NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
560381 | 2lsa | 18420 | cing | 4-filtered-FRED | STAR | entry | full | 103 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lsa # This FRED archive file contains, for PDB entry <2lsa>: # # - 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_2lsa _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lsa _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2470.93 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 $Magainin_2 A . 1 1 stop_ save_ save_Magainin_2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Magainin 2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIGKFLHSAKKFGKAFVGEIMNS _Entity.Number_of_monomers 23 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 ILE . 1 1 3 GLY . 1 1 4 LYS . 1 1 5 PHE . 1 1 6 LEU . 1 1 7 HIS . 1 1 8 SER . 1 1 9 ALA . 1 1 10 LYS . 1 1 11 LYS . 1 1 12 PHE . 1 1 13 GLY . 1 1 14 LYS . 1 1 15 ALA . 1 1 16 PHE . 1 1 17 VAL . 1 1 18 GLY . 1 1 19 GLU . 1 1 20 ILE . 1 1 21 MET . 1 1 22 ASN . 1 1 23 SER . 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 ILE 2 2 1 1 GLY 3 3 1 1 LYS 4 4 1 1 PHE 5 5 1 1 LEU 6 6 1 1 HIS 7 7 1 1 SER 8 8 1 1 ALA 9 9 1 1 LYS 10 10 1 1 LYS 11 11 1 1 PHE 12 12 1 1 GLY 13 13 1 1 LYS 14 14 1 1 ALA 15 15 1 1 PHE 16 16 1 1 VAL 17 17 1 1 GLY 18 18 1 1 GLU 19 19 1 1 ILE 20 20 1 1 MET 21 21 1 1 ASN 22 22 1 1 SER 23 23 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY H1 A 1 . HT1 1 1 1 1 2 1 1 1 GLY HA2 A 1 . HA2 1 1 2 1 1 1 1 1 GLY HA2 A 1 . HA2 1 1 2 1 2 1 1 4 LYS H A 4 . HN 1 1 3 1 1 1 1 2 ILE H A 2 . HN 1 1 3 1 2 1 1 2 ILE HA A 2 . HA 1 1 4 1 1 1 1 2 ILE H A 2 . HN 1 1 4 1 2 1 1 5 PHE H A 5 . HN 1 1 5 1 1 1 1 2 ILE HA A 2 . HA 1 1 5 1 2 1 1 4 LYS H A 4 . HN 1 1 6 1 1 1 1 2 ILE HA A 2 . HA 1 1 6 1 2 1 1 5 PHE H A 5 . HN 1 1 7 1 1 1 1 3 GLY H A 3 . HN 1 1 7 1 2 1 1 3 GLY HA2 A 3 . HA2 1 1 8 1 1 1 1 3 GLY H A 3 . HN 1 1 8 1 2 1 1 4 LYS H A 4 . HN 1 1 9 1 1 1 1 3 GLY HA2 A 3 . HA2 1 1 9 1 2 1 1 4 LYS H A 4 . HN 1 1 10 1 1 1 1 4 LYS H A 4 . HN 1 1 10 1 2 1 1 4 LYS HA A 4 . HA 1 1 11 1 1 1 1 4 LYS H A 4 . HN 1 1 11 1 2 1 1 6 LEU H A 6 . HN 1 1 12 1 1 1 1 4 LYS HA A 4 . HA 1 1 12 1 2 1 1 5 PHE H A 5 . HN 1 1 13 1 1 1 1 4 LYS HA A 4 . HA 1 1 13 1 2 1 1 6 LEU H A 6 . HN 1 1 14 1 1 1 1 4 LYS HA A 4 . HA 1 1 14 1 2 1 1 7 HIS H A 7 . HN 1 1 15 1 1 1 1 5 PHE H A 5 . HN 1 1 15 1 2 1 1 5 PHE HA A 5 . HA 1 1 16 1 1 1 1 5 PHE H A 5 . HN 1 1 16 1 2 1 1 6 LEU H A 6 . HN 1 1 17 1 1 1 1 5 PHE HA A 5 . HA 1 1 17 1 2 1 1 6 LEU H A 6 . HN 1 1 18 1 1 1 1 5 PHE HA A 5 . HA 1 1 18 1 2 1 1 8 SER H A 8 . HN 1 1 19 1 1 1 1 6 LEU H A 6 . HN 1 1 19 1 2 1 1 6 LEU HA A 6 . HA 1 1 20 1 1 1 1 6 LEU H A 6 . HN 1 1 20 1 2 1 1 7 HIS H A 7 . HN 1 1 21 1 1 1 1 6 LEU HA A 6 . HA 1 1 21 1 2 1 1 10 LYS H A 10 . HN 1 1 22 1 1 1 1 7 HIS H A 7 . HN 1 1 22 1 2 1 1 7 HIS HA A 7 . HA 1 1 23 1 1 1 1 7 HIS H A 7 . HN 1 1 23 1 2 1 1 8 SER H A 8 . HN 1 1 24 1 1 1 1 7 HIS HA A 7 . HA 1 1 24 1 2 1 1 8 SER H A 8 . HN 1 1 25 1 1 1 1 7 HIS HA A 7 . HA 1 1 25 1 2 1 1 10 LYS H A 10 . HN 1 1 26 1 1 1 1 8 SER H A 8 . HN 1 1 26 1 2 1 1 8 SER HA A 8 . HA 1 1 27 1 1 1 1 8 SER H A 8 . HN 1 1 27 1 2 1 1 8 SER QB A 8 . HB2 1 1 28 1 1 1 1 8 SER H A 8 . HN 1 1 28 1 2 1 1 9 ALA H A 9 . HN 1 1 29 1 1 1 1 8 SER HA A 8 . HA 1 1 29 1 2 1 1 9 ALA H A 9 . HN 1 1 30 1 1 1 1 8 SER HA A 8 . HA 1 1 30 1 2 1 1 10 LYS H A 10 . HN 1 1 31 1 1 1 1 8 SER HA A 8 . HA 1 1 31 1 2 1 1 11 LYS H A 11 . HN 1 1 32 1 1 1 1 8 SER HA A 8 . HA 1 1 32 1 2 1 1 12 PHE H A 12 . HN 1 1 33 1 1 1 1 8 SER QB A 8 . HB2 1 1 33 1 2 1 1 11 LYS H A 11 . HN 1 1 34 1 1 1 1 9 ALA H A 9 . HN 1 1 34 1 2 1 1 9 ALA HA A 9 . HA 1 1 35 1 1 1 1 9 ALA H A 9 . HN 1 1 35 1 2 1 1 10 LYS H A 10 . HN 1 1 36 1 1 1 1 9 ALA H A 9 . HN 1 1 36 1 2 1 1 11 LYS H A 11 . HN 1 1 37 1 1 1 1 9 ALA HA A 9 . HA 1 1 37 1 2 1 1 10 LYS H A 10 . HN 1 1 38 1 1 1 1 9 ALA HA A 9 . HA 1 1 38 1 2 1 1 12 PHE H A 12 . HN 1 1 39 1 1 1 1 10 LYS H A 10 . HN 1 1 39 1 2 1 1 10 LYS HA A 10 . HA 1 1 40 1 1 1 1 10 LYS H A 10 . HN 1 1 40 1 2 1 1 11 LYS H A 11 . HN 1 1 41 1 1 1 1 10 LYS HA A 10 . HA 1 1 41 1 2 1 1 11 LYS H A 11 . HN 1 1 42 1 1 1 1 10 LYS HA A 10 . HA 1 1 42 1 2 1 1 13 GLY H A 13 . HN 1 1 43 1 1 1 1 10 LYS HA A 10 . HA 1 1 43 1 2 1 1 14 LYS H A 14 . HN 1 1 44 1 1 1 1 11 LYS H A 11 . HN 1 1 44 1 2 1 1 11 LYS HA A 11 . HA 1 1 45 1 1 1 1 11 LYS H A 11 . HN 1 1 45 1 2 1 1 12 PHE H A 12 . HN 1 1 46 1 1 1 1 11 LYS H A 11 . HN 1 1 46 1 2 1 1 13 GLY H A 13 . HN 1 1 47 1 1 1 1 11 LYS HA A 11 . HA 1 1 47 1 2 1 1 12 PHE H A 12 . HN 1 1 48 1 1 1 1 12 PHE H A 12 . HN 1 1 48 1 2 1 1 12 PHE HA A 12 . HA 1 1 49 1 1 1 1 12 PHE H A 12 . HN 1 1 49 1 2 1 1 13 GLY H A 13 . HN 1 1 50 1 1 1 1 12 PHE H A 12 . HN 1 1 50 1 2 1 1 13 GLY HA2 A 13 . HA2 1 1 51 1 1 1 1 12 PHE H A 12 . HN 1 1 51 1 2 1 1 14 LYS H A 14 . HN 1 1 52 1 1 1 1 12 PHE HA A 12 . HA 1 1 52 1 2 1 1 13 GLY H A 13 . HN 1 1 53 1 1 1 1 12 PHE HA A 12 . HA 1 1 53 1 2 1 1 15 ALA H A 15 . HN 1 1 54 1 1 1 1 13 GLY H A 13 . HN 1 1 54 1 2 1 1 13 GLY HA2 A 13 . HA2 1 1 55 1 1 1 1 13 GLY H A 13 . HN 1 1 55 1 2 1 1 14 LYS H A 14 . HN 1 1 56 1 1 1 1 13 GLY H A 13 . HN 1 1 56 1 2 1 1 15 ALA H A 15 . HN 1 1 57 1 1 1 1 13 GLY HA2 A 13 . HA2 1 1 57 1 2 1 1 14 LYS H A 14 . HN 1 1 58 1 1 1 1 13 GLY HA2 A 13 . HA2 1 1 58 1 2 1 1 16 PHE H A 16 . HN 1 1 59 1 1 1 1 14 LYS H A 14 . HN 1 1 59 1 2 1 1 14 LYS HA A 14 . HA 1 1 60 1 1 1 1 14 LYS H A 14 . HN 1 1 60 1 2 1 1 15 ALA H A 15 . HN 1 1 61 1 1 1 1 14 LYS H A 14 . HN 1 1 61 1 2 1 1 17 VAL H A 17 . HN 1 1 62 1 1 1 1 14 LYS HA A 14 . HA 1 1 62 1 2 1 1 15 ALA H A 15 . HN 1 1 63 1 1 1 1 14 LYS HA A 14 . HA 1 1 63 1 2 1 1 16 PHE H A 16 . HN 1 1 64 1 1 1 1 14 LYS HA A 14 . HA 1 1 64 1 2 1 1 17 VAL H A 17 . HN 1 1 65 1 1 1 1 14 LYS HA A 14 . HA 1 1 65 1 2 1 1 18 GLY H A 18 . HN 1 1 66 1 1 1 1 15 ALA H A 15 . HN 1 1 66 1 2 1 1 15 ALA HA A 15 . HA 1 1 67 1 1 1 1 15 ALA H A 15 . HN 1 1 67 1 2 1 1 16 PHE H A 16 . HN 1 1 68 1 1 1 1 15 ALA H A 15 . HN 1 1 68 1 2 1 1 17 VAL H A 17 . HN 1 1 69 1 1 1 1 15 ALA HA A 15 . HA 1 1 69 1 2 1 1 16 PHE H A 16 . HN 1 1 70 1 1 1 1 15 ALA HA A 15 . HA 1 1 70 1 2 1 1 17 VAL H A 17 . HN 1 1 71 1 1 1 1 15 ALA HA A 15 . HA 1 1 71 1 2 1 1 18 GLY H A 18 . HN 1 1 72 1 1 1 1 16 PHE H A 16 . HN 1 1 72 1 2 1 1 16 PHE HA A 16 . HA 1 1 73 1 1 1 1 16 PHE H A 16 . HN 1 1 73 1 2 1 1 18 GLY H A 18 . HN 1 1 74 1 1 1 1 16 PHE HA A 16 . HA 1 1 74 1 2 1 1 17 VAL H A 17 . HN 1 1 75 1 1 1 1 16 PHE HA A 16 . HA 1 1 75 1 2 1 1 19 GLU H A 19 . HN 1 1 76 1 1 1 1 16 PHE HA A 16 . HA 1 1 76 1 2 1 1 20 ILE H A 20 . HN 1 1 77 1 1 1 1 17 VAL H A 17 . HN 1 1 77 1 2 1 1 17 VAL HA A 17 . HA 1 1 78 1 1 1 1 17 VAL H A 17 . HN 1 1 78 1 2 1 1 18 GLY H A 18 . HN 1 1 79 1 1 1 1 17 VAL H A 17 . HN 1 1 79 1 2 1 1 18 GLY HA3 A 18 . HA2 1 1 80 1 1 1 1 17 VAL H A 17 . HN 1 1 80 1 2 1 1 19 GLU H A 19 . HN 1 1 81 1 1 1 1 17 VAL HA A 17 . HA 1 1 81 1 2 1 1 18 GLY H A 18 . HN 1 1 82 1 1 1 1 17 VAL HA A 17 . HA 1 1 82 1 2 1 1 19 GLU H A 19 . HN 1 1 83 1 1 1 1 17 VAL HA A 17 . HA 1 1 83 1 2 1 1 20 ILE H A 20 . HN 1 1 84 1 1 1 1 17 VAL HA A 17 . HA 1 1 84 1 2 1 1 21 MET H A 21 . HN 1 1 85 1 1 1 1 18 GLY H A 18 . HN 1 1 85 1 2 1 1 18 GLY HA3 A 18 . HA2 1 1 86 1 1 1 1 18 GLY H A 18 . HN 1 1 86 1 2 1 1 19 GLU H A 19 . HN 1 1 87 1 1 1 1 18 GLY H A 18 . HN 1 1 87 1 2 1 1 20 ILE H A 20 . HN 1 1 88 1 1 1 1 18 GLY HA3 A 18 . HA2 1 1 88 1 2 1 1 19 GLU H A 19 . HN 1 1 89 1 1 1 1 19 GLU H A 19 . HN 1 1 89 1 2 1 1 19 GLU HA A 19 . HA 1 1 90 1 1 1 1 19 GLU H A 19 . HN 1 1 90 1 2 1 1 21 MET H A 21 . HN 1 1 91 1 1 1 1 19 GLU HA A 19 . HA 1 1 91 1 2 1 1 20 ILE H A 20 . HN 1 1 92 1 1 1 1 19 GLU HA A 19 . HA 1 1 92 1 2 1 1 22 ASN H A 22 . HN 1 1 93 1 1 1 1 20 ILE H A 20 . HN 1 1 93 1 2 1 1 20 ILE HA A 20 . HA 1 1 94 1 1 1 1 20 ILE H A 20 . HN 1 1 94 1 2 1 1 21 MET H A 21 . HN 1 1 95 1 1 1 1 20 ILE H A 20 . HN 1 1 95 1 2 1 1 22 ASN H A 22 . HN 1 1 96 1 1 1 1 20 ILE HA A 20 . HA 1 1 96 1 2 1 1 21 MET H A 21 . HN 1 1 97 1 1 1 1 20 ILE HA A 20 . HA 1 1 97 1 2 1 1 23 SER H A 23 . HN 1 1 98 1 1 1 1 21 MET H A 21 . HN 1 1 98 1 2 1 1 21 MET HA A 21 . HA 1 1 99 1 1 1 1 21 MET H A 21 . HN 1 1 99 1 2 1 1 22 ASN H A 22 . HN 1 1 100 1 1 1 1 21 MET HA A 21 . HA 1 1 100 1 2 1 1 22 ASN H A 22 . HN 1 1 101 1 1 1 1 22 ASN H A 22 . HN 1 1 101 1 2 1 1 22 ASN HA A 22 . HA 1 1 102 1 1 1 1 22 ASN HA A 22 . HA 1 1 102 1 2 1 1 23 SER H A 23 . HN 1 1 103 1 1 1 1 23 SER H A 23 . HN 1 1 103 1 2 1 1 23 SER HB2 A 23 . HB2 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 . . . . . 2.71 1.792 3.628 1 1 2 1 . . . . . 3.427 1.959 4.895 1 1 3 1 . . . . . 2.888 1.846 3.93 1 1 4 1 . . . . . 2.976 1.869 4.083 1 1 5 1 . . . . . 3.608 1.981 5.235 1 1 6 1 . . . . . 3.864 1.998 5.73 1 1 7 1 . . . . . 2.521 1.726 3.316 1 1 8 1 . . . . . 2.948 1.862 4.034 1 1 9 1 . . . . . 3.011 1.877 4.145 1 1 10 1 . . . . . 2.763 1.809 3.717 1 1 11 1 . . . . . 2.645 1.771 3.519 1 1 12 1 . . . . . 3.233 1.927 4.539 1 1 13 1 . . . . . 2.418 1.687 3.149 1 1 14 1 . . . . . 3.705 1.989 5.421 1 1 15 1 . . . . . 2.856 1.836 3.876 1 1 16 1 . . . . . 2.72 1.795 3.645 1 1 17 1 . . . . . 3.254 1.931 4.577 1 1 18 1 . . . . . 3.216 1.923 4.509 1 1 19 1 . . . . . 2.845 1.833 3.857 1 1 20 1 . . . . . 2.436 1.694 3.178 1 1 21 1 . . . . . 2.916 1.853 3.979 1 1 22 1 . . . . . 2.878 1.843 3.913 1 1 23 1 . . . . . 3.307 1.94 4.674 1 1 24 1 . . . . . 3.266 1.932 4.6 1 1 25 1 . . . . . 3.226 1.925 4.527 1 1 26 1 . . . . . 2.726 1.797 3.655 1 1 27 1 . . . . . 2.653 1.773 3.533 1 1 28 1 . . . . . 2.681 1.782 3.58 1 1 29 1 . . . . . 3.043 1.886 4.2 1 1 30 1 . . . . . 2.495 1.717 3.273 1 1 31 1 . . . . . 3.122 1.903 4.341 1 1 32 1 . . . . . 3.183 1.917 4.449 1 1 33 1 . . . . . 3.079 1.894 4.264 1 1 34 1 . . . . . 2.49 1.715 3.265 1 1 35 1 . . . . . 2.734 1.799 3.669 1 1 36 1 . . . . . 3.998 2.0 5.996 1 1 37 1 . . . . . 2.971 1.868 4.074 1 1 38 1 . . . . . 3.189 1.918 4.46 1 1 39 1 . . . . . 2.605 1.757 3.453 1 1 40 1 . . . . . 2.649 1.772 3.526 1 1 41 1 . . . . . 2.991 1.873 4.109 1 1 42 1 . . . . . 3.124 1.904 4.344 1 1 43 1 . . . . . 2.463 1.705 3.221 1 1 44 1 . . . . . 2.601 1.755 3.447 1 1 45 1 . . . . . 2.766 1.81 3.722 1 1 46 1 . . . . . 2.601 1.755 3.447 1 1 47 1 . . . . . 2.76 1.808 3.712 1 1 48 1 . . . . . 2.641 1.769 3.513 1 1 49 1 . . . . . 2.617 1.761 3.473 1 1 50 1 . . . . . 3.224 1.925 4.523 1 1 51 1 . . . . . 2.669 1.778 3.56 1 1 52 1 . . . . . 2.968 1.867 4.069 1 1 53 1 . . . . . 3.565 1.976 5.154 1 1 54 1 . . . . . 2.17 1.581 2.759 1 1 55 1 . . . . . 2.719 1.795 3.643 1 1 56 1 . . . . . 4.073 1.999 6.147 1 1 57 1 . . . . . 2.569 1.744 3.394 1 1 58 1 . . . . . 3.108 1.901 4.315 1 1 59 1 . . . . . 2.378 1.671 3.085 1 1 60 1 . . . . . 2.676 1.781 3.571 1 1 61 1 . . . . . 3.342 1.946 4.738 1 1 62 1 . . . . . 3.028 1.882 4.174 1 1 63 1 . . . . . 3.344 1.946 4.742 1 1 64 1 . . . . . 3.349 1.947 4.751 1 1 65 1 . . . . . 3.961 2.0 5.922 1 1 66 1 . . . . . 2.54 1.734 3.346 1 1 67 1 . . . . . 2.734 1.799 3.669 1 1 68 1 . . . . . 3.151 1.91 4.392 1 1 69 1 . . . . . 3.15 1.91 4.39 1 1 70 1 . . . . . 4.329 1.986 6.672 1 1 71 1 . . . . . 3.293 1.938 4.648 1 1 72 1 . . . . . 2.675 1.781 3.569 1 1 73 1 . . . . . 2.979 1.869 4.089 1 1 74 1 . . . . . 2.963 1.865 4.061 1 1 75 1 . . . . . 3.17 1.914 4.426 1 1 76 1 . . . . . 3.445 1.961 4.929 1 1 77 1 . . . . . 2.701 1.789 3.613 1 1 78 1 . . . . . 2.67 1.779 3.561 1 1 79 1 . . . . . 3.309 1.941 4.677 1 1 80 1 . . . . . 3.319 1.942 4.696 1 1 81 1 . . . . . 3.059 1.89 4.228 1 1 82 1 . . . . . 2.629 1.765 3.493 1 1 83 1 . . . . . 3.098 1.899 4.297 1 1 84 1 . . . . . 3.631 1.983 5.279 1 1 85 1 . . . . . 2.257 1.62 2.894 1 1 86 1 . . . . . 2.641 1.769 3.513 1 1 87 1 . . . . . 3.241 1.928 4.554 1 1 88 1 . . . . . 2.718 1.794 3.642 1 1 89 1 . . . . . 2.662 1.776 3.548 1 1 90 1 . . . . . 3.107 1.901 4.313 1 1 91 1 . . . . . 2.983 1.871 4.095 1 1 92 1 . . . . . 3.159 1.912 4.406 1 1 93 1 . . . . . 2.699 1.788 3.61 1 1 94 1 . . . . . 2.67 1.779 3.561 1 1 95 1 . . . . . 3.597 1.98 5.214 1 1 96 1 . . . . . 2.924 1.855 3.993 1 1 97 1 . . . . . 3.533 1.973 5.093 1 1 98 1 . . . . . 2.686 1.784 3.588 1 1 99 1 . . . . . 2.825 1.827 3.823 1 1 100 1 . . . . . 2.906 1.85 3.962 1 1 101 1 . . . . . 2.518 1.725 3.311 1 1 102 1 . . . . . 2.989 1.872 4.106 1 1 103 1 . . . . . 3.228 1.926 4.53 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -6.742 4.157 1.691 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -6.772 4.604 0.248 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -5.468 5.131 -1.290 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -4.840 3.968 -0.228 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -4.936 5.589 0.254 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -7.339 5.522 0.179 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -7.263 3.845 -0.343 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -5.412 4.839 -0.291 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -5.890 3.362 2.079 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ILE C C -9.134 3.876 4.303 1.00 . A A . 2 ILE C 1 1 1 11 1 1 2 ILE CA C -7.731 4.335 3.901 1.00 . A A . 2 ILE CA 1 1 1 12 1 1 2 ILE CB C -7.291 5.548 4.758 1.00 . A A . 2 ILE CB 1 1 1 13 1 1 2 ILE CD1 C -6.799 6.319 7.140 1.00 . A A . 2 ILE CD1 1 1 1 14 1 1 2 ILE CG1 C -7.287 5.196 6.250 1.00 . A A . 2 ILE CG1 1 1 1 15 1 1 2 ILE CG2 C -8.189 6.751 4.484 1.00 . A A . 2 ILE CG2 1 1 1 16 1 1 2 ILE H H -8.360 5.258 2.102 1.00 . A A . 2 ILE H 1 1 1 17 1 1 2 ILE HA H -7.040 3.524 4.079 1.00 . A A . 2 ILE HA 1 1 1 18 1 1 2 ILE HB H -6.289 5.815 4.461 1.00 . A A . 2 ILE HB 1 1 1 19 1 1 2 ILE HD11 H -5.796 6.596 6.851 1.00 . A A . 2 ILE HD11 1 1 1 20 1 1 2 ILE HD12 H -6.798 5.989 8.168 1.00 . A A . 2 ILE HD12 1 1 1 21 1 1 2 ILE HD13 H -7.451 7.173 7.034 1.00 . A A . 2 ILE HD13 1 1 1 22 1 1 2 ILE HG12 H -8.289 4.942 6.558 1.00 . A A . 2 ILE HG12 1 1 1 23 1 1 2 ILE HG13 H -6.641 4.344 6.409 1.00 . A A . 2 ILE HG13 1 1 1 24 1 1 2 ILE HG21 H -7.857 7.590 5.076 1.00 . A A . 2 ILE HG21 1 1 1 25 1 1 2 ILE HG22 H -9.208 6.508 4.744 1.00 . A A . 2 ILE HG22 1 1 1 26 1 1 2 ILE HG23 H -8.136 7.006 3.436 1.00 . A A . 2 ILE HG23 1 1 1 27 1 1 2 ILE N N -7.680 4.656 2.484 1.00 . A A . 2 ILE N 1 1 1 28 1 1 2 ILE O O -9.312 3.207 5.318 1.00 . A A . 2 ILE O 1 1 1 29 1 1 3 GLY C C -11.645 2.306 3.607 1.00 . A A . 3 GLY C 1 1 1 30 1 1 3 GLY CA C -11.485 3.805 3.753 1.00 . A A . 3 GLY CA 1 1 1 31 1 1 3 GLY H H -9.930 4.788 2.706 1.00 . A A . 3 GLY H 1 1 1 32 1 1 3 GLY HA2 H -11.755 4.092 4.758 1.00 . A A . 3 GLY HA2 1 1 1 33 1 1 3 GLY HA3 H -12.147 4.297 3.057 1.00 . A A . 3 GLY HA3 1 1 1 34 1 1 3 GLY N N -10.124 4.229 3.490 1.00 . A A . 3 GLY N 1 1 1 35 1 1 3 GLY O O -11.786 1.587 4.597 1.00 . A A . 3 GLY O 1 1 1 36 1 1 4 LYS C C -10.675 0.019 1.029 1.00 . A A . 4 LYS C 1 1 1 37 1 1 4 LYS CA C -11.675 0.399 2.117 1.00 . A A . 4 LYS CA 1 1 1 38 1 1 4 LYS CB C -13.095 -0.037 1.738 1.00 . A A . 4 LYS CB 1 1 1 39 1 1 4 LYS CD C -14.780 -1.914 1.751 1.00 . A A . 4 LYS CD 1 1 1 40 1 1 4 LYS CE C -14.979 -3.392 2.046 1.00 . A A . 4 LYS CE 1 1 1 41 1 1 4 LYS CG C -13.308 -1.541 1.831 1.00 . A A . 4 LYS CG 1 1 1 42 1 1 4 LYS H H -11.583 2.456 1.620 1.00 . A A . 4 LYS H 1 1 1 43 1 1 4 LYS HA H -11.390 -0.103 3.030 1.00 . A A . 4 LYS HA 1 1 1 44 1 1 4 LYS HB2 H -13.798 0.447 2.400 1.00 . A A . 4 LYS HB2 1 1 1 45 1 1 4 LYS HB3 H -13.298 0.272 0.723 1.00 . A A . 4 LYS HB3 1 1 1 46 1 1 4 LYS HD2 H -15.330 -1.333 2.476 1.00 . A A . 4 LYS HD2 1 1 1 47 1 1 4 LYS HD3 H -15.145 -1.699 0.758 1.00 . A A . 4 LYS HD3 1 1 1 48 1 1 4 LYS HE2 H -14.457 -3.967 1.296 1.00 . A A . 4 LYS HE2 1 1 1 49 1 1 4 LYS HE3 H -14.560 -3.608 3.018 1.00 . A A . 4 LYS HE3 1 1 1 50 1 1 4 LYS HG2 H -12.785 -2.019 1.016 1.00 . A A . 4 LYS HG2 1 1 1 51 1 1 4 LYS HG3 H -12.909 -1.893 2.772 1.00 . A A . 4 LYS HG3 1 1 1 52 1 1 4 LYS HZ1 H -16.951 -3.205 2.717 1.00 . A A . 4 LYS HZ1 1 1 1 53 1 1 4 LYS HZ2 H -16.507 -4.789 2.312 1.00 . A A . 4 LYS HZ2 1 1 1 54 1 1 4 LYS HZ3 H -16.822 -3.660 1.088 1.00 . A A . 4 LYS HZ3 1 1 1 55 1 1 4 LYS N N -11.620 1.831 2.372 1.00 . A A . 4 LYS N 1 1 1 56 1 1 4 LYS NZ N -16.413 -3.786 2.040 1.00 . A A . 4 LYS NZ 1 1 1 57 1 1 4 LYS O O -10.455 -1.157 0.751 1.00 . A A . 4 LYS O 1 1 1 58 1 1 5 PHE C C -7.739 0.280 0.167 1.00 . A A . 5 PHE C 1 1 1 59 1 1 5 PHE CA C -8.985 0.795 -0.542 1.00 . A A . 5 PHE CA 1 1 1 60 1 1 5 PHE CB C -8.644 2.085 -1.297 1.00 . A A . 5 PHE CB 1 1 1 61 1 1 5 PHE CD1 C -10.672 3.550 -1.555 1.00 . A A . 5 PHE CD1 1 1 1 62 1 1 5 PHE CD2 C -9.949 2.275 -3.436 1.00 . A A . 5 PHE CD2 1 1 1 63 1 1 5 PHE CE1 C -11.711 4.069 -2.304 1.00 . A A . 5 PHE CE1 1 1 1 64 1 1 5 PHE CE2 C -10.986 2.791 -4.189 1.00 . A A . 5 PHE CE2 1 1 1 65 1 1 5 PHE CG C -9.780 2.647 -2.111 1.00 . A A . 5 PHE CG 1 1 1 66 1 1 5 PHE CZ C -11.869 3.689 -3.622 1.00 . A A . 5 PHE CZ 1 1 1 67 1 1 5 PHE H H -10.295 1.944 0.653 1.00 . A A . 5 PHE H 1 1 1 68 1 1 5 PHE HA H -9.328 0.050 -1.242 1.00 . A A . 5 PHE HA 1 1 1 69 1 1 5 PHE HB2 H -8.346 2.838 -0.583 1.00 . A A . 5 PHE HB2 1 1 1 70 1 1 5 PHE HB3 H -7.820 1.888 -1.966 1.00 . A A . 5 PHE HB3 1 1 1 71 1 1 5 PHE HD1 H -10.549 3.850 -0.524 1.00 . A A . 5 PHE HD1 1 1 1 72 1 1 5 PHE HD2 H -9.258 1.575 -3.881 1.00 . A A . 5 PHE HD2 1 1 1 73 1 1 5 PHE HE1 H -12.399 4.771 -1.859 1.00 . A A . 5 PHE HE1 1 1 1 74 1 1 5 PHE HE2 H -11.107 2.493 -5.220 1.00 . A A . 5 PHE HE2 1 1 1 75 1 1 5 PHE HZ H -12.682 4.094 -4.208 1.00 . A A . 5 PHE HZ 1 1 1 76 1 1 5 PHE N N -10.044 1.028 0.433 1.00 . A A . 5 PHE N 1 1 1 77 1 1 5 PHE O O -6.802 -0.209 -0.459 1.00 . A A . 5 PHE O 1 1 1 78 1 1 6 LEU C C -6.540 -1.549 2.361 1.00 . A A . 6 LEU C 1 1 1 79 1 1 6 LEU CA C -6.633 -0.027 2.319 1.00 . A A . 6 LEU CA 1 1 1 80 1 1 6 LEU CB C -6.814 0.534 3.730 1.00 . A A . 6 LEU CB 1 1 1 81 1 1 6 LEU CD1 C -4.392 1.011 4.161 1.00 . A A . 6 LEU CD1 1 1 1 82 1 1 6 LEU CD2 C -5.987 0.834 6.073 1.00 . A A . 6 LEU CD2 1 1 1 83 1 1 6 LEU CG C -5.640 0.319 4.686 1.00 . A A . 6 LEU CG 1 1 1 84 1 1 6 LEU H H -8.550 0.762 1.926 1.00 . A A . 6 LEU H 1 1 1 85 1 1 6 LEU HA H -5.727 0.373 1.889 1.00 . A A . 6 LEU HA 1 1 1 86 1 1 6 LEU HB2 H -6.993 1.596 3.649 1.00 . A A . 6 LEU HB2 1 1 1 87 1 1 6 LEU HB3 H -7.690 0.073 4.164 1.00 . A A . 6 LEU HB3 1 1 1 88 1 1 6 LEU HD11 H -4.587 2.067 4.050 1.00 . A A . 6 LEU HD11 1 1 1 89 1 1 6 LEU HD12 H -4.121 0.593 3.202 1.00 . A A . 6 LEU HD12 1 1 1 90 1 1 6 LEU HD13 H -3.581 0.867 4.859 1.00 . A A . 6 LEU HD13 1 1 1 91 1 1 6 LEU HD21 H -6.849 0.302 6.450 1.00 . A A . 6 LEU HD21 1 1 1 92 1 1 6 LEU HD22 H -6.208 1.889 6.020 1.00 . A A . 6 LEU HD22 1 1 1 93 1 1 6 LEU HD23 H -5.149 0.674 6.737 1.00 . A A . 6 LEU HD23 1 1 1 94 1 1 6 LEU HG H -5.431 -0.737 4.761 1.00 . A A . 6 LEU HG 1 1 1 95 1 1 6 LEU N N -7.753 0.391 1.491 1.00 . A A . 6 LEU N 1 1 1 96 1 1 6 LEU O O -5.521 -2.116 2.767 1.00 . A A . 6 LEU O 1 1 1 97 1 1 7 HIS C C -6.568 -4.261 1.092 1.00 . A A . 7 HIS C 1 1 1 98 1 1 7 HIS CA C -7.691 -3.652 1.926 1.00 . A A . 7 HIS CA 1 1 1 99 1 1 7 HIS CB C -9.058 -4.104 1.399 1.00 . A A . 7 HIS CB 1 1 1 100 1 1 7 HIS CD2 C -9.399 -6.262 2.794 1.00 . A A . 7 HIS CD2 1 1 1 101 1 1 7 HIS CE1 C -9.955 -7.617 1.165 1.00 . A A . 7 HIS CE1 1 1 1 102 1 1 7 HIS CG C -9.365 -5.548 1.643 1.00 . A A . 7 HIS CG 1 1 1 103 1 1 7 HIS H H -8.363 -1.686 1.553 1.00 . A A . 7 HIS H 1 1 1 104 1 1 7 HIS HA H -7.580 -3.981 2.948 1.00 . A A . 7 HIS HA 1 1 1 105 1 1 7 HIS HB2 H -9.828 -3.518 1.877 1.00 . A A . 7 HIS HB2 1 1 1 106 1 1 7 HIS HB3 H -9.096 -3.932 0.333 1.00 . A A . 7 HIS HB3 1 1 1 107 1 1 7 HIS HD1 H -9.790 -6.213 -0.322 1.00 . A A . 7 HIS HD1 1 1 1 108 1 1 7 HIS HD2 H -9.169 -5.893 3.782 1.00 . A A . 7 HIS HD2 1 1 1 109 1 1 7 HIS HE1 H -10.252 -8.500 0.618 1.00 . A A . 7 HIS HE1 1 1 1 110 1 1 7 HIS HE2 H -9.787 -8.307 3.091 1.00 . A A . 7 HIS HE2 1 1 1 111 1 1 7 HIS N N -7.607 -2.200 1.912 1.00 . A A . 7 HIS N 1 1 1 112 1 1 7 HIS ND1 N -9.718 -6.429 0.641 1.00 . A A . 7 HIS ND1 1 1 1 113 1 1 7 HIS NE2 N -9.768 -7.541 2.468 1.00 . A A . 7 HIS NE2 1 1 1 114 1 1 7 HIS O O -5.968 -5.259 1.484 1.00 . A A . 7 HIS O 1 1 1 115 1 1 8 SER C C -4.000 -3.180 -0.834 1.00 . A A . 8 SER C 1 1 1 116 1 1 8 SER CA C -5.193 -4.118 -0.895 1.00 . A A . 8 SER CA 1 1 1 117 1 1 8 SER CB C -5.667 -4.272 -2.334 1.00 . A A . 8 SER CB 1 1 1 118 1 1 8 SER H H -6.837 -2.903 -0.362 1.00 . A A . 8 SER H 1 1 1 119 1 1 8 SER HA H -4.882 -5.076 -0.520 1.00 . A A . 8 SER HA 1 1 1 120 1 1 8 SER HB2 H -4.816 -4.458 -2.964 1.00 . A A . 8 SER HB2 1 1 1 121 1 1 8 SER HB3 H -6.357 -5.099 -2.399 1.00 . A A . 8 SER HB3 1 1 1 122 1 1 8 SER HG H -5.749 -2.627 -3.407 1.00 . A A . 8 SER HG 1 1 1 123 1 1 8 SER N N -6.283 -3.656 -0.056 1.00 . A A . 8 SER N 1 1 1 124 1 1 8 SER O O -2.881 -3.571 -1.187 1.00 . A A . 8 SER O 1 1 1 125 1 1 8 SER OG O -6.318 -3.093 -2.781 1.00 . A A . 8 SER OG 1 1 1 126 1 1 9 ALA C C -2.066 -1.538 0.689 1.00 . A A . 9 ALA C 1 1 1 127 1 1 9 ALA CA C -3.157 -0.985 -0.218 1.00 . A A . 9 ALA CA 1 1 1 128 1 1 9 ALA CB C -3.698 0.322 0.337 1.00 . A A . 9 ALA CB 1 1 1 129 1 1 9 ALA H H -5.147 -1.699 -0.132 1.00 . A A . 9 ALA H 1 1 1 130 1 1 9 ALA HA H -2.739 -0.791 -1.196 1.00 . A A . 9 ALA HA 1 1 1 131 1 1 9 ALA HB1 H -2.895 1.040 0.412 1.00 . A A . 9 ALA HB1 1 1 1 132 1 1 9 ALA HB2 H -4.118 0.148 1.317 1.00 . A A . 9 ALA HB2 1 1 1 133 1 1 9 ALA HB3 H -4.463 0.706 -0.321 1.00 . A A . 9 ALA HB3 1 1 1 134 1 1 9 ALA N N -4.231 -1.957 -0.371 1.00 . A A . 9 ALA N 1 1 1 135 1 1 9 ALA O O -0.900 -1.165 0.574 1.00 . A A . 9 ALA O 1 1 1 136 1 1 10 LYS C C -1.535 -4.572 2.389 1.00 . A A . 10 LYS C 1 1 1 137 1 1 10 LYS CA C -1.492 -3.058 2.489 1.00 . A A . 10 LYS CA 1 1 1 138 1 1 10 LYS CB C -1.741 -2.607 3.934 1.00 . A A . 10 LYS CB 1 1 1 139 1 1 10 LYS CD C 0.051 -0.830 3.833 1.00 . A A . 10 LYS CD 1 1 1 140 1 1 10 LYS CE C 1.034 -1.633 4.676 1.00 . A A . 10 LYS CE 1 1 1 141 1 1 10 LYS CG C -1.399 -1.144 4.187 1.00 . A A . 10 LYS CG 1 1 1 142 1 1 10 LYS H H -3.390 -2.756 1.584 1.00 . A A . 10 LYS H 1 1 1 143 1 1 10 LYS HA H -0.507 -2.730 2.188 1.00 . A A . 10 LYS HA 1 1 1 144 1 1 10 LYS HB2 H -2.785 -2.757 4.169 1.00 . A A . 10 LYS HB2 1 1 1 145 1 1 10 LYS HB3 H -1.143 -3.214 4.596 1.00 . A A . 10 LYS HB3 1 1 1 146 1 1 10 LYS HD2 H 0.212 -1.064 2.792 1.00 . A A . 10 LYS HD2 1 1 1 147 1 1 10 LYS HD3 H 0.229 0.223 3.997 1.00 . A A . 10 LYS HD3 1 1 1 148 1 1 10 LYS HE2 H 0.770 -2.678 4.614 1.00 . A A . 10 LYS HE2 1 1 1 149 1 1 10 LYS HE3 H 2.028 -1.491 4.277 1.00 . A A . 10 LYS HE3 1 1 1 150 1 1 10 LYS HG2 H -2.047 -0.525 3.586 1.00 . A A . 10 LYS HG2 1 1 1 151 1 1 10 LYS HG3 H -1.561 -0.925 5.233 1.00 . A A . 10 LYS HG3 1 1 1 152 1 1 10 LYS HZ1 H 1.604 -1.862 6.678 1.00 . A A . 10 LYS HZ1 1 1 1 153 1 1 10 LYS HZ2 H 0.047 -1.228 6.476 1.00 . A A . 10 LYS HZ2 1 1 1 154 1 1 10 LYS HZ3 H 1.400 -0.249 6.199 1.00 . A A . 10 LYS HZ3 1 1 1 155 1 1 10 LYS N N -2.446 -2.457 1.571 1.00 . A A . 10 LYS N 1 1 1 156 1 1 10 LYS NZ N 1.019 -1.217 6.102 1.00 . A A . 10 LYS NZ 1 1 1 157 1 1 10 LYS O O -1.203 -5.282 3.336 1.00 . A A . 10 LYS O 1 1 1 158 1 1 11 LYS C C -1.201 -6.776 -0.327 1.00 . A A . 11 LYS C 1 1 1 159 1 1 11 LYS CA C -1.942 -6.489 0.970 1.00 . A A . 11 LYS CA 1 1 1 160 1 1 11 LYS CB C -3.371 -7.027 0.902 1.00 . A A . 11 LYS CB 1 1 1 161 1 1 11 LYS CD C -4.871 -9.037 0.774 1.00 . A A . 11 LYS CD 1 1 1 162 1 1 11 LYS CE C -4.928 -10.551 0.672 1.00 . A A . 11 LYS CE 1 1 1 163 1 1 11 LYS CG C -3.440 -8.540 0.787 1.00 . A A . 11 LYS CG 1 1 1 164 1 1 11 LYS H H -2.256 -4.444 0.532 1.00 . A A . 11 LYS H 1 1 1 165 1 1 11 LYS HA H -1.422 -6.973 1.783 1.00 . A A . 11 LYS HA 1 1 1 166 1 1 11 LYS HB2 H -3.899 -6.729 1.797 1.00 . A A . 11 LYS HB2 1 1 1 167 1 1 11 LYS HB3 H -3.866 -6.597 0.043 1.00 . A A . 11 LYS HB3 1 1 1 168 1 1 11 LYS HD2 H -5.356 -8.729 1.689 1.00 . A A . 11 LYS HD2 1 1 1 169 1 1 11 LYS HD3 H -5.386 -8.606 -0.073 1.00 . A A . 11 LYS HD3 1 1 1 170 1 1 11 LYS HE2 H -4.441 -10.975 1.538 1.00 . A A . 11 LYS HE2 1 1 1 171 1 1 11 LYS HE3 H -5.963 -10.856 0.657 1.00 . A A . 11 LYS HE3 1 1 1 172 1 1 11 LYS HG2 H -2.958 -8.843 -0.131 1.00 . A A . 11 LYS HG2 1 1 1 173 1 1 11 LYS HG3 H -2.924 -8.979 1.628 1.00 . A A . 11 LYS HG3 1 1 1 174 1 1 11 LYS HZ1 H -3.223 -10.929 -0.478 1.00 . A A . 11 LYS HZ1 1 1 1 175 1 1 11 LYS HZ2 H -4.600 -10.535 -1.389 1.00 . A A . 11 LYS HZ2 1 1 1 176 1 1 11 LYS HZ3 H -4.462 -12.067 -0.684 1.00 . A A . 11 LYS HZ3 1 1 1 177 1 1 11 LYS N N -1.944 -5.060 1.230 1.00 . A A . 11 LYS N 1 1 1 178 1 1 11 LYS NZ N -4.256 -11.055 -0.554 1.00 . A A . 11 LYS NZ 1 1 1 179 1 1 11 LYS O O -0.525 -7.793 -0.461 1.00 . A A . 11 LYS O 1 1 1 180 1 1 12 PHE C C 0.452 -4.844 -2.573 1.00 . A A . 12 PHE C 1 1 1 181 1 1 12 PHE CA C -0.596 -5.951 -2.528 1.00 . A A . 12 PHE CA 1 1 1 182 1 1 12 PHE CB C -1.548 -5.836 -3.724 1.00 . A A . 12 PHE CB 1 1 1 183 1 1 12 PHE CD1 C -0.524 -7.238 -5.541 1.00 . A A . 12 PHE CD1 1 1 1 184 1 1 12 PHE CD2 C -0.580 -4.869 -5.827 1.00 . A A . 12 PHE CD2 1 1 1 185 1 1 12 PHE CE1 C 0.097 -7.375 -6.767 1.00 . A A . 12 PHE CE1 1 1 1 186 1 1 12 PHE CE2 C 0.042 -5.002 -7.053 1.00 . A A . 12 PHE CE2 1 1 1 187 1 1 12 PHE CG C -0.869 -5.983 -5.057 1.00 . A A . 12 PHE CG 1 1 1 188 1 1 12 PHE CZ C 0.381 -6.256 -7.524 1.00 . A A . 12 PHE CZ 1 1 1 189 1 1 12 PHE H H -1.953 -5.117 -1.145 1.00 . A A . 12 PHE H 1 1 1 190 1 1 12 PHE HA H -0.098 -6.909 -2.558 1.00 . A A . 12 PHE HA 1 1 1 191 1 1 12 PHE HB2 H -2.300 -6.608 -3.651 1.00 . A A . 12 PHE HB2 1 1 1 192 1 1 12 PHE HB3 H -2.031 -4.869 -3.698 1.00 . A A . 12 PHE HB3 1 1 1 193 1 1 12 PHE HD1 H -0.745 -8.113 -4.949 1.00 . A A . 12 PHE HD1 1 1 1 194 1 1 12 PHE HD2 H -0.846 -3.889 -5.459 1.00 . A A . 12 PHE HD2 1 1 1 195 1 1 12 PHE HE1 H 0.360 -8.357 -7.133 1.00 . A A . 12 PHE HE1 1 1 1 196 1 1 12 PHE HE2 H 0.264 -4.125 -7.643 1.00 . A A . 12 PHE HE2 1 1 1 197 1 1 12 PHE HZ H 0.867 -6.361 -8.483 1.00 . A A . 12 PHE HZ 1 1 1 198 1 1 12 PHE N N -1.336 -5.866 -1.281 1.00 . A A . 12 PHE N 1 1 1 199 1 1 12 PHE O O 1.620 -5.091 -2.868 1.00 . A A . 12 PHE O 1 1 1 200 1 1 13 GLY C C 1.880 -2.458 -1.071 1.00 . A A . 13 GLY C 1 1 1 201 1 1 13 GLY CA C 0.933 -2.488 -2.261 1.00 . A A . 13 GLY CA 1 1 1 202 1 1 13 GLY H H -0.908 -3.494 -1.990 1.00 . A A . 13 GLY H 1 1 1 203 1 1 13 GLY HA2 H 1.516 -2.524 -3.170 1.00 . A A . 13 GLY HA2 1 1 1 204 1 1 13 GLY HA3 H 0.347 -1.579 -2.260 1.00 . A A . 13 GLY HA3 1 1 1 205 1 1 13 GLY N N 0.030 -3.626 -2.240 1.00 . A A . 13 GLY N 1 1 1 206 1 1 13 GLY O O 2.729 -1.574 -0.970 1.00 . A A . 13 GLY O 1 1 1 207 1 1 14 LYS C C 4.068 -3.621 0.642 1.00 . A A . 14 LYS C 1 1 1 208 1 1 14 LYS CA C 2.584 -3.538 1.011 1.00 . A A . 14 LYS CA 1 1 1 209 1 1 14 LYS CB C 2.184 -4.774 1.830 1.00 . A A . 14 LYS CB 1 1 1 210 1 1 14 LYS CD C 1.975 -7.291 1.924 1.00 . A A . 14 LYS CD 1 1 1 211 1 1 14 LYS CE C 2.981 -7.439 3.055 1.00 . A A . 14 LYS CE 1 1 1 212 1 1 14 LYS CG C 2.280 -6.082 1.052 1.00 . A A . 14 LYS CG 1 1 1 213 1 1 14 LYS H H 1.044 -4.101 -0.326 1.00 . A A . 14 LYS H 1 1 1 214 1 1 14 LYS HA H 2.423 -2.654 1.611 1.00 . A A . 14 LYS HA 1 1 1 215 1 1 14 LYS HB2 H 2.830 -4.846 2.693 1.00 . A A . 14 LYS HB2 1 1 1 216 1 1 14 LYS HB3 H 1.163 -4.654 2.164 1.00 . A A . 14 LYS HB3 1 1 1 217 1 1 14 LYS HD2 H 0.989 -7.180 2.347 1.00 . A A . 14 LYS HD2 1 1 1 218 1 1 14 LYS HD3 H 2.005 -8.181 1.311 1.00 . A A . 14 LYS HD3 1 1 1 219 1 1 14 LYS HE2 H 3.975 -7.437 2.637 1.00 . A A . 14 LYS HE2 1 1 1 220 1 1 14 LYS HE3 H 2.873 -6.603 3.732 1.00 . A A . 14 LYS HE3 1 1 1 221 1 1 14 LYS HG2 H 1.575 -6.055 0.235 1.00 . A A . 14 LYS HG2 1 1 1 222 1 1 14 LYS HG3 H 3.283 -6.179 0.660 1.00 . A A . 14 LYS HG3 1 1 1 223 1 1 14 LYS HZ1 H 3.019 -9.518 3.206 1.00 . A A . 14 LYS HZ1 1 1 1 224 1 1 14 LYS HZ2 H 1.781 -8.788 4.100 1.00 . A A . 14 LYS HZ2 1 1 1 225 1 1 14 LYS HZ3 H 3.379 -8.719 4.655 1.00 . A A . 14 LYS HZ3 1 1 1 226 1 1 14 LYS N N 1.739 -3.433 -0.180 1.00 . A A . 14 LYS N 1 1 1 227 1 1 14 LYS NZ N 2.777 -8.702 3.809 1.00 . A A . 14 LYS NZ 1 1 1 228 1 1 14 LYS O O 4.925 -3.068 1.332 1.00 . A A . 14 LYS O 1 1 1 229 1 1 15 ALA C C 6.159 -3.404 -1.876 1.00 . A A . 15 ALA C 1 1 1 230 1 1 15 ALA CA C 5.739 -4.490 -0.897 1.00 . A A . 15 ALA CA 1 1 1 231 1 1 15 ALA CB C 5.906 -5.863 -1.524 1.00 . A A . 15 ALA CB 1 1 1 232 1 1 15 ALA H H 3.636 -4.675 -0.999 1.00 . A A . 15 ALA H 1 1 1 233 1 1 15 ALA HA H 6.375 -4.440 -0.025 1.00 . A A . 15 ALA HA 1 1 1 234 1 1 15 ALA HB1 H 5.304 -5.924 -2.420 1.00 . A A . 15 ALA HB1 1 1 1 235 1 1 15 ALA HB2 H 5.585 -6.619 -0.822 1.00 . A A . 15 ALA HB2 1 1 1 236 1 1 15 ALA HB3 H 6.945 -6.022 -1.776 1.00 . A A . 15 ALA HB3 1 1 1 237 1 1 15 ALA N N 4.363 -4.297 -0.462 1.00 . A A . 15 ALA N 1 1 1 238 1 1 15 ALA O O 7.247 -3.453 -2.445 1.00 . A A . 15 ALA O 1 1 1 239 1 1 16 PHE C C 5.630 -0.009 -2.211 1.00 . A A . 16 PHE C 1 1 1 240 1 1 16 PHE CA C 5.576 -1.324 -2.973 1.00 . A A . 16 PHE CA 1 1 1 241 1 1 16 PHE CB C 4.525 -1.244 -4.084 1.00 . A A . 16 PHE CB 1 1 1 242 1 1 16 PHE CD1 C 5.398 -2.603 -6.000 1.00 . A A . 16 PHE CD1 1 1 1 243 1 1 16 PHE CD2 C 3.542 -3.449 -4.768 1.00 . A A . 16 PHE CD2 1 1 1 244 1 1 16 PHE CE1 C 5.366 -3.716 -6.816 1.00 . A A . 16 PHE CE1 1 1 1 245 1 1 16 PHE CE2 C 3.507 -4.566 -5.581 1.00 . A A . 16 PHE CE2 1 1 1 246 1 1 16 PHE CG C 4.488 -2.457 -4.968 1.00 . A A . 16 PHE CG 1 1 1 247 1 1 16 PHE CZ C 4.421 -4.699 -6.607 1.00 . A A . 16 PHE CZ 1 1 1 248 1 1 16 PHE H H 4.445 -2.431 -1.570 1.00 . A A . 16 PHE H 1 1 1 249 1 1 16 PHE HA H 6.544 -1.505 -3.417 1.00 . A A . 16 PHE HA 1 1 1 250 1 1 16 PHE HB2 H 3.548 -1.127 -3.641 1.00 . A A . 16 PHE HB2 1 1 1 251 1 1 16 PHE HB3 H 4.736 -0.386 -4.707 1.00 . A A . 16 PHE HB3 1 1 1 252 1 1 16 PHE HD1 H 6.139 -1.835 -6.164 1.00 . A A . 16 PHE HD1 1 1 1 253 1 1 16 PHE HD2 H 2.827 -3.344 -3.965 1.00 . A A . 16 PHE HD2 1 1 1 254 1 1 16 PHE HE1 H 6.083 -3.817 -7.618 1.00 . A A . 16 PHE HE1 1 1 1 255 1 1 16 PHE HE2 H 2.766 -5.333 -5.413 1.00 . A A . 16 PHE HE2 1 1 1 256 1 1 16 PHE HZ H 4.396 -5.569 -7.245 1.00 . A A . 16 PHE HZ 1 1 1 257 1 1 16 PHE N N 5.292 -2.423 -2.064 1.00 . A A . 16 PHE N 1 1 1 258 1 1 16 PHE O O 6.653 0.674 -2.204 1.00 . A A . 16 PHE O 1 1 1 259 1 1 17 VAL C C 5.321 1.582 0.404 1.00 . A A . 17 VAL C 1 1 1 260 1 1 17 VAL CA C 4.434 1.591 -0.831 1.00 . A A . 17 VAL CA 1 1 1 261 1 1 17 VAL CB C 2.970 1.890 -0.429 1.00 . A A . 17 VAL CB 1 1 1 262 1 1 17 VAL CG1 C 2.843 3.274 0.193 1.00 . A A . 17 VAL CG1 1 1 1 263 1 1 17 VAL CG2 C 2.047 1.757 -1.633 1.00 . A A . 17 VAL CG2 1 1 1 264 1 1 17 VAL H H 3.800 -0.330 -1.463 1.00 . A A . 17 VAL H 1 1 1 265 1 1 17 VAL HA H 4.774 2.367 -1.499 1.00 . A A . 17 VAL HA 1 1 1 266 1 1 17 VAL HB H 2.667 1.163 0.309 1.00 . A A . 17 VAL HB 1 1 1 267 1 1 17 VAL HG11 H 3.458 3.327 1.080 1.00 . A A . 17 VAL HG11 1 1 1 268 1 1 17 VAL HG12 H 1.812 3.458 0.457 1.00 . A A . 17 VAL HG12 1 1 1 269 1 1 17 VAL HG13 H 3.173 4.019 -0.516 1.00 . A A . 17 VAL HG13 1 1 1 270 1 1 17 VAL HG21 H 2.322 2.489 -2.380 1.00 . A A . 17 VAL HG21 1 1 1 271 1 1 17 VAL HG22 H 1.026 1.923 -1.326 1.00 . A A . 17 VAL HG22 1 1 1 272 1 1 17 VAL HG23 H 2.141 0.765 -2.050 1.00 . A A . 17 VAL HG23 1 1 1 273 1 1 17 VAL N N 4.543 0.317 -1.526 1.00 . A A . 17 VAL N 1 1 1 274 1 1 17 VAL O O 5.808 2.615 0.849 1.00 . A A . 17 VAL O 1 1 1 275 1 1 18 GLY C C 7.855 -0.015 1.685 1.00 . A A . 18 GLY C 1 1 1 276 1 1 18 GLY CA C 6.420 0.259 2.080 1.00 . A A . 18 GLY CA 1 1 1 277 1 1 18 GLY H H 5.157 -0.401 0.524 1.00 . A A . 18 GLY H 1 1 1 278 1 1 18 GLY HA2 H 6.381 1.173 2.657 1.00 . A A . 18 GLY HA2 1 1 1 279 1 1 18 GLY HA3 H 6.061 -0.558 2.689 1.00 . A A . 18 GLY HA3 1 1 1 280 1 1 18 GLY N N 5.562 0.393 0.927 1.00 . A A . 18 GLY N 1 1 1 281 1 1 18 GLY O O 8.694 -0.316 2.531 1.00 . A A . 18 GLY O 1 1 1 282 1 1 19 GLU C C 10.013 0.905 -0.990 1.00 . A A . 19 GLU C 1 1 1 283 1 1 19 GLU CA C 9.465 -0.224 -0.120 1.00 . A A . 19 GLU CA 1 1 1 284 1 1 19 GLU CB C 9.417 -1.518 -0.935 1.00 . A A . 19 GLU CB 1 1 1 285 1 1 19 GLU CD C 10.658 -2.962 -2.588 1.00 . A A . 19 GLU CD 1 1 1 286 1 1 19 GLU CG C 10.773 -1.952 -1.466 1.00 . A A . 19 GLU CG 1 1 1 287 1 1 19 GLU H H 7.441 0.397 -0.227 1.00 . A A . 19 GLU H 1 1 1 288 1 1 19 GLU HA H 10.123 -0.364 0.725 1.00 . A A . 19 GLU HA 1 1 1 289 1 1 19 GLU HB2 H 9.026 -2.309 -0.313 1.00 . A A . 19 GLU HB2 1 1 1 290 1 1 19 GLU HB3 H 8.757 -1.372 -1.777 1.00 . A A . 19 GLU HB3 1 1 1 291 1 1 19 GLU HG2 H 11.294 -1.083 -1.838 1.00 . A A . 19 GLU HG2 1 1 1 292 1 1 19 GLU HG3 H 11.343 -2.392 -0.659 1.00 . A A . 19 GLU HG3 1 1 1 293 1 1 19 GLU N N 8.139 0.093 0.393 1.00 . A A . 19 GLU N 1 1 1 294 1 1 19 GLU O O 10.935 1.619 -0.589 1.00 . A A . 19 GLU O 1 1 1 295 1 1 19 GLU OE1 O 10.509 -2.539 -3.752 1.00 . A A . 19 GLU OE1 1 1 1 296 1 1 19 GLU OE2 O 10.730 -4.180 -2.315 1.00 . A A . 19 GLU OE2 1 1 1 297 1 1 20 ILE C C 9.628 3.445 -2.812 1.00 . A A . 20 ILE C 1 1 1 298 1 1 20 ILE CA C 9.947 1.994 -3.170 1.00 . A A . 