 6 ASP HB3 H -5.166 -2.330 -6.761 1.00 . A A . 785 ASP HB3 1 1 14 9920 1 1 6 ASP N N -6.664 -5.378 -6.909 1.00 . A A . 785 ASP N 1 1 14 9921 1 1 6 ASP O O -7.242 -2.229 -8.257 1.00 . A A . 785 ASP O 1 1 14 9922 1 1 6 ASP OD1 O -4.354 -3.680 -4.635 1.00 . A A . 785 ASP OD1 1 1 14 9923 1 1 6 ASP OD2 O -3.265 -4.721 -6.228 1.00 . A A . 785 ASP OD2 1 1 14 9924 1 1 7 SER C C -10.361 -2.314 -8.568 1.00 . A A . 786 SER C 1 1 14 9925 1 1 7 SER CA C -9.625 -3.609 -8.893 1.00 . A A . 786 SER CA 1 1 14 9926 1 1 7 SER CB C -10.635 -4.751 -8.991 1.00 . A A . 786 SER CB 1 1 14 9927 1 1 7 SER H H -8.824 -4.731 -7.310 1.00 . A A . 786 SER H 1 1 14 9928 1 1 7 SER HA H -9.125 -3.507 -9.841 1.00 . A A . 786 SER HA 1 1 14 9929 1 1 7 SER HB2 H -11.287 -4.722 -8.128 1.00 . A A . 786 SER HB2 1 1 14 9930 1 1 7 SER HB3 H -11.221 -4.636 -9.890 1.00 . A A . 786 SER HB3 1 1 14 9931 1 1 7 SER HG H -10.098 -6.409 -9.908 1.00 . A A . 786 SER HG 1 1 14 9932 1 1 7 SER N N -8.645 -3.955 -7.880 1.00 . A A . 786 SER N 1 1 14 9933 1 1 7 SER O O -11.032 -2.218 -7.545 1.00 . A A . 786 SER O 1 1 14 9934 1 1 7 SER OG O -9.974 -6.008 -9.029 1.00 . A A . 786 SER OG 1 1 14 9935 1 1 8 PRO C C -12.587 -0.438 -9.611 1.00 . A A . 787 PRO C 1 1 14 9936 1 1 8 PRO CA C -11.116 -0.106 -9.356 1.00 . A A . 787 PRO CA 1 1 14 9937 1 1 8 PRO CB C -10.572 0.813 -10.459 1.00 . A A . 787 PRO CB 1 1 14 9938 1 1 8 PRO CD C -9.391 -1.261 -10.619 1.00 . A A . 787 PRO CD 1 1 14 9939 1 1 8 PRO CG C -9.268 0.213 -10.871 1.00 . A A . 787 PRO CG 1 1 14 9940 1 1 8 PRO HA H -11.012 0.371 -8.391 1.00 . A A . 787 PRO HA 1 1 14 9941 1 1 8 PRO HB2 H -11.269 0.837 -11.283 1.00 . A A . 787 PRO HB2 1 1 14 9942 1 1 8 PRO HB3 H -10.439 1.809 -10.066 1.00 . A A . 787 PRO HB3 1 1 14 9943 1 1 8 PRO HD2 H -9.830 -1.756 -11.473 1.00 . A A . 787 PRO HD2 1 1 14 9944 1 1 8 PRO HD3 H -8.428 -1.689 -10.383 1.00 . A A . 787 PRO HD3 1 1 14 9945 1 1 8 PRO HG2 H -9.094 0.400 -11.920 1.00 . A A . 787 PRO HG2 1 1 14 9946 1 1 8 PRO HG3 H -8.469 0.630 -10.277 1.00 . A A . 787 PRO HG3 1 1 14 9947 1 1 8 PRO N N -10.289 -1.313 -9.459 1.00 . A A . 787 PRO N 1 1 14 9948 1 1 8 PRO O O -13.451 0.432 -9.608 1.00 . A A . 787 PRO O 1 1 14 9949 1 1 9 SER C C -14.877 -2.530 -8.744 1.00 . A A . 788 SER C 1 1 14 9950 1 1 9 SER CA C -14.175 -2.232 -10.073 1.00 . A A . 788 SER CA 1 1 14 9951 1 1 9 SER CB C -14.076 -3.504 -10.916 1.00 . A A . 788 SER CB 1 1 14 9952 1 1 9 SER H H -12.086 -2.336 -9.907 1.00 . A A . 788 SER H 1 1 14 9953 1 1 9 SER HA H -14.742 -1.491 -10.614 1.00 . A A . 788 SER HA 1 1 14 9954 1 1 9 SER HB2 H -13.603 -4.283 -10.335 1.00 . A A . 788 SER HB2 1 1 14 9955 1 1 9 SER HB3 H -15.063 -3.822 -11.203 1.00 . A A . 788 SER HB3 1 1 14 9956 1 1 9 SER HG H -13.730 -2.576 -12.613 1.00 . A A . 788 SER HG 1 1 14 9957 1 1 9 SER N N -12.838 -1.716 -9.853 1.00 . A A . 788 SER N 1 1 14 9958 1 1 9 SER O O -15.982 -2.048 -8.498 1.00 . A A . 788 SER O 1 1 14 9959 1 1 9 SER OG O -13.308 -3.274 -12.087 1.00 . A A . 788 SER OG 1 1 14 9960 1 1 10 ALA C C -14.012 -3.412 -5.415 1.00 . A A . 789 ALA C 1 1 14 9961 1 1 10 ALA CA C -14.851 -3.765 -6.642 1.00 . A A . 789 ALA CA 1 1 14 9962 1 1 10 ALA CB C -15.090 -5.267 -6.696 1.00 . A A . 789 ALA CB 1 1 14 9963 1 1 10 ALA H H -13.313 -3.594 -8.090 1.00 . A A . 789 ALA H 1 1 14 9964 1 1 10 ALA HA H -15.812 -3.279 -6.558 1.00 . A A . 789 ALA HA 1 1 14 9965 1 1 10 ALA HB1 H -15.645 -5.512 -7.589 1.00 . A A . 789 ALA HB1 1 1 14 9966 1 1 10 ALA HB2 H -15.654 -5.574 -5.827 1.00 . A A . 789 ALA HB2 1 1 14 9967 1 1 10 ALA HB3 H -14.141 -5.783 -6.710 1.00 . A A . 789 ALA HB3 1 1 14 9968 1 1 10 ALA N N -14.227 -3.314 -7.885 1.00 . A A . 789 ALA N 1 1 14 9969 1 1 10 ALA O O -14.545 -3.256 -4.315 1.00 . A A . 789 ALA O 1 1 14 9970 1 1 11 GLU C C -11.863 -1.556 -4.033 1.00 . A A . 790 GLU C 1 1 14 9971 1 1 11 GLU CA C -11.795 -2.999 -4.492 1.00 . A A . 790 GLU CA 1 1 14 9972 1 1 11 GLU CB C -10.356 -3.325 -4.871 1.00 . A A . 790 GLU CB 1 1 14 9973 1 1 11 GLU CD C -10.069 -5.422 -3.502 1.00 . A A . 790 GLU CD 1 1 14 9974 1 1 11 GLU CG C -10.047 -4.813 -4.890 1.00 . A A . 790 GLU CG 1 1 14 9975 1 1 11 GLU H H -12.343 -3.327 -6.511 1.00 . A A . 790 GLU H 1 1 14 9976 1 1 11 GLU HA H -12.088 -3.634 -3.672 1.00 . A A . 790 GLU HA 1 1 14 9977 1 1 11 GLU HB2 H -10.159 -2.920 -5.852 1.00 . A A . 790 GLU HB2 1 1 14 9978 1 1 11 GLU HB3 H -9.697 -2.848 -4.159 1.00 . A A . 790 GLU HB3 1 1 14 9979 1 1 11 GLU HG2 H -10.786 -5.313 -5.498 1.00 . A A . 790 GLU HG2 1 1 14 9980 1 1 11 GLU HG3 H -9.067 -4.960 -5.320 1.00 . A A . 790 GLU HG3 1 1 14 9981 1 1 11 GLU N N -12.707 -3.264 -5.606 1.00 . A A . 790 GLU N 1 1 14 9982 1 1 11 GLU O O -11.221 -1.190 -3.057 1.00 . A A . 790 GLU O 1 1 14 9983 1 1 11 GLU OE1 O -9.021 -5.387 -2.819 1.00 . A A . 790 GLU OE1 1 1 14 9984 1 1 11 GLU OE2 O -11.127 -5.937 -3.091 1.00 . A A . 790 GLU OE2 1 1 14 9985 1 1 12 LEU C C -13.576 0.793 -3.033 1.00 . A A . 791 LEU C 1 1 14 9986 1 1 12 LEU CA C -12.775 0.663 -4.322 1.00 . A A . 791 LEU CA 1 1 14 9987 1 1 12 LEU CB C -13.386 1.511 -5.447 1.00 . A A . 791 LEU CB 1 1 14 9988 1 1 12 LEU CD1 C -15.776 0.677 -5.285 1.00 . A A . 791 LEU CD1 1 1 14 9989 1 1 12 LEU CD2 C -14.976 1.807 -7.353 1.00 . A A . 791 LEU CD2 1 1 14 9990 1 1 12 LEU CG C -14.581 0.902 -6.201 1.00 . A A . 791 LEU CG 1 1 14 9991 1 1 12 LEU H H -13.140 -1.068 -5.490 1.00 . A A . 791 LEU H 1 1 14 9992 1 1 12 LEU HA H -11.779 1.007 -4.126 1.00 . A A . 791 LEU HA 1 1 14 9993 1 1 12 LEU HB2 H -13.709 2.448 -5.019 1.00 . A A . 791 LEU HB2 1 1 14 9994 1 1 12 LEU HB3 H -12.609 1.718 -6.168 1.00 . A A . 791 LEU HB3 1 1 14 9995 1 1 12 LEU HD11 H -16.099 1.624 -4.877 1.00 . A A . 791 LEU HD11 1 1 14 9996 1 1 12 LEU HD12 H -15.494 0.017 -4.477 1.00 . A A . 791 LEU HD12 1 1 14 9997 1 1 12 LEU HD13 H -16.585 0.232 -5.846 1.00 . A A . 791 LEU HD13 1 1 14 9998 1 1 12 LEU HD21 H -15.810 1.373 -7.883 1.00 . A A . 791 LEU HD21 1 1 14 9999 1 1 12 LEU HD22 H -14.139 1.919 -8.028 1.00 . A A . 791 LEU HD22 1 1 14 10000 1 1 12 LEU HD23 H -15.260 2.774 -6.967 1.00 . A A . 791 LEU HD23 1 1 14 10001 1 1 12 LEU HG H -14.291 -0.054 -6.613 1.00 . A A . 791 LEU HG 1 1 14 10002 1 1 12 LEU N N -12.648 -0.734 -4.715 1.00 . A A . 791 LEU N 1 1 14 10003 1 1 12 LEU O O -13.779 1.883 -2.501 1.00 . A A . 791 LEU O 1 1 14 10004 1 1 13 ASP C C -13.854 -1.200 -0.284 1.00 . A A . 792 ASP C 1 1 14 10005 1 1 13 ASP CA C -14.726 -0.443 -1.282 1.00 . A A . 792 ASP CA 1 1 14 10006 1 1 13 ASP CB C -16.068 -1.152 -1.505 1.00 . A A . 792 ASP CB 1 1 14 10007 1 1 13 ASP CG C -16.936 -1.193 -0.263 1.00 . A A . 792 ASP CG 1 1 14 10008 1 1 13 ASP H H -13.809 -1.167 -3.045 1.00 . A A . 792 ASP H 1 1 14 10009 1 1 13 ASP HA H -14.901 0.557 -0.912 1.00 . A A . 792 ASP HA 1 1 14 10010 1 1 13 ASP HB2 H -16.612 -0.639 -2.283 1.00 . A A . 792 ASP HB2 1 1 14 10011 1 1 13 ASP HB3 H -15.878 -2.169 -1.819 1.00 . A A . 792 ASP HB3 1 1 14 10012 1 1 13 ASP N N -14.006 -0.348 -2.541 1.00 . A A . 792 ASP N 1 1 14 10013 1 1 13 ASP O O -14.330 -1.906 0.603 1.00 . A A . 792 ASP O 1 1 14 10014 1 1 13 ASP OD1 O -17.336 -0.115 0.216 1.00 . A A . 792 ASP OD1 1 1 14 10015 1 1 13 ASP OD2 O -17.211 -2.298 0.244 1.00 . A A . 792 ASP OD2 1 1 14 10016 1 1 14 LYS C C -10.223 -0.935 0.257 1.00 . A A . 793 LYS C 1 1 14 10017 1 1 14 LYS CA C -11.522 -1.735 0.290 1.00 . A A . 793 LYS CA 1 1 14 10018 1 1 14 LYS CB C -11.260 -3.119 -0.339 1.00 . A A . 793 LYS CB 1 1 14 10019 1 1 14 LYS CD C -12.633 -4.643 1.128 1.00 . A A . 793 LYS CD 1 1 14 10020 1 1 14 LYS CE C -11.550 -5.645 1.499 1.00 . A A . 793 LYS CE 1 1 14 10021 1 1 14 LYS CG C -12.430 -4.091 -0.275 1.00 . A A . 793 LYS CG 1 1 14 10022 1 1 14 LYS H H -12.272 -0.312 -1.071 1.00 . A A . 793 LYS H 1 1 14 10023 1 1 14 LYS HA H -11.848 -1.852 1.310 1.00 . A A . 793 LYS HA 1 1 14 10024 1 1 14 LYS HB2 H -11.002 -2.981 -1.378 1.00 . A A . 793 LYS HB2 1 1 14 10025 1 1 14 LYS HB3 H -10.421 -3.573 0.169 1.00 . A A . 793 LYS HB3 1 1 14 10026 1 1 14 LYS HD2 H -12.608 -3.826 1.833 1.00 . A A . 793 LYS HD2 1 1 14 10027 1 1 14 LYS HD3 H -13.596 -5.131 1.177 1.00 . A A . 793 LYS HD3 1 1 14 10028 1 1 14 LYS HE2 H -11.542 -6.435 0.762 1.00 . A A . 793 LYS HE2 1 1 14 10029 1 1 14 LYS HE3 H -10.594 -5.143 1.495 1.00 . A A . 793 LYS HE3 1 1 14 10030 1 1 14 LYS HG2 H -13.329 -3.574 -0.579 1.00 . A A . 793 LYS HG2 1 1 14 10031 1 1 14 LYS HG3 H -12.240 -4.911 -0.950 1.00 . A A . 793 LYS HG3 1 1 14 10032 1 1 14 LYS HZ1 H -11.651 -5.519 3.585 1.00 . A A . 793 LYS HZ1 1 1 14 10033 1 1 14 LYS HZ2 H -11.112 -7.023 3.011 1.00 . A A . 793 LYS HZ2 1 1 14 10034 1 1 14 LYS HZ3 H -12.754 -6.612 2.905 1.00 . A A . 793 LYS HZ3 1 1 14 10035 1 1 14 LYS N N -12.552 -1.003 -0.444 1.00 . A A . 793 LYS N 1 1 14 10036 1 1 14 LYS NZ N -11.782 -6.240 2.842 1.00 . A A . 793 LYS NZ 1 1 14 10037 1 1 14 LYS O O -9.479 -0.878 1.240 1.00 . A A . 793 LYS O 1 1 14 10038 1 1 15 LYS C C -9.085 1.550 -2.162 1.00 . A A . 794 LYS C 1 1 14 10039 1 1 15 LYS CA C -8.789 0.496 -1.098 1.00 . A A . 794 LYS CA 1 1 14 10040 1 1 15 LYS CB C -7.631 -0.399 -1.553 1.00 . A A . 794 LYS CB 1 1 14 10041 1 1 15 LYS CD C -6.852 -2.140 -3.215 1.00 . A A . 794 LYS CD 1 1 14 10042 1 1 15 LYS CE C -6.737 -3.242 -2.177 1.00 . A A . 794 LYS CE 1 1 14 10043 1 1 15 LYS CG C -7.927 -1.132 -2.854 1.00 . A A . 794 LYS CG 1 1 14 10044 1 1 15 LYS H H -10.580 -0.428 -1.640 1.00 . A A . 794 LYS H 1 1 14 10045 1 1 15 LYS HA H -8.535 0.978 -0.171 1.00 . A A . 794 LYS HA 1 1 14 10046 1 1 15 LYS HB2 H -6.751 0.211 -1.696 1.00 . A A . 794 LYS HB2 1 1 14 10047 1 1 15 LYS HB3 H -7.431 -1.134 -0.788 1.00 . A A . 794 LYS HB3 1 1 14 10048 1 1 15 LYS HD2 H -7.099 -2.586 -4.165 1.00 . A A . 794 LYS HD2 1 1 14 10049 1 1 15 LYS HD3 H -5.904 -1.630 -3.290 1.00 . A A . 794 LYS HD3 1 1 14 10050 1 1 15 LYS HE2 H -6.243 -2.846 -1.302 1.00 . A A . 794 LYS HE2 1 1 14 10051 1 1 15 LYS HE3 H -7.729 -3.577 -1.911 1.00 . A A . 794 LYS HE3 1 1 14 10052 1 1 15 LYS HG2 H -8.867 -1.653 -2.753 1.00 . A A . 794 LYS HG2 1 1 14 10053 1 1 15 LYS HG3 H -8.005 -0.405 -3.651 1.00 . A A . 794 LYS HG3 1 1 14 10054 1 1 15 LYS HZ1 H -6.524 -4.925 -3.387 1.00 . A A . 794 LYS HZ1 1 1 14 10055 1 1 15 LYS HZ2 H -5.693 -5.036 -1.916 1.00 . A A . 794 LYS HZ2 1 1 14 10056 1 1 15 LYS HZ3 H -5.086 -4.057 -3.167 1.00 . A A . 794 LYS HZ3 1 1 14 10057 1 1 15 LYS N N -9.966 -0.313 -0.887 1.00 . A A . 794 LYS N 1 1 14 10058 1 1 15 LYS NZ N -5.956 -4.392 -2.692 1.00 . A A . 794 LYS NZ 1 1 14 10059 1 1 15 LYS O O -9.918 1.334 -3.042 1.00 . A A . 794 LYS O 1 1 14 10060 1 1 16 ALA C C -7.536 4.832 -2.825 1.00 . A A . 795 ALA C 1 1 14 10061 1 1 16 ALA CA C -8.613 3.785 -3.013 1.00 . A A . 795 ALA CA 1 1 14 10062 1 1 16 ALA CB C -9.994 4.398 -2.834 1.00 . A A . 795 ALA CB 1 1 14 10063 1 1 16 ALA H H -7.748 2.784 -1.360 1.00 . A A . 795 ALA H 1 1 14 10064 1 1 16 ALA HA H -8.542 3.390 -4.007 1.00 . A A . 795 ALA HA 1 1 14 10065 1 1 16 ALA HB1 H -10.128 5.198 -3.547 1.00 . A A . 795 ALA HB1 1 1 14 10066 1 1 16 ALA HB2 H -10.087 4.790 -1.831 1.00 . A A . 795 ALA HB2 1 1 14 10067 1 1 16 ALA HB3 H -10.746 3.641 -2.996 1.00 . A A . 795 ALA HB3 1 1 14 10068 1 1 16 ALA N N -8.407 2.683 -2.075 1.00 . A A . 795 ALA N 1 1 14 10069 1 1 16 ALA O O -7.021 5.402 -3.788 1.00 . A A . 795 ALA O 1 1 14 10070 1 1 17 ASN C C -4.756 5.155 -1.459 1.00 . A A . 796 ASN C 1 1 14 10071 1 1 17 ASN CA C -6.059 5.911 -1.223 1.00 . A A . 796 ASN CA 1 1 14 10072 1 1 17 ASN CB C -6.158 6.394 0.235 1.00 . A A . 796 ASN CB 1 1 14 10073 1 1 17 ASN CG C -6.589 5.315 1.231 1.00 . A A . 796 ASN CG 1 1 14 10074 1 1 17 ASN H H -7.732 4.661 -0.860 1.00 . A A . 796 ASN H 1 1 14 10075 1 1 17 ASN HA H -6.081 6.769 -1.879 1.00 . A A . 796 ASN HA 1 1 14 10076 1 1 17 ASN HB2 H -5.192 6.765 0.543 1.00 . A A . 796 ASN HB2 1 1 14 10077 1 1 17 ASN HB3 H -6.872 7.204 0.285 1.00 . A A . 796 ASN HB3 1 1 14 10078 1 1 17 ASN HD21 H -5.684 3.891 0.184 1.00 . A A . 796 ASN HD21 1 1 14 10079 1 1 17 ASN HD22 H -6.511 3.358 1.610 1.00 . A A . 796 ASN HD22 1 1 14 10080 1 1 17 ASN N N -7.194 5.062 -1.573 1.00 . A A . 796 ASN N 1 1 14 10081 1 1 17 ASN ND2 N -6.220 4.064 0.985 1.00 . A A . 796 ASN ND2 1 1 14 10082 1 1 17 ASN O O -4.054 4.766 -0.520 1.00 . A A . 796 ASN O 1 1 14 10083 1 1 17 ASN OD1 O -7.239 5.613 2.233 1.00 . A A . 796 ASN OD1 1 1 14 10084 1 1 18 LEU C C -2.139 5.024 -3.466 1.00 . A A . 797 LEU C 1 1 14 10085 1 1 18 LEU CA C -3.313 4.128 -3.110 1.00 . A A . 797 LEU CA 1 1 14 10086 1 1 18 LEU CB C -3.657 3.252 -4.316 1.00 . A A . 797 LEU CB 1 1 14 10087 1 1 18 LEU CD1 C -5.208 1.673 -5.494 1.00 . A A . 797 LEU CD1 1 1 14 10088 1 1 18 LEU CD2 C -5.076 1.646 -3.003 1.00 . A A . 797 LEU CD2 1 1 14 10089 1 1 18 LEU CG C -4.999 2.514 -4.245 1.00 . A A . 797 LEU CG 1 1 14 10090 1 1 18 LEU H H -5.010 5.299 -3.438 1.00 . A A . 797 LEU H 1 1 14 10091 1 1 18 LEU HA H -3.024 3.491 -2.288 1.00 . A A . 797 LEU HA 1 1 14 10092 1 1 18 LEU HB2 H -3.667 3.882 -5.187 1.00 . A A . 797 LEU HB2 1 1 14 10093 1 1 18 LEU HB3 H -2.873 2.517 -4.435 1.00 . A A . 797 LEU HB3 1 1 14 10094 1 1 18 LEU HD11 H -6.142 1.136 -5.414 1.00 . A A . 797 LEU HD11 1 1 14 10095 1 1 18 LEU HD12 H -4.395 0.969 -5.595 1.00 . A A . 797 LEU HD12 1 1 14 10096 1 1 18 LEU HD13 H -5.237 2.316 -6.361 1.00 . A A . 797 LEU HD13 1 1 14 10097 1 1 18 LEU HD21 H -4.986 2.267 -2.126 1.00 . A A . 797 LEU HD21 1 1 14 10098 1 1 18 LEU HD22 H -4.275 0.922 -3.018 1.00 . A A . 797 LEU HD22 1 1 14 10099 1 1 18 LEU HD23 H -6.027 1.132 -2.984 1.00 . A A . 797 LEU HD23 1 1 14 10100 1 1 18 LEU HG H -5.796 3.241 -4.198 1.00 . A A . 797 LEU HG 1 1 14 10101 1 1 18 LEU N N -4.460 4.913 -2.724 1.00 . A A . 797 LEU N 1 1 14 10102 1 1 18 LEU O O -2.309 6.118 -4.006 1.00 . A A . 797 LEU O 1 1 14 10103 1 1 19 LEU C C 1.235 3.986 -3.823 1.00 . A A . 798 LEU C 1 1 14 10104 1 1 19 LEU CA C 0.288 5.137 -3.579 1.00 . A A . 798 LEU CA 1 1 14 10105 1 1 19 LEU CB C 0.809 6.177 -2.544 1.00 . A A . 798 LEU CB 1 1 14 10106 1 1 19 LEU CD1 C 0.058 4.932 -0.452 1.00 . A A . 798 LEU CD1 1 1 14 10107 1 1 19 LEU CD2 C 2.459 4.892 -1.139 1.00 . A A . 798 LEU CD2 1 1 14 10108 1 1 19 LEU CG C 1.182 5.705 -1.120 1.00 . A A . 798 LEU CG 1 1 14 10109 1 1 19 LEU H H -0.921 3.679 -2.679 1.00 . A A . 798 LEU H 1 1 14 10110 1 1 19 LEU HA H 0.124 5.632 -4.520 1.00 . A A . 798 LEU HA 1 1 14 10111 1 1 19 LEU HB2 H 1.686 6.640 -2.967 1.00 . A A . 798 LEU HB2 1 1 14 10112 1 1 19 LEU HB3 H 0.051 6.941 -2.446 1.00 . A A . 798 LEU HB3 1 1 14 10113 1 1 19 LEU HD11 H 0.369 4.626 0.535 1.00 . A A . 798 LEU HD11 1 1 14 10114 1 1 19 LEU HD12 H -0.179 4.059 -1.043 1.00 . A A . 798 LEU HD12 1 1 14 10115 1 1 19 LEU HD13 H -0.817 5.562 -0.374 1.00 . A A . 798 LEU HD13 1 1 14 10116 1 1 19 LEU HD21 H 2.608 4.425 -0.177 1.00 . A A . 798 LEU HD21 1 1 14 10117 1 1 19 LEU HD22 H 3.293 5.540 -1.360 1.00 . A A . 798 LEU HD22 1 1 14 10118 1 1 19 LEU HD23 H 2.379 4.133 -1.904 1.00 . A A . 798 LEU HD23 1 1 14 10119 1 1 19 LEU HG H 1.370 6.580 -0.513 1.00 . A A . 798 LEU HG 1 1 14 10120 1 1 19 LEU N N -0.963 4.528 -3.172 1.00 . A A . 798 LEU N 1 1 14 10121 1 1 19 LEU O O 0.823 2.834 -3.658 1.00 . A A . 798 LEU O 1 1 14 10122 1 1 20 LYS C C 4.737 3.257 -4.082 1.00 . A A . 799 LYS C 1 1 14 10123 1 1 20 LYS CA C 3.299 3.083 -4.520 1.00 . A A . 799 LYS CA 1 1 14 10124 1 1 20 LYS CB C 3.223 2.696 -6.005 1.00 . A A . 799 LYS CB 1 1 14 10125 1 1 20 LYS CD C 3.217 4.994 -7.068 1.00 . A A . 799 LYS CD 1 1 14 10126 1 1 20 LYS CE C 3.753 5.814 -8.228 1.00 . A A . 799 LYS CE 1 1 14 10127 1 1 20 LYS CG C 3.928 3.654 -6.963 1.00 . A A . 799 LYS CG 1 1 14 10128 1 1 20 LYS H H 2.814 5.142 -4.287 1.00 . A A . 799 LYS H 1 1 14 10129 1 1 20 LYS HA H 2.891 2.290 -3.916 1.00 . A A . 799 LYS HA 1 1 14 10130 1 1 20 LYS HB2 H 3.665 1.718 -6.129 1.00 . A A . 799 LYS HB2 1 1 14 10131 1 1 20 LYS HB3 H 2.184 2.642 -6.290 1.00 . A A . 799 LYS HB3 1 1 14 10132 1 1 20 LYS HD2 H 2.162 4.820 -7.218 1.00 . A A . 799 LYS HD2 1 1 14 10133 1 1 20 LYS HD3 H 3.368 5.542 -6.149 1.00 . A A . 799 LYS HD3 1 1 14 10134 1 1 20 LYS HE2 H 4.808 5.988 -8.074 1.00 . A A . 799 LYS HE2 1 1 14 10135 1 1 20 LYS HE3 H 3.611 5.252 -9.140 1.00 . A A . 799 LYS HE3 1 1 14 10136 1 1 20 LYS HG2 H 4.932 3.823 -6.607 1.00 . A A . 799 LYS HG2 1 1 14 10137 1 1 20 LYS HG3 H 3.968 3.201 -7.944 1.00 . A A . 799 LYS HG3 1 1 14 10138 1 1 20 LYS HZ1 H 3.487 7.818 -7.700 1.00 . A A . 799 LYS HZ1 1 1 14 10139 1 1 20 LYS HZ2 H 2.050 7.019 -8.110 1.00 . A A . 799 LYS HZ2 1 1 14 10140 1 1 20 LYS HZ3 H 3.136 7.485 -9.326 1.00 . A A . 799 LYS HZ3 1 1 14 10141 1 1 20 LYS N N 2.468 4.223 -4.216 1.00 . A A . 799 LYS N 1 1 14 10142 1 1 20 LYS NZ N 3.061 7.123 -8.351 1.00 . A A . 799 LYS NZ 1 1 14 10143 1 1 20 LYS O O 5.318 4.343 -4.115 1.00 . A A . 799 LYS O 1 1 14 10144 1 1 21 CYS C C 7.623 2.527 -4.148 1.00 . A A . 800 CYS C 1 1 14 10145 1 1 21 CYS CA C 6.608 1.938 -3.179 1.00 . A A . 800 CYS CA 1 1 14 10146 1 1 21 CYS CB C 6.766 0.429 -3.078 1.00 . A A . 800 CYS CB 1 1 14 10147 1 1 21 CYS H H 4.651 1.355 -3.558 1.00 . A A . 800 CYS H 1 1 14 10148 1 1 21 CYS HA H 6.723 2.375 -2.200 1.00 . A A . 800 CYS HA 1 1 14 10149 1 1 21 CYS HB2 H 6.050 0.058 -2.360 1.00 . A A . 800 CYS HB2 1 1 14 10150 1 1 21 CYS HB3 H 6.530 -0.001 -4.045 1.00 . A A . 800 CYS HB3 1 1 14 10151 1 1 21 CYS N N 5.248 2.130 -3.628 1.00 . A A . 800 CYS N 1 1 14 10152 1 1 21 CYS O O 7.750 2.058 -5.275 1.00 . A A . 800 CYS O 1 1 14 10153 1 1 21 CYS SG S 8.374 -0.205 -2.586 1.00 . A A . 800 CYS SG 1 1 14 10154 1 1 22 GLU C C 10.519 3.267 -4.897 1.00 . A A . 801 GLU C 1 1 14 10155 1 1 22 GLU CA C 9.373 4.205 -4.507 1.00 . A A . 801 GLU CA 1 1 14 10156 1 1 22 GLU CB C 9.945 5.402 -3.751 1.00 . A A . 801 GLU CB 1 1 14 10157 1 1 22 GLU CD C 9.555 7.680 -2.764 1.00 . A A . 801 GLU CD 1 1 14 10158 1 1 22 GLU CG C 8.932 6.502 -3.478 1.00 . A A . 801 GLU CG 1 1 14 10159 1 1 22 GLU H H 8.141 3.921 -2.811 1.00 . A A . 801 GLU H 1 1 14 10160 1 1 22 GLU HA H 8.911 4.563 -5.413 1.00 . A A . 801 GLU HA 1 1 14 10161 1 1 22 GLU HB2 H 10.335 5.059 -2.805 1.00 . A A . 801 GLU HB2 1 1 14 10162 1 1 22 GLU HB3 H 10.754 5.823 -4.330 1.00 . A A . 801 GLU HB3 1 1 14 10163 1 1 22 GLU HG2 H 8.522 6.844 -4.417 1.00 . A A . 801 GLU HG2 1 1 14 10164 1 1 22 GLU HG3 H 8.139 6.104 -2.861 1.00 . A A . 801 GLU HG3 1 1 14 10165 1 1 22 GLU N N 8.342 3.551 -3.700 1.00 . A A . 801 GLU N 1 1 14 10166 1 1 22 GLU O O 11.492 3.699 -5.519 1.00 . A A . 801 GLU O 1 1 14 10167 1 1 22 GLU OE1 O 10.279 8.461 -3.420 1.00 . A A . 801 GLU OE1 1 1 14 10168 1 1 22 GLU OE2 O 9.343 7.826 -1.545 1.00 . A A . 801 GLU OE2 1 1 14 10169 1 1 23 TYR C C 10.999 0.169 -6.065 1.00 . A A . 802 TYR C 1 1 14 10170 1 1 23 TYR CA C 11.459 1.047 -4.901 1.00 . A A . 802 TYR CA 1 1 14 10171 1 1 23 TYR CB C 11.865 0.193 -3.692 1.00 . A A . 802 TYR CB 1 1 14 10172 1 1 23 TYR CD1 C 14.378 0.184 -3.508 1.00 . A A . 802 TYR CD1 1 1 14 10173 1 1 23 TYR CD2 C 13.312 -1.779 -4.341 1.00 . A A . 802 TYR CD2 1 1 14 10174 1 1 23 TYR CE1 C 15.611 -0.421 -3.647 1.00 . A A . 802 TYR CE1 1 1 14 10175 1 1 23 TYR CE2 C 14.542 -2.390 -4.482 1.00 . A A . 802 TYR CE2 1 1 14 10176 1 1 23 TYR CG C 13.209 -0.482 -3.849 1.00 . A A . 802 TYR CG 1 1 14 10177 1 1 23 TYR CZ C 15.688 -1.706 -4.134 1.00 . A A . 802 TYR CZ 1 1 14 10178 1 1 23 TYR H H 9.628 1.692 -4.057 1.00 . A A . 802 TYR H 1 1 14 10179 1 1 23 TYR HA H 12.309 1.622 -5.237 1.00 . A A . 802 TYR HA 1 1 14 10180 1 1 23 TYR HB2 H 11.911 0.820 -2.813 1.00 . A A . 802 TYR HB2 1 1 14 10181 1 1 23 TYR HB3 H 11.123 -0.578 -3.537 1.00 . A A . 802 TYR HB3 1 1 14 10182 1 1 23 TYR HD1 H 14.315 1.194 -3.126 1.00 . A A . 802 TYR HD1 1 1 14 10183 1 1 23 TYR HD2 H 12.413 -2.312 -4.610 1.00 . A A . 802 TYR HD2 1 1 14 10184 1 1 23 TYR HE1 H 16.508 0.116 -3.375 1.00 . A A . 802 TYR HE1 1 1 14 10185 1 1 23 TYR HE2 H 14.605 -3.399 -4.865 1.00 . A A . 802 TYR HE2 1 1 14 10186 1 1 23 TYR HH H 17.483 -2.050 -3.524 1.00 . A A . 802 TYR HH 1 1 14 10187 1 1 23 TYR N N 10.421 1.995 -4.544 1.00 . A A . 802 TYR N 1 1 14 10188 1 1 23 TYR O O 11.716 0.018 -7.052 1.00 . A A . 802 TYR O 1 1 14 10189 1 1 23 TYR OH O 16.917 -2.312 -4.267 1.00 . A A . 802 TYR OH 1 1 14 10190 1 1 24 CYS C C 8.073 -0.703 -7.737 1.00 . A A . 803 CYS C 1 1 14 10191 1 1 24 CYS CA C 9.288 -1.284 -7.005 1.00 . A A . 803 CYS CA 1 1 14 10192 1 1 24 CYS CB C 8.965 -2.662 -6.419 1.00 . A A . 803 CYS CB 1 1 14 10193 1 1 24 CYS H H 9.259 -0.220 -5.165 1.00 . A A . 803 CYS H 1 1 14 10194 1 1 24 CYS HA H 10.048 -1.387 -7.764 1.00 . A A . 803 CYS HA 1 1 14 10195 1 1 24 CYS HB2 H 8.393 -3.231 -7.138 1.00 . A A . 803 CYS HB2 1 1 14 10196 1 1 24 CYS HB3 H 9.888 -3.183 -6.210 1.00 . A A . 803 CYS HB3 1 1 14 10197 1 1 24 CYS N N 9.800 -0.393 -5.961 1.00 . A A . 803 CYS N 1 1 14 10198 1 1 24 CYS O O 7.864 -0.998 -8.915 1.00 . A A . 803 CYS O 1 1 14 10199 1 1 24 CYS SG S 8.006 -2.602 -4.879 1.00 . A A . 803 CYS SG 1 1 14 10200 1 1 25 GLY C C 4.873 0.038 -7.591 1.00 . A A . 804 GLY C 1 1 14 10201 1 1 25 GLY CA C 6.181 0.781 -7.744 1.00 . A A . 804 GLY CA 1 1 14 10202 1 1 25 GLY H H 7.451 0.296 -6.122 1.00 . A A . 804 GLY H 1 1 14 10203 1 1 25 GLY HA2 H 6.065 1.773 -7.333 1.00 . A A . 804 GLY HA2 1 1 14 10204 1 1 25 GLY HA3 H 6.412 0.867 -8.797 1.00 . A A . 804 GLY HA3 1 1 14 10205 1 1 25 GLY N N 7.285 0.121 -7.070 1.00 . A A . 804 GLY N 1 1 14 10206 1 1 25 GLY O O 3.957 0.212 -8.391 1.00 . A A . 804 GLY O 1 1 14 10207 1 1 26 LYS C C 2.520 -0.611 -5.653 1.00 . A A . 805 LYS C 1 1 14 10208 1 1 26 LYS CA C 3.552 -1.523 -6.298 1.00 . A A . 805 LYS CA 1 1 14 10209 1 1 26 LYS CB C 3.822 -2.726 -5.393 1.00 . A A . 805 LYS CB 1 1 14 10210 1 1 26 LYS CD C 4.864 -4.993 -5.113 1.00 . A A . 805 LYS CD 1 1 14 10211 1 1 26 LYS CE C 5.724 -6.076 -5.750 1.00 . A A . 805 LYS CE 1 1 14 10212 1 1 26 LYS CG C 4.686 -3.798 -6.037 1.00 . A A . 805 LYS CG 1 1 14 10213 1 1 26 LYS H H 5.529 -0.881 -5.945 1.00 . A A . 805 LYS H 1 1 14 10214 1 1 26 LYS HA H 3.158 -1.875 -7.240 1.00 . A A . 805 LYS HA 1 1 14 10215 1 1 26 LYS HB2 H 4.321 -2.384 -4.499 1.00 . A A . 805 LYS HB2 1 1 14 10216 1 1 26 LYS HB3 H 2.877 -3.172 -5.117 1.00 . A A . 805 LYS HB3 1 1 14 10217 1 1 26 LYS HD2 H 5.338 -4.663 -4.200 1.00 . A A . 805 LYS HD2 1 1 14 10218 1 1 26 LYS HD3 H 3.891 -5.406 -4.887 1.00 . A A . 805 LYS HD3 1 1 14 10219 1 1 26 LYS HE2 H 6.681 -5.649 -6.014 1.00 . A A . 805 LYS HE2 1 1 14 10220 1 1 26 LYS HE3 H 5.872 -6.868 -5.031 1.00 . A A . 805 LYS HE3 1 1 14 10221 1 1 26 LYS HG2 H 4.214 -4.128 -6.951 1.00 . A A . 805 LYS HG2 1 1 14 10222 1 1 26 LYS HG3 H 5.656 -3.379 -6.261 1.00 . A A . 805 LYS HG3 1 1 14 10223 1 1 26 LYS HZ1 H 4.119 -6.952 -6.768 1.00 . A A . 805 LYS HZ1 1 1 14 10224 1 1 26 LYS HZ2 H 5.639 -7.470 -7.306 1.00 . A A . 805 LYS HZ2 1 1 14 10225 1 1 26 LYS HZ3 H 5.070 -5.928 -7.736 1.00 . A A . 805 LYS HZ3 1 1 14 10226 1 1 26 LYS N N 4.777 -0.787 -6.560 1.00 . A A . 805 LYS N 1 1 14 10227 1 1 26 LYS NZ N 5.094 -6.643 -6.974 1.00 . A A . 805 LYS NZ 1 1 14 10228 1 1 26 LYS O O 2.787 0.010 -4.618 1.00 . A A . 805 LYS O 1 1 14 10229 1 1 27 TYR C C -0.540 -0.418 -4.750 1.00 . A A . 806 TYR C 1 1 14 10230 1 1 27 TYR CA C 0.279 0.322 -5.789 1.00 . A A . 806 TYR CA 1 1 14 10231 1 1 27 TYR CB C -0.627 0.773 -6.939 1.00 . A A . 806 TYR CB 1 1 14 10232 1 1 27 TYR CD1 C 0.744 0.801 -9.058 1.00 . A A . 806 TYR CD1 1 1 14 10233 1 1 27 TYR CD2 C 0.120 2.889 -8.094 1.00 . A A . 806 TYR CD2 1 1 14 10234 1 1 27 TYR CE1 C 1.411 1.464 -10.071 1.00 . A A . 806 TYR CE1 1 1 14 10235 1 1 27 TYR CE2 C 0.780 3.558 -9.103 1.00 . A A . 806 TYR CE2 1 1 14 10236 1 1 27 TYR CG C 0.089 1.501 -8.054 1.00 . A A . 806 TYR CG 1 1 14 10237 1 1 27 TYR CZ C 1.388 2.837 -10.116 1.00 . A A . 806 TYR CZ 1 1 14 10238 1 1 27 TYR H H 1.169 -1.147 -7.017 1.00 . A A . 806 TYR H 1 1 14 10239 1 1 27 TYR HA H 0.712 1.187 -5.307 1.00 . A A . 806 TYR HA 1 1 14 10240 1 1 27 TYR HB2 H -1.107 -0.093 -7.367 1.00 . A A . 806 TYR HB2 1 1 14 10241 1 1 27 TYR HB3 H -1.385 1.436 -6.546 1.00 . A A . 806 TYR HB3 1 1 14 10242 1 1 27 TYR HD1 H 0.726 -0.280 -9.042 1.00 . A A . 806 TYR HD1 1 1 14 10243 1 1 27 TYR HD2 H -0.387 3.447 -7.321 1.00 . A A . 806 TYR HD2 1 1 14 10244 1 1 27 TYR HE1 H 1.913 0.902 -10.845 1.00 . A A . 806 TYR HE1 1 1 14 10245 1 1 27 TYR HE2 H 0.792 4.637 -9.116 1.00 . A A . 806 TYR HE2 1 1 14 10246 1 1 27 TYR HH H 2.557 4.270 -10.709 1.00 . A A . 806 TYR HH 1 1 14 10247 1 1 27 TYR N N 1.347 -0.545 -6.262 1.00 . A A . 806 TYR N 1 1 14 10248 1 1 27 TYR O O -0.955 -1.557 -4.962 1.00 . A A . 806 TYR O 1 1 14 10249 1 1 27 TYR OH O 2.088 3.512 -11.092 1.00 . A A . 806 TYR OH 1 1 14 10250 1 1 28 ALA C C -2.016 0.655 -1.589 1.00 . A A . 807 ALA C 1 1 14 10251 1 1 28 ALA CA C -1.412 -0.395 -2.501 1.00 . A A . 807 ALA CA 1 1 14 10252 1 1 28 ALA CB C -0.399 -1.253 -1.748 1.00 . A A . 807 ALA CB 1 1 14 10253 1 1 28 ALA H H -0.475 1.177 -3.562 1.00 . A A . 807 ALA H 1 1 14 10254 1 1 28 ALA HA H -2.195 -1.037 -2.872 1.00 . A A . 807 ALA HA 1 1 14 10255 1 1 28 ALA HB1 H 0.378 -0.621 -1.342 1.00 . A A . 807 ALA HB1 1 1 14 10256 1 1 28 ALA HB2 H 0.040 -1.969 -2.427 1.00 . A A . 807 ALA HB2 1 1 14 10257 1 1 28 ALA HB3 H -0.895 -1.775 -0.943 1.00 . A A . 807 ALA HB3 1 1 14 10258 1 1 28 ALA N N -0.765 0.237 -3.630 1.00 . A A . 807 ALA N 1 1 14 10259 1 1 28 ALA O O -1.663 1.834 -1.674 1.00 . A A . 807 ALA O 1 1 14 10260 1 1 29 PRO C C -2.516 1.694 1.203 1.00 . A A . 808 PRO C 1 1 14 10261 1 1 29 PRO CA C -3.562 1.154 0.246 1.00 . A A . 808 PRO CA 1 1 14 10262 1 1 29 PRO CB C -4.569 0.272 0.993 1.00 . A A . 808 PRO CB 1 1 14 10263 1 1 29 PRO CD C -3.510 -1.108 -0.639 1.00 . A A . 808 PRO CD 1 1 14 10264 1 1 29 PRO CG C -4.142 -1.129 0.721 1.00 . A A . 808 PRO CG 1 1 14 10265 1 1 29 PRO HA H -4.078 1.975 -0.232 1.00 . A A . 808 PRO HA 1 1 14 10266 1 1 29 PRO HB2 H -4.530 0.496 2.050 1.00 . A A . 808 PRO HB2 1 1 14 10267 1 1 29 PRO HB3 H -5.564 0.460 0.619 1.00 . A A . 808 PRO HB3 1 1 14 10268 1 1 29 PRO HD2 H -2.724 -1.846 -0.702 1.00 . A A . 808 PRO HD2 1 1 14 10269 1 1 29 PRO HD3 H -4.249 -1.277 -1.406 1.00 . A A . 808 PRO HD3 1 1 14 10270 1 1 29 PRO HG2 H -3.425 -1.444 1.462 1.00 . A A . 808 PRO HG2 1 1 14 10271 1 1 29 PRO HG3 H -5.002 -1.783 0.725 1.00 . A A . 808 PRO HG3 1 1 14 10272 1 1 29 PRO N N -2.961 0.253 -0.729 1.00 . A A . 808 PRO N 1 1 14 10273 1 1 29 PRO O O -1.662 0.951 1.686 1.00 . A A . 808 PRO O 1 1 14 10274 1 1 30 ALA C C -1.523 2.944 3.664 1.00 . A A . 809 ALA C 1 1 14 10275 1 1 30 ALA CA C -1.686 3.705 2.352 1.00 . A A . 809 ALA CA 1 1 14 10276 1 1 30 ALA CB C -2.231 5.099 2.627 1.00 . A A . 809 ALA CB 1 1 14 10277 1 1 30 ALA H H -3.211 3.531 0.897 1.00 . A A . 809 ALA H 1 1 14 10278 1 1 30 ALA HA H -0.731 3.820 1.857 1.00 . A A . 809 ALA HA 1 1 14 10279 1 1 30 ALA HB1 H -3.188 5.022 3.124 1.00 . A A . 809 ALA HB1 1 1 14 10280 1 1 30 ALA HB2 H -2.352 5.626 1.693 1.00 . A A . 809 ALA HB2 1 1 14 10281 1 1 30 ALA HB3 H -1.540 5.639 3.257 1.00 . A A . 809 ALA HB3 1 1 14 10282 1 1 30 ALA N N -2.575 3.004 1.424 1.00 . A A . 809 ALA N 1 1 14 10283 1 1 30 ALA O O -0.443 2.886 4.238 1.00 . A A . 809 ALA O 1 1 14 10284 1 1 31 GLU C C -1.770 0.387 5.325 1.00 . A A . 810 GLU C 1 1 14 10285 1 1 31 GLU CA C -2.690 1.610 5.350 1.00 . A A . 810 GLU CA 1 1 14 10286 1 1 31 GLU CB C -4.137 1.182 5.582 1.00 . A A . 810 GLU CB 1 1 14 10287 1 1 31 GLU CD C -4.066 1.774 8.028 1.00 . A A . 810 GLU CD 1 1 14 10288 1 1 31 GLU CG C -4.414 0.721 6.996 1.00 . A A . 810 GLU CG 1 1 14 10289 1 1 31 GLU H H -3.411 2.379 3.522 1.00 . A A . 810 GLU H 1 1 14 10290 1 1 31 GLU HA H -2.386 2.255 6.161 1.00 . A A . 810 GLU HA 1 1 14 10291 1 1 31 GLU HB2 H -4.788 2.016 5.364 1.00 . A A . 810 GLU HB2 1 1 14 10292 1 1 31 GLU HB3 H -4.371 0.370 4.910 1.00 . A A . 810 GLU HB3 1 1 14 10293 1 1 31 GLU HG2 H -5.462 0.484 7.080 1.00 . A A . 810 GLU HG2 1 1 14 10294 1 1 31 GLU HG3 H -3.827 -0.161 7.190 1.00 . A A . 810 GLU HG3 1 1 14 10295 1 1 31 GLU N N -2.622 2.354 4.101 1.00 . A A . 810 GLU N 1 1 14 10296 1 1 31 GLU O O -1.281 -0.066 6.361 1.00 . A A . 810 GLU O 1 1 14 10297 1 1 31 GLU OE1 O -4.708 2.845 8.033 1.00 . A A . 810 GLU OE1 1 1 14 10298 1 1 31 GLU OE2 O -3.142 1.542 8.838 1.00 . A A . 810 GLU OE2 1 1 14 10299 1 1 32 GLN C C 0.739 -0.985 4.038 1.00 . A A . 811 GLN C 1 1 14 10300 1 1 32 GLN CA C -0.735 -1.335 3.955 1.00 . A A . 811 GLN CA 1 1 14 10301 1 1 32 GLN CB C -1.068 -2.006 2.617 1.00 . A A . 811 GLN CB 1 1 14 10302 1 1 32 GLN CD C 0.781 -3.038 1.192 1.00 . A A . 811 GLN CD 1 1 14 10303 1 1 32 GLN CG C -0.230 -3.242 2.310 1.00 . A A . 811 GLN CG 1 1 14 10304 1 1 32 GLN H H -1.904 0.322 3.342 1.00 . A A . 811 GLN H 1 1 14 10305 1 1 32 GLN HA H -0.976 -2.015 4.759 1.00 . A A . 811 GLN HA 1 1 14 10306 1 1 32 GLN HB2 H -2.107 -2.306 2.634 1.00 . A A . 811 GLN HB2 1 1 14 10307 1 1 32 GLN HB3 H -0.929 -1.290 1.821 1.00 . A A . 811 GLN HB3 1 1 14 10308 1 1 32 GLN HE21 H 0.982 -1.116 1.644 1.00 . A A . 811 GLN HE21 1 1 14 10309 1 1 32 GLN HE22 H 1.908 -1.674 0.305 1.00 . A A . 811 GLN HE22 1 1 14 10310 1 1 32 GLN HG2 H 0.303 -3.527 3.206 1.00 . A A . 811 GLN HG2 1 1 14 10311 1 1 32 GLN HG3 H -0.897 -4.040 2.026 1.00 . A A . 811 GLN HG3 1 1 14 10312 1 1 32 GLN N N -1.537 -0.134 4.130 1.00 . A A . 811 GLN N 1 1 14 10313 1 1 32 GLN NE2 N 1.277 -1.821 1.036 1.00 . A A . 811 GLN NE2 1 1 14 10314 1 1 32 GLN O O 1.570 -1.808 4.424 1.00 . A A . 811 GLN O 1 1 14 10315 1 1 32 GLN OE1 O 1.123 -3.977 0.476 1.00 . A A . 811 GLN OE1 1 1 14 10316 1 1 33 PHE C C 2.836 0.976 5.199 1.00 . A A . 812 PHE C 1 1 14 10317 1 1 33 PHE CA C 2.425 0.729 3.752 1.00 . A A . 812 PHE CA 1 1 14 10318 1 1 33 PHE CB C 2.583 2.014 2.936 1.00 . A A . 812 PHE CB 1 1 14 10319 1 1 33 PHE CD1 C 1.334 1.685 0.787 1.00 . A A . 812 PHE CD1 1 1 14 10320 1 1 33 PHE CD2 C 3.714 1.672 0.728 1.00 . A A . 812 PHE CD2 1 1 14 10321 1 1 33 PHE CE1 C 1.297 1.470 -0.576 1.00 . A A . 812 PHE CE1 1 1 14 10322 1 1 33 PHE CE2 C 3.683 1.456 -0.635 1.00 . A A . 812 PHE CE2 1 1 14 10323 1 1 33 PHE CG C 2.540 1.787 1.454 1.00 . A A . 812 PHE CG 1 1 14 10324 1 1 33 PHE CZ C 2.474 1.354 -1.288 1.00 . A A . 812 PHE CZ 1 1 14 10325 1 1 33 PHE H H 0.389 0.815 3.235 1.00 . A A . 812 PHE H 1 1 14 10326 1 1 33 PHE HA H 3.060 -0.026 3.313 1.00 . A A . 812 PHE HA 1 1 14 10327 1 1 33 PHE HB2 H 1.785 2.696 3.192 1.00 . A A . 812 PHE HB2 1 1 14 10328 1 1 33 PHE HB3 H 3.531 2.469 3.176 1.00 . A A . 812 PHE HB3 1 1 14 10329 1 1 33 PHE HD1 H 0.412 1.774 1.343 1.00 . A A . 812 PHE HD1 1 1 14 10330 1 1 33 PHE HD2 H 4.662 1.751 1.239 1.00 . A A . 812 PHE HD2 1 1 14 10331 1 1 33 PHE HE1 H 0.349 1.391 -1.085 1.00 . A A . 812 PHE HE1 1 1 14 10332 1 1 33 PHE HE2 H 4.607 1.366 -1.188 1.00 . A A . 812 PHE HE2 1 1 14 10333 1 1 33 PHE HZ H 2.447 1.185 -2.354 1.00 . A A . 812 PHE HZ 1 1 14 10334 1 1 33 PHE N N 1.063 0.242 3.660 1.00 . A A . 812 PHE N 1 1 14 10335 1 1 33 PHE O O 3.002 2.120 5.626 1.00 . A A . 812 PHE O 1 1 14 10336 1 1 34 ARG C C 5.009 0.344 7.284 1.00 . A A . 813 ARG C 1 1 14 10337 1 1 34 ARG CA C 3.534 -0.046 7.301 1.00 . A A . 813 ARG CA 1 1 14 10338 1 1 34 ARG CB C 3.357 -1.399 8.003 1.00 . A A . 813 ARG CB 1 1 14 10339 1 1 34 ARG CD C 1.780 -3.173 8.848 1.00 . A A . 813 ARG CD 1 1 14 10340 1 1 34 ARG CG C 1.907 -1.839 8.127 1.00 . A A . 813 ARG CG 1 1 14 10341 1 1 34 ARG CZ C 1.797 -3.868 11.222 1.00 . A A . 813 ARG CZ 1 1 14 10342 1 1 34 ARG H H 2.767 -0.981 5.560 1.00 . A A . 813 ARG H 1 1 14 10343 1 1 34 ARG HA H 2.984 0.706 7.847 1.00 . A A . 813 ARG HA 1 1 14 10344 1 1 34 ARG HB2 H 3.894 -2.154 7.447 1.00 . A A . 813 ARG HB2 1 1 14 10345 1 1 34 ARG HB3 H 3.776 -1.333 8.997 1.00 . A A . 813 ARG HB3 1 1 14 10346 1 1 34 ARG HD2 H 0.740 -3.465 8.858 1.00 . A A . 813 ARG HD2 1 1 14 10347 1 1 34 ARG HD3 H 2.355 -3.910 8.309 1.00 . A A . 813 ARG HD3 1 1 14 10348 1 1 34 ARG HE H 2.982 -2.464 10.428 1.00 . A A . 813 ARG HE 1 1 14 10349 1 1 34 ARG HG2 H 1.361 -1.090 8.680 1.00 . A A . 813 ARG HG2 1 1 14 10350 1 1 34 ARG HG3 H 1.488 -1.934 7.135 1.00 . A A . 813 ARG HG3 1 1 14 10351 1 1 34 ARG HH11 H 0.470 -4.881 10.068 1.00 . A A . 813 ARG HH11 1 1 14 10352 1 1 34 ARG HH12 H 0.495 -5.336 11.745 1.00 . A A . 813 ARG HH12 1 1 14 10353 1 1 34 ARG HH21 H 3.035 -3.075 12.618 1.00 . A A . 813 ARG HH21 1 1 14 10354 1 1 34 ARG HH22 H 1.936 -4.290 13.204 1.00 . A A . 813 ARG HH22 1 1 14 10355 1 1 34 ARG N N 3.023 -0.109 5.935 1.00 . A A . 813 ARG N 1 1 14 10356 1 1 34 ARG NE N 2.266 -3.110 10.229 1.00 . A A . 813 ARG NE 1 1 14 10357 1 1 34 ARG NH1 N 0.846 -4.765 10.992 1.00 . A A . 813 ARG NH1 1 1 14 10358 1 1 34 ARG NH2 N 2.299 -3.739 12.443 1.00 . A A . 813 ARG NH2 1 1 14 10359 1 1 34 ARG O O 5.621 0.564 8.328 1.00 . A A . 813 ARG O 1 1 14 10360 1 1 35 GLY C C 6.913 2.465 5.755 1.00 . A A . 814 GLY C 1 1 14 10361 1 1 35 GLY CA C 6.910 0.955 5.920 1.00 . A A . 814 GLY CA 1 1 14 10362 1 1 35 GLY H H 5.048 0.176 5.297 1.00 . A A . 814 GLY H 1 1 14 10363 1 1 35 GLY HA2 H 7.497 0.690 6.787 1.00 . A A . 814 GLY HA2 1 1 14 10364 1 1 35 GLY HA3 H 7.354 0.506 5.042 1.00 . A A . 814 GLY HA3 1 1 14 10365 1 1 35 GLY N N 5.566 0.445 6.082 1.00 . A A . 814 GLY N 1 1 14 10366 1 1 35 GLY O O 7.517 2.993 4.821 1.00 . A A . 814 GLY O 1 1 14 10367 1 1 36 SER C C 5.643 5.165 5.316 1.00 . A A . 815 SER C 1 1 14 10368 1 1 36 SER CA C 6.124 4.612 6.664 1.00 . A A . 815 SER CA 1 1 14 10369 1 1 36 SER CB C 7.477 5.206 7.077 1.00 . A A . 815 SER CB 1 1 14 10370 1 1 36 SER H H 5.702 2.652 7.337 1.00 . A A . 815 SER H 1 1 14 10371 1 1 36 SER HA H 5.361 4.917 7.364 1.00 . A A . 815 SER HA 1 1 14 10372 1 1 36 SER HB2 H 7.842 4.684 7.946 1.00 . A A . 815 SER HB2 1 1 14 10373 1 1 36 SER HB3 H 8.181 5.088 6.267 1.00 . A A . 815 SER HB3 1 1 14 10374 1 1 36 SER HG H 6.824 6.692 8.182 1.00 . A A . 815 SER HG 1 1 14 10375 1 1 36 SER N N 6.193 3.150 6.651 1.00 . A A . 815 SER N 1 1 14 10376 1 1 36 SER O O 6.166 6.157 4.807 1.00 . A A . 815 SER O 1 1 14 10377 1 1 36 SER OG O 7.375 6.585 7.391 1.00 . A A . 815 SER OG 1 1 14 10378 1 1 37 LYS C C 4.656 5.407 2.450 1.00 . A A . 816 LYS C 1 1 14 10379 1 1 37 LYS CA C 3.805 5.006 3.654 1.00 . A A . 816 LYS CA 1 1 14 10380 1 1 37 LYS CB C 2.976 6.214 4.108 1.00 . A A . 816 LYS CB 1 1 14 10381 1 1 37 LYS CD C 1.285 4.911 5.438 1.00 . A A . 816 LYS CD 1 1 14 10382 1 1 37 LYS CE C 0.634 4.712 6.798 1.00 . A A . 816 LYS CE 1 1 14 10383 1 1 37 LYS CG C 2.293 6.043 5.457 1.00 . A A . 816 LYS CG 1 1 14 10384 1 1 37 LYS H H 4.455 3.577 5.078 1.00 . A A . 816 LYS H 1 1 14 10385 1 1 37 LYS HA H 3.144 4.198 3.355 1.00 . A A . 816 LYS HA 1 1 14 10386 1 1 37 LYS HB2 H 3.625 7.075 4.170 1.00 . A A . 816 LYS HB2 1 1 14 10387 1 1 37 LYS HB3 H 2.216 6.405 3.366 1.00 . A A . 816 LYS HB3 1 1 14 10388 1 1 37 LYS HD2 H 0.515 5.140 4.715 1.00 . A A . 816 LYS HD2 1 1 14 10389 1 1 37 LYS HD3 H 1.788 3.998 5.152 1.00 . A A . 816 LYS HD3 1 1 14 10390 1 1 37 LYS HE2 H -0.015 3.852 6.747 1.00 . A A . 816 LYS HE2 1 1 14 10391 1 1 37 LYS HE3 H 1.407 4.534 7.529 1.00 . A A . 816 LYS HE3 1 1 14 10392 1 1 37 LYS HG2 H 3.044 5.828 6.204 1.00 . A A . 816 LYS HG2 1 1 14 10393 1 1 37 LYS HG3 H 1.786 6.964 5.709 1.00 . A A . 816 LYS HG3 1 1 14 10394 1 1 37 LYS HZ1 H -0.974 6.030 6.572 1.00 . A A . 816 LYS HZ1 1 1 14 10395 1 1 37 LYS HZ2 H 0.425 6.755 7.192 1.00 . A A . 816 LYS HZ2 1 1 14 10396 1 1 37 LYS HZ3 H -0.524 5.759 8.185 1.00 . A A . 816 LYS HZ3 1 1 14 10397 1 1 37 LYS N N 4.629 4.489 4.761 1.00 . A A . 816 LYS N 1 1 14 10398 1 1 37 LYS NZ N -0.165 5.894 7.215 1.00 . A A . 816 LYS NZ 1 1 14 10399 1 1 37 LYS O O 4.335 6.361 1.741 1.00 . A A . 816 LYS O 1 1 14 10400 1 1 38 ARG C C 7.199 3.665 0.554 1.00 . A A . 817 ARG C 1 1 14 10401 1 1 38 ARG CA C 6.689 4.955 1.176 1.00 . A A . 817 ARG CA 1 1 14 10402 1 1 38 ARG CB C 7.862 5.756 1.754 1.00 . A A . 817 ARG CB 1 1 14 10403 1 1 38 ARG CD C 8.648 7.931 2.751 1.00 . A A . 817 ARG CD 1 1 14 10404 1 1 38 ARG CG C 7.531 7.220 2.006 1.00 . A A . 817 ARG CG 1 1 14 10405 1 1 38 ARG CZ C 9.906 7.427 4.819 1.00 . A A . 817 ARG CZ 1 1 14 10406 1 1 38 ARG H H 5.861 3.862 2.766 1.00 . A A . 817 ARG H 1 1 14 10407 1 1 38 ARG HA H 6.228 5.533 0.388 1.00 . A A . 817 ARG HA 1 1 14 10408 1 1 38 ARG HB2 H 8.160 5.310 2.690 1.00 . A A . 817 ARG HB2 1 1 14 10409 1 1 38 ARG HB3 H 8.690 5.709 1.062 1.00 . A A . 817 ARG HB3 1 1 14 10410 1 1 38 ARG HD2 H 9.582 7.733 2.247 1.00 . A A . 817 ARG HD2 1 1 14 10411 1 1 38 ARG HD3 H 8.451 8.993 2.739 1.00 . A A . 817 ARG HD3 1 1 14 10412 1 1 38 ARG HE H 7.920 7.214 4.594 1.00 . A A . 817 ARG HE 1 1 14 10413 1 1 38 ARG HG2 H 7.379 7.711 1.057 1.00 . A A . 817 ARG HG2 1 1 14 10414 1 1 38 ARG HG3 H 6.627 7.277 2.591 1.00 . A A . 817 ARG HG3 1 1 14 10415 1 1 38 ARG HH11 H 11.062 8.087 3.279 1.00 . A A . 817 ARG HH11 1 1 14 10416 1 1 38 ARG HH12 H 11.914 7.723 4.751 1.00 . A A . 817 ARG HH12 1 1 14 10417 1 1 38 ARG HH21 H 9.048 6.792 6.546 1.00 . A A . 817 ARG HH21 1 1 14 10418 1 1 38 ARG HH22 H 10.782 6.971 6.591 1.00 . A A . 817 ARG HH22 1 1 14 10419 1 1 38 ARG N N 5.716 4.655 2.220 1.00 . A A . 817 ARG N 1 1 14 10420 1 1 38 ARG NE N 8.757 7.482 4.140 1.00 . A A . 817 ARG NE 1 1 14 10421 1 1 38 ARG NH1 N 11.051 7.774 4.238 1.00 . A A . 817 ARG NH1 1 1 14 10422 1 1 38 ARG NH2 N 9.911 7.038 6.087 1.00 . A A . 817 ARG NH2 1 1 14 10423 1 1 38 ARG O O 7.558 3.637 -0.625 1.00 . A A . 817 ARG O 1 1 14 10424 1 1 39 PHE C C 6.668 0.215 1.315 1.00 . A A . 818 PHE C 1 1 14 10425 1 1 39 PHE CA C 7.616 1.294 0.818 1.00 . A A . 818 PHE CA 1 1 14 10426 1 1 39 PHE CB C 9.060 0.976 1.211 1.00 . A A . 818 PHE CB 1 1 14 10427 1 1 39 PHE CD1 C 10.548 1.880 -0.597 1.00 . A A . 818 PHE CD1 1 1 14 10428 1 1 39 PHE CD2 C 10.491 3.014 1.499 1.00 . A A . 818 PHE CD2 1 1 14 10429 1 1 39 PHE CE1 C 11.469 2.795 -1.070 1.00 . A A . 818 PHE CE1 1 1 14 10430 1 1 39 PHE CE2 C 11.413 3.931 1.033 1.00 . A A . 818 PHE CE2 1 1 14 10431 1 1 39 PHE CG C 10.050 1.980 0.691 1.00 . A A . 818 PHE CG 1 1 14 10432 1 1 39 PHE CZ C 11.854 3.850 -0.288 1.00 . A A . 818 PHE CZ 1 1 14 10433 1 1 39 PHE H H 6.948 2.667 2.274 1.00 . A A . 818 PHE H 1 1 14 10434 1 1 39 PHE HA H 7.546 1.335 -0.259 1.00 . A A . 818 PHE HA 1 1 14 10435 1 1 39 PHE HB2 H 9.141 0.951 2.288 1.00 . A A . 818 PHE HB2 1 1 14 10436 1 1 39 PHE HB3 H 9.324 0.008 0.810 1.00 . A A . 818 PHE HB3 1 1 14 10437 1 1 39 PHE HD1 H 10.208 1.077 -1.235 1.00 . A A . 818 PHE HD1 1 1 14 10438 1 1 39 PHE HD2 H 10.109 3.100 2.506 1.00 . A A . 818 PHE HD2 1 1 14 10439 1 1 39 PHE HE1 H 11.850 2.707 -2.076 1.00 . A A . 818 PHE HE1 1 1 14 10440 1 1 39 PHE HE2 H 11.748 4.733 1.673 1.00 . A A . 818 PHE HE2 1 1 14 10441 1 1 39 PHE HZ H 12.555 4.575 -0.668 1.00 . A A . 818 PHE HZ 1 1 14 10442 1 1 39 PHE N N 7.208 2.590 1.333 1.00 . A A . 818 PHE N 1 1 14 10443 1 1 39 PHE O O 6.268 0.203 2.482 1.00 . A A . 818 PHE O 1 1 14 10444 1 1 40 CYS C C 5.813 -2.798 1.530 1.00 . A A . 819 CYS C 1 1 14 10445 1 1 40 CYS CA C 5.270 -1.659 0.673 1.00 . A A . 819 CYS CA 1 1 14 10446 1 1 40 CYS CB C 4.732 -2.206 -0.653 1.00 . A A . 819 CYS CB 1 1 14 10447 1 1 40 CYS H H 6.804 -0.741 -0.421 1.00 . A A . 819 CYS H 1 1 14 10448 1 1 40 CYS HA H 4.458 -1.165 1.187 1.00 . A A . 819 CYS HA 1 1 14 10449 1 1 40 CYS HB2 H 4.321 -3.185 -0.481 1.00 . A A . 819 CYS HB2 1 1 14 10450 1 1 40 CYS HB3 H 3.953 -1.552 -1.017 1.00 . A A . 819 CYS HB3 1 1 14 10451 1 1 40 CYS N N 6.289 -0.667 0.403 1.00 . A A . 819 CYS N 1 1 14 10452 1 1 40 CYS O O 6.617 -3.587 1.041 1.00 . A A . 819 CYS O 1 1 14 10453 1 1 40 CYS SG S 5.980 -2.364 -1.960 1.00 . A A . 819 CYS SG 1 1 14 10454 1 1 41 SER C C 6.977 -4.026 4.316 1.00 . A A . 820 SER C 1 1 14 10455 1 1 41 SER CA C 5.605 -4.062 3.621 1.00 . A A . 820 SER CA 1 1 14 10456 1 1 41 SER CB C 5.417 -5.353 2.796 1.00 . A A . 820 SER CB 1 1 14 10457 1 1 41 SER H H 5.233 -2.052 3.312 1.00 . A A . 820 SER H 1 1 14 10458 1 1 41 SER HA H 4.808 -4.005 4.349 1.00 . A A . 820 SER HA 1 1 14 10459 1 1 41 SER HB2 H 4.454 -5.326 2.307 1.00 . A A . 820 SER HB2 1 1 14 10460 1 1 41 SER HB3 H 6.198 -5.416 2.050 1.00 . A A . 820 SER HB3 1 1 14 10461 1 1 41 SER HG H 5.070 -7.254 3.161 1.00 . A A . 820 SER HG 1 1 14 10462 1 1 41 SER N N 5.434 -2.857 2.806 1.00 . A A . 820 SER N 1 1 14 10463 1 1 41 SER O O 7.630 -2.975 4.355 1.00 . A A . 820 SER O 1 1 14 10464 1 1 41 SER OG O 5.478 -6.508 3.619 1.00 . A A . 820 SER OG 1 1 14 10465 1 1 42 MET C C 9.872 -5.340 4.616 1.00 . A A . 821 MET C 1 1 14 10466 1 1 42 MET CA C 8.688 -5.232 5.570 1.00 . A A . 821 MET CA 1 1 14 10467 1 1 42 MET CB C 8.675 -6.444 6.509 1.00 . A A . 821 MET CB 1 1 14 10468 1 1 42 MET CE C 6.947 -3.724 8.048 1.00 . A A . 821 MET CE 1 1 14 10469 1 1 42 MET CG C 7.589 -6.408 7.581 1.00 . A A . 821 MET CG 1 1 14 10470 1 1 42 MET H H 6.910 -5.987 4.678 1.00 . A A . 821 MET H 1 1 14 10471 1 1 42 MET HA H 8.789 -4.339 6.171 1.00 . A A . 821 MET HA 1 1 14 10472 1 1 42 MET HB2 H 8.535 -7.336 5.920 1.00 . A A . 821 MET HB2 1 1 14 10473 1 1 42 MET HB3 H 9.634 -6.502 7.006 1.00 . A A . 821 MET HB3 1 1 14 10474 1 1 42 MET HE1 H 7.398 -3.489 7.097 1.00 . A A . 821 MET HE1 1 1 14 10475 1 1 42 MET HE2 H 7.005 -2.862 8.696 1.00 . A A . 821 MET HE2 1 1 14 10476 1 1 42 MET HE3 H 5.913 -3.995 7.900 1.00 . A A . 821 MET HE3 1 1 14 10477 1 1 42 MET HG2 H 6.637 -6.261 7.099 1.00 . A A . 821 MET HG2 1 1 14 10478 1 1 42 MET HG3 H 7.584 -7.360 8.093 1.00 . A A . 821 MET HG3 1 1 14 10479 1 1 42 MET N N 7.432 -5.164 4.821 1.00 . A A . 821 MET N 1 1 14 10480 1 1 42 MET O O 10.733 -4.466 4.586 1.00 . A A . 821 MET O 1 1 14 10481 1 1 42 MET SD S 7.819 -5.097 8.805 1.00 . A A . 821 MET SD 1 1 14 10482 1 1 43 THR C C 11.270 -5.406 2.004 1.00 . A A . 822 THR C 1 1 14 10483 1 1 43 THR CA C 10.878 -6.655 2.793 1.00 . A A . 822 THR CA 1 1 14 10484 1 1 43 THR CB C 10.331 -7.697 1.801 1.00 . A A . 822 THR CB 1 1 14 10485 1 1 43 THR CG2 C 11.430 -8.207 0.886 1.00 . A A . 822 THR CG2 1 1 14 10486 1 1 43 THR H H 9.125 -7.040 3.899 1.00 . A A . 822 THR H 1 1 14 10487 1 1 43 THR HA H 11.781 -7.069 3.218 1.00 . A A . 822 THR HA 1 1 14 10488 1 1 43 THR HB H 9.564 -7.232 1.198 1.00 . A A . 822 THR HB 1 1 14 10489 1 1 43 THR HG1 H 10.189 -9.620 2.262 1.00 . A A . 822 THR HG1 1 1 14 10490 1 1 43 THR HG21 H 11.014 -8.906 0.176 1.00 . A A . 822 THR HG21 1 1 14 10491 1 1 43 THR HG22 H 12.187 -8.701 1.476 1.00 . A A . 822 THR HG22 1 1 14 10492 1 1 43 THR HG23 H 11.872 -7.374 0.357 1.00 . A A . 822 THR HG23 1 1 14 10493 1 1 43 THR N N 9.856 -6.392 3.806 1.00 . A A . 822 THR N 1 1 14 10494 1 1 43 THR O O 12.454 -5.123 1.829 1.00 . A A . 822 THR O 1 1 14 10495 1 1 43 THR OG1 O 9.760 -8.791 2.529 1.00 . A A . 822 THR OG1 1 1 14 10496 1 1 44 CYS C C 11.183 -2.367 1.523 1.00 . A A . 823 CYS C 1 1 14 10497 1 1 44 CYS CA C 10.563 -3.497 0.723 1.00 . A A . 823 CYS CA 1 1 14 10498 1 1 44 CYS CB C 9.293 -3.044 0.034 1.00 . A A . 823 CYS CB 1 1 14 10499 1 1 44 CYS H H 9.369 -4.869 1.794 1.00 . A A . 823 CYS H 1 1 14 10500 1 1 44 CYS HA H 11.258 -3.789 -0.052 1.00 . A A . 823 CYS HA 1 1 14 10501 1 1 44 CYS HB2 H 8.501 -2.959 0.765 1.00 . A A . 823 CYS HB2 1 1 14 10502 1 1 44 CYS HB3 H 9.460 -2.083 -0.428 1.00 . A A . 823 CYS HB3 1 1 14 10503 1 1 44 CYS N N 10.292 -4.658 1.545 1.00 . A A . 823 CYS N 1 1 14 10504 1 1 44 CYS O O 12.189 -1.784 1.104 1.00 . A A . 823 CYS O 1 1 14 10505 1 1 44 CYS SG S 8.747 -4.196 -1.255 1.00 . A A . 823 CYS SG 1 1 14 10506 1 1 45 ALA C C 12.529 -1.312 3.966 1.00 . A A . 824 ALA C 1 1 14 10507 1 1 45 ALA CA C 11.108 -0.994 3.516 1.00 . A A . 824 ALA CA 1 1 14 10508 1 1 45 ALA CB C 10.200 -0.768 4.713 1.00 . A A . 824 ALA CB 1 1 14 10509 1 1 45 ALA H H 9.815 -2.579 2.982 1.00 . A A . 824 ALA H 1 1 14 10510 1 1 45 ALA HA H 11.128 -0.091 2.924 1.00 . A A . 824 ALA HA 1 1 14 10511 1 1 45 ALA HB1 H 10.591 0.042 5.310 1.00 . A A . 824 ALA HB1 1 1 14 10512 1 1 45 ALA HB2 H 10.159 -1.668 5.307 1.00 . A A . 824 ALA HB2 1 1 14 10513 1 1 45 ALA HB3 H 9.208 -0.515 4.370 1.00 . A A . 824 ALA HB3 1 1 14 10514 1 1 45 ALA N N 10.595 -2.059 2.675 1.00 . A A . 824 ALA N 1 1 14 10515 1 1 45 ALA O O 13.399 -0.442 3.973 1.00 . A A . 824 ALA O 1 1 14 10516 1 1 46 LYS C C 15.098 -2.974 3.646 1.00 . A A . 825 LYS C 1 1 14 10517 1 1 46 LYS CA C 14.078 -3.017 4.772 1.00 . A A . 825 LYS CA 1 1 14 10518 1 1 46 LYS CB C 14.018 -4.443 5.330 1.00 . A A . 825 LYS CB 1 1 14 10519 1 1 46 LYS CD C 13.115 -3.584 7.513 1.00 . A A . 825 LYS CD 1 1 14 10520 1 1 46 LYS CE C 14.485 -3.629 8.181 1.00 . A A . 825 LYS CE 1 1 14 10521 1 1 46 LYS CG C 12.988 -4.636 6.432 1.00 . A A . 825 LYS CG 1 1 14 10522 1 1 46 LYS H H 12.019 -3.222 4.334 1.00 . A A . 825 LYS H 1 1 14 10523 1 1 46 LYS HA H 14.405 -2.350 5.555 1.00 . A A . 825 LYS HA 1 1 14 10524 1 1 46 LYS HB2 H 13.780 -5.122 4.525 1.00 . A A . 825 LYS HB2 1 1 14 10525 1 1 46 LYS HB3 H 14.989 -4.700 5.729 1.00 . A A . 825 LYS HB3 1 1 14 10526 1 1 46 LYS HD2 H 12.970 -2.612 7.063 1.00 . A A . 825 LYS HD2 1 1 14 10527 1 1 46 LYS HD3 H 12.352 -3.756 8.255 1.00 . A A . 825 LYS HD3 1 1 14 10528 1 1 46 LYS HE2 H 15.242 -3.471 7.427 1.00 . A A . 825 LYS HE2 1 1 14 10529 1 1 46 LYS HE3 H 14.539 -2.839 8.915 1.00 . A A . 825 LYS HE3 1 1 14 10530 1 1 46 LYS HG2 H 12.001 -4.575 6.001 1.00 . A A . 825 LYS HG2 1 1 14 10531 1 1 46 LYS HG3 H 13.129 -5.612 6.874 1.00 . A A . 825 LYS HG3 1 1 14 10532 1 1 46 LYS HZ1 H 14.690 -5.718 8.163 1.00 . A A . 825 LYS HZ1 1 1 14 10533 1 1 46 LYS HZ2 H 14.024 -5.102 9.594 1.00 . A A . 825 LYS HZ2 1 1 14 10534 1 1 46 LYS HZ3 H 15.682 -4.934 9.295 1.00 . A A . 825 LYS HZ3 1 1 14 10535 1 1 46 LYS N N 12.761 -2.572 4.329 1.00 . A A . 825 LYS N 1 1 14 10536 1 1 46 LYS NZ N 14.739 -4.936 8.853 1.00 . A A . 825 LYS NZ 1 1 14 10537 1 1 46 LYS O O 16.284 -2.783 3.891 1.00 . A A . 825 LYS O 1 1 14 10538 1 1 47 ARG C C 16.107 -1.816 1.000 1.00 . A A . 826 ARG C 1 1 14 10539 1 1 47 ARG CA C 15.573 -3.217 1.298 1.00 . A A . 826 ARG CA 1 1 14 10540 1 1 47 ARG CB C 14.878 -3.826 0.083 1.00 . A A . 826 ARG CB 1 1 14 10541 1 1 47 ARG CD C 15.084 -5.013 -2.108 1.00 . A A . 826 ARG CD 1 1 14 10542 1 1 47 ARG CG C 15.800 -4.148 -1.082 1.00 . A A . 826 ARG CG 1 1 14 10543 1 1 47 ARG CZ C 15.545 -6.084 -4.281 1.00 . A A . 826 ARG CZ 1 1 14 10544 1 1 47 ARG H H 13.694 -3.349 2.264 1.00 . A A . 826 ARG H 1 1 14 10545 1 1 47 ARG HA H 16.374 -3.866 1.620 1.00 . A A . 826 ARG HA 1 1 14 10546 1 1 47 ARG HB2 H 14.390 -4.740 0.388 1.00 . A A . 826 ARG HB2 1 1 14 10547 1 1 47 ARG HB3 H 14.127 -3.133 -0.264 1.00 . A A . 826 ARG HB3 1 1 14 10548 1 1 47 ARG HD2 H 14.870 -5.975 -1.664 1.00 . A A . 826 ARG HD2 1 1 14 10549 1 1 47 ARG HD3 H 14.157 -4.531 -2.379 1.00 . A A . 826 ARG HD3 1 1 14 10550 1 1 47 ARG HE H 16.687 -4.673 -3.426 1.00 . A A . 826 ARG HE 1 1 14 10551 1 1 47 ARG HG2 H 16.108 -3.225 -1.552 1.00 . A A . 826 ARG HG2 1 1 14 10552 1 1 47 ARG HG3 H 16.664 -4.678 -0.715 1.00 . A A . 826 ARG HG3 1 1 14 10553 1 1 47 ARG HH11 H 13.959 -6.877 -3.290 1.00 . A A . 826 ARG HH11 1 1 14 10554 1 1 47 ARG HH12 H 14.255 -7.531 -4.872 1.00 . A A . 826 ARG HH12 1 1 14 10555 1 1 47 ARG HH21 H 17.082 -5.570 -5.502 1.00 . A A . 826 ARG HH21 1 1 14 10556 1 1 47 ARG HH22 H 16.020 -6.807 -6.110 1.00 . A A . 826 ARG HH22 1 1 14 10557 1 1 47 ARG N N 14.649 -3.169 2.415 1.00 . A A . 826 ARG N 1 1 14 10558 1 1 47 ARG NE N 15.877 -5.223 -3.316 1.00 . A A . 826 ARG NE 1 1 14 10559 1 1 47 ARG NH1 N 14.505 -6.895 -4.131 1.00 . A A . 826 ARG NH1 1 1 14 10560 1 1 47 ARG NH2 N 16.274 -6.161 -5.384 1.00 . A A . 826 ARG NH2 1 1 14 10561 1 1 47 ARG O O 17.192 -1.647 0.444 1.00 . A A . 826 ARG O 1 1 14 10562 1 1 48 TYR C C 16.540 0.962 2.518 1.00 . A A . 827 TYR C 1 1 14 10563 1 1 48 TYR CA C 15.745 0.573 1.277 1.00 . A A . 827 TYR CA 1 1 14 10564 1 1 48 TYR CB C 14.539 1.496 1.084 1.00 . A A . 827 TYR CB 1 1 14 10565 1 1 48 TYR CD1 C 15.420 3.658 0.115 1.00 . A A . 827 TYR CD1 1 1 14 10566 1 1 48 TYR CD2 C 14.613 3.681 2.357 1.00 . A A . 827 TYR CD2 1 1 14 10567 1 1 48 TYR CE1 C 15.726 5.003 0.204 1.00 . A A . 827 TYR CE1 1 1 14 10568 1 1 48 TYR CE2 C 14.914 5.029 2.453 1.00 . A A . 827 TYR CE2 1 1 14 10569 1 1 48 TYR CG C 14.860 2.974 1.188 1.00 . A A . 827 TYR CG 1 1 14 10570 1 1 48 TYR CZ C 15.430 5.693 1.381 1.00 . A A . 