NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
538271 | 2lqy | 18335 | cing | 4-filtered-FRED | STAR | entry | full | 89 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lqy # This FRED archive file contains, for PDB entry <2lqy>: # # - 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_2lqy _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lqy _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2284.62 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 $Envelope_glycoprotein_H A . 1 1 stop_ save_ save_Envelope_glycoprotein_H _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Envelope glycoprotein H" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HGLASTLTRWAHYNALIRAF _Entity.Number_of_monomers 20 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 HIS . 1 1 2 GLY . 1 1 3 LEU . 1 1 4 ALA . 1 1 5 SER . 1 1 6 THR . 1 1 7 LEU . 1 1 8 THR . 1 1 9 ARG . 1 1 10 TRP . 1 1 11 ALA . 1 1 12 HIS . 1 1 13 TYR . 1 1 14 ASN . 1 1 15 ALA . 1 1 16 LEU . 1 1 17 ILE . 1 1 18 ARG . 1 1 19 ALA . 1 1 20 PHE . 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 HIS 1 1 1 1 GLY 2 2 1 1 LEU 3 3 1 1 ALA 4 4 1 1 SER 5 5 1 1 THR 6 6 1 1 LEU 7 7 1 1 THR 8 8 1 1 ARG 9 9 1 1 TRP 10 10 1 1 ALA 11 11 1 1 HIS 12 12 1 1 TYR 13 13 1 1 ASN 14 14 1 1 ALA 15 15 1 1 LEU 16 16 1 1 ILE 17 17 1 1 ARG 18 18 1 1 ALA 19 19 1 1 PHE 20 20 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 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 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 GLY H . 2 GLY HN 1 1 1 1 2 1 1 4 ALA H . 4 ALA HN 1 1 2 1 1 1 1 2 GLY H . 2 GLY HN 1 1 2 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 3 1 1 1 1 2 GLY H . 2 GLY HN 1 1 3 1 2 1 1 5 SER H . 5 SER HN 1 1 4 1 1 1 1 2 GLY QA . 2 GLY HA1 1 1 4 1 2 1 1 5 SER H . 5 SER HN 1 1 5 1 1 1 1 2 GLY QA . 2 GLY HA2 1 1 5 1 2 1 1 6 THR MG . 6 THR QG2 1 1 6 1 1 1 1 3 LEU H . 3 LEU HN 1 1 6 1 2 1 1 3 LEU HA . 3 LEU HA 1 1 7 1 1 1 1 3 LEU H . 3 LEU HN 1 1 7 1 2 1 1 3 LEU HG . 3 LEU HG 1 1 8 1 1 1 1 3 LEU H . 3 LEU HN 1 1 8 1 2 1 1 4 ALA H . 4 ALA HN 1 1 9 1 1 1 1 3 LEU HA . 3 LEU HA 1 1 9 1 2 1 1 6 THR H . 6 THR HN 1 1 10 1 1 1 1 3 LEU QB . 3 LEU QB 1 1 10 1 2 1 1 4 ALA H . 4 ALA HN 1 1 11 1 1 1 1 3 LEU QB . 3 LEU QB 1 1 11 1 2 1 1 6 THR HA . 6 THR HA 1 1 12 1 1 1 1 3 LEU HG . 3 LEU HG 1 1 12 1 2 1 1 4 ALA H . 4 ALA HN 1 1 13 1 1 1 1 3 LEU HG . 3 LEU HG 1 1 13 1 2 1 1 5 SER H . 5 SER HN 1 1 14 1 1 1 1 4 ALA H . 4 ALA HN 1 1 14 1 2 1 1 4 ALA HA . 4 ALA HA 1 1 15 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 15 1 2 1 1 5 SER H . 5 SER HN 1 1 16 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 16 1 2 1 1 7 LEU QB . 7 LEU QB 1 1 17 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 17 1 2 1 1 5 SER H . 5 SER HN 1 1 18 1 1 1 1 5 SER H . 5 SER HN 1 1 18 1 2 1 1 5 SER HB2 . 5 SER HB2 1 1 19 1 1 1 1 5 SER H . 5 SER HN 1 1 19 1 2 1 1 5 SER HB3 . 5 SER HB3 1 1 20 1 1 1 1 5 SER H . 5 SER HN 1 1 20 1 2 1 1 6 THR H . 6 THR HN 1 1 21 1 1 1 1 5 SER H . 5 SER HN 1 1 21 1 2 1 1 6 THR MG . 6 THR QG2 1 1 22 1 1 1 1 5 SER HA . 5 SER HA 1 1 22 1 2 1 1 7 LEU H . 7 LEU HN 1 1 23 1 1 1 1 5 SER HA . 5 SER HA 1 1 23 1 2 1 1 8 THR H . 8 THR HN 1 1 24 1 1 1 1 5 SER HB2 . 5 SER HB2 1 1 24 1 2 1 1 6 THR H . 6 THR HN 1 1 25 1 1 1 1 6 THR H . 6 THR HN 1 1 25 1 2 1 1 6 THR HA . 6 THR HA 1 1 26 1 1 1 1 6 THR H . 6 THR HN 1 1 26 1 2 1 1 7 LEU H . 7 LEU HN 1 1 27 1 1 1 1 6 THR HA . 6 THR HA 1 1 27 1 2 1 1 7 LEU H . 7 LEU HN 1 1 28 1 1 1 1 6 THR HA . 6 THR HA 1 1 28 1 2 1 1 8 THR H . 8 THR HN 1 1 29 1 1 1 1 7 LEU H . 7 LEU HN 1 1 29 1 2 1 1 7 LEU MD1 . 7 LEU QD1 1 1 30 1 1 1 1 7 LEU H . 7 LEU HN 1 1 30 1 2 1 1 7 LEU HG . 7 LEU HG 1 1 31 1 1 1 1 7 LEU H . 7 LEU HN 1 1 31 1 2 1 1 8 THR H . 8 THR HN 1 1 32 1 1 1 1 7 LEU HA . 7 LEU HA 1 1 32 1 2 1 1 9 ARG H . 9 ARG HN 1 1 33 1 1 1 1 7 LEU HA . 7 LEU HA 1 1 33 1 2 1 1 10 TRP HB3 . 10 TRP HB2 1 1 34 1 1 1 1 7 LEU MD1 . 7 LEU QD1 1 1 34 1 2 1 1 8 THR H . 8 THR HN 1 1 35 1 1 1 1 8 THR H . 8 THR HN 1 1 35 1 2 1 1 9 ARG H . 9 ARG HN 1 1 36 1 1 1 1 8 THR H . 8 THR HN 1 1 36 1 2 1 1 10 TRP H . 10 TRP HN 1 1 37 1 1 1 1 8 THR HA . 8 THR HA 1 1 37 1 2 1 1 9 ARG H . 9 ARG HN 1 1 38 1 1 1 1 8 THR HB . 8 THR HB 1 1 38 1 2 1 1 9 ARG H . 9 ARG HN 1 1 39 1 1 1 1 9 ARG H . 9 ARG HN 1 1 39 1 2 1 1 9 ARG HA . 9 ARG HA 1 1 40 1 1 1 1 9 ARG H . 9 ARG HN 1 1 40 1 2 1 1 10 TRP H . 10 TRP HN 1 1 41 1 1 1 1 9 ARG H . 9 ARG HN 1 1 41 1 2 1 1 11 ALA H . 11 ALA HN 1 1 42 1 1 1 1 9 ARG HA . 9 ARG HA 1 1 42 1 2 1 1 12 HIS QB . 12 HIS HB2 1 1 43 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 43 1 2 1 1 10 TRP H . 10 TRP HN 1 1 44 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 44 1 2 1 1 10 TRP HD1 . 10 TRP HD1 1 1 45 1 1 1 1 10 TRP H . 10 TRP HN 1 1 45 1 2 1 1 10 TRP HB2 . 10 TRP HB3 1 1 46 1 1 1 1 10 TRP H . 10 TRP HN 1 1 46 1 2 1 1 10 TRP HB3 . 10 TRP HB2 1 1 47 1 1 1 1 10 TRP H . 10 TRP HN 1 1 47 1 2 1 1 10 TRP HD1 . 10 TRP HD1 1 1 48 1 1 1 1 10 TRP H . 10 TRP HN 1 1 48 1 2 1 1 11 ALA H . 11 ALA HN 1 1 49 1 1 1 1 10 TRP H . 10 TRP HN 1 1 49 1 2 1 1 12 HIS H . 12 HIS HN 1 1 50 1 1 1 1 10 TRP QB . 10 TRP QB 1 1 50 1 2 1 1 11 ALA H . 11 ALA HN 1 1 51 1 1 1 1 10 TRP HB2 . 10 TRP HB3 1 1 51 1 2 1 1 10 TRP HD1 . 10 TRP HD1 1 1 52 1 1 1 1 10 TRP HB3 . 10 TRP HB2 1 1 52 1 2 1 1 10 TRP HD1 . 10 TRP HD1 1 1 53 1 1 1 1 10 TRP HD1 . 10 TRP HD1 1 1 53 1 2 1 1 11 ALA H . 11 ALA HN 1 1 54 1 1 1 1 10 TRP HH2 . 10 TRP HH2 1 1 54 1 2 1 1 14 ASN H . 14 ASN HN 1 1 55 1 1 1 1 10 TRP HH2 . 10 TRP HH2 1 1 55 1 2 1 1 14 ASN QB . 14 ASN QB 1 1 56 1 1 1 1 11 ALA H . 11 ALA HN 1 1 56 1 2 1 1 12 HIS H . 12 HIS HN 1 1 57 1 1 1 1 11 ALA H . 11 ALA HN 1 1 57 1 2 1 1 13 TYR H . 13 TYR HN 1 1 58 1 1 1 1 11 ALA H . 11 ALA HN 1 1 58 1 2 1 1 13 TYR QD . 13 TYR QD 1 1 59 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 59 1 2 1 1 12 HIS H . 12 HIS HN 1 1 60 1 1 1 1 12 HIS H . 12 HIS HN 1 1 60 1 2 1 1 12 HIS QB . 12 HIS HB2 1 1 61 1 1 1 1 12 HIS H . 12 HIS HN 1 1 61 1 2 1 1 12 HIS HD2 . 12 HIS HD2 1 1 62 1 1 1 1 12 HIS H . 12 HIS HN 1 1 62 1 2 1 1 13 TYR H . 13 TYR HN 1 1 63 1 1 1 1 13 TYR H . 13 TYR HN 1 1 63 1 2 1 1 13 TYR QB . 13 TYR QB 1 1 64 1 1 1 1 13 TYR H . 13 TYR HN 1 1 64 1 2 1 1 14 ASN H . 14 ASN HN 1 1 65 1 1 1 1 13 TYR HA . 13 TYR HA 1 1 65 1 2 1 1 16 LEU QB . 16 LEU QB 1 1 66 1 1 1 1 13 TYR QB . 13 TYR QB 1 1 66 1 2 1 1 14 ASN H . 14 ASN HN 1 1 67 1 1 1 1 13 TYR QB . 13 TYR QB 1 1 67 1 2 1 1 14 ASN HA . 14 ASN HA 1 1 68 1 1 1 1 14 ASN H . 14 ASN HN 1 1 68 1 2 1 1 15 ALA H . 15 ALA HN 1 1 69 1 1 1 1 14 ASN HA . 14 ASN HA 1 1 69 1 2 1 1 17 ILE HA . 17 ILE HA 1 1 70 1 1 1 1 14 ASN QB . 14 ASN QB 1 1 70 1 2 1 1 15 ALA H . 15 ALA HN 1 1 71 1 1 1 1 15 ALA H . 15 ALA HN 1 1 71 1 2 1 1 17 ILE H . 17 ILE HN 1 1 72 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 72 1 2 1 1 16 LEU H . 16 LEU HN 1 1 73 1 1 1 1 15 ALA MB . 15 ALA QB 1 1 73 1 2 1 1 17 ILE H . 17 ILE HN 1 1 74 1 1 1 1 15 ALA MB . 15 ALA QB 1 1 74 1 2 1 1 18 ARG H . 18 ARG HN 1 1 75 1 1 1 1 16 LEU H . 16 LEU HN 1 1 75 1 2 1 1 16 LEU MD1 . 16 LEU QD1 1 1 76 1 1 1 1 16 LEU H . 16 LEU HN 1 1 76 1 2 1 1 17 ILE H . 17 ILE HN 1 1 77 1 1 1 1 16 LEU H . 16 LEU HN 1 1 77 1 2 1 1 18 ARG H . 18 ARG HN 1 1 78 1 1 1 1 17 ILE H . 17 ILE HN 1 1 78 1 2 1 1 17 ILE HB . 17 ILE HB 1 1 79 1 1 1 1 17 ILE H . 17 ILE HN 1 1 79 1 2 1 1 17 ILE MD . 17 ILE QD1 1 1 80 1 1 1 1 17 ILE H . 17 ILE HN 1 1 80 1 2 1 1 17 ILE HG12 . 17 ILE HG12 1 1 81 1 1 1 1 17 ILE H . 17 ILE HN 1 1 81 1 2 1 1 17 ILE HG13 . 17 ILE HG13 1 1 82 1 1 1 1 17 ILE H . 17 ILE HN 1 1 82 1 2 1 1 18 ARG H . 18 ARG HN 1 1 83 1 1 1 1 17 ILE HA . 17 ILE HA 1 1 83 1 2 1 1 18 ARG H . 18 ARG HN 1 1 84 1 1 1 1 17 ILE MD . 17 ILE QD1 1 1 84 1 2 1 1 18 ARG H . 18 ARG HN 1 1 85 1 1 1 1 19 ALA H . 19 ALA HN 1 1 85 1 2 1 1 20 PHE H . 20 PHE HN 1 1 86 1 1 1 1 19 ALA MB . 19 ALA QB 1 1 86 1 2 1 1 20 PHE H . 20 PHE HN 1 1 87 1 1 1 1 19 ALA MB . 19 ALA QB 1 1 87 1 2 1 1 20 PHE HB2 . 20 PHE HB2 1 1 88 1 1 1 1 20 PHE H . 20 PHE HN 1 1 88 1 2 1 1 20 PHE HB2 . 20 PHE HB2 1 1 89 1 1 1 1 20 PHE H . 20 PHE HN 1 1 89 1 2 1 1 20 PHE HB3 . 20 PHE HB3 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 . . . . . . . 2.86 1 1 2 1 . . . . . . . 5.33 1 1 3 1 . . . . . . . 2.83 1 1 4 1 . . . . . . . 2.96 1 1 5 1 . . . . . . . 4.92 1 1 6 1 . . . . . . . 2.9 1 1 7 1 . . . . . . . 3.05 1 1 8 1 . . . . . . . 2.99 1 1 9 1 . . . . . . . 3.27 1 1 10 1 . . . . . . . 5.64 1 1 11 1 . . . . . . . 6.02 1 1 12 1 . . . . . . . 4.01 1 1 13 1 . . . . . . . 4.26 1 1 14 1 . . . . . . . 2.59 1 1 15 1 . . . . . . . 3.64 1 1 16 1 . . . . . . . 4.49 1 1 17 1 . . . . . . . 6.07 1 1 18 1 . . . . . . . 2.86 1 1 19 1 . . . . . . . 3.08 1 1 20 1 . . . . . . . 2.68 1 1 21 1 . . . . . . . 5.79 1 1 22 1 . . . . . . . 4.4 1 1 23 1 . . . . . . . 3.05 1 1 24 1 . . . . . . . 3.95 1 1 25 1 . . . . . . . 2.74 1 1 26 1 . . . . . . . 2.96 1 1 27 1 . . . . . . . 3.42 1 1 28 1 . . . . . . . 3.42 1 1 29 1 . . . . . . . 4.46 1 1 30 1 . . . . . . . 3.89 1 1 31 1 . . . . . . . 2.9 1 1 32 1 . . . . . . . 3.98 1 1 33 1 . . . . . . . 3.52 1 1 34 1 . . . . . . . 6.29 1 1 35 1 . . . . . . . 3.08 1 1 36 1 . . . . . . . 4.2 1 1 37 1 . . . . . . . 3.39 1 1 38 1 . . . . . . . 3.73 1 1 39 1 . . . . . . . 2.96 1 1 40 1 . . . . . . . 2.81 1 1 41 1 . . . . . . . 4.04 1 1 42 1 . . . . . . . 3.45 1 1 43 1 . . . . . . . 5.18 1 1 44 1 . . . . . . . 5.64 1 1 45 1 . . . . . . . 3.11 1 1 46 1 . . . . . . . 2.99 1 1 47 1 . . . . . . . 4.14 1 1 48 1 . . . . . . . 2.9 1 1 49 1 . . . . . . . 4.2 1 1 50 1 . . . . . . . 4.1 1 1 51 1 . . . . . . . 4.07 1 1 52 1 . . . . . . . 3.33 1 1 53 1 . . . . . . . 4.14 1 1 54 1 . . . . . . . 4.79 1 1 55 1 . . . . . . . 6.39 1 1 56 1 . . . . . . . 3.11 1 1 57 1 . . . . . . . 4.32 1 1 58 1 . . . . . . . 8.48 1 1 59 1 . . . . . . . 3.27 1 1 60 1 . . . . . . . 3.39 1 1 61 1 . . . . . . . 4.07 1 1 62 1 . . . . . . . 2.83 1 1 63 1 . . . . . . . 3.27 1 1 64 1 . . . . . . . 2.82 1 1 65 1 . . . . . . . 5.58 1 1 66 1 . . . . . . . 4.1 1 1 67 1 . . . . . . . 5.58 1 1 68 1 . . . . . . . 2.86 1 1 69 1 . . . . . . . 4.37 1 1 70 1 . . . . . . . 4.2 1 1 71 1 . . . . . . . 4.2 1 1 72 1 . . . . . . . 3.61 1 1 73 1 . . . . . . . 5.51 1 1 74 1 . . . . . . . 4.95 1 1 75 1 . . . . . . . 5.05 1 1 76 1 . . . . . . . 2.83 1 1 77 1 . . . . . . . 4.0 1 1 78 1 . . . . . . . 2.55 1 1 79 1 . . . . . . . 5.42 1 1 80 1 . . . . . . . 3.05 1 1 81 1 . . . . . . . 3.48 1 1 82 1 . . . . . . . 2.8 1 1 83 1 . . . . . . . 3.17 1 1 84 1 . . . . . . . 6.44 1 1 85 1 . . . . . . . 3.08 1 1 86 1 . . . . . . . 5.57 1 1 87 1 . . . . . . . 6.19 1 1 88 1 . . . . . . . 3.17 1 1 89 1 . . . . . . . 2.93 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 HIS C C -5.123 -13.727 -4.674 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C -6.608 -13.525 -5.050 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C -6.726 -12.894 -6.449 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C -8.020 -14.078 -8.291 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C -10.046 -13.516 -7.824 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C -7.994 -13.328 -7.195 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS H1 H -6.860 -12.388 -3.256 1.00 . A A . 1 HIS H1 1 1 1 8 1 1 1 HIS HA H -7.066 -14.513 -5.101 1.00 . A A . 1 HIS HA 1 1 1 9 1 1 1 HIS HB2 H -6.741 -11.809 -6.341 1.00 . A A . 1 HIS HB2 1 1 1 10 1 1 1 HIS HB3 H -5.855 -13.179 -7.039 1.00 . A A . 1 HIS HB3 1 1 1 11 1 1 1 HIS HD1 H -9.535 -12.418 -6.134 1.00 . A A . 1 HIS HD1 1 1 1 12 1 1 1 HIS HD2 H -7.165 -14.518 -8.783 1.00 . A A . 1 HIS HD2 1 1 1 13 1 1 1 HIS HE1 H -11.121 -13.420 -7.866 1.00 . A A . 1 HIS HE1 1 1 1 14 1 1 1 HIS HE2 H -9.618 -14.704 -9.481 1.00 . A A . 1 HIS HE2 1 1 1 15 1 1 1 HIS N N -7.367 -12.739 -4.055 1.00 . A A . 1 HIS N 1 1 1 16 1 1 1 HIS ND1 N -9.241 -12.974 -6.903 1.00 . A A . 1 HIS ND1 1 1 1 17 1 1 1 HIS NE2 N -9.289 -14.191 -8.676 1.00 . A A . 1 HIS NE2 1 1 1 18 1 1 1 HIS O O -4.693 -14.838 -4.375 1.00 . A A . 1 HIS O 1 1 1 19 1 1 2 GLY C C -2.474 -11.111 -4.305 1.00 . A A . 2 GLY C 1 1 1 20 1 1 2 GLY CA C -2.974 -12.557 -4.244 1.00 . A A . 2 GLY CA 1 1 1 21 1 1 2 GLY H H -4.786 -11.707 -4.872 1.00 . A A . 2 GLY H 1 1 1 22 1 1 2 GLY HA2 H -2.863 -12.938 -3.228 1.00 . A A . 2 GLY HA2 1 1 1 23 1 1 2 GLY HA3 H -2.390 -13.172 -4.929 1.00 . A A . 2 GLY HA3 1 1 1 24 1 1 2 GLY N N -4.396 -12.602 -4.633 1.00 . A A . 2 GLY N 1 1 1 25 1 1 2 GLY O O -2.853 -10.296 -3.467 1.00 . A A . 2 GLY O 1 1 1 26 1 1 3 LEU C C -2.546 -8.287 -5.700 1.00 . A A . 3 LEU C 1 1 1 27 1 1 3 LEU CA C -1.497 -9.409 -5.819 1.00 . A A . 3 LEU CA 1 1 1 28 1 1 3 LEU CB C -0.827 -9.348 -7.199 1.00 . A A . 3 LEU CB 1 1 1 29 1 1 3 LEU CD1 C -1.233 -8.733 -9.586 1.00 . A A . 3 LEU CD1 1 1 1 30 1 1 3 LEU CD2 C -2.003 -10.966 -8.759 1.00 . A A . 3 LEU CD2 1 1 1 31 1 1 3 LEU CG C -1.790 -9.497 -8.386 1.00 . A A . 3 LEU CG 1 1 1 32 1 1 3 LEU H H -1.931 -11.432 -6.240 1.00 . A A . 3 LEU H 1 1 1 33 1 1 3 LEU HA H -0.721 -9.190 -5.086 1.00 . A A . 3 LEU HA 1 1 1 34 1 1 3 LEU HB2 H -0.323 -8.387 -7.290 1.00 . A A . 3 LEU HB2 1 1 1 35 1 1 3 LEU HB3 H -0.079 -10.139 -7.258 1.00 . A A . 3 LEU HB3 1 1 1 36 1 1 3 LEU HD11 H -1.913 -8.836 -10.432 1.00 . A A . 3 LEU HD11 1 1 1 37 1 1 3 LEU HD12 H -1.131 -7.679 -9.329 1.00 . A A . 3 LEU HD12 1 1 1 38 1 1 3 LEU HD13 H -0.257 -9.139 -9.854 1.00 . A A . 3 LEU HD13 1 1 1 39 1 1 3 LEU HD21 H -1.051 -11.407 -9.056 1.00 . A A . 3 LEU HD21 1 1 1 40 1 1 3 LEU HD22 H -2.401 -11.506 -7.899 1.00 . A A . 3 LEU HD22 1 1 1 41 1 1 3 LEU HD23 H -2.708 -11.032 -9.586 1.00 . A A . 3 LEU HD23 1 1 1 42 1 1 3 LEU HG H -2.752 -9.064 -8.112 1.00 . A A . 3 LEU HG 1 1 1 43 1 1 3 LEU N N -2.012 -10.761 -5.502 1.00 . A A . 3 LEU N 1 1 1 44 1 1 3 LEU O O -2.260 -7.235 -5.135 1.00 . A A . 3 LEU O 1 1 1 45 1 1 4 ALA C C -5.180 -7.244 -4.496 1.00 . A A . 4 ALA C 1 1 1 46 1 1 4 ALA CA C -4.952 -7.708 -5.949 1.00 . A A . 4 ALA CA 1 1 1 47 1 1 4 ALA CB C -6.199 -8.423 -6.482 1.00 . A A . 4 ALA CB 1 1 1 48 1 1 4 ALA H H -3.962 -9.439 -6.607 1.00 . A A . 4 ALA H 1 1 1 49 1 1 4 ALA HA H -4.779 -6.825 -6.564 1.00 . A A . 4 ALA HA 1 1 1 50 1 1 4 ALA HB1 H -6.024 -8.745 -7.509 1.00 . A A . 4 ALA HB1 1 1 1 51 1 1 4 ALA HB2 H -6.413 -9.292 -5.860 1.00 . A A . 4 ALA HB2 1 1 1 52 1 1 4 ALA HB3 H -7.048 -7.739 -6.456 1.00 . A A . 4 ALA HB3 1 1 1 53 1 1 4 ALA N N -3.784 -8.604 -6.091 1.00 . A A . 4 ALA N 1 1 1 54 1 1 4 ALA O O -5.640 -6.132 -4.260 1.00 . A A . 4 ALA O 1 1 1 55 1 1 5 SER C C -3.348 -7.348 -1.568 1.00 . A A . 5 SER C 1 1 1 56 1 1 5 SER CA C -4.720 -7.799 -2.111 1.00 . A A . 5 SER CA 1 1 1 57 1 1 5 SER CB C -5.180 -9.061 -1.378 1.00 . A A . 5 SER CB 1 1 1 58 1 1 5 SER H H -4.164 -8.868 -3.823 1.00 . A A . 5 SER H 1 1 1 59 1 1 5 SER HA H -5.443 -7.007 -1.919 1.00 . A A . 5 SER HA 1 1 1 60 1 1 5 SER HB2 H -6.002 -9.523 -1.924 1.00 . A A . 5 SER HB2 1 1 1 61 1 1 5 SER HB3 H -4.350 -9.764 -1.305 1.00 . A A . 5 SER HB3 1 1 1 62 1 1 5 SER HG H -5.854 -9.519 0.457 1.00 . A A . 5 SER HG 1 1 1 63 1 1 5 SER N N -4.690 -8.059 -3.564 1.00 . A A . 5 SER N 1 1 1 64 1 1 5 SER O O -3.267 -6.629 -0.575 1.00 . A A . 5 SER O 1 1 1 65 1 1 5 SER OG O -5.617 -8.702 -0.068 1.00 . A A . 5 SER OG 1 1 1 66 1 1 6 THR C C -0.802 -5.683 -2.050 1.00 . A A . 6 THR C 1 1 1 67 1 1 6 THR CA C -0.888 -7.222 -1.982 1.00 . A A . 6 THR CA 1 1 1 68 1 1 6 THR CB C 0.099 -7.890 -2.961 1.00 . A A . 6 THR CB 1 1 1 69 1 1 6 THR CG2 C 1.568 -7.591 -2.644 1.00 . A A . 6 THR CG2 1 1 1 70 1 1 6 THR H H -2.279 -8.483 -2.895 1.00 . A A . 6 THR H 1 1 1 71 1 1 6 THR HA H -0.614 -7.527 -0.972 1.00 . A A . 6 THR HA 1 1 1 72 1 1 6 THR HB H -0.118 -7.534 -3.968 1.00 . A A . 6 THR HB 1 1 1 73 1 1 6 THR HG1 H 0.641 -9.770 -3.402 1.00 . A A . 6 THR HG1 1 1 1 74 1 1 6 THR HG21 H 1.738 -6.515 -2.691 1.00 . A A . 6 THR HG21 1 1 1 75 1 1 6 THR HG22 H 2.206 -8.092 -3.372 1.00 . A A . 6 THR HG22 1 1 1 76 1 1 6 THR HG23 H 1.805 -7.953 -1.643 1.00 . A A . 6 THR HG23 1 1 1 77 1 1 6 THR N N -2.261 -7.718 -2.250 1.00 . A A . 6 THR N 1 1 1 78 1 1 6 THR O O -0.066 -5.063 -1.281 1.00 . A A . 6 THR O 1 1 1 79 1 1 6 THR OG1 O -0.107 -9.308 -2.924 1.00 . A A . 6 THR OG1 1 1 1 80 1 1 7 LEU C C -2.907 -3.058 -1.947 1.00 . A A . 7 LEU C 1 1 1 81 1 1 7 LEU CA C -1.854 -3.615 -2.926 1.00 . A A . 7 LEU CA 1 1 1 82 1 1 7 LEU CB C -2.237 -3.227 -4.357 1.00 . A A . 7 LEU CB 1 1 1 83 1 1 7 LEU CD1 C -1.728 -4.368 -6.520 1.00 . A A . 7 LEU CD1 1 1 1 84 1 1 7 LEU CD2 C -0.466 -2.295 -5.877 1.00 . A A . 7 LEU CD2 1 1 1 85 1 1 7 LEU CG C -1.134 -3.570 -5.360 1.00 . A A . 7 LEU CG 1 1 1 86 1 1 7 LEU H H -2.293 -5.604 -3.449 1.00 . A A . 7 LEU H 1 1 1 87 1 1 7 LEU HA H -0.895 -3.152 -2.693 1.00 . A A . 7 LEU HA 1 1 1 88 1 1 7 LEU HB2 H -3.144 -3.762 -4.635 1.00 . A A . 7 LEU HB2 1 1 1 89 1 1 7 LEU HB3 H -2.431 -2.155 -4.394 1.00 . A A . 7 LEU HB3 1 1 1 90 1 1 7 LEU HD11 H -0.942 -4.612 -7.235 1.00 . A A . 7 LEU HD11 1 1 1 91 1 1 7 LEU HD12 H -2.496 -3.774 -7.014 1.00 . A A . 7 LEU HD12 1 1 1 92 1 1 7 LEU HD13 H -2.170 -5.288 -6.138 1.00 . A A . 7 LEU HD13 1 1 1 93 1 1 7 LEU HD21 H -1.204 -1.679 -6.390 1.00 . A A . 7 LEU HD21 1 1 1 94 1 1 7 LEU HD22 H -0.047 -1.737 -5.039 1.00 . A A . 7 LEU HD22 1 1 1 95 1 1 7 LEU HD23 H 0.332 -2.559 -6.572 1.00 . A A . 7 LEU HD23 1 1 1 96 1 1 7 LEU HG H -0.382 -4.181 -4.861 1.00 . A A . 7 LEU HG 1 1 1 97 1 1 7 LEU N N -1.689 -5.081 -2.846 1.00 . A A . 7 LEU N 1 1 1 98 1 1 7 LEU O O -3.144 -1.856 -1.920 1.00 . A A . 7 LEU O 1 1 1 99 1 1 8 THR C C -3.682 -3.527 1.383 1.00 . A A . 8 THR C 1 1 1 100 1 1 8 THR CA C -4.378 -3.562 0.004 1.00 . A A . 8 THR CA 1 1 1 101 1 1 8 THR CB C -5.539 -4.577 -0.041 1.00 . A A . 8 THR CB 1 1 1 102 1 1 8 THR CG2 C -6.692 -4.262 0.920 1.00 . A A . 8 THR CG2 1 1 1 103 1 1 8 THR H H -3.263 -4.899 -1.146 1.00 . A A . 8 THR H 1 1 1 104 1 1 8 THR HA H -4.778 -2.570 -0.207 1.00 . A A . 8 THR HA 1 1 1 105 1 1 8 THR HB H -5.144 -5.562 0.207 1.00 . A A . 8 THR HB 1 1 1 106 1 1 8 THR HG1 H -6.878 -5.177 -1.416 1.00 . A A . 8 THR HG1 1 1 1 107 1 1 8 THR HG21 H -6.318 -4.250 1.944 1.00 . A A . 8 THR HG21 1 1 1 108 1 1 8 THR HG22 H -7.465 -5.024 0.824 1.00 . A A . 8 THR HG22 1 1 1 109 1 1 8 THR HG23 H -7.112 -3.286 0.675 1.00 . A A . 8 THR HG23 1 1 1 110 1 1 8 THR N N -3.405 -3.912 -1.058 1.00 . A A . 8 THR N 1 1 1 111 1 1 8 THR O O -4.214 -2.982 2.347 1.00 . A A . 8 THR O 1 1 1 112 1 1 8 THR OG1 O -6.050 -4.618 -1.379 1.00 . A A . 8 THR OG1 1 1 1 113 1 1 9 ARG C C -0.458 -3.027 2.563 1.00 . A A . 9 ARG C 1 1 1 114 1 1 9 ARG CA C -1.619 -4.038 2.650 1.00 . A A . 9 ARG CA 1 1 1 115 1 1 9 ARG CB C -1.102 -5.453 2.899 1.00 . A A . 9 ARG CB 1 1 1 116 1 1 9 ARG CD C -0.100 -6.996 4.607 1.00 . A A . 9 ARG CD 1 1 1 117 1 1 9 ARG CG C -0.556 -5.568 4.321 1.00 . A A . 9 ARG CG 1 1 1 118 1 1 9 ARG CZ C -0.555 -7.149 7.081 1.00 . A A . 9 ARG CZ 1 1 1 119 1 1 9 ARG H H -2.088 -4.562 0.664 1.00 . A A . 9 ARG H 1 1 1 120 1 1 9 ARG HA H -2.251 -3.755 3.492 1.00 . A A . 9 ARG HA 1 1 1 121 1 1 9 ARG HB2 H -1.917 -6.164 2.767 1.00 . A A . 9 ARG HB2 1 1 1 122 1 1 9 ARG HB3 H -0.307 -5.677 2.188 1.00 . A A . 9 ARG HB3 1 1 1 123 1 1 9 ARG HD2 H -0.345 -7.633 3.757 1.00 . A A . 9 ARG HD2 1 1 1 124 1 1 9 ARG HD3 H 0.977 -7.008 4.772 1.00 . A A . 9 ARG HD3 1 1 1 125 1 1 9 ARG HE H -1.532 -8.136 5.634 1.00 . A A . 9 ARG HE 1 1 1 126 1 1 9 ARG HG2 H 0.292 -4.892 4.435 1.00 . A A . 9 ARG HG2 1 1 1 127 1 1 9 ARG HG3 H -1.336 -5.290 5.029 1.00 . A A . 9 ARG HG3 1 1 1 128 1 1 9 ARG HH11 H 0.900 -5.814 6.702 1.00 . A A . 9 ARG HH11 1 1 1 129 1 1 9 ARG HH12 H 0.514 -6.022 8.378 1.00 . A A . 9 ARG HH12 1 1 1 130 1 1 9 ARG HH21 H -1.992 -8.356 7.833 1.00 . A A . 9 ARG HH21 1 1 1 131 1 1 9 ARG HH22 H -1.100 -7.435 8.994 1.00 . A A . 9 ARG HH22 1 1 1 132 1 1 9 ARG N N -2.451 -4.041 1.433 1.00 . A A . 9 ARG N 1 1 1 133 1 1 9 ARG NE N -0.788 -7.497 5.811 1.00 . A A . 9 ARG NE 1 1 1 134 1 1 9 ARG NH1 N 0.367 -6.259 7.421 1.00 . A A . 9 ARG NH1 1 1 1 135 1 1 9 ARG NH2 N -1.277 -7.697 8.047 1.00 . A A . 9 ARG NH2 1 1 1 136 1 1 9 ARG O O -0.359 -2.131 3.395 1.00 . A A . 9 ARG O 1 1 1 137 1 1 10 TRP C C 0.824 -0.667 1.102 1.00 . A A . 10 TRP C 1 1 1 138 1 1 10 TRP CA C 1.396 -2.098 1.241 1.00 . A A . 