20 ILE CA 1 1 1 299 1 1 20 ILE CB C 9.395 1.650 -4.578 1.00 . A A . 20 ILE CB 1 1 1 300 1 1 20 ILE CD1 C 11.664 1.779 -5.723 1.00 . A A . 20 ILE CD1 1 1 1 301 1 1 20 ILE CG1 C 10.246 2.302 -5.670 1.00 . A A . 20 ILE CG1 1 1 1 302 1 1 20 ILE CG2 C 7.939 2.074 -4.721 1.00 . A A . 20 ILE CG2 1 1 1 303 1 1 20 ILE H H 8.590 0.580 -2.362 1.00 . A A . 20 ILE H 1 1 1 304 1 1 20 ILE HA H 11.020 1.871 -3.191 1.00 . A A . 20 ILE HA 1 1 1 305 1 1 20 ILE HB H 9.439 0.579 -4.697 1.00 . A A . 20 ILE HB 1 1 1 306 1 1 20 ILE HD11 H 12.148 1.961 -4.775 1.00 . A A . 20 ILE HD11 1 1 1 307 1 1 20 ILE HD12 H 12.205 2.286 -6.507 1.00 . A A . 20 ILE HD12 1 1 1 308 1 1 20 ILE HD13 H 11.649 0.719 -5.921 1.00 . A A . 20 ILE HD13 1 1 1 309 1 1 20 ILE HG12 H 9.790 2.113 -6.631 1.00 . A A . 20 ILE HG12 1 1 1 310 1 1 20 ILE HG13 H 10.290 3.368 -5.500 1.00 . A A . 20 ILE HG13 1 1 1 311 1 1 20 ILE HG21 H 7.573 1.780 -5.694 1.00 . A A . 20 ILE HG21 1 1 1 312 1 1 20 ILE HG22 H 7.866 3.147 -4.618 1.00 . A A . 20 ILE HG22 1 1 1 313 1 1 20 ILE HG23 H 7.348 1.595 -3.954 1.00 . A A . 20 ILE HG23 1 1 1 314 1 1 20 ILE N N 9.417 1.078 -2.166 1.00 . A A . 20 ILE N 1 1 1 315 1 1 20 ILE O O 10.196 4.380 -3.373 1.00 . A A . 20 ILE O 1 1 1 316 1 1 21 MET C C 9.506 5.478 -0.485 1.00 . A A . 21 MET C 1 1 1 317 1 1 21 MET CA C 8.387 4.957 -1.378 1.00 . A A . 21 MET CA 1 1 1 318 1 1 21 MET CB C 7.071 4.938 -0.604 1.00 . A A . 21 MET CB 1 1 1 319 1 1 21 MET CE C 5.281 7.803 1.834 1.00 . A A . 21 MET CE 1 1 1 320 1 1 21 MET CG C 6.738 6.263 0.062 1.00 . A A . 21 MET CG 1 1 1 321 1 1 21 MET H H 8.250 2.847 -1.496 1.00 . A A . 21 MET H 1 1 1 322 1 1 21 MET HA H 8.288 5.611 -2.231 1.00 . A A . 21 MET HA 1 1 1 323 1 1 21 MET HB2 H 6.270 4.690 -1.284 1.00 . A A . 21 MET HB2 1 1 1 324 1 1 21 MET HB3 H 7.126 4.179 0.163 1.00 . A A . 21 MET HB3 1 1 1 325 1 1 21 MET HE1 H 6.208 7.974 2.360 1.00 . A A . 21 MET HE1 1 1 1 326 1 1 21 MET HE2 H 4.456 7.893 2.524 1.00 . A A . 21 MET HE2 1 1 1 327 1 1 21 MET HE3 H 5.173 8.532 1.046 1.00 . A A . 21 MET HE3 1 1 1 328 1 1 21 MET HG2 H 7.585 6.576 0.655 1.00 . A A . 21 MET HG2 1 1 1 329 1 1 21 MET HG3 H 6.549 6.997 -0.708 1.00 . A A . 21 MET HG3 1 1 1 330 1 1 21 MET N N 8.715 3.625 -1.868 1.00 . A A . 21 MET N 1 1 1 331 1 1 21 MET O O 9.881 6.647 -0.556 1.00 . A A . 21 MET O 1 1 1 332 1 1 21 MET SD S 5.290 6.159 1.129 1.00 . A A . 21 MET SD 1 1 1 333 1 1 22 ASN C C 12.408 5.152 0.479 1.00 . A A . 22 ASN C 1 1 1 334 1 1 22 ASN CA C 11.114 4.966 1.264 1.00 . A A . 22 ASN CA 1 1 1 335 1 1 22 ASN CB C 11.284 3.892 2.347 1.00 . A A . 22 ASN CB 1 1 1 336 1 1 22 ASN CG C 12.202 4.325 3.478 1.00 . A A . 22 ASN CG 1 1 1 337 1 1 22 ASN H H 9.713 3.677 0.347 1.00 . A A . 22 ASN H 1 1 1 338 1 1 22 ASN HA H 10.849 5.905 1.731 1.00 . A A . 22 ASN HA 1 1 1 339 1 1 22 ASN HB2 H 10.316 3.661 2.767 1.00 . A A . 22 ASN HB2 1 1 1 340 1 1 22 ASN HB3 H 11.696 3.001 1.897 1.00 . A A . 22 ASN HB3 1 1 1 341 1 1 22 ASN HD21 H 11.136 3.256 4.776 1.00 . A A . 22 ASN HD21 1 1 1 342 1 1 22 ASN HD22 H 12.493 4.115 5.430 1.00 . A A . 22 ASN HD22 1 1 1 343 1 1 22 ASN N N 10.041 4.597 0.351 1.00 . A A . 22 ASN N 1 1 1 344 1 1 22 ASN ND2 N 11.918 3.852 4.681 1.00 . A A . 22 ASN ND2 1 1 1 345 1 1 22 ASN O O 13.066 6.187 0.578 1.00 . A A . 22 ASN O 1 1 1 346 1 1 22 ASN OD1 O 13.148 5.085 3.282 1.00 . A A . 22 ASN OD1 1 1 1 347 1 1 23 SER C C 13.545 4.756 -2.542 1.00 . A A . 23 SER C 1 1 1 348 1 1 23 SER CA C 13.925 4.228 -1.165 1.00 . A A . 23 SER CA 1 1 1 349 1 1 23 SER CB C 14.587 2.857 -1.280 1.00 . A A . 23 SER CB 1 1 1 350 1 1 23 SER H H 12.191 3.349 -0.349 1.00 . A A . 23 SER H 1 1 1 351 1 1 23 SER HA H 14.621 4.918 -0.706 1.00 . A A . 23 SER HA 1 1 1 352 1 1 23 SER HB2 H 13.859 2.133 -1.613 1.00 . A A . 23 SER HB2 1 1 1 353 1 1 23 SER HB3 H 15.398 2.910 -1.993 1.00 . A A . 23 SER HB3 1 1 1 354 1 1 23 SER HG H 14.406 2.007 0.488 1.00 . A A . 23 SER HG 1 1 1 355 1 1 23 SER N N 12.750 4.153 -0.318 1.00 . A A . 23 SER N 1 1 1 356 1 1 23 SER O O 13.601 5.990 -2.741 1.00 . A A . 23 SER O 1 1 1 357 1 1 23 SER OXT O 13.178 3.942 -3.415 1.00 . A A . 23 SER OXT 1 1 1 358 1 1 23 SER OG O 15.109 2.437 -0.027 1.00 . A A . 23 SER OG 1 1 2 359 1 1 1 GLY C C -11.951 4.041 -2.172 1.00 . A A . 1 GLY C 1 1 2 360 1 1 1 GLY CA C -11.371 3.555 -3.485 1.00 . A A . 1 GLY CA 1 1 2 361 1 1 1 GLY H1 H -9.851 4.976 -3.589 1.00 . A A . 1 GLY H1 1 1 2 362 1 1 1 GLY H2 H -11.256 5.404 -4.437 1.00 . A A . 1 GLY H2 1 1 2 363 1 1 1 GLY H3 H -10.205 4.234 -5.072 1.00 . A A . 1 GLY H3 1 1 2 364 1 1 1 GLY HA2 H -12.176 3.214 -4.119 1.00 . A A . 1 GLY HA2 1 1 2 365 1 1 1 GLY HA3 H -10.707 2.725 -3.285 1.00 . A A . 1 GLY HA3 1 1 2 366 1 1 1 GLY N N -10.619 4.615 -4.193 1.00 . A A . 1 GLY N 1 1 2 367 1 1 1 GLY O O -13.166 4.191 -2.046 1.00 . A A . 1 GLY O 1 1 2 368 1 1 2 ILE C C -12.112 3.543 0.903 1.00 . A A . 2 ILE C 1 1 2 369 1 1 2 ILE CA C -11.461 4.708 0.149 1.00 . A A . 2 ILE CA 1 1 2 370 1 1 2 ILE CB C -12.410 5.935 0.147 1.00 . A A . 2 ILE CB 1 1 2 371 1 1 2 ILE CD1 C -12.578 8.376 -0.577 1.00 . A A . 2 ILE CD1 1 1 2 372 1 1 2 ILE CG1 C -11.713 7.136 -0.499 1.00 . A A . 2 ILE CG1 1 1 2 373 1 1 2 ILE CG2 C -12.861 6.274 1.565 1.00 . A A . 2 ILE CG2 1 1 2 374 1 1 2 ILE H H -10.110 4.255 -1.418 1.00 . A A . 2 ILE H 1 1 2 375 1 1 2 ILE HA H -10.559 4.987 0.676 1.00 . A A . 2 ILE HA 1 1 2 376 1 1 2 ILE HB H -13.286 5.683 -0.431 1.00 . A A . 2 ILE HB 1 1 2 377 1 1 2 ILE HD11 H -13.471 8.158 -1.146 1.00 . A A . 2 ILE HD11 1 1 2 378 1 1 2 ILE HD12 H -12.027 9.167 -1.062 1.00 . A A . 2 ILE HD12 1 1 2 379 1 1 2 ILE HD13 H -12.854 8.688 0.420 1.00 . A A . 2 ILE HD13 1 1 2 380 1 1 2 ILE HG12 H -10.834 7.385 0.075 1.00 . A A . 2 ILE HG12 1 1 2 381 1 1 2 ILE HG13 H -11.419 6.874 -1.504 1.00 . A A . 2 ILE HG13 1 1 2 382 1 1 2 ILE HG21 H -11.999 6.525 2.167 1.00 . A A . 2 ILE HG21 1 1 2 383 1 1 2 ILE HG22 H -13.363 5.422 1.996 1.00 . A A . 2 ILE HG22 1 1 2 384 1 1 2 ILE HG23 H -13.538 7.116 1.538 1.00 . A A . 2 ILE HG23 1 1 2 385 1 1 2 ILE N N -11.066 4.310 -1.207 1.00 . A A . 2 ILE N 1 1 2 386 1 1 2 ILE O O -12.981 2.847 0.377 1.00 . A A . 2 ILE O 1 1 2 387 1 1 3 GLY C C -11.771 0.879 2.557 1.00 . A A . 3 GLY C 1 1 2 388 1 1 3 GLY CA C -12.214 2.271 2.964 1.00 . A A . 3 GLY CA 1 1 2 389 1 1 3 GLY H H -10.925 3.883 2.479 1.00 . A A . 3 GLY H 1 1 2 390 1 1 3 GLY HA2 H -11.910 2.445 3.986 1.00 . A A . 3 GLY HA2 1 1 2 391 1 1 3 GLY HA3 H -13.292 2.323 2.908 1.00 . A A . 3 GLY HA3 1 1 2 392 1 1 3 GLY N N -11.654 3.316 2.128 1.00 . A A . 3 GLY N 1 1 2 393 1 1 3 GLY O O -10.961 0.253 3.238 1.00 . A A . 3 GLY O 1 1 2 394 1 1 4 LYS C C -10.820 -0.997 0.054 1.00 . A A . 4 LYS C 1 1 2 395 1 1 4 LYS CA C -12.020 -0.954 0.979 1.00 . A A . 4 LYS CA 1 1 2 396 1 1 4 LYS CB C -13.261 -1.543 0.300 1.00 . A A . 4 LYS CB 1 1 2 397 1 1 4 LYS CD C -15.220 -1.208 -1.233 1.00 . A A . 4 LYS CD 1 1 2 398 1 1 4 LYS CE C -16.095 -0.177 -1.928 1.00 . A A . 4 LYS CE 1 1 2 399 1 1 4 LYS CG C -13.968 -0.580 -0.642 1.00 . A A . 4 LYS CG 1 1 2 400 1 1 4 LYS H H -12.789 1.013 0.851 1.00 . A A . 4 LYS H 1 1 2 401 1 1 4 LYS HA H -11.789 -1.538 1.856 1.00 . A A . 4 LYS HA 1 1 2 402 1 1 4 LYS HB2 H -12.964 -2.413 -0.267 1.00 . A A . 4 LYS HB2 1 1 2 403 1 1 4 LYS HB3 H -13.963 -1.847 1.063 1.00 . A A . 4 LYS HB3 1 1 2 404 1 1 4 LYS HD2 H -14.929 -1.959 -1.951 1.00 . A A . 4 LYS HD2 1 1 2 405 1 1 4 LYS HD3 H -15.787 -1.671 -0.438 1.00 . A A . 4 LYS HD3 1 1 2 406 1 1 4 LYS HE2 H -16.417 0.553 -1.200 1.00 . A A . 4 LYS HE2 1 1 2 407 1 1 4 LYS HE3 H -15.512 0.313 -2.695 1.00 . A A . 4 LYS HE3 1 1 2 408 1 1 4 LYS HG2 H -14.245 0.308 -0.094 1.00 . A A . 4 LYS HG2 1 1 2 409 1 1 4 LYS HG3 H -13.294 -0.317 -1.444 1.00 . A A . 4 LYS HG3 1 1 2 410 1 1 4 LYS HZ1 H -17.012 -1.381 -3.367 1.00 . A A . 4 LYS HZ1 1 1 2 411 1 1 4 LYS HZ2 H -17.954 -0.056 -2.886 1.00 . A A . 4 LYS HZ2 1 1 2 412 1 1 4 LYS HZ3 H -17.790 -1.401 -1.863 1.00 . A A . 4 LYS HZ3 1 1 2 413 1 1 4 LYS N N -12.268 0.411 1.422 1.00 . A A . 4 LYS N 1 1 2 414 1 1 4 LYS NZ N -17.296 -0.795 -2.553 1.00 . A A . 4 LYS NZ 1 1 2 415 1 1 4 LYS O O -10.278 -2.060 -0.237 1.00 . A A . 4 LYS O 1 1 2 416 1 1 5 PHE C C -7.997 -0.009 -0.154 1.00 . A A . 5 PHE C 1 1 2 417 1 1 5 PHE CA C -9.144 0.308 -1.106 1.00 . A A . 5 PHE CA 1 1 2 418 1 1 5 PHE CB C -9.001 1.729 -1.659 1.00 . A A . 5 PHE CB 1 1 2 419 1 1 5 PHE CD1 C -7.524 1.495 -3.683 1.00 . A A . 5 PHE CD1 1 1 2 420 1 1 5 PHE CD2 C -6.692 2.709 -1.804 1.00 . A A . 5 PHE CD2 1 1 2 421 1 1 5 PHE CE1 C -6.339 1.727 -4.359 1.00 . A A . 5 PHE CE1 1 1 2 422 1 1 5 PHE CE2 C -5.507 2.945 -2.475 1.00 . A A . 5 PHE CE2 1 1 2 423 1 1 5 PHE CG C -7.713 1.980 -2.398 1.00 . A A . 5 PHE CG 1 1 2 424 1 1 5 PHE CZ C -5.331 2.454 -3.754 1.00 . A A . 5 PHE CZ 1 1 2 425 1 1 5 PHE H H -10.951 0.971 -0.233 1.00 . A A . 5 PHE H 1 1 2 426 1 1 5 PHE HA H -9.140 -0.401 -1.920 1.00 . A A . 5 PHE HA 1 1 2 427 1 1 5 PHE HB2 H -9.815 1.922 -2.341 1.00 . A A . 5 PHE HB2 1 1 2 428 1 1 5 PHE HB3 H -9.054 2.430 -0.840 1.00 . A A . 5 PHE HB3 1 1 2 429 1 1 5 PHE HD1 H -8.310 0.928 -4.157 1.00 . A A . 5 PHE HD1 1 1 2 430 1 1 5 PHE HD2 H -6.830 3.089 -0.802 1.00 . A A . 5 PHE HD2 1 1 2 431 1 1 5 PHE HE1 H -6.204 1.343 -5.359 1.00 . A A . 5 PHE HE1 1 1 2 432 1 1 5 PHE HE2 H -4.721 3.515 -2.000 1.00 . A A . 5 PHE HE2 1 1 2 433 1 1 5 PHE HZ H -4.406 2.638 -4.280 1.00 . A A . 5 PHE HZ 1 1 2 434 1 1 5 PHE N N -10.400 0.177 -0.388 1.00 . A A . 5 PHE N 1 1 2 435 1 1 5 PHE O O -6.906 -0.394 -0.571 1.00 . A A . 5 PHE O 1 1 2 436 1 1 6 LEU C C -7.021 -1.553 2.409 1.00 . A A . 6 LEU C 1 1 2 437 1 1 6 LEU CA C -7.275 -0.076 2.169 1.00 . A A . 6 LEU CA 1 1 2 438 1 1 6 LEU CB C -7.701 0.610 3.465 1.00 . A A . 6 LEU CB 1 1 2 439 1 1 6 LEU CD1 C -8.413 2.685 4.666 1.00 . A A . 6 LEU CD1 1 1 2 440 1 1 6 LEU CD2 C -6.646 2.814 2.914 1.00 . A A . 6 LEU CD2 1 1 2 441 1 1 6 LEU CG C -7.925 2.118 3.348 1.00 . A A . 6 LEU CG 1 1 2 442 1 1 6 LEU H H -9.208 0.335 1.404 1.00 . A A . 6 LEU H 1 1 2 443 1 1 6 LEU HA H -6.356 0.373 1.821 1.00 . A A . 6 LEU HA 1 1 2 444 1 1 6 LEU HB2 H -8.619 0.153 3.805 1.00 . A A . 6 LEU HB2 1 1 2 445 1 1 6 LEU HB3 H -6.935 0.440 4.207 1.00 . A A . 6 LEU HB3 1 1 2 446 1 1 6 LEU HD11 H -9.336 2.199 4.951 1.00 . A A . 6 LEU HD11 1 1 2 447 1 1 6 LEU HD12 H -8.584 3.745 4.560 1.00 . A A . 6 LEU HD12 1 1 2 448 1 1 6 LEU HD13 H -7.667 2.515 5.428 1.00 . A A . 6 LEU HD13 1 1 2 449 1 1 6 LEU HD21 H -5.885 2.668 3.667 1.00 . A A . 6 LEU HD21 1 1 2 450 1 1 6 LEU HD22 H -6.835 3.869 2.791 1.00 . A A . 6 LEU HD22 1 1 2 451 1 1 6 LEU HD23 H -6.309 2.396 1.977 1.00 . A A . 6 LEU HD23 1 1 2 452 1 1 6 LEU HG H -8.683 2.307 2.599 1.00 . A A . 6 LEU HG 1 1 2 453 1 1 6 LEU N N -8.282 0.119 1.138 1.00 . A A . 6 LEU N 1 1 2 454 1 1 6 LEU O O -5.991 -1.929 2.967 1.00 . A A . 6 LEU O 1 1 2 455 1 1 7 HIS C C -6.550 -4.248 1.251 1.00 . A A . 7 HIS C 1 1 2 456 1 1 7 HIS CA C -7.774 -3.831 2.061 1.00 . A A . 7 HIS CA 1 1 2 457 1 1 7 HIS CB C -9.028 -4.555 1.558 1.00 . A A . 7 HIS CB 1 1 2 458 1 1 7 HIS CD2 C -8.738 -6.949 2.531 1.00 . A A . 7 HIS CD2 1 1 2 459 1 1 7 HIS CE1 C -8.848 -8.067 0.651 1.00 . A A . 7 HIS CE1 1 1 2 460 1 1 7 HIS CG C -8.908 -6.051 1.533 1.00 . A A . 7 HIS CG 1 1 2 461 1 1 7 HIS H H -8.780 -2.029 1.590 1.00 . A A . 7 HIS H 1 1 2 462 1 1 7 HIS HA H -7.613 -4.082 3.099 1.00 . A A . 7 HIS HA 1 1 2 463 1 1 7 HIS HB2 H -9.859 -4.303 2.198 1.00 . A A . 7 HIS HB2 1 1 2 464 1 1 7 HIS HB3 H -9.242 -4.222 0.553 1.00 . A A . 7 HIS HB3 1 1 2 465 1 1 7 HIS HD1 H -9.123 -6.414 -0.536 1.00 . A A . 7 HIS HD1 1 1 2 466 1 1 7 HIS HD2 H -8.650 -6.727 3.586 1.00 . A A . 7 HIS HD2 1 1 2 467 1 1 7 HIS HE1 H -8.856 -8.873 -0.067 1.00 . A A . 7 HIS HE1 1 1 2 468 1 1 7 HIS HE2 H -8.782 -9.049 2.445 1.00 . A A . 7 HIS HE2 1 1 2 469 1 1 7 HIS N N -7.953 -2.388 1.974 1.00 . A A . 7 HIS N 1 1 2 470 1 1 7 HIS ND1 N -8.975 -6.784 0.370 1.00 . A A . 7 HIS ND1 1 1 2 471 1 1 7 HIS NE2 N -8.703 -8.196 1.956 1.00 . A A . 7 HIS NE2 1 1 2 472 1 1 7 HIS O O -5.665 -4.942 1.749 1.00 . A A . 7 HIS O 1 1 2 473 1 1 8 SER C C -4.211 -3.129 -0.582 1.00 . A A . 8 SER C 1 1 2 474 1 1 8 SER CA C -5.352 -4.098 -0.843 1.00 . A A . 8 SER CA 1 1 2 475 1 1 8 SER CB C -5.757 -4.066 -2.308 1.00 . A A . 8 SER CB 1 1 2 476 1 1 8 SER H H -7.228 -3.272 -0.355 1.00 . A A . 8 SER H 1 1 2 477 1 1 8 SER HA H -5.013 -5.090 -0.595 1.00 . A A . 8 SER HA 1 1 2 478 1 1 8 SER HB2 H -6.042 -3.061 -2.583 1.00 . A A . 8 SER HB2 1 1 2 479 1 1 8 SER HB3 H -4.921 -4.382 -2.905 1.00 . A A . 8 SER HB3 1 1 2 480 1 1 8 SER HG H -7.443 -4.538 -3.196 1.00 . A A . 8 SER HG 1 1 2 481 1 1 8 SER N N -6.489 -3.799 0.006 1.00 . A A . 8 SER N 1 1 2 482 1 1 8 SER O O -3.058 -3.416 -0.899 1.00 . A A . 8 SER O 1 1 2 483 1 1 8 SER OG O -6.849 -4.937 -2.547 1.00 . A A . 8 SER OG 1 1 2 484 1 1 9 ALA C C -2.681 -1.687 1.579 1.00 . A A . 9 ALA C 1 1 2 485 1 1 9 ALA CA C -3.498 -1.055 0.461 1.00 . A A . 9 ALA CA 1 1 2 486 1 1 9 ALA CB C -4.109 0.260 0.920 1.00 . A A . 9 ALA CB 1 1 2 487 1 1 9 ALA H H -5.473 -1.761 0.160 1.00 . A A . 9 ALA H 1 1 2 488 1 1 9 ALA HA H -2.846 -0.853 -0.378 1.00 . A A . 9 ALA HA 1 1 2 489 1 1 9 ALA HB1 H -4.691 0.686 0.116 1.00 . A A . 9 ALA HB1 1 1 2 490 1 1 9 ALA HB2 H -3.322 0.946 1.195 1.00 . A A . 9 ALA HB2 1 1 2 491 1 1 9 ALA HB3 H -4.749 0.083 1.772 1.00 . A A . 9 ALA HB3 1 1 2 492 1 1 9 ALA N N -4.526 -1.986 0.019 1.00 . A A . 9 ALA N 1 1 2 493 1 1 9 ALA O O -1.605 -1.207 1.933 1.00 . A A . 9 ALA O 1 1 2 494 1 1 10 LYS C C -1.817 -4.758 2.409 1.00 . A A . 10 LYS C 1 1 2 495 1 1 10 LYS CA C -2.467 -3.566 3.097 1.00 . A A . 10 LYS CA 1 1 2 496 1 1 10 LYS CB C -3.372 -4.069 4.224 1.00 . A A . 10 LYS CB 1 1 2 497 1 1 10 LYS CD C -4.684 -3.585 6.301 1.00 . A A . 10 LYS CD 1 1 2 498 1 1 10 LYS CE C -5.153 -2.527 7.282 1.00 . A A . 10 LYS CE 1 1 2 499 1 1 10 LYS CG C -3.873 -2.985 5.161 1.00 . A A . 10 LYS CG 1 1 2 500 1 1 10 LYS H H -4.134 -3.025 1.905 1.00 . A A . 10 LYS H 1 1 2 501 1 1 10 LYS HA H -1.693 -2.942 3.514 1.00 . A A . 10 LYS HA 1 1 2 502 1 1 10 LYS HB2 H -4.231 -4.554 3.785 1.00 . A A . 10 LYS HB2 1 1 2 503 1 1 10 LYS HB3 H -2.824 -4.792 4.809 1.00 . A A . 10 LYS HB3 1 1 2 504 1 1 10 LYS HD2 H -5.547 -4.085 5.891 1.00 . A A . 10 LYS HD2 1 1 2 505 1 1 10 LYS HD3 H -4.069 -4.301 6.829 1.00 . A A . 10 LYS HD3 1 1 2 506 1 1 10 LYS HE2 H -4.293 -1.976 7.638 1.00 . A A . 10 LYS HE2 1 1 2 507 1 1 10 LYS HE3 H -5.829 -1.856 6.774 1.00 . A A . 10 LYS HE3 1 1 2 508 1 1 10 LYS HG2 H -3.025 -2.456 5.571 1.00 . A A . 10 LYS HG2 1 1 2 509 1 1 10 LYS HG3 H -4.496 -2.300 4.605 1.00 . A A . 10 LYS HG3 1 1 2 510 1 1 10 LYS HZ1 H -6.719 -3.623 8.129 1.00 . A A . 10 LYS HZ1 1 1 2 511 1 1 10 LYS HZ2 H -6.111 -2.403 9.136 1.00 . A A . 10 LYS HZ2 1 1 2 512 1 1 10 LYS HZ3 H -5.229 -3.836 8.908 1.00 . A A . 10 LYS HZ3 1 1 2 513 1 1 10 LYS N N -3.211 -2.767 2.138 1.00 . A A . 10 LYS N 1 1 2 514 1 1 10 LYS NZ N -5.853 -3.137 8.442 1.00 . A A . 10 LYS NZ 1 1 2 515 1 1 10 LYS O O -0.690 -5.130 2.730 1.00 . A A . 10 LYS O 1 1 2 516 1 1 11 LYS C C -0.902 -6.289 -0.149 1.00 . A A . 11 LYS C 1 1 2 517 1 1 11 LYS CA C -2.064 -6.564 0.803 1.00 . A A . 11 LYS CA 1 1 2 518 1 1 11 LYS CB C -3.222 -7.227 0.048 1.00 . A A . 11 LYS CB 1 1 2 519 1 1 11 LYS CD C -2.301 -9.557 0.231 1.00 . A A . 11 LYS CD 1 1 2 520 1 1 11 LYS CE C -1.799 -10.769 -0.535 1.00 . A A . 11 LYS CE 1 1 2 521 1 1 11 LYS CG C -2.825 -8.487 -0.707 1.00 . A A . 11 LYS CG 1 1 2 522 1 1 11 LYS H H -3.370 -4.935 1.154 1.00 . A A . 11 LYS H 1 1 2 523 1 1 11 LYS HA H -1.724 -7.236 1.577 1.00 . A A . 11 LYS HA 1 1 2 524 1 1 11 LYS HB2 H -3.993 -7.491 0.757 1.00 . A A . 11 LYS HB2 1 1 2 525 1 1 11 LYS HB3 H -3.627 -6.521 -0.662 1.00 . A A . 11 LYS HB3 1 1 2 526 1 1 11 LYS HD2 H -1.486 -9.148 0.809 1.00 . A A . 11 LYS HD2 1 1 2 527 1 1 11 LYS HD3 H -3.097 -9.863 0.893 1.00 . A A . 11 LYS HD3 1 1 2 528 1 1 11 LYS HE2 H -1.024 -10.450 -1.215 1.00 . A A . 11 LYS HE2 1 1 2 529 1 1 11 LYS HE3 H -1.388 -11.477 0.170 1.00 . A A . 11 LYS HE3 1 1 2 530 1 1 11 LYS HG2 H -3.690 -8.872 -1.226 1.00 . A A . 11 LYS HG2 1 1 2 531 1 1 11 LYS HG3 H -2.054 -8.238 -1.423 1.00 . A A . 11 LYS HG3 1 1 2 532 1 1 11 LYS HZ1 H -3.327 -10.751 -1.966 1.00 . A A . 11 LYS HZ1 1 1 2 533 1 1 11 LYS HZ2 H -3.604 -11.814 -0.672 1.00 . A A . 11 LYS HZ2 1 1 2 534 1 1 11 LYS HZ3 H -2.479 -12.218 -1.877 1.00 . A A . 11 LYS HZ3 1 1 2 535 1 1 11 LYS N N -2.524 -5.341 1.447 1.00 . A A . 11 LYS N 1 1 2 536 1 1 11 LYS NZ N -2.877 -11.433 -1.315 1.00 . A A . 11 LYS NZ 1 1 2 537 1 1 11 LYS O O 0.095 -7.009 -0.154 1.00 . A A . 11 LYS O 1 1 2 538 1 1 12 PHE C C 0.409 -3.461 -1.787 1.00 . A A . 12 PHE C 1 1 2 539 1 1 12 PHE CA C -0.030 -4.910 -1.941 1.00 . A A . 12 PHE CA 1 1 2 540 1 1 12 PHE CB C -0.586 -5.163 -3.348 1.00 . A A . 12 PHE CB 1 1 2 541 1 1 12 PHE CD1 C 1.394 -5.943 -4.692 1.00 . A A . 12 PHE CD1 1 1 2 542 1 1 12 PHE CD2 C 0.405 -3.844 -5.247 1.00 . A A . 12 PHE CD2 1 1 2 543 1 1 12 PHE CE1 C 2.323 -5.776 -5.704 1.00 . A A . 12 PHE CE1 1 1 2 544 1 1 12 PHE CE2 C 1.331 -3.672 -6.260 1.00 . A A . 12 PHE CE2 1 1 2 545 1 1 12 PHE CG C 0.423 -4.980 -4.452 1.00 . A A . 12 PHE CG 1 1 2 546 1 1 12 PHE CZ C 2.293 -4.638 -6.487 1.00 . A A . 12 PHE CZ 1 1 2 547 1 1 12 PHE H H -1.820 -4.661 -0.843 1.00 . A A . 12 PHE H 1 1 2 548 1 1 12 PHE HA H 0.823 -5.552 -1.778 1.00 . A A . 12 PHE HA 1 1 2 549 1 1 12 PHE HB2 H -0.954 -6.175 -3.402 1.00 . A A . 12 PHE HB2 1 1 2 550 1 1 12 PHE HB3 H -1.405 -4.480 -3.527 1.00 . A A . 12 PHE HB3 1 1 2 551 1 1 12 PHE HD1 H 1.418 -6.833 -4.082 1.00 . A A . 12 PHE HD1 1 1 2 552 1 1 12 PHE HD2 H -0.345 -3.086 -5.073 1.00 . A A . 12 PHE HD2 1 1 2 553 1 1 12 PHE HE1 H 3.074 -6.533 -5.880 1.00 . A A . 12 PHE HE1 1 1 2 554 1 1 12 PHE HE2 H 1.304 -2.782 -6.871 1.00 . A A . 12 PHE HE2 1 1 2 555 1 1 12 PHE HZ H 3.018 -4.504 -7.277 1.00 . A A . 12 PHE HZ 1 1 2 556 1 1 12 PHE N N -1.033 -5.239 -0.940 1.00 . A A . 12 PHE N 1 1 2 557 1 1 12 PHE O O 1.510 -3.091 -2.183 1.00 . A A . 12 PHE O 1 1 2 558 1 1 13 GLY C C 1.095 -1.092 -0.099 1.00 . A A . 13 GLY C 1 1 2 559 1 1 13 GLY CA C -0.121 -1.257 -0.978 1.00 . A A . 13 GLY CA 1 1 2 560 1 1 13 GLY H H -1.317 -2.996 -0.876 1.00 . A A . 13 GLY H 1 1 2 561 1 1 13 GLY HA2 H 0.076 -0.807 -1.935 1.00 . A A . 13 GLY HA2 1 1 2 562 1 1 13 GLY HA3 H -0.960 -0.757 -0.518 1.00 . A A . 13 GLY HA3 1 1 2 563 1 1 13 GLY N N -0.450 -2.648 -1.182 1.00 . A A . 13 GLY N 1 1 2 564 1 1 13 GLY O O 1.985 -0.300 -0.396 1.00 . A A . 13 GLY O 1 1 2 565 1 1 14 LYS C C 3.494 -2.519 1.305 1.00 . A A . 14 LYS C 1 1 2 566 1 1 14 LYS CA C 2.264 -1.842 1.896 1.00 . A A . 14 LYS CA 1 1 2 567 1 1 14 LYS CB C 1.882 -2.506 3.219 1.00 . A A . 14 LYS CB 1 1 2 568 1 1 14 LYS CD C 1.213 -0.365 4.364 1.00 . A A . 14 LYS CD 1 1 2 569 1 1 14 LYS CE C 0.079 0.407 5.022 1.00 . A A . 14 LYS CE 1 1 2 570 1 1 14 LYS CG C 0.781 -1.773 3.970 1.00 . A A . 14 LYS CG 1 1 2 571 1 1 14 LYS H H 0.417 -2.523 1.105 1.00 . A A . 14 LYS H 1 1 2 572 1 1 14 LYS HA H 2.495 -0.803 2.081 1.00 . A A . 14 LYS HA 1 1 2 573 1 1 14 LYS HB2 H 1.545 -3.513 3.016 1.00 . A A . 14 LYS HB2 1 1 2 574 1 1 14 LYS HB3 H 2.754 -2.548 3.852 1.00 . A A . 14 LYS HB3 1 1 2 575 1 1 14 LYS HD2 H 2.038 -0.431 5.056 1.00 . A A . 14 LYS HD2 1 1 2 576 1 1 14 LYS HD3 H 1.527 0.163 3.476 1.00 . A A . 14 LYS HD3 1 1 2 577 1 1 14 LYS HE2 H -0.304 -0.170 5.851 1.00 . A A . 14 LYS HE2 1 1 2 578 1 1 14 LYS HE3 H 0.467 1.349 5.388 1.00 . A A . 14 LYS HE3 1 1 2 579 1 1 14 LYS HG2 H -0.089 -1.707 3.334 1.00 . A A . 14 LYS HG2 1 1 2 580 1 1 14 LYS HG3 H 0.536 -2.330 4.861 1.00 . A A . 14 LYS HG3 1 1 2 581 1 1 14 LYS HZ1 H -1.327 -0.202 3.605 1.00 . A A . 14 LYS HZ1 1 1 2 582 1 1 14 LYS HZ2 H -0.722 1.362 3.344 1.00 . A A . 14 LYS HZ2 1 1 2 583 1 1 14 LYS HZ3 H -1.849 1.081 4.580 1.00 . A A . 14 LYS HZ3 1 1 2 584 1 1 14 LYS N N 1.148 -1.886 0.957 1.00 . A A . 14 LYS N 1 1 2 585 1 1 14 LYS NZ N -1.031 0.678 4.072 1.00 . A A . 14 LYS NZ 1 1 2 586 1 1 14 LYS O O 4.616 -2.308 1.765 1.00 . A A . 14 LYS O 1 1 2 587 1 1 15 ALA C C 5.025 -3.020 -1.394 1.00 . A A . 15 ALA C 1 1 2 588 1 1 15 ALA CA C 4.373 -3.989 -0.417 1.00 . A A . 15 ALA CA 1 1 2 589 1 1 15 ALA CB C 3.872 -5.233 -1.141 1.00 . A A . 15 ALA CB 1 1 2 590 1 1 15 ALA H H 2.360 -3.494 -0.019 1.00 . A A . 15 ALA H 1 1 2 591 1 1 15 ALA HA H 5.106 -4.296 0.319 1.00 . A A . 15 ALA HA 1 1 2 592 1 1 15 ALA HB1 H 3.432 -5.913 -0.427 1.00 . A A . 15 ALA HB1 1 1 2 593 1 1 15 ALA HB2 H 4.698 -5.720 -1.640 1.00 . A A . 15 ALA HB2 1 1 2 594 1 1 15 ALA HB3 H 3.128 -4.949 -1.870 1.00 . A A . 15 ALA HB3 1 1 2 595 1 1 15 ALA N N 3.278 -3.334 0.280 1.00 . A A . 15 ALA N 1 1 2 596 1 1 15 ALA O O 6.249 -2.898 -1.448 1.00 . A A . 15 ALA O 1 1 2 597 1 1 16 PHE C C 5.300 -0.141 -2.415 1.00 . A A . 16 PHE C 1 1 2 598 1 1 16 PHE CA C 4.674 -1.343 -3.118 1.00 . A A . 16 PHE CA 1 1 2 599 1 1 16 PHE CB C 3.529 -0.895 -4.032 1.00 . A A . 16 PHE CB 1 1 2 600 1 1 16 PHE CD1 C 4.726 -0.419 -6.191 1.00 . A A . 16 PHE CD1 1 1 2 601 1 1 16 PHE CD2 C 3.609 1.382 -5.095 1.00 . A A . 16 PHE CD2 1 1 2 602 1 1 16 PHE CE1 C 5.126 0.439 -7.199 1.00 . A A . 16 PHE CE1 1 1 2 603 1 1 16 PHE CE2 C 4.005 2.241 -6.100 1.00 . A A . 16 PHE CE2 1 1 2 604 1 1 16 PHE CG C 3.963 0.041 -5.128 1.00 . A A . 16 PHE CG 1 1 2 605 1 1 16 PHE CZ C 4.764 1.770 -7.152 1.00 . A A . 16 PHE CZ 1 1 2 606 1 1 16 PHE H H 3.223 -2.453 -2.055 1.00 . A A . 16 PHE H 1 1 2 607 1 1 16 PHE HA H 5.431 -1.826 -3.720 1.00 . A A . 16 PHE HA 1 1 2 608 1 1 16 PHE HB2 H 3.087 -1.766 -4.492 1.00 . A A . 16 PHE HB2 1 1 2 609 1 1 16 PHE HB3 H 2.781 -0.390 -3.436 1.00 . A A . 16 PHE HB3 1 1 2 610 1 1 16 PHE HD1 H 5.010 -1.460 -6.228 1.00 . A A . 16 PHE HD1 1 1 2 611 1 1 16 PHE HD2 H 3.016 1.754 -4.271 1.00 . A A . 16 PHE HD2 1 1 2 612 1 1 16 PHE HE1 H 5.720 0.069 -8.020 1.00 . A A . 16 PHE HE1 1 1 2 613 1 1 16 PHE HE2 H 3.723 3.282 -6.062 1.00 . A A . 16 PHE HE2 1 1 2 614 1 1 16 PHE HZ H 5.074 2.442 -7.938 1.00 . A A . 16 PHE HZ 1 1 2 615 1 1 16 PHE N N 4.192 -2.311 -2.147 1.00 . A A . 16 PHE N 1 1 2 616 1 1 16 PHE O O 6.398 0.291 -2.768 1.00 . A A . 16 PHE O 1 1 2 617 1 1 17 VAL C C 6.304 1.124 0.219 1.00 . A A . 17 VAL C 1 1 2 618 1 1 17 VAL CA C 5.127 1.535 -0.665 1.00 . A A . 17 VAL CA 1 1 2 619 1 1 17 VAL CB C 4.026 2.205 0.194 1.00 . A A . 17 VAL CB 1 1 2 620 1 1 17 VAL CG1 C 3.749 1.414 1.465 1.00 . A A . 17 VAL CG1 1 1 2 621 1 1 17 VAL CG2 C 4.394 3.647 0.519 1.00 . A A . 17 VAL CG2 1 1 2 622 1 1 17 VAL H H 3.770 -0.029 -1.124 1.00 . A A . 17 VAL H 1 1 2 623 1 1 17 VAL HA H 5.477 2.255 -1.393 1.00 . A A . 17 VAL HA 1 1 2 624 1 1 17 VAL HB H 3.114 2.216 -0.387 1.00 . A A . 17 VAL HB 1 1 2 625 1 1 17 VAL HG11 H 3.411 0.421 1.203 1.00 . A A . 17 VAL HG11 1 1 2 626 1 1 17 VAL HG12 H 2.985 1.913 2.041 1.00 . A A . 17 VAL HG12 1 1 2 627 1 1 17 VAL HG13 H 4.653 1.342 2.051 1.00 . A A . 17 VAL HG13 1 1 2 628 1 1 17 VAL HG21 H 5.324 3.667 1.068 1.00 . A A . 17 VAL HG21 1 1 2 629 1 1 17 VAL HG22 H 3.614 4.093 1.119 1.00 . A A . 17 VAL HG22 1 1 2 630 1 1 17 VAL HG23 H 4.506 4.204 -0.398 1.00 . A A . 17 VAL HG23 1 1 2 631 1 1 17 VAL N N 4.622 0.378 -1.394 1.00 . A A . 17 VAL N 1 1 2 632 1 1 17 VAL O O 7.028 1.963 0.754 1.00 . A A . 17 VAL O 1 1 2 633 1 1 18 GLY C C 8.913 -0.620 0.404 1.00 . A A . 18 GLY C 1 1 2 634 1 1 18 GLY CA C 7.589 -0.703 1.134 1.00 . A A . 18 GLY CA 1 1 2 635 1 1 18 GLY H H 5.875 -0.800 -0.094 1.00 . A A . 18 GLY H 1 1 2 636 1 1 18 GLY HA2 H 7.660 -0.139 2.052 1.00 . A A . 18 GLY HA2 1 1 2 637 1 1 18 GLY HA3 H 7.385 -1.736 1.371 1.00 . A A . 18 GLY HA3 1 1 2 638 1 1 18 GLY N N 6.493 -0.181 0.348 1.00 . A A . 18 GLY N 1 1 2 639 1 1 18 GLY O O 9.971 -0.831 0.994 1.00 . A A . 18 GLY O 1 1 2 640 1 1 19 GLU C C 10.181 1.265 -2.210 1.00 . A A . 19 GLU C 1 1 2 641 1 1 19 GLU CA C 10.062 -0.162 -1.680 1.00 . A A . 19 GLU CA 1 1 2 642 1 1 19 GLU CB C 10.108 -1.176 -2.832 1.00 . A A . 19 GLU CB 1 1 2 643 1 1 19 GLU CD C 9.030 -2.086 -4.917 1.00 . A A . 19 GLU CD 1 1 2 644 1 1 19 GLU CG C 8.899 -1.137 -3.748 1.00 . A A . 19 GLU CG 1 1 2 645 1 1 19 GLU H H 7.979 -0.193 -1.312 1.00 . A A . 19 GLU H 1 1 2 646 1 1 19 GLU HA H 10.901 -0.349 -1.024 1.00 . A A . 19 GLU HA 1 1 2 647 1 1 19 GLU HB2 H 10.984 -0.980 -3.432 1.00 . A A . 19 GLU HB2 1 1 2 648 1 1 19 GLU HB3 H 10.184 -2.169 -2.415 1.00 . A A . 19 GLU HB3 1 1 2 649 1 1 19 GLU HG2 H 8.023 -1.413 -3.179 1.00 . A A . 19 GLU HG2 1 1 2 650 1 1 19 GLU HG3 H 8.783 -0.132 -4.127 1.00 . A A . 19 GLU HG3 1 1 2 651 1 1 19 GLU N N 8.854 -0.319 -0.888 1.00 . A A . 19 GLU N 1 1 2 652 1 1 19 GLU O O 11.239 1.881 -2.097 1.00 . A A . 19 GLU O 1 1 2 653 1 1 19 GLU OE1 O 8.742 -3.291 -4.747 1.00 . A A . 19 GLU OE1 1 1 2 654 1 1 19 GLU OE2 O 9.441 -1.639 -6.008 1.00 . A A . 19 GLU OE2 1 1 2 655 1 1 20 ILE C C 9.019 4.226 -2.222 1.00 . A A . 20 ILE C 1 1 2 656 1 1 20 ILE CA C 9.100 3.151 -3.326 1.00 . A A . 20 ILE CA 1 1 2 657 1 1 20 ILE CB C 7.958 3.317 -4.368 1.00 . A A . 20 ILE CB 1 1 2 658 1 1 20 ILE CD1 C 9.369 4.721 -5.958 1.00 . A A . 20 ILE CD1 1 1 2 659 1 1 20 ILE CG1 C 8.099 4.634 -5.140 1.00 . A A . 20 ILE CG1 1 1 2 660 1 1 20 ILE CG2 C 6.588 3.228 -3.709 1.00 . A A . 20 ILE CG2 1 1 2 661 1 1 20 ILE H H 8.253 1.289 -2.757 1.00 . A A . 20 ILE H 1 1 2 662 1 1 20 ILE HA H 10.043 3.269 -3.845 1.00 . A A . 20 ILE HA 1 1 2 663 1 1 20 ILE HB H 8.034 2.498 -5.066 1.00 . A A . 20 ILE HB 1 1 2 664 1 1 20 ILE HD11 H 9.405 3.895 -6.652 1.00 . A A . 20 ILE HD11 1 1 2 665 1 1 20 ILE HD12 H 10.225 4.676 -5.300 1.00 . A A . 20 ILE HD12 1 1 2 666 1 1 20 ILE HD13 H 9.384 5.651 -6.508 1.00 . A A . 20 ILE HD13 1 1 2 667 1 1 20 ILE HG12 H 7.262 4.740 -5.814 1.00 . A A . 20 ILE HG12 1 1 2 668 1 1 20 ILE HG13 H 8.097 5.455 -4.438 1.00 . A A . 20 ILE HG13 1 1 2 669 1 1 20 ILE HG21 H 6.464 2.247 -3.278 1.00 . A A . 20 ILE HG21 1 1 2 670 1 1 20 ILE HG22 H 5.819 3.399 -4.449 1.00 . A A . 20 ILE HG22 1 1 2 671 1 1 20 ILE HG23 H 6.513 3.974 -2.931 1.00 . A A . 20 ILE HG23 1 1 2 672 1 1 20 ILE N N 9.088 1.807 -2.745 1.00 . A A . 20 ILE N 1 1 2 673 1 1 20 ILE O O 8.211 5.159 -2.267 1.00 . A A . 20 ILE O 1 1 2 674 1 1 21 MET C C 11.368 5.285 0.298 1.00 . A A . 21 MET C 1 1 2 675 1 1 21 MET CA C 9.924 4.998 -0.099 1.00 . A A . 21 MET CA 1 1 2 676 1 1 21 MET CB C 9.158 4.419 1.095 1.00 . A A . 21 MET CB 1 1 2 677 1 1 21 MET CE C 6.674 6.368 1.747 1.00 . A A . 21 MET CE 1 1 2 678 1 1 21 MET CG C 9.169 5.313 2.328 1.00 . A A . 21 MET CG 1 1 2 679 1 1 21 MET H H 10.510 3.328 -1.258 1.00 . A A . 21 MET H 1 1 2 680 1 1 21 MET HA H 9.454 5.921 -0.403 1.00 . A A . 21 MET HA 1 1 2 681 1 1 21 MET HB2 H 8.130 4.261 0.802 1.00 . A A . 21 MET HB2 1 1 2 682 1 1 21 MET HB3 H 9.596 3.467 1.361 1.00 . A A . 21 MET HB3 1 1 2 683 1 1 21 MET HE1 H 6.656 5.710 0.891 1.00 . A A . 21 MET HE1 1 1 2 684 1 1 21 MET HE2 H 6.053 7.231 1.551 1.00 . A A . 21 MET HE2 1 1 2 685 1 1 21 MET HE3 H 6.297 5.843 2.612 1.00 . A A . 21 MET HE3 1 1 2 686 1 1 21 MET HG2 H 8.661 4.800 3.132 1.00 . A A . 21 MET HG2 1 1 2 687 1 1 21 MET HG3 H 10.195 5.496 2.615 1.00 . A A . 21 MET HG3 1 1 2 688 1 1 21 MET N N 9.878 4.079 -1.226 1.00 . A A . 21 MET N 1 1 2 689 1 1 21 MET O O 11.800 6.436 0.322 1.00 . A A . 21 MET O 1 1 2 690 1 1 21 MET SD S 8.355 6.899 2.055 1.00 . A A . 21 MET SD 1 1 2 691 1 1 22 ASN C C 14.442 3.793 -0.014 1.00 . A A . 22 ASN C 1 1 2 692 1 1 22 ASN CA C 13.498 4.368 1.037 1.00 . A A . 22 ASN CA 1 1 2 693 1 1 22 ASN CB C 13.711 3.659 2.380 1.00 . A A . 22 ASN CB 1 1 2 694 1 1 22 ASN CG C 12.838 4.217 3.492 1.00 . A A . 22 ASN CG 1 1 2 695 1 1 22 ASN H H 11.724 3.329 0.532 1.00 . A A . 22 ASN H 1 1 2 696 1 1 22 ASN HA H 13.704 5.421 1.155 1.00 . A A . 22 ASN HA 1 1 2 697 1 1 22 ASN HB2 H 13.483 2.608 2.266 1.00 . A A . 22 ASN HB2 1 1 2 698 1 1 22 ASN HB3 H 14.745 3.766 2.674 1.00 . A A . 22 ASN HB3 1 1 2 699 1 1 22 ASN HD21 H 12.999 6.052 2.740 1.00 . A A . 22 ASN HD21 1 1 2 700 1 1 22 ASN HD22 H 12.035 5.904 4.173 1.00 . A A . 22 ASN HD22 1 1 2 701 1 1 22 ASN N N 12.113 4.229 0.602 1.00 . A A . 22 ASN N 1 1 2 702 1 1 22 ASN ND2 N 12.600 5.520 3.466 1.00 . A A . 22 ASN ND2 1 1 2 703 1 1 22 ASN O O 15.611 3.514 0.262 1.00 . A A . 22 ASN O 1 1 2 704 1 1 22 ASN OD1 O 12.383 3.481 4.370 1.00 . A A . 22 ASN OD1 1 1 2 705 1 1 23 SER C C 14.613 4.045 -3.510 1.00 . A A . 23 SER C 1 1 2 706 1 1 23 SER CA C 14.708 3.095 -2.326 1.00 . A A . 23 SER CA 1 1 2 707 1 1 23 SER CB C 14.223 1.700 -2.727 1.00 . A A . 23 SER CB 1 1 2 708 1 1 23 SER H H 12.984 3.845 -1.375 1.00 . A A . 23 SER H 1 1 2 709 1 1 23 SER HA H 15.739 3.033 -2.006 1.00 . A A . 23 SER HA 1 1 2 710 1 1 23 SER HB2 H 13.203 1.761 -3.072 1.00 . A A . 23 SER HB2 1 1 2 711 1 1 23 SER HB3 H 14.849 1.320 -3.520 1.00 . A A . 23 SER HB3 1 1 2 712 1 1 23 SER HG H 14.609 1.272 -0.850 1.00 . A A . 23 SER HG 1 1 2 713 1 1 23 SER N N 13.923 3.610 -1.218 1.00 . A A . 23 SER N 1 1 2 714 1 1 23 SER O O 15.614 4.731 -3.809 1.00 . A A . 23 SER O 1 1 2 715 1 1 23 SER OXT O 13.526 4.129 -4.115 1.00 . A A . 23 SER OXT 1 1 2 716 1 1 23 SER OG O 14.278 0.804 -1.627 1.00 . A A . 23 SER OG 1 1 3 717 1 1 1 GLY C C -8.675 5.716 -1.389 1.00 . A A . 1 GLY C 1 1 3 718 1 1 1 GLY CA C -9.006 5.210 -2.770 1.00 . A A . 1 GLY CA 1 1 3 719 1 1 1 GLY H1 H -9.404 5.928 -4.685 1.00 . A A . 1 GLY H1 1 1 3 720 1 1 1 GLY H2 H -8.208 6.799 -3.861 1.00 . A A . 1 GLY H2 1 1 3 721 1 1 1 GLY H3 H -9.839 7.000 -3.444 1.00 . A A . 1 GLY H3 1 1 3 722 1 1 1 GLY HA2 H -9.944 4.672 -2.721 1.00 . A A . 1 GLY HA2 1 1 3 723 1 1 1 GLY HA3 H -8.228 4.531 -3.089 1.00 . A A . 1 GLY HA3 1 1 3 724 1 1 1 GLY N N -9.124 6.310 -3.759 1.00 . A A . 1 GLY N 1 1 3 725 1 1 1 GLY O O -9.221 6.730 -0.957 1.00 . A A . 1 GLY O 1 1 3 726 1 1 2 ILE C C -8.637 4.927 1.602 1.00 . A A . 2 ILE C 1 1 3 727 1 1 2 ILE CA C -7.458 5.317 0.696 1.00 . A A . 2 ILE CA 1 1 3 728 1 1 2 ILE CB C -7.067 6.815 0.892 1.00 . A A . 2 ILE CB 1 1 3 729 1 1 2 ILE CD1 C -5.303 6.871 -0.966 1.00 . A A . 2 ILE CD1 1 1 3 730 1 1 2 ILE CG1 C -5.599 7.061 0.506 1.00 . A A . 2 ILE CG1 1 1 3 731 1 1 2 ILE CG2 C -7.313 7.275 2.320 1.00 . A A . 2 ILE CG2 1 1 3 732 1 1 2 ILE H H -7.312 4.272 -1.138 1.00 . A A . 2 ILE H 1 1 3 733 1 1 2 ILE HA H -6.607 4.709 0.973 1.00 . A A . 2 ILE HA 1 1 3 734 1 1 2 ILE HB H -7.698 7.407 0.242 1.00 . A A . 2 ILE HB 1 1 3 735 1 1 2 ILE HD11 H -4.253 7.042 -1.149 1.00 . A A . 2 ILE HD11 1 1 3 736 1 1 2 ILE HD12 H -5.890 7.573 -1.541 1.00 . A A . 2 ILE HD12 1 1 3 737 1 1 2 ILE HD13 H -5.561 5.863 -1.259 1.00 . A A . 2 ILE HD13 1 1 3 738 1 1 2 ILE HG12 H -5.333 8.074 0.765 1.00 . A A . 2 ILE HG12 1 1 3 739 1 1 2 ILE HG13 H -4.970 6.378 1.061 1.00 . A A . 2 ILE HG13 1 1 3 740 1 1 2 ILE HG21 H -7.056 8.320 2.410 1.00 . A A . 2 ILE HG21 1 1 3 741 1 1 2 ILE HG22 H -6.702 6.695 2.995 1.00 . A A . 2 ILE HG22 1 1 3 742 1 1 2 ILE HG23 H -8.355 7.137 2.567 1.00 . A A . 2 ILE HG23 1 1 3 743 1 1 2 ILE N N -7.774 5.013 -0.697 1.00 . A A . 2 ILE N 1 1 3 744 1 1 2 ILE O O -9.797 4.958 1.186 1.00 . A A . 2 ILE O 1 1 3 745 1 1 3 GLY C C -9.749 2.650 3.549 1.00 . A A . 3 GLY C 1 1 3 746 1 1 3 GLY CA C -9.359 4.097 3.747 1.00 . A A . 3 GLY CA 1 1 3 747 1 1 3 GLY H H -7.389 4.477 3.092 1.00 . A A . 3 GLY H 1 1 3 748 1 1 3 GLY HA2 H -8.993 4.229 4.756 1.00 . A A . 3 GLY HA2 1 1 3 749 1 1 3 GLY HA3 H -10.230 4.720 3.605 1.00 . A A . 3 GLY HA3 1 1 3 750 1 1 3 GLY N N -8.328 4.505 2.819 1.00 . A A . 3 GLY N 1 1 3 751 1 1 3 GLY O O -9.250 1.765 4.247 1.00 . A A . 3 GLY O 1 1 3 752 1 1 4 LYS C C -10.413 0.439 1.104 1.00 . A A . 4 LYS C 1 1 3 753 1 1 4 LYS CA C -11.095 1.048 2.320 1.00 . A A . 4 LYS CA 1 1 3 754 1 1 4 LYS CB C -12.623 1.047 2.170 1.00 . A A . 4 LYS CB 1 1 3 755 1 1 4 LYS CD C -14.669 2.186 1.267 1.00 . A A . 4 LYS CD 1 1 3 756 1 1 4 LYS CE C -15.198 3.404 0.531 1.00 . A A . 4 LYS CE 1 1 3 757 1 1 4 LYS CG C -13.155 2.204 1.346 1.00 . A A . 4 LYS CG 1 1 3 758 1 1 4 LYS H H -10.903 3.140 1.984 1.00 . A A . 4 LYS H 1 1 3 759 1 1 4 LYS HA H -10.829 0.452 3.180 1.00 . A A . 4 LYS HA 1 1 3 760 1 1 4 LYS HB2 H -12.928 0.128 1.693 1.00 . A A . 4 LYS HB2 1 1 3 761 1 1 4 LYS HB3 H -13.068 1.098 3.153 1.00 . A A . 4 LYS HB3 1 1 3 762 1 1 4 LYS HD2 H -14.981 1.294 0.741 1.00 . A A . 4 LYS HD2 1 1 3 763 1 1 4 LYS HD3 H -15.075 2.175 2.269 1.00 . A A . 4 LYS HD3 1 1 3 764 1 1 4 LYS HE2 H -16.275 3.342 0.491 1.00 . A A . 4 LYS HE2 1 1 3 765 1 1 4 LYS HE3 H -14.911 4.292 1.073 1.00 . A A . 4 LYS HE3 1 1 3 766 1 1 4 LYS HG2 H -12.841 3.133 1.799 1.00 . A A . 4 LYS HG2 1 1 3 767 1 1 4 LYS HG3 H -12.752 2.134 0.347 1.00 . A A . 4 LYS HG3 1 1 3 768 1 1 4 LYS HZ1 H -15.030 4.347 -1.332 1.00 . A A . 4 LYS HZ1 1 1 3 769 1 1 4 LYS HZ2 H -14.956 2.650 -1.406 1.00 . A A . 4 LYS HZ2 1 1 3 770 1 1 4 LYS HZ3 H -13.626 3.530 -0.843 1.00 . A A . 4 LYS HZ3 1 1 3 771 1 1 4 LYS N N -10.604 2.398 2.567 1.00 . A A . 4 LYS N 1 1 3 772 1 1 4 LYS NZ N -14.666 3.490 -0.858 1.00 . A A . 4 LYS NZ 1 1 3 773 1 1 4 LYS O O -10.449 -0.771 0.895 1.00 . A A . 