827 TYR CZ 1 1 14 10571 1 1 48 TYR H H 14.486 -1.030 1.855 1.00 . A A . 827 TYR H 1 1 14 10572 1 1 48 TYR HA H 16.406 0.644 0.427 1.00 . A A . 827 TYR HA 1 1 14 10573 1 1 48 TYR HB2 H 14.116 1.320 0.107 1.00 . A A . 827 TYR HB2 1 1 14 10574 1 1 48 TYR HB3 H 13.800 1.265 1.836 1.00 . A A . 827 TYR HB3 1 1 14 10575 1 1 48 TYR HD1 H 15.621 3.122 -0.799 1.00 . A A . 827 TYR HD1 1 1 14 10576 1 1 48 TYR HD2 H 14.177 3.165 3.197 1.00 . A A . 827 TYR HD2 1 1 14 10577 1 1 48 TYR HE1 H 16.158 5.514 -0.643 1.00 . A A . 827 TYR HE1 1 1 14 10578 1 1 48 TYR HE2 H 14.715 5.561 3.371 1.00 . A A . 827 TYR HE2 1 1 14 10579 1 1 48 TYR HH H 15.457 7.488 0.675 1.00 . A A . 827 TYR HH 1 1 14 10580 1 1 48 TYR N N 15.324 -0.815 1.390 1.00 . A A . 827 TYR N 1 1 14 10581 1 1 48 TYR O O 17.651 1.477 2.408 1.00 . A A . 827 TYR O 1 1 14 10582 1 1 48 TYR OH O 15.780 7.026 1.466 1.00 . A A . 827 TYR OH 1 1 14 10583 1 1 49 ASN C C 17.475 2.139 5.052 1.00 . A A . 828 ASN C 1 1 14 10584 1 1 49 ASN CA C 16.512 0.948 5.021 1.00 . A A . 828 ASN CA 1 1 14 10585 1 1 49 ASN CB C 17.122 -0.323 5.674 1.00 . A A . 828 ASN CB 1 1 14 10586 1 1 49 ASN CG C 18.427 -0.855 5.077 1.00 . A A . 828 ASN CG 1 1 14 10587 1 1 49 ASN H H 15.043 0.284 3.647 1.00 . A A . 828 ASN H 1 1 14 10588 1 1 49 ASN HA H 15.666 1.234 5.632 1.00 . A A . 828 ASN HA 1 1 14 10589 1 1 49 ASN HB2 H 17.312 -0.109 6.713 1.00 . A A . 828 ASN HB2 1 1 14 10590 1 1 49 ASN HB3 H 16.387 -1.114 5.620 1.00 . A A . 828 ASN HB3 1 1 14 10591 1 1 49 ASN HD21 H 17.960 -0.205 3.270 1.00 . A A . 828 ASN HD21 1 1 14 10592 1 1 49 ASN HD22 H 19.474 -1.019 3.409 1.00 . A A . 828 ASN HD22 1 1 14 10593 1 1 49 ASN N N 15.939 0.685 3.684 1.00 . A A . 828 ASN N 1 1 14 10594 1 1 49 ASN ND2 N 18.642 -0.677 3.791 1.00 . A A . 828 ASN ND2 1 1 14 10595 1 1 49 ASN O O 16.985 3.283 5.147 1.00 . A A . 828 ASN O 1 1 14 10596 1 1 49 ASN OXT O 18.704 1.940 5.007 1.00 . A A . 828 ASN OXT 1 1 14 10597 1 1 49 ASN OD1 O 19.241 -1.445 5.793 1.00 . A A . 828 ASN OD1 1 1 14 10598 2 2 1 ZN ZN ZN 8.202 -2.522 -2.641 1.00 . B A . 829 ZN ZN 1 1 15 10599 1 1 1 GLY C C -15.442 -2.648 7.406 1.00 . A A . 1 GLY C 1 1 15 10600 1 1 1 GLY CA C -15.122 -3.589 6.270 1.00 . A A . 1 GLY CA 1 1 15 10601 1 1 1 GLY H1 H -14.187 -2.283 4.952 1.00 . A A . 1 GLY H1 1 1 15 10602 1 1 1 GLY H2 H -13.654 -3.887 4.829 1.00 . A A . 1 GLY H2 1 1 15 10603 1 1 1 GLY H3 H -13.157 -2.929 6.135 1.00 . A A . 1 GLY H3 1 1 15 10604 1 1 1 GLY HA2 H -15.977 -3.649 5.614 1.00 . A A . 1 GLY HA2 1 1 15 10605 1 1 1 GLY HA3 H -14.919 -4.570 6.674 1.00 . A A . 1 GLY HA3 1 1 15 10606 1 1 1 GLY N N -13.949 -3.141 5.490 1.00 . A A . 1 GLY N 1 1 15 10607 1 1 1 GLY O O -15.243 -1.436 7.287 1.00 . A A . 1 GLY O 1 1 15 10608 1 1 2 THR C C -17.517 -1.619 9.559 1.00 . A A . 2 THR C 1 1 15 10609 1 1 2 THR CA C -16.244 -2.458 9.718 1.00 . A A . 2 THR CA 1 1 15 10610 1 1 2 THR CB C -15.059 -1.553 10.122 1.00 . A A . 2 THR CB 1 1 15 10611 1 1 2 THR CG2 C -15.262 -0.969 11.514 1.00 . A A . 2 THR CG2 1 1 15 10612 1 1 2 THR H H -16.116 -4.177 8.498 1.00 . A A . 2 THR H 1 1 15 10613 1 1 2 THR HA H -16.405 -3.174 10.514 1.00 . A A . 2 THR HA 1 1 15 10614 1 1 2 THR HB H -14.988 -0.742 9.412 1.00 . A A . 2 THR HB 1 1 15 10615 1 1 2 THR HG1 H -13.190 -1.909 10.692 1.00 . A A . 2 THR HG1 1 1 15 10616 1 1 2 THR HG21 H -15.327 -1.770 12.236 1.00 . A A . 2 THR HG21 1 1 15 10617 1 1 2 THR HG22 H -16.173 -0.392 11.533 1.00 . A A . 2 THR HG22 1 1 15 10618 1 1 2 THR HG23 H -14.426 -0.331 11.759 1.00 . A A . 2 THR HG23 1 1 15 10619 1 1 2 THR N N -15.943 -3.211 8.505 1.00 . A A . 2 THR N 1 1 15 10620 1 1 2 THR O O -18.436 -1.709 10.373 1.00 . A A . 2 THR O 1 1 15 10621 1 1 2 THR OG1 O -13.837 -2.312 10.090 1.00 . A A . 2 THR OG1 1 1 15 10622 1 1 3 ARG C C -19.127 0.006 6.788 1.00 . A A . 3 ARG C 1 1 15 10623 1 1 3 ARG CA C -18.729 0.044 8.258 1.00 . A A . 3 ARG CA 1 1 15 10624 1 1 3 ARG CB C -18.425 1.484 8.685 1.00 . A A . 3 ARG CB 1 1 15 10625 1 1 3 ARG CD C -16.958 3.512 8.427 1.00 . A A . 3 ARG CD 1 1 15 10626 1 1 3 ARG CG C -17.177 2.061 8.035 1.00 . A A . 3 ARG CG 1 1 15 10627 1 1 3 ARG CZ C -18.090 5.690 8.180 1.00 . A A . 3 ARG CZ 1 1 15 10628 1 1 3 ARG H H -16.822 -0.802 7.870 1.00 . A A . 3 ARG H 1 1 15 10629 1 1 3 ARG HA H -19.552 -0.330 8.848 1.00 . A A . 3 ARG HA 1 1 15 10630 1 1 3 ARG HB2 H -19.265 2.110 8.419 1.00 . A A . 3 ARG HB2 1 1 15 10631 1 1 3 ARG HB3 H -18.293 1.510 9.757 1.00 . A A . 3 ARG HB3 1 1 15 10632 1 1 3 ARG HD2 H -16.952 3.583 9.505 1.00 . A A . 3 ARG HD2 1 1 15 10633 1 1 3 ARG HD3 H -16.002 3.833 8.042 1.00 . A A . 3 ARG HD3 1 1 15 10634 1 1 3 ARG HE H -18.667 3.991 7.285 1.00 . A A . 3 ARG HE 1 1 15 10635 1 1 3 ARG HG2 H -16.322 1.482 8.349 1.00 . A A . 3 ARG HG2 1 1 15 10636 1 1 3 ARG HG3 H -17.282 1.999 6.961 1.00 . A A . 3 ARG HG3 1 1 15 10637 1 1 3 ARG HH11 H -16.531 5.696 9.469 1.00 . A A . 3 ARG HH11 1 1 15 10638 1 1 3 ARG HH12 H -17.302 7.233 9.239 1.00 . A A . 3 ARG HH12 1 1 15 10639 1 1 3 ARG HH21 H -19.698 6.004 6.992 1.00 . A A . 3 ARG HH21 1 1 15 10640 1 1 3 ARG HH22 H -19.108 7.413 7.826 1.00 . A A . 3 ARG HH22 1 1 15 10641 1 1 3 ARG N N -17.576 -0.815 8.505 1.00 . A A . 3 ARG N 1 1 15 10642 1 1 3 ARG NE N -18.001 4.391 7.899 1.00 . A A . 3 ARG NE 1 1 15 10643 1 1 3 ARG NH1 N -17.240 6.248 9.032 1.00 . A A . 3 ARG NH1 1 1 15 10644 1 1 3 ARG NH2 N -19.044 6.424 7.623 1.00 . A A . 3 ARG NH2 1 1 15 10645 1 1 3 ARG O O -19.556 1.014 6.217 1.00 . A A . 3 ARG O 1 1 15 10646 1 1 4 GLY C C -20.808 -1.456 4.548 1.00 . A A . 783 GLY C 1 1 15 10647 1 1 4 GLY CA C -19.319 -1.332 4.783 1.00 . A A . 783 GLY CA 1 1 15 10648 1 1 4 GLY H H -18.659 -1.936 6.699 1.00 . A A . 783 GLY H 1 1 15 10649 1 1 4 GLY HA2 H -18.949 -0.479 4.234 1.00 . A A . 783 GLY HA2 1 1 15 10650 1 1 4 GLY HA3 H -18.833 -2.223 4.415 1.00 . A A . 783 GLY HA3 1 1 15 10651 1 1 4 GLY N N -18.990 -1.166 6.184 1.00 . A A . 783 GLY N 1 1 15 10652 1 1 4 GLY O O -21.312 -2.544 4.267 1.00 . A A . 783 GLY O 1 1 15 10653 1 1 5 VAL C C -23.210 -0.340 2.933 1.00 . A A . 784 VAL C 1 1 15 10654 1 1 5 VAL CA C -22.946 -0.314 4.432 1.00 . A A . 784 VAL CA 1 1 15 10655 1 1 5 VAL CB C -23.595 0.943 5.049 1.00 . A A . 784 VAL CB 1 1 15 10656 1 1 5 VAL CG1 C -25.094 0.959 4.797 1.00 . A A . 784 VAL CG1 1 1 15 10657 1 1 5 VAL CG2 C -23.303 1.019 6.540 1.00 . A A . 784 VAL CG2 1 1 15 10658 1 1 5 VAL H H -21.059 0.474 4.970 1.00 . A A . 784 VAL H 1 1 15 10659 1 1 5 VAL HA H -23.390 -1.189 4.885 1.00 . A A . 784 VAL HA 1 1 15 10660 1 1 5 VAL HB H -23.161 1.815 4.576 1.00 . A A . 784 VAL HB 1 1 15 10661 1 1 5 VAL HG11 H -25.523 1.849 5.234 1.00 . A A . 784 VAL HG11 1 1 15 10662 1 1 5 VAL HG12 H -25.543 0.086 5.246 1.00 . A A . 784 VAL HG12 1 1 15 10663 1 1 5 VAL HG13 H -25.281 0.953 3.733 1.00 . A A . 784 VAL HG13 1 1 15 10664 1 1 5 VAL HG21 H -22.237 1.078 6.695 1.00 . A A . 784 VAL HG21 1 1 15 10665 1 1 5 VAL HG22 H -23.690 0.135 7.026 1.00 . A A . 784 VAL HG22 1 1 15 10666 1 1 5 VAL HG23 H -23.778 1.896 6.956 1.00 . A A . 784 VAL HG23 1 1 15 10667 1 1 5 VAL N N -21.515 -0.345 4.685 1.00 . A A . 784 VAL N 1 1 15 10668 1 1 5 VAL O O -23.900 -1.224 2.426 1.00 . A A . 784 VAL O 1 1 15 10669 1 1 6 ASP C C -21.379 0.672 0.145 1.00 . A A . 785 ASP C 1 1 15 10670 1 1 6 ASP CA C -22.756 0.707 0.784 1.00 . A A . 785 ASP CA 1 1 15 10671 1 1 6 ASP CB C -23.491 1.979 0.345 1.00 . A A . 785 ASP CB 1 1 15 10672 1 1 6 ASP CG C -24.973 1.947 0.650 1.00 . A A . 785 ASP CG 1 1 15 10673 1 1 6 ASP H H -22.121 1.311 2.704 1.00 . A A . 785 ASP H 1 1 15 10674 1 1 6 ASP HA H -23.315 -0.155 0.452 1.00 . A A . 785 ASP HA 1 1 15 10675 1 1 6 ASP HB2 H -23.059 2.828 0.853 1.00 . A A . 785 ASP HB2 1 1 15 10676 1 1 6 ASP HB3 H -23.366 2.104 -0.721 1.00 . A A . 785 ASP HB3 1 1 15 10677 1 1 6 ASP N N -22.640 0.630 2.233 1.00 . A A . 785 ASP N 1 1 15 10678 1 1 6 ASP O O -20.759 1.713 -0.076 1.00 . A A . 785 ASP O 1 1 15 10679 1 1 6 ASP OD1 O -25.670 1.037 0.155 1.00 . A A . 785 ASP OD1 1 1 15 10680 1 1 6 ASP OD2 O -25.449 2.820 1.407 1.00 . A A . 785 ASP OD2 1 1 15 10681 1 1 7 SER C C -19.845 -0.951 -2.283 1.00 . A A . 786 SER C 1 1 15 10682 1 1 7 SER CA C -19.616 -0.686 -0.798 1.00 . A A . 786 SER CA 1 1 15 10683 1 1 7 SER CB C -18.825 -1.830 -0.161 1.00 . A A . 786 SER CB 1 1 15 10684 1 1 7 SER H H -21.402 -1.327 0.134 1.00 . A A . 786 SER H 1 1 15 10685 1 1 7 SER HA H -19.062 0.233 -0.687 1.00 . A A . 786 SER HA 1 1 15 10686 1 1 7 SER HB2 H -19.374 -2.753 -0.278 1.00 . A A . 786 SER HB2 1 1 15 10687 1 1 7 SER HB3 H -17.865 -1.917 -0.647 1.00 . A A . 786 SER HB3 1 1 15 10688 1 1 7 SER HG H -17.987 -2.252 1.570 1.00 . A A . 786 SER HG 1 1 15 10689 1 1 7 SER N N -20.891 -0.525 -0.127 1.00 . A A . 786 SER N 1 1 15 10690 1 1 7 SER O O -20.523 -1.908 -2.656 1.00 . A A . 786 SER O 1 1 15 10691 1 1 7 SER OG O -18.618 -1.596 1.224 1.00 . A A . 786 SER OG 1 1 15 10692 1 1 8 PRO C C -18.680 -1.420 -5.145 1.00 . A A . 787 PRO C 1 1 15 10693 1 1 8 PRO CA C -19.443 -0.215 -4.603 1.00 . A A . 787 PRO CA 1 1 15 10694 1 1 8 PRO CB C -18.849 1.088 -5.154 1.00 . A A . 787 PRO CB 1 1 15 10695 1 1 8 PRO CD C -18.523 1.110 -2.785 1.00 . A A . 787 PRO CD 1 1 15 10696 1 1 8 PRO CG C -18.717 1.999 -3.978 1.00 . A A . 787 PRO CG 1 1 15 10697 1 1 8 PRO HA H -20.482 -0.291 -4.890 1.00 . A A . 787 PRO HA 1 1 15 10698 1 1 8 PRO HB2 H -17.887 0.884 -5.603 1.00 . A A . 787 PRO HB2 1 1 15 10699 1 1 8 PRO HB3 H -19.515 1.501 -5.897 1.00 . A A . 787 PRO HB3 1 1 15 10700 1 1 8 PRO HD2 H -17.478 0.869 -2.656 1.00 . A A . 787 PRO HD2 1 1 15 10701 1 1 8 PRO HD3 H -18.922 1.574 -1.895 1.00 . A A . 787 PRO HD3 1 1 15 10702 1 1 8 PRO HG2 H -17.862 2.647 -4.106 1.00 . A A . 787 PRO HG2 1 1 15 10703 1 1 8 PRO HG3 H -19.618 2.585 -3.865 1.00 . A A . 787 PRO HG3 1 1 15 10704 1 1 8 PRO N N -19.299 -0.082 -3.150 1.00 . A A . 787 PRO N 1 1 15 10705 1 1 8 PRO O O -19.031 -1.979 -6.186 1.00 . A A . 787 PRO O 1 1 15 10706 1 1 9 SER C C -16.643 -3.899 -3.630 1.00 . A A . 788 SER C 1 1 15 10707 1 1 9 SER CA C -16.813 -2.948 -4.810 1.00 . A A . 788 SER CA 1 1 15 10708 1 1 9 SER CB C -15.449 -2.450 -5.292 1.00 . A A . 788 SER CB 1 1 15 10709 1 1 9 SER H H -17.428 -1.338 -3.596 1.00 . A A . 788 SER H 1 1 15 10710 1 1 9 SER HA H -17.308 -3.470 -5.615 1.00 . A A . 788 SER HA 1 1 15 10711 1 1 9 SER HB2 H -14.962 -1.910 -4.493 1.00 . A A . 788 SER HB2 1 1 15 10712 1 1 9 SER HB3 H -14.840 -3.294 -5.583 1.00 . A A . 788 SER HB3 1 1 15 10713 1 1 9 SER HG H -16.048 -2.056 -7.122 1.00 . A A . 788 SER HG 1 1 15 10714 1 1 9 SER N N -17.641 -1.818 -4.423 1.00 . A A . 788 SER N 1 1 15 10715 1 1 9 SER O O -16.619 -3.472 -2.477 1.00 . A A . 788 SER O 1 1 15 10716 1 1 9 SER OG O -15.592 -1.584 -6.408 1.00 . A A . 788 SER OG 1 1 15 10717 1 1 10 ALA C C -14.987 -6.482 -2.523 1.00 . A A . 789 ALA C 1 1 15 10718 1 1 10 ALA CA C -16.440 -6.214 -2.901 1.00 . A A . 789 ALA CA 1 1 15 10719 1 1 10 ALA CB C -17.109 -7.496 -3.377 1.00 . A A . 789 ALA CB 1 1 15 10720 1 1 10 ALA H H -16.515 -5.455 -4.876 1.00 . A A . 789 ALA H 1 1 15 10721 1 1 10 ALA HA H -16.969 -5.863 -2.028 1.00 . A A . 789 ALA HA 1 1 15 10722 1 1 10 ALA HB1 H -16.602 -7.861 -4.260 1.00 . A A . 789 ALA HB1 1 1 15 10723 1 1 10 ALA HB2 H -18.143 -7.295 -3.613 1.00 . A A . 789 ALA HB2 1 1 15 10724 1 1 10 ALA HB3 H -17.056 -8.240 -2.597 1.00 . A A . 789 ALA HB3 1 1 15 10725 1 1 10 ALA N N -16.537 -5.187 -3.931 1.00 . A A . 789 ALA N 1 1 15 10726 1 1 10 ALA O O -14.696 -6.929 -1.412 1.00 . A A . 789 ALA O 1 1 15 10727 1 1 11 GLU C C -12.074 -5.196 -2.492 1.00 . A A . 790 GLU C 1 1 15 10728 1 1 11 GLU CA C -12.657 -6.405 -3.213 1.00 . A A . 790 GLU CA 1 1 15 10729 1 1 11 GLU CB C -11.923 -6.640 -4.531 1.00 . A A . 790 GLU CB 1 1 15 10730 1 1 11 GLU CD C -11.661 -8.099 -6.573 1.00 . A A . 790 GLU CD 1 1 15 10731 1 1 11 GLU CG C -12.306 -7.943 -5.215 1.00 . A A . 790 GLU CG 1 1 15 10732 1 1 11 GLU H H -14.379 -5.885 -4.334 1.00 . A A . 790 GLU H 1 1 15 10733 1 1 11 GLU HA H -12.541 -7.276 -2.585 1.00 . A A . 790 GLU HA 1 1 15 10734 1 1 11 GLU HB2 H -12.145 -5.825 -5.205 1.00 . A A . 790 GLU HB2 1 1 15 10735 1 1 11 GLU HB3 H -10.861 -6.656 -4.339 1.00 . A A . 790 GLU HB3 1 1 15 10736 1 1 11 GLU HG2 H -11.995 -8.766 -4.590 1.00 . A A . 790 GLU HG2 1 1 15 10737 1 1 11 GLU HG3 H -13.380 -7.969 -5.336 1.00 . A A . 790 GLU HG3 1 1 15 10738 1 1 11 GLU N N -14.081 -6.215 -3.455 1.00 . A A . 790 GLU N 1 1 15 10739 1 1 11 GLU O O -11.626 -5.295 -1.351 1.00 . A A . 790 GLU O 1 1 15 10740 1 1 11 GLU OE1 O -10.421 -8.240 -6.636 1.00 . A A . 790 GLU OE1 1 1 15 10741 1 1 11 GLU OE2 O -12.389 -8.091 -7.585 1.00 . A A . 790 GLU OE2 1 1 15 10742 1 1 12 LEU C C -12.726 -2.145 -1.758 1.00 . A A . 791 LEU C 1 1 15 10743 1 1 12 LEU CA C -11.616 -2.814 -2.564 1.00 . A A . 791 LEU CA 1 1 15 10744 1 1 12 LEU CB C -11.050 -1.859 -3.624 1.00 . A A . 791 LEU CB 1 1 15 10745 1 1 12 LEU CD1 C -11.838 -0.199 -5.312 1.00 . A A . 791 LEU CD1 1 1 15 10746 1 1 12 LEU CD2 C -11.445 -2.557 -6.003 1.00 . A A . 791 LEU CD2 1 1 15 10747 1 1 12 LEU CG C -11.911 -1.650 -4.872 1.00 . A A . 791 LEU CG 1 1 15 10748 1 1 12 LEU H H -12.476 -4.035 -4.059 1.00 . A A . 791 LEU H 1 1 15 10749 1 1 12 LEU HA H -10.820 -3.080 -1.885 1.00 . A A . 791 LEU HA 1 1 15 10750 1 1 12 LEU HB2 H -10.898 -0.896 -3.159 1.00 . A A . 791 LEU HB2 1 1 15 10751 1 1 12 LEU HB3 H -10.088 -2.239 -3.940 1.00 . A A . 791 LEU HB3 1 1 15 10752 1 1 12 LEU HD11 H -12.213 0.434 -4.520 1.00 . A A . 791 LEU HD11 1 1 15 10753 1 1 12 LEU HD12 H -12.438 -0.061 -6.199 1.00 . A A . 791 LEU HD12 1 1 15 10754 1 1 12 LEU HD13 H -10.813 0.060 -5.525 1.00 . A A . 791 LEU HD13 1 1 15 10755 1 1 12 LEU HD21 H -11.454 -3.584 -5.673 1.00 . A A . 791 LEU HD21 1 1 15 10756 1 1 12 LEU HD22 H -10.443 -2.281 -6.295 1.00 . A A . 791 LEU HD22 1 1 15 10757 1 1 12 LEU HD23 H -12.107 -2.445 -6.849 1.00 . A A . 791 LEU HD23 1 1 15 10758 1 1 12 LEU HG H -12.939 -1.887 -4.645 1.00 . A A . 791 LEU HG 1 1 15 10759 1 1 12 LEU N N -12.105 -4.050 -3.156 1.00 . A A . 791 LEU N 1 1 15 10760 1 1 12 LEU O O -13.225 -1.074 -2.118 1.00 . A A . 791 LEU O 1 1 15 10761 1 1 13 ASP C C -13.940 -1.003 0.781 1.00 . A A . 792 ASP C 1 1 15 10762 1 1 13 ASP CA C -14.213 -2.381 0.180 1.00 . A A . 792 ASP CA 1 1 15 10763 1 1 13 ASP CB C -14.435 -3.404 1.299 1.00 . A A . 792 ASP CB 1 1 15 10764 1 1 13 ASP CG C -15.542 -3.002 2.256 1.00 . A A . 792 ASP CG 1 1 15 10765 1 1 13 ASP H H -12.653 -3.655 -0.462 1.00 . A A . 792 ASP H 1 1 15 10766 1 1 13 ASP HA H -15.107 -2.326 -0.422 1.00 . A A . 792 ASP HA 1 1 15 10767 1 1 13 ASP HB2 H -14.698 -4.355 0.858 1.00 . A A . 792 ASP HB2 1 1 15 10768 1 1 13 ASP HB3 H -13.520 -3.516 1.861 1.00 . A A . 792 ASP HB3 1 1 15 10769 1 1 13 ASP N N -13.121 -2.821 -0.685 1.00 . A A . 792 ASP N 1 1 15 10770 1 1 13 ASP O O -13.175 -0.874 1.740 1.00 . A A . 792 ASP O 1 1 15 10771 1 1 13 ASP OD1 O -16.719 -3.301 1.973 1.00 . A A . 792 ASP OD1 1 1 15 10772 1 1 13 ASP OD2 O -15.242 -2.358 3.284 1.00 . A A . 792 ASP OD2 1 1 15 10773 1 1 14 LYS C C -13.162 2.047 0.510 1.00 . A A . 793 LYS C 1 1 15 10774 1 1 14 LYS CA C -14.534 1.390 0.672 1.00 . A A . 793 LYS CA 1 1 15 10775 1 1 14 LYS CB C -14.991 1.439 2.135 1.00 . A A . 793 LYS CB 1 1 15 10776 1 1 14 LYS CD C -15.778 2.821 4.074 1.00 . A A . 793 LYS CD 1 1 15 10777 1 1 14 LYS CE C -16.046 4.222 4.593 1.00 . A A . 793 LYS CE 1 1 15 10778 1 1 14 LYS CG C -15.200 2.845 2.668 1.00 . A A . 793 LYS CG 1 1 15 10779 1 1 14 LYS H H -15.016 -0.169 -0.669 1.00 . A A . 793 LYS H 1 1 15 10780 1 1 14 LYS HA H -15.241 1.949 0.078 1.00 . A A . 793 LYS HA 1 1 15 10781 1 1 14 LYS HB2 H -15.924 0.902 2.227 1.00 . A A . 793 LYS HB2 1 1 15 10782 1 1 14 LYS HB3 H -14.247 0.951 2.749 1.00 . A A . 793 LYS HB3 1 1 15 10783 1 1 14 LYS HD2 H -16.707 2.270 4.063 1.00 . A A . 793 LYS HD2 1 1 15 10784 1 1 14 LYS HD3 H -15.074 2.332 4.732 1.00 . A A . 793 LYS HD3 1 1 15 10785 1 1 14 LYS HE2 H -16.424 4.152 5.601 1.00 . A A . 793 LYS HE2 1 1 15 10786 1 1 14 LYS HE3 H -15.116 4.774 4.595 1.00 . A A . 793 LYS HE3 1 1 15 10787 1 1 14 LYS HG2 H -14.251 3.358 2.690 1.00 . A A . 793 LYS HG2 1 1 15 10788 1 1 14 LYS HG3 H -15.883 3.371 2.016 1.00 . A A . 793 LYS HG3 1 1 15 10789 1 1 14 LYS HZ1 H -17.252 5.875 4.187 1.00 . A A . 793 LYS HZ1 1 1 15 10790 1 1 14 LYS HZ2 H -17.921 4.399 3.683 1.00 . A A . 793 LYS HZ2 1 1 15 10791 1 1 14 LYS HZ3 H -16.658 5.104 2.796 1.00 . A A . 793 LYS HZ3 1 1 15 10792 1 1 14 LYS N N -14.547 0.015 0.168 1.00 . A A . 793 LYS N 1 1 15 10793 1 1 14 LYS NZ N -17.037 4.947 3.757 1.00 . A A . 793 LYS NZ 1 1 15 10794 1 1 14 LYS O O -13.007 2.990 -0.269 1.00 . A A . 793 LYS O 1 1 15 10795 1 1 15 LYS C C -10.121 1.721 -0.070 1.00 . A A . 794 LYS C 1 1 15 10796 1 1 15 LYS CA C -10.846 2.113 1.202 1.00 . A A . 794 LYS CA 1 1 15 10797 1 1 15 LYS CB C -10.031 1.712 2.443 1.00 . A A . 794 LYS CB 1 1 15 10798 1 1 15 LYS CD C -9.223 -0.076 4.012 1.00 . A A . 794 LYS CD 1 1 15 10799 1 1 15 LYS CE C -9.339 -1.532 4.433 1.00 . A A . 794 LYS CE 1 1 15 10800 1 1 15 LYS CG C -10.034 0.219 2.757 1.00 . A A . 794 LYS CG 1 1 15 10801 1 1 15 LYS H H -12.334 0.746 1.767 1.00 . A A . 794 LYS H 1 1 15 10802 1 1 15 LYS HA H -10.964 3.185 1.204 1.00 . A A . 794 LYS HA 1 1 15 10803 1 1 15 LYS HB2 H -9.003 2.019 2.294 1.00 . A A . 794 LYS HB2 1 1 15 10804 1 1 15 LYS HB3 H -10.428 2.237 3.299 1.00 . A A . 794 LYS HB3 1 1 15 10805 1 1 15 LYS HD2 H -8.185 0.149 3.819 1.00 . A A . 794 LYS HD2 1 1 15 10806 1 1 15 LYS HD3 H -9.582 0.551 4.816 1.00 . A A . 794 LYS HD3 1 1 15 10807 1 1 15 LYS HE2 H -10.378 -1.759 4.623 1.00 . A A . 794 LYS HE2 1 1 15 10808 1 1 15 LYS HE3 H -8.976 -2.157 3.631 1.00 . A A . 794 LYS HE3 1 1 15 10809 1 1 15 LYS HG2 H -11.052 -0.110 2.907 1.00 . A A . 794 LYS HG2 1 1 15 10810 1 1 15 LYS HG3 H -9.599 -0.316 1.924 1.00 . A A . 794 LYS HG3 1 1 15 10811 1 1 15 LYS HZ1 H -8.776 -2.760 6.031 1.00 . A A . 794 LYS HZ1 1 1 15 10812 1 1 15 LYS HZ2 H -8.762 -1.108 6.402 1.00 . A A . 794 LYS HZ2 1 1 15 10813 1 1 15 LYS HZ3 H -7.523 -1.774 5.454 1.00 . A A . 794 LYS HZ3 1 1 15 10814 1 1 15 LYS N N -12.171 1.541 1.229 1.00 . A A . 794 LYS N 1 1 15 10815 1 1 15 LYS NZ N -8.548 -1.814 5.663 1.00 . A A . 794 LYS NZ 1 1 15 10816 1 1 15 LYS O O -10.127 0.558 -0.479 1.00 . A A . 794 LYS O 1 1 15 10817 1 1 16 ALA C C -7.855 3.706 -2.203 1.00 . A A . 795 ALA C 1 1 15 10818 1 1 16 ALA CA C -8.791 2.534 -1.934 1.00 . A A . 795 ALA CA 1 1 15 10819 1 1 16 ALA CB C -9.780 2.374 -3.081 1.00 . A A . 795 ALA CB 1 1 15 10820 1 1 16 ALA H H -9.534 3.599 -0.264 1.00 . A A . 795 ALA H 1 1 15 10821 1 1 16 ALA HA H -8.206 1.628 -1.866 1.00 . A A . 795 ALA HA 1 1 15 10822 1 1 16 ALA HB1 H -10.368 3.275 -3.179 1.00 . A A . 795 ALA HB1 1 1 15 10823 1 1 16 ALA HB2 H -10.434 1.538 -2.877 1.00 . A A . 795 ALA HB2 1 1 15 10824 1 1 16 ALA HB3 H -9.242 2.195 -3.999 1.00 . A A . 795 ALA HB3 1 1 15 10825 1 1 16 ALA N N -9.496 2.710 -0.675 1.00 . A A . 795 ALA N 1 1 15 10826 1 1 16 ALA O O -7.594 4.059 -3.355 1.00 . A A . 795 ALA O 1 1 15 10827 1 1 17 ASN C C -4.979 4.693 -1.514 1.00 . A A . 796 ASN C 1 1 15 10828 1 1 17 ASN CA C -6.331 5.340 -1.254 1.00 . A A . 796 ASN CA 1 1 15 10829 1 1 17 ASN CB C -6.287 6.246 -0.005 1.00 . A A . 796 ASN CB 1 1 15 10830 1 1 17 ASN CG C -6.422 5.514 1.332 1.00 . A A . 796 ASN CG 1 1 15 10831 1 1 17 ASN H H -7.665 4.048 -0.242 1.00 . A A . 796 ASN H 1 1 15 10832 1 1 17 ASN HA H -6.589 5.944 -2.113 1.00 . A A . 796 ASN HA 1 1 15 10833 1 1 17 ASN HB2 H -5.346 6.775 0.004 1.00 . A A . 796 ASN HB2 1 1 15 10834 1 1 17 ASN HB3 H -7.088 6.968 -0.075 1.00 . A A . 796 ASN HB3 1 1 15 10835 1 1 17 ASN HD21 H -5.430 3.930 0.655 1.00 . A A . 796 ASN HD21 1 1 15 10836 1 1 17 ASN HD22 H -5.983 3.834 2.293 1.00 . A A . 796 ASN HD22 1 1 15 10837 1 1 17 ASN N N -7.349 4.307 -1.133 1.00 . A A . 796 ASN N 1 1 15 10838 1 1 17 ASN ND2 N -5.894 4.303 1.438 1.00 . A A . 796 ASN ND2 1 1 15 10839 1 1 17 ASN O O -4.292 4.246 -0.593 1.00 . A A . 796 ASN O 1 1 15 10840 1 1 17 ASN OD1 O -6.998 6.051 2.275 1.00 . A A . 796 ASN OD1 1 1 15 10841 1 1 18 LEU C C -2.271 4.844 -3.411 1.00 . A A . 797 LEU C 1 1 15 10842 1 1 18 LEU CA C -3.419 3.882 -3.151 1.00 . A A . 797 LEU CA 1 1 15 10843 1 1 18 LEU CB C -3.678 3.042 -4.401 1.00 . A A . 797 LEU CB 1 1 15 10844 1 1 18 LEU CD1 C -5.100 1.423 -5.682 1.00 . A A . 797 LEU CD1 1 1 15 10845 1 1 18 LEU CD2 C -4.857 1.164 -3.209 1.00 . A A . 797 LEU CD2 1 1 15 10846 1 1 18 LEU CG C -4.928 2.156 -4.359 1.00 . A A . 797 LEU CG 1 1 15 10847 1 1 18 LEU H H -5.092 5.069 -3.482 1.00 . A A . 797 LEU H 1 1 15 10848 1 1 18 LEU HA H -3.146 3.229 -2.337 1.00 . A A . 797 LEU HA 1 1 15 10849 1 1 18 LEU HB2 H -3.774 3.715 -5.230 1.00 . A A . 797 LEU HB2 1 1 15 10850 1 1 18 LEU HB3 H -2.819 2.407 -4.571 1.00 . A A . 797 LEU HB3 1 1 15 10851 1 1 18 LEU HD11 H -4.258 0.765 -5.842 1.00 . A A . 797 LEU HD11 1 1 15 10852 1 1 18 LEU HD12 H -5.152 2.141 -6.487 1.00 . A A . 797 LEU HD12 1 1 15 10853 1 1 18 LEU HD13 H -6.012 0.843 -5.657 1.00 . A A . 797 LEU HD13 1 1 15 10854 1 1 18 LEU HD21 H -3.990 0.532 -3.329 1.00 . A A . 797 LEU HD21 1 1 15 10855 1 1 18 LEU HD22 H -5.749 0.553 -3.202 1.00 . A A . 797 LEU HD22 1 1 15 10856 1 1 18 LEU HD23 H -4.783 1.703 -2.276 1.00 . A A . 797 LEU HD23 1 1 15 10857 1 1 18 LEU HG H -5.796 2.780 -4.209 1.00 . A A . 797 LEU HG 1 1 15 10858 1 1 18 LEU N N -4.608 4.601 -2.777 1.00 . A A . 797 LEU N 1 1 15 10859 1 1 18 LEU O O -2.468 5.998 -3.795 1.00 . A A . 797 LEU O 1 1 15 10860 1 1 19 LEU C C 1.125 3.882 -3.778 1.00 . A A . 798 LEU C 1 1 15 10861 1 1 19 LEU CA C 0.163 5.001 -3.486 1.00 . A A . 798 LEU CA 1 1 15 10862 1 1 19 LEU CB C 0.658 5.880 -2.323 1.00 . A A . 798 LEU CB 1 1 15 10863 1 1 19 LEU CD1 C 1.744 6.128 -0.076 1.00 . A A . 798 LEU CD1 1 1 15 10864 1 1 19 LEU CD2 C 0.326 4.132 -0.567 1.00 . A A . 798 LEU CD2 1 1 15 10865 1 1 19 LEU CG C 1.294 5.143 -1.141 1.00 . A A . 798 LEU CG 1 1 15 10866 1 1 19 LEU H H -1.047 3.435 -2.793 1.00 . A A . 798 LEU H 1 1 15 10867 1 1 19 LEU HA H 0.059 5.589 -4.381 1.00 . A A . 798 LEU HA 1 1 15 10868 1 1 19 LEU HB2 H 1.384 6.579 -2.713 1.00 . A A . 798 LEU HB2 1 1 15 10869 1 1 19 LEU HB3 H -0.185 6.443 -1.949 1.00 . A A . 798 LEU HB3 1 1 15 10870 1 1 19 LEU HD11 H 0.893 6.695 0.272 1.00 . A A . 798 LEU HD11 1 1 15 10871 1 1 19 LEU HD12 H 2.477 6.799 -0.498 1.00 . A A . 798 LEU HD12 1 1 15 10872 1 1 19 LEU HD13 H 2.183 5.589 0.750 1.00 . A A . 798 LEU HD13 1 1 15 10873 1 1 19 LEU HD21 H -0.582 4.631 -0.271 1.00 . A A . 798 LEU HD21 1 1 15 10874 1 1 19 LEU HD22 H 0.771 3.644 0.287 1.00 . A A . 798 LEU HD22 1 1 15 10875 1 1 19 LEU HD23 H 0.103 3.398 -1.330 1.00 . A A . 798 LEU HD23 1 1 15 10876 1 1 19 LEU HG H 2.167 4.607 -1.487 1.00 . A A . 798 LEU HG 1 1 15 10877 1 1 19 LEU N N -1.091 4.338 -3.182 1.00 . A A . 798 LEU N 1 1 15 10878 1 1 19 LEU O O 0.709 2.718 -3.738 1.00 . A A . 798 LEU O 1 1 15 10879 1 1 20 LYS C C 4.658 3.165 -4.028 1.00 . A A . 799 LYS C 1 1 15 10880 1 1 20 LYS CA C 3.208 3.040 -4.452 1.00 . A A . 799 LYS CA 1 1 15 10881 1 1 20 LYS CB C 3.091 2.785 -5.953 1.00 . A A . 799 LYS CB 1 1 15 10882 1 1 20 LYS CD C 3.280 5.121 -6.906 1.00 . A A . 799 LYS CD 1 1 15 10883 1 1 20 LYS CE C 4.053 6.021 -7.857 1.00 . A A . 799 LYS CE 1 1 15 10884 1 1 20 LYS CG C 3.892 3.732 -6.839 1.00 . A A . 799 LYS CG 1 1 15 10885 1 1 20 LYS H H 2.728 5.072 -4.027 1.00 . A A . 799 LYS H 1 1 15 10886 1 1 20 LYS HA H 2.797 2.196 -3.921 1.00 . A A . 799 LYS HA 1 1 15 10887 1 1 20 LYS HB2 H 3.415 1.777 -6.159 1.00 . A A . 799 LYS HB2 1 1 15 10888 1 1 20 LYS HB3 H 2.047 2.879 -6.215 1.00 . A A . 799 LYS HB3 1 1 15 10889 1 1 20 LYS HD2 H 2.258 5.040 -7.249 1.00 . A A . 799 LYS HD2 1 1 15 10890 1 1 20 LYS HD3 H 3.296 5.557 -5.920 1.00 . A A . 799 LYS HD3 1 1 15 10891 1 1 20 LYS HE2 H 4.095 5.543 -8.825 1.00 . A A . 799 LYS HE2 1 1 15 10892 1 1 20 LYS HE3 H 3.534 6.964 -7.946 1.00 . A A . 799 LYS HE3 1 1 15 10893 1 1 20 LYS HG2 H 4.892 3.814 -6.442 1.00 . A A . 799 LYS HG2 1 1 15 10894 1 1 20 LYS HG3 H 3.936 3.320 -7.836 1.00 . A A . 799 LYS HG3 1 1 15 10895 1 1 20 LYS HZ1 H 5.424 6.744 -6.454 1.00 . A A . 799 LYS HZ1 1 1 15 10896 1 1 20 LYS HZ2 H 5.943 6.884 -8.062 1.00 . A A . 799 LYS HZ2 1 1 15 10897 1 1 20 LYS HZ3 H 5.964 5.372 -7.296 1.00 . A A . 799 LYS HZ3 1 1 15 10898 1 1 20 LYS N N 2.378 4.153 -4.065 1.00 . A A . 799 LYS N 1 1 15 10899 1 1 20 LYS NZ N 5.440 6.271 -7.384 1.00 . A A . 799 LYS NZ 1 1 15 10900 1 1 20 LYS O O 5.258 4.239 -4.011 1.00 . A A . 799 LYS O 1 1 15 10901 1 1 21 CYS C C 7.548 2.471 -4.111 1.00 . A A . 800 CYS C 1 1 15 10902 1 1 21 CYS CA C 6.521 1.729 -3.254 1.00 . A A . 800 CYS CA 1 1 15 10903 1 1 21 CYS CB C 6.656 0.221 -3.425 1.00 . A A . 800 CYS CB 1 1 15 10904 1 1 21 CYS H H 4.544 1.235 -3.616 1.00 . A A . 800 CYS H 1 1 15 10905 1 1 21 CYS HA H 6.637 1.985 -2.216 1.00 . A A . 800 CYS HA 1 1 15 10906 1 1 21 CYS HB2 H 5.725 -0.237 -3.123 1.00 . A A . 800 CYS HB2 1 1 15 10907 1 1 21 CYS HB3 H 6.812 0.014 -4.473 1.00 . A A . 800 CYS HB3 1 1 15 10908 1 1 21 CYS N N 5.159 1.996 -3.658 1.00 . A A . 800 CYS N 1 1 15 10909 1 1 21 CYS O O 7.773 2.122 -5.262 1.00 . A A . 800 CYS O 1 1 15 10910 1 1 21 CYS SG S 7.952 -0.627 -2.516 1.00 . A A . 800 CYS SG 1 1 15 10911 1 1 22 GLU C C 10.457 3.386 -4.515 1.00 . A A . 801 GLU C 1 1 15 10912 1 1 22 GLU CA C 9.234 4.257 -4.178 1.00 . A A . 801 GLU CA 1 1 15 10913 1 1 22 GLU CB C 9.640 5.410 -3.252 1.00 . A A . 801 GLU CB 1 1 15 10914 1 1 22 GLU CD C 10.949 7.535 -2.922 1.00 . A A . 801 GLU CD 1 1 15 10915 1 1 22 GLU CG C 10.616 6.402 -3.866 1.00 . A A . 801 GLU CG 1 1 15 10916 1 1 22 GLU H H 7.854 3.780 -2.647 1.00 . A A . 801 GLU H 1 1 15 10917 1 1 22 GLU HA H 8.851 4.669 -5.101 1.00 . A A . 801 GLU HA 1 1 15 10918 1 1 22 GLU HB2 H 8.751 5.950 -2.962 1.00 . A A . 801 GLU HB2 1 1 15 10919 1 1 22 GLU HB3 H 10.097 4.993 -2.366 1.00 . A A . 801 GLU HB3 1 1 15 10920 1 1 22 GLU HG2 H 11.529 5.882 -4.117 1.00 . A A . 801 GLU HG2 1 1 15 10921 1 1 22 GLU HG3 H 10.177 6.814 -4.763 1.00 . A A . 801 GLU HG3 1 1 15 10922 1 1 22 GLU N N 8.163 3.489 -3.532 1.00 . A A . 801 GLU N 1 1 15 10923 1 1 22 GLU O O 11.445 3.868 -5.072 1.00 . A A . 801 GLU O 1 1 15 10924 1 1 22 GLU OE1 O 11.629 7.289 -1.903 1.00 . A A . 801 GLU OE1 1 1 15 10925 1 1 22 GLU OE2 O 10.515 8.676 -3.179 1.00 . A A . 801 GLU OE2 1 1 15 10926 1 1 23 TYR C C 11.136 0.338 -5.734 1.00 . A A . 802 TYR C 1 1 15 10927 1 1 23 TYR CA C 11.474 1.192 -4.506 1.00 . A A . 802 TYR CA 1 1 15 10928 1 1 23 TYR CB C 11.797 0.310 -3.292 1.00 . A A . 802 TYR CB 1 1 15 10929 1 1 23 TYR CD1 C 14.270 -0.205 -3.173 1.00 . A A . 802 TYR CD1 1 1 15 10930 1 1 23 TYR CD2 C 12.803 -1.891 -4.001 1.00 . A A . 802 TYR CD2 1 1 15 10931 1 1 23 TYR CE1 C 15.347 -1.047 -3.356 1.00 . A A . 802 TYR CE1 1 1 15 10932 1 1 23 TYR CE2 C 13.876 -2.739 -4.187 1.00 . A A . 802 TYR CE2 1 1 15 10933 1 1 23 TYR CG C 12.979 -0.612 -3.491 1.00 . A A . 802 TYR CG 1 1 15 10934 1 1 23 TYR CZ C 15.155 -2.299 -3.849 1.00 . A A . 802 TYR CZ 1 1 15 10935 1 1 23 TYR H H 9.569 1.763 -3.785 1.00 . A A . 802 TYR H 1 1 15 10936 1 1 23 TYR HA H 12.330 1.796 -4.756 1.00 . A A . 802 TYR HA 1 1 15 10937 1 1 23 TYR HB2 H 12.014 0.944 -2.444 1.00 . A A . 802 TYR HB2 1 1 15 10938 1 1 23 TYR HB3 H 10.934 -0.300 -3.064 1.00 . A A . 802 TYR HB3 1 1 15 10939 1 1 23 TYR HD1 H 14.425 0.787 -2.774 1.00 . A A . 802 TYR HD1 1 1 15 10940 1 1 23 TYR HD2 H 11.807 -2.224 -4.251 1.00 . A A . 802 TYR HD2 1 1 15 10941 1 1 23 TYR HE1 H 16.343 -0.715 -3.102 1.00 . A A . 802 TYR HE1 1 1 15 10942 1 1 23 TYR HE2 H 13.718 -3.731 -4.583 1.00 . A A . 802 TYR HE2 1 1 15 10943 1 1 23 TYR HH H 16.740 -3.179 -3.226 1.00 . A A . 802 TYR HH 1 1 15 10944 1 1 23 TYR N N 10.384 2.103 -4.201 1.00 . A A . 802 TYR N 1 1 15 10945 1 1 23 TYR O O 11.948 0.213 -6.651 1.00 . A A . 802 TYR O 1 1 15 10946 1 1 23 TYR OH O 16.216 -3.151 -4.044 1.00 . A A . 802 TYR OH 1 1 15 10947 1 1 24 CYS C C 8.360 -0.547 -7.659 1.00 . A A . 803 CYS C 1 1 15 10948 1 1 24 CYS CA C 9.545 -1.112 -6.871 1.00 . A A . 803 CYS CA 1 1 15 10949 1 1 24 CYS CB C 9.234 -2.514 -6.355 1.00 . A A . 803 CYS CB 1 1 15 10950 1 1 24 CYS H H 9.337 -0.133 -4.997 1.00 . A A . 803 CYS H 1 1 15 10951 1 1 24 CYS HA H 10.368 -1.162 -7.565 1.00 . A A . 803 CYS HA 1 1 15 10952 1 1 24 CYS HB2 H 8.782 -3.093 -7.148 1.00 . A A . 803 CYS HB2 1 1 15 10953 1 1 24 CYS HB3 H 10.150 -2.986 -6.042 1.00 . A A . 803 CYS HB3 1 1 15 10954 1 1 24 CYS N N 9.944 -0.250 -5.755 1.00 . A A . 803 CYS N 1 1 15 10955 1 1 24 CYS O O 8.242 -0.799 -8.858 1.00 . A A . 803 CYS O 1 1 15 10956 1 1 24 CYS SG S 8.104 -2.530 -4.943 1.00 . A A . 803 CYS SG 1 1 15 10957 1 1 25 GLY C C 5.102 0.187 -7.705 1.00 . A A . 804 GLY C 1 1 15 10958 1 1 25 GLY CA C 6.434 0.907 -7.714 1.00 . A A . 804 GLY CA 1 1 15 10959 1 1 25 GLY H H 7.564 0.289 -6.034 1.00 . A A . 804 GLY H 1 1 15 10960 1 1 25 GLY HA2 H 6.302 1.876 -7.257 1.00 . A A . 804 GLY HA2 1 1 15 10961 1 1 25 GLY HA3 H 6.746 1.050 -8.738 1.00 . A A . 804 GLY HA3 1 1 15 10962 1 1 25 GLY N N 7.488 0.199 -7.003 1.00 . A A . 804 GLY N 1 1 15 10963 1 1 25 GLY O O 4.254 0.449 -8.557 1.00 . A A . 804 GLY O 1 1 15 10964 1 1 26 LYS C C 2.582 -0.601 -5.974 1.00 . A A . 805 LYS C 1 1 15 10965 1 1 26 LYS CA C 3.639 -1.444 -6.669 1.00 . A A . 805 LYS CA 1 1 15 10966 1 1 26 LYS CB C 3.816 -2.785 -5.946 1.00 . A A . 805 LYS CB 1 1 15 10967 1 1 26 LYS CD C 4.186 -4.082 -8.067 1.00 . A A . 805 LYS CD 1 1 15 10968 1 1 26 LYS CE C 3.045 -5.083 -7.993 1.00 . A A . 805 LYS CE 1 1 15 10969 1 1 26 LYS CG C 4.739 -3.742 -6.686 1.00 . A A . 805 LYS CG 1 1 15 10970 1 1 26 LYS H H 5.574 -0.852 -6.059 1.00 . A A . 805 LYS H 1 1 15 10971 1 1 26 LYS HA H 3.316 -1.637 -7.681 1.00 . A A . 805 LYS HA 1 1 15 10972 1 1 26 LYS HB2 H 4.221 -2.604 -4.960 1.00 . A A . 805 LYS HB2 1 1 15 10973 1 1 26 LYS HB3 H 2.850 -3.256 -5.848 1.00 . A A . 805 LYS HB3 1 1 15 10974 1 1 26 LYS HD2 H 3.825 -3.176 -8.530 1.00 . A A . 805 LYS HD2 1 1 15 10975 1 1 26 LYS HD3 H 4.982 -4.499 -8.667 1.00 . A A . 805 LYS HD3 1 1 15 10976 1 1 26 LYS HE2 H 2.415 -4.835 -7.153 1.00 . A A . 805 LYS HE2 1 1 15 10977 1 1 26 LYS HE3 H 2.468 -5.023 -8.905 1.00 . A A . 805 LYS HE3 1 1 15 10978 1 1 26 LYS HG2 H 5.707 -3.279 -6.802 1.00 . A A . 805 LYS HG2 1 1 15 10979 1 1 26 LYS HG3 H 4.836 -4.652 -6.113 1.00 . A A . 805 LYS HG3 1 1 15 10980 1 1 26 LYS HZ1 H 4.024 -6.779 -8.705 1.00 . A A . 805 LYS HZ1 1 1 15 10981 1 1 26 LYS HZ2 H 2.758 -7.125 -7.634 1.00 . A A . 805 LYS HZ2 1 1 15 10982 1 1 26 LYS HZ3 H 4.230 -6.520 -7.044 1.00 . A A . 805 LYS HZ3 1 1 15 10983 1 1 26 LYS N N 4.898 -0.712 -6.747 1.00 . A A . 805 LYS N 1 1 15 10984 1 1 26 LYS NZ N 3.547 -6.470 -7.831 1.00 . A A . 805 LYS NZ 1 1 15 10985 1 1 26 LYS O O 2.829 -0.048 -4.900 1.00 . A A . 805 LYS O 1 1 15 10986 1 1 27 TYR C C -0.460 -0.501 -5.029 1.00 . A A . 806 TYR C 1 1 15 10987 1 1 27 TYR CA C 0.313 0.290 -6.066 1.00 . A A . 806 TYR CA 1 1 15 10988 1 1 27 TYR CB C -0.635 0.710 -7.190 1.00 . A A . 806 TYR CB 1 1 15 10989 1 1 27 TYR CD1 C 0.185 2.814 -8.317 1.00 . A A . 806 TYR CD1 1 1 15 10990 1 1 27 TYR CD2 C 0.519 0.731 -9.425 1.00 . A A . 806 TYR CD2 1 1 15 10991 1 1 27 TYR CE1 C 0.791 3.474 -9.366 1.00 . A A . 806 TYR CE1 1 1 15 10992 1 1 27 TYR CE2 C 1.123 1.383 -10.477 1.00 . A A . 806 TYR CE2 1 1 15 10993 1 1 27 TYR CG C 0.040 1.433 -8.330 1.00 . A A . 806 TYR CG 1 1 15 10994 1 1 27 TYR CZ C 1.256 2.753 -10.444 1.00 . A A . 806 TYR CZ 1 1 15 10995 1 1 27 TYR H H 1.254 -1.056 -7.389 1.00 . A A . 806 TYR H 1 1 15 10996 1 1 27 TYR HA H 0.710 1.175 -5.585 1.00 . A A . 806 TYR HA 1 1 15 10997 1 1 27 TYR HB2 H -1.109 -0.169 -7.596 1.00 . A A . 806 TYR HB2 1 1 15 10998 1 1 27 TYR HB3 H -1.393 1.365 -6.785 1.00 . A A . 806 TYR HB3 1 1 15 10999 1 1 27 TYR HD1 H -0.180 3.373 -7.468 1.00 . A A . 806 TYR HD1 1 1 15 11000 1 1 27 TYR HD2 H 0.413 -0.344 -9.448 1.00 . A A . 806 TYR HD2 1 1 15 11001 1 1 27 TYR HE1 H 0.895 4.547 -9.341 1.00 . A A . 806 TYR HE1 1 1 15 11002 1 1 27 TYR HE2 H 1.489 0.819 -11.323 1.00 . A A . 806 TYR HE2 1 1 15 11003 1 1 27 TYR HH H 1.499 3.036 -12.330 1.00 . A A . 806 TYR HH 1 1 15 11004 1 1 27 TYR N N 1.409 -0.520 -6.585 1.00 . A A . 806 TYR N 1 1 15 11005 1 1 27 TYR O O -0.836 -1.654 -5.261 1.00 . A A . 806 TYR O 1 1 15 11006 1 1 27 TYR OH O 1.850 3.402 -11.499 1.00 . A A . 806 TYR OH 1 1 15 11007 1 1 28 ALA C C -1.820 0.470 -1.758 1.00 . A A . 807 ALA C 1 1 15 11008 1 1 28 ALA CA C -1.262 -0.547 -2.751 1.00 . A A . 807 ALA CA 1 1 15 11009 1 1 28 ALA CB C -0.185 -1.426 -2.124 1.00 . A A . 807 ALA CB 1 1 15 11010 1 1 28 ALA H H -0.462 1.088 -3.826 1.00 . A A . 807 ALA H 1 1 15 11011 1 1 28 ALA HA H -2.064 -1.182 -3.094 1.00 . A A . 807 ALA HA 1 1 15 11012 1 1 28 ALA HB1 H -0.615 -2.008 -1.322 1.00 . A A . 807 ALA HB1 1 1 15 11013 1 1 28 ALA HB2 H 0.605 -0.801 -1.731 1.00 . A A . 807 ALA HB2 1 1 15 11014 1 1 28 ALA HB3 H 0.222 -2.088 -2.875 1.00 . A A . 807 ALA HB3 1 1 15 11015 1 1 28 ALA N N -0.693 0.131 -3.893 1.00 . A A . 807 ALA N 1 1 15 11016 1 1 28 ALA O O -1.520 1.660 -1.860 1.00 . A A . 807 ALA O 1 1 15 11017 1 1 29 PRO C C -2.279 1.474 1.169 1.00 . A A . 808 PRO C 1 1 15 11018 1 1 29 PRO CA C -3.282 0.925 0.172 1.00 . A A . 808 PRO CA 1 1 15 11019 1 1 29 PRO CB C -4.299 0.025 0.893 1.00 . A A . 808 PRO CB 1 1 15 11020 1 1 29 PRO CD C -3.015 -1.369 -0.527 1.00 . A A . 808 PRO CD 1 1 15 11021 1 1 29 PRO CG C -4.376 -1.217 0.074 1.00 . A A . 808 PRO CG 1 1 15 11022 1 1 29 PRO HA H -3.806 1.738 -0.308 1.00 . A A . 808 PRO HA 1 1 15 11023 1 1 29 PRO HB2 H -3.951 -0.185 1.895 1.00 . A A . 808 PRO HB2 1 1 15 11024 1 1 29 PRO HB3 H -5.256 0.526 0.940 1.00 . A A . 808 PRO HB3 1 1 15 11025 1 1 29 PRO HD2 H -2.330 -1.818 0.195 1.00 . A A . 808 PRO HD2 1 1 15 11026 1 1 29 PRO HD3 H -3.054 -1.945 -1.439 1.00 . A A . 808 PRO HD3 1 1 15 11027 1 1 29 PRO HG2 H -4.607 -2.061 0.706 1.00 . A A . 808 PRO HG2 1 1 15 11028 1 1 29 PRO HG3 H -5.122 -1.107 -0.699 1.00 . A A . 808 PRO HG3 1 1 15 11029 1 1 29 PRO N N -2.645 0.029 -0.793 1.00 . A A . 808 PRO N 1 1 15 11030 1 1 29 PRO O O -1.426 0.752 1.670 1.00 . A A . 808 PRO O 1 1 15 11031 1 1 30 ALA C C -1.427 2.688 3.743 1.00 . A A . 809 ALA C 1 1 15 11032 1 1 30 ALA CA C -1.537 3.458 2.415 1.00 . A A . 809 ALA CA 1 1 15 11033 1 1 30 ALA CB C -2.093 4.850 2.670 1.00 . A A . 809 ALA CB 1 1 15 11034 1 1 30 ALA H H -2.989 3.304 0.860 1.00 . A A . 809 ALA H 1 1 15 11035 1 1 30 ALA HA H -0.554 3.575 1.980 1.00 . A A . 809 ALA HA 1 1 15 11036 1 1 30 ALA HB1 H -2.171 5.385 1.735 1.00 . A A . 809 ALA HB1 1 1 15 11037 1 1 30 ALA HB2 H -1.430 5.387 3.335 1.00 . A A . 809 ALA HB2 1 1 15 11038 1 1 30 ALA HB3 H -3.069 4.770 3.124 1.00 . A A . 809 ALA HB3 1 1 15 11039 1 1 30 ALA N N -2.375 2.771 1.417 1.00 . A A . 809 ALA N 1 1 15 11040 1 1 30 ALA O O -0.476 2.874 4.501 1.00 . A A . 809 ALA O 1 1 15 11041 1 1 31 GLU C C -1.288 0.178 5.514 1.00 . A A . 810 GLU C 1 1 15 11042 1 1 31 GLU CA C -2.508 1.065 5.244 1.00 . A A . 810 GLU CA 1 1 15 11043 1 1 31 GLU CB C -3.785 0.222 5.210 1.00 . A A . 810 GLU CB 1 1 15 11044 1 1 31 GLU CD C -5.346 -1.258 6.532 1.00 . A A . 810 GLU CD 1 1 15 11045 1 1 31 GLU CG C -3.931 -0.735 6.379 1.00 . A A . 810 GLU CG 1 1 15 11046 1 1 31 GLU H H -3.125 1.736 3.342 1.00 . A A . 810 GLU H 1 1 15 11047 1 1 31 GLU HA H -2.584 1.754 6.067 1.00 . A A . 810 GLU HA 1 1 15 11048 1 1 31 GLU HB2 H -4.637 0.884 5.209 1.00 . A A . 810 GLU HB2 1 1 15 11049 1 1 31 GLU HB3 H -3.793 -0.357 4.298 1.00 . A A . 810 GLU HB3 1 1 15 11050 1 1 31 GLU HG2 H -3.268 -1.573 6.226 1.00 . A A . 810 GLU HG2 1 1 15 11051 1 1 31 GLU HG3 H -3.653 -0.219 7.285 1.00 . A A . 810 GLU HG3 1 1 15 11052 1 1 31 GLU N N -2.418 1.841 4.008 1.00 . A A . 810 GLU N 1 1 15 11053 1 1 31 GLU O O -0.697 0.267 6.590 1.00 . A A . 810 GLU O 1 1 15 11054 1 1 31 GLU OE1 O -5.834 -1.935 5.600 1.00 . A A . 810 GLU OE1 1 1 15 11055 1 1 31 GLU OE2 O -5.969 -1.012 7.587 1.00 . A A . 810 GLU OE2 1 1 15 11056 1 1 32 GLN C C 1.556 -0.886 4.457 1.00 . A A . 811 GLN C 1 1 15 11057 1 1 32 GLN CA C 0.234 -1.568 4.810 1.00 . A A . 811 GLN CA 1 1 15 11058 1 1 32 GLN CB C 0.087 -2.923 4.091 1.00 . A A . 811 GLN CB 1 1 15 11059 1 1 32 GLN CD C -0.471 -2.063 1.815 1.00 . A A . 811 GLN CD 1 1 15 11060 1 1 32 GLN CG C 0.462 -2.907 2.625 1.00 . A A . 811 GLN CG 1 1 15 11061 1 1 32 GLN H H -1.318 -0.658 3.682 1.00 . A A . 811 GLN H 1 1 15 11062 1 1 32 GLN HA H 0.288 -1.756 5.863 1.00 . A A . 811 GLN HA 1 1 15 11063 1 1 32 GLN HB2 H 0.717 -3.645 4.588 1.00 . A A . 811 GLN HB2 1 1 15 11064 1 1 32 GLN HB3 H -0.940 -3.244 4.172 1.00 . A A . 811 GLN HB3 1 1 15 11065 1 1 32 GLN HE21 H 1.039 -1.481 0.686 1.00 . A A . 811 GLN HE21 1 1 15 11066 1 1 32 GLN HE22 H -0.499 -0.804 0.296 1.00 . A A . 811 GLN HE22 1 1 15 11067 1 1 32 GLN HG2 H 1.461 -2.510 2.523 1.00 . A A . 811 GLN HG2 1 1 15 11068 1 1 32 GLN HG3 H 0.434 -3.919 2.246 1.00 . A A . 811 GLN HG3 1 1 15 11069 1 1 32 GLN N N -0.892 -0.669 4.567 1.00 . A A . 811 GLN N 1 1 15 11070 1 1 32 GLN NE2 N 0.076 -1.389 0.831 1.00 . A A . 811 GLN NE2 1 1 15 11071 1 1 32 GLN O O 2.567 -1.540 4.210 1.00 . A A . 811 GLN O 1 1 15 11072 1 1 32 GLN OE1 O -1.665 -1.986 2.100 1.00 . A A . 811 GLN OE1 1 1 15 11073 1 1 33 PHE C C 3.286 1.579 5.731 1.00 . A A . 812 PHE C 1 1 15 11074 1 1 33 PHE CA C 2.768 1.218 4.342 1.00 . A A . 812 PHE CA 1 1 15 11075 1 1 33 PHE CB C 2.550 2.464 3.479 1.00 . A A . 812 PHE CB 1 1 15 11076 1 1 33 PHE CD1 C 1.872 1.328 1.341 1.00 . A A . 812 PHE CD1 1 1 15 11077 1 1 33 PHE CD2 C 3.679 2.880 1.281 1.00 . A A . 812 PHE CD2 1 1 15 11078 1 1 33 PHE CE1 C 2.018 1.103 -0.015 1.00 . A A . 812 PHE CE1 1 1 15 11079 1 1 33 PHE CE2 C 3.828 2.660 -0.075 1.00 . A A . 812 PHE CE2 1 1 15 11080 1 1 33 PHE CG C 2.701 2.217 2.004 1.00 . A A . 812 PHE CG 1 1 15 11081 1 1 33 PHE CZ C 2.997 1.770 -0.724 1.00 . A A . 812 PHE CZ 1 1 15 11082 1 1 33 PHE H H 0.715 0.902 4.722 1.00 . A A . 812 PHE H 1 1 15 11083 1 1 33 PHE HA H 3.509 0.581 3.881 1.00 . A A . 812 PHE HA 1 1 15 11084 1 1 33 PHE HB2 H 1.552 2.840 3.651 1.00 . A A . 812 PHE HB2 1 1 15 11085 1 1 33 PHE HB3 H 3.267 3.220 3.767 1.00 . A A . 812 PHE HB3 1 1 15 11086 1 1 33 PHE HD1 H 1.107 0.805 1.895 1.00 . A A . 812 PHE HD1 1 1 15 11087 1 1 33 PHE HD2 H 4.330 3.578 1.787 1.00 . A A . 812 PHE HD2 1 1 15 11088 1 1 33 PHE HE1 H 1.365 0.407 -0.519 1.00 . A A . 812 PHE HE1 1 1 15 11089 1 1 33 PHE HE2 H 4.596 3.184 -0.626 1.00 . A A . 812 PHE HE2 1 1 15 11090 1 1 33 PHE HZ H 3.111 1.596 -1.783 1.00 . A A . 812 PHE HZ 1 1 15 11091 1 1 33 PHE N N 1.547 0.440 4.487 1.00 . A A . 812 PHE N 1 1 15 11092 1 1 33 PHE O O 3.510 2.745 6.061 1.00 . A A . 812 PHE O 1 1 15 11093 1 1 34 ARG C C 5.441 0.930 7.934 1.00 . A A . 813 ARG C 1 1 15 11094 1 1 34 ARG CA C 3.944 0.642 7.903 1.00 . A A . 813 ARG CA 1 1 15 11095 1 1 34 ARG CB C 3.682 -0.672 8.641 1.00 . A A . 813 ARG CB 1 1 15 11096 1 1 34 ARG CD C 2.025 -2.388 9.418 1.00 . A A . 813 ARG CD 1 1 15 11097 1 1 34 ARG CG C 2.210 -1.009 8.804 1.00 . A A . 813 ARG CG 1 1 15 11098 1 1 34 ARG CZ C 3.271 -4.441 8.820 1.00 . A A . 813 ARG CZ 1 1 15 11099 1 1 34 ARG H H 3.199 -0.343 6.193 1.00 . A A . 813 ARG H 1 1 15 11100 1 1 34 ARG HA H 3.422 1.438 8.412 1.00 . A A . 813 ARG HA 1 1 15 11101 1 1 34 ARG HB2 H 4.154 -1.476 8.098 1.00 . A A . 813 ARG HB2 1 1 15 11102 1 1 34 ARG HB3 H 4.124 -0.610 9.626 1.00 . A A . 813 ARG HB3 1 1 15 11103 1 1 34 ARG HD2 H 2.624 -2.452 10.314 1.00 . A A . 813 ARG HD2 1 1 15 11104 1 1 34 ARG HD3 H 0.983 -2.516 9.672 1.00 . A A . 813 ARG HD3 1 1 15 11105 1 1 34 ARG HE H 2.009 -3.466 7.612 1.00 . A A . 813 ARG HE 1 1 15 11106 1 1 34 ARG HG2 H 1.751 -0.273 9.445 1.00 . A A . 813 ARG HG2 1 1 15 11107 1 1 34 ARG HG3 H 1.738 -0.990 7.833 1.00 . A A . 813 ARG HG3 1 1 15 11108 1 1 34 ARG HH11 H 3.743 -3.689 10.648 1.00 . A A . 813 ARG HH11 1 1 15 11109 1 1 34 ARG HH12 H 4.538 -5.181 10.227 1.00 . A A . 813 ARG HH12 1 1 15 11110 1 1 34 ARG HH21 H 3.042 -5.407 7.049 1.00 . A A . 813 ARG HH21 1 1 15 11111 1 1 34 ARG HH22 H 4.126 -6.168 8.180 1.00 . A A . 813 ARG HH22 1 1 15 11112 1 1 34 ARG N N 3.448 0.538 6.534 1.00 . A A . 813 ARG N 1 1 15 11113 1 1 34 ARG NE N 2.425 -3.460 8.504 1.00 . A A . 813 ARG NE 1 1 15 11114 1 1 34 ARG NH1 N 3.899 -4.437 9.991 1.00 . A A . 813 ARG NH1 1 1 15 11115 1 1 34 ARG NH2 N 3.504 -5.415 7.948 1.00 . A A . 813 ARG NH2 1 1 15 11116 1 1 34 ARG O O 6.192 0.484 7.064 1.00 . A A . 813 ARG O 1 1 15 11117 1 1 35 GLY C C 7.645 3.209 8.246 1.00 . A A . 814 GLY C 1 1 15 11118 1 1 35 GLY CA C 7.265 2.019 9.097 1.00 . A A . 814 GLY CA 1 1 15 11119 1 1 35 GLY H H 5.206 2.032 9.591 1.00 . A A . 814 GLY H 1 1 15 11120 1 1 35 GLY HA2 H 7.462 2.248 10.135 1.00 . A A . 814 GLY HA2 1 1 15 11121 1 1 35 GLY HA3 H 7.865 1.170 8.803 1.00 . A A . 814 GLY HA3 1 1 15 11122 1 1 35 GLY N N 5.865 1.681 8.946 1.00 . A A . 814 GLY N 1 1 15 11123 1 1 35 GLY O O 7.922 4.293 8.756 1.00 . A A . 814 GLY O 1 1 15 11124 1 1 36 SER C C 6.811 4.194 4.991 1.00 . A A . 815 SER C 1 1 15 11125 1 1 36 SER CA C 7.949 4.050 5.994 1.00 . A A . 815 SER CA 1 1 15 11126 1 1 36 SER CB C 9.258 3.729 5.264 1.00 . A A . 815 SER CB 1 1 15 11127 1 1 36 SER H H 7.400 2.111 6.607 1.00 . A A . 815 SER H 1 1 15 11128 1 1 36 SER HA H 8.059 4.978 6.532 1.00 . A A . 815 SER HA 1 1 15 11129 1 1 36 SER HB2 H 9.123 2.845 4.659 1.00 . A A . 815 SER HB2 1 1 15 11130 1 1 36 SER HB3 H 9.525 4.561 4.628 1.00 . A A . 815 SER HB3 1 1 15 11131 1 1 36 SER HG H 10.046 3.775 7.067 1.00 . A A . 815 SER HG 1 1 15 11132 1 1 36 SER N N 7.638 3.002 6.944 1.00 . A A . 815 SER N 1 1 15 11133 1 1 36 SER O O 6.539 3.276 4.214 1.00 . A A . 815 SER O 1 1 15 11134 1 1 36 SER OG O 10.317 3.496 6.179 1.00 . A A . 815 SER OG 1 1 15 11135 1 1 37 LYS C C 5.713 5.983 2.704 1.00 . A A . 816 LYS C 1 1 15 11136 1 1 37 LYS CA C 5.084 5.645 4.055 1.00 . A A . 816 LYS CA 1 1 15 11137 1 1 37 LYS CB C 4.231 6.807 4.575 1.00 . A A . 816 LYS CB 1 1 15 11138 1 1 37 LYS CD C 1.985 5.816 3.993 1.00 . A A . 816 LYS CD 1 1 15 11139 1 1 37 LYS CE C 1.641 5.544 5.454 1.00 . A A . 816 LYS CE 1 1 15 11140 1 1 37 LYS CG C 2.916 7.008 3.831 1.00 . A A . 816 LYS CG 1 1 15 11141 1 1 37 LYS H H 6.401 6.032 5.671 1.00 . A A . 816 LYS H 1 1 15 11142 1 1 37 LYS HA H 4.466 4.764 3.951 1.00 . A A . 816 LYS HA 1 1 15 11143 1 1 37 LYS HB2 H 4.006 6.621 5.611 1.00 . A A . 816 LYS HB2 1 1 15 11144 1 1 37 LYS HB3 H 4.805 7.721 4.501 1.00 . A A . 816 LYS HB3 1 1 15 11145 1 1 37 LYS HD2 H 1.071 6.014 3.454 1.00 . A A . 816 LYS HD2 1 1 15 11146 1 1 37 LYS HD3 H 2.464 4.941 3.578 1.00 . A A . 816 LYS HD3 1 1 15 11147 1 1 37 LYS HE2 H 1.047 4.644 5.507 1.00 . A A . 816 LYS HE2 1 1 15 11148 1 1 37 LYS HE3 H 2.560 5.400 6.006 1.00 . A A . 816 LYS HE3 1 1 15 11149 1 1 37 LYS HG2 H 2.426 7.887 4.219 1.00 . A A . 816 LYS HG2 1 1 15 11150 1 1 37 LYS HG3 H 3.127 7.148 2.780 1.00 . A A . 816 LYS HG3 1 1 15 11151 1 1 37 LYS HZ1 H 0.010 6.859 5.516 1.00 . A A . 816 LYS HZ1 1 1 15 11152 1 1 37 LYS HZ2 H 1.456 7.528 6.110 1.00 . A A . 816 LYS HZ2 1 1 15 11153 1 1 37 LYS HZ3 H 0.593 6.405 7.043 1.00 . A A . 816 LYS HZ3 1 1 15 11154 1 1 37 LYS N N 6.149 5.347 5.010 1.00 . A A . 816 LYS N 1 1 15 11155 1 1 37 LYS NZ N 0.873 6.661 6.071 1.00 . A A . 816 LYS NZ 1 1 15 11156 1 1 37 LYS O O 5.505 7.056 2.136 1.00 . A A . 816 LYS O 1 1 15 11157 1 1 38 ARG C C 7.380 3.906 0.261 1.00 . A A . 817 ARG C 1 1 15 11158 1 1 38 ARG CA C 7.355 5.205 1.057 1.00 . A A . 817 ARG CA 1 1 15 11159 1 1 38 ARG CB C 8.789 5.499 1.510 1.00 . A A . 817 ARG CB 1 1 15 11160 1 1 38 ARG CD C 10.365 6.862 2.895 1.00 . A A . 817 ARG CD 1 1 15 11161 1 1 38 ARG CG C 8.938 6.728 2.390 1.00 . A A . 817 ARG CG 1 1 15 11162 1 1 38 ARG CZ C 11.736 8.440 4.194 1.00 . A A . 817 ARG CZ 1 1 15 11163 1 1 38 ARG H H 6.574 4.186 2.694 1.00 . A A . 817 ARG H 1 1 15 11164 1 1 38 ARG HA H 7.031 6.010 0.412 1.00 . A A . 817 ARG HA 1 1 15 11165 1 1 38 ARG HB2 H 9.157 4.646 2.062 1.00 . A A . 817 ARG HB2 1 1 15 11166 1 1 38 ARG HB3 H 9.405 5.635 0.633 1.00 . A A . 817 ARG HB3 1 1 15 11167 1 1 38 ARG HD2 H 10.618 5.974 3.456 1.00 . A A . 817 ARG HD2 1 1 15 11168 1 1 38 ARG HD3 H 11.026 6.946 2.044 1.00 . A A . 817 ARG HD3 1 1 15 11169 1 1 38 ARG HE H 9.740 8.530 4.017 1.00 . A A . 817 ARG HE 1 1 15 11170 1 1 38 ARG HG2 H 8.684 7.606 1.814 1.00 . A A . 817 ARG HG2 1 1 15 11171 1 1 38 ARG HG3 H 8.270 6.641 3.234 1.00 . A A . 817 ARG HG3 1 1 15 11172 1 1 38 ARG HH11 H 12.784 6.991 3.245 1.00 . A A . 817 ARG HH11 1 1 15 11173 1 1 38 ARG HH12 H 13.734 8.109 4.171 1.00 . A A . 817 ARG HH12 1 1 15 11174 1 1 38 ARG HH21 H 10.997 10.016 5.241 1.00 . A A . 817 ARG HH21 1 1 15 11175 1 1 38 ARG HH22 H 12.723 9.808 5.314 1.00 . A A . 817 ARG HH22 1 1 15 11176 1 1 38 ARG N N 6.510 5.046 2.225 1.00 . A A . 817 ARG N 1 1 15 11177 1 1 38 ARG NE N 10.548 8.027 3.755 1.00 . A A . 817 ARG NE 1 1 15 11178 1 1 38 ARG NH1 N 12.838 7.792 3.843 1.00 . A A . 817 ARG NH1 1 1 15 11179 1 1 38 ARG NH2 N 11.826 9.507 4.976 1.00 . A A . 817 ARG NH2 1 1 15 11180 1 1 38 ARG O O 7.457 3.922 -0.961 1.00 . A A . 817 ARG O 1 1 15 11181 1 1 39 PHE C C 6.387 0.535 0.857 1.00 . A A . 818 PHE C 1 1 15 11182 1 1 39 PHE CA C 7.482 1.461 0.368 1.00 . A A . 818 PHE CA 1 1 15 11183 1 1 39 PHE CB C 8.836 0.884 0.777 1.00 . A A . 818 PHE CB 1 1 15 11184 1 1 39 PHE CD1 C 10.439 2.284 -0.548 1.00 . A A . 818 PHE CD1 1 1 15 11185 1 1 39 PHE CD2 C 10.548 2.385 1.834 1.00 . A A . 818 PHE CD2 1 1 15 11186 1 1 39 PHE CE1 C 11.482 3.182 -0.636 1.00 . A A . 818 PHE CE1 1 1 15 11187 1 1 39 PHE CE2 C 11.594 3.282 1.750 1.00 . A A . 818 PHE CE2 1 1 15 11188 1 1 39 PHE CG C 9.959 1.875 0.686 1.00 . A A . 818 PHE CG 1 1 15 11189 1 1 39 PHE CZ C 12.014 3.735 0.522 1.00 . A A . 818 PHE CZ 1 1 15 11190 1 1 39 PHE H H 7.090 2.824 1.927 1.00 . A A . 818 PHE H 1 1 15 11191 1 1 39 PHE HA H 7.459 1.554 -0.704 1.00 . A A . 818 PHE HA 1 1 15 11192 1 1 39 PHE HB2 H 8.770 0.538 1.789 1.00 . A A . 818 PHE HB2 1 1 15 11193 1 1 39 PHE HB3 H 9.074 0.050 0.131 1.00 . A A . 818 PHE HB3 1 1 15 11194 1 1 39 PHE HD1 H 9.989 1.894 -1.448 1.00 . A A . 818 PHE HD1 1 1 15 11195 1 1 39 PHE HD2 H 10.184 2.072 2.803 1.00 . A A . 818 PHE HD2 1 1 15 11196 1 1 39 PHE HE1 H 11.848 3.494 -1.603 1.00 . A A . 818 PHE HE1 1 1 15 11197 1 1 39 PHE HE2 H 12.046 3.673 2.650 1.00 . A A . 818 PHE HE2 1 1 15 11198 1 1 39 PHE HZ H 12.814 4.458 0.459 1.00 . A A . 818 PHE HZ 1 1 15 11199 1 1 39 PHE N N 7.301 2.779 0.970 1.00 . A A . 818 PHE N 1 1 15 11200 1 1 39 PHE O O 5.939 0.665 1.997 1.00 . A A . 818 PHE O 1 1 15 11201 1 1 40 CYS C C 5.364 -2.316 1.417 1.00 . A A . 819 CYS C 1 1 15 11202 1 1 40 CYS CA C 4.864 -1.256 0.429 1.00 . A A . 819 CYS CA 1 1 15 11203 1 1 40 CYS CB C 4.227 -1.906 -0.804 1.00 . A A . 819 CYS CB 1 1 15 11204 1 1 40 CYS H H 6.409 -0.569 -0.816 1.00 . A A . 819 CYS H 1 1 15 11205 1 1 40 CYS HA H 4.115 -0.641 0.904 1.00 . A A . 819 CYS HA 1 1 15 11206 1 1 40 CYS HB2 H 3.714 -2.796 -0.497 1.00 . A A . 819 CYS HB2 1 1 15 11207 1 1 40 CYS HB3 H 3.513 -1.219 -1.234 1.00 . A A . 819 CYS HB3 1 1 15 11208 1 1 40 CYS N N 5.938 -0.386 0.020 1.00 . A A . 819 CYS N 1 1 15 11209 1 1 40 CYS O O 6.019 -3.279 1.015 1.00 . A A . 819 CYS O 1 1 15 11210 1 1 40 CYS SG S 5.390 -2.382 -2.107 1.00 . A A . 819 CYS SG 1 1 15 11211 1 1 41 SER C C 6.566 -3.280 4.299 1.00 . A A . 820 SER C 1 1 15 11212 1 1 41 SER CA C 5.143 -3.152 3.720 1.00 . A A . 820 SER CA 1 1 15 11213 1 1 41 SER CB C 4.627 -4.487 3.157 1.00 . A A . 820 SER CB 1 1 15 11214 1 1 41 SER H H 5.062 -1.180 3.030 1.00 . A A . 820 SER H 1 1 15 11215 1 1 41 SER HA H 4.461 -2.812 4.486 1.00 . A A . 820 SER HA 1 1 15 11216 1 1 41 SER HB2 H 3.665 -4.326 2.691 1.00 . A A . 820 SER HB2 1 1 15 11217 1 1 41 SER HB3 H 5.325 -4.853 2.419 1.00 . A A . 820 SER HB3 1 1 15 11218 1 1 41 SER HG H 4.301 -6.328 3.755 1.00 . A A . 820 SER HG 1 1 15 11219 1 1 41 SER N N 5.099 -2.101 2.703 1.00 . A A . 820 SER N 1 1 15 11220 1 1 41 SER O O 7.354 -2.334 4.231 1.00 . A A . 820 SER O 1 1 15 11221 1 1 41 SER OG O 4.480 -5.470 4.171 1.00 . A A . 820 SER OG 1 1 15 11222 1 1 42 MET C C 9.331 -4.939 4.623 1.00 . A A . 821 MET C 1 1 15 11223 1 1 42 MET CA C 8.162 -4.646 5.550 1.00 . A A . 