10 TRP CA 1 1 1 139 1 1 10 TRP CB C 2.248 -2.570 0.049 1.00 . A A . 10 TRP CB 1 1 1 140 1 1 10 TRP CD1 C 1.901 -1.369 -2.156 1.00 . A A . 10 TRP CD1 1 1 1 141 1 1 10 TRP CD2 C 3.458 -0.453 -0.894 1.00 . A A . 10 TRP CD2 1 1 1 142 1 1 10 TRP CE2 C 3.305 0.299 -2.052 1.00 . A A . 10 TRP CE2 1 1 1 143 1 1 10 TRP CE3 C 4.368 -0.071 0.078 1.00 . A A . 10 TRP CE3 1 1 1 144 1 1 10 TRP CG C 2.553 -1.499 -0.993 1.00 . A A . 10 TRP CG 1 1 1 145 1 1 10 TRP CH2 C 4.980 1.834 -1.265 1.00 . A A . 10 TRP CH2 1 1 1 146 1 1 10 TRP CZ2 C 4.077 1.432 -2.245 1.00 . A A . 10 TRP CZ2 1 1 1 147 1 1 10 TRP CZ3 C 5.121 1.088 -0.100 1.00 . A A . 10 TRP CZ3 1 1 1 148 1 1 10 TRP H H 0.425 -3.943 0.951 1.00 . A A . 10 TRP H 1 1 1 149 1 1 10 TRP HA H 2.057 -2.084 2.107 1.00 . A A . 10 TRP HA 1 1 1 150 1 1 10 TRP HB2 H 3.191 -2.961 0.430 1.00 . A A . 10 TRP HB2 1 1 1 151 1 1 10 TRP HB3 H 1.714 -3.381 -0.447 1.00 . A A . 10 TRP HB3 1 1 1 152 1 1 10 TRP HD1 H 1.126 -2.029 -2.515 1.00 . A A . 10 TRP HD1 1 1 1 153 1 1 10 TRP HE1 H 2.064 0.016 -3.693 1.00 . A A . 10 TRP HE1 1 1 1 154 1 1 10 TRP HE3 H 4.579 -0.724 0.925 1.00 . A A . 10 TRP HE3 1 1 1 155 1 1 10 TRP HH2 H 5.569 2.740 -1.405 1.00 . A A . 10 TRP HH2 1 1 1 156 1 1 10 TRP HZ2 H 4.066 1.947 -3.207 1.00 . A A . 10 TRP HZ2 1 1 1 157 1 1 10 TRP HZ3 H 5.774 1.444 0.695 1.00 . A A . 10 TRP HZ3 1 1 1 158 1 1 10 TRP N N 0.363 -3.119 1.517 1.00 . A A . 10 TRP N 1 1 1 159 1 1 10 TRP NE1 N 2.362 -0.280 -2.790 1.00 . A A . 10 TRP NE1 1 1 1 160 1 1 10 TRP O O 1.429 0.293 1.581 1.00 . A A . 10 TRP O 1 1 1 161 1 1 11 ALA C C -1.654 1.237 1.939 1.00 . A A . 11 ALA C 1 1 1 162 1 1 11 ALA CA C -1.189 0.687 0.572 1.00 . A A . 11 ALA CA 1 1 1 163 1 1 11 ALA CB C -2.398 0.531 -0.345 1.00 . A A . 11 ALA CB 1 1 1 164 1 1 11 ALA H H -0.931 -1.393 0.345 1.00 . A A . 11 ALA H 1 1 1 165 1 1 11 ALA HA H -0.536 1.436 0.125 1.00 . A A . 11 ALA HA 1 1 1 166 1 1 11 ALA HB1 H -2.977 1.455 -0.345 1.00 . A A . 11 ALA HB1 1 1 1 167 1 1 11 ALA HB2 H -3.023 -0.288 0.012 1.00 . A A . 11 ALA HB2 1 1 1 168 1 1 11 ALA HB3 H -2.060 0.315 -1.359 1.00 . A A . 11 ALA HB3 1 1 1 169 1 1 11 ALA N N -0.425 -0.582 0.639 1.00 . A A . 11 ALA N 1 1 1 170 1 1 11 ALA O O -2.219 2.322 2.025 1.00 . A A . 11 ALA O 1 1 1 171 1 1 12 HIS C C -0.225 1.324 5.092 1.00 . A A . 12 HIS C 1 1 1 172 1 1 12 HIS CA C -1.540 0.884 4.406 1.00 . A A . 12 HIS CA 1 1 1 173 1 1 12 HIS CB C -2.212 -0.326 5.076 1.00 . A A . 12 HIS CB 1 1 1 174 1 1 12 HIS CD2 C -1.152 -0.957 7.301 1.00 . A A . 12 HIS CD2 1 1 1 175 1 1 12 HIS CE1 C -2.465 0.022 8.689 1.00 . A A . 12 HIS CE1 1 1 1 176 1 1 12 HIS CG C -2.130 -0.379 6.609 1.00 . A A . 12 HIS CG 1 1 1 177 1 1 12 HIS H H -0.887 -0.394 2.892 1.00 . A A . 12 HIS H 1 1 1 178 1 1 12 HIS HA H -2.238 1.721 4.430 1.00 . A A . 12 HIS HA 1 1 1 179 1 1 12 HIS HB2 H -3.264 -0.336 4.788 1.00 . A A . 12 HIS HB2 1 1 1 180 1 1 12 HIS HB3 H -1.740 -1.227 4.685 1.00 . A A . 12 HIS HB3 1 1 1 181 1 1 12 HIS HD1 H -3.825 0.646 7.238 1.00 . A A . 12 HIS HD1 1 1 1 182 1 1 12 HIS HD2 H -0.336 -1.531 6.889 1.00 . A A . 12 HIS HD2 1 1 1 183 1 1 12 HIS HE1 H -2.896 0.395 9.606 1.00 . A A . 12 HIS HE1 1 1 1 184 1 1 12 HIS HE2 H -0.773 -1.006 9.357 1.00 . A A . 12 HIS HE2 1 1 1 185 1 1 12 HIS N N -1.316 0.506 2.996 1.00 . A A . 12 HIS N 1 1 1 186 1 1 12 HIS ND1 N -2.956 0.209 7.461 1.00 . A A . 12 HIS ND1 1 1 1 187 1 1 12 HIS NE2 N -1.356 -0.703 8.590 1.00 . A A . 12 HIS NE2 1 1 1 188 1 1 12 HIS O O -0.254 1.948 6.148 1.00 . A A . 12 HIS O 1 1 1 189 1 1 13 TYR C C 2.747 2.757 4.458 1.00 . A A . 13 TYR C 1 1 1 190 1 1 13 TYR CA C 2.250 1.377 4.916 1.00 . A A . 13 TYR CA 1 1 1 191 1 1 13 TYR CB C 3.150 0.251 4.400 1.00 . A A . 13 TYR CB 1 1 1 192 1 1 13 TYR CD1 C 3.393 -0.997 6.564 1.00 . A A . 13 TYR CD1 1 1 1 193 1 1 13 TYR CD2 C 5.391 -0.190 5.467 1.00 . A A . 13 TYR CD2 1 1 1 194 1 1 13 TYR CE1 C 4.169 -1.595 7.541 1.00 . A A . 13 TYR CE1 1 1 1 195 1 1 13 TYR CE2 C 6.163 -0.795 6.447 1.00 . A A . 13 TYR CE2 1 1 1 196 1 1 13 TYR CG C 4.004 -0.300 5.523 1.00 . A A . 13 TYR CG 1 1 1 197 1 1 13 TYR CZ C 5.548 -1.482 7.480 1.00 . A A . 13 TYR CZ 1 1 1 198 1 1 13 TYR H H 0.872 0.693 3.494 1.00 . A A . 13 TYR H 1 1 1 199 1 1 13 TYR HA H 2.232 1.349 6.005 1.00 . A A . 13 TYR HA 1 1 1 200 1 1 13 TYR HB2 H 2.529 -0.549 3.996 1.00 . A A . 13 TYR HB2 1 1 1 201 1 1 13 TYR HB3 H 3.796 0.637 3.613 1.00 . A A . 13 TYR HB3 1 1 1 202 1 1 13 TYR HD1 H 2.306 -1.036 6.624 1.00 . A A . 13 TYR HD1 1 1 1 203 1 1 13 TYR HD2 H 5.859 0.377 4.665 1.00 . A A . 13 TYR HD2 1 1 1 204 1 1 13 TYR HE1 H 3.676 -2.204 8.302 1.00 . A A . 13 TYR HE1 1 1 1 205 1 1 13 TYR HE2 H 7.251 -0.789 6.348 1.00 . A A . 13 TYR HE2 1 1 1 206 1 1 13 TYR HH H 5.709 -2.431 9.149 1.00 . A A . 13 TYR HH 1 1 1 207 1 1 13 TYR N N 0.893 1.104 4.405 1.00 . A A . 13 TYR N 1 1 1 208 1 1 13 TYR O O 2.725 3.726 5.216 1.00 . A A . 13 TYR O 1 1 1 209 1 1 13 TYR OH O 6.313 -2.037 8.463 1.00 . A A . 13 TYR OH 1 1 1 210 1 1 14 ASN C C 2.168 5.157 2.596 1.00 . A A . 14 ASN C 1 1 1 211 1 1 14 ASN CA C 3.314 4.138 2.494 1.00 . A A . 14 ASN CA 1 1 1 212 1 1 14 ASN CB C 3.698 3.927 1.029 1.00 . A A . 14 ASN CB 1 1 1 213 1 1 14 ASN CG C 4.288 5.197 0.409 1.00 . A A . 14 ASN CG 1 1 1 214 1 1 14 ASN H H 3.023 2.054 2.557 1.00 . A A . 14 ASN H 1 1 1 215 1 1 14 ASN HA H 4.179 4.563 3.003 1.00 . A A . 14 ASN HA 1 1 1 216 1 1 14 ASN HB2 H 4.432 3.125 0.964 1.00 . A A . 14 ASN HB2 1 1 1 217 1 1 14 ASN HB3 H 2.807 3.641 0.468 1.00 . A A . 14 ASN HB3 1 1 1 218 1 1 14 ASN HD21 H 2.540 5.673 -0.492 1.00 . A A . 14 ASN HD21 1 1 1 219 1 1 14 ASN HD22 H 3.888 6.748 -0.729 1.00 . A A . 14 ASN HD22 1 1 1 220 1 1 14 ASN N N 2.992 2.858 3.152 1.00 . A A . 14 ASN N 1 1 1 221 1 1 14 ASN ND2 N 3.499 5.906 -0.369 1.00 . A A . 14 ASN ND2 1 1 1 222 1 1 14 ASN O O 2.402 6.334 2.384 1.00 . A A . 14 ASN O 1 1 1 223 1 1 14 ASN OD1 O 5.408 5.598 0.684 1.00 . A A . 14 ASN OD1 1 1 1 224 1 1 15 ALA C C 0.279 6.868 4.231 1.00 . A A . 15 ALA C 1 1 1 225 1 1 15 ALA CA C -0.134 5.674 3.341 1.00 . A A . 15 ALA CA 1 1 1 226 1 1 15 ALA CB C -1.266 4.886 4.003 1.00 . A A . 15 ALA CB 1 1 1 227 1 1 15 ALA H H 0.819 3.798 3.303 1.00 . A A . 15 ALA H 1 1 1 228 1 1 15 ALA HA H -0.502 6.067 2.393 1.00 . A A . 15 ALA HA 1 1 1 229 1 1 15 ALA HB1 H -1.548 4.048 3.365 1.00 . A A . 15 ALA HB1 1 1 1 230 1 1 15 ALA HB2 H -2.127 5.539 4.146 1.00 . A A . 15 ALA HB2 1 1 1 231 1 1 15 ALA HB3 H -0.930 4.511 4.970 1.00 . A A . 15 ALA HB3 1 1 1 232 1 1 15 ALA N N 0.986 4.750 3.056 1.00 . A A . 15 ALA N 1 1 1 233 1 1 15 ALA O O -0.220 7.976 4.052 1.00 . A A . 15 ALA O 1 1 1 234 1 1 16 LEU C C 3.298 8.171 5.364 1.00 . A A . 16 LEU C 1 1 1 235 1 1 16 LEU CA C 1.945 7.666 5.906 1.00 . A A . 16 LEU CA 1 1 1 236 1 1 16 LEU CB C 2.108 7.081 7.313 1.00 . A A . 16 LEU CB 1 1 1 237 1 1 16 LEU CD1 C 0.734 5.509 8.706 1.00 . A A . 16 LEU CD1 1 1 1 238 1 1 16 LEU CD2 C 0.423 7.989 8.943 1.00 . A A . 16 LEU CD2 1 1 1 239 1 1 16 LEU CG C 0.744 6.850 7.972 1.00 . A A . 16 LEU CG 1 1 1 240 1 1 16 LEU H H 1.722 5.735 5.104 1.00 . A A . 16 LEU H 1 1 1 241 1 1 16 LEU HA H 1.268 8.519 5.971 1.00 . A A . 16 LEU HA 1 1 1 242 1 1 16 LEU HB2 H 2.637 6.131 7.244 1.00 . A A . 16 LEU HB2 1 1 1 243 1 1 16 LEU HB3 H 2.689 7.772 7.924 1.00 . A A . 16 LEU HB3 1 1 1 244 1 1 16 LEU HD11 H -0.240 5.355 9.171 1.00 . A A . 16 LEU HD11 1 1 1 245 1 1 16 LEU HD12 H 0.928 4.705 7.996 1.00 . A A . 16 LEU HD12 1 1 1 246 1 1 16 LEU HD13 H 1.506 5.509 9.475 1.00 . A A . 16 LEU HD13 1 1 1 247 1 1 16 LEU HD21 H 1.169 8.011 9.737 1.00 . A A . 16 LEU HD21 1 1 1 248 1 1 16 LEU HD22 H 0.433 8.938 8.408 1.00 . A A . 16 LEU HD22 1 1 1 249 1 1 16 LEU HD23 H -0.564 7.828 9.378 1.00 . A A . 16 LEU HD23 1 1 1 250 1 1 16 LEU HG H -0.020 6.827 7.195 1.00 . A A . 16 LEU HG 1 1 1 251 1 1 16 LEU N N 1.312 6.645 5.045 1.00 . A A . 16 LEU N 1 1 1 252 1 1 16 LEU O O 3.659 9.325 5.579 1.00 . A A . 16 LEU O 1 1 1 253 1 1 17 ILE C C 5.054 8.293 2.572 1.00 . A A . 17 ILE C 1 1 1 254 1 1 17 ILE CA C 5.294 7.631 3.959 1.00 . A A . 17 ILE CA 1 1 1 255 1 1 17 ILE CB C 6.170 6.355 3.847 1.00 . A A . 17 ILE CB 1 1 1 256 1 1 17 ILE CD1 C 6.629 4.072 4.970 1.00 . A A . 17 ILE CD1 1 1 1 257 1 1 17 ILE CG1 C 6.167 5.525 5.145 1.00 . A A . 17 ILE CG1 1 1 1 258 1 1 17 ILE CG2 C 7.624 6.742 3.529 1.00 . A A . 17 ILE CG2 1 1 1 259 1 1 17 ILE H H 3.726 6.359 4.535 1.00 . A A . 17 ILE H 1 1 1 260 1 1 17 ILE HA H 5.831 8.348 4.580 1.00 . A A . 17 ILE HA 1 1 1 261 1 1 17 ILE HB H 5.786 5.738 3.035 1.00 . A A . 17 ILE HB 1 1 1 262 1 1 17 ILE HD11 H 5.972 3.564 4.266 1.00 . A A . 17 ILE HD11 1 1 1 263 1 1 17 ILE HD12 H 6.596 3.561 5.932 1.00 . A A . 17 ILE HD12 1 1 1 264 1 1 17 ILE HD13 H 7.650 4.060 4.588 1.00 . A A . 17 ILE HD13 1 1 1 265 1 1 17 ILE HG12 H 6.830 6.010 5.861 1.00 . A A . 17 ILE HG12 1 1 1 266 1 1 17 ILE HG13 H 5.156 5.522 5.554 1.00 . A A . 17 ILE HG13 1 1 1 267 1 1 17 ILE HG21 H 7.653 7.331 2.612 1.00 . A A . 17 ILE HG21 1 1 1 268 1 1 17 ILE HG22 H 8.031 7.330 4.351 1.00 . A A . 17 ILE HG22 1 1 1 269 1 1 17 ILE HG23 H 8.220 5.839 3.399 1.00 . A A . 17 ILE HG23 1 1 1 270 1 1 17 ILE N N 4.015 7.306 4.644 1.00 . A A . 17 ILE N 1 1 1 271 1 1 17 ILE O O 5.976 8.557 1.798 1.00 . A A . 17 ILE O 1 1 1 272 1 1 18 ARG C C 3.383 10.835 1.278 1.00 . A A . 18 ARG C 1 1 1 273 1 1 18 ARG CA C 3.390 9.320 1.052 1.00 . A A . 18 ARG CA 1 1 1 274 1 1 18 ARG CB C 1.996 8.836 0.626 1.00 . A A . 18 ARG CB 1 1 1 275 1 1 18 ARG CD C 0.188 8.990 -1.133 1.00 . A A . 18 ARG CD 1 1 1 276 1 1 18 ARG CG C 1.634 9.320 -0.782 1.00 . A A . 18 ARG CG 1 1 1 277 1 1 18 ARG CZ C -1.580 10.438 -2.152 1.00 . A A . 18 ARG CZ 1 1 1 278 1 1 18 ARG H H 3.046 8.366 2.881 1.00 . A A . 18 ARG H 1 1 1 279 1 1 18 ARG HA H 4.105 9.081 0.264 1.00 . A A . 18 ARG HA 1 1 1 280 1 1 18 ARG HB2 H 1.982 7.746 0.639 1.00 . A A . 18 ARG HB2 1 1 1 281 1 1 18 ARG HB3 H 1.257 9.211 1.333 1.00 . A A . 18 ARG HB3 1 1 1 282 1 1 18 ARG HD2 H 0.142 8.018 -1.624 1.00 . A A . 18 ARG HD2 1 1 1 283 1 1 18 ARG HD3 H -0.417 8.973 -0.227 1.00 . A A . 18 ARG HD3 1 1 1 284 1 1 18 ARG HE H 0.376 10.479 -2.613 1.00 . A A . 18 ARG HE 1 1 1 285 1 1 18 ARG HG2 H 1.772 10.401 -0.831 1.00 . A A . 18 ARG HG2 1 1 1 286 1 1 18 ARG HG3 H 2.295 8.843 -1.505 1.00 . A A . 18 ARG HG3 1 1 1 287 1 1 18 ARG HH11 H -2.321 9.151 -0.804 1.00 . A A . 18 ARG HH11 1 1 1 288 1 1 18 ARG HH12 H -3.495 10.191 -1.546 1.00 . A A . 18 ARG HH12 1 1 1 289 1 1 18 ARG HH21 H -1.202 11.885 -3.522 1.00 . A A . 18 ARG HH21 1 1 1 290 1 1 18 ARG HH22 H -2.856 11.712 -3.046 1.00 . A A . 18 ARG HH22 1 1 1 291 1 1 18 ARG N N 3.802 8.648 2.294 1.00 . A A . 18 ARG N 1 1 1 292 1 1 18 ARG NE N -0.313 10.033 -2.048 1.00 . A A . 18 ARG NE 1 1 1 293 1 1 18 ARG NH1 N -2.554 9.877 -1.448 1.00 . A A . 18 ARG NH1 1 1 1 294 1 1 18 ARG NH2 N -1.903 11.420 -2.981 1.00 . A A . 18 ARG NH2 1 1 1 295 1 1 18 ARG O O 3.110 11.339 2.365 1.00 . A A . 18 ARG O 1 1 1 296 1 1 19 ALA C C 2.864 13.538 -0.951 1.00 . A A . 19 ALA C 1 1 1 297 1 1 19 ALA CA C 3.782 12.993 0.154 1.00 . A A . 19 ALA CA 1 1 1 298 1 1 19 ALA CB C 5.228 13.465 -0.032 1.00 . A A . 19 ALA CB 1 1 1 299 1 1 19 ALA H H 4.038 11.033 -0.616 1.00 . A A . 19 ALA H 1 1 1 300 1 1 19 ALA HA H 3.422 13.372 1.111 1.00 . A A . 19 ALA HA 1 1 1 301 1 1 19 ALA HB1 H 5.254 14.554 -0.071 1.00 . A A . 19 ALA HB1 1 1 1 302 1 1 19 ALA HB2 H 5.834 13.117 0.805 1.00 . A A . 19 ALA HB2 1 1 1 303 1 1 19 ALA HB3 H 5.626 13.059 -0.962 1.00 . A A . 19 ALA HB3 1 1 1 304 1 1 19 ALA N N 3.755 11.520 0.205 1.00 . A A . 19 ALA N 1 1 1 305 1 1 19 ALA O O 1.880 14.220 -0.680 1.00 . A A . 19 ALA O 1 1 1 306 1 1 20 PHE C C 1.529 12.334 -3.947 1.00 . A A . 20 PHE C 1 1 1 307 1 1 20 PHE CA C 2.359 13.494 -3.370 1.00 . A A . 20 PHE CA 1 1 1 308 1 1 20 PHE CB C 3.356 14.040 -4.401 1.00 . A A . 20 PHE CB 1 1 1 309 1 1 20 PHE CD1 C 1.774 15.536 -5.710 1.00 . A A . 20 PHE CD1 1 1 1 310 1 1 20 PHE CD2 C 3.018 13.841 -6.890 1.00 . A A . 20 PHE CD2 1 1 1 311 1 1 20 PHE CE1 C 1.171 15.918 -6.903 1.00 . A A . 20 PHE CE1 1 1 1 312 1 1 20 PHE CE2 C 2.415 14.229 -8.079 1.00 . A A . 20 PHE CE2 1 1 1 313 1 1 20 PHE CG C 2.700 14.495 -5.704 1.00 . A A . 20 PHE CG 1 1 1 314 1 1 20 PHE CZ C 1.495 15.267 -8.085 1.00 . A A . 20 PHE CZ 1 1 1 315 1 1 20 PHE H H 3.860 12.438 -2.347 1.00 . A A . 20 PHE H 1 1 1 316 1 1 20 PHE HA H 1.679 14.298 -3.087 1.00 . A A . 20 PHE HA 1 1 1 317 1 1 20 PHE HB2 H 3.887 14.884 -3.962 1.00 . A A . 20 PHE HB2 1 1 1 318 1 1 20 PHE HB3 H 4.076 13.256 -4.633 1.00 . A A . 20 PHE HB3 1 1 1 319 1 1 20 PHE HD1 H 1.511 16.038 -4.780 1.00 . A A . 20 PHE HD1 1 1 1 320 1 1 20 PHE HD2 H 3.749 13.033 -6.885 1.00 . A A . 20 PHE HD2 1 1 1 321 1 1 20 PHE HE1 H 0.436 16.723 -6.903 1.00 . A A . 20 PHE HE1 1 1 1 322 1 1 20 PHE HE2 H 2.673 13.720 -9.009 1.00 . A A . 20 PHE HE2 1 1 1 323 1 1 20 PHE HZ H 1.044 15.591 -9.026 1.00 . A A . 20 PHE HZ 1 1 1 324 1 1 20 PHE N N 3.119 13.082 -2.175 1.00 . A A . 20 PHE N 1 1 1 325 1 1 20 PHE O O 2.021 11.184 -3.881 1.00 . A A . 20 PHE O 1 1 2 326 1 1 1 HIS C C -6.624 -13.106 -5.276 1.00 . A A . 1 HIS C 1 1 2 327 1 1 1 HIS CA C -8.026 -12.749 -5.821 1.00 . A A . 1 HIS CA 1 1 2 328 1 1 1 HIS CB C -9.079 -12.864 -4.708 1.00 . A A . 1 HIS CB 1 1 2 329 1 1 1 HIS CD2 C -10.074 -10.601 -4.118 1.00 . A A . 1 HIS CD2 1 1 2 330 1 1 1 HIS CE1 C -8.981 -10.101 -2.337 1.00 . A A . 1 HIS CE1 1 1 2 331 1 1 1 HIS CG C -9.198 -11.581 -3.886 1.00 . A A . 1 HIS CG 1 1 2 332 1 1 1 HIS H1 H -7.747 -14.334 -7.227 1.00 . A A . 1 HIS H1 1 1 2 333 1 1 1 HIS HA H -8.008 -11.718 -6.176 1.00 . A A . 1 HIS HA 1 1 2 334 1 1 1 HIS HB2 H -10.046 -13.080 -5.162 1.00 . A A . 1 HIS HB2 1 1 2 335 1 1 1 HIS HB3 H -8.807 -13.686 -4.046 1.00 . A A . 1 HIS HB3 1 1 2 336 1 1 1 HIS HD1 H -7.776 -11.798 -2.379 1.00 . A A . 1 HIS HD1 1 1 2 337 1 1 1 HIS HD2 H -10.778 -10.559 -4.935 1.00 . A A . 1 HIS HD2 1 1 2 338 1 1 1 HIS HE1 H -8.647 -9.584 -1.450 1.00 . A A . 1 HIS HE1 1 1 2 339 1 1 1 HIS HE2 H -10.447 -8.824 -3.091 1.00 . A A . 1 HIS HE2 1 1 2 340 1 1 1 HIS N N -8.403 -13.621 -6.940 1.00 . A A . 1 HIS N 1 1 2 341 1 1 1 HIS ND1 N -8.515 -11.267 -2.787 1.00 . A A . 1 HIS ND1 1 1 2 342 1 1 1 HIS NE2 N -9.927 -9.687 -3.168 1.00 . A A . 1 HIS NE2 1 1 2 343 1 1 1 HIS O O -6.318 -14.270 -5.031 1.00 . A A . 1 HIS O 1 1 2 344 1 1 2 GLY C C -3.618 -10.903 -4.826 1.00 . A A . 2 GLY C 1 1 2 345 1 1 2 GLY CA C -4.361 -12.242 -4.799 1.00 . A A . 2 GLY CA 1 1 2 346 1 1 2 GLY H H -6.018 -11.148 -5.506 1.00 . A A . 2 GLY H 1 1 2 347 1 1 2 GLY HA2 H -4.346 -12.636 -3.783 1.00 . A A . 2 GLY HA2 1 1 2 348 1 1 2 GLY HA3 H -3.859 -12.944 -5.464 1.00 . A A . 2 GLY HA3 1 1 2 349 1 1 2 GLY N N -5.764 -12.081 -5.232 1.00 . A A . 2 GLY N 1 1 2 350 1 1 2 GLY O O -3.695 -10.125 -3.879 1.00 . A A . 2 GLY O 1 1 2 351 1 1 3 LEU C C -3.383 -8.046 -6.094 1.00 . A A . 3 LEU C 1 1 2 352 1 1 3 LEU CA C -2.456 -9.265 -6.256 1.00 . A A . 3 LEU CA 1 1 2 353 1 1 3 LEU CB C -1.748 -9.207 -7.617 1.00 . A A . 3 LEU CB 1 1 2 354 1 1 3 LEU CD1 C -2.037 -8.357 -9.947 1.00 . A A . 3 LEU CD1 1 1 2 355 1 1 3 LEU CD2 C -3.052 -10.559 -9.313 1.00 . A A . 3 LEU CD2 1 1 2 356 1 1 3 LEU CG C -2.695 -9.154 -8.821 1.00 . A A . 3 LEU CG 1 1 2 357 1 1 3 LEU H H -3.103 -11.205 -6.780 1.00 . A A . 3 LEU H 1 1 2 358 1 1 3 LEU HA H -1.679 -9.170 -5.497 1.00 . A A . 3 LEU HA 1 1 2 359 1 1 3 LEU HB2 H -1.122 -8.315 -7.637 1.00 . A A . 3 LEU HB2 1 1 2 360 1 1 3 LEU HB3 H -1.109 -10.084 -7.716 1.00 . A A . 3 LEU HB3 1 1 2 361 1 1 3 LEU HD11 H -2.709 -8.317 -10.805 1.00 . A A . 3 LEU HD11 1 1 2 362 1 1 3 LEU HD12 H -1.105 -8.840 -10.237 1.00 . A A . 3 LEU HD12 1 1 2 363 1 1 3 LEU HD13 H -1.829 -7.344 -9.601 1.00 . A A . 3 LEU HD13 1 1 2 364 1 1 3 LEU HD21 H -3.744 -10.485 -10.152 1.00 . A A . 3 LEU HD21 1 1 2 365 1 1 3 LEU HD22 H -3.520 -11.119 -8.503 1.00 . A A . 3 LEU HD22 1 1 2 366 1 1 3 LEU HD23 H -2.146 -11.073 -9.634 1.00 . A A . 3 LEU HD23 1 1 2 367 1 1 3 LEU HG H -3.612 -8.645 -8.523 1.00 . A A . 3 LEU HG 1 1 2 368 1 1 3 LEU N N -3.127 -10.561 -6.015 1.00 . A A . 3 LEU N 1 1 2 369 1 1 3 LEU O O -3.004 -7.060 -5.472 1.00 . A A . 3 LEU O 1 1 2 370 1 1 4 ALA C C -5.843 -6.774 -4.788 1.00 . A A . 4 ALA C 1 1 2 371 1 1 4 ALA CA C -5.694 -7.181 -6.270 1.00 . A A . 4 ALA CA 1 1 2 372 1 1 4 ALA CB C -7.025 -7.689 -6.829 1.00 . A A . 4 ALA CB 1 1 2 373 1 1 4 ALA H H -4.925 -8.970 -7.061 1.00 . A A . 4 ALA H 1 1 2 374 1 1 4 ALA HA H -5.412 -6.291 -6.833 1.00 . A A . 4 ALA HA 1 1 2 375 1 1 4 ALA HB1 H -6.897 -7.969 -7.874 1.00 . A A . 4 ALA HB1 1 1 2 376 1 1 4 ALA HB2 H -7.351 -8.558 -6.258 1.00 . A A . 4 ALA HB2 1 1 2 377 1 1 4 ALA HB3 H -7.775 -6.902 -6.753 1.00 . A A . 4 ALA HB3 1 1 2 378 1 1 4 ALA N N -4.648 -8.205 -6.484 1.00 . A A . 4 ALA N 1 1 2 379 1 1 4 ALA O O -6.059 -5.606 -4.489 1.00 . A A . 4 ALA O 1 1 2 380 1 1 5 SER C C -4.037 -7.109 -1.924 1.00 . A A . 5 SER C 1 1 2 381 1 1 5 SER CA C -5.426 -7.522 -2.445 1.00 . A A . 5 SER CA 1 1 2 382 1 1 5 SER CB C -5.833 -8.822 -1.754 1.00 . A A . 5 SER CB 1 1 2 383 1 1 5 SER H H -5.050 -8.556 -4.225 1.00 . A A . 5 SER H 1 1 2 384 1 1 5 SER HA H -6.143 -6.746 -2.176 1.00 . A A . 5 SER HA 1 1 2 385 1 1 5 SER HB2 H -6.552 -9.359 -2.374 1.00 . A A . 5 SER HB2 1 1 2 386 1 1 5 SER HB3 H -4.952 -9.444 -1.595 1.00 . A A . 5 SER HB3 1 1 2 387 1 1 5 SER HG H -6.681 -9.333 0.004 1.00 . A A . 5 SER HG 1 1 2 388 1 1 5 SER N N -5.453 -7.701 -3.911 1.00 . A A . 5 SER N 1 1 2 389 1 1 5 SER O O -3.929 -6.404 -0.922 1.00 . A A . 5 SER O 1 1 2 390 1 1 5 SER OG O -6.428 -8.505 -0.496 1.00 . A A . 5 SER OG 1 1 2 391 1 1 6 THR C C -1.432 -5.513 -2.340 1.00 . A A . 6 THR C 1 1 2 392 1 1 6 THR CA C -1.581 -7.047 -2.342 1.00 . A A . 6 THR CA 1 1 2 393 1 1 6 THR CB C -0.547 -7.752 -3.256 1.00 . A A . 6 THR CB 1 1 2 394 1 1 6 THR CG2 C -0.152 -7.041 -4.559 1.00 . A A . 6 THR CG2 1 1 2 395 1 1 6 THR H H -3.072 -8.014 -3.482 1.00 . A A . 6 THR H 1 1 2 396 1 1 6 THR HA H -1.376 -7.381 -1.325 1.00 . A A . 6 THR HA 1 1 2 397 1 1 6 THR HB H -0.939 -8.736 -3.514 1.00 . A A . 6 THR HB 1 1 2 398 1 1 6 THR HG1 H 1.382 -8.234 -3.103 1.00 . A A . 6 THR HG1 1 1 2 399 1 1 6 THR HG21 H -0.419 -7.668 -5.410 1.00 . A A . 6 THR HG21 1 1 2 400 1 1 6 THR HG22 H 0.924 -6.861 -4.563 1.00 . A A . 6 THR HG22 1 1 2 401 1 1 6 THR HG23 H -0.679 -6.090 -4.628 1.00 . A A . 6 THR HG23 1 1 2 402 1 1 6 THR N N -2.973 -7.467 -2.653 1.00 . A A . 6 THR N 1 1 2 403 1 1 6 THR O O -0.715 -4.932 -1.525 1.00 . A A . 6 THR O 1 1 2 404 1 1 6 THR OG1 O 0.644 -7.935 -2.497 1.00 . A A . 6 THR OG1 1 1 2 405 1 1 7 LEU C C -3.415 -2.812 -2.291 1.00 . A A . 7 LEU C 1 1 2 406 1 1 7 LEU CA C -2.391 -3.413 -3.264 1.00 . A A . 7 LEU CA 1 1 2 407 1 1 7 LEU CB C -2.790 -3.074 -4.705 1.00 . A A . 7 LEU CB 1 1 2 408 1 1 7 LEU CD1 C -2.441 -4.169 -6.922 1.00 . A A . 7 LEU CD1 1 1 2 409 1 1 7 LEU CD2 C -0.855 -2.378 -6.156 1.00 . A A . 7 LEU CD2 1 1 2 410 1 1 7 LEU CG C -1.742 -3.545 -5.715 1.00 . A A . 7 LEU CG 1 1 2 411 1 1 7 LEU H H -2.919 -5.384 -3.735 1.00 . A A . 7 LEU H 1 1 2 412 1 1 7 LEU HA H -1.414 -2.973 -3.059 1.00 . A A . 7 LEU HA 1 1 2 413 1 1 7 LEU HB2 H -3.743 -3.551 -4.932 1.00 . A A . 7 LEU HB2 1 1 2 414 1 1 7 LEU HB3 H -2.904 -1.993 -4.794 1.00 . A A . 7 LEU HB3 1 1 2 415 1 1 7 LEU HD11 H -1.695 -4.504 -7.641 1.00 . A A . 7 LEU HD11 1 1 2 416 1 1 7 LEU HD12 H -3.039 -5.019 -6.595 1.00 . A A . 7 LEU HD12 1 1 2 417 1 1 7 LEU HD13 H -3.089 -3.427 -7.390 1.00 . A A . 7 LEU HD13 1 1 2 418 1 1 7 LEU HD21 H -0.102 -2.739 -6.856 1.00 . A A . 7 LEU HD21 1 1 2 419 1 1 7 LEU HD22 H -0.363 -1.945 -5.285 1.00 . A A . 7 LEU HD22 1 1 2 420 1 1 7 LEU HD23 H -1.469 -1.620 -6.642 1.00 . A A . 7 LEU HD23 1 1 2 421 1 1 7 LEU HG H -1.116 -4.302 -5.243 1.00 . A A . 7 LEU HG 1 1 2 422 1 1 7 LEU N N -2.282 -4.879 -3.151 1.00 . A A . 7 LEU N 1 1 2 423 1 1 7 LEU O O -3.566 -1.597 -2.239 1.00 . A A . 7 LEU O 1 1 2 424 1 1 8 THR C C -4.256 -3.372 1.011 1.00 . A A . 8 THR C 1 1 2 425 1 1 8 THR CA C -4.940 -3.280 -0.368 1.00 . A A . 8 THR CA 1 1 2 426 1 1 8 THR CB C -6.170 -4.210 -0.444 1.00 . A A . 8 THR CB 1 1 2 427 1 1 8 THR CG2 C -7.348 -3.747 0.420 1.00 . A A . 8 THR CG2 1 1 2 428 1 1 8 THR H H -3.888 -4.647 -1.531 1.00 . A A . 