4 LYS O 1 1 3 774 1 1 5 PHE C C -7.595 0.327 -0.209 1.00 . A A . 5 PHE C 1 1 3 775 1 1 5 PHE CA C -8.926 0.813 -0.775 1.00 . A A . 5 PHE CA 1 1 3 776 1 1 5 PHE CB C -8.704 1.937 -1.794 1.00 . A A . 5 PHE CB 1 1 3 777 1 1 5 PHE CD1 C -8.400 0.691 -3.950 1.00 . A A . 5 PHE CD1 1 1 3 778 1 1 5 PHE CD2 C -6.594 2.020 -3.141 1.00 . A A . 5 PHE CD2 1 1 3 779 1 1 5 PHE CE1 C -7.647 0.330 -5.050 1.00 . A A . 5 PHE CE1 1 1 3 780 1 1 5 PHE CE2 C -5.834 1.663 -4.236 1.00 . A A . 5 PHE CE2 1 1 3 781 1 1 5 PHE CG C -7.882 1.539 -2.986 1.00 . A A . 5 PHE CG 1 1 3 782 1 1 5 PHE CZ C -6.362 0.816 -5.193 1.00 . A A . 5 PHE CZ 1 1 3 783 1 1 5 PHE H H -9.865 2.247 0.461 1.00 . A A . 5 PHE H 1 1 3 784 1 1 5 PHE HA H -9.427 -0.014 -1.256 1.00 . A A . 5 PHE HA 1 1 3 785 1 1 5 PHE HB2 H -9.663 2.276 -2.156 1.00 . A A . 5 PHE HB2 1 1 3 786 1 1 5 PHE HB3 H -8.202 2.760 -1.306 1.00 . A A . 5 PHE HB3 1 1 3 787 1 1 5 PHE HD1 H -9.404 0.312 -3.837 1.00 . A A . 5 PHE HD1 1 1 3 788 1 1 5 PHE HD2 H -6.183 2.680 -2.392 1.00 . A A . 5 PHE HD2 1 1 3 789 1 1 5 PHE HE1 H -8.061 -0.331 -5.797 1.00 . A A . 5 PHE HE1 1 1 3 790 1 1 5 PHE HE2 H -4.829 2.045 -4.345 1.00 . A A . 5 PHE HE2 1 1 3 791 1 1 5 PHE HZ H -5.769 0.536 -6.050 1.00 . A A . 5 PHE HZ 1 1 3 792 1 1 5 PHE N N -9.764 1.284 0.316 1.00 . A A . 5 PHE N 1 1 3 793 1 1 5 PHE O O -6.820 -0.354 -0.880 1.00 . A A . 5 PHE O 1 1 3 794 1 1 6 LEU C C -6.057 -1.142 2.114 1.00 . A A . 6 LEU C 1 1 3 795 1 1 6 LEU CA C -6.091 0.319 1.697 1.00 . A A . 6 LEU CA 1 1 3 796 1 1 6 LEU CB C -5.830 1.222 2.902 1.00 . A A . 6 LEU CB 1 1 3 797 1 1 6 LEU CD1 C -5.274 3.481 3.832 1.00 . A A . 6 LEU CD1 1 1 3 798 1 1 6 LEU CD2 C -4.504 2.861 1.536 1.00 . A A . 6 LEU CD2 1 1 3 799 1 1 6 LEU CG C -5.608 2.700 2.572 1.00 . A A . 6 LEU CG 1 1 3 800 1 1 6 LEU H H -8.061 1.092 1.583 1.00 . A A . 6 LEU H 1 1 3 801 1 1 6 LEU HA H -5.310 0.481 0.968 1.00 . A A . 6 LEU HA 1 1 3 802 1 1 6 LEU HB2 H -6.677 1.146 3.569 1.00 . A A . 6 LEU HB2 1 1 3 803 1 1 6 LEU HB3 H -4.955 0.855 3.418 1.00 . A A . 6 LEU HB3 1 1 3 804 1 1 6 LEU HD11 H -5.079 4.513 3.576 1.00 . A A . 6 LEU HD11 1 1 3 805 1 1 6 LEU HD12 H -4.400 3.055 4.300 1.00 . A A . 6 LEU HD12 1 1 3 806 1 1 6 LEU HD13 H -6.108 3.431 4.516 1.00 . A A . 6 LEU HD13 1 1 3 807 1 1 6 LEU HD21 H -3.580 2.461 1.927 1.00 . A A . 6 LEU HD21 1 1 3 808 1 1 6 LEU HD22 H -4.375 3.910 1.305 1.00 . A A . 6 LEU HD22 1 1 3 809 1 1 6 LEU HD23 H -4.775 2.328 0.637 1.00 . A A . 6 LEU HD23 1 1 3 810 1 1 6 LEU HG H -6.518 3.110 2.158 1.00 . A A . 6 LEU HG 1 1 3 811 1 1 6 LEU N N -7.357 0.648 1.060 1.00 . A A . 6 LEU N 1 1 3 812 1 1 6 LEU O O -5.014 -1.656 2.502 1.00 . A A . 6 LEU O 1 1 3 813 1 1 7 HIS C C -6.475 -3.974 1.193 1.00 . A A . 7 HIS C 1 1 3 814 1 1 7 HIS CA C -7.259 -3.236 2.272 1.00 . A A . 7 HIS CA 1 1 3 815 1 1 7 HIS CB C -8.711 -3.720 2.317 1.00 . A A . 7 HIS CB 1 1 3 816 1 1 7 HIS CD2 C -9.162 -6.212 1.759 1.00 . A A . 7 HIS CD2 1 1 3 817 1 1 7 HIS CE1 C -8.828 -7.054 3.753 1.00 . A A . 7 HIS CE1 1 1 3 818 1 1 7 HIS CG C -8.848 -5.188 2.586 1.00 . A A . 7 HIS CG 1 1 3 819 1 1 7 HIS H H -8.014 -1.332 1.759 1.00 . A A . 7 HIS H 1 1 3 820 1 1 7 HIS HA H -6.793 -3.422 3.229 1.00 . A A . 7 HIS HA 1 1 3 821 1 1 7 HIS HB2 H -9.233 -3.191 3.098 1.00 . A A . 7 HIS HB2 1 1 3 822 1 1 7 HIS HB3 H -9.184 -3.510 1.368 1.00 . A A . 7 HIS HB3 1 1 3 823 1 1 7 HIS HD1 H -8.388 -5.259 4.648 1.00 . A A . 7 HIS HD1 1 1 3 824 1 1 7 HIS HD2 H -9.393 -6.136 0.704 1.00 . A A . 7 HIS HD2 1 1 3 825 1 1 7 HIS HE1 H -8.748 -7.751 4.574 1.00 . A A . 7 HIS HE1 1 1 3 826 1 1 7 HIS HE2 H -9.319 -8.270 2.168 1.00 . A A . 7 HIS HE2 1 1 3 827 1 1 7 HIS N N -7.198 -1.809 2.014 1.00 . A A . 7 HIS N 1 1 3 828 1 1 7 HIS ND1 N -8.644 -5.749 3.827 1.00 . A A . 7 HIS ND1 1 1 3 829 1 1 7 HIS NE2 N -9.143 -7.358 2.509 1.00 . A A . 7 HIS NE2 1 1 3 830 1 1 7 HIS O O -5.705 -4.883 1.482 1.00 . A A . 7 HIS O 1 1 3 831 1 1 8 SER C C -4.570 -3.509 -1.317 1.00 . A A . 8 SER C 1 1 3 832 1 1 8 SER CA C -5.937 -4.152 -1.157 1.00 . A A . 8 SER CA 1 1 3 833 1 1 8 SER CB C -6.728 -4.011 -2.444 1.00 . A A . 8 SER CB 1 1 3 834 1 1 8 SER H H -7.303 -2.843 -0.232 1.00 . A A . 8 SER H 1 1 3 835 1 1 8 SER HA H -5.800 -5.197 -0.936 1.00 . A A . 8 SER HA 1 1 3 836 1 1 8 SER HB2 H -6.801 -2.968 -2.710 1.00 . A A . 8 SER HB2 1 1 3 837 1 1 8 SER HB3 H -6.213 -4.545 -3.222 1.00 . A A . 8 SER HB3 1 1 3 838 1 1 8 SER HG H -8.616 -4.131 -2.969 1.00 . A A . 8 SER HG 1 1 3 839 1 1 8 SER N N -6.659 -3.558 -0.051 1.00 . A A . 8 SER N 1 1 3 840 1 1 8 SER O O -3.628 -4.147 -1.779 1.00 . A A . 8 SER O 1 1 3 841 1 1 8 SER OG O -8.036 -4.539 -2.302 1.00 . A A . 8 SER OG 1 1 3 842 1 1 9 ALA C C -2.230 -2.230 0.092 1.00 . A A . 9 ALA C 1 1 3 843 1 1 9 ALA CA C -3.165 -1.582 -0.921 1.00 . A A . 9 ALA CA 1 1 3 844 1 1 9 ALA CB C -3.331 -0.102 -0.627 1.00 . A A . 9 ALA CB 1 1 3 845 1 1 9 ALA H H -5.251 -1.767 -0.615 1.00 . A A . 9 ALA H 1 1 3 846 1 1 9 ALA HA H -2.738 -1.688 -1.910 1.00 . A A . 9 ALA HA 1 1 3 847 1 1 9 ALA HB1 H -2.367 0.383 -0.658 1.00 . A A . 9 ALA HB1 1 1 3 848 1 1 9 ALA HB2 H -3.767 0.021 0.353 1.00 . A A . 9 ALA HB2 1 1 3 849 1 1 9 ALA HB3 H -3.982 0.340 -1.368 1.00 . A A . 9 ALA HB3 1 1 3 850 1 1 9 ALA N N -4.455 -2.254 -0.913 1.00 . A A . 9 ALA N 1 1 3 851 1 1 9 ALA O O -1.029 -1.971 0.106 1.00 . A A . 9 ALA O 1 1 3 852 1 1 10 LYS C C -2.136 -5.329 1.594 1.00 . A A . 10 LYS C 1 1 3 853 1 1 10 LYS CA C -2.019 -3.835 1.901 1.00 . A A . 10 LYS CA 1 1 3 854 1 1 10 LYS CB C -2.500 -3.524 3.324 1.00 . A A . 10 LYS CB 1 1 3 855 1 1 10 LYS CD C -2.065 -3.620 5.796 1.00 . A A . 10 LYS CD 1 1 3 856 1 1 10 LYS CE C -1.092 -4.028 6.889 1.00 . A A . 10 LYS CE 1 1 3 857 1 1 10 LYS CG C -1.515 -3.926 4.411 1.00 . A A . 10 LYS CG 1 1 3 858 1 1 10 LYS H H -3.770 -3.215 0.900 1.00 . A A . 10 LYS H 1 1 3 859 1 1 10 LYS HA H -0.985 -3.535 1.798 1.00 . A A . 10 LYS HA 1 1 3 860 1 1 10 LYS HB2 H -2.679 -2.462 3.408 1.00 . A A . 10 LYS HB2 1 1 3 861 1 1 10 LYS HB3 H -3.427 -4.051 3.499 1.00 . A A . 10 LYS HB3 1 1 3 862 1 1 10 LYS HD2 H -2.250 -2.561 5.871 1.00 . A A . 10 LYS HD2 1 1 3 863 1 1 10 LYS HD3 H -2.990 -4.159 5.931 1.00 . A A . 10 LYS HD3 1 1 3 864 1 1 10 LYS HE2 H -1.583 -3.923 7.846 1.00 . A A . 10 LYS HE2 1 1 3 865 1 1 10 LYS HE3 H -0.816 -5.062 6.739 1.00 . A A . 10 LYS HE3 1 1 3 866 1 1 10 LYS HG2 H -1.322 -4.986 4.335 1.00 . A A . 10 LYS HG2 1 1 3 867 1 1 10 LYS HG3 H -0.594 -3.379 4.266 1.00 . A A . 10 LYS HG3 1 1 3 868 1 1 10 LYS HZ1 H 0.806 -3.534 7.610 1.00 . A A . 10 LYS HZ1 1 1 3 869 1 1 10 LYS HZ2 H -0.099 -2.197 7.094 1.00 . A A . 10 LYS HZ2 1 1 3 870 1 1 10 LYS HZ3 H 0.605 -3.234 5.957 1.00 . A A . 10 LYS HZ3 1 1 3 871 1 1 10 LYS N N -2.797 -3.085 0.935 1.00 . A A . 10 LYS N 1 1 3 872 1 1 10 LYS NZ N 0.139 -3.193 6.885 1.00 . A A . 10 LYS NZ 1 1 3 873 1 1 10 LYS O O -1.694 -6.184 2.365 1.00 . A A . 10 LYS O 1 1 3 874 1 1 11 LYS C C -1.565 -7.439 -0.680 1.00 . A A . 11 LYS C 1 1 3 875 1 1 11 LYS CA C -2.862 -7.008 -0.014 1.00 . A A . 11 LYS CA 1 1 3 876 1 1 11 LYS CB C -4.028 -7.134 -0.999 1.00 . A A . 11 LYS CB 1 1 3 877 1 1 11 LYS CD C -5.256 -8.538 -2.669 1.00 . A A . 11 LYS CD 1 1 3 878 1 1 11 LYS CE C -5.453 -9.931 -3.244 1.00 . A A . 11 LYS CE 1 1 3 879 1 1 11 LYS CG C -4.194 -8.524 -1.584 1.00 . A A . 11 LYS CG 1 1 3 880 1 1 11 LYS H H -3.113 -4.911 -0.109 1.00 . A A . 11 LYS H 1 1 3 881 1 1 11 LYS HA H -3.048 -7.639 0.842 1.00 . A A . 11 LYS HA 1 1 3 882 1 1 11 LYS HB2 H -4.946 -6.873 -0.489 1.00 . A A . 11 LYS HB2 1 1 3 883 1 1 11 LYS HB3 H -3.872 -6.440 -1.812 1.00 . A A . 11 LYS HB3 1 1 3 884 1 1 11 LYS HD2 H -6.188 -8.201 -2.245 1.00 . A A . 11 LYS HD2 1 1 3 885 1 1 11 LYS HD3 H -4.954 -7.869 -3.462 1.00 . A A . 11 LYS HD3 1 1 3 886 1 1 11 LYS HE2 H -6.182 -9.881 -4.039 1.00 . A A . 11 LYS HE2 1 1 3 887 1 1 11 LYS HE3 H -4.511 -10.279 -3.643 1.00 . A A . 11 LYS HE3 1 1 3 888 1 1 11 LYS HG2 H -3.253 -8.843 -2.009 1.00 . A A . 11 LYS HG2 1 1 3 889 1 1 11 LYS HG3 H -4.487 -9.205 -0.798 1.00 . A A . 11 LYS HG3 1 1 3 890 1 1 11 LYS HZ1 H -6.187 -11.800 -2.664 1.00 . A A . 11 LYS HZ1 1 1 3 891 1 1 11 LYS HZ2 H -6.762 -10.507 -1.724 1.00 . A A . 11 LYS HZ2 1 1 3 892 1 1 11 LYS HZ3 H -5.176 -11.068 -1.513 1.00 . A A . 11 LYS HZ3 1 1 3 893 1 1 11 LYS N N -2.740 -5.635 0.448 1.00 . A A . 11 LYS N 1 1 3 894 1 1 11 LYS NZ N -5.927 -10.892 -2.214 1.00 . A A . 11 LYS NZ 1 1 3 895 1 1 11 LYS O O -0.867 -8.329 -0.195 1.00 . A A . 11 LYS O 1 1 3 896 1 1 12 PHE C C 0.937 -5.891 -2.439 1.00 . A A . 12 PHE C 1 1 3 897 1 1 12 PHE CA C 0.000 -7.090 -2.497 1.00 . A A . 12 PHE CA 1 1 3 898 1 1 12 PHE CB C -0.315 -7.471 -3.949 1.00 . A A . 12 PHE CB 1 1 3 899 1 1 12 PHE CD1 C 1.367 -9.233 -4.528 1.00 . A A . 12 PHE CD1 1 1 3 900 1 1 12 PHE CD2 C 1.488 -7.139 -5.664 1.00 . A A . 12 PHE CD2 1 1 3 901 1 1 12 PHE CE1 C 2.453 -9.690 -5.245 1.00 . A A . 12 PHE CE1 1 1 3 902 1 1 12 PHE CE2 C 2.576 -7.590 -6.383 1.00 . A A . 12 PHE CE2 1 1 3 903 1 1 12 PHE CG C 0.873 -7.954 -4.728 1.00 . A A . 12 PHE CG 1 1 3 904 1 1 12 PHE CZ C 3.058 -8.868 -6.174 1.00 . A A . 12 PHE CZ 1 1 3 905 1 1 12 PHE H H -1.827 -6.082 -2.127 1.00 . A A . 12 PHE H 1 1 3 906 1 1 12 PHE HA H 0.473 -7.927 -2.006 1.00 . A A . 12 PHE HA 1 1 3 907 1 1 12 PHE HB2 H -1.051 -8.262 -3.952 1.00 . A A . 12 PHE HB2 1 1 3 908 1 1 12 PHE HB3 H -0.721 -6.611 -4.461 1.00 . A A . 12 PHE HB3 1 1 3 909 1 1 12 PHE HD1 H 0.894 -9.878 -3.801 1.00 . A A . 12 PHE HD1 1 1 3 910 1 1 12 PHE HD2 H 1.111 -6.140 -5.828 1.00 . A A . 12 PHE HD2 1 1 3 911 1 1 12 PHE HE1 H 2.829 -10.689 -5.080 1.00 . A A . 12 PHE HE1 1 1 3 912 1 1 12 PHE HE2 H 3.050 -6.948 -7.108 1.00 . A A . 12 PHE HE2 1 1 3 913 1 1 12 PHE HZ H 3.908 -9.224 -6.736 1.00 . A A . 12 PHE HZ 1 1 3 914 1 1 12 PHE N N -1.231 -6.787 -1.782 1.00 . A A . 12 PHE N 1 1 3 915 1 1 12 PHE O O 2.160 -6.039 -2.376 1.00 . A A . 12 PHE O 1 1 3 916 1 1 13 GLY C C 1.653 -3.150 -1.003 1.00 . A A . 13 GLY C 1 1 3 917 1 1 13 GLY CA C 1.116 -3.478 -2.382 1.00 . A A . 13 GLY CA 1 1 3 918 1 1 13 GLY H H -0.636 -4.657 -2.433 1.00 . A A . 13 GLY H 1 1 3 919 1 1 13 GLY HA2 H 1.947 -3.573 -3.062 1.00 . A A . 13 GLY HA2 1 1 3 920 1 1 13 GLY HA3 H 0.486 -2.667 -2.713 1.00 . A A . 13 GLY HA3 1 1 3 921 1 1 13 GLY N N 0.346 -4.704 -2.413 1.00 . A A . 13 GLY N 1 1 3 922 1 1 13 GLY O O 2.229 -2.084 -0.799 1.00 . A A . 13 GLY O 1 1 3 923 1 1 14 LYS C C 3.503 -3.786 1.298 1.00 . A A . 14 LYS C 1 1 3 924 1 1 14 LYS CA C 1.981 -3.873 1.300 1.00 . A A . 14 LYS CA 1 1 3 925 1 1 14 LYS CB C 1.518 -5.000 2.233 1.00 . A A . 14 LYS CB 1 1 3 926 1 1 14 LYS CD C 1.614 -7.428 2.880 1.00 . A A . 14 LYS CD 1 1 3 927 1 1 14 LYS CE C 2.069 -8.828 2.489 1.00 . A A . 14 LYS CE 1 1 3 928 1 1 14 LYS CG C 1.994 -6.392 1.833 1.00 . A A . 14 LYS CG 1 1 3 929 1 1 14 LYS H H 0.988 -4.886 -0.275 1.00 . A A . 14 LYS H 1 1 3 930 1 1 14 LYS HA H 1.585 -2.935 1.662 1.00 . A A . 14 LYS HA 1 1 3 931 1 1 14 LYS HB2 H 1.884 -4.796 3.227 1.00 . A A . 14 LYS HB2 1 1 3 932 1 1 14 LYS HB3 H 0.438 -5.007 2.254 1.00 . A A . 14 LYS HB3 1 1 3 933 1 1 14 LYS HD2 H 2.080 -7.162 3.817 1.00 . A A . 14 LYS HD2 1 1 3 934 1 1 14 LYS HD3 H 0.541 -7.429 2.999 1.00 . A A . 14 LYS HD3 1 1 3 935 1 1 14 LYS HE2 H 3.129 -8.801 2.285 1.00 . A A . 14 LYS HE2 1 1 3 936 1 1 14 LYS HE3 H 1.882 -9.497 3.317 1.00 . A A . 14 LYS HE3 1 1 3 937 1 1 14 LYS HG2 H 1.544 -6.662 0.891 1.00 . A A . 14 LYS HG2 1 1 3 938 1 1 14 LYS HG3 H 3.069 -6.376 1.730 1.00 . A A . 14 LYS HG3 1 1 3 939 1 1 14 LYS HZ1 H 0.327 -9.324 1.439 1.00 . A A . 14 LYS HZ1 1 1 3 940 1 1 14 LYS HZ2 H 1.657 -10.317 1.083 1.00 . A A . 14 LYS HZ2 1 1 3 941 1 1 14 LYS HZ3 H 1.586 -8.747 0.457 1.00 . A A . 14 LYS HZ3 1 1 3 942 1 1 14 LYS N N 1.477 -4.068 -0.057 1.00 . A A . 14 LYS N 1 1 3 943 1 1 14 LYS NZ N 1.360 -9.337 1.284 1.00 . A A . 14 LYS NZ 1 1 3 944 1 1 14 LYS O O 4.105 -3.151 2.162 1.00 . A A . 14 LYS O 1 1 3 945 1 1 15 ALA C C 5.929 -3.117 -0.660 1.00 . A A . 15 ALA C 1 1 3 946 1 1 15 ALA CA C 5.562 -4.351 0.150 1.00 . A A . 15 ALA CA 1 1 3 947 1 1 15 ALA CB C 6.083 -5.604 -0.531 1.00 . A A . 15 ALA CB 1 1 3 948 1 1 15 ALA H H 3.592 -4.961 -0.312 1.00 . A A . 15 ALA H 1 1 3 949 1 1 15 ALA HA H 6.014 -4.282 1.130 1.00 . A A . 15 ALA HA 1 1 3 950 1 1 15 ALA HB1 H 7.158 -5.544 -0.620 1.00 . A A . 15 ALA HB1 1 1 3 951 1 1 15 ALA HB2 H 5.644 -5.690 -1.512 1.00 . A A . 15 ALA HB2 1 1 3 952 1 1 15 ALA HB3 H 5.819 -6.472 0.058 1.00 . A A . 15 ALA HB3 1 1 3 953 1 1 15 ALA N N 4.121 -4.424 0.315 1.00 . A A . 15 ALA N 1 1 3 954 1 1 15 ALA O O 7.010 -2.549 -0.501 1.00 . A A . 15 ALA O 1 1 3 955 1 1 16 PHE C C 5.130 -0.241 -1.639 1.00 . A A . 16 PHE C 1 1 3 956 1 1 16 PHE CA C 5.225 -1.562 -2.392 1.00 . A A . 16 PHE CA 1 1 3 957 1 1 16 PHE CB C 4.224 -1.583 -3.552 1.00 . A A . 16 PHE CB 1 1 3 958 1 1 16 PHE CD1 C 5.382 -0.286 -5.364 1.00 . A A . 16 PHE CD1 1 1 3 959 1 1 16 PHE CD2 C 3.397 0.629 -4.410 1.00 . A A . 16 PHE CD2 1 1 3 960 1 1 16 PHE CE1 C 5.491 0.813 -6.192 1.00 . A A . 16 PHE CE1 1 1 3 961 1 1 16 PHE CE2 C 3.504 1.731 -5.235 1.00 . A A . 16 PHE CE2 1 1 3 962 1 1 16 PHE CG C 4.334 -0.393 -4.464 1.00 . A A . 16 PHE CG 1 1 3 963 1 1 16 PHE CZ C 4.551 1.823 -6.128 1.00 . A A . 16 PHE CZ 1 1 3 964 1 1 16 PHE H H 4.136 -3.151 -1.533 1.00 . A A . 16 PHE H 1 1 3 965 1 1 16 PHE HA H 6.224 -1.657 -2.794 1.00 . A A . 16 PHE HA 1 1 3 966 1 1 16 PHE HB2 H 4.387 -2.472 -4.145 1.00 . A A . 16 PHE HB2 1 1 3 967 1 1 16 PHE HB3 H 3.223 -1.604 -3.150 1.00 . A A . 16 PHE HB3 1 1 3 968 1 1 16 PHE HD1 H 6.119 -1.076 -5.418 1.00 . A A . 16 PHE HD1 1 1 3 969 1 1 16 PHE HD2 H 2.575 0.559 -3.713 1.00 . A A . 16 PHE HD2 1 1 3 970 1 1 16 PHE HE1 H 6.311 0.884 -6.893 1.00 . A A . 16 PHE HE1 1 1 3 971 1 1 16 PHE HE2 H 2.767 2.518 -5.184 1.00 . A A . 16 PHE HE2 1 1 3 972 1 1 16 PHE HZ H 4.637 2.685 -6.774 1.00 . A A . 16 PHE HZ 1 1 3 973 1 1 16 PHE N N 5.001 -2.693 -1.506 1.00 . A A . 16 PHE N 1 1 3 974 1 1 16 PHE O O 5.815 0.719 -1.979 1.00 . A A . 16 PHE O 1 1 3 975 1 1 17 VAL C C 5.414 1.350 0.915 1.00 . A A . 17 VAL C 1 1 3 976 1 1 17 VAL CA C 4.138 1.043 0.150 1.00 . A A . 17 VAL CA 1 1 3 977 1 1 17 VAL CB C 2.921 0.999 1.112 1.00 . A A . 17 VAL CB 1 1 3 978 1 1 17 VAL CG1 C 3.087 -0.078 2.174 1.00 . A A . 17 VAL CG1 1 1 3 979 1 1 17 VAL CG2 C 2.689 2.362 1.750 1.00 . A A . 17 VAL CG2 1 1 3 980 1 1 17 VAL H H 3.797 -0.993 -0.343 1.00 . A A . 17 VAL H 1 1 3 981 1 1 17 VAL HA H 3.978 1.837 -0.563 1.00 . A A . 17 VAL HA 1 1 3 982 1 1 17 VAL HB H 2.047 0.753 0.529 1.00 . A A . 17 VAL HB 1 1 3 983 1 1 17 VAL HG11 H 3.174 -1.045 1.699 1.00 . A A . 17 VAL HG11 1 1 3 984 1 1 17 VAL HG12 H 2.226 -0.074 2.827 1.00 . A A . 17 VAL HG12 1 1 3 985 1 1 17 VAL HG13 H 3.979 0.119 2.751 1.00 . A A . 17 VAL HG13 1 1 3 986 1 1 17 VAL HG21 H 2.499 3.092 0.979 1.00 . A A . 17 VAL HG21 1 1 3 987 1 1 17 VAL HG22 H 3.565 2.652 2.313 1.00 . A A . 17 VAL HG22 1 1 3 988 1 1 17 VAL HG23 H 1.839 2.307 2.413 1.00 . A A . 17 VAL HG23 1 1 3 989 1 1 17 VAL N N 4.300 -0.190 -0.605 1.00 . A A . 17 VAL N 1 1 3 990 1 1 17 VAL O O 5.816 2.504 1.051 1.00 . A A . 17 VAL O 1 1 3 991 1 1 18 GLY C C 8.466 0.634 0.999 1.00 . A A . 18 GLY C 1 1 3 992 1 1 18 GLY CA C 7.355 0.442 2.009 1.00 . A A . 18 GLY CA 1 1 3 993 1 1 18 GLY H H 5.682 -0.596 1.263 1.00 . A A . 18 GLY H 1 1 3 994 1 1 18 GLY HA2 H 7.322 1.295 2.670 1.00 . A A . 18 GLY HA2 1 1 3 995 1 1 18 GLY HA3 H 7.552 -0.446 2.585 1.00 . A A . 18 GLY HA3 1 1 3 996 1 1 18 GLY N N 6.075 0.296 1.363 1.00 . A A . 18 GLY N 1 1 3 997 1 1 18 GLY O O 9.588 0.999 1.350 1.00 . A A . 18 GLY O 1 1 3 998 1 1 19 GLU C C 9.126 1.860 -1.970 1.00 . A A . 19 GLU C 1 1 3 999 1 1 19 GLU CA C 9.103 0.468 -1.348 1.00 . A A . 19 GLU CA 1 1 3 1000 1 1 19 GLU CB C 8.752 -0.590 -2.398 1.00 . A A . 19 GLU CB 1 1 3 1001 1 1 19 GLU CD C 9.366 -1.795 -4.520 1.00 . A A . 19 GLU CD 1 1 3 1002 1 1 19 GLU CG C 9.725 -0.679 -3.559 1.00 . A A . 19 GLU CG 1 1 3 1003 1 1 19 GLU H H 7.189 0.227 -0.479 1.00 . A A . 19 GLU H 1 1 3 1004 1 1 19 GLU HA H 10.078 0.248 -0.937 1.00 . A A . 19 GLU HA 1 1 3 1005 1 1 19 GLU HB2 H 8.719 -1.556 -1.917 1.00 . A A . 19 GLU HB2 1 1 3 1006 1 1 19 GLU HB3 H 7.775 -0.366 -2.796 1.00 . A A . 19 GLU HB3 1 1 3 1007 1 1 19 GLU HG2 H 9.714 0.257 -4.096 1.00 . A A . 19 GLU HG2 1 1 3 1008 1 1 19 GLU HG3 H 10.718 -0.861 -3.172 1.00 . A A . 19 GLU HG3 1 1 3 1009 1 1 19 GLU N N 8.132 0.416 -0.265 1.00 . A A . 19 GLU N 1 1 3 1010 1 1 19 GLU O O 10.188 2.431 -2.218 1.00 . A A . 19 GLU O 1 1 3 1011 1 1 19 GLU OE1 O 9.769 -2.952 -4.267 1.00 . A A . 19 GLU OE1 1 1 3 1012 1 1 19 GLU OE2 O 8.682 -1.528 -5.532 1.00 . A A . 19 GLU OE2 1 1 3 1013 1 1 20 ILE C C 8.249 4.823 -1.790 1.00 . A A . 20 ILE C 1 1 3 1014 1 1 20 ILE CA C 7.820 3.738 -2.781 1.00 . A A . 20 ILE CA 1 1 3 1015 1 1 20 ILE CB C 6.371 4.008 -3.270 1.00 . A A . 20 ILE CB 1 1 3 1016 1 1 20 ILE CD1 C 4.942 5.620 -4.630 1.00 . A A . 20 ILE CD1 1 1 3 1017 1 1 20 ILE CG1 C 6.293 5.349 -4.008 1.00 . A A . 20 ILE CG1 1 1 3 1018 1 1 20 ILE CG2 C 5.389 3.979 -2.102 1.00 . A A . 20 ILE CG2 1 1 3 1019 1 1 20 ILE H H 7.128 1.915 -1.959 1.00 . A A . 20 ILE H 1 1 3 1020 1 1 20 ILE HA H 8.475 3.775 -3.641 1.00 . A A . 20 ILE HA 1 1 3 1021 1 1 20 ILE HB H 6.095 3.218 -3.952 1.00 . A A . 20 ILE HB 1 1 3 1022 1 1 20 ILE HD11 H 4.741 4.879 -5.390 1.00 . A A . 20 ILE HD11 1 1 3 1023 1 1 20 ILE HD12 H 4.941 6.604 -5.076 1.00 . A A . 20 ILE HD12 1 1 3 1024 1 1 20 ILE HD13 H 4.181 5.568 -3.868 1.00 . A A . 20 ILE HD13 1 1 3 1025 1 1 20 ILE HG12 H 6.501 6.147 -3.312 1.00 . A A . 20 ILE HG12 1 1 3 1026 1 1 20 ILE HG13 H 7.031 5.364 -4.797 1.00 . A A . 20 ILE HG13 1 1 3 1027 1 1 20 ILE HG21 H 4.386 4.135 -2.469 1.00 . A A . 20 ILE HG21 1 1 3 1028 1 1 20 ILE HG22 H 5.642 4.762 -1.400 1.00 . A A . 20 ILE HG22 1 1 3 1029 1 1 20 ILE HG23 H 5.448 3.021 -1.607 1.00 . A A . 20 ILE HG23 1 1 3 1030 1 1 20 ILE N N 7.943 2.415 -2.189 1.00 . A A . 20 ILE N 1 1 3 1031 1 1 20 ILE O O 8.750 5.871 -2.190 1.00 . A A . 20 ILE O 1 1 3 1032 1 1 21 MET C C 9.871 5.679 0.823 1.00 . A A . 21 MET C 1 1 3 1033 1 1 21 MET CA C 8.376 5.571 0.520 1.00 . A A . 21 MET CA 1 1 3 1034 1 1 21 MET CB C 7.587 5.307 1.809 1.00 . A A . 21 MET CB 1 1 3 1035 1 1 21 MET CE C 8.013 2.521 4.897 1.00 . A A . 21 MET CE 1 1 3 1036 1 1 21 MET CG C 8.072 4.115 2.620 1.00 . A A . 21 MET CG 1 1 3 1037 1 1 21 MET H H 7.773 3.673 -0.215 1.00 . A A . 21 MET H 1 1 3 1038 1 1 21 MET HA H 8.052 6.520 0.114 1.00 . A A . 21 MET HA 1 1 3 1039 1 1 21 MET HB2 H 7.645 6.184 2.436 1.00 . A A . 21 MET HB2 1 1 3 1040 1 1 21 MET HB3 H 6.552 5.136 1.549 1.00 . A A . 21 MET HB3 1 1 3 1041 1 1 21 MET HE1 H 7.933 1.671 4.234 1.00 . A A . 21 MET HE1 1 1 3 1042 1 1 21 MET HE2 H 7.561 2.279 5.847 1.00 . A A . 21 MET HE2 1 1 3 1043 1 1 21 MET HE3 H 9.056 2.764 5.047 1.00 . A A . 21 MET HE3 1 1 3 1044 1 1 21 MET HG2 H 7.942 3.216 2.033 1.00 . A A . 21 MET HG2 1 1 3 1045 1 1 21 MET HG3 H 9.120 4.249 2.841 1.00 . A A . 21 MET HG3 1 1 3 1046 1 1 21 MET N N 8.093 4.556 -0.493 1.00 . A A . 21 MET N 1 1 3 1047 1 1 21 MET O O 10.300 6.609 1.506 1.00 . A A . 21 MET O 1 1 3 1048 1 1 21 MET SD S 7.167 3.926 4.174 1.00 . A A . 21 MET SD 1 1 3 1049 1 1 22 ASN C C 12.769 5.332 -0.800 1.00 . A A . 22 ASN C 1 1 3 1050 1 1 22 ASN CA C 12.122 4.839 0.488 1.00 . A A . 22 ASN CA 1 1 3 1051 1 1 22 ASN CB C 12.754 3.511 0.942 1.00 . A A . 22 ASN CB 1 1 3 1052 1 1 22 ASN CG C 12.803 2.435 -0.130 1.00 . A A . 22 ASN CG 1 1 3 1053 1 1 22 ASN H H 10.286 3.987 -0.177 1.00 . A A . 22 ASN H 1 1 3 1054 1 1 22 ASN HA H 12.299 5.581 1.252 1.00 . A A . 22 ASN HA 1 1 3 1055 1 1 22 ASN HB2 H 13.765 3.700 1.268 1.00 . A A . 22 ASN HB2 1 1 3 1056 1 1 22 ASN HB3 H 12.186 3.127 1.778 1.00 . A A . 22 ASN HB3 1 1 3 1057 1 1 22 ASN HD21 H 11.205 1.540 0.648 1.00 . A A . 22 ASN HD21 1 1 3 1058 1 1 22 ASN HD22 H 11.893 0.790 -0.758 1.00 . A A . 22 ASN HD22 1 1 3 1059 1 1 22 ASN N N 10.671 4.743 0.317 1.00 . A A . 22 ASN N 1 1 3 1060 1 1 22 ASN ND2 N 11.875 1.499 -0.076 1.00 . A A . 22 ASN ND2 1 1 3 1061 1 1 22 ASN O O 13.989 5.290 -0.961 1.00 . A A . 22 ASN O 1 1 3 1062 1 1 22 ASN OD1 O 13.706 2.413 -0.969 1.00 . A A . 22 ASN OD1 1 1 3 1063 1 1 23 SER C C 12.450 7.901 -2.847 1.00 . A A . 23 SER C 1 1 3 1064 1 1 23 SER CA C 12.413 6.381 -2.959 1.00 . A A . 23 SER CA 1 1 3 1065 1 1 23 SER CB C 11.514 5.950 -4.118 1.00 . A A . 23 SER CB 1 1 3 1066 1 1 23 SER H H 10.973 5.804 -1.532 1.00 . A A . 23 SER H 1 1 3 1067 1 1 23 SER HA H 13.416 6.018 -3.130 1.00 . A A . 23 SER HA 1 1 3 1068 1 1 23 SER HB2 H 10.521 6.347 -3.971 1.00 . A A . 23 SER HB2 1 1 3 1069 1 1 23 SER HB3 H 11.919 6.326 -5.047 1.00 . A A . 23 SER HB3 1 1 3 1070 1 1 23 SER HG H 11.258 4.177 -3.319 1.00 . A A . 23 SER HG 1 1 3 1071 1 1 23 SER N N 11.936 5.812 -1.713 1.00 . A A . 23 SER N 1 1 3 1072 1 1 23 SER O O 11.409 8.541 -3.087 1.00 . A A . 23 SER O 1 1 3 1073 1 1 23 SER OXT O 13.511 8.447 -2.475 1.00 . A A . 23 SER OXT 1 1 3 1074 1 1 23 SER OG O 11.431 4.536 -4.196 1.00 . A A . 23 SER OG 1 1 4 1075 1 1 1 GLY C C -14.260 2.494 -0.302 1.00 . A A . 1 GLY C 1 1 4 1076 1 1 1 GLY CA C -14.845 2.093 -1.639 1.00 . A A . 1 GLY CA 1 1 4 1077 1 1 1 GLY H1 H -16.262 2.756 -3.018 1.00 . A A . 1 GLY H1 1 1 4 1078 1 1 1 GLY H2 H -15.421 4.007 -2.234 1.00 . A A . 1 GLY H2 1 1 4 1079 1 1 1 GLY H3 H -16.627 3.147 -1.411 1.00 . A A . 1 GLY H3 1 1 4 1080 1 1 1 GLY HA2 H -15.309 1.124 -1.543 1.00 . A A . 1 GLY HA2 1 1 4 1081 1 1 1 GLY HA3 H -14.051 2.031 -2.369 1.00 . A A . 1 GLY HA3 1 1 4 1082 1 1 1 GLY N N -15.858 3.066 -2.110 1.00 . A A . 1 GLY N 1 1 4 1083 1 1 1 GLY O O -13.399 3.372 -0.232 1.00 . A A . 1 GLY O 1 1 4 1084 1 1 2 ILE C C -13.919 0.889 2.886 1.00 . A A . 2 ILE C 1 1 4 1085 1 1 2 ILE CA C -14.259 2.161 2.112 1.00 . A A . 2 ILE CA 1 1 4 1086 1 1 2 ILE CB C -15.296 2.974 2.921 1.00 . A A . 2 ILE CB 1 1 4 1087 1 1 2 ILE CD1 C -17.688 2.933 3.787 1.00 . A A . 2 ILE CD1 1 1 4 1088 1 1 2 ILE CG1 C -16.668 2.301 2.869 1.00 . A A . 2 ILE CG1 1 1 4 1089 1 1 2 ILE CG2 C -15.373 4.402 2.411 1.00 . A A . 2 ILE CG2 1 1 4 1090 1 1 2 ILE H H -15.410 1.154 0.642 1.00 . A A . 2 ILE H 1 1 4 1091 1 1 2 ILE HA H -13.364 2.760 2.021 1.00 . A A . 2 ILE HA 1 1 4 1092 1 1 2 ILE HB H -14.963 3.009 3.948 1.00 . A A . 2 ILE HB 1 1 4 1093 1 1 2 ILE HD11 H -17.343 2.864 4.808 1.00 . A A . 2 ILE HD11 1 1 4 1094 1 1 2 ILE HD12 H -18.631 2.415 3.689 1.00 . A A . 2 ILE HD12 1 1 4 1095 1 1 2 ILE HD13 H -17.818 3.971 3.521 1.00 . A A . 2 ILE HD13 1 1 4 1096 1 1 2 ILE HG12 H -17.051 2.357 1.860 1.00 . A A . 2 ILE HG12 1 1 4 1097 1 1 2 ILE HG13 H -16.562 1.263 3.151 1.00 . A A . 2 ILE HG13 1 1 4 1098 1 1 2 ILE HG21 H -15.582 4.395 1.350 1.00 . A A . 2 ILE HG21 1 1 4 1099 1 1 2 ILE HG22 H -14.431 4.898 2.590 1.00 . A A . 2 ILE HG22 1 1 4 1100 1 1 2 ILE HG23 H -16.161 4.927 2.930 1.00 . A A . 2 ILE HG23 1 1 4 1101 1 1 2 ILE N N -14.728 1.856 0.765 1.00 . A A . 2 ILE N 1 1 4 1102 1 1 2 ILE O O -12.917 0.835 3.595 1.00 . A A . 2 ILE O 1 1 4 1103 1 1 3 GLY C C -13.610 -2.331 2.826 1.00 . A A . 3 GLY C 1 1 4 1104 1 1 3 GLY CA C -14.562 -1.363 3.493 1.00 . A A . 3 GLY CA 1 1 4 1105 1 1 3 GLY H H -15.483 -0.077 2.084 1.00 . A A . 3 GLY H 1 1 4 1106 1 1 3 GLY HA2 H -14.174 -1.111 4.467 1.00 . A A . 3 GLY HA2 1 1 4 1107 1 1 3 GLY HA3 H -15.523 -1.844 3.613 1.00 . A A . 3 GLY HA3 1 1 4 1108 1 1 3 GLY N N -14.743 -0.143 2.729 1.00 . A A . 3 GLY N 1 1 4 1109 1 1 3 GLY O O -13.426 -3.456 3.289 1.00 . A A . 3 GLY O 1 1 4 1110 1 1 4 LYS C C -10.969 -1.835 0.397 1.00 . A A . 4 LYS C 1 1 4 1111 1 1 4 LYS CA C -12.045 -2.714 1.011 1.00 . A A . 4 LYS CA 1 1 4 1112 1 1 4 LYS CB C -12.738 -3.555 -0.067 1.00 . A A . 4 LYS CB 1 1 4 1113 1 1 4 LYS CD C -14.390 -3.590 -1.970 1.00 . A A . 4 LYS CD 1 1 4 1114 1 1 4 LYS CE C -15.236 -2.739 -2.902 1.00 . A A . 4 LYS CE 1 1 4 1115 1 1 4 LYS CG C -13.536 -2.724 -1.059 1.00 . A A . 4 LYS CG 1 1 4 1116 1 1 4 LYS H H -13.272 -1.029 1.361 1.00 . A A . 4 LYS H 1 1 4 1117 1 1 4 LYS HA H -11.577 -3.367 1.728 1.00 . A A . 4 LYS HA 1 1 4 1118 1 1 4 LYS HB2 H -11.987 -4.110 -0.613 1.00 . A A . 4 LYS HB2 1 1 4 1119 1 1 4 LYS HB3 H -13.411 -4.251 0.412 1.00 . A A . 4 LYS HB3 1 1 4 1120 1 1 4 LYS HD2 H -13.745 -4.223 -2.561 1.00 . A A . 4 LYS HD2 1 1 4 1121 1 1 4 LYS HD3 H -15.042 -4.202 -1.363 1.00 . A A . 4 LYS HD3 1 1 4 1122 1 1 4 LYS HE2 H -15.865 -2.095 -2.306 1.00 . A A . 4 LYS HE2 1 1 4 1123 1 1 4 LYS HE3 H -14.579 -2.135 -3.512 1.00 . A A . 4 LYS HE3 1 1 4 1124 1 1 4 LYS HG2 H -14.179 -2.050 -0.513 1.00 . A A . 4 LYS HG2 1 1 4 1125 1 1 4 LYS HG3 H -12.849 -2.148 -1.666 1.00 . A A . 4 LYS HG3 1 1 4 1126 1 1 4 LYS HZ1 H -16.647 -2.953 -4.425 1.00 . A A . 4 LYS HZ1 1 1 4 1127 1 1 4 LYS HZ2 H -16.756 -4.136 -3.217 1.00 . A A . 4 LYS HZ2 1 1 4 1128 1 1 4 LYS HZ3 H -15.506 -4.208 -4.362 1.00 . A A . 4 LYS HZ3 1 1 4 1129 1 1 4 LYS N N -13.023 -1.903 1.720 1.00 . A A . 4 LYS N 1 1 4 1130 1 1 4 LYS NZ N -16.095 -3.565 -3.788 1.00 . A A . 4 LYS NZ 1 1 4 1131 1 1 4 LYS O O -10.007 -2.327 -0.188 1.00 . A A . 4 LYS O 1 1 4 1132 1 1 5 PHE C C -8.886 0.347 0.923 1.00 . A A . 5 PHE C 1 1 4 1133 1 1 5 PHE CA C -10.149 0.423 0.073 1.00 . A A . 5 PHE CA 1 1 4 1134 1 1 5 PHE CB C -10.736 1.838 0.115 1.00 . A A . 5 PHE CB 1 1 4 1135 1 1 5 PHE CD1 C -9.690 3.000 -1.847 1.00 . A A . 5 PHE CD1 1 1 4 1136 1 1 5 PHE CD2 C -9.165 3.785 0.343 1.00 . A A . 5 PHE CD2 1 1 4 1137 1 1 5 PHE CE1 C -8.875 3.972 -2.396 1.00 . A A . 5 PHE CE1 1 1 4 1138 1 1 5 PHE CE2 C -8.348 4.759 -0.198 1.00 . A A . 5 PHE CE2 1 1 4 1139 1 1 5 PHE CG C -9.844 2.896 -0.475 1.00 . A A . 5 PHE CG 1 1 4 1140 1 1 5 PHE CZ C -8.203 4.853 -1.570 1.00 . A A . 5 PHE CZ 1 1 4 1141 1 1 5 PHE H H -11.903 -0.206 1.058 1.00 . A A . 5 PHE H 1 1 4 1142 1 1 5 PHE HA H -9.909 0.162 -0.948 1.00 . A A . 5 PHE HA 1 1 4 1143 1 1 5 PHE HB2 H -11.665 1.848 -0.436 1.00 . A A . 5 PHE HB2 1 1 4 1144 1 1 5 PHE HB3 H -10.934 2.105 1.143 1.00 . A A . 5 PHE HB3 1 1 4 1145 1 1 5 PHE HD1 H -10.212 2.309 -2.493 1.00 . A A . 5 PHE HD1 1 1 4 1146 1 1 5 PHE HD2 H -9.279 3.712 1.415 1.00 . A A . 5 PHE HD2 1 1 4 1147 1 1 5 PHE HE1 H -8.765 4.044 -3.467 1.00 . A A . 5 PHE HE1 1 1 4 1148 1 1 5 PHE HE2 H -7.822 5.445 0.450 1.00 . A A . 5 PHE HE2 1 1 4 1149 1 1 5 PHE HZ H -7.566 5.615 -1.995 1.00 . A A . 5 PHE HZ 1 1 4 1150 1 1 5 PHE N N -11.122 -0.533 0.571 1.00 . A A . 5 PHE N 1 1 4 1151 1 1 5 PHE O O -7.803 0.726 0.488 1.00 . A A . 5 PHE O 1 1 4 1152 1 1 6 LEU C C -7.393 -1.676 3.153 1.00 . A A . 6 LEU C 1 1 4 1153 1 1 6 LEU CA C -7.920 -0.256 3.069 1.00 . A A . 6 LEU CA 1 1 4 1154 1 1 6 LEU CB C -8.339 0.236 4.463 1.00 . A A . 6 LEU CB 1 1 4 1155 1 1 6 LEU CD1 C -7.470 2.551 3.972 1.00 . A A . 6 LEU CD1 1 1 4 1156 1 1 6 LEU CD2 C -9.939 2.127 3.981 1.00 . A A . 6 LEU CD2 1 1 4 1157 1 1 6 LEU CG C -8.600 1.745 4.597 1.00 . A A . 6 LEU CG 1 1 4 1158 1 1 6 LEU H H -9.904 -0.573 2.381 1.00 . A A . 6 LEU H 1 1 4 1159 1 1 6 LEU HA H -7.128 0.380 2.694 1.00 . A A . 6 LEU HA 1 1 4 1160 1 1 6 LEU HB2 H -9.243 -0.286 4.741 1.00 . A A . 6 LEU HB2 1 1 4 1161 1 1 6 LEU HB3 H -7.561 -0.032 5.164 1.00 . A A . 6 LEU HB3 1 1 4 1162 1 1 6 LEU HD11 H -7.408 2.324 2.918 1.00 . A A . 6 LEU HD11 1 1 4 1163 1 1 6 LEU HD12 H -6.538 2.293 4.450 1.00 . A A . 6 LEU HD12 1 1 4 1164 1 1 6 LEU HD13 H -7.662 3.606 4.103 1.00 . A A . 6 LEU HD13 1 1 4 1165 1 1 6 LEU HD21 H -9.923 1.913 2.923 1.00 . A A . 6 LEU HD21 1 1 4 1166 1 1 6 LEU HD22 H -10.118 3.182 4.133 1.00 . A A . 6 LEU HD22 1 1 4 1167 1 1 6 LEU HD23 H -10.727 1.557 4.452 1.00 . A A . 6 LEU HD23 1 1 4 1168 1 1 6 LEU HG H -8.637 1.999 5.648 1.00 . A A . 6 LEU HG 1 1 4 1169 1 1 6 LEU N N -9.031 -0.187 2.127 1.00 . A A . 6 LEU N 1 1 4 1170 1 1 6 LEU O O -6.561 -1.998 3.995 1.00 . A A . 6 LEU O 1 1 4 1171 1 1 7 HIS C C -6.226 -3.997 1.277 1.00 . A A . 7 HIS C 1 1 4 1172 1 1 7 HIS CA C -7.426 -3.897 2.210 1.00 . A A . 7 HIS CA 1 1 4 1173 1 1 7 HIS CB C -8.559 -4.815 1.738 1.00 . A A . 7 HIS CB 1 1 4 1174 1 1 7 HIS CD2 C -7.667 -7.086 0.847 1.00 . A A . 7 HIS CD2 1 1 4 1175 1 1 7 HIS CE1 C -8.094 -8.316 2.609 1.00 . A A . 7 HIS CE1 1 1 4 1176 1 1 7 HIS CG C -8.226 -6.278 1.779 1.00 . A A . 7 HIS CG 1 1 4 1177 1 1 7 HIS H H -8.577 -2.220 1.646 1.00 . A A . 7 HIS H 1 1 4 1178 1 1 7 HIS HA H -7.124 -4.191 3.204 1.00 . A A . 7 HIS HA 1 1 4 1179 1 1 7 HIS HB2 H -9.422 -4.657 2.365 1.00 . A A . 7 HIS HB2 1 1 4 1180 1 1 7 HIS HB3 H -8.812 -4.562 0.718 1.00 . A A . 7 HIS HB3 1 1 4 1181 1 1 7 HIS HD1 H -8.889 -6.786 3.717 1.00 . A A . 7 HIS HD1 1 1 4 1182 1 1 7 HIS HD2 H -7.344 -6.792 -0.143 1.00 . A A . 7 HIS HD2 1 1 4 1183 1 1 7 HIS HE1 H -8.181 -9.161 3.277 1.00 . A A . 7 HIS HE1 1 1 4 1184 1 1 7 HIS HE2 H -7.375 -9.165 0.886 1.00 . A A . 7 HIS HE2 1 1 4 1185 1 1 7 HIS N N -7.885 -2.525 2.270 1.00 . A A . 7 HIS N 1 1 4 1186 1 1 7 HIS ND1 N -8.480 -7.080 2.871 1.00 . A A . 7 HIS ND1 1 1 4 1187 1 1 7 HIS NE2 N -7.597 -8.345 1.387 1.00 . A A . 7 HIS NE2 1 1 4 1188 1 1 7 HIS O O -5.145 -4.429 1.675 1.00 . A A . 7 HIS O 1 1 4 1189 1 1 8 SER C C -4.407 -2.493 -0.912 1.00 . A A . 8 SER C 1 1 4 1190 1 1 8 SER CA C -5.370 -3.668 -0.959 1.00 . A A . 8 SER CA 1 1 4 1191 1 1 8 SER CB C -5.991 -3.785 -2.341 1.00 . A A . 8 SER CB 1 1 4 1192 1 1 8 SER H H -7.271 -3.162 -0.205 1.00 . A A . 8 SER H 1 1 4 1193 1 1 8 SER HA H -4.811 -4.562 -0.746 1.00 . A A . 8 SER HA 1 1 4 1194 1 1 8 SER HB2 H -5.237 -3.560 -3.078 1.00 . A A . 8 SER HB2 1 1 4 1195 1 1 8 SER HB3 H -6.360 -4.789 -2.492 1.00 . A A . 8 SER HB3 1 1 4 1196 1 1 8 SER HG H -7.137 -2.590 -3.409 1.00 . A A . 8 SER HG 1 1 4 1197 1 1 8 SER N N -6.410 -3.560 0.044 1.00 . A A . 8 SER N 1 1 4 1198 1 1 8 SER O O -3.226 -2.649 -1.217 1.00 . A A . 8 SER O 1 1 4 1199 1 1 8 SER OG O -7.067 -2.868 -2.480 1.00 . A A . 8 SER OG 1 1 4 1200 1 1 9 ALA C C -2.940 -0.453 0.668 1.00 . A A . 9 ALA C 1 1 4 1201 1 1 9 ALA CA C -4.017 -0.165 -0.365 1.00 . A A . 9 ALA CA 1 1 4 1202 1 1 9 ALA CB C -4.810 1.073 0.021 1.00 . A A . 9 ALA CB 1 1 4 1203 1 1 9 ALA H H -5.853 -1.232 -0.338 1.00 . A A . 9 ALA H 1 1 4 1204 1 1 9 ALA HA H -3.542 0.020 -1.317 1.00 . A A . 9 ALA HA 1 1 4 1205 1 1 9 ALA HB1 H -5.257 0.927 0.994 1.00 . A A . 9 ALA HB1 1 1 4 1206 1 1 9 ALA HB2 H -5.586 1.245 -0.710 1.00 . A A . 9 ALA HB2 1 1 4 1207 1 1 9 ALA HB3 H -4.150 1.928 0.055 1.00 . A A . 9 ALA HB3 1 1 4 1208 1 1 9 ALA N N -4.893 -1.324 -0.516 1.00 . A A . 9 ALA N 1 1 4 1209 1 1 9 ALA O O -1.878 0.167 0.673 1.00 . A A . 9 ALA O 1 1 4 1210 1 1 10 LYS C C -1.520 -3.080 2.180 1.00 . A A . 10 LYS C 1 1 4 1211 1 1 10 LYS CA C -2.262 -1.800 2.551 1.00 . A A . 10 LYS CA 1 1 4 1212 1 1 10 LYS CB C -2.978 -1.954 3.890 1.00 . A A . 10 LYS CB 1 1 4 1213 1 1 10 LYS CD C -4.259 -0.805 5.730 1.00 . A A . 10 LYS CD 1 1 4 1214 1 1 10 LYS CE C -5.069 0.425 6.112 1.00 . A A . 10 LYS CE 1 1 4 1215 1 1 10 LYS CG C -3.704 -0.687 4.321 1.00 . A A . 10 LYS CG 1 1 4 1216 1 1 10 LYS H H -4.048 -1.941 1.425 1.00 . A A . 10 LYS H 1 1 4 1217 1 1 10 LYS HA H -1.541 -0.998 2.632 1.00 . A A . 10 LYS HA 1 1 4 1218 1 1 10 LYS HB2 H -3.700 -2.754 3.809 1.00 . A A . 10 LYS HB2 1 1 4 1219 1 1 10 LYS HB3 H -2.253 -2.207 4.649 1.00 . A A . 10 LYS HB3 1 1 4 1220 1 1 10 LYS HD2 H -4.898 -1.674 5.783 1.00 . A A . 10 LYS HD2 1 1 4 1221 1 1 10 LYS HD3 H -3.436 -0.916 6.423 1.00 . A A . 10 LYS HD3 1 1 4 1222 1 1 10 LYS HE2 H -5.927 0.490 5.461 1.00 . A A . 10 LYS HE2 1 1 4 1223 1 1 10 LYS HE3 H -5.404 0.316 7.134 1.00 . A A . 10 LYS HE3 1 1 4 1224 1 1 10 LYS HG2 H -3.013 0.141 4.290 1.00 . A A . 10 LYS HG2 1 1 4 1225 1 1 10 LYS HG3 H -4.521 -0.503 3.638 1.00 . A A . 10 LYS HG3 1 1 4 1226 1 1 10 LYS HZ1 H -3.981 1.831 5.006 1.00 . A A . 10 LYS HZ1 1 1 4 1227 1 1 10 LYS HZ2 H -3.427 1.625 6.593 1.00 . A A . 10 LYS HZ2 1 1 4 1228 1 1 10 LYS HZ3 H -4.849 2.500 6.300 1.00 . A A . 10 LYS HZ3 1 1 4 1229 1 1 10 LYS N N -3.203 -1.436 1.514 1.00 . A A . 10 LYS N 1 1 4 1230 1 1 10 LYS NZ N -4.278 1.680 5.995 1.00 . A A . 10 LYS NZ 1 1 4 1231 1 1 10 LYS O O -0.565 -3.464 2.850 1.00 . A A . 10 LYS O 1 1 4 1232 1 1 11 LYS C C -0.337 -4.646 -0.520 1.00 . A A . 11 LYS C 1 1 4 1233 1 1 11 LYS CA C -1.271 -4.942 0.647 1.00 . A A . 11 LYS CA 1 1 4 1234 1 1 11 LYS CB C -2.293 -6.010 0.245 1.00 . A A . 11 LYS CB 1 1 4 1235 1 1 11 LYS CD C -2.696 -8.306 -0.721 1.00 . A A . 11 LYS CD 1 1 4 1236 1 1 11 LYS CE C -3.199 -8.991 0.540 1.00 . A A . 11 LYS CE 1 1 4 1237 1 1 11 LYS CG C -1.665 -7.233 -0.408 1.00 . A A . 11 LYS CG 1 1 4 1238 1 1 11 LYS H H -2.707 -3.382 0.580 1.00 . A A . 11 LYS H 1 1 4 1239 1 1 11 LYS HA H -0.683 -5.314 1.470 1.00 . A A . 11 LYS HA 1 1 4 1240 1 1 11 LYS HB2 H -2.825 -6.333 1.128 1.00 . A A . 11 LYS HB2 1 1 4 1241 1 1 11 LYS HB3 H -2.996 -5.577 -0.451 1.00 . A A . 11 LYS HB3 1 1 4 1242 1 1 11 LYS HD2 H -3.536 -7.851 -1.226 1.00 . A A . 11 LYS HD2 1 1 4 1243 1 1 11 LYS HD3 H -2.244 -9.045 -1.364 1.00 . A A . 11 LYS HD3 1 1 4 1244 1 1 11 LYS HE2 H -3.679 -8.256 1.167 1.00 . A A . 11 LYS HE2 1 1 4 1245 1 1 11 LYS HE3 H -3.917 -9.749 0.261 1.00 . A A . 