821 MET CA 1 1 15 11224 1 1 42 MET CB C 8.009 -5.788 6.549 1.00 . A A . 821 MET CB 1 1 15 11225 1 1 42 MET CE C 8.487 -3.049 8.481 1.00 . A A . 821 MET CE 1 1 15 11226 1 1 42 MET CG C 7.162 -5.418 7.753 1.00 . A A . 821 MET CG 1 1 15 11227 1 1 42 MET H H 6.285 -5.212 4.728 1.00 . A A . 821 MET H 1 1 15 11228 1 1 42 MET HA H 8.364 -3.749 6.114 1.00 . A A . 821 MET HA 1 1 15 11229 1 1 42 MET HB2 H 7.545 -6.627 6.052 1.00 . A A . 821 MET HB2 1 1 15 11230 1 1 42 MET HB3 H 8.986 -6.080 6.899 1.00 . A A . 821 MET HB3 1 1 15 11231 1 1 42 MET HE1 H 9.203 -3.124 7.678 1.00 . A A . 821 MET HE1 1 1 15 11232 1 1 42 MET HE2 H 8.900 -2.447 9.277 1.00 . A A . 821 MET HE2 1 1 15 11233 1 1 42 MET HE3 H 7.582 -2.587 8.115 1.00 . A A . 821 MET HE3 1 1 15 11234 1 1 42 MET HG2 H 6.427 -4.699 7.431 1.00 . A A . 821 MET HG2 1 1 15 11235 1 1 42 MET HG3 H 6.664 -6.305 8.113 1.00 . A A . 821 MET HG3 1 1 15 11236 1 1 42 MET N N 6.905 -4.453 4.825 1.00 . A A . 821 MET N 1 1 15 11237 1 1 42 MET O O 10.304 -4.198 4.604 1.00 . A A . 821 MET O 1 1 15 11238 1 1 42 MET SD S 8.111 -4.687 9.108 1.00 . A A . 821 MET SD 1 1 15 11239 1 1 43 THR C C 10.744 -5.257 2.052 1.00 . A A . 822 THR C 1 1 15 11240 1 1 43 THR CA C 10.235 -6.430 2.892 1.00 . A A . 822 THR CA 1 1 15 11241 1 1 43 THR CB C 9.646 -7.498 1.951 1.00 . A A . 822 THR CB 1 1 15 11242 1 1 43 THR CG2 C 10.732 -8.144 1.104 1.00 . A A . 822 THR CG2 1 1 15 11243 1 1 43 THR H H 8.424 -6.588 3.967 1.00 . A A . 822 THR H 1 1 15 11244 1 1 43 THR HA H 11.100 -6.859 3.377 1.00 . A A . 822 THR HA 1 1 15 11245 1 1 43 THR HB H 8.930 -7.023 1.295 1.00 . A A . 822 THR HB 1 1 15 11246 1 1 43 THR HG1 H 9.618 -8.930 3.320 1.00 . A A . 822 THR HG1 1 1 15 11247 1 1 43 THR HG21 H 10.288 -8.888 0.459 1.00 . A A . 822 THR HG21 1 1 15 11248 1 1 43 THR HG22 H 11.460 -8.614 1.747 1.00 . A A . 822 THR HG22 1 1 15 11249 1 1 43 THR HG23 H 11.216 -7.389 0.504 1.00 . A A . 822 THR HG23 1 1 15 11250 1 1 43 THR N N 9.218 -6.021 3.863 1.00 . A A . 822 THR N 1 1 15 11251 1 1 43 THR O O 11.943 -5.138 1.822 1.00 . A A . 822 THR O 1 1 15 11252 1 1 43 THR OG1 O 8.978 -8.504 2.727 1.00 . A A . 822 THR OG1 1 1 15 11253 1 1 44 CYS C C 10.979 -2.194 1.605 1.00 . A A . 823 CYS C 1 1 15 11254 1 1 44 CYS CA C 10.248 -3.255 0.800 1.00 . A A . 823 CYS CA 1 1 15 11255 1 1 44 CYS CB C 9.034 -2.687 0.104 1.00 . A A . 823 CYS CB 1 1 15 11256 1 1 44 CYS H H 8.919 -4.500 1.872 1.00 . A A . 823 CYS H 1 1 15 11257 1 1 44 CYS HA H 10.921 -3.616 0.035 1.00 . A A . 823 CYS HA 1 1 15 11258 1 1 44 CYS HB2 H 8.271 -2.458 0.833 1.00 . A A . 823 CYS HB2 1 1 15 11259 1 1 44 CYS HB3 H 9.311 -1.789 -0.429 1.00 . A A . 823 CYS HB3 1 1 15 11260 1 1 44 CYS N N 9.855 -4.391 1.617 1.00 . A A . 823 CYS N 1 1 15 11261 1 1 44 CYS O O 11.972 -1.630 1.139 1.00 . A A . 823 CYS O 1 1 15 11262 1 1 44 CYS SG S 8.353 -3.853 -1.089 1.00 . A A . 823 CYS SG 1 1 15 11263 1 1 45 ALA C C 12.580 -1.552 4.002 1.00 . A A . 824 ALA C 1 1 15 11264 1 1 45 ALA CA C 11.181 -1.024 3.718 1.00 . A A . 824 ALA CA 1 1 15 11265 1 1 45 ALA CB C 10.399 -0.877 5.013 1.00 . A A . 824 ALA CB 1 1 15 11266 1 1 45 ALA H H 9.659 -2.353 3.107 1.00 . A A . 824 ALA H 1 1 15 11267 1 1 45 ALA HA H 11.249 -0.052 3.252 1.00 . A A . 824 ALA HA 1 1 15 11268 1 1 45 ALA HB1 H 9.415 -0.485 4.799 1.00 . A A . 824 ALA HB1 1 1 15 11269 1 1 45 ALA HB2 H 10.921 -0.202 5.673 1.00 . A A . 824 ALA HB2 1 1 15 11270 1 1 45 ALA HB3 H 10.307 -1.843 5.487 1.00 . A A . 824 ALA HB3 1 1 15 11271 1 1 45 ALA N N 10.492 -1.924 2.810 1.00 . A A . 824 ALA N 1 1 15 11272 1 1 45 ALA O O 13.559 -0.803 3.988 1.00 . A A . 824 ALA O 1 1 15 11273 1 1 46 LYS C C 14.865 -3.421 3.319 1.00 . A A . 825 LYS C 1 1 15 11274 1 1 46 LYS CA C 13.935 -3.516 4.522 1.00 . A A . 825 LYS CA 1 1 15 11275 1 1 46 LYS CB C 13.702 -5.000 4.831 1.00 . A A . 825 LYS CB 1 1 15 11276 1 1 46 LYS CD C 13.162 -4.521 7.236 1.00 . A A . 825 LYS CD 1 1 15 11277 1 1 46 LYS CE C 14.491 -5.040 7.766 1.00 . A A . 825 LYS CE 1 1 15 11278 1 1 46 LYS CG C 12.738 -5.252 5.978 1.00 . A A . 825 LYS CG 1 1 15 11279 1 1 46 LYS H H 11.832 -3.388 4.343 1.00 . A A . 825 LYS H 1 1 15 11280 1 1 46 LYS HA H 14.339 -3.045 5.404 1.00 . A A . 825 LYS HA 1 1 15 11281 1 1 46 LYS HB2 H 13.306 -5.480 3.948 1.00 . A A . 825 LYS HB2 1 1 15 11282 1 1 46 LYS HB3 H 14.649 -5.456 5.078 1.00 . A A . 825 LYS HB3 1 1 15 11283 1 1 46 LYS HD2 H 13.259 -3.470 7.006 1.00 . A A . 825 LYS HD2 1 1 15 11284 1 1 46 LYS HD3 H 12.401 -4.656 7.989 1.00 . A A . 825 LYS HD3 1 1 15 11285 1 1 46 LYS HE2 H 14.383 -6.088 8.004 1.00 . A A . 825 LYS HE2 1 1 15 11286 1 1 46 LYS HE3 H 15.239 -4.925 6.995 1.00 . A A . 825 LYS HE3 1 1 15 11287 1 1 46 LYS HG2 H 11.754 -4.912 5.692 1.00 . A A . 825 LYS HG2 1 1 15 11288 1 1 46 LYS HG3 H 12.709 -6.312 6.183 1.00 . A A . 825 LYS HG3 1 1 15 11289 1 1 46 LYS HZ1 H 14.195 -4.350 9.718 1.00 . A A . 825 LYS HZ1 1 1 15 11290 1 1 46 LYS HZ2 H 15.129 -3.312 8.755 1.00 . A A . 825 LYS HZ2 1 1 15 11291 1 1 46 LYS HZ3 H 15.806 -4.741 9.360 1.00 . A A . 825 LYS HZ3 1 1 15 11292 1 1 46 LYS N N 12.662 -2.859 4.259 1.00 . A A . 825 LYS N 1 1 15 11293 1 1 46 LYS NZ N 14.935 -4.312 8.984 1.00 . A A . 825 LYS NZ 1 1 15 11294 1 1 46 LYS O O 16.049 -3.112 3.438 1.00 . A A . 825 LYS O 1 1 15 11295 1 1 47 ARG C C 15.646 -2.490 0.496 1.00 . A A . 826 ARG C 1 1 15 11296 1 1 47 ARG CA C 15.019 -3.814 0.900 1.00 . A A . 826 ARG CA 1 1 15 11297 1 1 47 ARG CB C 14.062 -4.281 -0.203 1.00 . A A . 826 ARG CB 1 1 15 11298 1 1 47 ARG CD C 15.532 -6.133 -1.042 1.00 . A A . 826 ARG CD 1 1 15 11299 1 1 47 ARG CG C 14.751 -4.885 -1.414 1.00 . A A . 826 ARG CG 1 1 15 11300 1 1 47 ARG CZ C 16.931 -7.843 -2.127 1.00 . A A . 826 ARG CZ 1 1 15 11301 1 1 47 ARG H H 13.307 -3.821 2.138 1.00 . A A . 826 ARG H 1 1 15 11302 1 1 47 ARG HA H 15.777 -4.570 1.042 1.00 . A A . 826 ARG HA 1 1 15 11303 1 1 47 ARG HB2 H 13.397 -5.025 0.208 1.00 . A A . 826 ARG HB2 1 1 15 11304 1 1 47 ARG HB3 H 13.476 -3.436 -0.535 1.00 . A A . 826 ARG HB3 1 1 15 11305 1 1 47 ARG HD2 H 16.352 -5.850 -0.400 1.00 . A A . 826 ARG HD2 1 1 15 11306 1 1 47 ARG HD3 H 14.875 -6.806 -0.509 1.00 . A A . 826 ARG HD3 1 1 15 11307 1 1 47 ARG HE H 15.749 -6.544 -3.099 1.00 . A A . 826 ARG HE 1 1 15 11308 1 1 47 ARG HG2 H 14.003 -5.147 -2.148 1.00 . A A . 826 ARG HG2 1 1 15 11309 1 1 47 ARG HG3 H 15.429 -4.156 -1.831 1.00 . A A . 826 ARG HG3 1 1 15 11310 1 1 47 ARG HH11 H 17.160 -7.696 -0.116 1.00 . A A . 826 ARG HH11 1 1 15 11311 1 1 47 ARG HH12 H 18.065 -8.973 -0.875 1.00 . A A . 826 ARG HH12 1 1 15 11312 1 1 47 ARG HH21 H 16.949 -8.221 -4.118 1.00 . A A . 826 ARG HH21 1 1 15 11313 1 1 47 ARG HH22 H 17.958 -9.252 -3.159 1.00 . A A . 826 ARG HH22 1 1 15 11314 1 1 47 ARG N N 14.279 -3.680 2.150 1.00 . A A . 826 ARG N 1 1 15 11315 1 1 47 ARG NE N 16.071 -6.828 -2.209 1.00 . A A . 826 ARG NE 1 1 15 11316 1 1 47 ARG NH1 N 17.425 -8.197 -0.948 1.00 . A A . 826 ARG NH1 1 1 15 11317 1 1 47 ARG NH2 N 17.311 -8.491 -3.222 1.00 . A A . 826 ARG NH2 1 1 15 11318 1 1 47 ARG O O 16.605 -2.451 -0.277 1.00 . A A . 826 ARG O 1 1 15 11319 1 1 48 TYR C C 17.028 0.079 1.203 1.00 . A A . 827 TYR C 1 1 15 11320 1 1 48 TYR CA C 15.580 -0.069 0.754 1.00 . A A . 827 TYR CA 1 1 15 11321 1 1 48 TYR CB C 14.716 0.941 1.511 1.00 . A A . 827 TYR CB 1 1 15 11322 1 1 48 TYR CD1 C 15.157 2.821 -0.112 1.00 . A A . 827 TYR CD1 1 1 15 11323 1 1 48 TYR CD2 C 15.234 3.315 2.220 1.00 . A A . 827 TYR CD2 1 1 15 11324 1 1 48 TYR CE1 C 15.436 4.139 -0.405 1.00 . A A . 827 TYR CE1 1 1 15 11325 1 1 48 TYR CE2 C 15.517 4.638 1.932 1.00 . A A . 827 TYR CE2 1 1 15 11326 1 1 48 TYR CG C 15.049 2.384 1.203 1.00 . A A . 827 TYR CG 1 1 15 11327 1 1 48 TYR CZ C 15.617 5.044 0.617 1.00 . A A . 827 TYR CZ 1 1 15 11328 1 1 48 TYR H H 14.248 -1.504 1.532 1.00 . A A . 827 TYR H 1 1 15 11329 1 1 48 TYR HA H 15.445 0.119 -0.301 1.00 . A A . 827 TYR HA 1 1 15 11330 1 1 48 TYR HB2 H 13.679 0.780 1.248 1.00 . A A . 827 TYR HB2 1 1 15 11331 1 1 48 TYR HB3 H 14.841 0.788 2.574 1.00 . A A . 827 TYR HB3 1 1 15 11332 1 1 48 TYR HD1 H 15.016 2.111 -0.915 1.00 . A A . 827 TYR HD1 1 1 15 11333 1 1 48 TYR HD2 H 15.155 2.993 3.249 1.00 . A A . 827 TYR HD2 1 1 15 11334 1 1 48 TYR HE1 H 15.515 4.459 -1.434 1.00 . A A . 827 TYR HE1 1 1 15 11335 1 1 48 TYR HE2 H 15.659 5.348 2.735 1.00 . A A . 827 TYR HE2 1 1 15 11336 1 1 48 TYR HH H 15.309 6.637 -0.409 1.00 . A A . 827 TYR HH 1 1 15 11337 1 1 48 TYR N N 15.082 -1.407 1.021 1.00 . A A . 827 TYR N 1 1 15 11338 1 1 48 TYR O O 17.791 0.873 0.657 1.00 . A A . 827 TYR O 1 1 15 11339 1 1 48 TYR OH O 15.881 6.360 0.320 1.00 . A A . 827 TYR OH 1 1 15 11340 1 1 49 ASN C C 19.060 -1.931 3.510 1.00 . A A . 828 ASN C 1 1 15 11341 1 1 49 ASN CA C 18.688 -0.606 2.850 1.00 . A A . 828 ASN CA 1 1 15 11342 1 1 49 ASN CB C 18.711 0.553 3.873 1.00 . A A . 828 ASN CB 1 1 15 11343 1 1 49 ASN CG C 17.660 0.465 4.984 1.00 . A A . 828 ASN CG 1 1 15 11344 1 1 49 ASN H H 16.775 -1.421 2.501 1.00 . A A . 828 ASN H 1 1 15 11345 1 1 49 ASN HA H 19.415 -0.398 2.077 1.00 . A A . 828 ASN HA 1 1 15 11346 1 1 49 ASN HB2 H 19.683 0.580 4.341 1.00 . A A . 828 ASN HB2 1 1 15 11347 1 1 49 ASN HB3 H 18.557 1.480 3.342 1.00 . A A . 828 ASN HB3 1 1 15 11348 1 1 49 ASN HD21 H 16.309 -0.274 3.738 1.00 . A A . 828 ASN HD21 1 1 15 11349 1 1 49 ASN HD22 H 15.785 -0.071 5.367 1.00 . A A . 828 ASN HD22 1 1 15 11350 1 1 49 ASN N N 17.392 -0.714 2.204 1.00 . A A . 828 ASN N 1 1 15 11351 1 1 49 ASN ND2 N 16.464 -0.005 4.665 1.00 . A A . 828 ASN ND2 1 1 15 11352 1 1 49 ASN O O 18.751 -2.132 4.701 1.00 . A A . 828 ASN O 1 1 15 11353 1 1 49 ASN OXT O 19.652 -2.784 2.819 1.00 . A A . 828 ASN OXT 1 1 15 11354 1 1 49 ASN OD1 O 17.915 0.857 6.122 1.00 . A A . 828 ASN OD1 1 1 15 11355 2 2 1 ZN ZN ZN 7.492 -2.896 -2.816 1.00 . B A . 829 ZN ZN 1 1 16 11356 1 1 1 GLY C C -16.016 0.770 11.764 1.00 . A A . 1 GLY C 1 1 16 11357 1 1 1 GLY CA C -17.399 1.354 11.565 1.00 . A A . 1 GLY CA 1 1 16 11358 1 1 1 GLY H1 H -17.329 2.684 13.168 1.00 . A A . 1 GLY H1 1 1 16 11359 1 1 1 GLY H2 H -18.474 3.094 11.981 1.00 . A A . 1 GLY H2 1 1 16 11360 1 1 1 GLY H3 H -16.824 3.354 11.693 1.00 . A A . 1 GLY H3 1 1 16 11361 1 1 1 GLY HA2 H -18.123 0.709 12.040 1.00 . A A . 1 GLY HA2 1 1 16 11362 1 1 1 GLY HA3 H -17.612 1.402 10.507 1.00 . A A . 1 GLY HA3 1 1 16 11363 1 1 1 GLY N N -17.515 2.714 12.141 1.00 . A A . 1 GLY N 1 1 16 11364 1 1 1 GLY O O -15.046 1.508 11.944 1.00 . A A . 1 GLY O 1 1 16 11365 1 1 2 THR C C -13.811 -1.097 10.620 1.00 . A A . 2 THR C 1 1 16 11366 1 1 2 THR CA C -14.641 -1.226 11.896 1.00 . A A . 2 THR CA 1 1 16 11367 1 1 2 THR CB C -14.849 -2.710 12.243 1.00 . A A . 2 THR CB 1 1 16 11368 1 1 2 THR CG2 C -13.522 -3.393 12.532 1.00 . A A . 2 THR CG2 1 1 16 11369 1 1 2 THR H H -16.727 -1.090 11.605 1.00 . A A . 2 THR H 1 1 16 11370 1 1 2 THR HA H -14.111 -0.753 12.713 1.00 . A A . 2 THR HA 1 1 16 11371 1 1 2 THR HB H -15.320 -3.201 11.403 1.00 . A A . 2 THR HB 1 1 16 11372 1 1 2 THR HG1 H -15.405 -2.188 14.069 1.00 . A A . 2 THR HG1 1 1 16 11373 1 1 2 THR HG21 H -13.699 -4.423 12.804 1.00 . A A . 2 THR HG21 1 1 16 11374 1 1 2 THR HG22 H -13.026 -2.886 13.346 1.00 . A A . 2 THR HG22 1 1 16 11375 1 1 2 THR HG23 H -12.897 -3.357 11.652 1.00 . A A . 2 THR HG23 1 1 16 11376 1 1 2 THR N N -15.919 -0.552 11.738 1.00 . A A . 2 THR N 1 1 16 11377 1 1 2 THR O O -14.111 -1.737 9.610 1.00 . A A . 2 THR O 1 1 16 11378 1 1 2 THR OG1 O -15.706 -2.814 13.390 1.00 . A A . 2 THR OG1 1 1 16 11379 1 1 3 ARG C C -12.695 0.876 8.492 1.00 . A A . 3 ARG C 1 1 16 11380 1 1 3 ARG CA C -11.922 0.069 9.534 1.00 . A A . 3 ARG CA 1 1 16 11381 1 1 3 ARG CB C -11.342 -1.192 8.881 1.00 . A A . 3 ARG CB 1 1 16 11382 1 1 3 ARG CD C -9.792 -3.154 9.022 1.00 . A A . 3 ARG CD 1 1 16 11383 1 1 3 ARG CG C -10.512 -2.067 9.808 1.00 . A A . 3 ARG CG 1 1 16 11384 1 1 3 ARG CZ C -7.926 -4.650 9.639 1.00 . A A . 3 ARG CZ 1 1 16 11385 1 1 3 ARG H H -12.594 0.204 11.536 1.00 . A A . 3 ARG H 1 1 16 11386 1 1 3 ARG HA H -11.106 0.677 9.898 1.00 . A A . 3 ARG HA 1 1 16 11387 1 1 3 ARG HB2 H -12.159 -1.789 8.503 1.00 . A A . 3 ARG HB2 1 1 16 11388 1 1 3 ARG HB3 H -10.718 -0.892 8.052 1.00 . A A . 3 ARG HB3 1 1 16 11389 1 1 3 ARG HD2 H -10.512 -3.670 8.406 1.00 . A A . 3 ARG HD2 1 1 16 11390 1 1 3 ARG HD3 H -9.050 -2.687 8.390 1.00 . A A . 3 ARG HD3 1 1 16 11391 1 1 3 ARG HE H -9.629 -4.445 10.680 1.00 . A A . 3 ARG HE 1 1 16 11392 1 1 3 ARG HG2 H -9.781 -1.452 10.314 1.00 . A A . 3 ARG HG2 1 1 16 11393 1 1 3 ARG HG3 H -11.164 -2.529 10.533 1.00 . A A . 3 ARG HG3 1 1 16 11394 1 1 3 ARG HH11 H -7.559 -3.512 7.996 1.00 . A A . 3 ARG HH11 1 1 16 11395 1 1 3 ARG HH12 H -6.298 -4.631 8.436 1.00 . A A . 3 ARG HH12 1 1 16 11396 1 1 3 ARG HH21 H -7.971 -5.925 11.215 1.00 . A A . 3 ARG HH21 1 1 16 11397 1 1 3 ARG HH22 H -6.530 -5.987 10.246 1.00 . A A . 3 ARG HH22 1 1 16 11398 1 1 3 ARG N N -12.780 -0.246 10.682 1.00 . A A . 3 ARG N 1 1 16 11399 1 1 3 ARG NE N -9.128 -4.129 9.886 1.00 . A A . 3 ARG NE 1 1 16 11400 1 1 3 ARG NH1 N -7.206 -4.230 8.609 1.00 . A A . 3 ARG NH1 1 1 16 11401 1 1 3 ARG NH2 N -7.436 -5.596 10.431 1.00 . A A . 3 ARG NH2 1 1 16 11402 1 1 3 ARG O O -12.422 2.060 8.285 1.00 . A A . 3 ARG O 1 1 16 11403 1 1 4 GLY C C -14.000 0.565 5.437 1.00 . A A . 783 GLY C 1 1 16 11404 1 1 4 GLY CA C -14.452 0.908 6.839 1.00 . A A . 783 GLY CA 1 1 16 11405 1 1 4 GLY H H -13.851 -0.701 8.075 1.00 . A A . 783 GLY H 1 1 16 11406 1 1 4 GLY HA2 H -15.487 0.620 6.954 1.00 . A A . 783 GLY HA2 1 1 16 11407 1 1 4 GLY HA3 H -14.368 1.974 6.981 1.00 . A A . 783 GLY HA3 1 1 16 11408 1 1 4 GLY N N -13.662 0.238 7.849 1.00 . A A . 783 GLY N 1 1 16 11409 1 1 4 GLY O O -13.208 1.294 4.833 1.00 . A A . 783 GLY O 1 1 16 11410 1 1 5 VAL C C -15.455 -1.206 2.785 1.00 . A A . 784 VAL C 1 1 16 11411 1 1 5 VAL CA C -14.167 -0.973 3.568 1.00 . A A . 784 VAL CA 1 1 16 11412 1 1 5 VAL CB C -13.281 -2.246 3.521 1.00 . A A . 784 VAL CB 1 1 16 11413 1 1 5 VAL CG1 C -13.981 -3.441 4.155 1.00 . A A . 784 VAL CG1 1 1 16 11414 1 1 5 VAL CG2 C -12.869 -2.563 2.091 1.00 . A A . 784 VAL CG2 1 1 16 11415 1 1 5 VAL H H -15.036 -1.145 5.495 1.00 . A A . 784 VAL H 1 1 16 11416 1 1 5 VAL HA H -13.621 -0.167 3.097 1.00 . A A . 784 VAL HA 1 1 16 11417 1 1 5 VAL HB H -12.384 -2.048 4.090 1.00 . A A . 784 VAL HB 1 1 16 11418 1 1 5 VAL HG11 H -14.907 -3.633 3.634 1.00 . A A . 784 VAL HG11 1 1 16 11419 1 1 5 VAL HG12 H -14.189 -3.225 5.191 1.00 . A A . 784 VAL HG12 1 1 16 11420 1 1 5 VAL HG13 H -13.343 -4.310 4.087 1.00 . A A . 784 VAL HG13 1 1 16 11421 1 1 5 VAL HG21 H -12.297 -1.739 1.691 1.00 . A A . 784 VAL HG21 1 1 16 11422 1 1 5 VAL HG22 H -13.751 -2.715 1.488 1.00 . A A . 784 VAL HG22 1 1 16 11423 1 1 5 VAL HG23 H -12.266 -3.460 2.079 1.00 . A A . 784 VAL HG23 1 1 16 11424 1 1 5 VAL N N -14.469 -0.565 4.931 1.00 . A A . 784 VAL N 1 1 16 11425 1 1 5 VAL O O -16.357 -1.904 3.252 1.00 . A A . 784 VAL O 1 1 16 11426 1 1 6 ASP C C -17.994 -0.489 1.488 1.00 . A A . 785 ASP C 1 1 16 11427 1 1 6 ASP CA C -16.693 -0.726 0.720 1.00 . A A . 785 ASP CA 1 1 16 11428 1 1 6 ASP CB C -16.695 -2.117 0.072 1.00 . A A . 785 ASP CB 1 1 16 11429 1 1 6 ASP CG C -17.573 -2.190 -1.160 1.00 . A A . 785 ASP CG 1 1 16 11430 1 1 6 ASP H H -14.808 0.007 1.337 1.00 . A A . 785 ASP H 1 1 16 11431 1 1 6 ASP HA H -16.609 0.022 -0.054 1.00 . A A . 785 ASP HA 1 1 16 11432 1 1 6 ASP HB2 H -15.685 -2.375 -0.214 1.00 . A A . 785 ASP HB2 1 1 16 11433 1 1 6 ASP HB3 H -17.055 -2.839 0.792 1.00 . A A . 785 ASP HB3 1 1 16 11434 1 1 6 ASP N N -15.541 -0.579 1.612 1.00 . A A . 785 ASP N 1 1 16 11435 1 1 6 ASP O O -18.902 -1.317 1.484 1.00 . A A . 785 ASP O 1 1 16 11436 1 1 6 ASP OD1 O -17.124 -1.782 -2.249 1.00 . A A . 785 ASP OD1 1 1 16 11437 1 1 6 ASP OD2 O -18.728 -2.654 -1.042 1.00 . A A . 785 ASP OD2 1 1 16 11438 1 1 7 SER C C -20.309 1.601 2.123 1.00 . A A . 786 SER C 1 1 16 11439 1 1 7 SER CA C -19.220 0.968 2.983 1.00 . A A . 786 SER CA 1 1 16 11440 1 1 7 SER CB C -18.802 1.920 4.101 1.00 . A A . 786 SER CB 1 1 16 11441 1 1 7 SER H H -17.313 1.264 2.140 1.00 . A A . 786 SER H 1 1 16 11442 1 1 7 SER HA H -19.601 0.056 3.415 1.00 . A A . 786 SER HA 1 1 16 11443 1 1 7 SER HB2 H -18.487 2.859 3.674 1.00 . A A . 786 SER HB2 1 1 16 11444 1 1 7 SER HB3 H -19.640 2.089 4.761 1.00 . A A . 786 SER HB3 1 1 16 11445 1 1 7 SER HG H -17.629 0.441 4.634 1.00 . A A . 786 SER HG 1 1 16 11446 1 1 7 SER N N -18.060 0.637 2.176 1.00 . A A . 786 SER N 1 1 16 11447 1 1 7 SER O O -20.014 2.381 1.214 1.00 . A A . 786 SER O 1 1 16 11448 1 1 7 SER OG O -17.726 1.375 4.849 1.00 . A A . 786 SER OG 1 1 16 11449 1 1 8 PRO C C -22.993 3.278 2.139 1.00 . A A . 787 PRO C 1 1 16 11450 1 1 8 PRO CA C -22.733 1.842 1.685 1.00 . A A . 787 PRO CA 1 1 16 11451 1 1 8 PRO CB C -23.907 0.926 2.074 1.00 . A A . 787 PRO CB 1 1 16 11452 1 1 8 PRO CD C -22.012 0.277 3.389 1.00 . A A . 787 PRO CD 1 1 16 11453 1 1 8 PRO CG C -23.302 -0.225 2.814 1.00 . A A . 787 PRO CG 1 1 16 11454 1 1 8 PRO HA H -22.592 1.822 0.616 1.00 . A A . 787 PRO HA 1 1 16 11455 1 1 8 PRO HB2 H -24.596 1.475 2.699 1.00 . A A . 787 PRO HB2 1 1 16 11456 1 1 8 PRO HB3 H -24.415 0.595 1.181 1.00 . A A . 787 PRO HB3 1 1 16 11457 1 1 8 PRO HD2 H -22.181 0.745 4.348 1.00 . A A . 787 PRO HD2 1 1 16 11458 1 1 8 PRO HD3 H -21.295 -0.525 3.475 1.00 . A A . 787 PRO HD3 1 1 16 11459 1 1 8 PRO HG2 H -23.965 -0.541 3.604 1.00 . A A . 787 PRO HG2 1 1 16 11460 1 1 8 PRO HG3 H -23.115 -1.040 2.131 1.00 . A A . 787 PRO HG3 1 1 16 11461 1 1 8 PRO N N -21.584 1.260 2.390 1.00 . A A . 787 PRO N 1 1 16 11462 1 1 8 PRO O O -24.099 3.633 2.559 1.00 . A A . 787 PRO O 1 1 16 11463 1 1 9 SER C C -20.781 6.190 1.891 1.00 . A A . 788 SER C 1 1 16 11464 1 1 9 SER CA C -21.990 5.474 2.481 1.00 . A A . 788 SER CA 1 1 16 11465 1 1 9 SER CB C -21.964 5.548 4.016 1.00 . A A . 788 SER CB 1 1 16 11466 1 1 9 SER H H -21.112 3.737 1.675 1.00 . A A . 788 SER H 1 1 16 11467 1 1 9 SER HA H -22.897 5.926 2.108 1.00 . A A . 788 SER HA 1 1 16 11468 1 1 9 SER HB2 H -22.769 4.951 4.419 1.00 . A A . 788 SER HB2 1 1 16 11469 1 1 9 SER HB3 H -21.020 5.161 4.374 1.00 . A A . 788 SER HB3 1 1 16 11470 1 1 9 SER HG H -23.052 7.111 4.508 1.00 . A A . 788 SER HG 1 1 16 11471 1 1 9 SER N N -21.954 4.090 2.053 1.00 . A A . 788 SER N 1 1 16 11472 1 1 9 SER O O -19.914 5.548 1.291 1.00 . A A . 788 SER O 1 1 16 11473 1 1 9 SER OG O -22.113 6.880 4.482 1.00 . A A . 788 SER OG 1 1 16 11474 1 1 10 ALA C C -18.377 8.135 2.447 1.00 . A A . 789 ALA C 1 1 16 11475 1 1 10 ALA CA C -19.605 8.297 1.550 1.00 . A A . 789 ALA CA 1 1 16 11476 1 1 10 ALA CB C -20.004 9.762 1.438 1.00 . A A . 789 ALA CB 1 1 16 11477 1 1 10 ALA H H -21.455 7.961 2.528 1.00 . A A . 789 ALA H 1 1 16 11478 1 1 10 ALA HA H -19.364 7.936 0.559 1.00 . A A . 789 ALA HA 1 1 16 11479 1 1 10 ALA HB1 H -19.206 10.317 0.966 1.00 . A A . 789 ALA HB1 1 1 16 11480 1 1 10 ALA HB2 H -20.186 10.162 2.424 1.00 . A A . 789 ALA HB2 1 1 16 11481 1 1 10 ALA HB3 H -20.902 9.849 0.843 1.00 . A A . 789 ALA HB3 1 1 16 11482 1 1 10 ALA N N -20.724 7.506 2.054 1.00 . A A . 789 ALA N 1 1 16 11483 1 1 10 ALA O O -17.824 9.113 2.958 1.00 . A A . 789 ALA O 1 1 16 11484 1 1 11 GLU C C -15.744 5.867 2.699 1.00 . A A . 790 GLU C 1 1 16 11485 1 1 11 GLU CA C -16.825 6.571 3.485 1.00 . A A . 790 GLU CA 1 1 16 11486 1 1 11 GLU CB C -17.236 5.668 4.629 1.00 . A A . 790 GLU CB 1 1 16 11487 1 1 11 GLU CD C -18.303 5.489 6.901 1.00 . A A . 790 GLU CD 1 1 16 11488 1 1 11 GLU CG C -18.108 6.344 5.670 1.00 . A A . 790 GLU CG 1 1 16 11489 1 1 11 GLU H H -18.441 6.157 2.188 1.00 . A A . 790 GLU H 1 1 16 11490 1 1 11 GLU HA H -16.429 7.493 3.885 1.00 . A A . 790 GLU HA 1 1 16 11491 1 1 11 GLU HB2 H -17.781 4.831 4.221 1.00 . A A . 790 GLU HB2 1 1 16 11492 1 1 11 GLU HB3 H -16.341 5.300 5.108 1.00 . A A . 790 GLU HB3 1 1 16 11493 1 1 11 GLU HG2 H -17.644 7.273 5.966 1.00 . A A . 790 GLU HG2 1 1 16 11494 1 1 11 GLU HG3 H -19.075 6.547 5.236 1.00 . A A . 790 GLU HG3 1 1 16 11495 1 1 11 GLU N N -17.963 6.890 2.641 1.00 . A A . 790 GLU N 1 1 16 11496 1 1 11 GLU O O -15.062 4.984 3.218 1.00 . A A . 790 GLU O 1 1 16 11497 1 1 11 GLU OE1 O -19.213 4.635 6.894 1.00 . A A . 790 GLU OE1 1 1 16 11498 1 1 11 GLU OE2 O -17.545 5.658 7.876 1.00 . A A . 790 GLU OE2 1 1 16 11499 1 1 12 LEU C C -13.282 6.306 0.662 1.00 . A A . 791 LEU C 1 1 16 11500 1 1 12 LEU CA C -14.605 5.555 0.637 1.00 . A A . 791 LEU CA 1 1 16 11501 1 1 12 LEU CB C -15.117 5.398 -0.798 1.00 . A A . 791 LEU CB 1 1 16 11502 1 1 12 LEU CD1 C -16.906 4.628 -2.380 1.00 . A A . 791 LEU CD1 1 1 16 11503 1 1 12 LEU CD2 C -16.279 3.200 -0.425 1.00 . A A . 791 LEU CD2 1 1 16 11504 1 1 12 LEU CG C -16.434 4.627 -0.935 1.00 . A A . 791 LEU CG 1 1 16 11505 1 1 12 LEU H H -16.107 6.977 1.081 1.00 . A A . 791 LEU H 1 1 16 11506 1 1 12 LEU HA H -14.462 4.580 1.076 1.00 . A A . 791 LEU HA 1 1 16 11507 1 1 12 LEU HB2 H -15.255 6.384 -1.219 1.00 . A A . 791 LEU HB2 1 1 16 11508 1 1 12 LEU HB3 H -14.363 4.883 -1.372 1.00 . A A . 791 LEU HB3 1 1 16 11509 1 1 12 LEU HD11 H -16.175 4.129 -2.998 1.00 . A A . 791 LEU HD11 1 1 16 11510 1 1 12 LEU HD12 H -17.029 5.646 -2.717 1.00 . A A . 791 LEU HD12 1 1 16 11511 1 1 12 LEU HD13 H -17.850 4.108 -2.449 1.00 . A A . 791 LEU HD13 1 1 16 11512 1 1 12 LEU HD21 H -15.979 3.219 0.612 1.00 . A A . 791 LEU HD21 1 1 16 11513 1 1 12 LEU HD22 H -15.527 2.687 -1.008 1.00 . A A . 791 LEU HD22 1 1 16 11514 1 1 12 LEU HD23 H -17.221 2.681 -0.518 1.00 . A A . 791 LEU HD23 1 1 16 11515 1 1 12 LEU HG H -17.191 5.113 -0.340 1.00 . A A . 791 LEU HG 1 1 16 11516 1 1 12 LEU N N -15.578 6.233 1.455 1.00 . A A . 791 LEU N 1 1 16 11517 1 1 12 LEU O O -12.443 6.153 -0.224 1.00 . A A . 791 LEU O 1 1 16 11518 1 1 13 ASP C C -11.155 7.544 3.112 1.00 . A A . 792 ASP C 1 1 16 11519 1 1 13 ASP CA C -11.904 7.926 1.845 1.00 . A A . 792 ASP CA 1 1 16 11520 1 1 13 ASP CB C -12.261 9.415 1.879 1.00 . A A . 792 ASP CB 1 1 16 11521 1 1 13 ASP CG C -12.888 9.836 3.195 1.00 . A A . 792 ASP CG 1 1 16 11522 1 1 13 ASP H H -13.796 7.155 2.392 1.00 . A A . 792 ASP H 1 1 16 11523 1 1 13 ASP HA H -11.272 7.732 0.996 1.00 . A A . 792 ASP HA 1 1 16 11524 1 1 13 ASP HB2 H -11.364 9.996 1.729 1.00 . A A . 792 ASP HB2 1 1 16 11525 1 1 13 ASP HB3 H -12.960 9.628 1.084 1.00 . A A . 792 ASP HB3 1 1 16 11526 1 1 13 ASP N N -13.102 7.110 1.701 1.00 . A A . 792 ASP N 1 1 16 11527 1 1 13 ASP O O -10.152 8.160 3.473 1.00 . A A . 792 ASP O 1 1 16 11528 1 1 13 ASP OD1 O -13.936 9.259 3.571 1.00 . A A . 792 ASP OD1 1 1 16 11529 1 1 13 ASP OD2 O -12.337 10.734 3.864 1.00 . A A . 792 ASP OD2 1 1 16 11530 1 1 14 LYS C C -9.727 5.289 4.579 1.00 . A A . 793 LYS C 1 1 16 11531 1 1 14 LYS CA C -11.008 6.000 4.982 1.00 . A A . 793 LYS CA 1 1 16 11532 1 1 14 LYS CB C -11.934 5.019 5.707 1.00 . A A . 793 LYS CB 1 1 16 11533 1 1 14 LYS CD C -14.260 4.477 6.499 1.00 . A A . 793 LYS CD 1 1 16 11534 1 1 14 LYS CE C -14.244 4.740 7.994 1.00 . A A . 793 LYS CE 1 1 16 11535 1 1 14 LYS CG C -13.385 5.467 5.747 1.00 . A A . 793 LYS CG 1 1 16 11536 1 1 14 LYS H H -12.467 6.092 3.454 1.00 . A A . 793 LYS H 1 1 16 11537 1 1 14 LYS HA H -10.777 6.830 5.630 1.00 . A A . 793 LYS HA 1 1 16 11538 1 1 14 LYS HB2 H -11.890 4.063 5.206 1.00 . A A . 793 LYS HB2 1 1 16 11539 1 1 14 LYS HB3 H -11.590 4.898 6.723 1.00 . A A . 793 LYS HB3 1 1 16 11540 1 1 14 LYS HD2 H -15.273 4.564 6.140 1.00 . A A . 793 LYS HD2 1 1 16 11541 1 1 14 LYS HD3 H -13.896 3.476 6.315 1.00 . A A . 793 LYS HD3 1 1 16 11542 1 1 14 LYS HE2 H -14.732 3.918 8.497 1.00 . A A . 793 LYS HE2 1 1 16 11543 1 1 14 LYS HE3 H -13.219 4.807 8.324 1.00 . A A . 793 LYS HE3 1 1 16 11544 1 1 14 LYS HG2 H -13.440 6.426 6.239 1.00 . A A . 793 LYS HG2 1 1 16 11545 1 1 14 LYS HG3 H -13.751 5.559 4.735 1.00 . A A . 793 LYS HG3 1 1 16 11546 1 1 14 LYS HZ1 H -15.957 5.929 8.080 1.00 . A A . 793 LYS HZ1 1 1 16 11547 1 1 14 LYS HZ2 H -14.529 6.801 7.806 1.00 . A A . 793 LYS HZ2 1 1 16 11548 1 1 14 LYS HZ3 H -14.872 6.199 9.351 1.00 . A A . 793 LYS HZ3 1 1 16 11549 1 1 14 LYS N N -11.650 6.514 3.779 1.00 . A A . 793 LYS N 1 1 16 11550 1 1 14 LYS NZ N -14.946 6.002 8.331 1.00 . A A . 793 LYS NZ 1 1 16 11551 1 1 14 LYS O O -8.726 5.297 5.297 1.00 . A A . 793 LYS O 1 1 16 11552 1 1 15 LYS C C -8.977 3.821 1.299 1.00 . A A . 794 LYS C 1 1 16 11553 1 1 15 LYS CA C -8.665 4.020 2.783 1.00 . A A . 794 LYS CA 1 1 16 11554 1 1 15 LYS CB C -8.364 2.692 3.490 1.00 . A A . 794 LYS CB 1 1 16 11555 1 1 15 LYS CD C -9.017 0.321 3.895 1.00 . A A . 794 LYS CD 1 1 16 11556 1 1 15 LYS CE C -10.158 -0.622 4.207 1.00 . A A . 794 LYS CE 1 1 16 11557 1 1 15 LYS CG C -9.509 1.693 3.470 1.00 . A A . 794 LYS CG 1 1 16 11558 1 1 15 LYS H H -10.639 4.708 2.914 1.00 . A A . 794 LYS H 1 1 16 11559 1 1 15 LYS HA H -7.809 4.672 2.869 1.00 . A A . 794 LYS HA 1 1 16 11560 1 1 15 LYS HB2 H -7.504 2.233 3.033 1.00 . A A . 794 LYS HB2 1 1 16 11561 1 1 15 LYS HB3 H -8.129 2.905 4.524 1.00 . A A . 794 LYS HB3 1 1 16 11562 1 1 15 LYS HD2 H -8.429 -0.101 3.093 1.00 . A A . 794 LYS HD2 1 1 16 11563 1 1 15 LYS HD3 H -8.399 0.431 4.775 1.00 . A A . 794 LYS HD3 1 1 16 11564 1 1 15 LYS HE2 H -10.817 -0.663 3.355 1.00 . A A . 794 LYS HE2 1 1 16 11565 1 1 15 LYS HE3 H -9.757 -1.606 4.400 1.00 . A A . 794 LYS HE3 1 1 16 11566 1 1 15 LYS HG2 H -10.282 2.024 4.151 1.00 . A A . 794 LYS HG2 1 1 16 11567 1 1 15 LYS HG3 H -9.908 1.633 2.467 1.00 . A A . 794 LYS HG3 1 1 16 11568 1 1 15 LYS HZ1 H -11.591 0.584 5.127 1.00 . A A . 794 LYS HZ1 1 1 16 11569 1 1 15 LYS HZ2 H -10.278 0.200 6.122 1.00 . A A . 794 LYS HZ2 1 1 16 11570 1 1 15 LYS HZ3 H -11.464 -0.971 5.795 1.00 . A A . 794 LYS HZ3 1 1 16 11571 1 1 15 LYS N N -9.791 4.688 3.401 1.00 . A A . 794 LYS N 1 1 16 11572 1 1 15 LYS NZ N -10.928 -0.171 5.393 1.00 . A A . 794 LYS NZ 1 1 16 11573 1 1 15 LYS O O -9.732 4.612 0.739 1.00 . A A . 794 LYS O 1 1 16 11574 1 1 16 ALA C C -7.692 3.451 -1.603 1.00 . A A . 795 ALA C 1 1 16 11575 1 1 16 ALA CA C -8.552 2.517 -0.763 1.00 . A A . 795 ALA CA 1 1 16 11576 1 1 16 ALA CB C -10.017 2.579 -1.189 1.00 . A A . 795 ALA CB 1 1 16 11577 1 1 16 ALA H H -7.783 2.221 1.180 1.00 . A A . 795 ALA H 1 1 16 11578 1 1 16 ALA HA H -8.204 1.507 -0.928 1.00 . A A . 795 ALA HA 1 1 16 11579 1 1 16 ALA HB1 H -10.388 3.583 -1.050 1.00 . A A . 795 ALA HB1 1 1 16 11580 1 1 16 ALA HB2 H -10.596 1.893 -0.590 1.00 . A A . 795 ALA HB2 1 1 16 11581 1 1 16 ALA HB3 H -10.100 2.305 -2.231 1.00 . A A . 795 ALA HB3 1 1 16 11582 1 1 16 ALA N N -8.371 2.804 0.668 1.00 . A A . 795 ALA N 1 1 16 11583 1 1 16 ALA O O -7.556 3.276 -2.813 1.00 . A A . 795 ALA O 1 1 16 11584 1 1 17 ASN C C -4.824 4.640 -1.706 1.00 . A A . 796 ASN C 1 1 16 11585 1 1 17 ASN CA C -6.161 5.337 -1.567 1.00 . A A . 796 ASN CA 1 1 16 11586 1 1 17 ASN CB C -6.013 6.641 -0.767 1.00 . A A . 796 ASN CB 1 1 16 11587 1 1 17 ASN CG C -6.098 6.466 0.747 1.00 . A A . 796 ASN CG 1 1 16 11588 1 1 17 ASN H H -7.342 4.575 -0.004 1.00 . A A . 796 ASN H 1 1 16 11589 1 1 17 ASN HA H -6.531 5.571 -2.554 1.00 . A A . 796 ASN HA 1 1 16 11590 1 1 17 ASN HB2 H -5.049 7.073 -0.995 1.00 . A A . 796 ASN HB2 1 1 16 11591 1 1 17 ASN HB3 H -6.787 7.328 -1.074 1.00 . A A . 796 ASN HB3 1 1 16 11592 1 1 17 ASN HD21 H -5.044 4.779 0.688 1.00 . A A . 796 ASN HD21 1 1 16 11593 1 1 17 ASN HD22 H -5.567 5.292 2.264 1.00 . A A . 796 ASN HD22 1 1 16 11594 1 1 17 ASN N N -7.115 4.442 -0.942 1.00 . A A . 796 ASN N 1 1 16 11595 1 1 17 ASN ND2 N -5.512 5.405 1.287 1.00 . A A . 796 ASN ND2 1 1 16 11596 1 1 17 ASN O O -4.165 4.314 -0.715 1.00 . A A . 796 ASN O 1 1 16 11597 1 1 17 ASN OD1 O -6.671 7.305 1.436 1.00 . A A . 796 ASN OD1 1 1 16 11598 1 1 18 LEU C C -2.105 4.613 -3.552 1.00 . A A . 797 LEU C 1 1 16 11599 1 1 18 LEU CA C -3.229 3.644 -3.208 1.00 . A A . 797 LEU CA 1 1 16 11600 1 1 18 LEU CB C -3.443 2.680 -4.374 1.00 . A A . 797 LEU CB 1 1 16 11601 1 1 18 LEU CD1 C -4.859 0.982 -5.563 1.00 . A A . 797 LEU CD1 1 1 16 11602 1 1 18 LEU CD2 C -4.792 1.003 -3.068 1.00 . A A . 797 LEU CD2 1 1 16 11603 1 1 18 LEU CG C -4.732 1.853 -4.324 1.00 . A A . 797 LEU CG 1 1 16 11604 1 1 18 LEU H H -4.980 4.674 -3.693 1.00 . A A . 797 LEU H 1 1 16 11605 1 1 18 LEU HA H -2.951 3.083 -2.330 1.00 . A A . 797 LEU HA 1 1 16 11606 1 1 18 LEU HB2 H -3.448 3.257 -5.280 1.00 . A A . 797 LEU HB2 1 1 16 11607 1 1 18 LEU HB3 H -2.606 1.999 -4.408 1.00 . A A . 797 LEU HB3 1 1 16 11608 1 1 18 LEU HD11 H -4.904 1.610 -6.442 1.00 . A A . 797 LEU HD11 1 1 16 11609 1 1 18 LEU HD12 H -5.761 0.392 -5.499 1.00 . A A . 797 LEU HD12 1 1 16 11610 1 1 18 LEU HD13 H -4.004 0.326 -5.635 1.00 . A A . 797 LEU HD13 1 1 16 11611 1 1 18 LEU HD21 H -4.781 1.645 -2.199 1.00 . A A . 797 LEU HD21 1 1 16 11612 1 1 18 LEU HD22 H -3.940 0.341 -3.037 1.00 . A A . 797 LEU HD22 1 1 16 11613 1 1 18 LEU HD23 H -5.702 0.419 -3.070 1.00 . A A . 797 LEU HD23 1 1 16 11614 1 1 18 LEU HG H -5.575 2.527 -4.308 1.00 . A A . 797 LEU HG 1 1 16 11615 1 1 18 LEU N N -4.450 4.364 -2.934 1.00 . A A . 797 LEU N 1 1 16 11616 1 1 18 LEU O O -2.326 5.646 -4.192 1.00 . A A . 797 LEU O 1 1 16 11617 1 1 19 LEU C C 1.410 3.969 -3.620 1.00 . A A . 798 LEU C 1 1 16 11618 1 1 19 LEU CA C 0.299 4.988 -3.492 1.00 . A A . 798 LEU CA 1 1 16 11619 1 1 19 LEU CB C 0.625 6.130 -2.490 1.00 . A A . 798 LEU CB 1 1 16 11620 1 1 19 LEU CD1 C 0.391 4.668 -0.424 1.00 . A A . 798 LEU CD1 1 1 16 11621 1 1 19 LEU CD2 C 2.661 5.397 -1.207 1.00 . A A . 798 LEU CD2 1 1 16 11622 1 1 19 LEU CG C 1.193 5.766 -1.103 1.00 . A A . 798 LEU CG 1 1 16 11623 1 1 19 LEU H H -0.826 3.452 -2.568 1.00 . A A . 798 LEU H 1 1 16 11624 1 1 19 LEU HA H 0.156 5.412 -4.471 1.00 . A A . 798 LEU HA 1 1 16 11625 1 1 19 LEU HB2 H 1.339 6.783 -2.968 1.00 . A A . 798 LEU HB2 1 1 16 11626 1 1 19 LEU HB3 H -0.284 6.693 -2.336 1.00 . A A . 798 LEU HB3 1 1 16 11627 1 1 19 LEU HD11 H 0.823 4.452 0.542 1.00 . A A . 798 LEU HD11 1 1 16 11628 1 1 19 LEU HD12 H 0.412 3.779 -1.036 1.00 . A A . 798 LEU HD12 1 1 16 11629 1 1 19 LEU HD13 H -0.631 4.995 -0.297 1.00 . A A . 798 LEU HD13 1 1 16 11630 1 1 19 LEU HD21 H 3.008 5.012 -0.260 1.00 . A A . 798 LEU HD21 1 1 16 11631 1 1 19 LEU HD22 H 3.233 6.274 -1.472 1.00 . A A . 798 LEU HD22 1 1 16 11632 1 1 19 LEU HD23 H 2.781 4.646 -1.973 1.00 . A A . 798 LEU HD23 1 1 16 11633 1 1 19 LEU HG H 1.127 6.642 -0.472 1.00 . A A . 798 LEU HG 1 1 16 11634 1 1 19 LEU N N -0.910 4.257 -3.133 1.00 . A A . 798 LEU N 1 1 16 11635 1 1 19 LEU O O 1.355 2.920 -2.978 1.00 . A A . 798 LEU O 1 1 16 11636 1 1 20 LYS C C 4.681 3.294 -4.243 1.00 . A A . 799 LYS C 1 1 16 11637 1 1 20 LYS CA C 3.277 3.125 -4.806 1.00 . A A . 799 LYS CA 1 1 16 11638 1 1 20 LYS CB C 3.290 2.808 -6.308 1.00 . A A . 799 LYS CB 1 1 16 11639 1 1 20 LYS CD C 3.703 5.187 -7.082 1.00 . A A . 799 LYS CD 1 1 16 11640 1 1 20 LYS CE C 4.628 6.106 -7.865 1.00 . A A . 799 LYS CE 1 1 16 11641 1 1 20 LYS CG C 4.162 3.738 -7.153 1.00 . A A . 799 LYS CG 1 1 16 11642 1 1 20 LYS H H 2.490 5.113 -4.858 1.00 . A A . 799 LYS H 1 1 16 11643 1 1 20 LYS HA H 2.848 2.312 -4.248 1.00 . A A . 799 LYS HA 1 1 16 11644 1 1 20 LYS HB2 H 3.651 1.800 -6.443 1.00 . A A . 799 LYS HB2 1 1 16 11645 1 1 20 LYS HB3 H 2.277 2.868 -6.679 1.00 . A A . 799 LYS HB3 1 1 16 11646 1 1 20 LYS HD2 H 2.707 5.259 -7.494 1.00 . A A . 799 LYS HD2 1 1 16 11647 1 1 20 LYS HD3 H 3.690 5.499 -6.048 1.00 . A A . 799 LYS HD3 1 1 16 11648 1 1 20 LYS HE2 H 5.641 5.953 -7.523 1.00 . A A . 799 LYS HE2 1 1 16 11649 1 1 20 LYS HE3 H 4.559 5.859 -8.914 1.00 . A A . 799 LYS HE3 1 1 16 11650 1 1 20 LYS HG2 H 5.179 3.681 -6.797 1.00 . A A . 799 LYS HG2 1 1 16 11651 1 1 20 LYS HG3 H 4.123 3.410 -8.183 1.00 . A A . 799 LYS HG3 1 1 16 11652 1 1 20 LYS HZ1 H 4.368 7.805 -6.675 1.00 . A A . 799 LYS HZ1 1 1 16 11653 1 1 20 LYS HZ2 H 3.283 7.703 -7.975 1.00 . A A . 799 LYS HZ2 1 1 16 11654 1 1 20 LYS HZ3 H 4.894 8.146 -8.252 1.00 . A A . 799 LYS HZ3 1 1 16 11655 1 1 20 LYS N N 2.381 4.214 -4.482 1.00 . A A . 799 LYS N 1 1 16 11656 1 1 20 LYS NZ N 4.269 7.537 -7.679 1.00 . A A . 799 LYS NZ 1 1 16 11657 1 1 20 LYS O O 5.279 4.371 -4.265 1.00 . A A . 799 LYS O 1 1 16 11658 1 1 21 CYS C C 7.532 2.570 -4.137 1.00 . A A . 800 CYS C 1 1 16 11659 1 1 21 CYS CA C 6.488 1.942 -3.225 1.00 . A A . 800 CYS CA 1 1 16 11660 1 1 21 CYS CB C 6.625 0.424 -3.210 1.00 . A A . 800 CYS CB 1 1 16 11661 1 1 21 CYS H H 4.502 1.436 -3.575 1.00 . A A . 800 CYS H 1 1 16 11662 1 1 21 CYS HA H 6.595 2.330 -2.227 1.00 . A A . 800 CYS HA 1 1 16 11663 1 1 21 CYS HB2 H 5.830 0.023 -2.603 1.00 . A A . 800 CYS HB2 1 1 16 11664 1 1 21 CYS HB3 H 6.490 0.067 -4.222 1.00 . A A . 800 CYS HB3 1 1 16 11665 1 1 21 CYS N N 5.137 2.172 -3.698 1.00 . A A . 800 CYS N 1 1 16 11666 1 1 21 CYS O O 7.740 2.118 -5.257 1.00 . A A . 800 CYS O 1 1 16 11667 1 1 21 CYS SG S 8.153 -0.298 -2.592 1.00 . A A . 800 CYS SG 1 1 16 11668 1 1 22 GLU C C 10.449 3.463 -4.682 1.00 . A A . 801 GLU C 1 1 16 11669 1 1 22 GLU CA C 9.222 4.330 -4.384 1.00 . A A . 801 GLU CA 1 1 16 11670 1 1 22 GLU CB C 9.665 5.564 -3.602 1.00 . A A . 801 GLU CB 1 1 16 11671 1 1 22 GLU CD C 9.042 7.796 -2.627 1.00 . A A . 801 GLU CD 1 1 16 11672 1 1 22 GLU CG C 8.541 6.543 -3.308 1.00 . A A . 801 GLU CG 1 1 16 11673 1 1 22 GLU H H 7.887 3.994 -2.781 1.00 . A A . 801 GLU H 1 1 16 11674 1 1 22 GLU HA H 8.813 4.654 -5.329 1.00 . A A . 801 GLU HA 1 1 16 11675 1 1 22 GLU HB2 H 10.088 5.243 -2.661 1.00 . A A . 801 GLU HB2 1 1 16 11676 1 1 22 GLU HB3 H 10.425 6.080 -4.169 1.00 . A A . 801 GLU HB3 1 1 16 11677 1 1 22 GLU HG2 H 8.067 6.820 -4.237 1.00 . A A . 801 GLU HG2 1 1 16 11678 1 1 22 GLU HG3 H 7.820 6.062 -2.663 1.00 . A A . 801 GLU HG3 1 1 16 11679 1 1 22 GLU N N 8.172 3.626 -3.649 1.00 . A A . 801 GLU N 1 1 16 11680 1 1 22 GLU O O 11.444 3.970 -5.197 1.00 . A A . 801 GLU O 1 1 16 11681 1 1 22 GLU OE1 O 9.399 8.760 -3.333 1.00 . A A . 801 GLU OE1 1 1 16 11682 1 1 22 GLU OE2 O 9.060 7.826 -1.378 1.00 . A A . 801 GLU OE2 1 1 16 11683 1 1 23 TYR C C 11.152 0.397 -5.877 1.00 . A A . 802 TYR C 1 1 16 11684 1 1 23 TYR CA C 11.505 1.297 -4.688 1.00 . A A . 802 TYR CA 1 1 16 11685 1 1 23 TYR CB C 11.912 0.455 -3.471 1.00 . A A . 802 TYR CB 1 1 16 11686 1 1 23 TYR CD1 C 14.422 0.551 -3.192 1.00 . A A . 802 TYR CD1 1 1 16 11687 1 1 23 TYR CD2 C 13.460 -1.430 -4.107 1.00 . A A . 802 TYR CD2 1 1 16 11688 1 1 23 TYR CE1 C 15.682 -0.007 -3.297 1.00 . A A . 802 TYR CE1 1 1 16 11689 1 1 23 TYR CE2 C 14.717 -1.997 -4.212 1.00 . A A . 802 TYR CE2 1 1 16 11690 1 1 23 TYR CG C 13.292 -0.148 -3.595 1.00 . A A . 802 TYR CG 1 1 16 11691 1 1 23 TYR CZ C 15.840 -1.236 -3.843 1.00 . A A . 802 TYR CZ 1 1 16 11692 1 1 23 TYR H H 9.593 1.820 -3.939 1.00 . A A . 802 TYR H 1 1 16 11693 1 1 23 TYR HA H 12.333 1.923 -4.982 1.00 . A A . 802 TYR HA 1 1 16 11694 1 1 23 TYR HB2 H 11.902 1.078 -2.585 1.00 . A A . 802 TYR HB2 1 1 16 11695 1 1 23 TYR HB3 H 11.205 -0.353 -3.345 1.00 . A A . 802 TYR HB3 1 1 16 11696 1 1 23 TYR HD1 H 14.307 1.548 -2.793 1.00 . A A . 802 TYR HD1 1 1 16 11697 1 1 23 TYR HD2 H 12.592 -1.987 -4.425 1.00 . A A . 802 TYR HD2 1 1 16 11698 1 1 23 TYR HE1 H 16.548 0.554 -2.978 1.00 . A A . 802 TYR HE1 1 1 16 11699 1 1 23 TYR HE2 H 14.827 -2.993 -4.613 1.00 . A A . 802 TYR HE2 1 1 16 11700 1 1 23 TYR HH H 17.169 -2.278 -4.767 1.00 . A A . 802 TYR HH 1 1 16 11701 1 1 23 TYR N N 10.393 2.178 -4.370 1.00 . A A . 802 TYR N 1 1 16 11702 1 1 23 TYR O O 11.976 0.183 -6.768 1.00 . A A . 802 TYR O 1 1 16 11703 1 1 23 TYR OH O 17.076 -1.846 -3.901 1.00 . A A . 802 TYR OH 1 1 16 11704 1 1 24 CYS C C 8.328 -0.426 -7.784 1.00 . A A . 803 CYS C 1 1 16 11705 1 1 24 CYS CA C 9.489 -1.008 -6.978 1.00 . A A . 803 CYS CA 1 1 16 11706 1 1 24 CYS CB C 9.113 -2.380 -6.420 1.00 . A A . 803 CYS CB 1 1 16 11707 1 1 24 CYS H H 9.330 0.054 -5.143 1.00 . A A . 803 CYS H 1 1 16 11708 1 1 24 CYS HA H 10.300 -1.119 -7.681 1.00 . A A . 803 CYS HA 1 1 16 11709 1 1 24 CYS HB2 H 8.657 -2.968 -7.203 1.00 . A A . 803 CYS HB2 1 1 16 11710 1 1 24 CYS HB3 H 10.006 -2.878 -6.074 1.00 . A A . 803 CYS HB3 1 1 16 11711 1 1 24 CYS N N 9.931 -0.125 -5.893 1.00 . A A . 803 CYS N 1 1 16 11712 1 1 24 CYS O O 8.219 -0.685 -8.981 1.00 . A A . 803 CYS O 1 1 16 11713 1 1 24 CYS SG S 7.949 -2.313 -5.030 1.00 . A A . 803 CYS SG 1 1 16 11714 1 1 25 GLY C C 5.076 0.212 -7.764 1.00 . A A . 804 GLY C 1 1 16 11715 1 1 25 GLY CA C 6.380 0.976 -7.879 1.00 . A A . 804 GLY CA 1 1 16 11716 1 1 25 GLY H H 7.589 0.533 -6.198 1.00 . A A . 804 GLY H 1 1 16 11717 1 1 25 GLY HA2 H 6.232 1.974 -7.495 1.00 . A A . 804 GLY HA2 1 1 16 11718 1 1 25 GLY HA3 H 6.654 1.044 -8.922 1.00 . A A . 804 GLY HA3 1 1 16 11719 1 1 25 GLY N N 7.471 0.354 -7.152 1.00 . A A . 804 GLY N 1 1 16 11720 1 1 25 GLY O O 4.194 0.355 -8.609 1.00 . A A . 804 GLY O 1 1 16 11721 1 1 26 LYS C C 2.674 -0.489 -5.827 1.00 . A A . 805 LYS C 1 1 16 11722 1 1 26 LYS CA C 3.723 -1.360 -6.505 1.00 . A A . 805 LYS CA 1 1 16 11723 1 1 26 LYS CB C 4.009 -2.592 -5.647 1.00 . A A . 805 LYS CB 1 1 16 11724 1 1 26 LYS CD C 4.017 -4.337 -7.460 1.00 . A A . 805 LYS CD 1 1 16 11725 1 1 26 LYS CE C 4.777 -5.501 -8.081 1.00 . A A . 805 LYS CE 1 1 16 11726 1 1 26 LYS CG C 4.818 -3.666 -6.354 1.00 . A A . 805 LYS CG 1 1 16 11727 1 1 26 LYS H H 5.664 -0.659 -6.066 1.00 . A A . 805 LYS H 1 1 16 11728 1 1 26 LYS HA H 3.353 -1.676 -7.468 1.00 . A A . 805 LYS HA 1 1 16 11729 1 1 26 LYS HB2 H 4.559 -2.284 -4.770 1.00 . A A . 805 LYS HB2 1 1 16 11730 1 1 26 LYS HB3 H 3.072 -3.027 -5.336 1.00 . A A . 805 LYS HB3 1 1 16 11731 1 1 26 LYS HD2 H 3.090 -4.705 -7.046 1.00 . A A . 805 LYS HD2 1 1 16 11732 1 1 26 LYS HD3 H 3.803 -3.607 -8.229 1.00 . A A . 805 LYS HD3 1 1 16 11733 1 1 26 LYS HE2 H 4.155 -5.957 -8.836 1.00 . A A . 805 LYS HE2 1 1 16 11734 1 1 26 LYS HE3 H 5.680 -5.122 -8.538 1.00 . A A . 805 LYS HE3 1 1 16 11735 1 1 26 LYS HG2 H 5.697 -3.213 -6.787 1.00 . A A . 805 LYS HG2 1 1 16 11736 1 1 26 LYS HG3 H 5.115 -4.414 -5.633 1.00 . A A . 805 LYS HG3 1 1 16 11737 1 1 26 LYS HZ1 H 5.873 -6.162 -6.424 1.00 . A A . 805 LYS HZ1 1 1 16 11738 1 1 26 LYS HZ2 H 5.507 -7.387 -7.538 1.00 . A A . 805 LYS HZ2 1 1 16 11739 1 1 26 LYS HZ3 H 4.302 -6.792 -6.504 1.00 . A A . 805 LYS HZ3 1 1 16 11740 1 1 26 LYS N N 4.946 -0.598 -6.726 1.00 . A A . 805 LYS N 1 1 16 11741 1 1 26 LYS NZ N 5.140 -6.530 -7.068 1.00 . A A . 805 LYS NZ 1 1 16 11742 1 1 26 LYS O O 2.951 0.128 -4.800 1.00 . A A . 805 LYS O 1 1 16 11743 1 1 27 TYR C C -0.358 -0.504 -4.802 1.00 . A A . 806 TYR C 1 1 16 11744 1 1 27 TYR CA C 0.392 0.331 -5.817 1.00 . A A . 806 TYR CA 1 1 16 11745 1 1 27 TYR CB C -0.582 0.825 -6.888 1.00 . A A . 806 TYR CB 1 1 16 11746 1 1 27 TYR CD1 C -0.234 3.311 -7.171 1.00 . A A . 806 TYR CD1 1 1 16 11747 1 1 27 TYR CD2 C 0.510 1.858 -8.907 1.00 . A A . 806 TYR CD2 1 1 16 11748 1 1 27 TYR CE1 C 0.220 4.401 -7.885 1.00 . A A . 806 TYR CE1 1 1 16 11749 1 1 27 TYR CE2 C 0.969 2.942 -9.624 1.00 . A A . 806 TYR CE2 1 1 16 11750 1 1 27 TYR CG C -0.099 2.023 -7.671 1.00 . A A . 806 TYR CG 1 1 16 11751 1 1 27 TYR CZ C 0.755 4.239 -9.109 1.00 . A A . 806 TYR CZ 1 1 16 11752 1 1 27 TYR H H 1.286 -1.033 -7.157 1.00 . A A . 806 TYR H 1 1 16 11753 1 1 27 TYR HA H 0.805 1.179 -5.291 1.00 . A A . 806 TYR HA 1 1 16 11754 1 1 27 TYR HB2 H -0.764 0.029 -7.587 1.00 . A A . 806 TYR HB2 1 1 16 11755 1 1 27 TYR HB3 H -1.514 1.096 -6.414 1.00 . A A . 806 TYR HB3 1 1 16 11756 1 1 27 TYR HD1 H -0.707 3.456 -6.207 1.00 . A A . 806 TYR HD1 1 1 16 11757 1 1 27 TYR HD2 H 0.621 0.861 -9.308 1.00 . A A . 806 TYR HD2 1 1 16 11758 1 1 27 TYR HE1 H 0.104 5.397 -7.481 1.00 . A A . 806 TYR HE1 1 1 16 11759 1 1 27 TYR HE2 H 1.439 2.794 -10.583 1.00 . A A . 806 TYR HE2 1 1 16 11760 1 1 27 TYR HH H 1.859 5.823 -9.253 1.00 . A A . 806 TYR HH 1 1 16 11761 1 1 27 TYR N N 1.476 -0.454 -6.387 1.00 . A A . 806 TYR N 1 1 16 11762 1 1 27 TYR O O -0.780 -1.627 -5.087 1.00 . A A . 806 TYR O 1 1 16 11763 1 1 27 TYR OH O 1.279 5.291 -9.824 1.00 . A A . 806 TYR OH 1 1 16 11764 1 1 28 ALA C C -1.721 0.376 -1.548 1.00 . A A . 807 ALA C 1 1 16 11765 1 1 28 ALA CA C -1.137 -0.632 -2.517 1.00 . A A . 807 ALA CA 1 1 16 11766 1 1 28 ALA CB C -0.106 -1.506 -1.824 1.00 . A A . 807 ALA CB 1 1 16 11767 1 1 28 ALA H H -0.189 0.980 -3.488 1.00 . A A . 807 ALA H 1 1 16 11768 1 1 28 ALA HA H -1.924 -1.263 -2.904 1.00 . A A . 807 ALA HA 1 1 16 11769 1 1 28 ALA HB1 H -0.569 -2.026 -0.999 1.00 . A A . 807 ALA HB1 1 1 16 11770 1 1 28 ALA HB2 H 0.699 -0.887 -1.456 1.00 . A A . 807 ALA HB2 1 1 16 11771 1 1 28 ALA HB3 H 0.287 -2.226 -2.528 1.00 . A A . 807 ALA HB3 1 1 16 11772 1 1 28 ALA N N -0.516 0.060 -3.623 1.00 . A A . 807 ALA N 1 1 16 11773 1 1 28 ALA O O -1.325 1.544 -1.551 1.00 . A A . 807 ALA O 1 1 16 11774 1 1 29 PRO C C -2.337 1.344 1.259 1.00 . A A . 808 PRO C 1 1 16 11775 1 1 29 PRO CA C -3.337 0.837 0.233 1.00 . A A . 808 PRO CA 1 1 16 11776 1 1 29 PRO CB C -4.402 -0.039 0.901 1.00 . A A . 808 PRO CB 1 1 16 11777 1 1 29 PRO CD C -3.255 -1.407 -0.698 1.00 . A A . 808 PRO CD 1 1 16 11778 1 1 29 PRO CG C -4.556 -1.234 0.029 1.00 . A A . 808 PRO CG 1 1 16 11779 1 1 29 PRO HA H -3.808 1.680 -0.256 1.00 . A A . 808 PRO HA 1 1 16 11780 1 1 29 PRO HB2 H -4.076 -0.319 1.885 1.00 . A A . 808 PRO HB2 1 1 16 11781 1 1 29 PRO HB3 H -5.325 0.516 0.969 1.00 . A A . 808 PRO HB3 1 1 16 11782 1 1 29 PRO HD2 H -2.606 -2.076 -0.153 1.00 . A A . 808 PRO HD2 1 1 16 11783 1 1 29 PRO HD3 H -3.428 -1.779 -1.698 1.00 . A A . 808 PRO HD3 1 1 16 11784 1 1 29 PRO HG2 H -4.760 -2.104 0.635 1.00 . A A . 808 PRO HG2 1 1 16 11785 1 1 29 PRO HG3 H -5.356 -1.070 -0.668 1.00 . A A . 808 PRO HG3 1 1 16 11786 1 1 29 PRO N N -2.700 -0.045 -0.734 1.00 . A A . 808 PRO N 1 1 16 11787 1 1 29 PRO O O -1.603 0.560 1.864 1.00 . A A . 808 PRO O 1 1 16 11788 1 1 30 ALA C C -1.264 2.672 3.709 1.00 . A A . 809 ALA C 1 1 16 11789 1 1 30 ALA CA C -1.390 3.351 2.334 1.00 . A A . 809 ALA CA 1 1 16 11790 1 1 30 ALA CB C -1.835 4.796 2.507 1.00 . A A . 809 ALA CB 1 1 16 11791 1 1 30 ALA H H -2.893 3.217 0.830 1.00 . A A . 809 ALA H 1 1 16 11792 1 1 30 ALA HA H -0.425 3.368 1.849 1.00 . A A . 809 ALA HA 1 1 16 11793 1 1 30 ALA HB1 H -2.777 4.822 3.035 1.00 . A A . 809 ALA HB1 1 1 16 11794 1 1 30 ALA HB2 H -1.953 5.255 1.537 1.00 . A A . 809 ALA HB2 1 1 16 11795 1 1 30 ALA HB3 H -1.090 5.337 3.073 1.00 . A A . 809 ALA HB3 1 1 16 11796 1 1 30 ALA N N -2.307 2.667 1.410 1.00 . A A . 809 ALA N 1 1 16 11797 1 1 30 ALA O O -0.224 2.777 4.355 1.00 . A A . 809 ALA O 1 1 16 11798 1 1 31 GLU C C -1.225 0.262 5.556 1.00 . A A . 810 GLU C 1 1 16 11799 1 1 31 GLU CA C -2.331 1.305 5.446 1.00 . A A . 810 GLU CA 1 1 16 11800 1 1 31 GLU CB C -3.676 0.618 5.686 1.00 . A A . 810 GLU CB 1 1 16 11801 1 1 31 GLU CD C -6.127 0.869 6.192 1.00 . A A . 810 GLU CD 1 1 16 11802 1 1 31 GLU CG C -4.860 1.566 5.740 1.00 . A A . 810 GLU CG 1 1 16 11803 1 1 31 GLU H H -3.083 1.875 3.545 1.00 . A A . 810 GLU H 1 1 16 11804 1 1 31 GLU HA H -2.181 2.042 6.219 1.00 . A A . 810 GLU HA 1 1 16 11805 1 1 31 GLU HB2 H -3.850 -0.088 4.888 1.00 . A A . 810 GLU HB2 1 1 16 11806 1 1 31 GLU HB3 H -3.629 0.082 6.622 1.00 . A A . 810 GLU HB3 1 1 16 11807 1 1 31 GLU HG2 H -4.637 2.360 6.438 1.00 . A A . 810 GLU HG2 1 1 16 11808 1 1 31 GLU HG3 H -5.024 1.983 4.757 1.00 . A A . 810 GLU HG3 1 1 16 11809 1 1 31 GLU N N -2.318 1.980 4.143 1.00 . A A . 810 GLU N 1 1 16 11810 1 1 31 GLU O O -0.711 -0.001 6.640 1.00 . A A . 810 GLU O 1 1 16 11811 1 1 31 GLU OE1 O -6.492 -0.164 5.591 1.00 . A A . 810 GLU OE1 1 1 16 11812 1 1 31 GLU OE2 O -6.779 1.364 7.132 1.00 . A A . 810 GLU OE2 1 1 16 11813 1 1 32 GLN C C 1.511 -0.839 4.594 1.00 . A A . 811 GLN C 1 1 16 11814 1 1 32 GLN CA C 0.110 -1.394 4.403 1.00 . A A . 811 GLN CA 1 1 16 11815 1 1 32 GLN CB C -0.008 -2.149 3.083 1.00 . A A . 811 GLN CB 1 1 16 11816 1 1 32 GLN CD C 0.998 -3.750 1.444 1.00 . A A . 811 GLN CD 1 1 16 11817 1 1 32 GLN CG C 1.131 -3.108 2.802 1.00 . A A . 811 GLN CG 1 1 16 11818 1 1 32 GLN H H -1.232 0.007 3.576 1.00 . A A . 811 GLN H 1 1 16 11819 1 1 32 GLN HA H -0.122 -2.059 5.221 1.00 . A A . 811 GLN HA 1 1 16 11820 1 1 32 GLN HB2 H -0.926 -2.714 3.090 1.00 . A A . 811 GLN HB2 1 1 16 11821 1 1 32 GLN HB3 H -0.046 -1.431 2.277 1.00 . A A . 811 GLN HB3 1 1 16 11822 1 1 32 GLN HE21 H 1.837 -2.163 0.597 1.00 . A A . 811 GLN HE21 1 1 16 11823 1 1 32 GLN HE22 H 1.366 -3.433 -0.480 1.00 . A A . 811 GLN HE22 1 1 16 11824 1 1 32 GLN HG2 H 2.064 -2.566 2.842 1.00 . A A . 811 GLN HG2 1 1 16 11825 1 1 32 GLN HG3 H 1.130 -3.883 3.556 1.00 . A A . 811 GLN HG3 1 1 16 11826 1 1 32 GLN N N -0.857 -0.316 4.424 1.00 . A A . 811 GLN N 1 1 16 11827 1 1 32 GLN NE2 N 1.450 -3.046 0.418 1.00 . A A . 811 GLN NE2 1 1 16 11828 1 1 32 GLN O O 2.415 -1.533 5.068 1.00 . A A . 811 GLN O 1 1 16 11829 1 1 32 GLN OE1 O 0.453 -4.844 1.307 1.00 . A A . 811 GLN OE1 1 1 16 11830 1 1 33 PHE C C 3.209 1.422 5.867 1.00 . A A . 812 PHE C 1 1 16 11831 1 1 33 PHE CA C 2.943 1.115 4.392 1.00 . A A . 812 PHE CA 1 1 16 11832 1 1 33 PHE CB C 2.920 2.405 3.573 1.00 . A A . 812 PHE CB 1 1 16 11833 1 1 33 PHE CD1 C 1.776 1.604 1.478 1.00 . A A . 812 PHE CD1 1 1 16 11834 1 1 33 PHE CD2 C 3.969 2.515 1.298 1.00 . A A . 812 PHE CD2 1 1 16 11835 1 1 33 PHE CE1 C 1.750 1.384 0.116 1.00 . A A . 812 PHE CE1 1 1 16 11836 1 1 33 PHE CE2 C 3.950 2.298 -0.066 1.00 . A A . 812 PHE CE2 1 1 16 11837 1 1 33 PHE CG C 2.886 2.170 2.086 1.00 . A A . 812 PHE CG 1 1 16 11838 1 1 33 PHE CZ C 2.840 1.731 -0.658 1.00 . A A . 812 PHE CZ 1 1 16 11839 1 1 33 PHE H H 0.982 0.859 3.690 1.00 . A A . 812 PHE H 1 1 16 11840 1 1 33 PHE HA H 3.720 0.481 3.994 1.00 . A A . 812 PHE HA 1 1 16 11841 1 1 33 PHE HB2 H 2.043 2.977 3.838 1.00 . A A . 812 PHE HB2 1 1 16 11842 1 1 33 PHE HB3 H 3.803 2.982 3.799 1.00 . A A . 812 PHE HB3 1 1 16 11843 1 1 33 PHE HD1 H 0.923 1.332 2.079 1.00 . A A . 812 PHE HD1 1 1 16 11844 1 1 33 PHE HD2 H 4.838 2.961 1.760 1.00 . A A . 812 PHE HD2 1 1 16 11845 1 1 33 PHE HE1 H 0.879 0.943 -0.346 1.00 . A A . 812 PHE HE1 1 1 16 11846 1 1 33 PHE HE2 H 4.804 2.570 -0.669 1.00 . A A . 812 PHE HE2 1 1 16 11847 1 1 33 PHE HZ H 2.824 1.559 -1.723 1.00 . A A . 812 PHE HZ 1 1 16 11848 1 1 33 PHE N N 1.684 0.416 4.210 1.00 . A A . 812 PHE N 1 1 16 11849 1 1 33 PHE O O 3.170 2.575 6.297 1.00 . A A . 812 PHE O 1 1 16 11850 1 1 34 ARG C C 5.242 1.063 8.151 1.00 . A A . 813 ARG C 1 1 16 11851 1 1 34 ARG CA C 3.837 0.488 8.033 1.00 . A A . 813 ARG CA 1 1 16 11852 1 1 34 ARG CB C 3.791 -0.889 8.705 1.00 . A A . 813 ARG CB 1 1 16 11853 1 1 34 ARG CD C 1.360 -0.757 9.357 1.00 . A A . 813 ARG CD 1 1 16 11854 1 1 34 ARG CG C 2.429 -1.570 8.643 1.00 . A A . 813 ARG CG 1 1 16 11855 1 1 34 ARG CZ C -1.074 -0.860 9.771 1.00 . A A . 813 ARG CZ 1 1 16 11856 1 1 34 ARG H H 3.364 -0.525 6.238 1.00 . A A . 813 ARG H 1 1 16 11857 1 1 34 ARG HA H 3.144 1.147 8.538 1.00 . A A . 813 ARG HA 1 1 16 11858 1 1 34 ARG HB2 H 4.512 -1.533 8.223 1.00 . A A . 813 ARG HB2 1 1 16 11859 1 1 34 ARG HB3 H 4.065 -0.778 9.743 1.00 . A A . 813 ARG HB3 1 1 16 11860 1 1 34 ARG HD2 H 1.660 -0.614 10.385 1.00 . A A . 813 ARG HD2 1 1 16 11861 1 1 34 ARG HD3 H 1.274 0.206 8.871 1.00 . A A . 813 ARG HD3 1 1 16 11862 1 1 34 ARG HE H 0.018 -2.331 8.953 1.00 . A A . 813 ARG HE 1 1 16 11863 1 1 34 ARG HG2 H 2.144 -1.689 7.609 1.00 . A A . 813 ARG HG2 1 1 16 11864 1 1 34 ARG HG3 H 2.502 -2.542 9.110 1.00 . A A . 813 ARG HG3 1 1 16 11865 1 1 34 ARG HH11 H -0.186 0.867 10.358 1.00 . A A . 813 ARG HH11 1 1 16 11866 1 1 34 ARG HH12 H -1.903 0.781 10.624 1.00 . A A . 813 ARG HH12 1 1 16 11867 1 1 34 ARG HH21 H -2.256 -2.453 9.332 1.00 . A A . 813 ARG HH21 1 1 16 11868 1 1 34 ARG HH22 H -3.072 -1.082 10.033 1.00 . A A . 813 ARG HH22 1 1 16 11869 1 1 34 ARG N N 3.466 0.370 6.629 1.00 . A A . 813 ARG N 1 1 16 11870 1 1 34 ARG NE N 0.054 -1.420 9.330 1.00 . A A . 813 ARG NE 1 1 16 11871 1 1 34 ARG NH1 N -1.052 0.359 10.293 1.00 . A A . 813 ARG NH1 1 1 16 11872 1 1 34 ARG NH2 N -2.222 -1.520 9.711 1.00 . A A . 813 ARG NH2 1 1 16 11873 1 1 34 ARG O O 5.512 1.900 9.014 1.00 . A A . 813 ARG O 1 1 16 11874 1 1 35 GLY C C 7.510 2.445 6.405 1.00 . A A . 814 GLY C 1 1 16 11875 1 1 35 GLY CA C 7.468 1.173 7.223 1.00 . A A . 814 GLY CA 1 1 16 11876 1 1 35 GLY H H 5.875 -0.096 6.655 1.00 . A A . 