8 THR H 1 1 2 429 1 1 8 THR HA H -5.265 -2.253 -0.533 1.00 . A A . 8 THR HA 1 1 2 430 1 1 8 THR HB H -5.872 -5.207 -0.118 1.00 . A A . 8 THR HB 1 1 2 431 1 1 8 THR HG1 H -7.471 -4.793 -1.860 1.00 . A A . 8 THR HG1 1 1 2 432 1 1 8 THR HG21 H -7.669 -2.757 0.096 1.00 . A A . 8 THR HG21 1 1 2 433 1 1 8 THR HG22 H -8.175 -4.449 0.315 1.00 . A A . 8 THR HG22 1 1 2 434 1 1 8 THR HG23 H -7.037 -3.704 1.464 1.00 . A A . 8 THR HG23 1 1 2 435 1 1 8 THR N N -3.981 -3.655 -1.428 1.00 . A A . 8 THR N 1 1 2 436 1 1 8 THR O O -4.832 -3.009 2.029 1.00 . A A . 8 THR O 1 1 2 437 1 1 8 THR OG1 O -6.608 -4.289 -1.805 1.00 . A A . 8 THR OG1 1 1 2 438 1 1 9 ARG C C -1.082 -2.966 2.290 1.00 . A A . 9 ARG C 1 1 2 439 1 1 9 ARG CA C -2.257 -3.961 2.312 1.00 . A A . 9 ARG CA 1 1 2 440 1 1 9 ARG CB C -1.804 -5.405 2.550 1.00 . A A . 9 ARG CB 1 1 2 441 1 1 9 ARG CD C 0.072 -5.239 4.280 1.00 . A A . 9 ARG CD 1 1 2 442 1 1 9 ARG CG C -1.360 -5.688 3.990 1.00 . A A . 9 ARG CG 1 1 2 443 1 1 9 ARG CZ C 2.014 -6.656 4.992 1.00 . A A . 9 ARG CZ 1 1 2 444 1 1 9 ARG H H -2.689 -4.464 0.307 1.00 . A A . 9 ARG H 1 1 2 445 1 1 9 ARG HA H -2.917 -3.679 3.132 1.00 . A A . 9 ARG HA 1 1 2 446 1 1 9 ARG HB2 H -2.626 -6.075 2.299 1.00 . A A . 9 ARG HB2 1 1 2 447 1 1 9 ARG HB3 H -0.966 -5.616 1.884 1.00 . A A . 9 ARG HB3 1 1 2 448 1 1 9 ARG HD2 H 0.603 -5.056 3.347 1.00 . A A . 9 ARG HD2 1 1 2 449 1 1 9 ARG HD3 H 0.059 -4.330 4.883 1.00 . A A . 9 ARG HD3 1 1 2 450 1 1 9 ARG HE H 0.111 -6.877 5.587 1.00 . A A . 9 ARG HE 1 1 2 451 1 1 9 ARG HG2 H -2.032 -5.164 4.668 1.00 . A A . 9 ARG HG2 1 1 2 452 1 1 9 ARG HG3 H -1.437 -6.759 4.178 1.00 . A A . 9 ARG HG3 1 1 2 453 1 1 9 ARG HH11 H 2.602 -5.174 3.768 1.00 . A A . 9 ARG HH11 1 1 2 454 1 1 9 ARG HH12 H 3.865 -6.241 4.289 1.00 . A A . 9 ARG HH12 1 1 2 455 1 1 9 ARG HH21 H 1.792 -8.230 6.236 1.00 . A A . 9 ARG HH21 1 1 2 456 1 1 9 ARG HH22 H 3.403 -7.940 5.676 1.00 . A A . 9 ARG HH22 1 1 2 457 1 1 9 ARG N N -3.038 -3.912 1.064 1.00 . A A . 9 ARG N 1 1 2 458 1 1 9 ARG NE N 0.723 -6.326 5.027 1.00 . A A . 9 ARG NE 1 1 2 459 1 1 9 ARG NH1 N 2.905 -5.969 4.288 1.00 . A A . 9 ARG NH1 1 1 2 460 1 1 9 ARG NH2 N 2.436 -7.694 5.695 1.00 . A A . 9 ARG NH2 1 1 2 461 1 1 9 ARG O O -0.991 -2.107 3.164 1.00 . A A . 9 ARG O 1 1 2 462 1 1 10 TRP C C 0.269 -0.560 0.942 1.00 . A A . 10 TRP C 1 1 2 463 1 1 10 TRP CA C 0.806 -2.008 1.035 1.00 . A A . 10 TRP CA 1 1 2 464 1 1 10 TRP CB C 1.664 -2.454 -0.163 1.00 . A A . 10 TRP CB 1 1 2 465 1 1 10 TRP CD1 C 1.317 -1.080 -2.264 1.00 . A A . 10 TRP CD1 1 1 2 466 1 1 10 TRP CD2 C 3.015 -0.395 -1.037 1.00 . A A . 10 TRP CD2 1 1 2 467 1 1 10 TRP CE2 C 2.882 0.439 -2.137 1.00 . A A . 10 TRP CE2 1 1 2 468 1 1 10 TRP CE3 C 4.011 -0.170 -0.099 1.00 . A A . 10 TRP CE3 1 1 2 469 1 1 10 TRP CG C 2.012 -1.349 -1.149 1.00 . A A . 10 TRP CG 1 1 2 470 1 1 10 TRP CH2 C 4.753 1.739 -1.369 1.00 . A A . 10 TRP CH2 1 1 2 471 1 1 10 TRP CZ2 C 3.758 1.494 -2.314 1.00 . A A . 10 TRP CZ2 1 1 2 472 1 1 10 TRP CZ3 C 4.872 0.910 -0.254 1.00 . A A . 10 TRP CZ3 1 1 2 473 1 1 10 TRP H H -0.314 -3.725 0.540 1.00 . A A . 10 TRP H 1 1 2 474 1 1 10 TRP HA H 1.445 -2.053 1.917 1.00 . A A . 10 TRP HA 1 1 2 475 1 1 10 TRP HB2 H 2.595 -2.868 0.223 1.00 . A A . 10 TRP HB2 1 1 2 476 1 1 10 TRP HB3 H 1.131 -3.240 -0.698 1.00 . A A . 10 TRP HB3 1 1 2 477 1 1 10 TRP HD1 H 0.459 -1.633 -2.612 1.00 . A A . 10 TRP HD1 1 1 2 478 1 1 10 TRP HE1 H 1.533 0.380 -3.719 1.00 . A A . 10 TRP HE1 1 1 2 479 1 1 10 TRP HE3 H 4.202 -0.901 0.688 1.00 . A A . 10 TRP HE3 1 1 2 480 1 1 10 TRP HH2 H 5.430 2.579 -1.495 1.00 . A A . 10 TRP HH2 1 1 2 481 1 1 10 TRP HZ2 H 3.757 2.063 -3.245 1.00 . A A . 10 TRP HZ2 1 1 2 482 1 1 10 TRP HZ3 H 5.605 1.143 0.516 1.00 . A A . 10 TRP HZ3 1 1 2 483 1 1 10 TRP N N -0.272 -3.001 1.234 1.00 . A A . 10 TRP N 1 1 2 484 1 1 10 TRP NE1 N 1.847 0.000 -2.859 1.00 . A A . 10 TRP NE1 1 1 2 485 1 1 10 TRP O O 0.889 0.382 1.439 1.00 . A A . 10 TRP O 1 1 2 486 1 1 11 ALA C C -2.203 1.309 1.795 1.00 . A A . 11 ALA C 1 1 2 487 1 1 11 ALA CA C -1.717 0.827 0.413 1.00 . A A . 11 ALA CA 1 1 2 488 1 1 11 ALA CB C -2.919 0.706 -0.518 1.00 . A A . 11 ALA CB 1 1 2 489 1 1 11 ALA H H -1.482 -1.243 0.143 1.00 . A A . 11 ALA H 1 1 2 490 1 1 11 ALA HA H -1.055 1.592 0.007 1.00 . A A . 11 ALA HA 1 1 2 491 1 1 11 ALA HB1 H -3.520 1.613 -0.457 1.00 . A A . 11 ALA HB1 1 1 2 492 1 1 11 ALA HB2 H -3.524 -0.150 -0.221 1.00 . A A . 11 ALA HB2 1 1 2 493 1 1 11 ALA HB3 H -2.573 0.568 -1.543 1.00 . A A . 11 ALA HB3 1 1 2 494 1 1 11 ALA N N -0.967 -0.446 0.453 1.00 . A A . 11 ALA N 1 1 2 495 1 1 11 ALA O O -2.791 2.378 1.901 1.00 . A A . 11 ALA O 1 1 2 496 1 1 12 HIS C C -0.879 1.393 4.988 1.00 . A A . 12 HIS C 1 1 2 497 1 1 12 HIS CA C -2.157 0.954 4.240 1.00 . A A . 12 HIS CA 1 1 2 498 1 1 12 HIS CB C -2.820 -0.240 4.946 1.00 . A A . 12 HIS CB 1 1 2 499 1 1 12 HIS CD2 C -4.930 -0.088 3.460 1.00 . A A . 12 HIS CD2 1 1 2 500 1 1 12 HIS CE1 C -6.124 -1.630 4.346 1.00 . A A . 12 HIS CE1 1 1 2 501 1 1 12 HIS CG C -4.183 -0.684 4.390 1.00 . A A . 12 HIS CG 1 1 2 502 1 1 12 HIS H H -1.422 -0.328 2.751 1.00 . A A . 12 HIS H 1 1 2 503 1 1 12 HIS HA H -2.859 1.787 4.230 1.00 . A A . 12 HIS HA 1 1 2 504 1 1 12 HIS HB2 H -2.137 -1.089 4.898 1.00 . A A . 12 HIS HB2 1 1 2 505 1 1 12 HIS HB3 H -2.959 0.028 5.994 1.00 . A A . 12 HIS HB3 1 1 2 506 1 1 12 HIS HD1 H -4.639 -2.272 5.653 1.00 . A A . 12 HIS HD1 1 1 2 507 1 1 12 HIS HD2 H -4.612 0.727 2.826 1.00 . A A . 12 HIS HD2 1 1 2 508 1 1 12 HIS HE1 H -6.949 -2.290 4.573 1.00 . A A . 12 HIS HE1 1 1 2 509 1 1 12 HIS HE2 H -6.904 -0.401 2.844 1.00 . A A . 12 HIS HE2 1 1 2 510 1 1 12 HIS N N -1.860 0.569 2.843 1.00 . A A . 12 HIS N 1 1 2 511 1 1 12 HIS ND1 N -4.927 -1.650 4.927 1.00 . A A . 12 HIS ND1 1 1 2 512 1 1 12 HIS NE2 N -6.130 -0.658 3.440 1.00 . A A . 12 HIS NE2 1 1 2 513 1 1 12 HIS O O -0.877 1.586 6.199 1.00 . A A . 12 HIS O 1 1 2 514 1 1 13 TYR C C 1.965 3.253 4.058 1.00 . A A . 13 TYR C 1 1 2 515 1 1 13 TYR CA C 1.536 1.934 4.698 1.00 . A A . 13 TYR CA 1 1 2 516 1 1 13 TYR CB C 2.546 0.824 4.400 1.00 . A A . 13 TYR CB 1 1 2 517 1 1 13 TYR CD1 C 1.538 -0.823 6.062 1.00 . A A . 13 TYR CD1 1 1 2 518 1 1 13 TYR CD2 C 3.917 -0.412 6.068 1.00 . A A . 13 TYR CD2 1 1 2 519 1 1 13 TYR CE1 C 1.695 -1.735 7.092 1.00 . A A . 13 TYR CE1 1 1 2 520 1 1 13 TYR CE2 C 4.072 -1.331 7.089 1.00 . A A . 13 TYR CE2 1 1 2 521 1 1 13 TYR CG C 2.652 -0.161 5.547 1.00 . A A . 13 TYR CG 1 1 2 522 1 1 13 TYR CZ C 2.959 -1.978 7.601 1.00 . A A . 13 TYR CZ 1 1 2 523 1 1 13 TYR H H 0.168 1.260 3.257 1.00 . A A . 13 TYR H 1 1 2 524 1 1 13 TYR HA H 1.487 2.075 5.777 1.00 . A A . 13 TYR HA 1 1 2 525 1 1 13 TYR HB2 H 2.230 0.290 3.505 1.00 . A A . 13 TYR HB2 1 1 2 526 1 1 13 TYR HB3 H 3.524 1.270 4.222 1.00 . A A . 13 TYR HB3 1 1 2 527 1 1 13 TYR HD1 H 0.545 -0.626 5.670 1.00 . A A . 13 TYR HD1 1 1 2 528 1 1 13 TYR HD2 H 4.774 0.139 5.681 1.00 . A A . 13 TYR HD2 1 1 2 529 1 1 13 TYR HE1 H 0.825 -2.286 7.452 1.00 . A A . 13 TYR HE1 1 1 2 530 1 1 13 TYR HE2 H 5.083 -1.602 7.400 1.00 . A A . 13 TYR HE2 1 1 2 531 1 1 13 TYR HH H 4.065 -2.892 8.883 1.00 . A A . 13 TYR HH 1 1 2 532 1 1 13 TYR N N 0.200 1.528 4.219 1.00 . A A . 13 TYR N 1 1 2 533 1 1 13 TYR O O 1.695 4.307 4.628 1.00 . A A . 13 TYR O 1 1 2 534 1 1 13 TYR OH O 3.101 -2.850 8.638 1.00 . A A . 13 TYR OH 1 1 2 535 1 1 14 ASN C C 1.607 5.388 1.920 1.00 . A A . 14 ASN C 1 1 2 536 1 1 14 ASN CA C 2.730 4.341 1.967 1.00 . A A . 14 ASN CA 1 1 2 537 1 1 14 ASN CB C 3.083 3.886 0.549 1.00 . A A . 14 ASN CB 1 1 2 538 1 1 14 ASN CG C 3.429 5.054 -0.377 1.00 . A A . 14 ASN CG 1 1 2 539 1 1 14 ASN H H 2.461 2.290 2.326 1.00 . A A . 14 ASN H 1 1 2 540 1 1 14 ASN HA H 3.612 4.807 2.406 1.00 . A A . 14 ASN HA 1 1 2 541 1 1 14 ASN HB2 H 3.936 3.209 0.597 1.00 . A A . 14 ASN HB2 1 1 2 542 1 1 14 ASN HB3 H 2.230 3.352 0.132 1.00 . A A . 14 ASN HB3 1 1 2 543 1 1 14 ASN HD21 H 2.252 4.301 -1.830 1.00 . A A . 14 ASN HD21 1 1 2 544 1 1 14 ASN HD22 H 2.963 5.871 -2.110 1.00 . A A . 14 ASN HD22 1 1 2 545 1 1 14 ASN N N 2.367 3.172 2.789 1.00 . A A . 14 ASN N 1 1 2 546 1 1 14 ASN ND2 N 2.807 5.072 -1.537 1.00 . A A . 14 ASN ND2 1 1 2 547 1 1 14 ASN O O 1.885 6.564 1.775 1.00 . A A . 14 ASN O 1 1 2 548 1 1 14 ASN OD1 O 4.249 5.914 -0.093 1.00 . A A . 14 ASN OD1 1 1 2 549 1 1 15 ALA C C -0.483 7.076 3.283 1.00 . A A . 15 ALA C 1 1 2 550 1 1 15 ALA CA C -0.764 5.945 2.275 1.00 . A A . 15 ALA CA 1 1 2 551 1 1 15 ALA CB C -2.028 5.196 2.692 1.00 . A A . 15 ALA CB 1 1 2 552 1 1 15 ALA H H 0.151 4.047 2.402 1.00 . A A . 15 ALA H 1 1 2 553 1 1 15 ALA HA H -0.934 6.390 1.294 1.00 . A A . 15 ALA HA 1 1 2 554 1 1 15 ALA HB1 H -2.634 5.836 3.333 1.00 . A A . 15 ALA HB1 1 1 2 555 1 1 15 ALA HB2 H -2.599 4.925 1.805 1.00 . A A . 15 ALA HB2 1 1 2 556 1 1 15 ALA HB3 H -1.752 4.293 3.237 1.00 . A A . 15 ALA HB3 1 1 2 557 1 1 15 ALA N N 0.361 4.991 2.167 1.00 . A A . 15 ALA N 1 1 2 558 1 1 15 ALA O O -0.589 8.248 2.933 1.00 . A A . 15 ALA O 1 1 2 559 1 1 16 LEU C C 2.046 7.798 5.617 1.00 . A A . 16 LEU C 1 1 2 560 1 1 16 LEU CA C 0.519 7.639 5.481 1.00 . A A . 16 LEU CA 1 1 2 561 1 1 16 LEU CB C -0.117 7.201 6.810 1.00 . A A . 16 LEU CB 1 1 2 562 1 1 16 LEU CD1 C -0.139 9.479 7.967 1.00 . A A . 16 LEU CD1 1 1 2 563 1 1 16 LEU CD2 C -2.161 8.717 6.654 1.00 . A A . 16 LEU CD2 1 1 2 564 1 1 16 LEU CG C -0.972 8.274 7.514 1.00 . A A . 16 LEU CG 1 1 2 565 1 1 16 LEU H H 0.332 5.740 4.592 1.00 . A A . 16 LEU H 1 1 2 566 1 1 16 LEU HA H 0.110 8.617 5.229 1.00 . A A . 16 LEU HA 1 1 2 567 1 1 16 LEU HB2 H -0.744 6.330 6.623 1.00 . A A . 16 LEU HB2 1 1 2 568 1 1 16 LEU HB3 H 0.685 6.911 7.489 1.00 . A A . 16 LEU HB3 1 1 2 569 1 1 16 LEU HD11 H 0.697 9.135 8.576 1.00 . A A . 16 LEU HD11 1 1 2 570 1 1 16 LEU HD12 H -0.764 10.151 8.555 1.00 . A A . 16 LEU HD12 1 1 2 571 1 1 16 LEU HD13 H 0.240 10.007 7.093 1.00 . A A . 16 LEU HD13 1 1 2 572 1 1 16 LEU HD21 H -1.795 9.241 5.770 1.00 . A A . 16 LEU HD21 1 1 2 573 1 1 16 LEU HD22 H -2.733 7.842 6.346 1.00 . A A . 16 LEU HD22 1 1 2 574 1 1 16 LEU HD23 H -2.799 9.384 7.234 1.00 . A A . 16 LEU HD23 1 1 2 575 1 1 16 LEU HG H -1.383 7.815 8.413 1.00 . A A . 16 LEU HG 1 1 2 576 1 1 16 LEU N N 0.113 6.701 4.417 1.00 . A A . 16 LEU N 1 1 2 577 1 1 16 LEU O O 2.525 8.798 6.145 1.00 . A A . 16 LEU O 1 1 2 578 1 1 17 ILE C C 4.735 7.462 3.725 1.00 . A A . 17 ILE C 1 1 2 579 1 1 17 ILE CA C 4.271 6.817 5.064 1.00 . A A . 17 ILE CA 1 1 2 580 1 1 17 ILE CB C 4.797 5.369 5.275 1.00 . A A . 17 ILE CB 1 1 2 581 1 1 17 ILE CD1 C 4.466 5.317 7.889 1.00 . A A . 17 ILE CD1 1 1 2 582 1 1 17 ILE CG1 C 4.213 4.664 6.520 1.00 . A A . 17 ILE CG1 1 1 2 583 1 1 17 ILE CG2 C 6.331 5.257 5.303 1.00 . A A . 17 ILE CG2 1 1 2 584 1 1 17 ILE H H 2.375 5.934 4.856 1.00 . A A . 17 ILE H 1 1 2 585 1 1 17 ILE HA H 4.645 7.434 5.881 1.00 . A A . 17 ILE HA 1 1 2 586 1 1 17 ILE HB H 4.463 4.794 4.412 1.00 . A A . 17 ILE HB 1 1 2 587 1 1 17 ILE HD11 H 4.039 6.320 7.898 1.00 . A A . 17 ILE HD11 1 1 2 588 1 1 17 ILE HD12 H 4.001 4.716 8.670 1.00 . A A . 17 ILE HD12 1 1 2 589 1 1 17 ILE HD13 H 5.539 5.378 8.069 1.00 . A A . 17 ILE HD13 1 1 2 590 1 1 17 ILE HG12 H 3.134 4.601 6.383 1.00 . A A . 17 ILE HG12 1 1 2 591 1 1 17 ILE HG13 H 4.611 3.650 6.550 1.00 . A A . 17 ILE HG13 1 1 2 592 1 1 17 ILE HG21 H 6.749 5.752 4.426 1.00 . A A . 17 ILE HG21 1 1 2 593 1 1 17 ILE HG22 H 6.618 4.206 5.296 1.00 . A A . 17 ILE HG22 1 1 2 594 1 1 17 ILE HG23 H 6.714 5.732 6.205 1.00 . A A . 17 ILE HG23 1 1 2 595 1 1 17 ILE N N 2.791 6.799 5.143 1.00 . A A . 17 ILE N 1 1 2 596 1 1 17 ILE O O 5.909 7.426 3.356 1.00 . A A . 17 ILE O 1 1 2 597 1 1 18 ARG C C 4.940 10.068 2.075 1.00 . A A . 18 ARG C 1 1 2 598 1 1 18 ARG CA C 4.088 8.837 1.768 1.00 . A A . 18 ARG CA 1 1 2 599 1 1 18 ARG CB C 2.820 9.300 1.039 1.00 . A A . 18 ARG CB 1 1 2 600 1 1 18 ARG CD C 1.853 9.430 -1.308 1.00 . A A . 18 ARG CD 1 1 2 601 1 1 18 ARG CG C 2.771 8.669 -0.356 1.00 . A A . 18 ARG CG 1 1 2 602 1 1 18 ARG CZ C -0.073 8.844 -2.781 1.00 . A A . 18 ARG CZ 1 1 2 603 1 1 18 ARG H H 2.828 7.992 3.204 1.00 . A A . 18 ARG H 1 1 2 604 1 1 18 ARG HA H 4.652 8.188 1.097 1.00 . A A . 18 ARG HA 1 1 2 605 1 1 18 ARG HB2 H 1.941 8.993 1.607 1.00 . A A . 18 ARG HB2 1 1 2 606 1 1 18 ARG HB3 H 2.831 10.386 0.946 1.00 . A A . 18 ARG HB3 1 1 2 607 1 1 18 ARG HD2 H 1.550 10.365 -0.835 1.00 . A A . 18 ARG HD2 1 1 2 608 1 1 18 ARG HD3 H 2.406 9.657 -2.219 1.00 . A A . 18 ARG HD3 1 1 2 609 1 1 18 ARG HE H 0.334 7.999 -0.989 1.00 . A A . 18 ARG HE 1 1 2 610 1 1 18 ARG HG2 H 3.778 8.662 -0.771 1.00 . A A . 18 ARG HG2 1 1 2 611 1 1 18 ARG HG3 H 2.417 7.642 -0.267 1.00 . A A . 18 ARG HG3 1 1 2 612 1 1 18 ARG HH11 H 1.162 10.205 -3.582 1.00 . A A . 18 ARG HH11 1 1 2 613 1 1 18 ARG HH12 H -0.226 9.830 -4.550 1.00 . A A . 18 ARG HH12 1 1 2 614 1 1 18 ARG HH21 H -1.521 7.516 -2.304 1.00 . A A . 18 ARG HH21 1 1 2 615 1 1 18 ARG HH22 H -1.704 8.312 -3.829 1.00 . A A . 18 ARG HH22 1 1 2 616 1 1 18 ARG N N 3.801 8.088 3.006 1.00 . A A . 18 ARG N 1 1 2 617 1 1 18 ARG NE N 0.645 8.661 -1.666 1.00 . A A . 18 ARG NE 1 1 2 618 1 1 18 ARG NH1 N 0.318 9.692 -3.725 1.00 . A A . 18 ARG NH1 1 1 2 619 1 1 18 ARG NH2 N -1.183 8.153 -2.992 1.00 . A A . 18 ARG NH2 1 1 2 620 1 1 18 ARG O O 4.867 10.655 3.153 1.00 . A A . 18 ARG O 1 1 2 621 1 1 19 ALA C C 7.320 11.761 -0.267 1.00 . A A . 19 ALA C 1 1 2 622 1 1 19 ALA CA C 6.661 11.564 1.103 1.00 . A A . 19 ALA CA 1 1 2 623 1 1 19 ALA CB C 7.755 11.419 2.177 1.00 . A A . 19 ALA CB 1 1 2 624 1 1 19 ALA H H 5.727 9.873 0.234 1.00 . A A . 19 ALA H 1 1 2 625 1 1 19 ALA HA H 6.071 12.452 1.331 1.00 . A A . 19 ALA HA 1 1 2 626 1 1 19 ALA HB1 H 7.290 11.279 3.153 1.00 . A A . 19 ALA HB1 1 1 2 627 1 1 19 ALA HB2 H 8.379 10.556 1.945 1.00 . A A . 19 ALA HB2 1 1 2 628 1 1 19 ALA HB3 H 8.370 12.319 2.193 1.00 . A A . 19 ALA HB3 1 1 2 629 1 1 19 ALA N N 5.757 10.396 1.083 1.00 . A A . 19 ALA N 1 1 2 630 1 1 19 ALA O O 7.207 12.822 -0.875 1.00 . A A . 19 ALA O 1 1 2 631 1 1 20 PHE C C 8.468 9.448 -2.877 1.00 . A A . 20 PHE C 1 1 2 632 1 1 20 PHE CA C 8.705 10.705 -2.015 1.00 . A A . 20 PHE CA 1 1 2 633 1 1 20 PHE CB C 10.186 10.901 -1.671 1.00 . A A . 20 PHE CB 1 1 2 634 1 1 20 PHE CD1 C 10.317 13.297 -2.521 1.00 . A A . 20 PHE CD1 1 1 2 635 1 1 20 PHE CD2 C 11.998 11.711 -3.201 1.00 . A A . 20 PHE CD2 1 1 2 636 1 1 20 PHE CE1 C 10.970 14.294 -3.231 1.00 . A A . 20 PHE CE1 1 1 2 637 1 1 20 PHE CE2 C 12.651 12.711 -3.911 1.00 . A A . 20 PHE CE2 1 1 2 638 1 1 20 PHE CG C 10.830 12.003 -2.510 1.00 . A A . 20 PHE CG 1 1 2 639 1 1 20 PHE CZ C 12.135 14.001 -3.928 1.00 . A A . 20 PHE CZ 1 1 2 640 1 1 20 PHE H H 8.107 9.888 -0.163 1.00 . A A . 20 PHE H 1 1 2 641 1 1 20 PHE HA H 8.376 11.573 -2.586 1.00 . A A . 20 PHE HA 1 1 2 642 1 1 20 PHE HB2 H 10.270 11.167 -0.617 1.00 . A A . 20 PHE HB2 1 1 2 643 1 1 20 PHE HB3 H 10.717 9.966 -1.845 1.00 . A A . 20 PHE HB3 1 1 2 644 1 1 20 PHE HD1 H 9.410 13.535 -1.959 1.00 . A A . 20 PHE HD1 1 1 2 645 1 1 20 PHE HD2 H 12.415 10.705 -3.159 1.00 . A A . 20 PHE HD2 1 1 2 646 1 1 20 PHE HE1 H 10.571 15.310 -3.233 1.00 . A A . 20 PHE HE1 1 1 2 647 1 1 20 PHE HE2 H 13.570 12.480 -4.448 1.00 . A A . 20 PHE HE2 1 1 2 648 1 1 20 PHE HZ H 12.645 14.783 -4.492 1.00 . A A . 20 PHE HZ 1 1 2 649 1 1 20 PHE N N 7.970 10.696 -0.736 1.00 . A A . 20 PHE N 1 1 2 650 1 1 20 PHE O O 9.075 8.404 -2.558 1.00 . A A . 20 PHE O 1 1 3 651 1 1 1 HIS C C -5.608 -13.387 -5.176 1.00 . A A . 1 HIS C 1 1 3 652 1 1 1 HIS CA C -7.012 -13.081 -5.743 1.00 . A A . 1 HIS CA 1 1 3 653 1 1 1 HIS CB C -8.099 -13.621 -4.794 1.00 . A A . 1 HIS CB 1 1 3 654 1 1 1 HIS CD2 C -10.539 -12.899 -4.617 1.00 . A A . 1 HIS CD2 1 1 3 655 1 1 1 HIS CE1 C -10.331 -10.818 -4.095 1.00 . A A . 1 HIS CE1 1 1 3 656 1 1 1 HIS CG C -9.234 -12.621 -4.557 1.00 . A A . 1 HIS CG 1 1 3 657 1 1 1 HIS H1 H -6.452 -14.080 -7.543 1.00 . A A . 1 HIS H1 1 1 3 658 1 1 1 HIS HA H -7.119 -11.997 -5.771 1.00 . A A . 1 HIS HA 1 1 3 659 1 1 1 HIS HB2 H -8.516 -14.534 -5.217 1.00 . A A . 1 HIS HB2 1 1 3 660 1 1 1 HIS HB3 H -7.637 -13.856 -3.835 1.00 . A A . 1 HIS HB3 1 1 3 661 1 1 1 HIS HD1 H -8.256 -10.850 -4.068 1.00 . A A . 1 HIS HD1 1 1 3 662 1 1 1 HIS HD2 H -10.975 -13.858 -4.852 1.00 . A A . 1 HIS HD2 1 1 3 663 1 1 1 HIS HE1 H -10.566 -9.796 -3.836 1.00 . A A . 1 HIS HE1 1 1 3 664 1 1 1 HIS HE2 H -12.211 -11.692 -4.308 1.00 . A A . 1 HIS HE2 1 1 3 665 1 1 1 HIS N N -7.214 -13.574 -7.114 1.00 . A A . 1 HIS N 1 1 3 666 1 1 1 HIS ND1 N -9.109 -11.337 -4.232 1.00 . A A . 1 HIS ND1 1 1 3 667 1 1 1 HIS NE2 N -11.206 -11.786 -4.335 1.00 . A A . 1 HIS NE2 1 1 3 668 1 1 1 HIS O O -5.245 -14.541 -4.960 1.00 . A A . 1 HIS O 1 1 3 669 1 1 2 GLY C C -2.691 -11.046 -4.783 1.00 . A A . 2 GLY C 1 1 3 670 1 1 2 GLY CA C -3.380 -12.415 -4.723 1.00 . A A . 2 GLY CA 1 1 3 671 1 1 2 GLY H H -5.070 -11.420 -5.483 1.00 . A A . 2 GLY H 1 1 3 672 1 1 2 GLY HA2 H -3.358 -12.778 -3.696 1.00 . A A . 2 GLY HA2 1 1 3 673 1 1 2 GLY HA3 H -2.839 -13.116 -5.360 1.00 . A A . 2 GLY HA3 1 1 3 674 1 1 2 GLY N N -4.782 -12.333 -5.175 1.00 . A A . 2 GLY N 1 1 3 675 1 1 2 GLY O O -2.798 -10.248 -3.855 1.00 . A A . 2 GLY O 1 1 3 676 1 1 3 LEU C C -2.547 -8.199 -6.114 1.00 . A A . 3 LEU C 1 1 3 677 1 1 3 LEU CA C -1.590 -9.399 -6.253 1.00 . A A . 3 LEU CA 1 1 3 678 1 1 3 LEU CB C -0.893 -9.353 -7.621 1.00 . A A . 3 LEU CB 1 1 3 679 1 1 3 LEU CD1 C -1.199 -8.603 -9.982 1.00 . A A . 3 LEU CD1 1 1 3 680 1 1 3 LEU CD2 C -2.199 -10.781 -9.255 1.00 . A A . 3 LEU CD2 1 1 3 681 1 1 3 LEU CG C -1.848 -9.356 -8.822 1.00 . A A . 3 LEU CG 1 1 3 682 1 1 3 LEU H H -2.180 -11.369 -6.732 1.00 . A A . 3 LEU H 1 1 3 683 1 1 3 LEU HA H -0.811 -9.265 -5.502 1.00 . A A . 3 LEU HA 1 1 3 684 1 1 3 LEU HB2 H -0.278 -8.454 -7.668 1.00 . A A . 3 LEU HB2 1 1 3 685 1 1 3 LEU HB3 H -0.243 -10.224 -7.701 1.00 . A A . 3 LEU HB3 1 1 3 686 1 1 3 LEU HD11 H -1.874 -8.602 -10.838 1.00 . A A . 3 LEU HD11 1 1 3 687 1 1 3 LEU HD12 H -0.265 -9.093 -10.257 1.00 . A A . 3 LEU HD12 1 1 3 688 1 1 3 LEU HD13 H -0.995 -7.575 -9.680 1.00 . A A . 3 LEU HD13 1 1 3 689 1 1 3 LEU HD21 H -1.292 -11.303 -9.559 1.00 . A A . 3 LEU HD21 1 1 3 690 1 1 3 LEU HD22 H -2.661 -11.311 -8.422 1.00 . A A . 3 LEU HD22 1 1 3 691 1 1 3 LEU HD23 H -2.896 -10.745 -10.093 1.00 . A A . 3 LEU HD23 1 1 3 692 1 1 3 LEU HG H -2.765 -8.839 -8.540 1.00 . A A . 3 LEU HG 1 1 3 693 1 1 3 LEU N N -2.220 -10.709 -5.980 1.00 . A A . 3 LEU N 1 1 3 694 1 1 3 LEU O O -2.194 -7.186 -5.521 1.00 . A A . 3 LEU O 1 1 3 695 1 1 4 ALA C C -5.045 -6.981 -4.831 1.00 . A A . 4 ALA C 1 1 3 696 1 1 4 ALA CA C -4.880 -7.401 -6.306 1.00 . A A . 4 ALA CA 1 1 3 697 1 1 4 ALA CB C -6.195 -7.954 -6.861 1.00 . A A . 4 ALA CB 1 1 3 698 1 1 4 ALA H H -4.059 -9.183 -7.065 1.00 . A A . 4 ALA H 1 1 3 699 1 1 4 ALA HA H -4.620 -6.513 -6.882 1.00 . A A . 4 ALA HA 1 1 3 700 1 1 4 ALA HB1 H -6.057 -8.244 -7.902 1.00 . A A . 4 ALA HB1 1 1 3 701 1 1 4 ALA HB2 H -6.967 -7.187 -6.797 1.00 . A A . 4 ALA HB2 1 1 3 702 1 1 4 ALA HB3 H -6.498 -8.823 -6.278 1.00 . A A . 4 ALA HB3 1 1 3 703 1 1 4 ALA N N -3.807 -8.400 -6.501 1.00 . A A . 4 ALA N 1 1 3 704 1 1 4 ALA O O -5.345 -5.829 -4.543 1.00 . A A . 4 ALA O 1 1 3 705 1 1 5 SER C C -3.243 -7.249 -1.946 1.00 . A A . 5 SER C 1 1 3 706 1 1 5 SER CA C -4.623 -7.686 -2.478 1.00 . A A . 5 SER CA 1 1 3 707 1 1 5 SER CB C -5.062 -8.983 -1.794 1.00 . A A . 5 SER CB 1 1 3 708 1 1 5 SER H H -4.179 -8.722 -4.238 1.00 . A A . 5 SER H 1 1 3 709 1 1 5 SER HA H -5.347 -6.908 -2.235 1.00 . A A . 5 SER HA 1 1 3 710 1 1 5 SER HB2 H -5.788 -9.499 -2.423 1.00 . A A . 5 SER HB2 1 1 3 711 1 1 5 SER HB3 H -4.196 -9.625 -1.636 1.00 . A A . 5 SER HB3 1 1 3 712 1 1 5 SER HG H -5.873 -9.502 -0.031 1.00 . A A . 5 SER HG 1 1 3 713 1 1 5 SER N N -4.627 -7.883 -3.940 1.00 . A A . 5 SER N 1 1 3 714 1 1 5 SER O O -3.160 -6.515 -0.962 1.00 . A A . 5 SER O 1 1 3 715 1 1 5 SER OG O -5.658 -8.666 -0.539 1.00 . A A . 5 SER OG 1 1 3 716 1 1 6 THR C C -0.676 -5.574 -2.383 1.00 . A A . 6 THR C 1 1 3 717 1 1 6 THR CA C -0.785 -7.113 -2.367 1.00 . A A . 6 THR CA 1 1 3 718 1 1 6 THR CB C 0.271 -7.801 -3.269 1.00 . A A . 6 THR CB 1 1 3 719 1 1 6 THR CG2 C 0.649 -7.098 -4.582 1.00 . A A . 