11 LYS HE3 1 1 4 1246 1 1 11 LYS HG2 H -1.188 -6.931 -1.328 1.00 . A A . 11 LYS HG2 1 1 4 1247 1 1 11 LYS HG3 H -0.925 -7.646 0.263 1.00 . A A . 11 LYS HG3 1 1 4 1248 1 1 11 LYS HZ1 H -1.523 -8.901 1.789 1.00 . A A . 11 LYS HZ1 1 1 4 1249 1 1 11 LYS HZ2 H -1.468 -10.158 0.659 1.00 . A A . 11 LYS HZ2 1 1 4 1250 1 1 11 LYS HZ3 H -2.478 -10.286 2.017 1.00 . A A . 11 LYS HZ3 1 1 4 1251 1 1 11 LYS N N -1.937 -3.727 1.094 1.00 . A A . 11 LYS N 1 1 4 1252 1 1 11 LYS NZ N -2.092 -9.626 1.304 1.00 . A A . 11 LYS NZ 1 1 4 1253 1 1 11 LYS O O 0.758 -5.196 -0.605 1.00 . A A . 11 LYS O 1 1 4 1254 1 1 12 PHE C C 0.268 -1.971 -2.678 1.00 . A A . 12 PHE C 1 1 4 1255 1 1 12 PHE CA C -0.019 -3.461 -2.609 1.00 . A A . 12 PHE CA 1 1 4 1256 1 1 12 PHE CB C -0.806 -3.924 -3.843 1.00 . A A . 12 PHE CB 1 1 4 1257 1 1 12 PHE CD1 C 0.863 -5.314 -5.102 1.00 . A A . 12 PHE CD1 1 1 4 1258 1 1 12 PHE CD2 C 0.089 -3.297 -6.115 1.00 . A A . 12 PHE CD2 1 1 4 1259 1 1 12 PHE CE1 C 1.672 -5.557 -6.195 1.00 . A A . 12 PHE CE1 1 1 4 1260 1 1 12 PHE CE2 C 0.897 -3.538 -7.212 1.00 . A A . 12 PHE CE2 1 1 4 1261 1 1 12 PHE CG C 0.063 -4.182 -5.046 1.00 . A A . 12 PHE CG 1 1 4 1262 1 1 12 PHE CZ C 1.690 -4.668 -7.250 1.00 . A A . 12 PHE CZ 1 1 4 1263 1 1 12 PHE H H -1.575 -3.230 -1.195 1.00 . A A . 12 PHE H 1 1 4 1264 1 1 12 PHE HA H 0.919 -3.997 -2.562 1.00 . A A . 12 PHE HA 1 1 4 1265 1 1 12 PHE HB2 H -1.328 -4.838 -3.605 1.00 . A A . 12 PHE HB2 1 1 4 1266 1 1 12 PHE HB3 H -1.526 -3.161 -4.107 1.00 . A A . 12 PHE HB3 1 1 4 1267 1 1 12 PHE HD1 H 0.852 -6.011 -4.277 1.00 . A A . 12 PHE HD1 1 1 4 1268 1 1 12 PHE HD2 H -0.532 -2.415 -6.090 1.00 . A A . 12 PHE HD2 1 1 4 1269 1 1 12 PHE HE1 H 2.289 -6.443 -6.224 1.00 . A A . 12 PHE HE1 1 1 4 1270 1 1 12 PHE HE2 H 0.912 -2.841 -8.037 1.00 . A A . 12 PHE HE2 1 1 4 1271 1 1 12 PHE HZ H 2.323 -4.856 -8.104 1.00 . A A . 12 PHE HZ 1 1 4 1272 1 1 12 PHE N N -0.759 -3.744 -1.390 1.00 . A A . 12 PHE N 1 1 4 1273 1 1 12 PHE O O 0.472 -1.394 -3.744 1.00 . A A . 12 PHE O 1 1 4 1274 1 1 13 GLY C C 1.504 0.210 -0.172 1.00 . A A . 13 GLY C 1 1 4 1275 1 1 13 GLY CA C 0.629 0.029 -1.381 1.00 . A A . 13 GLY CA 1 1 4 1276 1 1 13 GLY H H -0.036 -1.855 -0.721 1.00 . A A . 13 GLY H 1 1 4 1277 1 1 13 GLY HA2 H 1.165 0.341 -2.266 1.00 . A A . 13 GLY HA2 1 1 4 1278 1 1 13 GLY HA3 H -0.255 0.635 -1.267 1.00 . A A . 13 GLY HA3 1 1 4 1279 1 1 13 GLY N N 0.247 -1.357 -1.513 1.00 . A A . 13 GLY N 1 1 4 1280 1 1 13 GLY O O 2.621 0.708 -0.269 1.00 . A A . 13 GLY O 1 1 4 1281 1 1 14 LYS C C 2.983 -1.073 2.157 1.00 . A A . 14 LYS C 1 1 4 1282 1 1 14 LYS CA C 1.751 -0.175 2.220 1.00 . A A . 14 LYS CA 1 1 4 1283 1 1 14 LYS CB C 0.848 -0.569 3.400 1.00 . A A . 14 LYS CB 1 1 4 1284 1 1 14 LYS CD C 2.091 0.858 5.071 1.00 . A A . 14 LYS CD 1 1 4 1285 1 1 14 LYS CE C 2.542 0.978 6.522 1.00 . A A . 14 LYS CE 1 1 4 1286 1 1 14 LYS CG C 1.522 -0.522 4.766 1.00 . A A . 14 LYS CG 1 1 4 1287 1 1 14 LYS H H 0.101 -0.645 0.965 1.00 . A A . 14 LYS H 1 1 4 1288 1 1 14 LYS HA H 2.075 0.848 2.350 1.00 . A A . 14 LYS HA 1 1 4 1289 1 1 14 LYS HB2 H 0.002 0.101 3.426 1.00 . A A . 14 LYS HB2 1 1 4 1290 1 1 14 LYS HB3 H 0.489 -1.576 3.238 1.00 . A A . 14 LYS HB3 1 1 4 1291 1 1 14 LYS HD2 H 2.939 1.038 4.426 1.00 . A A . 14 LYS HD2 1 1 4 1292 1 1 14 LYS HD3 H 1.330 1.597 4.880 1.00 . A A . 14 LYS HD3 1 1 4 1293 1 1 14 LYS HE2 H 3.100 1.896 6.640 1.00 . A A . 14 LYS HE2 1 1 4 1294 1 1 14 LYS HE3 H 1.667 1.008 7.154 1.00 . A A . 14 LYS HE3 1 1 4 1295 1 1 14 LYS HG2 H 0.793 -0.769 5.523 1.00 . A A . 14 LYS HG2 1 1 4 1296 1 1 14 LYS HG3 H 2.324 -1.248 4.788 1.00 . A A . 14 LYS HG3 1 1 4 1297 1 1 14 LYS HZ1 H 3.922 0.082 7.807 1.00 . A A . 14 LYS HZ1 1 1 4 1298 1 1 14 LYS HZ2 H 4.084 -0.397 6.186 1.00 . A A . 14 LYS HZ2 1 1 4 1299 1 1 14 LYS HZ3 H 2.808 -0.998 7.131 1.00 . A A . 14 LYS HZ3 1 1 4 1300 1 1 14 LYS N N 1.006 -0.252 0.967 1.00 . A A . 14 LYS N 1 1 4 1301 1 1 14 LYS NZ N 3.398 -0.160 6.939 1.00 . A A . 14 LYS NZ 1 1 4 1302 1 1 14 LYS O O 4.071 -0.685 2.578 1.00 . A A . 14 LYS O 1 1 4 1303 1 1 15 ALA C C 4.694 -2.976 0.192 1.00 . A A . 15 ALA C 1 1 4 1304 1 1 15 ALA CA C 3.907 -3.211 1.478 1.00 . A A . 15 ALA CA 1 1 4 1305 1 1 15 ALA CB C 3.378 -4.636 1.519 1.00 . A A . 15 ALA CB 1 1 4 1306 1 1 15 ALA H H 1.924 -2.511 1.263 1.00 . A A . 15 ALA H 1 1 4 1307 1 1 15 ALA HA H 4.565 -3.070 2.324 1.00 . A A . 15 ALA HA 1 1 4 1308 1 1 15 ALA HB1 H 2.740 -4.805 0.665 1.00 . A A . 15 ALA HB1 1 1 4 1309 1 1 15 ALA HB2 H 2.810 -4.786 2.426 1.00 . A A . 15 ALA HB2 1 1 4 1310 1 1 15 ALA HB3 H 4.205 -5.331 1.494 1.00 . A A . 15 ALA HB3 1 1 4 1311 1 1 15 ALA N N 2.809 -2.263 1.598 1.00 . A A . 15 ALA N 1 1 4 1312 1 1 15 ALA O O 5.876 -3.298 0.111 1.00 . A A . 15 ALA O 1 1 4 1313 1 1 16 PHE C C 5.534 -0.950 -2.121 1.00 . A A . 16 PHE C 1 1 4 1314 1 1 16 PHE CA C 4.657 -2.201 -2.116 1.00 . A A . 16 PHE CA 1 1 4 1315 1 1 16 PHE CB C 3.588 -2.102 -3.209 1.00 . A A . 16 PHE CB 1 1 4 1316 1 1 16 PHE CD1 C 4.722 -3.054 -5.232 1.00 . A A . 16 PHE CD1 1 1 4 1317 1 1 16 PHE CD2 C 4.073 -0.760 -5.271 1.00 . A A . 16 PHE CD2 1 1 4 1318 1 1 16 PHE CE1 C 5.224 -2.937 -6.514 1.00 . A A . 16 PHE CE1 1 1 4 1319 1 1 16 PHE CE2 C 4.575 -0.636 -6.551 1.00 . A A . 16 PHE CE2 1 1 4 1320 1 1 16 PHE CG C 4.142 -1.969 -4.598 1.00 . A A . 16 PHE CG 1 1 4 1321 1 1 16 PHE CZ C 5.152 -1.727 -7.173 1.00 . A A . 16 PHE CZ 1 1 4 1322 1 1 16 PHE H H 3.117 -2.090 -0.667 1.00 . A A . 16 PHE H 1 1 4 1323 1 1 16 PHE HA H 5.281 -3.059 -2.316 1.00 . A A . 16 PHE HA 1 1 4 1324 1 1 16 PHE HB2 H 2.976 -2.990 -3.186 1.00 . A A . 16 PHE HB2 1 1 4 1325 1 1 16 PHE HB3 H 2.967 -1.239 -3.016 1.00 . A A . 16 PHE HB3 1 1 4 1326 1 1 16 PHE HD1 H 4.780 -4.001 -4.715 1.00 . A A . 16 PHE HD1 1 1 4 1327 1 1 16 PHE HD2 H 3.621 0.091 -4.784 1.00 . A A . 16 PHE HD2 1 1 4 1328 1 1 16 PHE HE1 H 5.672 -3.791 -6.997 1.00 . A A . 16 PHE HE1 1 1 4 1329 1 1 16 PHE HE2 H 4.520 0.311 -7.064 1.00 . A A . 16 PHE HE2 1 1 4 1330 1 1 16 PHE HZ H 5.543 -1.633 -8.175 1.00 . A A . 16 PHE HZ 1 1 4 1331 1 1 16 PHE N N 4.035 -2.397 -0.812 1.00 . A A . 16 PHE N 1 1 4 1332 1 1 16 PHE O O 6.738 -1.024 -2.375 1.00 . A A . 16 PHE O 1 1 4 1333 1 1 17 VAL C C 6.661 1.494 -0.691 1.00 . A A . 17 VAL C 1 1 4 1334 1 1 17 VAL CA C 5.648 1.462 -1.826 1.00 . A A . 17 VAL CA 1 1 4 1335 1 1 17 VAL CB C 4.679 2.662 -1.705 1.00 . A A . 17 VAL CB 1 1 4 1336 1 1 17 VAL CG1 C 5.429 3.988 -1.730 1.00 . A A . 17 VAL CG1 1 1 4 1337 1 1 17 VAL CG2 C 3.646 2.619 -2.820 1.00 . A A . 17 VAL CG2 1 1 4 1338 1 1 17 VAL H H 3.986 0.183 -1.550 1.00 . A A . 17 VAL H 1 1 4 1339 1 1 17 VAL HA H 6.175 1.538 -2.768 1.00 . A A . 17 VAL HA 1 1 4 1340 1 1 17 VAL HB H 4.161 2.586 -0.762 1.00 . A A . 17 VAL HB 1 1 4 1341 1 1 17 VAL HG11 H 5.943 4.094 -2.674 1.00 . A A . 17 VAL HG11 1 1 4 1342 1 1 17 VAL HG12 H 6.149 4.010 -0.924 1.00 . A A . 17 VAL HG12 1 1 4 1343 1 1 17 VAL HG13 H 4.728 4.801 -1.611 1.00 . A A . 17 VAL HG13 1 1 4 1344 1 1 17 VAL HG21 H 2.963 3.449 -2.712 1.00 . A A . 17 VAL HG21 1 1 4 1345 1 1 17 VAL HG22 H 3.097 1.691 -2.765 1.00 . A A . 17 VAL HG22 1 1 4 1346 1 1 17 VAL HG23 H 4.145 2.685 -3.776 1.00 . A A . 17 VAL HG23 1 1 4 1347 1 1 17 VAL N N 4.931 0.193 -1.813 1.00 . A A . 17 VAL N 1 1 4 1348 1 1 17 VAL O O 7.707 2.137 -0.790 1.00 . A A . 17 VAL O 1 1 4 1349 1 1 18 GLY C C 8.590 0.073 1.224 1.00 . A A . 18 GLY C 1 1 4 1350 1 1 18 GLY CA C 7.227 0.675 1.521 1.00 . A A . 18 GLY CA 1 1 4 1351 1 1 18 GLY H H 5.531 0.221 0.349 1.00 . A A . 18 GLY H 1 1 4 1352 1 1 18 GLY HA2 H 7.366 1.674 1.907 1.00 . A A . 18 GLY HA2 1 1 4 1353 1 1 18 GLY HA3 H 6.741 0.077 2.277 1.00 . A A . 18 GLY HA3 1 1 4 1354 1 1 18 GLY N N 6.360 0.741 0.360 1.00 . A A . 18 GLY N 1 1 4 1355 1 1 18 GLY O O 9.478 0.106 2.069 1.00 . A A . 18 GLY O 1 1 4 1356 1 1 19 GLU C C 10.690 -0.170 -1.448 1.00 . A A . 19 GLU C 1 1 4 1357 1 1 19 GLU CA C 10.040 -1.038 -0.378 1.00 . A A . 19 GLU CA 1 1 4 1358 1 1 19 GLU CB C 9.883 -2.464 -0.917 1.00 . A A . 19 GLU CB 1 1 4 1359 1 1 19 GLU CD C 9.319 -4.877 -0.429 1.00 . A A . 19 GLU CD 1 1 4 1360 1 1 19 GLU CG C 9.416 -3.468 0.122 1.00 . A A . 19 GLU CG 1 1 4 1361 1 1 19 GLU H H 7.996 -0.526 -0.589 1.00 . A A . 19 GLU H 1 1 4 1362 1 1 19 GLU HA H 10.682 -1.059 0.491 1.00 . A A . 19 GLU HA 1 1 4 1363 1 1 19 GLU HB2 H 9.163 -2.453 -1.721 1.00 . A A . 19 GLU HB2 1 1 4 1364 1 1 19 GLU HB3 H 10.835 -2.797 -1.304 1.00 . A A . 19 GLU HB3 1 1 4 1365 1 1 19 GLU HG2 H 10.116 -3.468 0.944 1.00 . A A . 19 GLU HG2 1 1 4 1366 1 1 19 GLU HG3 H 8.442 -3.168 0.481 1.00 . A A . 19 GLU HG3 1 1 4 1367 1 1 19 GLU N N 8.755 -0.486 0.030 1.00 . A A . 19 GLU N 1 1 4 1368 1 1 19 GLU O O 11.853 0.213 -1.331 1.00 . A A . 19 GLU O 1 1 4 1369 1 1 19 GLU OE1 O 8.243 -5.249 -0.936 1.00 . A A . 19 GLU OE1 1 1 4 1370 1 1 19 GLU OE2 O 10.318 -5.625 -0.341 1.00 . A A . 19 GLU OE2 1 1 4 1371 1 1 20 ILE C C 11.022 2.202 -3.374 1.00 . A A . 20 ILE C 1 1 4 1372 1 1 20 ILE CA C 10.454 0.813 -3.667 1.00 . A A . 20 ILE CA 1 1 4 1373 1 1 20 ILE CB C 9.387 0.924 -4.777 1.00 . A A . 20 ILE CB 1 1 4 1374 1 1 20 ILE CD1 C 7.126 1.969 -5.359 1.00 . A A . 20 ILE CD1 1 1 4 1375 1 1 20 ILE CG1 C 8.189 1.750 -4.298 1.00 . A A . 20 ILE CG1 1 1 4 1376 1 1 20 ILE CG2 C 8.942 -0.464 -5.209 1.00 . A A . 20 ILE CG2 1 1 4 1377 1 1 20 ILE H H 8.962 -0.054 -2.442 1.00 . A A . 20 ILE H 1 1 4 1378 1 1 20 ILE HA H 11.253 0.189 -4.042 1.00 . A A . 20 ILE HA 1 1 4 1379 1 1 20 ILE HB H 9.839 1.413 -5.629 1.00 . A A . 20 ILE HB 1 1 4 1380 1 1 20 ILE HD11 H 6.324 2.563 -4.946 1.00 . A A . 20 ILE HD11 1 1 4 1381 1 1 20 ILE HD12 H 6.736 1.015 -5.682 1.00 . A A . 20 ILE HD12 1 1 4 1382 1 1 20 ILE HD13 H 7.558 2.485 -6.205 1.00 . A A . 20 ILE HD13 1 1 4 1383 1 1 20 ILE HG12 H 7.722 1.241 -3.467 1.00 . A A . 20 ILE HG12 1 1 4 1384 1 1 20 ILE HG13 H 8.536 2.718 -3.970 1.00 . A A . 20 ILE HG13 1 1 4 1385 1 1 20 ILE HG21 H 8.208 -0.375 -5.996 1.00 . A A . 20 ILE HG21 1 1 4 1386 1 1 20 ILE HG22 H 8.506 -0.981 -4.367 1.00 . A A . 20 ILE HG22 1 1 4 1387 1 1 20 ILE HG23 H 9.793 -1.019 -5.572 1.00 . A A . 20 ILE HG23 1 1 4 1388 1 1 20 ILE N N 9.918 0.157 -2.477 1.00 . A A . 20 ILE N 1 1 4 1389 1 1 20 ILE O O 11.956 2.642 -4.043 1.00 . A A . 20 ILE O 1 1 4 1390 1 1 21 MET C C 12.190 4.261 -1.230 1.00 . A A . 21 MET C 1 1 4 1391 1 1 21 MET CA C 10.922 4.251 -2.081 1.00 . A A . 21 MET CA 1 1 4 1392 1 1 21 MET CB C 9.818 5.056 -1.386 1.00 . A A . 21 MET CB 1 1 4 1393 1 1 21 MET CE C 7.914 4.642 2.295 1.00 . A A . 21 MET CE 1 1 4 1394 1 1 21 MET CG C 9.461 4.557 0.003 1.00 . A A . 21 MET CG 1 1 4 1395 1 1 21 MET H H 9.781 2.477 -1.823 1.00 . A A . 21 MET H 1 1 4 1396 1 1 21 MET HA H 11.146 4.723 -3.027 1.00 . A A . 21 MET HA 1 1 4 1397 1 1 21 MET HB2 H 10.140 6.082 -1.302 1.00 . A A . 21 MET HB2 1 1 4 1398 1 1 21 MET HB3 H 8.926 5.019 -1.996 1.00 . A A . 21 MET HB3 1 1 4 1399 1 1 21 MET HE1 H 7.145 5.125 2.878 1.00 . A A . 21 MET HE1 1 1 4 1400 1 1 21 MET HE2 H 8.832 4.612 2.863 1.00 . A A . 21 MET HE2 1 1 4 1401 1 1 21 MET HE3 H 7.606 3.635 2.056 1.00 . A A . 21 MET HE3 1 1 4 1402 1 1 21 MET HG2 H 9.112 3.539 -0.074 1.00 . A A . 21 MET HG2 1 1 4 1403 1 1 21 MET HG3 H 10.346 4.588 0.622 1.00 . A A . 21 MET HG3 1 1 4 1404 1 1 21 MET N N 10.484 2.889 -2.371 1.00 . A A . 21 MET N 1 1 4 1405 1 1 21 MET O O 12.794 5.310 -1.024 1.00 . A A . 21 MET O 1 1 4 1406 1 1 21 MET SD S 8.176 5.555 0.778 1.00 . A A . 21 MET SD 1 1 4 1407 1 1 22 ASN C C 15.008 2.675 -0.799 1.00 . A A . 22 ASN C 1 1 4 1408 1 1 22 ASN CA C 13.808 3.000 0.070 1.00 . A A . 22 ASN CA 1 1 4 1409 1 1 22 ASN CB C 13.681 1.924 1.153 1.00 . A A . 22 ASN CB 1 1 4 1410 1 1 22 ASN CG C 12.520 2.151 2.095 1.00 . A A . 22 ASN CG 1 1 4 1411 1 1 22 ASN H H 12.082 2.282 -0.940 1.00 . A A . 22 ASN H 1 1 4 1412 1 1 22 ASN HA H 13.966 3.959 0.542 1.00 . A A . 22 ASN HA 1 1 4 1413 1 1 22 ASN HB2 H 13.545 0.963 0.680 1.00 . A A . 22 ASN HB2 1 1 4 1414 1 1 22 ASN HB3 H 14.592 1.904 1.734 1.00 . A A . 22 ASN HB3 1 1 4 1415 1 1 22 ASN HD21 H 12.390 0.195 2.410 1.00 . A A . 22 ASN HD21 1 1 4 1416 1 1 22 ASN HD22 H 11.240 1.174 3.251 1.00 . A A . 22 ASN HD22 1 1 4 1417 1 1 22 ASN N N 12.599 3.093 -0.744 1.00 . A A . 22 ASN N 1 1 4 1418 1 1 22 ASN ND2 N 11.999 1.067 2.643 1.00 . A A . 22 ASN ND2 1 1 4 1419 1 1 22 ASN O O 16.151 2.919 -0.413 1.00 . A A . 22 ASN O 1 1 4 1420 1 1 22 ASN OD1 O 12.103 3.282 2.343 1.00 . A A . 22 ASN OD1 1 1 4 1421 1 1 23 SER C C 16.247 2.845 -3.750 1.00 . A A . 23 SER C 1 1 4 1422 1 1 23 SER CA C 15.796 1.685 -2.865 1.00 . A A . 23 SER CA 1 1 4 1423 1 1 23 SER CB C 15.300 0.513 -3.717 1.00 . A A . 23 SER CB 1 1 4 1424 1 1 23 SER H H 13.808 2.002 -2.243 1.00 . A A . 23 SER H 1 1 4 1425 1 1 23 SER HA H 16.632 1.357 -2.264 1.00 . A A . 23 SER HA 1 1 4 1426 1 1 23 SER HB2 H 14.500 0.851 -4.362 1.00 . A A . 23 SER HB2 1 1 4 1427 1 1 23 SER HB3 H 16.113 0.138 -4.319 1.00 . A A . 23 SER HB3 1 1 4 1428 1 1 23 SER HG H 15.263 -0.517 -2.040 1.00 . A A . 23 SER HG 1 1 4 1429 1 1 23 SER N N 14.742 2.116 -1.968 1.00 . A A . 23 SER N 1 1 4 1430 1 1 23 SER O O 17.272 3.478 -3.426 1.00 . A A . 23 SER O 1 1 4 1431 1 1 23 SER OXT O 15.562 3.141 -4.748 1.00 . A A . 23 SER OXT 1 1 4 1432 1 1 23 SER OG O 14.810 -0.541 -2.897 1.00 . A A . 23 SER OG 1 1 5 1433 1 1 1 GLY C C -11.955 5.316 -0.219 1.00 . A A . 1 GLY C 1 1 5 1434 1 1 1 GLY CA C -11.919 5.487 -1.716 1.00 . A A . 1 GLY CA 1 1 5 1435 1 1 1 GLY H1 H -12.167 7.554 -1.738 1.00 . A A . 1 GLY H1 1 1 5 1436 1 1 1 GLY H2 H -13.618 6.686 -1.843 1.00 . A A . 1 GLY H2 1 1 5 1437 1 1 1 GLY H3 H -12.600 6.792 -3.189 1.00 . A A . 1 GLY H3 1 1 5 1438 1 1 1 GLY HA2 H -12.390 4.627 -2.173 1.00 . A A . 1 GLY HA2 1 1 5 1439 1 1 1 GLY HA3 H -10.891 5.537 -2.038 1.00 . A A . 1 GLY HA3 1 1 5 1440 1 1 1 GLY N N -12.623 6.715 -2.152 1.00 . A A . 1 GLY N 1 1 5 1441 1 1 1 GLY O O -12.918 5.729 0.433 1.00 . A A . 1 GLY O 1 1 5 1442 1 1 2 ILE C C -11.858 3.279 2.065 1.00 . A A . 2 ILE C 1 1 5 1443 1 1 2 ILE CA C -10.822 4.370 1.745 1.00 . A A . 2 ILE CA 1 1 5 1444 1 1 2 ILE CB C -11.032 5.620 2.653 1.00 . A A . 2 ILE CB 1 1 5 1445 1 1 2 ILE CD1 C -10.295 8.041 2.985 1.00 . A A . 2 ILE CD1 1 1 5 1446 1 1 2 ILE CG1 C -10.116 6.760 2.196 1.00 . A A . 2 ILE CG1 1 1 5 1447 1 1 2 ILE CG2 C -10.760 5.294 4.118 1.00 . A A . 2 ILE CG2 1 1 5 1448 1 1 2 ILE H H -10.120 4.513 -0.253 1.00 . A A . 2 ILE H 1 1 5 1449 1 1 2 ILE HA H -9.834 3.973 1.937 1.00 . A A . 2 ILE HA 1 1 5 1450 1 1 2 ILE HB H -12.060 5.937 2.562 1.00 . A A . 2 ILE HB 1 1 5 1451 1 1 2 ILE HD11 H -11.319 8.375 2.897 1.00 . A A . 2 ILE HD11 1 1 5 1452 1 1 2 ILE HD12 H -9.634 8.799 2.594 1.00 . A A . 2 ILE HD12 1 1 5 1453 1 1 2 ILE HD13 H -10.063 7.860 4.024 1.00 . A A . 2 ILE HD13 1 1 5 1454 1 1 2 ILE HG12 H -9.087 6.450 2.298 1.00 . A A . 2 ILE HG12 1 1 5 1455 1 1 2 ILE HG13 H -10.319 6.979 1.160 1.00 . A A . 2 ILE HG13 1 1 5 1456 1 1 2 ILE HG21 H -10.927 6.173 4.720 1.00 . A A . 2 ILE HG21 1 1 5 1457 1 1 2 ILE HG22 H -9.735 4.968 4.230 1.00 . A A . 2 ILE HG22 1 1 5 1458 1 1 2 ILE HG23 H -11.424 4.505 4.439 1.00 . A A . 2 ILE HG23 1 1 5 1459 1 1 2 ILE N N -10.891 4.718 0.325 1.00 . A A . 2 ILE N 1 1 5 1460 1 1 2 ILE O O -12.713 2.963 1.237 1.00 . A A . 2 ILE O 1 1 5 1461 1 1 3 GLY C C -12.469 0.323 2.946 1.00 . A A . 3 GLY C 1 1 5 1462 1 1 3 GLY CA C -12.707 1.654 3.631 1.00 . A A . 3 GLY CA 1 1 5 1463 1 1 3 GLY H H -11.018 2.909 3.838 1.00 . A A . 3 GLY H 1 1 5 1464 1 1 3 GLY HA2 H -12.643 1.512 4.701 1.00 . A A . 3 GLY HA2 1 1 5 1465 1 1 3 GLY HA3 H -13.700 2.001 3.382 1.00 . A A . 3 GLY HA3 1 1 5 1466 1 1 3 GLY N N -11.751 2.668 3.236 1.00 . A A . 3 GLY N 1 1 5 1467 1 1 3 GLY O O -11.902 -0.595 3.538 1.00 . A A . 3 GLY O 1 1 5 1468 1 1 4 LYS C C -11.526 -1.065 0.098 1.00 . A A . 4 LYS C 1 1 5 1469 1 1 4 LYS CA C -12.777 -1.034 0.954 1.00 . A A . 4 LYS CA 1 1 5 1470 1 1 4 LYS CB C -14.016 -1.262 0.086 1.00 . A A . 4 LYS CB 1 1 5 1471 1 1 4 LYS CD C -16.479 -1.844 0.063 1.00 . A A . 4 LYS CD 1 1 5 1472 1 1 4 LYS CE C -16.822 -0.963 -1.132 1.00 . A A . 4 LYS CE 1 1 5 1473 1 1 4 LYS CG C -15.309 -1.305 0.880 1.00 . A A . 4 LYS CG 1 1 5 1474 1 1 4 LYS H H -13.184 1.035 1.215 1.00 . A A . 4 LYS H 1 1 5 1475 1 1 4 LYS HA H -12.707 -1.823 1.686 1.00 . A A . 4 LYS HA 1 1 5 1476 1 1 4 LYS HB2 H -14.089 -0.464 -0.636 1.00 . A A . 4 LYS HB2 1 1 5 1477 1 1 4 LYS HB3 H -13.908 -2.200 -0.436 1.00 . A A . 4 LYS HB3 1 1 5 1478 1 1 4 LYS HD2 H -16.223 -2.829 -0.298 1.00 . A A . 4 LYS HD2 1 1 5 1479 1 1 4 LYS HD3 H -17.346 -1.914 0.706 1.00 . A A . 4 LYS HD3 1 1 5 1480 1 1 4 LYS HE2 H -17.870 -1.080 -1.358 1.00 . A A . 4 LYS HE2 1 1 5 1481 1 1 4 LYS HE3 H -16.627 0.066 -0.868 1.00 . A A . 4 LYS HE3 1 1 5 1482 1 1 4 LYS HG2 H -15.165 -1.940 1.739 1.00 . A A . 4 LYS HG2 1 1 5 1483 1 1 4 LYS HG3 H -15.546 -0.304 1.209 1.00 . A A . 4 LYS HG3 1 1 5 1484 1 1 4 LYS HZ1 H -16.374 -0.768 -3.167 1.00 . A A . 4 LYS HZ1 1 1 5 1485 1 1 4 LYS HZ2 H -16.120 -2.328 -2.552 1.00 . A A . 4 LYS HZ2 1 1 5 1486 1 1 4 LYS HZ3 H -15.021 -1.089 -2.197 1.00 . A A . 4 LYS HZ3 1 1 5 1487 1 1 4 LYS N N -12.862 0.229 1.680 1.00 . A A . 4 LYS N 1 1 5 1488 1 1 4 LYS NZ N -16.028 -1.309 -2.343 1.00 . A A . 4 LYS NZ 1 1 5 1489 1 1 4 LYS O O -11.042 -2.129 -0.272 1.00 . A A . 4 LYS O 1 1 5 1490 1 1 5 PHE C C -8.571 -0.075 0.021 1.00 . A A . 5 PHE C 1 1 5 1491 1 1 5 PHE CA C -9.736 0.221 -0.913 1.00 . A A . 5 PHE CA 1 1 5 1492 1 1 5 PHE CB C -9.589 1.611 -1.533 1.00 . A A . 5 PHE CB 1 1 5 1493 1 1 5 PHE CD1 C -11.859 2.185 -2.445 1.00 . A A . 5 PHE CD1 1 1 5 1494 1 1 5 PHE CD2 C -10.087 1.762 -3.982 1.00 . A A . 5 PHE CD2 1 1 5 1495 1 1 5 PHE CE1 C -12.723 2.408 -3.498 1.00 . A A . 5 PHE CE1 1 1 5 1496 1 1 5 PHE CE2 C -10.944 1.984 -5.038 1.00 . A A . 5 PHE CE2 1 1 5 1497 1 1 5 PHE CG C -10.531 1.859 -2.675 1.00 . A A . 5 PHE CG 1 1 5 1498 1 1 5 PHE CZ C -12.264 2.308 -4.795 1.00 . A A . 5 PHE CZ 1 1 5 1499 1 1 5 PHE H H -11.455 0.931 0.090 1.00 . A A . 5 PHE H 1 1 5 1500 1 1 5 PHE HA H -9.747 -0.517 -1.703 1.00 . A A . 5 PHE HA 1 1 5 1501 1 1 5 PHE HB2 H -9.781 2.358 -0.776 1.00 . A A . 5 PHE HB2 1 1 5 1502 1 1 5 PHE HB3 H -8.580 1.730 -1.901 1.00 . A A . 5 PHE HB3 1 1 5 1503 1 1 5 PHE HD1 H -12.218 2.264 -1.428 1.00 . A A . 5 PHE HD1 1 1 5 1504 1 1 5 PHE HD2 H -9.054 1.510 -4.172 1.00 . A A . 5 PHE HD2 1 1 5 1505 1 1 5 PHE HE1 H -13.755 2.660 -3.308 1.00 . A A . 5 PHE HE1 1 1 5 1506 1 1 5 PHE HE2 H -10.583 1.905 -6.054 1.00 . A A . 5 PHE HE2 1 1 5 1507 1 1 5 PHE HZ H -12.938 2.482 -5.620 1.00 . A A . 5 PHE HZ 1 1 5 1508 1 1 5 PHE N N -10.992 0.114 -0.187 1.00 . A A . 5 PHE N 1 1 5 1509 1 1 5 PHE O O -7.410 -0.043 -0.377 1.00 . A A . 5 PHE O 1 1 5 1510 1 1 6 LEU C C -7.646 -2.252 2.164 1.00 . A A . 6 LEU C 1 1 5 1511 1 1 6 LEU CA C -7.913 -0.758 2.268 1.00 . A A . 6 LEU CA 1 1 5 1512 1 1 6 LEU CB C -8.411 -0.393 3.671 1.00 . A A . 6 LEU CB 1 1 5 1513 1 1 6 LEU CD1 C -6.195 0.248 4.653 1.00 . A A . 6 LEU CD1 1 1 5 1514 1 1 6 LEU CD2 C -8.087 -0.382 6.151 1.00 . A A . 6 LEU CD2 1 1 5 1515 1 1 6 LEU CG C -7.421 -0.635 4.811 1.00 . A A . 6 LEU CG 1 1 5 1516 1 1 6 LEU H H -9.858 -0.348 1.527 1.00 . A A . 6 LEU H 1 1 5 1517 1 1 6 LEU HA H -6.996 -0.224 2.059 1.00 . A A . 6 LEU HA 1 1 5 1518 1 1 6 LEU HB2 H -8.675 0.655 3.673 1.00 . A A . 6 LEU HB2 1 1 5 1519 1 1 6 LEU HB3 H -9.302 -0.968 3.873 1.00 . A A . 6 LEU HB3 1 1 5 1520 1 1 6 LEU HD11 H -5.499 0.047 5.452 1.00 . A A . 6 LEU HD11 1 1 5 1521 1 1 6 LEU HD12 H -6.493 1.286 4.688 1.00 . A A . 6 LEU HD12 1 1 5 1522 1 1 6 LEU HD13 H -5.725 0.043 3.702 1.00 . A A . 6 LEU HD13 1 1 5 1523 1 1 6 LEU HD21 H -8.445 0.635 6.185 1.00 . A A . 6 LEU HD21 1 1 5 1524 1 1 6 LEU HD22 H -7.371 -0.541 6.942 1.00 . A A . 6 LEU HD22 1 1 5 1525 1 1 6 LEU HD23 H -8.918 -1.062 6.273 1.00 . A A . 6 LEU HD23 1 1 5 1526 1 1 6 LEU HG H -7.098 -1.666 4.785 1.00 . A A . 6 LEU HG 1 1 5 1527 1 1 6 LEU N N -8.906 -0.374 1.272 1.00 . A A . 6 LEU N 1 1 5 1528 1 1 6 LEU O O -6.717 -2.780 2.774 1.00 . A A . 6 LEU O 1 1 5 1529 1 1 7 HIS C C -6.973 -4.699 0.589 1.00 . A A . 7 HIS C 1 1 5 1530 1 1 7 HIS CA C -8.352 -4.350 1.139 1.00 . A A . 7 HIS CA 1 1 5 1531 1 1 7 HIS CB C -9.454 -4.815 0.177 1.00 . A A . 7 HIS CB 1 1 5 1532 1 1 7 HIS CD2 C -8.746 -7.067 -0.912 1.00 . A A . 7 HIS CD2 1 1 5 1533 1 1 7 HIS CE1 C -10.190 -8.371 0.088 1.00 . A A . 7 HIS CE1 1 1 5 1534 1 1 7 HIS CG C -9.482 -6.293 -0.078 1.00 . A A . 7 HIS CG 1 1 5 1535 1 1 7 HIS H H -9.163 -2.418 0.878 1.00 . A A . 7 HIS H 1 1 5 1536 1 1 7 HIS HA H -8.481 -4.840 2.092 1.00 . A A . 7 HIS HA 1 1 5 1537 1 1 7 HIS HB2 H -10.413 -4.536 0.588 1.00 . A A . 7 HIS HB2 1 1 5 1538 1 1 7 HIS HB3 H -9.320 -4.314 -0.771 1.00 . A A . 7 HIS HB3 1 1 5 1539 1 1 7 HIS HD1 H -11.061 -6.885 1.198 1.00 . A A . 7 HIS HD1 1 1 5 1540 1 1 7 HIS HD2 H -7.938 -6.733 -1.548 1.00 . A A . 7 HIS HD2 1 1 5 1541 1 1 7 HIS HE1 H -10.743 -9.245 0.398 1.00 . A A . 7 HIS HE1 1 1 5 1542 1 1 7 HIS HE2 H -9.027 -9.080 -1.436 1.00 . A A . 7 HIS HE2 1 1 5 1543 1 1 7 HIS N N -8.463 -2.915 1.354 1.00 . A A . 7 HIS N 1 1 5 1544 1 1 7 HIS ND1 N -10.377 -7.143 0.532 1.00 . A A . 7 HIS ND1 1 1 5 1545 1 1 7 HIS NE2 N -9.208 -8.353 -0.791 1.00 . A A . 7 HIS NE2 1 1 5 1546 1 1 7 HIS O O -6.259 -5.528 1.153 1.00 . A A . 7 HIS O 1 1 5 1547 1 1 8 SER C C -4.319 -3.204 -0.696 1.00 . A A . 8 SER C 1 1 5 1548 1 1 8 SER CA C -5.300 -4.298 -1.097 1.00 . A A . 8 SER CA 1 1 5 1549 1 1 8 SER CB C -5.426 -4.386 -2.615 1.00 . A A . 8 SER CB 1 1 5 1550 1 1 8 SER H H -7.221 -3.444 -0.957 1.00 . A A . 8 SER H 1 1 5 1551 1 1 8 SER HA H -4.933 -5.237 -0.716 1.00 . A A . 8 SER HA 1 1 5 1552 1 1 8 SER HB2 H -5.724 -3.425 -3.007 1.00 . A A . 8 SER HB2 1 1 5 1553 1 1 8 SER HB3 H -4.476 -4.665 -3.032 1.00 . A A . 8 SER HB3 1 1 5 1554 1 1 8 SER HG H -6.041 -6.239 -2.846 1.00 . A A . 8 SER HG 1 1 5 1555 1 1 8 SER N N -6.601 -4.066 -0.511 1.00 . A A . 8 SER N 1 1 5 1556 1 1 8 SER O O -3.128 -3.295 -0.987 1.00 . A A . 8 SER O 1 1 5 1557 1 1 8 SER OG O -6.394 -5.353 -2.991 1.00 . A A . 8 SER OG 1 1 5 1558 1 1 9 ALA C C -2.930 -1.733 1.493 1.00 . A A . 9 ALA C 1 1 5 1559 1 1 9 ALA CA C -3.931 -1.141 0.512 1.00 . A A . 9 ALA CA 1 1 5 1560 1 1 9 ALA CB C -4.726 -0.030 1.177 1.00 . A A . 9 ALA CB 1 1 5 1561 1 1 9 ALA H H -5.770 -2.130 0.166 1.00 . A A . 9 ALA H 1 1 5 1562 1 1 9 ALA HA H -3.392 -0.718 -0.325 1.00 . A A . 9 ALA HA 1 1 5 1563 1 1 9 ALA HB1 H -4.059 0.770 1.465 1.00 . A A . 9 ALA HB1 1 1 5 1564 1 1 9 ALA HB2 H -5.224 -0.417 2.054 1.00 . A A . 9 ALA HB2 1 1 5 1565 1 1 9 ALA HB3 H -5.462 0.349 0.484 1.00 . A A . 9 ALA HB3 1 1 5 1566 1 1 9 ALA N N -4.807 -2.186 0.002 1.00 . A A . 9 ALA N 1 1 5 1567 1 1 9 ALA O O -1.825 -1.222 1.657 1.00 . A A . 9 ALA O 1 1 5 1568 1 1 10 LYS C C -1.561 -4.549 2.405 1.00 . A A . 10 LYS C 1 1 5 1569 1 1 10 LYS CA C -2.428 -3.485 3.082 1.00 . A A . 10 LYS CA 1 1 5 1570 1 1 10 LYS CB C -3.224 -4.118 4.228 1.00 . A A . 10 LYS CB 1 1 5 1571 1 1 10 LYS CD C -3.119 -5.399 6.408 1.00 . A A . 10 LYS CD 1 1 5 1572 1 1 10 LYS CE C -2.181 -6.025 7.428 1.00 . A A . 10 LYS CE 1 1 5 1573 1 1 10 LYS CG C -2.331 -4.739 5.291 1.00 . A A . 10 LYS CG 1 1 5 1574 1 1 10 LYS H H -4.213 -3.205 1.953 1.00 . A A . 10 LYS H 1 1 5 1575 1 1 10 LYS HA H -1.778 -2.725 3.489 1.00 . A A . 10 LYS HA 1 1 5 1576 1 1 10 LYS HB2 H -3.833 -3.358 4.694 1.00 . A A . 10 LYS HB2 1 1 5 1577 1 1 10 LYS HB3 H -3.863 -4.889 3.827 1.00 . A A . 10 LYS HB3 1 1 5 1578 1 1 10 LYS HD2 H -3.729 -4.655 6.899 1.00 . A A . 10 LYS HD2 1 1 5 1579 1 1 10 LYS HD3 H -3.750 -6.170 5.989 1.00 . A A . 10 LYS HD3 1 1 5 1580 1 1 10 LYS HE2 H -1.588 -6.782 6.936 1.00 . A A . 10 LYS HE2 1 1 5 1581 1 1 10 LYS HE3 H -1.530 -5.258 7.817 1.00 . A A . 10 LYS HE3 1 1 5 1582 1 1 10 LYS HG2 H -1.706 -5.485 4.824 1.00 . A A . 10 LYS HG2 1 1 5 1583 1 1 10 LYS HG3 H -1.708 -3.965 5.712 1.00 . A A . 10 LYS HG3 1 1 5 1584 1 1 10 LYS HZ1 H -3.523 -5.939 9.025 1.00 . A A . 10 LYS HZ1 1 1 5 1585 1 1 10 LYS HZ2 H -2.241 -7.028 9.257 1.00 . A A . 10 LYS HZ2 1 1 5 1586 1 1 10 LYS HZ3 H -3.513 -7.430 8.209 1.00 . A A . 10 LYS HZ3 1 1 5 1587 1 1 10 LYS N N -3.313 -2.833 2.127 1.00 . A A . 10 LYS N 1 1 5 1588 1 1 10 LYS NZ N -2.916 -6.649 8.556 1.00 . A A . 10 LYS NZ 1 1 5 1589 1 1 10 LYS O O -0.426 -4.789 2.813 1.00 . A A . 10 LYS O 1 1 5 1590 1 1 11 LYS C C -0.864 -5.914 -0.638 1.00 . A A . 11 LYS C 1 1 5 1591 1 1 11 LYS CA C -1.400 -6.296 0.728 1.00 . A A . 11 LYS CA 1 1 5 1592 1 1 11 LYS CB C -2.333 -7.502 0.622 1.00 . A A . 11 LYS CB 1 1 5 1593 1 1 11 LYS CD C -3.397 -9.435 1.817 1.00 . A A . 11 LYS CD 1 1 5 1594 1 1 11 LYS CE C -3.584 -10.110 3.162 1.00 . A A . 11 LYS CE 1 1 5 1595 1 1 11 LYS CG C -2.669 -8.114 1.968 1.00 . A A . 11 LYS CG 1 1 5 1596 1 1 11 LYS H H -2.913 -4.825 0.957 1.00 . A A . 11 LYS H 1 1 5 1597 1 1 11 LYS HA H -0.565 -6.558 1.359 1.00 . A A . 11 LYS HA 1 1 5 1598 1 1 11 LYS HB2 H -3.252 -7.193 0.150 1.00 . A A . 11 LYS HB2 1 1 5 1599 1 1 11 LYS HB3 H -1.861 -8.260 0.013 1.00 . A A . 11 LYS HB3 1 1 5 1600 1 1 11 LYS HD2 H -4.365 -9.254 1.376 1.00 . A A . 11 LYS HD2 1 1 5 1601 1 1 11 LYS HD3 H -2.820 -10.083 1.174 1.00 . A A . 11 LYS HD3 1 1 5 1602 1 1 11 LYS HE2 H -2.618 -10.223 3.632 1.00 . A A . 11 LYS HE2 1 1 5 1603 1 1 11 LYS HE3 H -4.211 -9.483 3.778 1.00 . A A . 11 LYS HE3 1 1 5 1604 1 1 11 LYS HG2 H -1.754 -8.282 2.515 1.00 . A A . 11 LYS HG2 1 1 5 1605 1 1 11 LYS HG3 H -3.298 -7.429 2.517 1.00 . A A . 11 LYS HG3 1 1 5 1606 1 1 11 LYS HZ1 H -4.355 -11.869 3.975 1.00 . A A . 11 LYS HZ1 1 1 5 1607 1 1 11 LYS HZ2 H -3.612 -12.076 2.462 1.00 . A A . 11 LYS HZ2 1 1 5 1608 1 1 11 LYS HZ3 H -5.145 -11.361 2.563 1.00 . A A . 11 LYS HZ3 1 1 5 1609 1 1 11 LYS N N -2.080 -5.162 1.351 1.00 . A A . 11 LYS N 1 1 5 1610 1 1 11 LYS NZ N -4.217 -11.447 3.032 1.00 . A A . 11 LYS NZ 1 1 5 1611 1 1 11 LYS O O -0.658 -6.762 -1.508 1.00 . A A . 11 LYS O 1 1 5 1612 1 1 12 PHE C C 0.437 -2.682 -1.726 1.00 . A A . 12 PHE C 1 1 5 1613 1 1 12 PHE CA C -0.077 -4.079 -2.017 1.00 . A A . 12 PHE CA 1 1 5 1614 1 1 12 PHE CB C -1.110 -4.048 -3.151 1.00 . A A . 12 PHE CB 1 1 5 1615 1 1 12 PHE CD1 C 0.236 -4.105 -5.271 1.00 . A A . 12 PHE CD1 1 1 5 1616 1 1 12 PHE CD2 C -0.978 -2.117 -4.754 1.00 . A A . 12 PHE CD2 1 1 5 1617 1 1 12 PHE CE1 C 0.700 -3.521 -6.433 1.00 . A A . 12 PHE CE1 1 1 5 1618 1 1 12 PHE CE2 C -0.514 -1.529 -5.916 1.00 . A A . 12 PHE CE2 1 1 5 1619 1 1 12 PHE CG C -0.608 -3.412 -4.418 1.00 . A A . 12 PHE CG 1 1 5 1620 1 1 12 PHE CZ C 0.326 -2.232 -6.756 1.00 . A A . 12 PHE CZ 1 1 5 1621 1 1 12 PHE H H -0.911 -4.012 -0.089 1.00 . A A . 12 PHE H 1 1 5 1622 1 1 12 PHE HA H 0.754 -4.706 -2.305 1.00 . A A . 12 PHE HA 1 1 5 1623 1 1 12 PHE HB2 H -1.408 -5.059 -3.383 1.00 . A A . 12 PHE HB2 1 1 5 1624 1 1 12 PHE HB3 H -1.977 -3.492 -2.820 1.00 . A A . 12 PHE HB3 1 1 5 1625 1 1 12 PHE HD1 H 0.531 -5.114 -5.020 1.00 . A A . 12 PHE HD1 1 1 5 1626 1 1 12 PHE HD2 H -1.634 -1.566 -4.099 1.00 . A A . 12 PHE HD2 1 1 5 1627 1 1 12 PHE HE1 H 1.358 -4.073 -7.091 1.00 . A A . 12 PHE HE1 1 1 5 1628 1 1 12 PHE HE2 H -0.809 -0.521 -6.166 1.00 . A A . 12 PHE HE2 1 1 5 1629 1 1 12 PHE HZ H 0.690 -1.774 -7.663 1.00 . A A . 12 PHE HZ 1 1 5 1630 1 1 12 PHE N N -0.656 -4.626 -0.807 1.00 . A A . 12 PHE N 1 1 5 1631 1 1 12 PHE O O 1.573 -2.355 -2.040 1.00 . A A . 12 PHE O 1 1 5 1632 1 1 13 GLY C C 1.156 -0.437 0.182 1.00 . A A . 13 GLY C 1 1 5 1633 1 1 13 GLY CA C -0.024 -0.514 -0.766 1.00 . A A . 13 GLY CA 1 1 5 1634 1 1 13 GLY H H -1.288 -2.216 -0.824 1.00 . A A . 13 GLY H 1 1 5 1635 1 1 13 GLY HA2 H 0.231 -0.007 -1.676 1.00 . A A . 13 GLY HA2 1 1 5 1636 1 1 13 GLY HA3 H -0.868 -0.015 -0.312 1.00 . A A . 13 GLY HA3 1 1 5 1637 1 1 13 GLY N N -0.400 -1.880 -1.082 1.00 . A A . 13 GLY N 1 1 5 1638 1 1 13 GLY O O 2.209 0.098 -0.161 1.00 . A A . 13 GLY O 1 1 5 1639 1 1 14 LYS C C 3.282 -1.661 1.916 1.00 . A A . 14 LYS C 1 1 5 1640 1 1 14 LYS CA C 1.997 -1.002 2.408 1.00 . A A . 14 LYS CA 1 1 5 1641 1 1 14 LYS CB C 1.485 -1.740 3.649 1.00 . A A . 14 LYS CB 1 1 5 1642 1 1 14 LYS CD C 0.419 0.246 4.783 1.00 . A A . 14 LYS CD 1 1 5 1643 1 1 14 LYS CE C -0.891 0.848 5.273 1.00 . A A . 14 LYS CE 1 1 5 1644 1 1 14 LYS CG C 0.208 -1.159 4.234 1.00 . A A . 14 LYS CG 1 1 5 1645 1 1 14 LYS H H 0.103 -1.401 1.553 1.00 . A A . 14 LYS H 1 1 5 1646 1 1 14 LYS HA H 2.207 0.024 2.671 1.00 . A A . 14 LYS HA 1 1 5 1647 1 1 14 LYS HB2 H 1.296 -2.769 3.385 1.00 . A A . 14 LYS HB2 1 1 5 1648 1 1 14 LYS HB3 H 2.250 -1.710 4.411 1.00 . A A . 14 LYS HB3 1 1 5 1649 1 1 14 LYS HD2 H 1.115 0.199 5.608 1.00 . A A . 14 LYS HD2 1 1 5 1650 1 1 14 LYS HD3 H 0.824 0.871 4.002 1.00 . A A . 14 LYS HD3 1 1 5 1651 1 1 14 LYS HE2 H -1.566 0.932 4.436 1.00 . A A . 14 LYS HE2 1 1 5 1652 1 1 14 LYS HE3 H -1.320 0.187 6.012 1.00 . A A . 14 LYS HE3 1 1 5 1653 1 1 14 LYS HG2 H -0.547 -1.126 3.462 1.00 . A A . 14 LYS HG2 1 1 5 1654 1 1 14 LYS HG3 H -0.126 -1.801 5.034 1.00 . A A . 14 LYS HG3 1 1 5 1655 1 1 14 LYS HZ1 H -1.642 2.627 6.066 1.00 . A A . 14 LYS HZ1 1 1 5 1656 1 1 14 LYS HZ2 H -0.179 2.817 5.231 1.00 . A A . 14 LYS HZ2 1 1 5 1657 1 1 14 LYS HZ3 H -0.187 2.122 6.778 1.00 . A A . 14 LYS HZ3 1 1 5 1658 1 1 14 LYS N N 0.971 -0.995 1.366 1.00 . A A . 14 LYS N 1 1 5 1659 1 1 14 LYS NZ N -0.711 2.195 5.876 1.00 . A A . 14 LYS NZ 1 1 5 1660 1 1 14 LYS O O 4.385 -1.247 2.271 1.00 . A A . 14 LYS O 1 1 5 1661 1 1 15 ALA C C 4.987 -2.570 -0.506 1.00 . A A . 15 ALA C 1 1 5 1662 1 1 15 ALA CA C 4.273 -3.400 0.554 1.00 . A A . 15 ALA CA 1 1 5 1663 1 1 15 ALA CB C 3.834 -4.732 -0.024 1.00 . A A . 15 ALA CB 1 1 5 1664 1 1 15 ALA H H 2.231 -2.952 0.822 1.00 . A A . 15 ALA H 1 1 5 1665 1 1 15 ALA HA H 4.955 -3.595 1.369 1.00 . A A . 15 ALA HA 1 1 5 1666 1 1 15 ALA HB1 H 4.700 -5.277 -0.371 1.00 . A A . 15 ALA HB1 1 1 5 1667 1 1 15 ALA HB2 H 3.162 -4.560 -0.852 1.00 . A A . 15 ALA HB2 1 1 5 1668 1 1 15 ALA HB3 H 3.328 -5.307 0.737 1.00 . A A . 15 ALA HB3 1 1 5 1669 1 1 15 ALA N N 3.131 -2.681 1.086 1.00 . A A . 15 ALA N 1 1 5 1670 1 1 15 ALA O O 6.217 -2.497 -0.529 1.00 . A A . 15 ALA O 1 1 5 1671 1 1 16 PHE C C 5.471 0.088 -1.939 1.00 . A A . 16 PHE C 1 1 5 1672 1 1 16 PHE CA C 4.736 -1.139 -2.466 1.00 . A A . 16 PHE CA 1 1 5 1673 1 1 16 PHE CB C 3.597 -0.706 -3.394 1.00 . A A . 16 PHE CB 1 1 5 1674 1 1 16 PHE CD1 C 4.105 -1.464 -5.723 1.00 . A A . 16 PHE CD1 1 1 5 1675 1 1 16 PHE CD2 C 4.320 0.857 -5.218 1.00 . A A . 16 PHE CD2 1 1 5 1676 1 1 16 PHE CE1 C 4.481 -1.221 -7.027 1.00 . A A . 16 PHE CE1 1 1 5 1677 1 1 16 PHE CE2 C 4.699 1.107 -6.521 1.00 . A A . 16 PHE CE2 1 1 5 1678 1 1 16 PHE CG C 4.020 -0.431 -4.806 1.00 . A A . 16 PHE CG 1 1 5 1679 1 1 16 PHE CZ C 4.779 0.066 -7.427 1.00 . A A . 16 PHE CZ 1 1 5 1680 1 1 16 PHE H H 3.228 -1.996 -1.263 1.00 . A A . 16 PHE H 1 1 5 1681 1 1 16 PHE HA H 5.430 -1.755 -3.019 1.00 . A A . 16 PHE HA 1 1 5 1682 1 1 16 PHE HB2 H 2.852 -1.486 -3.421 1.00 . A A . 16 PHE HB2 1 1 5 1683 1 1 16 PHE HB3 H 3.149 0.195 -3.001 1.00 . A A . 16 PHE HB3 1 1 5 1684 1 1 16 PHE HD1 H 3.871 -2.470 -5.409 1.00 . A A . 16 PHE HD1 1 1 5 1685 1 1 16 PHE HD2 H 4.256 1.668 -4.509 1.00 . A A . 16 PHE HD2 1 1 5 1686 1 1 16 PHE HE1 H 4.544 -2.036 -7.734 1.00 . A A . 16 PHE HE1 1 1 5 1687 1 1 16 PHE HE2 H 4.933 2.116 -6.831 1.00 . A A . 16 PHE HE2 1 1 5 1688 1 1 16 PHE HZ H 5.074 0.260 -8.447 1.00 . A A . 16 PHE HZ 1 1 5 1689 1 1 16 PHE N N 4.203 -1.929 -1.365 1.00 . A A . 16 PHE N 1 1 5 1690 1 1 16 PHE O O 6.531 0.456 -2.447 1.00 . A A . 16 PHE O 1 1 5 1691 1 1 17 VAL C C 6.800 1.534 0.427 1.00 . A A . 17 VAL C 1 1 5 1692 1 1 17 VAL CA C 5.539 1.905 -0.338 1.00 . A A . 17 VAL CA 1 1 5 1693 1 1 17 VAL CB C 4.583 2.701 0.579 1.00 . A A . 17 VAL CB 1 1 5 1694 1 1 17 VAL CG1 C 3.350 3.151 -0.189 1.00 . A A . 17 VAL CG1 1 1 5 1695 1 1 17 VAL CG2 C 4.184 1.887 1.796 1.00 . A A . 17 VAL CG2 1 1 5 1696 1 1 17 VAL H H 4.078 0.368 -0.511 1.00 . A A . 17 VAL H 1 1 5 1697 1 1 17 VAL HA H 5.823 2.540 -1.163 1.00 . A A . 17 VAL HA 1 1 5 1698 1 1 17 VAL HB H 5.104 3.583 0.920 1.00 . A A . 17 VAL HB 1 1 5 1699 1 1 17 VAL HG11 H 2.813 2.285 -0.548 1.00 . A A . 17 VAL HG11 1 1 5 1700 1 1 17 VAL HG12 H 3.649 3.763 -1.027 1.00 . A A . 17 VAL HG12 1 1 5 1701 1 1 17 VAL HG13 H 2.711 3.724 0.466 1.00 . A A . 17 VAL HG13 1 1 5 1702 1 1 17 VAL HG21 H 3.523 2.471 2.417 1.00 . A A . 17 VAL HG21 1 1 5 1703 1 1 17 VAL HG22 H 5.068 1.624 2.357 1.00 . A A . 17 VAL HG22 1 1 5 1704 1 1 17 VAL HG23 H 3.678 0.988 1.476 1.00 . A A . 17 VAL HG23 1 1 5 1705 1 1 17 VAL N N 4.918 0.715 -0.902 1.00 . A A . 17 VAL N 1 1 5 1706 1 1 17 VAL O O 7.683 2.364 0.635 1.00 . A A . 17 VAL O 1 1 5 1707 1 1 18 GLY C C 9.229 -0.348 0.498 1.00 . A A . 18 GLY C 1 1 5 1708 1 1 18 GLY CA C 8.072 -0.224 1.467 1.00 . A A . 18 GLY CA 1 1 5 1709 1 1 18 GLY H H 6.130 -0.332 0.655 1.00 . A A . 18 GLY H 1 1 5 1710 1 1 18 GLY HA2 H 8.348 0.453 2.261 1.00 . A A . 18 GLY HA2 1 1 5 1711 1 1 18 GLY HA3 H 7.857 -1.194 1.887 1.00 . A A . 18 GLY HA3 1 1 5 1712 1 1 18 GLY N N 6.886 0.272 0.814 1.00 . A A . 