814 GLY H 1 1 16 11877 1 1 35 GLY HA2 H 7.796 1.388 8.230 1.00 . A A . 814 GLY HA2 1 1 16 11878 1 1 35 GLY HA3 H 8.134 0.448 6.781 1.00 . A A . 814 GLY HA3 1 1 16 11879 1 1 35 GLY N N 6.131 0.618 7.273 1.00 . A A . 814 GLY N 1 1 16 11880 1 1 35 GLY O O 8.189 2.503 5.378 1.00 . A A . 814 GLY O 1 1 16 11881 1 1 36 SER C C 5.827 4.593 4.887 1.00 . A A . 815 SER C 1 1 16 11882 1 1 36 SER CA C 6.646 4.737 6.175 1.00 . A A . 815 SER CA 1 1 16 11883 1 1 36 SER CB C 8.030 5.327 5.873 1.00 . A A . 815 SER CB 1 1 16 11884 1 1 36 SER H H 6.278 3.329 7.709 1.00 . A A . 815 SER H 1 1 16 11885 1 1 36 SER HA H 6.109 5.422 6.814 1.00 . A A . 815 SER HA 1 1 16 11886 1 1 36 SER HB2 H 8.551 4.681 5.183 1.00 . A A . 815 SER HB2 1 1 16 11887 1 1 36 SER HB3 H 7.912 6.306 5.431 1.00 . A A . 815 SER HB3 1 1 16 11888 1 1 36 SER HG H 8.225 5.679 7.799 1.00 . A A . 815 SER HG 1 1 16 11889 1 1 36 SER N N 6.768 3.456 6.868 1.00 . A A . 815 SER N 1 1 16 11890 1 1 36 SER O O 5.898 3.576 4.189 1.00 . A A . 815 SER O 1 1 16 11891 1 1 36 SER OG O 8.807 5.450 7.057 1.00 . A A . 815 SER OG 1 1 16 11892 1 1 37 LYS C C 5.035 5.886 2.150 1.00 . A A . 816 LYS C 1 1 16 11893 1 1 37 LYS CA C 4.187 5.639 3.396 1.00 . A A . 816 LYS CA 1 1 16 11894 1 1 37 LYS CB C 3.120 6.737 3.518 1.00 . A A . 816 LYS CB 1 1 16 11895 1 1 37 LYS CD C 1.483 5.372 4.853 1.00 . A A . 816 LYS CD 1 1 16 11896 1 1 37 LYS CE C 0.659 5.291 6.128 1.00 . A A . 816 LYS CE 1 1 16 11897 1 1 37 LYS CG C 2.284 6.659 4.786 1.00 . A A . 816 LYS CG 1 1 16 11898 1 1 37 LYS H H 5.052 6.422 5.165 1.00 . A A . 816 LYS H 1 1 16 11899 1 1 37 LYS HA H 3.698 4.675 3.313 1.00 . A A . 816 LYS HA 1 1 16 11900 1 1 37 LYS HB2 H 3.611 7.698 3.497 1.00 . A A . 816 LYS HB2 1 1 16 11901 1 1 37 LYS HB3 H 2.454 6.666 2.671 1.00 . A A . 816 LYS HB3 1 1 16 11902 1 1 37 LYS HD2 H 0.819 5.329 4.004 1.00 . A A . 816 LYS HD2 1 1 16 11903 1 1 37 LYS HD3 H 2.165 4.534 4.821 1.00 . A A . 816 LYS HD3 1 1 16 11904 1 1 37 LYS HE2 H 0.176 4.325 6.168 1.00 . A A . 816 LYS HE2 1 1 16 11905 1 1 37 LYS HE3 H 1.320 5.396 6.975 1.00 . A A . 816 LYS HE3 1 1 16 11906 1 1 37 LYS HG2 H 2.940 6.705 5.641 1.00 . A A . 816 LYS HG2 1 1 16 11907 1 1 37 LYS HG3 H 1.603 7.498 4.808 1.00 . A A . 816 LYS HG3 1 1 16 11908 1 1 37 LYS HZ1 H 0.052 7.295 6.074 1.00 . A A . 816 LYS HZ1 1 1 16 11909 1 1 37 LYS HZ2 H -0.871 6.324 7.111 1.00 . A A . 816 LYS HZ2 1 1 16 11910 1 1 37 LYS HZ3 H -1.088 6.212 5.439 1.00 . A A . 816 LYS HZ3 1 1 16 11911 1 1 37 LYS N N 5.039 5.624 4.585 1.00 . A A . 816 LYS N 1 1 16 11912 1 1 37 LYS NZ N -0.382 6.353 6.190 1.00 . A A . 816 LYS NZ 1 1 16 11913 1 1 37 LYS O O 4.801 6.835 1.398 1.00 . A A . 816 LYS O 1 1 16 11914 1 1 38 ARG C C 7.379 3.797 0.340 1.00 . A A . 817 ARG C 1 1 16 11915 1 1 38 ARG CA C 6.999 5.169 0.879 1.00 . A A . 817 ARG CA 1 1 16 11916 1 1 38 ARG CB C 8.265 5.875 1.383 1.00 . A A . 817 ARG CB 1 1 16 11917 1 1 38 ARG CD C 9.333 8.053 2.078 1.00 . A A . 817 ARG CD 1 1 16 11918 1 1 38 ARG CG C 8.030 7.316 1.808 1.00 . A A . 817 ARG CG 1 1 16 11919 1 1 38 ARG CZ C 10.354 8.064 4.326 1.00 . A A . 817 ARG CZ 1 1 16 11920 1 1 38 ARG H H 6.130 4.263 2.554 1.00 . A A . 817 ARG H 1 1 16 11921 1 1 38 ARG HA H 6.595 5.740 0.057 1.00 . A A . 817 ARG HA 1 1 16 11922 1 1 38 ARG HB2 H 8.651 5.330 2.232 1.00 . A A . 817 ARG HB2 1 1 16 11923 1 1 38 ARG HB3 H 9.004 5.869 0.595 1.00 . A A . 817 ARG HB3 1 1 16 11924 1 1 38 ARG HD2 H 9.928 8.038 1.178 1.00 . A A . 817 ARG HD2 1 1 16 11925 1 1 38 ARG HD3 H 9.101 9.076 2.337 1.00 . A A . 817 ARG HD3 1 1 16 11926 1 1 38 ARG HE H 10.497 6.566 3.004 1.00 . A A . 817 ARG HE 1 1 16 11927 1 1 38 ARG HG2 H 7.500 7.830 1.019 1.00 . A A . 817 ARG HG2 1 1 16 11928 1 1 38 ARG HG3 H 7.430 7.323 2.707 1.00 . A A . 817 ARG HG3 1 1 16 11929 1 1 38 ARG HH11 H 9.174 9.671 3.927 1.00 . A A . 817 ARG HH11 1 1 16 11930 1 1 38 ARG HH12 H 9.975 9.696 5.473 1.00 . A A . 817 ARG HH12 1 1 16 11931 1 1 38 ARG HH21 H 11.568 6.602 5.042 1.00 . A A . 817 ARG HH21 1 1 16 11932 1 1 38 ARG HH22 H 11.333 7.963 6.102 1.00 . A A . 817 ARG HH22 1 1 16 11933 1 1 38 ARG N N 6.027 5.032 1.952 1.00 . A A . 817 ARG N 1 1 16 11934 1 1 38 ARG NE N 10.108 7.453 3.166 1.00 . A A . 817 ARG NE 1 1 16 11935 1 1 38 ARG NH1 N 9.790 9.235 4.595 1.00 . A A . 817 ARG NH1 1 1 16 11936 1 1 38 ARG NH2 N 11.145 7.495 5.226 1.00 . A A . 817 ARG NH2 1 1 16 11937 1 1 38 ARG O O 7.697 3.662 -0.840 1.00 . A A . 817 ARG O 1 1 16 11938 1 1 39 PHE C C 6.703 0.405 1.326 1.00 . A A . 818 PHE C 1 1 16 11939 1 1 39 PHE CA C 7.683 1.422 0.755 1.00 . A A . 818 PHE CA 1 1 16 11940 1 1 39 PHE CB C 9.099 1.064 1.201 1.00 . A A . 818 PHE CB 1 1 16 11941 1 1 39 PHE CD1 C 10.594 2.124 -0.513 1.00 . A A . 818 PHE CD1 1 1 16 11942 1 1 39 PHE CD2 C 10.657 2.967 1.719 1.00 . A A . 818 PHE CD2 1 1 16 11943 1 1 39 PHE CE1 C 11.555 3.041 -0.890 1.00 . A A . 818 PHE CE1 1 1 16 11944 1 1 39 PHE CE2 C 11.620 3.885 1.347 1.00 . A A . 818 PHE CE2 1 1 16 11945 1 1 39 PHE CG C 10.134 2.075 0.794 1.00 . A A . 818 PHE CG 1 1 16 11946 1 1 39 PHE CZ C 12.025 3.964 0.039 1.00 . A A . 818 PHE CZ 1 1 16 11947 1 1 39 PHE H H 7.068 2.914 2.125 1.00 . A A . 818 PHE H 1 1 16 11948 1 1 39 PHE HA H 7.641 1.395 -0.324 1.00 . A A . 818 PHE HA 1 1 16 11949 1 1 39 PHE HB2 H 9.121 0.981 2.278 1.00 . A A . 818 PHE HB2 1 1 16 11950 1 1 39 PHE HB3 H 9.367 0.115 0.766 1.00 . A A . 818 PHE HB3 1 1 16 11951 1 1 39 PHE HD1 H 10.192 1.435 -1.241 1.00 . A A . 818 PHE HD1 1 1 16 11952 1 1 39 PHE HD2 H 10.308 2.937 2.740 1.00 . A A . 818 PHE HD2 1 1 16 11953 1 1 39 PHE HE1 H 11.906 3.068 -1.911 1.00 . A A . 818 PHE HE1 1 1 16 11954 1 1 39 PHE HE2 H 12.019 4.576 2.076 1.00 . A A . 818 PHE HE2 1 1 16 11955 1 1 39 PHE HZ H 12.760 4.698 -0.253 1.00 . A A . 818 PHE HZ 1 1 16 11956 1 1 39 PHE N N 7.335 2.770 1.190 1.00 . A A . 818 PHE N 1 1 16 11957 1 1 39 PHE O O 6.635 0.204 2.538 1.00 . A A . 818 PHE O 1 1 16 11958 1 1 40 CYS C C 5.497 -2.329 1.679 1.00 . A A . 819 CYS C 1 1 16 11959 1 1 40 CYS CA C 4.940 -1.204 0.806 1.00 . A A . 819 CYS CA 1 1 16 11960 1 1 40 CYS CB C 4.391 -1.808 -0.490 1.00 . A A . 819 CYS CB 1 1 16 11961 1 1 40 CYS H H 5.871 0.157 -0.463 1.00 . A A . 819 CYS H 1 1 16 11962 1 1 40 CYS HA H 4.108 -0.697 1.274 1.00 . A A . 819 CYS HA 1 1 16 11963 1 1 40 CYS HB2 H 3.933 -2.752 -0.265 1.00 . A A . 819 CYS HB2 1 1 16 11964 1 1 40 CYS HB3 H 3.644 -1.141 -0.897 1.00 . A A . 819 CYS HB3 1 1 16 11965 1 1 40 CYS N N 5.916 -0.193 0.441 1.00 . A A . 819 CYS N 1 1 16 11966 1 1 40 CYS O O 6.289 -3.127 1.202 1.00 . A A . 819 CYS O 1 1 16 11967 1 1 40 CYS SG S 5.630 -2.096 -1.780 1.00 . A A . 819 CYS SG 1 1 16 11968 1 1 41 SER C C 6.577 -3.594 4.523 1.00 . A A . 820 SER C 1 1 16 11969 1 1 41 SER CA C 5.207 -3.525 3.834 1.00 . A A . 820 SER CA 1 1 16 11970 1 1 41 SER CB C 4.872 -4.838 3.090 1.00 . A A . 820 SER CB 1 1 16 11971 1 1 41 SER H H 4.950 -1.506 3.430 1.00 . A A . 820 SER H 1 1 16 11972 1 1 41 SER HA H 4.413 -3.341 4.549 1.00 . A A . 820 SER HA 1 1 16 11973 1 1 41 SER HB2 H 4.615 -5.598 3.812 1.00 . A A . 820 SER HB2 1 1 16 11974 1 1 41 SER HB3 H 4.026 -4.664 2.439 1.00 . A A . 820 SER HB3 1 1 16 11975 1 1 41 SER HG H 6.183 -4.647 1.638 1.00 . A A . 820 SER HG 1 1 16 11976 1 1 41 SER N N 5.128 -2.342 2.960 1.00 . A A . 820 SER N 1 1 16 11977 1 1 41 SER O O 7.306 -2.598 4.564 1.00 . A A . 820 SER O 1 1 16 11978 1 1 41 SER OG O 5.959 -5.313 2.308 1.00 . A A . 820 SER OG 1 1 16 11979 1 1 42 MET C C 9.347 -5.202 4.714 1.00 . A A . 821 MET C 1 1 16 11980 1 1 42 MET CA C 8.230 -4.920 5.710 1.00 . A A . 821 MET CA 1 1 16 11981 1 1 42 MET CB C 8.150 -6.058 6.727 1.00 . A A . 821 MET CB 1 1 16 11982 1 1 42 MET CE C 7.953 -3.017 8.419 1.00 . A A . 821 MET CE 1 1 16 11983 1 1 42 MET CG C 7.334 -5.729 7.972 1.00 . A A . 821 MET CG 1 1 16 11984 1 1 42 MET H H 6.362 -5.542 4.922 1.00 . A A . 821 MET H 1 1 16 11985 1 1 42 MET HA H 8.442 -4.011 6.242 1.00 . A A . 821 MET HA 1 1 16 11986 1 1 42 MET HB2 H 7.704 -6.917 6.249 1.00 . A A . 821 MET HB2 1 1 16 11987 1 1 42 MET HB3 H 9.153 -6.314 7.039 1.00 . A A . 821 MET HB3 1 1 16 11988 1 1 42 MET HE1 H 8.109 -2.265 9.179 1.00 . A A . 821 MET HE1 1 1 16 11989 1 1 42 MET HE2 H 6.948 -2.938 8.033 1.00 . A A . 821 MET HE2 1 1 16 11990 1 1 42 MET HE3 H 8.661 -2.862 7.621 1.00 . A A . 821 MET HE3 1 1 16 11991 1 1 42 MET HG2 H 6.421 -5.242 7.665 1.00 . A A . 821 MET HG2 1 1 16 11992 1 1 42 MET HG3 H 7.091 -6.653 8.478 1.00 . A A . 821 MET HG3 1 1 16 11993 1 1 42 MET N N 6.952 -4.763 5.025 1.00 . A A . 821 MET N 1 1 16 11994 1 1 42 MET O O 10.350 -4.491 4.676 1.00 . A A . 821 MET O 1 1 16 11995 1 1 42 MET SD S 8.198 -4.643 9.136 1.00 . A A . 821 MET SD 1 1 16 11996 1 1 43 THR C C 10.577 -5.446 2.026 1.00 . A A . 822 THR C 1 1 16 11997 1 1 43 THR CA C 10.076 -6.634 2.854 1.00 . A A . 822 THR CA 1 1 16 11998 1 1 43 THR CB C 9.407 -7.670 1.921 1.00 . A A . 822 THR CB 1 1 16 11999 1 1 43 THR CG2 C 10.292 -7.996 0.731 1.00 . A A . 822 THR CG2 1 1 16 12000 1 1 43 THR H H 8.341 -6.787 4.053 1.00 . A A . 822 THR H 1 1 16 12001 1 1 43 THR HA H 10.941 -7.105 3.296 1.00 . A A . 822 THR HA 1 1 16 12002 1 1 43 THR HB H 8.477 -7.255 1.556 1.00 . A A . 822 THR HB 1 1 16 12003 1 1 43 THR HG1 H 9.072 -8.669 3.598 1.00 . A A . 822 THR HG1 1 1 16 12004 1 1 43 THR HG21 H 10.489 -7.093 0.173 1.00 . A A . 822 THR HG21 1 1 16 12005 1 1 43 THR HG22 H 9.792 -8.711 0.095 1.00 . A A . 822 THR HG22 1 1 16 12006 1 1 43 THR HG23 H 11.224 -8.414 1.081 1.00 . A A . 822 THR HG23 1 1 16 12007 1 1 43 THR N N 9.141 -6.238 3.907 1.00 . A A . 822 THR N 1 1 16 12008 1 1 43 THR O O 11.779 -5.300 1.820 1.00 . A A . 822 THR O 1 1 16 12009 1 1 43 THR OG1 O 9.126 -8.871 2.651 1.00 . A A . 822 THR OG1 1 1 16 12010 1 1 44 CYS C C 10.781 -2.394 1.492 1.00 . A A . 823 CYS C 1 1 16 12011 1 1 44 CYS CA C 10.077 -3.492 0.710 1.00 . A A . 823 CYS CA 1 1 16 12012 1 1 44 CYS CB C 8.879 -2.954 -0.036 1.00 . A A . 823 CYS CB 1 1 16 12013 1 1 44 CYS H H 8.740 -4.710 1.814 1.00 . A A . 823 CYS H 1 1 16 12014 1 1 44 CYS HA H 10.770 -3.875 -0.025 1.00 . A A . 823 CYS HA 1 1 16 12015 1 1 44 CYS HB2 H 8.092 -2.717 0.669 1.00 . A A . 823 CYS HB2 1 1 16 12016 1 1 44 CYS HB3 H 9.161 -2.066 -0.578 1.00 . A A . 823 CYS HB3 1 1 16 12017 1 1 44 CYS N N 9.679 -4.604 1.559 1.00 . A A . 823 CYS N 1 1 16 12018 1 1 44 CYS O O 11.785 -1.849 1.027 1.00 . A A . 823 CYS O 1 1 16 12019 1 1 44 CYS SG S 8.229 -4.149 -1.224 1.00 . A A . 823 CYS SG 1 1 16 12020 1 1 45 ALA C C 12.300 -1.418 3.877 1.00 . A A . 824 ALA C 1 1 16 12021 1 1 45 ALA CA C 10.882 -1.024 3.482 1.00 . A A . 824 ALA CA 1 1 16 12022 1 1 45 ALA CB C 10.042 -0.725 4.708 1.00 . A A . 824 ALA CB 1 1 16 12023 1 1 45 ALA H H 9.457 -2.514 3.002 1.00 . A A . 824 ALA H 1 1 16 12024 1 1 45 ALA HA H 10.935 -0.128 2.881 1.00 . A A . 824 ALA HA 1 1 16 12025 1 1 45 ALA HB1 H 9.966 -1.612 5.318 1.00 . A A . 824 ALA HB1 1 1 16 12026 1 1 45 ALA HB2 H 9.055 -0.414 4.395 1.00 . A A . 824 ALA HB2 1 1 16 12027 1 1 45 ALA HB3 H 10.507 0.065 5.277 1.00 . A A . 824 ALA HB3 1 1 16 12028 1 1 45 ALA N N 10.265 -2.059 2.670 1.00 . A A . 824 ALA N 1 1 16 12029 1 1 45 ALA O O 13.214 -0.595 3.831 1.00 . A A . 824 ALA O 1 1 16 12030 1 1 46 LYS C C 14.713 -3.240 3.387 1.00 . A A . 825 LYS C 1 1 16 12031 1 1 46 LYS CA C 13.819 -3.160 4.625 1.00 . A A . 825 LYS CA 1 1 16 12032 1 1 46 LYS CB C 13.725 -4.530 5.310 1.00 . A A . 825 LYS CB 1 1 16 12033 1 1 46 LYS CD C 13.228 -6.985 5.169 1.00 . A A . 825 LYS CD 1 1 16 12034 1 1 46 LYS CE C 14.599 -7.413 5.665 1.00 . A A . 825 LYS CE 1 1 16 12035 1 1 46 LYS CG C 13.299 -5.672 4.403 1.00 . A A . 825 LYS CG 1 1 16 12036 1 1 46 LYS H H 11.723 -3.288 4.342 1.00 . A A . 825 LYS H 1 1 16 12037 1 1 46 LYS HA H 14.209 -2.458 5.348 1.00 . A A . 825 LYS HA 1 1 16 12038 1 1 46 LYS HB2 H 14.689 -4.775 5.728 1.00 . A A . 825 LYS HB2 1 1 16 12039 1 1 46 LYS HB3 H 13.005 -4.458 6.113 1.00 . A A . 825 LYS HB3 1 1 16 12040 1 1 46 LYS HD2 H 12.570 -6.864 6.016 1.00 . A A . 825 LYS HD2 1 1 16 12041 1 1 46 LYS HD3 H 12.837 -7.749 4.512 1.00 . A A . 825 LYS HD3 1 1 16 12042 1 1 46 LYS HE2 H 15.211 -7.672 4.814 1.00 . A A . 825 LYS HE2 1 1 16 12043 1 1 46 LYS HE3 H 15.053 -6.585 6.193 1.00 . A A . 825 LYS HE3 1 1 16 12044 1 1 46 LYS HG2 H 12.324 -5.450 3.993 1.00 . A A . 825 LYS HG2 1 1 16 12045 1 1 46 LYS HG3 H 14.016 -5.769 3.601 1.00 . A A . 825 LYS HG3 1 1 16 12046 1 1 46 LYS HZ1 H 13.939 -9.336 6.144 1.00 . A A . 825 LYS HZ1 1 1 16 12047 1 1 46 LYS HZ2 H 14.088 -8.304 7.485 1.00 . A A . 825 LYS HZ2 1 1 16 12048 1 1 46 LYS HZ3 H 15.472 -8.962 6.758 1.00 . A A . 825 LYS HZ3 1 1 16 12049 1 1 46 LYS N N 12.491 -2.679 4.265 1.00 . A A . 825 LYS N 1 1 16 12050 1 1 46 LYS NZ N 14.519 -8.584 6.575 1.00 . A A . 825 LYS NZ 1 1 16 12051 1 1 46 LYS O O 15.932 -3.089 3.464 1.00 . A A . 825 LYS O 1 1 16 12052 1 1 47 ARG C C 15.416 -2.386 0.493 1.00 . A A . 826 ARG C 1 1 16 12053 1 1 47 ARG CA C 14.743 -3.664 0.966 1.00 . A A . 826 ARG CA 1 1 16 12054 1 1 47 ARG CB C 13.734 -4.112 -0.095 1.00 . A A . 826 ARG CB 1 1 16 12055 1 1 47 ARG CD C 15.226 -5.719 -1.335 1.00 . A A . 826 ARG CD 1 1 16 12056 1 1 47 ARG CG C 14.362 -4.471 -1.433 1.00 . A A . 826 ARG CG 1 1 16 12057 1 1 47 ARG CZ C 15.925 -7.160 -3.221 1.00 . A A . 826 ARG CZ 1 1 16 12058 1 1 47 ARG H H 13.085 -3.541 2.275 1.00 . A A . 826 ARG H 1 1 16 12059 1 1 47 ARG HA H 15.470 -4.453 1.093 1.00 . A A . 826 ARG HA 1 1 16 12060 1 1 47 ARG HB2 H 13.208 -4.979 0.273 1.00 . A A . 826 ARG HB2 1 1 16 12061 1 1 47 ARG HB3 H 13.025 -3.313 -0.256 1.00 . A A . 826 ARG HB3 1 1 16 12062 1 1 47 ARG HD2 H 15.944 -5.583 -0.540 1.00 . A A . 826 ARG HD2 1 1 16 12063 1 1 47 ARG HD3 H 14.590 -6.563 -1.105 1.00 . A A . 826 ARG HD3 1 1 16 12064 1 1 47 ARG HE H 16.484 -5.255 -2.958 1.00 . A A . 826 ARG HE 1 1 16 12065 1 1 47 ARG HG2 H 13.578 -4.649 -2.154 1.00 . A A . 826 ARG HG2 1 1 16 12066 1 1 47 ARG HG3 H 14.976 -3.645 -1.763 1.00 . A A . 826 ARG HG3 1 1 16 12067 1 1 47 ARG HH11 H 14.604 -8.043 -1.952 1.00 . A A . 826 ARG HH11 1 1 16 12068 1 1 47 ARG HH12 H 15.164 -9.044 -3.264 1.00 . A A . 826 ARG HH12 1 1 16 12069 1 1 47 ARG HH21 H 17.197 -6.548 -4.675 1.00 . A A . 826 ARG HH21 1 1 16 12070 1 1 47 ARG HH22 H 16.643 -8.188 -4.817 1.00 . A A . 826 ARG HH22 1 1 16 12071 1 1 47 ARG N N 14.063 -3.467 2.242 1.00 . A A . 826 ARG N 1 1 16 12072 1 1 47 ARG NE N 15.943 -5.991 -2.579 1.00 . A A . 826 ARG NE 1 1 16 12073 1 1 47 ARG NH1 N 15.175 -8.162 -2.774 1.00 . A A . 826 ARG NH1 1 1 16 12074 1 1 47 ARG NH2 N 16.646 -7.313 -4.324 1.00 . A A . 826 ARG NH2 1 1 16 12075 1 1 47 ARG O O 16.364 -2.431 -0.294 1.00 . A A . 826 ARG O 1 1 16 12076 1 1 48 TYR C C 16.942 0.127 0.898 1.00 . A A . 827 TYR C 1 1 16 12077 1 1 48 TYR CA C 15.453 0.050 0.584 1.00 . A A . 827 TYR CA 1 1 16 12078 1 1 48 TYR CB C 14.708 1.157 1.331 1.00 . A A . 827 TYR CB 1 1 16 12079 1 1 48 TYR CD1 C 15.215 3.000 -0.315 1.00 . A A . 827 TYR CD1 1 1 16 12080 1 1 48 TYR CD2 C 15.643 3.406 1.995 1.00 . A A . 827 TYR CD2 1 1 16 12081 1 1 48 TYR CE1 C 15.662 4.268 -0.626 1.00 . A A . 827 TYR CE1 1 1 16 12082 1 1 48 TYR CE2 C 16.091 4.677 1.691 1.00 . A A . 827 TYR CE2 1 1 16 12083 1 1 48 TYR CG C 15.199 2.547 0.998 1.00 . A A . 827 TYR CG 1 1 16 12084 1 1 48 TYR CZ C 16.099 5.103 0.381 1.00 . A A . 827 TYR CZ 1 1 16 12085 1 1 48 TYR H H 14.091 -1.273 1.509 1.00 . A A . 827 TYR H 1 1 16 12086 1 1 48 TYR HA H 15.263 0.183 -0.469 1.00 . A A . 827 TYR HA 1 1 16 12087 1 1 48 TYR HB2 H 13.658 1.109 1.071 1.00 . A A . 827 TYR HB2 1 1 16 12088 1 1 48 TYR HB3 H 14.821 1.008 2.393 1.00 . A A . 827 TYR HB3 1 1 16 12089 1 1 48 TYR HD1 H 14.873 2.342 -1.101 1.00 . A A . 827 TYR HD1 1 1 16 12090 1 1 48 TYR HD2 H 15.635 3.068 3.022 1.00 . A A . 827 TYR HD2 1 1 16 12091 1 1 48 TYR HE1 H 15.667 4.601 -1.653 1.00 . A A . 827 TYR HE1 1 1 16 12092 1 1 48 TYR HE2 H 16.433 5.330 2.480 1.00 . A A . 827 TYR HE2 1 1 16 12093 1 1 48 TYR HH H 15.975 6.755 -0.605 1.00 . A A . 827 TYR HH 1 1 16 12094 1 1 48 TYR N N 14.908 -1.247 0.963 1.00 . A A . 827 TYR N 1 1 16 12095 1 1 48 TYR O O 17.705 0.819 0.226 1.00 . A A . 827 TYR O 1 1 16 12096 1 1 48 TYR OH O 16.548 6.367 0.074 1.00 . A A . 827 TYR OH 1 1 16 12097 1 1 49 ASN C C 19.478 -1.634 1.429 1.00 . A A . 828 ASN C 1 1 16 12098 1 1 49 ASN CA C 18.730 -0.672 2.340 1.00 . A A . 828 ASN CA 1 1 16 12099 1 1 49 ASN CB C 18.847 -1.138 3.795 1.00 . A A . 828 ASN CB 1 1 16 12100 1 1 49 ASN CG C 17.953 -0.352 4.734 1.00 . A A . 828 ASN CG 1 1 16 12101 1 1 49 ASN H H 16.669 -1.121 2.431 1.00 . A A . 828 ASN H 1 1 16 12102 1 1 49 ASN HA H 19.159 0.314 2.247 1.00 . A A . 828 ASN HA 1 1 16 12103 1 1 49 ASN HB2 H 18.571 -2.180 3.856 1.00 . A A . 828 ASN HB2 1 1 16 12104 1 1 49 ASN HB3 H 19.870 -1.021 4.122 1.00 . A A . 828 ASN HB3 1 1 16 12105 1 1 49 ASN HD21 H 16.493 -1.667 4.458 1.00 . A A . 828 ASN HD21 1 1 16 12106 1 1 49 ASN HD22 H 16.117 -0.341 5.511 1.00 . A A . 828 ASN HD22 1 1 16 12107 1 1 49 ASN N N 17.338 -0.603 1.932 1.00 . A A . 828 ASN N 1 1 16 12108 1 1 49 ASN ND2 N 16.736 -0.836 4.924 1.00 . A A . 828 ASN ND2 1 1 16 12109 1 1 49 ASN O O 19.421 -2.856 1.672 1.00 . A A . 828 ASN O 1 1 16 12110 1 1 49 ASN OXT O 20.106 -1.168 0.455 1.00 . A A . 828 ASN OXT 1 1 16 12111 1 1 49 ASN OD1 O 18.356 0.673 5.287 1.00 . A A . 828 ASN OD1 1 1 16 12112 2 2 1 ZN ZN ZN 7.864 -2.605 -2.787 1.00 . B A . 829 ZN ZN 1 1 17 12113 1 1 1 GLY C C -21.374 5.180 9.837 1.00 . A A . 1 GLY C 1 1 17 12114 1 1 1 GLY CA C -22.723 4.788 9.284 1.00 . A A . 1 GLY CA 1 1 17 12115 1 1 1 GLY H1 H -23.585 6.685 9.333 1.00 . A A . 1 GLY H1 1 1 17 12116 1 1 1 GLY H2 H -24.311 5.625 8.221 1.00 . A A . 1 GLY H2 1 1 17 12117 1 1 1 GLY H3 H -22.805 6.320 7.874 1.00 . A A . 1 GLY H3 1 1 17 12118 1 1 1 GLY HA2 H -23.341 4.424 10.092 1.00 . A A . 1 GLY HA2 1 1 17 12119 1 1 1 GLY HA3 H -22.593 4.000 8.558 1.00 . A A . 1 GLY HA3 1 1 17 12120 1 1 1 GLY N N -23.406 5.932 8.634 1.00 . A A . 1 GLY N 1 1 17 12121 1 1 1 GLY O O -20.962 6.338 9.717 1.00 . A A . 1 GLY O 1 1 17 12122 1 1 2 THR C C -18.329 4.503 9.845 1.00 . A A . 2 THR C 1 1 17 12123 1 1 2 THR CA C -19.353 4.454 10.973 1.00 . A A . 2 THR CA 1 1 17 12124 1 1 2 THR CB C -18.969 3.359 11.986 1.00 . A A . 2 THR CB 1 1 17 12125 1 1 2 THR CG2 C -19.684 3.568 13.309 1.00 . A A . 2 THR CG2 1 1 17 12126 1 1 2 THR H H -21.083 3.326 10.525 1.00 . A A . 2 THR H 1 1 17 12127 1 1 2 THR HA H -19.358 5.405 11.485 1.00 . A A . 2 THR HA 1 1 17 12128 1 1 2 THR HB H -17.903 3.404 12.159 1.00 . A A . 2 THR HB 1 1 17 12129 1 1 2 THR HG1 H -19.128 1.392 12.133 1.00 . A A . 2 THR HG1 1 1 17 12130 1 1 2 THR HG21 H -19.411 2.778 13.995 1.00 . A A . 2 THR HG21 1 1 17 12131 1 1 2 THR HG22 H -20.752 3.551 13.147 1.00 . A A . 2 THR HG22 1 1 17 12132 1 1 2 THR HG23 H -19.399 4.523 13.726 1.00 . A A . 2 THR HG23 1 1 17 12133 1 1 2 THR N N -20.685 4.223 10.441 1.00 . A A . 2 THR N 1 1 17 12134 1 1 2 THR O O -18.451 3.794 8.842 1.00 . A A . 2 THR O 1 1 17 12135 1 1 2 THR OG1 O -19.305 2.069 11.459 1.00 . A A . 2 THR OG1 1 1 17 12136 1 1 3 ARG C C -15.147 4.610 9.176 1.00 . A A . 3 ARG C 1 1 17 12137 1 1 3 ARG CA C -16.333 5.542 8.957 1.00 . A A . 3 ARG CA 1 1 17 12138 1 1 3 ARG CB C -15.889 7.004 8.926 1.00 . A A . 3 ARG CB 1 1 17 12139 1 1 3 ARG CD C -16.603 9.418 8.788 1.00 . A A . 3 ARG CD 1 1 17 12140 1 1 3 ARG CG C -17.058 7.970 8.793 1.00 . A A . 3 ARG CG 1 1 17 12141 1 1 3 ARG CZ C -17.764 11.442 7.988 1.00 . A A . 3 ARG CZ 1 1 17 12142 1 1 3 ARG H H -17.243 5.847 10.842 1.00 . A A . 3 ARG H 1 1 17 12143 1 1 3 ARG HA H -16.797 5.294 8.014 1.00 . A A . 3 ARG HA 1 1 17 12144 1 1 3 ARG HB2 H -15.362 7.230 9.842 1.00 . A A . 3 ARG HB2 1 1 17 12145 1 1 3 ARG HB3 H -15.226 7.156 8.088 1.00 . A A . 3 ARG HB3 1 1 17 12146 1 1 3 ARG HD2 H -16.022 9.602 9.680 1.00 . A A . 3 ARG HD2 1 1 17 12147 1 1 3 ARG HD3 H -15.985 9.582 7.918 1.00 . A A . 3 ARG HD3 1 1 17 12148 1 1 3 ARG HE H -18.498 10.156 9.346 1.00 . A A . 3 ARG HE 1 1 17 12149 1 1 3 ARG HG2 H -17.576 7.766 7.869 1.00 . A A . 3 ARG HG2 1 1 17 12150 1 1 3 ARG HG3 H -17.730 7.817 9.625 1.00 . A A . 3 ARG HG3 1 1 17 12151 1 1 3 ARG HH11 H -15.958 11.096 7.145 1.00 . A A . 3 ARG HH11 1 1 17 12152 1 1 3 ARG HH12 H -16.775 12.518 6.574 1.00 . A A . 3 ARG HH12 1 1 17 12153 1 1 3 ARG HH21 H -19.573 12.073 8.656 1.00 . A A . 3 ARG HH21 1 1 17 12154 1 1 3 ARG HH22 H -18.827 13.093 7.459 1.00 . A A . 3 ARG HH22 1 1 17 12155 1 1 3 ARG N N -17.326 5.347 10.000 1.00 . A A . 3 ARG N 1 1 17 12156 1 1 3 ARG NE N -17.730 10.352 8.755 1.00 . A A . 3 ARG NE 1 1 17 12157 1 1 3 ARG NH1 N -16.749 11.708 7.176 1.00 . A A . 3 ARG NH1 1 1 17 12158 1 1 3 ARG NH2 N -18.805 12.265 8.037 1.00 . A A . 3 ARG NH2 1 1 17 12159 1 1 3 ARG O O -14.069 5.032 9.602 1.00 . A A . 3 ARG O 1 1 17 12160 1 1 4 GLY C C -14.172 2.035 10.583 1.00 . A A . 783 GLY C 1 1 17 12161 1 1 4 GLY CA C -14.350 2.327 9.109 1.00 . A A . 783 GLY CA 1 1 17 12162 1 1 4 GLY H H -16.246 3.066 8.543 1.00 . A A . 783 GLY H 1 1 17 12163 1 1 4 GLY HA2 H -14.637 1.417 8.598 1.00 . A A . 783 GLY HA2 1 1 17 12164 1 1 4 GLY HA3 H -13.414 2.679 8.703 1.00 . A A . 783 GLY HA3 1 1 17 12165 1 1 4 GLY N N -15.369 3.332 8.893 1.00 . A A . 783 GLY N 1 1 17 12166 1 1 4 GLY O O -15.088 1.535 11.234 1.00 . A A . 783 GLY O 1 1 17 12167 1 1 5 VAL C C -12.887 3.633 13.185 1.00 . A A . 784 VAL C 1 1 17 12168 1 1 5 VAL CA C -12.758 2.257 12.544 1.00 . A A . 784 VAL CA 1 1 17 12169 1 1 5 VAL CB C -11.365 1.660 12.858 1.00 . A A . 784 VAL CB 1 1 17 12170 1 1 5 VAL CG1 C -11.266 0.228 12.354 1.00 . A A . 784 VAL CG1 1 1 17 12171 1 1 5 VAL CG2 C -10.257 2.513 12.258 1.00 . A A . 784 VAL CG2 1 1 17 12172 1 1 5 VAL H H -12.278 2.679 10.523 1.00 . A A . 784 VAL H 1 1 17 12173 1 1 5 VAL HA H -13.513 1.606 12.965 1.00 . A A . 784 VAL HA 1 1 17 12174 1 1 5 VAL HB H -11.236 1.648 13.930 1.00 . A A . 784 VAL HB 1 1 17 12175 1 1 5 VAL HG11 H -12.023 -0.376 12.831 1.00 . A A . 784 VAL HG11 1 1 17 12176 1 1 5 VAL HG12 H -10.289 -0.168 12.590 1.00 . A A . 784 VAL HG12 1 1 17 12177 1 1 5 VAL HG13 H -11.414 0.209 11.286 1.00 . A A . 784 VAL HG13 1 1 17 12178 1 1 5 VAL HG21 H -9.298 2.116 12.558 1.00 . A A . 784 VAL HG21 1 1 17 12179 1 1 5 VAL HG22 H -10.352 3.530 12.609 1.00 . A A . 784 VAL HG22 1 1 17 12180 1 1 5 VAL HG23 H -10.330 2.495 11.181 1.00 . A A . 784 VAL HG23 1 1 17 12181 1 1 5 VAL N N -13.001 2.361 11.111 1.00 . A A . 784 VAL N 1 1 17 12182 1 1 5 VAL O O -12.524 3.837 14.346 1.00 . A A . 784 VAL O 1 1 17 12183 1 1 6 ASP C C -12.296 6.673 13.062 1.00 . A A . 785 ASP C 1 1 17 12184 1 1 6 ASP CA C -13.614 5.957 12.807 1.00 . A A . 785 ASP CA 1 1 17 12185 1 1 6 ASP CB C -14.531 6.058 14.031 1.00 . A A . 785 ASP CB 1 1 17 12186 1 1 6 ASP CG C -15.992 5.901 13.669 1.00 . A A . 785 ASP CG 1 1 17 12187 1 1 6 ASP H H -13.670 4.315 11.482 1.00 . A A . 785 ASP H 1 1 17 12188 1 1 6 ASP HA H -14.103 6.458 11.982 1.00 . A A . 785 ASP HA 1 1 17 12189 1 1 6 ASP HB2 H -14.269 5.283 14.735 1.00 . A A . 785 ASP HB2 1 1 17 12190 1 1 6 ASP HB3 H -14.394 7.025 14.497 1.00 . A A . 785 ASP HB3 1 1 17 12191 1 1 6 ASP N N -13.407 4.571 12.393 1.00 . A A . 785 ASP N 1 1 17 12192 1 1 6 ASP O O -12.218 7.575 13.897 1.00 . A A . 785 ASP O 1 1 17 12193 1 1 6 ASP OD1 O -16.570 6.843 13.091 1.00 . A A . 785 ASP OD1 1 1 17 12194 1 1 6 ASP OD2 O -16.566 4.827 13.957 1.00 . A A . 785 ASP OD2 1 1 17 12195 1 1 7 SER C C -9.888 7.885 11.139 1.00 . A A . 786 SER C 1 1 17 12196 1 1 7 SER CA C -10.005 6.994 12.372 1.00 . A A . 786 SER CA 1 1 17 12197 1 1 7 SER CB C -8.833 6.018 12.439 1.00 . A A . 786 SER CB 1 1 17 12198 1 1 7 SER H H -11.351 5.484 11.768 1.00 . A A . 786 SER H 1 1 17 12199 1 1 7 SER HA H -10.003 7.612 13.253 1.00 . A A . 786 SER HA 1 1 17 12200 1 1 7 SER HB2 H -8.845 5.383 11.565 1.00 . A A . 786 SER HB2 1 1 17 12201 1 1 7 SER HB3 H -7.906 6.574 12.466 1.00 . A A . 786 SER HB3 1 1 17 12202 1 1 7 SER HG H -8.237 5.490 14.233 1.00 . A A . 786 SER HG 1 1 17 12203 1 1 7 SER N N -11.264 6.276 12.336 1.00 . A A . 786 SER N 1 1 17 12204 1 1 7 SER O O -9.904 7.398 10.009 1.00 . A A . 786 SER O 1 1 17 12205 1 1 7 SER OG O -8.911 5.201 13.594 1.00 . A A . 786 SER OG 1 1 17 12206 1 1 8 PRO C C -8.352 10.342 9.626 1.00 . A A . 787 PRO C 1 1 17 12207 1 1 8 PRO CA C -9.735 10.184 10.260 1.00 . A A . 787 PRO CA 1 1 17 12208 1 1 8 PRO CB C -10.157 11.491 10.950 1.00 . A A . 787 PRO CB 1 1 17 12209 1 1 8 PRO CD C -9.653 9.858 12.644 1.00 . A A . 787 PRO CD 1 1 17 12210 1 1 8 PRO CG C -10.357 11.160 12.399 1.00 . A A . 787 PRO CG 1 1 17 12211 1 1 8 PRO HA H -10.454 9.937 9.490 1.00 . A A . 787 PRO HA 1 1 17 12212 1 1 8 PRO HB2 H -9.377 12.227 10.824 1.00 . A A . 787 PRO HB2 1 1 17 12213 1 1 8 PRO HB3 H -11.070 11.855 10.502 1.00 . A A . 787 PRO HB3 1 1 17 12214 1 1 8 PRO HD2 H -8.620 10.025 12.912 1.00 . A A . 787 PRO HD2 1 1 17 12215 1 1 8 PRO HD3 H -10.160 9.286 13.408 1.00 . A A . 787 PRO HD3 1 1 17 12216 1 1 8 PRO HG2 H -9.926 11.936 13.013 1.00 . A A . 787 PRO HG2 1 1 17 12217 1 1 8 PRO HG3 H -11.411 11.060 12.609 1.00 . A A . 787 PRO HG3 1 1 17 12218 1 1 8 PRO N N -9.760 9.202 11.342 1.00 . A A . 787 PRO N 1 1 17 12219 1 1 8 PRO O O -7.996 11.419 9.143 1.00 . A A . 787 PRO O 1 1 17 12220 1 1 9 SER C C -6.388 8.862 7.535 1.00 . A A . 788 SER C 1 1 17 12221 1 1 9 SER CA C -6.263 9.285 9.007 1.00 . A A . 788 SER CA 1 1 17 12222 1 1 9 SER CB C -5.302 8.376 9.783 1.00 . A A . 788 SER CB 1 1 17 12223 1 1 9 SER H H -7.889 8.455 10.074 1.00 . A A . 788 SER H 1 1 17 12224 1 1 9 SER HA H -5.892 10.300 9.043 1.00 . A A . 788 SER HA 1 1 17 12225 1 1 9 SER HB2 H -5.668 7.362 9.763 1.00 . A A . 788 SER HB2 1 1 17 12226 1 1 9 SER HB3 H -4.322 8.417 9.329 1.00 . A A . 788 SER HB3 1 1 17 12227 1 1 9 SER HG H -5.686 9.622 11.265 1.00 . A A . 788 SER HG 1 1 17 12228 1 1 9 SER N N -7.573 9.273 9.636 1.00 . A A . 788 SER N 1 1 17 12229 1 1 9 SER O O -6.936 9.604 6.724 1.00 . A A . 788 SER O 1 1 17 12230 1 1 9 SER OG O -5.201 8.786 11.138 1.00 . A A . 788 SER OG 1 1 17 12231 1 1 10 ALA C C -6.871 5.787 6.032 1.00 . A A . 789 ALA C 1 1 17 12232 1 1 10 ALA CA C -6.139 7.108 5.872 1.00 . A A . 789 ALA CA 1 1 17 12233 1 1 10 ALA CB C -4.827 6.919 5.123 1.00 . A A . 789 ALA CB 1 1 17 12234 1 1 10 ALA H H -5.373 7.163 7.834 1.00 . A A . 789 ALA H 1 1 17 12235 1 1 10 ALA HA H -6.762 7.794 5.312 1.00 . A A . 789 ALA HA 1 1 17 12236 1 1 10 ALA HB1 H -4.192 6.237 5.671 1.00 . A A . 789 ALA HB1 1 1 17 12237 1 1 10 ALA HB2 H -4.329 7.872 5.023 1.00 . A A . 789 ALA HB2 1 1 17 12238 1 1 10 ALA HB3 H -5.028 6.514 4.142 1.00 . A A . 789 ALA HB3 1 1 17 12239 1 1 10 ALA N N -5.906 7.673 7.193 1.00 . A A . 789 ALA N 1 1 17 12240 1 1 10 ALA O O -6.872 4.933 5.146 1.00 . A A . 789 ALA O 1 1 17 12241 1 1 11 GLU C C -9.524 4.325 6.868 1.00 . A A . 790 GLU C 1 1 17 12242 1 1 11 GLU CA C -8.187 4.430 7.575 1.00 . A A . 790 GLU CA 1 1 17 12243 1 1 11 GLU CB C -8.428 4.434 9.083 1.00 . A A . 790 GLU CB 1 1 17 12244 1 1 11 GLU CD C -6.230 3.381 9.719 1.00 . A A . 790 GLU CD 1 1 17 12245 1 1 11 GLU CG C -7.157 4.555 9.906 1.00 . A A . 790 GLU CG 1 1 17 12246 1 1 11 GLU H H -7.476 6.393 7.826 1.00 . A A . 790 GLU H 1 1 17 12247 1 1 11 GLU HA H -7.571 3.584 7.314 1.00 . A A . 790 GLU HA 1 1 17 12248 1 1 11 GLU HB2 H -9.067 5.271 9.327 1.00 . A A . 790 GLU HB2 1 1 17 12249 1 1 11 GLU HB3 H -8.931 3.519 9.357 1.00 . A A . 790 GLU HB3 1 1 17 12250 1 1 11 GLU HG2 H -6.637 5.455 9.613 1.00 . A A . 790 GLU HG2 1 1 17 12251 1 1 11 GLU HG3 H -7.427 4.622 10.951 1.00 . A A . 790 GLU HG3 1 1 17 12252 1 1 11 GLU N N -7.491 5.647 7.196 1.00 . A A . 790 GLU N 1 1 17 12253 1 1 11 GLU O O -9.840 3.286 6.307 1.00 . A A . 790 GLU O 1 1 17 12254 1 1 11 GLU OE1 O -6.371 2.390 10.468 1.00 . A A . 790 GLU OE1 1 1 17 12255 1 1 11 GLU OE2 O -5.361 3.445 8.834 1.00 . A A . 790 GLU OE2 1 1 17 12256 1 1 12 LEU C C -12.268 4.425 5.708 1.00 . A A . 791 LEU C 1 1 17 12257 1 1 12 LEU CA C -11.661 5.599 6.491 1.00 . A A . 791 LEU CA 1 1 17 12258 1 1 12 LEU CB C -11.867 6.899 5.700 1.00 . A A . 791 LEU CB 1 1 17 12259 1 1 12 LEU CD1 C -12.542 8.158 7.775 1.00 . A A . 791 LEU CD1 1 1 17 12260 1 1 12 LEU CD2 C -10.261 8.516 6.795 1.00 . A A . 791 LEU CD2 1 1 17 12261 1 1 12 LEU CG C -11.724 8.209 6.492 1.00 . A A . 791 LEU CG 1 1 17 12262 1 1 12 LEU H H -9.768 6.272 7.141 1.00 . A A . 791 LEU H 1 1 17 12263 1 1 12 LEU HA H -12.208 5.689 7.414 1.00 . A A . 791 LEU HA 1 1 17 12264 1 1 12 LEU HB2 H -11.146 6.916 4.896 1.00 . A A . 791 LEU HB2 1 1 17 12265 1 1 12 LEU HB3 H -12.857 6.875 5.267 1.00 . A A . 791 LEU HB3 1 1 17 12266 1 1 12 LEU HD11 H -12.211 7.326 8.380 1.00 . A A . 791 LEU HD11 1 1 17 12267 1 1 12 LEU HD12 H -13.587 8.033 7.534 1.00 . A A . 791 LEU HD12 1 1 17 12268 1 1 12 LEU HD13 H -12.408 9.079 8.325 1.00 . A A . 791 LEU HD13 1 1 17 12269 1 1 12 LEU HD21 H -10.197 9.411 7.395 1.00 . A A . 791 LEU HD21 1 1 17 12270 1 1 12 LEU HD22 H -9.726 8.663 5.869 1.00 . A A . 791 LEU HD22 1 1 17 12271 1 1 12 LEU HD23 H -9.825 7.689 7.337 1.00 . A A . 791 LEU HD23 1 1 17 12272 1 1 12 LEU HG H -12.113 9.018 5.891 1.00 . A A . 791 LEU HG 1 1 17 12273 1 1 12 LEU N N -10.236 5.459 6.867 1.00 . A A . 791 LEU N 1 1 17 12274 1 1 12 LEU O O -12.640 4.575 4.544 1.00 . A A . 791 LEU O 1 1 17 12275 1 1 13 ASP C C -12.322 1.637 4.512 1.00 . A A . 792 ASP C 1 1 17 12276 1 1 13 ASP CA C -13.031 2.089 5.792 1.00 . A A . 792 ASP CA 1 1 17 12277 1 1 13 ASP CB C -14.521 2.355 5.531 1.00 . A A . 792 ASP CB 1 1 17 12278 1 1 13 ASP CG C -15.285 1.100 5.154 1.00 . A A . 792 ASP CG 1 1 17 12279 1 1 13 ASP H H -12.011 3.209 7.274 1.00 . A A . 792 ASP H 1 1 17 12280 1 1 13 ASP HA H -12.949 1.293 6.521 1.00 . A A . 792 ASP HA 1 1 17 12281 1 1 13 ASP HB2 H -14.968 2.770 6.424 1.00 . A A . 792 ASP HB2 1 1 17 12282 1 1 13 ASP HB3 H -14.614 3.069 4.724 1.00 . A A . 792 ASP HB3 1 1 17 12283 1 1 13 ASP N N -12.389 3.273 6.368 1.00 . A A . 792 ASP N 1 1 17 12284 1 1 13 ASP O O -12.955 1.371 3.488 1.00 . A A . 792 ASP O 1 1 17 12285 1 1 13 ASP OD1 O -15.118 0.066 5.835 1.00 . A A . 792 ASP OD1 1 1 17 12286 1 1 13 ASP OD2 O -16.058 1.145 4.175 1.00 . A A . 792 ASP OD2 1 1 17 12287 1 1 14 LYS C C -9.976 2.016 2.358 1.00 . A A . 793 LYS C 1 1 17 12288 1 1 14 LYS CA C -10.142 1.042 3.527 1.00 . A A . 793 LYS CA 1 1 17 12289 1 1 14 LYS CB C -10.683 -0.314 3.055 1.00 . A A . 793 LYS CB 1 1 17 12290 1 1 14 LYS CD C -10.420 -2.329 1.562 1.00 . A A . 793 LYS CD 1 1 17 12291 1 1 14 LYS CE C -11.719 -2.259 0.764 1.00 . A A . 793 LYS CE 1 1 17 12292 1 1 14 LYS CG C -9.882 -0.951 1.932 1.00 . A A . 793 LYS CG 1 1 17 12293 1 1 14 LYS H H -10.554 1.975 5.382 1.00 . A A . 793 LYS H 1 1 17 12294 1 1 14 LYS HA H -9.166 0.880 3.961 1.00 . A A . 793 LYS HA 1 1 17 12295 1 1 14 LYS HB2 H -10.682 -0.994 3.893 1.00 . A A . 793 LYS HB2 1 1 17 12296 1 1 14 LYS HB3 H -11.701 -0.182 2.716 1.00 . A A . 793 LYS HB3 1 1 17 12297 1 1 14 LYS HD2 H -9.680 -2.841 0.969 1.00 . A A . 793 LYS HD2 1 1 17 12298 1 1 14 LYS HD3 H -10.599 -2.886 2.471 1.00 . A A . 793 LYS HD3 1 1 17 12299 1 1 14 LYS HE2 H -11.588 -1.551 -0.039 1.00 . A A . 793 LYS HE2 1 1 17 12300 1 1 14 LYS HE3 H -11.919 -3.235 0.345 1.00 . A A . 793 LYS HE3 1 1 17 12301 1 1 14 LYS HG2 H -9.928 -0.313 1.062 1.00 . A A . 793 LYS HG2 1 1 17 12302 1 1 14 LYS HG3 H -8.856 -1.052 2.253 1.00 . A A . 793 LYS HG3 1 1 17 12303 1 1 14 LYS HZ1 H -12.767 -0.858 1.910 1.00 . A A . 793 LYS HZ1 1 1 17 12304 1 1 14 LYS HZ2 H -12.993 -2.461 2.414 1.00 . A A . 793 LYS HZ2 1 1 17 12305 1 1 14 LYS HZ3 H -13.762 -1.895 1.014 1.00 . A A . 793 LYS HZ3 1 1 17 12306 1 1 14 LYS N N -10.989 1.595 4.584 1.00 . A A . 793 LYS N 1 1 17 12307 1 1 14 LYS NZ N -12.888 -1.836 1.583 1.00 . A A . 793 LYS NZ 1 1 17 12308 1 1 14 LYS O O -8.854 2.427 2.045 1.00 . A A . 793 LYS O 1 1 17 12309 1 1 15 LYS C C -10.539 2.815 -0.685 1.00 . A A . 794 LYS C 1 1 17 12310 1 1 15 LYS CA C -11.149 3.334 0.616 1.00 . A A . 794 LYS CA 1 1 17 12311 1 1 15 LYS CB C -10.500 4.667 1.005 1.00 . A A . 794 LYS CB 1 1 17 12312 1 1 15 LYS CD C -12.746 5.723 1.318 1.00 . A A . 794 LYS CD 1 1 17 12313 1 1 15 LYS CE C -13.619 6.584 2.209 1.00 . A A . 794 LYS CE 1 1 17 12314 1 1 15 LYS CG C -11.366 5.514 1.919 1.00 . A A . 794 LYS CG 1 1 17 12315 1 1 15 LYS H H -11.940 1.942 2.006 1.00 . A A . 794 LYS H 1 1 17 12316 1 1 15 LYS HA H -12.195 3.522 0.425 1.00 . A A . 794 LYS HA 1 1 17 12317 1 1 15 LYS HB2 H -9.567 4.466 1.511 1.00 . A A . 794 LYS HB2 1 1 17 12318 1 1 15 LYS HB3 H -10.299 5.232 0.106 1.00 . A A . 794 LYS HB3 1 1 17 12319 1 1 15 LYS HD2 H -12.638 6.208 0.361 1.00 . A A . 794 LYS HD2 1 1 17 12320 1 1 15 LYS HD3 H -13.218 4.761 1.186 1.00 . A A . 794 LYS HD3 1 1 17 12321 1 1 15 LYS HE2 H -14.615 6.610 1.796 1.00 . A A . 794 LYS HE2 1 1 17 12322 1 1 15 LYS HE3 H -13.650 6.140 3.194 1.00 . A A . 794 LYS HE3 1 1 17 12323 1 1 15 LYS HG2 H -11.469 5.017 2.875 1.00 . A A . 794 LYS HG2 1 1 17 12324 1 1 15 LYS HG3 H -10.897 6.475 2.058 1.00 . A A . 794 LYS HG3 1 1 17 12325 1 1 15 LYS HZ1 H -13.113 8.431 1.386 1.00 . A A . 794 LYS HZ1 1 1 17 12326 1 1 15 LYS HZ2 H -12.129 7.973 2.688 1.00 . A A . 794 LYS HZ2 1 1 17 12327 1 1 15 LYS HZ3 H -13.709 8.523 2.969 1.00 . A A . 794 LYS HZ3 1 1 17 12328 1 1 15 LYS N N -11.095 2.361 1.718 1.00 . A A . 794 LYS N 1 1 17 12329 1 1 15 LYS NZ N -13.107 7.973 2.321 1.00 . A A . 794 LYS NZ 1 1 17 12330 1 1 15 LYS O O -11.063 3.093 -1.765 1.00 . A A . 794 LYS O 1 1 17 12331 1 1 16 ALA C C -7.855 2.583 -2.379 1.00 . A A . 795 ALA C 1 1 17 12332 1 1 16 ALA CA C -8.702 1.516 -1.697 1.00 . A A . 795 ALA CA 1 1 17 12333 1 1 16 ALA CB C -9.631 0.822 -2.689 1.00 . A A . 795 ALA CB 1 1 17 12334 1 1 16 ALA H H -9.081 1.921 0.342 1.00 . A A . 795 ALA H 1 1 17 12335 1 1 16 ALA HA H -8.032 0.766 -1.298 1.00 . A A . 795 ALA HA 1 1 17 12336 1 1 16 ALA HB1 H -9.044 0.352 -3.464 1.00 . A A . 795 ALA HB1 1 1 17 12337 1 1 16 ALA HB2 H -10.295 1.550 -3.130 1.00 . A A . 795 ALA HB2 1 1 17 12338 1 1 16 ALA HB3 H -10.211 0.072 -2.173 1.00 . A A . 795 ALA HB3 1 1 17 12339 1 1 16 ALA N N -9.429 2.083 -0.562 1.00 . A A . 795 ALA N 1 1 17 12340 1 1 16 ALA O O -7.495 2.456 -3.548 1.00 . A A . 795 ALA O 1 1 17 12341 1 1 17 ASN C C -5.211 4.216 -2.126 1.00 . A A . 796 ASN C 1 1 17 12342 1 1 17 ASN CA C -6.659 4.688 -2.129 1.00 . A A . 796 ASN CA 1 1 17 12343 1 1 17 ASN CB C -6.822 5.988 -1.316 1.00 . A A . 796 ASN CB 1 1 17 12344 1 1 17 ASN CG C -7.003 5.785 0.188 1.00 . A A . 796 ASN CG 1 1 17 12345 1 1 17 ASN H H -7.887 3.698 -0.719 1.00 . A A . 796 ASN H 1 1 17 12346 1 1 17 ASN HA H -6.947 4.880 -3.153 1.00 . A A . 796 ASN HA 1 1 17 12347 1 1 17 ASN HB2 H -5.942 6.595 -1.464 1.00 . A A . 796 ASN HB2 1 1 17 12348 1 1 17 ASN HB3 H -7.683 6.524 -1.692 1.00 . A A . 796 ASN HB3 1 1 17 12349 1 1 17 ASN HD21 H -5.746 4.249 0.196 1.00 . A A . 796 ASN HD21 1 1 17 12350 1 1 17 ASN HD22 H -6.443 4.654 1.729 1.00 . A A . 796 ASN HD22 1 1 17 12351 1 1 17 ASN N N -7.531 3.632 -1.629 1.00 . A A . 796 ASN N 1 1 17 12352 1 1 17 ASN ND2 N -6.331 4.798 0.761 1.00 . A A . 796 ASN ND2 1 1 17 12353 1 1 17 ASN O O -4.568 4.112 -1.077 1.00 . A A . 796 ASN O 1 1 17 12354 1 1 17 ASN OD1 O -7.732 6.540 0.837 1.00 . A A . 796 ASN OD1 1 1 17 12355 1 1 18 LEU C C -2.377 4.448 -3.706 1.00 . A A . 797 LEU C 1 1 17 12356 1 1 18 LEU CA C -3.386 3.345 -3.431 1.00 . A A . 797 LEU CA 1 1 17 12357 1 1 18 LEU CB C -3.334 2.332 -4.574 1.00 . A A . 797 LEU CB 1 1 17 12358 1 1 18 LEU CD1 C -4.363 0.460 -5.873 1.00 . A A . 797 LEU CD1 1 1 17 12359 1 1 18 LEU CD2 C -4.452 0.417 -3.388 1.00 . A A . 797 LEU CD2 1 1 17 12360 1 1 18 LEU CG C -4.471 1.306 -4.617 1.00 . A A . 797 LEU CG 1 1 17 12361 1 1 18 LEU H H -5.247 4.005 -4.116 1.00 . A A . 797 LEU H 1 1 17 12362 1 1 18 LEU HA H -3.129 2.851 -2.506 1.00 . A A . 797 LEU HA 1 1 17 12363 1 1 18 LEU HB2 H -3.342 2.881 -5.498 1.00 . A A . 797 LEU HB2 1 1 17 12364 1 1 18 LEU HB3 H -2.401 1.795 -4.504 1.00 . A A . 797 LEU HB3 1 1 17 12365 1 1 18 LEU HD11 H -4.439 1.094 -6.744 1.00 . A A . 797 LEU HD11 1 1 17 12366 1 1 18 LEU HD12 H -5.159 -0.269 -5.886 1.00 . A A . 797 LEU HD12 1 1 17 12367 1 1 18 LEU HD13 H -3.410 -0.048 -5.882 1.00 . A A . 797 LEU HD13 1 1 17 12368 1 1 18 LEU HD21 H -4.543 1.026 -2.501 1.00 . A A . 797 LEU HD21 1 1 17 12369 1 1 18 LEU HD22 H -3.521 -0.130 -3.355 1.00 . A A . 797 LEU HD22 1 1 17 12370 1 1 18 LEU HD23 H -5.276 -0.279 -3.435 1.00 . A A . 797 LEU HD23 1 1 17 12371 1 1 18 LEU HG H -5.418 1.827 -4.641 1.00 . A A . 797 LEU HG 1 1 17 12372 1 1 18 LEU N N -4.716 3.881 -3.300 1.00 . A A . 797 LEU N 1 1 17 12373 1 1 18 LEU O O -2.697 5.475 -4.305 1.00 . A A . 797 LEU O 1 1 17 12374 1 1 19 LEU C C 1.149 4.000 -3.624 1.00 . A A . 798 LEU C 1 1 17 12375 1 1 19 LEU CA C 0.002 4.986 -3.630 1.00 . A A . 798 LEU CA 1 1 17 12376 1 1 19 LEU CB C 0.231 6.228 -2.723 1.00 . A A . 798 LEU CB 1 1 17 12377 1 1 19 LEU CD1 C -0.196 5.014 -0.526 1.00 . A A . 798 LEU CD1 1 1 17 12378 1 1 19 LEU CD2 C 2.146 5.612 -1.207 1.00 . A A . 798 LEU CD2 1 1 17 12379 1 1 19 LEU CG C 0.683 6.016 -1.262 1.00 . A A . 798 LEU CG 1 1 17 12380 1 1 19 LEU H H -1.057 3.478 -2.599 1.00 . A A . 798 LEU H 1 1 17 12381 1 1 19 LEU HA H -0.124 5.308 -4.650 1.00 . A A . 798 LEU HA 1 1 17 12382 1 1 19 LEU HB2 H 0.971 6.849 -3.205 1.00 . A A . 798 LEU HB2 1 1 17 12383 1 1 19 LEU HB3 H -0.697 6.785 -2.702 1.00 . A A . 798 LEU HB3 1 1 17 12384 1 1 19 LEU HD11 H 0.128 4.935 0.501 1.00 . A A . 798 LEU HD11 1 1 17 12385 1 1 19 LEU HD12 H -0.119 4.049 -1.004 1.00 . A A . 798 LEU HD12 1 1 17 12386 1 1 19 LEU HD13 H -1.223 5.348 -0.556 1.00 . A A . 798 LEU HD13 1 1 17 12387 1 1 19 LEU HD21 H 2.408 5.330 -0.198 1.00 . A A . 798 LEU HD21 1 1 17 12388 1 1 19 LEU HD22 H 2.760 6.443 -1.521 1.00 . A A . 798 LEU HD22 1 1 17 12389 1 1 19 LEU HD23 H 2.307 4.775 -1.873 1.00 . A A . 798 LEU HD23 1 1 17 12390 1 1 19 LEU HG H 0.593 6.959 -0.740 1.00 . A A . 798 LEU HG 1 1 17 12391 1 1 19 LEU N N -1.173 4.217 -3.242 1.00 . A A . 798 LEU N 1 1 17 12392 1 1 19 LEU O O 1.025 2.946 -3.003 1.00 . A A . 798 LEU O 1 1 17 12393 1 1 20 LYS C C 4.517 3.336 -3.946 1.00 . A A . 799 LYS C 1 1 17 12394 1 1 20 LYS CA C 3.145 3.156 -4.567 1.00 . A A . 799 LYS CA 1 1 17 12395 1 1 20 LYS CB C 3.251 2.813 -6.054 1.00 . A A . 799 LYS CB 1 1 17 12396 1 1 20 LYS CD C 3.944 3.545 -8.354 1.00 . A A . 799 LYS CD 1 1 17 12397 1 1 20 LYS CE C 4.572 4.644 -9.193 1.00 . A A . 799 LYS CE 1 1 17 12398 1 1 20 LYS CG C 3.935 3.893 -6.878 1.00 . A A . 799 LYS CG 1 1 17 12399 1 1 20 LYS H H 2.427 5.172 -4.642 1.00 . A A . 799 LYS H 1 1 17 12400 1 1 20 LYS HA H 2.682 2.356 -4.020 1.00 . A A . 799 LYS HA 1 1 17 12401 1 1 20 LYS HB2 H 3.815 1.897 -6.162 1.00 . A A . 799 LYS HB2 1 1 17 12402 1 1 20 LYS HB3 H 2.257 2.662 -6.450 1.00 . A A . 799 LYS HB3 1 1 17 12403 1 1 20 LYS HD2 H 4.507 2.635 -8.495 1.00 . A A . 799 LYS HD2 1 1 17 12404 1 1 20 LYS HD3 H 2.925 3.392 -8.682 1.00 . A A . 799 LYS HD3 1 1 17 12405 1 1 20 LYS HE2 H 4.089 5.582 -8.959 1.00 . A A . 799 LYS HE2 1 1 17 12406 1 1 20 LYS HE3 H 5.622 4.710 -8.948 1.00 . A A . 799 LYS HE3 1 1 17 12407 1 1 20 LYS HG2 H 3.410 4.823 -6.741 1.00 . A A . 799 LYS HG2 1 1 17 12408 1 1 20 LYS HG3 H 4.954 3.999 -6.537 1.00 . A A . 799 LYS HG3 1 1 17 12409 1 1 20 LYS HZ1 H 3.421 4.387 -10.916 1.00 . A A . 799 LYS HZ1 1 1 17 12410 1 1 20 LYS HZ2 H 4.828 3.441 -10.886 1.00 . A A . 799 LYS HZ2 1 1 17 12411 1 1 20 LYS HZ3 H 4.927 5.107 -11.197 1.00 . A A . 799 LYS HZ3 1 1 17 12412 1 1 20 LYS N N 2.234 4.260 -4.333 1.00 . A A . 799 LYS N 1 1 17 12413 1 1 20 LYS NZ N 4.428 4.376 -10.647 1.00 . A A . 799 LYS NZ 1 1 17 12414 1 1 20 LYS O O 5.099 4.422 -3.919 1.00 . A A . 799 LYS O 1 1 17 12415 1 1 21 CYS C C 7.369 2.485 -3.853 1.00 . A A . 800 CYS C 1 1 17 12416 1 1 21 CYS CA C 6.294 1.977 -2.898 1.00 . A A . 800 CYS CA 1 1 17 12417 1 1 21 CYS CB C 6.330 0.466 -2.757 1.00 . A A . 800 CYS CB 1 1 17 12418 1 1 21 CYS H H 4.339 1.453 -3.341 1.00 . A A . 800 CYS H 1 1 17 12419 1 1 21 CYS HA H 6.382 2.430 -1.925 1.00 . A A . 800 CYS HA 1 1 17 12420 1 1 21 CYS HB2 H 5.639 0.187 -1.974 1.00 . A A . 800 CYS HB2 1 1 17 12421 1 1 21 CYS HB3 H 5.971 0.041 -3.686 1.00 . A A . 800 CYS HB3 1 1 17 12422 1 1 21 CYS N N 4.967 2.208 -3.418 1.00 . A A . 800 CYS N 1 1 17 12423 1 1 21 CYS O O 7.650 1.853 -4.865 1.00 . A A . 800 CYS O 1 1 17 12424 1 1 21 CYS SG S 7.874 -0.360 -2.361 1.00 . A A . 800 CYS SG 1 1 17 12425 1 1 22 GLU C C 10.264 3.500 -4.503 1.00 . A A . 801 GLU C 1 1 17 12426 1 1 22 GLU CA C 8.962 4.297 -4.348 1.00 . A A . 801 GLU CA 1 1 17 12427 1 1 22 GLU CB C 9.263 5.683 -3.775 1.00 . A A . 801 GLU CB 1 1 17 12428 1 1 22 GLU CD C 8.325 7.914 -3.047 1.00 . A A . 801 GLU CD 1 1 17 12429 1 1 22 GLU CG C 8.046 6.594 -3.736 1.00 . A A . 801 GLU CG 1 1 17 12430 1 1 22 GLU H H 7.697 4.055 -2.667 1.00 . A A . 801 GLU H 1 1 17 12431 1 1 22 GLU HA H 8.547 4.421 -5.336 1.00 . A A . 801 GLU HA 1 1 17 12432 1 1 22 GLU HB2 H 9.638 5.572 -2.769 1.00 . A A . 801 GLU HB2 1 1 17 12433 1 1 22 GLU HB3 H 10.018 6.155 -4.383 1.00 . A A . 801 GLU HB3 1 1 17 12434 1 1 22 GLU HG2 H 7.730 6.795 -4.749 1.00 . A A . 801 GLU HG2 1 1 17 12435 1 1 22 GLU HG3 H 7.252 6.088 -3.206 1.00 . A A . 801 GLU HG3 1 1 17 12436 1 1 22 GLU N N 7.959 3.627 -3.514 1.00 . A A . 801 GLU N 1 1 17 12437 1 1 22 GLU O O 11.291 4.055 -4.893 1.00 . A A . 801 GLU O 1 1 17 12438 1 1 22 GLU OE1 O 9.013 8.765 -3.648 1.00 . A A . 801 GLU OE1 1 1 17 12439 1 1 22 GLU OE2 O 7.885 8.101 -1.896 1.00 . A A . 801 GLU OE2 1 1 17 12440 1 1 23 TYR C C 11.066 0.440 -5.675 1.00 . A A . 802 TYR C 1 1 17 12441 1 1 23 TYR CA C 11.369 1.354 -4.488 1.00 . A A . 802 TYR CA 1 1 17 12442 1 1 23 TYR CB C 11.747 0.513 -3.266 1.00 . A A . 802 TYR CB 1 1 17 12443 1 1 23 TYR CD1 C 14.266 0.446 -3.076 1.00 . A A . 802 TYR CD1 1 1 17 12444 1 1 23 TYR CD2 C 13.143 -1.481 -3.916 1.00 . A A . 802 TYR CD2 1 1 17 12445 1 1 23 TYR CE1 C 15.479 -0.198 -3.209 1.00 . A A . 802 TYR CE1 1 1 17 12446 1 1 23 TYR CE2 C 14.352 -2.134 -4.047 1.00 . A A . 802 TYR CE2 1 1 17 12447 1 1 23 TYR CG C 13.078 -0.183 -3.429 1.00 . A A . 802 TYR CG 1 1 17 12448 1 1 23 TYR CZ C 15.533 -1.437 -3.763 1.00 . A A . 802 TYR CZ 1 1 17 12449 1 1 23 TYR H H 9.410 1.827 -3.841 1.00 . A A . 802 TYR H 1 1 17 12450 1 1 23 TYR HA H 12.205 1.990 -4.743 1.00 . A A . 802 TYR HA 1 1 17 12451 1 1 23 TYR HB2 H 11.810 1.154 -2.400 1.00 . A A . 802 TYR HB2 1 1 17 12452 1 1 23 TYR HB3 H 10.992 -0.241 -3.101 1.00 . A A . 802 TYR HB3 1 1 17 12453 1 1 23 TYR HD1 H 14.234 1.458 -2.697 1.00 . A A . 802 TYR HD1 1 1 17 12454 1 1 23 TYR HD2 H 12.229 -1.983 -4.196 1.00 . A A . 802 TYR HD2 1 1 17 12455 1 1 23 TYR HE1 H 16.392 0.309 -2.932 1.00 . A A . 802 TYR HE1 1 1 17 12456 1 1 23 TYR HE2 H 14.383 -3.145 -4.427 1.00 . A A . 802 TYR HE2 1 1 17 12457 1 1 23 TYR HH H 16.727 -2.666 -4.626 1.00 . A A . 802 TYR HH 1 1 17 12458 1 1 23 TYR N N 10.228 2.210 -4.218 1.00 . A A . 802 TYR N 1 1 17 12459 1 1 23 TYR O O 11.884 0.288 -6.582 1.00 . A A . 802 TYR O 1 1 17 12460 1 1 23 TYR OH O 16.722 -2.134 -3.813 1.00 . A A . 802 TYR OH 1 1 17 12461 1 1 24 CYS C C 8.346 -0.564 -7.565 1.00 . A A . 803 CYS C 1 1 17 12462 1 1 24 CYS CA C 9.495 -1.098 -6.708 1.00 . A A . 803 CYS CA 1 1 17 12463 1 1 24 CYS CB C 9.116 -2.438 -6.077 1.00 . A A . 803 CYS CB 1 1 17 12464 1 1 24 CYS H H 9.254 0.041 -4.944 1.00 . A A . 803 CYS H 1 1 17 12465 1 1 24 CYS HA H 10.334 -1.236 -7.371 1.00 . A A . 803 CYS HA 1 1 17 12466 1 1 24 CYS HB2 H 8.706 -3.085 -6.836 1.00 . A A . 803 CYS HB2 1 1 17 12467 1 1 24 CYS HB3 H 10.002 -2.896 -5.659 1.00 . A A . 803 CYS HB3 1 1 17 12468 1 1 24 CYS N N 9.881 -0.154 -5.668 1.00 . A A . 803 CYS N 1 1 17 12469 1 1 24 CYS O O 8.166 -0.996 -8.702 1.00 . A A . 803 CYS O 1 1 17 12470 1 1 24 CYS SG S 7.889 -2.297 -4.748 1.00 . A A . 803 CYS SG 1 1 17 12471 1 1 25 GLY C C 5.224 0.252 -7.800 1.00 . A A . 804 GLY C 1 1 17 12472 1 1 25 GLY CA C 6.536 1.001 -7.817 1.00 . A A . 804 GLY CA 1 1 17 12473 1 1 25 GLY H H 7.648 0.580 -6.072 1.00 . A A . 804 GLY H 1 1 17 12474 1 1 25 GLY HA2 H 6.374 1.997 -7.432 1.00 . A A . 804 GLY HA2 1 1 17 12475 1 1 25 GLY HA3 H 6.882 1.074 -8.835 1.00 . A A . 804 GLY HA3 1 1 17 12476 1 1 25 GLY N N 7.555 0.350 -7.022 1.00 . A A . 804 GLY N 1 1 17 12477 1 1 25 GLY O O 4.385 0.431 -8.680 1.00 . A A . 804 GLY O 1 1 17 12478 1 1 26 LYS C C 2.772 -0.579 -5.949 1.00 . A A . 805 LYS C 1 1 17 12479 1 1 26 LYS CA C 3.820 -1.379 -6.704 1.00 . A A . 805 LYS CA 1 1 17 12480 1 1 26 LYS CB C 4.092 -2.720 -6.021 1.00 . A A . 805 LYS CB 1 1 17 12481 1 1 26 LYS CD C 4.515 -3.965 -8.165 1.00 . A A . 805 LYS CD 1 1 17 12482 1 1 26 LYS CE C 5.615 -4.365 -9.140 1.00 . A A . 805 LYS CE 1 1 17 12483 1 1 26 LYS CG C 5.079 -3.576 -6.803 1.00 . A A . 805 LYS CG 1 1 17 12484 1 1 26 LYS H H 5.726 -0.689 -6.107 1.00 . A A . 805 LYS H 1 1 17 12485 1 1 26 LYS HA H 3.464 -1.563 -7.708 1.00 . A A . 805 LYS HA 1 1 17 12486 1 1 26 LYS HB2 H 4.493 -2.542 -5.033 1.00 . A A . 805 LYS HB2 1 1 17 12487 1 1 26 LYS HB3 H 3.165 -3.266 -5.935 1.00 . A A . 805 LYS HB3 1 1 17 12488 1 1 26 LYS HD2 H 3.840 -4.798 -8.039 1.00 . A A . 805 LYS HD2 1 1 17 12489 1 1 26 LYS HD3 H 3.976 -3.123 -8.574 1.00 . A A . 805 LYS HD3 1 1 17 12490 1 1 26 LYS HE2 H 6.280 -5.060 -8.648 1.00 . A A . 805 LYS HE2 1 1 17 12491 1 1 26 LYS HE3 H 5.163 -4.846 -9.994 1.00 . A A . 805 LYS HE3 1 1 17 12492 1 1 26 LYS HG2 H 5.992 -3.017 -6.948 1.00 . A A . 805 LYS HG2 1 1 17 12493 1 1 26 LYS HG3 H 5.289 -4.474 -6.240 1.00 . A A . 805 LYS HG3 1 1 17 12494 1 1 26 LYS HZ1 H 5.770 -2.486 -10.050 1.00 . A A . 805 LYS HZ1 1 1 17 12495 1 1 26 LYS HZ2 H 7.114 -3.487 -10.307 1.00 . A A . 805 LYS HZ2 1 1 17 12496 1 1 26 LYS HZ3 H 6.892 -2.743 -8.807 1.00 . A A . 805 LYS HZ3 1 1 17 12497 1 1 26 LYS N N 5.047 -0.607 -6.811 1.00 . A A . 805 LYS N 1 1 17 12498 1 1 26 LYS NZ N 6.402 -3.190 -9.604 1.00 . A A . 805 LYS NZ 1 1 17 12499 1 1 26 LYS O O 3.064 -0.009 -4.895 1.00 . A A . 805 LYS O 1 1 17 12500 1 1 27 TYR C C -0.178 -0.566 -4.781 1.00 . A A . 806 TYR C 1 1 17 12501 1 1 27 TYR CA C 0.490 0.241 -5.872 1.00 . A A . 806 TYR CA 1 1 17 12502 1 1 27 TYR CB C -0.544 0.681 -6.911 1.00 . A A . 806 TYR CB 1 1 17 12503 1 1 27 TYR CD1 C 0.032 2.993 -7.751 1.00 . A A . 806 TYR CD1 1 1 17 12504 1 1 27 TYR CD2 C 0.495 1.130 -9.161 1.00 . A A . 806 TYR CD2 1 1 17 12505 1 1 27 TYR CE1 C 0.532 3.850 -8.711 1.00 . A A . 806 TYR CE1 1 1 17 12506 1 1 27 TYR CE2 C 0.995 1.981 -10.126 1.00 . A A . 806 TYR CE2 1 1 17 12507 1 1 27 TYR CG C 0.004 1.619 -7.960 1.00 . A A . 806 TYR CG 1 1 17 12508 1 1 27 TYR CZ C 1.017 3.351 -9.884 1.00 . A A . 806 TYR CZ 1 1 17 12509 1 1 27 TYR H H 1.346 -1.105 -7.259 1.00 . A A . 806 TYR H 1 1 17 12510 1 1 27 TYR HA H 0.919 1.117 -5.406 1.00 . A A . 806 TYR HA 1 1 17 12511 1 1 27 TYR HB2 H -0.930 -0.190 -7.414 1.00 . A A . 806 TYR HB2 1 1 17 12512 1 1 27 TYR HB3 H -1.356 1.186 -6.407 1.00 . A A . 806 TYR HB3 1 1 17 12513 1 1 27 TYR HD1 H -0.342 3.390 -6.820 1.00 . A A . 806 TYR HD1 1 1 17 12514 1 1 27 TYR HD2 H 0.479 0.064 -9.341 1.00 . A A . 806 TYR HD2 1 1 17 12515 1 1 27 TYR HE1 H 0.544 4.915 -8.531 1.00 . A A . 806 TYR HE1 1 1 17 12516 1 1 27 TYR HE2 H 1.374 1.580 -11.055 1.00 . A A . 806 TYR HE2 1 1 17 12517 1 1 27 TYR HH H 2.137 4.800 -10.463 1.00 . A A . 806 TYR HH 1 1 17 12518 1 1 27 TYR N N 1.556 -0.543 -6.477 1.00 . A A . 806 TYR N 1 1 17 12519 1 1 27 TYR O O -0.566 -1.715 -4.984 1.00 . A A . 806 TYR O 1 1 17 12520 1 1 27 TYR OH O 1.496 4.190 -10.863 1.00 . A A . 806 TYR OH 1 1 17 12521 1 1 28 ALA C C -1.547 0.395 -1.580 1.00 . A A . 807 ALA C 1 1 17 12522 1 1 28 ALA CA C -0.807 -0.611 -2.445 1.00 . A A . 807 ALA CA 1 1 17 12523 1 1 28 ALA CB C 0.343 -1.254 -1.676 1.00 . A A . 807 ALA CB 1 1 17 12524 1 1 28 ALA H H 0.007 0.986 -3.558 1.00 . A A . 807 ALA H 1 1 17 12525 1 1 28 ALA HA H -1.490 -1.387 -2.758 1.00 . A A . 807 ALA HA 1 1 17 12526 1 1 28 ALA HB1 H 1.014 -0.486 -1.322 1.00 . A A . 807 ALA HB1 1 1 17 12527 1 1 28 ALA HB2 H 0.882 -1.926 -2.330 1.00 . A A . 807 ALA HB2 1 1 17 12528 1 1 28 ALA HB3 H -0.049 -1.807 -0.835 1.00 . A A . 807 ALA HB3 1 1 17 12529 1 1 28 ALA N N -0.292 0.051 -3.625 1.00 . A A . 807 ALA N 1 1 17 12530 1 1 28 ALA O O -1.304 1.601 -1.677 1.00 . A A . 