6 THR CG2 1 1 3 720 1 1 6 THR H H -2.243 -8.138 -3.493 1.00 . A A . 6 THR H 1 1 3 721 1 1 6 THR HA H -0.574 -7.427 -1.345 1.00 . A A . 6 THR HA 1 1 3 722 1 1 6 THR HB H -0.093 -8.799 -3.514 1.00 . A A . 6 THR HB 1 1 3 723 1 1 6 THR HG1 H 2.211 -8.237 -3.105 1.00 . A A . 6 THR HG1 1 1 3 724 1 1 6 THR HG21 H 0.398 -7.741 -5.425 1.00 . A A . 6 THR HG21 1 1 3 725 1 1 6 THR HG22 H 1.720 -6.891 -4.588 1.00 . A A . 6 THR HG22 1 1 3 726 1 1 6 THR HG23 H 0.099 -6.160 -4.664 1.00 . A A . 6 THR HG23 1 1 3 727 1 1 6 THR N N -2.166 -7.573 -2.675 1.00 . A A . 6 THR N 1 1 3 728 1 1 6 THR O O 0.035 -4.965 -1.583 1.00 . A A . 6 THR O 1 1 3 729 1 1 6 THR OG1 O 1.465 -7.941 -2.505 1.00 . A A . 6 THR OG1 1 1 3 730 1 1 7 LEU C C -2.748 -2.925 -2.379 1.00 . A A . 7 LEU C 1 1 3 731 1 1 7 LEU CA C -1.689 -3.509 -3.330 1.00 . A A . 7 LEU CA 1 1 3 732 1 1 7 LEU CB C -2.063 -3.200 -4.782 1.00 . A A . 7 LEU CB 1 1 3 733 1 1 7 LEU CD1 C -1.545 -4.053 -7.074 1.00 . A A . 7 LEU CD1 1 1 3 734 1 1 7 LEU CD2 C -0.028 -2.366 -6.006 1.00 . A A . 7 LEU CD2 1 1 3 735 1 1 7 LEU CG C -0.941 -3.570 -5.756 1.00 . A A . 7 LEU CG 1 1 3 736 1 1 7 LEU H H -2.148 -5.499 -3.794 1.00 . A A . 7 LEU H 1 1 3 737 1 1 7 LEU HA H -0.729 -3.041 -3.111 1.00 . A A . 7 LEU HA 1 1 3 738 1 1 7 LEU HB2 H -2.960 -3.760 -5.046 1.00 . A A . 7 LEU HB2 1 1 3 739 1 1 7 LEU HB3 H -2.270 -2.135 -4.873 1.00 . A A . 7 LEU HB3 1 1 3 740 1 1 7 LEU HD11 H -0.745 -4.317 -7.766 1.00 . A A . 7 LEU HD11 1 1 3 741 1 1 7 LEU HD12 H -2.167 -4.929 -6.889 1.00 . A A . 7 LEU HD12 1 1 3 742 1 1 7 LEU HD13 H -2.154 -3.260 -7.507 1.00 . A A . 7 LEU HD13 1 1 3 743 1 1 7 LEU HD21 H -0.608 -1.557 -6.453 1.00 . A A . 7 LEU HD21 1 1 3 744 1 1 7 LEU HD22 H 0.397 -2.029 -5.061 1.00 . A A . 7 LEU HD22 1 1 3 745 1 1 7 LEU HD23 H 0.775 -2.654 -6.685 1.00 . A A . 7 LEU HD23 1 1 3 746 1 1 7 LEU HG H -0.349 -4.377 -5.323 1.00 . A A . 7 LEU HG 1 1 3 747 1 1 7 LEU N N -1.539 -4.972 -3.202 1.00 . A A . 7 LEU N 1 1 3 748 1 1 7 LEU O O -2.971 -1.720 -2.384 1.00 . A A . 7 LEU O 1 1 3 749 1 1 8 THR C C -3.575 -3.338 0.951 1.00 . A A . 8 THR C 1 1 3 750 1 1 8 THR CA C -4.252 -3.378 -0.438 1.00 . A A . 8 THR CA 1 1 3 751 1 1 8 THR CB C -5.431 -4.370 -0.488 1.00 . A A . 8 THR CB 1 1 3 752 1 1 8 THR CG2 C -6.608 -3.983 0.416 1.00 . A A . 8 THR CG2 1 1 3 753 1 1 8 THR H H -3.143 -4.748 -1.555 1.00 . A A . 8 THR H 1 1 3 754 1 1 8 THR HA H -4.629 -2.381 -0.667 1.00 . A A . 8 THR HA 1 1 3 755 1 1 8 THR HB H -5.070 -5.353 -0.184 1.00 . A A . 8 THR HB 1 1 3 756 1 1 8 THR HG1 H -6.749 -4.979 -1.880 1.00 . A A . 8 THR HG1 1 1 3 757 1 1 8 THR HG21 H -6.270 -3.934 1.451 1.00 . A A . 8 THR HG21 1 1 3 758 1 1 8 THR HG22 H -7.397 -4.729 0.326 1.00 . A A . 8 THR HG22 1 1 3 759 1 1 8 THR HG23 H -6.993 -3.009 0.113 1.00 . A A . 8 THR HG23 1 1 3 760 1 1 8 THR N N -3.268 -3.758 -1.482 1.00 . A A . 8 THR N 1 1 3 761 1 1 8 THR O O -4.111 -2.778 1.903 1.00 . A A . 8 THR O 1 1 3 762 1 1 8 THR OG1 O -5.898 -4.456 -1.840 1.00 . A A . 8 THR OG1 1 1 3 763 1 1 9 ARG C C -0.383 -2.876 2.180 1.00 . A A . 9 ARG C 1 1 3 764 1 1 9 ARG CA C -1.532 -3.894 2.249 1.00 . A A . 9 ARG CA 1 1 3 765 1 1 9 ARG CB C -0.950 -5.281 2.518 1.00 . A A . 9 ARG CB 1 1 3 766 1 1 9 ARG CD C -1.403 -7.608 3.312 1.00 . A A . 9 ARG CD 1 1 3 767 1 1 9 ARG CG C -2.038 -6.314 2.805 1.00 . A A . 9 ARG CG 1 1 3 768 1 1 9 ARG CZ C -1.354 -7.308 5.821 1.00 . A A . 9 ARG CZ 1 1 3 769 1 1 9 ARG H H -2.010 -4.438 0.271 1.00 . A A . 9 ARG H 1 1 3 770 1 1 9 ARG HA H -2.169 -3.627 3.092 1.00 . A A . 9 ARG HA 1 1 3 771 1 1 9 ARG HB2 H -0.376 -5.601 1.648 1.00 . A A . 9 ARG HB2 1 1 3 772 1 1 9 ARG HB3 H -0.285 -5.222 3.381 1.00 . A A . 9 ARG HB3 1 1 3 773 1 1 9 ARG HD2 H -1.717 -8.439 2.679 1.00 . A A . 9 ARG HD2 1 1 3 774 1 1 9 ARG HD3 H -0.317 -7.516 3.279 1.00 . A A . 9 ARG HD3 1 1 3 775 1 1 9 ARG HE H -2.596 -8.492 4.790 1.00 . A A . 9 ARG HE 1 1 3 776 1 1 9 ARG HG2 H -2.717 -5.923 3.564 1.00 . A A . 9 ARG HG2 1 1 3 777 1 1 9 ARG HG3 H -2.596 -6.517 1.890 1.00 . A A . 9 ARG HG3 1 1 3 778 1 1 9 ARG HH11 H 0.043 -6.140 4.961 1.00 . A A . 9 ARG HH11 1 1 3 779 1 1 9 ARG HH12 H -0.035 -6.042 6.689 1.00 . A A . 9 ARG HH12 1 1 3 780 1 1 9 ARG HH21 H -2.633 -8.303 7.026 1.00 . A A . 9 ARG HH21 1 1 3 781 1 1 9 ARG HH22 H -1.523 -7.245 7.824 1.00 . A A . 9 ARG HH22 1 1 3 782 1 1 9 ARG N N -2.364 -3.893 1.027 1.00 . A A . 9 ARG N 1 1 3 783 1 1 9 ARG NE N -1.835 -7.856 4.700 1.00 . A A . 9 ARG NE 1 1 3 784 1 1 9 ARG NH1 N -0.363 -6.424 5.826 1.00 . A A . 9 ARG NH1 1 1 3 785 1 1 9 ARG NH2 N -1.882 -7.650 6.985 1.00 . A A . 9 ARG NH2 1 1 3 786 1 1 9 ARG O O -0.301 -1.984 3.020 1.00 . A A . 9 ARG O 1 1 3 787 1 1 10 TRP C C 0.930 -0.506 0.737 1.00 . A A . 10 TRP C 1 1 3 788 1 1 10 TRP CA C 1.482 -1.943 0.874 1.00 . A A . 10 TRP CA 1 1 3 789 1 1 10 TRP CB C 2.355 -2.420 -0.301 1.00 . A A . 10 TRP CB 1 1 3 790 1 1 10 TRP CD1 C 2.033 -1.214 -2.506 1.00 . A A . 10 TRP CD1 1 1 3 791 1 1 10 TRP CD2 C 3.592 -0.315 -1.236 1.00 . A A . 10 TRP CD2 1 1 3 792 1 1 10 TRP CE2 C 3.459 0.438 -2.391 1.00 . A A . 10 TRP CE2 1 1 3 793 1 1 10 TRP CE3 C 4.506 0.056 -0.258 1.00 . A A . 10 TRP CE3 1 1 3 794 1 1 10 TRP CG C 2.678 -1.353 -1.339 1.00 . A A . 10 TRP CG 1 1 3 795 1 1 10 TRP CH2 C 5.156 1.946 -1.605 1.00 . A A . 10 TRP CH2 1 1 3 796 1 1 10 TRP CZ2 C 4.249 1.556 -2.585 1.00 . A A . 10 TRP CZ2 1 1 3 797 1 1 10 TRP CZ3 C 5.277 1.200 -0.433 1.00 . A A . 10 TRP CZ3 1 1 3 798 1 1 10 TRP H H 0.388 -3.693 0.456 1.00 . A A . 10 TRP H 1 1 3 799 1 1 10 TRP HA H 2.121 -1.947 1.757 1.00 . A A . 10 TRP HA 1 1 3 800 1 1 10 TRP HB2 H 3.295 -2.792 0.105 1.00 . A A . 10 TRP HB2 1 1 3 801 1 1 10 TRP HB3 H 1.844 -3.244 -0.799 1.00 . A A . 10 TRP HB3 1 1 3 802 1 1 10 TRP HD1 H 1.248 -1.859 -2.865 1.00 . A A . 10 TRP HD1 1 1 3 803 1 1 10 TRP HE1 H 2.214 0.175 -4.035 1.00 . A A . 10 TRP HE1 1 1 3 804 1 1 10 TRP HE3 H 4.699 -0.599 0.593 1.00 . A A . 10 TRP HE3 1 1 3 805 1 1 10 TRP HH2 H 5.764 2.837 -1.744 1.00 . A A . 10 TRP HH2 1 1 3 806 1 1 10 TRP HZ2 H 4.245 2.074 -3.545 1.00 . A A . 10 TRP HZ2 1 1 3 807 1 1 10 TRP HZ3 H 5.931 1.548 0.365 1.00 . A A . 10 TRP HZ3 1 1 3 808 1 1 10 TRP N N 0.420 -2.941 1.118 1.00 . A A . 10 TRP N 1 1 3 809 1 1 10 TRP NE1 N 2.510 -0.131 -3.138 1.00 . A A . 10 TRP NE1 1 1 3 810 1 1 10 TRP O O 1.515 0.428 1.285 1.00 . A A . 10 TRP O 1 1 3 811 1 1 11 ALA C C -1.547 1.406 1.511 1.00 . A A . 11 ALA C 1 1 3 812 1 1 11 ALA CA C -1.076 0.846 0.153 1.00 . A A . 11 ALA CA 1 1 3 813 1 1 11 ALA CB C -2.284 0.665 -0.764 1.00 . A A . 11 ALA CB 1 1 3 814 1 1 11 ALA H H -0.806 -1.228 -0.057 1.00 . A A . 11 ALA H 1 1 3 815 1 1 11 ALA HA H -0.428 1.594 -0.303 1.00 . A A . 11 ALA HA 1 1 3 816 1 1 11 ALA HB1 H -2.893 1.570 -0.747 1.00 . A A . 11 ALA HB1 1 1 3 817 1 1 11 ALA HB2 H -1.943 0.476 -1.782 1.00 . A A . 11 ALA HB2 1 1 3 818 1 1 11 ALA HB3 H -2.879 -0.179 -0.419 1.00 . A A . 11 ALA HB3 1 1 3 819 1 1 11 ALA N N -0.307 -0.417 0.241 1.00 . A A . 11 ALA N 1 1 3 820 1 1 11 ALA O O -2.103 2.499 1.585 1.00 . A A . 11 ALA O 1 1 3 821 1 1 12 HIS C C -0.185 1.385 4.731 1.00 . A A . 12 HIS C 1 1 3 822 1 1 12 HIS CA C -1.494 1.084 3.974 1.00 . A A . 12 HIS CA 1 1 3 823 1 1 12 HIS CB C -2.280 -0.024 4.685 1.00 . A A . 12 HIS CB 1 1 3 824 1 1 12 HIS CD2 C -4.554 0.852 3.802 1.00 . A A . 12 HIS CD2 1 1 3 825 1 1 12 HIS CE1 C -5.861 0.000 5.280 1.00 . A A . 12 HIS CE1 1 1 3 826 1 1 12 HIS CG C -3.806 0.115 4.634 1.00 . A A . 12 HIS CG 1 1 3 827 1 1 12 HIS H H -0.806 -0.227 2.493 1.00 . A A . 12 HIS H 1 1 3 828 1 1 12 HIS HA H -2.103 1.988 3.964 1.00 . A A . 12 HIS HA 1 1 3 829 1 1 12 HIS HB2 H -2.006 -0.981 4.241 1.00 . A A . 12 HIS HB2 1 1 3 830 1 1 12 HIS HB3 H -1.978 -0.030 5.732 1.00 . A A . 12 HIS HB3 1 1 3 831 1 1 12 HIS HD1 H -4.347 -1.019 6.283 1.00 . A A . 12 HIS HD1 1 1 3 832 1 1 12 HIS HD2 H -4.192 1.405 2.949 1.00 . A A . 12 HIS HD2 1 1 3 833 1 1 12 HIS HE1 H -6.747 -0.258 5.842 1.00 . A A . 12 HIS HE1 1 1 3 834 1 1 12 HIS HE2 H -6.604 1.246 3.779 1.00 . A A . 12 HIS HE2 1 1 3 835 1 1 12 HIS N N -1.252 0.667 2.577 1.00 . A A . 12 HIS N 1 1 3 836 1 1 12 HIS ND1 N -4.620 -0.412 5.539 1.00 . A A . 12 HIS ND1 1 1 3 837 1 1 12 HIS NE2 N -5.817 0.783 4.209 1.00 . A A . 12 HIS NE2 1 1 3 838 1 1 12 HIS O O -0.191 1.646 5.932 1.00 . A A . 12 HIS O 1 1 3 839 1 1 13 TYR C C 2.746 3.140 3.920 1.00 . A A . 13 TYR C 1 1 3 840 1 1 13 TYR CA C 2.245 1.809 4.470 1.00 . A A . 13 TYR CA 1 1 3 841 1 1 13 TYR CB C 3.245 0.700 4.144 1.00 . A A . 13 TYR CB 1 1 3 842 1 1 13 TYR CD1 C 3.580 0.227 6.611 1.00 . A A . 13 TYR CD1 1 1 3 843 1 1 13 TYR CD2 C 3.557 -1.610 5.048 1.00 . A A . 13 TYR CD2 1 1 3 844 1 1 13 TYR CE1 C 3.898 -0.641 7.640 1.00 . A A . 13 TYR CE1 1 1 3 845 1 1 13 TYR CE2 C 3.875 -2.479 6.079 1.00 . A A . 13 TYR CE2 1 1 3 846 1 1 13 TYR CG C 3.410 -0.255 5.314 1.00 . A A . 13 TYR CG 1 1 3 847 1 1 13 TYR CZ C 4.030 -1.995 7.369 1.00 . A A . 13 TYR CZ 1 1 3 848 1 1 13 TYR H H 0.866 1.219 2.998 1.00 . A A . 13 TYR H 1 1 3 849 1 1 13 TYR HA H 2.184 1.897 5.555 1.00 . A A . 13 TYR HA 1 1 3 850 1 1 13 TYR HB2 H 2.893 0.144 3.275 1.00 . A A . 13 TYR HB2 1 1 3 851 1 1 13 TYR HB3 H 4.212 1.150 3.914 1.00 . A A . 13 TYR HB3 1 1 3 852 1 1 13 TYR HD1 H 3.473 1.291 6.820 1.00 . A A . 13 TYR HD1 1 1 3 853 1 1 13 TYR HD2 H 3.438 -1.977 4.030 1.00 . A A . 13 TYR HD2 1 1 3 854 1 1 13 TYR HE1 H 4.115 -0.230 8.626 1.00 . A A . 13 TYR HE1 1 1 3 855 1 1 13 TYR HE2 H 4.079 -3.526 5.849 1.00 . A A . 13 TYR HE2 1 1 3 856 1 1 13 TYR HH H 4.299 -2.342 9.241 1.00 . A A . 13 TYR HH 1 1 3 857 1 1 13 TYR N N 0.901 1.470 3.968 1.00 . A A . 13 TYR N 1 1 3 858 1 1 13 TYR O O 2.751 4.141 4.637 1.00 . A A . 13 TYR O 1 1 3 859 1 1 13 TYR OH O 4.246 -2.863 8.392 1.00 . A A . 13 TYR OH 1 1 3 860 1 1 14 ASN C C 2.270 5.483 2.076 1.00 . A A . 14 ASN C 1 1 3 861 1 1 14 ASN CA C 3.317 4.377 1.864 1.00 . A A . 14 ASN CA 1 1 3 862 1 1 14 ASN CB C 3.473 4.083 0.366 1.00 . A A . 14 ASN CB 1 1 3 863 1 1 14 ASN CG C 2.132 3.854 -0.331 1.00 . A A . 14 ASN CG 1 1 3 864 1 1 14 ASN H H 2.903 2.323 2.046 1.00 . A A . 14 ASN H 1 1 3 865 1 1 14 ASN HA H 4.274 4.738 2.240 1.00 . A A . 14 ASN HA 1 1 3 866 1 1 14 ASN HB2 H 3.980 4.923 -0.109 1.00 . A A . 14 ASN HB2 1 1 3 867 1 1 14 ASN HB3 H 4.084 3.188 0.248 1.00 . A A . 14 ASN HB3 1 1 3 868 1 1 14 ASN HD21 H 2.141 5.753 -1.034 1.00 . A A . 14 ASN HD21 1 1 3 869 1 1 14 ASN HD22 H 0.765 4.771 -1.428 1.00 . A A . 14 ASN HD22 1 1 3 870 1 1 14 ASN N N 2.963 3.154 2.606 1.00 . A A . 14 ASN N 1 1 3 871 1 1 14 ASN ND2 N 1.656 4.882 -1.003 1.00 . A A . 14 ASN ND2 1 1 3 872 1 1 14 ASN O O 2.590 6.643 1.912 1.00 . A A . 14 ASN O 1 1 3 873 1 1 14 ASN OD1 O 1.418 2.896 -0.079 1.00 . A A . 14 ASN OD1 1 1 3 874 1 1 15 ALA C C 0.506 7.223 3.800 1.00 . A A . 15 ALA C 1 1 3 875 1 1 15 ALA CA C 0.010 6.150 2.806 1.00 . A A . 15 ALA CA 1 1 3 876 1 1 15 ALA CB C -1.222 5.428 3.355 1.00 . A A . 15 ALA CB 1 1 3 877 1 1 15 ALA H H 0.789 4.196 2.637 1.00 . A A . 15 ALA H 1 1 3 878 1 1 15 ALA HA H -0.274 6.650 1.880 1.00 . A A . 15 ALA HA 1 1 3 879 1 1 15 ALA HB1 H -1.996 6.157 3.592 1.00 . A A . 15 ALA HB1 1 1 3 880 1 1 15 ALA HB2 H -1.596 4.731 2.606 1.00 . A A . 15 ALA HB2 1 1 3 881 1 1 15 ALA HB3 H -0.950 4.880 4.257 1.00 . A A . 15 ALA HB3 1 1 3 882 1 1 15 ALA N N 1.050 5.147 2.490 1.00 . A A . 15 ALA N 1 1 3 883 1 1 15 ALA O O 0.427 8.413 3.504 1.00 . A A . 15 ALA O 1 1 3 884 1 1 16 LEU C C 3.440 7.705 5.621 1.00 . A A . 16 LEU C 1 1 3 885 1 1 16 LEU CA C 1.909 7.643 5.802 1.00 . A A . 16 LEU CA 1 1 3 886 1 1 16 LEU CB C 1.552 7.174 7.220 1.00 . A A . 16 LEU CB 1 1 3 887 1 1 16 LEU CD1 C 0.602 7.715 9.469 1.00 . A A . 16 LEU CD1 1 1 3 888 1 1 16 LEU CD2 C 2.297 9.262 8.510 1.00 . A A . 16 LEU CD2 1 1 3 889 1 1 16 LEU CG C 1.143 8.312 8.170 1.00 . A A . 16 LEU CG 1 1 3 890 1 1 16 LEU H H 1.450 5.791 4.901 1.00 . A A . 16 LEU H 1 1 3 891 1 1 16 LEU HA H 1.513 8.651 5.673 1.00 . A A . 16 LEU HA 1 1 3 892 1 1 16 LEU HB2 H 0.731 6.460 7.155 1.00 . A A . 16 LEU HB2 1 1 3 893 1 1 16 LEU HB3 H 2.421 6.670 7.642 1.00 . A A . 16 LEU HB3 1 1 3 894 1 1 16 LEU HD11 H -0.220 7.035 9.243 1.00 . A A . 16 LEU HD11 1 1 3 895 1 1 16 LEU HD12 H 1.396 7.167 9.975 1.00 . A A . 16 LEU HD12 1 1 3 896 1 1 16 LEU HD13 H 0.244 8.516 10.115 1.00 . A A . 16 LEU HD13 1 1 3 897 1 1 16 LEU HD21 H 3.085 8.709 9.021 1.00 . A A . 16 LEU HD21 1 1 3 898 1 1 16 LEU HD22 H 2.694 9.696 7.592 1.00 . A A . 16 LEU HD22 1 1 3 899 1 1 16 LEU HD23 H 1.932 10.058 9.160 1.00 . A A . 16 LEU HD23 1 1 3 900 1 1 16 LEU HG H 0.349 8.888 7.697 1.00 . A A . 16 LEU HG 1 1 3 901 1 1 16 LEU N N 1.265 6.769 4.801 1.00 . A A . 16 LEU N 1 1 3 902 1 1 16 LEU O O 4.059 8.717 5.935 1.00 . A A . 16 LEU O 1 1 3 903 1 1 17 ILE C C 5.750 7.240 3.348 1.00 . A A . 17 ILE C 1 1 3 904 1 1 17 ILE CA C 5.472 6.588 4.732 1.00 . A A . 17 ILE CA 1 1 3 905 1 1 17 ILE CB C 5.986 5.127 4.855 1.00 . A A . 17 ILE CB 1 1 3 906 1 1 17 ILE CD1 C 5.803 2.999 6.335 1.00 . A A . 17 ILE CD1 1 1 3 907 1 1 17 ILE CG1 C 5.591 4.515 6.214 1.00 . A A . 17 ILE CG1 1 1 3 908 1 1 17 ILE CG2 C 7.518 5.054 4.721 1.00 . A A . 17 ILE CG2 1 1 3 909 1 1 17 ILE H H 3.529 5.789 4.896 1.00 . A A . 17 ILE H 1 1 3 910 1 1 17 ILE HA H 6.001 7.179 5.479 1.00 . A A . 17 ILE HA 1 1 3 911 1 1 17 ILE HB H 5.537 4.530 4.060 1.00 . A A . 17 ILE HB 1 1 3 912 1 1 17 ILE HD11 H 5.206 2.487 5.580 1.00 . A A . 17 ILE HD11 1 1 3 913 1 1 17 ILE HD12 H 5.495 2.667 7.327 1.00 . A A . 17 ILE HD12 1 1 3 914 1 1 17 ILE HD13 H 6.856 2.767 6.185 1.00 . A A . 17 ILE HD13 1 1 3 915 1 1 17 ILE HG12 H 6.186 5.002 6.988 1.00 . A A . 17 ILE HG12 1 1 3 916 1 1 17 ILE HG13 H 4.539 4.733 6.399 1.00 . A A . 17 ILE HG13 1 1 3 917 1 1 17 ILE HG21 H 7.821 5.481 3.766 1.00 . A A . 17 ILE HG21 1 1 3 918 1 1 17 ILE HG22 H 7.980 5.615 5.533 1.00 . A A . 17 ILE HG22 1 1 3 919 1 1 17 ILE HG23 H 7.838 4.012 4.772 1.00 . A A . 17 ILE HG23 1 1 3 920 1 1 17 ILE N N 4.029 6.642 5.069 1.00 . A A . 17 ILE N 1 1 3 921 1 1 17 ILE O O 6.813 7.082 2.748 1.00 . A A . 17 ILE O 1 1 3 922 1 1 18 ARG C C 5.859 9.949 1.764 1.00 . A A . 18 ARG C 1 1 3 923 1 1 18 ARG CA C 4.930 8.744 1.569 1.00 . A A . 18 ARG CA 1 1 3 924 1 1 18 ARG CB C 3.590 9.228 0.996 1.00 . A A . 18 ARG CB 1 1 3 925 1 1 18 ARG CD C 2.554 9.459 -1.283 1.00 . A A . 18 ARG CD 1 1 3 926 1 1 18 ARG CG C 3.306 8.527 -0.336 1.00 . A A . 18 ARG CG 1 1 3 927 1 1 18 ARG CZ C 0.536 8.298 -2.176 1.00 . A A . 18 ARG CZ 1 1 3 928 1 1 18 ARG H H 3.845 7.964 3.190 1.00 . A A . 18 ARG H 1 1 3 929 1 1 18 ARG HA H 5.389 8.085 0.832 1.00 . A A . 18 ARG HA 1 1 3 930 1 1 18 ARG HB2 H 2.791 9.000 1.701 1.00 . A A . 18 ARG HB2 1 1 3 931 1 1 18 ARG HB3 H 3.633 10.305 0.834 1.00 . A A . 18 ARG HB3 1 1 3 932 1 1 18 ARG HD2 H 1.852 10.065 -0.709 1.00 . A A . 18 ARG HD2 1 1 3 933 1 1 18 ARG HD3 H 3.266 10.113 -1.787 1.00 . A A . 18 ARG HD3 1 1 3 934 1 1 18 ARG HE H 2.300 8.471 -3.134 1.00 . A A . 18 ARG HE 1 1 3 935 1 1 18 ARG HG2 H 4.251 8.235 -0.796 1.00 . A A . 18 ARG HG2 1 1 3 936 1 1 18 ARG HG3 H 2.705 7.637 -0.154 1.00 . A A . 18 ARG HG3 1 1 3 937 1 1 18 ARG HH11 H 0.262 9.038 -0.326 1.00 . A A . 18 ARG HH11 1 1 3 938 1 1 18 ARG HH12 H -1.128 8.271 -1.013 1.00 . A A . 18 ARG HH12 1 1 3 939 1 1 18 ARG HH21 H 0.432 7.432 -4.003 1.00 . A A . 18 ARG HH21 1 1 3 940 1 1 18 ARG HH22 H -1.010 7.360 -3.049 1.00 . A A . 18 ARG HH22 1 1 3 941 1 1 18 ARG N N 4.774 7.981 2.821 1.00 . A A . 18 ARG N 1 1 3 942 1 1 18 ARG NE N 1.812 8.677 -2.290 1.00 . A A . 18 ARG NE 1 1 3 943 1 1 18 ARG NH1 N -0.174 8.553 -1.082 1.00 . A A . 18 ARG NH1 1 1 3 944 1 1 18 ARG NH2 N -0.053 7.628 -3.153 1.00 . A A . 18 ARG NH2 1 1 3 945 1 1 18 ARG O O 6.439 10.168 2.825 1.00 . A A . 18 ARG O 1 1 3 946 1 1 19 ALA C C 6.110 12.988 -0.292 1.00 . A A . 19 ALA C 1 1 3 947 1 1 19 ALA CA C 6.769 11.952 0.644 1.00 . A A . 19 ALA CA 1 1 3 948 1 1 19 ALA CB C 8.211 11.608 0.253 1.00 . A A . 19 ALA CB 1 1 3 949 1 1 19 ALA H H 5.532 10.447 -0.170 1.00 . A A . 19 ALA H 1 1 3 950 1 1 19 ALA HA H 6.783 12.369 1.651 1.00 . A A . 19 ALA HA 1 1 3 951 1 1 19 ALA HB1 H 8.806 12.521 0.220 1.00 . A A . 19 ALA HB1 1 1 3 952 1 1 19 ALA HB2 H 8.635 10.925 0.989 1.00 . A A . 19 ALA HB2 1 1 3 953 1 1 19 ALA HB3 H 8.219 11.134 -0.729 1.00 . A A . 19 ALA HB3 1 1 3 954 1 1 19 ALA N N 5.990 10.703 0.680 1.00 . A A . 19 ALA N 1 1 3 955 1 1 19 ALA O O 6.757 13.651 -1.099 1.00 . A A . 19 ALA O 1 1 3 956 1 1 20 PHE C C 3.743 15.332 -0.285 1.00 . A A . 20 PHE C 1 1 3 957 1 1 20 PHE CA C 3.991 14.001 -1.022 1.00 . A A . 20 PHE CA 1 1 3 958 1 1 20 PHE CB C 2.666 13.338 -1.427 1.00 . A A . 20 PHE CB 1 1 3 959 1 1 20 PHE CD1 C 2.452 14.508 -3.674 1.00 . A A . 20 PHE CD1 1 1 3 960 1 1 20 PHE CD2 C 0.568 14.524 -2.167 1.00 . A A . 20 PHE CD2 1 1 3 961 1 1 20 PHE CE1 C 1.716 15.240 -4.597 1.00 . A A . 20 PHE CE1 1 1 3 962 1 1 20 PHE CE2 C -0.162 15.253 -3.100 1.00 . A A . 20 PHE CE2 1 1 3 963 1 1 20 PHE CG C 1.882 14.150 -2.451 1.00 . A A . 20 PHE CG 1 1 3 964 1 1 20 PHE CZ C 0.415 15.609 -4.309 1.00 . A A . 20 PHE CZ 1 1 3 965 1 1 20 PHE H H 4.256 12.486 0.421 1.00 . A A . 20 PHE H 1 1 3 966 1 1 20 PHE HA H 4.551 14.219 -1.931 1.00 . A A . 20 PHE HA 1 1 3 967 1 1 20 PHE HB2 H 2.884 12.359 -1.853 1.00 . A A . 20 PHE HB2 1 1 3 968 1 1 20 PHE HB3 H 2.051 13.205 -0.536 1.00 . A A . 20 PHE HB3 1 1 3 969 1 1 20 PHE HD1 H 3.476 14.213 -3.902 1.00 . A A . 20 PHE HD1 1 1 3 970 1 1 20 PHE HD2 H 0.123 14.249 -1.215 1.00 . A A . 20 PHE HD2 1 1 3 971 1 1 20 PHE HE1 H 2.178 15.536 -5.542 1.00 . A A . 20 PHE HE1 1 1 3 972 1 1 20 PHE HE2 H -1.193 15.530 -2.878 1.00 . A A . 20 PHE HE2 1 1 3 973 1 1 20 PHE HZ H -0.164 16.190 -5.037 1.00 . A A . 20 PHE HZ 1 1 3 974 1 1 20 PHE N N 4.782 13.051 -0.216 1.00 . A A . 20 PHE N 1 1 3 975 1 1 20 PHE O O 3.511 15.274 0.944 1.00 . A A . 20 PHE O 1 1 4 976 1 1 1 HIS C C -5.160 -13.248 -4.339 1.00 . A A . 1 HIS C 1 1 4 977 1 1 1 HIS CA C -6.636 -12.986 -4.719 1.00 . A A . 1 HIS CA 1 1 4 978 1 1 1 HIS CB C -6.732 -12.251 -6.067 1.00 . A A . 1 HIS CB 1 1 4 979 1 1 1 HIS CD2 C -9.287 -12.238 -6.345 1.00 . A A . 1 HIS CD2 1 1 4 980 1 1 1 HIS CE1 C -9.468 -12.800 -8.417 1.00 . A A . 1 HIS CE1 1 1 4 981 1 1 1 HIS CG C -8.067 -12.446 -6.820 1.00 . A A . 1 HIS CG 1 1 4 982 1 1 1 HIS H1 H -6.874 -11.989 -2.837 1.00 . A A . 1 HIS H1 1 1 4 983 1 1 1 HIS HA H -7.114 -13.958 -4.846 1.00 . A A . 1 HIS HA 1 1 4 984 1 1 1 HIS HB2 H -6.585 -11.185 -5.892 1.00 . A A . 1 HIS HB2 1 1 4 985 1 1 1 HIS HB3 H -5.926 -12.612 -6.707 1.00 . A A . 1 HIS HB3 1 1 4 986 1 1 1 HIS HD1 H -7.418 -12.987 -8.722 1.00 . A A . 1 HIS HD1 1 1 4 987 1 1 1 HIS HD2 H -9.536 -11.942 -5.337 1.00 . A A . 1 HIS HD2 1 1 4 988 1 1 1 HIS HE1 H -9.884 -13.044 -9.384 1.00 . A A . 1 HIS HE1 1 1 4 989 1 1 1 HIS HE2 H -11.156 -12.383 -7.271 1.00 . A A . 1 HIS HE2 1 1 4 990 1 1 1 HIS N N -7.383 -12.266 -3.664 1.00 . A A . 1 HIS N 1 1 4 991 1 1 1 HIS ND1 N -8.166 -12.785 -8.096 1.00 . A A . 1 HIS ND1 1 1 4 992 1 1 1 HIS NE2 N -10.151 -12.461 -7.335 1.00 . A A . 1 HIS NE2 1 1 4 993 1 1 1 HIS O O -4.775 -14.380 -4.059 1.00 . A A . 1 HIS O 1 1 4 994 1 1 2 GLY C C -2.377 -10.764 -3.989 1.00 . A A . 2 GLY C 1 1 4 995 1 1 2 GLY CA C -2.955 -12.182 -3.928 1.00 . A A . 2 GLY CA 1 1 4 996 1 1 2 GLY H H -4.727 -11.250 -4.560 1.00 . A A . 2 GLY H 1 1 4 997 1 1 2 GLY HA2 H -2.863 -12.565 -2.912 1.00 . A A . 2 GLY HA2 1 1 4 998 1 1 2 GLY HA3 H -2.403 -12.828 -4.611 1.00 . A A . 2 GLY HA3 1 1 4 999 1 1 2 GLY N N -4.379 -12.160 -4.316 1.00 . A A . 2 GLY N 1 1 4 1000 1 1 2 GLY O O -2.671 -9.939 -3.130 1.00 . A A . 2 GLY O 1 1 4 1001 1 1 3 LEU C C -2.338 -7.936 -5.395 1.00 . A A . 3 LEU C 1 1 4 1002 1 1 3 LEU CA C -1.337 -9.102 -5.506 1.00 . A A . 3 LEU CA 1 1 4 1003 1 1 3 LEU CB C -0.661 -9.078 -6.884 1.00 . A A . 3 LEU CB 1 1 4 1004 1 1 3 LEU CD1 C -1.025 -8.459 -9.277 1.00 . A A . 3 LEU CD1 1 1 4 1005 1 1 3 LEU CD2 C -1.904 -10.649 -8.442 1.00 . A A . 3 LEU CD2 1 1 4 1006 1 1 3 LEU CG C -1.624 -9.188 -8.075 1.00 . A A . 3 LEU CG 1 1 4 1007 1 1 3 LEU H H -1.857 -11.104 -5.927 1.00 . A A . 3 LEU H 1 1 4 1008 1 1 3 LEU HA H -0.554 -8.914 -4.770 1.00 . A A . 3 LEU HA 1 1 4 1009 1 1 3 LEU HB2 H -0.099 -8.149 -6.978 1.00 . A A . 3 LEU HB2 1 1 4 1010 1 1 3 LEU HB3 H 0.037 -9.913 -6.933 1.00 . A A . 