18 GLY N 1 1 5 1713 1 1 18 GLY O O 10.385 -0.423 0.906 1.00 . A A . 18 GLY O 1 1 5 1714 1 1 19 GLU C C 10.329 0.927 -2.304 1.00 . A A . 19 GLU C 1 1 5 1715 1 1 19 GLU CA C 9.925 -0.460 -1.832 1.00 . A A . 19 GLU CA 1 1 5 1716 1 1 19 GLU CB C 9.400 -1.257 -3.023 1.00 . A A . 19 GLU CB 1 1 5 1717 1 1 19 GLU CD C 8.513 -3.438 -3.909 1.00 . A A . 19 GLU CD 1 1 5 1718 1 1 19 GLU CG C 8.963 -2.670 -2.684 1.00 . A A . 19 GLU CG 1 1 5 1719 1 1 19 GLU H H 7.965 -0.302 -1.051 1.00 . A A . 19 GLU H 1 1 5 1720 1 1 19 GLU HA H 10.785 -0.962 -1.418 1.00 . A A . 19 GLU HA 1 1 5 1721 1 1 19 GLU HB2 H 8.553 -0.734 -3.439 1.00 . A A . 19 GLU HB2 1 1 5 1722 1 1 19 GLU HB3 H 10.177 -1.313 -3.770 1.00 . A A . 19 GLU HB3 1 1 5 1723 1 1 19 GLU HG2 H 9.793 -3.193 -2.235 1.00 . A A . 19 GLU HG2 1 1 5 1724 1 1 19 GLU HG3 H 8.142 -2.624 -1.983 1.00 . A A . 19 GLU HG3 1 1 5 1725 1 1 19 GLU N N 8.911 -0.360 -0.792 1.00 . A A . 19 GLU N 1 1 5 1726 1 1 19 GLU O O 11.513 1.253 -2.382 1.00 . A A . 19 GLU O 1 1 5 1727 1 1 19 GLU OE1 O 9.383 -3.828 -4.719 1.00 . A A . 19 GLU OE1 1 1 5 1728 1 1 19 GLU OE2 O 7.295 -3.652 -4.069 1.00 . A A . 19 GLU OE2 1 1 5 1729 1 1 20 ILE C C 10.149 4.011 -2.059 1.00 . A A . 20 ILE C 1 1 5 1730 1 1 20 ILE CA C 9.576 3.091 -3.131 1.00 . A A . 20 ILE CA 1 1 5 1731 1 1 20 ILE CB C 8.298 3.717 -3.725 1.00 . A A . 20 ILE CB 1 1 5 1732 1 1 20 ILE CD1 C 5.860 4.279 -3.225 1.00 . A A . 20 ILE CD1 1 1 5 1733 1 1 20 ILE CG1 C 7.171 3.740 -2.690 1.00 . A A . 20 ILE CG1 1 1 5 1734 1 1 20 ILE CG2 C 7.870 2.954 -4.966 1.00 . A A . 20 ILE CG2 1 1 5 1735 1 1 20 ILE H H 8.405 1.436 -2.506 1.00 . A A . 20 ILE H 1 1 5 1736 1 1 20 ILE HA H 10.302 3.002 -3.928 1.00 . A A . 20 ILE HA 1 1 5 1737 1 1 20 ILE HB H 8.527 4.731 -4.019 1.00 . A A . 20 ILE HB 1 1 5 1738 1 1 20 ILE HD11 H 5.119 4.267 -2.439 1.00 . A A . 20 ILE HD11 1 1 5 1739 1 1 20 ILE HD12 H 5.523 3.664 -4.046 1.00 . A A . 20 ILE HD12 1 1 5 1740 1 1 20 ILE HD13 H 6.001 5.293 -3.569 1.00 . A A . 20 ILE HD13 1 1 5 1741 1 1 20 ILE HG12 H 6.994 2.733 -2.341 1.00 . A A . 20 ILE HG12 1 1 5 1742 1 1 20 ILE HG13 H 7.471 4.358 -1.856 1.00 . A A . 20 ILE HG13 1 1 5 1743 1 1 20 ILE HG21 H 7.673 1.926 -4.705 1.00 . A A . 20 ILE HG21 1 1 5 1744 1 1 20 ILE HG22 H 8.659 2.994 -5.703 1.00 . A A . 20 ILE HG22 1 1 5 1745 1 1 20 ILE HG23 H 6.976 3.401 -5.374 1.00 . A A . 20 ILE HG23 1 1 5 1746 1 1 20 ILE N N 9.331 1.748 -2.614 1.00 . A A . 20 ILE N 1 1 5 1747 1 1 20 ILE O O 10.595 5.120 -2.357 1.00 . A A . 20 ILE O 1 1 5 1748 1 1 21 MET C C 12.285 4.336 0.024 1.00 . A A . 21 MET C 1 1 5 1749 1 1 21 MET CA C 10.782 4.273 0.272 1.00 . A A . 21 MET CA 1 1 5 1750 1 1 21 MET CB C 10.498 3.604 1.622 1.00 . A A . 21 MET CB 1 1 5 1751 1 1 21 MET CE C 8.962 3.884 4.423 1.00 . A A . 21 MET CE 1 1 5 1752 1 1 21 MET CG C 11.173 4.289 2.805 1.00 . A A . 21 MET CG 1 1 5 1753 1 1 21 MET H H 9.670 2.706 -0.619 1.00 . A A . 21 MET H 1 1 5 1754 1 1 21 MET HA H 10.388 5.279 0.284 1.00 . A A . 21 MET HA 1 1 5 1755 1 1 21 MET HB2 H 9.433 3.604 1.796 1.00 . A A . 21 MET HB2 1 1 5 1756 1 1 21 MET HB3 H 10.847 2.583 1.581 1.00 . A A . 21 MET HB3 1 1 5 1757 1 1 21 MET HE1 H 8.545 3.519 5.350 1.00 . A A . 21 MET HE1 1 1 5 1758 1 1 21 MET HE2 H 8.483 3.383 3.594 1.00 . A A . 21 MET HE2 1 1 5 1759 1 1 21 MET HE3 H 8.793 4.948 4.347 1.00 . A A . 21 MET HE3 1 1 5 1760 1 1 21 MET HG2 H 12.243 4.215 2.682 1.00 . A A . 21 MET HG2 1 1 5 1761 1 1 21 MET HG3 H 10.886 5.331 2.815 1.00 . A A . 21 MET HG3 1 1 5 1762 1 1 21 MET N N 10.134 3.548 -0.813 1.00 . A A . 21 MET N 1 1 5 1763 1 1 21 MET O O 12.923 5.363 0.245 1.00 . A A . 21 MET O 1 1 5 1764 1 1 21 MET SD S 10.721 3.549 4.387 1.00 . A A . 21 MET SD 1 1 5 1765 1 1 22 ASN C C 14.462 3.201 -2.303 1.00 . A A . 22 ASN C 1 1 5 1766 1 1 22 ASN CA C 14.257 3.158 -0.791 1.00 . A A . 22 ASN CA 1 1 5 1767 1 1 22 ASN CB C 14.880 1.883 -0.209 1.00 . A A . 22 ASN CB 1 1 5 1768 1 1 22 ASN CG C 14.128 0.626 -0.606 1.00 . A A . 22 ASN CG 1 1 5 1769 1 1 22 ASN H H 12.274 2.442 -0.612 1.00 . A A . 22 ASN H 1 1 5 1770 1 1 22 ASN HA H 14.741 4.017 -0.350 1.00 . A A . 22 ASN HA 1 1 5 1771 1 1 22 ASN HB2 H 15.896 1.796 -0.562 1.00 . A A . 22 ASN HB2 1 1 5 1772 1 1 22 ASN HB3 H 14.885 1.953 0.870 1.00 . A A . 22 ASN HB3 1 1 5 1773 1 1 22 ASN HD21 H 15.309 0.377 -2.190 1.00 . A A . 22 ASN HD21 1 1 5 1774 1 1 22 ASN HD22 H 14.066 -0.817 -1.979 1.00 . A A . 22 ASN HD22 1 1 5 1775 1 1 22 ASN N N 12.837 3.233 -0.464 1.00 . A A . 22 ASN N 1 1 5 1776 1 1 22 ASN ND2 N 14.543 0.001 -1.698 1.00 . A A . 22 ASN ND2 1 1 5 1777 1 1 22 ASN O O 15.489 2.759 -2.816 1.00 . A A . 22 ASN O 1 1 5 1778 1 1 22 ASN OD1 O 13.193 0.211 0.077 1.00 . A A . 22 ASN OD1 1 1 5 1779 1 1 23 SER C C 13.058 5.241 -4.884 1.00 . A A . 23 SER C 1 1 5 1780 1 1 23 SER CA C 13.558 3.864 -4.456 1.00 . A A . 23 SER CA 1 1 5 1781 1 1 23 SER CB C 12.737 2.763 -5.135 1.00 . A A . 23 SER CB 1 1 5 1782 1 1 23 SER H H 12.676 4.058 -2.547 1.00 . A A . 23 SER H 1 1 5 1783 1 1 23 SER HA H 14.594 3.763 -4.741 1.00 . A A . 23 SER HA 1 1 5 1784 1 1 23 SER HB2 H 11.691 2.913 -4.913 1.00 . A A . 23 SER HB2 1 1 5 1785 1 1 23 SER HB3 H 12.889 2.810 -6.203 1.00 . A A . 23 SER HB3 1 1 5 1786 1 1 23 SER HG H 12.770 1.336 -3.779 1.00 . A A . 23 SER HG 1 1 5 1787 1 1 23 SER N N 13.477 3.734 -3.010 1.00 . A A . 23 SER N 1 1 5 1788 1 1 23 SER O O 11.912 5.337 -5.363 1.00 . A A . 23 SER O 1 1 5 1789 1 1 23 SER OXT O 13.802 6.229 -4.699 1.00 . A A . 23 SER OXT 1 1 5 1790 1 1 23 SER OG O 13.120 1.472 -4.673 1.00 . A A . 23 SER OG 1 1 6 1791 1 1 1 GLY C C -6.966 6.372 1.744 1.00 . A A . 1 GLY C 1 1 6 1792 1 1 1 GLY CA C -6.696 6.242 0.263 1.00 . A A . 1 GLY CA 1 1 6 1793 1 1 1 GLY H1 H -5.085 7.566 0.196 1.00 . A A . 1 GLY H1 1 1 6 1794 1 1 1 GLY H2 H -5.119 6.469 -1.089 1.00 . A A . 1 GLY H2 1 1 6 1795 1 1 1 GLY H3 H -4.638 5.950 0.449 1.00 . A A . 1 GLY H3 1 1 6 1796 1 1 1 GLY HA2 H -7.354 6.907 -0.272 1.00 . A A . 1 GLY HA2 1 1 6 1797 1 1 1 GLY HA3 H -6.899 5.222 -0.041 1.00 . A A . 1 GLY HA3 1 1 6 1798 1 1 1 GLY N N -5.290 6.580 -0.071 1.00 . A A . 1 GLY N 1 1 6 1799 1 1 1 GLY O O -6.089 6.782 2.504 1.00 . A A . 1 GLY O 1 1 6 1800 1 1 2 ILE C C -8.505 4.726 4.210 1.00 . A A . 2 ILE C 1 1 6 1801 1 1 2 ILE CA C -8.554 6.105 3.563 1.00 . A A . 2 ILE CA 1 1 6 1802 1 1 2 ILE CB C -9.966 6.707 3.735 1.00 . A A . 2 ILE CB 1 1 6 1803 1 1 2 ILE CD1 C -11.439 8.670 3.052 1.00 . A A . 2 ILE CD1 1 1 6 1804 1 1 2 ILE CG1 C -10.060 8.048 3.002 1.00 . A A . 2 ILE CG1 1 1 6 1805 1 1 2 ILE CG2 C -10.297 6.881 5.215 1.00 . A A . 2 ILE CG2 1 1 6 1806 1 1 2 ILE H H -8.829 5.677 1.508 1.00 . A A . 2 ILE H 1 1 6 1807 1 1 2 ILE HA H -7.844 6.751 4.060 1.00 . A A . 2 ILE HA 1 1 6 1808 1 1 2 ILE HB H -10.681 6.021 3.309 1.00 . A A . 2 ILE HB 1 1 6 1809 1 1 2 ILE HD11 H -11.717 8.842 4.081 1.00 . A A . 2 ILE HD11 1 1 6 1810 1 1 2 ILE HD12 H -12.152 8.002 2.592 1.00 . A A . 2 ILE HD12 1 1 6 1811 1 1 2 ILE HD13 H -11.430 9.608 2.519 1.00 . A A . 2 ILE HD13 1 1 6 1812 1 1 2 ILE HG12 H -9.367 8.746 3.449 1.00 . A A . 2 ILE HG12 1 1 6 1813 1 1 2 ILE HG13 H -9.797 7.902 1.964 1.00 . A A . 2 ILE HG13 1 1 6 1814 1 1 2 ILE HG21 H -9.569 7.536 5.673 1.00 . A A . 2 ILE HG21 1 1 6 1815 1 1 2 ILE HG22 H -10.276 5.920 5.706 1.00 . A A . 2 ILE HG22 1 1 6 1816 1 1 2 ILE HG23 H -11.281 7.317 5.315 1.00 . A A . 2 ILE HG23 1 1 6 1817 1 1 2 ILE N N -8.175 6.017 2.159 1.00 . A A . 2 ILE N 1 1 6 1818 1 1 2 ILE O O -7.633 4.443 5.031 1.00 . A A . 2 ILE O 1 1 6 1819 1 1 3 GLY C C -9.629 1.473 3.273 1.00 . A A . 3 GLY C 1 1 6 1820 1 1 3 GLY CA C -9.475 2.520 4.358 1.00 . A A . 3 GLY CA 1 1 6 1821 1 1 3 GLY H H -10.135 4.160 3.198 1.00 . A A . 3 GLY H 1 1 6 1822 1 1 3 GLY HA2 H -8.559 2.333 4.894 1.00 . A A . 3 GLY HA2 1 1 6 1823 1 1 3 GLY HA3 H -10.305 2.434 5.043 1.00 . A A . 3 GLY HA3 1 1 6 1824 1 1 3 GLY N N -9.442 3.868 3.829 1.00 . A A . 3 GLY N 1 1 6 1825 1 1 3 GLY O O -9.142 0.350 3.407 1.00 . A A . 3 GLY O 1 1 6 1826 1 1 4 LYS C C -9.306 0.806 0.211 1.00 . A A . 4 LYS C 1 1 6 1827 1 1 4 LYS CA C -10.530 0.894 1.101 1.00 . A A . 4 LYS CA 1 1 6 1828 1 1 4 LYS CB C -11.767 1.284 0.289 1.00 . A A . 4 LYS CB 1 1 6 1829 1 1 4 LYS CD C -14.273 1.528 0.229 1.00 . A A . 4 LYS CD 1 1 6 1830 1 1 4 LYS CE C -15.558 1.451 1.038 1.00 . A A . 4 LYS CE 1 1 6 1831 1 1 4 LYS CG C -13.058 1.251 1.096 1.00 . A A . 4 LYS CG 1 1 6 1832 1 1 4 LYS H H -10.629 2.753 2.110 1.00 . A A . 4 LYS H 1 1 6 1833 1 1 4 LYS HA H -10.692 -0.073 1.548 1.00 . A A . 4 LYS HA 1 1 6 1834 1 1 4 LYS HB2 H -11.630 2.284 -0.095 1.00 . A A . 4 LYS HB2 1 1 6 1835 1 1 4 LYS HB3 H -11.869 0.600 -0.540 1.00 . A A . 4 LYS HB3 1 1 6 1836 1 1 4 LYS HD2 H -14.185 2.517 -0.195 1.00 . A A . 4 LYS HD2 1 1 6 1837 1 1 4 LYS HD3 H -14.314 0.796 -0.565 1.00 . A A . 4 LYS HD3 1 1 6 1838 1 1 4 LYS HE2 H -15.604 0.491 1.529 1.00 . A A . 4 LYS HE2 1 1 6 1839 1 1 4 LYS HE3 H -15.549 2.234 1.781 1.00 . A A . 4 LYS HE3 1 1 6 1840 1 1 4 LYS HG2 H -13.165 0.275 1.544 1.00 . A A . 4 LYS HG2 1 1 6 1841 1 1 4 LYS HG3 H -13.004 2.002 1.872 1.00 . A A . 4 LYS HG3 1 1 6 1842 1 1 4 LYS HZ1 H -16.718 2.520 -0.330 1.00 . A A . 4 LYS HZ1 1 1 6 1843 1 1 4 LYS HZ2 H -17.628 1.594 0.764 1.00 . A A . 4 LYS HZ2 1 1 6 1844 1 1 4 LYS HZ3 H -16.811 0.835 -0.512 1.00 . A A . 4 LYS HZ3 1 1 6 1845 1 1 4 LYS N N -10.294 1.836 2.186 1.00 . A A . 4 LYS N 1 1 6 1846 1 1 4 LYS NZ N -16.760 1.611 0.181 1.00 . A A . 4 LYS NZ 1 1 6 1847 1 1 4 LYS O O -8.905 -0.279 -0.208 1.00 . A A . 4 LYS O 1 1 6 1848 1 1 5 PHE C C -6.283 1.700 0.261 1.00 . A A . 5 PHE C 1 1 6 1849 1 1 5 PHE CA C -7.408 1.973 -0.735 1.00 . A A . 5 PHE CA 1 1 6 1850 1 1 5 PHE CB C -7.186 3.313 -1.438 1.00 . A A . 5 PHE CB 1 1 6 1851 1 1 5 PHE CD1 C -9.320 4.054 -2.540 1.00 . A A . 5 PHE CD1 1 1 6 1852 1 1 5 PHE CD2 C -7.587 3.156 -3.908 1.00 . A A . 5 PHE CD2 1 1 6 1853 1 1 5 PHE CE1 C -10.112 4.233 -3.658 1.00 . A A . 5 PHE CE1 1 1 6 1854 1 1 5 PHE CE2 C -8.374 3.334 -5.029 1.00 . A A . 5 PHE CE2 1 1 6 1855 1 1 5 PHE CG C -8.049 3.513 -2.654 1.00 . A A . 5 PHE CG 1 1 6 1856 1 1 5 PHE CZ C -9.638 3.871 -4.904 1.00 . A A . 5 PHE CZ 1 1 6 1857 1 1 5 PHE H H -9.109 2.797 0.220 1.00 . A A . 5 PHE H 1 1 6 1858 1 1 5 PHE HA H -7.416 1.182 -1.472 1.00 . A A . 5 PHE HA 1 1 6 1859 1 1 5 PHE HB2 H -7.400 4.110 -0.746 1.00 . A A . 5 PHE HB2 1 1 6 1860 1 1 5 PHE HB3 H -6.153 3.379 -1.748 1.00 . A A . 5 PHE HB3 1 1 6 1861 1 1 5 PHE HD1 H -9.691 4.337 -1.565 1.00 . A A . 5 PHE HD1 1 1 6 1862 1 1 5 PHE HD2 H -6.595 2.737 -4.009 1.00 . A A . 5 PHE HD2 1 1 6 1863 1 1 5 PHE HE1 H -11.099 4.656 -3.557 1.00 . A A . 5 PHE HE1 1 1 6 1864 1 1 5 PHE HE2 H -8.000 3.051 -6.002 1.00 . A A . 5 PHE HE2 1 1 6 1865 1 1 5 PHE HZ H -10.255 4.010 -5.777 1.00 . A A . 5 PHE HZ 1 1 6 1866 1 1 5 PHE N N -8.689 1.949 -0.048 1.00 . A A . 5 PHE N 1 1 6 1867 1 1 5 PHE O O -5.128 2.041 0.029 1.00 . A A . 5 PHE O 1 1 6 1868 1 1 6 LEU C C -5.863 -0.840 2.605 1.00 . A A . 6 LEU C 1 1 6 1869 1 1 6 LEU CA C -5.699 0.662 2.393 1.00 . A A . 6 LEU CA 1 1 6 1870 1 1 6 LEU CB C -5.938 1.410 3.712 1.00 . A A . 6 LEU CB 1 1 6 1871 1 1 6 LEU CD1 C -3.598 1.674 4.575 1.00 . A A . 6 LEU CD1 1 1 6 1872 1 1 6 LEU CD2 C -5.524 1.549 6.179 1.00 . A A . 6 LEU CD2 1 1 6 1873 1 1 6 LEU CG C -4.971 1.073 4.845 1.00 . A A . 6 LEU CG 1 1 6 1874 1 1 6 LEU H H -7.615 0.961 1.552 1.00 . A A . 6 LEU H 1 1 6 1875 1 1 6 LEU HA H -4.703 0.867 2.036 1.00 . A A . 6 LEU HA 1 1 6 1876 1 1 6 LEU HB2 H -5.871 2.471 3.516 1.00 . A A . 6 LEU HB2 1 1 6 1877 1 1 6 LEU HB3 H -6.939 1.187 4.049 1.00 . A A . 6 LEU HB3 1 1 6 1878 1 1 6 LEU HD11 H -3.196 1.258 3.662 1.00 . A A . 6 LEU HD11 1 1 6 1879 1 1 6 LEU HD12 H -2.936 1.445 5.397 1.00 . A A . 6 LEU HD12 1 1 6 1880 1 1 6 LEU HD13 H -3.686 2.746 4.473 1.00 . A A . 6 LEU HD13 1 1 6 1881 1 1 6 LEU HD21 H -6.494 1.104 6.343 1.00 . A A . 6 LEU HD21 1 1 6 1882 1 1 6 LEU HD22 H -5.618 2.625 6.169 1.00 . A A . 6 LEU HD22 1 1 6 1883 1 1 6 LEU HD23 H -4.855 1.253 6.973 1.00 . A A . 6 LEU HD23 1 1 6 1884 1 1 6 LEU HG H -4.855 0.000 4.895 1.00 . A A . 6 LEU HG 1 1 6 1885 1 1 6 LEU N N -6.655 1.105 1.387 1.00 . A A . 6 LEU N 1 1 6 1886 1 1 6 LEU O O -5.040 -1.499 3.237 1.00 . A A . 6 LEU O 1 1 6 1887 1 1 7 HIS C C -6.358 -3.694 1.476 1.00 . A A . 7 HIS C 1 1 6 1888 1 1 7 HIS CA C -7.306 -2.766 2.230 1.00 . A A . 7 HIS CA 1 1 6 1889 1 1 7 HIS CB C -8.751 -2.972 1.768 1.00 . A A . 7 HIS CB 1 1 6 1890 1 1 7 HIS CD2 C -8.991 -5.139 3.188 1.00 . A A . 7 HIS CD2 1 1 6 1891 1 1 7 HIS CE1 C -10.918 -5.806 2.399 1.00 . A A . 7 HIS CE1 1 1 6 1892 1 1 7 HIS CG C -9.387 -4.237 2.256 1.00 . A A . 7 HIS CG 1 1 6 1893 1 1 7 HIS H H -7.487 -0.815 1.448 1.00 . A A . 7 HIS H 1 1 6 1894 1 1 7 HIS HA H -7.239 -2.981 3.284 1.00 . A A . 7 HIS HA 1 1 6 1895 1 1 7 HIS HB2 H -9.351 -2.148 2.121 1.00 . A A . 7 HIS HB2 1 1 6 1896 1 1 7 HIS HB3 H -8.774 -2.984 0.687 1.00 . A A . 7 HIS HB3 1 1 6 1897 1 1 7 HIS HD1 H -11.157 -4.233 1.102 1.00 . A A . 7 HIS HD1 1 1 6 1898 1 1 7 HIS HD2 H -8.081 -5.103 3.767 1.00 . A A . 7 HIS HD2 1 1 6 1899 1 1 7 HIS HE1 H -11.811 -6.385 2.224 1.00 . A A . 7 HIS HE1 1 1 6 1900 1 1 7 HIS HE2 H -10.079 -6.728 4.017 1.00 . A A . 7 HIS HE2 1 1 6 1901 1 1 7 HIS N N -6.933 -1.374 2.031 1.00 . A A . 7 HIS N 1 1 6 1902 1 1 7 HIS ND1 N -10.597 -4.686 1.783 1.00 . A A . 7 HIS ND1 1 1 6 1903 1 1 7 HIS NE2 N -9.963 -6.107 3.258 1.00 . A A . 7 HIS NE2 1 1 6 1904 1 1 7 HIS O O -5.521 -4.365 2.080 1.00 . A A . 7 HIS O 1 1 6 1905 1 1 8 SER C C -4.364 -3.852 -1.079 1.00 . A A . 8 SER C 1 1 6 1906 1 1 8 SER CA C -5.636 -4.572 -0.660 1.00 . A A . 8 SER CA 1 1 6 1907 1 1 8 SER CB C -6.407 -5.027 -1.888 1.00 . A A . 8 SER CB 1 1 6 1908 1 1 8 SER H H -7.160 -3.164 -0.281 1.00 . A A . 8 SER H 1 1 6 1909 1 1 8 SER HA H -5.364 -5.432 -0.070 1.00 . A A . 8 SER HA 1 1 6 1910 1 1 8 SER HB2 H -5.710 -5.413 -2.617 1.00 . A A . 8 SER HB2 1 1 6 1911 1 1 8 SER HB3 H -7.111 -5.799 -1.611 1.00 . A A . 8 SER HB3 1 1 6 1912 1 1 8 SER HG H -7.047 -3.969 -3.419 1.00 . A A . 8 SER HG 1 1 6 1913 1 1 8 SER N N -6.479 -3.719 0.158 1.00 . A A . 8 SER N 1 1 6 1914 1 1 8 SER O O -3.349 -4.485 -1.382 1.00 . A A . 8 SER O 1 1 6 1915 1 1 8 SER OG O -7.118 -3.938 -2.453 1.00 . A A . 8 SER OG 1 1 6 1916 1 1 9 ALA C C -2.172 -1.920 -0.324 1.00 . A A . 9 ALA C 1 1 6 1917 1 1 9 ALA CA C -3.249 -1.714 -1.379 1.00 . A A . 9 ALA CA 1 1 6 1918 1 1 9 ALA CB C -3.627 -0.247 -1.481 1.00 . A A . 9 ALA CB 1 1 6 1919 1 1 9 ALA H H -5.262 -2.083 -0.856 1.00 . A A . 9 ALA H 1 1 6 1920 1 1 9 ALA HA H -2.864 -2.033 -2.338 1.00 . A A . 9 ALA HA 1 1 6 1921 1 1 9 ALA HB1 H -4.388 -0.123 -2.238 1.00 . A A . 9 ALA HB1 1 1 6 1922 1 1 9 ALA HB2 H -2.756 0.332 -1.747 1.00 . A A . 9 ALA HB2 1 1 6 1923 1 1 9 ALA HB3 H -4.008 0.093 -0.527 1.00 . A A . 9 ALA HB3 1 1 6 1924 1 1 9 ALA N N -4.416 -2.525 -1.069 1.00 . A A . 9 ALA N 1 1 6 1925 1 1 9 ALA O O -1.017 -1.545 -0.512 1.00 . A A . 9 ALA O 1 1 6 1926 1 1 10 LYS C C -1.633 -4.392 2.062 1.00 . A A . 10 LYS C 1 1 6 1927 1 1 10 LYS CA C -1.608 -2.893 1.823 1.00 . A A . 10 LYS CA 1 1 6 1928 1 1 10 LYS CB C -1.879 -2.124 3.114 1.00 . A A . 10 LYS CB 1 1 6 1929 1 1 10 LYS CD C 0.063 -0.596 2.726 1.00 . A A . 10 LYS CD 1 1 6 1930 1 1 10 LYS CE C 0.555 0.841 2.655 1.00 . A A . 10 LYS CE 1 1 6 1931 1 1 10 LYS CG C -1.418 -0.678 3.054 1.00 . A A . 10 LYS CG 1 1 6 1932 1 1 10 LYS H H -3.509 -2.762 0.905 1.00 . A A . 10 LYS H 1 1 6 1933 1 1 10 LYS HA H -0.623 -2.626 1.461 1.00 . A A . 10 LYS HA 1 1 6 1934 1 1 10 LYS HB2 H -2.941 -2.136 3.313 1.00 . A A . 10 LYS HB2 1 1 6 1935 1 1 10 LYS HB3 H -1.363 -2.611 3.928 1.00 . A A . 10 LYS HB3 1 1 6 1936 1 1 10 LYS HD2 H 0.617 -1.116 3.493 1.00 . A A . 10 LYS HD2 1 1 6 1937 1 1 10 LYS HD3 H 0.234 -1.075 1.773 1.00 . A A . 10 LYS HD3 1 1 6 1938 1 1 10 LYS HE2 H 1.596 0.834 2.372 1.00 . A A . 10 LYS HE2 1 1 6 1939 1 1 10 LYS HE3 H -0.017 1.368 1.904 1.00 . A A . 10 LYS HE3 1 1 6 1940 1 1 10 LYS HG2 H -1.978 -0.161 2.290 1.00 . A A . 10 LYS HG2 1 1 6 1941 1 1 10 LYS HG3 H -1.593 -0.212 4.013 1.00 . A A . 10 LYS HG3 1 1 6 1942 1 1 10 LYS HZ1 H 0.995 2.412 3.959 1.00 . A A . 10 LYS HZ1 1 1 6 1943 1 1 10 LYS HZ2 H 0.725 0.932 4.740 1.00 . A A . 10 LYS HZ2 1 1 6 1944 1 1 10 LYS HZ3 H -0.580 1.812 4.114 1.00 . A A . 10 LYS HZ3 1 1 6 1945 1 1 10 LYS N N -2.559 -2.535 0.786 1.00 . A A . 10 LYS N 1 1 6 1946 1 1 10 LYS NZ N 0.413 1.546 3.957 1.00 . A A . 10 LYS NZ 1 1 6 1947 1 1 10 LYS O O -1.251 -4.875 3.124 1.00 . A A . 10 LYS O 1 1 6 1948 1 1 11 LYS C C -1.014 -6.988 0.001 1.00 . A A . 11 LYS C 1 1 6 1949 1 1 11 LYS CA C -2.008 -6.572 1.076 1.00 . A A . 11 LYS CA 1 1 6 1950 1 1 11 LYS CB C -3.373 -7.220 0.830 1.00 . A A . 11 LYS CB 1 1 6 1951 1 1 11 LYS CD C -3.063 -9.100 2.461 1.00 . A A . 11 LYS CD 1 1 6 1952 1 1 11 LYS CE C -2.987 -10.605 2.649 1.00 . A A . 11 LYS CE 1 1 6 1953 1 1 11 LYS CG C -3.377 -8.729 1.021 1.00 . A A . 11 LYS CG 1 1 6 1954 1 1 11 LYS H H -2.553 -4.680 0.311 1.00 . A A . 11 LYS H 1 1 6 1955 1 1 11 LYS HA H -1.632 -6.878 2.042 1.00 . A A . 11 LYS HA 1 1 6 1956 1 1 11 LYS HB2 H -4.089 -6.792 1.514 1.00 . A A . 11 LYS HB2 1 1 6 1957 1 1 11 LYS HB3 H -3.682 -7.007 -0.182 1.00 . A A . 11 LYS HB3 1 1 6 1958 1 1 11 LYS HD2 H -2.114 -8.666 2.739 1.00 . A A . 11 LYS HD2 1 1 6 1959 1 1 11 LYS HD3 H -3.840 -8.705 3.100 1.00 . A A . 11 LYS HD3 1 1 6 1960 1 1 11 LYS HE2 H -2.846 -10.815 3.699 1.00 . A A . 11 LYS HE2 1 1 6 1961 1 1 11 LYS HE3 H -3.917 -11.042 2.317 1.00 . A A . 11 LYS HE3 1 1 6 1962 1 1 11 LYS HG2 H -4.353 -9.112 0.765 1.00 . A A . 11 LYS HG2 1 1 6 1963 1 1 11 LYS HG3 H -2.632 -9.169 0.373 1.00 . A A . 11 LYS HG3 1 1 6 1964 1 1 11 LYS HZ1 H -2.017 -11.087 0.855 1.00 . A A . 11 LYS HZ1 1 1 6 1965 1 1 11 LYS HZ2 H -1.801 -12.230 2.089 1.00 . A A . 11 LYS HZ2 1 1 6 1966 1 1 11 LYS HZ3 H -0.961 -10.757 2.144 1.00 . A A . 11 LYS HZ3 1 1 6 1967 1 1 11 LYS N N -2.113 -5.125 1.071 1.00 . A A . 11 LYS N 1 1 6 1968 1 1 11 LYS NZ N -1.866 -11.211 1.881 1.00 . A A . 11 LYS NZ 1 1 6 1969 1 1 11 LYS O O 0.037 -7.553 0.292 1.00 . A A . 11 LYS O 1 1 6 1970 1 1 12 PHE C C 0.515 -5.740 -2.500 1.00 . A A . 12 PHE C 1 1 6 1971 1 1 12 PHE CA C -0.447 -6.907 -2.362 1.00 . A A . 12 PHE CA 1 1 6 1972 1 1 12 PHE CB C -1.243 -7.092 -3.661 1.00 . A A . 12 PHE CB 1 1 6 1973 1 1 12 PHE CD1 C -1.649 -9.530 -4.092 1.00 . A A . 12 PHE CD1 1 1 6 1974 1 1 12 PHE CD2 C -3.447 -8.213 -3.241 1.00 . A A . 12 PHE CD2 1 1 6 1975 1 1 12 PHE CE1 C -2.464 -10.646 -4.097 1.00 . A A . 12 PHE CE1 1 1 6 1976 1 1 12 PHE CE2 C -4.266 -9.324 -3.242 1.00 . A A . 12 PHE CE2 1 1 6 1977 1 1 12 PHE CG C -2.132 -8.303 -3.664 1.00 . A A . 12 PHE CG 1 1 6 1978 1 1 12 PHE CZ C -3.775 -10.542 -3.670 1.00 . A A . 12 PHE CZ 1 1 6 1979 1 1 12 PHE H H -2.207 -6.232 -1.409 1.00 . A A . 12 PHE H 1 1 6 1980 1 1 12 PHE HA H 0.115 -7.809 -2.154 1.00 . A A . 12 PHE HA 1 1 6 1981 1 1 12 PHE HB2 H -1.868 -6.226 -3.819 1.00 . A A . 12 PHE HB2 1 1 6 1982 1 1 12 PHE HB3 H -0.552 -7.185 -4.488 1.00 . A A . 12 PHE HB3 1 1 6 1983 1 1 12 PHE HD1 H -0.624 -9.611 -4.427 1.00 . A A . 12 PHE HD1 1 1 6 1984 1 1 12 PHE HD2 H -3.832 -7.261 -2.907 1.00 . A A . 12 PHE HD2 1 1 6 1985 1 1 12 PHE HE1 H -2.077 -11.597 -4.431 1.00 . A A . 12 PHE HE1 1 1 6 1986 1 1 12 PHE HE2 H -5.290 -9.241 -2.909 1.00 . A A . 12 PHE HE2 1 1 6 1987 1 1 12 PHE HZ H -4.413 -11.415 -3.671 1.00 . A A . 12 PHE HZ 1 1 6 1988 1 1 12 PHE N N -1.342 -6.659 -1.241 1.00 . A A . 12 PHE N 1 1 6 1989 1 1 12 PHE O O 1.668 -5.902 -2.892 1.00 . A A . 12 PHE O 1 1 6 1990 1 1 13 GLY C C 1.710 -3.251 -0.937 1.00 . A A . 13 GLY C 1 1 6 1991 1 1 13 GLY CA C 0.855 -3.371 -2.177 1.00 . A A . 13 GLY CA 1 1 6 1992 1 1 13 GLY H H -0.912 -4.488 -1.872 1.00 . A A . 13 GLY H 1 1 6 1993 1 1 13 GLY HA2 H 1.498 -3.414 -3.043 1.00 . A A . 13 GLY HA2 1 1 6 1994 1 1 13 GLY HA3 H 0.222 -2.501 -2.252 1.00 . A A . 13 GLY HA3 1 1 6 1995 1 1 13 GLY N N 0.026 -4.557 -2.148 1.00 . A A . 13 GLY N 1 1 6 1996 1 1 13 GLY O O 2.486 -2.308 -0.796 1.00 . A A . 13 GLY O 1 1 6 1997 1 1 14 LYS C C 3.850 -4.358 0.838 1.00 . A A . 14 LYS C 1 1 6 1998 1 1 14 LYS CA C 2.364 -4.248 1.183 1.00 . A A . 14 LYS CA 1 1 6 1999 1 1 14 LYS CB C 1.932 -5.429 2.061 1.00 . A A . 14 LYS CB 1 1 6 2000 1 1 14 LYS CD C 2.184 -6.688 4.216 1.00 . A A . 14 LYS CD 1 1 6 2001 1 1 14 LYS CE C 3.085 -6.951 5.410 1.00 . A A . 14 LYS CE 1 1 6 2002 1 1 14 LYS CG C 2.735 -5.574 3.343 1.00 . A A . 14 LYS CG 1 1 6 2003 1 1 14 LYS H H 0.913 -4.921 -0.199 1.00 . A A . 14 LYS H 1 1 6 2004 1 1 14 LYS HA H 2.197 -3.326 1.718 1.00 . A A . 14 LYS HA 1 1 6 2005 1 1 14 LYS HB2 H 0.893 -5.304 2.326 1.00 . A A . 14 LYS HB2 1 1 6 2006 1 1 14 LYS HB3 H 2.040 -6.340 1.492 1.00 . A A . 14 LYS HB3 1 1 6 2007 1 1 14 LYS HD2 H 1.203 -6.406 4.571 1.00 . A A . 14 LYS HD2 1 1 6 2008 1 1 14 LYS HD3 H 2.108 -7.591 3.627 1.00 . A A . 14 LYS HD3 1 1 6 2009 1 1 14 LYS HE2 H 3.214 -6.029 5.957 1.00 . A A . 14 LYS HE2 1 1 6 2010 1 1 14 LYS HE3 H 2.615 -7.684 6.048 1.00 . A A . 14 LYS HE3 1 1 6 2011 1 1 14 LYS HG2 H 3.760 -5.801 3.092 1.00 . A A . 14 LYS HG2 1 1 6 2012 1 1 14 LYS HG3 H 2.693 -4.646 3.892 1.00 . A A . 14 LYS HG3 1 1 6 2013 1 1 14 LYS HZ1 H 4.322 -8.382 4.518 1.00 . A A . 14 LYS HZ1 1 1 6 2014 1 1 14 LYS HZ2 H 5.042 -7.561 5.821 1.00 . A A . 14 LYS HZ2 1 1 6 2015 1 1 14 LYS HZ3 H 4.865 -6.786 4.326 1.00 . A A . 14 LYS HZ3 1 1 6 2016 1 1 14 LYS N N 1.568 -4.212 -0.036 1.00 . A A . 14 LYS N 1 1 6 2017 1 1 14 LYS NZ N 4.419 -7.455 4.991 1.00 . A A . 14 LYS NZ 1 1 6 2018 1 1 14 LYS O O 4.703 -3.790 1.516 1.00 . A A . 14 LYS O 1 1 6 2019 1 1 15 ALA C C 5.824 -4.274 -1.849 1.00 . A A . 15 ALA C 1 1 6 2020 1 1 15 ALA CA C 5.518 -5.230 -0.701 1.00 . A A . 15 ALA CA 1 1 6 2021 1 1 15 ALA CB C 5.762 -6.676 -1.117 1.00 . A A . 15 ALA CB 1 1 6 2022 1 1 15 ALA H H 3.420 -5.478 -0.758 1.00 . A A . 15 ALA H 1 1 6 2023 1 1 15 ALA HA H 6.172 -5.001 0.127 1.00 . A A . 15 ALA HA 1 1 6 2024 1 1 15 ALA HB1 H 6.795 -6.798 -1.407 1.00 . A A . 15 ALA HB1 1 1 6 2025 1 1 15 ALA HB2 H 5.122 -6.925 -1.948 1.00 . A A . 15 ALA HB2 1 1 6 2026 1 1 15 ALA HB3 H 5.542 -7.327 -0.285 1.00 . A A . 15 ALA HB3 1 1 6 2027 1 1 15 ALA N N 4.146 -5.063 -0.247 1.00 . A A . 15 ALA N 1 1 6 2028 1 1 15 ALA O O 6.690 -4.539 -2.681 1.00 . A A . 15 ALA O 1 1 6 2029 1 1 16 PHE C C 5.223 -0.755 -2.358 1.00 . A A . 16 PHE C 1 1 6 2030 1 1 16 PHE CA C 5.308 -2.166 -2.932 1.00 . A A . 16 PHE CA 1 1 6 2031 1 1 16 PHE CB C 4.275 -2.348 -4.049 1.00 . A A . 16 PHE CB 1 1 6 2032 1 1 16 PHE CD1 C 5.481 -1.670 -6.143 1.00 . A A . 16 PHE CD1 1 1 6 2033 1 1 16 PHE CD2 C 3.668 -0.316 -5.387 1.00 . A A . 16 PHE CD2 1 1 6 2034 1 1 16 PHE CE1 C 5.667 -0.825 -7.219 1.00 . A A . 16 PHE CE1 1 1 6 2035 1 1 16 PHE CE2 C 3.850 0.534 -6.460 1.00 . A A . 16 PHE CE2 1 1 6 2036 1 1 16 PHE CG C 4.480 -1.425 -5.216 1.00 . A A . 16 PHE CG 1 1 6 2037 1 1 16 PHE CZ C 4.851 0.279 -7.379 1.00 . A A . 16 PHE CZ 1 1 6 2038 1 1 16 PHE H H 4.424 -3.000 -1.200 1.00 . A A . 16 PHE H 1 1 6 2039 1 1 16 PHE HA H 6.296 -2.314 -3.342 1.00 . A A . 16 PHE HA 1 1 6 2040 1 1 16 PHE HB2 H 4.330 -3.362 -4.418 1.00 . A A . 16 PHE HB2 1 1 6 2041 1 1 16 PHE HB3 H 3.287 -2.169 -3.651 1.00 . A A . 16 PHE HB3 1 1 6 2042 1 1 16 PHE HD1 H 6.119 -2.532 -6.018 1.00 . A A . 16 PHE HD1 1 1 6 2043 1 1 16 PHE HD2 H 2.887 -0.117 -4.667 1.00 . A A . 16 PHE HD2 1 1 6 2044 1 1 16 PHE HE1 H 6.450 -1.028 -7.934 1.00 . A A . 16 PHE HE1 1 1 6 2045 1 1 16 PHE HE2 H 3.210 1.394 -6.581 1.00 . A A . 16 PHE HE2 1 1 6 2046 1 1 16 PHE HZ H 4.994 0.939 -8.222 1.00 . A A . 16 PHE HZ 1 1 6 2047 1 1 16 PHE N N 5.106 -3.158 -1.890 1.00 . A A . 16 PHE N 1 1 6 2048 1 1 16 PHE O O 6.184 0.011 -2.425 1.00 . A A . 16 PHE O 1 1 6 2049 1 1 17 VAL C C 4.698 1.211 -0.050 1.00 . A A . 17 VAL C 1 1 6 2050 1 1 17 VAL CA C 3.838 0.926 -1.275 1.00 . A A . 17 VAL CA 1 1 6 2051 1 1 17 VAL CB C 2.348 1.143 -0.931 1.00 . A A . 17 VAL CB 1 1 6 2052 1 1 17 VAL CG1 C 2.088 2.582 -0.513 1.00 . A A . 17 VAL CG1 1 1 6 2053 1 1 17 VAL CG2 C 1.468 0.756 -2.110 1.00 . A A . 17 VAL CG2 1 1 6 2054 1 1 17 VAL H H 3.398 -1.119 -1.622 1.00 . A A . 17 VAL H 1 1 6 2055 1 1 17 VAL HA H 4.115 1.614 -2.062 1.00 . A A . 17 VAL HA 1 1 6 2056 1 1 17 VAL HB H 2.096 0.500 -0.100 1.00 . A A . 17 VAL HB 1 1 6 2057 1 1 17 VAL HG11 H 1.035 2.715 -0.320 1.00 . A A . 17 VAL HG11 1 1 6 2058 1 1 17 VAL HG12 H 2.398 3.250 -1.305 1.00 . A A . 17 VAL HG12 1 1 6 2059 1 1 17 VAL HG13 H 2.648 2.802 0.384 1.00 . A A . 17 VAL HG13 1 1 6 2060 1 1 17 VAL HG21 H 1.604 -0.292 -2.332 1.00 . A A . 17 VAL HG21 1 1 6 2061 1 1 17 VAL HG22 H 1.742 1.346 -2.972 1.00 . A A . 17 VAL HG22 1 1 6 2062 1 1 17 VAL HG23 H 0.432 0.940 -1.863 1.00 . A A . 17 VAL HG23 1 1 6 2063 1 1 17 VAL N N 4.086 -0.426 -1.762 1.00 . A A . 17 VAL N 1 1 6 2064 1 1 17 VAL O O 5.205 2.321 0.130 1.00 . A A . 17 VAL O 1 1 6 2065 1 1 18 GLY C C 7.183 0.500 1.640 1.00 . A A . 18 GLY C 1 1 6 2066 1 1 18 GLY CA C 5.709 0.312 1.951 1.00 . A A . 18 GLY CA 1 1 6 2067 1 1 18 GLY H H 4.473 -0.677 0.554 1.00 . A A . 18 GLY H 1 1 6 2068 1 1 18 GLY HA2 H 5.363 1.161 2.522 1.00 . A A . 18 GLY HA2 1 1 6 2069 1 1 18 GLY HA3 H 5.589 -0.580 2.546 1.00 . A A . 18 GLY HA3 1 1 6 2070 1 1 18 GLY N N 4.895 0.183 0.760 1.00 . A A . 18 GLY N 1 1 6 2071 1 1 18 GLY O O 7.988 0.727 2.544 1.00 . A A . 18 GLY O 1 1 6 2072 1 1 19 GLU C C 9.105 1.725 -1.000 1.00 . A A . 19 GLU C 1 1 6 2073 1 1 19 GLU CA C 8.933 0.549 -0.042 1.00 . A A . 19 GLU CA 1 1 6 2074 1 1 19 GLU CB C 9.443 -0.739 -0.690 1.00 . A A . 19 GLU CB 1 1 6 2075 1 1 19 GLU CD C 9.987 -3.180 -0.331 1.00 . A A . 19 GLU CD 1 1 6 2076 1 1 19 GLU CG C 9.249 -1.963 0.185 1.00 . A A . 19 GLU CG 1 1 6 2077 1 1 19 GLU H H 6.857 0.233 -0.314 1.00 . A A . 19 GLU H 1 1 6 2078 1 1 19 GLU HA H 9.513 0.745 0.847 1.00 . A A . 19 GLU HA 1 1 6 2079 1 1 19 GLU HB2 H 8.912 -0.897 -1.617 1.00 . A A . 19 GLU HB2 1 1 6 2080 1 1 19 GLU HB3 H 10.498 -0.634 -0.900 1.00 . A A . 19 GLU HB3 1 1 6 2081 1 1 19 GLU HG2 H 9.606 -1.740 1.181 1.00 . A A . 19 GLU HG2 1 1 6 2082 1 1 19 GLU HG3 H 8.195 -2.190 0.226 1.00 . A A . 19 GLU HG3 1 1 6 2083 1 1 19 GLU N N 7.543 0.405 0.366 1.00 . A A . 19 GLU N 1 1 6 2084 1 1 19 GLU O O 10.161 2.364 -1.025 1.00 . A A . 19 GLU O 1 1 6 2085 1 1 19 GLU OE1 O 9.632 -3.687 -1.413 1.00 . A A . 19 GLU OE1 1 1 6 2086 1 1 19 GLU OE2 O 10.937 -3.632 0.346 1.00 . A A . 19 GLU OE2 1 1 6 2087 1 1 20 ILE C C 8.099 4.462 -1.961 1.00 . A A . 20 ILE C 1 1 6 2088 1 1 20 ILE CA C 8.109 3.131 -2.717 1.00 . A A . 20 ILE CA 1 1 6 2089 1 1 20 ILE CB C 6.934 3.079 -3.731 1.00 . A A . 20 ILE CB 1 1 6 2090 1 1 20 ILE CD1 C 8.383 3.824 -5.686 1.00 . A A . 20 ILE CD1 1 1 6 2091 1 1 20 ILE CG1 C 7.144 4.090 -4.858 1.00 . A A . 20 ILE CG1 1 1 6 2092 1 1 20 ILE CG2 C 5.604 3.334 -3.041 1.00 . A A . 20 ILE CG2 1 1 6 2093 1 1 20 ILE H H 7.263 1.452 -1.741 1.00 . A A . 20 ILE H 1 1 6 2094 1 1 20 ILE HA H 9.036 3.057 -3.271 1.00 . A A . 20 ILE HA 1 1 6 2095 1 1 20 ILE HB H 6.903 2.086 -4.154 1.00 . A A . 20 ILE HB 1 1 6 2096 1 1 20 ILE HD11 H 8.333 2.826 -6.095 1.00 . A A . 20 ILE HD11 1 1 6 2097 1 1 20 ILE HD12 H 9.258 3.912 -5.058 1.00 . A A . 20 ILE HD12 1 1 6 2098 1 1 20 ILE HD13 H 8.443 4.541 -6.492 1.00 . A A . 20 ILE HD13 1 1 6 2099 1 1 20 ILE HG12 H 6.291 4.065 -5.521 1.00 . A A . 20 ILE HG12 1 1 6 2100 1 1 20 ILE HG13 H 7.234 5.078 -4.430 1.00 . A A . 20 ILE HG13 1 1 6 2101 1 1 20 ILE HG21 H 5.629 4.299 -2.555 1.00 . A A . 20 ILE HG21 1 1 6 2102 1 1 20 ILE HG22 H 5.428 2.565 -2.304 1.00 . A A . 20 ILE HG22 1 1 6 2103 1 1 20 ILE HG23 H 4.811 3.322 -3.773 1.00 . A A . 20 ILE HG23 1 1 6 2104 1 1 20 ILE N N 8.068 2.013 -1.781 1.00 . A A . 20 ILE N 1 1 6 2105 1 1 20 ILE O O 8.597 5.473 -2.449 1.00 . A A . 20 ILE O 1 1 6 2106 1 1 21 MET C C 8.833 5.712 0.922 1.00 . A A . 21 MET C 1 1 6 2107 1 1 21 MET CA C 7.547 5.637 0.095 1.00 . A A . 21 MET CA 1 1 6 2108 1 1 21 MET CB C 6.309 5.633 0.996 1.00 . A A . 21 MET CB 1 1 6 2109 1 1 21 MET CE C 5.458 9.692 1.522 1.00 . A A . 21 MET CE 1 1 6 2110 1 1 21 MET CG C 6.022 6.979 1.648 1.00 . A A . 21 MET CG 1 1 6 2111 1 1 21 MET H H 7.177 3.612 -0.402 1.00 . A A . 21 MET H 1 1 6 2112 1 1 21 MET HA H 7.505 6.499 -0.557 1.00 . A A . 21 MET HA 1 1 6 2113 1 1 21 MET HB2 H 5.452 5.355 0.402 1.00 . A A . 21 MET HB2 1 1 6 2114 1 1 21 MET HB3 H 6.449 4.899 1.776 1.00 . A A . 21 MET HB3 1 1 6 2115 1 1 21 MET HE1 H 6.347 9.883 2.105 1.00 . A A . 21 MET HE1 1 1 6 2116 1 1 21 MET HE2 H 4.636 9.470 2.185 1.00 . A A . 21 MET HE2 1 1 6 2117 1 1 21 MET HE3 H 5.220 10.564 0.931 1.00 . A A . 21 MET HE3 1 1 6 2118 1 1 21 MET HG2 H 5.143 6.884 2.265 1.00 . A A . 21 MET HG2 1 1 6 2119 1 1 21 MET HG3 H 6.865 7.252 2.266 1.00 . A A . 21 MET HG3 1 1 6 2120 1 1 21 MET N N 7.568 4.444 -0.743 1.00 . A A . 21 MET N 1 1 6 2121 1 1 21 MET O O 8.835 6.116 2.086 1.00 . A A . 21 MET O 1 1 6 2122 1 1 21 MET SD S 5.742 8.293 0.440 1.00 . A A . 21 MET SD 1 1 6 2123 1 1 22 ASN C C 12.263 5.755 -0.157 1.00 . A A . 22 ASN C 1 1 6 2124 1 1 22 ASN CA C 11.247 5.372 0.910 1.00 . A A . 22 ASN CA 1 1 6 2125 1 1 22 ASN CB C 11.637 4.036 1.554 1.00 . A A . 22 ASN CB 1 1 6 2126 1 1 22 ASN CG C 12.993 4.083 2.242 1.00 . A A . 22 ASN CG 1 1 6 2127 1 1 22 ASN H H 9.842 4.919 -0.598 1.00 . A A . 22 ASN H 1 1 6 2128 1 1 22 ASN HA H 11.221 6.141 1.668 1.00 . A A . 22 ASN HA 1 1 6 2129 1 1 22 ASN HB2 H 10.892 3.770 2.290 1.00 . A A . 22 ASN HB2 1 1 6 2130 1 1 22 ASN HB3 H 11.668 3.271 0.791 1.00 . A A . 22 ASN HB3 1 1 6 2131 1 1 22 ASN HD21 H 13.905 3.507 0.575 1.00 . A A . 22 ASN HD21 1 1 6 2132 1 1 22 ASN HD22 H 14.933 3.784 1.935 1.00 . A A . 22 ASN HD22 1 1 6 2133 1 1 22 ASN N N 9.926 5.291 0.305 1.00 . A A . 22 ASN N 1 1 6 2134 1 1 22 ASN ND2 N 14.048 3.759 1.510 1.00 . A A . 22 ASN ND2 1 1 6 2135 1 1 22 ASN O O 12.907 6.804 -0.076 1.00 . A A . 22 ASN O 1 1 6 2136 1 1 22 ASN OD1 O 13.093 4.402 3.426 1.00 . A A . 22 ASN OD1 1 1 6 2137 1 1 23 SER C C 12.775 4.362 -3.516 1.00 . A A . 23 SER C 1 1 6 2138 1 1 23 SER CA C 13.268 5.143 -2.301 1.00 . A A . 23 SER CA 1 1 6 2139 1 1 23 SER CB C 14.711 4.747 -1.971 1.00 . A A . 23 SER CB 1 1 6 2140 1 1 23 SER H H 11.866 4.067 -1.146 1.00 . A A . 23 SER H 1 1 6 2141 1 1 23 SER HA H 13.230 6.201 -2.523 1.00 . A A . 23 SER HA 1 1 6 2142 1 1 23 SER HB2 H 14.743 3.699 -1.707 1.00 . A A . 23 SER HB2 1 1 6 2143 1 1 23 SER HB3 H 15.333 4.917 -2.837 1.00 . A A . 23 SER HB3 1 1 6 2144 1 1 23 SER HG H 14.524 6.093 -0.555 1.00 . A A . 23 SER HG 1 1 6 2145 1 1 23 SER N N 12.389 4.896 -1.163 1.00 . A A . 23 SER N 1 1 6 2146 1 1 23 SER O O 13.177 3.188 -3.676 1.00 . A A . 23 SER O 1 1 6 2147 1 1 23 SER OXT O 11.959 4.912 -4.284 1.00 . A A . 23 SER OXT 1 1 6 2148 1 1 23 SER OG O 15.217 5.506 -0.885 1.00 . A A . 23 SER OG 1 1 7 2149 1 1 1 GLY C C -8.776 3.705 -1.324 1.00 . A A . 1 GLY C 1 1 7 2150 1 1 1 GLY CA C -8.990 2.953 -2.615 1.00 . A A . 1 GLY CA 1 1 7 2151 1 1 1 GLY H1 H -7.988 4.299 -3.856 1.00 . A A . 1 GLY H1 1 1 7 2152 1 1 1 GLY H2 H -8.112 2.730 -4.495 1.00 . A A . 1 GLY H2 1 1 7 2153 1 1 1 GLY H3 H -7.003 3.055 -3.251 1.00 . A A . 1 GLY H3 1 1 7 2154 1 1 1 GLY HA2 H -9.961 3.209 -3.012 1.00 . A A . 1 GLY HA2 1 1 7 2155 1 1 1 GLY HA3 H -8.961 1.894 -2.410 1.00 . A A . 1 GLY HA3 1 1 7 2156 1 1 1 GLY N N -7.953 3.281 -3.624 1.00 . A A . 1 GLY N 1 1 7 2157 1 1 1 GLY O O -7.639 3.910 -0.906 1.00 . A A . 1 GLY O 1 1 7 2158 1 1 2 ILE C C -10.758 4.389 1.592 1.00 . A A . 2 ILE C 1 1 7 2159 1 1 2 ILE CA C -9.762 4.883 0.544 1.00 . A A . 2 ILE CA 1 1 7 2160 1 1 2 ILE CB C -9.977 6.393 0.274 1.00 . A A . 2 ILE CB 1 1 7 2161 1 1 2 ILE CD1 C -8.245 7.108 2.001 1.00 . A A . 2 ILE CD1 1 1 7 2162 1 1 2 ILE CG1 C -9.678 7.221 1.526 1.00 . A A . 2 ILE CG1 1 1 7 2163 1 1 2 ILE CG2 C -11.393 6.662 -0.222 1.00 . A A . 2 ILE CG2 1 1 7 2164 1 1 2 ILE H H -10.745 3.903 -1.059 1.00 . A A . 2 ILE H 1 1 7 2165 1 1 2 ILE HA H -8.765 4.749 0.931 1.00 . A A . 2 ILE HA 1 1 7 2166 1 1 2 ILE HB H -9.294 6.688 -0.509 1.00 . A A . 2 ILE HB 1 1 7 2167 1 1 2 ILE HD11 H -8.111 7.717 2.883 1.00 . A A . 2 ILE HD11 1 1 7 2168 1 1 2 ILE HD12 H -7.580 7.449 1.222 1.00 . A A . 2 ILE HD12 1 1 7 2169 1 1 2 ILE HD13 H -8.025 6.076 2.237 1.00 . A A . 2 ILE HD13 1 1 7 2170 1 1 2 ILE HG12 H -9.875 8.261 1.314 1.00 . A A . 2 ILE HG12 1 1 7 2171 1 1 2 ILE HG13 H -10.322 6.893 2.329 1.00 . A A . 2 ILE HG13 1 1 7 2172 1 1 2 ILE HG21 H -11.516 7.721 -0.397 1.00 . A A . 2 ILE HG21 1 1 7 2173 1 1 2 ILE HG22 H -12.105 6.335 0.521 1.00 . A A . 2 ILE HG22 1 1 7 2174 1 1 2 ILE HG23 H -11.562 6.125 -1.144 1.00 . A A . 2 ILE HG23 1 1 7 2175 1 1 2 ILE N N -9.862 4.115 -0.687 1.00 . A A . 2 ILE N 1 1 7 2176 1 1 2 ILE O O -10.566 4.584 2.795 1.00 . A A . 2 ILE O 1 1 7 2177 1 1 3 GLY C C -12.492 1.871 2.589 1.00 . A A . 3 GLY C 1 1 7 2178 1 1 3 GLY CA C -12.822 3.244 2.055 1.00 . A A . 3 GLY CA 1 1 7 2179 1 1 3 GLY H H -11.913 3.578 0.179 1.00 . A A . 3 GLY H 1 1 7 2180 1 1 3 GLY HA2 H -12.909 3.930 2.882 1.00 . A A . 3 GLY HA2 1 1 7 2181 1 1 3 GLY HA3 H -13.769 3.198 1.538 1.00 . A A . 