807 ALA O 1 1 17 12531 1 1 29 PRO C C -2.510 1.482 1.151 1.00 . A A . 808 PRO C 1 1 17 12532 1 1 29 PRO CA C -3.320 0.808 0.061 1.00 . A A . 808 PRO CA 1 1 17 12533 1 1 29 PRO CB C -4.371 -0.124 0.677 1.00 . A A . 808 PRO CB 1 1 17 12534 1 1 29 PRO CD C -2.816 -1.488 -0.525 1.00 . A A . 808 PRO CD 1 1 17 12535 1 1 29 PRO CG C -4.232 -1.429 -0.040 1.00 . A A . 808 PRO CG 1 1 17 12536 1 1 29 PRO HA H -3.804 1.559 -0.546 1.00 . A A . 808 PRO HA 1 1 17 12537 1 1 29 PRO HB2 H -4.174 -0.233 1.730 1.00 . A A . 808 PRO HB2 1 1 17 12538 1 1 29 PRO HB3 H -5.356 0.299 0.534 1.00 . A A . 808 PRO HB3 1 1 17 12539 1 1 29 PRO HD2 H -2.174 -1.916 0.234 1.00 . A A . 808 PRO HD2 1 1 17 12540 1 1 29 PRO HD3 H -2.749 -2.053 -1.442 1.00 . A A . 808 PRO HD3 1 1 17 12541 1 1 29 PRO HG2 H -4.427 -2.242 0.641 1.00 . A A . 808 PRO HG2 1 1 17 12542 1 1 29 PRO HG3 H -4.916 -1.466 -0.875 1.00 . A A . 808 PRO HG3 1 1 17 12543 1 1 29 PRO N N -2.491 -0.073 -0.752 1.00 . A A . 808 PRO N 1 1 17 12544 1 1 29 PRO O O -1.720 0.834 1.841 1.00 . A A . 808 PRO O 1 1 17 12545 1 1 30 ALA C C -1.957 2.982 3.655 1.00 . A A . 809 ALA C 1 1 17 12546 1 1 30 ALA CA C -2.027 3.633 2.270 1.00 . A A . 809 ALA CA 1 1 17 12547 1 1 30 ALA CB C -2.725 4.981 2.370 1.00 . A A . 809 ALA CB 1 1 17 12548 1 1 30 ALA H H -3.300 3.239 0.609 1.00 . A A . 809 ALA H 1 1 17 12549 1 1 30 ALA HA H -1.022 3.813 1.911 1.00 . A A . 809 ALA HA 1 1 17 12550 1 1 30 ALA HB1 H -3.731 4.838 2.735 1.00 . A A . 809 ALA HB1 1 1 17 12551 1 1 30 ALA HB2 H -2.756 5.443 1.395 1.00 . A A . 809 ALA HB2 1 1 17 12552 1 1 30 ALA HB3 H -2.181 5.617 3.054 1.00 . A A . 809 ALA HB3 1 1 17 12553 1 1 30 ALA N N -2.704 2.798 1.267 1.00 . A A . 809 ALA N 1 1 17 12554 1 1 30 ALA O O -1.041 3.259 4.429 1.00 . A A . 809 ALA O 1 1 17 12555 1 1 31 GLU C C -1.708 0.658 5.539 1.00 . A A . 810 GLU C 1 1 17 12556 1 1 31 GLU CA C -3.007 1.416 5.223 1.00 . A A . 810 GLU CA 1 1 17 12557 1 1 31 GLU CB C -4.198 0.450 5.187 1.00 . A A . 810 GLU CB 1 1 17 12558 1 1 31 GLU CD C -4.072 -1.935 6.015 1.00 . A A . 810 GLU CD 1 1 17 12559 1 1 31 GLU CG C -4.299 -0.482 6.387 1.00 . A A . 810 GLU CG 1 1 17 12560 1 1 31 GLU H H -3.662 2.015 3.306 1.00 . A A . 810 GLU H 1 1 17 12561 1 1 31 GLU HA H -3.179 2.146 6.000 1.00 . A A . 810 GLU HA 1 1 17 12562 1 1 31 GLU HB2 H -5.110 1.030 5.138 1.00 . A A . 810 GLU HB2 1 1 17 12563 1 1 31 GLU HB3 H -4.126 -0.155 4.294 1.00 . A A . 810 GLU HB3 1 1 17 12564 1 1 31 GLU HG2 H -3.558 -0.192 7.117 1.00 . A A . 810 GLU HG2 1 1 17 12565 1 1 31 GLU HG3 H -5.285 -0.386 6.818 1.00 . A A . 810 GLU HG3 1 1 17 12566 1 1 31 GLU N N -2.939 2.139 3.954 1.00 . A A . 810 GLU N 1 1 17 12567 1 1 31 GLU O O -1.185 0.758 6.648 1.00 . A A . 810 GLU O 1 1 17 12568 1 1 31 GLU OE1 O -2.906 -2.377 5.992 1.00 . A A . 810 GLU OE1 1 1 17 12569 1 1 31 GLU OE2 O -5.061 -2.648 5.741 1.00 . A A . 810 GLU OE2 1 1 17 12570 1 1 32 GLN C C 1.292 -0.148 4.571 1.00 . A A . 811 GLN C 1 1 17 12571 1 1 32 GLN CA C -0.010 -0.922 4.777 1.00 . A A . 811 GLN CA 1 1 17 12572 1 1 32 GLN CB C -0.061 -2.169 3.877 1.00 . A A . 811 GLN CB 1 1 17 12573 1 1 32 GLN CD C 1.161 -1.974 1.669 1.00 . A A . 811 GLN CD 1 1 17 12574 1 1 32 GLN CG C -0.172 -1.894 2.385 1.00 . A A . 811 GLN CG 1 1 17 12575 1 1 32 GLN H H -1.592 -0.047 3.670 1.00 . A A . 811 GLN H 1 1 17 12576 1 1 32 GLN HA H -0.015 -1.257 5.804 1.00 . A A . 811 GLN HA 1 1 17 12577 1 1 32 GLN HB2 H 0.837 -2.745 4.041 1.00 . A A . 811 GLN HB2 1 1 17 12578 1 1 32 GLN HB3 H -0.911 -2.767 4.171 1.00 . A A . 811 GLN HB3 1 1 17 12579 1 1 32 GLN HE21 H 1.434 -0.027 1.902 1.00 . A A . 811 GLN HE21 1 1 17 12580 1 1 32 GLN HE22 H 2.684 -0.866 1.064 1.00 . A A . 811 GLN HE22 1 1 17 12581 1 1 32 GLN HG2 H -0.838 -2.622 1.948 1.00 . A A . 811 GLN HG2 1 1 17 12582 1 1 32 GLN HG3 H -0.583 -0.904 2.243 1.00 . A A . 811 GLN HG3 1 1 17 12583 1 1 32 GLN N N -1.187 -0.083 4.563 1.00 . A A . 811 GLN N 1 1 17 12584 1 1 32 GLN NE2 N 1.828 -0.845 1.533 1.00 . A A . 811 GLN NE2 1 1 17 12585 1 1 32 GLN O O 2.361 -0.744 4.444 1.00 . A A . 811 GLN O 1 1 17 12586 1 1 32 GLN OE1 O 1.575 -3.042 1.223 1.00 . A A . 811 GLN OE1 1 1 17 12587 1 1 33 PHE C C 2.828 2.562 5.764 1.00 . A A . 812 PHE C 1 1 17 12588 1 1 33 PHE CA C 2.379 2.023 4.412 1.00 . A A . 812 PHE CA 1 1 17 12589 1 1 33 PHE CB C 2.123 3.167 3.428 1.00 . A A . 812 PHE CB 1 1 17 12590 1 1 33 PHE CD1 C 1.227 2.191 1.304 1.00 . A A . 812 PHE CD1 1 1 17 12591 1 1 33 PHE CD2 C 3.471 2.975 1.332 1.00 . A A . 812 PHE CD2 1 1 17 12592 1 1 33 PHE CE1 C 1.373 1.820 -0.016 1.00 . A A . 812 PHE CE1 1 1 17 12593 1 1 33 PHE CE2 C 3.624 2.608 0.012 1.00 . A A . 812 PHE CE2 1 1 17 12594 1 1 33 PHE CG C 2.274 2.770 1.991 1.00 . A A . 812 PHE CG 1 1 17 12595 1 1 33 PHE CZ C 2.573 2.027 -0.663 1.00 . A A . 812 PHE CZ 1 1 17 12596 1 1 33 PHE H H 0.330 1.593 4.737 1.00 . A A . 812 PHE H 1 1 17 12597 1 1 33 PHE HA H 3.173 1.400 4.029 1.00 . A A . 812 PHE HA 1 1 17 12598 1 1 33 PHE HB2 H 1.116 3.532 3.565 1.00 . A A . 812 PHE HB2 1 1 17 12599 1 1 33 PHE HB3 H 2.820 3.968 3.626 1.00 . A A . 812 PHE HB3 1 1 17 12600 1 1 33 PHE HD1 H 0.285 2.027 1.811 1.00 . A A . 812 PHE HD1 1 1 17 12601 1 1 33 PHE HD2 H 4.295 3.430 1.862 1.00 . A A . 812 PHE HD2 1 1 17 12602 1 1 33 PHE HE1 H 0.547 1.368 -0.545 1.00 . A A . 812 PHE HE1 1 1 17 12603 1 1 33 PHE HE2 H 4.567 2.773 -0.490 1.00 . A A . 812 PHE HE2 1 1 17 12604 1 1 33 PHE HZ H 2.688 1.737 -1.699 1.00 . A A . 812 PHE HZ 1 1 17 12605 1 1 33 PHE N N 1.200 1.176 4.560 1.00 . A A . 812 PHE N 1 1 17 12606 1 1 33 PHE O O 3.333 3.678 5.871 1.00 . A A . 812 PHE O 1 1 17 12607 1 1 34 ARG C C 4.504 1.857 8.360 1.00 . A A . 813 ARG C 1 1 17 12608 1 1 34 ARG CA C 3.027 2.139 8.143 1.00 . A A . 813 ARG CA 1 1 17 12609 1 1 34 ARG CB C 2.165 1.411 9.174 1.00 . A A . 813 ARG CB 1 1 17 12610 1 1 34 ARG CD C -0.174 0.914 9.973 1.00 . A A . 813 ARG CD 1 1 17 12611 1 1 34 ARG CG C 0.684 1.661 8.968 1.00 . A A . 813 ARG CG 1 1 17 12612 1 1 34 ARG CZ C -2.569 1.296 10.465 1.00 . A A . 813 ARG CZ 1 1 17 12613 1 1 34 ARG H H 2.231 0.882 6.644 1.00 . A A . 813 ARG H 1 1 17 12614 1 1 34 ARG HA H 2.894 3.205 8.256 1.00 . A A . 813 ARG HA 1 1 17 12615 1 1 34 ARG HB2 H 2.349 0.349 9.100 1.00 . A A . 813 ARG HB2 1 1 17 12616 1 1 34 ARG HB3 H 2.434 1.750 10.164 1.00 . A A . 813 ARG HB3 1 1 17 12617 1 1 34 ARG HD2 H 0.131 -0.122 9.991 1.00 . A A . 813 ARG HD2 1 1 17 12618 1 1 34 ARG HD3 H -0.031 1.353 10.950 1.00 . A A . 813 ARG HD3 1 1 17 12619 1 1 34 ARG HE H -1.817 0.824 8.671 1.00 . A A . 813 ARG HE 1 1 17 12620 1 1 34 ARG HG2 H 0.491 2.718 9.067 1.00 . A A . 813 ARG HG2 1 1 17 12621 1 1 34 ARG HG3 H 0.412 1.340 7.971 1.00 . A A . 813 ARG HG3 1 1 17 12622 1 1 34 ARG HH11 H -1.353 1.452 12.087 1.00 . A A . 813 ARG HH11 1 1 17 12623 1 1 34 ARG HH12 H -3.040 1.759 12.390 1.00 . A A . 813 ARG HH12 1 1 17 12624 1 1 34 ARG HH21 H -4.024 1.217 9.058 1.00 . A A . 813 ARG HH21 1 1 17 12625 1 1 34 ARG HH22 H -4.567 1.631 10.648 1.00 . A A . 813 ARG HH22 1 1 17 12626 1 1 34 ARG N N 2.635 1.760 6.796 1.00 . A A . 813 ARG N 1 1 17 12627 1 1 34 ARG NE N -1.589 0.996 9.614 1.00 . A A . 813 ARG NE 1 1 17 12628 1 1 34 ARG NH1 N -2.299 1.520 11.747 1.00 . A A . 813 ARG NH1 1 1 17 12629 1 1 34 ARG NH2 N -3.818 1.384 10.023 1.00 . A A . 813 ARG NH2 1 1 17 12630 1 1 34 ARG O O 5.088 0.977 7.725 1.00 . A A . 813 ARG O 1 1 17 12631 1 1 35 GLY C C 7.161 3.733 8.566 1.00 . A A . 814 GLY C 1 1 17 12632 1 1 35 GLY CA C 6.540 2.620 9.387 1.00 . A A . 814 GLY CA 1 1 17 12633 1 1 35 GLY H H 4.562 3.185 9.847 1.00 . A A . 814 GLY H 1 1 17 12634 1 1 35 GLY HA2 H 6.795 2.757 10.428 1.00 . A A . 814 GLY HA2 1 1 17 12635 1 1 35 GLY HA3 H 6.925 1.672 9.046 1.00 . A A . 814 GLY HA3 1 1 17 12636 1 1 35 GLY N N 5.103 2.623 9.251 1.00 . A A . 814 GLY N 1 1 17 12637 1 1 35 GLY O O 7.905 4.562 9.088 1.00 . A A . 814 GLY O 1 1 17 12638 1 1 36 SER C C 6.379 4.883 5.152 1.00 . A A . 815 SER C 1 1 17 12639 1 1 36 SER CA C 7.293 4.806 6.374 1.00 . A A . 815 SER CA 1 1 17 12640 1 1 36 SER CB C 8.737 4.548 5.926 1.00 . A A . 815 SER CB 1 1 17 12641 1 1 36 SER H H 6.271 3.039 6.918 1.00 . A A . 815 SER H 1 1 17 12642 1 1 36 SER HA H 7.246 5.750 6.899 1.00 . A A . 815 SER HA 1 1 17 12643 1 1 36 SER HB2 H 8.792 3.588 5.435 1.00 . A A . 815 SER HB2 1 1 17 12644 1 1 36 SER HB3 H 9.039 5.322 5.236 1.00 . A A . 815 SER HB3 1 1 17 12645 1 1 36 SER HG H 9.113 4.621 7.850 1.00 . A A . 815 SER HG 1 1 17 12646 1 1 36 SER N N 6.838 3.756 7.278 1.00 . A A . 815 SER N 1 1 17 12647 1 1 36 SER O O 6.230 3.902 4.421 1.00 . A A . 815 SER O 1 1 17 12648 1 1 36 SER OG O 9.628 4.545 7.032 1.00 . A A . 815 SER OG 1 1 17 12649 1 1 37 LYS C C 5.739 6.466 2.518 1.00 . A A . 816 LYS C 1 1 17 12650 1 1 37 LYS CA C 4.900 6.272 3.779 1.00 . A A . 816 LYS CA 1 1 17 12651 1 1 37 LYS CB C 4.013 7.500 4.009 1.00 . A A . 816 LYS CB 1 1 17 12652 1 1 37 LYS CD C 1.932 6.260 4.646 1.00 . A A . 816 LYS CD 1 1 17 12653 1 1 37 LYS CE C 0.842 6.067 5.688 1.00 . A A . 816 LYS CE 1 1 17 12654 1 1 37 LYS CG C 2.945 7.306 5.073 1.00 . A A . 816 LYS CG 1 1 17 12655 1 1 37 LYS H H 5.954 6.807 5.541 1.00 . A A . 816 LYS H 1 1 17 12656 1 1 37 LYS HA H 4.275 5.396 3.662 1.00 . A A . 816 LYS HA 1 1 17 12657 1 1 37 LYS HB2 H 4.643 8.322 4.306 1.00 . A A . 816 LYS HB2 1 1 17 12658 1 1 37 LYS HB3 H 3.523 7.752 3.078 1.00 . A A . 816 LYS HB3 1 1 17 12659 1 1 37 LYS HD2 H 1.475 6.572 3.719 1.00 . A A . 816 LYS HD2 1 1 17 12660 1 1 37 LYS HD3 H 2.444 5.321 4.497 1.00 . A A . 816 LYS HD3 1 1 17 12661 1 1 37 LYS HE2 H 0.256 5.201 5.419 1.00 . A A . 816 LYS HE2 1 1 17 12662 1 1 37 LYS HE3 H 1.306 5.900 6.649 1.00 . A A . 816 LYS HE3 1 1 17 12663 1 1 37 LYS HG2 H 3.418 6.982 5.990 1.00 . A A . 816 LYS HG2 1 1 17 12664 1 1 37 LYS HG3 H 2.437 8.244 5.238 1.00 . A A . 816 LYS HG3 1 1 17 12665 1 1 37 LYS HZ1 H -0.809 7.064 6.483 1.00 . A A . 816 LYS HZ1 1 1 17 12666 1 1 37 LYS HZ2 H -0.497 7.437 4.858 1.00 . A A . 816 LYS HZ2 1 1 17 12667 1 1 37 LYS HZ3 H 0.480 8.090 6.077 1.00 . A A . 816 LYS HZ3 1 1 17 12668 1 1 37 LYS N N 5.774 6.051 4.934 1.00 . A A . 816 LYS N 1 1 17 12669 1 1 37 LYS NZ N -0.055 7.245 5.784 1.00 . A A . 816 LYS NZ 1 1 17 12670 1 1 37 LYS O O 5.728 7.535 1.903 1.00 . A A . 816 LYS O 1 1 17 12671 1 1 38 ARG C C 7.577 4.094 0.446 1.00 . A A . 817 ARG C 1 1 17 12672 1 1 38 ARG CA C 7.439 5.469 1.070 1.00 . A A . 817 ARG CA 1 1 17 12673 1 1 38 ARG CB C 8.806 5.926 1.588 1.00 . A A . 817 ARG CB 1 1 17 12674 1 1 38 ARG CD C 10.571 7.727 1.531 1.00 . A A . 817 ARG CD 1 1 17 12675 1 1 38 ARG CG C 9.136 7.352 1.190 1.00 . A A . 817 ARG CG 1 1 17 12676 1 1 38 ARG CZ C 12.188 9.503 0.935 1.00 . A A . 817 ARG CZ 1 1 17 12677 1 1 38 ARG H H 6.374 4.579 2.633 1.00 . A A . 817 ARG H 1 1 17 12678 1 1 38 ARG HA H 7.143 6.147 0.285 1.00 . A A . 817 ARG HA 1 1 17 12679 1 1 38 ARG HB2 H 8.815 5.860 2.665 1.00 . A A . 817 ARG HB2 1 1 17 12680 1 1 38 ARG HB3 H 9.571 5.276 1.187 1.00 . A A . 817 ARG HB3 1 1 17 12681 1 1 38 ARG HD2 H 10.650 7.867 2.598 1.00 . A A . 817 ARG HD2 1 1 17 12682 1 1 38 ARG HD3 H 11.224 6.926 1.220 1.00 . A A . 817 ARG HD3 1 1 17 12683 1 1 38 ARG HE H 10.291 9.410 0.298 1.00 . A A . 817 ARG HE 1 1 17 12684 1 1 38 ARG HG2 H 8.994 7.460 0.126 1.00 . A A . 817 ARG HG2 1 1 17 12685 1 1 38 ARG HG3 H 8.467 8.020 1.712 1.00 . A A . 817 ARG HG3 1 1 17 12686 1 1 38 ARG HH11 H 12.939 8.097 2.201 1.00 . A A . 817 ARG HH11 1 1 17 12687 1 1 38 ARG HH12 H 14.054 9.350 1.732 1.00 . A A . 817 ARG HH12 1 1 17 12688 1 1 38 ARG HH21 H 11.747 11.034 -0.323 1.00 . A A . 817 ARG HH21 1 1 17 12689 1 1 38 ARG HH22 H 13.367 11.039 0.318 1.00 . A A . 817 ARG HH22 1 1 17 12690 1 1 38 ARG N N 6.470 5.431 2.155 1.00 . A A . 817 ARG N 1 1 17 12691 1 1 38 ARG NE N 10.974 8.961 0.858 1.00 . A A . 817 ARG NE 1 1 17 12692 1 1 38 ARG NH1 N 13.133 8.939 1.684 1.00 . A A . 817 ARG NH1 1 1 17 12693 1 1 38 ARG NH2 N 12.456 10.611 0.255 1.00 . A A . 817 ARG NH2 1 1 17 12694 1 1 38 ARG O O 7.810 3.976 -0.755 1.00 . A A . 817 ARG O 1 1 17 12695 1 1 39 PHE C C 6.419 0.855 1.272 1.00 . A A . 818 PHE C 1 1 17 12696 1 1 39 PHE CA C 7.563 1.704 0.760 1.00 . A A . 818 PHE CA 1 1 17 12697 1 1 39 PHE CB C 8.892 1.123 1.250 1.00 . A A . 818 PHE CB 1 1 17 12698 1 1 39 PHE CD1 C 10.542 2.139 -0.338 1.00 . A A . 818 PHE CD1 1 1 17 12699 1 1 39 PHE CD2 C 10.692 2.715 1.970 1.00 . A A . 818 PHE CD2 1 1 17 12700 1 1 39 PHE CE1 C 11.614 2.964 -0.615 1.00 . A A . 818 PHE CE1 1 1 17 12701 1 1 39 PHE CE2 C 11.763 3.543 1.700 1.00 . A A . 818 PHE CE2 1 1 17 12702 1 1 39 PHE CG C 10.070 2.005 0.955 1.00 . A A . 818 PHE CG 1 1 17 12703 1 1 39 PHE CZ C 12.225 3.667 0.405 1.00 . A A . 818 PHE CZ 1 1 17 12704 1 1 39 PHE H H 7.195 3.184 2.195 1.00 . A A . 818 PHE H 1 1 17 12705 1 1 39 PHE HA H 7.561 1.721 -0.319 1.00 . A A . 818 PHE HA 1 1 17 12706 1 1 39 PHE HB2 H 8.842 0.985 2.320 1.00 . A A . 818 PHE HB2 1 1 17 12707 1 1 39 PHE HB3 H 9.058 0.167 0.777 1.00 . A A . 818 PHE HB3 1 1 17 12708 1 1 39 PHE HD1 H 10.064 1.590 -1.136 1.00 . A A . 818 PHE HD1 1 1 17 12709 1 1 39 PHE HD2 H 10.331 2.617 2.983 1.00 . A A . 818 PHE HD2 1 1 17 12710 1 1 39 PHE HE1 H 11.974 3.060 -1.628 1.00 . A A . 818 PHE HE1 1 1 17 12711 1 1 39 PHE HE2 H 12.239 4.090 2.499 1.00 . A A . 818 PHE HE2 1 1 17 12712 1 1 39 PHE HZ H 13.064 4.314 0.189 1.00 . A A . 818 PHE HZ 1 1 17 12713 1 1 39 PHE N N 7.416 3.053 1.247 1.00 . A A . 818 PHE N 1 1 17 12714 1 1 39 PHE O O 5.734 1.248 2.215 1.00 . A A . 818 PHE O 1 1 17 12715 1 1 40 CYS C C 5.908 -1.826 2.522 1.00 . A A . 819 CYS C 1 1 17 12716 1 1 40 CYS CA C 5.310 -1.294 1.207 1.00 . A A . 819 CYS CA 1 1 17 12717 1 1 40 CYS CB C 5.039 -2.431 0.210 1.00 . A A . 819 CYS CB 1 1 17 12718 1 1 40 CYS H H 6.744 -0.528 -0.130 1.00 . A A . 819 CYS H 1 1 17 12719 1 1 40 CYS HA H 4.392 -0.831 1.531 1.00 . A A . 819 CYS HA 1 1 17 12720 1 1 40 CYS HB2 H 5.665 -3.256 0.455 1.00 . A A . 819 CYS HB2 1 1 17 12721 1 1 40 CYS HB3 H 4.001 -2.731 0.290 1.00 . A A . 819 CYS HB3 1 1 17 12722 1 1 40 CYS N N 6.209 -0.296 0.655 1.00 . A A . 819 CYS N 1 1 17 12723 1 1 40 CYS O O 6.778 -1.193 3.113 1.00 . A A . 819 CYS O 1 1 17 12724 1 1 40 CYS SG S 5.365 -2.043 -1.526 1.00 . A A . 819 CYS SG 1 1 17 12725 1 1 41 SER C C 7.083 -3.775 4.681 1.00 . A A . 820 SER C 1 1 17 12726 1 1 41 SER CA C 5.621 -3.433 4.344 1.00 . A A . 820 SER CA 1 1 17 12727 1 1 41 SER CB C 4.712 -4.636 4.590 1.00 . A A . 820 SER CB 1 1 17 12728 1 1 41 SER H H 5.055 -3.603 2.306 1.00 . A A . 820 SER H 1 1 17 12729 1 1 41 SER HA H 5.318 -2.650 5.022 1.00 . A A . 820 SER HA 1 1 17 12730 1 1 41 SER HB2 H 5.033 -5.461 3.974 1.00 . A A . 820 SER HB2 1 1 17 12731 1 1 41 SER HB3 H 4.761 -4.919 5.630 1.00 . A A . 820 SER HB3 1 1 17 12732 1 1 41 SER HG H 3.259 -3.359 4.246 1.00 . A A . 820 SER HG 1 1 17 12733 1 1 41 SER N N 5.444 -2.988 2.959 1.00 . A A . 820 SER N 1 1 17 12734 1 1 41 SER O O 7.962 -2.917 4.594 1.00 . A A . 820 SER O 1 1 17 12735 1 1 41 SER OG O 3.365 -4.321 4.261 1.00 . A A . 820 SER OG 1 1 17 12736 1 1 42 MET C C 9.689 -5.520 4.471 1.00 . A A . 821 MET C 1 1 17 12737 1 1 42 MET CA C 8.698 -5.308 5.585 1.00 . A A . 821 MET CA 1 1 17 12738 1 1 42 MET CB C 8.675 -6.534 6.487 1.00 . A A . 821 MET CB 1 1 17 12739 1 1 42 MET CE C 11.077 -5.791 8.274 1.00 . A A . 821 MET CE 1 1 17 12740 1 1 42 MET CG C 8.343 -6.204 7.929 1.00 . A A . 821 MET CG 1 1 17 12741 1 1 42 MET H H 6.696 -5.719 5.001 1.00 . A A . 821 MET H 1 1 17 12742 1 1 42 MET HA H 9.009 -4.463 6.182 1.00 . A A . 821 MET HA 1 1 17 12743 1 1 42 MET HB2 H 7.935 -7.228 6.116 1.00 . A A . 821 MET HB2 1 1 17 12744 1 1 42 MET HB3 H 9.645 -7.006 6.462 1.00 . A A . 821 MET HB3 1 1 17 12745 1 1 42 MET HE1 H 11.191 -5.847 7.201 1.00 . A A . 821 MET HE1 1 1 17 12746 1 1 42 MET HE2 H 11.111 -6.785 8.694 1.00 . A A . 821 MET HE2 1 1 17 12747 1 1 42 MET HE3 H 11.876 -5.196 8.691 1.00 . A A . 821 MET HE3 1 1 17 12748 1 1 42 MET HG2 H 7.359 -5.770 7.956 1.00 . A A . 821 MET HG2 1 1 17 12749 1 1 42 MET HG3 H 8.354 -7.115 8.508 1.00 . A A . 821 MET HG3 1 1 17 12750 1 1 42 MET N N 7.371 -5.009 5.065 1.00 . A A . 821 MET N 1 1 17 12751 1 1 42 MET O O 10.716 -4.861 4.430 1.00 . A A . 821 MET O 1 1 17 12752 1 1 42 MET SD S 9.502 -5.030 8.666 1.00 . A A . 821 MET SD 1 1 17 12753 1 1 43 THR C C 10.791 -5.537 1.763 1.00 . A A . 822 THR C 1 1 17 12754 1 1 43 THR CA C 10.232 -6.778 2.461 1.00 . A A . 822 THR CA 1 1 17 12755 1 1 43 THR CB C 9.475 -7.635 1.432 1.00 . A A . 822 THR CB 1 1 17 12756 1 1 43 THR CG2 C 10.446 -8.456 0.597 1.00 . A A . 822 THR CG2 1 1 17 12757 1 1 43 THR H H 8.534 -6.932 3.690 1.00 . A A . 822 THR H 1 1 17 12758 1 1 43 THR HA H 11.057 -7.360 2.843 1.00 . A A . 822 THR HA 1 1 17 12759 1 1 43 THR HB H 8.920 -6.982 0.776 1.00 . A A . 822 THR HB 1 1 17 12760 1 1 43 THR HG1 H 9.007 -8.925 2.866 1.00 . A A . 822 THR HG1 1 1 17 12761 1 1 43 THR HG21 H 11.105 -7.793 0.057 1.00 . A A . 822 THR HG21 1 1 17 12762 1 1 43 THR HG22 H 9.892 -9.065 -0.103 1.00 . A A . 822 THR HG22 1 1 17 12763 1 1 43 THR HG23 H 11.029 -9.093 1.246 1.00 . A A . 822 THR HG23 1 1 17 12764 1 1 43 THR N N 9.366 -6.435 3.572 1.00 . A A . 822 THR N 1 1 17 12765 1 1 43 THR O O 12.003 -5.396 1.635 1.00 . A A . 822 THR O 1 1 17 12766 1 1 43 THR OG1 O 8.561 -8.511 2.108 1.00 . A A . 822 THR OG1 1 1 17 12767 1 1 44 CYS C C 11.120 -2.453 1.382 1.00 . A A . 823 CYS C 1 1 17 12768 1 1 44 CYS CA C 10.368 -3.490 0.550 1.00 . A A . 823 CYS CA 1 1 17 12769 1 1 44 CYS CB C 9.203 -2.856 -0.189 1.00 . A A . 823 CYS CB 1 1 17 12770 1 1 44 CYS H H 8.966 -4.741 1.540 1.00 . A A . 823 CYS H 1 1 17 12771 1 1 44 CYS HA H 11.069 -3.891 -0.165 1.00 . A A . 823 CYS HA 1 1 17 12772 1 1 44 CYS HB2 H 8.511 -2.432 0.527 1.00 . A A . 823 CYS HB2 1 1 17 12773 1 1 44 CYS HB3 H 9.576 -2.072 -0.832 1.00 . A A . 823 CYS HB3 1 1 17 12774 1 1 44 CYS N N 9.921 -4.633 1.332 1.00 . A A . 823 CYS N 1 1 17 12775 1 1 44 CYS O O 12.161 -1.959 0.944 1.00 . A A . 823 CYS O 1 1 17 12776 1 1 44 CYS SG S 8.296 -4.029 -1.214 1.00 . A A . 823 CYS SG 1 1 17 12777 1 1 45 ALA C C 12.688 -1.750 3.820 1.00 . A A . 824 ALA C 1 1 17 12778 1 1 45 ALA CA C 11.322 -1.181 3.432 1.00 . A A . 824 ALA CA 1 1 17 12779 1 1 45 ALA CB C 10.487 -0.858 4.659 1.00 . A A . 824 ALA CB 1 1 17 12780 1 1 45 ALA H H 9.756 -2.486 2.866 1.00 . A A . 824 ALA H 1 1 17 12781 1 1 45 ALA HA H 11.478 -0.269 2.881 1.00 . A A . 824 ALA HA 1 1 17 12782 1 1 45 ALA HB1 H 10.351 -1.753 5.249 1.00 . A A . 824 ALA HB1 1 1 17 12783 1 1 45 ALA HB2 H 9.523 -0.483 4.343 1.00 . A A . 824 ALA HB2 1 1 17 12784 1 1 45 ALA HB3 H 10.990 -0.107 5.251 1.00 . A A . 824 ALA HB3 1 1 17 12785 1 1 45 ALA N N 10.611 -2.107 2.561 1.00 . A A . 824 ALA N 1 1 17 12786 1 1 45 ALA O O 13.691 -1.033 3.844 1.00 . A A . 824 ALA O 1 1 17 12787 1 1 46 LYS C C 14.885 -3.756 3.155 1.00 . A A . 825 LYS C 1 1 17 12788 1 1 46 LYS CA C 13.962 -3.766 4.378 1.00 . A A . 825 LYS CA 1 1 17 12789 1 1 46 LYS CB C 13.606 -5.209 4.759 1.00 . A A . 825 LYS CB 1 1 17 12790 1 1 46 LYS CD C 14.168 -7.642 4.733 1.00 . A A . 825 LYS CD 1 1 17 12791 1 1 46 LYS CE C 15.186 -8.696 4.326 1.00 . A A . 825 LYS CE 1 1 17 12792 1 1 46 LYS CG C 14.694 -6.235 4.507 1.00 . A A . 825 LYS CG 1 1 17 12793 1 1 46 LYS H H 11.868 -3.543 4.206 1.00 . A A . 825 LYS H 1 1 17 12794 1 1 46 LYS HA H 14.415 -3.286 5.233 1.00 . A A . 825 LYS HA 1 1 17 12795 1 1 46 LYS HB2 H 13.364 -5.235 5.812 1.00 . A A . 825 LYS HB2 1 1 17 12796 1 1 46 LYS HB3 H 12.731 -5.504 4.199 1.00 . A A . 825 LYS HB3 1 1 17 12797 1 1 46 LYS HD2 H 13.935 -7.765 5.781 1.00 . A A . 825 LYS HD2 1 1 17 12798 1 1 46 LYS HD3 H 13.270 -7.774 4.146 1.00 . A A . 825 LYS HD3 1 1 17 12799 1 1 46 LYS HE2 H 15.371 -8.606 3.266 1.00 . A A . 825 LYS HE2 1 1 17 12800 1 1 46 LYS HE3 H 16.106 -8.524 4.868 1.00 . A A . 825 LYS HE3 1 1 17 12801 1 1 46 LYS HG2 H 15.031 -6.148 3.485 1.00 . A A . 825 LYS HG2 1 1 17 12802 1 1 46 LYS HG3 H 15.517 -6.052 5.183 1.00 . A A . 825 LYS HG3 1 1 17 12803 1 1 46 LYS HZ1 H 14.447 -10.160 5.621 1.00 . A A . 825 LYS HZ1 1 1 17 12804 1 1 46 LYS HZ2 H 15.453 -10.771 4.400 1.00 . A A . 825 LYS HZ2 1 1 17 12805 1 1 46 LYS HZ3 H 13.865 -10.288 4.034 1.00 . A A . 825 LYS HZ3 1 1 17 12806 1 1 46 LYS N N 12.718 -3.049 4.110 1.00 . A A . 825 LYS N 1 1 17 12807 1 1 46 LYS NZ N 14.705 -10.071 4.614 1.00 . A A . 825 LYS NZ 1 1 17 12808 1 1 46 LYS O O 16.106 -3.621 3.267 1.00 . A A . 825 LYS O 1 1 17 12809 1 1 47 ARG C C 15.652 -2.707 0.342 1.00 . A A . 826 ARG C 1 1 17 12810 1 1 47 ARG CA C 14.960 -4.008 0.713 1.00 . A A . 826 ARG CA 1 1 17 12811 1 1 47 ARG CB C 13.951 -4.392 -0.379 1.00 . A A . 826 ARG CB 1 1 17 12812 1 1 47 ARG CD C 15.730 -5.494 -1.789 1.00 . A A . 826 ARG CD 1 1 17 12813 1 1 47 ARG CG C 14.543 -4.546 -1.773 1.00 . A A . 826 ARG CG 1 1 17 12814 1 1 47 ARG CZ C 16.302 -7.657 -0.775 1.00 . A A . 826 ARG CZ 1 1 17 12815 1 1 47 ARG H H 13.280 -3.939 1.991 1.00 . A A . 826 ARG H 1 1 17 12816 1 1 47 ARG HA H 15.686 -4.804 0.789 1.00 . A A . 826 ARG HA 1 1 17 12817 1 1 47 ARG HB2 H 13.488 -5.329 -0.109 1.00 . A A . 826 ARG HB2 1 1 17 12818 1 1 47 ARG HB3 H 13.187 -3.630 -0.422 1.00 . A A . 826 ARG HB3 1 1 17 12819 1 1 47 ARG HD2 H 16.079 -5.593 -2.805 1.00 . A A . 826 ARG HD2 1 1 17 12820 1 1 47 ARG HD3 H 16.517 -5.071 -1.181 1.00 . A A . 826 ARG HD3 1 1 17 12821 1 1 47 ARG HE H 14.452 -7.105 -1.317 1.00 . A A . 826 ARG HE 1 1 17 12822 1 1 47 ARG HG2 H 13.782 -4.929 -2.436 1.00 . A A . 826 ARG HG2 1 1 17 12823 1 1 47 ARG HG3 H 14.866 -3.575 -2.120 1.00 . A A . 826 ARG HG3 1 1 17 12824 1 1 47 ARG HH11 H 17.867 -6.387 -1.043 1.00 . A A . 826 ARG HH11 1 1 17 12825 1 1 47 ARG HH12 H 18.268 -7.921 -0.320 1.00 . A A . 826 ARG HH12 1 1 17 12826 1 1 47 ARG HH21 H 14.960 -9.121 -0.367 1.00 . A A . 826 ARG HH21 1 1 17 12827 1 1 47 ARG HH22 H 16.612 -9.497 0.024 1.00 . A A . 826 ARG HH22 1 1 17 12828 1 1 47 ARG N N 14.262 -3.891 1.989 1.00 . A A . 826 ARG N 1 1 17 12829 1 1 47 ARG NE N 15.400 -6.821 -1.277 1.00 . A A . 826 ARG NE 1 1 17 12830 1 1 47 ARG NH1 N 17.579 -7.295 -0.710 1.00 . A A . 826 ARG NH1 1 1 17 12831 1 1 47 ARG NH2 N 15.927 -8.850 -0.331 1.00 . A A . 826 ARG NH2 1 1 17 12832 1 1 47 ARG O O 16.666 -2.714 -0.352 1.00 . A A . 826 ARG O 1 1 17 12833 1 1 48 TYR C C 17.113 -0.179 0.961 1.00 . A A . 827 TYR C 1 1 17 12834 1 1 48 TYR CA C 15.652 -0.277 0.538 1.00 . A A . 827 TYR CA 1 1 17 12835 1 1 48 TYR CB C 14.850 0.787 1.293 1.00 . A A . 827 TYR CB 1 1 17 12836 1 1 48 TYR CD1 C 15.397 2.702 -0.266 1.00 . A A . 827 TYR CD1 1 1 17 12837 1 1 48 TYR CD2 C 15.685 3.037 2.077 1.00 . A A . 827 TYR CD2 1 1 17 12838 1 1 48 TYR CE1 C 15.818 3.998 -0.506 1.00 . A A . 827 TYR CE1 1 1 17 12839 1 1 48 TYR CE2 C 16.106 4.331 1.844 1.00 . A A . 827 TYR CE2 1 1 17 12840 1 1 48 TYR CG C 15.324 2.200 1.028 1.00 . A A . 827 TYR CG 1 1 17 12841 1 1 48 TYR CZ C 16.215 4.787 0.526 1.00 . A A . 827 TYR CZ 1 1 17 12842 1 1 48 TYR H H 14.248 -1.656 1.302 1.00 . A A . 827 TYR H 1 1 17 12843 1 1 48 TYR HA H 15.532 -0.086 -0.519 1.00 . A A . 827 TYR HA 1 1 17 12844 1 1 48 TYR HB2 H 13.814 0.721 0.999 1.00 . A A . 827 TYR HB2 1 1 17 12845 1 1 48 TYR HB3 H 14.931 0.602 2.354 1.00 . A A . 827 TYR HB3 1 1 17 12846 1 1 48 TYR HD1 H 15.121 2.066 -1.093 1.00 . A A . 827 TYR HD1 1 1 17 12847 1 1 48 TYR HD2 H 15.637 2.662 3.088 1.00 . A A . 827 TYR HD2 1 1 17 12848 1 1 48 TYR HE1 H 15.867 4.372 -1.520 1.00 . A A . 827 TYR HE1 1 1 17 12849 1 1 48 TYR HE2 H 16.383 4.964 2.673 1.00 . A A . 827 TYR HE2 1 1 17 12850 1 1 48 TYR HH H 16.056 6.486 -0.380 1.00 . A A . 827 TYR HH 1 1 17 12851 1 1 48 TYR N N 15.102 -1.596 0.821 1.00 . A A . 827 TYR N 1 1 17 12852 1 1 48 TYR O O 17.932 0.417 0.261 1.00 . A A . 827 TYR O 1 1 17 12853 1 1 48 TYR OH O 16.587 6.100 0.323 1.00 . A A . 827 TYR OH 1 1 17 12854 1 1 49 ASN C C 18.978 0.743 3.181 1.00 . A A . 828 ASN C 1 1 17 12855 1 1 49 ASN CA C 18.734 -0.687 2.734 1.00 . A A . 828 ASN CA 1 1 17 12856 1 1 49 ASN CB C 19.864 -1.147 1.801 1.00 . A A . 828 ASN CB 1 1 17 12857 1 1 49 ASN CG C 19.987 -2.656 1.707 1.00 . A A . 828 ASN CG 1 1 17 12858 1 1 49 ASN H H 16.724 -1.329 2.550 1.00 . A A . 828 ASN H 1 1 17 12859 1 1 49 ASN HA H 18.727 -1.320 3.610 1.00 . A A . 828 ASN HA 1 1 17 12860 1 1 49 ASN HB2 H 19.680 -0.759 0.810 1.00 . A A . 828 ASN HB2 1 1 17 12861 1 1 49 ASN HB3 H 20.801 -0.750 2.166 1.00 . A A . 828 ASN HB3 1 1 17 12862 1 1 49 ASN HD21 H 18.028 -2.878 1.926 1.00 . A A . 828 ASN HD21 1 1 17 12863 1 1 49 ASN HD22 H 18.937 -4.339 1.758 1.00 . A A . 828 ASN HD22 1 1 17 12864 1 1 49 ASN N N 17.417 -0.793 2.106 1.00 . A A . 828 ASN N 1 1 17 12865 1 1 49 ASN ND2 N 18.872 -3.360 1.803 1.00 . A A . 828 ASN ND2 1 1 17 12866 1 1 49 ASN O O 18.350 1.159 4.176 1.00 . A A . 828 ASN O 1 1 17 12867 1 1 49 ASN OXT O 19.782 1.449 2.536 1.00 . A A . 828 ASN OXT 1 1 17 12868 1 1 49 ASN OD1 O 21.085 -3.186 1.535 1.00 . A A . 828 ASN OD1 1 1 17 12869 2 2 1 ZN ZN ZN 7.354 -2.620 -2.593 1.00 . B A . 829 ZN ZN 1 1 18 12870 1 1 1 GLY C C -10.526 -6.502 0.210 1.00 . A A . 1 GLY C 1 1 18 12871 1 1 1 GLY CA C -10.714 -7.928 -0.254 1.00 . A A . 1 GLY CA 1 1 18 12872 1 1 1 GLY H1 H -11.066 -8.830 1.592 1.00 . A A . 1 GLY H1 1 1 18 12873 1 1 1 GLY H2 H -9.430 -8.713 1.180 1.00 . A A . 1 GLY H2 1 1 18 12874 1 1 1 GLY H3 H -10.407 -9.877 0.427 1.00 . A A . 1 GLY H3 1 1 18 12875 1 1 1 GLY HA2 H -10.074 -8.108 -1.106 1.00 . A A . 1 GLY HA2 1 1 18 12876 1 1 1 GLY HA3 H -11.743 -8.066 -0.551 1.00 . A A . 1 GLY HA3 1 1 18 12877 1 1 1 GLY N N -10.384 -8.906 0.807 1.00 . A A . 1 GLY N 1 1 18 12878 1 1 1 GLY O O -11.092 -6.092 1.223 1.00 . A A . 1 GLY O 1 1 18 12879 1 1 2 THR C C -9.728 -3.484 -1.425 1.00 . A A . 2 THR C 1 1 18 12880 1 1 2 THR CA C -9.460 -4.358 -0.196 1.00 . A A . 2 THR CA 1 1 18 12881 1 1 2 THR CB C -7.997 -4.171 0.263 1.00 . A A . 2 THR CB 1 1 18 12882 1 1 2 THR CG2 C -7.833 -2.893 1.077 1.00 . A A . 2 THR CG2 1 1 18 12883 1 1 2 THR H H -9.280 -6.144 -1.311 1.00 . A A . 2 THR H 1 1 18 12884 1 1 2 THR HA H -10.118 -4.062 0.607 1.00 . A A . 2 THR HA 1 1 18 12885 1 1 2 THR HB H -7.363 -4.111 -0.611 1.00 . A A . 2 THR HB 1 1 18 12886 1 1 2 THR HG1 H -8.318 -5.555 1.640 1.00 . A A . 2 THR HG1 1 1 18 12887 1 1 2 THR HG21 H -8.142 -2.045 0.483 1.00 . A A . 2 THR HG21 1 1 18 12888 1 1 2 THR HG22 H -6.798 -2.777 1.358 1.00 . A A . 2 THR HG22 1 1 18 12889 1 1 2 THR HG23 H -8.444 -2.951 1.966 1.00 . A A . 2 THR HG23 1 1 18 12890 1 1 2 THR N N -9.720 -5.749 -0.522 1.00 . A A . 2 THR N 1 1 18 12891 1 1 2 THR O O -9.037 -2.495 -1.673 1.00 . A A . 2 THR O 1 1 18 12892 1 1 2 THR OG1 O -7.589 -5.290 1.063 1.00 . A A . 2 THR OG1 1 1 18 12893 1 1 3 ARG C C -12.500 -3.106 -3.754 1.00 . A A . 3 ARG C 1 1 18 12894 1 1 3 ARG CA C -11.004 -3.210 -3.469 1.00 . A A . 3 ARG CA 1 1 18 12895 1 1 3 ARG CB C -10.318 -3.990 -4.595 1.00 . A A . 3 ARG CB 1 1 18 12896 1 1 3 ARG CD C -10.071 -6.191 -5.798 1.00 . A A . 3 ARG CD 1 1 18 12897 1 1 3 ARG CG C -10.786 -5.432 -4.696 1.00 . A A . 3 ARG CG 1 1 18 12898 1 1 3 ARG CZ C -10.206 -8.404 -6.879 1.00 . A A . 3 ARG CZ 1 1 18 12899 1 1 3 ARG H H -11.338 -4.579 -1.887 1.00 . A A . 3 ARG H 1 1 18 12900 1 1 3 ARG HA H -10.586 -2.215 -3.429 1.00 . A A . 3 ARG HA 1 1 18 12901 1 1 3 ARG HB2 H -10.522 -3.499 -5.536 1.00 . A A . 3 ARG HB2 1 1 18 12902 1 1 3 ARG HB3 H -9.251 -3.989 -4.422 1.00 . A A . 3 ARG HB3 1 1 18 12903 1 1 3 ARG HD2 H -10.198 -5.658 -6.729 1.00 . A A . 3 ARG HD2 1 1 18 12904 1 1 3 ARG HD3 H -9.019 -6.252 -5.556 1.00 . A A . 3 ARG HD3 1 1 18 12905 1 1 3 ARG HE H -11.321 -7.817 -5.319 1.00 . A A . 3 ARG HE 1 1 18 12906 1 1 3 ARG HG2 H -10.594 -5.926 -3.755 1.00 . A A . 3 ARG HG2 1 1 18 12907 1 1 3 ARG HG3 H -11.848 -5.439 -4.896 1.00 . A A . 3 ARG HG3 1 1 18 12908 1 1 3 ARG HH11 H -8.765 -7.190 -7.630 1.00 . A A . 3 ARG HH11 1 1 18 12909 1 1 3 ARG HH12 H -8.922 -8.732 -8.415 1.00 . A A . 3 ARG HH12 1 1 18 12910 1 1 3 ARG HH21 H -11.531 -9.843 -6.343 1.00 . A A . 3 ARG HH21 1 1 18 12911 1 1 3 ARG HH22 H -10.500 -10.238 -7.682 1.00 . A A . 3 ARG HH22 1 1 18 12912 1 1 3 ARG N N -10.743 -3.859 -2.192 1.00 . A A . 3 ARG N 1 1 18 12913 1 1 3 ARG NE N -10.604 -7.542 -5.947 1.00 . A A . 3 ARG NE 1 1 18 12914 1 1 3 ARG NH1 N -9.219 -8.084 -7.705 1.00 . A A . 3 ARG NH1 1 1 18 12915 1 1 3 ARG NH2 N -10.788 -9.590 -6.976 1.00 . A A . 3 ARG NH2 1 1 18 12916 1 1 3 ARG O O -13.280 -3.994 -3.401 1.00 . A A . 3 ARG O 1 1 18 12917 1 1 4 GLY C C -14.280 -1.745 -6.360 1.00 . A A . 783 GLY C 1 1 18 12918 1 1 4 GLY CA C -14.250 -1.853 -4.849 1.00 . A A . 783 GLY CA 1 1 18 12919 1 1 4 GLY H H -12.236 -1.297 -4.546 1.00 . A A . 783 GLY H 1 1 18 12920 1 1 4 GLY HA2 H -14.834 -2.707 -4.535 1.00 . A A . 783 GLY HA2 1 1 18 12921 1 1 4 GLY HA3 H -14.669 -0.954 -4.419 1.00 . A A . 783 GLY HA3 1 1 18 12922 1 1 4 GLY N N -12.887 -2.011 -4.385 1.00 . A A . 783 GLY N 1 1 18 12923 1 1 4 GLY O O -13.625 -0.872 -6.928 1.00 . A A . 783 GLY O 1 1 18 12924 1 1 5 VAL C C -16.192 -1.955 -9.081 1.00 . A A . 784 VAL C 1 1 18 12925 1 1 5 VAL CA C -14.988 -2.678 -8.481 1.00 . A A . 784 VAL CA 1 1 18 12926 1 1 5 VAL CB C -14.919 -4.127 -9.021 1.00 . A A . 784 VAL CB 1 1 18 12927 1 1 5 VAL CG1 C -13.655 -4.815 -8.538 1.00 . A A . 784 VAL CG1 1 1 18 12928 1 1 5 VAL CG2 C -16.144 -4.935 -8.622 1.00 . A A . 784 VAL CG2 1 1 18 12929 1 1 5 VAL H H -15.565 -3.270 -6.527 1.00 . A A . 784 VAL H 1 1 18 12930 1 1 5 VAL HA H -14.092 -2.164 -8.803 1.00 . A A . 784 VAL HA 1 1 18 12931 1 1 5 VAL HB H -14.881 -4.080 -10.101 1.00 . A A . 784 VAL HB 1 1 18 12932 1 1 5 VAL HG11 H -13.655 -4.851 -7.458 1.00 . A A . 784 VAL HG11 1 1 18 12933 1 1 5 VAL HG12 H -12.791 -4.264 -8.879 1.00 . A A . 784 VAL HG12 1 1 18 12934 1 1 5 VAL HG13 H -13.622 -5.820 -8.931 1.00 . A A . 784 VAL HG13 1 1 18 12935 1 1 5 VAL HG21 H -16.070 -5.930 -9.038 1.00 . A A . 784 VAL HG21 1 1 18 12936 1 1 5 VAL HG22 H -17.033 -4.451 -9.001 1.00 . A A . 784 VAL HG22 1 1 18 12937 1 1 5 VAL HG23 H -16.200 -5.000 -7.546 1.00 . A A . 784 VAL HG23 1 1 18 12938 1 1 5 VAL N N -15.006 -2.638 -7.023 1.00 . A A . 784 VAL N 1 1 18 12939 1 1 5 VAL O O -16.062 -1.242 -10.076 1.00 . A A . 784 VAL O 1 1 18 12940 1 1 6 ASP C C -19.572 -1.431 -7.805 1.00 . A A . 785 ASP C 1 1 18 12941 1 1 6 ASP CA C -18.576 -1.499 -8.946 1.00 . A A . 785 ASP CA 1 1 18 12942 1 1 6 ASP CB C -19.175 -2.283 -10.117 1.00 . A A . 785 ASP CB 1 1 18 12943 1 1 6 ASP CG C -20.176 -1.468 -10.910 1.00 . A A . 785 ASP CG 1 1 18 12944 1 1 6 ASP H H -17.395 -2.709 -7.677 1.00 . A A . 785 ASP H 1 1 18 12945 1 1 6 ASP HA H -18.334 -0.496 -9.268 1.00 . A A . 785 ASP HA 1 1 18 12946 1 1 6 ASP HB2 H -18.381 -2.587 -10.782 1.00 . A A . 785 ASP HB2 1 1 18 12947 1 1 6 ASP HB3 H -19.675 -3.163 -9.735 1.00 . A A . 785 ASP HB3 1 1 18 12948 1 1 6 ASP N N -17.354 -2.133 -8.471 1.00 . A A . 785 ASP N 1 1 18 12949 1 1 6 ASP O O -20.238 -2.418 -7.492 1.00 . A A . 785 ASP O 1 1 18 12950 1 1 6 ASP OD1 O -21.356 -1.399 -10.511 1.00 . A A . 785 ASP OD1 1 1 18 12951 1 1 6 ASP OD2 O -19.779 -0.879 -11.936 1.00 . A A . 785 ASP OD2 1 1 18 12952 1 1 7 SER C C -21.523 0.962 -6.211 1.00 . A A . 786 SER C 1 1 18 12953 1 1 7 SER CA C -20.487 -0.133 -5.991 1.00 . A A . 786 SER CA 1 1 18 12954 1 1 7 SER CB C -19.630 0.195 -4.769 1.00 . A A . 786 SER CB 1 1 18 12955 1 1 7 SER H H -19.105 0.475 -7.462 1.00 . A A . 786 SER H 1 1 18 12956 1 1 7 SER HA H -20.999 -1.069 -5.823 1.00 . A A . 786 SER HA 1 1 18 12957 1 1 7 SER HB2 H -19.184 1.171 -4.896 1.00 . A A . 786 SER HB2 1 1 18 12958 1 1 7 SER HB3 H -20.251 0.196 -3.886 1.00 . A A . 786 SER HB3 1 1 18 12959 1 1 7 SER HG H -18.986 -1.645 -4.544 1.00 . A A . 786 SER HG 1 1 18 12960 1 1 7 SER N N -19.638 -0.286 -7.155 1.00 . A A . 786 SER N 1 1 18 12961 1 1 7 SER O O -21.176 2.107 -6.503 1.00 . A A . 786 SER O 1 1 18 12962 1 1 7 SER OG O -18.596 -0.761 -4.601 1.00 . A A . 786 SER OG 1 1 18 12963 1 1 8 PRO C C -23.870 2.460 -4.880 1.00 . A A . 787 PRO C 1 1 18 12964 1 1 8 PRO CA C -23.906 1.583 -6.124 1.00 . A A . 787 PRO CA 1 1 18 12965 1 1 8 PRO CB C -25.177 0.720 -6.129 1.00 . A A . 787 PRO CB 1 1 18 12966 1 1 8 PRO CD C -23.312 -0.768 -5.991 1.00 . A A . 787 PRO CD 1 1 18 12967 1 1 8 PRO CG C -24.724 -0.655 -6.480 1.00 . A A . 787 PRO CG 1 1 18 12968 1 1 8 PRO HA H -23.876 2.203 -7.007 1.00 . A A . 787 PRO HA 1 1 18 12969 1 1 8 PRO HB2 H -25.633 0.746 -5.150 1.00 . A A . 787 PRO HB2 1 1 18 12970 1 1 8 PRO HB3 H -25.870 1.105 -6.863 1.00 . A A . 787 PRO HB3 1 1 18 12971 1 1 8 PRO HD2 H -23.292 -1.104 -4.964 1.00 . A A . 787 PRO HD2 1 1 18 12972 1 1 8 PRO HD3 H -22.745 -1.437 -6.621 1.00 . A A . 787 PRO HD3 1 1 18 12973 1 1 8 PRO HG2 H -25.349 -1.385 -5.988 1.00 . A A . 787 PRO HG2 1 1 18 12974 1 1 8 PRO HG3 H -24.760 -0.791 -7.552 1.00 . A A . 787 PRO HG3 1 1 18 12975 1 1 8 PRO N N -22.813 0.609 -6.105 1.00 . A A . 787 PRO N 1 1 18 12976 1 1 8 PRO O O -24.341 3.597 -4.881 1.00 . A A . 787 PRO O 1 1 18 12977 1 1 9 SER C C -21.868 3.481 -2.630 1.00 . A A . 788 SER C 1 1 18 12978 1 1 9 SER CA C -23.125 2.619 -2.569 1.00 . A A . 788 SER CA 1 1 18 12979 1 1 9 SER CB C -23.015 1.611 -1.425 1.00 . A A . 788 SER CB 1 1 18 12980 1 1 9 SER H H -22.985 0.981 -3.884 1.00 . A A . 788 SER H 1 1 18 12981 1 1 9 SER HA H -23.986 3.251 -2.412 1.00 . A A . 788 SER HA 1 1 18 12982 1 1 9 SER HB2 H -22.078 1.080 -1.507 1.00 . A A . 788 SER HB2 1 1 18 12983 1 1 9 SER HB3 H -23.055 2.133 -0.481 1.00 . A A . 788 SER HB3 1 1 18 12984 1 1 9 SER HG H -24.905 1.133 -1.676 1.00 . A A . 788 SER HG 1 1 18 12985 1 1 9 SER N N -23.301 1.906 -3.819 1.00 . A A . 788 SER N 1 1 18 12986 1 1 9 SER O O -21.041 3.325 -3.531 1.00 . A A . 788 SER O 1 1 18 12987 1 1 9 SER OG O -24.077 0.669 -1.472 1.00 . A A . 788 SER OG 1 1 18 12988 1 1 10 ALA C C -19.380 4.594 -0.965 1.00 . A A . 789 ALA C 1 1 18 12989 1 1 10 ALA CA C -20.580 5.275 -1.618 1.00 . A A . 789 ALA CA 1 1 18 12990 1 1 10 ALA CB C -20.948 6.549 -0.871 1.00 . A A . 789 ALA CB 1 1 18 12991 1 1 10 ALA H H -22.383 4.409 -0.939 1.00 . A A . 789 ALA H 1 1 18 12992 1 1 10 ALA HA H -20.324 5.540 -2.634 1.00 . A A . 789 ALA HA 1 1 18 12993 1 1 10 ALA HB1 H -20.106 7.227 -0.879 1.00 . A A . 789 ALA HB1 1 1 18 12994 1 1 10 ALA HB2 H -21.203 6.308 0.150 1.00 . A A . 789 ALA HB2 1 1 18 12995 1 1 10 ALA HB3 H -21.793 7.018 -1.354 1.00 . A A . 789 ALA HB3 1 1 18 12996 1 1 10 ALA N N -21.718 4.372 -1.661 1.00 . A A . 789 ALA N 1 1 18 12997 1 1 10 ALA O O -18.725 5.158 -0.085 1.00 . A A . 789 ALA O 1 1 18 12998 1 1 11 GLU C C -16.712 2.800 -1.603 1.00 . A A . 790 GLU C 1 1 18 12999 1 1 11 GLU CA C -18.003 2.595 -0.830 1.00 . A A . 790 GLU CA 1 1 18 13000 1 1 11 GLU CB C -18.340 1.108 -0.806 1.00 . A A . 790 GLU CB 1 1 18 13001 1 1 11 GLU CD C -19.513 -0.756 0.424 1.00 . A A . 790 GLU CD 1 1 18 13002 1 1 11 GLU CG C -19.410 0.738 0.207 1.00 . A A . 790 GLU CG 1 1 18 13003 1 1 11 GLU H H -19.633 2.985 -2.124 1.00 . A A . 790 GLU H 1 1 18 13004 1 1 11 GLU HA H -17.855 2.933 0.184 1.00 . A A . 790 GLU HA 1 1 18 13005 1 1 11 GLU HB2 H -18.688 0.817 -1.786 1.00 . A A . 790 GLU HB2 1 1 18 13006 1 1 11 GLU HB3 H -17.440 0.556 -0.575 1.00 . A A . 790 GLU HB3 1 1 18 13007 1 1 11 GLU HG2 H -19.173 1.207 1.151 1.00 . A A . 790 GLU HG2 1 1 18 13008 1 1 11 GLU HG3 H -20.363 1.105 -0.146 1.00 . A A . 790 GLU HG3 1 1 18 13009 1 1 11 GLU N N -19.095 3.372 -1.398 1.00 . A A . 790 GLU N 1 1 18 13010 1 1 11 GLU O O -15.650 2.351 -1.174 1.00 . A A . 790 GLU O 1 1 18 13011 1 1 11 GLU OE1 O -20.010 -1.458 -0.481 1.00 . A A . 790 GLU OE1 1 1 18 13012 1 1 11 GLU OE2 O -19.091 -1.239 1.497 1.00 . A A . 790 GLU OE2 1 1 18 13013 1 1 12 LEU C C -14.750 4.831 -3.005 1.00 . A A . 791 LEU C 1 1 18 13014 1 1 12 LEU CA C -15.608 3.700 -3.557 1.00 . A A . 791 LEU CA 1 1 18 13015 1 1 12 LEU CB C -16.004 3.990 -5.008 1.00 . A A . 791 LEU CB 1 1 18 13016 1 1 12 LEU CD1 C -17.212 3.319 -7.103 1.00 . A A . 791 LEU CD1 1 1 18 13017 1 1 12 LEU CD2 C -16.050 1.584 -5.726 1.00 . A A . 791 LEU CD2 1 1 18 13018 1 1 12 LEU CG C -16.825 2.894 -5.695 1.00 . A A . 791 LEU CG 1 1 18 13019 1 1 12 LEU H H -17.649 3.882 -3.010 1.00 . A A . 791 LEU H 1 1 18 13020 1 1 12 LEU HA H -15.036 2.788 -3.522 1.00 . A A . 791 LEU HA 1 1 18 13021 1 1 12 LEU HB2 H -16.577 4.905 -5.025 1.00 . A A . 791 LEU HB2 1 1 18 13022 1 1 12 LEU HB3 H -15.100 4.141 -5.579 1.00 . A A . 791 LEU HB3 1 1 18 13023 1 1 12 LEU HD11 H -16.319 3.510 -7.681 1.00 . A A . 791 LEU HD11 1 1 18 13024 1 1 12 LEU HD12 H -17.808 4.219 -7.056 1.00 . A A . 791 LEU HD12 1 1 18 13025 1 1 12 LEU HD13 H -17.784 2.534 -7.573 1.00 . A A . 791 LEU HD13 1 1 18 13026 1 1 12 LEU HD21 H -16.637 0.831 -6.231 1.00 . A A . 791 LEU HD21 1 1 18 13027 1 1 12 LEU HD22 H -15.845 1.263 -4.715 1.00 . A A . 791 LEU HD22 1 1 18 13028 1 1 12 LEU HD23 H -15.118 1.728 -6.253 1.00 . A A . 791 LEU HD23 1 1 18 13029 1 1 12 LEU HG H -17.735 2.732 -5.134 1.00 . A A . 791 LEU HG 1 1 18 13030 1 1 12 LEU N N -16.788 3.495 -2.729 1.00 . A A . 791 LEU N 1 1 18 13031 1 1 12 LEU O O -13.829 5.316 -3.662 1.00 . A A . 791 LEU O 1 1 18 13032 1 1 13 ASP C C -13.992 5.809 0.316 1.00 . A A . 792 ASP C 1 1 18 13033 1 1 13 ASP CA C -14.315 6.271 -1.091 1.00 . A A . 792 ASP CA 1 1 18 13034 1 1 13 ASP CB C -15.109 7.577 -1.015 1.00 . A A . 792 ASP CB 1 1 18 13035 1 1 13 ASP CG C -15.533 8.099 -2.369 1.00 . A A . 792 ASP CG 1 1 18 13036 1 1 13 ASP H H -15.819 4.807 -1.333 1.00 . A A . 792 ASP H 1 1 18 13037 1 1 13 ASP HA H -13.396 6.439 -1.628 1.00 . A A . 792 ASP HA 1 1 18 13038 1 1 13 ASP HB2 H -15.996 7.414 -0.423 1.00 . A A . 792 ASP HB2 1 1 18 13039 1 1 13 ASP HB3 H -14.498 8.328 -0.535 1.00 . A A . 792 ASP HB3 1 1 18 13040 1 1 13 ASP N N -15.063 5.233 -1.785 1.00 . A A . 792 ASP N 1 1 18 13041 1 1 13 ASP O O -13.470 6.568 1.132 1.00 . A A . 792 ASP O 1 1 18 13042 1 1 13 ASP OD1 O -14.657 8.577 -3.121 1.00 . A A . 792 ASP OD1 1 1 18 13043 1 1 13 ASP OD2 O -16.735 8.031 -2.689 1.00 . A A . 792 ASP OD2 1 1 18 13044 1 1 14 LYS C C -12.614 3.775 2.150 1.00 . A A . 793 LYS C 1 1 18 13045 1 1 14 LYS CA C -14.101 3.988 1.917 1.00 . A A . 793 LYS CA 1 1 18 13046 1 1 14 LYS CB C -14.866 2.668 2.061 1.00 . A A . 793 LYS CB 1 1 18 13047 1 1 14 LYS CD C -15.605 0.808 3.582 1.00 . A A . 793 LYS CD 1 1 18 13048 1 1 14 LYS CE C -15.503 0.215 4.978 1.00 . A A . 793 LYS CE 1 1 18 13049 1 1 14 LYS CG C -14.738 2.045 3.440 1.00 . A A . 793 LYS CG 1 1 18 13050 1 1 14 LYS H H -14.688 3.993 -0.111 1.00 . A A . 793 LYS H 1 1 18 13051 1 1 14 LYS HA H -14.473 4.694 2.641 1.00 . A A . 793 LYS HA 1 1 18 13052 1 1 14 LYS HB2 H -15.914 2.850 1.868 1.00 . A A . 793 LYS HB2 1 1 18 13053 1 1 14 LYS HB3 H -14.493 1.962 1.330 1.00 . A A . 793 LYS HB3 1 1 18 13054 1 1 14 LYS HD2 H -16.634 1.077 3.391 1.00 . A A . 793 LYS HD2 1 1 18 13055 1 1 14 LYS HD3 H -15.285 0.069 2.862 1.00 . A A . 793 LYS HD3 1 1 18 13056 1 1 14 LYS HE2 H -16.133 -0.660 5.031 1.00 . A A . 793 LYS HE2 1 1 18 13057 1 1 14 LYS HE3 H -14.477 -0.068 5.160 1.00 . A A . 793 LYS HE3 1 1 18 13058 1 1 14 LYS HG2 H -13.708 1.768 3.607 1.00 . A A . 793 LYS HG2 1 1 18 13059 1 1 14 LYS HG3 H -15.041 2.773 4.180 1.00 . A A . 793 LYS HG3 1 1 18 13060 1 1 14 LYS HZ1 H -15.792 0.770 6.973 1.00 . A A . 793 LYS HZ1 1 1 18 13061 1 1 14 LYS HZ2 H -16.942 1.411 5.910 1.00 . A A . 793 LYS HZ2 1 1 18 13062 1 1 14 LYS HZ3 H -15.375 2.059 5.955 1.00 . A A . 793 LYS HZ3 1 1 18 13063 1 1 14 LYS N N -14.314 4.554 0.595 1.00 . A A . 793 LYS N 1 1 18 13064 1 1 14 LYS NZ N -15.932 1.180 6.023 1.00 . A A . 793 LYS NZ 1 1 18 13065 1 1 14 LYS O O -12.100 3.988 3.247 1.00 . A A . 793 LYS O 1 1 18 13066 1 1 15 LYS C C -10.020 3.179 -0.353 1.00 . A A . 794 LYS C 1 1 18 13067 1 1 15 LYS CA C -10.500 3.206 1.097 1.00 . A A . 794 LYS CA 1 1 18 13068 1 1 15 LYS CB C -10.088 1.952 1.897 1.00 . A A . 794 LYS CB 1 1 18 13069 1 1 15 LYS CD C -10.526 -0.455 2.466 1.00 . A A . 794 LYS CD 1 1 18 13070 1 1 15 LYS CE C -11.343 -1.699 2.152 1.00 . A A . 794 LYS CE 1 1 18 13071 1 1 15 LYS CG C -10.813 0.677 1.487 1.00 . A A . 794 LYS CG 1 1 18 13072 1 1 15 LYS H H -12.429 3.146 0.272 1.00 . A A . 794 LYS H 1 1 18 13073 1 1 15 LYS HA H -10.087 4.080 1.574 1.00 . A A . 794 LYS HA 1 1 18 13074 1 1 15 LYS HB2 H -9.025 1.795 1.784 1.00 . A A . 794 LYS HB2 1 1 18 13075 1 1 15 LYS HB3 H -10.299 2.131 2.940 1.00 . A A . 794 LYS HB3 1 1 18 13076 1 1 15 LYS HD2 H -9.477 -0.705 2.415 1.00 . A A . 794 LYS HD2 1 1 18 13077 1 1 15 LYS HD3 H -10.768 -0.120 3.464 1.00 . A A . 794 LYS HD3 1 1 18 13078 1 1 15 LYS HE2 H -12.385 -1.424 2.087 1.00 . A A . 794 LYS HE2 1 1 18 13079 1 1 15 LYS HE3 H -11.015 -2.100 1.203 1.00 . A A . 794 LYS HE3 1 1 18 13080 1 1 15 LYS HG2 H -11.878 0.869 1.470 1.00 . A A . 794 LYS HG2 1 1 18 13081 1 1 15 LYS HG3 H -10.482 0.386 0.502 1.00 . A A . 794 LYS HG3 1 1 18 13082 1 1 15 LYS HZ1 H -11.368 -2.341 4.146 1.00 . A A . 794 LYS HZ1 1 1 18 13083 1 1 15 LYS HZ2 H -10.220 -3.139 3.183 1.00 . A A . 794 LYS HZ2 1 1 18 13084 1 1 15 LYS HZ3 H -11.860 -3.524 3.039 1.00 . A A . 794 LYS HZ3 1 1 18 13085 1 1 15 LYS N N -11.938 3.359 1.096 1.00 . A A . 794 LYS N 1 1 18 13086 1 1 15 LYS NZ N -11.185 -2.747 3.200 1.00 . A A . 794 LYS NZ 1 1 18 13087 1 1 15 LYS O O -10.413 4.050 -1.131 1.00 . A A . 794 LYS O 1 1 18 13088 1 1 16 ALA C C -7.760 3.320 -2.396 1.00 . A A . 795 ALA C 1 1 18 13089 1 1 16 ALA CA C -8.637 2.113 -2.074 1.00 . A A . 795 ALA CA 1 1 18 13090 1 1 16 ALA CB C -9.744 1.957 -3.108 1.00 . A A . 795 ALA CB 1 1 18 13091 1 1 16 ALA H H -8.953 1.511 -0.075 1.00 . A A . 795 ALA H 1 1 18 13092 1 1 16 ALA HA H -8.019 1.226 -2.114 1.00 . A A . 795 ALA HA 1 1 18 13093 1 1 16 ALA HB1 H -10.366 1.115 -2.845 1.00 . A A . 795 ALA HB1 1 1 18 13094 1 1 16 ALA HB2 H -9.306 1.791 -4.082 1.00 . A A . 795 ALA HB2 1 1 18 13095 1 1 16 ALA HB3 H -10.345 2.855 -3.133 1.00 . A A . 795 ALA HB3 1 1 18 13096 1 1 16 ALA N N -9.187 2.202 -0.719 1.00 . A A . 795 ALA N 1 1 18 13097 1 1 16 ALA O O -7.413 3.560 -3.552 1.00 . A A . 795 ALA O 1 1 18 13098 1 1 17 ASN C C -5.070 4.698 -1.640 1.00 . A A . 796 ASN C 1 1 18 13099 1 1 17 ASN CA C -6.501 5.203 -1.513 1.00 . A A . 796 ASN CA 1 1 18 13100 1 1 17 ASN CB C -6.665 6.200 -0.348 1.00 . A A . 796 ASN CB 1 1 18 13101 1 1 17 ASN CG C -6.845 5.555 1.026 1.00 . A A . 796 ASN CG 1 1 18 13102 1 1 17 ASN H H -7.772 3.870 -0.480 1.00 . A A . 796 ASN H 1 1 18 13103 1 1 17 ASN HA H -6.765 5.702 -2.436 1.00 . A A . 796 ASN HA 1 1 18 13104 1 1 17 ASN HB2 H -5.788 6.827 -0.305 1.00 . A A . 796 ASN HB2 1 1 18 13105 1 1 17 ASN HB3 H -7.527 6.821 -0.544 1.00 . A A . 796 ASN HB3 1 1 18 13106 1 1 17 ASN HD21 H -5.465 4.182 0.637 1.00 . A A . 796 ASN HD21 1 1 18 13107 1 1 17 ASN HD22 H -6.211 4.085 2.198 1.00 . A A . 796 ASN HD22 1 1 18 13108 1 1 17 ASN N N -7.405 4.074 -1.364 1.00 . A A . 796 ASN N 1 1 18 13109 1 1 17 ASN ND2 N -6.103 4.499 1.316 1.00 . A A . 796 ASN ND2 1 1 18 13110 1 1 17 ASN O O -4.378 4.450 -0.649 1.00 . A A . 796 ASN O 1 1 18 13111 1 1 17 ASN OD1 O -7.633 6.032 1.839 1.00 . A A . 796 ASN OD1 1 1 18 13112 1 1 18 LEU C C -2.268 4.850 -3.360 1.00 . A A . 797 LEU C 1 1 18 13113 1 1 18 LEU CA C -3.391 3.845 -3.154 1.00 . A A . 797 LEU CA 1 1 18 13114 1 1 18 LEU CB C -3.527 2.980 -4.406 1.00 . A A . 797 LEU CB 1 1 18 13115 1 1 18 LEU CD1 C -4.869 1.405 -5.818 1.00 . A A . 797 LEU CD1 1 1 18 13116 1 1 18 LEU CD2 C -4.739 1.046 -3.354 1.00 . A A . 797 LEU CD2 1 1 18 13117 1 1 18 LEU CG C -4.768 2.084 -4.461 1.00 . A A . 797 LEU CG 1 1 18 13118 1 1 18 LEU H H -5.176 4.812 -3.634 1.00 . A A . 797 LEU H 1 1 18 13119 1 1 18 LEU HA H -3.140 3.209 -2.320 1.00 . A A . 797 LEU HA 1 1 18 13120 1 1 18 LEU HB2 H -3.547 3.635 -5.257 1.00 . A A . 797 LEU HB2 1 1 18 13121 1 1 18 LEU HB3 H -2.654 2.348 -4.480 1.00 . A A . 797 LEU HB3 1 1 18 13122 1 1 18 LEU HD11 H -3.989 0.800 -5.983 1.00 . A A . 797 LEU HD11 1 1 18 13123 1 1 18 LEU HD12 H -4.942 2.152 -6.593 1.00 . A A . 797 LEU HD12 1 1 18 13124 1 1 18 LEU HD13 H -5.746 0.774 -5.842 1.00 . A A . 797 LEU HD13 1 1 18 13125 1 1 18 LEU HD21 H -4.725 1.543 -2.395 1.00 . A A . 797 LEU HD21 1 1 18 13126 1 1 18 LEU HD22 H -3.852 0.438 -3.455 1.00 . A A . 797 LEU HD22 1 1 18 13127 1 1 18 LEU HD23 H -5.615 0.420 -3.422 1.00 . A A . 797 LEU HD23 1 1 18 13128 1 1 18 LEU HG H -5.648 2.695 -4.324 1.00 . A A . 797 LEU HG 1 1 18 13129 1 1 18 LEU N N -4.646 4.497 -2.875 1.00 . A A . 797 LEU N 1 1 18 13130 1 1 18 LEU O O -2.485 5.992 -3.771 1.00 . A A . 797 LEU O 1 1 18 13131 1 1 19 LEU C C 1.157 3.927 -3.591 1.00 . A A . 798 LEU C 1 1 18 13132 1 1 19 LEU CA C 0.176 5.048 -3.360 1.00 . A A . 798 LEU CA 1 1 18 13133 1 1 19 LEU CB C 0.643 5.983 -2.229 1.00 . A A . 798 LEU CB 1 1 18 13134 1 1 19 LEU CD1 C 1.698 6.344 0.016 1.00 . A A . 798 LEU CD1 1 1 18 13135 1 1 19 LEU CD2 C 0.367 4.282 -0.413 1.00 . A A . 798 LEU CD2 1 1 18 13136 1 1 19 LEU CG C 1.298 5.307 -1.019 1.00 . A A . 798 LEU CG 1 1 18 13137 1 1 19 LEU H H -1.047 3.509 -2.592 1.00 . A A . 798 LEU H 1 1 18 13138 1 1 19 LEU HA H 0.078 5.593 -4.280 1.00 . A A . 798 LEU HA 1 1 18 13139 1 1 19 LEU HB2 H 1.352 6.684 -2.644 1.00 . A A . 798 LEU HB2 1 1 18 13140 1 1 19 LEU HB3 H -0.216 6.537 -1.880 1.00 . A A . 798 LEU HB3 1 1 18 13141 1 1 19 LEU HD11 H 0.826 6.907 0.315 1.00 . A A . 798 LEU HD11 1 1 18 13142 1 1 19 LEU HD12 H 2.432 7.010 -0.409 1.00 . A A . 798 LEU HD12 1 1 18 13143 1 1 19 LEU HD13 H 2.119 5.846 0.879 1.00 . A A . 798 LEU HD13 1 1 18 13144 1 1 19 LEU HD21 H 0.148 3.529 -1.157 1.00 . A A . 798 LEU HD21 1 1 18 13145 1 1 19 LEU HD22 H -0.548 4.765 -0.105 1.00 . A A . 798 LEU HD22 1 1 18 13146 1 1 19 LEU HD23 H 0.842 3.820 0.438 1.00 . A A . 798 LEU HD23 1 1 18 13147 1 1 19 LEU HG H 2.195 4.797 -1.342 1.00 . A A . 798 LEU HG 1 1 18 13148 1 1 19 LEU N N -1.082 4.381 -3.054 1.00 . A A . 798 LEU N 1 1 18 13149 1 1 19 LEU O O 0.756 2.764 -3.476 1.00 . A A . 798 LEU O 1 1 18 13150 1 1 20 LYS C C 4.693 3.173 -3.882 1.00 . A A . 799 LYS C 1 1 18 13151 1 1 20 LYS CA C 3.229 3.059 -4.265 1.00 . A A . 799 LYS CA 1 1 18 13152 1 1 20 LYS CB C 3.073 2.752 -5.755 1.00 . A A . 799 LYS CB 1 1 18 13153 1 1 20 LYS CD C 3.586 5.081 -6.633 1.00 . A A . 799 LYS CD 1 1 18 13154 1 1 20 LYS CE C 4.398 5.887 -7.633 1.00 . A A . 799 LYS CE 1 1 18 13155 1 1 20 LYS CG C 3.936 3.600 -6.688 1.00 . A A . 799 LYS CG 1 1 18 13156 1 1 20 LYS H H 2.766 5.112 -3.908 1.00 . A A . 799 LYS H 1 1 18 13157 1 1 20 LYS HA H 2.816 2.251 -3.687 1.00 . A A . 799 LYS HA 1 1 18 13158 1 1 20 LYS HB2 H 3.321 1.713 -5.921 1.00 . A A . 799 LYS HB2 1 1 18 13159 1 1 20 LYS HB3 H 2.037 2.908 -6.017 1.00 . A A . 799 LYS HB3 1 1 18 13160 1 1 20 LYS HD2 H 2.537 5.202 -6.858 1.00 . A A . 799 LYS HD2 1 1 18 13161 1 1 20 LYS HD3 H 3.787 5.451 -5.638 1.00 . A A . 799 LYS HD3 1 1 18 13162 1 1 20 LYS HE2 H 4.150 5.552 -8.629 1.00 . A A . 799 LYS HE2 1 1 18 13163 1 1 20 LYS HE3 H 4.136 6.931 -7.531 1.00 . A A . 799 LYS HE3 1 1 18 13164 1 1 20 LYS HG2 H 4.969 3.483 -6.401 1.00 . A A . 799 LYS HG2 1 1 18 13165 1 1 20 LYS HG3 H 3.803 3.247 -7.700 1.00 . A A . 799 LYS HG3 1 1 18 13166 1 1 20 LYS HZ1 H 6.382 6.352 -8.087 1.00 . A A . 799 LYS HZ1 1 1 18 13167 1 1 20 LYS HZ2 H 6.150 4.750 -7.599 1.00 . A A . 799 LYS HZ2 1 1 18 13168 1 1 20 LYS HZ3 H 6.125 5.996 -6.450 1.00 . A A . 799 LYS HZ3 1 1 18 13169 1 1 20 LYS N N 2.410 4.191 -3.907 1.00 . A A . 799 LYS N 1 1 18 13170 1 1 20 LYS NZ N 5.863 5.734 -7.428 1.00 . A A . 799 LYS NZ 1 1 18 13171 1 1 20 LYS O O 5.298 4.246 -3.859 1.00 . A A . 799 LYS O 1 1 18 13172 1 1 21 CYS C C 7.559 2.433 -4.156 1.00 . A A . 800 CYS C 1 1 18 13173 1 1 21 CYS CA C 6.581 1.714 -3.235 1.00 . A A . 800 CYS CA 1 1 18 13174 1 1 21 CYS CB C 6.708 0.210 -3.419 1.00 . A A . 800 CYS CB 1 1 18 13175 1 1 21 CYS H H 4.574 1.245 -3.486 1.00 . A A . 800 CYS H 1 1 18 13176 1 1 21 CYS HA H 6.765 1.970 -2.206 1.00 . A A . 800 CYS HA 1 1 18 13177 1 1 21 CYS HB2 H 5.812 -0.253 -3.041 1.00 . A A . 800 CYS HB2 1 1 18 13178 1 1 21 CYS HB3 H 6.772 0.006 -4.480 1.00 . A A . 800 CYS HB3 1 1 18 13179 1 1 21 CYS N N 5.198 1.995 -3.557 1.00 . A A . 800 CYS N 1 1 18 13180 1 1 21 CYS O O 7.745 2.031 -5.297 1.00 . A A . 800 CYS O 1 1 18 13181 1 1 21 CYS SG S 8.088 -0.626 -2.626 1.00 . A A . 800 CYS SG 1 1 18 13182 1 1 22 GLU C C 10.453 3.358 -4.678 1.00 . A A . 