3 LEU HB3 1 1 4 1011 1 1 3 LEU HD11 H -1.706 -8.535 -10.125 1.00 . A A . 3 LEU HD11 1 1 4 1012 1 1 3 LEU HD12 H -0.874 -7.409 -9.025 1.00 . A A . 3 LEU HD12 1 1 4 1013 1 1 3 LEU HD13 H -0.068 -8.911 -9.537 1.00 . A A . 3 LEU HD13 1 1 4 1014 1 1 3 LEU HD21 H -0.974 -11.136 -8.733 1.00 . A A . 3 LEU HD21 1 1 4 1015 1 1 3 LEU HD22 H -2.331 -11.164 -7.582 1.00 . A A . 3 LEU HD22 1 1 4 1016 1 1 3 LEU HD23 H -2.608 -10.685 -9.273 1.00 . A A . 3 LEU HD23 1 1 4 1017 1 1 3 LEU HG H -2.566 -8.708 -7.808 1.00 . A A . 3 LEU HG 1 1 4 1018 1 1 3 LEU N N -1.909 -10.432 -5.190 1.00 . A A . 3 LEU N 1 1 4 1019 1 1 3 LEU O O -2.004 -6.878 -4.867 1.00 . A A . 3 LEU O 1 1 4 1020 1 1 4 ALA C C -4.939 -6.803 -4.185 1.00 . A A . 4 ALA C 1 1 4 1021 1 1 4 ALA CA C -4.721 -7.264 -5.640 1.00 . A A . 4 ALA CA 1 1 4 1022 1 1 4 ALA CB C -5.991 -7.918 -6.193 1.00 . A A . 4 ALA CB 1 1 4 1023 1 1 4 ALA H H -3.802 -9.034 -6.294 1.00 . A A . 4 ALA H 1 1 4 1024 1 1 4 ALA HA H -4.505 -6.383 -6.244 1.00 . A A . 4 ALA HA 1 1 4 1025 1 1 4 ALA HB1 H -5.818 -8.238 -7.220 1.00 . A A . 4 ALA HB1 1 1 4 1026 1 1 4 ALA HB2 H -6.810 -7.199 -6.169 1.00 . A A . 4 ALA HB2 1 1 4 1027 1 1 4 ALA HB3 H -6.248 -8.784 -5.582 1.00 . A A . 4 ALA HB3 1 1 4 1028 1 1 4 ALA N N -3.589 -8.206 -5.783 1.00 . A A . 4 ALA N 1 1 4 1029 1 1 4 ALA O O -5.359 -5.677 -3.941 1.00 . A A . 4 ALA O 1 1 4 1030 1 1 5 SER C C -3.114 -6.933 -1.284 1.00 . A A . 5 SER C 1 1 4 1031 1 1 5 SER CA C -4.492 -7.390 -1.801 1.00 . A A . 5 SER CA 1 1 4 1032 1 1 5 SER CB C -4.925 -8.654 -1.054 1.00 . A A . 5 SER CB 1 1 4 1033 1 1 5 SER H H -3.985 -8.467 -3.521 1.00 . A A . 5 SER H 1 1 4 1034 1 1 5 SER HA H -5.216 -6.603 -1.593 1.00 . A A . 5 SER HA 1 1 4 1035 1 1 5 SER HB2 H -5.888 -8.990 -1.438 1.00 . A A . 5 SER HB2 1 1 4 1036 1 1 5 SER HB3 H -4.181 -9.437 -1.203 1.00 . A A . 5 SER HB3 1 1 4 1037 1 1 5 SER HG H -5.264 -9.195 0.855 1.00 . A A . 5 SER HG 1 1 4 1038 1 1 5 SER N N -4.484 -7.644 -3.256 1.00 . A A . 5 SER N 1 1 4 1039 1 1 5 SER O O -3.025 -6.177 -0.320 1.00 . A A . 5 SER O 1 1 4 1040 1 1 5 SER OG O -5.041 -8.368 0.340 1.00 . A A . 5 SER OG 1 1 4 1041 1 1 6 THR C C -0.556 -5.314 -1.767 1.00 . A A . 6 THR C 1 1 4 1042 1 1 6 THR CA C -0.658 -6.852 -1.697 1.00 . A A . 6 THR CA 1 1 4 1043 1 1 6 THR CB C 0.316 -7.544 -2.670 1.00 . A A . 6 THR CB 1 1 4 1044 1 1 6 THR CG2 C 1.790 -7.224 -2.399 1.00 . A A . 6 THR CG2 1 1 4 1045 1 1 6 THR H H -2.062 -8.116 -2.584 1.00 . A A . 6 THR H 1 1 4 1046 1 1 6 THR HA H -0.387 -7.156 -0.685 1.00 . A A . 6 THR HA 1 1 4 1047 1 1 6 THR HB H 0.075 -7.221 -3.683 1.00 . A A . 6 THR HB 1 1 4 1048 1 1 6 THR HG1 H 0.903 -9.438 -2.981 1.00 . A A . 6 THR HG1 1 1 4 1049 1 1 6 THR HG21 H 2.053 -7.549 -1.391 1.00 . A A . 6 THR HG21 1 1 4 1050 1 1 6 THR HG22 H 2.415 -7.747 -3.123 1.00 . A A . 6 THR HG22 1 1 4 1051 1 1 6 THR HG23 H 1.952 -6.151 -2.488 1.00 . A A . 6 THR HG23 1 1 4 1052 1 1 6 THR N N -2.036 -7.334 -1.959 1.00 . A A . 6 THR N 1 1 4 1053 1 1 6 THR O O 0.182 -4.708 -0.987 1.00 . A A . 6 THR O 1 1 4 1054 1 1 6 THR OG1 O 0.116 -8.961 -2.588 1.00 . A A . 6 THR OG1 1 1 4 1055 1 1 7 LEU C C -2.509 -2.638 -1.577 1.00 . A A . 7 LEU C 1 1 4 1056 1 1 7 LEU CA C -1.545 -3.223 -2.634 1.00 . A A . 7 LEU CA 1 1 4 1057 1 1 7 LEU CB C -1.897 -2.784 -4.068 1.00 . A A . 7 LEU CB 1 1 4 1058 1 1 7 LEU CD1 C -3.720 -1.094 -4.457 1.00 . A A . 7 LEU CD1 1 1 4 1059 1 1 7 LEU CD2 C -3.777 -3.301 -5.667 1.00 . A A . 7 LEU CD2 1 1 4 1060 1 1 7 LEU CG C -3.389 -2.587 -4.374 1.00 . A A . 7 LEU CG 1 1 4 1061 1 1 7 LEU H H -2.048 -5.199 -3.171 1.00 . A A . 7 LEU H 1 1 4 1062 1 1 7 LEU HA H -0.556 -2.818 -2.416 1.00 . A A . 7 LEU HA 1 1 4 1063 1 1 7 LEU HB2 H -1.379 -1.847 -4.275 1.00 . A A . 7 LEU HB2 1 1 4 1064 1 1 7 LEU HB3 H -1.516 -3.544 -4.750 1.00 . A A . 7 LEU HB3 1 1 4 1065 1 1 7 LEU HD11 H -4.780 -0.967 -4.675 1.00 . A A . 7 LEU HD11 1 1 4 1066 1 1 7 LEU HD12 H -3.485 -0.617 -3.506 1.00 . A A . 7 LEU HD12 1 1 4 1067 1 1 7 LEU HD13 H -3.129 -0.634 -5.250 1.00 . A A . 7 LEU HD13 1 1 4 1068 1 1 7 LEU HD21 H -4.847 -3.187 -5.838 1.00 . A A . 7 LEU HD21 1 1 4 1069 1 1 7 LEU HD22 H -3.532 -4.361 -5.586 1.00 . A A . 7 LEU HD22 1 1 4 1070 1 1 7 LEU HD23 H -3.227 -2.865 -6.501 1.00 . A A . 7 LEU HD23 1 1 4 1071 1 1 7 LEU HG H -3.966 -3.020 -3.558 1.00 . A A . 7 LEU HG 1 1 4 1072 1 1 7 LEU N N -1.424 -4.694 -2.573 1.00 . A A . 7 LEU N 1 1 4 1073 1 1 7 LEU O O -2.615 -1.426 -1.461 1.00 . A A . 7 LEU O 1 1 4 1074 1 1 8 THR C C -3.363 -3.155 1.698 1.00 . A A . 8 THR C 1 1 4 1075 1 1 8 THR CA C -4.062 -3.132 0.318 1.00 . A A . 8 THR CA 1 1 4 1076 1 1 8 THR CB C -5.267 -4.094 0.243 1.00 . A A . 8 THR CB 1 1 4 1077 1 1 8 THR CG2 C -6.393 -3.783 1.237 1.00 . A A . 8 THR CG2 1 1 4 1078 1 1 8 THR H H -3.015 -4.486 -0.873 1.00 . A A . 8 THR H 1 1 4 1079 1 1 8 THR HA H -4.420 -2.119 0.131 1.00 . A A . 8 THR HA 1 1 4 1080 1 1 8 THR HB H -4.909 -5.104 0.439 1.00 . A A . 8 THR HB 1 1 4 1081 1 1 8 THR HG1 H -6.668 -4.542 -1.128 1.00 . A A . 8 THR HG1 1 1 4 1082 1 1 8 THR HG21 H -6.776 -2.780 1.050 1.00 . A A . 8 THR HG21 1 1 4 1083 1 1 8 THR HG22 H -7.197 -4.508 1.114 1.00 . A A . 8 THR HG22 1 1 4 1084 1 1 8 THR HG23 H -6.005 -3.840 2.254 1.00 . A A . 8 THR HG23 1 1 4 1085 1 1 8 THR N N -3.109 -3.495 -0.759 1.00 . A A . 8 THR N 1 1 4 1086 1 1 8 THR O O -3.868 -2.606 2.674 1.00 . A A . 8 THR O 1 1 4 1087 1 1 8 THR OG1 O -5.795 -4.056 -1.088 1.00 . A A . 8 THR OG1 1 1 4 1088 1 1 9 ARG C C -0.175 -2.761 2.918 1.00 . A A . 9 ARG C 1 1 4 1089 1 1 9 ARG CA C -1.320 -3.782 2.957 1.00 . A A . 9 ARG CA 1 1 4 1090 1 1 9 ARG CB C -0.727 -5.173 3.176 1.00 . A A . 9 ARG CB 1 1 4 1091 1 1 9 ARG CD C -1.745 -7.337 2.410 1.00 . A A . 9 ARG CD 1 1 4 1092 1 1 9 ARG CG C -1.810 -6.218 3.447 1.00 . A A . 9 ARG CG 1 1 4 1093 1 1 9 ARG CZ C -0.261 -9.332 2.164 1.00 . A A . 9 ARG CZ 1 1 4 1094 1 1 9 ARG H H -1.833 -4.268 0.965 1.00 . A A . 9 ARG H 1 1 4 1095 1 1 9 ARG HA H -1.951 -3.547 3.814 1.00 . A A . 9 ARG HA 1 1 4 1096 1 1 9 ARG HB2 H -0.165 -5.464 2.288 1.00 . A A . 9 ARG HB2 1 1 4 1097 1 1 9 ARG HB3 H -0.050 -5.138 4.029 1.00 . A A . 9 ARG HB3 1 1 4 1098 1 1 9 ARG HD2 H -2.574 -8.027 2.571 1.00 . A A . 9 ARG HD2 1 1 4 1099 1 1 9 ARG HD3 H -1.822 -6.907 1.411 1.00 . A A . 9 ARG HD3 1 1 4 1100 1 1 9 ARG HE H 0.286 -7.556 2.926 1.00 . A A . 9 ARG HE 1 1 4 1101 1 1 9 ARG HG2 H -1.662 -6.640 4.441 1.00 . A A . 9 ARG HG2 1 1 4 1102 1 1 9 ARG HG3 H -2.789 -5.742 3.400 1.00 . A A . 9 ARG HG3 1 1 4 1103 1 1 9 ARG HH11 H -2.122 -9.648 1.509 1.00 . A A . 9 ARG HH11 1 1 4 1104 1 1 9 ARG HH12 H -1.062 -11.019 1.379 1.00 . A A . 9 ARG HH12 1 1 4 1105 1 1 9 ARG HH21 H 1.678 -9.354 2.741 1.00 . A A . 9 ARG HH21 1 1 4 1106 1 1 9 ARG HH22 H 1.078 -10.831 2.071 1.00 . A A . 9 ARG HH22 1 1 4 1107 1 1 9 ARG N N -2.164 -3.737 1.743 1.00 . A A . 9 ARG N 1 1 4 1108 1 1 9 ARG NE N -0.469 -8.070 2.527 1.00 . A A . 9 ARG NE 1 1 4 1109 1 1 9 ARG NH1 N -1.226 -10.071 1.638 1.00 . A A . 9 ARG NH1 1 1 4 1110 1 1 9 ARG NH2 N 0.934 -9.881 2.338 1.00 . A A . 9 ARG NH2 1 1 4 1111 1 1 9 ARG O O -0.075 -1.917 3.805 1.00 . A A . 9 ARG O 1 1 4 1112 1 1 10 TRP C C 1.098 -0.339 1.580 1.00 . A A . 10 TRP C 1 1 4 1113 1 1 10 TRP CA C 1.676 -1.771 1.631 1.00 . A A . 10 TRP CA 1 1 4 1114 1 1 10 TRP CB C 2.514 -2.171 0.406 1.00 . A A . 10 TRP CB 1 1 4 1115 1 1 10 TRP CD1 C 2.128 -0.809 -1.696 1.00 . A A . 10 TRP CD1 1 1 4 1116 1 1 10 TRP CD2 C 3.748 -0.023 -0.437 1.00 . A A . 10 TRP CD2 1 1 4 1117 1 1 10 TRP CE2 C 3.587 0.799 -1.548 1.00 . A A . 10 TRP CE2 1 1 4 1118 1 1 10 TRP CE3 C 4.715 0.268 0.518 1.00 . A A . 10 TRP CE3 1 1 4 1119 1 1 10 TRP CG C 2.811 -1.030 -0.572 1.00 . A A . 10 TRP CG 1 1 4 1120 1 1 10 TRP CH2 C 5.372 2.205 -0.751 1.00 . A A . 10 TRP CH2 1 1 4 1121 1 1 10 TRP CZ2 C 4.411 1.903 -1.716 1.00 . A A . 10 TRP CZ2 1 1 4 1122 1 1 10 TRP CZ3 C 5.515 1.399 0.365 1.00 . A A . 10 TRP CZ3 1 1 4 1123 1 1 10 TRP H H 0.678 -3.583 1.239 1.00 . A A . 10 TRP H 1 1 4 1124 1 1 10 TRP HA H 2.346 -1.804 2.490 1.00 . A A . 10 TRP HA 1 1 4 1125 1 1 10 TRP HB2 H 3.464 -2.569 0.762 1.00 . A A . 10 TRP HB2 1 1 4 1126 1 1 10 TRP HB3 H 1.987 -2.960 -0.130 1.00 . A A . 10 TRP HB3 1 1 4 1127 1 1 10 TRP HD1 H 1.309 -1.418 -2.063 1.00 . A A . 10 TRP HD1 1 1 4 1128 1 1 10 TRP HE1 H 2.273 0.664 -3.150 1.00 . A A . 10 TRP HE1 1 1 4 1129 1 1 10 TRP HE3 H 4.925 -0.439 1.318 1.00 . A A . 10 TRP HE3 1 1 4 1130 1 1 10 TRP HH2 H 5.973 3.110 -0.854 1.00 . A A . 10 TRP HH2 1 1 4 1131 1 1 10 TRP HZ2 H 4.365 2.484 -2.634 1.00 . A A . 10 TRP HZ2 1 1 4 1132 1 1 10 TRP HZ3 H 6.196 1.693 1.165 1.00 . A A . 10 TRP HZ3 1 1 4 1133 1 1 10 TRP N N 0.641 -2.802 1.864 1.00 . A A . 10 TRP N 1 1 4 1134 1 1 10 TRP NE1 N 2.602 0.296 -2.279 1.00 . A A . 10 TRP NE1 1 1 4 1135 1 1 10 TRP O O 1.691 0.570 2.161 1.00 . A A . 10 TRP O 1 1 4 1136 1 1 11 ALA C C -1.365 1.519 2.501 1.00 . A A . 11 ALA C 1 1 4 1137 1 1 11 ALA CA C -0.921 1.033 1.107 1.00 . A A . 11 ALA CA 1 1 4 1138 1 1 11 ALA CB C -2.156 0.911 0.217 1.00 . A A . 11 ALA CB 1 1 4 1139 1 1 11 ALA H H -0.655 -1.028 0.782 1.00 . A A . 11 ALA H 1 1 4 1140 1 1 11 ALA HA H -0.283 1.805 0.678 1.00 . A A . 11 ALA HA 1 1 4 1141 1 1 11 ALA HB1 H -2.775 1.801 0.330 1.00 . A A . 11 ALA HB1 1 1 4 1142 1 1 11 ALA HB2 H -2.729 0.032 0.509 1.00 . A A . 11 ALA HB2 1 1 4 1143 1 1 11 ALA HB3 H -1.846 0.814 -0.823 1.00 . A A . 11 ALA HB3 1 1 4 1144 1 1 11 ALA N N -0.150 -0.231 1.112 1.00 . A A . 11 ALA N 1 1 4 1145 1 1 11 ALA O O -1.942 2.595 2.638 1.00 . A A . 11 ALA O 1 1 4 1146 1 1 12 HIS C C 0.052 1.374 5.694 1.00 . A A . 12 HIS C 1 1 4 1147 1 1 12 HIS CA C -1.263 1.082 4.942 1.00 . A A . 12 HIS CA 1 1 4 1148 1 1 12 HIS CB C -2.007 -0.078 5.606 1.00 . A A . 12 HIS CB 1 1 4 1149 1 1 12 HIS CD2 C -4.334 0.775 4.871 1.00 . A A . 12 HIS CD2 1 1 4 1150 1 1 12 HIS CE1 C -5.532 0.012 6.487 1.00 . A A . 12 HIS CE1 1 1 4 1151 1 1 12 HIS CG C -3.536 0.101 5.689 1.00 . A A . 12 HIS CG 1 1 4 1152 1 1 12 HIS H H -0.583 -0.147 3.388 1.00 . A A . 12 HIS H 1 1 4 1153 1 1 12 HIS HA H -1.894 1.971 4.986 1.00 . A A . 12 HIS HA 1 1 4 1154 1 1 12 HIS HB2 H -1.802 -0.984 5.037 1.00 . A A . 12 HIS HB2 1 1 4 1155 1 1 12 HIS HB3 H -1.618 -0.207 6.616 1.00 . A A . 12 HIS HB3 1 1 4 1156 1 1 12 HIS HD1 H -3.938 -0.933 7.442 1.00 . A A . 12 HIS HD1 1 1 4 1157 1 1 12 HIS HD2 H -4.036 1.276 3.962 1.00 . A A . 12 HIS HD2 1 1 4 1158 1 1 12 HIS HE1 H -6.372 -0.214 7.127 1.00 . A A . 12 HIS HE1 1 1 4 1159 1 1 12 HIS HE2 H -6.393 1.152 4.969 1.00 . A A . 12 HIS HE2 1 1 4 1160 1 1 12 HIS N N -1.036 0.737 3.524 1.00 . A A . 12 HIS N 1 1 4 1161 1 1 12 HIS ND1 N -4.266 -0.379 6.682 1.00 . A A . 12 HIS ND1 1 1 4 1162 1 1 12 HIS NE2 N -5.572 0.723 5.372 1.00 . A A . 12 HIS NE2 1 1 4 1163 1 1 12 HIS O O 0.070 1.502 6.916 1.00 . A A . 12 HIS O 1 1 4 1164 1 1 13 TYR C C 2.952 3.217 4.917 1.00 . A A . 13 TYR C 1 1 4 1165 1 1 13 TYR CA C 2.469 1.851 5.437 1.00 . A A . 13 TYR CA 1 1 4 1166 1 1 13 TYR CB C 3.404 0.701 5.041 1.00 . A A . 13 TYR CB 1 1 4 1167 1 1 13 TYR CD1 C 5.140 1.002 6.840 1.00 . A A . 13 TYR CD1 1 1 4 1168 1 1 13 TYR CD2 C 5.838 1.162 4.537 1.00 . A A . 13 TYR CD2 1 1 4 1169 1 1 13 TYR CE1 C 6.442 1.227 7.255 1.00 . A A . 13 TYR CE1 1 1 4 1170 1 1 13 TYR CE2 C 7.144 1.383 4.951 1.00 . A A . 13 TYR CE2 1 1 4 1171 1 1 13 TYR CG C 4.841 0.960 5.484 1.00 . A A . 13 TYR CG 1 1 4 1172 1 1 13 TYR CZ C 7.439 1.423 6.307 1.00 . A A . 13 TYR CZ 1 1 4 1173 1 1 13 TYR H H 1.081 1.344 3.940 1.00 . A A . 13 TYR H 1 1 4 1174 1 1 13 TYR HA H 2.420 1.895 6.525 1.00 . A A . 13 TYR HA 1 1 4 1175 1 1 13 TYR HB2 H 3.049 -0.221 5.502 1.00 . A A . 13 TYR HB2 1 1 4 1176 1 1 13 TYR HB3 H 3.384 0.588 3.956 1.00 . A A . 13 TYR HB3 1 1 4 1177 1 1 13 TYR HD1 H 4.341 0.905 7.573 1.00 . A A . 13 TYR HD1 1 1 4 1178 1 1 13 TYR HD2 H 5.592 1.175 3.476 1.00 . A A . 13 TYR HD2 1 1 4 1179 1 1 13 TYR HE1 H 6.674 1.167 8.319 1.00 . A A . 13 TYR HE1 1 1 4 1180 1 1 13 TYR HE2 H 7.944 1.423 4.211 1.00 . A A . 13 TYR HE2 1 1 4 1181 1 1 13 TYR HH H 8.740 1.673 7.706 1.00 . A A . 13 TYR HH 1 1 4 1182 1 1 13 TYR N N 1.122 1.542 4.922 1.00 . A A . 13 TYR N 1 1 4 1183 1 1 13 TYR O O 2.934 4.219 5.632 1.00 . A A . 13 TYR O 1 1 4 1184 1 1 13 TYR OH O 8.715 1.655 6.708 1.00 . A A . 13 TYR OH 1 1 4 1185 1 1 14 ASN C C 2.461 5.531 2.924 1.00 . A A . 14 ASN C 1 1 4 1186 1 1 14 ASN CA C 3.586 4.486 2.890 1.00 . A A . 14 ASN CA 1 1 4 1187 1 1 14 ASN CB C 3.914 4.186 1.427 1.00 . A A . 14 ASN CB 1 1 4 1188 1 1 14 ASN CG C 2.686 3.756 0.615 1.00 . A A . 14 ASN CG 1 1 4 1189 1 1 14 ASN H H 3.191 2.429 3.045 1.00 . A A . 14 ASN H 1 1 4 1190 1 1 14 ASN HA H 4.470 4.922 3.356 1.00 . A A . 14 ASN HA 1 1 4 1191 1 1 14 ASN HB2 H 4.344 5.078 0.971 1.00 . A A . 14 ASN HB2 1 1 4 1192 1 1 14 ASN HB3 H 4.650 3.383 1.393 1.00 . A A . 14 ASN HB3 1 1 4 1193 1 1 14 ASN HD21 H 3.259 4.900 -0.936 1.00 . A A . 14 ASN HD21 1 1 4 1194 1 1 14 ASN HD22 H 1.768 3.999 -1.099 1.00 . A A . 14 ASN HD22 1 1 4 1195 1 1 14 ASN N N 3.242 3.248 3.619 1.00 . A A . 14 ASN N 1 1 4 1196 1 1 14 ASN ND2 N 2.578 4.264 -0.586 1.00 . A A . 14 ASN ND2 1 1 4 1197 1 1 14 ASN O O 2.687 6.664 2.527 1.00 . A A . 14 ASN O 1 1 4 1198 1 1 14 ASN OD1 O 1.781 3.076 1.081 1.00 . A A . 14 ASN OD1 1 1 4 1199 1 1 15 ALA C C 0.485 7.309 4.366 1.00 . A A . 15 ALA C 1 1 4 1200 1 1 15 ALA CA C 0.114 6.058 3.542 1.00 . A A . 15 ALA CA 1 1 4 1201 1 1 15 ALA CB C -1.015 5.289 4.233 1.00 . A A . 15 ALA CB 1 1 4 1202 1 1 15 ALA H H 1.063 4.183 3.541 1.00 . A A . 15 ALA H 1 1 4 1203 1 1 15 ALA HA H -0.238 6.381 2.563 1.00 . A A . 15 ALA HA 1 1 4 1204 1 1 15 ALA HB1 H -1.298 5.805 5.151 1.00 . A A . 15 ALA HB1 1 1 4 1205 1 1 15 ALA HB2 H -1.876 5.233 3.568 1.00 . A A . 15 ALA HB2 1 1 4 1206 1 1 15 ALA HB3 H -0.674 4.282 4.474 1.00 . A A . 15 ALA HB3 1 1 4 1207 1 1 15 ALA N N 1.257 5.142 3.349 1.00 . A A . 15 ALA N 1 1 4 1208 1 1 15 ALA O O -0.083 8.381 4.177 1.00 . A A . 15 ALA O 1 1 4 1209 1 1 16 LEU C C 3.475 8.700 5.456 1.00 . A A . 16 LEU C 1 1 4 1210 1 1 16 LEU CA C 2.118 8.222 6.010 1.00 . A A . 16 LEU CA 1 1 4 1211 1 1 16 LEU CB C 2.257 7.718 7.451 1.00 . A A . 16 LEU CB 1 1 4 1212 1 1 16 LEU CD1 C 1.047 6.456 9.252 1.00 . A A . 16 LEU CD1 1 1 4 1213 1 1 16 LEU CD2 C 0.248 8.737 8.599 1.00 . A A . 16 LEU CD2 1 1 4 1214 1 1 16 LEU CG C 0.890 7.440 8.093 1.00 . A A . 16 LEU CG 1 1 4 1215 1 1 16 LEU H H 1.913 6.240 5.328 1.00 . A A . 16 LEU H 1 1 4 1216 1 1 16 LEU HA H 1.434 9.071 6.012 1.00 . A A . 16 LEU HA 1 1 4 1217 1 1 16 LEU HB2 H 2.839 6.797 7.449 1.00 . A A . 16 LEU HB2 1 1 4 1218 1 1 16 LEU HB3 H 2.782 8.469 8.041 1.00 . A A . 16 LEU HB3 1 1 4 1219 1 1 16 LEU HD11 H 1.504 5.535 8.887 1.00 . A A . 16 LEU HD11 1 1 4 1220 1 1 16 LEU HD12 H 1.682 6.898 10.020 1.00 . A A . 16 LEU HD12 1 1 4 1221 1 1 16 LEU HD13 H 0.068 6.233 9.675 1.00 . A A . 16 LEU HD13 1 1 4 1222 1 1 16 LEU HD21 H 0.882 9.180 9.366 1.00 . A A . 16 LEU HD21 1 1 4 1223 1 1 16 LEU HD22 H 0.138 9.435 7.770 1.00 . A A . 16 LEU HD22 1 1 4 1224 1 1 16 LEU HD23 H -0.733 8.516 9.020 1.00 . A A . 16 LEU HD23 1 1 4 1225 1 1 16 LEU HG H 0.236 6.996 7.343 1.00 . A A . 16 LEU HG 1 1 4 1226 1 1 16 LEU N N 1.511 7.146 5.201 1.00 . A A . 16 LEU N 1 1 4 1227 1 1 16 LEU O O 3.819 9.872 5.583 1.00 . A A . 16 LEU O 1 1 4 1228 1 1 17 ILE C C 5.301 8.667 2.704 1.00 . A A . 17 ILE C 1 1 4 1229 1 1 17 ILE CA C 5.506 8.089 4.134 1.00 . A A . 17 ILE CA 1 1 4 1230 1 1 17 ILE CB C 6.375 6.801 4.129 1.00 . A A . 17 ILE CB 1 1 4 1231 1 1 17 ILE CD1 C 6.835 6.795 6.717 1.00 . A A . 17 ILE CD1 1 1 4 1232 1 1 17 ILE CG1 C 6.376 6.026 5.466 1.00 . A A . 17 ILE CG1 1 1 4 1233 1 1 17 ILE CG2 C 7.827 7.056 3.686 1.00 . A A . 17 ILE CG2 1 1 4 1234 1 1 17 ILE H H 3.923 6.844 4.745 1.00 . A A . 17 ILE H 1 1 4 1235 1 1 17 ILE HA H 6.026 8.842 4.728 1.00 . A A . 17 ILE HA 1 1 4 1236 1 1 17 ILE HB H 5.937 6.135 3.386 1.00 . A A . 17 ILE HB 1 1 4 1237 1 1 17 ILE HD11 H 7.859 7.139 6.576 1.00 . A A . 17 ILE HD11 1 1 4 1238 1 1 17 ILE HD12 H 6.788 6.137 7.585 1.00 . A A . 17 ILE HD12 1 1 4 1239 1 1 17 ILE HD13 H 6.181 7.653 6.875 1.00 . A A . 17 ILE HD13 1 1 4 1240 1 1 17 ILE HG12 H 5.358 5.681 5.646 1.00 . A A . 17 ILE HG12 1 1 4 1241 1 1 17 ILE HG13 H 7.015 5.151 5.351 1.00 . A A . 17 ILE HG13 1 1 4 1242 1 1 17 ILE HG21 H 7.829 7.602 2.744 1.00 . A A . 17 ILE HG21 1 1 4 1243 1 1 17 ILE HG22 H 8.341 7.643 4.447 1.00 . A A . 17 ILE HG22 1 1 4 1244 1 1 17 ILE HG23 H 8.340 6.103 3.554 1.00 . A A . 17 ILE HG23 1 1 4 1245 1 1 17 ILE N N 4.210 7.797 4.802 1.00 . A A . 17 ILE N 1 1 4 1246 1 1 17 ILE O O 6.243 8.851 1.934 1.00 . A A . 17 ILE O 1 1 4 1247 1 1 18 ARG C C 2.211 10.121 1.160 1.00 . A A . 18 ARG C 1 1 4 1248 1 1 18 ARG CA C 3.614 9.512 1.059 1.00 . A A . 18 ARG CA 1 1 4 1249 1 1 18 ARG CB C 3.587 8.364 0.036 1.00 . A A . 18 ARG CB 1 1 4 1250 1 1 18 ARG CD C 4.390 9.557 -2.012 1.00 . A A . 18 ARG CD 1 1 4 1251 1 1 18 ARG CG C 4.733 8.494 -0.969 1.00 . A A . 18 ARG CG 1 1 4 1252 1 1 18 ARG CZ C 5.816 11.003 -3.471 1.00 . A A . 18 ARG CZ 1 1 4 1253 1 1 18 ARG H H 3.290 8.769 2.972 1.00 . A A . 18 ARG H 1 1 4 1254 1 1 18 ARG HA H 4.311 10.277 0.716 1.00 . A A . 18 ARG HA 1 1 4 1255 1 1 18 ARG HB2 H 3.683 7.416 0.564 1.00 . A A . 18 ARG HB2 1 1 4 1256 1 1 18 ARG HB3 H 2.637 8.383 -0.498 1.00 . A A . 18 ARG HB3 1 1 4 1257 1 1 18 ARG HD2 H 4.044 9.067 -2.923 1.00 . A A . 18 ARG HD2 1 1 4 1258 1 1 18 ARG HD3 H 3.601 10.201 -1.626 1.00 . A A . 18 ARG HD3 1 1 4 1259 1 1 18 ARG HE H 6.240 10.464 -1.578 1.00 . A A . 18 ARG HE 1 1 4 1260 1 1 18 ARG HG2 H 5.643 8.782 -0.444 1.00 . A A . 18 ARG HG2 1 1 4 1261 1 1 18 ARG HG3 H 4.888 7.537 -1.465 1.00 . A A . 18 ARG HG3 1 1 4 1262 1 1 18 ARG HH11 H 4.224 10.279 -4.459 1.00 . A A . 18 ARG HH11 1 1 4 1263 1 1 18 ARG HH12 H 5.230 11.353 -5.375 1.00 . A A . 18 ARG HH12 1 1 4 1264 1 1 18 ARG HH21 H 7.523 11.879 -2.829 1.00 . A A . 18 ARG HH21 1 1 4 1265 1 1 18 ARG HH22 H 7.071 12.227 -4.461 1.00 . A A . 18 ARG HH22 1 1 4 1266 1 1 18 ARG N N 4.056 9.013 2.374 1.00 . A A . 18 ARG N 1 1 4 1267 1 1 18 ARG NE N 5.579 10.372 -2.320 1.00 . A A . 18 ARG NE 1 1 4 1268 1 1 18 ARG NH1 N 5.027 10.871 -4.527 1.00 . A A . 18 ARG NH1 1 1 4 1269 1 1 18 ARG NH2 N 6.899 11.759 -3.597 1.00 . A A . 18 ARG NH2 1 1 4 1270 1 1 18 ARG O O 1.401 9.721 1.991 1.00 . A A . 18 ARG O 1 1 4 1271 1 1 19 ALA C C 0.180 11.882 -1.264 1.00 . A A . 19 ALA C 1 1 4 1272 1 1 19 ALA CA C 0.693 11.816 0.190 1.00 . A A . 19 ALA CA 1 1 4 1273 1 1 19 ALA CB C 0.876 13.197 0.835 1.00 . A A . 19 ALA CB 1 1 4 1274 1 1 19 ALA H H 2.646 11.324 -0.418 1.00 . A A . 19 ALA H 1 1 4 1275 1 1 19 ALA HA H -0.045 11.270 0.779 1.00 . A A . 19 ALA HA 1 1 4 1276 1 1 19 ALA HB1 H -0.061 13.752 0.780 1.00 . A A . 19 ALA HB1 1 1 4 1277 1 1 19 ALA HB2 H 1.165 13.075 1.879 1.00 . A A . 19 ALA HB2 1 1 4 1278 1 1 19 ALA HB3 H 1.655 13.745 0.305 1.00 . A A . 19 ALA HB3 1 1 4 1279 1 1 19 ALA N N 1.969 11.081 0.274 1.00 . A A . 19 ALA N 1 1 4 1280 1 1 19 ALA O O 0.024 12.942 -1.867 1.00 . A A . 19 ALA O 1 1 4 1281 1 1 20 PHE C C -1.913 10.700 -3.363 1.00 . A A . 20 PHE C 1 1 4 1282 1 1 20 PHE CA C -0.385 10.505 -3.254 1.00 . A A . 20 PHE CA 1 1 4 1283 1 1 20 PHE CB C 0.110 9.132 -3.764 1.00 . A A . 20 PHE CB 1 1 4 1284 1 1 20 PHE CD1 C -0.473 9.122 -6.246 1.00 . A A . 20 PHE CD1 1 1 4 1285 1 1 20 PHE CD2 C -1.627 7.599 -4.790 1.00 . A A . 20 PHE CD2 1 1 4 1286 1 1 20 PHE CE1 C -1.300 8.733 -7.294 1.00 . A A . 20 PHE CE1 1 1 4 1287 1 1 20 PHE CE2 C -2.467 7.227 -5.833 1.00 . A A . 20 PHE CE2 1 1 4 1288 1 1 20 PHE CG C -0.631 8.556 -4.986 1.00 . A A . 20 PHE CG 1 1 4 1289 1 1 20 PHE CZ C -2.299 7.791 -7.089 1.00 . A A . 20 PHE CZ 1 1 4 1290 1 1 20 PHE H H 0.338 9.859 -1.374 1.00 . A A . 20 PHE H 1 1 4 1291 1 1 20 PHE HA H 0.084 11.269 -3.873 1.00 . A A . 20 PHE HA 1 1 4 1292 1 1 20 PHE HB2 H 1.162 9.235 -4.031 1.00 . A A . 20 PHE HB2 1 1 4 1293 1 1 20 PHE HB3 H 0.033 8.414 -2.947 1.00 . A A . 20 PHE HB3 1 1 4 1294 1 1 20 PHE HD1 H 0.260 9.913 -6.397 1.00 . A A . 20 PHE HD1 1 1 4 1295 1 1 20 PHE HD2 H -1.875 7.282 -3.776 1.00 . A A . 20 PHE HD2 1 1 4 1296 1 1 20 PHE HE1 H -1.134 9.135 -8.294 1.00 . A A . 20 PHE HE1 1 1 4 1297 1 1 20 PHE HE2 H -3.314 6.568 -5.637 1.00 . A A . 