3 GLY HA3 1 1 7 2182 1 1 3 GLY N N -11.814 3.733 1.140 1.00 . A A . 3 GLY N 1 1 7 2183 1 1 3 GLY O O -12.218 1.703 3.781 1.00 . A A . 3 GLY O 1 1 7 2184 1 1 4 LYS C C -11.092 -1.103 1.373 1.00 . A A . 4 LYS C 1 1 7 2185 1 1 4 LYS CA C -12.267 -0.488 2.111 1.00 . A A . 4 LYS CA 1 1 7 2186 1 1 4 LYS CB C -13.533 -1.328 1.904 1.00 . A A . 4 LYS CB 1 1 7 2187 1 1 4 LYS CD C -15.246 -2.255 0.322 1.00 . A A . 4 LYS CD 1 1 7 2188 1 1 4 LYS CE C -15.790 -2.244 -1.099 1.00 . A A . 4 LYS CE 1 1 7 2189 1 1 4 LYS CG C -14.041 -1.342 0.469 1.00 . A A . 4 LYS CG 1 1 7 2190 1 1 4 LYS H H -12.625 1.105 0.754 1.00 . A A . 4 LYS H 1 1 7 2191 1 1 4 LYS HA H -12.026 -0.472 3.160 1.00 . A A . 4 LYS HA 1 1 7 2192 1 1 4 LYS HB2 H -13.327 -2.345 2.198 1.00 . A A . 4 LYS HB2 1 1 7 2193 1 1 4 LYS HB3 H -14.316 -0.933 2.533 1.00 . A A . 4 LYS HB3 1 1 7 2194 1 1 4 LYS HD2 H -14.953 -3.263 0.578 1.00 . A A . 4 LYS HD2 1 1 7 2195 1 1 4 LYS HD3 H -16.022 -1.922 0.997 1.00 . A A . 4 LYS HD3 1 1 7 2196 1 1 4 LYS HE2 H -16.652 -2.889 -1.143 1.00 . A A . 4 LYS HE2 1 1 7 2197 1 1 4 LYS HE3 H -16.085 -1.234 -1.348 1.00 . A A . 4 LYS HE3 1 1 7 2198 1 1 4 LYS HG2 H -14.324 -0.338 0.187 1.00 . A A . 4 LYS HG2 1 1 7 2199 1 1 4 LYS HG3 H -13.251 -1.693 -0.178 1.00 . A A . 4 LYS HG3 1 1 7 2200 1 1 4 LYS HZ1 H -14.436 -3.664 -1.834 1.00 . A A . 4 LYS HZ1 1 1 7 2201 1 1 4 LYS HZ2 H -13.976 -2.057 -2.128 1.00 . A A . 4 LYS HZ2 1 1 7 2202 1 1 4 LYS HZ3 H -15.214 -2.766 -3.042 1.00 . A A . 4 LYS HZ3 1 1 7 2203 1 1 4 LYS N N -12.488 0.892 1.703 1.00 . A A . 4 LYS N 1 1 7 2204 1 1 4 LYS NZ N -14.786 -2.713 -2.092 1.00 . A A . 4 LYS NZ 1 1 7 2205 1 1 4 LYS O O -10.482 -2.055 1.856 1.00 . A A . 4 LYS O 1 1 7 2206 1 1 5 PHE C C -8.315 -0.704 0.196 1.00 . A A . 5 PHE C 1 1 7 2207 1 1 5 PHE CA C -9.614 -1.026 -0.538 1.00 . A A . 5 PHE CA 1 1 7 2208 1 1 5 PHE CB C -9.608 -0.413 -1.944 1.00 . A A . 5 PHE CB 1 1 7 2209 1 1 5 PHE CD1 C -8.758 -2.249 -3.425 1.00 . A A . 5 PHE CD1 1 1 7 2210 1 1 5 PHE CD2 C -7.408 -0.302 -3.153 1.00 . A A . 5 PHE CD2 1 1 7 2211 1 1 5 PHE CE1 C -7.806 -2.794 -4.265 1.00 . A A . 5 PHE CE1 1 1 7 2212 1 1 5 PHE CE2 C -6.454 -0.842 -3.992 1.00 . A A . 5 PHE CE2 1 1 7 2213 1 1 5 PHE CG C -8.568 -1.001 -2.857 1.00 . A A . 5 PHE CG 1 1 7 2214 1 1 5 PHE CZ C -6.654 -2.088 -4.552 1.00 . A A . 5 PHE CZ 1 1 7 2215 1 1 5 PHE H H -11.264 0.228 -0.114 1.00 . A A . 5 PHE H 1 1 7 2216 1 1 5 PHE HA H -9.710 -2.101 -0.624 1.00 . A A . 5 PHE HA 1 1 7 2217 1 1 5 PHE HB2 H -10.574 -0.567 -2.403 1.00 . A A . 5 PHE HB2 1 1 7 2218 1 1 5 PHE HB3 H -9.419 0.649 -1.866 1.00 . A A . 5 PHE HB3 1 1 7 2219 1 1 5 PHE HD1 H -9.659 -2.801 -3.201 1.00 . A A . 5 PHE HD1 1 1 7 2220 1 1 5 PHE HD2 H -7.251 0.672 -2.715 1.00 . A A . 5 PHE HD2 1 1 7 2221 1 1 5 PHE HE1 H -7.965 -3.770 -4.700 1.00 . A A . 5 PHE HE1 1 1 7 2222 1 1 5 PHE HE2 H -5.554 -0.287 -4.213 1.00 . A A . 5 PHE HE2 1 1 7 2223 1 1 5 PHE HZ H -5.911 -2.513 -5.211 1.00 . A A . 5 PHE HZ 1 1 7 2224 1 1 5 PHE N N -10.746 -0.536 0.226 1.00 . A A . 5 PHE N 1 1 7 2225 1 1 5 PHE O O -7.257 -1.210 -0.149 1.00 . A A . 5 PHE O 1 1 7 2226 1 1 6 LEU C C -6.712 -0.657 2.833 1.00 . A A . 6 LEU C 1 1 7 2227 1 1 6 LEU CA C -7.236 0.518 2.015 1.00 . A A . 6 LEU CA 1 1 7 2228 1 1 6 LEU CB C -7.582 1.700 2.929 1.00 . A A . 6 LEU CB 1 1 7 2229 1 1 6 LEU CD1 C -5.386 2.909 2.740 1.00 . A A . 6 LEU CD1 1 1 7 2230 1 1 6 LEU CD2 C -6.908 3.355 4.681 1.00 . A A . 6 LEU CD2 1 1 7 2231 1 1 6 LEU CG C -6.407 2.308 3.698 1.00 . A A . 6 LEU CG 1 1 7 2232 1 1 6 LEU H H -9.304 0.436 1.517 1.00 . A A . 6 LEU H 1 1 7 2233 1 1 6 LEU HA H -6.465 0.818 1.319 1.00 . A A . 6 LEU HA 1 1 7 2234 1 1 6 LEU HB2 H -8.024 2.476 2.321 1.00 . A A . 6 LEU HB2 1 1 7 2235 1 1 6 LEU HB3 H -8.318 1.369 3.647 1.00 . A A . 6 LEU HB3 1 1 7 2236 1 1 6 LEU HD11 H -5.854 3.691 2.161 1.00 . A A . 6 LEU HD11 1 1 7 2237 1 1 6 LEU HD12 H -5.022 2.139 2.077 1.00 . A A . 6 LEU HD12 1 1 7 2238 1 1 6 LEU HD13 H -4.560 3.322 3.303 1.00 . A A . 6 LEU HD13 1 1 7 2239 1 1 6 LEU HD21 H -7.585 2.891 5.385 1.00 . A A . 6 LEU HD21 1 1 7 2240 1 1 6 LEU HD22 H -7.425 4.135 4.144 1.00 . A A . 6 LEU HD22 1 1 7 2241 1 1 6 LEU HD23 H -6.071 3.779 5.215 1.00 . A A . 6 LEU HD23 1 1 7 2242 1 1 6 LEU HG H -5.914 1.530 4.262 1.00 . A A . 6 LEU HG 1 1 7 2243 1 1 6 LEU N N -8.412 0.113 1.244 1.00 . A A . 6 LEU N 1 1 7 2244 1 1 6 LEU O O -5.571 -0.658 3.296 1.00 . A A . 6 LEU O 1 1 7 2245 1 1 7 HIS C C -6.210 -3.703 2.772 1.00 . A A . 7 HIS C 1 1 7 2246 1 1 7 HIS CA C -7.158 -2.899 3.657 1.00 . A A . 7 HIS CA 1 1 7 2247 1 1 7 HIS CB C -8.386 -3.752 4.014 1.00 . A A . 7 HIS CB 1 1 7 2248 1 1 7 HIS CD2 C -9.965 -2.076 5.220 1.00 . A A . 7 HIS CD2 1 1 7 2249 1 1 7 HIS CE1 C -10.136 -3.124 7.131 1.00 . A A . 7 HIS CE1 1 1 7 2250 1 1 7 HIS CG C -9.214 -3.199 5.135 1.00 . A A . 7 HIS CG 1 1 7 2251 1 1 7 HIS H H -8.457 -1.601 2.609 1.00 . A A . 7 HIS H 1 1 7 2252 1 1 7 HIS HA H -6.641 -2.624 4.565 1.00 . A A . 7 HIS HA 1 1 7 2253 1 1 7 HIS HB2 H -9.020 -3.833 3.145 1.00 . A A . 7 HIS HB2 1 1 7 2254 1 1 7 HIS HB3 H -8.053 -4.738 4.302 1.00 . A A . 7 HIS HB3 1 1 7 2255 1 1 7 HIS HD1 H -8.940 -4.700 6.599 1.00 . A A . 7 HIS HD1 1 1 7 2256 1 1 7 HIS HD2 H -10.100 -1.335 4.444 1.00 . A A . 7 HIS HD2 1 1 7 2257 1 1 7 HIS HE1 H -10.424 -3.385 8.141 1.00 . A A . 7 HIS HE1 1 1 7 2258 1 1 7 HIS HE2 H -11.283 -1.474 6.747 1.00 . A A . 7 HIS HE2 1 1 7 2259 1 1 7 HIS N N -7.552 -1.674 2.979 1.00 . A A . 7 HIS N 1 1 7 2260 1 1 7 HIS ND1 N -9.349 -3.833 6.349 1.00 . A A . 7 HIS ND1 1 1 7 2261 1 1 7 HIS NE2 N -10.526 -2.051 6.473 1.00 . A A . 7 HIS NE2 1 1 7 2262 1 1 7 HIS O O -5.453 -4.540 3.259 1.00 . A A . 7 HIS O 1 1 7 2263 1 1 8 SER C C -4.448 -3.220 -0.177 1.00 . A A . 8 SER C 1 1 7 2264 1 1 8 SER CA C -5.432 -4.147 0.521 1.00 . A A . 8 SER CA 1 1 7 2265 1 1 8 SER CB C -6.324 -4.838 -0.497 1.00 . A A . 8 SER CB 1 1 7 2266 1 1 8 SER H H -6.882 -2.765 1.137 1.00 . A A . 8 SER H 1 1 7 2267 1 1 8 SER HA H -4.870 -4.885 1.063 1.00 . A A . 8 SER HA 1 1 7 2268 1 1 8 SER HB2 H -6.854 -4.094 -1.075 1.00 . A A . 8 SER HB2 1 1 7 2269 1 1 8 SER HB3 H -5.718 -5.436 -1.149 1.00 . A A . 8 SER HB3 1 1 7 2270 1 1 8 SER HG H -6.857 -6.531 0.349 1.00 . A A . 8 SER HG 1 1 7 2271 1 1 8 SER N N -6.257 -3.437 1.471 1.00 . A A . 8 SER N 1 1 7 2272 1 1 8 SER O O -3.442 -3.679 -0.722 1.00 . A A . 8 SER O 1 1 7 2273 1 1 8 SER OG O -7.270 -5.673 0.150 1.00 . A A . 8 SER OG 1 1 7 2274 1 1 9 ALA C C -2.456 -1.042 -0.033 1.00 . A A . 9 ALA C 1 1 7 2275 1 1 9 ALA CA C -3.825 -0.917 -0.683 1.00 . A A . 9 ALA CA 1 1 7 2276 1 1 9 ALA CB C -4.386 0.480 -0.469 1.00 . A A . 9 ALA CB 1 1 7 2277 1 1 9 ALA H H -5.591 -1.631 0.235 1.00 . A A . 9 ALA H 1 1 7 2278 1 1 9 ALA HA H -3.729 -1.087 -1.745 1.00 . A A . 9 ALA HA 1 1 7 2279 1 1 9 ALA HB1 H -5.385 0.532 -0.875 1.00 . A A . 9 ALA HB1 1 1 7 2280 1 1 9 ALA HB2 H -3.757 1.199 -0.969 1.00 . A A . 9 ALA HB2 1 1 7 2281 1 1 9 ALA HB3 H -4.415 0.699 0.588 1.00 . A A . 9 ALA HB3 1 1 7 2282 1 1 9 ALA N N -4.731 -1.921 -0.143 1.00 . A A . 9 ALA N 1 1 7 2283 1 1 9 ALA O O -1.435 -0.680 -0.618 1.00 . A A . 9 ALA O 1 1 7 2284 1 1 10 LYS C C -1.114 -3.330 2.240 1.00 . A A . 10 LYS C 1 1 7 2285 1 1 10 LYS CA C -1.193 -1.859 1.864 1.00 . A A . 10 LYS CA 1 1 7 2286 1 1 10 LYS CB C -0.988 -0.961 3.089 1.00 . A A . 10 LYS CB 1 1 7 2287 1 1 10 LYS CD C -1.759 -0.165 5.334 1.00 . A A . 10 LYS CD 1 1 7 2288 1 1 10 LYS CE C -1.215 1.222 5.004 1.00 . A A . 10 LYS CE 1 1 7 2289 1 1 10 LYS CG C -2.143 -0.933 4.074 1.00 . A A . 10 LYS CG 1 1 7 2290 1 1 10 LYS H H -3.302 -1.805 1.618 1.00 . A A . 10 LYS H 1 1 7 2291 1 1 10 LYS HA H -0.399 -1.654 1.158 1.00 . A A . 10 LYS HA 1 1 7 2292 1 1 10 LYS HB2 H -0.110 -1.300 3.617 1.00 . A A . 10 LYS HB2 1 1 7 2293 1 1 10 LYS HB3 H -0.814 0.051 2.746 1.00 . A A . 10 LYS HB3 1 1 7 2294 1 1 10 LYS HD2 H -2.632 -0.059 5.959 1.00 . A A . 10 LYS HD2 1 1 7 2295 1 1 10 LYS HD3 H -1.000 -0.722 5.865 1.00 . A A . 10 LYS HD3 1 1 7 2296 1 1 10 LYS HE2 H -0.411 1.117 4.292 1.00 . A A . 10 LYS HE2 1 1 7 2297 1 1 10 LYS HE3 H -2.008 1.811 4.564 1.00 . A A . 10 LYS HE3 1 1 7 2298 1 1 10 LYS HG2 H -2.990 -0.451 3.609 1.00 . A A . 10 LYS HG2 1 1 7 2299 1 1 10 LYS HG3 H -2.403 -1.948 4.343 1.00 . A A . 10 LYS HG3 1 1 7 2300 1 1 10 LYS HZ1 H -1.480 2.095 6.885 1.00 . A A . 10 LYS HZ1 1 1 7 2301 1 1 10 LYS HZ2 H -0.283 2.843 5.942 1.00 . A A . 10 LYS HZ2 1 1 7 2302 1 1 10 LYS HZ3 H 0.028 1.348 6.684 1.00 . A A . 10 LYS HZ3 1 1 7 2303 1 1 10 LYS N N -2.444 -1.577 1.182 1.00 . A A . 10 LYS N 1 1 7 2304 1 1 10 LYS NZ N -0.702 1.926 6.210 1.00 . A A . 10 LYS NZ 1 1 7 2305 1 1 10 LYS O O -0.605 -3.697 3.298 1.00 . A A . 10 LYS O 1 1 7 2306 1 1 11 LYS C C -0.836 -6.130 0.190 1.00 . A A . 11 LYS C 1 1 7 2307 1 1 11 LYS CA C -1.462 -5.604 1.473 1.00 . A A . 11 LYS CA 1 1 7 2308 1 1 11 LYS CB C -2.800 -6.297 1.744 1.00 . A A . 11 LYS CB 1 1 7 2309 1 1 11 LYS CD C -1.809 -8.067 3.232 1.00 . A A . 11 LYS CD 1 1 7 2310 1 1 11 LYS CE C -2.471 -7.595 4.521 1.00 . A A . 11 LYS CE 1 1 7 2311 1 1 11 LYS CG C -2.673 -7.790 2.012 1.00 . A A . 11 LYS CG 1 1 7 2312 1 1 11 LYS H H -2.156 -3.807 0.605 1.00 . A A . 11 LYS H 1 1 7 2313 1 1 11 LYS HA H -0.786 -5.793 2.297 1.00 . A A . 11 LYS HA 1 1 7 2314 1 1 11 LYS HB2 H -3.260 -5.839 2.607 1.00 . A A . 11 LYS HB2 1 1 7 2315 1 1 11 LYS HB3 H -3.443 -6.161 0.887 1.00 . A A . 11 LYS HB3 1 1 7 2316 1 1 11 LYS HD2 H -1.632 -9.129 3.300 1.00 . A A . 11 LYS HD2 1 1 7 2317 1 1 11 LYS HD3 H -0.866 -7.552 3.111 1.00 . A A . 11 LYS HD3 1 1 7 2318 1 1 11 LYS HE2 H -1.742 -7.634 5.316 1.00 . A A . 11 LYS HE2 1 1 7 2319 1 1 11 LYS HE3 H -2.803 -6.574 4.388 1.00 . A A . 11 LYS HE3 1 1 7 2320 1 1 11 LYS HG2 H -3.657 -8.201 2.182 1.00 . A A . 11 LYS HG2 1 1 7 2321 1 1 11 LYS HG3 H -2.227 -8.264 1.150 1.00 . A A . 11 LYS HG3 1 1 7 2322 1 1 11 LYS HZ1 H -4.331 -8.466 4.117 1.00 . A A . 11 LYS HZ1 1 1 7 2323 1 1 11 LYS HZ2 H -4.103 -8.052 5.742 1.00 . A A . 11 LYS HZ2 1 1 7 2324 1 1 11 LYS HZ3 H -3.324 -9.413 5.099 1.00 . A A . 11 LYS HZ3 1 1 7 2325 1 1 11 LYS N N -1.634 -4.167 1.358 1.00 . A A . 11 LYS N 1 1 7 2326 1 1 11 LYS NZ N -3.639 -8.438 4.894 1.00 . A A . 11 LYS NZ 1 1 7 2327 1 1 11 LYS O O 0.063 -6.972 0.216 1.00 . A A . 11 LYS O 1 1 7 2328 1 1 12 PHE C C 0.364 -4.937 -2.567 1.00 . A A . 12 PHE C 1 1 7 2329 1 1 12 PHE CA C -0.725 -5.940 -2.227 1.00 . A A . 12 PHE CA 1 1 7 2330 1 1 12 PHE CB C -1.793 -5.935 -3.321 1.00 . A A . 12 PHE CB 1 1 7 2331 1 1 12 PHE CD1 C -2.608 -8.307 -3.384 1.00 . A A . 12 PHE CD1 1 1 7 2332 1 1 12 PHE CD2 C -4.128 -6.606 -2.699 1.00 . A A . 12 PHE CD2 1 1 7 2333 1 1 12 PHE CE1 C -3.592 -9.261 -3.210 1.00 . A A . 12 PHE CE1 1 1 7 2334 1 1 12 PHE CE2 C -5.117 -7.556 -2.524 1.00 . A A . 12 PHE CE2 1 1 7 2335 1 1 12 PHE CG C -2.864 -6.971 -3.130 1.00 . A A . 12 PHE CG 1 1 7 2336 1 1 12 PHE CZ C -4.848 -8.886 -2.779 1.00 . A A . 12 PHE CZ 1 1 7 2337 1 1 12 PHE H H -2.050 -4.969 -0.904 1.00 . A A . 12 PHE H 1 1 7 2338 1 1 12 PHE HA H -0.290 -6.926 -2.155 1.00 . A A . 12 PHE HA 1 1 7 2339 1 1 12 PHE HB2 H -2.271 -4.969 -3.341 1.00 . A A . 12 PHE HB2 1 1 7 2340 1 1 12 PHE HB3 H -1.322 -6.115 -4.275 1.00 . A A . 12 PHE HB3 1 1 7 2341 1 1 12 PHE HD1 H -1.625 -8.603 -3.723 1.00 . A A . 12 PHE HD1 1 1 7 2342 1 1 12 PHE HD2 H -4.340 -5.566 -2.500 1.00 . A A . 12 PHE HD2 1 1 7 2343 1 1 12 PHE HE1 H -3.377 -10.300 -3.412 1.00 . A A . 12 PHE HE1 1 1 7 2344 1 1 12 PHE HE2 H -6.098 -7.257 -2.185 1.00 . A A . 12 PHE HE2 1 1 7 2345 1 1 12 PHE HZ H -5.619 -9.631 -2.645 1.00 . A A . 12 PHE HZ 1 1 7 2346 1 1 12 PHE N N -1.301 -5.604 -0.938 1.00 . A A . 12 PHE N 1 1 7 2347 1 1 12 PHE O O 1.513 -5.306 -2.813 1.00 . A A . 12 PHE O 1 1 7 2348 1 1 13 GLY C C 1.881 -2.309 -1.680 1.00 . A A . 13 GLY C 1 1 7 2349 1 1 13 GLY CA C 0.938 -2.599 -2.832 1.00 . A A . 13 GLY CA 1 1 7 2350 1 1 13 GLY H H -0.939 -3.434 -2.333 1.00 . A A . 13 GLY H 1 1 7 2351 1 1 13 GLY HA2 H 1.522 -2.878 -3.698 1.00 . A A . 13 GLY HA2 1 1 7 2352 1 1 13 GLY HA3 H 0.384 -1.702 -3.059 1.00 . A A . 13 GLY HA3 1 1 7 2353 1 1 13 GLY N N -0.003 -3.661 -2.537 1.00 . A A . 13 GLY N 1 1 7 2354 1 1 13 GLY O O 2.737 -1.434 -1.779 1.00 . A A . 13 GLY O 1 1 7 2355 1 1 14 LYS C C 4.051 -3.068 0.236 1.00 . A A . 14 LYS C 1 1 7 2356 1 1 14 LYS CA C 2.577 -2.886 0.588 1.00 . A A . 14 LYS CA 1 1 7 2357 1 1 14 LYS CB C 2.169 -3.886 1.671 1.00 . A A . 14 LYS CB 1 1 7 2358 1 1 14 LYS CD C 2.440 -4.713 4.023 1.00 . A A . 14 LYS CD 1 1 7 2359 1 1 14 LYS CE C 3.285 -4.677 5.285 1.00 . A A . 14 LYS CE 1 1 7 2360 1 1 14 LYS CG C 2.972 -3.770 2.958 1.00 . A A . 14 LYS CG 1 1 7 2361 1 1 14 LYS H H 1.047 -3.754 -0.590 1.00 . A A . 14 LYS H 1 1 7 2362 1 1 14 LYS HA H 2.428 -1.883 0.959 1.00 . A A . 14 LYS HA 1 1 7 2363 1 1 14 LYS HB2 H 1.127 -3.731 1.911 1.00 . A A . 14 LYS HB2 1 1 7 2364 1 1 14 LYS HB3 H 2.294 -4.887 1.285 1.00 . A A . 14 LYS HB3 1 1 7 2365 1 1 14 LYS HD2 H 1.428 -4.425 4.272 1.00 . A A . 14 LYS HD2 1 1 7 2366 1 1 14 LYS HD3 H 2.441 -5.718 3.629 1.00 . A A . 14 LYS HD3 1 1 7 2367 1 1 14 LYS HE2 H 3.352 -3.656 5.626 1.00 . A A . 14 LYS HE2 1 1 7 2368 1 1 14 LYS HE3 H 2.799 -5.276 6.042 1.00 . A A . 14 LYS HE3 1 1 7 2369 1 1 14 LYS HG2 H 4.002 -4.018 2.752 1.00 . A A . 14 LYS HG2 1 1 7 2370 1 1 14 LYS HG3 H 2.908 -2.754 3.322 1.00 . A A . 14 LYS HG3 1 1 7 2371 1 1 14 LYS HZ1 H 4.614 -6.166 4.663 1.00 . A A . 14 LYS HZ1 1 1 7 2372 1 1 14 LYS HZ2 H 5.183 -5.233 5.957 1.00 . A A . 14 LYS HZ2 1 1 7 2373 1 1 14 LYS HZ3 H 5.170 -4.589 4.389 1.00 . A A . 14 LYS HZ3 1 1 7 2374 1 1 14 LYS N N 1.737 -3.061 -0.595 1.00 . A A . 14 LYS N 1 1 7 2375 1 1 14 LYS NZ N 4.656 -5.202 5.058 1.00 . A A . 14 LYS NZ 1 1 7 2376 1 1 14 LYS O O 4.908 -2.303 0.680 1.00 . A A . 14 LYS O 1 1 7 2377 1 1 15 ALA C C 6.170 -3.443 -2.109 1.00 . A A . 15 ALA C 1 1 7 2378 1 1 15 ALA CA C 5.693 -4.376 -1.002 1.00 . A A . 15 ALA CA 1 1 7 2379 1 1 15 ALA CB C 5.789 -5.826 -1.453 1.00 . A A . 15 ALA CB 1 1 7 2380 1 1 15 ALA H H 3.587 -4.574 -0.993 1.00 . A A . 15 ALA H 1 1 7 2381 1 1 15 ALA HA H 6.328 -4.248 -0.135 1.00 . A A . 15 ALA HA 1 1 7 2382 1 1 15 ALA HB1 H 6.817 -6.061 -1.691 1.00 . A A . 15 ALA HB1 1 1 7 2383 1 1 15 ALA HB2 H 5.175 -5.971 -2.330 1.00 . A A . 15 ALA HB2 1 1 7 2384 1 1 15 ALA HB3 H 5.445 -6.476 -0.660 1.00 . A A . 15 ALA HB3 1 1 7 2385 1 1 15 ALA N N 4.326 -4.055 -0.609 1.00 . A A . 15 ALA N 1 1 7 2386 1 1 15 ALA O O 7.233 -3.643 -2.697 1.00 . A A . 15 ALA O 1 1 7 2387 1 1 16 PHE C C 5.826 -0.058 -2.742 1.00 . A A . 16 PHE C 1 1 7 2388 1 1 16 PHE CA C 5.713 -1.431 -3.394 1.00 . A A . 16 PHE CA 1 1 7 2389 1 1 16 PHE CB C 4.674 -1.389 -4.518 1.00 . A A . 16 PHE CB 1 1 7 2390 1 1 16 PHE CD1 C 5.403 -2.853 -6.424 1.00 . A A . 16 PHE CD1 1 1 7 2391 1 1 16 PHE CD2 C 3.686 -3.652 -4.970 1.00 . A A . 16 PHE CD2 1 1 7 2392 1 1 16 PHE CE1 C 5.324 -4.017 -7.162 1.00 . A A . 16 PHE CE1 1 1 7 2393 1 1 16 PHE CE2 C 3.603 -4.819 -5.704 1.00 . A A . 16 PHE CE2 1 1 7 2394 1 1 16 PHE CG C 4.587 -2.659 -5.320 1.00 . A A . 16 PHE CG 1 1 7 2395 1 1 16 PHE CZ C 4.421 -5.000 -6.802 1.00 . A A . 16 PHE CZ 1 1 7 2396 1 1 16 PHE H H 4.502 -2.362 -1.939 1.00 . A A . 16 PHE H 1 1 7 2397 1 1 16 PHE HA H 6.673 -1.699 -3.810 1.00 . A A . 16 PHE HA 1 1 7 2398 1 1 16 PHE HB2 H 3.702 -1.201 -4.088 1.00 . A A . 16 PHE HB2 1 1 7 2399 1 1 16 PHE HB3 H 4.922 -0.584 -5.195 1.00 . A A . 16 PHE HB3 1 1 7 2400 1 1 16 PHE HD1 H 6.108 -2.083 -6.703 1.00 . A A . 16 PHE HD1 1 1 7 2401 1 1 16 PHE HD2 H 3.045 -3.508 -4.111 1.00 . A A . 16 PHE HD2 1 1 7 2402 1 1 16 PHE HE1 H 5.965 -4.156 -8.022 1.00 . A A . 16 PHE HE1 1 1 7 2403 1 1 16 PHE HE2 H 2.898 -5.584 -5.423 1.00 . A A . 16 PHE HE2 1 1 7 2404 1 1 16 PHE HZ H 4.358 -5.910 -7.379 1.00 . A A . 16 PHE HZ 1 1 7 2405 1 1 16 PHE N N 5.363 -2.434 -2.402 1.00 . A A . 16 PHE N 1 1 7 2406 1 1 16 PHE O O 6.870 0.594 -2.821 1.00 . A A . 16 PHE O 1 1 7 2407 1 1 17 VAL C C 5.652 1.787 -0.277 1.00 . A A . 17 VAL C 1 1 7 2408 1 1 17 VAL CA C 4.718 1.696 -1.477 1.00 . A A . 17 VAL CA 1 1 7 2409 1 1 17 VAL CB C 3.276 2.102 -1.070 1.00 . A A . 17 VAL CB 1 1 7 2410 1 1 17 VAL CG1 C 2.725 1.196 0.023 1.00 . A A . 17 VAL CG1 1 1 7 2411 1 1 17 VAL CG2 C 3.227 3.560 -0.637 1.00 . A A . 17 VAL CG2 1 1 7 2412 1 1 17 VAL H H 4.011 -0.259 -1.910 1.00 . A A . 17 VAL H 1 1 7 2413 1 1 17 VAL HA H 5.063 2.389 -2.232 1.00 . A A . 17 VAL HA 1 1 7 2414 1 1 17 VAL HB H 2.642 1.993 -1.939 1.00 . A A . 17 VAL HB 1 1 7 2415 1 1 17 VAL HG11 H 2.696 0.177 -0.336 1.00 . A A . 17 VAL HG11 1 1 7 2416 1 1 17 VAL HG12 H 1.727 1.513 0.286 1.00 . A A . 17 VAL HG12 1 1 7 2417 1 1 17 VAL HG13 H 3.361 1.252 0.892 1.00 . A A . 17 VAL HG13 1 1 7 2418 1 1 17 VAL HG21 H 3.881 3.706 0.210 1.00 . A A . 17 VAL HG21 1 1 7 2419 1 1 17 VAL HG22 H 2.216 3.822 -0.359 1.00 . A A . 17 VAL HG22 1 1 7 2420 1 1 17 VAL HG23 H 3.550 4.189 -1.453 1.00 . A A . 17 VAL HG23 1 1 7 2421 1 1 17 VAL N N 4.769 0.358 -2.052 1.00 . A A . 17 VAL N 1 1 7 2422 1 1 17 VAL O O 6.281 2.815 -0.036 1.00 . A A . 17 VAL O 1 1 7 2423 1 1 18 GLY C C 8.065 0.233 1.152 1.00 . A A . 18 GLY C 1 1 7 2424 1 1 18 GLY CA C 6.671 0.630 1.568 1.00 . A A . 18 GLY CA 1 1 7 2425 1 1 18 GLY H H 5.268 -0.115 0.182 1.00 . A A . 18 GLY H 1 1 7 2426 1 1 18 GLY HA2 H 6.701 1.603 2.039 1.00 . A A . 18 GLY HA2 1 1 7 2427 1 1 18 GLY HA3 H 6.292 -0.093 2.270 1.00 . A A . 18 GLY HA3 1 1 7 2428 1 1 18 GLY N N 5.781 0.681 0.434 1.00 . A A . 18 GLY N 1 1 7 2429 1 1 18 GLY O O 8.943 0.020 1.987 1.00 . A A . 18 GLY O 1 1 7 2430 1 1 19 GLU C C 10.264 0.824 -1.383 1.00 . A A . 19 GLU C 1 1 7 2431 1 1 19 GLU CA C 9.532 -0.320 -0.693 1.00 . A A . 19 GLU CA 1 1 7 2432 1 1 19 GLU CB C 9.278 -1.457 -1.682 1.00 . A A . 19 GLU CB 1 1 7 2433 1 1 19 GLU CD C 11.187 -2.912 -0.932 1.00 . A A . 19 GLU CD 1 1 7 2434 1 1 19 GLU CG C 10.526 -2.205 -2.094 1.00 . A A . 19 GLU CG 1 1 7 2435 1 1 19 GLU H H 7.547 0.386 -0.767 1.00 . A A . 19 GLU H 1 1 7 2436 1 1 19 GLU HA H 10.134 -0.686 0.124 1.00 . A A . 19 GLU HA 1 1 7 2437 1 1 19 GLU HB2 H 8.594 -2.163 -1.234 1.00 . A A . 19 GLU HB2 1 1 7 2438 1 1 19 GLU HB3 H 8.823 -1.045 -2.570 1.00 . A A . 19 GLU HB3 1 1 7 2439 1 1 19 GLU HG2 H 10.259 -2.940 -2.839 1.00 . A A . 19 GLU HG2 1 1 7 2440 1 1 19 GLU HG3 H 11.229 -1.503 -2.518 1.00 . A A . 19 GLU HG3 1 1 7 2441 1 1 19 GLU N N 8.269 0.138 -0.152 1.00 . A A . 19 GLU N 1 1 7 2442 1 1 19 GLU O O 11.393 1.158 -1.024 1.00 . A A . 19 GLU O 1 1 7 2443 1 1 19 GLU OE1 O 10.838 -4.084 -0.665 1.00 . A A . 19 GLU OE1 1 1 7 2444 1 1 19 GLU OE2 O 12.061 -2.305 -0.284 1.00 . A A . 19 GLU OE2 1 1 7 2445 1 1 20 ILE C C 10.301 3.803 -2.375 1.00 . A A . 20 ILE C 1 1 7 2446 1 1 20 ILE CA C 10.236 2.487 -3.149 1.00 . A A . 20 ILE CA 1 1 7 2447 1 1 20 ILE CB C 9.507 2.703 -4.502 1.00 . A A . 20 ILE CB 1 1 7 2448 1 1 20 ILE CD1 C 9.590 4.029 -6.684 1.00 . A A . 20 ILE CD1 1 1 7 2449 1 1 20 ILE CG1 C 10.242 3.750 -5.345 1.00 . A A . 20 ILE CG1 1 1 7 2450 1 1 20 ILE CG2 C 8.058 3.118 -4.280 1.00 . A A . 20 ILE CG2 1 1 7 2451 1 1 20 ILE H H 8.684 1.166 -2.566 1.00 . A A . 20 ILE H 1 1 7 2452 1 1 20 ILE HA H 11.246 2.169 -3.364 1.00 . A A . 20 ILE HA 1 1 7 2453 1 1 20 ILE HB H 9.506 1.764 -5.035 1.00 . A A . 20 ILE HB 1 1 7 2454 1 1 20 ILE HD11 H 10.173 4.761 -7.224 1.00 . A A . 20 ILE HD11 1 1 7 2455 1 1 20 ILE HD12 H 8.591 4.410 -6.527 1.00 . A A . 20 ILE HD12 1 1 7 2456 1 1 20 ILE HD13 H 9.539 3.114 -7.258 1.00 . A A . 20 ILE HD13 1 1 7 2457 1 1 20 ILE HG12 H 10.278 4.681 -4.800 1.00 . A A . 20 ILE HG12 1 1 7 2458 1 1 20 ILE HG13 H 11.249 3.407 -5.531 1.00 . A A . 20 ILE HG13 1 1 7 2459 1 1 20 ILE HG21 H 7.540 2.340 -3.738 1.00 . A A . 20 ILE HG21 1 1 7 2460 1 1 20 ILE HG22 H 7.579 3.271 -5.235 1.00 . A A . 20 ILE HG22 1 1 7 2461 1 1 20 ILE HG23 H 8.030 4.035 -3.711 1.00 . A A . 20 ILE HG23 1 1 7 2462 1 1 20 ILE N N 9.608 1.436 -2.361 1.00 . A A . 20 ILE N 1 1 7 2463 1 1 20 ILE O O 11.217 4.600 -2.567 1.00 . A A . 20 ILE O 1 1 7 2464 1 1 21 MET C C 10.268 5.205 0.451 1.00 . A A . 21 MET C 1 1 7 2465 1 1 21 MET CA C 9.304 5.272 -0.725 1.00 . A A . 21 MET CA 1 1 7 2466 1 1 21 MET CB C 7.888 5.570 -0.230 1.00 . A A . 21 MET CB 1 1 7 2467 1 1 21 MET CE C 5.989 6.872 -3.710 1.00 . A A . 21 MET CE 1 1 7 2468 1 1 21 MET CG C 6.874 5.722 -1.350 1.00 . A A . 21 MET CG 1 1 7 2469 1 1 21 MET H H 8.652 3.348 -1.336 1.00 . A A . 21 MET H 1 1 7 2470 1 1 21 MET HA H 9.619 6.069 -1.383 1.00 . A A . 21 MET HA 1 1 7 2471 1 1 21 MET HB2 H 7.567 4.763 0.410 1.00 . A A . 21 MET HB2 1 1 7 2472 1 1 21 MET HB3 H 7.901 6.487 0.339 1.00 . A A . 21 MET HB3 1 1 7 2473 1 1 21 MET HE1 H 5.872 5.865 -4.084 1.00 . A A . 21 MET HE1 1 1 7 2474 1 1 21 MET HE2 H 6.166 7.546 -4.535 1.00 . A A . 21 MET HE2 1 1 7 2475 1 1 21 MET HE3 H 5.092 7.168 -3.188 1.00 . A A . 21 MET HE3 1 1 7 2476 1 1 21 MET HG2 H 6.746 4.765 -1.836 1.00 . A A . 21 MET HG2 1 1 7 2477 1 1 21 MET HG3 H 5.932 6.038 -0.926 1.00 . A A . 21 MET HG3 1 1 7 2478 1 1 21 MET N N 9.341 4.029 -1.486 1.00 . A A . 21 MET N 1 1 7 2479 1 1 21 MET O O 10.767 6.227 0.919 1.00 . A A . 21 MET O 1 1 7 2480 1 1 21 MET SD S 7.385 6.929 -2.588 1.00 . A A . 21 MET SD 1 1 7 2481 1 1 22 ASN C C 12.467 2.713 1.710 1.00 . A A . 22 ASN C 1 1 7 2482 1 1 22 ASN CA C 11.441 3.787 2.038 1.00 . A A . 22 ASN CA 1 1 7 2483 1 1 22 ASN CB C 10.657 3.399 3.301 1.00 . A A . 22 ASN CB 1 1 7 2484 1 1 22 ASN CG C 9.675 4.472 3.735 1.00 . A A . 22 ASN CG 1 1 7 2485 1 1 22 ASN H H 10.139 3.214 0.474 1.00 . A A . 22 ASN H 1 1 7 2486 1 1 22 ASN HA H 11.957 4.719 2.219 1.00 . A A . 22 ASN HA 1 1 7 2487 1 1 22 ASN HB2 H 10.103 2.492 3.105 1.00 . A A . 22 ASN HB2 1 1 7 2488 1 1 22 ASN HB3 H 11.351 3.223 4.108 1.00 . A A . 22 ASN HB3 1 1 7 2489 1 1 22 ASN HD21 H 11.079 5.369 4.816 1.00 . A A . 22 ASN HD21 1 1 7 2490 1 1 22 ASN HD22 H 9.527 6.128 4.820 1.00 . A A . 22 ASN HD22 1 1 7 2491 1 1 22 ASN N N 10.542 3.991 0.910 1.00 . A A . 22 ASN N 1 1 7 2492 1 1 22 ASN ND2 N 10.137 5.413 4.541 1.00 . A A . 22 ASN ND2 1 1 7 2493 1 1 22 ASN O O 12.331 1.562 2.121 1.00 . A A . 22 ASN O 1 1 7 2494 1 1 22 ASN OD1 O 8.507 4.455 3.349 1.00 . A A . 22 ASN OD1 1 1 7 2495 1 1 23 SER C C 15.732 2.336 1.535 1.00 . A A . 23 SER C 1 1 7 2496 1 1 23 SER CA C 14.545 2.167 0.591 1.00 . A A . 23 SER CA 1 1 7 2497 1 1 23 SER CB C 14.979 2.388 -0.859 1.00 . A A . 23 SER CB 1 1 7 2498 1 1 23 SER H H 13.520 4.017 0.618 1.00 . A A . 23 SER H 1 1 7 2499 1 1 23 SER HA H 14.161 1.161 0.694 1.00 . A A . 23 SER HA 1 1 7 2500 1 1 23 SER HB2 H 15.307 3.409 -0.982 1.00 . A A . 23 SER HB2 1 1 7 2501 1 1 23 SER HB3 H 15.792 1.718 -1.096 1.00 . A A . 23 SER HB3 1 1 7 2502 1 1 23 SER HG H 13.067 2.223 -1.282 1.00 . A A . 23 SER HG 1 1 7 2503 1 1 23 SER N N 13.479 3.089 0.946 1.00 . A A . 23 SER N 1 1 7 2504 1 1 23 SER O O 15.952 1.445 2.386 1.00 . A A . 23 SER O 1 1 7 2505 1 1 23 SER OXT O 16.427 3.369 1.438 1.00 . A A . 23 SER OXT 1 1 7 2506 1 1 23 SER OG O 13.904 2.138 -1.755 1.00 . A A . 23 SER OG 1 1 8 2507 1 1 1 GLY C C -9.105 5.187 -2.860 1.00 . A A . 1 GLY C 1 1 8 2508 1 1 1 GLY CA C -9.734 4.297 -3.912 1.00 . A A . 1 GLY CA 1 1 8 2509 1 1 1 GLY H1 H -11.008 5.736 -4.730 1.00 . A A . 1 GLY H1 1 1 8 2510 1 1 1 GLY H2 H -10.708 4.417 -5.748 1.00 . A A . 1 GLY H2 1 1 8 2511 1 1 1 GLY H3 H -9.516 5.600 -5.525 1.00 . A A . 1 GLY H3 1 1 8 2512 1 1 1 GLY HA2 H -10.534 3.732 -3.454 1.00 . A A . 1 GLY HA2 1 1 8 2513 1 1 1 GLY HA3 H -8.986 3.611 -4.278 1.00 . A A . 1 GLY HA3 1 1 8 2514 1 1 1 GLY N N -10.281 5.065 -5.057 1.00 . A A . 1 GLY N 1 1 8 2515 1 1 1 GLY O O -7.997 5.690 -3.041 1.00 . A A . 1 GLY O 1 1 8 2516 1 1 2 ILE C C -8.840 5.113 0.428 1.00 . A A . 2 ILE C 1 1 8 2517 1 1 2 ILE CA C -9.312 6.128 -0.631 1.00 . A A . 2 ILE CA 1 1 8 2518 1 1 2 ILE CB C -10.390 7.105 -0.076 1.00 . A A . 2 ILE CB 1 1 8 2519 1 1 2 ILE CD1 C -8.705 8.989 0.255 1.00 . A A . 2 ILE CD1 1 1 8 2520 1 1 2 ILE CG1 C -9.771 8.121 0.891 1.00 . A A . 2 ILE CG1 1 1 8 2521 1 1 2 ILE CG2 C -11.538 6.352 0.591 1.00 . A A . 2 ILE CG2 1 1 8 2522 1 1 2 ILE H H -10.755 5.052 -1.739 1.00 . A A . 2 ILE H 1 1 8 2523 1 1 2 ILE HA H -8.459 6.705 -0.963 1.00 . A A . 2 ILE HA 1 1 8 2524 1 1 2 ILE HB H -10.805 7.643 -0.917 1.00 . A A . 2 ILE HB 1 1 8 2525 1 1 2 ILE HD11 H -7.917 8.362 -0.135 1.00 . A A . 2 ILE HD11 1 1 8 2526 1 1 2 ILE HD12 H -8.297 9.659 0.998 1.00 . A A . 2 ILE HD12 1 1 8 2527 1 1 2 ILE HD13 H -9.139 9.565 -0.550 1.00 . A A . 2 ILE HD13 1 1 8 2528 1 1 2 ILE HG12 H -10.548 8.772 1.266 1.00 . A A . 2 ILE HG12 1 1 8 2529 1 1 2 ILE HG13 H -9.320 7.592 1.715 1.00 . A A . 2 ILE HG13 1 1 8 2530 1 1 2 ILE HG21 H -11.154 5.749 1.400 1.00 . A A . 2 ILE HG21 1 1 8 2531 1 1 2 ILE HG22 H -12.021 5.715 -0.135 1.00 . A A . 2 ILE HG22 1 1 8 2532 1 1 2 ILE HG23 H -12.255 7.060 0.981 1.00 . A A . 2 ILE HG23 1 1 8 2533 1 1 2 ILE N N -9.831 5.398 -1.773 1.00 . A A . 2 ILE N 1 1 8 2534 1 1 2 ILE O O -8.481 3.991 0.070 1.00 . A A . 2 ILE O 1 1 8 2535 1 1 3 GLY C C -9.076 3.242 2.839 1.00 . A A . 3 GLY C 1 1 8 2536 1 1 3 GLY CA C -8.370 4.592 2.754 1.00 . A A . 3 GLY CA 1 1 8 2537 1 1 3 GLY H H -9.227 6.351 1.950 1.00 . A A . 3 GLY H 1 1 8 2538 1 1 3 GLY HA2 H -7.320 4.418 2.582 1.00 . A A . 3 GLY HA2 1 1 8 2539 1 1 3 GLY HA3 H -8.482 5.097 3.703 1.00 . A A . 3 GLY HA3 1 1 8 2540 1 1 3 GLY N N -8.870 5.471 1.708 1.00 . A A . 3 GLY N 1 1 8 2541 1 1 3 GLY O O -8.607 2.349 3.543 1.00 . A A . 3 GLY O 1 1 8 2542 1 1 4 LYS C C -10.369 0.839 1.144 1.00 . A A . 4 LYS C 1 1 8 2543 1 1 4 LYS CA C -10.904 1.803 2.188 1.00 . A A . 4 LYS CA 1 1 8 2544 1 1 4 LYS CB C -12.413 2.006 2.019 1.00 . A A . 4 LYS CB 1 1 8 2545 1 1 4 LYS CD C -14.359 2.543 0.540 1.00 . A A . 4 LYS CD 1 1 8 2546 1 1 4 LYS CE C -14.859 2.625 -0.894 1.00 . A A . 4 LYS CE 1 1 8 2547 1 1 4 LYS CG C -12.855 2.343 0.605 1.00 . A A . 4 LYS CG 1 1 8 2548 1 1 4 LYS H H -10.503 3.785 1.539 1.00 . A A . 4 LYS H 1 1 8 2549 1 1 4 LYS HA H -10.711 1.377 3.159 1.00 . A A . 4 LYS HA 1 1 8 2550 1 1 4 LYS HB2 H -12.914 1.098 2.315 1.00 . A A . 4 LYS HB2 1 1 8 2551 1 1 4 LYS HB3 H -12.730 2.807 2.670 1.00 . A A . 4 LYS HB3 1 1 8 2552 1 1 4 LYS HD2 H -14.841 1.713 1.030 1.00 . A A . 4 LYS HD2 1 1 8 2553 1 1 4 LYS HD3 H -14.611 3.461 1.051 1.00 . A A . 4 LYS HD3 1 1 8 2554 1 1 4 LYS HE2 H -15.906 2.883 -0.878 1.00 . A A . 4 LYS HE2 1 1 8 2555 1 1 4 LYS HE3 H -14.307 3.397 -1.411 1.00 . A A . 4 LYS HE3 1 1 8 2556 1 1 4 LYS HG2 H -12.362 3.252 0.289 1.00 . A A . 4 LYS HG2 1 1 8 2557 1 1 4 LYS HG3 H -12.579 1.533 -0.051 1.00 . A A . 4 LYS HG3 1 1 8 2558 1 1 4 LYS HZ1 H -15.207 1.368 -2.529 1.00 . A A . 4 LYS HZ1 1 1 8 2559 1 1 4 LYS HZ2 H -15.066 0.551 -1.047 1.00 . A A . 4 LYS HZ2 1 1 8 2560 1 1 4 LYS HZ3 H -13.680 1.158 -1.817 1.00 . A A . 4 LYS HZ3 1 1 8 2561 1 1 4 LYS N N -10.182 3.066 2.123 1.00 . A A . 4 LYS N 1 1 8 2562 1 1 4 LYS NZ N -14.690 1.338 -1.621 1.00 . A A . 4 LYS NZ 1 1 8 2563 1 1 4 LYS O O -10.529 -0.375 1.255 1.00 . A A . 4 LYS O 1 1 8 2564 1 1 5 PHE C C -7.659 0.198 -0.332 1.00 . A A . 5 PHE C 1 1 8 2565 1 1 5 PHE CA C -9.025 0.608 -0.865 1.00 . A A . 5 PHE CA 1 1 8 2566 1 1 5 PHE CB C -8.887 1.440 -2.149 1.00 . A A . 5 PHE CB 1 1 8 2567 1 1 5 PHE CD1 C -8.813 -0.219 -4.041 1.00 . A A . 5 PHE CD1 1 1 8 2568 1 1 5 PHE CD2 C -6.861 1.077 -3.596 1.00 . A A . 5 PHE CD2 1 1 8 2569 1 1 5 PHE CE1 C -8.161 -0.843 -5.090 1.00 . A A . 5 PHE CE1 1 1 8 2570 1 1 5 PHE CE2 C -6.206 0.456 -4.643 1.00 . A A . 5 PHE CE2 1 1 8 2571 1 1 5 PHE CG C -8.173 0.749 -3.285 1.00 . A A . 5 PHE CG 1 1 8 2572 1 1 5 PHE CZ C -6.856 -0.508 -5.388 1.00 . A A . 5 PHE CZ 1 1 8 2573 1 1 5 PHE H H -9.649 2.376 0.096 1.00 . A A . 5 PHE H 1 1 8 2574 1 1 5 PHE HA H -9.612 -0.275 -1.068 1.00 . A A . 5 PHE HA 1 1 8 2575 1 1 5 PHE HB2 H -9.873 1.705 -2.501 1.00 . A A . 5 PHE HB2 1 1 8 2576 1 1 5 PHE HB3 H -8.343 2.347 -1.920 1.00 . A A . 5 PHE HB3 1 1 8 2577 1 1 5 PHE HD1 H -9.833 -0.483 -3.809 1.00 . A A . 5 PHE HD1 1 1 8 2578 1 1 5 PHE HD2 H -6.352 1.832 -3.014 1.00 . A A . 5 PHE HD2 1 1 8 2579 1 1 5 PHE HE1 H -8.672 -1.597 -5.671 1.00 . A A . 5 PHE HE1 1 1 8 2580 1 1 5 PHE HE2 H -5.184 0.719 -4.872 1.00 . A A . 5 PHE HE2 1 1 8 2581 1 1 5 PHE HZ H -6.345 -0.995 -6.205 1.00 . A A . 5 PHE HZ 1 1 8 2582 1 1 5 PHE N N -9.702 1.396 0.147 1.00 . A A . 5 PHE N 1 1 8 2583 1 1 5 PHE O O -6.972 -0.648 -0.903 1.00 . A A . 5 PHE O 1 1 8 2584 1 1 6 LEU C C -5.846 -0.699 2.139 1.00 . A A . 6 LEU C 1 1 8 2585 1 1 6 LEU CA C -5.966 0.613 1.366 1.00 . A A . 6 LEU CA 1 1 8 2586 1 1 6 LEU CB C -5.626 1.810 2.266 1.00 . A A . 6 LEU CB 1 1 8 2587 1 1 6 LEU CD1 C -3.217 1.977 1.573 1.00 . A A . 6 LEU CD1 1 1 8 2588 1 1 6 LEU CD2 C -3.989 3.071 3.681 1.00 . A A . 6 LEU CD2 1 1 8 2589 1 1 6 LEU CG C -4.176 1.884 2.749 1.00 . A A . 6 LEU CG 1 1 8 2590 1 1 6 LEU H H -7.967 1.316 1.305 1.00 . A A . 6 LEU H 1 1 8 2591 1 1 6 LEU HA H -5.270 0.591 0.540 1.00 . A A . 6 LEU HA 1 1 8 2592 1 1 6 LEU HB2 H -5.849 2.714 1.721 1.00 . A A . 6 LEU HB2 1 1 8 2593 1 1 6 LEU HB3 H -6.264 1.770 3.136 1.00 . A A . 6 LEU HB3 1 1 8 2594 1 1 6 LEU HD11 H -3.334 1.106 0.945 1.00 . A A . 6 LEU HD11 1 1 8 2595 1 1 6 LEU HD12 H -2.201 2.020 1.941 1.00 . A A . 6 LEU HD12 1 1 8 2596 1 1 6 LEU HD13 H -3.433 2.865 1.000 1.00 . A A . 6 LEU HD13 1 1 8 2597 1 1 6 LEU HD21 H -4.646 2.968 4.532 1.00 . A A . 6 LEU HD21 1 1 8 2598 1 1 6 LEU HD22 H -4.221 3.985 3.154 1.00 . A A . 6 LEU HD22 1 1 8 2599 1 1 6 LEU HD23 H -2.965 3.100 4.020 1.00 . A A . 6 LEU HD23 1 1 8 2600 1 1 6 LEU HG H -3.941 0.985 3.300 1.00 . A A . 6 LEU HG 1 1 8 2601 1 1 6 LEU N N -7.302 0.774 0.811 1.00 . A A . 6 LEU N 1 1 8 2602 1 1 6 LEU O O -4.753 -1.101 2.530 1.00 . A A . 6 LEU O 1 1 8 2603 1 1 7 HIS C C -6.197 -3.703 2.240 1.00 . A A . 7 HIS C 1 1 8 2604 1 1 7 HIS CA C -6.956 -2.657 3.047 1.00 . A A . 7 HIS CA 1 1 8 2605 1 1 7 HIS CB C -8.379 -3.153 3.317 1.00 . A A . 7 HIS CB 1 1 8 2606 1 1 7 HIS CD2 C -8.763 -1.875 5.538 1.00 . A A . 7 HIS CD2 1 1 8 2607 1 1 7 HIS CE1 C -10.847 -1.297 5.212 1.00 . A A . 7 HIS CE1 1 1 8 2608 1 1 7 HIS CG C -9.131 -2.346 4.326 1.00 . A A . 7 HIS CG 1 1 8 2609 1 1 7 HIS H H -7.815 -1.022 2.001 1.00 . A A . 7 HIS H 1 1 8 2610 1 1 7 HIS HA H -6.450 -2.511 3.989 1.00 . A A . 7 HIS HA 1 1 8 2611 1 1 7 HIS HB2 H -8.940 -3.128 2.392 1.00 . A A . 7 HIS HB2 1 1 8 2612 1 1 7 HIS HB3 H -8.331 -4.171 3.676 1.00 . A A . 7 HIS HB3 1 1 8 2613 1 1 7 HIS HD1 H -11.004 -2.179 3.366 1.00 . A A . 7 HIS HD1 1 1 8 2614 1 1 7 HIS HD2 H -7.797 -1.999 6.008 1.00 . A A . 7 HIS HD2 1 1 8 2615 1 1 7 HIS HE1 H -11.835 -0.885 5.358 1.00 . A A . 7 HIS HE1 1 1 8 2616 1 1 7 HIS HE2 H -9.961 -1.024 7.032 1.00 . A A . 7 HIS HE2 1 1 8 2617 1 1 7 HIS N N -6.967 -1.380 2.342 1.00 . A A . 7 HIS N 1 1 8 2618 1 1 7 HIS ND1 N -10.441 -1.968 4.153 1.00 . A A . 7 HIS ND1 1 1 8 2619 1 1 7 HIS NE2 N -9.850 -1.226 6.073 1.00 . A A . 7 HIS NE2 1 1 8 2620 1 1 7 HIS O O -5.191 -4.242 2.697 1.00 . A A . 7 HIS O 1 1 8 2621 1 1 8 SER C C -4.899 -4.406 -0.627 1.00 . A A . 8 SER C 1 1 8 2622 1 1 8 SER CA C -6.047 -4.984 0.197 1.00 . A A . 8 SER CA 1 1 8 2623 1 1 8 SER CB C -7.086 -5.628 -0.708 1.00 . A A . 8 SER CB 1 1 8 2624 1 1 8 SER H H -7.454 -3.492 0.695 1.00 . A A . 8 SER H 1 1 8 2625 1 1 8 SER HA H -5.643 -5.738 0.855 1.00 . A A . 8 SER HA 1 1 8 2626 1 1 8 SER HB2 H -7.550 -4.868 -1.320 1.00 . A A . 8 SER HB2 1 1 8 2627 1 1 8 SER HB3 H -6.601 -6.352 -1.339 1.00 . A A . 8 SER HB3 1 1 8 2628 1 1 8 SER HG H -8.449 -7.027 -0.450 1.00 . A A . 8 SER HG 1 1 8 2629 1 1 8 SER N N -6.667 -3.972 1.031 1.00 . A A . 8 SER N 1 1 8 2630 1 1 8 SER O O -4.065 -5.150 -1.142 1.00 . A A . 8 SER O 1 1 8 2631 1 1 8 SER OG O -8.091 -6.278 0.056 1.00 . A A . 8 SER OG 1 1 8 2632 1 1 9 ALA C C -2.478 -2.611 -0.456 1.00 . A A . 9 ALA C 1 1 8 2633 1 1 9 ALA CA C -3.695 -2.423 -1.349 1.00 . A A . 9 ALA CA 1 1 8 2634 1 1 9 ALA CB C -3.968 -0.945 -1.575 1.00 . A A . 9 ALA CB 1 1 8 2635 1 1 9 ALA H H -5.601 -2.539 -0.415 1.00 . A A . 9 ALA H 1 1 8 2636 1 1 9 ALA HA H -3.507 -2.891 -2.306 1.00 . A A . 9 ALA HA 1 1 8 2637 1 1 9 ALA HB1 H -3.107 -0.486 -2.037 1.00 . A A . 9 ALA HB1 1 1 8 2638 1 1 9 ALA HB2 H -4.164 -0.466 -0.627 1.00 . A A . 9 ALA HB2 1 1 8 2639 1 1 9 ALA HB3 H -4.826 -0.832 -2.221 1.00 . A A . 9 ALA HB3 1 1 8 2640 1 1 9 ALA N N -4.848 -3.082 -0.737 1.00 . A A . 9 ALA N 1 1 8 2641 1 1 9 ALA O O -1.334 -2.476 -0.888 1.00 . A A . 9 ALA O 1 1 8 2642 1 1 10 LYS C C -1.546 -4.719 1.946 1.00 . A A . 10 LYS C 1 1 8 2643 1 1 10 LYS CA C -1.713 -3.208 1.775 1.00 . A A . 10 LYS CA 1 1 8 2644 1 1 10 LYS CB C -2.095 -2.549 3.104 1.00 . A A . 10 LYS CB 1 1 8 2645 1 1 10 LYS CD C -1.554 -2.045 5.494 1.00 . A A . 10 LYS CD 1 1 8 2646 1 1 10 LYS CE C -2.825 -2.747 5.947 1.00 . A A . 10 LYS CE 1 1 8 2647 1 1 10 LYS CG C -1.037 -2.636 4.194 1.00 . A A . 10 LYS CG 1 1 8 2648 1 1 10 LYS H H -3.692 -3.013 1.075 1.00 . A A . 10 LYS H 1 1 8 2649 1 1 10 LYS HA H -0.787 -2.783 1.413 1.00 . A A . 10 LYS HA 1 1 8 2650 1 1 10 LYS HB2 H -2.299 -1.505 2.925 1.00 . A A . 10 LYS HB2 1 1 8 2651 1 1 10 LYS HB3 H -2.994 -3.021 3.475 1.00 . A A . 