801 GLU C 1 1 18 13183 1 1 22 GLU CA C 9.219 4.218 -4.369 1.00 . A A . 801 GLU CA 1 1 18 13184 1 1 22 GLU CB C 9.637 5.436 -3.546 1.00 . A A . 801 GLU CB 1 1 18 13185 1 1 22 GLU CD C 8.280 7.158 -4.777 1.00 . A A . 801 GLU CD 1 1 18 13186 1 1 22 GLU CG C 8.557 6.499 -3.444 1.00 . A A . 801 GLU CG 1 1 18 13187 1 1 22 GLU H H 7.881 3.838 -2.778 1.00 . A A . 801 GLU H 1 1 18 13188 1 1 22 GLU HA H 8.808 4.559 -5.304 1.00 . A A . 801 GLU HA 1 1 18 13189 1 1 22 GLU HB2 H 9.888 5.112 -2.547 1.00 . A A . 801 GLU HB2 1 1 18 13190 1 1 22 GLU HB3 H 10.509 5.881 -3.999 1.00 . A A . 801 GLU HB3 1 1 18 13191 1 1 22 GLU HG2 H 7.646 6.040 -3.087 1.00 . A A . 801 GLU HG2 1 1 18 13192 1 1 22 GLU HG3 H 8.878 7.256 -2.743 1.00 . A A . 801 GLU HG3 1 1 18 13193 1 1 22 GLU N N 8.175 3.489 -3.651 1.00 . A A . 801 GLU N 1 1 18 13194 1 1 22 GLU O O 11.465 3.870 -5.154 1.00 . A A . 801 GLU O 1 1 18 13195 1 1 22 GLU OE1 O 9.048 8.067 -5.161 1.00 . A A . 801 GLU OE1 1 1 18 13196 1 1 22 GLU OE2 O 7.309 6.762 -5.458 1.00 . A A . 801 GLU OE2 1 1 18 13197 1 1 23 TYR C C 11.127 0.316 -5.958 1.00 . A A . 802 TYR C 1 1 18 13198 1 1 23 TYR CA C 11.477 1.163 -4.731 1.00 . A A . 802 TYR CA 1 1 18 13199 1 1 23 TYR CB C 11.802 0.272 -3.525 1.00 . A A . 802 TYR CB 1 1 18 13200 1 1 23 TYR CD1 C 13.372 -1.550 -4.296 1.00 . A A . 802 TYR CD1 1 1 18 13201 1 1 23 TYR CD2 C 14.253 0.161 -2.890 1.00 . A A . 802 TYR CD2 1 1 18 13202 1 1 23 TYR CE1 C 14.616 -2.151 -4.354 1.00 . A A . 802 TYR CE1 1 1 18 13203 1 1 23 TYR CE2 C 15.499 -0.435 -2.941 1.00 . A A . 802 TYR CE2 1 1 18 13204 1 1 23 TYR CG C 13.168 -0.385 -3.565 1.00 . A A . 802 TYR CG 1 1 18 13205 1 1 23 TYR CZ C 15.676 -1.595 -3.602 1.00 . A A . 802 TYR CZ 1 1 18 13206 1 1 23 TYR H H 9.566 1.705 -4.003 1.00 . A A . 802 TYR H 1 1 18 13207 1 1 23 TYR HA H 12.328 1.775 -4.985 1.00 . A A . 802 TYR HA 1 1 18 13208 1 1 23 TYR HB2 H 11.750 0.868 -2.627 1.00 . A A . 802 TYR HB2 1 1 18 13209 1 1 23 TYR HB3 H 11.061 -0.513 -3.467 1.00 . A A . 802 TYR HB3 1 1 18 13210 1 1 23 TYR HD1 H 12.538 -1.990 -4.827 1.00 . A A . 802 TYR HD1 1 1 18 13211 1 1 23 TYR HD2 H 14.113 1.066 -2.315 1.00 . A A . 802 TYR HD2 1 1 18 13212 1 1 23 TYR HE1 H 14.754 -3.053 -4.930 1.00 . A A . 802 TYR HE1 1 1 18 13213 1 1 23 TYR HE2 H 16.328 0.003 -2.407 1.00 . A A . 802 TYR HE2 1 1 18 13214 1 1 23 TYR HH H 17.123 -2.420 -4.644 1.00 . A A . 802 TYR HH 1 1 18 13215 1 1 23 TYR N N 10.378 2.061 -4.413 1.00 . A A . 802 TYR N 1 1 18 13216 1 1 23 TYR O O 11.932 0.192 -6.879 1.00 . A A . 802 TYR O 1 1 18 13217 1 1 23 TYR OH O 16.921 -2.180 -3.730 1.00 . A A . 802 TYR OH 1 1 18 13218 1 1 24 CYS C C 8.307 -0.567 -7.855 1.00 . A A . 803 CYS C 1 1 18 13219 1 1 24 CYS CA C 9.514 -1.117 -7.082 1.00 . A A . 803 CYS CA 1 1 18 13220 1 1 24 CYS CB C 9.221 -2.519 -6.555 1.00 . A A . 803 CYS CB 1 1 18 13221 1 1 24 CYS H H 9.323 -0.118 -5.219 1.00 . A A . 803 CYS H 1 1 18 13222 1 1 24 CYS HA H 10.331 -1.168 -7.784 1.00 . A A . 803 CYS HA 1 1 18 13223 1 1 24 CYS HB2 H 8.712 -3.086 -7.320 1.00 . A A . 803 CYS HB2 1 1 18 13224 1 1 24 CYS HB3 H 10.152 -3.008 -6.307 1.00 . A A . 803 CYS HB3 1 1 18 13225 1 1 24 CYS N N 9.926 -0.252 -5.976 1.00 . A A . 803 CYS N 1 1 18 13226 1 1 24 CYS O O 8.139 -0.868 -9.035 1.00 . A A . 803 CYS O 1 1 18 13227 1 1 24 CYS SG S 8.181 -2.533 -5.075 1.00 . A A . 803 CYS SG 1 1 18 13228 1 1 25 GLY C C 5.058 0.142 -7.815 1.00 . A A . 804 GLY C 1 1 18 13229 1 1 25 GLY CA C 6.378 0.885 -7.905 1.00 . A A . 804 GLY CA 1 1 18 13230 1 1 25 GLY H H 7.582 0.370 -6.239 1.00 . A A . 804 GLY H 1 1 18 13231 1 1 25 GLY HA2 H 6.248 1.874 -7.490 1.00 . A A . 804 GLY HA2 1 1 18 13232 1 1 25 GLY HA3 H 6.650 0.981 -8.946 1.00 . A A . 804 GLY HA3 1 1 18 13233 1 1 25 GLY N N 7.463 0.222 -7.201 1.00 . A A . 804 GLY N 1 1 18 13234 1 1 25 GLY O O 4.189 0.313 -8.671 1.00 . A A . 804 GLY O 1 1 18 13235 1 1 26 LYS C C 2.621 -0.548 -5.897 1.00 . A A . 805 LYS C 1 1 18 13236 1 1 26 LYS CA C 3.662 -1.424 -6.587 1.00 . A A . 805 LYS CA 1 1 18 13237 1 1 26 LYS CB C 3.917 -2.682 -5.754 1.00 . A A . 805 LYS CB 1 1 18 13238 1 1 26 LYS CD C 3.702 -4.894 -6.949 1.00 . A A . 805 LYS CD 1 1 18 13239 1 1 26 LYS CE C 2.753 -4.440 -8.049 1.00 . A A . 805 LYS CE 1 1 18 13240 1 1 26 LYS CG C 4.650 -3.787 -6.501 1.00 . A A . 805 LYS CG 1 1 18 13241 1 1 26 LYS H H 5.616 -0.764 -6.126 1.00 . A A . 805 LYS H 1 1 18 13242 1 1 26 LYS HA H 3.295 -1.711 -7.560 1.00 . A A . 805 LYS HA 1 1 18 13243 1 1 26 LYS HB2 H 4.509 -2.414 -4.892 1.00 . A A . 805 LYS HB2 1 1 18 13244 1 1 26 LYS HB3 H 2.968 -3.073 -5.419 1.00 . A A . 805 LYS HB3 1 1 18 13245 1 1 26 LYS HD2 H 4.287 -5.722 -7.318 1.00 . A A . 805 LYS HD2 1 1 18 13246 1 1 26 LYS HD3 H 3.120 -5.220 -6.098 1.00 . A A . 805 LYS HD3 1 1 18 13247 1 1 26 LYS HE2 H 1.973 -5.178 -8.159 1.00 . A A . 805 LYS HE2 1 1 18 13248 1 1 26 LYS HE3 H 2.314 -3.496 -7.760 1.00 . A A . 805 LYS HE3 1 1 18 13249 1 1 26 LYS HG2 H 5.128 -3.363 -7.372 1.00 . A A . 805 LYS HG2 1 1 18 13250 1 1 26 LYS HG3 H 5.401 -4.210 -5.849 1.00 . A A . 805 LYS HG3 1 1 18 13251 1 1 26 LYS HZ1 H 2.757 -3.978 -10.084 1.00 . A A . 805 LYS HZ1 1 1 18 13252 1 1 26 LYS HZ2 H 3.875 -5.174 -9.653 1.00 . A A . 805 LYS HZ2 1 1 18 13253 1 1 26 LYS HZ3 H 4.190 -3.548 -9.286 1.00 . A A . 805 LYS HZ3 1 1 18 13254 1 1 26 LYS N N 4.903 -0.681 -6.786 1.00 . A A . 805 LYS N 1 1 18 13255 1 1 26 LYS NZ N 3.444 -4.272 -9.355 1.00 . A A . 805 LYS NZ 1 1 18 13256 1 1 26 LYS O O 2.870 -0.033 -4.806 1.00 . A A . 805 LYS O 1 1 18 13257 1 1 27 TYR C C -0.465 -0.365 -5.005 1.00 . A A . 806 TYR C 1 1 18 13258 1 1 27 TYR CA C 0.388 0.438 -5.966 1.00 . A A . 806 TYR CA 1 1 18 13259 1 1 27 TYR CB C -0.504 1.020 -7.067 1.00 . A A . 806 TYR CB 1 1 18 13260 1 1 27 TYR CD1 C 0.999 1.726 -8.979 1.00 . A A . 806 TYR CD1 1 1 18 13261 1 1 27 TYR CD2 C -0.060 3.424 -7.683 1.00 . A A . 806 TYR CD2 1 1 18 13262 1 1 27 TYR CE1 C 1.596 2.694 -9.766 1.00 . A A . 806 TYR CE1 1 1 18 13263 1 1 27 TYR CE2 C 0.534 4.395 -8.464 1.00 . A A . 806 TYR CE2 1 1 18 13264 1 1 27 TYR CG C 0.161 2.075 -7.926 1.00 . A A . 806 TYR CG 1 1 18 13265 1 1 27 TYR CZ C 1.362 4.026 -9.502 1.00 . A A . 806 TYR CZ 1 1 18 13266 1 1 27 TYR H H 1.263 -0.945 -7.314 1.00 . A A . 806 TYR H 1 1 18 13267 1 1 27 TYR HA H 0.828 1.245 -5.400 1.00 . A A . 806 TYR HA 1 1 18 13268 1 1 27 TYR HB2 H -0.823 0.223 -7.714 1.00 . A A . 806 TYR HB2 1 1 18 13269 1 1 27 TYR HB3 H -1.375 1.468 -6.609 1.00 . A A . 806 TYR HB3 1 1 18 13270 1 1 27 TYR HD1 H 1.180 0.681 -9.182 1.00 . A A . 806 TYR HD1 1 1 18 13271 1 1 27 TYR HD2 H -0.709 3.711 -6.869 1.00 . A A . 806 TYR HD2 1 1 18 13272 1 1 27 TYR HE1 H 2.246 2.404 -10.579 1.00 . A A . 806 TYR HE1 1 1 18 13273 1 1 27 TYR HE2 H 0.350 5.439 -8.258 1.00 . A A . 806 TYR HE2 1 1 18 13274 1 1 27 TYR HH H 1.917 4.729 -11.212 1.00 . A A . 806 TYR HH 1 1 18 13275 1 1 27 TYR N N 1.452 -0.407 -6.513 1.00 . A A . 806 TYR N 1 1 18 13276 1 1 27 TYR O O -0.950 -1.449 -5.337 1.00 . A A . 806 TYR O 1 1 18 13277 1 1 27 TYR OH O 1.951 4.995 -10.279 1.00 . A A . 806 TYR OH 1 1 18 13278 1 1 28 ALA C C -1.857 0.493 -1.723 1.00 . A A . 807 ALA C 1 1 18 13279 1 1 28 ALA CA C -1.312 -0.504 -2.737 1.00 . A A . 807 ALA CA 1 1 18 13280 1 1 28 ALA CB C -0.324 -1.454 -2.085 1.00 . A A . 807 ALA CB 1 1 18 13281 1 1 28 ALA H H -0.326 1.112 -3.675 1.00 . A A . 807 ALA H 1 1 18 13282 1 1 28 ALA HA H -2.126 -1.082 -3.150 1.00 . A A . 807 ALA HA 1 1 18 13283 1 1 28 ALA HB1 H -0.810 -1.980 -1.278 1.00 . A A . 807 ALA HB1 1 1 18 13284 1 1 28 ALA HB2 H 0.514 -0.891 -1.698 1.00 . A A . 807 ALA HB2 1 1 18 13285 1 1 28 ALA HB3 H 0.028 -2.165 -2.817 1.00 . A A . 807 ALA HB3 1 1 18 13286 1 1 28 ALA N N -0.652 0.194 -3.821 1.00 . A A . 807 ALA N 1 1 18 13287 1 1 28 ALA O O -1.497 1.670 -1.755 1.00 . A A . 807 ALA O 1 1 18 13288 1 1 29 PRO C C -2.331 1.417 1.194 1.00 . A A . 808 PRO C 1 1 18 13289 1 1 29 PRO CA C -3.350 0.933 0.175 1.00 . A A . 808 PRO CA 1 1 18 13290 1 1 29 PRO CB C -4.411 0.060 0.857 1.00 . A A . 808 PRO CB 1 1 18 13291 1 1 29 PRO CD C -3.216 -1.336 -0.663 1.00 . A A . 808 PRO CD 1 1 18 13292 1 1 29 PRO CG C -4.547 -1.150 -0.006 1.00 . A A . 808 PRO CG 1 1 18 13293 1 1 29 PRO HA H -3.823 1.784 -0.293 1.00 . A A . 808 PRO HA 1 1 18 13294 1 1 29 PRO HB2 H -4.072 -0.198 1.847 1.00 . A A . 808 PRO HB2 1 1 18 13295 1 1 29 PRO HB3 H -5.341 0.606 0.921 1.00 . A A . 808 PRO HB3 1 1 18 13296 1 1 29 PRO HD2 H -2.552 -1.905 -0.023 1.00 . A A . 808 PRO HD2 1 1 18 13297 1 1 29 PRO HD3 H -3.329 -1.817 -1.623 1.00 . A A . 808 PRO HD3 1 1 18 13298 1 1 29 PRO HG2 H -4.787 -2.007 0.603 1.00 . A A . 808 PRO HG2 1 1 18 13299 1 1 29 PRO HG3 H -5.314 -0.989 -0.749 1.00 . A A . 808 PRO HG3 1 1 18 13300 1 1 29 PRO N N -2.744 0.049 -0.815 1.00 . A A . 808 PRO N 1 1 18 13301 1 1 29 PRO O O -1.576 0.622 1.759 1.00 . A A . 808 PRO O 1 1 18 13302 1 1 30 ALA C C -1.312 2.682 3.702 1.00 . A A . 809 ALA C 1 1 18 13303 1 1 30 ALA CA C -1.425 3.411 2.355 1.00 . A A . 809 ALA CA 1 1 18 13304 1 1 30 ALA CB C -1.910 4.835 2.586 1.00 . A A . 809 ALA CB 1 1 18 13305 1 1 30 ALA H H -2.912 3.294 0.829 1.00 . A A . 809 ALA H 1 1 18 13306 1 1 30 ALA HA H -0.451 3.476 1.892 1.00 . A A . 809 ALA HA 1 1 18 13307 1 1 30 ALA HB1 H -1.937 5.362 1.645 1.00 . A A . 809 ALA HB1 1 1 18 13308 1 1 30 ALA HB2 H -1.236 5.338 3.264 1.00 . A A . 809 ALA HB2 1 1 18 13309 1 1 30 ALA HB3 H -2.901 4.812 3.014 1.00 . A A . 809 ALA HB3 1 1 18 13310 1 1 30 ALA N N -2.320 2.737 1.394 1.00 . A A . 809 ALA N 1 1 18 13311 1 1 30 ALA O O -0.299 2.785 4.389 1.00 . A A . 809 ALA O 1 1 18 13312 1 1 31 GLU C C -1.310 0.260 5.557 1.00 . A A . 810 GLU C 1 1 18 13313 1 1 31 GLU CA C -2.456 1.256 5.339 1.00 . A A . 810 GLU CA 1 1 18 13314 1 1 31 GLU CB C -3.799 0.533 5.402 1.00 . A A . 810 GLU CB 1 1 18 13315 1 1 31 GLU CD C -5.447 -0.782 6.751 1.00 . A A . 810 GLU CD 1 1 18 13316 1 1 31 GLU CG C -4.119 -0.067 6.756 1.00 . A A . 810 GLU CG 1 1 18 13317 1 1 31 GLU H H -3.109 1.889 3.436 1.00 . A A . 810 GLU H 1 1 18 13318 1 1 31 GLU HA H -2.421 1.986 6.132 1.00 . A A . 810 GLU HA 1 1 18 13319 1 1 31 GLU HB2 H -4.581 1.236 5.154 1.00 . A A . 810 GLU HB2 1 1 18 13320 1 1 31 GLU HB3 H -3.800 -0.263 4.670 1.00 . A A . 810 GLU HB3 1 1 18 13321 1 1 31 GLU HG2 H -3.343 -0.771 7.019 1.00 . A A . 810 GLU HG2 1 1 18 13322 1 1 31 GLU HG3 H -4.152 0.726 7.489 1.00 . A A . 810 GLU HG3 1 1 18 13323 1 1 31 GLU N N -2.363 1.960 4.061 1.00 . A A . 810 GLU N 1 1 18 13324 1 1 31 GLU O O -0.800 0.138 6.675 1.00 . A A . 810 GLU O 1 1 18 13325 1 1 31 GLU OE1 O -6.486 -0.114 6.942 1.00 . A A . 810 GLU OE1 1 1 18 13326 1 1 31 GLU OE2 O -5.463 -2.011 6.538 1.00 . A A . 810 GLU OE2 1 1 18 13327 1 1 32 GLN C C 1.514 -0.830 4.797 1.00 . A A . 811 GLN C 1 1 18 13328 1 1 32 GLN CA C 0.136 -1.461 4.631 1.00 . A A . 811 GLN CA 1 1 18 13329 1 1 32 GLN CB C 0.136 -2.394 3.416 1.00 . A A . 811 GLN CB 1 1 18 13330 1 1 32 GLN CD C 1.266 -3.033 1.268 1.00 . A A . 811 GLN CD 1 1 18 13331 1 1 32 GLN CG C 0.996 -1.925 2.258 1.00 . A A . 811 GLN CG 1 1 18 13332 1 1 32 GLN H H -1.312 -0.275 3.629 1.00 . A A . 811 GLN H 1 1 18 13333 1 1 32 GLN HA H -0.063 -2.071 5.499 1.00 . A A . 811 GLN HA 1 1 18 13334 1 1 32 GLN HB2 H 0.497 -3.362 3.728 1.00 . A A . 811 GLN HB2 1 1 18 13335 1 1 32 GLN HB3 H -0.879 -2.498 3.062 1.00 . A A . 811 GLN HB3 1 1 18 13336 1 1 32 GLN HE21 H 1.456 -1.709 -0.188 1.00 . A A . 811 GLN HE21 1 1 18 13337 1 1 32 GLN HE22 H 1.642 -3.364 -0.640 1.00 . A A . 811 GLN HE22 1 1 18 13338 1 1 32 GLN HG2 H 0.487 -1.122 1.747 1.00 . A A . 811 GLN HG2 1 1 18 13339 1 1 32 GLN HG3 H 1.939 -1.567 2.644 1.00 . A A . 811 GLN HG3 1 1 18 13340 1 1 32 GLN N N -0.900 -0.441 4.504 1.00 . A A . 811 GLN N 1 1 18 13341 1 1 32 GLN NE2 N 1.481 -2.666 0.024 1.00 . A A . 811 GLN NE2 1 1 18 13342 1 1 32 GLN O O 2.449 -1.485 5.266 1.00 . A A . 811 GLN O 1 1 18 13343 1 1 32 GLN OE1 O 1.299 -4.211 1.625 1.00 . A A . 811 GLN OE1 1 1 18 13344 1 1 33 PHE C C 3.246 1.516 5.956 1.00 . A A . 812 PHE C 1 1 18 13345 1 1 33 PHE CA C 2.899 1.163 4.503 1.00 . A A . 812 PHE CA 1 1 18 13346 1 1 33 PHE CB C 2.815 2.436 3.655 1.00 . A A . 812 PHE CB 1 1 18 13347 1 1 33 PHE CD1 C 1.750 1.482 1.590 1.00 . A A . 812 PHE CD1 1 1 18 13348 1 1 33 PHE CD2 C 3.834 2.612 1.358 1.00 . A A . 812 PHE CD2 1 1 18 13349 1 1 33 PHE CE1 C 1.727 1.240 0.230 1.00 . A A . 812 PHE CE1 1 1 18 13350 1 1 33 PHE CE2 C 3.817 2.373 -0.002 1.00 . A A . 812 PHE CE2 1 1 18 13351 1 1 33 PHE CG C 2.801 2.169 2.171 1.00 . A A . 812 PHE CG 1 1 18 13352 1 1 33 PHE CZ C 2.785 1.665 -0.564 1.00 . A A . 812 PHE CZ 1 1 18 13353 1 1 33 PHE H H 0.917 0.841 3.873 1.00 . A A . 812 PHE H 1 1 18 13354 1 1 33 PHE HA H 3.671 0.540 4.075 1.00 . A A . 812 PHE HA 1 1 18 13355 1 1 33 PHE HB2 H 1.911 2.970 3.906 1.00 . A A . 812 PHE HB2 1 1 18 13356 1 1 33 PHE HB3 H 3.668 3.061 3.872 1.00 . A A . 812 PHE HB3 1 1 18 13357 1 1 33 PHE HD1 H 0.939 1.133 2.212 1.00 . A A . 812 PHE HD1 1 1 18 13358 1 1 33 PHE HD2 H 4.662 3.150 1.800 1.00 . A A . 812 PHE HD2 1 1 18 13359 1 1 33 PHE HE1 H 0.901 0.702 -0.209 1.00 . A A . 812 PHE HE1 1 1 18 13360 1 1 33 PHE HE2 H 4.628 2.724 -0.622 1.00 . A A . 812 PHE HE2 1 1 18 13361 1 1 33 PHE HZ H 2.781 1.470 -1.627 1.00 . A A . 812 PHE HZ 1 1 18 13362 1 1 33 PHE N N 1.643 0.428 4.386 1.00 . A A . 812 PHE N 1 1 18 13363 1 1 33 PHE O O 3.361 2.683 6.321 1.00 . A A . 812 PHE O 1 1 18 13364 1 1 34 ARG C C 5.357 0.936 8.191 1.00 . A A . 813 ARG C 1 1 18 13365 1 1 34 ARG CA C 3.869 0.623 8.149 1.00 . A A . 813 ARG CA 1 1 18 13366 1 1 34 ARG CB C 3.605 -0.666 8.929 1.00 . A A . 813 ARG CB 1 1 18 13367 1 1 34 ARG CD C 1.518 0.281 9.970 1.00 . A A . 813 ARG CD 1 1 18 13368 1 1 34 ARG CG C 2.137 -0.902 9.237 1.00 . A A . 813 ARG CG 1 1 18 13369 1 1 34 ARG CZ C 1.831 1.470 12.110 1.00 . A A . 813 ARG CZ 1 1 18 13370 1 1 34 ARG H H 3.174 -0.411 6.436 1.00 . A A . 813 ARG H 1 1 18 13371 1 1 34 ARG HA H 3.343 1.429 8.639 1.00 . A A . 813 ARG HA 1 1 18 13372 1 1 34 ARG HB2 H 3.969 -1.504 8.350 1.00 . A A . 813 ARG HB2 1 1 18 13373 1 1 34 ARG HB3 H 4.146 -0.626 9.864 1.00 . A A . 813 ARG HB3 1 1 18 13374 1 1 34 ARG HD2 H 1.467 1.121 9.293 1.00 . A A . 813 ARG HD2 1 1 18 13375 1 1 34 ARG HD3 H 0.520 0.011 10.282 1.00 . A A . 813 ARG HD3 1 1 18 13376 1 1 34 ARG HE H 3.215 0.327 11.223 1.00 . A A . 813 ARG HE 1 1 18 13377 1 1 34 ARG HG2 H 1.607 -1.053 8.309 1.00 . A A . 813 ARG HG2 1 1 18 13378 1 1 34 ARG HG3 H 2.046 -1.784 9.854 1.00 . A A . 813 ARG HG3 1 1 18 13379 1 1 34 ARG HH11 H -0.025 1.630 11.321 1.00 . A A . 813 ARG HH11 1 1 18 13380 1 1 34 ARG HH12 H 0.229 2.521 12.787 1.00 . A A . 813 ARG HH12 1 1 18 13381 1 1 34 ARG HH21 H 3.562 1.475 13.165 1.00 . A A . 813 ARG HH21 1 1 18 13382 1 1 34 ARG HH22 H 2.269 2.407 13.853 1.00 . A A . 813 ARG HH22 1 1 18 13383 1 1 34 ARG N N 3.405 0.484 6.771 1.00 . A A . 813 ARG N 1 1 18 13384 1 1 34 ARG NE N 2.293 0.671 11.150 1.00 . A A . 813 ARG NE 1 1 18 13385 1 1 34 ARG NH1 N 0.579 1.905 12.069 1.00 . A A . 813 ARG NH1 1 1 18 13386 1 1 34 ARG NH2 N 2.618 1.813 13.123 1.00 . A A . 813 ARG NH2 1 1 18 13387 1 1 34 ARG O O 5.861 1.482 9.175 1.00 . A A . 813 ARG O 1 1 18 13388 1 1 35 GLY C C 7.648 2.183 6.199 1.00 . A A . 814 GLY C 1 1 18 13389 1 1 35 GLY CA C 7.458 0.931 7.021 1.00 . A A . 814 GLY CA 1 1 18 13390 1 1 35 GLY H H 5.619 0.116 6.391 1.00 . A A . 814 GLY H 1 1 18 13391 1 1 35 GLY HA2 H 7.859 1.091 8.012 1.00 . A A . 814 GLY HA2 1 1 18 13392 1 1 35 GLY HA3 H 7.987 0.116 6.550 1.00 . A A . 814 GLY HA3 1 1 18 13393 1 1 35 GLY N N 6.058 0.593 7.124 1.00 . A A . 814 GLY N 1 1 18 13394 1 1 35 GLY O O 8.326 2.153 5.172 1.00 . A A . 814 GLY O 1 1 18 13395 1 1 36 SER C C 6.100 4.480 4.729 1.00 . A A . 815 SER C 1 1 18 13396 1 1 36 SER CA C 7.026 4.549 5.941 1.00 . A A . 815 SER CA 1 1 18 13397 1 1 36 SER CB C 8.450 4.959 5.523 1.00 . A A . 815 SER CB 1 1 18 13398 1 1 36 SER H H 6.541 3.218 7.506 1.00 . A A . 815 SER H 1 1 18 13399 1 1 36 SER HA H 6.625 5.307 6.598 1.00 . A A . 815 SER HA 1 1 18 13400 1 1 36 SER HB2 H 9.088 4.969 6.396 1.00 . A A . 815 SER HB2 1 1 18 13401 1 1 36 SER HB3 H 8.832 4.244 4.810 1.00 . A A . 815 SER HB3 1 1 18 13402 1 1 36 SER HG H 7.780 6.799 5.336 1.00 . A A . 815 SER HG 1 1 18 13403 1 1 36 SER N N 7.026 3.275 6.657 1.00 . A A . 815 SER N 1 1 18 13404 1 1 36 SER O O 6.057 3.480 4.006 1.00 . A A . 815 SER O 1 1 18 13405 1 1 36 SER OG O 8.472 6.250 4.932 1.00 . A A . 815 SER OG 1 1 18 13406 1 1 37 LYS C C 5.179 5.936 2.119 1.00 . A A . 816 LYS C 1 1 18 13407 1 1 37 LYS CA C 4.410 5.651 3.405 1.00 . A A . 816 LYS CA 1 1 18 13408 1 1 37 LYS CB C 3.384 6.757 3.671 1.00 . A A . 816 LYS CB 1 1 18 13409 1 1 37 LYS CD C 1.721 5.397 4.988 1.00 . A A . 816 LYS CD 1 1 18 13410 1 1 37 LYS CE C 1.207 5.073 6.382 1.00 . A A . 816 LYS CE 1 1 18 13411 1 1 37 LYS CG C 2.652 6.599 4.996 1.00 . A A . 816 LYS CG 1 1 18 13412 1 1 37 LYS H H 5.440 6.327 5.125 1.00 . A A . 816 LYS H 1 1 18 13413 1 1 37 LYS HA H 3.894 4.705 3.308 1.00 . A A . 816 LYS HA 1 1 18 13414 1 1 37 LYS HB2 H 3.892 7.711 3.674 1.00 . A A . 816 LYS HB2 1 1 18 13415 1 1 37 LYS HB3 H 2.653 6.752 2.876 1.00 . A A . 816 LYS HB3 1 1 18 13416 1 1 37 LYS HD2 H 0.880 5.612 4.346 1.00 . A A . 816 LYS HD2 1 1 18 13417 1 1 37 LYS HD3 H 2.258 4.543 4.604 1.00 . A A . 816 LYS HD3 1 1 18 13418 1 1 37 LYS HE2 H 0.510 4.249 6.312 1.00 . A A . 816 LYS HE2 1 1 18 13419 1 1 37 LYS HE3 H 2.044 4.782 7.000 1.00 . A A . 816 LYS HE3 1 1 18 13420 1 1 37 LYS HG2 H 3.379 6.473 5.784 1.00 . A A . 816 LYS HG2 1 1 18 13421 1 1 37 LYS HG3 H 2.072 7.491 5.179 1.00 . A A . 816 LYS HG3 1 1 18 13422 1 1 37 LYS HZ1 H 1.193 7.015 7.149 1.00 . A A . 816 LYS HZ1 1 1 18 13423 1 1 37 LYS HZ2 H 0.124 5.959 7.927 1.00 . A A . 816 LYS HZ2 1 1 18 13424 1 1 37 LYS HZ3 H -0.256 6.564 6.393 1.00 . A A . 816 LYS HZ3 1 1 18 13425 1 1 37 LYS N N 5.343 5.554 4.523 1.00 . A A . 816 LYS N 1 1 18 13426 1 1 37 LYS NZ N 0.521 6.232 7.008 1.00 . A A . 816 LYS NZ 1 1 18 13427 1 1 37 LYS O O 4.934 6.928 1.432 1.00 . A A . 816 LYS O 1 1 18 13428 1 1 38 ARG C C 7.397 3.812 0.158 1.00 . A A . 817 ARG C 1 1 18 13429 1 1 38 ARG CA C 7.045 5.187 0.711 1.00 . A A . 817 ARG CA 1 1 18 13430 1 1 38 ARG CB C 8.335 5.868 1.176 1.00 . A A . 817 ARG CB 1 1 18 13431 1 1 38 ARG CD C 9.494 7.973 1.886 1.00 . A A . 817 ARG CD 1 1 18 13432 1 1 38 ARG CG C 8.164 7.329 1.546 1.00 . A A . 817 ARG CG 1 1 18 13433 1 1 38 ARG CZ C 11.470 7.297 3.188 1.00 . A A . 817 ARG CZ 1 1 18 13434 1 1 38 ARG H H 6.211 4.254 2.384 1.00 . A A . 817 ARG H 1 1 18 13435 1 1 38 ARG HA H 6.627 5.769 -0.097 1.00 . A A . 817 ARG HA 1 1 18 13436 1 1 38 ARG HB2 H 8.714 5.345 2.041 1.00 . A A . 817 ARG HB2 1 1 18 13437 1 1 38 ARG HB3 H 9.065 5.806 0.381 1.00 . A A . 817 ARG HB3 1 1 18 13438 1 1 38 ARG HD2 H 10.142 7.910 1.024 1.00 . A A . 817 ARG HD2 1 1 18 13439 1 1 38 ARG HD3 H 9.325 9.013 2.130 1.00 . A A . 817 ARG HD3 1 1 18 13440 1 1 38 ARG HE H 9.568 6.894 3.695 1.00 . A A . 817 ARG HE 1 1 18 13441 1 1 38 ARG HG2 H 7.723 7.852 0.711 1.00 . A A . 817 ARG HG2 1 1 18 13442 1 1 38 ARG HG3 H 7.510 7.398 2.403 1.00 . A A . 817 ARG HG3 1 1 18 13443 1 1 38 ARG HH11 H 11.875 8.265 1.455 1.00 . A A . 817 ARG HH11 1 1 18 13444 1 1 38 ARG HH12 H 13.266 7.852 2.409 1.00 . A A . 817 ARG HH12 1 1 18 13445 1 1 38 ARG HH21 H 11.400 6.300 4.958 1.00 . A A . 817 ARG HH21 1 1 18 13446 1 1 38 ARG HH22 H 12.995 6.698 4.387 1.00 . A A . 817 ARG HH22 1 1 18 13447 1 1 38 ARG N N 6.116 5.052 1.822 1.00 . A A . 817 ARG N 1 1 18 13448 1 1 38 ARG NE N 10.150 7.322 3.017 1.00 . A A . 817 ARG NE 1 1 18 13449 1 1 38 ARG NH1 N 12.266 7.842 2.275 1.00 . A A . 817 ARG NH1 1 1 18 13450 1 1 38 ARG NH2 N 11.995 6.721 4.262 1.00 . A A . 817 ARG NH2 1 1 18 13451 1 1 38 ARG O O 7.685 3.675 -1.025 1.00 . A A . 817 ARG O 1 1 18 13452 1 1 39 PHE C C 6.663 0.470 1.092 1.00 . A A . 818 PHE C 1 1 18 13453 1 1 39 PHE CA C 7.710 1.443 0.586 1.00 . A A . 818 PHE CA 1 1 18 13454 1 1 39 PHE CB C 9.092 1.055 1.108 1.00 . A A . 818 PHE CB 1 1 18 13455 1 1 39 PHE CD1 C 10.670 1.977 -0.611 1.00 . A A . 818 PHE CD1 1 1 18 13456 1 1 39 PHE CD2 C 10.667 2.948 1.565 1.00 . A A . 818 PHE CD2 1 1 18 13457 1 1 39 PHE CE1 C 11.648 2.864 -1.012 1.00 . A A . 818 PHE CE1 1 1 18 13458 1 1 39 PHE CE2 C 11.644 3.842 1.170 1.00 . A A . 818 PHE CE2 1 1 18 13459 1 1 39 PHE CG C 10.170 2.008 0.680 1.00 . A A . 818 PHE CG 1 1 18 13460 1 1 39 PHE CZ C 12.135 3.797 -0.121 1.00 . A A . 818 PHE CZ 1 1 18 13461 1 1 39 PHE H H 7.122 2.935 1.947 1.00 . A A . 818 PHE H 1 1 18 13462 1 1 39 PHE HA H 7.714 1.421 -0.493 1.00 . A A . 818 PHE HA 1 1 18 13463 1 1 39 PHE HB2 H 9.070 1.038 2.189 1.00 . A A . 818 PHE HB2 1 1 18 13464 1 1 39 PHE HB3 H 9.343 0.072 0.742 1.00 . A A . 818 PHE HB3 1 1 18 13465 1 1 39 PHE HD1 H 10.289 1.246 -1.310 1.00 . A A . 818 PHE HD1 1 1 18 13466 1 1 39 PHE HD2 H 10.283 2.981 2.574 1.00 . A A . 818 PHE HD2 1 1 18 13467 1 1 39 PHE HE1 H 12.031 2.827 -2.022 1.00 . A A . 818 PHE HE1 1 1 18 13468 1 1 39 PHE HE2 H 12.024 4.572 1.868 1.00 . A A . 818 PHE HE2 1 1 18 13469 1 1 39 PHE HZ H 12.900 4.493 -0.433 1.00 . A A . 818 PHE HZ 1 1 18 13470 1 1 39 PHE N N 7.371 2.792 1.011 1.00 . A A . 818 PHE N 1 1 18 13471 1 1 39 PHE O O 6.271 0.515 2.259 1.00 . A A . 818 PHE O 1 1 18 13472 1 1 40 CYS C C 5.551 -2.389 1.482 1.00 . A A . 819 CYS C 1 1 18 13473 1 1 40 CYS CA C 5.097 -1.268 0.551 1.00 . A A . 819 CYS CA 1 1 18 13474 1 1 40 CYS CB C 4.477 -1.846 -0.726 1.00 . A A . 819 CYS CB 1 1 18 13475 1 1 40 CYS H H 6.694 -0.570 -0.610 1.00 . A A . 819 CYS H 1 1 18 13476 1 1 40 CYS HA H 4.342 -0.662 1.032 1.00 . A A . 819 CYS HA 1 1 18 13477 1 1 40 CYS HB2 H 3.868 -2.686 -0.458 1.00 . A A . 819 CYS HB2 1 1 18 13478 1 1 40 CYS HB3 H 3.855 -1.091 -1.183 1.00 . A A . 819 CYS HB3 1 1 18 13479 1 1 40 CYS N N 6.196 -0.403 0.211 1.00 . A A . 819 CYS N 1 1 18 13480 1 1 40 CYS O O 6.268 -3.285 1.044 1.00 . A A . 819 CYS O 1 1 18 13481 1 1 40 CYS SG S 5.658 -2.416 -1.971 1.00 . A A . 819 CYS SG 1 1 18 13482 1 1 41 SER C C 6.611 -3.568 4.345 1.00 . A A . 820 SER C 1 1 18 13483 1 1 41 SER CA C 5.218 -3.413 3.709 1.00 . A A . 820 SER CA 1 1 18 13484 1 1 41 SER CB C 4.704 -4.724 3.073 1.00 . A A . 820 SER CB 1 1 18 13485 1 1 41 SER H H 5.135 -1.411 3.175 1.00 . A A . 820 SER H 1 1 18 13486 1 1 41 SER HA H 4.503 -3.107 4.461 1.00 . A A . 820 SER HA 1 1 18 13487 1 1 41 SER HB2 H 4.424 -5.410 3.859 1.00 . A A . 820 SER HB2 1 1 18 13488 1 1 41 SER HB3 H 3.829 -4.498 2.473 1.00 . A A . 820 SER HB3 1 1 18 13489 1 1 41 SER HG H 5.965 -4.735 1.568 1.00 . A A . 820 SER HG 1 1 18 13490 1 1 41 SER N N 5.213 -2.289 2.764 1.00 . A A . 820 SER N 1 1 18 13491 1 1 41 SER O O 7.380 -2.604 4.391 1.00 . A A . 820 SER O 1 1 18 13492 1 1 41 SER OG O 5.671 -5.358 2.250 1.00 . A A . 820 SER OG 1 1 18 13493 1 1 42 MET C C 9.380 -5.200 4.640 1.00 . A A . 821 MET C 1 1 18 13494 1 1 42 MET CA C 8.184 -4.981 5.562 1.00 . A A . 821 MET CA 1 1 18 13495 1 1 42 MET CB C 8.027 -6.194 6.485 1.00 . A A . 821 MET CB 1 1 18 13496 1 1 42 MET CE C 6.487 -3.326 7.928 1.00 . A A . 821 MET CE 1 1 18 13497 1 1 42 MET CG C 6.924 -6.061 7.527 1.00 . A A . 821 MET CG 1 1 18 13498 1 1 42 MET H H 6.376 -5.539 4.597 1.00 . A A . 821 MET H 1 1 18 13499 1 1 42 MET HA H 8.360 -4.110 6.174 1.00 . A A . 821 MET HA 1 1 18 13500 1 1 42 MET HB2 H 7.813 -7.062 5.879 1.00 . A A . 821 MET HB2 1 1 18 13501 1 1 42 MET HB3 H 8.960 -6.353 7.004 1.00 . A A . 821 MET HB3 1 1 18 13502 1 1 42 MET HE1 H 5.439 -3.517 7.756 1.00 . A A . 821 MET HE1 1 1 18 13503 1 1 42 MET HE2 H 6.979 -3.147 6.984 1.00 . A A . 821 MET HE2 1 1 18 13504 1 1 42 MET HE3 H 6.595 -2.458 8.561 1.00 . A A . 821 MET HE3 1 1 18 13505 1 1 42 MET HG2 H 5.993 -5.852 7.020 1.00 . A A . 821 MET HG2 1 1 18 13506 1 1 42 MET HG3 H 6.836 -6.999 8.053 1.00 . A A . 821 MET HG3 1 1 18 13507 1 1 42 MET N N 6.953 -4.769 4.797 1.00 . A A . 821 MET N 1 1 18 13508 1 1 42 MET O O 10.344 -4.438 4.676 1.00 . A A . 821 MET O 1 1 18 13509 1 1 42 MET SD S 7.227 -4.747 8.733 1.00 . A A . 821 MET SD 1 1 18 13510 1 1 43 THR C C 10.813 -5.355 2.047 1.00 . A A . 822 THR C 1 1 18 13511 1 1 43 THR CA C 10.321 -6.575 2.827 1.00 . A A . 822 THR CA 1 1 18 13512 1 1 43 THR CB C 9.759 -7.605 1.832 1.00 . A A . 822 THR CB 1 1 18 13513 1 1 43 THR CG2 C 10.848 -8.111 0.895 1.00 . A A . 822 THR CG2 1 1 18 13514 1 1 43 THR H H 8.513 -6.832 3.895 1.00 . A A . 822 THR H 1 1 18 13515 1 1 43 THR HA H 11.188 -7.021 3.292 1.00 . A A . 822 THR HA 1 1 18 13516 1 1 43 THR HB H 8.984 -7.131 1.242 1.00 . A A . 822 THR HB 1 1 18 13517 1 1 43 THR HG1 H 8.806 -9.339 1.931 1.00 . A A . 822 THR HG1 1 1 18 13518 1 1 43 THR HG21 H 11.645 -8.553 1.474 1.00 . A A . 822 THR HG21 1 1 18 13519 1 1 43 THR HG22 H 11.236 -7.285 0.316 1.00 . A A . 822 THR HG22 1 1 18 13520 1 1 43 THR HG23 H 10.434 -8.855 0.229 1.00 . A A . 822 THR HG23 1 1 18 13521 1 1 43 THR N N 9.294 -6.240 3.818 1.00 . A A . 822 THR N 1 1 18 13522 1 1 43 THR O O 12.017 -5.122 1.952 1.00 . A A . 822 THR O 1 1 18 13523 1 1 43 THR OG1 O 9.193 -8.706 2.556 1.00 . A A . 822 THR OG1 1 1 18 13524 1 1 44 CYS C C 10.910 -2.314 1.501 1.00 . A A . 823 CYS C 1 1 18 13525 1 1 44 CYS CA C 10.269 -3.435 0.693 1.00 . A A . 823 CYS CA 1 1 18 13526 1 1 44 CYS CB C 9.061 -2.945 -0.071 1.00 . A A . 823 CYS CB 1 1 18 13527 1 1 44 CYS H H 8.951 -4.758 1.697 1.00 . A A . 823 CYS H 1 1 18 13528 1 1 44 CYS HA H 10.984 -3.768 -0.047 1.00 . A A . 823 CYS HA 1 1 18 13529 1 1 44 CYS HB2 H 8.223 -2.841 0.605 1.00 . A A . 823 CYS HB2 1 1 18 13530 1 1 44 CYS HB3 H 9.282 -1.992 -0.525 1.00 . A A . 823 CYS HB3 1 1 18 13531 1 1 44 CYS N N 9.897 -4.576 1.511 1.00 . A A . 823 CYS N 1 1 18 13532 1 1 44 CYS O O 11.910 -1.735 1.075 1.00 . A A . 823 CYS O 1 1 18 13533 1 1 44 CYS SG S 8.593 -4.095 -1.383 1.00 . A A . 823 CYS SG 1 1 18 13534 1 1 45 ALA C C 12.328 -1.411 3.959 1.00 . A A . 824 ALA C 1 1 18 13535 1 1 45 ALA CA C 10.933 -0.990 3.523 1.00 . A A . 824 ALA CA 1 1 18 13536 1 1 45 ALA CB C 10.049 -0.736 4.723 1.00 . A A . 824 ALA CB 1 1 18 13537 1 1 45 ALA H H 9.534 -2.477 2.958 1.00 . A A . 824 ALA H 1 1 18 13538 1 1 45 ALA HA H 11.003 -0.071 2.958 1.00 . A A . 824 ALA HA 1 1 18 13539 1 1 45 ALA HB1 H 9.943 -1.646 5.291 1.00 . A A . 824 ALA HB1 1 1 18 13540 1 1 45 ALA HB2 H 9.078 -0.406 4.382 1.00 . A A . 824 ALA HB2 1 1 18 13541 1 1 45 ALA HB3 H 10.494 0.028 5.342 1.00 . A A . 824 ALA HB3 1 1 18 13542 1 1 45 ALA N N 10.347 -2.005 2.663 1.00 . A A . 824 ALA N 1 1 18 13543 1 1 45 ALA O O 13.269 -0.614 3.940 1.00 . A A . 824 ALA O 1 1 18 13544 1 1 46 LYS C C 14.704 -3.255 3.541 1.00 . A A . 825 LYS C 1 1 18 13545 1 1 46 LYS CA C 13.745 -3.234 4.718 1.00 . A A . 825 LYS CA 1 1 18 13546 1 1 46 LYS CB C 13.578 -4.655 5.244 1.00 . A A . 825 LYS CB 1 1 18 13547 1 1 46 LYS CD C 12.909 -6.163 7.123 1.00 . A A . 825 LYS CD 1 1 18 13548 1 1 46 LYS CE C 14.303 -6.774 7.150 1.00 . A A . 825 LYS CE 1 1 18 13549 1 1 46 LYS CG C 12.941 -4.732 6.618 1.00 . A A . 825 LYS CG 1 1 18 13550 1 1 46 LYS H H 11.662 -3.255 4.392 1.00 . A A . 825 LYS H 1 1 18 13551 1 1 46 LYS HA H 14.132 -2.619 5.518 1.00 . A A . 825 LYS HA 1 1 18 13552 1 1 46 LYS HB2 H 12.959 -5.210 4.554 1.00 . A A . 825 LYS HB2 1 1 18 13553 1 1 46 LYS HB3 H 14.549 -5.123 5.296 1.00 . A A . 825 LYS HB3 1 1 18 13554 1 1 46 LYS HD2 H 12.501 -6.172 8.123 1.00 . A A . 825 LYS HD2 1 1 18 13555 1 1 46 LYS HD3 H 12.281 -6.750 6.470 1.00 . A A . 825 LYS HD3 1 1 18 13556 1 1 46 LYS HE2 H 14.714 -6.751 6.149 1.00 . A A . 825 LYS HE2 1 1 18 13557 1 1 46 LYS HE3 H 14.930 -6.187 7.806 1.00 . A A . 825 LYS HE3 1 1 18 13558 1 1 46 LYS HG2 H 13.514 -4.126 7.306 1.00 . A A . 825 LYS HG2 1 1 18 13559 1 1 46 LYS HG3 H 11.929 -4.355 6.556 1.00 . A A . 825 LYS HG3 1 1 18 13560 1 1 46 LYS HZ1 H 15.239 -8.591 7.587 1.00 . A A . 825 LYS HZ1 1 1 18 13561 1 1 46 LYS HZ2 H 13.644 -8.753 7.037 1.00 . A A . 825 LYS HZ2 1 1 18 13562 1 1 46 LYS HZ3 H 13.944 -8.214 8.617 1.00 . A A . 825 LYS HZ3 1 1 18 13563 1 1 46 LYS N N 12.458 -2.679 4.336 1.00 . A A . 825 LYS N 1 1 18 13564 1 1 46 LYS NZ N 14.281 -8.180 7.631 1.00 . A A . 825 LYS NZ 1 1 18 13565 1 1 46 LYS O O 15.910 -3.166 3.713 1.00 . A A . 825 LYS O 1 1 18 13566 1 1 47 ARG C C 15.717 -2.185 0.908 1.00 . A A . 826 ARG C 1 1 18 13567 1 1 47 ARG CA C 14.971 -3.492 1.137 1.00 . A A . 826 ARG CA 1 1 18 13568 1 1 47 ARG CB C 14.091 -3.813 -0.076 1.00 . A A . 826 ARG CB 1 1 18 13569 1 1 47 ARG CD C 15.565 -5.621 -1.005 1.00 . A A . 826 ARG CD 1 1 18 13570 1 1 47 ARG CG C 14.869 -4.300 -1.290 1.00 . A A . 826 ARG CG 1 1 18 13571 1 1 47 ARG CZ C 16.869 -7.329 -2.214 1.00 . A A . 826 ARG CZ 1 1 18 13572 1 1 47 ARG H H 13.182 -3.514 2.275 1.00 . A A . 826 ARG H 1 1 18 13573 1 1 47 ARG HA H 15.667 -4.302 1.287 1.00 . A A . 826 ARG HA 1 1 18 13574 1 1 47 ARG HB2 H 13.384 -4.580 0.202 1.00 . A A . 826 ARG HB2 1 1 18 13575 1 1 47 ARG HB3 H 13.547 -2.923 -0.357 1.00 . A A . 826 ARG HB3 1 1 18 13576 1 1 47 ARG HD2 H 16.265 -5.476 -0.199 1.00 . A A . 826 ARG HD2 1 1 18 13577 1 1 47 ARG HD3 H 14.823 -6.348 -0.707 1.00 . A A . 826 ARG HD3 1 1 18 13578 1 1 47 ARG HE H 16.346 -5.547 -2.965 1.00 . A A . 826 ARG HE 1 1 18 13579 1 1 47 ARG HG2 H 14.185 -4.435 -2.115 1.00 . A A . 826 ARG HG2 1 1 18 13580 1 1 47 ARG HG3 H 15.611 -3.561 -1.551 1.00 . A A . 826 ARG HG3 1 1 18 13581 1 1 47 ARG HH11 H 16.359 -7.838 -0.324 1.00 . A A . 826 ARG HH11 1 1 18 13582 1 1 47 ARG HH12 H 17.256 -9.044 -1.195 1.00 . A A . 826 ARG HH12 1 1 18 13583 1 1 47 ARG HH21 H 17.548 -7.105 -4.108 1.00 . A A . 826 ARG HH21 1 1 18 13584 1 1 47 ARG HH22 H 17.946 -8.618 -3.353 1.00 . A A . 826 ARG HH22 1 1 18 13585 1 1 47 ARG N N 14.155 -3.396 2.340 1.00 . A A . 826 ARG N 1 1 18 13586 1 1 47 ARG NE N 16.288 -6.133 -2.168 1.00 . A A . 826 ARG NE 1 1 18 13587 1 1 47 ARG NH1 N 16.825 -8.131 -1.158 1.00 . A A . 826 ARG NH1 1 1 18 13588 1 1 47 ARG NH2 N 17.504 -7.715 -3.312 1.00 . A A . 826 ARG NH2 1 1 18 13589 1 1 47 ARG O O 16.800 -2.161 0.326 1.00 . A A . 826 ARG O 1 1 18 13590 1 1 48 TYR C C 16.620 0.466 2.531 1.00 . A A . 827 TYR C 1 1 18 13591 1 1 48 TYR CA C 15.750 0.211 1.293 1.00 . A A . 827 TYR CA 1 1 18 13592 1 1 48 TYR CB C 14.686 1.296 1.100 1.00 . A A . 827 TYR CB 1 1 18 13593 1 1 48 TYR CD1 C 15.760 2.874 -0.546 1.00 . A A . 827 TYR CD1 1 1 18 13594 1 1 48 TYR CD2 C 15.210 3.712 1.617 1.00 . A A . 827 TYR CD2 1 1 18 13595 1 1 48 TYR CE1 C 16.249 4.113 -0.904 1.00 . A A . 827 TYR CE1 1 1 18 13596 1 1 48 TYR CE2 C 15.699 4.953 1.266 1.00 . A A . 827 TYR CE2 1 1 18 13597 1 1 48 TYR CG C 15.233 2.652 0.717 1.00 . A A . 827 TYR CG 1 1 18 13598 1 1 48 TYR CZ C 16.218 5.147 0.005 1.00 . A A . 827 TYR CZ 1 1 18 13599 1 1 48 TYR H H 14.273 -1.190 1.864 1.00 . A A . 827 TYR H 1 1 18 13600 1 1 48 TYR HA H 16.419 0.184 0.445 1.00 . A A . 827 TYR HA 1 1 18 13601 1 1 48 TYR HB2 H 14.007 0.986 0.321 1.00 . A A . 827 TYR HB2 1 1 18 13602 1 1 48 TYR HB3 H 14.133 1.411 2.022 1.00 . A A . 827 TYR HB3 1 1 18 13603 1 1 48 TYR HD1 H 15.783 2.061 -1.256 1.00 . A A . 827 TYR HD1 1 1 18 13604 1 1 48 TYR HD2 H 14.802 3.553 2.604 1.00 . A A . 827 TYR HD2 1 1 18 13605 1 1 48 TYR HE1 H 16.654 4.267 -1.893 1.00 . A A . 827 TYR HE1 1 1 18 13606 1 1 48 TYR HE2 H 15.674 5.764 1.979 1.00 . A A . 827 TYR HE2 1 1 18 13607 1 1 48 TYR HH H 17.295 6.709 0.353 1.00 . A A . 827 TYR HH 1 1 18 13608 1 1 48 TYR N N 15.124 -1.097 1.383 1.00 . A A . 827 TYR N 1 1 18 13609 1 1 48 TYR O O 16.811 1.604 2.961 1.00 . A A . 827 TYR O 1 1 18 13610 1 1 48 TYR OH O 16.707 6.382 -0.352 1.00 . A A . 827 TYR OH 1 1 18 13611 1 1 49 ASN C C 19.476 -0.144 3.579 1.00 . A A . 828 ASN C 1 1 18 13612 1 1 49 ASN CA C 18.115 -0.463 4.189 1.00 . A A . 828 ASN CA 1 1 18 13613 1 1 49 ASN CB C 18.188 -1.715 5.091 1.00 . A A . 828 ASN CB 1 1 18 13614 1 1 49 ASN CG C 18.836 -2.946 4.455 1.00 . A A . 828 ASN CG 1 1 18 13615 1 1 49 ASN H H 16.800 -1.493 2.879 1.00 . A A . 828 ASN H 1 1 18 13616 1 1 49 ASN HA H 17.815 0.381 4.795 1.00 . A A . 828 ASN HA 1 1 18 13617 1 1 49 ASN HB2 H 18.752 -1.468 5.975 1.00 . A A . 828 ASN HB2 1 1 18 13618 1 1 49 ASN HB3 H 17.182 -1.981 5.386 1.00 . A A . 828 ASN HB3 1 1 18 13619 1 1 49 ASN HD21 H 18.191 -2.450 2.652 1.00 . A A . 828 ASN HD21 1 1 18 13620 1 1 49 ASN HD22 H 19.118 -3.904 2.742 1.00 . A A . 828 ASN HD22 1 1 18 13621 1 1 49 ASN N N 17.123 -0.602 3.130 1.00 . A A . 828 ASN N 1 1 18 13622 1 1 49 ASN ND2 N 18.699 -3.117 3.154 1.00 . A A . 828 ASN ND2 1 1 18 13623 1 1 49 ASN O O 19.808 -0.723 2.523 1.00 . A A . 828 ASN O 1 1 18 13624 1 1 49 ASN OXT O 20.191 0.715 4.132 1.00 . A A . 828 ASN OXT 1 1 18 13625 1 1 49 ASN OD1 O 19.447 -3.758 5.152 1.00 . A A . 828 ASN OD1 1 1 18 13626 2 2 1 ZN ZN ZN 7.655 -2.894 -2.941 1.00 . B A . 829 ZN ZN 1 1 19 13627 1 1 1 GLY C C -21.943 5.650 -3.740 1.00 . A A . 1 GLY C 1 1 19 13628 1 1 1 GLY CA C -23.307 5.910 -3.145 1.00 . A A . 1 GLY CA 1 1 19 13629 1 1 1 GLY H1 H -24.190 6.668 -4.874 1.00 . A A . 1 GLY H1 1 1 19 13630 1 1 1 GLY H2 H -23.479 7.849 -3.892 1.00 . A A . 1 GLY H2 1 1 19 13631 1 1 1 GLY H3 H -24.959 7.154 -3.443 1.00 . A A . 1 GLY H3 1 1 19 13632 1 1 1 GLY HA2 H -23.189 6.219 -2.118 1.00 . A A . 1 GLY HA2 1 1 19 13633 1 1 1 GLY HA3 H -23.883 4.996 -3.173 1.00 . A A . 1 GLY HA3 1 1 19 13634 1 1 1 GLY N N -24.036 6.965 -3.888 1.00 . A A . 1 GLY N 1 1 19 13635 1 1 1 GLY O O -21.170 6.585 -3.952 1.00 . A A . 1 GLY O 1 1 19 13636 1 1 2 THR C C -19.195 4.434 -3.784 1.00 . A A . 2 THR C 1 1 19 13637 1 1 2 THR CA C -20.391 3.992 -4.634 1.00 . A A . 2 THR CA 1 1 19 13638 1 1 2 THR CB C -20.283 4.565 -6.064 1.00 . A A . 2 THR CB 1 1 19 13639 1 1 2 THR CG2 C -19.068 4.011 -6.793 1.00 . A A . 2 THR CG2 1 1 19 13640 1 1 2 THR H H -22.305 3.680 -3.786 1.00 . A A . 2 THR H 1 1 19 13641 1 1 2 THR HA H -20.383 2.912 -4.706 1.00 . A A . 2 THR HA 1 1 19 13642 1 1 2 THR HB H -20.198 5.641 -6.005 1.00 . A A . 2 THR HB 1 1 19 13643 1 1 2 THR HG1 H -22.084 4.972 -6.781 1.00 . A A . 2 THR HG1 1 1 19 13644 1 1 2 THR HG21 H -19.159 2.939 -6.884 1.00 . A A . 2 THR HG21 1 1 19 13645 1 1 2 THR HG22 H -18.175 4.249 -6.233 1.00 . A A . 2 THR HG22 1 1 19 13646 1 1 2 THR HG23 H -19.004 4.453 -7.775 1.00 . A A . 2 THR HG23 1 1 19 13647 1 1 2 THR N N -21.649 4.381 -4.011 1.00 . A A . 2 THR N 1 1 19 13648 1 1 2 THR O O -18.401 5.295 -4.174 1.00 . A A . 2 THR O 1 1 19 13649 1 1 2 THR OG1 O -21.464 4.226 -6.804 1.00 . A A . 2 THR OG1 1 1 19 13650 1 1 3 ARG C C -17.004 2.912 -1.790 1.00 . A A . 3 ARG C 1 1 19 13651 1 1 3 ARG CA C -17.970 4.087 -1.711 1.00 . A A . 3 ARG CA 1 1 19 13652 1 1 3 ARG CB C -18.451 4.310 -0.275 1.00 . A A . 3 ARG CB 1 1 19 13653 1 1 3 ARG CD C -19.991 3.626 1.592 1.00 . A A . 3 ARG CD 1 1 19 13654 1 1 3 ARG CG C -19.417 3.247 0.233 1.00 . A A . 3 ARG CG 1 1 19 13655 1 1 3 ARG CZ C -21.823 5.281 1.717 1.00 . A A . 3 ARG CZ 1 1 19 13656 1 1 3 ARG H H -19.804 3.223 -2.321 1.00 . A A . 3 ARG H 1 1 19 13657 1 1 3 ARG HA H -17.461 4.975 -2.055 1.00 . A A . 3 ARG HA 1 1 19 13658 1 1 3 ARG HB2 H -17.593 4.322 0.380 1.00 . A A . 3 ARG HB2 1 1 19 13659 1 1 3 ARG HB3 H -18.945 5.267 -0.221 1.00 . A A . 3 ARG HB3 1 1 19 13660 1 1 3 ARG HD2 H -20.780 2.933 1.843 1.00 . A A . 3 ARG HD2 1 1 19 13661 1 1 3 ARG HD3 H -19.205 3.562 2.333 1.00 . A A . 3 ARG HD3 1 1 19 13662 1 1 3 ARG HE H -19.888 5.721 1.465 1.00 . A A . 3 ARG HE 1 1 19 13663 1 1 3 ARG HG2 H -20.226 3.143 -0.475 1.00 . A A . 3 ARG HG2 1 1 19 13664 1 1 3 ARG HG3 H -18.891 2.308 0.322 1.00 . A A . 3 ARG HG3 1 1 19 13665 1 1 3 ARG HH11 H -22.420 3.366 2.012 1.00 . A A . 3 ARG HH11 1 1 19 13666 1 1 3 ARG HH12 H -23.689 4.555 2.039 1.00 . A A . 3 ARG HH12 1 1 19 13667 1 1 3 ARG HH21 H -21.542 7.276 1.482 1.00 . A A . 3 ARG HH21 1 1 19 13668 1 1 3 ARG HH22 H -23.193 6.771 1.713 1.00 . A A . 3 ARG HH22 1 1 19 13669 1 1 3 ARG N N -19.098 3.847 -2.601 1.00 . A A . 3 ARG N 1 1 19 13670 1 1 3 ARG NE N -20.532 4.984 1.587 1.00 . A A . 3 ARG NE 1 1 19 13671 1 1 3 ARG NH1 N -22.714 4.325 1.940 1.00 . A A . 3 ARG NH1 1 1 19 13672 1 1 3 ARG NH2 N -22.219 6.541 1.636 1.00 . A A . 3 ARG NH2 1 1 19 13673 1 1 3 ARG O O -15.867 2.987 -1.332 1.00 . A A . 3 ARG O 1 1 19 13674 1 1 4 GLY C C -16.732 0.261 -4.090 1.00 . A A . 783 GLY C 1 1 19 13675 1 1 4 GLY CA C -16.643 0.678 -2.639 1.00 . A A . 783 GLY CA 1 1 19 13676 1 1 4 GLY H H -18.425 1.807 -2.652 1.00 . A A . 783 GLY H 1 1 19 13677 1 1 4 GLY HA2 H -15.618 0.925 -2.401 1.00 . A A . 783 GLY HA2 1 1 19 13678 1 1 4 GLY HA3 H -16.966 -0.141 -2.015 1.00 . A A . 783 GLY HA3 1 1 19 13679 1 1 4 GLY N N -17.480 1.829 -2.383 1.00 . A A . 783 GLY N 1 1 19 13680 1 1 4 GLY O O -17.399 -0.721 -4.424 1.00 . A A . 783 GLY O 1 1 19 13681 1 1 5 VAL C C -14.949 -0.087 -6.830 1.00 . A A . 784 VAL C 1 1 19 13682 1 1 5 VAL CA C -16.141 0.757 -6.387 1.00 . A A . 784 VAL CA 1 1 19 13683 1 1 5 VAL CB C -16.217 2.064 -7.217 1.00 . A A . 784 VAL CB 1 1 19 13684 1 1 5 VAL CG1 C -15.048 2.992 -6.911 1.00 . A A . 784 VAL CG1 1 1 19 13685 1 1 5 VAL CG2 C -16.281 1.753 -8.707 1.00 . A A . 784 VAL CG2 1 1 19 13686 1 1 5 VAL H H -15.557 1.777 -4.630 1.00 . A A . 784 VAL H 1 1 19 13687 1 1 5 VAL HA H -17.043 0.193 -6.575 1.00 . A A . 784 VAL HA 1 1 19 13688 1 1 5 VAL HB H -17.126 2.578 -6.945 1.00 . A A . 784 VAL HB 1 1 19 13689 1 1 5 VAL HG11 H -15.113 3.868 -7.541 1.00 . A A . 784 VAL HG11 1 1 19 13690 1 1 5 VAL HG12 H -14.118 2.479 -7.105 1.00 . A A . 784 VAL HG12 1 1 19 13691 1 1 5 VAL HG13 H -15.085 3.292 -5.874 1.00 . A A . 784 VAL HG13 1 1 19 13692 1 1 5 VAL HG21 H -16.351 2.676 -9.267 1.00 . A A . 784 VAL HG21 1 1 19 13693 1 1 5 VAL HG22 H -17.149 1.144 -8.910 1.00 . A A . 784 VAL HG22 1 1 19 13694 1 1 5 VAL HG23 H -15.390 1.220 -9.002 1.00 . A A . 784 VAL HG23 1 1 19 13695 1 1 5 VAL N N -16.088 1.024 -4.958 1.00 . A A . 784 VAL N 1 1 19 13696 1 1 5 VAL O O -13.793 0.304 -6.651 1.00 . A A . 784 VAL O 1 1 19 13697 1 1 6 ASP C C -13.151 -2.451 -6.859 1.00 . A A . 785 ASP C 1 1 19 13698 1 1 6 ASP CA C -14.246 -2.195 -7.884 1.00 . A A . 785 ASP CA 1 1 19 13699 1 1 6 ASP CB C -13.639 -1.692 -9.197 1.00 . A A . 785 ASP CB 1 1 19 13700 1 1 6 ASP CG C -14.535 -1.971 -10.387 1.00 . A A . 785 ASP CG 1 1 19 13701 1 1 6 ASP H H -16.205 -1.511 -7.461 1.00 . A A . 785 ASP H 1 1 19 13702 1 1 6 ASP HA H -14.749 -3.131 -8.078 1.00 . A A . 785 ASP HA 1 1 19 13703 1 1 6 ASP HB2 H -13.482 -0.625 -9.130 1.00 . A A . 785 ASP HB2 1 1 19 13704 1 1 6 ASP HB3 H -12.692 -2.183 -9.359 1.00 . A A . 785 ASP HB3 1 1 19 13705 1 1 6 ASP N N -15.256 -1.263 -7.382 1.00 . A A . 785 ASP N 1 1 19 13706 1 1 6 ASP O O -11.972 -2.560 -7.202 1.00 . A A . 785 ASP O 1 1 19 13707 1 1 6 ASP OD1 O -14.519 -3.105 -10.906 1.00 . A A . 785 ASP OD1 1 1 19 13708 1 1 6 ASP OD2 O -15.261 -1.048 -10.811 1.00 . A A . 785 ASP OD2 1 1 19 13709 1 1 7 SER C C -12.261 -4.287 -4.485 1.00 . A A . 786 SER C 1 1 19 13710 1 1 7 SER CA C -12.629 -2.807 -4.520 1.00 . A A . 786 SER CA 1 1 19 13711 1 1 7 SER CB C -13.270 -2.392 -3.194 1.00 . A A . 786 SER CB 1 1 19 13712 1 1 7 SER H H -14.501 -2.427 -5.399 1.00 . A A . 786 SER H 1 1 19 13713 1 1 7 SER HA H -11.739 -2.221 -4.686 1.00 . A A . 786 SER HA 1 1 19 13714 1 1 7 SER HB2 H -14.124 -3.022 -2.996 1.00 . A A . 786 SER HB2 1 1 19 13715 1 1 7 SER HB3 H -12.548 -2.504 -2.398 1.00 . A A . 786 SER HB3 1 1 19 13716 1 1 7 SER HG H -13.158 -0.517 -2.629 1.00 . A A . 786 SER HG 1 1 19 13717 1 1 7 SER N N -13.553 -2.543 -5.604 1.00 . A A . 786 SER N 1 1 19 13718 1 1 7 SER O O -13.138 -5.151 -4.400 1.00 . A A . 786 SER O 1 1 19 13719 1 1 7 SER OG O -13.699 -1.041 -3.234 1.00 . A A . 786 SER OG 1 1 19 13720 1 1 8 PRO C C -10.803 -6.477 -3.032 1.00 . A A . 787 PRO C 1 1 19 13721 1 1 8 PRO CA C -10.442 -5.952 -4.415 1.00 . A A . 787 PRO CA 1 1 19 13722 1 1 8 PRO CB C -8.924 -5.793 -4.548 1.00 . A A . 787 PRO CB 1 1 19 13723 1 1 8 PRO CD C -9.887 -3.636 -4.932 1.00 . A A . 787 PRO CD 1 1 19 13724 1 1 8 PRO CG C -8.727 -4.518 -5.291 1.00 . A A . 787 PRO CG 1 1 19 13725 1 1 8 PRO HA H -10.814 -6.627 -5.173 1.00 . A A . 787 PRO HA 1 1 19 13726 1 1 8 PRO HB2 H -8.477 -5.747 -3.567 1.00 . A A . 787 PRO HB2 1 1 19 13727 1 1 8 PRO HB3 H -8.519 -6.631 -5.095 1.00 . A A . 787 PRO HB3 1 1 19 13728 1 1 8 PRO HD2 H -9.642 -3.021 -4.077 1.00 . A A . 787 PRO HD2 1 1 19 13729 1 1 8 PRO HD3 H -10.168 -3.020 -5.772 1.00 . A A . 787 PRO HD3 1 1 19 13730 1 1 8 PRO HG2 H -7.799 -4.056 -4.986 1.00 . A A . 787 PRO HG2 1 1 19 13731 1 1 8 PRO HG3 H -8.719 -4.710 -6.354 1.00 . A A . 787 PRO HG3 1 1 19 13732 1 1 8 PRO N N -10.956 -4.593 -4.599 1.00 . A A . 787 PRO N 1 1 19 13733 1 1 8 PRO O O -11.373 -7.558 -2.885 1.00 . A A . 787 PRO O 1 1 19 13734 1 1 9 SER C C -12.077 -5.038 -0.357 1.00 . A A . 788 SER C 1 1 19 13735 1 1 9 SER CA C -10.902 -5.956 -0.668 1.00 . A A . 788 SER CA 1 1 19 13736 1 1 9 SER CB C -9.758 -5.727 0.325 1.00 . A A . 788 SER CB 1 1 19 13737 1 1 9 SER H H -9.870 -4.925 -2.192 1.00 . A A . 788 SER H 1 1 19 13738 1 1 9 SER HA H -11.229 -6.982 -0.608 1.00 . A A . 788 SER HA 1 1 19 13739 1 1 9 SER HB2 H -8.918 -6.349 0.055 1.00 . A A . 788 SER HB2 1 1 19 13740 1 1 9 SER HB3 H -9.460 -4.689 0.295 1.00 . A A . 788 SER HB3 1 1 19 13741 1 1 9 SER HG H -10.138 -7.013 1.760 1.00 . A A . 788 SER HG 1 1 19 13742 1 1 9 SER N N -10.455 -5.699 -2.021 1.00 . A A . 788 SER N 1 1 19 13743 1 1 9 SER O O -11.998 -3.824 -0.541 1.00 . A A . 788 SER O 1 1 19 13744 1 1 9 SER OG O -10.156 -6.049 1.647 1.00 . A A . 788 SER OG 1 1 19 13745 1 1 10 ALA C C -14.238 -3.789 1.345 1.00 . A A . 789 ALA C 1 1 19 13746 1 1 10 ALA CA C -14.413 -4.917 0.336 1.00 . A A . 789 ALA CA 1 1 19 13747 1 1 10 ALA CB C -15.496 -5.878 0.800 1.00 . A A . 789 ALA CB 1 1 19 13748 1 1 10 ALA H H -13.132 -6.601 0.290 1.00 . A A . 789 ALA H 1 1 19 13749 1 1 10 ALA HA H -14.729 -4.493 -0.606 1.00 . A A . 789 ALA HA 1 1 19 13750 1 1 10 ALA HB1 H -16.435 -5.350 0.879 1.00 . A A . 789 ALA HB1 1 1 19 13751 1 1 10 ALA HB2 H -15.228 -6.283 1.765 1.00 . A A . 789 ALA HB2 1 1 19 13752 1 1 10 ALA HB3 H -15.593 -6.682 0.086 1.00 . A A . 789 ALA HB3 1 1 19 13753 1 1 10 ALA N N -13.166 -5.636 0.102 1.00 . A A . 789 ALA N 1 1 19 13754 1 1 10 ALA O O -14.919 -2.768 1.263 1.00 . A A . 789 ALA O 1 1 19 13755 1 1 11 GLU C C -11.676 -2.374 3.214 1.00 . A A . 790 GLU C 1 1 19 13756 1 1 11 GLU CA C -13.084 -2.958 3.306 1.00 . A A . 790 GLU CA 1 1 19 13757 1 1 11 GLU CB C -13.307 -3.519 4.704 1.00 . A A . 790 GLU CB 1 1 19 13758 1 1 11 GLU CD C -15.764 -2.912 4.853 1.00 . A A . 790 GLU CD 1 1 19 13759 1 1 11 GLU CG C -14.723 -4.012 4.963 1.00 . A A . 790 GLU CG 1 1 19 13760 1 1 11 GLU H H -12.823 -4.819 2.319 1.00 . A A . 790 GLU H 1 1 19 13761 1 1 11 GLU HA H -13.793 -2.160 3.140 1.00 . A A . 790 GLU HA 1 1 19 13762 1 1 11 GLU HB2 H -12.628 -4.344 4.860 1.00 . A A . 790 GLU HB2 1 1 19 13763 1 1 11 GLU HB3 H -13.084 -2.740 5.417 1.00 . A A . 790 GLU HB3 1 1 19 13764 1 1 11 GLU HG2 H -14.960 -4.780 4.242 1.00 . A A . 790 GLU HG2 1 1 19 13765 1 1 11 GLU HG3 H -14.766 -4.430 5.957 1.00 . A A . 790 GLU HG3 1 1 19 13766 1 1 11 GLU N N -13.327 -3.973 2.292 1.00 . A A . 790 GLU N 1 1 19 13767 1 1 11 GLU O O -11.483 -1.176 3.430 1.00 . A A . 790 GLU O 1 1 19 13768 1 1 11 GLU OE1 O -15.821 -2.041 5.753 1.00 . A A . 790 GLU OE1 1 1 19 13769 1 1 11 GLU OE2 O -16.524 -2.908 3.862 1.00 . A A . 790 GLU OE2 1 1 19 13770 1 1 12 LEU C C -9.065 -1.888 1.596 1.00 . A A . 791 LEU C 1 1 19 13771 1 1 12 LEU CA C -9.304 -2.718 2.844 1.00 . A A . 791 LEU CA 1 1 19 13772 1 1 12 LEU CB C -8.300 -3.870 2.925 1.00 . A A . 791 LEU CB 1 1 19 13773 1 1 12 LEU CD1 C -7.304 -5.791 4.191 1.00 . A A . 791 LEU CD1 1 1 19 13774 1 1 12 LEU CD2 C -8.106 -3.772 5.427 1.00 . A A . 791 LEU CD2 1 1 19 13775 1 1 12 LEU CG C -8.336 -4.676 4.224 1.00 . A A . 791 LEU CG 1 1 19 13776 1 1 12 LEU H H -10.878 -4.143 2.692 1.00 . A A . 791 LEU H 1 1 19 13777 1 1 12 LEU HA H -9.171 -2.080 3.694 1.00 . A A . 791 LEU HA 1 1 19 13778 1 1 12 LEU HB2 H -8.493 -4.546 2.103 1.00 . A A . 791 LEU HB2 1 1 19 13779 1 1 12 LEU HB3 H -7.307 -3.463 2.808 1.00 . A A . 791 LEU HB3 1 1 19 13780 1 1 12 LEU HD11 H -7.323 -6.327 5.129 1.00 . A A . 791 LEU HD11 1 1 19 13781 1 1 12 LEU HD12 H -6.322 -5.368 4.036 1.00 . A A . 791 LEU HD12 1 1 19 13782 1 1 12 LEU HD13 H -7.536 -6.470 3.385 1.00 . A A . 791 LEU HD13 1 1 19 13783 1 1 12 LEU HD21 H -8.147 -4.362 6.331 1.00 . A A . 791 LEU HD21 1 1 19 13784 1 1 12 LEU HD22 H -8.874 -3.014 5.458 1.00 . A A . 791 LEU HD22 1 1 19 13785 1 1 12 LEU HD23 H -7.137 -3.302 5.345 1.00 . A A . 791 LEU HD23 1 1 19 13786 1 1 12 LEU HG H -9.310 -5.129 4.329 1.00 . A A . 791 LEU HG 1 1 19 13787 1 1 12 LEU N N -10.684 -3.201 2.895 1.00 . A A . 791 LEU N 1 1 19 13788 1 1 12 LEU O O -8.080 -1.158 1.489 1.00 . A A . 791 LEU O 1 1 19 13789 1 1 13 ASP C C -11.240 -0.339 -0.582 1.00 . A A . 792 ASP C 1 1 19 13790 1 1 13 ASP CA C -9.980 -1.183 -0.541 1.00 . A A . 792 ASP CA 1 1 19 13791 1 1 13 ASP CB C -9.888 -2.032 -1.812 1.00 . A A . 792 ASP CB 1 1 19 13792 1 1 13 ASP CG C -8.508 -2.600 -2.044 1.00 . A A . 792 ASP CG 1 1 19 13793 1 1 13 ASP H H -10.709 -2.644 0.803 1.00 . A A . 792 ASP H 1 1 19 13794 1 1 13 ASP HA H -9.124 -0.526 -0.491 1.00 . A A . 792 ASP HA 1 1 19 13795 1 1 13 ASP HB2 H -10.584 -2.853 -1.736 1.00 . A A . 792 ASP HB2 1 1 19 13796 1 1 13 ASP HB3 H -10.153 -1.422 -2.664 1.00 . A A . 792 ASP HB3 1 1 19 13797 1 1 13 ASP N N -9.988 -1.999 0.666 1.00 . A A . 792 ASP N 1 1 19 13798 1 1 13 ASP O O -11.654 0.150 -1.635 1.00 . A A . 792 ASP O 1 1 19 13799 1 1 13 ASP OD1 O -7.631 -1.859 -2.535 1.00 . A A . 792 ASP OD1 1 1 19 13800 1 1 13 ASP OD2 O -8.301 -3.796 -1.757 1.00 . A A . 792 ASP OD2 1 1 19 13801 1 1 14 LYS C C -12.606 2.110 0.623 1.00 . A A . 793 LYS C 1 1 19 13802 1 1 14 LYS CA C -13.030 0.652 0.726 1.00 . A A . 793 LYS CA 1 1 19 13803 1 1 14 LYS CB C -13.708 0.396 2.071 1.00 . A A . 793 LYS CB 1 1 19 13804 1 1 14 LYS CD C -15.735 0.638 3.517 1.00 . A A . 793 LYS CD 1 1 19 13805 1 1 14 LYS CE C -17.253 0.596 3.521 1.00 . A A . 793 LYS CE 1 1 19 13806 1 1 14 LYS CG C -15.176 0.782 2.112 1.00 . A A . 793 LYS CG 1 1 19 13807 1 1 14 LYS H H -11.505 -0.650 1.373 1.00 . A A . 793 LYS H 1 1 19 13808 1 1 14 LYS HA H -13.708 0.413 -0.071 1.00 . A A . 793 LYS HA 1 1 19 13809 1 1 14 LYS HB2 H -13.630 -0.655 2.306 1.00 . A A . 793 LYS HB2 1 1 19 13810 1 1 14 LYS HB3 H -13.191 0.961 2.834 1.00 . A A . 793 LYS HB3 1 1 19 13811 1 1 14 LYS HD2 H -15.360 -0.279 3.947 1.00 . A A . 793 LYS HD2 1 1 19 13812 1 1 14 LYS HD3 H -15.404 1.478 4.110 1.00 . A A . 793 LYS HD3 1 1 19 13813 1 1 14 LYS HE2 H -17.599 0.639 4.543 1.00 . A A . 793 LYS HE2 1 1 19 13814 1 1 14 LYS HE3 H -17.627 1.450 2.977 1.00 . A A . 793 LYS HE3 1 1 19 13815 1 1 14 LYS HG2 H -15.282 1.810 1.793 1.00 . A A . 793 LYS HG2 1 1 19 13816 1 1 14 LYS HG3 H -15.729 0.136 1.444 1.00 . A A . 793 LYS HG3 1 1 19 13817 1 1 14 LYS HZ1 H -17.367 -1.489 3.363 1.00 . A A . 793 LYS HZ1 1 1 19 13818 1 1 14 LYS HZ2 H -17.502 -0.676 1.882 1.00 . A A . 793 LYS HZ2 1 1 19 13819 1 1 14 LYS HZ3 H -18.809 -0.685 2.955 1.00 . A A . 793 LYS HZ3 1 1 19 13820 1 1 14 LYS N N -11.853 -0.184 0.586 1.00 . A A . 793 LYS N 1 1 19 13821 1 1 14 LYS NZ N -17.769 -0.648 2.885 1.00 . A A . 793 LYS NZ 1 1 19 13822 1 1 14 LYS O O -13.376 2.977 0.230 1.00 . A A . 793 LYS O 1 1 19 13823 1 1 15 LYS C C -10.361 4.045 -0.478 1.00 . A A . 794 LYS C 1 1 19 13824 1 1 15 LYS CA C -10.784 3.686 0.945 1.00 . A A . 794 LYS CA 1 1 19 13825 1 1 15 LYS CB C -9.575 3.781 1.879 1.00 . A A . 794 LYS CB 1 1 19 13826 1 1 15 LYS CD C -10.922 4.089 3.993 1.00 . A A . 794 LYS CD 1 1 19 13827 1 1 15 LYS CE C -10.520 5.545 4.173 1.00 . A A . 794 LYS CE 1 1 19 13828 1 1 15 LYS CG C -9.838 3.283 3.293 1.00 . A A . 794 LYS CG 1 1 19 13829 1 1 15 LYS H H -10.810 1.615 1.316 1.00 . A A . 794 LYS H 1 1 19 13830 1 1 15 LYS HA H -11.538 4.381 1.273 1.00 . A A . 794 LYS HA 1 1 19 13831 1 1 15 LYS HB2 H -8.769 3.192 1.461 1.00 . A A . 794 LYS HB2 1 1 19 13832 1 1 15 LYS HB3 H -9.260 4.812 1.935 1.00 . A A . 794 LYS HB3 1 1 19 13833 1 1 15 LYS HD2 H -11.825 4.050 3.402 1.00 . A A . 794 LYS HD2 1 1 19 13834 1 1 15 LYS HD3 H -11.107 3.654 4.964 1.00 . A A . 794 LYS HD3 1 1 19 13835 1 1 15 LYS HE2 H -9.594 5.584 4.727 1.00 . A A . 