20 PHE HE2 1 1 4 1298 1 1 20 PHE HZ H -2.939 7.478 -7.916 1.00 . A A . 20 PHE HZ 1 1 4 1299 1 1 20 PHE N N 0.107 10.696 -1.868 1.00 . A A . 20 PHE N 1 1 4 1300 1 1 20 PHE O O -2.362 11.866 -3.312 1.00 . A A . 20 PHE O 1 1 5 1301 1 1 1 HIS C C -4.823 -13.560 -4.646 1.00 . A A . 1 HIS C 1 1 5 1302 1 1 1 HIS CA C -6.315 -13.391 -5.032 1.00 . A A . 1 HIS CA 1 1 5 1303 1 1 1 HIS CB C -6.418 -12.787 -6.448 1.00 . A A . 1 HIS CB 1 1 5 1304 1 1 1 HIS CD2 C -8.647 -13.557 -7.432 1.00 . A A . 1 HIS CD2 1 1 5 1305 1 1 1 HIS CE1 C -9.755 -11.709 -7.425 1.00 . A A . 1 HIS CE1 1 1 5 1306 1 1 1 HIS CG C -7.850 -12.608 -6.948 1.00 . A A . 1 HIS CG 1 1 5 1307 1 1 1 HIS H1 H -6.589 -12.222 -3.260 1.00 . A A . 1 HIS H1 1 1 5 1308 1 1 1 HIS HA H -6.759 -14.386 -5.067 1.00 . A A . 1 HIS HA 1 1 5 1309 1 1 1 HIS HB2 H -5.924 -11.815 -6.449 1.00 . A A . 1 HIS HB2 1 1 5 1310 1 1 1 HIS HB3 H -5.894 -13.446 -7.140 1.00 . A A . 1 HIS HB3 1 1 5 1311 1 1 1 HIS HD1 H -8.194 -10.567 -6.672 1.00 . A A . 1 HIS HD1 1 1 5 1312 1 1 1 HIS HD2 H -8.386 -14.596 -7.567 1.00 . A A . 1 HIS HD2 1 1 5 1313 1 1 1 HIS HE1 H -10.550 -10.989 -7.550 1.00 . A A . 1 HIS HE1 1 1 5 1314 1 1 1 HIS HE2 H -10.621 -13.483 -8.103 1.00 . A A . 1 HIS HE2 1 1 5 1315 1 1 1 HIS N N -7.086 -12.595 -4.057 1.00 . A A . 1 HIS N 1 1 5 1316 1 1 1 HIS ND1 N -8.542 -11.459 -6.948 1.00 . A A . 1 HIS ND1 1 1 5 1317 1 1 1 HIS NE2 N -9.818 -13.003 -7.721 1.00 . A A . 1 HIS NE2 1 1 5 1318 1 1 1 HIS O O -4.365 -14.663 -4.362 1.00 . A A . 1 HIS O 1 1 5 1319 1 1 2 GLY C C -2.229 -10.887 -4.271 1.00 . A A . 2 GLY C 1 1 5 1320 1 1 2 GLY CA C -2.693 -12.346 -4.223 1.00 . A A . 2 GLY CA 1 1 5 1321 1 1 2 GLY H H -4.526 -11.533 -4.834 1.00 . A A . 2 GLY H 1 1 5 1322 1 1 2 GLY HA2 H -2.567 -12.734 -3.212 1.00 . A A . 2 GLY HA2 1 1 5 1323 1 1 2 GLY HA3 H -2.098 -12.940 -4.917 1.00 . A A . 2 GLY HA3 1 1 5 1324 1 1 2 GLY N N -4.117 -12.421 -4.606 1.00 . A A . 2 GLY N 1 1 5 1325 1 1 2 GLY O O -2.634 -10.089 -3.429 1.00 . A A . 2 GLY O 1 1 5 1326 1 1 3 LEU C C -2.355 -8.045 -5.641 1.00 . A A . 3 LEU C 1 1 5 1327 1 1 3 LEU CA C -1.285 -9.146 -5.766 1.00 . A A . 3 LEU CA 1 1 5 1328 1 1 3 LEU CB C -0.618 -9.062 -7.148 1.00 . A A . 3 LEU CB 1 1 5 1329 1 1 3 LEU CD1 C -1.035 -8.451 -9.534 1.00 . A A . 3 LEU CD1 1 1 5 1330 1 1 3 LEU CD2 C -1.768 -10.697 -8.710 1.00 . A A . 3 LEU CD2 1 1 5 1331 1 1 3 LEU CG C -1.578 -9.226 -8.335 1.00 . A A . 3 LEU CG 1 1 5 1332 1 1 3 LEU H H -1.667 -11.175 -6.204 1.00 . A A . 3 LEU H 1 1 5 1333 1 1 3 LEU HA H -0.513 -8.916 -5.032 1.00 . A A . 3 LEU HA 1 1 5 1334 1 1 3 LEU HB2 H -0.136 -8.088 -7.233 1.00 . A A . 3 LEU HB2 1 1 5 1335 1 1 3 LEU HB3 H 0.147 -9.835 -7.211 1.00 . A A . 3 LEU HB3 1 1 5 1336 1 1 3 LEU HD11 H -1.714 -8.565 -10.379 1.00 . A A . 3 LEU HD11 1 1 5 1337 1 1 3 LEU HD12 H -0.053 -8.840 -9.804 1.00 . A A . 3 LEU HD12 1 1 5 1338 1 1 3 LEU HD13 H -0.949 -7.395 -9.277 1.00 . A A . 3 LEU HD13 1 1 5 1339 1 1 3 LEU HD21 H -2.473 -10.773 -9.538 1.00 . A A . 3 LEU HD21 1 1 5 1340 1 1 3 LEU HD22 H -2.156 -11.245 -7.851 1.00 . A A . 3 LEU HD22 1 1 5 1341 1 1 3 LEU HD23 H -0.810 -11.122 -9.010 1.00 . A A . 3 LEU HD23 1 1 5 1342 1 1 3 LEU HG H -2.547 -8.808 -8.060 1.00 . A A . 3 LEU HG 1 1 5 1343 1 1 3 LEU N N -1.768 -10.513 -5.462 1.00 . A A . 3 LEU N 1 1 5 1344 1 1 3 LEU O O -2.089 -6.980 -5.089 1.00 . A A . 3 LEU O 1 1 5 1345 1 1 4 ALA C C -5.015 -7.079 -4.429 1.00 . A A . 4 ALA C 1 1 5 1346 1 1 4 ALA CA C -4.777 -7.528 -5.886 1.00 . A A . 4 ALA CA 1 1 5 1347 1 1 4 ALA CB C -6.004 -8.271 -6.422 1.00 . A A . 4 ALA CB 1 1 5 1348 1 1 4 ALA H H -3.740 -9.226 -6.554 1.00 . A A . 4 ALA H 1 1 5 1349 1 1 4 ALA HA H -4.628 -6.637 -6.494 1.00 . A A . 4 ALA HA 1 1 5 1350 1 1 4 ALA HB1 H -5.821 -8.581 -7.451 1.00 . A A . 4 ALA HB1 1 1 5 1351 1 1 4 ALA HB2 H -6.871 -7.611 -6.390 1.00 . A A . 4 ALA HB2 1 1 5 1352 1 1 4 ALA HB3 H -6.195 -9.150 -5.806 1.00 . A A . 4 ALA HB3 1 1 5 1353 1 1 4 ALA N N -3.585 -8.390 -6.034 1.00 . A A . 4 ALA N 1 1 5 1354 1 1 4 ALA O O -5.513 -5.986 -4.184 1.00 . A A . 4 ALA O 1 1 5 1355 1 1 5 SER C C -3.175 -7.187 -1.493 1.00 . A A . 5 SER C 1 1 5 1356 1 1 5 SER CA C -4.540 -7.646 -2.049 1.00 . A A . 5 SER CA 1 1 5 1357 1 1 5 SER CB C -4.987 -8.924 -1.339 1.00 . A A . 5 SER CB 1 1 5 1358 1 1 5 SER H H -3.950 -8.679 -3.769 1.00 . A A . 5 SER H 1 1 5 1359 1 1 5 SER HA H -5.274 -6.865 -1.849 1.00 . A A . 5 SER HA 1 1 5 1360 1 1 5 SER HB2 H -5.707 -9.456 -1.961 1.00 . A A . 5 SER HB2 1 1 5 1361 1 1 5 SER HB3 H -4.122 -9.561 -1.153 1.00 . A A . 5 SER HB3 1 1 5 1362 1 1 5 SER HG H -5.839 -9.388 0.418 1.00 . A A . 5 SER HG 1 1 5 1363 1 1 5 SER N N -4.498 -7.887 -3.504 1.00 . A A . 5 SER N 1 1 5 1364 1 1 5 SER O O -3.108 -6.478 -0.492 1.00 . A A . 5 SER O 1 1 5 1365 1 1 5 SER OG O -5.595 -8.568 -0.098 1.00 . A A . 5 SER OG 1 1 5 1366 1 1 6 THR C C -0.644 -5.486 -1.943 1.00 . A A . 6 THR C 1 1 5 1367 1 1 6 THR CA C -0.715 -7.027 -1.897 1.00 . A A . 6 THR CA 1 1 5 1368 1 1 6 THR CB C 0.284 -7.667 -2.881 1.00 . A A . 6 THR CB 1 1 5 1369 1 1 6 THR CG2 C 1.749 -7.373 -2.536 1.00 . A A . 6 THR CG2 1 1 5 1370 1 1 6 THR H H -2.088 -8.290 -2.833 1.00 . A A . 6 THR H 1 1 5 1371 1 1 6 THR HA H -0.442 -7.344 -0.890 1.00 . A A . 6 THR HA 1 1 5 1372 1 1 6 THR HB H 0.080 -7.286 -3.882 1.00 . A A . 6 THR HB 1 1 5 1373 1 1 6 THR HG1 H 0.819 -9.527 -3.406 1.00 . A A . 6 THR HG1 1 1 5 1374 1 1 6 THR HG21 H 1.917 -6.297 -2.551 1.00 . A A . 6 THR HG21 1 1 5 1375 1 1 6 THR HG22 H 2.398 -7.854 -3.268 1.00 . A A . 6 THR HG22 1 1 5 1376 1 1 6 THR HG23 H 1.973 -7.761 -1.542 1.00 . A A . 6 THR HG23 1 1 5 1377 1 1 6 THR N N -2.082 -7.533 -2.178 1.00 . A A . 6 THR N 1 1 5 1378 1 1 6 THR O O 0.094 -4.868 -1.175 1.00 . A A . 6 THR O 1 1 5 1379 1 1 6 THR OG1 O 0.087 -9.087 -2.882 1.00 . A A . 6 THR OG1 1 1 5 1380 1 1 7 LEU C C -2.780 -2.885 -1.818 1.00 . A A . 7 LEU C 1 1 5 1381 1 1 7 LEU CA C -1.721 -3.422 -2.801 1.00 . A A . 7 LEU CA 1 1 5 1382 1 1 7 LEU CB C -2.120 -3.052 -4.233 1.00 . A A . 7 LEU CB 1 1 5 1383 1 1 7 LEU CD1 C -1.711 -3.588 -6.635 1.00 . A A . 7 LEU CD1 1 1 5 1384 1 1 7 LEU CD2 C 0.058 -2.384 -5.330 1.00 . A A . 7 LEU CD2 1 1 5 1385 1 1 7 LEU CG C -1.053 -3.436 -5.264 1.00 . A A . 7 LEU CG 1 1 5 1386 1 1 7 LEU H H -2.134 -5.409 -3.341 1.00 . A A . 7 LEU H 1 1 5 1387 1 1 7 LEU HA H -0.768 -2.945 -2.575 1.00 . A A . 7 LEU HA 1 1 5 1388 1 1 7 LEU HB2 H -3.051 -3.560 -4.483 1.00 . A A . 7 LEU HB2 1 1 5 1389 1 1 7 LEU HB3 H -2.281 -1.976 -4.283 1.00 . A A . 7 LEU HB3 1 1 5 1390 1 1 7 LEU HD11 H -0.957 -3.861 -7.373 1.00 . A A . 7 LEU HD11 1 1 5 1391 1 1 7 LEU HD12 H -2.174 -2.644 -6.922 1.00 . A A . 7 LEU HD12 1 1 5 1392 1 1 7 LEU HD13 H -2.472 -4.367 -6.589 1.00 . A A . 7 LEU HD13 1 1 5 1393 1 1 7 LEU HD21 H -0.367 -1.426 -5.632 1.00 . A A . 7 LEU HD21 1 1 5 1394 1 1 7 LEU HD22 H 0.520 -2.282 -4.348 1.00 . A A . 7 LEU HD22 1 1 5 1395 1 1 7 LEU HD23 H 0.809 -2.694 -6.056 1.00 . A A . 7 LEU HD23 1 1 5 1396 1 1 7 LEU HG H -0.615 -4.391 -4.977 1.00 . A A . 7 LEU HG 1 1 5 1397 1 1 7 LEU N N -1.540 -4.887 -2.729 1.00 . A A . 7 LEU N 1 1 5 1398 1 1 7 LEU O O -3.028 -1.687 -1.780 1.00 . A A . 7 LEU O 1 1 5 1399 1 1 8 THR C C -3.546 -3.410 1.508 1.00 . A A . 8 THR C 1 1 5 1400 1 1 8 THR CA C -4.247 -3.431 0.130 1.00 . A A . 8 THR CA 1 1 5 1401 1 1 8 THR CB C -5.401 -4.456 0.067 1.00 . A A . 8 THR CB 1 1 5 1402 1 1 8 THR CG2 C -6.531 -4.213 1.073 1.00 . A A . 8 THR CG2 1 1 5 1403 1 1 8 THR H H -3.125 -4.739 -1.042 1.00 . A A . 8 THR H 1 1 5 1404 1 1 8 THR HA H -4.656 -2.439 -0.063 1.00 . A A . 8 THR HA 1 1 5 1405 1 1 8 THR HB H -4.985 -5.446 0.254 1.00 . A A . 8 THR HB 1 1 5 1406 1 1 8 THR HG1 H -6.788 -4.973 -1.290 1.00 . A A . 8 THR HG1 1 1 5 1407 1 1 8 THR HG21 H -6.972 -3.233 0.895 1.00 . A A . 8 THR HG21 1 1 5 1408 1 1 8 THR HG22 H -7.295 -4.982 0.954 1.00 . A A . 8 THR HG22 1 1 5 1409 1 1 8 THR HG23 H -6.130 -4.254 2.085 1.00 . A A . 8 THR HG23 1 1 5 1410 1 1 8 THR N N -3.276 -3.754 -0.940 1.00 . A A . 8 THR N 1 1 5 1411 1 1 8 THR O O -4.075 -2.885 2.485 1.00 . A A . 8 THR O 1 1 5 1412 1 1 8 THR OG1 O -5.941 -4.442 -1.260 1.00 . A A . 8 THR OG1 1 1 5 1413 1 1 9 ARG C C -0.329 -2.890 2.703 1.00 . A A . 9 ARG C 1 1 5 1414 1 1 9 ARG CA C -1.466 -3.921 2.756 1.00 . A A . 9 ARG CA 1 1 5 1415 1 1 9 ARG CB C -0.889 -5.310 3.033 1.00 . A A . 9 ARG CB 1 1 5 1416 1 1 9 ARG CD C -1.376 -7.362 4.373 1.00 . A A . 9 ARG CD 1 1 5 1417 1 1 9 ARG CG C -1.985 -6.267 3.496 1.00 . A A . 9 ARG CG 1 1 5 1418 1 1 9 ARG CZ C -0.471 -9.102 2.785 1.00 . A A . 9 ARG CZ 1 1 5 1419 1 1 9 ARG H H -1.956 -4.434 0.770 1.00 . A A . 9 ARG H 1 1 5 1420 1 1 9 ARG HA H -2.103 -3.659 3.601 1.00 . A A . 9 ARG HA 1 1 5 1421 1 1 9 ARG HB2 H -0.434 -5.698 2.122 1.00 . A A . 9 ARG HB2 1 1 5 1422 1 1 9 ARG HB3 H -0.129 -5.233 3.810 1.00 . A A . 9 ARG HB3 1 1 5 1423 1 1 9 ARG HD2 H -0.355 -7.082 4.629 1.00 . A A . 9 ARG HD2 1 1 5 1424 1 1 9 ARG HD3 H -1.961 -7.452 5.288 1.00 . A A . 9 ARG HD3 1 1 5 1425 1 1 9 ARG HE H -2.096 -9.277 3.947 1.00 . A A . 9 ARG HE 1 1 5 1426 1 1 9 ARG HG2 H -2.730 -5.715 4.070 1.00 . A A . 9 ARG HG2 1 1 5 1427 1 1 9 ARG HG3 H -2.461 -6.721 2.628 1.00 . A A . 9 ARG HG3 1 1 5 1428 1 1 9 ARG HH11 H 0.681 -7.456 2.749 1.00 . A A . 9 ARG HH11 1 1 5 1429 1 1 9 ARG HH12 H 1.199 -8.736 1.701 1.00 . A A . 9 ARG HH12 1 1 5 1430 1 1 9 ARG HH21 H -1.351 -10.907 2.602 1.00 . A A . 9 ARG HH21 1 1 5 1431 1 1 9 ARG HH22 H 0.056 -10.659 1.626 1.00 . A A . 9 ARG HH22 1 1 5 1432 1 1 9 ARG N N -2.315 -3.924 1.549 1.00 . A A . 9 ARG N 1 1 5 1433 1 1 9 ARG NE N -1.356 -8.663 3.685 1.00 . A A . 9 ARG NE 1 1 5 1434 1 1 9 ARG NH1 N 0.557 -8.371 2.372 1.00 . A A . 9 ARG NH1 1 1 5 1435 1 1 9 ARG NH2 N -0.605 -10.322 2.293 1.00 . A A . 9 ARG NH2 1 1 5 1436 1 1 9 ARG O O -0.252 -2.010 3.557 1.00 . A A . 9 ARG O 1 1 5 1437 1 1 10 TRP C C 0.922 -0.490 1.276 1.00 . A A . 10 TRP C 1 1 5 1438 1 1 10 TRP CA C 1.516 -1.913 1.399 1.00 . A A . 10 TRP CA 1 1 5 1439 1 1 10 TRP CB C 2.368 -2.364 0.198 1.00 . A A . 10 TRP CB 1 1 5 1440 1 1 10 TRP CD1 C 1.999 -1.117 -1.977 1.00 . A A . 10 TRP CD1 1 1 5 1441 1 1 10 TRP CD2 C 3.574 -0.235 -0.719 1.00 . A A . 10 TRP CD2 1 1 5 1442 1 1 10 TRP CE2 C 3.416 0.536 -1.858 1.00 . A A . 10 TRP CE2 1 1 5 1443 1 1 10 TRP CE3 C 4.505 0.117 0.248 1.00 . A A . 10 TRP CE3 1 1 5 1444 1 1 10 TRP CG C 2.662 -1.277 -0.826 1.00 . A A . 10 TRP CG 1 1 5 1445 1 1 10 TRP CH2 C 5.129 2.031 -1.077 1.00 . A A . 10 TRP CH2 1 1 5 1446 1 1 10 TRP CZ2 C 4.203 1.661 -2.046 1.00 . A A . 10 TRP CZ2 1 1 5 1447 1 1 10 TRP CZ3 C 5.273 1.264 0.078 1.00 . A A . 10 TRP CZ3 1 1 5 1448 1 1 10 TRP H H 0.554 -3.756 1.067 1.00 . A A . 10 TRP H 1 1 5 1449 1 1 10 TRP HA H 2.178 -1.902 2.265 1.00 . A A . 10 TRP HA 1 1 5 1450 1 1 10 TRP HB2 H 3.319 -2.736 0.579 1.00 . A A . 10 TRP HB2 1 1 5 1451 1 1 10 TRP HB3 H 1.852 -3.183 -0.304 1.00 . A A . 10 TRP HB3 1 1 5 1452 1 1 10 TRP HD1 H 1.210 -1.764 -2.336 1.00 . A A . 10 TRP HD1 1 1 5 1453 1 1 10 TRP HE1 H 2.150 0.293 -3.490 1.00 . A A . 10 TRP HE1 1 1 5 1454 1 1 10 TRP HE3 H 4.717 -0.554 1.082 1.00 . A A . 10 TRP HE3 1 1 5 1455 1 1 10 TRP HH2 H 5.718 2.937 -1.201 1.00 . A A . 10 TRP HH2 1 1 5 1456 1 1 10 TRP HZ2 H 4.182 2.194 -2.997 1.00 . A A . 10 TRP HZ2 1 1 5 1457 1 1 10 TRP HZ3 H 5.930 1.608 0.876 1.00 . A A . 10 TRP HZ3 1 1 5 1458 1 1 10 TRP N N 0.495 -2.950 1.658 1.00 . A A . 10 TRP N 1 1 5 1459 1 1 10 TRP NE1 N 2.457 -0.022 -2.598 1.00 . A A . 10 TRP NE1 1 1 5 1460 1 1 10 TRP O O 1.513 0.478 1.761 1.00 . A A . 10 TRP O 1 1 5 1461 1 1 11 ALA C C -1.587 1.355 2.120 1.00 . A A . 11 ALA C 1 1 5 1462 1 1 11 ALA CA C -1.104 0.839 0.748 1.00 . A A . 11 ALA CA 1 1 5 1463 1 1 11 ALA CB C -2.304 0.687 -0.183 1.00 . A A . 11 ALA CB 1 1 5 1464 1 1 11 ALA H H -0.821 -1.235 0.507 1.00 . A A . 11 ALA H 1 1 5 1465 1 1 11 ALA HA H -0.456 1.604 0.322 1.00 . A A . 11 ALA HA 1 1 5 1466 1 1 11 ALA HB1 H -2.884 1.610 -0.181 1.00 . A A . 11 ALA HB1 1 1 5 1467 1 1 11 ALA HB2 H -1.955 0.479 -1.194 1.00 . A A . 11 ALA HB2 1 1 5 1468 1 1 11 ALA HB3 H -2.929 -0.136 0.162 1.00 . A A . 11 ALA HB3 1 1 5 1469 1 1 11 ALA N N -0.325 -0.420 0.805 1.00 . A A . 11 ALA N 1 1 5 1470 1 1 11 ALA O O -2.128 2.454 2.221 1.00 . A A . 11 ALA O 1 1 5 1471 1 1 12 HIS C C -0.202 1.326 5.335 1.00 . A A . 12 HIS C 1 1 5 1472 1 1 12 HIS CA C -1.503 1.000 4.572 1.00 . A A . 12 HIS CA 1 1 5 1473 1 1 12 HIS CB C -2.245 -0.162 5.243 1.00 . A A . 12 HIS CB 1 1 5 1474 1 1 12 HIS CD2 C -4.637 0.344 4.443 1.00 . A A . 12 HIS CD2 1 1 5 1475 1 1 12 HIS CE1 C -5.658 0.366 6.336 1.00 . A A . 12 HIS CE1 1 1 5 1476 1 1 12 HIS CG C -3.737 0.096 5.392 1.00 . A A . 12 HIS CG 1 1 5 1477 1 1 12 HIS H H -0.781 -0.266 3.071 1.00 . A A . 12 HIS H 1 1 5 1478 1 1 12 HIS HA H -2.146 1.880 4.584 1.00 . A A . 12 HIS HA 1 1 5 1479 1 1 12 HIS HB2 H -2.105 -1.059 4.639 1.00 . A A . 12 HIS HB2 1 1 5 1480 1 1 12 HIS HB3 H -1.815 -0.332 6.231 1.00 . A A . 12 HIS HB3 1 1 5 1481 1 1 12 HIS HD1 H -3.959 -0.071 7.454 1.00 . A A . 12 HIS HD1 1 1 5 1482 1 1 12 HIS HD2 H -4.439 0.397 3.383 1.00 . A A . 12 HIS HD2 1 1 5 1483 1 1 12 HIS HE1 H -6.435 0.444 7.081 1.00 . A A . 12 HIS HE1 1 1 5 1484 1 1 12 HIS HE2 H -6.689 0.723 4.552 1.00 . A A . 12 HIS HE2 1 1 5 1485 1 1 12 HIS N N -1.245 0.618 3.170 1.00 . A A . 12 HIS N 1 1 5 1486 1 1 12 HIS ND1 N -4.381 0.105 6.573 1.00 . A A . 12 HIS ND1 1 1 5 1487 1 1 12 HIS NE2 N -5.821 0.516 5.023 1.00 . A A . 12 HIS NE2 1 1 5 1488 1 1 12 HIS O O -0.203 1.476 6.555 1.00 . A A . 12 HIS O 1 1 5 1489 1 1 13 TYR C C 2.742 3.136 4.536 1.00 . A A . 13 TYR C 1 1 5 1490 1 1 13 TYR CA C 2.217 1.808 5.103 1.00 . A A . 13 TYR CA 1 1 5 1491 1 1 13 TYR CB C 3.140 0.648 4.726 1.00 . A A . 13 TYR CB 1 1 5 1492 1 1 13 TYR CD1 C 3.738 -0.456 6.880 1.00 . A A . 13 TYR CD1 1 1 5 1493 1 1 13 TYR CD2 C 5.420 0.909 5.818 1.00 . A A . 13 TYR CD2 1 1 5 1494 1 1 13 TYR CE1 C 4.630 -0.787 7.886 1.00 . A A . 13 TYR CE1 1 1 5 1495 1 1 13 TYR CE2 C 6.316 0.576 6.824 1.00 . A A . 13 TYR CE2 1 1 5 1496 1 1 13 TYR CG C 4.135 0.380 5.847 1.00 . A A . 13 TYR CG 1 1 5 1497 1 1 13 TYR CZ C 5.915 -0.262 7.857 1.00 . A A . 13 TYR CZ 1 1 5 1498 1 1 13 TYR H H 0.846 1.284 3.597 1.00 . A A . 13 TYR H 1 1 5 1499 1 1 13 TYR HA H 2.162 1.881 6.189 1.00 . A A . 13 TYR HA 1 1 5 1500 1 1 13 TYR HB2 H 2.541 -0.247 4.555 1.00 . A A . 13 TYR HB2 1 1 5 1501 1 1 13 TYR HB3 H 3.682 0.899 3.815 1.00 . A A . 13 TYR HB3 1 1 5 1502 1 1 13 TYR HD1 H 2.713 -0.825 6.912 1.00 . A A . 13 TYR HD1 1 1 5 1503 1 1 13 TYR HD2 H 5.720 1.590 5.022 1.00 . A A . 13 TYR HD2 1 1 5 1504 1 1 13 TYR HE1 H 4.331 -1.520 8.637 1.00 . A A . 13 TYR HE1 1 1 5 1505 1 1 13 TYR HE2 H 7.352 0.910 6.755 1.00 . A A . 13 TYR HE2 1 1 5 1506 1 1 13 TYR HH H 6.318 -1.130 9.529 1.00 . A A . 13 TYR HH 1 1 5 1507 1 1 13 TYR N N 0.875 1.501 4.572 1.00 . A A . 13 TYR N 1 1 5 1508 1 1 13 TYR O O 2.815 4.146 5.236 1.00 . A A . 13 TYR O 1 1 5 1509 1 1 13 TYR OH O 6.785 -0.558 8.858 1.00 . A A . 13 TYR OH 1 1 5 1510 1 1 14 ASN C C 2.293 5.505 2.590 1.00 . A A . 14 ASN C 1 1 5 1511 1 1 14 ASN CA C 3.302 4.350 2.453 1.00 . A A . 14 ASN CA 1 1 5 1512 1 1 14 ASN CB C 3.482 4.001 0.977 1.00 . A A . 14 ASN CB 1 1 5 1513 1 1 14 ASN CG C 4.259 5.098 0.254 1.00 . A A . 14 ASN CG 1 1 5 1514 1 1 14 ASN H H 2.951 2.293 2.685 1.00 . A A . 14 ASN H 1 1 5 1515 1 1 14 ASN HA H 4.261 4.700 2.832 1.00 . A A . 14 ASN HA 1 1 5 1516 1 1 14 ASN HB2 H 4.026 3.060 0.894 1.00 . A A . 14 ASN HB2 1 1 5 1517 1 1 14 ASN HB3 H 2.502 3.892 0.513 1.00 . A A . 14 ASN HB3 1 1 5 1518 1 1 14 ASN HD21 H 3.249 4.803 -1.478 1.00 . A A . 14 ASN HD21 1 1 5 1519 1 1 14 ASN HD22 H 4.454 6.076 -1.419 1.00 . A A . 14 ASN HD22 1 1 5 1520 1 1 14 ASN N N 2.930 3.143 3.216 1.00 . A A . 14 ASN N 1 1 5 1521 1 1 14 ASN ND2 N 3.968 5.304 -1.012 1.00 . A A . 14 ASN ND2 1 1 5 1522 1 1 14 ASN O O 2.631 6.650 2.329 1.00 . A A . 14 ASN O 1 1 5 1523 1 1 14 ASN OD1 O 5.136 5.750 0.797 1.00 . A A . 14 ASN OD1 1 1 5 1524 1 1 15 ALA C C 0.683 7.313 4.415 1.00 . A A . 15 ALA C 1 1 5 1525 1 1 15 ALA CA C 0.097 6.224 3.487 1.00 . A A . 15 ALA CA 1 1 5 1526 1 1 15 ALA CB C -1.074 5.511 4.164 1.00 . A A . 15 ALA CB 1 1 5 1527 1 1 15 ALA H H 0.836 4.268 3.293 1.00 . A A . 15 ALA H 1 1 5 1528 1 1 15 ALA HA H -0.272 6.707 2.582 1.00 . A A . 15 ALA HA 1 1 5 1529 1 1 15 ALA HB1 H -1.825 6.244 4.458 1.00 . A A . 15 ALA HB1 1 1 5 1530 1 1 15 ALA HB2 H -0.716 4.984 5.048 1.00 . A A . 15 ALA HB2 1 1 5 1531 1 1 15 ALA HB3 H -1.516 4.797 3.469 1.00 . A A . 15 ALA HB3 1 1 5 1532 1 1 15 ALA N N 1.099 5.208 3.098 1.00 . A A . 15 ALA N 1 1 5 1533 1 1 15 ALA O O 0.312 8.478 4.309 1.00 . A A . 15 ALA O 1 1 5 1534 1 1 16 LEU C C 3.862 8.249 5.424 1.00 . A A . 16 LEU C 1 1 5 1535 1 1 16 LEU CA C 2.502 7.849 6.026 1.00 . A A . 16 LEU CA 1 1 5 1536 1 1 16 LEU CB C 2.713 7.266 7.427 1.00 . A A . 16 LEU CB 1 1 5 1537 1 1 16 LEU CD1 C 0.432 6.433 8.201 1.00 . A A . 16 LEU CD1 1 1 5 1538 1 1 16 LEU CD2 C 1.995 7.619 9.801 1.00 . A A . 16 LEU CD2 1 1 5 1539 1 1 16 LEU CG C 1.513 7.506 8.354 1.00 . A A . 16 LEU CG 1 1 5 1540 1 1 16 LEU H H 2.029 5.983 5.174 1.00 . A A . 16 LEU H 1 1 5 1541 1 1 16 LEU HA H 1.919 8.763 6.142 1.00 . A A . 16 LEU HA 1 1 5 1542 1 1 16 LEU HB2 H 2.884 6.193 7.341 1.00 . A A . 16 LEU HB2 1 1 5 1543 1 1 16 LEU HB3 H 3.594 7.731 7.869 1.00 . A A . 16 LEU HB3 1 1 5 1544 1 1 16 LEU HD11 H 0.115 6.382 7.160 1.00 . A A . 16 LEU HD11 1 1 5 1545 1 1 16 LEU HD12 H 0.834 5.466 8.506 1.00 . A A . 16 LEU HD12 1 1 5 1546 1 1 16 LEU HD13 H -0.422 6.686 8.829 1.00 . A A . 16 LEU HD13 1 1 5 1547 1 1 16 LEU HD21 H 2.497 6.695 10.090 1.00 . A A . 16 LEU HD21 1 1 5 1548 1 1 16 LEU HD22 H 1.141 7.789 10.456 1.00 . A A . 16 LEU HD22 1 1 5 1549 1 1 16 LEU HD23 H 2.691 8.453 9.888 1.00 . A A . 16 LEU HD23 1 1 5 1550 1 1 16 LEU HG H 1.070 8.462 8.079 1.00 . A A . 16 LEU HG 1 1 5 1551 1 1 16 LEU N N 1.714 6.933 5.173 1.00 . A A . 16 LEU N 1 1 5 1552 1 1 16 LEU O O 4.323 9.366 5.638 1.00 . A A . 16 LEU O 1 1 5 1553 1 1 17 ILE C C 5.477 8.287 2.536 1.00 . A A . 17 ILE C 1 1 5 1554 1 1 17 ILE CA C 5.725 7.588 3.902 1.00 . A A . 17 ILE CA 1 1 5 1555 1 1 17 ILE CB C 6.483 6.243 3.730 1.00 . A A . 17 ILE CB 1 1 5 1556 1 1 17 ILE CD1 C 7.072 5.945 6.272 1.00 . A A . 17 ILE CD1 1 1 5 1557 1 1 17 ILE CG1 C 6.480 5.344 4.986 1.00 . A A . 17 ILE CG1 1 1 5 1558 1 1 17 ILE CG2 C 7.929 6.427 3.235 1.00 . A A . 17 ILE CG2 1 1 5 1559 1 1 17 ILE H H 4.066 6.444 4.490 1.00 . A A . 17 ILE H 1 1 5 1560 1 1 17 ILE HA H 6.343 8.248 4.511 1.00 . A A . 17 ILE HA 1 1 5 1561 1 1 17 ILE HB H 5.957 5.689 2.953 1.00 . A A . 17 ILE HB 1 1 5 1562 1 1 17 ILE HD11 H 6.510 6.838 6.547 1.00 . A A . 17 ILE HD11 1 1 5 1563 1 1 17 ILE HD12 H 7.009 5.214 7.077 1.00 . A A . 17 ILE HD12 1 1 5 1564 1 1 17 ILE HD13 H 8.115 6.210 6.102 1.00 . A A . 17 ILE HD13 1 1 5 1565 1 1 17 ILE HG12 H 5.451 5.050 5.191 1.00 . A A . 17 ILE HG12 1 1 5 1566 1 1 17 ILE HG13 H 7.050 4.446 4.749 1.00 . A A . 17 ILE HG13 1 1 5 1567 1 1 17 ILE HG21 H 7.932 7.061 2.349 1.00 . A A . 17 ILE HG21 1 1 5 1568 1 1 17 ILE HG22 H 8.354 5.454 2.987 1.00 . A A . 17 ILE HG22 1 1 5 1569 1 1 17 ILE HG23 H 8.525 6.894 4.019 1.00 . A A . 17 ILE HG23 1 1 5 1570 1 1 17 ILE N N 4.449 7.353 4.628 1.00 . A A . 17 ILE N 1 1 5 1571 1 1 17 ILE O O 6.384 8.416 1.716 1.00 . A A . 17 ILE O 1 1 5 1572 1 1 18 ARG C C 3.478 8.690 -0.012 1.00 . A A . 18 ARG C 1 1 5 1573 1 1 18 ARG CA C 3.781 9.599 1.198 1.00 . A A . 18 ARG CA 1 1 5 1574 1 1 18 ARG CB C 4.773 10.718 0.858 1.00 . A A . 18 ARG CB 1 1 5 1575 1 1 18 ARG CD C 4.754 11.990 -1.298 1.00 . A A . 18 ARG CD 1 1 5 1576 1 1 18 ARG CG C 4.142 11.872 0.096 1.00 . A A . 18 ARG CG 1 1 5 1577 1 1 18 ARG CZ C 3.808 14.246 -1.893 1.00 . A A . 18 ARG CZ 1 1 5 1578 1 1 18 ARG H H 3.554 8.636 3.031 1.00 . A A . 18 ARG H 1 1 5 1579 1 1 18 ARG HA H 2.845 10.075 1.486 1.00 . A A . 18 ARG HA 1 1 5 1580 1 1 18 ARG HB2 H 5.190 11.104 1.788 1.00 . A A . 18 ARG HB2 1 1 5 1581 1 1 18 ARG HB3 H 5.582 10.301 0.257 1.00 . A A . 18 ARG HB3 1 1 5 1582 1 1 18 ARG HD2 H 5.754 11.558 -1.300 1.00 . A A . 18 ARG HD2 1 1 5 1583 1 1 18 ARG HD3 H 4.127 11.469 -2.021 1.00 . A A . 18 ARG HD3 1 1 5 1584 1 1 18 ARG HE H 5.745 13.804 -1.613 1.00 . A A . 18 ARG HE 1 1 5 1585 1 1 18 ARG HG2 H 3.069 11.700 0.006 1.00 . A A . 