10 LYS HB3 1 1 8 2652 1 1 10 LYS HD2 H -0.801 -2.158 6.259 1.00 . A A . 10 LYS HD2 1 1 8 2653 1 1 10 LYS HD3 H -1.764 -0.996 5.344 1.00 . A A . 10 LYS HD3 1 1 8 2654 1 1 10 LYS HE2 H -3.507 -2.802 5.111 1.00 . A A . 10 LYS HE2 1 1 8 2655 1 1 10 LYS HE3 H -2.572 -3.746 6.268 1.00 . A A . 10 LYS HE3 1 1 8 2656 1 1 10 LYS HG2 H -0.781 -3.675 4.353 1.00 . A A . 10 LYS HG2 1 1 8 2657 1 1 10 LYS HG3 H -0.160 -2.091 3.880 1.00 . A A . 10 LYS HG3 1 1 8 2658 1 1 10 LYS HZ1 H -3.700 -1.049 6.792 1.00 . A A . 10 LYS HZ1 1 1 8 2659 1 1 10 LYS HZ2 H -2.881 -2.024 7.912 1.00 . A A . 10 LYS HZ2 1 1 8 2660 1 1 10 LYS HZ3 H -4.392 -2.507 7.311 1.00 . A A . 10 LYS HZ3 1 1 8 2661 1 1 10 LYS N N -2.751 -2.942 0.797 1.00 . A A . 10 LYS N 1 1 8 2662 1 1 10 LYS NZ N -3.493 -2.034 7.067 1.00 . A A . 10 LYS NZ 1 1 8 2663 1 1 10 LYS O O -0.765 -5.185 2.771 1.00 . A A . 10 LYS O 1 1 8 2664 1 1 11 LYS C C -1.168 -7.403 0.167 1.00 . A A . 11 LYS C 1 1 8 2665 1 1 11 LYS CA C -2.186 -6.930 1.195 1.00 . A A . 11 LYS CA 1 1 8 2666 1 1 11 LYS CB C -3.550 -7.572 0.929 1.00 . A A . 11 LYS CB 1 1 8 2667 1 1 11 LYS CD C -4.923 -9.668 0.836 1.00 . A A . 11 LYS CD 1 1 8 2668 1 1 11 LYS CE C -4.924 -11.176 1.011 1.00 . A A . 11 LYS CE 1 1 8 2669 1 1 11 LYS CG C -3.544 -9.084 1.068 1.00 . A A . 11 LYS CG 1 1 8 2670 1 1 11 LYS H H -2.909 -5.064 0.522 1.00 . A A . 11 LYS H 1 1 8 2671 1 1 11 LYS HA H -1.846 -7.215 2.181 1.00 . A A . 11 LYS HA 1 1 8 2672 1 1 11 LYS HB2 H -4.268 -7.173 1.631 1.00 . A A . 11 LYS HB2 1 1 8 2673 1 1 11 LYS HB3 H -3.862 -7.323 -0.074 1.00 . A A . 11 LYS HB3 1 1 8 2674 1 1 11 LYS HD2 H -5.611 -9.233 1.544 1.00 . A A . 11 LYS HD2 1 1 8 2675 1 1 11 LYS HD3 H -5.239 -9.430 -0.170 1.00 . A A . 11 LYS HD3 1 1 8 2676 1 1 11 LYS HE2 H -4.239 -11.609 0.296 1.00 . A A . 11 LYS HE2 1 1 8 2677 1 1 11 LYS HE3 H -4.592 -11.410 2.012 1.00 . A A . 11 LYS HE3 1 1 8 2678 1 1 11 LYS HG2 H -2.863 -9.499 0.341 1.00 . A A . 11 LYS HG2 1 1 8 2679 1 1 11 LYS HG3 H -3.217 -9.343 2.063 1.00 . A A . 11 LYS HG3 1 1 8 2680 1 1 11 LYS HZ1 H -6.244 -12.787 0.965 1.00 . A A . 11 LYS HZ1 1 1 8 2681 1 1 11 LYS HZ2 H -6.589 -11.587 -0.181 1.00 . A A . 11 LYS HZ2 1 1 8 2682 1 1 11 LYS HZ3 H -6.960 -11.330 1.456 1.00 . A A . 11 LYS HZ3 1 1 8 2683 1 1 11 LYS N N -2.286 -5.483 1.154 1.00 . A A . 11 LYS N 1 1 8 2684 1 1 11 LYS NZ N -6.272 -11.760 0.799 1.00 . A A . 11 LYS NZ 1 1 8 2685 1 1 11 LYS O O -0.280 -8.196 0.474 1.00 . A A . 11 LYS O 1 1 8 2686 1 1 12 PHE C C 0.611 -6.121 -2.370 1.00 . A A . 12 PHE C 1 1 8 2687 1 1 12 PHE CA C -0.369 -7.262 -2.118 1.00 . A A . 12 PHE CA 1 1 8 2688 1 1 12 PHE CB C -1.133 -7.591 -3.407 1.00 . A A . 12 PHE CB 1 1 8 2689 1 1 12 PHE CD1 C 0.405 -7.375 -5.387 1.00 . A A . 12 PHE CD1 1 1 8 2690 1 1 12 PHE CD2 C -0.153 -9.562 -4.621 1.00 . A A . 12 PHE CD2 1 1 8 2691 1 1 12 PHE CE1 C 1.191 -7.922 -6.384 1.00 . A A . 12 PHE CE1 1 1 8 2692 1 1 12 PHE CE2 C 0.632 -10.115 -5.616 1.00 . A A . 12 PHE CE2 1 1 8 2693 1 1 12 PHE CG C -0.277 -8.188 -4.495 1.00 . A A . 12 PHE CG 1 1 8 2694 1 1 12 PHE CZ C 1.307 -9.293 -6.497 1.00 . A A . 12 PHE CZ 1 1 8 2695 1 1 12 PHE H H -2.032 -6.281 -1.245 1.00 . A A . 12 PHE H 1 1 8 2696 1 1 12 PHE HA H 0.182 -8.134 -1.798 1.00 . A A . 12 PHE HA 1 1 8 2697 1 1 12 PHE HB2 H -1.919 -8.297 -3.179 1.00 . A A . 12 PHE HB2 1 1 8 2698 1 1 12 PHE HB3 H -1.576 -6.684 -3.792 1.00 . A A . 12 PHE HB3 1 1 8 2699 1 1 12 PHE HD1 H 0.316 -6.301 -5.299 1.00 . A A . 12 PHE HD1 1 1 8 2700 1 1 12 PHE HD2 H -0.680 -10.207 -3.931 1.00 . A A . 12 PHE HD2 1 1 8 2701 1 1 12 PHE HE1 H 1.715 -7.276 -7.074 1.00 . A A . 12 PHE HE1 1 1 8 2702 1 1 12 PHE HE2 H 0.719 -11.187 -5.701 1.00 . A A . 12 PHE HE2 1 1 8 2703 1 1 12 PHE HZ H 1.920 -9.722 -7.274 1.00 . A A . 12 PHE HZ 1 1 8 2704 1 1 12 PHE N N -1.296 -6.903 -1.054 1.00 . A A . 12 PHE N 1 1 8 2705 1 1 12 PHE O O 1.820 -6.327 -2.458 1.00 . A A . 12 PHE O 1 1 8 2706 1 1 13 GLY C C 1.759 -3.270 -1.643 1.00 . A A . 13 GLY C 1 1 8 2707 1 1 13 GLY CA C 0.893 -3.757 -2.792 1.00 . A A . 13 GLY CA 1 1 8 2708 1 1 13 GLY H H -0.887 -4.791 -2.296 1.00 . A A . 13 GLY H 1 1 8 2709 1 1 13 GLY HA2 H 1.532 -4.020 -3.621 1.00 . A A . 13 GLY HA2 1 1 8 2710 1 1 13 GLY HA3 H 0.240 -2.952 -3.099 1.00 . A A . 13 GLY HA3 1 1 8 2711 1 1 13 GLY N N 0.078 -4.908 -2.454 1.00 . A A . 13 GLY N 1 1 8 2712 1 1 13 GLY O O 2.504 -2.301 -1.798 1.00 . A A . 13 GLY O 1 1 8 2713 1 1 14 LYS C C 3.963 -3.652 0.381 1.00 . A A . 14 LYS C 1 1 8 2714 1 1 14 LYS CA C 2.466 -3.566 0.674 1.00 . A A . 14 LYS CA 1 1 8 2715 1 1 14 LYS CB C 2.113 -4.443 1.881 1.00 . A A . 14 LYS CB 1 1 8 2716 1 1 14 LYS CD C 2.147 -6.688 2.999 1.00 . A A . 14 LYS CD 1 1 8 2717 1 1 14 LYS CE C 2.606 -8.137 2.929 1.00 . A A . 14 LYS CE 1 1 8 2718 1 1 14 LYS CG C 2.476 -5.913 1.730 1.00 . A A . 14 LYS CG 1 1 8 2719 1 1 14 LYS H H 1.071 -4.708 -0.440 1.00 . A A . 14 LYS H 1 1 8 2720 1 1 14 LYS HA H 2.221 -2.539 0.907 1.00 . A A . 14 LYS HA 1 1 8 2721 1 1 14 LYS HB2 H 2.626 -4.061 2.748 1.00 . A A . 14 LYS HB2 1 1 8 2722 1 1 14 LYS HB3 H 1.048 -4.379 2.052 1.00 . A A . 14 LYS HB3 1 1 8 2723 1 1 14 LYS HD2 H 2.632 -6.212 3.838 1.00 . A A . 14 LYS HD2 1 1 8 2724 1 1 14 LYS HD3 H 1.077 -6.671 3.146 1.00 . A A . 14 LYS HD3 1 1 8 2725 1 1 14 LYS HE2 H 3.674 -8.155 2.767 1.00 . A A . 14 LYS HE2 1 1 8 2726 1 1 14 LYS HE3 H 2.379 -8.621 3.869 1.00 . A A . 14 LYS HE3 1 1 8 2727 1 1 14 LYS HG2 H 1.914 -6.331 0.909 1.00 . A A . 14 LYS HG2 1 1 8 2728 1 1 14 LYS HG3 H 3.534 -5.997 1.531 1.00 . A A . 14 LYS HG3 1 1 8 2729 1 1 14 LYS HZ1 H 0.927 -8.643 1.793 1.00 . A A . 14 LYS HZ1 1 1 8 2730 1 1 14 LYS HZ2 H 2.032 -9.911 1.995 1.00 . A A . 14 LYS HZ2 1 1 8 2731 1 1 14 LYS HZ3 H 2.380 -8.648 0.913 1.00 . A A . 14 LYS HZ3 1 1 8 2732 1 1 14 LYS N N 1.679 -3.946 -0.499 1.00 . A A . 14 LYS N 1 1 8 2733 1 1 14 LYS NZ N 1.941 -8.883 1.831 1.00 . A A . 14 LYS NZ 1 1 8 2734 1 1 14 LYS O O 4.761 -2.907 0.953 1.00 . A A . 14 LYS O 1 1 8 2735 1 1 15 ALA C C 6.166 -3.532 -1.775 1.00 . A A . 15 ALA C 1 1 8 2736 1 1 15 ALA CA C 5.721 -4.714 -0.924 1.00 . A A . 15 ALA CA 1 1 8 2737 1 1 15 ALA CB C 5.915 -6.024 -1.680 1.00 . A A . 15 ALA CB 1 1 8 2738 1 1 15 ALA H H 3.648 -5.132 -0.927 1.00 . A A . 15 ALA H 1 1 8 2739 1 1 15 ALA HA H 6.326 -4.747 -0.029 1.00 . A A . 15 ALA HA 1 1 8 2740 1 1 15 ALA HB1 H 5.582 -6.847 -1.066 1.00 . A A . 15 ALA HB1 1 1 8 2741 1 1 15 ALA HB2 H 6.961 -6.154 -1.916 1.00 . A A . 15 ALA HB2 1 1 8 2742 1 1 15 ALA HB3 H 5.341 -6.002 -2.594 1.00 . A A . 15 ALA HB3 1 1 8 2743 1 1 15 ALA N N 4.331 -4.556 -0.522 1.00 . A A . 15 ALA N 1 1 8 2744 1 1 15 ALA O O 7.328 -3.133 -1.750 1.00 . A A . 15 ALA O 1 1 8 2745 1 1 16 PHE C C 5.509 -0.537 -2.637 1.00 . A A . 16 PHE C 1 1 8 2746 1 1 16 PHE CA C 5.512 -1.853 -3.402 1.00 . A A . 16 PHE CA 1 1 8 2747 1 1 16 PHE CB C 4.496 -1.802 -4.544 1.00 . A A . 16 PHE CB 1 1 8 2748 1 1 16 PHE CD1 C 5.467 -3.269 -6.338 1.00 . A A . 16 PHE CD1 1 1 8 2749 1 1 16 PHE CD2 C 3.484 -3.993 -5.230 1.00 . A A . 16 PHE CD2 1 1 8 2750 1 1 16 PHE CE1 C 5.457 -4.418 -7.109 1.00 . A A . 16 PHE CE1 1 1 8 2751 1 1 16 PHE CE2 C 3.469 -5.139 -5.997 1.00 . A A . 16 PHE CE2 1 1 8 2752 1 1 16 PHE CG C 4.481 -3.046 -5.388 1.00 . A A . 16 PHE CG 1 1 8 2753 1 1 16 PHE CZ C 4.453 -5.351 -6.940 1.00 . A A . 16 PHE CZ 1 1 8 2754 1 1 16 PHE H H 4.301 -3.300 -2.450 1.00 . A A . 16 PHE H 1 1 8 2755 1 1 16 PHE HA H 6.495 -2.011 -3.816 1.00 . A A . 16 PHE HA 1 1 8 2756 1 1 16 PHE HB2 H 3.507 -1.671 -4.132 1.00 . A A . 16 PHE HB2 1 1 8 2757 1 1 16 PHE HB3 H 4.729 -0.965 -5.185 1.00 . A A . 16 PHE HB3 1 1 8 2758 1 1 16 PHE HD1 H 6.252 -2.538 -6.471 1.00 . A A . 16 PHE HD1 1 1 8 2759 1 1 16 PHE HD2 H 2.711 -3.829 -4.496 1.00 . A A . 16 PHE HD2 1 1 8 2760 1 1 16 PHE HE1 H 6.229 -4.583 -7.845 1.00 . A A . 16 PHE HE1 1 1 8 2761 1 1 16 PHE HE2 H 2.685 -5.871 -5.861 1.00 . A A . 16 PHE HE2 1 1 8 2762 1 1 16 PHE HZ H 4.442 -6.250 -7.540 1.00 . A A . 16 PHE HZ 1 1 8 2763 1 1 16 PHE N N 5.221 -2.965 -2.512 1.00 . A A . 16 PHE N 1 1 8 2764 1 1 16 PHE O O 6.469 0.231 -2.713 1.00 . A A . 16 PHE O 1 1 8 2765 1 1 17 VAL C C 5.345 1.046 -0.034 1.00 . A A . 17 VAL C 1 1 8 2766 1 1 17 VAL CA C 4.318 0.965 -1.150 1.00 . A A . 17 VAL CA 1 1 8 2767 1 1 17 VAL CB C 2.899 1.161 -0.568 1.00 . A A . 17 VAL CB 1 1 8 2768 1 1 17 VAL CG1 C 1.866 1.180 -1.683 1.00 . A A . 17 VAL CG1 1 1 8 2769 1 1 17 VAL CG2 C 2.560 0.075 0.444 1.00 . A A . 17 VAL CG2 1 1 8 2770 1 1 17 VAL H H 3.748 -0.980 -1.776 1.00 . A A . 17 VAL H 1 1 8 2771 1 1 17 VAL HA H 4.513 1.766 -1.850 1.00 . A A . 17 VAL HA 1 1 8 2772 1 1 17 VAL HB H 2.869 2.118 -0.065 1.00 . A A . 17 VAL HB 1 1 8 2773 1 1 17 VAL HG11 H 1.901 0.242 -2.220 1.00 . A A . 17 VAL HG11 1 1 8 2774 1 1 17 VAL HG12 H 2.079 1.994 -2.361 1.00 . A A . 17 VAL HG12 1 1 8 2775 1 1 17 VAL HG13 H 0.884 1.313 -1.257 1.00 . A A . 17 VAL HG13 1 1 8 2776 1 1 17 VAL HG21 H 3.293 0.082 1.238 1.00 . A A . 17 VAL HG21 1 1 8 2777 1 1 17 VAL HG22 H 2.569 -0.888 -0.047 1.00 . A A . 17 VAL HG22 1 1 8 2778 1 1 17 VAL HG23 H 1.578 0.260 0.855 1.00 . A A . 17 VAL HG23 1 1 8 2779 1 1 17 VAL N N 4.448 -0.293 -1.871 1.00 . A A . 17 VAL N 1 1 8 2780 1 1 17 VAL O O 5.753 2.136 0.374 1.00 . A A . 17 VAL O 1 1 8 2781 1 1 18 GLY C C 8.142 0.323 0.955 1.00 . A A . 18 GLY C 1 1 8 2782 1 1 18 GLY CA C 6.804 -0.182 1.451 1.00 . A A . 18 GLY CA 1 1 8 2783 1 1 18 GLY H H 5.407 -0.950 0.067 1.00 . A A . 18 GLY H 1 1 8 2784 1 1 18 GLY HA2 H 6.491 0.418 2.291 1.00 . A A . 18 GLY HA2 1 1 8 2785 1 1 18 GLY HA3 H 6.913 -1.207 1.769 1.00 . A A . 18 GLY HA3 1 1 8 2786 1 1 18 GLY N N 5.787 -0.119 0.428 1.00 . A A . 18 GLY N 1 1 8 2787 1 1 18 GLY O O 9.032 0.623 1.749 1.00 . A A . 18 GLY O 1 1 8 2788 1 1 19 GLU C C 9.288 2.375 -1.422 1.00 . A A . 19 GLU C 1 1 8 2789 1 1 19 GLU CA C 9.504 0.944 -0.953 1.00 . A A . 19 GLU CA 1 1 8 2790 1 1 19 GLU CB C 9.967 0.077 -2.123 1.00 . A A . 19 GLU CB 1 1 8 2791 1 1 19 GLU CD C 11.673 -0.211 -3.967 1.00 . A A . 19 GLU CD 1 1 8 2792 1 1 19 GLU CG C 11.310 0.513 -2.692 1.00 . A A . 19 GLU CG 1 1 8 2793 1 1 19 GLU H H 7.545 0.142 -0.945 1.00 . A A . 19 GLU H 1 1 8 2794 1 1 19 GLU HA H 10.266 0.941 -0.189 1.00 . A A . 19 GLU HA 1 1 8 2795 1 1 19 GLU HB2 H 10.056 -0.944 -1.784 1.00 . A A . 19 GLU HB2 1 1 8 2796 1 1 19 GLU HB3 H 9.232 0.126 -2.911 1.00 . A A . 19 GLU HB3 1 1 8 2797 1 1 19 GLU HG2 H 11.273 1.572 -2.899 1.00 . A A . 19 GLU HG2 1 1 8 2798 1 1 19 GLU HG3 H 12.076 0.318 -1.954 1.00 . A A . 19 GLU HG3 1 1 8 2799 1 1 19 GLU N N 8.284 0.422 -0.360 1.00 . A A . 19 GLU N 1 1 8 2800 1 1 19 GLU O O 10.196 3.206 -1.353 1.00 . A A . 19 GLU O 1 1 8 2801 1 1 19 GLU OE1 O 12.002 -1.412 -3.900 1.00 . A A . 19 GLU OE1 1 1 8 2802 1 1 19 GLU OE2 O 11.639 0.423 -5.044 1.00 . A A . 19 GLU OE2 1 1 8 2803 1 1 20 ILE C C 7.874 5.013 -1.231 1.00 . A A . 20 ILE C 1 1 8 2804 1 1 20 ILE CA C 7.730 3.994 -2.359 1.00 . A A . 20 ILE CA 1 1 8 2805 1 1 20 ILE CB C 6.290 4.046 -2.922 1.00 . A A . 20 ILE CB 1 1 8 2806 1 1 20 ILE CD1 C 4.732 2.963 -4.632 1.00 . A A . 20 ILE CD1 1 1 8 2807 1 1 20 ILE CG1 C 6.139 3.052 -4.079 1.00 . A A . 20 ILE CG1 1 1 8 2808 1 1 20 ILE CG2 C 5.950 5.457 -3.389 1.00 . A A . 20 ILE CG2 1 1 8 2809 1 1 20 ILE H H 7.410 1.945 -1.948 1.00 . A A . 20 ILE H 1 1 8 2810 1 1 20 ILE HA H 8.413 4.258 -3.151 1.00 . A A . 20 ILE HA 1 1 8 2811 1 1 20 ILE HB H 5.607 3.778 -2.130 1.00 . A A . 20 ILE HB 1 1 8 2812 1 1 20 ILE HD11 H 4.053 2.671 -3.844 1.00 . A A . 20 ILE HD11 1 1 8 2813 1 1 20 ILE HD12 H 4.700 2.231 -5.424 1.00 . A A . 20 ILE HD12 1 1 8 2814 1 1 20 ILE HD13 H 4.436 3.926 -5.022 1.00 . A A . 20 ILE HD13 1 1 8 2815 1 1 20 ILE HG12 H 6.791 3.351 -4.884 1.00 . A A . 20 ILE HG12 1 1 8 2816 1 1 20 ILE HG13 H 6.427 2.067 -3.738 1.00 . A A . 20 ILE HG13 1 1 8 2817 1 1 20 ILE HG21 H 6.644 5.758 -4.161 1.00 . A A . 20 ILE HG21 1 1 8 2818 1 1 20 ILE HG22 H 6.024 6.139 -2.554 1.00 . A A . 20 ILE HG22 1 1 8 2819 1 1 20 ILE HG23 H 4.945 5.475 -3.780 1.00 . A A . 20 ILE HG23 1 1 8 2820 1 1 20 ILE N N 8.080 2.658 -1.896 1.00 . A A . 20 ILE N 1 1 8 2821 1 1 20 ILE O O 8.447 6.081 -1.425 1.00 . A A . 20 ILE O 1 1 8 2822 1 1 21 MET C C 8.852 5.395 1.791 1.00 . A A . 21 MET C 1 1 8 2823 1 1 21 MET CA C 7.494 5.562 1.107 1.00 . A A . 21 MET CA 1 1 8 2824 1 1 21 MET CB C 6.356 5.319 2.108 1.00 . A A . 21 MET CB 1 1 8 2825 1 1 21 MET CE C 5.282 5.112 5.075 1.00 . A A . 21 MET CE 1 1 8 2826 1 1 21 MET CG C 6.431 3.979 2.821 1.00 . A A . 21 MET CG 1 1 8 2827 1 1 21 MET H H 6.936 3.798 0.059 1.00 . A A . 21 MET H 1 1 8 2828 1 1 21 MET HA H 7.423 6.574 0.738 1.00 . A A . 21 MET HA 1 1 8 2829 1 1 21 MET HB2 H 6.380 6.099 2.854 1.00 . A A . 21 MET HB2 1 1 8 2830 1 1 21 MET HB3 H 5.414 5.367 1.582 1.00 . A A . 21 MET HB3 1 1 8 2831 1 1 21 MET HE1 H 5.271 6.030 4.508 1.00 . A A . 21 MET HE1 1 1 8 2832 1 1 21 MET HE2 H 6.227 5.017 5.588 1.00 . A A . 21 MET HE2 1 1 8 2833 1 1 21 MET HE3 H 4.478 5.128 5.797 1.00 . A A . 21 MET HE3 1 1 8 2834 1 1 21 MET HG2 H 6.419 3.193 2.082 1.00 . A A . 21 MET HG2 1 1 8 2835 1 1 21 MET HG3 H 7.357 3.934 3.379 1.00 . A A . 21 MET HG3 1 1 8 2836 1 1 21 MET N N 7.385 4.667 -0.043 1.00 . A A . 21 MET N 1 1 8 2837 1 1 21 MET O O 9.094 5.938 2.868 1.00 . A A . 21 MET O 1 1 8 2838 1 1 21 MET SD S 5.060 3.723 3.964 1.00 . A A . 21 MET SD 1 1 8 2839 1 1 22 ASN C C 12.076 5.220 0.788 1.00 . A A . 22 ASN C 1 1 8 2840 1 1 22 ASN CA C 11.087 4.437 1.646 1.00 . A A . 22 ASN CA 1 1 8 2841 1 1 22 ASN CB C 11.438 2.944 1.637 1.00 . A A . 22 ASN CB 1 1 8 2842 1 1 22 ASN CG C 12.903 2.673 1.928 1.00 . A A . 22 ASN CG 1 1 8 2843 1 1 22 ASN H H 9.461 4.192 0.320 1.00 . A A . 22 ASN H 1 1 8 2844 1 1 22 ASN HA H 11.133 4.807 2.660 1.00 . A A . 22 ASN HA 1 1 8 2845 1 1 22 ASN HB2 H 10.846 2.440 2.384 1.00 . A A . 22 ASN HB2 1 1 8 2846 1 1 22 ASN HB3 H 11.203 2.534 0.664 1.00 . A A . 22 ASN HB3 1 1 8 2847 1 1 22 ASN HD21 H 13.313 2.610 -0.016 1.00 . A A . 22 ASN HD21 1 1 8 2848 1 1 22 ASN HD22 H 14.659 2.374 1.044 1.00 . A A . 22 ASN HD22 1 1 8 2849 1 1 22 ASN N N 9.731 4.635 1.154 1.00 . A A . 22 ASN N 1 1 8 2850 1 1 22 ASN ND2 N 13.702 2.535 0.879 1.00 . A A . 22 ASN ND2 1 1 8 2851 1 1 22 ASN O O 13.160 5.585 1.240 1.00 . A A . 22 ASN O 1 1 8 2852 1 1 22 ASN OD1 O 13.310 2.569 3.085 1.00 . A A . 22 ASN OD1 1 1 8 2853 1 1 23 SER C C 12.119 7.616 -1.604 1.00 . A A . 23 SER C 1 1 8 2854 1 1 23 SER CA C 12.552 6.166 -1.396 1.00 . A A . 23 SER CA 1 1 8 2855 1 1 23 SER CB C 12.534 5.402 -2.720 1.00 . A A . 23 SER CB 1 1 8 2856 1 1 23 SER H H 10.766 5.272 -0.714 1.00 . A A . 23 SER H 1 1 8 2857 1 1 23 SER HA H 13.551 6.154 -0.992 1.00 . A A . 23 SER HA 1 1 8 2858 1 1 23 SER HB2 H 11.603 5.598 -3.237 1.00 . A A . 23 SER HB2 1 1 8 2859 1 1 23 SER HB3 H 13.362 5.729 -3.332 1.00 . A A . 23 SER HB3 1 1 8 2860 1 1 23 SER HG H 11.847 3.684 -2.060 1.00 . A A . 23 SER HG 1 1 8 2861 1 1 23 SER N N 11.677 5.505 -0.442 1.00 . A A . 23 SER N 1 1 8 2862 1 1 23 SER O O 11.204 7.859 -2.420 1.00 . A A . 23 SER O 1 1 8 2863 1 1 23 SER OXT O 12.687 8.509 -0.936 1.00 . A A . 23 SER OXT 1 1 8 2864 1 1 23 SER OG O 12.649 4.003 -2.497 1.00 . A A . 23 SER OG 1 1 9 2865 1 1 1 GLY C C -9.916 6.247 -2.589 1.00 . A A . 1 GLY C 1 1 9 2866 1 1 1 GLY CA C -11.219 5.628 -3.037 1.00 . A A . 1 GLY CA 1 1 9 2867 1 1 1 GLY H1 H -11.779 7.145 -4.357 1.00 . A A . 1 GLY H1 1 1 9 2868 1 1 1 GLY H2 H -12.397 7.332 -2.783 1.00 . A A . 1 GLY H2 1 1 9 2869 1 1 1 GLY H3 H -13.066 6.176 -3.822 1.00 . A A . 1 GLY H3 1 1 9 2870 1 1 1 GLY HA2 H -11.660 5.102 -2.202 1.00 . A A . 1 GLY HA2 1 1 9 2871 1 1 1 GLY HA3 H -11.016 4.920 -3.828 1.00 . A A . 1 GLY HA3 1 1 9 2872 1 1 1 GLY N N -12.181 6.639 -3.533 1.00 . A A . 1 GLY N 1 1 9 2873 1 1 1 GLY O O -9.076 6.603 -3.413 1.00 . A A . 1 GLY O 1 1 9 2874 1 1 2 ILE C C -7.852 6.034 0.250 1.00 . A A . 2 ILE C 1 1 9 2875 1 1 2 ILE CA C -8.535 6.984 -0.732 1.00 . A A . 2 ILE CA 1 1 9 2876 1 1 2 ILE CB C -8.851 8.323 -0.017 1.00 . A A . 2 ILE CB 1 1 9 2877 1 1 2 ILE CD1 C -8.587 9.715 -2.144 1.00 . A A . 2 ILE CD1 1 1 9 2878 1 1 2 ILE CG1 C -9.486 9.325 -0.991 1.00 . A A . 2 ILE CG1 1 1 9 2879 1 1 2 ILE CG2 C -7.589 8.912 0.603 1.00 . A A . 2 ILE CG2 1 1 9 2880 1 1 2 ILE H H -10.429 6.035 -0.666 1.00 . A A . 2 ILE H 1 1 9 2881 1 1 2 ILE HA H -7.861 7.188 -1.552 1.00 . A A . 2 ILE HA 1 1 9 2882 1 1 2 ILE HB H -9.548 8.121 0.781 1.00 . A A . 2 ILE HB 1 1 9 2883 1 1 2 ILE HD11 H -7.671 10.140 -1.762 1.00 . A A . 2 ILE HD11 1 1 9 2884 1 1 2 ILE HD12 H -9.091 10.442 -2.763 1.00 . A A . 2 ILE HD12 1 1 9 2885 1 1 2 ILE HD13 H -8.360 8.839 -2.731 1.00 . A A . 2 ILE HD13 1 1 9 2886 1 1 2 ILE HG12 H -10.381 8.889 -1.407 1.00 . A A . 2 ILE HG12 1 1 9 2887 1 1 2 ILE HG13 H -9.746 10.225 -0.453 1.00 . A A . 2 ILE HG13 1 1 9 2888 1 1 2 ILE HG21 H -7.835 9.833 1.114 1.00 . A A . 2 ILE HG21 1 1 9 2889 1 1 2 ILE HG22 H -6.865 9.113 -0.173 1.00 . A A . 2 ILE HG22 1 1 9 2890 1 1 2 ILE HG23 H -7.175 8.208 1.308 1.00 . A A . 2 ILE HG23 1 1 9 2891 1 1 2 ILE N N -9.737 6.372 -1.281 1.00 . A A . 2 ILE N 1 1 9 2892 1 1 2 ILE O O -6.636 5.857 0.213 1.00 . A A . 2 ILE O 1 1 9 2893 1 1 3 GLY C C -8.869 3.254 2.304 1.00 . A A . 3 GLY C 1 1 9 2894 1 1 3 GLY CA C -8.074 4.528 2.114 1.00 . A A . 3 GLY CA 1 1 9 2895 1 1 3 GLY H H -9.614 5.552 1.076 1.00 . A A . 3 GLY H 1 1 9 2896 1 1 3 GLY HA2 H -7.068 4.269 1.819 1.00 . A A . 3 GLY HA2 1 1 9 2897 1 1 3 GLY HA3 H -8.033 5.057 3.056 1.00 . A A . 3 GLY HA3 1 1 9 2898 1 1 3 GLY N N -8.642 5.409 1.114 1.00 . A A . 3 GLY N 1 1 9 2899 1 1 3 GLY O O -8.568 2.459 3.188 1.00 . A A . 3 GLY O 1 1 9 2900 1 1 4 LYS C C -10.168 0.750 0.658 1.00 . A A . 4 LYS C 1 1 9 2901 1 1 4 LYS CA C -10.681 1.832 1.591 1.00 . A A . 4 LYS CA 1 1 9 2902 1 1 4 LYS CB C -12.163 2.112 1.340 1.00 . A A . 4 LYS CB 1 1 9 2903 1 1 4 LYS CD C -12.497 2.326 3.812 1.00 . A A . 4 LYS CD 1 1 9 2904 1 1 4 LYS CE C -13.141 3.109 4.945 1.00 . A A . 4 LYS CE 1 1 9 2905 1 1 4 LYS CG C -12.815 2.922 2.450 1.00 . A A . 4 LYS CG 1 1 9 2906 1 1 4 LYS H H -10.096 3.705 0.791 1.00 . A A . 4 LYS H 1 1 9 2907 1 1 4 LYS HA H -10.568 1.475 2.603 1.00 . A A . 4 LYS HA 1 1 9 2908 1 1 4 LYS HB2 H -12.263 2.659 0.414 1.00 . A A . 4 LYS HB2 1 1 9 2909 1 1 4 LYS HB3 H -12.688 1.172 1.254 1.00 . A A . 4 LYS HB3 1 1 9 2910 1 1 4 LYS HD2 H -12.862 1.312 3.840 1.00 . A A . 4 LYS HD2 1 1 9 2911 1 1 4 LYS HD3 H -11.426 2.327 3.950 1.00 . A A . 4 LYS HD3 1 1 9 2912 1 1 4 LYS HE2 H -12.716 2.778 5.881 1.00 . A A . 4 LYS HE2 1 1 9 2913 1 1 4 LYS HE3 H -12.928 4.158 4.805 1.00 . A A . 4 LYS HE3 1 1 9 2914 1 1 4 LYS HG2 H -12.443 3.935 2.413 1.00 . A A . 4 LYS HG2 1 1 9 2915 1 1 4 LYS HG3 H -13.885 2.921 2.306 1.00 . A A . 4 LYS HG3 1 1 9 2916 1 1 4 LYS HZ1 H -15.052 3.260 4.109 1.00 . A A . 4 LYS HZ1 1 1 9 2917 1 1 4 LYS HZ2 H -15.017 3.440 5.793 1.00 . A A . 4 LYS HZ2 1 1 9 2918 1 1 4 LYS HZ3 H -14.835 1.904 5.104 1.00 . A A . 4 LYS HZ3 1 1 9 2919 1 1 4 LYS N N -9.880 3.041 1.478 1.00 . A A . 4 LYS N 1 1 9 2920 1 1 4 LYS NZ N -14.612 2.915 4.990 1.00 . A A . 4 LYS NZ 1 1 9 2921 1 1 4 LYS O O -10.512 -0.419 0.802 1.00 . A A . 4 LYS O 1 1 9 2922 1 1 5 PHE C C -7.307 -0.182 -0.429 1.00 . A A . 5 PHE C 1 1 9 2923 1 1 5 PHE CA C -8.630 0.156 -1.104 1.00 . A A . 5 PHE CA 1 1 9 2924 1 1 5 PHE CB C -8.404 0.672 -2.533 1.00 . A A . 5 PHE CB 1 1 9 2925 1 1 5 PHE CD1 C -7.818 3.119 -2.444 1.00 . A A . 5 PHE CD1 1 1 9 2926 1 1 5 PHE CD2 C -6.092 1.556 -2.962 1.00 . A A . 5 PHE CD2 1 1 9 2927 1 1 5 PHE CE1 C -6.913 4.157 -2.559 1.00 . A A . 5 PHE CE1 1 1 9 2928 1 1 5 PHE CE2 C -5.184 2.590 -3.077 1.00 . A A . 5 PHE CE2 1 1 9 2929 1 1 5 PHE CG C -7.419 1.807 -2.645 1.00 . A A . 5 PHE CG 1 1 9 2930 1 1 5 PHE CZ C -5.594 3.892 -2.874 1.00 . A A . 5 PHE CZ 1 1 9 2931 1 1 5 PHE H H -9.213 2.092 -0.468 1.00 . A A . 5 PHE H 1 1 9 2932 1 1 5 PHE HA H -9.239 -0.737 -1.142 1.00 . A A . 5 PHE HA 1 1 9 2933 1 1 5 PHE HB2 H -8.039 -0.141 -3.144 1.00 . A A . 5 PHE HB2 1 1 9 2934 1 1 5 PHE HB3 H -9.349 1.013 -2.933 1.00 . A A . 5 PHE HB3 1 1 9 2935 1 1 5 PHE HD1 H -8.848 3.329 -2.195 1.00 . A A . 5 PHE HD1 1 1 9 2936 1 1 5 PHE HD2 H -5.770 0.537 -3.118 1.00 . A A . 5 PHE HD2 1 1 9 2937 1 1 5 PHE HE1 H -7.236 5.176 -2.400 1.00 . A A . 5 PHE HE1 1 1 9 2938 1 1 5 PHE HE2 H -4.154 2.381 -3.324 1.00 . A A . 5 PHE HE2 1 1 9 2939 1 1 5 PHE HZ H -4.887 4.701 -2.965 1.00 . A A . 5 PHE HZ 1 1 9 2940 1 1 5 PHE N N -9.336 1.134 -0.293 1.00 . A A . 5 PHE N 1 1 9 2941 1 1 5 PHE O O -6.518 -0.987 -0.923 1.00 . A A . 5 PHE O 1 1 9 2942 1 1 6 LEU C C -5.806 -1.147 2.108 1.00 . A A . 6 LEU C 1 1 9 2943 1 1 6 LEU CA C -5.851 0.241 1.481 1.00 . A A . 6 LEU CA 1 1 9 2944 1 1 6 LEU CB C -5.721 1.319 2.561 1.00 . A A . 6 LEU CB 1 1 9 2945 1 1 6 LEU CD1 C -3.247 1.691 2.360 1.00 . A A . 6 LEU CD1 1 1 9 2946 1 1 6 LEU CD2 C -4.440 2.337 4.462 1.00 . A A . 6 LEU CD2 1 1 9 2947 1 1 6 LEU CG C -4.384 1.348 3.308 1.00 . A A . 6 LEU CG 1 1 9 2948 1 1 6 LEU H H -7.782 1.018 1.102 1.00 . A A . 6 LEU H 1 1 9 2949 1 1 6 LEU HA H -5.026 0.334 0.790 1.00 . A A . 6 LEU HA 1 1 9 2950 1 1 6 LEU HB2 H -5.867 2.281 2.093 1.00 . A A . 6 LEU HB2 1 1 9 2951 1 1 6 LEU HB3 H -6.507 1.166 3.284 1.00 . A A . 6 LEU HB3 1 1 9 2952 1 1 6 LEU HD11 H -3.432 2.656 1.911 1.00 . A A . 6 LEU HD11 1 1 9 2953 1 1 6 LEU HD12 H -3.185 0.941 1.585 1.00 . A A . 6 LEU HD12 1 1 9 2954 1 1 6 LEU HD13 H -2.315 1.720 2.909 1.00 . A A . 6 LEU HD13 1 1 9 2955 1 1 6 LEU HD21 H -5.213 2.040 5.155 1.00 . A A . 6 LEU HD21 1 1 9 2956 1 1 6 LEU HD22 H -4.658 3.324 4.079 1.00 . A A . 6 LEU HD22 1 1 9 2957 1 1 6 LEU HD23 H -3.488 2.352 4.970 1.00 . A A . 6 LEU HD23 1 1 9 2958 1 1 6 LEU HG H -4.189 0.369 3.718 1.00 . A A . 6 LEU HG 1 1 9 2959 1 1 6 LEU N N -7.088 0.427 0.734 1.00 . A A . 6 LEU N 1 1 9 2960 1 1 6 LEU O O -4.761 -1.593 2.572 1.00 . A A . 6 LEU O 1 1 9 2961 1 1 7 HIS C C -6.080 -4.099 1.800 1.00 . A A . 7 HIS C 1 1 9 2962 1 1 7 HIS CA C -6.997 -3.193 2.612 1.00 . A A . 7 HIS CA 1 1 9 2963 1 1 7 HIS CB C -8.432 -3.728 2.583 1.00 . A A . 7 HIS CB 1 1 9 2964 1 1 7 HIS CD2 C -9.720 -1.771 3.715 1.00 . A A . 7 HIS CD2 1 1 9 2965 1 1 7 HIS CE1 C -10.734 -2.922 5.275 1.00 . A A . 7 HIS CE1 1 1 9 2966 1 1 7 HIS CG C -9.347 -3.066 3.573 1.00 . A A . 7 HIS CG 1 1 9 2967 1 1 7 HIS H H -7.739 -1.426 1.710 1.00 . A A . 7 HIS H 1 1 9 2968 1 1 7 HIS HA H -6.649 -3.171 3.635 1.00 . A A . 7 HIS HA 1 1 9 2969 1 1 7 HIS HB2 H -8.843 -3.574 1.595 1.00 . A A . 7 HIS HB2 1 1 9 2970 1 1 7 HIS HB3 H -8.417 -4.785 2.800 1.00 . A A . 7 HIS HB3 1 1 9 2971 1 1 7 HIS HD1 H -9.941 -4.732 4.722 1.00 . A A . 7 HIS HD1 1 1 9 2972 1 1 7 HIS HD2 H -9.391 -0.938 3.106 1.00 . A A . 7 HIS HD2 1 1 9 2973 1 1 7 HIS HE1 H -11.349 -3.184 6.121 1.00 . A A . 7 HIS HE1 1 1 9 2974 1 1 7 HIS HE2 H -10.856 -0.876 5.239 1.00 . A A . 7 HIS HE2 1 1 9 2975 1 1 7 HIS N N -6.936 -1.836 2.092 1.00 . A A . 7 HIS N 1 1 9 2976 1 1 7 HIS ND1 N -10.002 -3.758 4.564 1.00 . A A . 7 HIS ND1 1 1 9 2977 1 1 7 HIS NE2 N -10.582 -1.709 4.781 1.00 . A A . 7 HIS NE2 1 1 9 2978 1 1 7 HIS O O -5.218 -4.786 2.349 1.00 . A A . 7 HIS O 1 1 9 2979 1 1 8 SER C C -4.107 -4.111 -0.686 1.00 . A A . 8 SER C 1 1 9 2980 1 1 8 SER CA C -5.400 -4.855 -0.395 1.00 . A A . 8 SER CA 1 1 9 2981 1 1 8 SER CB C -6.128 -5.164 -1.692 1.00 . A A . 8 SER CB 1 1 9 2982 1 1 8 SER H H -6.968 -3.533 0.094 1.00 . A A . 8 SER H 1 1 9 2983 1 1 8 SER HA H -5.160 -5.777 0.108 1.00 . A A . 8 SER HA 1 1 9 2984 1 1 8 SER HB2 H -6.230 -4.258 -2.272 1.00 . A A . 8 SER HB2 1 1 9 2985 1 1 8 SER HB3 H -5.558 -5.886 -2.248 1.00 . A A . 8 SER HB3 1 1 9 2986 1 1 8 SER HG H -7.731 -6.171 -2.219 1.00 . A A . 8 SER HG 1 1 9 2987 1 1 8 SER N N -6.247 -4.075 0.483 1.00 . A A . 8 SER N 1 1 9 2988 1 1 8 SER O O -3.096 -4.720 -1.037 1.00 . A A . 8 SER O 1 1 9 2989 1 1 8 SER OG O -7.418 -5.692 -1.436 1.00 . A A . 8 SER OG 1 1 9 2990 1 1 9 ALA C C -1.956 -2.272 0.466 1.00 . A A . 9 ALA C 1 1 9 2991 1 1 9 ALA CA C -2.937 -1.978 -0.665 1.00 . A A . 9 ALA CA 1 1 9 2992 1 1 9 ALA CB C -3.286 -0.497 -0.698 1.00 . A A . 9 ALA CB 1 1 9 2993 1 1 9 ALA H H -4.988 -2.355 -0.305 1.00 . A A . 9 ALA H 1 1 9 2994 1 1 9 ALA HA H -2.474 -2.237 -1.606 1.00 . A A . 9 ALA HA 1 1 9 2995 1 1 9 ALA HB1 H -2.393 0.080 -0.886 1.00 . A A . 9 ALA HB1 1 1 9 2996 1 1 9 ALA HB2 H -3.708 -0.206 0.251 1.00 . A A . 9 ALA HB2 1 1 9 2997 1 1 9 ALA HB3 H -4.005 -0.313 -1.482 1.00 . A A . 9 ALA HB3 1 1 9 2998 1 1 9 ALA N N -4.135 -2.793 -0.520 1.00 . A A . 9 ALA N 1 1 9 2999 1 1 9 ALA O O -0.826 -1.798 0.464 1.00 . A A . 9 ALA O 1 1 9 3000 1 1 10 LYS C C -1.354 -5.045 2.396 1.00 . A A . 10 LYS C 1 1 9 3001 1 1 10 LYS CA C -1.534 -3.533 2.500 1.00 . A A . 10 LYS CA 1 1 9 3002 1 1 10 LYS CB C -2.092 -3.167 3.875 1.00 . A A . 10 LYS CB 1 1 9 3003 1 1 10 LYS CD C -2.763 -1.354 5.488 1.00 . A A . 10 LYS CD 1 1 9 3004 1 1 10 LYS CE C -2.055 -2.028 6.649 1.00 . A A . 10 LYS CE 1 1 9 3005 1 1 10 LYS CG C -2.088 -1.673 4.164 1.00 . A A . 10 LYS CG 1 1 9 3006 1 1 10 LYS H H -3.362 -3.282 1.461 1.00 . A A . 10 LYS H 1 1 9 3007 1 1 10 LYS HA H -0.569 -3.062 2.373 1.00 . A A . 10 LYS HA 1 1 9 3008 1 1 10 LYS HB2 H -3.111 -3.521 3.941 1.00 . A A . 10 LYS HB2 1 1 9 3009 1 1 10 LYS HB3 H -1.500 -3.659 4.633 1.00 . A A . 10 LYS HB3 1 1 9 3010 1 1 10 LYS HD2 H -2.747 -0.285 5.642 1.00 . A A . 10 LYS HD2 1 1 9 3011 1 1 10 LYS HD3 H -3.786 -1.698 5.452 1.00 . A A . 10 LYS HD3 1 1 9 3012 1 1 10 LYS HE2 H -2.100 -3.097 6.511 1.00 . A A . 10 LYS HE2 1 1 9 3013 1 1 10 LYS HE3 H -1.022 -1.712 6.658 1.00 . A A . 10 LYS HE3 1 1 9 3014 1 1 10 LYS HG2 H -1.065 -1.327 4.205 1.00 . A A . 10 LYS HG2 1 1 9 3015 1 1 10 LYS HG3 H -2.612 -1.160 3.371 1.00 . A A . 10 LYS HG3 1 1 9 3016 1 1 10 LYS HZ1 H -3.696 -1.913 7.937 1.00 . A A . 10 LYS HZ1 1 1 9 3017 1 1 10 LYS HZ2 H -2.568 -0.662 8.141 1.00 . A A . 10 LYS HZ2 1 1 9 3018 1 1 10 LYS HZ3 H -2.221 -2.223 8.720 1.00 . A A . 10 LYS HZ3 1 1 9 3019 1 1 10 LYS N N -2.409 -3.048 1.442 1.00 . A A . 10 LYS N 1 1 9 3020 1 1 10 LYS NZ N -2.678 -1.682 7.952 1.00 . A A . 10 LYS NZ 1 1 9 3021 1 1 10 LYS O O -0.451 -5.615 3.010 1.00 . A A . 10 LYS O 1 1 9 3022 1 1 11 LYS C C -1.117 -7.439 0.318 1.00 . A A . 11 LYS C 1 1 9 3023 1 1 11 LYS CA C -2.116 -7.135 1.429 1.00 . A A . 11 LYS CA 1 1 9 3024 1 1 11 LYS CB C -3.482 -7.730 1.084 1.00 . A A . 11 LYS CB 1 1 9 3025 1 1 11 LYS CD C -3.417 -9.724 2.608 1.00 . A A . 11 LYS CD 1 1 9 3026 1 1 11 LYS CE C -3.429 -11.244 2.711 1.00 . A A . 11 LYS CE 1 1 9 3027 1 1 11 LYS CG C -3.521 -9.249 1.167 1.00 . A A . 11 LYS CG 1 1 9 3028 1 1 11 LYS H H -2.922 -5.198 1.156 1.00 . A A . 11 LYS H 1 1 9 3029 1 1 11 LYS HA H -1.759 -7.568 2.351 1.00 . A A . 11 LYS HA 1 1 9 3030 1 1 11 LYS HB2 H -4.220 -7.334 1.767 1.00 . A A . 11 LYS HB2 1 1 9 3031 1 1 11 LYS HB3 H -3.744 -7.440 0.078 1.00 . A A . 11 LYS HB3 1 1 9 3032 1 1 11 LYS HD2 H -2.495 -9.354 3.030 1.00 . A A . 11 LYS HD2 1 1 9 3033 1 1 11 LYS HD3 H -4.252 -9.329 3.167 1.00 . A A . 11 LYS HD3 1 1 9 3034 1 1 11 LYS HE2 H -3.556 -11.518 3.747 1.00 . A A . 11 LYS HE2 1 1 9 3035 1 1 11 LYS HE3 H -4.258 -11.625 2.135 1.00 . A A . 11 LYS HE3 1 1 9 3036 1 1 11 LYS HG2 H -4.451 -9.601 0.745 1.00 . A A . 11 LYS HG2 1 1 9 3037 1 1 11 LYS HG3 H -2.693 -9.651 0.602 1.00 . A A . 11 LYS HG3 1 1 9 3038 1 1 11 LYS HZ1 H -1.347 -11.442 2.695 1.00 . A A . 11 LYS HZ1 1 1 9 3039 1 1 11 LYS HZ2 H -2.071 -11.691 1.181 1.00 . A A . 11 LYS HZ2 1 1 9 3040 1 1 11 LYS HZ3 H -2.179 -12.884 2.380 1.00 . A A . 11 LYS HZ3 1 1 9 3041 1 1 11 LYS N N -2.212 -5.696 1.617 1.00 . A A . 11 LYS N 1 1 9 3042 1 1 11 LYS NZ N -2.170 -11.855 2.206 1.00 . A A . 11 LYS NZ 1 1 9 3043 1 1 11 LYS O O -0.145 -8.166 0.521 1.00 . A A . 11 LYS O 1 1 9 3044 1 1 12 PHE C C 0.321 -5.750 -2.204 1.00 . A A . 12 PHE C 1 1 9 3045 1 1 12 PHE CA C -0.481 -7.021 -1.992 1.00 . A A . 12 PHE CA 1 1 9 3046 1 1 12 PHE CB C -1.285 -7.320 -3.263 1.00 . A A . 12 PHE CB 1 1 9 3047 1 1 12 PHE CD1 C -1.595 -9.797 -3.540 1.00 . A A . 12 PHE CD1 1 1 9 3048 1 1 12 PHE CD2 C -3.448 -8.497 -2.786 1.00 . A A . 12 PHE CD2 1 1 9 3049 1 1 12 PHE CE1 C -2.370 -10.938 -3.480 1.00 . A A . 12 PHE CE1 1 1 9 3050 1 1 12 PHE CE2 C -4.225 -9.636 -2.724 1.00 . A A . 12 PHE CE2 1 1 9 3051 1 1 12 PHE CG C -2.125 -8.565 -3.192 1.00 . A A . 12 PHE CG 1 1 9 3052 1 1 12 PHE CZ C -3.687 -10.858 -3.071 1.00 . A A . 12 PHE CZ 1 1 9 3053 1 1 12 PHE H H -2.152 -6.277 -0.932 1.00 . A A . 12 PHE H 1 1 9 3054 1 1 12 PHE HA H 0.192 -7.839 -1.791 1.00 . A A . 12 PHE HA 1 1 9 3055 1 1 12 PHE HB2 H -1.946 -6.490 -3.459 1.00 . A A . 12 PHE HB2 1 1 9 3056 1 1 12 PHE HB3 H -0.599 -7.425 -4.091 1.00 . A A . 12 PHE HB3 1 1 9 3057 1 1 12 PHE HD1 H -0.563 -9.860 -3.860 1.00 . A A . 12 PHE HD1 1 1 9 3058 1 1 12 PHE HD2 H -3.872 -7.541 -2.514 1.00 . A A . 12 PHE HD2 1 1 9 3059 1 1 12 PHE HE1 H -1.946 -11.893 -3.750 1.00 . A A . 12 PHE HE1 1 1 9 3060 1 1 12 PHE HE2 H -5.255 -9.571 -2.405 1.00 . A A . 12 PHE HE2 1 1 9 3061 1 1 12 PHE HZ H -4.294 -11.752 -3.025 1.00 . A A . 12 PHE HZ 1 1 9 3062 1 1 12 PHE N N -1.361 -6.854 -0.844 1.00 . A A . 12 PHE N 1 1 9 3063 1 1 12 PHE O O 1.498 -5.786 -2.569 1.00 . A A . 12 PHE O 1 1 9 3064 1 1 13 GLY C C 1.338 -2.987 -1.144 1.00 . A A . 13 GLY C 1 1 9 3065 1 1 13 GLY CA C 0.284 -3.331 -2.174 1.00 . A A . 13 GLY CA 1 1 9 3066 1 1 13 GLY H H -1.254 -4.665 -1.612 1.00 . A A . 13 GLY H 1 1 9 3067 1 1 13 GLY HA2 H 0.743 -3.330 -3.150 1.00 . A A . 13 GLY HA2 1 1 9 3068 1 1 13 GLY HA3 H -0.484 -2.571 -2.152 1.00 . A A . 13 GLY HA3 1 1 9 3069 1 1 13 GLY N N -0.332 -4.621 -1.949 1.00 . A A . 13 GLY N 1 1 9 3070 1 1 13 GLY O O 2.002 -1.963 -1.263 1.00 . A A . 13 GLY O 1 1 9 3071 1 1 14 LYS C C 3.901 -3.547 0.285 1.00 . A A . 14 LYS C 1 1 9 3072 1 1 14 LYS CA C 2.502 -3.600 0.903 1.00 . A A . 14 LYS CA 1 1 9 3073 1 1 14 LYS CB C 2.454 -4.682 1.987 1.00 . A A . 14 LYS CB 1 1 9 3074 1 1 14 LYS CD C 3.304 -5.481 4.226 1.00 . A A . 14 LYS CD 1 1 9 3075 1 1 14 LYS CE C 4.215 -5.170 5.404 1.00 . A A . 14 LYS CE 1 1 9 3076 1 1 14 LYS CG C 3.376 -4.395 3.166 1.00 . A A . 14 LYS CG 1 1 9 3077 1 1 14 LYS H H 0.917 -4.622 -0.069 1.00 . A A . 14 LYS H 1 1 9 3078 1 1 14 LYS HA H 2.288 -2.642 1.356 1.00 . A A . 14 LYS HA 1 1 9 3079 1 1 14 LYS HB2 H 1.441 -4.765 2.358 1.00 . A A . 14 LYS HB2 1 1 9 3080 1 1 14 LYS HB3 H 2.746 -5.627 1.551 1.00 . A A . 14 LYS HB3 1 1 9 3081 1 1 14 LYS HD2 H 2.287 -5.560 4.581 1.00 . A A . 14 LYS HD2 1 1 9 3082 1 1 14 LYS HD3 H 3.607 -6.420 3.786 1.00 . A A . 14 LYS HD3 1 1 9 3083 1 1 14 LYS HE2 H 3.943 -4.207 5.809 1.00 . A A . 14 LYS HE2 1 1 9 3084 1 1 14 LYS HE3 H 4.077 -5.930 6.160 1.00 . A A . 14 LYS HE3 1 1 9 3085 1 1 14 LYS HG2 H 4.391 -4.330 2.805 1.00 . A A . 14 LYS HG2 1 1 9 3086 1 1 14 LYS HG3 H 3.091 -3.452 3.610 1.00 . A A . 14 LYS HG3 1 1 9 3087 1 1 14 LYS HZ1 H 6.228 -4.741 5.781 1.00 . A A . 14 LYS HZ1 1 1 9 3088 1 1 14 LYS HZ2 H 5.778 -4.557 4.156 1.00 . A A . 14 LYS HZ2 1 1 9 3089 1 1 14 LYS HZ3 H 5.984 -6.106 4.805 1.00 . A A . 14 LYS HZ3 1 1 9 3090 1 1 14 LYS N N 1.497 -3.835 -0.130 1.00 . A A . 14 LYS N 1 1 9 3091 1 1 14 LYS NZ N 5.649 -5.139 5.010 1.00 . A A . 14 LYS NZ 1 1 9 3092 1 1 14 LYS O O 4.779 -2.840 0.773 1.00 . A A . 14 LYS O 1 1 9 3093 1 1 15 ALA C C 5.556 -3.013 -2.316 1.00 . A A . 15 ALA C 1 1 9 3094 1 1 15 ALA CA C 5.363 -4.296 -1.512 1.00 . A A . 15 ALA CA 1 1 9 3095 1 1 15 ALA CB C 5.452 -5.517 -2.417 1.00 . A A . 15 ALA CB 1 1 9 3096 1 1 15 ALA H H 3.349 -4.831 -1.146 1.00 . A A . 15 ALA H 1 1 9 3097 1 1 15 ALA HA H 6.151 -4.366 -0.775 1.00 . A A . 15 ALA HA 1 1 9 3098 1 1 15 ALA HB1 H 6.434 -5.565 -2.863 1.00 . A A . 15 ALA HB1 1 1 9 3099 1 1 15 ALA HB2 H 4.708 -5.444 -3.196 1.00 . A A . 15 ALA HB2 1 1 9 3100 1 1 15 ALA HB3 H 5.277 -6.409 -1.835 1.00 . A A . 15 ALA HB3 1 1 9 3101 1 1 15 ALA N N 4.089 -4.283 -0.806 1.00 . A A . 15 ALA N 1 1 9 3102 1 1 15 ALA O O 6.647 -2.731 -2.805 1.00 . A A . 15 ALA O 1 1 9 3103 1 1 16 PHE C C 4.571 0.202 -2.227 1.00 . A A . 16 PHE C 1 1 9 3104 1 1 16 PHE CA C 4.534 -0.985 -3.183 1.00 . A A . 16 PHE CA 1 1 9 3105 1 1 16 PHE CB C 3.330 -0.877 -4.121 1.00 . A A . 16 PHE CB 1 1 9 3106 1 1 16 PHE CD1 C 4.093 -1.987 -6.237 1.00 . A A . 16 PHE CD1 1 1 9 3107 1 1 16 PHE CD2 C 2.364 -3.030 -4.972 1.00 . A A . 16 PHE CD2 1 1 9 3108 1 1 16 PHE CE1 C 4.031 -3.005 -7.169 1.00 . A A . 16 PHE CE1 1 1 9 3109 1 1 16 PHE CE2 C 2.295 -4.052 -5.900 1.00 . A A . 16 PHE CE2 1 1 9 3110 1 1 16 PHE CG C 3.258 -1.984 -5.133 1.00 . A A . 16 PHE CG 1 1 9 3111 1 1 16 PHE CZ C 3.134 -4.040 -7.000 1.00 . A A . 16 PHE CZ 1 1 9 3112 1 1 16 PHE H H 3.646 -2.512 -2.021 1.00 . A A . 16 PHE H 1 1 9 3113 1 1 16 PHE HA H 5.439 -0.983 -3.774 1.00 . A A . 16 PHE HA 1 1 9 3114 1 1 16 PHE HB2 H 2.424 -0.905 -3.535 1.00 . A A . 16 PHE HB2 1 1 9 3115 1 1 16 PHE HB3 H 3.381 0.060 -4.654 1.00 . A A . 16 PHE HB3 1 1 9 3116 1 1 16 PHE HD1 H 4.798 -1.178 -6.372 1.00 . A A . 16 PHE HD1 1 1 9 3117 1 1 16 PHE HD2 H 1.709 -3.040 -4.113 1.00 . A A . 