794 LYS HE2 1 1 19 13836 1 1 15 LYS HE3 H -10.376 5.989 3.199 1.00 . A A . 794 LYS HE3 1 1 19 13837 1 1 15 LYS HG2 H -10.150 2.251 3.246 1.00 . A A . 794 LYS HG2 1 1 19 13838 1 1 15 LYS HG3 H -8.925 3.357 3.864 1.00 . A A . 794 LYS HG3 1 1 19 13839 1 1 15 LYS HZ1 H -12.478 6.230 4.428 1.00 . A A . 794 LYS HZ1 1 1 19 13840 1 1 15 LYS HZ2 H -11.293 7.320 4.958 1.00 . A A . 794 LYS HZ2 1 1 19 13841 1 1 15 LYS HZ3 H -11.649 5.944 5.881 1.00 . A A . 794 LYS HZ3 1 1 19 13842 1 1 15 LYS N N -11.356 2.355 0.994 1.00 . A A . 794 LYS N 1 1 19 13843 1 1 15 LYS NZ N -11.556 6.314 4.910 1.00 . A A . 794 LYS NZ 1 1 19 13844 1 1 15 LYS O O -10.609 5.153 -0.948 1.00 . A A . 794 LYS O 1 1 19 13845 1 1 16 ALA C C -8.021 4.153 -2.650 1.00 . A A . 795 ALA C 1 1 19 13846 1 1 16 ALA CA C -9.228 3.226 -2.523 1.00 . A A . 795 ALA CA 1 1 19 13847 1 1 16 ALA CB C -10.358 3.676 -3.441 1.00 . A A . 795 ALA CB 1 1 19 13848 1 1 16 ALA H H -9.475 2.262 -0.657 1.00 . A A . 795 ALA H 1 1 19 13849 1 1 16 ALA HA H -8.922 2.240 -2.848 1.00 . A A . 795 ALA HA 1 1 19 13850 1 1 16 ALA HB1 H -10.666 4.676 -3.170 1.00 . A A . 795 ALA HB1 1 1 19 13851 1 1 16 ALA HB2 H -11.195 3.001 -3.339 1.00 . A A . 795 ALA HB2 1 1 19 13852 1 1 16 ALA HB3 H -10.012 3.669 -4.463 1.00 . A A . 795 ALA HB3 1 1 19 13853 1 1 16 ALA N N -9.676 3.094 -1.129 1.00 . A A . 795 ALA N 1 1 19 13854 1 1 16 ALA O O -7.533 4.401 -3.752 1.00 . A A . 795 ALA O 1 1 19 13855 1 1 17 ASN C C -5.080 4.741 -1.697 1.00 . A A . 796 ASN C 1 1 19 13856 1 1 17 ASN CA C -6.373 5.535 -1.491 1.00 . A A . 796 ASN CA 1 1 19 13857 1 1 17 ASN CB C -6.322 6.347 -0.175 1.00 . A A . 796 ASN CB 1 1 19 13858 1 1 17 ASN CG C -6.126 5.525 1.108 1.00 . A A . 796 ASN CG 1 1 19 13859 1 1 17 ASN H H -8.023 4.479 -0.685 1.00 . A A . 796 ASN H 1 1 19 13860 1 1 17 ASN HA H -6.476 6.229 -2.313 1.00 . A A . 796 ASN HA 1 1 19 13861 1 1 17 ASN HB2 H -5.508 7.052 -0.239 1.00 . A A . 796 ASN HB2 1 1 19 13862 1 1 17 ASN HB3 H -7.247 6.900 -0.080 1.00 . A A . 796 ASN HB3 1 1 19 13863 1 1 17 ASN HD21 H -6.817 3.867 0.258 1.00 . A A . 796 ASN HD21 1 1 19 13864 1 1 17 ASN HD22 H -6.358 3.725 1.912 1.00 . A A . 796 ASN HD22 1 1 19 13865 1 1 17 ASN N N -7.547 4.661 -1.517 1.00 . A A . 796 ASN N 1 1 19 13866 1 1 17 ASN ND2 N -6.468 4.241 1.090 1.00 . A A . 796 ASN ND2 1 1 19 13867 1 1 17 ASN O O -4.446 4.279 -0.746 1.00 . A A . 796 ASN O 1 1 19 13868 1 1 17 ASN OD1 O -5.633 6.045 2.111 1.00 . A A . 796 ASN OD1 1 1 19 13869 1 1 18 LEU C C -2.357 4.728 -3.635 1.00 . A A . 797 LEU C 1 1 19 13870 1 1 18 LEU CA C -3.500 3.798 -3.252 1.00 . A A . 797 LEU CA 1 1 19 13871 1 1 18 LEU CB C -3.770 2.833 -4.406 1.00 . A A . 797 LEU CB 1 1 19 13872 1 1 18 LEU CD1 C -5.278 1.240 -5.604 1.00 . A A . 797 LEU CD1 1 1 19 13873 1 1 18 LEU CD2 C -5.175 1.196 -3.120 1.00 . A A . 797 LEU CD2 1 1 19 13874 1 1 18 LEU CG C -5.100 2.078 -4.351 1.00 . A A . 797 LEU CG 1 1 19 13875 1 1 18 LEU H H -5.149 5.001 -3.689 1.00 . A A . 797 LEU H 1 1 19 13876 1 1 18 LEU HA H -3.234 3.237 -2.369 1.00 . A A . 797 LEU HA 1 1 19 13877 1 1 18 LEU HB2 H -3.741 3.399 -5.320 1.00 . A A . 797 LEU HB2 1 1 19 13878 1 1 18 LEU HB3 H -2.972 2.107 -4.431 1.00 . A A . 797 LEU HB3 1 1 19 13879 1 1 18 LEU HD11 H -4.498 0.493 -5.648 1.00 . A A . 797 LEU HD11 1 1 19 13880 1 1 18 LEU HD12 H -5.218 1.875 -6.475 1.00 . A A . 797 LEU HD12 1 1 19 13881 1 1 18 LEU HD13 H -6.241 0.754 -5.575 1.00 . A A . 797 LEU HD13 1 1 19 13882 1 1 18 LEU HD21 H -6.124 0.681 -3.107 1.00 . A A . 797 LEU HD21 1 1 19 13883 1 1 18 LEU HD22 H -5.082 1.806 -2.234 1.00 . A A . 797 LEU HD22 1 1 19 13884 1 1 18 LEU HD23 H -4.372 0.473 -3.148 1.00 . A A . 797 LEU HD23 1 1 19 13885 1 1 18 LEU HG H -5.909 2.792 -4.305 1.00 . A A . 797 LEU HG 1 1 19 13886 1 1 18 LEU N N -4.684 4.569 -2.947 1.00 . A A . 797 LEU N 1 1 19 13887 1 1 18 LEU O O -2.570 5.794 -4.219 1.00 . A A . 797 LEU O 1 1 19 13888 1 1 19 LEU C C 1.122 3.905 -3.792 1.00 . A A . 798 LEU C 1 1 19 13889 1 1 19 LEU CA C 0.063 4.983 -3.721 1.00 . A A . 798 LEU CA 1 1 19 13890 1 1 19 LEU CB C 0.417 6.175 -2.791 1.00 . A A . 798 LEU CB 1 1 19 13891 1 1 19 LEU CD1 C 0.253 4.767 -0.674 1.00 . A A . 798 LEU CD1 1 1 19 13892 1 1 19 LEU CD2 C 2.477 5.606 -1.487 1.00 . A A . 798 LEU CD2 1 1 19 13893 1 1 19 LEU CG C 0.992 5.887 -1.391 1.00 . A A . 798 LEU CG 1 1 19 13894 1 1 19 LEU H H -1.079 3.496 -2.759 1.00 . A A . 798 LEU H 1 1 19 13895 1 1 19 LEU HA H -0.078 5.351 -4.723 1.00 . A A . 798 LEU HA 1 1 19 13896 1 1 19 LEU HB2 H 1.137 6.788 -3.311 1.00 . A A . 798 LEU HB2 1 1 19 13897 1 1 19 LEU HB3 H -0.481 6.760 -2.661 1.00 . A A . 798 LEU HB3 1 1 19 13898 1 1 19 LEU HD11 H 0.689 4.616 0.302 1.00 . A A . 798 LEU HD11 1 1 19 13899 1 1 19 LEU HD12 H 0.335 3.856 -1.249 1.00 . A A . 798 LEU HD12 1 1 19 13900 1 1 19 LEU HD13 H -0.787 5.034 -0.567 1.00 . A A . 798 LEU HD13 1 1 19 13901 1 1 19 LEU HD21 H 2.644 4.845 -2.237 1.00 . A A . 798 LEU HD21 1 1 19 13902 1 1 19 LEU HD22 H 2.840 5.261 -0.531 1.00 . A A . 798 LEU HD22 1 1 19 13903 1 1 19 LEU HD23 H 2.996 6.509 -1.768 1.00 . A A . 798 LEU HD23 1 1 19 13904 1 1 19 LEU HG H 0.875 6.778 -0.790 1.00 . A A . 798 LEU HG 1 1 19 13905 1 1 19 LEU N N -1.158 4.313 -3.303 1.00 . A A . 798 LEU N 1 1 19 13906 1 1 19 LEU O O 0.830 2.767 -3.414 1.00 . A A . 798 LEU O 1 1 19 13907 1 1 20 LYS C C 4.592 3.196 -4.000 1.00 . A A . 799 LYS C 1 1 19 13908 1 1 20 LYS CA C 3.190 3.064 -4.563 1.00 . A A . 799 LYS CA 1 1 19 13909 1 1 20 LYS CB C 3.238 2.747 -6.062 1.00 . A A . 799 LYS CB 1 1 19 13910 1 1 20 LYS CD C 3.116 4.984 -7.223 1.00 . A A . 799 LYS CD 1 1 19 13911 1 1 20 LYS CE C 3.797 5.908 -8.218 1.00 . A A . 799 LYS CE 1 1 19 13912 1 1 20 LYS CG C 3.976 3.774 -6.913 1.00 . A A . 799 LYS CG 1 1 19 13913 1 1 20 LYS H H 2.616 5.118 -4.394 1.00 . A A . 799 LYS H 1 1 19 13914 1 1 20 LYS HA H 2.731 2.244 -4.039 1.00 . A A . 799 LYS HA 1 1 19 13915 1 1 20 LYS HB2 H 3.725 1.793 -6.197 1.00 . A A . 799 LYS HB2 1 1 19 13916 1 1 20 LYS HB3 H 2.224 2.675 -6.428 1.00 . A A . 799 LYS HB3 1 1 19 13917 1 1 20 LYS HD2 H 2.180 4.649 -7.642 1.00 . A A . 799 LYS HD2 1 1 19 13918 1 1 20 LYS HD3 H 2.929 5.528 -6.306 1.00 . A A . 799 LYS HD3 1 1 19 13919 1 1 20 LYS HE2 H 4.661 6.351 -7.746 1.00 . A A . 799 LYS HE2 1 1 19 13920 1 1 20 LYS HE3 H 4.113 5.328 -9.073 1.00 . A A . 799 LYS HE3 1 1 19 13921 1 1 20 LYS HG2 H 4.856 4.100 -6.376 1.00 . A A . 799 LYS HG2 1 1 19 13922 1 1 20 LYS HG3 H 4.275 3.306 -7.840 1.00 . A A . 799 LYS HG3 1 1 19 13923 1 1 20 LYS HZ1 H 2.598 7.586 -7.874 1.00 . A A . 799 LYS HZ1 1 1 19 13924 1 1 20 LYS HZ2 H 2.042 6.582 -9.123 1.00 . A A . 799 LYS HZ2 1 1 19 13925 1 1 20 LYS HZ3 H 3.380 7.591 -9.381 1.00 . A A . 799 LYS HZ3 1 1 19 13926 1 1 20 LYS N N 2.319 4.186 -4.276 1.00 . A A . 799 LYS N 1 1 19 13927 1 1 20 LYS NZ N 2.892 6.992 -8.679 1.00 . A A . 799 LYS NZ 1 1 19 13928 1 1 20 LYS O O 5.176 4.276 -3.908 1.00 . A A . 799 LYS O 1 1 19 13929 1 1 21 CYS C C 7.474 2.429 -3.927 1.00 . A A . 800 CYS C 1 1 19 13930 1 1 21 CYS CA C 6.392 1.771 -3.076 1.00 . A A . 800 CYS CA 1 1 19 13931 1 1 21 CYS CB C 6.516 0.241 -3.092 1.00 . A A . 800 CYS CB 1 1 19 13932 1 1 21 CYS H H 4.468 1.251 -3.655 1.00 . A A . 800 CYS H 1 1 19 13933 1 1 21 CYS HA H 6.441 2.129 -2.061 1.00 . A A . 800 CYS HA 1 1 19 13934 1 1 21 CYS HB2 H 5.740 -0.170 -2.466 1.00 . A A . 800 CYS HB2 1 1 19 13935 1 1 21 CYS HB3 H 6.346 -0.098 -4.107 1.00 . A A . 800 CYS HB3 1 1 19 13936 1 1 21 CYS N N 5.070 2.022 -3.608 1.00 . A A . 800 CYS N 1 1 19 13937 1 1 21 CYS O O 7.685 2.034 -5.066 1.00 . A A . 800 CYS O 1 1 19 13938 1 1 21 CYS SG S 8.054 -0.515 -2.537 1.00 . A A . 800 CYS SG 1 1 19 13939 1 1 22 GLU C C 10.444 3.193 -4.352 1.00 . A A . 801 GLU C 1 1 19 13940 1 1 22 GLU CA C 9.258 4.123 -4.060 1.00 . A A . 801 GLU CA 1 1 19 13941 1 1 22 GLU CB C 9.733 5.327 -3.243 1.00 . A A . 801 GLU CB 1 1 19 13942 1 1 22 GLU CD C 9.282 7.698 -2.504 1.00 . A A . 801 GLU CD 1 1 19 13943 1 1 22 GLU CG C 8.748 6.488 -3.236 1.00 . A A . 801 GLU CG 1 1 19 13944 1 1 22 GLU H H 7.860 3.786 -2.497 1.00 . A A . 801 GLU H 1 1 19 13945 1 1 22 GLU HA H 8.890 4.482 -5.010 1.00 . A A . 801 GLU HA 1 1 19 13946 1 1 22 GLU HB2 H 9.896 5.013 -2.222 1.00 . A A . 801 GLU HB2 1 1 19 13947 1 1 22 GLU HB3 H 10.669 5.679 -3.654 1.00 . A A . 801 GLU HB3 1 1 19 13948 1 1 22 GLU HG2 H 8.534 6.769 -4.256 1.00 . A A . 801 GLU HG2 1 1 19 13949 1 1 22 GLU HG3 H 7.837 6.167 -2.752 1.00 . A A . 801 GLU HG3 1 1 19 13950 1 1 22 GLU N N 8.146 3.443 -3.374 1.00 . A A . 801 GLU N 1 1 19 13951 1 1 22 GLU O O 11.539 3.657 -4.676 1.00 . A A . 801 GLU O 1 1 19 13952 1 1 22 GLU OE1 O 10.422 8.123 -2.799 1.00 . A A . 801 GLU OE1 1 1 19 13953 1 1 22 GLU OE2 O 8.575 8.222 -1.613 1.00 . A A . 801 GLU OE2 1 1 19 13954 1 1 23 TYR C C 10.667 0.240 -5.948 1.00 . A A . 802 TYR C 1 1 19 13955 1 1 23 TYR CA C 11.210 0.929 -4.688 1.00 . A A . 802 TYR CA 1 1 19 13956 1 1 23 TYR CB C 11.543 -0.084 -3.577 1.00 . A A . 802 TYR CB 1 1 19 13957 1 1 23 TYR CD1 C 14.059 -0.307 -3.541 1.00 . A A . 802 TYR CD1 1 1 19 13958 1 1 23 TYR CD2 C 12.779 -2.170 -4.285 1.00 . A A . 802 TYR CD2 1 1 19 13959 1 1 23 TYR CE1 C 15.225 -1.024 -3.738 1.00 . A A . 802 TYR CE1 1 1 19 13960 1 1 23 TYR CE2 C 13.940 -2.894 -4.483 1.00 . A A . 802 TYR CE2 1 1 19 13961 1 1 23 TYR CG C 12.818 -0.868 -3.811 1.00 . A A . 802 TYR CG 1 1 19 13962 1 1 23 TYR CZ C 15.159 -2.318 -4.208 1.00 . A A . 802 TYR CZ 1 1 19 13963 1 1 23 TYR H H 9.393 1.581 -3.842 1.00 . A A . 802 TYR H 1 1 19 13964 1 1 23 TYR HA H 12.105 1.472 -4.955 1.00 . A A . 802 TYR HA 1 1 19 13965 1 1 23 TYR HB2 H 11.654 0.445 -2.641 1.00 . A A . 802 TYR HB2 1 1 19 13966 1 1 23 TYR HB3 H 10.731 -0.789 -3.487 1.00 . A A . 802 TYR HB3 1 1 19 13967 1 1 23 TYR HD1 H 14.107 0.708 -3.172 1.00 . A A . 802 TYR HD1 1 1 19 13968 1 1 23 TYR HD2 H 11.823 -2.622 -4.501 1.00 . A A . 802 TYR HD2 1 1 19 13969 1 1 23 TYR HE1 H 16.180 -0.569 -3.522 1.00 . A A . 802 TYR HE1 1 1 19 13970 1 1 23 TYR HE2 H 13.887 -3.906 -4.854 1.00 . A A . 802 TYR HE2 1 1 19 13971 1 1 23 TYR HH H 16.905 -2.905 -3.649 1.00 . A A . 802 TYR HH 1 1 19 13972 1 1 23 TYR N N 10.234 1.894 -4.231 1.00 . A A . 802 TYR N 1 1 19 13973 1 1 23 TYR O O 10.924 0.692 -7.062 1.00 . A A . 802 TYR O 1 1 19 13974 1 1 23 TYR OH O 16.317 -3.041 -4.401 1.00 . A A . 802 TYR OH 1 1 19 13975 1 1 24 CYS C C 8.252 -0.694 -7.616 1.00 . A A . 803 CYS C 1 1 19 13976 1 1 24 CYS CA C 9.283 -1.550 -6.884 1.00 . A A . 803 CYS CA 1 1 19 13977 1 1 24 CYS CB C 8.633 -2.829 -6.374 1.00 . A A . 803 CYS CB 1 1 19 13978 1 1 24 CYS H H 9.923 -1.269 -4.884 1.00 . A A . 803 CYS H 1 1 19 13979 1 1 24 CYS HA H 10.041 -1.802 -7.611 1.00 . A A . 803 CYS HA 1 1 19 13980 1 1 24 CYS HB2 H 8.017 -3.254 -7.155 1.00 . A A . 803 CYS HB2 1 1 19 13981 1 1 24 CYS HB3 H 9.403 -3.537 -6.100 1.00 . A A . 803 CYS HB3 1 1 19 13982 1 1 24 CYS N N 9.924 -0.849 -5.764 1.00 . A A . 803 CYS N 1 1 19 13983 1 1 24 CYS O O 8.192 -0.698 -8.846 1.00 . A A . 803 CYS O 1 1 19 13984 1 1 24 CYS SG S 7.584 -2.560 -4.921 1.00 . A A . 803 CYS SG 1 1 19 13985 1 1 25 GLY C C 5.120 0.297 -7.660 1.00 . A A . 804 GLY C 1 1 19 13986 1 1 25 GLY CA C 6.484 0.919 -7.495 1.00 . A A . 804 GLY CA 1 1 19 13987 1 1 25 GLY H H 7.512 -0.029 -5.894 1.00 . A A . 804 GLY H 1 1 19 13988 1 1 25 GLY HA2 H 6.389 1.806 -6.888 1.00 . A A . 804 GLY HA2 1 1 19 13989 1 1 25 GLY HA3 H 6.857 1.201 -8.468 1.00 . A A . 804 GLY HA3 1 1 19 13990 1 1 25 GLY N N 7.440 0.024 -6.872 1.00 . A A . 804 GLY N 1 1 19 13991 1 1 25 GLY O O 4.344 0.714 -8.517 1.00 . A A . 804 GLY O 1 1 19 13992 1 1 26 LYS C C 2.507 -0.538 -6.065 1.00 . A A . 805 LYS C 1 1 19 13993 1 1 26 LYS CA C 3.515 -1.333 -6.884 1.00 . A A . 805 LYS CA 1 1 19 13994 1 1 26 LYS CB C 3.613 -2.776 -6.386 1.00 . A A . 805 LYS CB 1 1 19 13995 1 1 26 LYS CD C 2.369 -4.805 -5.564 1.00 . A A . 805 LYS CD 1 1 19 13996 1 1 26 LYS CE C 3.440 -5.215 -4.567 1.00 . A A . 805 LYS CE 1 1 19 13997 1 1 26 LYS CG C 2.328 -3.301 -5.772 1.00 . A A . 805 LYS CG 1 1 19 13998 1 1 26 LYS H H 5.458 -0.972 -6.157 1.00 . A A . 805 LYS H 1 1 19 13999 1 1 26 LYS HA H 3.182 -1.342 -7.913 1.00 . A A . 805 LYS HA 1 1 19 14000 1 1 26 LYS HB2 H 3.864 -3.408 -7.221 1.00 . A A . 805 LYS HB2 1 1 19 14001 1 1 26 LYS HB3 H 4.396 -2.841 -5.645 1.00 . A A . 805 LYS HB3 1 1 19 14002 1 1 26 LYS HD2 H 1.409 -5.131 -5.195 1.00 . A A . 805 LYS HD2 1 1 19 14003 1 1 26 LYS HD3 H 2.572 -5.282 -6.511 1.00 . A A . 805 LYS HD3 1 1 19 14004 1 1 26 LYS HE2 H 4.406 -4.912 -4.946 1.00 . A A . 805 LYS HE2 1 1 19 14005 1 1 26 LYS HE3 H 3.249 -4.722 -3.627 1.00 . A A . 805 LYS HE3 1 1 19 14006 1 1 26 LYS HG2 H 2.186 -2.818 -4.817 1.00 . A A . 805 LYS HG2 1 1 19 14007 1 1 26 LYS HG3 H 1.503 -3.058 -6.427 1.00 . A A . 805 LYS HG3 1 1 19 14008 1 1 26 LYS HZ1 H 2.532 -6.992 -3.941 1.00 . A A . 805 LYS HZ1 1 1 19 14009 1 1 26 LYS HZ2 H 4.207 -6.952 -3.695 1.00 . A A . 805 LYS HZ2 1 1 19 14010 1 1 26 LYS HZ3 H 3.590 -7.181 -5.256 1.00 . A A . 805 LYS HZ3 1 1 19 14011 1 1 26 LYS N N 4.818 -0.695 -6.843 1.00 . A A . 805 LYS N 1 1 19 14012 1 1 26 LYS NZ N 3.444 -6.685 -4.350 1.00 . A A . 805 LYS NZ 1 1 19 14013 1 1 26 LYS O O 2.825 -0.049 -4.978 1.00 . A A . 805 LYS O 1 1 19 14014 1 1 27 TYR C C -0.466 -0.464 -4.878 1.00 . A A . 806 TYR C 1 1 19 14015 1 1 27 TYR CA C 0.232 0.340 -5.956 1.00 . A A . 806 TYR CA 1 1 19 14016 1 1 27 TYR CB C -0.796 0.813 -6.990 1.00 . A A . 806 TYR CB 1 1 19 14017 1 1 27 TYR CD1 C -0.655 3.323 -7.187 1.00 . A A . 806 TYR CD1 1 1 19 14018 1 1 27 TYR CD2 C 0.223 2.014 -8.974 1.00 . A A . 806 TYR CD2 1 1 19 14019 1 1 27 TYR CE1 C -0.304 4.478 -7.855 1.00 . A A . 806 TYR CE1 1 1 19 14020 1 1 27 TYR CE2 C 0.577 3.169 -9.648 1.00 . A A . 806 TYR CE2 1 1 19 14021 1 1 27 TYR CG C -0.399 2.072 -7.731 1.00 . A A . 806 TYR CG 1 1 19 14022 1 1 27 TYR CZ C 0.310 4.397 -9.082 1.00 . A A . 806 TYR CZ 1 1 19 14023 1 1 27 TYR H H 1.079 -0.960 -7.393 1.00 . A A . 806 TYR H 1 1 19 14024 1 1 27 TYR HA H 0.672 1.204 -5.484 1.00 . A A . 806 TYR HA 1 1 19 14025 1 1 27 TYR HB2 H -0.942 0.034 -7.719 1.00 . A A . 806 TYR HB2 1 1 19 14026 1 1 27 TYR HB3 H -1.732 1.007 -6.488 1.00 . A A . 806 TYR HB3 1 1 19 14027 1 1 27 TYR HD1 H -1.136 3.387 -6.223 1.00 . A A . 806 TYR HD1 1 1 19 14028 1 1 27 TYR HD2 H 0.433 1.049 -9.414 1.00 . A A . 806 TYR HD2 1 1 19 14029 1 1 27 TYR HE1 H -0.511 5.439 -7.413 1.00 . A A . 806 TYR HE1 1 1 19 14030 1 1 27 TYR HE2 H 1.059 3.106 -10.613 1.00 . A A . 806 TYR HE2 1 1 19 14031 1 1 27 TYR HH H 0.267 5.543 -10.627 1.00 . A A . 806 TYR HH 1 1 19 14032 1 1 27 TYR N N 1.289 -0.443 -6.585 1.00 . A A . 806 TYR N 1 1 19 14033 1 1 27 TYR O O -0.802 -1.638 -5.065 1.00 . A A . 806 TYR O 1 1 19 14034 1 1 27 TYR OH O 0.666 5.550 -9.741 1.00 . A A . 806 TYR OH 1 1 19 14035 1 1 28 ALA C C -1.885 0.551 -1.674 1.00 . A A . 807 ALA C 1 1 19 14036 1 1 28 ALA CA C -1.256 -0.471 -2.598 1.00 . A A . 807 ALA CA 1 1 19 14037 1 1 28 ALA CB C -0.184 -1.257 -1.863 1.00 . A A . 807 ALA CB 1 1 19 14038 1 1 28 ALA H H -0.412 1.132 -3.691 1.00 . A A . 807 ALA H 1 1 19 14039 1 1 28 ALA HA H -2.013 -1.161 -2.940 1.00 . A A . 807 ALA HA 1 1 19 14040 1 1 28 ALA HB1 H 0.581 -0.580 -1.513 1.00 . A A . 807 ALA HB1 1 1 19 14041 1 1 28 ALA HB2 H 0.256 -1.980 -2.533 1.00 . A A . 807 ALA HB2 1 1 19 14042 1 1 28 ALA HB3 H -0.627 -1.768 -1.022 1.00 . A A . 807 ALA HB3 1 1 19 14043 1 1 28 ALA N N -0.679 0.182 -3.750 1.00 . A A . 807 ALA N 1 1 19 14044 1 1 28 ALA O O -1.518 1.729 -1.697 1.00 . A A . 807 ALA O 1 1 19 14045 1 1 29 PRO C C -2.509 1.475 1.146 1.00 . A A . 808 PRO C 1 1 19 14046 1 1 29 PRO CA C -3.506 0.994 0.107 1.00 . A A . 808 PRO CA 1 1 19 14047 1 1 29 PRO CB C -4.570 0.102 0.754 1.00 . A A . 808 PRO CB 1 1 19 14048 1 1 29 PRO CD C -3.434 -1.234 -0.858 1.00 . A A . 808 PRO CD 1 1 19 14049 1 1 29 PRO CG C -4.766 -1.020 -0.204 1.00 . A A . 808 PRO CG 1 1 19 14050 1 1 29 PRO HA H -3.966 1.844 -0.373 1.00 . A A . 808 PRO HA 1 1 19 14051 1 1 29 PRO HB2 H -4.207 -0.254 1.706 1.00 . A A . 808 PRO HB2 1 1 19 14052 1 1 29 PRO HB3 H -5.480 0.665 0.894 1.00 . A A . 808 PRO HB3 1 1 19 14053 1 1 29 PRO HD2 H -2.826 -1.908 -0.273 1.00 . A A . 808 PRO HD2 1 1 19 14054 1 1 29 PRO HD3 H -3.560 -1.609 -1.863 1.00 . A A . 808 PRO HD3 1 1 19 14055 1 1 29 PRO HG2 H -5.073 -1.909 0.326 1.00 . A A . 808 PRO HG2 1 1 19 14056 1 1 29 PRO HG3 H -5.503 -0.748 -0.942 1.00 . A A . 808 PRO HG3 1 1 19 14057 1 1 29 PRO N N -2.864 0.123 -0.870 1.00 . A A . 808 PRO N 1 1 19 14058 1 1 29 PRO O O -1.777 0.674 1.731 1.00 . A A . 808 PRO O 1 1 19 14059 1 1 30 ALA C C -1.519 2.745 3.665 1.00 . A A . 809 ALA C 1 1 19 14060 1 1 30 ALA CA C -1.581 3.449 2.301 1.00 . A A . 809 ALA CA 1 1 19 14061 1 1 30 ALA CB C -2.012 4.895 2.488 1.00 . A A . 809 ALA CB 1 1 19 14062 1 1 30 ALA H H -3.040 3.360 0.752 1.00 . A A . 809 ALA H 1 1 19 14063 1 1 30 ALA HA H -0.595 3.463 1.854 1.00 . A A . 809 ALA HA 1 1 19 14064 1 1 30 ALA HB1 H -2.963 4.924 3.000 1.00 . A A . 809 ALA HB1 1 1 19 14065 1 1 30 ALA HB2 H -2.112 5.367 1.521 1.00 . A A . 809 ALA HB2 1 1 19 14066 1 1 30 ALA HB3 H -1.272 5.420 3.072 1.00 . A A . 809 ALA HB3 1 1 19 14067 1 1 30 ALA N N -2.475 2.793 1.333 1.00 . A A . 809 ALA N 1 1 19 14068 1 1 30 ALA O O -0.544 2.891 4.400 1.00 . A A . 809 ALA O 1 1 19 14069 1 1 31 GLU C C -1.477 0.274 5.375 1.00 . A A . 810 GLU C 1 1 19 14070 1 1 31 GLU CA C -2.655 1.241 5.245 1.00 . A A . 810 GLU CA 1 1 19 14071 1 1 31 GLU CB C -3.971 0.452 5.280 1.00 . A A . 810 GLU CB 1 1 19 14072 1 1 31 GLU CD C -3.769 -0.286 7.714 1.00 . A A . 810 GLU CD 1 1 19 14073 1 1 31 GLU CG C -4.630 0.370 6.654 1.00 . A A . 810 GLU CG 1 1 19 14074 1 1 31 GLU H H -3.302 1.918 3.349 1.00 . A A . 810 GLU H 1 1 19 14075 1 1 31 GLU HA H -2.633 1.934 6.072 1.00 . A A . 810 GLU HA 1 1 19 14076 1 1 31 GLU HB2 H -4.670 0.918 4.602 1.00 . A A . 810 GLU HB2 1 1 19 14077 1 1 31 GLU HB3 H -3.778 -0.555 4.940 1.00 . A A . 810 GLU HB3 1 1 19 14078 1 1 31 GLU HG2 H -4.861 1.371 6.982 1.00 . A A . 810 GLU HG2 1 1 19 14079 1 1 31 GLU HG3 H -5.547 -0.193 6.560 1.00 . A A . 810 GLU HG3 1 1 19 14080 1 1 31 GLU N N -2.571 1.993 3.991 1.00 . A A . 810 GLU N 1 1 19 14081 1 1 31 GLU O O -0.965 0.047 6.469 1.00 . A A . 810 GLU O 1 1 19 14082 1 1 31 GLU OE1 O -3.550 -1.511 7.639 1.00 . A A . 810 GLU OE1 1 1 19 14083 1 1 31 GLU OE2 O -3.329 0.424 8.642 1.00 . A A . 810 GLU OE2 1 1 19 14084 1 1 32 GLN C C 1.371 -0.674 4.411 1.00 . A A . 811 GLN C 1 1 19 14085 1 1 32 GLN CA C -0.012 -1.289 4.227 1.00 . A A . 811 GLN CA 1 1 19 14086 1 1 32 GLN CB C -0.107 -2.049 2.906 1.00 . A A . 811 GLN CB 1 1 19 14087 1 1 32 GLN CD C 0.967 -3.566 1.237 1.00 . A A . 811 GLN CD 1 1 19 14088 1 1 32 GLN CG C 1.050 -2.984 2.627 1.00 . A A . 811 GLN CG 1 1 19 14089 1 1 32 GLN H H -1.389 0.056 3.393 1.00 . A A . 811 GLN H 1 1 19 14090 1 1 32 GLN HA H -0.209 -1.966 5.043 1.00 . A A . 811 GLN HA 1 1 19 14091 1 1 32 GLN HB2 H -1.016 -2.632 2.911 1.00 . A A . 811 GLN HB2 1 1 19 14092 1 1 32 GLN HB3 H -0.160 -1.332 2.100 1.00 . A A . 811 GLN HB3 1 1 19 14093 1 1 32 GLN HE21 H 1.831 -1.940 0.496 1.00 . A A . 811 GLN HE21 1 1 19 14094 1 1 32 GLN HE22 H 1.396 -3.155 -0.655 1.00 . A A . 811 GLN HE22 1 1 19 14095 1 1 32 GLN HG2 H 1.975 -2.434 2.722 1.00 . A A . 811 GLN HG2 1 1 19 14096 1 1 32 GLN HG3 H 1.032 -3.791 3.346 1.00 . A A . 811 GLN HG3 1 1 19 14097 1 1 32 GLN N N -1.037 -0.265 4.247 1.00 . A A . 811 GLN N 1 1 19 14098 1 1 32 GLN NE2 N 1.453 -2.815 0.263 1.00 . A A . 811 GLN NE2 1 1 19 14099 1 1 32 GLN O O 2.302 -1.346 4.858 1.00 . A A . 811 GLN O 1 1 19 14100 1 1 32 GLN OE1 O 0.433 -4.651 1.032 1.00 . A A . 811 GLN OE1 1 1 19 14101 1 1 33 PHE C C 2.992 1.627 5.732 1.00 . A A . 812 PHE C 1 1 19 14102 1 1 33 PHE CA C 2.730 1.361 4.247 1.00 . A A . 812 PHE CA 1 1 19 14103 1 1 33 PHE CB C 2.640 2.680 3.472 1.00 . A A . 812 PHE CB 1 1 19 14104 1 1 33 PHE CD1 C 1.754 1.700 1.326 1.00 . A A . 812 PHE CD1 1 1 19 14105 1 1 33 PHE CD2 C 3.666 3.115 1.223 1.00 . A A . 812 PHE CD2 1 1 19 14106 1 1 33 PHE CE1 C 1.805 1.520 -0.041 1.00 . A A . 812 PHE CE1 1 1 19 14107 1 1 33 PHE CE2 C 3.724 2.939 -0.145 1.00 . A A . 812 PHE CE2 1 1 19 14108 1 1 33 PHE CG C 2.684 2.497 1.976 1.00 . A A . 812 PHE CG 1 1 19 14109 1 1 33 PHE CZ C 2.793 2.139 -0.779 1.00 . A A . 812 PHE CZ 1 1 19 14110 1 1 33 PHE H H 0.794 1.009 3.504 1.00 . A A . 812 PHE H 1 1 19 14111 1 1 33 PHE HA H 3.543 0.781 3.836 1.00 . A A . 812 PHE HA 1 1 19 14112 1 1 33 PHE HB2 H 1.711 3.174 3.720 1.00 . A A . 812 PHE HB2 1 1 19 14113 1 1 33 PHE HB3 H 3.467 3.314 3.755 1.00 . A A . 812 PHE HB3 1 1 19 14114 1 1 33 PHE HD1 H 0.980 1.213 1.903 1.00 . A A . 812 PHE HD1 1 1 19 14115 1 1 33 PHE HD2 H 4.395 3.741 1.717 1.00 . A A . 812 PHE HD2 1 1 19 14116 1 1 33 PHE HE1 H 1.075 0.897 -0.533 1.00 . A A . 812 PHE HE1 1 1 19 14117 1 1 33 PHE HE2 H 4.499 3.425 -0.718 1.00 . A A . 812 PHE HE2 1 1 19 14118 1 1 33 PHE HZ H 2.838 1.999 -1.848 1.00 . A A . 812 PHE HZ 1 1 19 14119 1 1 33 PHE N N 1.497 0.599 4.043 1.00 . A A . 812 PHE N 1 1 19 14120 1 1 33 PHE O O 3.084 2.770 6.179 1.00 . A A . 812 PHE O 1 1 19 14121 1 1 34 ARG C C 4.881 0.675 8.118 1.00 . A A . 813 ARG C 1 1 19 14122 1 1 34 ARG CA C 3.382 0.552 7.894 1.00 . A A . 813 ARG CA 1 1 19 14123 1 1 34 ARG CB C 2.846 -0.737 8.515 1.00 . A A . 813 ARG CB 1 1 19 14124 1 1 34 ARG CD C 0.879 -2.314 8.638 1.00 . A A . 813 ARG CD 1 1 19 14125 1 1 34 ARG CG C 1.371 -0.941 8.222 1.00 . A A . 813 ARG CG 1 1 19 14126 1 1 34 ARG CZ C -0.978 -3.694 7.770 1.00 . A A . 813 ARG CZ 1 1 19 14127 1 1 34 ARG H H 2.957 -0.327 6.032 1.00 . A A . 813 ARG H 1 1 19 14128 1 1 34 ARG HA H 2.898 1.396 8.368 1.00 . A A . 813 ARG HA 1 1 19 14129 1 1 34 ARG HB2 H 3.398 -1.578 8.119 1.00 . A A . 813 ARG HB2 1 1 19 14130 1 1 34 ARG HB3 H 2.977 -0.697 9.585 1.00 . A A . 813 ARG HB3 1 1 19 14131 1 1 34 ARG HD2 H 1.506 -3.064 8.181 1.00 . A A . 813 ARG HD2 1 1 19 14132 1 1 34 ARG HD3 H 0.938 -2.395 9.713 1.00 . A A . 813 ARG HD3 1 1 19 14133 1 1 34 ARG HE H -1.116 -1.760 8.270 1.00 . A A . 813 ARG HE 1 1 19 14134 1 1 34 ARG HG2 H 0.805 -0.193 8.756 1.00 . A A . 813 ARG HG2 1 1 19 14135 1 1 34 ARG HG3 H 1.211 -0.820 7.160 1.00 . A A . 813 ARG HG3 1 1 19 14136 1 1 34 ARG HH11 H 0.779 -4.696 7.935 1.00 . A A . 813 ARG HH11 1 1 19 14137 1 1 34 ARG HH12 H -0.558 -5.623 7.322 1.00 . A A . 813 ARG HH12 1 1 19 14138 1 1 34 ARG HH21 H -2.857 -2.981 7.466 1.00 . A A . 813 ARG HH21 1 1 19 14139 1 1 34 ARG HH22 H -2.609 -4.660 7.062 1.00 . A A . 813 ARG HH22 1 1 19 14140 1 1 34 ARG N N 3.090 0.541 6.474 1.00 . A A . 813 ARG N 1 1 19 14141 1 1 34 ARG NE N -0.505 -2.532 8.221 1.00 . A A . 813 ARG NE 1 1 19 14142 1 1 34 ARG NH1 N -0.190 -4.755 7.672 1.00 . A A . 813 ARG NH1 1 1 19 14143 1 1 34 ARG NH2 N -2.247 -3.791 7.405 1.00 . A A . 813 ARG NH2 1 1 19 14144 1 1 34 ARG O O 5.681 0.146 7.347 1.00 . A A . 813 ARG O 1 1 19 14145 1 1 35 GLY C C 7.131 2.929 8.793 1.00 . A A . 814 GLY C 1 1 19 14146 1 1 35 GLY CA C 6.656 1.640 9.436 1.00 . A A . 814 GLY CA 1 1 19 14147 1 1 35 GLY H H 4.569 1.750 9.775 1.00 . A A . 814 GLY H 1 1 19 14148 1 1 35 GLY HA2 H 6.803 1.705 10.504 1.00 . A A . 814 GLY HA2 1 1 19 14149 1 1 35 GLY HA3 H 7.241 0.819 9.049 1.00 . A A . 814 GLY HA3 1 1 19 14150 1 1 35 GLY N N 5.255 1.390 9.168 1.00 . A A . 814 GLY N 1 1 19 14151 1 1 35 GLY O O 7.758 3.767 9.444 1.00 . A A . 814 GLY O 1 1 19 14152 1 1 36 SER C C 6.345 4.442 5.520 1.00 . A A . 815 SER C 1 1 19 14153 1 1 36 SER CA C 7.207 4.277 6.770 1.00 . A A . 815 SER CA 1 1 19 14154 1 1 36 SER CB C 8.692 4.198 6.395 1.00 . A A . 815 SER CB 1 1 19 14155 1 1 36 SER H H 6.291 2.395 7.064 1.00 . A A . 815 SER H 1 1 19 14156 1 1 36 SER HA H 7.050 5.142 7.397 1.00 . A A . 815 SER HA 1 1 19 14157 1 1 36 SER HB2 H 8.916 4.959 5.664 1.00 . A A . 815 SER HB2 1 1 19 14158 1 1 36 SER HB3 H 9.292 4.363 7.279 1.00 . A A . 815 SER HB3 1 1 19 14159 1 1 36 SER HG H 8.254 2.351 5.900 1.00 . A A . 815 SER HG 1 1 19 14160 1 1 36 SER N N 6.814 3.093 7.517 1.00 . A A . 815 SER N 1 1 19 14161 1 1 36 SER O O 6.234 3.522 4.705 1.00 . A A . 815 SER O 1 1 19 14162 1 1 36 SER OG O 9.021 2.931 5.846 1.00 . A A . 815 SER OG 1 1 19 14163 1 1 37 LYS C C 5.756 6.261 3.004 1.00 . A A . 816 LYS C 1 1 19 14164 1 1 37 LYS CA C 4.887 5.922 4.218 1.00 . A A . 816 LYS CA 1 1 19 14165 1 1 37 LYS CB C 3.925 7.081 4.521 1.00 . A A . 816 LYS CB 1 1 19 14166 1 1 37 LYS CD C 3.325 6.617 6.937 1.00 . A A . 816 LYS CD 1 1 19 14167 1 1 37 LYS CE C 2.209 6.279 7.913 1.00 . A A . 816 LYS CE 1 1 19 14168 1 1 37 LYS CG C 2.809 6.744 5.511 1.00 . A A . 816 LYS CG 1 1 19 14169 1 1 37 LYS H H 5.895 6.327 6.042 1.00 . A A . 816 LYS H 1 1 19 14170 1 1 37 LYS HA H 4.311 5.032 3.995 1.00 . A A . 816 LYS HA 1 1 19 14171 1 1 37 LYS HB2 H 4.498 7.900 4.928 1.00 . A A . 816 LYS HB2 1 1 19 14172 1 1 37 LYS HB3 H 3.469 7.405 3.597 1.00 . A A . 816 LYS HB3 1 1 19 14173 1 1 37 LYS HD2 H 4.069 5.836 6.973 1.00 . A A . 816 LYS HD2 1 1 19 14174 1 1 37 LYS HD3 H 3.770 7.554 7.230 1.00 . A A . 816 LYS HD3 1 1 19 14175 1 1 37 LYS HE2 H 1.751 5.349 7.607 1.00 . A A . 816 LYS HE2 1 1 19 14176 1 1 37 LYS HE3 H 2.633 6.162 8.899 1.00 . A A . 816 LYS HE3 1 1 19 14177 1 1 37 LYS HG2 H 2.066 7.526 5.480 1.00 . A A . 816 LYS HG2 1 1 19 14178 1 1 37 LYS HG3 H 2.355 5.807 5.218 1.00 . A A . 816 LYS HG3 1 1 19 14179 1 1 37 LYS HZ1 H 1.607 8.269 8.117 1.00 . A A . 816 LYS HZ1 1 1 19 14180 1 1 37 LYS HZ2 H 0.492 7.149 8.729 1.00 . A A . 816 LYS HZ2 1 1 19 14181 1 1 37 LYS HZ3 H 0.639 7.364 7.054 1.00 . A A . 816 LYS HZ3 1 1 19 14182 1 1 37 LYS N N 5.735 5.620 5.374 1.00 . A A . 816 LYS N 1 1 19 14183 1 1 37 LYS NZ N 1.166 7.336 7.954 1.00 . A A . 816 LYS NZ 1 1 19 14184 1 1 37 LYS O O 5.653 7.340 2.419 1.00 . A A . 816 LYS O 1 1 19 14185 1 1 38 ARG C C 7.606 4.224 0.720 1.00 . A A . 817 ARG C 1 1 19 14186 1 1 38 ARG CA C 7.591 5.481 1.574 1.00 . A A . 817 ARG CA 1 1 19 14187 1 1 38 ARG CB C 8.989 5.657 2.173 1.00 . A A . 817 ARG CB 1 1 19 14188 1 1 38 ARG CD C 10.623 7.010 3.474 1.00 . A A . 817 ARG CD 1 1 19 14189 1 1 38 ARG CG C 9.225 6.980 2.882 1.00 . A A . 817 ARG CG 1 1 19 14190 1 1 38 ARG CZ C 12.167 8.564 4.601 1.00 . A A . 817 ARG CZ 1 1 19 14191 1 1 38 ARG H H 6.600 4.462 3.113 1.00 . A A . 817 ARG H 1 1 19 14192 1 1 38 ARG HA H 7.375 6.328 0.940 1.00 . A A . 817 ARG HA 1 1 19 14193 1 1 38 ARG HB2 H 9.157 4.863 2.885 1.00 . A A . 817 ARG HB2 1 1 19 14194 1 1 38 ARG HB3 H 9.716 5.567 1.378 1.00 . A A . 817 ARG HB3 1 1 19 14195 1 1 38 ARG HD2 H 10.674 6.280 4.265 1.00 . A A . 817 ARG HD2 1 1 19 14196 1 1 38 ARG HD3 H 11.328 6.745 2.699 1.00 . A A . 817 ARG HD3 1 1 19 14197 1 1 38 ARG HE H 10.337 9.054 3.925 1.00 . A A . 817 ARG HE 1 1 19 14198 1 1 38 ARG HG2 H 9.121 7.787 2.172 1.00 . A A . 817 ARG HG2 1 1 19 14199 1 1 38 ARG HG3 H 8.501 7.094 3.676 1.00 . A A . 817 ARG HG3 1 1 19 14200 1 1 38 ARG HH11 H 12.815 6.641 4.498 1.00 . A A . 817 ARG HH11 1 1 19 14201 1 1 38 ARG HH12 H 13.931 7.761 5.220 1.00 . A A . 817 ARG HH12 1 1 19 14202 1 1 38 ARG HH21 H 11.809 10.541 4.881 1.00 . A A . 817 ARG HH21 1 1 19 14203 1 1 38 ARG HH22 H 13.350 9.972 5.455 1.00 . A A . 817 ARG HH22 1 1 19 14204 1 1 38 ARG N N 6.609 5.323 2.642 1.00 . A A . 817 ARG N 1 1 19 14205 1 1 38 ARG NE N 10.992 8.316 4.019 1.00 . A A . 817 ARG NE 1 1 19 14206 1 1 38 ARG NH1 N 13.039 7.578 4.790 1.00 . A A . 817 ARG NH1 1 1 19 14207 1 1 38 ARG NH2 N 12.465 9.789 5.010 1.00 . A A . 817 ARG NH2 1 1 19 14208 1 1 38 ARG O O 7.785 4.276 -0.497 1.00 . A A . 817 ARG O 1 1 19 14209 1 1 39 PHE C C 6.295 0.981 1.222 1.00 . A A . 818 PHE C 1 1 19 14210 1 1 39 PHE CA C 7.458 1.806 0.736 1.00 . A A . 818 PHE CA 1 1 19 14211 1 1 39 PHE CB C 8.766 1.110 1.118 1.00 . A A . 818 PHE CB 1 1 19 14212 1 1 39 PHE CD1 C 10.377 2.077 -0.541 1.00 . A A . 818 PHE CD1 1 1 19 14213 1 1 39 PHE CD2 C 10.699 2.560 1.773 1.00 . A A . 818 PHE CD2 1 1 19 14214 1 1 39 PHE CE1 C 11.477 2.847 -0.859 1.00 . A A . 818 PHE CE1 1 1 19 14215 1 1 39 PHE CE2 C 11.798 3.334 1.461 1.00 . A A . 818 PHE CE2 1 1 19 14216 1 1 39 PHE CG C 9.977 1.925 0.777 1.00 . A A . 818 PHE CG 1 1 19 14217 1 1 39 PHE CZ C 12.186 3.477 0.144 1.00 . A A . 818 PHE CZ 1 1 19 14218 1 1 39 PHE H H 7.185 3.125 2.330 1.00 . A A . 818 PHE H 1 1 19 14219 1 1 39 PHE HA H 7.436 1.931 -0.340 1.00 . A A . 818 PHE HA 1 1 19 14220 1 1 39 PHE HB2 H 8.773 0.930 2.183 1.00 . A A . 818 PHE HB2 1 1 19 14221 1 1 39 PHE HB3 H 8.835 0.167 0.597 1.00 . A A . 818 PHE HB3 1 1 19 14222 1 1 39 PHE HD1 H 9.820 1.585 -1.326 1.00 . A A . 818 PHE HD1 1 1 19 14223 1 1 39 PHE HD2 H 10.396 2.447 2.804 1.00 . A A . 818 PHE HD2 1 1 19 14224 1 1 39 PHE HE1 H 11.779 2.961 -1.889 1.00 . A A . 818 PHE HE1 1 1 19 14225 1 1 39 PHE HE2 H 12.352 3.825 2.245 1.00 . A A . 818 PHE HE2 1 1 19 14226 1 1 39 PHE HZ H 13.047 4.082 -0.102 1.00 . A A . 818 PHE HZ 1 1 19 14227 1 1 39 PHE N N 7.398 3.097 1.375 1.00 . A A . 818 PHE N 1 1 19 14228 1 1 39 PHE O O 5.675 1.322 2.228 1.00 . A A . 818 PHE O 1 1 19 14229 1 1 40 CYS C C 5.705 -1.752 2.266 1.00 . A A . 819 CYS C 1 1 19 14230 1 1 40 CYS CA C 5.069 -1.068 1.040 1.00 . A A . 819 CYS CA 1 1 19 14231 1 1 40 CYS CB C 4.641 -2.011 -0.088 1.00 . A A . 819 CYS CB 1 1 19 14232 1 1 40 CYS H H 6.491 -0.303 -0.279 1.00 . A A . 819 CYS H 1 1 19 14233 1 1 40 CYS HA H 4.209 -0.546 1.436 1.00 . A A . 819 CYS HA 1 1 19 14234 1 1 40 CYS HB2 H 4.288 -2.930 0.320 1.00 . A A . 819 CYS HB2 1 1 19 14235 1 1 40 CYS HB3 H 3.839 -1.545 -0.644 1.00 . A A . 819 CYS HB3 1 1 19 14236 1 1 40 CYS N N 5.995 -0.091 0.531 1.00 . A A . 819 CYS N 1 1 19 14237 1 1 40 CYS O O 6.623 -1.195 2.863 1.00 . A A . 819 CYS O 1 1 19 14238 1 1 40 CYS SG S 5.956 -2.400 -1.258 1.00 . A A . 819 CYS SG 1 1 19 14239 1 1 41 SER C C 6.883 -3.772 4.353 1.00 . A A . 820 SER C 1 1 19 14240 1 1 41 SER CA C 5.419 -3.459 3.983 1.00 . A A . 820 SER CA 1 1 19 14241 1 1 41 SER CB C 4.545 -4.702 4.124 1.00 . A A . 820 SER CB 1 1 19 14242 1 1 41 SER H H 4.883 -3.519 1.942 1.00 . A A . 820 SER H 1 1 19 14243 1 1 41 SER HA H 5.071 -2.740 4.709 1.00 . A A . 820 SER HA 1 1 19 14244 1 1 41 SER HB2 H 4.724 -5.161 5.084 1.00 . A A . 820 SER HB2 1 1 19 14245 1 1 41 SER HB3 H 3.507 -4.408 4.050 1.00 . A A . 820 SER HB3 1 1 19 14246 1 1 41 SER HG H 4.485 -6.516 3.375 1.00 . A A . 820 SER HG 1 1 19 14247 1 1 41 SER N N 5.247 -2.936 2.628 1.00 . A A . 820 SER N 1 1 19 14248 1 1 41 SER O O 7.742 -2.894 4.338 1.00 . A A . 820 SER O 1 1 19 14249 1 1 41 SER OG O 4.827 -5.644 3.106 1.00 . A A . 820 SER OG 1 1 19 14250 1 1 42 MET C C 9.603 -5.428 4.438 1.00 . A A . 821 MET C 1 1 19 14251 1 1 42 MET CA C 8.433 -5.294 5.395 1.00 . A A . 821 MET CA 1 1 19 14252 1 1 42 MET CB C 8.293 -6.569 6.228 1.00 . A A . 821 MET CB 1 1 19 14253 1 1 42 MET CE C 6.868 -3.783 7.962 1.00 . A A . 821 MET CE 1 1 19 14254 1 1 42 MET CG C 7.266 -6.484 7.351 1.00 . A A . 821 MET CG 1 1 19 14255 1 1 42 MET H H 6.574 -5.743 4.457 1.00 . A A . 821 MET H 1 1 19 14256 1 1 42 MET HA H 8.627 -4.468 6.064 1.00 . A A . 821 MET HA 1 1 19 14257 1 1 42 MET HB2 H 8.008 -7.380 5.574 1.00 . A A . 821 MET HB2 1 1 19 14258 1 1 42 MET HB3 H 9.252 -6.800 6.667 1.00 . A A . 821 MET HB3 1 1 19 14259 1 1 42 MET HE1 H 7.035 -2.955 8.636 1.00 . A A . 821 MET HE1 1 1 19 14260 1 1 42 MET HE2 H 5.808 -3.968 7.874 1.00 . A A . 821 MET HE2 1 1 19 14261 1 1 42 MET HE3 H 7.273 -3.544 6.991 1.00 . A A . 821 MET HE3 1 1 19 14262 1 1 42 MET HG2 H 6.308 -6.233 6.923 1.00 . A A . 821 MET HG2 1 1 19 14263 1 1 42 MET HG3 H 7.199 -7.452 7.829 1.00 . A A . 821 MET HG3 1 1 19 14264 1 1 42 MET N N 7.185 -5.011 4.691 1.00 . A A . 821 MET N 1 1 19 14265 1 1 42 MET O O 10.516 -4.606 4.451 1.00 . A A . 821 MET O 1 1 19 14266 1 1 42 MET SD S 7.677 -5.249 8.606 1.00 . A A . 821 MET SD 1 1 19 14267 1 1 43 THR C C 11.106 -5.495 1.898 1.00 . A A . 822 THR C 1 1 19 14268 1 1 43 THR CA C 10.607 -6.740 2.637 1.00 . A A . 822 THR CA 1 1 19 14269 1 1 43 THR CB C 10.095 -7.764 1.607 1.00 . A A . 822 THR CB 1 1 19 14270 1 1 43 THR CG2 C 11.234 -8.279 0.736 1.00 . A A . 822 THR CG2 1 1 19 14271 1 1 43 THR H H 8.758 -7.028 3.624 1.00 . A A . 822 THR H 1 1 19 14272 1 1 43 THR HA H 11.459 -7.185 3.131 1.00 . A A . 822 THR HA 1 1 19 14273 1 1 43 THR HB H 9.365 -7.280 0.973 1.00 . A A . 822 THR HB 1 1 19 14274 1 1 43 THR HG1 H 8.522 -8.680 2.395 1.00 . A A . 822 THR HG1 1 1 19 14275 1 1 43 THR HG21 H 11.644 -7.462 0.160 1.00 . A A . 822 THR HG21 1 1 19 14276 1 1 43 THR HG22 H 10.861 -9.041 0.065 1.00 . A A . 822 THR HG22 1 1 19 14277 1 1 43 THR HG23 H 12.006 -8.700 1.362 1.00 . A A . 822 THR HG23 1 1 19 14278 1 1 43 THR N N 9.544 -6.443 3.596 1.00 . A A . 822 THR N 1 1 19 14279 1 1 43 THR O O 12.312 -5.277 1.781 1.00 . A A . 822 THR O 1 1 19 14280 1 1 43 THR OG1 O 9.471 -8.864 2.291 1.00 . A A . 822 THR OG1 1 1 19 14281 1 1 44 CYS C C 11.174 -2.403 1.413 1.00 . A A . 823 CYS C 1 1 19 14282 1 1 44 CYS CA C 10.548 -3.527 0.605 1.00 . A A . 823 CYS CA 1 1 19 14283 1 1 44 CYS CB C 9.329 -3.049 -0.154 1.00 . A A . 823 CYS CB 1 1 19 14284 1 1 44 CYS H H 9.252 -4.825 1.631 1.00 . A A . 823 CYS H 1 1 19 14285 1 1 44 CYS HA H 11.277 -3.860 -0.119 1.00 . A A . 823 CYS HA 1 1 19 14286 1 1 44 CYS HB2 H 8.496 -2.947 0.530 1.00 . A A . 823 CYS HB2 1 1 19 14287 1 1 44 CYS HB3 H 9.539 -2.096 -0.616 1.00 . A A . 823 CYS HB3 1 1 19 14288 1 1 44 CYS N N 10.192 -4.676 1.420 1.00 . A A . 823 CYS N 1 1 19 14289 1 1 44 CYS O O 12.230 -1.887 1.044 1.00 . A A . 823 CYS O 1 1 19 14290 1 1 44 CYS SG S 8.846 -4.201 -1.455 1.00 . A A . 823 CYS SG 1 1 19 14291 1 1 45 ALA C C 12.439 -1.346 3.856 1.00 . A A . 824 ALA C 1 1 19 14292 1 1 45 ALA CA C 11.053 -0.969 3.360 1.00 . A A . 824 ALA CA 1 1 19 14293 1 1 45 ALA CB C 10.119 -0.725 4.528 1.00 . A A . 824 ALA CB 1 1 19 14294 1 1 45 ALA H H 9.683 -2.452 2.758 1.00 . A A . 824 ALA H 1 1 19 14295 1 1 45 ALA HA H 11.116 -0.060 2.783 1.00 . A A . 824 ALA HA 1 1 19 14296 1 1 45 ALA HB1 H 10.551 0.015 5.183 1.00 . A A . 824 ALA HB1 1 1 19 14297 1 1 45 ALA HB2 H 9.973 -1.651 5.069 1.00 . A A . 824 ALA HB2 1 1 19 14298 1 1 45 ALA HB3 H 9.171 -0.368 4.157 1.00 . A A . 824 ALA HB3 1 1 19 14299 1 1 45 ALA N N 10.525 -2.015 2.505 1.00 . A A . 824 ALA N 1 1 19 14300 1 1 45 ALA O O 13.355 -0.525 3.868 1.00 . A A . 824 ALA O 1 1 19 14301 1 1 46 LYS C C 14.925 -3.101 3.676 1.00 . A A . 825 LYS C 1 1 19 14302 1 1 46 LYS CA C 13.851 -3.106 4.750 1.00 . A A . 825 LYS CA 1 1 19 14303 1 1 46 LYS CB C 13.696 -4.529 5.299 1.00 . A A . 825 LYS CB 1 1 19 14304 1 1 46 LYS CD C 12.899 -3.485 7.439 1.00 . A A . 825 LYS CD 1 1 19 14305 1 1 46 LYS CE C 14.305 -3.463 8.034 1.00 . A A . 825 LYS CE 1 1 19 14306 1 1 46 LYS CG C 12.721 -4.633 6.463 1.00 . A A . 825 LYS CG 1 1 19 14307 1 1 46 LYS H H 11.815 -3.217 4.211 1.00 . A A . 825 LYS H 1 1 19 14308 1 1 46 LYS HA H 14.151 -2.463 5.564 1.00 . A A . 825 LYS HA 1 1 19 14309 1 1 46 LYS HB2 H 13.349 -5.174 4.506 1.00 . A A . 825 LYS HB2 1 1 19 14310 1 1 46 LYS HB3 H 14.662 -4.877 5.636 1.00 . A A . 825 LYS HB3 1 1 19 14311 1 1 46 LYS HD2 H 12.721 -2.559 6.911 1.00 . A A . 825 LYS HD2 1 1 19 14312 1 1 46 LYS HD3 H 12.179 -3.590 8.235 1.00 . A A . 825 LYS HD3 1 1 19 14313 1 1 46 LYS HE2 H 14.444 -4.352 8.632 1.00 . A A . 825 LYS HE2 1 1 19 14314 1 1 46 LYS HE3 H 15.021 -3.461 7.224 1.00 . A A . 825 LYS HE3 1 1 19 14315 1 1 46 LYS HG2 H 11.712 -4.614 6.077 1.00 . A A . 825 LYS HG2 1 1 19 14316 1 1 46 LYS HG3 H 12.893 -5.566 6.981 1.00 . A A . 825 LYS HG3 1 1 19 14317 1 1 46 LYS HZ1 H 14.364 -1.396 8.338 1.00 . A A . 825 LYS HZ1 1 1 19 14318 1 1 46 LYS HZ2 H 15.520 -2.258 9.231 1.00 . A A . 825 LYS HZ2 1 1 19 14319 1 1 46 LYS HZ3 H 13.896 -2.279 9.710 1.00 . A A . 825 LYS HZ3 1 1 19 14320 1 1 46 LYS N N 12.586 -2.606 4.244 1.00 . A A . 825 LYS N 1 1 19 14321 1 1 46 LYS NZ N 14.536 -2.267 8.886 1.00 . A A . 825 LYS NZ 1 1 19 14322 1 1 46 LYS O O 16.075 -2.771 3.946 1.00 . A A . 825 LYS O 1 1 19 14323 1 1 47 ARG C C 16.177 -2.364 0.971 1.00 . A A . 826 ARG C 1 1 19 14324 1 1 47 ARG CA C 15.527 -3.669 1.403 1.00 . A A . 826 ARG CA 1 1 19 14325 1 1 47 ARG CB C 14.886 -4.354 0.193 1.00 . A A . 826 ARG CB 1 1 19 14326 1 1 47 ARG CD C 16.740 -5.947 -0.463 1.00 . A A . 826 ARG CD 1 1 19 14327 1 1 47 ARG CG C 15.880 -4.763 -0.890 1.00 . A A . 826 ARG CG 1 1 19 14328 1 1 47 ARG CZ C 17.720 -6.598 1.707 1.00 . A A . 826 ARG CZ 1 1 19 14329 1 1 47 ARG H H 13.596 -3.624 2.268 1.00 . A A . 826 ARG H 1 1 19 14330 1 1 47 ARG HA H 16.269 -4.329 1.824 1.00 . A A . 826 ARG HA 1 1 19 14331 1 1 47 ARG HB2 H 14.373 -5.241 0.530 1.00 . A A . 826 ARG HB2 1 1 19 14332 1 1 47 ARG HB3 H 14.167 -3.678 -0.245 1.00 . A A . 826 ARG HB3 1 1 19 14333 1 1 47 ARG HD2 H 16.097 -6.799 -0.302 1.00 . A A . 826 ARG HD2 1 1 19 14334 1 1 47 ARG HD3 H 17.439 -6.172 -1.256 1.00 . A A . 826 ARG HD3 1 1 19 14335 1 1 47 ARG HE H 17.795 -4.758 0.918 1.00 . A A . 826 ARG HE 1 1 19 14336 1 1 47 ARG HG2 H 15.330 -5.037 -1.778 1.00 . A A . 826 ARG HG2 1 1 19 14337 1 1 47 ARG HG3 H 16.521 -3.922 -1.108 1.00 . A A . 826 ARG HG3 1 1 19 14338 1 1 47 ARG HH11 H 16.978 -8.141 0.622 1.00 . A A . 826 ARG HH11 1 1 19 14339 1 1 47 ARG HH12 H 17.561 -8.569 2.199 1.00 . A A . 826 ARG HH12 1 1 19 14340 1 1 47 ARG HH21 H 18.583 -5.281 2.997 1.00 . A A . 826 ARG HH21 1 1 19 14341 1 1 47 ARG HH22 H 18.469 -6.926 3.570 1.00 . A A . 826 ARG HH22 1 1 19 14342 1 1 47 ARG N N 14.546 -3.455 2.453 1.00 . A A . 826 ARG N 1 1 19 14343 1 1 47 ARG NE N 17.487 -5.682 0.769 1.00 . A A . 826 ARG NE 1 1 19 14344 1 1 47 ARG NH1 N 17.395 -7.869 1.492 1.00 . A A . 826 ARG NH1 1 1 19 14345 1 1 47 ARG NH2 N 18.309 -6.245 2.843 1.00 . A A . 826 ARG NH2 1 1 19 14346 1 1 47 ARG O O 17.318 -2.356 0.509 1.00 . A A . 826 ARG O 1 1 19 14347 1 1 48 TYR C C 16.931 0.573 1.747 1.00 . A A . 827 TYR C 1 1 19 14348 1 1 48 TYR CA C 15.972 0.029 0.694 1.00 . A A . 827 TYR CA 1 1 19 14349 1 1 48 TYR CB C 14.825 0.998 0.391 1.00 . A A . 827 TYR CB 1 1 19 14350 1 1 48 TYR CD1 C 15.487 3.422 0.717 1.00 . A A . 827 TYR CD1 1 1 19 14351 1 1 48 TYR CD2 C 15.331 2.584 -1.511 1.00 . A A . 827 TYR CD2 1 1 19 14352 1 1 48 TYR CE1 C 15.828 4.668 0.230 1.00 . A A . 827 TYR CE1 1 1 19 14353 1 1 48 TYR CE2 C 15.665 3.830 -2.004 1.00 . A A . 827 TYR CE2 1 1 19 14354 1 1 48 TYR CG C 15.235 2.357 -0.144 1.00 . A A . 827 TYR CG 1 1 19 14355 1 1 48 TYR CZ C 15.916 4.868 -1.130 1.00 . A A . 827 TYR CZ 1 1 19 14356 1 1 48 TYR H H 14.583 -1.320 1.587 1.00 . A A . 827 TYR H 1 1 19 14357 1 1 48 TYR HA H 16.555 -0.166 -0.184 1.00 . A A . 827 TYR HA 1 1 19 14358 1 1 48 TYR HB2 H 14.176 0.547 -0.344 1.00 . A A . 827 TYR HB2 1 1 19 14359 1 1 48 TYR HB3 H 14.261 1.162 1.298 1.00 . A A . 827 TYR HB3 1 1 19 14360 1 1 48 TYR HD1 H 15.419 3.263 1.782 1.00 . A A . 827 TYR HD1 1 1 19 14361 1 1 48 TYR HD2 H 15.138 1.770 -2.193 1.00 . A A . 827 TYR HD2 1 1 19 14362 1 1 48 TYR HE1 H 16.023 5.481 0.915 1.00 . A A . 827 TYR HE1 1 1 19 14363 1 1 48 TYR HE2 H 15.734 3.988 -3.070 1.00 . A A . 827 TYR HE2 1 1 19 14364 1 1 48 TYR HH H 15.723 6.286 -2.415 1.00 . A A . 827 TYR HH 1 1 19 14365 1 1 48 TYR N N 15.453 -1.264 1.125 1.00 . A A . 827 TYR N 1 1 19 14366 1 1 48 TYR O O 17.764 1.432 1.465 1.00 . A A . 827 TYR O 1 1 19 14367 1 1 48 TYR OH O 16.236 6.114 -1.617 1.00 . A A . 827 TYR OH 1 1 19 14368 1 1 49 ASN C C 18.891 -0.546 4.083 1.00 . A A . 828 ASN C 1 1 19 14369 1 1 49 ASN CA C 17.717 0.421 4.035 1.00 . A A . 828 ASN CA 1 1 19 14370 1 1 49 ASN CB C 16.973 0.450 5.369 1.00 . A A . 828 ASN CB 1 1 19 14371 1 1 49 ASN CG C 16.026 1.629 5.454 1.00 . A A . 828 ASN CG 1 1 19 14372 1 1 49 ASN H H 16.114 -0.608 3.127 1.00 . A A . 828 ASN H 1 1 19 14373 1 1 49 ASN HA H 18.096 1.410 3.825 1.00 . A A . 828 ASN HA 1 1 19 14374 1 1 49 ASN HB2 H 16.399 -0.458 5.477 1.00 . A A . 828 ASN HB2 1 1 19 14375 1 1 49 ASN HB3 H 17.687 0.523 6.178 1.00 . A A . 828 ASN HB3 1 1 19 14376 1 1 49 ASN HD21 H 14.630 0.605 4.475 1.00 . A A . 828 ASN HD21 1 1 19 14377 1 1 49 ASN HD22 H 14.209 2.220 4.926 1.00 . A A . 828 ASN HD22 1 1 19 14378 1 1 49 ASN N N 16.812 0.057 2.958 1.00 . A A . 828 ASN N 1 1 19 14379 1 1 49 ASN ND2 N 14.835 1.469 4.901 1.00 . A A . 828 ASN ND2 1 1 19 14380 1 1 49 ASN O O 19.912 -0.276 3.413 1.00 . A A . 828 ASN O 1 1 19 14381 1 1 49 ASN OXT O 18.792 -1.578 4.774 1.00 . A A . 828 ASN OXT 1 1 19 14382 1 1 49 ASN OD1 O 16.369 2.682 5.987 1.00 . A A . 828 ASN OD1 1 1 19 14383 2 2 1 ZN ZN ZN 7.682 -2.814 -2.692 1.00 . B A . 829 ZN ZN 1 1 20 14384 1 1 1 GLY C C -21.383 7.466 -7.327 1.00 . A A . 1 GLY C 1 1 20 14385 1 1 1 GLY CA C -22.426 8.559 -7.346 1.00 . A A . 1 GLY CA 1 1 20 14386 1 1 1 GLY H1 H -23.080 10.112 -8.574 1.00 . A A . 1 GLY H1 1 1 20 14387 1 1 1 GLY H2 H -22.392 8.808 -9.416 1.00 . A A . 1 GLY H2 1 1 20 14388 1 1 1 GLY H3 H -21.399 9.892 -8.570 1.00 . A A . 1 GLY H3 1 1 20 14389 1 1 1 GLY HA2 H -22.294 9.182 -6.476 1.00 . A A . 1 GLY HA2 1 1 20 14390 1 1 1 GLY HA3 H -23.409 8.111 -7.315 1.00 . A A . 1 GLY HA3 1 1 20 14391 1 1 1 GLY N N -22.318 9.400 -8.561 1.00 . A A . 1 GLY N 1 1 20 14392 1 1 1 GLY O O -20.327 7.605 -7.949 1.00 . A A . 1 GLY O 1 1 20 14393 1 1 2 THR C C -19.468 5.583 -5.865 1.00 . A A . 2 THR C 1 1 20 14394 1 1 2 THR CA C -20.803 5.224 -6.526 1.00 . A A . 2 THR CA 1 1 20 14395 1 1 2 THR CB C -20.548 4.610 -7.916 1.00 . A A . 2 THR CB 1 1 20 14396 1 1 2 THR CG2 C -19.806 3.284 -7.802 1.00 . A A . 2 THR CG2 1 1 20 14397 1 1 2 THR H H -22.550 6.354 -6.143 1.00 . A A . 2 THR H 1 1 20 14398 1 1 2 THR HA H -21.300 4.481 -5.919 1.00 . A A . 2 THR HA 1 1 20 14399 1 1 2 THR HB H -19.945 5.296 -8.490 1.00 . A A . 2 THR HB 1 1 20 14400 1 1 2 THR HG1 H -22.367 5.176 -8.467 1.00 . A A . 2 THR HG1 1 1 20 14401 1 1 2 THR HG21 H -18.851 3.444 -7.323 1.00 . A A . 2 THR HG21 1 1 20 14402 1 1 2 THR HG22 H -19.647 2.875 -8.788 1.00 . A A . 2 THR HG22 1 1 20 14403 1 1 2 THR HG23 H -20.394 2.589 -7.217 1.00 . A A . 2 THR HG23 1 1 20 14404 1 1 2 THR N N -21.688 6.380 -6.619 1.00 . A A . 2 THR N 1 1 20 14405 1 1 2 THR O O -18.516 5.999 -6.527 1.00 . A A . 2 THR O 1 1 20 14406 1 1 2 THR OG1 O -21.798 4.400 -8.589 1.00 . A A . 2 THR OG1 1 1 20 14407 1 1 3 ARG C C -17.594 4.341 -3.330 1.00 . A A . 3 ARG C 1 1 20 14408 1 1 3 ARG CA C -18.167 5.661 -3.821 1.00 . A A . 3 ARG CA 1 1 20 14409 1 1 3 ARG CB C -18.400 6.608 -2.643 1.00 . A A . 3 ARG CB 1 1 20 14410 1 1 3 ARG CD C -18.850 8.963 -1.900 1.00 . A A . 3 ARG CD 1 1 20 14411 1 1 3 ARG CG C -18.890 7.984 -3.059 1.00 . A A . 3 ARG CG 1 1 20 14412 1 1 3 ARG CZ C -19.267 8.500 0.488 1.00 . A A . 3 ARG CZ 1 1 20 14413 1 1 3 ARG H H -20.205 5.124 -4.064 1.00 . A A . 3 ARG H 1 1 20 14414 1 1 3 ARG HA H -17.462 6.115 -4.502 1.00 . A A . 3 ARG HA 1 1 20 14415 1 1 3 ARG HB2 H -19.135 6.171 -1.984 1.00 . A A . 3 ARG HB2 1 1 20 14416 1 1 3 ARG HB3 H -17.471 6.727 -2.103 1.00 . A A . 3 ARG HB3 1 1 20 14417 1 1 3 ARG HD2 H -17.829 9.050 -1.559 1.00 . A A . 3 ARG HD2 1 1 20 14418 1 1 3 ARG HD3 H -19.193 9.926 -2.250 1.00 . A A . 3 ARG HD3 1 1 20 14419 1 1 3 ARG HE H -20.624 8.306 -0.977 1.00 . A A . 3 ARG HE 1 1 20 14420 1 1 3 ARG HG2 H -18.258 8.355 -3.853 1.00 . A A . 3 ARG HG2 1 1 20 14421 1 1 3 ARG HG3 H -19.907 7.901 -3.415 1.00 . A A . 3 ARG HG3 1 1 20 14422 1 1 3 ARG HH11 H -17.340 8.957 0.046 1.00 . A A . 3 ARG HH11 1 1 20 14423 1 1 3 ARG HH12 H -17.683 8.704 1.737 1.00 . A A . 3 ARG HH12 1 1 20 14424 1 1 3 ARG HH21 H -21.079 8.002 1.257 1.00 . A A . 3 ARG HH21 1 1 20 14425 1 1 3 ARG HH22 H -19.798 8.192 2.420 1.00 . A A . 3 ARG HH22 1 1 20 14426 1 1 3 ARG N N -19.404 5.425 -4.553 1.00 . A A . 3 ARG N 1 1 20 14427 1 1 3 ARG NE N -19.688 8.541 -0.778 1.00 . A A . 3 ARG NE 1 1 20 14428 1 1 3 ARG NH1 N -17.999 8.743 0.778 1.00 . A A . 3 ARG NH1 1 1 20 14429 1 1 3 ARG NH2 N -20.112 8.203 1.465 1.00 . A A . 3 ARG NH2 1 1 20 14430 1 1 3 ARG O O -16.468 4.275 -2.835 1.00 . A A . 3 ARG O 1 1 20 14431 1 1 4 GLY C C -18.463 0.918 -4.057 1.00 . A A . 783 GLY C 1 1 20 14432 1 1 4 GLY CA C -17.944 1.964 -3.099 1.00 . A A . 783 GLY CA 1 1 20 14433 1 1 4 GLY H H -19.278 3.411 -3.860 1.00 . A A . 783 GLY H 1 1 20 14434 1 1 4 GLY HA2 H -16.863 1.935 -3.097 1.00 . A A . 783 GLY HA2 1 1 20 14435 1 1 4 GLY HA3 H -18.306 1.744 -2.107 1.00 . A A . 783 GLY HA3 1 1 20 14436 1 1 4 GLY N N -18.381 3.287 -3.480 1.00 . A A . 783 GLY N 1 1 20 14437 1 1 4 GLY O O -19.155 1.244 -5.023 1.00 . A A . 783 GLY O 1 1 20 14438 1 1 5 VAL C C -18.940 -2.630 -3.751 1.00 . A A . 784 VAL C 1 1 20 14439 1 1 5 VAL CA C -18.581 -1.433 -4.633 1.00 . A A . 784 VAL CA 1 1 20 14440 1 1 5 VAL CB C -17.518 -1.804 -5.705 1.00 . A A . 784 VAL CB 1 1 20 14441 1 1 5 VAL CG1 C -16.157 -2.079 -5.079 1.00 . A A . 784 VAL CG1 1 1 20 14442 1 1 5 VAL CG2 C -17.978 -2.989 -6.546 1.00 . A A . 784 VAL CG2 1 1 20 14443 1 1 5 VAL H H -17.575 -0.532 -3.007 1.00 . A A . 784 VAL H 1 1 20 14444 1 1 5 VAL HA H -19.475 -1.107 -5.143 1.00 . A A . 784 VAL HA 1 1 20 14445 1 1 5 VAL HB H -17.408 -0.956 -6.365 1.00 . A A . 784 VAL HB 1 1 20 14446 1 1 5 VAL HG11 H -15.814 -1.197 -4.561 1.00 . A A . 784 VAL HG11 1 1 20 14447 1 1 5 VAL HG12 H -15.450 -2.340 -5.852 1.00 . A A . 784 VAL HG12 1 1 20 14448 1 1 5 VAL HG13 H -16.242 -2.897 -4.380 1.00 . A A . 784 VAL HG13 1 1 20 14449 1 1 5 VAL HG21 H -18.155 -3.839 -5.904 1.00 . A A . 784 VAL HG21 1 1 20 14450 1 1 5 VAL HG22 H -17.212 -3.236 -7.266 1.00 . A A . 784 VAL HG22 1 1 20 14451 1 1 5 VAL HG23 H -18.890 -2.732 -7.065 1.00 . A A . 784 VAL HG23 1 1 20 14452 1 1 5 VAL N N -18.130 -0.334 -3.797 1.00 . A A . 784 VAL N 1 1 20 14453 1 1 5 VAL O O -18.125 -3.530 -3.518 1.00 . A A . 784 VAL O 1 1 20 14454 1 1 6 ASP C C -19.718 -3.472 -1.013 1.00 . A A . 785 ASP C 1 1 20 14455 1 1 6 ASP CA C -20.612 -3.582 -2.240 1.00 . A A . 785 ASP CA 1 1 20 14456 1 1 6 ASP CB C -20.587 -5.014 -2.796 1.00 . A A . 785 ASP CB 1 1 20 14457 1 1 6 ASP CG C -21.693 -5.284 -3.799 1.00 . A A . 785 ASP CG 1 1 20 14458 1 1 6 ASP H H -20.802 -1.920 -3.545 1.00 . A A . 785 ASP H 1 1 20 14459 1 1 6 ASP HA H -21.624 -3.330 -1.957 1.00 . A A . 785 ASP HA 1 1 20 14460 1 1 6 ASP HB2 H -19.641 -5.186 -3.285 1.00 . A A . 785 ASP HB2 1 1 20 14461 1 1 6 ASP HB3 H -20.693 -5.712 -1.978 1.00 . A A . 785 ASP HB3 1 1 20 14462 1 1 6 ASP N N -20.171 -2.612 -3.240 1.00 . A A . 785 ASP N 1 1 20 14463 1 1 6 ASP O O -19.321 -4.474 -0.414 1.00 . A A . 785 ASP O 1 1 20 14464 1 1 6 ASP OD1 O -21.706 -4.634 -4.864 1.00 . A A . 785 ASP OD1 1 1 20 14465 1 1 6 ASP OD2 O -22.571 -6.126 -3.520 1.00 . A A . 785 ASP OD2 1 1 20 14466 1 1 7 SER C C -19.163 -1.419 1.640 1.00 . A A . 786 SER C 1 1 20 14467 1 1 7 SER CA C -18.448 -1.952 0.400 1.00 . A A . 786 SER CA 1 1 20 14468 1 1 7 SER CB C -17.421 -0.932 -0.095 1.00 . A A . 786 SER CB 1 1 20 14469 1 1 7 SER H H -19.823 -1.480 -1.126 1.00 . A A . 786 SER H 1 1 20 14470 1 1 7 SER HA H -17.942 -2.871 0.650 1.00 . A A . 786 SER HA 1 1 20 14471 1 1 7 SER HB2 H -17.900 0.029 -0.214 1.00 . A A . 786 SER HB2 1 1 20 14472 1 1 7 SER HB3 H -16.622 -0.848 0.627 1.00 . A A . 786 SER HB3 1 1 20 14473 1 1 7 SER HG H -16.552 -2.239 -1.282 1.00 . A A . 786 SER HG 1 1 20 14474 1 1 7 SER N N -19.395 -2.235 -0.660 1.00 . A A . 786 SER N 1 1 20 14475 1 1 7 SER O O -19.961 -0.483 1.559 1.00 . A A . 786 SER O 1 1 20 14476 1 1 7 SER OG O -16.871 -1.325 -1.345 1.00 . A A . 786 SER OG 1 1 20 14477 1 1 8 PRO C C -18.879 -0.257 4.526 1.00 . A A . 787 PRO C 1 1 20 14478 1 1 8 PRO CA C -19.454 -1.600 4.089 1.00 . A A . 787 PRO CA 1 1 20 14479 1 1 8 PRO CB C -19.029 -2.704 5.069 1.00 . A A . 787 PRO CB 1 1 20 14480 1 1 8 PRO CD C -18.045 -3.220 2.955 1.00 . A A . 787 PRO CD 1 1 20 14481 1 1 8 PRO CG C -18.561 -3.837 4.219 1.00 . A A . 787 PRO CG 1 1 20 14482 1 1 8 PRO HA H -20.531 -1.537 4.056 1.00 . A A . 787 PRO HA 1 1 20 14483 1 1 8 PRO HB2 H -18.234 -2.339 5.704 1.00 . A A . 787 PRO HB2 1 1 20 14484 1 1 8 PRO HB3 H -19.873 -2.993 5.674 1.00 . A A . 787 PRO HB3 1 1 20 14485 1 1 8 PRO HD2 H -17.009 -2.939 3.065 1.00 . A A . 787 PRO HD2 1 1 20 14486 1 1 8 PRO HD3 H -18.171 -3.897 2.123 1.00 . A A . 787 PRO HD3 1 1 20 14487 1 1 8 PRO HG2 H -17.769 -4.371 4.723 1.00 . A A . 787 PRO HG2 1 1 20 14488 1 1 8 PRO HG3 H -19.384 -4.502 4.004 1.00 . A A . 787 PRO HG3 1 1 20 14489 1 1 8 PRO N N -18.897 -2.035 2.803 1.00 . A A . 