18 ARG HG2 1 1 5 1586 1 1 18 ARG HG3 H 4.313 12.799 0.643 1.00 . A A . 18 ARG HG3 1 1 5 1587 1 1 18 ARG HH11 H 2.353 12.879 -1.707 1.00 . A A . 18 ARG HH11 1 1 5 1588 1 1 18 ARG HH12 H 1.805 14.476 -2.097 1.00 . A A . 18 ARG HH12 1 1 5 1589 1 1 18 ARG HH21 H 4.993 15.866 -2.086 1.00 . A A . 18 ARG HH21 1 1 5 1590 1 1 18 ARG HH22 H 3.298 16.146 -2.306 1.00 . A A . 18 ARG HH22 1 1 5 1591 1 1 18 ARG N N 4.274 8.853 2.377 1.00 . A A . 18 ARG N 1 1 5 1592 1 1 18 ARG NE N 4.826 13.420 -1.641 1.00 . A A . 18 ARG NE 1 1 5 1593 1 1 18 ARG NH1 N 2.544 13.836 -1.908 1.00 . A A . 18 ARG NH1 1 1 5 1594 1 1 18 ARG NH2 N 4.055 15.525 -2.120 1.00 . A A . 18 ARG NH2 1 1 5 1595 1 1 18 ARG O O 4.362 8.218 -0.726 1.00 . A A . 18 ARG O 1 1 5 1596 1 1 19 ALA C C 0.721 8.464 -2.315 1.00 . A A . 19 ALA C 1 1 5 1597 1 1 19 ALA CA C 1.657 7.686 -1.370 1.00 . A A . 19 ALA CA 1 1 5 1598 1 1 19 ALA CB C 0.960 6.462 -0.758 1.00 . A A . 19 ALA CB 1 1 5 1599 1 1 19 ALA H H 1.483 9.007 0.261 1.00 . A A . 19 ALA H 1 1 5 1600 1 1 19 ALA HA H 2.506 7.332 -1.955 1.00 . A A . 19 ALA HA 1 1 5 1601 1 1 19 ALA HB1 H -0.095 6.685 -0.600 1.00 . A A . 19 ALA HB1 1 1 5 1602 1 1 19 ALA HB2 H 1.426 6.219 0.197 1.00 . A A . 19 ALA HB2 1 1 5 1603 1 1 19 ALA HB3 H 1.055 5.613 -1.434 1.00 . A A . 19 ALA HB3 1 1 5 1604 1 1 19 ALA N N 2.179 8.534 -0.276 1.00 . A A . 19 ALA N 1 1 5 1605 1 1 19 ALA O O -0.472 8.185 -2.444 1.00 . A A . 19 ALA O 1 1 5 1606 1 1 20 PHE C C 1.382 11.015 -4.976 1.00 . A A . 20 PHE C 1 1 5 1607 1 1 20 PHE CA C 0.528 10.357 -3.877 1.00 . A A . 20 PHE CA 1 1 5 1608 1 1 20 PHE CB C -0.129 11.453 -3.022 1.00 . A A . 20 PHE CB 1 1 5 1609 1 1 20 PHE CD1 C -1.777 12.543 -4.605 1.00 . A A . 20 PHE CD1 1 1 5 1610 1 1 20 PHE CD2 C -2.636 11.286 -2.738 1.00 . A A . 20 PHE CD2 1 1 5 1611 1 1 20 PHE CE1 C -3.074 12.863 -4.984 1.00 . A A . 20 PHE CE1 1 1 5 1612 1 1 20 PHE CE2 C -3.934 11.612 -3.119 1.00 . A A . 20 PHE CE2 1 1 5 1613 1 1 20 PHE CG C -1.554 11.753 -3.481 1.00 . A A . 20 PHE CG 1 1 5 1614 1 1 20 PHE CZ C -4.151 12.398 -4.243 1.00 . A A . 20 PHE CZ 1 1 5 1615 1 1 20 PHE H H 2.284 9.630 -2.933 1.00 . A A . 20 PHE H 1 1 5 1616 1 1 20 PHE HA H -0.260 9.777 -4.356 1.00 . A A . 20 PHE HA 1 1 5 1617 1 1 20 PHE HB2 H -0.154 11.122 -1.984 1.00 . A A . 20 PHE HB2 1 1 5 1618 1 1 20 PHE HB3 H 0.467 12.363 -3.092 1.00 . A A . 20 PHE HB3 1 1 5 1619 1 1 20 PHE HD1 H -0.935 12.884 -5.205 1.00 . A A . 20 PHE HD1 1 1 5 1620 1 1 20 PHE HD2 H -2.467 10.658 -1.864 1.00 . A A . 20 PHE HD2 1 1 5 1621 1 1 20 PHE HE1 H -3.243 13.469 -5.874 1.00 . A A . 20 PHE HE1 1 1 5 1622 1 1 20 PHE HE2 H -4.779 11.255 -2.529 1.00 . A A . 20 PHE HE2 1 1 5 1623 1 1 20 PHE HZ H -5.171 12.636 -4.552 1.00 . A A . 20 PHE HZ 1 1 5 1624 1 1 20 PHE N N 1.300 9.456 -2.992 1.00 . A A . 20 PHE N 1 1 5 1625 1 1 20 PHE O O 2.509 11.436 -4.638 1.00 . A A . 20 PHE O 1 1 6 1626 1 1 1 HIS C C -5.361 -13.415 -5.265 1.00 . A A . 1 HIS C 1 1 6 1627 1 1 1 HIS CA C -6.777 -13.134 -5.814 1.00 . A A . 1 HIS CA 1 1 6 1628 1 1 1 HIS CB C -7.859 -13.506 -4.779 1.00 . A A . 1 HIS CB 1 1 6 1629 1 1 1 HIS CD2 C -8.832 -15.834 -5.175 1.00 . A A . 1 HIS CD2 1 1 6 1630 1 1 1 HIS CE1 C -7.653 -17.012 -3.811 1.00 . A A . 1 HIS CE1 1 1 6 1631 1 1 1 HIS CG C -8.000 -15.013 -4.535 1.00 . A A . 1 HIS CG 1 1 6 1632 1 1 1 HIS H1 H -6.312 -14.359 -7.496 1.00 . A A . 1 HIS H1 1 1 6 1633 1 1 1 HIS HA H -6.847 -12.058 -5.973 1.00 . A A . 1 HIS HA 1 1 6 1634 1 1 1 HIS HB2 H -7.606 -13.029 -3.832 1.00 . A A . 1 HIS HB2 1 1 6 1635 1 1 1 HIS HB3 H -8.817 -13.116 -5.120 1.00 . A A . 1 HIS HB3 1 1 6 1636 1 1 1 HIS HD1 H -6.518 -15.407 -3.131 1.00 . A A . 1 HIS HD1 1 1 6 1637 1 1 1 HIS HD2 H -9.558 -15.548 -5.921 1.00 . A A . 1 HIS HD2 1 1 6 1638 1 1 1 HIS HE1 H -7.252 -17.850 -3.262 1.00 . A A . 1 HIS HE1 1 1 6 1639 1 1 1 HIS HE2 H -9.087 -17.900 -5.042 1.00 . A A . 1 HIS HE2 1 1 6 1640 1 1 1 HIS N N -7.041 -13.776 -7.110 1.00 . A A . 1 HIS N 1 1 6 1641 1 1 1 HIS ND1 N -7.278 -15.738 -3.688 1.00 . A A . 1 HIS ND1 1 1 6 1642 1 1 1 HIS NE2 N -8.610 -17.065 -4.732 1.00 . A A . 1 HIS NE2 1 1 6 1643 1 1 1 HIS O O -4.977 -14.562 -5.043 1.00 . A A . 1 HIS O 1 1 6 1644 1 1 2 GLY C C -2.483 -11.049 -4.795 1.00 . A A . 2 GLY C 1 1 6 1645 1 1 2 GLY CA C -3.152 -12.427 -4.782 1.00 . A A . 2 GLY CA 1 1 6 1646 1 1 2 GLY H H -4.871 -11.423 -5.476 1.00 . A A . 2 GLY H 1 1 6 1647 1 1 2 GLY HA2 H -3.121 -12.826 -3.768 1.00 . A A . 2 GLY HA2 1 1 6 1648 1 1 2 GLY HA3 H -2.606 -13.096 -5.447 1.00 . A A . 2 GLY HA3 1 1 6 1649 1 1 2 GLY N N -4.558 -12.345 -5.223 1.00 . A A . 2 GLY N 1 1 6 1650 1 1 2 GLY O O -2.587 -10.291 -3.835 1.00 . A A . 2 GLY O 1 1 6 1651 1 1 3 LEU C C -2.406 -8.163 -6.029 1.00 . A A . 3 LEU C 1 1 6 1652 1 1 3 LEU CA C -1.422 -9.335 -6.214 1.00 . A A . 3 LEU CA 1 1 6 1653 1 1 3 LEU CB C -0.733 -9.232 -7.583 1.00 . A A . 3 LEU CB 1 1 6 1654 1 1 3 LEU CD1 C -1.060 -8.413 -9.918 1.00 . A A . 3 LEU CD1 1 1 6 1655 1 1 3 LEU CD2 C -2.021 -10.631 -9.258 1.00 . A A . 3 LEU CD2 1 1 6 1656 1 1 3 LEU CG C -1.692 -9.214 -8.780 1.00 . A A . 3 LEU CG 1 1 6 1657 1 1 3 LEU H H -1.981 -11.298 -6.757 1.00 . A A . 3 LEU H 1 1 6 1658 1 1 3 LEU HA H -0.643 -9.210 -5.462 1.00 . A A . 3 LEU HA 1 1 6 1659 1 1 3 LEU HB2 H -0.134 -8.321 -7.604 1.00 . A A . 3 LEU HB2 1 1 6 1660 1 1 3 LEU HB3 H -0.067 -10.088 -7.695 1.00 . A A . 3 LEU HB3 1 1 6 1661 1 1 3 LEU HD11 H -1.739 -8.397 -10.771 1.00 . A A . 3 LEU HD11 1 1 6 1662 1 1 3 LEU HD12 H -0.119 -8.879 -10.211 1.00 . A A . 3 LEU HD12 1 1 6 1663 1 1 3 LEU HD13 H -0.873 -7.393 -9.583 1.00 . A A . 3 LEU HD13 1 1 6 1664 1 1 3 LEU HD21 H -2.720 -10.580 -10.093 1.00 . A A . 3 LEU HD21 1 1 6 1665 1 1 3 LEU HD22 H -2.471 -11.195 -8.442 1.00 . A A . 3 LEU HD22 1 1 6 1666 1 1 3 LEU HD23 H -1.105 -11.126 -9.581 1.00 . A A . 3 LEU HD23 1 1 6 1667 1 1 3 LEU HG H -2.618 -8.723 -8.478 1.00 . A A . 3 LEU HG 1 1 6 1668 1 1 3 LEU N N -2.025 -10.664 -5.982 1.00 . A A . 3 LEU N 1 1 6 1669 1 1 3 LEU O O -2.071 -7.160 -5.408 1.00 . A A . 3 LEU O 1 1 6 1670 1 1 4 ALA C C -4.938 -7.062 -4.687 1.00 . A A . 4 ALA C 1 1 6 1671 1 1 4 ALA CA C -4.760 -7.420 -6.177 1.00 . A A . 4 ALA CA 1 1 6 1672 1 1 4 ALA CB C -6.063 -7.973 -6.759 1.00 . A A . 4 ALA CB 1 1 6 1673 1 1 4 ALA H H -3.899 -9.145 -7.012 1.00 . A A . 4 ALA H 1 1 6 1674 1 1 4 ALA HA H -4.520 -6.502 -6.713 1.00 . A A . 4 ALA HA 1 1 6 1675 1 1 4 ALA HB1 H -5.917 -8.219 -7.811 1.00 . A A . 4 ALA HB1 1 1 6 1676 1 1 4 ALA HB2 H -6.352 -8.871 -6.213 1.00 . A A . 4 ALA HB2 1 1 6 1677 1 1 4 ALA HB3 H -6.849 -7.223 -6.669 1.00 . A A . 4 ALA HB3 1 1 6 1678 1 1 4 ALA N N -3.663 -8.382 -6.416 1.00 . A A . 4 ALA N 1 1 6 1679 1 1 4 ALA O O -5.308 -5.942 -4.355 1.00 . A A . 4 ALA O 1 1 6 1680 1 1 5 SER C C -3.085 -7.370 -1.832 1.00 . A A . 5 SER C 1 1 6 1681 1 1 5 SER CA C -4.463 -7.820 -2.360 1.00 . A A . 5 SER CA 1 1 6 1682 1 1 5 SER CB C -4.875 -9.139 -1.701 1.00 . A A . 5 SER CB 1 1 6 1683 1 1 5 SER H H -4.029 -8.800 -4.156 1.00 . A A . 5 SER H 1 1 6 1684 1 1 5 SER HA H -5.196 -7.060 -2.089 1.00 . A A . 5 SER HA 1 1 6 1685 1 1 5 SER HB2 H -5.775 -9.521 -2.183 1.00 . A A . 5 SER HB2 1 1 6 1686 1 1 5 SER HB3 H -4.070 -9.866 -1.805 1.00 . A A . 5 SER HB3 1 1 6 1687 1 1 5 SER HG H -5.371 -9.768 0.144 1.00 . A A . 5 SER HG 1 1 6 1688 1 1 5 SER N N -4.482 -7.976 -3.828 1.00 . A A . 5 SER N 1 1 6 1689 1 1 5 SER O O -3.001 -6.663 -0.828 1.00 . A A . 5 SER O 1 1 6 1690 1 1 5 SER OG O -5.135 -8.912 -0.317 1.00 . A A . 5 SER OG 1 1 6 1691 1 1 6 THR C C -0.566 -5.634 -2.238 1.00 . A A . 6 THR C 1 1 6 1692 1 1 6 THR CA C -0.642 -7.175 -2.267 1.00 . A A . 6 THR CA 1 1 6 1693 1 1 6 THR CB C 0.426 -7.817 -3.188 1.00 . A A . 6 THR CB 1 1 6 1694 1 1 6 THR CG2 C 0.789 -7.065 -4.478 1.00 . A A . 6 THR CG2 1 1 6 1695 1 1 6 THR H H -2.086 -8.201 -3.410 1.00 . A A . 6 THR H 1 1 6 1696 1 1 6 THR HA H -0.420 -7.513 -1.256 1.00 . A A . 6 THR HA 1 1 6 1697 1 1 6 THR HB H 0.079 -8.813 -3.463 1.00 . A A . 6 THR HB 1 1 6 1698 1 1 6 THR HG1 H 2.371 -8.233 -3.034 1.00 . A A . 6 THR HG1 1 1 6 1699 1 1 6 THR HG21 H 0.542 -7.684 -5.341 1.00 . A A . 6 THR HG21 1 1 6 1700 1 1 6 THR HG22 H 1.857 -6.845 -4.482 1.00 . A A . 6 THR HG22 1 1 6 1701 1 1 6 THR HG23 H 0.226 -6.133 -4.525 1.00 . A A . 6 THR HG23 1 1 6 1702 1 1 6 THR N N -2.013 -7.654 -2.580 1.00 . A A . 6 THR N 1 1 6 1703 1 1 6 THR O O 0.128 -5.042 -1.410 1.00 . A A . 6 THR O 1 1 6 1704 1 1 6 THR OG1 O 1.622 -7.961 -2.428 1.00 . A A . 6 THR OG1 1 1 6 1705 1 1 7 LEU C C -2.627 -3.023 -2.077 1.00 . A A . 7 LEU C 1 1 6 1706 1 1 7 LEU CA C -1.586 -3.547 -3.086 1.00 . A A . 7 LEU CA 1 1 6 1707 1 1 7 LEU CB C -1.905 -3.102 -4.525 1.00 . A A . 7 LEU CB 1 1 6 1708 1 1 7 LEU CD1 C -4.029 -1.846 -5.021 1.00 . A A . 7 LEU CD1 1 1 6 1709 1 1 7 LEU CD2 C -3.487 -3.943 -6.294 1.00 . A A . 7 LEU CD2 1 1 6 1710 1 1 7 LEU CG C -3.375 -3.230 -4.949 1.00 . A A . 7 LEU CG 1 1 6 1711 1 1 7 LEU H H -2.052 -5.520 -3.645 1.00 . A A . 7 LEU H 1 1 6 1712 1 1 7 LEU HA H -0.624 -3.111 -2.816 1.00 . A A . 7 LEU HA 1 1 6 1713 1 1 7 LEU HB2 H -1.604 -2.061 -4.638 1.00 . A A . 7 LEU HB2 1 1 6 1714 1 1 7 LEU HB3 H -1.306 -3.709 -5.204 1.00 . A A . 7 LEU HB3 1 1 6 1715 1 1 7 LEU HD11 H -3.941 -1.352 -4.053 1.00 . A A . 7 LEU HD11 1 1 6 1716 1 1 7 LEU HD12 H -3.529 -1.248 -5.782 1.00 . A A . 7 LEU HD12 1 1 6 1717 1 1 7 LEU HD13 H -5.083 -1.955 -5.278 1.00 . A A . 7 LEU HD13 1 1 6 1718 1 1 7 LEU HD21 H -4.538 -4.061 -6.557 1.00 . A A . 7 LEU HD21 1 1 6 1719 1 1 7 LEU HD22 H -3.017 -4.924 -6.226 1.00 . A A . 7 LEU HD22 1 1 6 1720 1 1 7 LEU HD23 H -2.985 -3.352 -7.061 1.00 . A A . 7 LEU HD23 1 1 6 1721 1 1 7 LEU HG H -3.900 -3.822 -4.199 1.00 . A A . 7 LEU HG 1 1 6 1722 1 1 7 LEU N N -1.434 -5.014 -3.043 1.00 . A A . 7 LEU N 1 1 6 1723 1 1 7 LEU O O -2.858 -1.824 -2.009 1.00 . A A . 7 LEU O 1 1 6 1724 1 1 8 THR C C -3.495 -3.563 1.193 1.00 . A A . 8 THR C 1 1 6 1725 1 1 8 THR CA C -4.161 -3.578 -0.201 1.00 . A A . 8 THR CA 1 1 6 1726 1 1 8 THR CB C -5.316 -4.594 -0.267 1.00 . A A . 8 THR CB 1 1 6 1727 1 1 8 THR CG2 C -6.551 -4.147 0.524 1.00 . A A . 8 THR CG2 1 1 6 1728 1 1 8 THR H H -3.041 -4.894 -1.366 1.00 . A A . 8 THR H 1 1 6 1729 1 1 8 THR HA H -4.560 -2.584 -0.405 1.00 . A A . 8 THR HA 1 1 6 1730 1 1 8 THR HB H -4.971 -5.548 0.130 1.00 . A A . 8 THR HB 1 1 6 1731 1 1 8 THR HG1 H -6.501 -5.358 -1.704 1.00 . A A . 8 THR HG1 1 1 6 1732 1 1 8 THR HG21 H -6.284 -4.017 1.573 1.00 . A A . 8 THR HG21 1 1 6 1733 1 1 8 THR HG22 H -7.332 -4.903 0.439 1.00 . A A . 8 THR HG22 1 1 6 1734 1 1 8 THR HG23 H -6.917 -3.202 0.122 1.00 . A A . 8 THR HG23 1 1 6 1735 1 1 8 THR N N -3.161 -3.909 -1.243 1.00 . A A . 8 THR N 1 1 6 1736 1 1 8 THR O O -4.056 -3.050 2.157 1.00 . A A . 8 THR O 1 1 6 1737 1 1 8 THR OG1 O -5.694 -4.772 -1.638 1.00 . A A . 8 THR OG1 1 1 6 1738 1 1 9 ARG C C -0.302 -3.042 2.394 1.00 . A A . 9 ARG C 1 1 6 1739 1 1 9 ARG CA C -1.456 -4.057 2.496 1.00 . A A . 9 ARG CA 1 1 6 1740 1 1 9 ARG CB C -0.902 -5.444 2.817 1.00 . A A . 9 ARG CB 1 1 6 1741 1 1 9 ARG CD C 0.734 -6.570 4.423 1.00 . A A . 9 ARG CD 1 1 6 1742 1 1 9 ARG CG C -0.296 -5.456 4.225 1.00 . A A . 9 ARG CG 1 1 6 1743 1 1 9 ARG CZ C -0.411 -8.773 3.954 1.00 . A A . 9 ARG CZ 1 1 6 1744 1 1 9 ARG H H -1.897 -4.615 0.505 1.00 . A A . 9 ARG H 1 1 6 1745 1 1 9 ARG HA H -2.102 -3.753 3.320 1.00 . A A . 9 ARG HA 1 1 6 1746 1 1 9 ARG HB2 H -1.708 -6.176 2.765 1.00 . A A . 9 ARG HB2 1 1 6 1747 1 1 9 ARG HB3 H -0.131 -5.703 2.090 1.00 . A A . 9 ARG HB3 1 1 6 1748 1 1 9 ARG HD2 H 1.304 -6.692 3.502 1.00 . A A . 9 ARG HD2 1 1 6 1749 1 1 9 ARG HD3 H 1.414 -6.278 5.223 1.00 . A A . 9 ARG HD3 1 1 6 1750 1 1 9 ARG HE H 0.107 -8.062 5.753 1.00 . A A . 9 ARG HE 1 1 6 1751 1 1 9 ARG HG2 H 0.190 -4.497 4.402 1.00 . A A . 9 ARG HG2 1 1 6 1752 1 1 9 ARG HG3 H -1.098 -5.584 4.952 1.00 . A A . 9 ARG HG3 1 1 6 1753 1 1 9 ARG HH11 H -0.124 -7.753 2.250 1.00 . A A . 9 ARG HH11 1 1 6 1754 1 1 9 ARG HH12 H -0.876 -9.301 2.054 1.00 . A A . 9 ARG HH12 1 1 6 1755 1 1 9 ARG HH21 H -0.861 -10.060 5.440 1.00 . A A . 9 ARG HH21 1 1 6 1756 1 1 9 ARG HH22 H -1.293 -10.576 3.846 1.00 . A A . 9 ARG HH22 1 1 6 1757 1 1 9 ARG N N -2.271 -4.089 1.266 1.00 . A A . 9 ARG N 1 1 6 1758 1 1 9 ARG NE N 0.112 -7.861 4.777 1.00 . A A . 9 ARG NE 1 1 6 1759 1 1 9 ARG NH1 N -0.472 -8.602 2.639 1.00 . A A . 9 ARG NH1 1 1 6 1760 1 1 9 ARG NH2 N -0.899 -9.894 4.459 1.00 . A A . 9 ARG NH2 1 1 6 1761 1 1 9 ARG O O -0.195 -2.157 3.238 1.00 . A A . 9 ARG O 1 1 6 1762 1 1 10 TRP C C 1.019 -0.682 0.981 1.00 . A A . 10 TRP C 1 1 6 1763 1 1 10 TRP CA C 1.571 -2.120 1.100 1.00 . A A . 10 TRP CA 1 1 6 1764 1 1 10 TRP CB C 2.447 -2.572 -0.082 1.00 . A A . 10 TRP CB 1 1 6 1765 1 1 10 TRP CD1 C 2.120 -1.336 -2.269 1.00 . A A . 10 TRP CD1 1 1 6 1766 1 1 10 TRP CD2 C 3.687 -0.452 -0.996 1.00 . A A . 10 TRP CD2 1 1 6 1767 1 1 10 TRP CE2 C 3.549 0.298 -2.152 1.00 . A A . 10 TRP CE2 1 1 6 1768 1 1 10 TRP CE3 C 4.585 -0.086 -0.012 1.00 . A A . 10 TRP CE3 1 1 6 1769 1 1 10 TRP CG C 2.760 -1.488 -1.107 1.00 . A A . 10 TRP CG 1 1 6 1770 1 1 10 TRP CH2 C 5.231 1.815 -1.343 1.00 . A A . 10 TRP CH2 1 1 6 1771 1 1 10 TRP CZ2 C 4.341 1.431 -2.332 1.00 . A A . 10 TRP CZ2 1 1 6 1772 1 1 10 TRP CZ3 C 5.353 1.068 -0.176 1.00 . A A . 10 TRP CZ3 1 1 6 1773 1 1 10 TRP H H 0.482 -3.875 0.678 1.00 . A A . 10 TRP H 1 1 6 1774 1 1 10 TRP HA H 2.209 -2.135 1.983 1.00 . A A . 10 TRP HA 1 1 6 1775 1 1 10 TRP HB2 H 3.388 -2.956 0.312 1.00 . A A . 10 TRP HB2 1 1 6 1776 1 1 10 TRP HB3 H 1.930 -3.382 -0.596 1.00 . A A . 10 TRP HB3 1 1 6 1777 1 1 10 TRP HD1 H 1.340 -1.989 -2.640 1.00 . A A . 10 TRP HD1 1 1 6 1778 1 1 10 TRP HE1 H 2.309 0.052 -3.800 1.00 . A A . 10 TRP HE1 1 1 6 1779 1 1 10 TRP HE3 H 4.797 -0.755 0.823 1.00 . A A . 10 TRP HE3 1 1 6 1780 1 1 10 TRP HH2 H 5.837 2.715 -1.476 1.00 . A A . 10 TRP HH2 1 1 6 1781 1 1 10 TRP HZ2 H 4.326 1.962 -3.286 1.00 . A A . 10 TRP HZ2 1 1 6 1782 1 1 10 TRP HZ3 H 6.021 1.397 0.616 1.00 . A A . 10 TRP HZ3 1 1 6 1783 1 1 10 TRP N N 0.505 -3.118 1.334 1.00 . A A . 10 TRP N 1 1 6 1784 1 1 10 TRP NE1 N 2.602 -0.255 -2.897 1.00 . A A . 10 TRP NE1 1 1 6 1785 1 1 10 TRP O O 1.638 0.262 1.476 1.00 . A A . 10 TRP O 1 1 6 1786 1 1 11 ALA C C -1.454 1.223 1.792 1.00 . A A . 11 ALA C 1 1 6 1787 1 1 11 ALA CA C -0.967 0.701 0.427 1.00 . A A . 11 ALA CA 1 1 6 1788 1 1 11 ALA CB C -2.166 0.578 -0.511 1.00 . A A . 11 ALA CB 1 1 6 1789 1 1 11 ALA H H -0.731 -1.379 0.189 1.00 . A A . 11 ALA H 1 1 6 1790 1 1 11 ALA HA H -0.299 1.454 0.008 1.00 . A A . 11 ALA HA 1 1 6 1791 1 1 11 ALA HB1 H -2.712 1.522 -0.528 1.00 . A A . 11 ALA HB1 1 1 6 1792 1 1 11 ALA HB2 H -2.823 -0.216 -0.157 1.00 . A A . 11 ALA HB2 1 1 6 1793 1 1 11 ALA HB3 H -1.818 0.342 -1.516 1.00 . A A . 11 ALA HB3 1 1 6 1794 1 1 11 ALA N N -0.217 -0.574 0.486 1.00 . A A . 11 ALA N 1 1 6 1795 1 1 11 ALA O O -1.992 2.323 1.888 1.00 . A A . 11 ALA O 1 1 6 1796 1 1 12 HIS C C -0.093 1.153 5.016 1.00 . A A . 12 HIS C 1 1 6 1797 1 1 12 HIS CA C -1.399 0.866 4.246 1.00 . A A . 12 HIS CA 1 1 6 1798 1 1 12 HIS CB C -2.187 -0.266 4.917 1.00 . A A . 12 HIS CB 1 1 6 1799 1 1 12 HIS CD2 C -4.422 -0.112 3.638 1.00 . A A . 12 HIS CD2 1 1 6 1800 1 1 12 HIS CE1 C -5.774 0.144 5.293 1.00 . A A . 12 HIS CE1 1 1 6 1801 1 1 12 HIS CG C -3.703 -0.122 4.762 1.00 . A A . 12 HIS CG 1 1 6 1802 1 1 12 HIS H H -0.715 -0.428 2.752 1.00 . A A . 12 HIS H 1 1 6 1803 1 1 12 HIS HA H -2.012 1.768 4.250 1.00 . A A . 12 HIS HA 1 1 6 1804 1 1 12 HIS HB2 H -1.878 -1.215 4.481 1.00 . A A . 12 HIS HB2 1 1 6 1805 1 1 12 HIS HB3 H -1.947 -0.272 5.979 1.00 . A A . 12 HIS HB3 1 1 6 1806 1 1 12 HIS HD1 H -4.284 0.044 6.747 1.00 . A A . 12 HIS HD1 1 1 6 1807 1 1 12 HIS HD2 H -4.035 -0.222 2.636 1.00 . A A . 12 HIS HD2 1 1 6 1808 1 1 12 HIS HE1 H -6.676 0.282 5.870 1.00 . A A . 12 HIS HE1 1 1 6 1809 1 1 12 HIS HE2 H -6.476 0.107 3.326 1.00 . A A . 12 HIS HE2 1 1 6 1810 1 1 12 HIS N N -1.143 0.474 2.846 1.00 . A A . 12 HIS N 1 1 6 1811 1 1 12 HIS ND1 N -4.540 0.033 5.781 1.00 . A A . 12 HIS ND1 1 1 6 1812 1 1 12 HIS NE2 N -5.699 0.056 3.969 1.00 . A A . 12 HIS NE2 1 1 6 1813 1 1 12 HIS O O -0.101 1.334 6.231 1.00 . A A . 12 HIS O 1 1 6 1814 1 1 13 TYR C C 2.872 2.912 4.264 1.00 . A A . 13 TYR C 1 1 6 1815 1 1 13 TYR CA C 2.341 1.566 4.790 1.00 . A A . 13 TYR CA 1 1 6 1816 1 1 13 TYR CB C 3.254 0.413 4.362 1.00 . A A . 13 TYR CB 1 1 6 1817 1 1 13 TYR CD1 C 5.483 0.755 5.528 1.00 . A A . 13 TYR CD1 1 1 6 1818 1 1 13 TYR CD2 C 3.955 -0.922 6.354 1.00 . A A . 13 TYR CD2 1 1 6 1819 1 1 13 TYR CE1 C 6.404 0.389 6.500 1.00 . A A . 13 TYR CE1 1 1 6 1820 1 1 13 TYR CE2 C 4.877 -1.286 7.322 1.00 . A A . 13 TYR CE2 1 1 6 1821 1 1 13 TYR CG C 4.261 0.092 5.453 1.00 . A A . 13 TYR CG 1 1 6 1822 1 1 13 TYR CZ C 6.092 -0.624 7.395 1.00 . A A . 13 TYR CZ 1 1 6 1823 1 1 13 TYR H H 0.961 1.067 3.284 1.00 . A A . 13 TYR H 1 1 6 1824 1 1 13 TYR HA H 2.295 1.600 5.878 1.00 . A A . 13 TYR HA 1 1 6 1825 1 1 13 TYR HB2 H 2.647 -0.469 4.160 1.00 . A A . 13 TYR HB2 1 1 6 1826 1 1 13 TYR HB3 H 3.787 0.698 3.455 1.00 . A A . 13 TYR HB3 1 1 6 1827 1 1 13 TYR HD1 H 5.700 1.579 4.849 1.00 . A A . 13 TYR HD1 1 1 6 1828 1 1 13 TYR HD2 H 2.983 -1.410 6.308 1.00 . A A . 13 TYR HD2 1 1 6 1829 1 1 13 TYR HE1 H 7.392 0.853 6.491 1.00 . A A . 13 TYR HE1 1 1 6 1830 1 1 13 TYR HE2 H 4.666 -2.141 7.968 1.00 . A A . 13 TYR HE2 1 1 6 1831 1 1 13 TYR HH H 7.769 -0.368 8.321 1.00 . A A . 13 TYR HH 1 1 6 1832 1 1 13 TYR N N 0.993 1.295 4.258 1.00 . A A . 13 TYR N 1 1 6 1833 1 1 13 TYR O O 2.928 3.901 4.995 1.00 . A A . 13 TYR O 1 1 6 1834 1 1 13 TYR OH O 6.972 -0.962 8.378 1.00 . A A . 13 TYR OH 1 1 6 1835 1 1 14 ASN C C 2.393 5.301 2.380 1.00 . A A . 14 ASN C 1 1 6 1836 1 1 14 ASN CA C 3.467 4.209 2.244 1.00 . A A . 14 ASN CA 1 1 6 1837 1 1 14 ASN CB C 3.746 3.989 0.751 1.00 . A A . 14 ASN CB 1 1 6 1838 1 1 14 ASN CG C 2.470 3.806 -0.073 1.00 . A A . 14 ASN CG 1 1 6 1839 1 1 14 ASN H H 3.087 2.140 2.381 1.00 . A A . 14 ASN H 1 1 6 1840 1 1 14 ASN HA H 4.383 4.589 2.698 1.00 . A A . 14 ASN HA 1 1 6 1841 1 1 14 ASN HB2 H 4.286 4.855 0.367 1.00 . A A . 14 ASN HB2 1 1 6 1842 1 1 14 ASN HB3 H 4.370 3.104 0.635 1.00 . A A . 14 ASN HB3 1 1 6 1843 1 1 14 ASN HD21 H 2.681 1.791 -0.154 1.00 . A A . 14 ASN HD21 1 1 6 1844 1 1 14 ASN HD22 H 1.227 2.491 -0.810 1.00 . A A . 14 ASN HD22 1 1 6 1845 1 1 14 ASN N N 3.102 2.963 2.950 1.00 . A A . 14 ASN N 1 1 6 1846 1 1 14 ASN ND2 N 2.089 2.577 -0.327 1.00 . A A . 14 ASN ND2 1 1 6 1847 1 1 14 ASN O O 2.666 6.446 2.063 1.00 . A A . 14 ASN O 1 1 6 1848 1 1 14 ASN OD1 O 1.743 4.736 -0.384 1.00 . A A . 14 ASN OD1 1 1 6 1849 1 1 15 ALA C C 0.544 7.112 3.923 1.00 . A A . 15 ALA C 1 1 6 1850 1 1 15 ALA CA C 0.092 5.901 3.078 1.00 . A A . 15 ALA CA 1 1 6 1851 1 1 15 ALA CB C -1.054 5.157 3.766 1.00 . A A . 15 ALA CB 1 1 6 1852 1 1 15 ALA H H 0.962 3.991 3.010 1.00 . A A . 15 ALA H 1 1 6 1853 1 1 15 ALA HA H -0.269 6.271 2.118 1.00 . A A . 15 ALA HA 1 1 6 1854 1 1 15 ALA HB1 H -1.872 5.849 3.962 1.00 . A A . 15 ALA HB1 1 1 6 1855 1 1 15 ALA HB2 H -0.700 4.736 4.708 1.00 . A A . 15 ALA HB2 1 1 6 1856 1 1 15 ALA HB3 H -1.406 4.354 3.118 1.00 . A A . 15 ALA HB3 1 1 6 1857 1 1 15 ALA N N 1.188 4.943 2.822 1.00 . A A . 15 ALA N 1 1 6 1858 1 1 15 ALA O O 0.094 8.233 3.705 1.00 . A A . 15 ALA O 1 1 6 1859 1 1 16 LEU C C 3.604 8.354 4.942 1.00 . A A . 16 LEU C 1 1 6 1860 1 1 16 LEU CA C 2.244 7.923 5.536 1.00 . A A . 16 LEU CA 1 1 6 1861 1 1 16 LEU CB C 2.377 7.393 6.967 1.00 . A A . 16 LEU CB 1 1 6 1862 1 1 16 LEU CD1 C 1.696 8.024 9.283 1.00 . A A . 16 LEU CD1 1 1 6 1863 1 1 16 LEU CD2 C 3.783 8.999 8.323 1.00 . A A . 16 LEU CD2 1 1 6 1864 1 1 16 LEU CG C 2.363 8.523 8.002 1.00 . A A . 16 LEU CG 1 1 6 1865 1 1 16 LEU H H 1.958 5.960 4.822 1.00 . A A . 16 LEU H 1 1 6 1866 1 1 16 LEU HA H 1.594 8.798 5.559 1.00 . A A . 16 LEU HA 1 1 6 1867 1 1 16 LEU HB2 H 1.545 6.719 7.171 1.00 . A A . 16 LEU HB2 1 1 6 1868 1 1 16 LEU HB3 H 3.313 6.840 7.056 1.00 . A A . 16 LEU HB3 1 1 6 1869 1 1 16 LEU HD11 H 1.684 8.825 10.022 1.00 . A A . 16 LEU HD11 1 1 6 1870 1 1 16 LEU HD12 H 0.673 7.718 9.064 1.00 . A A . 16 LEU HD12 1 1 6 1871 1 1 16 LEU HD13 H 2.254 7.174 9.677 1.00 . A A . 