16 PHE HD2 1 1 9 3118 1 1 16 PHE HE1 H 4.687 -2.993 -8.027 1.00 . A A . 16 PHE HE1 1 1 9 3119 1 1 16 PHE HE2 H 1.594 -4.860 -5.762 1.00 . A A . 16 PHE HE2 1 1 9 3120 1 1 16 PHE HZ H 3.084 -4.839 -7.729 1.00 . A A . 16 PHE HZ 1 1 9 3121 1 1 16 PHE N N 4.489 -2.237 -2.443 1.00 . A A . 16 PHE N 1 1 9 3122 1 1 16 PHE O O 5.406 1.095 -2.369 1.00 . A A . 16 PHE O 1 1 9 3123 1 1 17 VAL C C 4.914 1.181 0.620 1.00 . A A . 17 VAL C 1 1 9 3124 1 1 17 VAL CA C 3.660 1.265 -0.242 1.00 . A A . 17 VAL CA 1 1 9 3125 1 1 17 VAL CB C 2.386 1.216 0.643 1.00 . A A . 17 VAL CB 1 1 9 3126 1 1 17 VAL CG1 C 2.320 -0.066 1.459 1.00 . A A . 17 VAL CG1 1 1 9 3127 1 1 17 VAL CG2 C 2.319 2.433 1.555 1.00 . A A . 17 VAL CG2 1 1 9 3128 1 1 17 VAL H H 3.056 -0.552 -1.151 1.00 . A A . 17 VAL H 1 1 9 3129 1 1 17 VAL HA H 3.670 2.207 -0.776 1.00 . A A . 17 VAL HA 1 1 9 3130 1 1 17 VAL HB H 1.525 1.240 -0.008 1.00 . A A . 17 VAL HB 1 1 9 3131 1 1 17 VAL HG11 H 2.255 -0.913 0.791 1.00 . A A . 17 VAL HG11 1 1 9 3132 1 1 17 VAL HG12 H 1.449 -0.046 2.096 1.00 . A A . 17 VAL HG12 1 1 9 3133 1 1 17 VAL HG13 H 3.208 -0.153 2.064 1.00 . A A . 17 VAL HG13 1 1 9 3134 1 1 17 VAL HG21 H 3.191 2.453 2.191 1.00 . A A . 17 VAL HG21 1 1 9 3135 1 1 17 VAL HG22 H 1.431 2.378 2.166 1.00 . A A . 17 VAL HG22 1 1 9 3136 1 1 17 VAL HG23 H 2.289 3.330 0.956 1.00 . A A . 17 VAL HG23 1 1 9 3137 1 1 17 VAL N N 3.690 0.195 -1.231 1.00 . A A . 17 VAL N 1 1 9 3138 1 1 17 VAL O O 5.475 2.196 1.034 1.00 . A A . 17 VAL O 1 1 9 3139 1 1 18 GLY C C 7.820 -0.145 0.650 1.00 . A A . 18 GLY C 1 1 9 3140 1 1 18 GLY CA C 6.609 -0.270 1.555 1.00 . A A . 18 GLY CA 1 1 9 3141 1 1 18 GLY H H 4.878 -0.814 0.482 1.00 . A A . 18 GLY H 1 1 9 3142 1 1 18 GLY HA2 H 6.685 0.453 2.354 1.00 . A A . 18 GLY HA2 1 1 9 3143 1 1 18 GLY HA3 H 6.586 -1.263 1.976 1.00 . A A . 18 GLY HA3 1 1 9 3144 1 1 18 GLY N N 5.381 -0.046 0.829 1.00 . A A . 18 GLY N 1 1 9 3145 1 1 18 GLY O O 8.907 -0.613 0.983 1.00 . A A . 18 GLY O 1 1 9 3146 1 1 19 GLU C C 8.742 2.225 -1.732 1.00 . A A . 19 GLU C 1 1 9 3147 1 1 19 GLU CA C 8.684 0.727 -1.455 1.00 . A A . 19 GLU CA 1 1 9 3148 1 1 19 GLU CB C 8.457 -0.048 -2.755 1.00 . A A . 19 GLU CB 1 1 9 3149 1 1 19 GLU CD C 10.860 -0.748 -3.089 1.00 . A A . 19 GLU CD 1 1 9 3150 1 1 19 GLU CG C 9.657 -0.048 -3.686 1.00 . A A . 19 GLU CG 1 1 9 3151 1 1 19 GLU H H 6.698 0.724 -0.746 1.00 . A A . 19 GLU H 1 1 9 3152 1 1 19 GLU HA H 9.613 0.411 -1.008 1.00 . A A . 19 GLU HA 1 1 9 3153 1 1 19 GLU HB2 H 8.218 -1.074 -2.512 1.00 . A A . 19 GLU HB2 1 1 9 3154 1 1 19 GLU HB3 H 7.622 0.390 -3.281 1.00 . A A . 19 GLU HB3 1 1 9 3155 1 1 19 GLU HG2 H 9.387 -0.551 -4.602 1.00 . A A . 19 GLU HG2 1 1 9 3156 1 1 19 GLU HG3 H 9.926 0.975 -3.903 1.00 . A A . 19 GLU HG3 1 1 9 3157 1 1 19 GLU N N 7.610 0.458 -0.512 1.00 . A A . 19 GLU N 1 1 9 3158 1 1 19 GLU O O 9.813 2.826 -1.750 1.00 . A A . 19 GLU O 1 1 9 3159 1 1 19 GLU OE1 O 10.910 -1.997 -3.130 1.00 . A A . 19 GLU OE1 1 1 9 3160 1 1 19 GLU OE2 O 11.768 -0.055 -2.581 1.00 . A A . 19 GLU OE2 1 1 9 3161 1 1 20 ILE C C 7.946 5.019 -0.891 1.00 . A A . 20 ILE C 1 1 9 3162 1 1 20 ILE CA C 7.469 4.265 -2.131 1.00 . A A . 20 ILE CA 1 1 9 3163 1 1 20 ILE CB C 6.017 4.681 -2.469 1.00 . A A . 20 ILE CB 1 1 9 3164 1 1 20 ILE CD1 C 4.111 4.284 -4.124 1.00 . A A . 20 ILE CD1 1 1 9 3165 1 1 20 ILE CG1 C 5.543 3.967 -3.742 1.00 . A A . 20 ILE CG1 1 1 9 3166 1 1 20 ILE CG2 C 5.907 6.192 -2.629 1.00 . A A . 20 ILE CG2 1 1 9 3167 1 1 20 ILE H H 6.752 2.282 -1.947 1.00 . A A . 20 ILE H 1 1 9 3168 1 1 20 ILE HA H 8.103 4.528 -2.965 1.00 . A A . 20 ILE HA 1 1 9 3169 1 1 20 ILE HB H 5.382 4.387 -1.648 1.00 . A A . 20 ILE HB 1 1 9 3170 1 1 20 ILE HD11 H 4.013 5.343 -4.314 1.00 . A A . 20 ILE HD11 1 1 9 3171 1 1 20 ILE HD12 H 3.453 4.000 -3.318 1.00 . A A . 20 ILE HD12 1 1 9 3172 1 1 20 ILE HD13 H 3.844 3.733 -5.013 1.00 . A A . 20 ILE HD13 1 1 9 3173 1 1 20 ILE HG12 H 6.177 4.259 -4.566 1.00 . A A . 20 ILE HG12 1 1 9 3174 1 1 20 ILE HG13 H 5.619 2.899 -3.594 1.00 . A A . 20 ILE HG13 1 1 9 3175 1 1 20 ILE HG21 H 6.228 6.675 -1.719 1.00 . A A . 20 ILE HG21 1 1 9 3176 1 1 20 ILE HG22 H 4.881 6.459 -2.835 1.00 . A A . 20 ILE HG22 1 1 9 3177 1 1 20 ILE HG23 H 6.533 6.514 -3.449 1.00 . A A . 20 ILE HG23 1 1 9 3178 1 1 20 ILE N N 7.571 2.826 -1.923 1.00 . A A . 20 ILE N 1 1 9 3179 1 1 20 ILE O O 8.574 6.071 -0.995 1.00 . A A . 20 ILE O 1 1 9 3180 1 1 21 MET C C 9.591 4.969 1.753 1.00 . A A . 21 MET C 1 1 9 3181 1 1 21 MET CA C 8.082 5.074 1.543 1.00 . A A . 21 MET CA 1 1 9 3182 1 1 21 MET CB C 7.350 4.430 2.720 1.00 . A A . 21 MET CB 1 1 9 3183 1 1 21 MET CE C 5.963 4.634 5.543 1.00 . A A . 21 MET CE 1 1 9 3184 1 1 21 MET CG C 5.863 4.747 2.774 1.00 . A A . 21 MET CG 1 1 9 3185 1 1 21 MET H H 7.178 3.611 0.303 1.00 . A A . 21 MET H 1 1 9 3186 1 1 21 MET HA H 7.814 6.121 1.498 1.00 . A A . 21 MET HA 1 1 9 3187 1 1 21 MET HB2 H 7.464 3.358 2.653 1.00 . A A . 21 MET HB2 1 1 9 3188 1 1 21 MET HB3 H 7.802 4.773 3.638 1.00 . A A . 21 MET HB3 1 1 9 3189 1 1 21 MET HE1 H 5.571 4.245 6.471 1.00 . A A . 21 MET HE1 1 1 9 3190 1 1 21 MET HE2 H 5.875 5.711 5.539 1.00 . A A . 21 MET HE2 1 1 9 3191 1 1 21 MET HE3 H 7.003 4.358 5.447 1.00 . A A . 21 MET HE3 1 1 9 3192 1 1 21 MET HG2 H 5.739 5.818 2.862 1.00 . A A . 21 MET HG2 1 1 9 3193 1 1 21 MET HG3 H 5.403 4.407 1.859 1.00 . A A . 21 MET HG3 1 1 9 3194 1 1 21 MET N N 7.672 4.458 0.282 1.00 . A A . 21 MET N 1 1 9 3195 1 1 21 MET O O 10.144 5.569 2.679 1.00 . A A . 21 MET O 1 1 9 3196 1 1 21 MET SD S 5.036 3.955 4.168 1.00 . A A . 21 MET SD 1 1 9 3197 1 1 22 ASN C C 12.352 5.265 0.239 1.00 . A A . 22 ASN C 1 1 9 3198 1 1 22 ASN CA C 11.708 4.082 0.949 1.00 . A A . 22 ASN CA 1 1 9 3199 1 1 22 ASN CB C 12.180 2.776 0.299 1.00 . A A . 22 ASN CB 1 1 9 3200 1 1 22 ASN CG C 11.626 1.537 0.973 1.00 . A A . 22 ASN CG 1 1 9 3201 1 1 22 ASN H H 9.758 3.718 0.203 1.00 . A A . 22 ASN H 1 1 9 3202 1 1 22 ASN HA H 12.005 4.091 1.987 1.00 . A A . 22 ASN HA 1 1 9 3203 1 1 22 ASN HB2 H 11.874 2.764 -0.736 1.00 . A A . 22 ASN HB2 1 1 9 3204 1 1 22 ASN HB3 H 13.260 2.732 0.346 1.00 . A A . 22 ASN HB3 1 1 9 3205 1 1 22 ASN HD21 H 11.753 0.522 -0.734 1.00 . A A . 22 ASN HD21 1 1 9 3206 1 1 22 ASN HD22 H 11.140 -0.357 0.627 1.00 . A A . 22 ASN HD22 1 1 9 3207 1 1 22 ASN N N 10.255 4.207 0.894 1.00 . A A . 22 ASN N 1 1 9 3208 1 1 22 ASN ND2 N 11.489 0.463 0.213 1.00 . A A . 22 ASN ND2 1 1 9 3209 1 1 22 ASN O O 13.556 5.496 0.356 1.00 . A A . 22 ASN O 1 1 9 3210 1 1 22 ASN OD1 O 11.326 1.539 2.168 1.00 . A A . 22 ASN OD1 1 1 9 3211 1 1 23 SER C C 11.598 8.448 -0.540 1.00 . A A . 23 SER C 1 1 9 3212 1 1 23 SER CA C 12.018 7.158 -1.241 1.00 . A A . 23 SER CA 1 1 9 3213 1 1 23 SER CB C 11.465 7.107 -2.670 1.00 . A A . 23 SER CB 1 1 9 3214 1 1 23 SER H H 10.582 5.793 -0.518 1.00 . A A . 23 SER H 1 1 9 3215 1 1 23 SER HA H 13.096 7.112 -1.275 1.00 . A A . 23 SER HA 1 1 9 3216 1 1 23 SER HB2 H 11.622 6.122 -3.076 1.00 . A A . 23 SER HB2 1 1 9 3217 1 1 23 SER HB3 H 10.406 7.323 -2.651 1.00 . A A . 23 SER HB3 1 1 9 3218 1 1 23 SER HG H 13.048 7.825 -3.586 1.00 . A A . 23 SER HG 1 1 9 3219 1 1 23 SER N N 11.540 6.014 -0.491 1.00 . A A . 23 SER N 1 1 9 3220 1 1 23 SER O O 10.435 8.870 -0.707 1.00 . A A . 23 SER O 1 1 9 3221 1 1 23 SER OXT O 12.429 9.027 0.191 1.00 . A A . 23 SER OXT 1 1 9 3222 1 1 23 SER OG O 12.104 8.047 -3.515 1.00 . A A . 23 SER OG 1 1 10 3223 1 1 1 GLY C C -9.876 5.380 -1.853 1.00 . A A . 1 GLY C 1 1 10 3224 1 1 1 GLY CA C -9.627 4.684 -3.166 1.00 . A A . 1 GLY CA 1 1 10 3225 1 1 1 GLY H1 H -11.640 4.447 -3.630 1.00 . A A . 1 GLY H1 1 1 10 3226 1 1 1 GLY H2 H -10.602 4.272 -4.958 1.00 . A A . 1 GLY H2 1 1 10 3227 1 1 1 GLY H3 H -10.926 5.815 -4.334 1.00 . A A . 1 GLY H3 1 1 10 3228 1 1 1 GLY HA2 H -9.447 3.635 -2.973 1.00 . A A . 1 GLY HA2 1 1 10 3229 1 1 1 GLY HA3 H -8.751 5.112 -3.634 1.00 . A A . 1 GLY HA3 1 1 10 3230 1 1 1 GLY N N -10.777 4.814 -4.086 1.00 . A A . 1 GLY N 1 1 10 3231 1 1 1 GLY O O -11.025 5.690 -1.527 1.00 . A A . 1 GLY O 1 1 10 3232 1 1 2 ILE C C -9.547 5.321 1.230 1.00 . A A . 2 ILE C 1 1 10 3233 1 1 2 ILE CA C -8.886 6.260 0.212 1.00 . A A . 2 ILE CA 1 1 10 3234 1 1 2 ILE CB C -9.652 7.609 0.146 1.00 . A A . 2 ILE CB 1 1 10 3235 1 1 2 ILE CD1 C -9.673 9.886 -1.013 1.00 . A A . 2 ILE CD1 1 1 10 3236 1 1 2 ILE CG1 C -8.942 8.573 -0.813 1.00 . A A . 2 ILE CG1 1 1 10 3237 1 1 2 ILE CG2 C -9.780 8.233 1.528 1.00 . A A . 2 ILE CG2 1 1 10 3238 1 1 2 ILE H H -7.910 5.404 -1.462 1.00 . A A . 2 ILE H 1 1 10 3239 1 1 2 ILE HA H -7.877 6.465 0.542 1.00 . A A . 2 ILE HA 1 1 10 3240 1 1 2 ILE HB H -10.647 7.414 -0.228 1.00 . A A . 2 ILE HB 1 1 10 3241 1 1 2 ILE HD11 H -10.663 9.694 -1.400 1.00 . A A . 2 ILE HD11 1 1 10 3242 1 1 2 ILE HD12 H -9.125 10.498 -1.713 1.00 . A A . 2 ILE HD12 1 1 10 3243 1 1 2 ILE HD13 H -9.750 10.403 -0.068 1.00 . A A . 2 ILE HD13 1 1 10 3244 1 1 2 ILE HG12 H -7.962 8.798 -0.421 1.00 . A A . 2 ILE HG12 1 1 10 3245 1 1 2 ILE HG13 H -8.839 8.100 -1.778 1.00 . A A . 2 ILE HG13 1 1 10 3246 1 1 2 ILE HG21 H -8.796 8.415 1.933 1.00 . A A . 2 ILE HG21 1 1 10 3247 1 1 2 ILE HG22 H -10.318 7.560 2.178 1.00 . A A . 2 ILE HG22 1 1 10 3248 1 1 2 ILE HG23 H -10.318 9.166 1.452 1.00 . A A . 2 ILE HG23 1 1 10 3249 1 1 2 ILE N N -8.801 5.633 -1.105 1.00 . A A . 2 ILE N 1 1 10 3250 1 1 2 ILE O O -10.490 4.590 0.911 1.00 . A A . 2 ILE O 1 1 10 3251 1 1 3 GLY C C -9.231 3.068 3.452 1.00 . A A . 3 GLY C 1 1 10 3252 1 1 3 GLY CA C -9.607 4.533 3.510 1.00 . A A . 3 GLY CA 1 1 10 3253 1 1 3 GLY H H -8.220 5.865 2.628 1.00 . A A . 3 GLY H 1 1 10 3254 1 1 3 GLY HA2 H -9.280 4.937 4.457 1.00 . A A . 3 GLY HA2 1 1 10 3255 1 1 3 GLY HA3 H -10.681 4.619 3.452 1.00 . A A . 3 GLY HA3 1 1 10 3256 1 1 3 GLY N N -9.020 5.316 2.444 1.00 . A A . 3 GLY N 1 1 10 3257 1 1 3 GLY O O -8.369 2.613 4.205 1.00 . A A . 3 GLY O 1 1 10 3258 1 1 4 LYS C C -8.984 0.410 1.277 1.00 . A A . 4 LYS C 1 1 10 3259 1 1 4 LYS CA C -9.712 0.878 2.520 1.00 . A A . 4 LYS CA 1 1 10 3260 1 1 4 LYS CB C -11.079 0.197 2.655 1.00 . A A . 4 LYS CB 1 1 10 3261 1 1 4 LYS CD C -13.503 0.149 2.030 1.00 . A A . 4 LYS CD 1 1 10 3262 1 1 4 LYS CE C -14.578 0.622 1.064 1.00 . A A . 4 LYS CE 1 1 10 3263 1 1 4 LYS CG C -12.120 0.652 1.642 1.00 . A A . 4 LYS CG 1 1 10 3264 1 1 4 LYS H H -10.387 2.775 1.845 1.00 . A A . 4 LYS H 1 1 10 3265 1 1 4 LYS HA H -9.110 0.610 3.375 1.00 . A A . 4 LYS HA 1 1 10 3266 1 1 4 LYS HB2 H -10.946 -0.868 2.543 1.00 . A A . 4 LYS HB2 1 1 10 3267 1 1 4 LYS HB3 H -11.464 0.397 3.644 1.00 . A A . 4 LYS HB3 1 1 10 3268 1 1 4 LYS HD2 H -13.494 -0.931 2.037 1.00 . A A . 4 LYS HD2 1 1 10 3269 1 1 4 LYS HD3 H -13.739 0.513 3.019 1.00 . A A . 4 LYS HD3 1 1 10 3270 1 1 4 LYS HE2 H -15.545 0.387 1.481 1.00 . A A . 4 LYS HE2 1 1 10 3271 1 1 4 LYS HE3 H -14.491 1.693 0.945 1.00 . A A . 4 LYS HE3 1 1 10 3272 1 1 4 LYS HG2 H -12.133 1.731 1.611 1.00 . A A . 4 LYS HG2 1 1 10 3273 1 1 4 LYS HG3 H -11.862 0.261 0.668 1.00 . A A . 4 LYS HG3 1 1 10 3274 1 1 4 LYS HZ1 H -13.581 0.279 -0.738 1.00 . A A . 4 LYS HZ1 1 1 10 3275 1 1 4 LYS HZ2 H -15.272 0.232 -0.866 1.00 . A A . 4 LYS HZ2 1 1 10 3276 1 1 4 LYS HZ3 H -14.442 -1.064 -0.161 1.00 . A A . 4 LYS HZ3 1 1 10 3277 1 1 4 LYS N N -9.848 2.330 2.537 1.00 . A A . 4 LYS N 1 1 10 3278 1 1 4 LYS NZ N -14.460 -0.025 -0.267 1.00 . A A . 4 LYS NZ 1 1 10 3279 1 1 4 LYS O O -8.624 -0.761 1.161 1.00 . A A . 4 LYS O 1 1 10 3280 1 1 5 PHE C C -6.456 0.870 -0.297 1.00 . A A . 5 PHE C 1 1 10 3281 1 1 5 PHE CA C -7.888 1.047 -0.783 1.00 . A A . 5 PHE CA 1 1 10 3282 1 1 5 PHE CB C -7.965 2.178 -1.815 1.00 . A A . 5 PHE CB 1 1 10 3283 1 1 5 PHE CD1 C -7.557 1.078 -4.036 1.00 . A A . 5 PHE CD1 1 1 10 3284 1 1 5 PHE CD2 C -5.918 2.605 -3.216 1.00 . A A . 5 PHE CD2 1 1 10 3285 1 1 5 PHE CE1 C -6.794 0.865 -5.171 1.00 . A A . 5 PHE CE1 1 1 10 3286 1 1 5 PHE CE2 C -5.151 2.397 -4.347 1.00 . A A . 5 PHE CE2 1 1 10 3287 1 1 5 PHE CG C -7.129 1.948 -3.047 1.00 . A A . 5 PHE CG 1 1 10 3288 1 1 5 PHE CZ C -5.590 1.525 -5.326 1.00 . A A . 5 PHE CZ 1 1 10 3289 1 1 5 PHE H H -9.145 2.220 0.449 1.00 . A A . 5 PHE H 1 1 10 3290 1 1 5 PHE HA H -8.223 0.126 -1.235 1.00 . A A . 5 PHE HA 1 1 10 3291 1 1 5 PHE HB2 H -8.990 2.295 -2.132 1.00 . A A . 5 PHE HB2 1 1 10 3292 1 1 5 PHE HB3 H -7.632 3.098 -1.355 1.00 . A A . 5 PHE HB3 1 1 10 3293 1 1 5 PHE HD1 H -8.496 0.562 -3.915 1.00 . A A . 5 PHE HD1 1 1 10 3294 1 1 5 PHE HD2 H -5.575 3.288 -2.451 1.00 . A A . 5 PHE HD2 1 1 10 3295 1 1 5 PHE HE1 H -7.141 0.183 -5.934 1.00 . A A . 5 PHE HE1 1 1 10 3296 1 1 5 PHE HE2 H -4.210 2.912 -4.465 1.00 . A A . 5 PHE HE2 1 1 10 3297 1 1 5 PHE HZ H -4.993 1.360 -6.211 1.00 . A A . 5 PHE HZ 1 1 10 3298 1 1 5 PHE N N -8.742 1.333 0.359 1.00 . A A . 5 PHE N 1 1 10 3299 1 1 5 PHE O O -5.625 0.254 -0.959 1.00 . A A . 5 PHE O 1 1 10 3300 1 1 6 LEU C C -4.705 -0.049 2.189 1.00 . A A . 6 LEU C 1 1 10 3301 1 1 6 LEU CA C -4.859 1.289 1.483 1.00 . A A . 6 LEU CA 1 1 10 3302 1 1 6 LEU CB C -4.592 2.439 2.463 1.00 . A A . 6 LEU CB 1 1 10 3303 1 1 6 LEU CD1 C -3.402 3.800 0.717 1.00 . A A . 6 LEU CD1 1 1 10 3304 1 1 6 LEU CD2 C -5.752 4.387 1.348 1.00 . A A . 6 LEU CD2 1 1 10 3305 1 1 6 LEU CG C -4.422 3.834 1.843 1.00 . A A . 6 LEU CG 1 1 10 3306 1 1 6 LEU H H -6.905 1.846 1.391 1.00 . A A . 6 LEU H 1 1 10 3307 1 1 6 LEU HA H -4.137 1.332 0.682 1.00 . A A . 6 LEU HA 1 1 10 3308 1 1 6 LEU HB2 H -5.415 2.481 3.160 1.00 . A A . 6 LEU HB2 1 1 10 3309 1 1 6 LEU HB3 H -3.693 2.207 3.015 1.00 . A A . 6 LEU HB3 1 1 10 3310 1 1 6 LEU HD11 H -3.765 3.163 -0.077 1.00 . A A . 6 LEU HD11 1 1 10 3311 1 1 6 LEU HD12 H -2.467 3.410 1.091 1.00 . A A . 6 LEU HD12 1 1 10 3312 1 1 6 LEU HD13 H -3.249 4.800 0.337 1.00 . A A . 6 LEU HD13 1 1 10 3313 1 1 6 LEU HD21 H -6.163 3.725 0.601 1.00 . A A . 6 LEU HD21 1 1 10 3314 1 1 6 LEU HD22 H -5.597 5.366 0.918 1.00 . A A . 6 LEU HD22 1 1 10 3315 1 1 6 LEU HD23 H -6.439 4.465 2.178 1.00 . A A . 6 LEU HD23 1 1 10 3316 1 1 6 LEU HG H -4.047 4.506 2.602 1.00 . A A . 6 LEU HG 1 1 10 3317 1 1 6 LEU N N -6.186 1.392 0.893 1.00 . A A . 6 LEU N 1 1 10 3318 1 1 6 LEU O O -3.594 -0.481 2.487 1.00 . A A . 6 LEU O 1 1 10 3319 1 1 7 HIS C C -5.420 -3.060 1.973 1.00 . A A . 7 HIS C 1 1 10 3320 1 1 7 HIS CA C -5.802 -2.038 3.033 1.00 . A A . 7 HIS CA 1 1 10 3321 1 1 7 HIS CB C -7.157 -2.391 3.659 1.00 . A A . 7 HIS CB 1 1 10 3322 1 1 7 HIS CD2 C -6.320 -4.200 5.323 1.00 . A A . 7 HIS CD2 1 1 10 3323 1 1 7 HIS CE1 C -7.851 -5.718 4.943 1.00 . A A . 7 HIS CE1 1 1 10 3324 1 1 7 HIS CG C -7.159 -3.707 4.381 1.00 . A A . 7 HIS CG 1 1 10 3325 1 1 7 HIS H H -6.688 -0.305 2.206 1.00 . A A . 7 HIS H 1 1 10 3326 1 1 7 HIS HA H -5.046 -2.038 3.804 1.00 . A A . 7 HIS HA 1 1 10 3327 1 1 7 HIS HB2 H -7.429 -1.624 4.367 1.00 . A A . 7 HIS HB2 1 1 10 3328 1 1 7 HIS HB3 H -7.905 -2.438 2.881 1.00 . A A . 7 HIS HB3 1 1 10 3329 1 1 7 HIS HD1 H -8.866 -4.621 3.533 1.00 . A A . 7 HIS HD1 1 1 10 3330 1 1 7 HIS HD2 H -5.454 -3.701 5.736 1.00 . A A . 7 HIS HD2 1 1 10 3331 1 1 7 HIS HE1 H -8.433 -6.626 4.995 1.00 . A A . 7 HIS HE1 1 1 10 3332 1 1 7 HIS HE2 H -6.242 -6.130 6.135 1.00 . A A . 7 HIS HE2 1 1 10 3333 1 1 7 HIS N N -5.828 -0.712 2.436 1.00 . A A . 7 HIS N 1 1 10 3334 1 1 7 HIS ND1 N -8.107 -4.680 4.168 1.00 . A A . 7 HIS ND1 1 1 10 3335 1 1 7 HIS NE2 N -6.770 -5.453 5.654 1.00 . A A . 7 HIS NE2 1 1 10 3336 1 1 7 HIS O O -4.755 -4.051 2.261 1.00 . A A . 7 HIS O 1 1 10 3337 1 1 8 SER C C -4.105 -3.241 -0.921 1.00 . A A . 8 SER C 1 1 10 3338 1 1 8 SER CA C -5.461 -3.654 -0.372 1.00 . A A . 8 SER CA 1 1 10 3339 1 1 8 SER CB C -6.528 -3.607 -1.457 1.00 . A A . 8 SER CB 1 1 10 3340 1 1 8 SER H H -6.421 -2.034 0.577 1.00 . A A . 8 SER H 1 1 10 3341 1 1 8 SER HA H -5.381 -4.660 0.002 1.00 . A A . 8 SER HA 1 1 10 3342 1 1 8 SER HB2 H -6.089 -3.914 -2.394 1.00 . A A . 8 SER HB2 1 1 10 3343 1 1 8 SER HB3 H -7.334 -4.278 -1.198 1.00 . A A . 8 SER HB3 1 1 10 3344 1 1 8 SER HG H -7.469 -2.211 -2.472 1.00 . A A . 8 SER HG 1 1 10 3345 1 1 8 SER N N -5.837 -2.806 0.741 1.00 . A A . 8 SER N 1 1 10 3346 1 1 8 SER O O -3.344 -4.076 -1.420 1.00 . A A . 8 SER O 1 1 10 3347 1 1 8 SER OG O -7.049 -2.297 -1.600 1.00 . A A . 8 SER OG 1 1 10 3348 1 1 9 ALA C C -1.470 -2.101 -0.090 1.00 . A A . 9 ALA C 1 1 10 3349 1 1 9 ALA CA C -2.447 -1.475 -1.075 1.00 . A A . 9 ALA CA 1 1 10 3350 1 1 9 ALA CB C -2.388 0.041 -0.999 1.00 . A A . 9 ALA CB 1 1 10 3351 1 1 9 ALA H H -4.483 -1.315 -0.523 1.00 . A A . 9 ALA H 1 1 10 3352 1 1 9 ALA HA H -2.182 -1.779 -2.079 1.00 . A A . 9 ALA HA 1 1 10 3353 1 1 9 ALA HB1 H -3.072 0.464 -1.719 1.00 . A A . 9 ALA HB1 1 1 10 3354 1 1 9 ALA HB2 H -1.384 0.373 -1.217 1.00 . A A . 9 ALA HB2 1 1 10 3355 1 1 9 ALA HB3 H -2.666 0.362 -0.006 1.00 . A A . 9 ALA HB3 1 1 10 3356 1 1 9 ALA N N -3.789 -1.957 -0.795 1.00 . A A . 9 ALA N 1 1 10 3357 1 1 9 ALA O O -0.261 -2.079 -0.291 1.00 . A A . 9 ALA O 1 1 10 3358 1 1 10 LYS C C -1.645 -4.898 1.915 1.00 . A A . 10 LYS C 1 1 10 3359 1 1 10 LYS CA C -1.232 -3.429 1.935 1.00 . A A . 10 LYS CA 1 1 10 3360 1 1 10 LYS CB C -1.364 -2.860 3.349 1.00 . A A . 10 LYS CB 1 1 10 3361 1 1 10 LYS CD C -0.478 -1.249 5.062 1.00 . A A . 10 LYS CD 1 1 10 3362 1 1 10 LYS CE C 0.622 -0.248 5.369 1.00 . A A . 10 LYS CE 1 1 10 3363 1 1 10 LYS CG C -0.469 -1.656 3.599 1.00 . A A . 10 LYS CG 1 1 10 3364 1 1 10 LYS H H -2.982 -2.545 1.140 1.00 . A A . 10 LYS H 1 1 10 3365 1 1 10 LYS HA H -0.197 -3.362 1.632 1.00 . A A . 10 LYS HA 1 1 10 3366 1 1 10 LYS HB2 H -2.389 -2.559 3.513 1.00 . A A . 10 LYS HB2 1 1 10 3367 1 1 10 LYS HB3 H -1.104 -3.628 4.062 1.00 . A A . 10 LYS HB3 1 1 10 3368 1 1 10 LYS HD2 H -1.433 -0.803 5.296 1.00 . A A . 10 LYS HD2 1 1 10 3369 1 1 10 LYS HD3 H -0.331 -2.130 5.669 1.00 . A A . 10 LYS HD3 1 1 10 3370 1 1 10 LYS HE2 H 0.608 -0.029 6.426 1.00 . A A . 10 LYS HE2 1 1 10 3371 1 1 10 LYS HE3 H 1.572 -0.689 5.106 1.00 . A A . 10 LYS HE3 1 1 10 3372 1 1 10 LYS HG2 H 0.542 -1.905 3.312 1.00 . A A . 10 LYS HG2 1 1 10 3373 1 1 10 LYS HG3 H -0.821 -0.827 3.001 1.00 . A A . 10 LYS HG3 1 1 10 3374 1 1 10 LYS HZ1 H 1.302 1.617 4.724 1.00 . A A . 10 LYS HZ1 1 1 10 3375 1 1 10 LYS HZ2 H -0.370 1.546 4.979 1.00 . A A . 10 LYS HZ2 1 1 10 3376 1 1 10 LYS HZ3 H 0.303 0.825 3.607 1.00 . A A . 10 LYS HZ3 1 1 10 3377 1 1 10 LYS N N -2.018 -2.660 0.984 1.00 . A A . 10 LYS N 1 1 10 3378 1 1 10 LYS NZ N 0.452 1.019 4.615 1.00 . A A . 10 LYS NZ 1 1 10 3379 1 1 10 LYS O O -1.330 -5.654 2.831 1.00 . A A . 10 LYS O 1 1 10 3380 1 1 11 LYS C C -1.829 -7.367 -0.323 1.00 . A A . 11 LYS C 1 1 10 3381 1 1 11 LYS CA C -2.730 -6.698 0.705 1.00 . A A . 11 LYS CA 1 1 10 3382 1 1 11 LYS CB C -4.196 -6.833 0.276 1.00 . A A . 11 LYS CB 1 1 10 3383 1 1 11 LYS CD C -6.087 -8.391 -0.332 1.00 . A A . 11 LYS CD 1 1 10 3384 1 1 11 LYS CE C -6.142 -8.017 -1.803 1.00 . A A . 11 LYS CE 1 1 10 3385 1 1 11 LYS CG C -4.676 -8.277 0.220 1.00 . A A . 11 LYS CG 1 1 10 3386 1 1 11 LYS H H -2.644 -4.642 0.194 1.00 . A A . 11 LYS H 1 1 10 3387 1 1 11 LYS HA H -2.596 -7.188 1.656 1.00 . A A . 11 LYS HA 1 1 10 3388 1 1 11 LYS HB2 H -4.819 -6.296 0.977 1.00 . A A . 11 LYS HB2 1 1 10 3389 1 1 11 LYS HB3 H -4.314 -6.399 -0.706 1.00 . A A . 11 LYS HB3 1 1 10 3390 1 1 11 LYS HD2 H -6.424 -9.411 -0.221 1.00 . A A . 11 LYS HD2 1 1 10 3391 1 1 11 LYS HD3 H -6.738 -7.733 0.225 1.00 . A A . 11 LYS HD3 1 1 10 3392 1 1 11 LYS HE2 H -5.816 -6.994 -1.916 1.00 . A A . 11 LYS HE2 1 1 10 3393 1 1 11 LYS HE3 H -5.477 -8.669 -2.351 1.00 . A A . 11 LYS HE3 1 1 10 3394 1 1 11 LYS HG2 H -4.010 -8.839 -0.417 1.00 . A A . 11 LYS HG2 1 1 10 3395 1 1 11 LYS HG3 H -4.653 -8.691 1.220 1.00 . A A . 11 LYS HG3 1 1 10 3396 1 1 11 LYS HZ1 H -7.838 -9.140 -2.265 1.00 . A A . 11 LYS HZ1 1 1 10 3397 1 1 11 LYS HZ2 H -7.519 -7.892 -3.370 1.00 . A A . 11 LYS HZ2 1 1 10 3398 1 1 11 LYS HZ3 H -8.172 -7.527 -1.847 1.00 . A A . 11 LYS HZ3 1 1 10 3399 1 1 11 LYS N N -2.355 -5.301 0.867 1.00 . A A . 11 LYS N 1 1 10 3400 1 1 11 LYS NZ N -7.511 -8.153 -2.359 1.00 . A A . 11 LYS NZ 1 1 10 3401 1 1 11 LYS O O -1.242 -8.415 -0.063 1.00 . A A . 11 LYS O 1 1 10 3402 1 1 12 PHE C C 0.142 -6.346 -3.044 1.00 . A A . 12 PHE C 1 1 10 3403 1 1 12 PHE CA C -0.934 -7.314 -2.579 1.00 . A A . 12 PHE CA 1 1 10 3404 1 1 12 PHE CB C -1.849 -7.690 -3.753 1.00 . A A . 12 PHE CB 1 1 10 3405 1 1 12 PHE CD1 C -3.889 -6.217 -3.808 1.00 . A A . 12 PHE CD1 1 1 10 3406 1 1 12 PHE CD2 C -2.131 -5.769 -5.355 1.00 . A A . 12 PHE CD2 1 1 10 3407 1 1 12 PHE CE1 C -4.617 -5.164 -4.326 1.00 . A A . 12 PHE CE1 1 1 10 3408 1 1 12 PHE CE2 C -2.856 -4.713 -5.876 1.00 . A A . 12 PHE CE2 1 1 10 3409 1 1 12 PHE CG C -2.641 -6.536 -4.317 1.00 . A A . 12 PHE CG 1 1 10 3410 1 1 12 PHE CZ C -4.097 -4.408 -5.358 1.00 . A A . 12 PHE CZ 1 1 10 3411 1 1 12 PHE H H -2.167 -5.886 -1.616 1.00 . A A . 12 PHE H 1 1 10 3412 1 1 12 PHE HA H -0.453 -8.208 -2.209 1.00 . A A . 12 PHE HA 1 1 10 3413 1 1 12 PHE HB2 H -1.246 -8.097 -4.550 1.00 . A A . 12 PHE HB2 1 1 10 3414 1 1 12 PHE HB3 H -2.552 -8.443 -3.423 1.00 . A A . 12 PHE HB3 1 1 10 3415 1 1 12 PHE HD1 H -4.297 -6.806 -3.000 1.00 . A A . 12 PHE HD1 1 1 10 3416 1 1 12 PHE HD2 H -1.157 -6.007 -5.760 1.00 . A A . 12 PHE HD2 1 1 10 3417 1 1 12 PHE HE1 H -5.590 -4.926 -3.920 1.00 . A A . 12 PHE HE1 1 1 10 3418 1 1 12 PHE HE2 H -2.447 -4.124 -6.684 1.00 . A A . 12 PHE HE2 1 1 10 3419 1 1 12 PHE HZ H -4.664 -3.584 -5.765 1.00 . A A . 12 PHE HZ 1 1 10 3420 1 1 12 PHE N N -1.715 -6.747 -1.487 1.00 . A A . 12 PHE N 1 1 10 3421 1 1 12 PHE O O 0.956 -6.673 -3.908 1.00 . A A . 12 PHE O 1 1 10 3422 1 1 13 GLY C C 1.871 -3.643 -1.631 1.00 . A A . 13 GLY C 1 1 10 3423 1 1 13 GLY CA C 1.119 -4.160 -2.833 1.00 . A A . 13 GLY CA 1 1 10 3424 1 1 13 GLY H H -0.530 -4.954 -1.787 1.00 . A A . 13 GLY H 1 1 10 3425 1 1 13 GLY HA2 H 1.822 -4.595 -3.528 1.00 . A A . 13 GLY HA2 1 1 10 3426 1 1 13 GLY HA3 H 0.616 -3.333 -3.313 1.00 . A A . 13 GLY HA3 1 1 10 3427 1 1 13 GLY N N 0.141 -5.158 -2.467 1.00 . A A . 13 GLY N 1 1 10 3428 1 1 13 GLY O O 2.576 -2.639 -1.718 1.00 . A A . 13 GLY O 1 1 10 3429 1 1 14 LYS C C 3.883 -3.947 0.598 1.00 . A A . 14 LYS C 1 1 10 3430 1 1 14 LYS CA C 2.366 -3.911 0.738 1.00 . A A . 14 LYS CA 1 1 10 3431 1 1 14 LYS CB C 1.906 -4.780 1.918 1.00 . A A . 14 LYS CB 1 1 10 3432 1 1 14 LYS CD C 1.731 -7.076 2.949 1.00 . A A . 14 LYS CD 1 1 10 3433 1 1 14 LYS CE C 1.862 -6.473 4.343 1.00 . A A . 14 LYS CE 1 1 10 3434 1 1 14 LYS CG C 2.403 -6.219 1.880 1.00 . A A . 14 LYS CG 1 1 10 3435 1 1 14 LYS H H 1.204 -5.165 -0.516 1.00 . A A . 14 LYS H 1 1 10 3436 1 1 14 LYS HA H 2.063 -2.889 0.919 1.00 . A A . 14 LYS HA 1 1 10 3437 1 1 14 LYS HB2 H 2.255 -4.329 2.834 1.00 . A A . 14 LYS HB2 1 1 10 3438 1 1 14 LYS HB3 H 0.826 -4.799 1.930 1.00 . A A . 14 LYS HB3 1 1 10 3439 1 1 14 LYS HD2 H 0.682 -7.170 2.712 1.00 . A A . 14 LYS HD2 1 1 10 3440 1 1 14 LYS HD3 H 2.189 -8.055 2.947 1.00 . A A . 14 LYS HD3 1 1 10 3441 1 1 14 LYS HE2 H 1.432 -5.483 4.331 1.00 . A A . 14 LYS HE2 1 1 10 3442 1 1 14 LYS HE3 H 1.316 -7.092 5.040 1.00 . A A . 14 LYS HE3 1 1 10 3443 1 1 14 LYS HG2 H 2.183 -6.638 0.909 1.00 . A A . 14 LYS HG2 1 1 10 3444 1 1 14 LYS HG3 H 3.470 -6.223 2.043 1.00 . A A . 14 LYS HG3 1 1 10 3445 1 1 14 LYS HZ1 H 3.312 -5.999 5.766 1.00 . A A . 14 LYS HZ1 1 1 10 3446 1 1 14 LYS HZ2 H 3.814 -5.732 4.165 1.00 . A A . 14 LYS HZ2 1 1 10 3447 1 1 14 LYS HZ3 H 3.727 -7.311 4.778 1.00 . A A . 14 LYS HZ3 1 1 10 3448 1 1 14 LYS N N 1.735 -4.340 -0.505 1.00 . A A . 14 LYS N 1 1 10 3449 1 1 14 LYS NZ N 3.276 -6.372 4.791 1.00 . A A . 14 LYS NZ 1 1 10 3450 1 1 14 LYS O O 4.591 -3.146 1.208 1.00 . A A . 14 LYS O 1 1 10 3451 1 1 15 ALA C C 6.262 -3.825 -1.382 1.00 . A A . 15 ALA C 1 1 10 3452 1 1 15 ALA CA C 5.792 -4.976 -0.500 1.00 . A A . 15 ALA CA 1 1 10 3453 1 1 15 ALA CB C 6.109 -6.311 -1.159 1.00 . A A . 15 ALA CB 1 1 10 3454 1 1 15 ALA H H 3.741 -5.495 -0.667 1.00 . A A . 15 ALA H 1 1 10 3455 1 1 15 ALA HA H 6.316 -4.932 0.444 1.00 . A A . 15 ALA HA 1 1 10 3456 1 1 15 ALA HB1 H 5.573 -6.391 -2.094 1.00 . A A . 15 ALA HB1 1 1 10 3457 1 1 15 ALA HB2 H 5.813 -7.117 -0.504 1.00 . A A . 15 ALA HB2 1 1 10 3458 1 1 15 ALA HB3 H 7.171 -6.375 -1.348 1.00 . A A . 15 ALA HB3 1 1 10 3459 1 1 15 ALA N N 4.367 -4.866 -0.230 1.00 . A A . 15 ALA N 1 1 10 3460 1 1 15 ALA O O 7.447 -3.491 -1.403 1.00 . A A . 15 ALA O 1 1 10 3461 1 1 16 PHE C C 5.546 -0.782 -2.274 1.00 . A A . 16 PHE C 1 1 10 3462 1 1 16 PHE CA C 5.649 -2.115 -2.999 1.00 . A A . 16 PHE CA 1 1 10 3463 1 1 16 PHE CB C 4.727 -2.112 -4.223 1.00 . A A . 16 PHE CB 1 1 10 3464 1 1 16 PHE CD1 C 5.896 -3.357 -6.055 1.00 . A A . 16 PHE CD1 1 1 10 3465 1 1 16 PHE CD2 C 4.045 -4.403 -4.977 1.00 . A A . 16 PHE CD2 1 1 10 3466 1 1 16 PHE CE1 C 6.054 -4.464 -6.865 1.00 . A A . 16 PHE CE1 1 1 10 3467 1 1 16 PHE CE2 C 4.199 -5.511 -5.784 1.00 . A A . 16 PHE CE2 1 1 10 3468 1 1 16 PHE CG C 4.891 -3.314 -5.103 1.00 . A A . 16 PHE CG 1 1 10 3469 1 1 16 PHE CZ C 5.204 -5.543 -6.729 1.00 . A A . 16 PHE CZ 1 1 10 3470 1 1 16 PHE H H 4.397 -3.517 -2.023 1.00 . A A . 16 PHE H 1 1 10 3471 1 1 16 PHE HA H 6.669 -2.249 -3.331 1.00 . A A . 16 PHE HA 1 1 10 3472 1 1 16 PHE HB2 H 3.698 -2.082 -3.892 1.00 . A A . 16 PHE HB2 1 1 10 3473 1 1 16 PHE HB3 H 4.934 -1.235 -4.818 1.00 . A A . 16 PHE HB3 1 1 10 3474 1 1 16 PHE HD1 H 6.561 -2.515 -6.162 1.00 . A A . 16 PHE HD1 1 1 10 3475 1 1 16 PHE HD2 H 3.258 -4.380 -4.240 1.00 . A A . 16 PHE HD2 1 1 10 3476 1 1 16 PHE HE1 H 6.841 -4.487 -7.604 1.00 . A A . 16 PHE HE1 1 1 10 3477 1 1 16 PHE HE2 H 3.532 -6.355 -5.675 1.00 . A A . 16 PHE HE2 1 1 10 3478 1 1 16 PHE HZ H 5.326 -6.411 -7.360 1.00 . A A . 16 PHE HZ 1 1 10 3479 1 1 16 PHE N N 5.328 -3.218 -2.102 1.00 . A A . 16 PHE N 1 1 10 3480 1 1 16 PHE O O 6.427 0.071 -2.399 1.00 . A A . 16 PHE O 1 1 10 3481 1 1 17 VAL C C 5.264 0.797 0.346 1.00 . A A . 17 VAL C 1 1 10 3482 1 1 17 VAL CA C 4.265 0.647 -0.790 1.00 . A A . 17 VAL CA 1 1 10 3483 1 1 17 VAL CB C 2.825 0.766 -0.238 1.00 . A A . 17 VAL CB 1 1 10 3484 1 1 17 VAL CG1 C 1.808 0.695 -1.367 1.00 . A A . 17 VAL CG1 1 1 10 3485 1 1 17 VAL CG2 C 2.537 -0.307 0.803 1.00 . A A . 17 VAL CG2 1 1 10 3486 1 1 17 VAL H H 3.834 -1.336 -1.398 1.00 . A A . 17 VAL H 1 1 10 3487 1 1 17 VAL HA H 4.425 1.453 -1.493 1.00 . A A . 17 VAL HA 1 1 10 3488 1 1 17 VAL HB H 2.727 1.733 0.239 1.00 . A A . 17 VAL HB 1 1 10 3489 1 1 17 VAL HG11 H 1.896 -0.258 -1.871 1.00 . A A . 17 VAL HG11 1 1 10 3490 1 1 17 VAL HG12 H 1.993 1.493 -2.070 1.00 . A A . 17 VAL HG12 1 1 10 3491 1 1 17 VAL HG13 H 0.814 0.796 -0.960 1.00 . A A . 17 VAL HG13 1 1 10 3492 1 1 17 VAL HG21 H 1.522 -0.203 1.156 1.00 . A A . 17 VAL HG21 1 1 10 3493 1 1 17 VAL HG22 H 3.219 -0.196 1.633 1.00 . A A . 17 VAL HG22 1 1 10 3494 1 1 17 VAL HG23 H 2.665 -1.284 0.360 1.00 . A A . 17 VAL HG23 1 1 10 3495 1 1 17 VAL N N 4.483 -0.605 -1.499 1.00 . A A . 17 VAL N 1 1 10 3496 1 1 17 VAL O O 5.568 1.905 0.778 1.00 . A A . 17 VAL O 1 1 10 3497 1 1 18 GLY C C 8.138 0.146 1.379 1.00 . A A . 18 GLY C 1 1 10 3498 1 1 18 GLY CA C 6.779 -0.322 1.860 1.00 . A A . 18 GLY CA 1 1 10 3499 1 1 18 GLY H H 5.496 -1.186 0.425 1.00 . A A . 18 GLY H 1 1 10 3500 1 1 18 GLY HA2 H 6.441 0.336 2.648 1.00 . A A . 18 GLY HA2 1 1 10 3501 1 1 18 GLY HA3 H 6.872 -1.321 2.252 1.00 . A A . 18 GLY HA3 1 1 10 3502 1 1 18 GLY N N 5.792 -0.331 0.804 1.00 . A A . 18 GLY N 1 1 10 3503 1 1 18 GLY O O 9.063 0.327 2.175 1.00 . A A . 18 GLY O 1 1 10 3504 1 1 19 GLU C C 9.274 2.092 -1.310 1.00 . A A . 19 GLU C 1 1 10 3505 1 1 19 GLU CA C 9.504 0.811 -0.513 1.00 . A A . 19 GLU CA 1 1 10 3506 1 1 19 GLU CB C 10.099 -0.274 -1.409 1.00 . A A . 19 GLU CB 1 1 10 3507 1 1 19 GLU CD C 11.074 -2.607 -1.536 1.00 . A A . 19 GLU CD 1 1 10 3508 1 1 19 GLU CG C 10.342 -1.591 -0.686 1.00 . A A . 19 GLU CG 1 1 10 3509 1 1 19 GLU H H 7.492 0.168 -0.509 1.00 . A A . 19 GLU H 1 1 10 3510 1 1 19 GLU HA H 10.193 1.020 0.291 1.00 . A A . 19 GLU HA 1 1 10 3511 1 1 19 GLU HB2 H 9.421 -0.459 -2.230 1.00 . A A . 19 GLU HB2 1 1 10 3512 1 1 19 GLU HB3 H 11.041 0.077 -1.801 1.00 . A A . 19 GLU HB3 1 1 10 3513 1 1 19 GLU HG2 H 10.931 -1.397 0.197 1.00 . A A . 19 GLU HG2 1 1 10 3514 1 1 19 GLU HG3 H 9.387 -2.007 -0.394 1.00 . A A . 19 GLU HG3 1 1 10 3515 1 1 19 GLU N N 8.260 0.345 0.074 1.00 . A A . 19 GLU N 1 1 10 3516 1 1 19 GLU O O 9.807 3.150 -0.971 1.00 . A A . 19 GLU O 1 1 10 3517 1 1 19 GLU OE1 O 10.418 -3.333 -2.313 1.00 . A A . 19 GLU OE1 1 1 10 3518 1 1 19 GLU OE2 O 12.312 -2.700 -1.419 1.00 . A A . 19 GLU OE2 1 1 10 3519 1 1 20 ILE C C 7.547 4.290 -2.485 1.00 . A A . 20 ILE C 1 1 10 3520 1 1 20 ILE CA C 8.172 3.116 -3.240 1.00 . A A . 20 ILE CA 1 1 10 3521 1 1 20 ILE CB C 7.226 2.687 -4.385 1.00 . A A . 20 ILE CB 1 1 10 3522 1 1 20 ILE CD1 C 6.852 0.878 -6.143 1.00 . A A . 20 ILE CD1 1 1 10 3523 1 1 20 ILE CG1 C 7.795 1.466 -5.117 1.00 . A A . 20 ILE CG1 1 1 10 3524 1 1 20 ILE CG2 C 7.008 3.839 -5.359 1.00 . A A . 20 ILE CG2 1 1 10 3525 1 1 20 ILE H H 7.995 1.138 -2.512 1.00 . A A . 20 ILE H 1 1 10 3526 1 1 20 ILE HA H 9.109 3.436 -3.674 1.00 . A A . 20 ILE HA 1 1 10 3527 1 1 20 ILE HB H 6.270 2.428 -3.956 1.00 . A A . 20 ILE HB 1 1 10 3528 1 1 20 ILE HD11 H 7.318 0.023 -6.609 1.00 . A A . 20 ILE HD11 1 1 10 3529 1 1 20 ILE HD12 H 6.630 1.621 -6.894 1.00 . A A . 20 ILE HD12 1 1 10 3530 1 1 20 ILE HD13 H 5.936 0.572 -5.657 1.00 . A A . 20 ILE HD13 1 1 10 3531 1 1 20 ILE HG12 H 8.701 1.750 -5.630 1.00 . A A . 20 ILE HG12 1 1 10 3532 1 1 20 ILE HG13 H 8.022 0.695 -4.395 1.00 . A A . 20 ILE HG13 1 1 10 3533 1 1 20 ILE HG21 H 6.564 4.674 -4.837 1.00 . A A . 20 ILE HG21 1 1 10 3534 1 1 20 ILE HG22 H 6.351 3.518 -6.152 1.00 . A A . 20 ILE HG22 1 1 10 3535 1 1 20 ILE HG23 H 7.958 4.138 -5.777 1.00 . A A . 20 ILE HG23 1 1 10 3536 1 1 20 ILE N N 8.444 1.995 -2.344 1.00 . A A . 20 ILE N 1 1 10 3537 1 1 20 ILE O O 7.954 5.440 -2.652 1.00 . A A . 20 ILE O 1 1 10 3538 1 1 21 MET C C 6.302 5.028 0.569 1.00 . A A . 21 MET C 1 1 10 3539 1 1 21 MET CA C 5.863 5.020 -0.888 1.00 . A A . 21 MET CA 1 1 10 3540 1 1 21 MET CB C 4.351 4.800 -0.973 1.00 . A A . 21 MET CB 1 1 10 3541 1 1 21 MET CE C 3.241 6.724 -4.505 1.00 . A A . 21 MET CE 1 1 10 3542 1 1 21 MET CG C 3.771 5.060 -2.352 1.00 . A A . 21 MET CG 1 1 10 3543 1 1 21 MET H H 6.330 3.048 -1.501 1.00 . A A . 21 MET H 1 1 10 3544 1 1 21 MET HA H 6.104 5.976 -1.330 1.00 . A A . 21 MET HA 1 1 10 3545 1 1 21 MET HB2 H 4.135 3.776 -0.705 1.00 . A A . 21 MET HB2 1 1 10 3546 1 1 21 MET HB3 H 3.862 5.458 -0.270 1.00 . A A . 21 MET HB3 1 1 10 3547 1 1 21 MET HE1 H 3.291 7.706 -4.952 1.00 . A A . 21 MET HE1 1 1 10 3548 1 1 21 MET HE2 H 2.209 6.413 -4.433 1.00 . A A . 21 MET HE2 1 1 10 3549 1 1 21 MET HE3 H 3.786 6.022 -5.118 1.00 . A A . 21 MET HE3 1 1 10 3550 1 1 21 MET HG2 H 4.272 4.421 -3.066 1.00 . A A . 21 MET HG2 1 1 10 3551 1 1 21 MET HG3 H 2.718 4.821 -2.336 1.00 . A A . 21 MET HG3 1 1 10 3552 1 1 21 MET N N 6.573 3.989 -1.636 1.00 . A A . 21 MET N 1 1 10 3553 1 1 21 MET O O 5.478 5.142 1.479 1.00 . A A . 21 MET O 1 1 10 3554 1 1 21 MET SD S 3.969 6.777 -2.869 1.00 . A A . 21 MET SD 1 1 10 3555 1 1 22 ASN C C 9.549 5.428 2.181 1.00 . A A . 22 ASN C 1 1 10 3556 1 1 22 ASN CA C 8.140 4.854 2.140 1.00 . A A . 22 ASN CA 1 1 10 3557 1 1 22 ASN CB C 8.150 3.410 2.653 1.00 . A A . 22 ASN CB 1 1 10 3558 1 1 22 ASN CG C 8.640 3.300 4.085 1.00 . A A . 22 ASN CG 1 1 10 3559 1 1 22 ASN H H 8.215 4.863 0.024 1.00 . A A . 22 ASN H 1 1 10 3560 1 1 22 ASN HA H 7.503 5.449 2.776 1.00 . A A . 22 ASN HA 1 1 10 3561 1 1 22 ASN HB2 H 7.150 3.007 2.605 1.00 . A A . 22 ASN HB2 1 1 10 3562 1 1 22 ASN HB3 H 8.801 2.820 2.024 1.00 . A A . 22 ASN HB3 1 1 10 3563 1 1 22 ASN HD21 H 9.373 1.493 3.711 1.00 . A A . 22 ASN HD21 1 1 10 3564 1 1 22 ASN HD22 H 9.611 2.082 5.324 1.00 . A A . 22 ASN HD22 1 1 10 3565 1 1 22 ASN N N 7.600 4.907 0.789 1.00 . A A . 22 ASN N 1 1 10 3566 1 1 22 ASN ND2 N 9.268 2.180 4.407 1.00 . A A . 22 ASN ND2 1 1 10 3567 1 1 22 ASN O O 9.847 6.309 2.987 1.00 . A A . 22 ASN O 1 1 10 3568 1 1 22 ASN OD1 O 8.451 4.210 4.895 1.00 . A A . 22 ASN OD1 1 1 10 3569 1 1 23 SER C C 11.947 6.430 0.156 1.00 . A A . 23 SER C 1 1 10 3570 1 1 23 SER CA C 11.783 5.385 1.258 1.00 . A A . 23 SER CA 1 1 10 3571 1 1 23 SER CB C 12.713 4.193 1.024 1.00 . A A . 23 SER CB 1 1 10 3572 1 1 23 SER H H 10.116 4.238 0.677 1.00 . A A . 23 SER H 1 1 10 3573 1 1 23 SER HA H 12.021 5.839 2.210 1.00 . A A . 23 SER HA 1 1 10 3574 1 1 23 SER HB2 H 12.523 3.774 0.047 1.00 . A A . 23 SER HB2 1 1 10 3575 1 1 23 SER HB3 H 13.741 4.522 1.082 1.00 . A A . 23 SER HB3 1 1 10 3576 1 1 23 SER HG H 12.255 3.611 2.847 1.00 . A A . 23 SER HG 1 1 10 3577 1 1 23 SER N N 10.409 4.929 1.310 1.00 . A A . 23 SER N 1 1 10 3578 1 1 23 SER O O 12.220 7.606 0.479 1.00 . A A . 23 SER O 1 1 10 3579 1 1 23 SER OXT O 11.762 6.078 -1.026 1.00 . A A . 23 SER OXT 1 1 10 3580 1 1 23 SER OG O 12.497 3.187 2.006 1.00 . A A . 23 SER OG 1 1 stop_ save_
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