787 PRO N 1 1 20 14490 1 1 8 PRO O O -19.470 0.459 5.336 1.00 . A A . 787 PRO O 1 1 20 14491 1 1 9 SER C C -16.697 1.986 2.923 1.00 . A A . 788 SER C 1 1 20 14492 1 1 9 SER CA C -17.068 1.336 4.247 1.00 . A A . 788 SER CA 1 1 20 14493 1 1 9 SER CB C -15.820 1.133 5.114 1.00 . A A . 788 SER CB 1 1 20 14494 1 1 9 SER H H -17.288 -0.564 3.371 1.00 . A A . 788 SER H 1 1 20 14495 1 1 9 SER HA H -17.767 1.972 4.769 1.00 . A A . 788 SER HA 1 1 20 14496 1 1 9 SER HB2 H -16.106 0.672 6.046 1.00 . A A . 788 SER HB2 1 1 20 14497 1 1 9 SER HB3 H -15.129 0.485 4.593 1.00 . A A . 788 SER HB3 1 1 20 14498 1 1 9 SER HG H -14.633 2.252 6.205 1.00 . A A . 788 SER HG 1 1 20 14499 1 1 9 SER N N -17.717 0.068 3.983 1.00 . A A . 788 SER N 1 1 20 14500 1 1 9 SER O O -16.663 1.310 1.899 1.00 . A A . 788 SER O 1 1 20 14501 1 1 9 SER OG O -15.167 2.360 5.402 1.00 . A A . 788 SER OG 1 1 20 14502 1 1 10 ALA C C -14.858 3.456 1.064 1.00 . A A . 789 ALA C 1 1 20 14503 1 1 10 ALA CA C -16.121 4.006 1.719 1.00 . A A . 789 ALA CA 1 1 20 14504 1 1 10 ALA CB C -15.976 5.495 2.000 1.00 . A A . 789 ALA CB 1 1 20 14505 1 1 10 ALA H H -16.432 3.759 3.797 1.00 . A A . 789 ALA H 1 1 20 14506 1 1 10 ALA HA H -16.950 3.875 1.041 1.00 . A A . 789 ALA HA 1 1 20 14507 1 1 10 ALA HB1 H -15.149 5.657 2.674 1.00 . A A . 789 ALA HB1 1 1 20 14508 1 1 10 ALA HB2 H -16.884 5.867 2.451 1.00 . A A . 789 ALA HB2 1 1 20 14509 1 1 10 ALA HB3 H -15.792 6.019 1.073 1.00 . A A . 789 ALA HB3 1 1 20 14510 1 1 10 ALA N N -16.431 3.282 2.941 1.00 . A A . 789 ALA N 1 1 20 14511 1 1 10 ALA O O -14.924 2.796 0.025 1.00 . A A . 789 ALA O 1 1 20 14512 1 1 11 GLU C C -11.677 2.383 2.090 1.00 . A A . 790 GLU C 1 1 20 14513 1 1 11 GLU CA C -12.442 3.270 1.114 1.00 . A A . 790 GLU CA 1 1 20 14514 1 1 11 GLU CB C -11.585 4.467 0.715 1.00 . A A . 790 GLU CB 1 1 20 14515 1 1 11 GLU CD C -11.418 6.564 -0.692 1.00 . A A . 790 GLU CD 1 1 20 14516 1 1 11 GLU CG C -12.247 5.355 -0.326 1.00 . A A . 790 GLU CG 1 1 20 14517 1 1 11 GLU H H -13.714 4.242 2.500 1.00 . A A . 790 GLU H 1 1 20 14518 1 1 11 GLU HA H -12.660 2.694 0.227 1.00 . A A . 790 GLU HA 1 1 20 14519 1 1 11 GLU HB2 H -11.386 5.063 1.594 1.00 . A A . 790 GLU HB2 1 1 20 14520 1 1 11 GLU HB3 H -10.651 4.105 0.315 1.00 . A A . 790 GLU HB3 1 1 20 14521 1 1 11 GLU HG2 H -12.417 4.774 -1.220 1.00 . A A . 790 GLU HG2 1 1 20 14522 1 1 11 GLU HG3 H -13.197 5.694 0.064 1.00 . A A . 790 GLU HG3 1 1 20 14523 1 1 11 GLU N N -13.709 3.726 1.668 1.00 . A A . 790 GLU N 1 1 20 14524 1 1 11 GLU O O -10.895 1.526 1.672 1.00 . A A . 790 GLU O 1 1 20 14525 1 1 11 GLU OE1 O -11.089 7.355 0.214 1.00 . A A . 790 GLU OE1 1 1 20 14526 1 1 11 GLU OE2 O -11.086 6.723 -1.883 1.00 . A A . 790 GLU OE2 1 1 20 14527 1 1 12 LEU C C -11.416 0.412 4.483 1.00 . A A . 791 LEU C 1 1 20 14528 1 1 12 LEU CA C -11.109 1.899 4.407 1.00 . A A . 791 LEU CA 1 1 20 14529 1 1 12 LEU CB C -11.281 2.552 5.787 1.00 . A A . 791 LEU CB 1 1 20 14530 1 1 12 LEU CD1 C -11.313 5.006 5.192 1.00 . A A . 791 LEU CD1 1 1 20 14531 1 1 12 LEU CD2 C -10.534 4.275 7.451 1.00 . A A . 791 LEU CD2 1 1 20 14532 1 1 12 LEU CG C -10.598 3.916 5.974 1.00 . A A . 791 LEU CG 1 1 20 14533 1 1 12 LEU H H -12.638 3.169 3.664 1.00 . A A . 791 LEU H 1 1 20 14534 1 1 12 LEU HA H -10.094 2.000 4.101 1.00 . A A . 791 LEU HA 1 1 20 14535 1 1 12 LEU HB2 H -12.338 2.678 5.970 1.00 . A A . 791 LEU HB2 1 1 20 14536 1 1 12 LEU HB3 H -10.886 1.873 6.529 1.00 . A A . 791 LEU HB3 1 1 20 14537 1 1 12 LEU HD11 H -10.795 5.945 5.327 1.00 . A A . 791 LEU HD11 1 1 20 14538 1 1 12 LEU HD12 H -12.327 5.100 5.549 1.00 . A A . 791 LEU HD12 1 1 20 14539 1 1 12 LEU HD13 H -11.322 4.749 4.143 1.00 . A A . 791 LEU HD13 1 1 20 14540 1 1 12 LEU HD21 H -10.059 5.237 7.568 1.00 . A A . 791 LEU HD21 1 1 20 14541 1 1 12 LEU HD22 H -9.963 3.524 7.977 1.00 . A A . 791 LEU HD22 1 1 20 14542 1 1 12 LEU HD23 H -11.535 4.316 7.855 1.00 . A A . 791 LEU HD23 1 1 20 14543 1 1 12 LEU HG H -9.583 3.857 5.605 1.00 . A A . 791 LEU HG 1 1 20 14544 1 1 12 LEU N N -11.914 2.571 3.387 1.00 . A A . 791 LEU N 1 1 20 14545 1 1 12 LEU O O -10.638 -0.371 5.024 1.00 . A A . 791 LEU O 1 1 20 14546 1 1 13 ASP C C -13.266 -1.655 2.364 1.00 . A A . 792 ASP C 1 1 20 14547 1 1 13 ASP CA C -12.916 -1.364 3.811 1.00 . A A . 792 ASP CA 1 1 20 14548 1 1 13 ASP CB C -14.080 -1.709 4.741 1.00 . A A . 792 ASP CB 1 1 20 14549 1 1 13 ASP CG C -14.352 -3.201 4.788 1.00 . A A . 792 ASP CG 1 1 20 14550 1 1 13 ASP H H -13.104 0.723 3.530 1.00 . A A . 792 ASP H 1 1 20 14551 1 1 13 ASP HA H -12.056 -1.958 4.084 1.00 . A A . 792 ASP HA 1 1 20 14552 1 1 13 ASP HB2 H -13.847 -1.372 5.740 1.00 . A A . 792 ASP HB2 1 1 20 14553 1 1 13 ASP HB3 H -14.974 -1.209 4.396 1.00 . A A . 792 ASP HB3 1 1 20 14554 1 1 13 ASP N N -12.533 0.038 3.916 1.00 . A A . 792 ASP N 1 1 20 14555 1 1 13 ASP O O -14.379 -2.052 2.021 1.00 . A A . 792 ASP O 1 1 20 14556 1 1 13 ASP OD1 O -13.413 -3.972 5.079 1.00 . A A . 792 ASP OD1 1 1 20 14557 1 1 13 ASP OD2 O -15.502 -3.609 4.552 1.00 . A A . 792 ASP OD2 1 1 20 14558 1 1 14 LYS C C -11.013 -1.517 -0.509 1.00 . A A . 793 LYS C 1 1 20 14559 1 1 14 LYS CA C -12.410 -1.554 0.084 1.00 . A A . 793 LYS CA 1 1 20 14560 1 1 14 LYS CB C -13.262 -0.423 -0.512 1.00 . A A . 793 LYS CB 1 1 20 14561 1 1 14 LYS CD C -14.245 0.639 -2.578 1.00 . A A . 793 LYS CD 1 1 20 14562 1 1 14 LYS CE C -13.378 1.887 -2.515 1.00 . A A . 793 LYS CE 1 1 20 14563 1 1 14 LYS CG C -13.524 -0.574 -2.004 1.00 . A A . 793 LYS CG 1 1 20 14564 1 1 14 LYS H H -11.430 -1.111 1.884 1.00 . A A . 793 LYS H 1 1 20 14565 1 1 14 LYS HA H -12.868 -2.507 -0.119 1.00 . A A . 793 LYS HA 1 1 20 14566 1 1 14 LYS HB2 H -14.214 -0.397 -0.001 1.00 . A A . 793 LYS HB2 1 1 20 14567 1 1 14 LYS HB3 H -12.753 0.515 -0.351 1.00 . A A . 793 LYS HB3 1 1 20 14568 1 1 14 LYS HD2 H -14.497 0.442 -3.610 1.00 . A A . 793 LYS HD2 1 1 20 14569 1 1 14 LYS HD3 H -15.151 0.812 -2.012 1.00 . A A . 793 LYS HD3 1 1 20 14570 1 1 14 LYS HE2 H -13.177 2.115 -1.479 1.00 . A A . 793 LYS HE2 1 1 20 14571 1 1 14 LYS HE3 H -12.448 1.690 -3.026 1.00 . A A . 793 LYS HE3 1 1 20 14572 1 1 14 LYS HG2 H -12.579 -0.691 -2.514 1.00 . A A . 793 LYS HG2 1 1 20 14573 1 1 14 LYS HG3 H -14.132 -1.452 -2.164 1.00 . A A . 793 LYS HG3 1 1 20 14574 1 1 14 LYS HZ1 H -14.888 3.326 -2.604 1.00 . A A . 793 LYS HZ1 1 1 20 14575 1 1 14 LYS HZ2 H -14.321 2.828 -4.124 1.00 . A A . 793 LYS HZ2 1 1 20 14576 1 1 14 LYS HZ3 H -13.384 3.872 -3.171 1.00 . A A . 793 LYS HZ3 1 1 20 14577 1 1 14 LYS N N -12.288 -1.401 1.520 1.00 . A A . 793 LYS N 1 1 20 14578 1 1 14 LYS NZ N -14.038 3.059 -3.145 1.00 . A A . 793 LYS NZ 1 1 20 14579 1 1 14 LYS O O -10.688 -2.279 -1.421 1.00 . A A . 793 LYS O 1 1 20 14580 1 1 15 LYS C C -8.686 -0.030 -1.791 1.00 . A A . 794 LYS C 1 1 20 14581 1 1 15 LYS CA C -8.794 -0.481 -0.343 1.00 . A A . 794 LYS CA 1 1 20 14582 1 1 15 LYS CB C -7.984 -1.764 -0.085 1.00 . A A . 794 LYS CB 1 1 20 14583 1 1 15 LYS CD C -9.015 -2.683 2.043 1.00 . A A . 794 LYS CD 1 1 20 14584 1 1 15 LYS CE C -8.962 -2.609 3.565 1.00 . A A . 794 LYS CE 1 1 20 14585 1 1 15 LYS CG C -7.778 -2.073 1.397 1.00 . A A . 794 LYS CG 1 1 20 14586 1 1 15 LYS H H -10.552 -0.006 0.718 1.00 . A A . 794 LYS H 1 1 20 14587 1 1 15 LYS HA H -8.381 0.307 0.274 1.00 . A A . 794 LYS HA 1 1 20 14588 1 1 15 LYS HB2 H -8.497 -2.597 -0.539 1.00 . A A . 794 LYS HB2 1 1 20 14589 1 1 15 LYS HB3 H -7.009 -1.655 -0.544 1.00 . A A . 794 LYS HB3 1 1 20 14590 1 1 15 LYS HD2 H -9.887 -2.149 1.700 1.00 . A A . 794 LYS HD2 1 1 20 14591 1 1 15 LYS HD3 H -9.088 -3.719 1.744 1.00 . A A . 794 LYS HD3 1 1 20 14592 1 1 15 LYS HE2 H -8.938 -1.570 3.858 1.00 . A A . 794 LYS HE2 1 1 20 14593 1 1 15 LYS HE3 H -9.853 -3.072 3.965 1.00 . A A . 794 LYS HE3 1 1 20 14594 1 1 15 LYS HG2 H -6.957 -2.767 1.498 1.00 . A A . 794 LYS HG2 1 1 20 14595 1 1 15 LYS HG3 H -7.534 -1.154 1.911 1.00 . A A . 794 LYS HG3 1 1 20 14596 1 1 15 LYS HZ1 H -7.744 -3.166 5.165 1.00 . A A . 794 LYS HZ1 1 1 20 14597 1 1 15 LYS HZ2 H -6.896 -2.897 3.724 1.00 . A A . 794 LYS HZ2 1 1 20 14598 1 1 15 LYS HZ3 H -7.805 -4.315 3.919 1.00 . A A . 794 LYS HZ3 1 1 20 14599 1 1 15 LYS N N -10.191 -0.622 0.043 1.00 . A A . 794 LYS N 1 1 20 14600 1 1 15 LYS NZ N -7.771 -3.293 4.130 1.00 . A A . 794 LYS NZ 1 1 20 14601 1 1 15 LYS O O -8.630 -0.835 -2.725 1.00 . A A . 794 LYS O 1 1 20 14602 1 1 16 ALA C C -8.138 3.366 -2.979 1.00 . A A . 795 ALA C 1 1 20 14603 1 1 16 ALA CA C -8.597 1.944 -3.226 1.00 . A A . 795 ALA CA 1 1 20 14604 1 1 16 ALA CB C -9.959 1.911 -3.904 1.00 . A A . 795 ALA CB 1 1 20 14605 1 1 16 ALA H H -8.618 1.839 -1.129 1.00 . A A . 795 ALA H 1 1 20 14606 1 1 16 ALA HA H -7.875 1.435 -3.853 1.00 . A A . 795 ALA HA 1 1 20 14607 1 1 16 ALA HB1 H -9.897 2.415 -4.857 1.00 . A A . 795 ALA HB1 1 1 20 14608 1 1 16 ALA HB2 H -10.684 2.409 -3.280 1.00 . A A . 795 ALA HB2 1 1 20 14609 1 1 16 ALA HB3 H -10.259 0.884 -4.057 1.00 . A A . 795 ALA HB3 1 1 20 14610 1 1 16 ALA N N -8.636 1.280 -1.938 1.00 . A A . 795 ALA N 1 1 20 14611 1 1 16 ALA O O -8.752 4.343 -3.403 1.00 . A A . 795 ALA O 1 1 20 14612 1 1 17 ASN C C -4.942 4.448 -1.734 1.00 . A A . 796 ASN C 1 1 20 14613 1 1 17 ASN CA C -6.444 4.670 -1.786 1.00 . A A . 796 ASN CA 1 1 20 14614 1 1 17 ASN CB C -7.023 5.031 -0.408 1.00 . A A . 796 ASN CB 1 1 20 14615 1 1 17 ASN CG C -6.954 3.880 0.586 1.00 . A A . 796 ASN CG 1 1 20 14616 1 1 17 ASN H H -6.571 2.595 -2.055 1.00 . A A . 796 ASN H 1 1 20 14617 1 1 17 ASN HA H -6.668 5.454 -2.495 1.00 . A A . 796 ASN HA 1 1 20 14618 1 1 17 ASN HB2 H -6.468 5.862 -0.001 1.00 . A A . 796 ASN HB2 1 1 20 14619 1 1 17 ASN HB3 H -8.058 5.317 -0.525 1.00 . A A . 796 ASN HB3 1 1 20 14620 1 1 17 ASN HD21 H -5.391 4.720 1.488 1.00 . A A . 796 ASN HD21 1 1 20 14621 1 1 17 ASN HD22 H -5.942 3.219 2.157 1.00 . A A . 796 ASN HD22 1 1 20 14622 1 1 17 ASN N N -7.031 3.434 -2.267 1.00 . A A . 796 ASN N 1 1 20 14623 1 1 17 ASN ND2 N -5.999 3.939 1.500 1.00 . A A . 796 ASN ND2 1 1 20 14624 1 1 17 ASN O O -4.278 4.568 -0.701 1.00 . A A . 796 ASN O 1 1 20 14625 1 1 17 ASN OD1 O -7.776 2.960 0.552 1.00 . A A . 796 ASN OD1 1 1 20 14626 1 1 18 LEU C C -2.083 4.679 -3.293 1.00 . A A . 797 LEU C 1 1 20 14627 1 1 18 LEU CA C -3.098 3.572 -3.056 1.00 . A A . 797 LEU CA 1 1 20 14628 1 1 18 LEU CB C -3.071 2.616 -4.249 1.00 . A A . 797 LEU CB 1 1 20 14629 1 1 18 LEU CD1 C -4.214 0.914 -5.693 1.00 . A A . 797 LEU CD1 1 1 20 14630 1 1 18 LEU CD2 C -4.418 0.759 -3.213 1.00 . A A . 797 LEU CD2 1 1 20 14631 1 1 18 LEU CG C -4.294 1.702 -4.396 1.00 . A A . 797 LEU CG 1 1 20 14632 1 1 18 LEU H H -5.008 4.181 -3.699 1.00 . A A . 797 LEU H 1 1 20 14633 1 1 18 LEU HA H -2.812 3.023 -2.174 1.00 . A A . 797 LEU HA 1 1 20 14634 1 1 18 LEU HB2 H -2.979 3.205 -5.143 1.00 . A A . 797 LEU HB2 1 1 20 14635 1 1 18 LEU HB3 H -2.196 1.990 -4.160 1.00 . A A . 797 LEU HB3 1 1 20 14636 1 1 18 LEU HD11 H -4.166 1.599 -6.526 1.00 . A A . 797 LEU HD11 1 1 20 14637 1 1 18 LEU HD12 H -5.089 0.288 -5.791 1.00 . A A . 797 LEU HD12 1 1 20 14638 1 1 18 LEU HD13 H -3.328 0.297 -5.683 1.00 . A A . 797 LEU HD13 1 1 20 14639 1 1 18 LEU HD21 H -4.523 1.333 -2.303 1.00 . A A . 797 LEU HD21 1 1 20 14640 1 1 18 LEU HD22 H -3.532 0.143 -3.149 1.00 . A A . 797 LEU HD22 1 1 20 14641 1 1 18 LEU HD23 H -5.285 0.129 -3.341 1.00 . A A . 797 LEU HD23 1 1 20 14642 1 1 18 LEU HG H -5.185 2.313 -4.431 1.00 . A A . 797 LEU HG 1 1 20 14643 1 1 18 LEU N N -4.440 4.085 -2.896 1.00 . A A . 797 LEU N 1 1 20 14644 1 1 18 LEU O O -2.409 5.765 -3.768 1.00 . A A . 797 LEU O 1 1 20 14645 1 1 19 LEU C C 1.447 4.141 -3.442 1.00 . A A . 798 LEU C 1 1 20 14646 1 1 19 LEU CA C 0.316 5.143 -3.286 1.00 . A A . 798 LEU CA 1 1 20 14647 1 1 19 LEU CB C 0.613 6.284 -2.271 1.00 . A A . 798 LEU CB 1 1 20 14648 1 1 19 LEU CD1 C 0.386 4.805 -0.209 1.00 . A A . 798 LEU CD1 1 1 20 14649 1 1 19 LEU CD2 C 2.651 5.564 -0.980 1.00 . A A . 798 LEU CD2 1 1 20 14650 1 1 19 LEU CG C 1.179 5.915 -0.881 1.00 . A A . 798 LEU CG 1 1 20 14651 1 1 19 LEU H H -0.735 3.584 -2.345 1.00 . A A . 798 LEU H 1 1 20 14652 1 1 19 LEU HA H 0.155 5.570 -4.263 1.00 . A A . 798 LEU HA 1 1 20 14653 1 1 19 LEU HB2 H 1.317 6.957 -2.738 1.00 . A A . 798 LEU HB2 1 1 20 14654 1 1 19 LEU HB3 H -0.307 6.829 -2.117 1.00 . A A . 798 LEU HB3 1 1 20 14655 1 1 19 LEU HD11 H 0.820 4.586 0.756 1.00 . A A . 798 LEU HD11 1 1 20 14656 1 1 19 LEU HD12 H 0.416 3.919 -0.826 1.00 . A A . 798 LEU HD12 1 1 20 14657 1 1 19 LEU HD13 H -0.638 5.120 -0.080 1.00 . A A . 798 LEU HD13 1 1 20 14658 1 1 19 LEU HD21 H 2.994 5.171 -0.036 1.00 . A A . 798 LEU HD21 1 1 20 14659 1 1 19 LEU HD22 H 3.214 6.450 -1.230 1.00 . A A . 798 LEU HD22 1 1 20 14660 1 1 19 LEU HD23 H 2.786 4.823 -1.754 1.00 . A A . 798 LEU HD23 1 1 20 14661 1 1 19 LEU HG H 1.100 6.786 -0.244 1.00 . A A . 798 LEU HG 1 1 20 14662 1 1 19 LEU N N -0.860 4.375 -2.917 1.00 . A A . 798 LEU N 1 1 20 14663 1 1 19 LEU O O 1.467 3.123 -2.747 1.00 . A A . 798 LEU O 1 1 20 14664 1 1 20 LYS C C 4.601 3.328 -4.196 1.00 . A A . 799 LYS C 1 1 20 14665 1 1 20 LYS CA C 3.199 3.259 -4.795 1.00 . A A . 799 LYS CA 1 1 20 14666 1 1 20 LYS CB C 3.242 3.048 -6.316 1.00 . A A . 799 LYS CB 1 1 20 14667 1 1 20 LYS CD C 3.611 5.472 -6.930 1.00 . A A . 799 LYS CD 1 1 20 14668 1 1 20 LYS CE C 4.557 6.472 -7.568 1.00 . A A . 799 LYS CE 1 1 20 14669 1 1 20 LYS CG C 4.118 4.047 -7.071 1.00 . A A . 799 LYS CG 1 1 20 14670 1 1 20 LYS H H 2.370 5.239 -4.834 1.00 . A A . 799 LYS H 1 1 20 14671 1 1 20 LYS HA H 2.731 2.425 -4.306 1.00 . A A . 799 LYS HA 1 1 20 14672 1 1 20 LYS HB2 H 3.615 2.055 -6.516 1.00 . A A . 799 LYS HB2 1 1 20 14673 1 1 20 LYS HB3 H 2.237 3.126 -6.703 1.00 . A A . 799 LYS HB3 1 1 20 14674 1 1 20 LYS HD2 H 2.646 5.548 -7.407 1.00 . A A . 799 LYS HD2 1 1 20 14675 1 1 20 LYS HD3 H 3.512 5.704 -5.878 1.00 . A A . 799 LYS HD3 1 1 20 14676 1 1 20 LYS HE2 H 5.539 6.355 -7.132 1.00 . A A . 799 LYS HE2 1 1 20 14677 1 1 20 LYS HE3 H 4.607 6.275 -8.628 1.00 . A A . 799 LYS HE3 1 1 20 14678 1 1 20 LYS HG2 H 5.122 3.995 -6.676 1.00 . A A . 799 LYS HG2 1 1 20 14679 1 1 20 LYS HG3 H 4.128 3.780 -8.118 1.00 . A A . 799 LYS HG3 1 1 20 14680 1 1 20 LYS HZ1 H 3.162 8.010 -7.788 1.00 . A A . 799 LYS HZ1 1 1 20 14681 1 1 20 LYS HZ2 H 4.771 8.540 -7.796 1.00 . A A . 799 LYS HZ2 1 1 20 14682 1 1 20 LYS HZ3 H 4.041 8.079 -6.336 1.00 . A A . 799 LYS HZ3 1 1 20 14683 1 1 20 LYS N N 2.326 4.355 -4.408 1.00 . A A . 799 LYS N 1 1 20 14684 1 1 20 LYS NZ N 4.099 7.870 -7.358 1.00 . A A . 799 LYS NZ 1 1 20 14685 1 1 20 LYS O O 5.243 4.376 -4.125 1.00 . A A . 799 LYS O 1 1 20 14686 1 1 21 CYS C C 7.433 2.398 -4.173 1.00 . A A . 800 CYS C 1 1 20 14687 1 1 21 CYS CA C 6.339 1.812 -3.279 1.00 . A A . 800 CYS CA 1 1 20 14688 1 1 21 CYS CB C 6.361 0.287 -3.318 1.00 . A A . 800 CYS CB 1 1 20 14689 1 1 21 CYS H H 4.344 1.424 -3.702 1.00 . A A . 800 CYS H 1 1 20 14690 1 1 21 CYS HA H 6.457 2.151 -2.263 1.00 . A A . 800 CYS HA 1 1 20 14691 1 1 21 CYS HB2 H 5.539 -0.075 -2.722 1.00 . A A . 800 CYS HB2 1 1 20 14692 1 1 21 CYS HB3 H 6.196 -0.023 -4.341 1.00 . A A . 800 CYS HB3 1 1 20 14693 1 1 21 CYS N N 5.008 2.144 -3.750 1.00 . A A . 800 CYS N 1 1 20 14694 1 1 21 CYS O O 7.648 1.928 -5.283 1.00 . A A . 800 CYS O 1 1 20 14695 1 1 21 CYS SG S 7.828 -0.577 -2.733 1.00 . A A . 800 CYS SG 1 1 20 14696 1 1 22 GLU C C 10.386 3.182 -4.726 1.00 . A A . 801 GLU C 1 1 20 14697 1 1 22 GLU CA C 9.186 4.103 -4.412 1.00 . A A . 801 GLU CA 1 1 20 14698 1 1 22 GLU CB C 9.652 5.322 -3.604 1.00 . A A . 801 GLU CB 1 1 20 14699 1 1 22 GLU CD C 11.081 7.397 -3.512 1.00 . A A . 801 GLU CD 1 1 20 14700 1 1 22 GLU CG C 10.498 6.312 -4.392 1.00 . A A . 801 GLU CG 1 1 20 14701 1 1 22 GLU H H 7.860 3.774 -2.792 1.00 . A A . 801 GLU H 1 1 20 14702 1 1 22 GLU HA H 8.780 4.447 -5.350 1.00 . A A . 801 GLU HA 1 1 20 14703 1 1 22 GLU HB2 H 8.783 5.844 -3.235 1.00 . A A . 801 GLU HB2 1 1 20 14704 1 1 22 GLU HB3 H 10.236 4.976 -2.763 1.00 . A A . 801 GLU HB3 1 1 20 14705 1 1 22 GLU HG2 H 11.308 5.779 -4.867 1.00 . A A . 801 GLU HG2 1 1 20 14706 1 1 22 GLU HG3 H 9.880 6.775 -5.148 1.00 . A A . 801 GLU HG3 1 1 20 14707 1 1 22 GLU N N 8.114 3.422 -3.677 1.00 . A A . 801 GLU N 1 1 20 14708 1 1 22 GLU O O 11.399 3.636 -5.255 1.00 . A A . 801 GLU O 1 1 20 14709 1 1 22 GLU OE1 O 12.171 7.186 -2.938 1.00 . A A . 801 GLU OE1 1 1 20 14710 1 1 22 GLU OE2 O 10.454 8.471 -3.395 1.00 . A A . 801 GLU OE2 1 1 20 14711 1 1 23 TYR C C 11.042 0.136 -5.955 1.00 . A A . 802 TYR C 1 1 20 14712 1 1 23 TYR CA C 11.375 0.974 -4.718 1.00 . A A . 802 TYR CA 1 1 20 14713 1 1 23 TYR CB C 11.682 0.074 -3.514 1.00 . A A . 802 TYR CB 1 1 20 14714 1 1 23 TYR CD1 C 14.184 -0.060 -3.203 1.00 . A A . 802 TYR CD1 1 1 20 14715 1 1 23 TYR CD2 C 13.071 -1.954 -4.124 1.00 . A A . 802 TYR CD2 1 1 20 14716 1 1 23 TYR CE1 C 15.394 -0.721 -3.290 1.00 . A A . 802 TYR CE1 1 1 20 14717 1 1 23 TYR CE2 C 14.279 -2.623 -4.215 1.00 . A A . 802 TYR CE2 1 1 20 14718 1 1 23 TYR CG C 13.003 -0.662 -3.617 1.00 . A A . 802 TYR CG 1 1 20 14719 1 1 23 TYR CZ C 15.435 -2.001 -3.797 1.00 . A A . 802 TYR CZ 1 1 20 14720 1 1 23 TYR H H 9.454 1.559 -4.021 1.00 . A A . 802 TYR H 1 1 20 14721 1 1 23 TYR HA H 12.242 1.575 -4.951 1.00 . A A . 802 TYR HA 1 1 20 14722 1 1 23 TYR HB2 H 11.711 0.679 -2.619 1.00 . A A . 802 TYR HB2 1 1 20 14723 1 1 23 TYR HB3 H 10.899 -0.663 -3.414 1.00 . A A . 802 TYR HB3 1 1 20 14724 1 1 23 TYR HD1 H 14.151 0.944 -2.806 1.00 . A A . 802 TYR HD1 1 1 20 14725 1 1 23 TYR HD2 H 12.163 -2.440 -4.450 1.00 . A A . 802 TYR HD2 1 1 20 14726 1 1 23 TYR HE1 H 16.300 -0.236 -2.962 1.00 . A A . 802 TYR HE1 1 1 20 14727 1 1 23 TYR HE2 H 14.312 -3.626 -4.613 1.00 . A A . 802 TYR HE2 1 1 20 14728 1 1 23 TYR HH H 17.205 -2.402 -3.140 1.00 . A A . 802 TYR HH 1 1 20 14729 1 1 23 TYR N N 10.283 1.894 -4.420 1.00 . A A . 802 TYR N 1 1 20 14730 1 1 23 TYR O O 11.845 0.028 -6.881 1.00 . A A . 802 TYR O 1 1 20 14731 1 1 23 TYR OH O 16.641 -2.662 -3.886 1.00 . A A . 802 TYR OH 1 1 20 14732 1 1 24 CYS C C 8.294 -0.654 -7.886 1.00 . A A . 803 CYS C 1 1 20 14733 1 1 24 CYS CA C 9.434 -1.289 -7.087 1.00 . A A . 803 CYS CA 1 1 20 14734 1 1 24 CYS CB C 9.029 -2.663 -6.563 1.00 . A A . 803 CYS CB 1 1 20 14735 1 1 24 CYS H H 9.249 -0.322 -5.213 1.00 . A A . 803 CYS H 1 1 20 14736 1 1 24 CYS HA H 10.254 -1.380 -7.782 1.00 . A A . 803 CYS HA 1 1 20 14737 1 1 24 CYS HB2 H 8.549 -3.220 -7.354 1.00 . A A . 803 CYS HB2 1 1 20 14738 1 1 24 CYS HB3 H 9.911 -3.193 -6.236 1.00 . A A . 803 CYS HB3 1 1 20 14739 1 1 24 CYS N N 9.854 -0.444 -5.974 1.00 . A A . 803 CYS N 1 1 20 14740 1 1 24 CYS O O 8.063 -1.019 -9.040 1.00 . A A . 803 CYS O 1 1 20 14741 1 1 24 CYS SG S 7.883 -2.580 -5.160 1.00 . A A . 803 CYS SG 1 1 20 14742 1 1 25 GLY C C 5.223 0.448 -7.943 1.00 . A A . 804 GLY C 1 1 20 14743 1 1 25 GLY CA C 6.608 1.044 -8.032 1.00 . A A . 804 GLY CA 1 1 20 14744 1 1 25 GLY H H 7.707 0.456 -6.338 1.00 . A A . 804 GLY H 1 1 20 14745 1 1 25 GLY HA2 H 6.579 2.050 -7.645 1.00 . A A . 804 GLY HA2 1 1 20 14746 1 1 25 GLY HA3 H 6.910 1.073 -9.064 1.00 . A A . 804 GLY HA3 1 1 20 14747 1 1 25 GLY N N 7.588 0.285 -7.289 1.00 . A A . 804 GLY N 1 1 20 14748 1 1 25 GLY O O 4.337 0.808 -8.714 1.00 . A A . 804 GLY O 1 1 20 14749 1 1 26 LYS C C 2.796 -0.354 -6.032 1.00 . A A . 805 LYS C 1 1 20 14750 1 1 26 LYS CA C 3.762 -1.162 -6.883 1.00 . A A . 805 LYS CA 1 1 20 14751 1 1 26 LYS CB C 3.979 -2.557 -6.290 1.00 . A A . 805 LYS CB 1 1 20 14752 1 1 26 LYS CD C 4.136 -3.687 -8.522 1.00 . A A . 805 LYS CD 1 1 20 14753 1 1 26 LYS CE C 5.053 -4.383 -9.516 1.00 . A A . 805 LYS CE 1 1 20 14754 1 1 26 LYS CG C 4.815 -3.460 -7.182 1.00 . A A . 805 LYS CG 1 1 20 14755 1 1 26 LYS H H 5.730 -0.638 -6.346 1.00 . A A . 805 LYS H 1 1 20 14756 1 1 26 LYS HA H 3.369 -1.264 -7.884 1.00 . A A . 805 LYS HA 1 1 20 14757 1 1 26 LYS HB2 H 4.483 -2.458 -5.339 1.00 . A A . 805 LYS HB2 1 1 20 14758 1 1 26 LYS HB3 H 3.018 -3.025 -6.134 1.00 . A A . 805 LYS HB3 1 1 20 14759 1 1 26 LYS HD2 H 3.261 -4.298 -8.369 1.00 . A A . 805 LYS HD2 1 1 20 14760 1 1 26 LYS HD3 H 3.841 -2.730 -8.930 1.00 . A A . 805 LYS HD3 1 1 20 14761 1 1 26 LYS HE2 H 4.520 -4.507 -10.448 1.00 . A A . 805 LYS HE2 1 1 20 14762 1 1 26 LYS HE3 H 5.917 -3.759 -9.680 1.00 . A A . 805 LYS HE3 1 1 20 14763 1 1 26 LYS HG2 H 5.777 -2.996 -7.349 1.00 . A A . 805 LYS HG2 1 1 20 14764 1 1 26 LYS HG3 H 4.951 -4.411 -6.689 1.00 . A A . 805 LYS HG3 1 1 20 14765 1 1 26 LYS HZ1 H 6.255 -5.616 -8.327 1.00 . A A . 805 LYS HZ1 1 1 20 14766 1 1 26 LYS HZ2 H 5.880 -6.274 -9.844 1.00 . A A . 805 LYS HZ2 1 1 20 14767 1 1 26 LYS HZ3 H 4.706 -6.241 -8.618 1.00 . A A . 805 LYS HZ3 1 1 20 14768 1 1 26 LYS N N 5.030 -0.466 -7.005 1.00 . A A . 805 LYS N 1 1 20 14769 1 1 26 LYS NZ N 5.504 -5.718 -9.041 1.00 . A A . 805 LYS NZ 1 1 20 14770 1 1 26 LYS O O 3.177 0.173 -4.986 1.00 . A A . 805 LYS O 1 1 20 14771 1 1 27 TYR C C -0.129 -0.411 -4.720 1.00 . A A . 806 TYR C 1 1 20 14772 1 1 27 TYR CA C 0.529 0.479 -5.755 1.00 . A A . 806 TYR CA 1 1 20 14773 1 1 27 TYR CB C -0.529 1.027 -6.718 1.00 . A A . 806 TYR CB 1 1 20 14774 1 1 27 TYR CD1 C 0.646 1.858 -8.795 1.00 . A A . 806 TYR CD1 1 1 20 14775 1 1 27 TYR CD2 C -0.214 3.469 -7.262 1.00 . A A . 806 TYR CD2 1 1 20 14776 1 1 27 TYR CE1 C 1.116 2.871 -9.606 1.00 . A A . 806 TYR CE1 1 1 20 14777 1 1 27 TYR CE2 C 0.253 4.489 -8.069 1.00 . A A . 806 TYR CE2 1 1 20 14778 1 1 27 TYR CG C -0.022 2.137 -7.610 1.00 . A A . 806 TYR CG 1 1 20 14779 1 1 27 TYR CZ C 0.915 4.186 -9.239 1.00 . A A . 806 TYR CZ 1 1 20 14780 1 1 27 TYR H H 1.293 -0.755 -7.288 1.00 . A A . 806 TYR H 1 1 20 14781 1 1 27 TYR HA H 0.987 1.303 -5.229 1.00 . A A . 806 TYR HA 1 1 20 14782 1 1 27 TYR HB2 H -0.875 0.226 -7.351 1.00 . A A . 806 TYR HB2 1 1 20 14783 1 1 27 TYR HB3 H -1.361 1.413 -6.147 1.00 . A A . 806 TYR HB3 1 1 20 14784 1 1 27 TYR HD1 H 0.802 0.825 -9.079 1.00 . A A . 806 TYR HD1 1 1 20 14785 1 1 27 TYR HD2 H -0.734 3.704 -6.346 1.00 . A A . 806 TYR HD2 1 1 20 14786 1 1 27 TYR HE1 H 1.636 2.634 -10.522 1.00 . A A . 806 TYR HE1 1 1 20 14787 1 1 27 TYR HE2 H 0.097 5.518 -7.780 1.00 . A A . 806 TYR HE2 1 1 20 14788 1 1 27 TYR HH H 1.186 4.987 -10.971 1.00 . A A . 806 TYR HH 1 1 20 14789 1 1 27 TYR N N 1.551 -0.265 -6.474 1.00 . A A . 806 TYR N 1 1 20 14790 1 1 27 TYR O O -0.523 -1.542 -5.013 1.00 . A A . 806 TYR O 1 1 20 14791 1 1 27 TYR OH O 1.382 5.199 -10.045 1.00 . A A . 806 TYR OH 1 1 20 14792 1 1 28 ALA C C -1.484 0.317 -1.425 1.00 . A A . 807 ALA C 1 1 20 14793 1 1 28 ALA CA C -0.798 -0.636 -2.396 1.00 . A A . 807 ALA CA 1 1 20 14794 1 1 28 ALA CB C 0.307 -1.413 -1.696 1.00 . A A . 807 ALA CB 1 1 20 14795 1 1 28 ALA H H 0.105 1.022 -3.354 1.00 . A A . 807 ALA H 1 1 20 14796 1 1 28 ALA HA H -1.523 -1.337 -2.783 1.00 . A A . 807 ALA HA 1 1 20 14797 1 1 28 ALA HB1 H -0.117 -2.008 -0.900 1.00 . A A . 807 ALA HB1 1 1 20 14798 1 1 28 ALA HB2 H 1.027 -0.721 -1.283 1.00 . A A . 807 ALA HB2 1 1 20 14799 1 1 28 ALA HB3 H 0.798 -2.061 -2.407 1.00 . A A . 807 ALA HB3 1 1 20 14800 1 1 28 ALA N N -0.237 0.111 -3.509 1.00 . A A . 807 ALA N 1 1 20 14801 1 1 28 ALA O O -1.154 1.504 -1.373 1.00 . A A . 807 ALA O 1 1 20 14802 1 1 29 PRO C C -2.355 1.198 1.370 1.00 . A A . 808 PRO C 1 1 20 14803 1 1 29 PRO CA C -3.239 0.641 0.266 1.00 . A A . 808 PRO CA 1 1 20 14804 1 1 29 PRO CB C -4.290 -0.315 0.843 1.00 . A A . 808 PRO CB 1 1 20 14805 1 1 29 PRO CD C -2.943 -1.579 -0.674 1.00 . A A . 808 PRO CD 1 1 20 14806 1 1 29 PRO CG C -4.321 -1.478 -0.090 1.00 . A A . 808 PRO CG 1 1 20 14807 1 1 29 PRO HA H -3.723 1.460 -0.248 1.00 . A A . 808 PRO HA 1 1 20 14808 1 1 29 PRO HB2 H -3.997 -0.617 1.838 1.00 . A A . 808 PRO HB2 1 1 20 14809 1 1 29 PRO HB3 H -5.249 0.181 0.881 1.00 . A A . 808 PRO HB3 1 1 20 14810 1 1 29 PRO HD2 H -2.313 -2.200 -0.054 1.00 . A A . 808 PRO HD2 1 1 20 14811 1 1 29 PRO HD3 H -2.986 -1.968 -1.682 1.00 . A A . 808 PRO HD3 1 1 20 14812 1 1 29 PRO HG2 H -4.563 -2.380 0.455 1.00 . A A . 808 PRO HG2 1 1 20 14813 1 1 29 PRO HG3 H -5.046 -1.306 -0.870 1.00 . A A . 808 PRO HG3 1 1 20 14814 1 1 29 PRO N N -2.479 -0.183 -0.670 1.00 . A A . 808 PRO N 1 1 20 14815 1 1 29 PRO O O -1.601 0.461 2.009 1.00 . A A . 808 PRO O 1 1 20 14816 1 1 30 ALA C C -1.572 2.576 3.903 1.00 . A A . 809 ALA C 1 1 20 14817 1 1 30 ALA CA C -1.639 3.257 2.532 1.00 . A A . 809 ALA CA 1 1 20 14818 1 1 30 ALA CB C -2.192 4.664 2.688 1.00 . A A . 809 ALA CB 1 1 20 14819 1 1 30 ALA H H -3.058 3.021 0.962 1.00 . A A . 809 ALA H 1 1 20 14820 1 1 30 ALA HA H -0.644 3.345 2.112 1.00 . A A . 809 ALA HA 1 1 20 14821 1 1 30 ALA HB1 H -2.229 5.143 1.721 1.00 . A A . 809 ALA HB1 1 1 20 14822 1 1 30 ALA HB2 H -1.553 5.233 3.348 1.00 . A A . 809 ALA HB2 1 1 20 14823 1 1 30 ALA HB3 H -3.188 4.616 3.102 1.00 . A A . 809 ALA HB3 1 1 20 14824 1 1 30 ALA N N -2.448 2.515 1.552 1.00 . A A . 809 ALA N 1 1 20 14825 1 1 30 ALA O O -0.592 2.726 4.629 1.00 . A A . 809 ALA O 1 1 20 14826 1 1 31 GLU C C -1.500 0.193 5.701 1.00 . A A . 810 GLU C 1 1 20 14827 1 1 31 GLU CA C -2.725 1.089 5.492 1.00 . A A . 810 GLU CA 1 1 20 14828 1 1 31 GLU CB C -4.000 0.235 5.447 1.00 . A A . 810 GLU CB 1 1 20 14829 1 1 31 GLU CD C -4.439 -0.291 7.887 1.00 . A A . 810 GLU CD 1 1 20 14830 1 1 31 GLU CG C -4.089 -0.839 6.519 1.00 . A A . 810 GLU CG 1 1 20 14831 1 1 31 GLU H H -3.380 1.804 3.616 1.00 . A A . 810 GLU H 1 1 20 14832 1 1 31 GLU HA H -2.795 1.791 6.307 1.00 . A A . 810 GLU HA 1 1 20 14833 1 1 31 GLU HB2 H -4.851 0.886 5.558 1.00 . A A . 810 GLU HB2 1 1 20 14834 1 1 31 GLU HB3 H -4.056 -0.249 4.481 1.00 . A A . 810 GLU HB3 1 1 20 14835 1 1 31 GLU HG2 H -4.850 -1.549 6.231 1.00 . A A . 810 GLU HG2 1 1 20 14836 1 1 31 GLU HG3 H -3.136 -1.343 6.580 1.00 . A A . 810 GLU HG3 1 1 20 14837 1 1 31 GLU N N -2.631 1.844 4.239 1.00 . A A . 810 GLU N 1 1 20 14838 1 1 31 GLU O O -0.999 0.046 6.816 1.00 . A A . 810 GLU O 1 1 20 14839 1 1 31 GLU OE1 O -5.643 -0.168 8.191 1.00 . A A . 810 GLU OE1 1 1 20 14840 1 1 31 GLU OE2 O -3.517 -0.004 8.675 1.00 . A A . 810 GLU OE2 1 1 20 14841 1 1 32 GLN C C 1.422 -0.623 4.833 1.00 . A A . 811 GLN C 1 1 20 14842 1 1 32 GLN CA C 0.077 -1.331 4.659 1.00 . A A . 811 GLN CA 1 1 20 14843 1 1 32 GLN CB C 0.054 -2.160 3.376 1.00 . A A . 811 GLN CB 1 1 20 14844 1 1 32 GLN CD C 1.243 -3.740 1.841 1.00 . A A . 811 GLN CD 1 1 20 14845 1 1 32 GLN CG C 1.273 -3.032 3.171 1.00 . A A . 811 GLN CG 1 1 20 14846 1 1 32 GLN H H -1.409 -0.150 3.744 1.00 . A A . 811 GLN H 1 1 20 14847 1 1 32 GLN HA H -0.087 -1.987 5.504 1.00 . A A . 811 GLN HA 1 1 20 14848 1 1 32 GLN HB2 H -0.815 -2.799 3.394 1.00 . A A . 811 GLN HB2 1 1 20 14849 1 1 32 GLN HB3 H -0.025 -1.488 2.534 1.00 . A A . 811 GLN HB3 1 1 20 14850 1 1 32 GLN HE21 H 1.944 -2.108 0.964 1.00 . A A . 811 GLN HE21 1 1 20 14851 1 1 32 GLN HE22 H 1.673 -3.470 -0.075 1.00 . A A . 811 GLN HE22 1 1 20 14852 1 1 32 GLN HG2 H 2.156 -2.412 3.212 1.00 . A A . 811 GLN HG2 1 1 20 14853 1 1 32 GLN HG3 H 1.312 -3.771 3.958 1.00 . A A . 811 GLN HG3 1 1 20 14854 1 1 32 GLN N N -1.015 -0.380 4.612 1.00 . A A . 811 GLN N 1 1 20 14855 1 1 32 GLN NE2 N 1.660 -3.035 0.807 1.00 . A A . 811 GLN NE2 1 1 20 14856 1 1 32 GLN O O 2.384 -1.215 5.325 1.00 . A A . 811 GLN O 1 1 20 14857 1 1 32 GLN OE1 O 0.800 -4.883 1.734 1.00 . A A . 811 GLN OE1 1 1 20 14858 1 1 33 PHE C C 3.066 1.835 5.962 1.00 . A A . 812 PHE C 1 1 20 14859 1 1 33 PHE CA C 2.701 1.450 4.522 1.00 . A A . 812 PHE CA 1 1 20 14860 1 1 33 PHE CB C 2.538 2.709 3.673 1.00 . A A . 812 PHE CB 1 1 20 14861 1 1 33 PHE CD1 C 1.673 1.784 1.514 1.00 . A A . 812 PHE CD1 1 1 20 14862 1 1 33 PHE CD2 C 3.806 2.845 1.508 1.00 . A A . 812 PHE CD2 1 1 20 14863 1 1 33 PHE CE1 C 1.786 1.546 0.158 1.00 . A A . 812 PHE CE1 1 1 20 14864 1 1 33 PHE CE2 C 3.924 2.608 0.154 1.00 . A A . 812 PHE CE2 1 1 20 14865 1 1 33 PHE CG C 2.680 2.433 2.204 1.00 . A A . 812 PHE CG 1 1 20 14866 1 1 33 PHE CZ C 2.972 1.887 -0.503 1.00 . A A . 812 PHE CZ 1 1 20 14867 1 1 33 PHE H H 0.735 1.002 3.897 1.00 . A A . 812 PHE H 1 1 20 14868 1 1 33 PHE HA H 3.501 0.877 4.079 1.00 . A A . 812 PHE HA 1 1 20 14869 1 1 33 PHE HB2 H 1.559 3.134 3.842 1.00 . A A . 812 PHE HB2 1 1 20 14870 1 1 33 PHE HB3 H 3.294 3.426 3.953 1.00 . A A . 812 PHE HB3 1 1 20 14871 1 1 33 PHE HD1 H 0.789 1.461 2.046 1.00 . A A . 812 PHE HD1 1 1 20 14872 1 1 33 PHE HD2 H 4.599 3.351 2.036 1.00 . A A . 812 PHE HD2 1 1 20 14873 1 1 33 PHE HE1 H 0.992 1.037 -0.369 1.00 . A A . 812 PHE HE1 1 1 20 14874 1 1 33 PHE HE2 H 4.807 2.933 -0.377 1.00 . A A . 812 PHE HE2 1 1 20 14875 1 1 33 PHE HZ H 3.086 1.675 -1.557 1.00 . A A . 812 PHE HZ 1 1 20 14876 1 1 33 PHE N N 1.483 0.639 4.413 1.00 . A A . 812 PHE N 1 1 20 14877 1 1 33 PHE O O 3.334 2.999 6.263 1.00 . A A . 812 PHE O 1 1 20 14878 1 1 34 ARG C C 5.068 0.935 8.227 1.00 . A A . 813 ARG C 1 1 20 14879 1 1 34 ARG CA C 3.550 1.007 8.199 1.00 . A A . 813 ARG CA 1 1 20 14880 1 1 34 ARG CB C 2.941 -0.073 9.090 1.00 . A A . 813 ARG CB 1 1 20 14881 1 1 34 ARG CD C 0.840 -1.185 9.907 1.00 . A A . 813 ARG CD 1 1 20 14882 1 1 34 ARG CG C 1.424 -0.057 9.081 1.00 . A A . 813 ARG CG 1 1 20 14883 1 1 34 ARG CZ C -1.263 -2.452 9.705 1.00 . A A . 813 ARG CZ 1 1 20 14884 1 1 34 ARG H H 2.777 -0.040 6.537 1.00 . A A . 813 ARG H 1 1 20 14885 1 1 34 ARG HA H 3.268 1.977 8.583 1.00 . A A . 813 ARG HA 1 1 20 14886 1 1 34 ARG HB2 H 3.276 -1.042 8.748 1.00 . A A . 813 ARG HB2 1 1 20 14887 1 1 34 ARG HB3 H 3.278 0.079 10.105 1.00 . A A . 813 ARG HB3 1 1 20 14888 1 1 34 ARG HD2 H 1.313 -2.112 9.617 1.00 . A A . 813 ARG HD2 1 1 20 14889 1 1 34 ARG HD3 H 1.033 -0.990 10.951 1.00 . A A . 813 ARG HD3 1 1 20 14890 1 1 34 ARG HE H -1.097 -0.461 9.526 1.00 . A A . 813 ARG HE 1 1 20 14891 1 1 34 ARG HG2 H 1.082 0.883 9.486 1.00 . A A . 813 ARG HG2 1 1 20 14892 1 1 34 ARG HG3 H 1.081 -0.154 8.060 1.00 . A A . 813 ARG HG3 1 1 20 14893 1 1 34 ARG HH11 H 0.345 -3.567 10.224 1.00 . A A . 813 ARG HH11 1 1 20 14894 1 1 34 ARG HH12 H -1.122 -4.456 9.971 1.00 . A A . 813 ARG HH12 1 1 20 14895 1 1 34 ARG HH21 H -3.049 -1.605 9.247 1.00 . A A . 813 ARG HH21 1 1 20 14896 1 1 34 ARG HH22 H -3.064 -3.343 9.441 1.00 . A A . 813 ARG HH22 1 1 20 14897 1 1 34 ARG N N 3.084 0.845 6.832 1.00 . A A . 813 ARG N 1 1 20 14898 1 1 34 ARG NE N -0.600 -1.299 9.702 1.00 . A A . 813 ARG NE 1 1 20 14899 1 1 34 ARG NH1 N -0.630 -3.581 9.994 1.00 . A A . 813 ARG NH1 1 1 20 14900 1 1 34 ARG NH2 N -2.560 -2.470 9.446 1.00 . A A . 813 ARG NH2 1 1 20 14901 1 1 34 ARG O O 5.683 0.210 7.445 1.00 . A A . 813 ARG O 1 1 20 14902 1 1 35 GLY C C 7.536 3.072 8.349 1.00 . A A . 814 GLY C 1 1 20 14903 1 1 35 GLY CA C 7.104 1.853 9.135 1.00 . A A . 814 GLY CA 1 1 20 14904 1 1 35 GLY H H 5.122 2.192 9.779 1.00 . A A . 814 GLY H 1 1 20 14905 1 1 35 GLY HA2 H 7.438 1.953 10.158 1.00 . A A . 814 GLY HA2 1 1 20 14906 1 1 35 GLY HA3 H 7.555 0.974 8.700 1.00 . A A . 814 GLY HA3 1 1 20 14907 1 1 35 GLY N N 5.666 1.711 9.118 1.00 . A A . 814 GLY N 1 1 20 14908 1 1 35 GLY O O 8.227 3.949 8.869 1.00 . A A . 814 GLY O 1 1 20 14909 1 1 36 SER C C 6.449 4.320 5.054 1.00 . A A . 815 SER C 1 1 20 14910 1 1 36 SER CA C 7.411 4.267 6.238 1.00 . A A . 815 SER CA 1 1 20 14911 1 1 36 SER CB C 8.856 4.170 5.743 1.00 . A A . 815 SER CB 1 1 20 14912 1 1 36 SER H H 6.552 2.406 6.746 1.00 . A A . 815 SER H 1 1 20 14913 1 1 36 SER HA H 7.300 5.166 6.824 1.00 . A A . 815 SER HA 1 1 20 14914 1 1 36 SER HB2 H 9.022 4.906 4.972 1.00 . A A . 815 SER HB2 1 1 20 14915 1 1 36 SER HB3 H 9.528 4.353 6.569 1.00 . A A . 815 SER HB3 1 1 20 14916 1 1 36 SER HG H 8.292 2.449 4.991 1.00 . A A . 815 SER HG 1 1 20 14917 1 1 36 SER N N 7.102 3.139 7.098 1.00 . A A . 815 SER N 1 1 20 14918 1 1 36 SER O O 6.332 3.349 4.299 1.00 . A A . 815 SER O 1 1 20 14919 1 1 36 SER OG O 9.125 2.882 5.212 1.00 . A A . 815 SER OG 1 1 20 14920 1 1 37 LYS C C 5.648 5.993 2.523 1.00 . A A . 816 LYS C 1 1 20 14921 1 1 37 LYS CA C 4.850 5.649 3.776 1.00 . A A . 816 LYS CA 1 1 20 14922 1 1 37 LYS CB C 3.845 6.750 4.104 1.00 . A A . 816 LYS CB 1 1 20 14923 1 1 37 LYS CD C 2.084 7.571 5.704 1.00 . A A . 816 LYS CD 1 1 20 14924 1 1 37 LYS CE C 1.172 7.180 6.854 1.00 . A A . 816 LYS CE 1 1 20 14925 1 1 37 LYS CG C 2.951 6.400 5.280 1.00 . A A . 816 LYS CG 1 1 20 14926 1 1 37 LYS H H 5.910 6.192 5.526 1.00 . A A . 816 LYS H 1 1 20 14927 1 1 37 LYS HA H 4.319 4.721 3.610 1.00 . A A . 816 LYS HA 1 1 20 14928 1 1 37 LYS HB2 H 4.384 7.655 4.341 1.00 . A A . 816 LYS HB2 1 1 20 14929 1 1 37 LYS HB3 H 3.220 6.925 3.243 1.00 . A A . 816 LYS HB3 1 1 20 14930 1 1 37 LYS HD2 H 2.720 8.384 6.023 1.00 . A A . 816 LYS HD2 1 1 20 14931 1 1 37 LYS HD3 H 1.480 7.886 4.867 1.00 . A A . 816 LYS HD3 1 1 20 14932 1 1 37 LYS HE2 H 0.472 6.437 6.503 1.00 . A A . 816 LYS HE2 1 1 20 14933 1 1 37 LYS HE3 H 1.774 6.760 7.646 1.00 . A A . 816 LYS HE3 1 1 20 14934 1 1 37 LYS HG2 H 2.309 5.579 4.999 1.00 . A A . 816 LYS HG2 1 1 20 14935 1 1 37 LYS HG3 H 3.571 6.104 6.112 1.00 . A A . 816 LYS HG3 1 1 20 14936 1 1 37 LYS HZ1 H 1.067 9.002 7.868 1.00 . A A . 816 LYS HZ1 1 1 20 14937 1 1 37 LYS HZ2 H -0.305 8.026 8.064 1.00 . A A . 816 LYS HZ2 1 1 20 14938 1 1 37 LYS HZ3 H -0.055 8.851 6.607 1.00 . A A . 816 LYS HZ3 1 1 20 14939 1 1 37 LYS N N 5.763 5.447 4.896 1.00 . A A . 816 LYS N 1 1 20 14940 1 1 37 LYS NZ N 0.419 8.343 7.384 1.00 . A A . 816 LYS NZ 1 1 20 14941 1 1 37 LYS O O 5.556 7.095 1.979 1.00 . A A . 816 LYS O 1 1 20 14942 1 1 38 ARG C C 7.541 3.851 0.270 1.00 . A A . 817 ARG C 1 1 20 14943 1 1 38 ARG CA C 7.406 5.173 1.015 1.00 . A A . 817 ARG CA 1 1 20 14944 1 1 38 ARG CB C 8.780 5.544 1.587 1.00 . A A . 817 ARG CB 1 1 20 14945 1 1 38 ARG CD C 10.265 7.211 2.711 1.00 . A A . 817 ARG CD 1 1 20 14946 1 1 38 ARG CG C 8.875 6.949 2.156 1.00 . A A . 817 ARG CG 1 1 20 14947 1 1 38 ARG CZ C 11.538 9.040 3.762 1.00 . A A . 817 ARG CZ 1 1 20 14948 1 1 38 ARG H H 6.376 4.147 2.519 1.00 . A A . 817 ARG H 1 1 20 14949 1 1 38 ARG HA H 7.108 5.931 0.307 1.00 . A A . 817 ARG HA 1 1 20 14950 1 1 38 ARG HB2 H 9.026 4.849 2.376 1.00 . A A . 817 ARG HB2 1 1 20 14951 1 1 38 ARG HB3 H 9.516 5.450 0.801 1.00 . A A . 817 ARG HB3 1 1 20 14952 1 1 38 ARG HD2 H 10.436 6.546 3.543 1.00 . A A . 817 ARG HD2 1 1 20 14953 1 1 38 ARG HD3 H 10.991 7.008 1.936 1.00 . A A . 817 ARG HD3 1 1 20 14954 1 1 38 ARG HE H 9.691 9.212 3.011 1.00 . A A . 817 ARG HE 1 1 20 14955 1 1 38 ARG HG2 H 8.666 7.664 1.374 1.00 . A A . 817 ARG HG2 1 1 20 14956 1 1 38 ARG HG3 H 8.153 7.056 2.952 1.00 . A A . 817 ARG HG3 1 1 20 14957 1 1 38 ARG HH11 H 12.493 7.246 3.745 1.00 . A A . 817 ARG HH11 1 1 20 14958 1 1 38 ARG HH12 H 13.398 8.563 4.435 1.00 . A A . 817 ARG HH12 1 1 20 14959 1 1 38 ARG HH21 H 10.844 10.937 3.970 1.00 . A A . 817 ARG HH21 1 1 20 14960 1 1 38 ARG HH22 H 12.452 10.661 4.564 1.00 . A A . 817 ARG HH22 1 1 20 14961 1 1 38 ARG N N 6.436 5.026 2.093 1.00 . A A . 817 ARG N 1 1 20 14962 1 1 38 ARG NE N 10.434 8.588 3.170 1.00 . A A . 817 ARG NE 1 1 20 14963 1 1 38 ARG NH1 N 12.553 8.217 4.004 1.00 . A A . 817 ARG NH1 1 1 20 14964 1 1 38 ARG NH2 N 11.617 10.312 4.132 1.00 . A A . 817 ARG NH2 1 1 20 14965 1 1 38 ARG O O 7.734 3.822 -0.943 1.00 . A A . 817 ARG O 1 1 20 14966 1 1 39 PHE C C 6.546 0.499 0.969 1.00 . A A . 818 PHE C 1 1 20 14967 1 1 39 PHE CA C 7.630 1.425 0.457 1.00 . A A . 818 PHE CA 1 1 20 14968 1 1 39 PHE CB C 9.003 0.903 0.876 1.00 . A A . 818 PHE CB 1 1 20 14969 1 1 39 PHE CD1 C 10.514 1.935 -0.840 1.00 . A A . 818 PHE CD1 1 1 20 14970 1 1 39 PHE CD2 C 10.752 2.613 1.432 1.00 . A A . 818 PHE CD2 1 1 20 14971 1 1 39 PHE CE1 C 11.521 2.806 -1.209 1.00 . A A . 818 PHE CE1 1 1 20 14972 1 1 39 PHE CE2 C 11.755 3.489 1.069 1.00 . A A . 818 PHE CE2 1 1 20 14973 1 1 39 PHE CG C 10.119 1.828 0.482 1.00 . A A . 818 PHE CG 1 1 20 14974 1 1 39 PHE CZ C 12.141 3.584 -0.253 1.00 . A A . 818 PHE CZ 1 1 20 14975 1 1 39 PHE H H 7.183 2.830 1.953 1.00 . A A . 818 PHE H 1 1 20 14976 1 1 39 PHE HA H 7.592 1.487 -0.621 1.00 . A A . 818 PHE HA 1 1 20 14977 1 1 39 PHE HB2 H 9.027 0.791 1.950 1.00 . A A . 818 PHE HB2 1 1 20 14978 1 1 39 PHE HB3 H 9.174 -0.054 0.414 1.00 . A A . 818 PHE HB3 1 1 20 14979 1 1 39 PHE HD1 H 10.031 1.326 -1.589 1.00 . A A . 818 PHE HD1 1 1 20 14980 1 1 39 PHE HD2 H 10.453 2.537 2.466 1.00 . A A . 818 PHE HD2 1 1 20 14981 1 1 39 PHE HE1 H 11.821 2.879 -2.245 1.00 . A A . 818 PHE HE1 1 1 20 14982 1 1 39 PHE HE2 H 12.240 4.097 1.818 1.00 . A A . 818 PHE HE2 1 1 20 14983 1 1 39 PHE HZ H 12.924 4.269 -0.540 1.00 . A A . 818 PHE HZ 1 1 20 14984 1 1 39 PHE N N 7.422 2.754 1.007 1.00 . A A . 818 PHE N 1 1 20 14985 1 1 39 PHE O O 6.161 0.584 2.137 1.00 . A A . 818 PHE O 1 1 20 14986 1 1 40 CYS C C 5.366 -2.304 1.449 1.00 . A A . 819 CYS C 1 1 20 14987 1 1 40 CYS CA C 4.922 -1.190 0.505 1.00 . A A . 819 CYS CA 1 1 20 14988 1 1 40 CYS CB C 4.244 -1.769 -0.736 1.00 . A A . 819 CYS CB 1 1 20 14989 1 1 40 CYS H H 6.506 -0.568 -0.719 1.00 . A A . 819 CYS H 1 1 20 14990 1 1 40 CYS HA H 4.208 -0.549 1.000 1.00 . A A . 819 CYS HA 1 1 20 14991 1 1 40 CYS HB2 H 3.633 -2.599 -0.437 1.00 . A A . 819 CYS HB2 1 1 20 14992 1 1 40 CYS HB3 H 3.617 -1.009 -1.179 1.00 . A A . 819 CYS HB3 1 1 20 14993 1 1 40 CYS N N 6.038 -0.371 0.113 1.00 . A A . 819 CYS N 1 1 20 14994 1 1 40 CYS O O 5.990 -3.274 1.008 1.00 . A A . 819 CYS O 1 1 20 14995 1 1 40 CYS SG S 5.373 -2.365 -2.015 1.00 . A A . 819 CYS SG 1 1 20 14996 1 1 41 SER C C 6.524 -3.407 4.283 1.00 . A A . 820 SER C 1 1 20 14997 1 1 41 SER CA C 5.105 -3.223 3.706 1.00 . A A . 820 SER CA 1 1 20 14998 1 1 41 SER CB C 4.544 -4.518 3.087 1.00 . A A . 820 SER CB 1 1 20 14999 1 1 41 SER H H 5.098 -1.234 3.119 1.00 . A A . 820 SER H 1 1 20 15000 1 1 41 SER HA H 4.422 -2.885 4.472 1.00 . A A . 820 SER HA 1 1 20 15001 1 1 41 SER HB2 H 3.543 -4.325 2.719 1.00 . A A . 820 SER HB2 1 1 20 15002 1 1 41 SER HB3 H 5.176 -4.826 2.266 1.00 . A A . 820 SER HB3 1 1 20 15003 1 1 41 SER HG H 3.555 -5.845 4.149 1.00 . A A . 820 SER HG 1 1 20 15004 1 1 41 SER N N 5.100 -2.132 2.739 1.00 . A A . 820 SER N 1 1 20 15005 1 1 41 SER O O 7.351 -2.492 4.204 1.00 . A A . 820 SER O 1 1 20 15006 1 1 41 SER OG O 4.480 -5.570 4.034 1.00 . A A . 820 SER OG 1 1 20 15007 1 1 42 MET C C 9.222 -5.139 4.556 1.00 . A A . 821 MET C 1 1 20 15008 1 1 42 MET CA C 8.083 -4.824 5.523 1.00 . A A . 821 MET CA 1 1 20 15009 1 1 42 MET CB C 7.914 -5.985 6.507 1.00 . A A . 821 MET CB 1 1 20 15010 1 1 42 MET CE C 6.589 -2.939 7.811 1.00 . A A . 821 MET CE 1 1 20 15011 1 1 42 MET CG C 6.920 -5.713 7.632 1.00 . A A . 821 MET CG 1 1 20 15012 1 1 42 MET H H 6.168 -5.320 4.732 1.00 . A A . 821 MET H 1 1 20 15013 1 1 42 MET HA H 8.329 -3.944 6.097 1.00 . A A . 821 MET HA 1 1 20 15014 1 1 42 MET HB2 H 7.573 -6.852 5.962 1.00 . A A . 821 MET HB2 1 1 20 15015 1 1 42 MET HB3 H 8.875 -6.206 6.950 1.00 . A A . 821 MET HB3 1 1 20 15016 1 1 42 MET HE1 H 6.962 -2.889 6.802 1.00 . A A . 821 MET HE1 1 1 20 15017 1 1 42 MET HE2 H 6.813 -2.013 8.322 1.00 . A A . 821 MET HE2 1 1 20 15018 1 1 42 MET HE3 H 5.517 -3.088 7.792 1.00 . A A . 821 MET HE3 1 1 20 15019 1 1 42 MET HG2 H 5.953 -5.515 7.193 1.00 . A A . 821 MET HG2 1 1 20 15020 1 1 42 MET HG3 H 6.856 -6.594 8.254 1.00 . A A . 821 MET HG3 1 1 20 15021 1 1 42 MET N N 6.820 -4.585 4.815 1.00 . A A . 821 MET N 1 1 20 15022 1 1 42 MET O O 10.258 -4.472 4.572 1.00 . A A . 821 MET O 1 1 20 15023 1 1 42 MET SD S 7.371 -4.303 8.678 1.00 . A A . 821 MET SD 1 1 20 15024 1 1 43 THR C C 10.570 -5.393 1.922 1.00 . A A . 822 THR C 1 1 20 15025 1 1 43 THR CA C 9.956 -6.571 2.685 1.00 . A A . 822 THR CA 1 1 20 15026 1 1 43 THR CB C 9.230 -7.482 1.677 1.00 . A A . 822 THR CB 1 1 20 15027 1 1 43 THR CG2 C 10.222 -8.278 0.845 1.00 . A A . 822 THR CG2 1 1 20 15028 1 1 43 THR H H 8.175 -6.662 3.814 1.00 . A A . 822 THR H 1 1 20 15029 1 1 43 THR HA H 10.771 -7.137 3.111 1.00 . A A . 822 THR HA 1 1 20 15030 1 1 43 THR HB H 8.636 -6.865 1.016 1.00 . A A . 822 THR HB 1 1 20 15031 1 1 43 THR HG1 H 8.525 -9.287 2.092 1.00 . A A . 822 THR HG1 1 1 20 15032 1 1 43 THR HG21 H 10.793 -8.928 1.491 1.00 . A A . 822 THR HG21 1 1 20 15033 1 1 43 THR HG22 H 10.891 -7.597 0.337 1.00 . A A . 822 THR HG22 1 1 20 15034 1 1 43 THR HG23 H 9.691 -8.872 0.118 1.00 . A A . 822 THR HG23 1 1 20 15035 1 1 43 THR N N 9.003 -6.147 3.715 1.00 . A A . 822 THR N 1 1 20 15036 1 1 43 THR O O 11.792 -5.273 1.831 1.00 . A A . 822 THR O 1 1 20 15037 1 1 43 THR OG1 O 8.361 -8.379 2.386 1.00 . A A . 822 THR OG1 1 1 20 15038 1 1 44 CYS C C 10.937 -2.363 1.392 1.00 . A A . 823 CYS C 1 1 20 15039 1 1 44 CYS CA C 10.193 -3.415 0.586 1.00 . A A . 823 CYS CA 1 1 20 15040 1 1 44 CYS CB C 9.014 -2.807 -0.140 1.00 . A A . 823 CYS CB 1 1 20 15041 1 1 44 CYS H H 8.779 -4.624 1.602 1.00 . A A . 823 CYS H 1 1 20 15042 1 1 44 CYS HA H 10.860 -3.801 -0.173 1.00 . A A . 823 CYS HA 1 1 20 15043 1 1 44 CYS HB2 H 8.218 -2.610 0.566 1.00 . A A . 823 CYS HB2 1 1 20 15044 1 1 44 CYS HB3 H 9.315 -1.887 -0.614 1.00 . A A . 823 CYS HB3 1 1 20 15045 1 1 44 CYS N N 9.732 -4.528 1.402 1.00 . A A . 823 CYS N 1 1 20 15046 1 1 44 CYS O O 12.027 -1.931 1.006 1.00 . A A . 823 CYS O 1 1 20 15047 1 1 44 CYS SG S 8.383 -3.916 -1.411 1.00 . A A . 823 CYS SG 1 1 20 15048 1 1 45 ALA C C 12.309 -1.311 3.846 1.00 . A A . 824 ALA C 1 1 20 15049 1 1 45 ALA CA C 10.933 -0.917 3.343 1.00 . A A . 824 ALA CA 1 1 20 15050 1 1 45 ALA CB C 10.025 -0.615 4.513 1.00 . A A . 824 ALA CB 1 1 20 15051 1 1 45 ALA H H 9.513 -2.387 2.801 1.00 . A A . 824 ALA H 1 1 20 15052 1 1 45 ALA HA H 11.008 -0.014 2.753 1.00 . A A . 824 ALA HA 1 1 20 15053 1 1 45 ALA HB1 H 10.450 0.189 5.091 1.00 . A A . 824 ALA HB1 1 1 20 15054 1 1 45 ALA HB2 H 9.931 -1.496 5.129 1.00 . A A . 824 ALA HB2 1 1 20 15055 1 1 45 ALA HB3 H 9.054 -0.323 4.141 1.00 . A A . 824 ALA HB3 1 1 20 15056 1 1 45 ALA N N 10.351 -1.959 2.513 1.00 . A A . 824 ALA N 1 1 20 15057 1 1 45 ALA O O 13.255 -0.520 3.784 1.00 . A A . 824 ALA O 1 1 20 15058 1 1 46 LYS C C 14.710 -3.145 3.781 1.00 . A A . 825 LYS C 1 1 20 15059 1 1 46 LYS CA C 13.673 -3.026 4.887 1.00 . A A . 825 LYS CA 1 1 20 15060 1 1 46 LYS CB C 13.486 -4.390 5.570 1.00 . A A . 825 LYS CB 1 1 20 15061 1 1 46 LYS CD C 13.329 -6.892 5.340 1.00 . A A . 825 LYS CD 1 1 20 15062 1 1 46 LYS CE C 14.681 -7.098 6.006 1.00 . A A . 825 LYS CE 1 1 20 15063 1 1 46 LYS CG C 13.265 -5.555 4.616 1.00 . A A . 825 LYS CG 1 1 20 15064 1 1 46 LYS H H 11.626 -3.124 4.374 1.00 . A A . 825 LYS H 1 1 20 15065 1 1 46 LYS HA H 13.998 -2.321 5.639 1.00 . A A . 825 LYS HA 1 1 20 15066 1 1 46 LYS HB2 H 14.364 -4.605 6.158 1.00 . A A . 825 LYS HB2 1 1 20 15067 1 1 46 LYS HB3 H 12.632 -4.329 6.228 1.00 . A A . 825 LYS HB3 1 1 20 15068 1 1 46 LYS HD2 H 12.560 -6.917 6.098 1.00 . A A . 825 LYS HD2 1 1 20 15069 1 1 46 LYS HD3 H 13.163 -7.686 4.627 1.00 . A A . 825 LYS HD3 1 1 20 15070 1 1 46 LYS HE2 H 15.453 -7.010 5.257 1.00 . A A . 825 LYS HE2 1 1 20 15071 1 1 46 LYS HE3 H 14.819 -6.331 6.754 1.00 . A A . 825 LYS HE3 1 1 20 15072 1 1 46 LYS HG2 H 12.292 -5.452 4.159 1.00 . A A . 825 LYS HG2 1 1 20 15073 1 1 46 LYS HG3 H 14.028 -5.533 3.852 1.00 . A A . 825 LYS HG3 1 1 20 15074 1 1 46 LYS HZ1 H 14.790 -9.184 5.932 1.00 . A A . 825 LYS HZ1 1 1 20 15075 1 1 46 LYS HZ2 H 13.985 -8.585 7.300 1.00 . A A . 825 LYS HZ2 1 1 20 15076 1 1 46 LYS HZ3 H 15.677 -8.491 7.200 1.00 . A A . 825 LYS HZ3 1 1 20 15077 1 1 46 LYS N N 12.417 -2.537 4.349 1.00 . A A . 825 LYS N 1 1 20 15078 1 1 46 LYS NZ N 14.791 -8.430 6.654 1.00 . A A . 825 LYS NZ 1 1 20 15079 1 1 46 LYS O O 15.899 -2.970 4.009 1.00 . A A . 825 LYS O 1 1 20 15080 1 1 47 ARG C C 15.811 -2.431 0.994 1.00 . A A . 826 ARG C 1 1 20 15081 1 1 47 ARG CA C 15.104 -3.702 1.444 1.00 . A A . 826 ARG CA 1 1 20 15082 1 1 47 ARG CB C 14.279 -4.308 0.307 1.00 . A A . 826 ARG CB 1 1 20 15083 1 1 47 ARG CD C 14.194 -5.623 -1.804 1.00 . A A . 826 ARG CD 1 1 20 15084 1 1 47 ARG CG C 15.082 -4.809 -0.880 1.00 . A A . 826 ARG CG 1 1 20 15085 1 1 47 ARG CZ C 14.147 -6.037 -4.229 1.00 . A A . 826 ARG CZ 1 1 20 15086 1 1 47 ARG H H 13.258 -3.515 2.454 1.00 . A A . 826 ARG H 1 1 20 15087 1 1 47 ARG HA H 15.822 -4.432 1.791 1.00 . A A . 826 ARG HA 1 1 20 15088 1 1 47 ARG HB2 H 13.713 -5.141 0.697 1.00 . A A . 826 ARG HB2 1 1 20 15089 1 1 47 ARG HB3 H 13.588 -3.558 -0.050 1.00 . A A . 826 ARG HB3 1 1 20 15090 1 1 47 ARG HD2 H 13.964 -6.560 -1.320 1.00 . A A . 826 ARG HD2 1 1 20 15091 1 1 47 ARG HD3 H 13.278 -5.075 -1.974 1.00 . A A . 826 ARG HD3 1 1 20 15092 1 1 47 ARG HE H 15.809 -5.973 -3.108 1.00 . A A . 826 ARG HE 1 1 20 15093 1 1 47 ARG HG2 H 15.477 -3.962 -1.423 1.00 . A A . 826 ARG HG2 1 1 20 15094 1 1 47 ARG HG3 H 15.893 -5.430 -0.529 1.00 . A A . 826 ARG HG3 1 1 20 15095 1 1 47 ARG HH11 H 12.321 -5.813 -3.365 1.00 . A A . 826 ARG HH11 1 1 20 15096 1 1 47 ARG HH12 H 12.306 -6.041 -5.088 1.00 . A A . 826 ARG HH12 1 1 20 15097 1 1 47 ARG HH21 H 15.794 -6.336 -5.380 1.00 . A A . 826 ARG HH21 1 1 20 15098 1 1 47 ARG HH22 H 14.277 -6.351 -6.228 1.00 . A A . 826 ARG HH22 1 1 20 15099 1 1 47 ARG N N 14.230 -3.430 2.571 1.00 . A A . 826 ARG N 1 1 20 15100 1 1 47 ARG NE N 14.825 -5.900 -3.091 1.00 . A A . 826 ARG NE 1 1 20 15101 1 1 47 ARG NH1 N 12.821 -5.963 -4.224 1.00 . A A . 826 ARG NH1 1 1 20 15102 1 1 47 ARG NH2 N 14.790 -6.262 -5.368 1.00 . A A . 826 ARG NH2 1 1 20 15103 1 1 47 ARG O O 16.897 -2.476 0.422 1.00 . A A . 826 ARG O 1 1 20 15104 1 1 48 TYR C C 16.759 0.419 2.080 1.00 . A A . 827 TYR C 1 1 20 15105 1 1 48 TYR CA C 15.795 0.001 0.961 1.00 . A A . 827 TYR CA 1 1 20 15106 1 1 48 TYR CB C 14.709 1.059 0.694 1.00 . A A . 827 TYR CB 1 1 20 15107 1 1 48 TYR CD1 C 15.761 2.624 -0.993 1.00 . A A . 827 TYR CD1 1 1 20 15108 1 1 48 TYR CD2 C 15.196 3.507 1.147 1.00 . A A . 827 TYR CD2 1 1 20 15109 1 1 48 TYR CE1 C 16.240 3.858 -1.385 1.00 . A A . 827 TYR CE1 1 1 20 15110 1 1 48 TYR CE2 C 15.673 4.747 0.761 1.00 . A A . 827 TYR CE2 1 1 20 15111 1 1 48 TYR CG C 15.229 2.425 0.276 1.00 . A A . 827 TYR CG 1 1 20 15112 1 1 48 TYR CZ C 16.166 4.938 -0.473 1.00 . A A . 827 TYR CZ 1 1 20 15113 1 1 48 TYR H H 14.340 -1.323 1.769 1.00 . A A . 827 TYR H 1 1 20 15114 1 1 48 TYR HA H 16.392 -0.153 0.076 1.00 . A A . 827 TYR HA 1 1 20 15115 1 1 48 TYR HB2 H 14.064 0.702 -0.093 1.00 . A A . 827 TYR HB2 1 1 20 15116 1 1 48 TYR HB3 H 14.124 1.190 1.593 1.00 . A A . 827 TYR HB3 1 1 20 15117 1 1 48 TYR HD1 H 15.794 1.792 -1.683 1.00 . A A . 827 TYR HD1 1 1 20 15118 1 1 48 TYR HD2 H 14.789 3.370 2.139 1.00 . A A . 827 TYR HD2 1 1 20 15119 1 1 48 TYR HE1 H 16.649 3.987 -2.377 1.00 . A A . 827 TYR HE1 1 1 20 15120 1 1 48 TYR HE2 H 15.637 5.577 1.451 1.00 . A A . 827 TYR HE2 1 1 20 15121 1 1 48 TYR HH H 17.204 6.525 -0.187 1.00 . A A . 827 TYR HH 1 1 20 15122 1 1 48 TYR N N 15.193 -1.290 1.280 1.00 . A A . 827 TYR N 1 1 20 15123 1 1 48 TYR O O 17.017 1.598 2.308 1.00 . A A . 827 TYR O 1 1 20 15124 1 1 48 TYR OH O 16.675 6.147 -0.898 1.00 . A A . 827 TYR OH 1 1 20 15125 1 1 49 ASN C C 19.690 -0.134 2.982 1.00 . A A . 828 ASN C 1 1 20 15126 1 1 49 ASN CA C 18.364 -0.324 3.739 1.00 . A A . 828 ASN CA 1 1 20 15127 1 1 49 ASN CB C 18.470 -1.467 4.771 1.00 . A A . 828 ASN CB 1 1 20 15128 1 1 49 ASN CG C 18.910 -2.821 4.205 1.00 . A A . 828 ASN CG 1 1 20 15129 1 1 49 ASN H H 16.865 -1.458 2.748 1.00 . A A . 828 ASN H 1 1 20 15130 1 1 49 ASN HA H 18.141 0.595 4.262 1.00 . A A . 828 ASN HA 1 1 20 15131 1 1 49 ASN HB2 H 19.181 -1.181 5.531 1.00 . A A . 828 ASN HB2 1 1 20 15132 1 1 49 ASN HB3 H 17.502 -1.597 5.236 1.00 . A A . 828 ASN HB3 1 1 20 15133 1 1 49 ASN HD21 H 18.144 -2.415 2.416 1.00 . A A . 828 ASN HD21 1 1 20 15134 1 1 49 ASN HD22 H 18.909 -3.957 2.569 1.00 . A A . 828 ASN HD22 1 1 20 15135 1 1 49 ASN N N 17.270 -0.565 2.802 1.00 . A A . 828 ASN N 1 1 20 15136 1 1 49 ASN ND2 N 18.622 -3.089 2.936 1.00 . A A . 828 ASN ND2 1 1 20 15137 1 1 49 ASN O O 20.590 -0.987 3.088 1.00 . A A . 828 ASN O 1 1 20 15138 1 1 49 ASN OXT O 19.819 0.877 2.263 1.00 . A A . 828 ASN OXT 1 1 20 15139 1 1 49 ASN OD1 O 19.517 -3.623 4.913 1.00 . A A . 828 ASN OD1 1 1 20 15140 2 2 1 ZN ZN ZN 7.348 -2.846 -2.998 1.00 . B A . 829 ZN ZN 1 1 stop_ save_
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