16 LEU HD13 1 1 6 1872 1 1 16 LEU HD21 H 4.360 8.172 8.737 1.00 . A A . 16 LEU HD21 1 1 6 1873 1 1 16 LEU HD22 H 4.262 9.355 7.412 1.00 . A A . 16 LEU HD22 1 1 6 1874 1 1 16 LEU HD23 H 3.738 9.810 9.050 1.00 . A A . 16 LEU HD23 1 1 6 1875 1 1 16 LEU HG H 1.789 9.360 7.605 1.00 . A A . 16 LEU HG 1 1 6 1876 1 1 16 LEU N N 1.579 6.881 4.733 1.00 . A A . 16 LEU N 1 1 6 1877 1 1 16 LEU O O 3.954 9.531 4.991 1.00 . A A . 16 LEU O 1 1 6 1878 1 1 17 ILE C C 5.319 8.288 2.158 1.00 . A A . 17 ILE C 1 1 6 1879 1 1 17 ILE CA C 5.575 7.688 3.568 1.00 . A A . 17 ILE CA 1 1 6 1880 1 1 17 ILE CB C 6.408 6.379 3.494 1.00 . A A . 17 ILE CB 1 1 6 1881 1 1 17 ILE CD1 C 6.946 6.297 6.062 1.00 . A A . 17 ILE CD1 1 1 6 1882 1 1 17 ILE CG1 C 6.432 5.569 4.809 1.00 . A A . 17 ILE CG1 1 1 6 1883 1 1 17 ILE CG2 C 7.850 6.608 3.008 1.00 . A A . 17 ILE CG2 1 1 6 1884 1 1 17 ILE H H 3.969 6.488 4.199 1.00 . A A . 17 ILE H 1 1 6 1885 1 1 17 ILE HA H 6.142 8.417 4.148 1.00 . A A . 17 ILE HA 1 1 6 1886 1 1 17 ILE HB H 5.926 5.746 2.749 1.00 . A A . 17 ILE HB 1 1 6 1887 1 1 17 ILE HD11 H 7.973 6.622 5.898 1.00 . A A . 17 ILE HD11 1 1 6 1888 1 1 17 ILE HD12 H 6.912 5.620 6.916 1.00 . A A . 17 ILE HD12 1 1 6 1889 1 1 17 ILE HD13 H 6.317 7.165 6.262 1.00 . A A . 17 ILE HD13 1 1 6 1890 1 1 17 ILE HG12 H 5.419 5.218 5.010 1.00 . A A . 17 ILE HG12 1 1 6 1891 1 1 17 ILE HG13 H 7.068 4.699 4.649 1.00 . A A . 17 ILE HG13 1 1 6 1892 1 1 17 ILE HG21 H 7.835 7.180 2.080 1.00 . A A . 17 ILE HG21 1 1 6 1893 1 1 17 ILE HG22 H 8.405 7.161 3.766 1.00 . A A . 17 ILE HG22 1 1 6 1894 1 1 17 ILE HG23 H 8.332 5.646 2.834 1.00 . A A . 17 ILE HG23 1 1 6 1895 1 1 17 ILE N N 4.298 7.426 4.280 1.00 . A A . 17 ILE N 1 1 6 1896 1 1 17 ILE O O 6.231 8.447 1.350 1.00 . A A . 17 ILE O 1 1 6 1897 1 1 18 ARG C C 4.403 10.551 0.297 1.00 . A A . 18 ARG C 1 1 6 1898 1 1 18 ARG CA C 3.652 9.247 0.595 1.00 . A A . 18 ARG CA 1 1 6 1899 1 1 18 ARG CB C 2.141 9.492 0.616 1.00 . A A . 18 ARG CB 1 1 6 1900 1 1 18 ARG CD C 0.108 9.806 -0.827 1.00 . A A . 18 ARG CD 1 1 6 1901 1 1 18 ARG CG C 1.524 9.236 -0.762 1.00 . A A . 18 ARG CG 1 1 6 1902 1 1 18 ARG CZ C -2.212 8.882 -0.948 1.00 . A A . 18 ARG CZ 1 1 6 1903 1 1 18 ARG H H 3.313 8.376 2.454 1.00 . A A . 18 ARG H 1 1 6 1904 1 1 18 ARG HA H 3.881 8.523 -0.187 1.00 . A A . 18 ARG HA 1 1 6 1905 1 1 18 ARG HB2 H 1.681 8.822 1.342 1.00 . A A . 18 ARG HB2 1 1 6 1906 1 1 18 ARG HB3 H 1.949 10.524 0.908 1.00 . A A . 18 ARG HB3 1 1 6 1907 1 1 18 ARG HD2 H -0.127 10.284 0.124 1.00 . A A . 18 ARG HD2 1 1 6 1908 1 1 18 ARG HD3 H 0.063 10.549 -1.622 1.00 . A A . 18 ARG HD3 1 1 6 1909 1 1 18 ARG HE H -0.527 7.885 -1.428 1.00 . A A . 18 ARG HE 1 1 6 1910 1 1 18 ARG HG2 H 2.139 9.715 -1.525 1.00 . A A . 18 ARG HG2 1 1 6 1911 1 1 18 ARG HG3 H 1.490 8.162 -0.948 1.00 . A A . 18 ARG HG3 1 1 6 1912 1 1 18 ARG HH11 H -2.159 10.766 -0.265 1.00 . A A . 18 ARG HH11 1 1 6 1913 1 1 18 ARG HH12 H -3.746 10.076 -0.376 1.00 . A A . 18 ARG HH12 1 1 6 1914 1 1 18 ARG HH21 H -2.647 7.000 -1.549 1.00 . A A . 18 ARG HH21 1 1 6 1915 1 1 18 ARG HH22 H -4.002 7.977 -1.097 1.00 . A A . 18 ARG HH22 1 1 6 1916 1 1 18 ARG N N 4.076 8.696 1.895 1.00 . A A . 18 ARG N 1 1 6 1917 1 1 18 ARG NE N -0.890 8.752 -1.098 1.00 . A A . 18 ARG NE 1 1 6 1918 1 1 18 ARG NH1 N -2.758 10.002 -0.492 1.00 . A A . 18 ARG NH1 1 1 6 1919 1 1 18 ARG NH2 N -3.018 7.868 -1.225 1.00 . A A . 18 ARG NH2 1 1 6 1920 1 1 18 ARG O O 4.918 10.729 -0.803 1.00 . A A . 18 ARG O 1 1 6 1921 1 1 19 ALA C C 4.838 13.501 0.039 1.00 . A A . 19 ALA C 1 1 6 1922 1 1 19 ALA CA C 5.215 12.691 1.300 1.00 . A A . 19 ALA CA 1 1 6 1923 1 1 19 ALA CB C 6.727 12.471 1.460 1.00 . A A . 19 ALA CB 1 1 6 1924 1 1 19 ALA H H 4.187 11.115 2.237 1.00 . A A . 19 ALA H 1 1 6 1925 1 1 19 ALA HA H 4.877 13.262 2.164 1.00 . A A . 19 ALA HA 1 1 6 1926 1 1 19 ALA HB1 H 7.239 13.433 1.434 1.00 . A A . 19 ALA HB1 1 1 6 1927 1 1 19 ALA HB2 H 7.091 11.844 0.647 1.00 . A A . 19 ALA HB2 1 1 6 1928 1 1 19 ALA HB3 H 6.924 11.981 2.413 1.00 . A A . 19 ALA HB3 1 1 6 1929 1 1 19 ALA N N 4.519 11.388 1.335 1.00 . A A . 19 ALA N 1 1 6 1930 1 1 19 ALA O O 5.641 13.789 -0.847 1.00 . A A . 19 ALA O 1 1 6 1931 1 1 20 PHE C C 2.323 15.803 -0.817 1.00 . A A . 20 PHE C 1 1 6 1932 1 1 20 PHE CA C 2.916 14.433 -1.194 1.00 . A A . 20 PHE CA 1 1 6 1933 1 1 20 PHE CB C 1.856 13.505 -1.801 1.00 . A A . 20 PHE CB 1 1 6 1934 1 1 20 PHE CD1 C 2.072 13.815 -4.292 1.00 . A A . 20 PHE CD1 1 1 6 1935 1 1 20 PHE CD2 C 0.115 14.705 -3.197 1.00 . A A . 20 PHE CD2 1 1 6 1936 1 1 20 PHE CE1 C 1.588 14.267 -5.516 1.00 . A A . 20 PHE CE1 1 1 6 1937 1 1 20 PHE CE2 C -0.362 15.151 -4.423 1.00 . A A . 20 PHE CE2 1 1 6 1938 1 1 20 PHE CG C 1.333 14.035 -3.131 1.00 . A A . 20 PHE CG 1 1 6 1939 1 1 20 PHE CZ C 0.374 14.934 -5.577 1.00 . A A . 20 PHE CZ 1 1 6 1940 1 1 20 PHE H H 2.897 13.377 0.629 1.00 . A A . 20 PHE H 1 1 6 1941 1 1 20 PHE HA H 3.690 14.598 -1.945 1.00 . A A . 20 PHE HA 1 1 6 1942 1 1 20 PHE HB2 H 2.293 12.520 -1.957 1.00 . A A . 20 PHE HB2 1 1 6 1943 1 1 20 PHE HB3 H 1.023 13.419 -1.103 1.00 . A A . 20 PHE HB3 1 1 6 1944 1 1 20 PHE HD1 H 3.034 13.311 -4.234 1.00 . A A . 20 PHE HD1 1 1 6 1945 1 1 20 PHE HD2 H -0.461 14.877 -2.287 1.00 . A A . 20 PHE HD2 1 1 6 1946 1 1 20 PHE HE1 H 2.168 14.088 -6.422 1.00 . A A . 20 PHE HE1 1 1 6 1947 1 1 20 PHE HE2 H -1.332 15.652 -4.476 1.00 . A A . 20 PHE HE2 1 1 6 1948 1 1 20 PHE HZ H 0.000 15.293 -6.540 1.00 . A A . 20 PHE HZ 1 1 6 1949 1 1 20 PHE N N 3.536 13.747 -0.045 1.00 . A A . 20 PHE N 1 1 6 1950 1 1 20 PHE O O 1.390 15.818 0.016 1.00 . A A . 20 PHE O 1 1 7 1951 1 1 1 HIS C C -5.494 -12.985 -5.178 1.00 . A A . 1 HIS C 1 1 7 1952 1 1 1 HIS CA C -6.894 -12.558 -5.680 1.00 . A A . 1 HIS CA 1 1 7 1953 1 1 1 HIS CB C -7.955 -13.654 -5.509 1.00 . A A . 1 HIS CB 1 1 7 1954 1 1 1 HIS CD2 C -8.700 -12.874 -3.184 1.00 . A A . 1 HIS CD2 1 1 7 1955 1 1 1 HIS CE1 C -9.313 -14.734 -2.296 1.00 . A A . 1 HIS CE1 1 1 7 1956 1 1 1 HIS CG C -8.438 -13.848 -4.052 1.00 . A A . 1 HIS CG 1 1 7 1957 1 1 1 HIS H1 H -5.988 -12.189 -7.590 1.00 . A A . 1 HIS H1 1 1 7 1958 1 1 1 HIS HA H -7.210 -11.701 -5.084 1.00 . A A . 1 HIS HA 1 1 7 1959 1 1 1 HIS HB2 H -8.816 -13.408 -6.132 1.00 . A A . 1 HIS HB2 1 1 7 1960 1 1 1 HIS HB3 H -7.532 -14.597 -5.858 1.00 . A A . 1 HIS HB3 1 1 7 1961 1 1 1 HIS HD1 H -8.761 -15.900 -3.929 1.00 . A A . 1 HIS HD1 1 1 7 1962 1 1 1 HIS HD2 H -8.508 -11.821 -3.335 1.00 . A A . 1 HIS HD2 1 1 7 1963 1 1 1 HIS HE1 H -9.705 -15.462 -1.602 1.00 . A A . 1 HIS HE1 1 1 7 1964 1 1 1 HIS HE2 H -9.539 -12.929 -1.270 1.00 . A A . 1 HIS HE2 1 1 7 1965 1 1 1 HIS N N -6.869 -12.129 -7.100 1.00 . A A . 1 HIS N 1 1 7 1966 1 1 1 HIS ND1 N -8.813 -14.989 -3.510 1.00 . A A . 1 HIS ND1 1 1 7 1967 1 1 1 HIS NE2 N -9.239 -13.423 -2.098 1.00 . A A . 1 HIS NE2 1 1 7 1968 1 1 1 HIS O O -5.169 -14.163 -5.040 1.00 . A A . 1 HIS O 1 1 7 1969 1 1 2 GLY C C -2.517 -10.735 -4.656 1.00 . A A . 2 GLY C 1 1 7 1970 1 1 2 GLY CA C -3.227 -12.093 -4.665 1.00 . A A . 2 GLY CA 1 1 7 1971 1 1 2 GLY H H -4.925 -11.011 -5.274 1.00 . A A . 2 GLY H 1 1 7 1972 1 1 2 GLY HA2 H -3.186 -12.526 -3.665 1.00 . A A . 2 GLY HA2 1 1 7 1973 1 1 2 GLY HA3 H -2.717 -12.757 -5.364 1.00 . A A . 2 GLY HA3 1 1 7 1974 1 1 2 GLY N N -4.640 -11.953 -5.076 1.00 . A A . 2 GLY N 1 1 7 1975 1 1 2 GLY O O -2.625 -9.972 -3.698 1.00 . A A . 2 GLY O 1 1 7 1976 1 1 3 LEU C C -2.304 -7.834 -5.848 1.00 . A A . 3 LEU C 1 1 7 1977 1 1 3 LEU CA C -1.357 -9.038 -6.024 1.00 . A A . 3 LEU CA 1 1 7 1978 1 1 3 LEU CB C -0.630 -8.935 -7.373 1.00 . A A . 3 LEU CB 1 1 7 1979 1 1 3 LEU CD1 C -0.924 -7.987 -9.665 1.00 . A A . 3 LEU CD1 1 1 7 1980 1 1 3 LEU CD2 C -1.851 -10.259 -9.147 1.00 . A A . 3 LEU CD2 1 1 7 1981 1 1 3 LEU CG C -1.562 -8.864 -8.588 1.00 . A A . 3 LEU CG 1 1 7 1982 1 1 3 LEU H H -1.949 -10.982 -6.602 1.00 . A A . 3 LEU H 1 1 7 1983 1 1 3 LEU HA H -0.594 -8.950 -5.251 1.00 . A A . 3 LEU HA 1 1 7 1984 1 1 3 LEU HB2 H -0.015 -8.034 -7.360 1.00 . A A . 3 LEU HB2 1 1 7 1985 1 1 3 LEU HB3 H 0.023 -9.800 -7.484 1.00 . A A . 3 LEU HB3 1 1 7 1986 1 1 3 LEU HD11 H -1.585 -7.935 -10.530 1.00 . A A . 3 LEU HD11 1 1 7 1987 1 1 3 LEU HD12 H 0.032 -8.417 -9.964 1.00 . A A . 3 LEU HD12 1 1 7 1988 1 1 3 LEU HD13 H -0.764 -6.984 -9.269 1.00 . A A . 3 LEU HD13 1 1 7 1989 1 1 3 LEU HD21 H -0.919 -10.719 -9.476 1.00 . A A . 3 LEU HD21 1 1 7 1990 1 1 3 LEU HD22 H -2.305 -10.875 -8.371 1.00 . A A . 3 LEU HD22 1 1 7 1991 1 1 3 LEU HD23 H -2.534 -10.178 -9.993 1.00 . A A . 3 LEU HD23 1 1 7 1992 1 1 3 LEU HG H -2.504 -8.409 -8.280 1.00 . A A . 3 LEU HG 1 1 7 1993 1 1 3 LEU N N -2.009 -10.353 -5.828 1.00 . A A . 3 LEU N 1 1 7 1994 1 1 3 LEU O O -1.939 -6.836 -5.237 1.00 . A A . 3 LEU O 1 1 7 1995 1 1 4 ALA C C -4.788 -6.626 -4.525 1.00 . A A . 4 ALA C 1 1 7 1996 1 1 4 ALA CA C -4.627 -7.004 -6.015 1.00 . A A . 4 ALA CA 1 1 7 1997 1 1 4 ALA CB C -5.944 -7.520 -6.598 1.00 . A A . 4 ALA CB 1 1 7 1998 1 1 4 ALA H H -3.827 -8.776 -6.824 1.00 . A A . 4 ALA H 1 1 7 1999 1 1 4 ALA HA H -4.352 -6.101 -6.559 1.00 . A A . 4 ALA HA 1 1 7 2000 1 1 4 ALA HB1 H -5.802 -7.779 -7.647 1.00 . A A . 4 ALA HB1 1 1 7 2001 1 1 4 ALA HB2 H -6.264 -8.404 -6.046 1.00 . A A . 4 ALA HB2 1 1 7 2002 1 1 4 ALA HB3 H -6.706 -6.745 -6.515 1.00 . A A . 4 ALA HB3 1 1 7 2003 1 1 4 ALA N N -3.565 -8.010 -6.243 1.00 . A A . 4 ALA N 1 1 7 2004 1 1 4 ALA O O -5.036 -5.470 -4.204 1.00 . A A . 4 ALA O 1 1 7 2005 1 1 5 SER C C -2.971 -6.978 -1.680 1.00 . A A . 5 SER C 1 1 7 2006 1 1 5 SER CA C -4.356 -7.425 -2.190 1.00 . A A . 5 SER CA 1 1 7 2007 1 1 5 SER CB C -4.743 -8.753 -1.530 1.00 . A A . 5 SER CB 1 1 7 2008 1 1 5 SER H H -3.990 -8.414 -3.993 1.00 . A A . 5 SER H 1 1 7 2009 1 1 5 SER HA H -5.087 -6.671 -1.897 1.00 . A A . 5 SER HA 1 1 7 2010 1 1 5 SER HB2 H -5.776 -8.990 -1.787 1.00 . A A . 5 SER HB2 1 1 7 2011 1 1 5 SER HB3 H -4.091 -9.543 -1.903 1.00 . A A . 5 SER HB3 1 1 7 2012 1 1 5 SER HG H -4.837 -9.566 0.298 1.00 . A A . 5 SER HG 1 1 7 2013 1 1 5 SER N N -4.403 -7.568 -3.662 1.00 . A A . 5 SER N 1 1 7 2014 1 1 5 SER O O -2.877 -6.283 -0.671 1.00 . A A . 5 SER O 1 1 7 2015 1 1 5 SER OG O -4.623 -8.677 -0.107 1.00 . A A . 5 SER OG 1 1 7 2016 1 1 6 THR C C -0.415 -5.298 -2.069 1.00 . A A . 6 THR C 1 1 7 2017 1 1 6 THR CA C -0.525 -6.841 -2.102 1.00 . A A . 6 THR CA 1 1 7 2018 1 1 6 THR CB C 0.526 -7.513 -3.016 1.00 . A A . 6 THR CB 1 1 7 2019 1 1 6 THR CG2 C 0.908 -6.777 -4.310 1.00 . A A . 6 THR CG2 1 1 7 2020 1 1 6 THR H H -1.987 -7.844 -3.249 1.00 . A A . 6 THR H 1 1 7 2021 1 1 6 THR HA H -0.316 -7.184 -1.088 1.00 . A A . 6 THR HA 1 1 7 2022 1 1 6 THR HB H 0.155 -8.501 -3.287 1.00 . A A . 6 THR HB 1 1 7 2023 1 1 6 THR HG1 H 2.456 -7.988 -2.857 1.00 . A A . 6 THR HG1 1 1 7 2024 1 1 6 THR HG21 H 0.361 -5.837 -4.368 1.00 . A A . 6 THR HG21 1 1 7 2025 1 1 6 THR HG22 H 1.979 -6.575 -4.311 1.00 . A A . 6 THR HG22 1 1 7 2026 1 1 6 THR HG23 H 0.655 -7.399 -5.170 1.00 . A A . 6 THR HG23 1 1 7 2027 1 1 6 THR N N -1.904 -7.292 -2.420 1.00 . A A . 6 THR N 1 1 7 2028 1 1 6 THR O O 0.299 -4.719 -1.252 1.00 . A A . 6 THR O 1 1 7 2029 1 1 6 THR OG1 O 1.717 -7.683 -2.255 1.00 . A A . 6 THR OG1 1 1 7 2030 1 1 7 LEU C C -2.486 -2.701 -1.867 1.00 . A A . 7 LEU C 1 1 7 2031 1 1 7 LEU CA C -1.473 -3.208 -2.919 1.00 . A A . 7 LEU CA 1 1 7 2032 1 1 7 LEU CB C -1.873 -2.838 -4.357 1.00 . A A . 7 LEU CB 1 1 7 2033 1 1 7 LEU CD1 C -1.442 -0.304 -4.315 1.00 . A A . 7 LEU CD1 1 1 7 2034 1 1 7 LEU CD2 C -2.995 -1.333 -6.016 1.00 . A A . 7 LEU CD2 1 1 7 2035 1 1 7 LEU CG C -2.447 -1.429 -4.593 1.00 . A A . 7 LEU CG 1 1 7 2036 1 1 7 LEU H H -1.879 -5.183 -3.482 1.00 . A A . 7 LEU H 1 1 7 2037 1 1 7 LEU HA H -0.513 -2.735 -2.710 1.00 . A A . 7 LEU HA 1 1 7 2038 1 1 7 LEU HB2 H -0.983 -2.937 -4.980 1.00 . A A . 7 LEU HB2 1 1 7 2039 1 1 7 LEU HB3 H -2.609 -3.564 -4.701 1.00 . A A . 7 LEU HB3 1 1 7 2040 1 1 7 LEU HD11 H -1.067 -0.394 -3.296 1.00 . A A . 7 LEU HD11 1 1 7 2041 1 1 7 LEU HD12 H -1.935 0.661 -4.437 1.00 . A A . 7 LEU HD12 1 1 7 2042 1 1 7 LEU HD13 H -0.610 -0.378 -5.017 1.00 . A A . 7 LEU HD13 1 1 7 2043 1 1 7 LEU HD21 H -2.191 -1.522 -6.727 1.00 . A A . 7 LEU HD21 1 1 7 2044 1 1 7 LEU HD22 H -3.401 -0.335 -6.183 1.00 . A A . 7 LEU HD22 1 1 7 2045 1 1 7 LEU HD23 H -3.783 -2.073 -6.152 1.00 . A A . 7 LEU HD23 1 1 7 2046 1 1 7 LEU HG H -3.285 -1.297 -3.909 1.00 . A A . 7 LEU HG 1 1 7 2047 1 1 7 LEU N N -1.272 -4.669 -2.874 1.00 . A A . 7 LEU N 1 1 7 2048 1 1 7 LEU O O -2.592 -1.506 -1.653 1.00 . A A . 7 LEU O 1 1 7 2049 1 1 8 THR C C -3.322 -3.199 1.383 1.00 . A A . 8 THR C 1 1 7 2050 1 1 8 THR CA C -4.013 -3.229 -0.001 1.00 . A A . 8 THR CA 1 1 7 2051 1 1 8 THR CB C -5.214 -4.190 -0.086 1.00 . A A . 8 THR CB 1 1 7 2052 1 1 8 THR CG2 C -6.334 -3.895 0.917 1.00 . A A . 8 THR CG2 1 1 7 2053 1 1 8 THR H H -2.923 -4.581 -1.175 1.00 . A A . 8 THR H 1 1 7 2054 1 1 8 THR HA H -4.377 -2.224 -0.210 1.00 . A A . 8 THR HA 1 1 7 2055 1 1 8 THR HB H -4.856 -5.205 0.084 1.00 . A A . 8 THR HB 1 1 7 2056 1 1 8 THR HG1 H -6.619 -4.585 -1.474 1.00 . A A . 8 THR HG1 1 1 7 2057 1 1 8 THR HG21 H -5.942 -3.967 1.931 1.00 . A A . 8 THR HG21 1 1 7 2058 1 1 8 THR HG22 H -7.139 -4.619 0.787 1.00 . A A . 8 THR HG22 1 1 7 2059 1 1 8 THR HG23 H -6.719 -2.889 0.747 1.00 . A A . 8 THR HG23 1 1 7 2060 1 1 8 THR N N -3.052 -3.592 -1.069 1.00 . A A . 8 THR N 1 1 7 2061 1 1 8 THR O O -3.828 -2.610 2.332 1.00 . A A . 8 THR O 1 1 7 2062 1 1 8 THR OG1 O -5.741 -4.111 -1.417 1.00 . A A . 8 THR OG1 1 1 7 2063 1 1 9 ARG C C -0.097 -2.757 2.598 1.00 . A A . 9 ARG C 1 1 7 2064 1 1 9 ARG CA C -1.254 -3.760 2.649 1.00 . A A . 9 ARG CA 1 1 7 2065 1 1 9 ARG CB C -0.685 -5.165 2.829 1.00 . A A . 9 ARG CB 1 1 7 2066 1 1 9 ARG CD C -1.403 -7.527 2.527 1.00 . A A . 9 ARG CD 1 1 7 2067 1 1 9 ARG CG C -1.806 -6.165 3.080 1.00 . A A . 9 ARG CG 1 1 7 2068 1 1 9 ARG CZ C -2.717 -9.146 3.903 1.00 . A A . 9 ARG CZ 1 1 7 2069 1 1 9 ARG H H -1.750 -4.254 0.661 1.00 . A A . 9 ARG H 1 1 7 2070 1 1 9 ARG HA H -1.879 -3.526 3.511 1.00 . A A . 9 ARG HA 1 1 7 2071 1 1 9 ARG HB2 H -0.141 -5.452 1.930 1.00 . A A . 9 ARG HB2 1 1 7 2072 1 1 9 ARG HB3 H -0.003 -5.170 3.679 1.00 . A A . 9 ARG HB3 1 1 7 2073 1 1 9 ARG HD2 H -1.220 -7.450 1.456 1.00 . A A . 9 ARG HD2 1 1 7 2074 1 1 9 ARG HD3 H -0.503 -7.879 3.031 1.00 . A A . 9 ARG HD3 1 1 7 2075 1 1 9 ARG HE H -3.185 -8.513 2.042 1.00 . A A . 9 ARG HE 1 1 7 2076 1 1 9 ARG HG2 H -1.988 -6.246 4.152 1.00 . A A . 9 ARG HG2 1 1 7 2077 1 1 9 ARG HG3 H -2.715 -5.824 2.583 1.00 . A A . 9 ARG HG3 1 1 7 2078 1 1 9 ARG HH11 H -1.143 -8.406 4.907 1.00 . A A . 9 ARG HH11 1 1 7 2079 1 1 9 ARG HH12 H -2.097 -9.553 5.789 1.00 . A A . 9 ARG HH12 1 1 7 2080 1 1 9 ARG HH21 H -4.416 -10.020 3.249 1.00 . A A . 9 ARG HH21 1 1 7 2081 1 1 9 ARG HH22 H -3.915 -10.453 4.847 1.00 . A A . 9 ARG HH22 1 1 7 2082 1 1 9 ARG N N -2.097 -3.723 1.430 1.00 . A A . 9 ARG N 1 1 7 2083 1 1 9 ARG NE N -2.512 -8.461 2.775 1.00 . A A . 9 ARG NE 1 1 7 2084 1 1 9 ARG NH1 N -1.921 -9.034 4.957 1.00 . A A . 9 ARG NH1 1 1 7 2085 1 1 9 ARG NH2 N -3.769 -9.946 4.001 1.00 . A A . 9 ARG NH2 1 1 7 2086 1 1 9 ARG O O 0.008 -1.884 3.458 1.00 . A A . 9 ARG O 1 1 7 2087 1 1 10 TRP C C 1.225 -0.375 1.183 1.00 . A A . 10 TRP C 1 1 7 2088 1 1 10 TRP CA C 1.772 -1.815 1.304 1.00 . A A . 10 TRP CA 1 1 7 2089 1 1 10 TRP CB C 2.637 -2.289 0.128 1.00 . A A . 10 TRP CB 1 1 7 2090 1 1 10 TRP CD1 C 2.330 -0.996 -2.032 1.00 . A A . 10 TRP CD1 1 1 7 2091 1 1 10 TRP CD2 C 3.931 -0.201 -0.765 1.00 . A A . 10 TRP CD2 1 1 7 2092 1 1 10 TRP CE2 C 3.803 0.594 -1.896 1.00 . A A . 10 TRP CE2 1 1 7 2093 1 1 10 TRP CE3 C 4.874 0.106 0.212 1.00 . A A . 10 TRP CE3 1 1 7 2094 1 1 10 TRP CG C 2.980 -1.197 -0.895 1.00 . A A . 10 TRP CG 1 1 7 2095 1 1 10 TRP CH2 C 5.573 2.007 -1.084 1.00 . A A . 10 TRP CH2 1 1 7 2096 1 1 10 TRP CZ2 C 4.639 1.693 -2.066 1.00 . A A . 10 TRP CZ2 1 1 7 2097 1 1 10 TRP CZ3 C 5.680 1.228 0.055 1.00 . A A . 10 TRP CZ3 1 1 7 2098 1 1 10 TRP H H 0.654 -3.543 0.850 1.00 . A A . 10 TRP H 1 1 7 2099 1 1 10 TRP HA H 2.409 -1.835 2.189 1.00 . A A . 10 TRP HA 1 1 7 2100 1 1 10 TRP HB2 H 3.567 -2.699 0.523 1.00 . A A . 10 TRP HB2 1 1 7 2101 1 1 10 TRP HB3 H 2.100 -3.083 -0.391 1.00 . A A . 10 TRP HB3 1 1 7 2102 1 1 10 TRP HD1 H 1.506 -1.611 -2.402 1.00 . A A . 10 TRP HD1 1 1 7 2103 1 1 10 TRP HE1 H 2.531 0.423 -3.531 1.00 . A A . 10 TRP HE1 1 1 7 2104 1 1 10 TRP HE3 H 5.067 -0.592 1.024 1.00 . A A . 10 TRP HE3 1 1 7 2105 1 1 10 TRP HH2 H 6.250 2.852 -1.228 1.00 . A A . 10 TRP HH2 1 1 7 2106 1 1 10 TRP HZ2 H 4.652 2.219 -3.019 1.00 . A A . 10 TRP HZ2 1 1 7 2107 1 1 10 TRP HZ3 H 6.366 1.520 0.855 1.00 . A A . 10 TRP HZ3 1 1 7 2108 1 1 10 TRP N N 0.701 -2.808 1.529 1.00 . A A . 10 TRP N 1 1 7 2109 1 1 10 TRP NE1 N 2.826 0.079 -2.635 1.00 . A A . 10 TRP NE1 1 1 7 2110 1 1 10 TRP O O 1.838 0.573 1.683 1.00 . A A . 10 TRP O 1 1 7 2111 1 1 11 ALA C C -1.243 1.522 2.023 1.00 . A A . 11 ALA C 1 1 7 2112 1 1 11 ALA CA C -0.749 1.021 0.653 1.00 . A A . 11 ALA CA 1 1 7 2113 1 1 11 ALA CB C -1.938 0.955 -0.302 1.00 . A A . 11 ALA CB 1 1 7 2114 1 1 11 ALA H H -0.536 -1.064 0.399 1.00 . A A . 11 ALA H 1 1 7 2115 1 1 11 ALA HA H -0.062 1.772 0.263 1.00 . A A . 11 ALA HA 1 1 7 2116 1 1 11 ALA HB1 H -2.422 1.930 -0.349 1.00 . A A . 11 ALA HB1 1 1 7 2117 1 1 11 ALA HB2 H -1.590 0.674 -1.297 1.00 . A A . 11 ALA HB2 1 1 7 2118 1 1 11 ALA HB3 H -2.651 0.212 0.056 1.00 . A A . 11 ALA HB3 1 1 7 2119 1 1 11 ALA N N -0.015 -0.263 0.699 1.00 . A A . 11 ALA N 1 1 7 2120 1 1 11 ALA O O -1.769 2.626 2.129 1.00 . A A . 11 ALA O 1 1 7 2121 1 1 12 HIS C C 0.108 1.486 5.241 1.00 . A A . 12 HIS C 1 1 7 2122 1 1 12 HIS CA C -1.186 1.144 4.474 1.00 . A A . 12 HIS CA 1 1 7 2123 1 1 12 HIS CB C -1.921 -0.024 5.132 1.00 . A A . 12 HIS CB 1 1 7 2124 1 1 12 HIS CD2 C -4.354 0.437 4.434 1.00 . A A . 12 HIS CD2 1 1 7 2125 1 1 12 HIS CE1 C -5.269 0.657 6.374 1.00 . A A . 12 HIS CE1 1 1 7 2126 1 1 12 HIS CG C -3.417 0.266 5.365 1.00 . A A . 12 HIS CG 1 1 7 2127 1 1 12 HIS H H -0.494 -0.133 2.967 1.00 . A A . 12 HIS H 1 1 7 2128 1 1 12 HIS HA H -1.839 2.017 4.484 1.00 . A A . 12 HIS HA 1 1 7 2129 1 1 12 HIS HB2 H -1.826 -0.904 4.495 1.00 . A A . 12 HIS HB2 1 1 7 2130 1 1 12 HIS HB3 H -1.452 -0.232 6.093 1.00 . A A . 12 HIS HB3 1 1 7 2131 1 1 12 HIS HD1 H -3.507 0.292 7.433 1.00 . A A . 12 HIS HD1 1 1 7 2132 1 1 12 HIS HD2 H -4.210 0.386 3.365 1.00 . A A . 12 HIS HD2 1 1 7 2133 1 1 12 HIS HE1 H -5.996 0.818 7.157 1.00 . A A . 12 HIS HE1 1 1 7 2134 1 1 12 HIS HE2 H -6.395 0.856 4.630 1.00 . A A . 12 HIS HE2 1 1 7 2135 1 1 12 HIS N N -0.922 0.769 3.072 1.00 . A A . 12 HIS N 1 1 7 2136 1 1 12 HIS ND1 N -3.966 0.397 6.545 1.00 . A A . 12 HIS ND1 1 1 7 2137 1 1 12 HIS NE2 N -5.503 0.682 5.069 1.00 . A A . 12 HIS NE2 1 1 7 2138 1 1 12 HIS O O 0.088 1.709 6.449 1.00 . A A . 12 HIS O 1 1 7 2139 1 1 13 TYR C C 3.002 3.311 4.448 1.00 . A A . 13 TYR C 1 1 7 2140 1 1 13 TYR CA C 2.547 1.951 4.993 1.00 . A A . 13 TYR CA 1 1 7 2141 1 1 13 TYR CB C 3.543 0.866 4.572 1.00 . A A . 13 TYR CB 1 1 7 2142 1 1 13 TYR CD1 C 2.531 -1.086 5.843 1.00 . A A . 13 TYR CD1 1 1 7 2143 1 1 13 TYR CD2 C 4.843 -0.503 6.199 1.00 . A A . 13 TYR CD2 1 1 7 2144 1 1 13 TYR CE1 C 2.661 -2.140 6.733 1.00 . A A . 13 TYR CE1 1 1 7 2145 1 1 13 TYR CE2 C 4.980 -1.558 7.086 1.00 . A A . 13 TYR CE2 1 1 7 2146 1 1 13 TYR CG C 3.624 -0.270 5.584 1.00 . A A . 13 TYR CG 1 1 7 2147 1 1 13 TYR CZ C 3.881 -2.368 7.360 1.00 . A A . 13 TYR CZ 1 1 7 2148 1 1 13 TYR H H 1.183 1.312 3.531 1.00 . A A . 13 TYR H 1 1 7 2149 1 1 13 TYR HA H 2.516 1.999 6.082 1.00 . A A . 13 TYR HA 1 1 7 2150 1 1 13 TYR HB2 H 3.229 0.457 3.611 1.00 . A A . 13 TYR HB2 1 1 7 2151 1 1 13 TYR HB3 H 4.530 1.315 4.462 1.00 . A A . 13 TYR HB3 1 1 7 2152 1 1 13 TYR HD1 H 1.569 -0.896 5.368 1.00 . A A . 13 TYR HD1 1 1 7 2153 1 1 13 TYR HD2 H 5.697 0.137 5.974 1.00 . A A . 13 TYR HD2 1 1 7 2154 1 1 13 TYR HE1 H 1.821 -2.815 6.892 1.00 . A A . 13 TYR HE1 1 1 7 2155 1 1 13 TYR HE2 H 5.967 -1.792 7.482 1.00 . A A . 13 TYR HE2 1 1 7 2156 1 1 13 TYR HH H 4.916 -3.355 8.645 1.00 . A A . 13 TYR HH 1 1 7 2157 1 1 13 TYR N N 1.205 1.595 4.491 1.00 . A A . 13 TYR N 1 1 7 2158 1 1 13 TYR O O 2.947 4.329 5.138 1.00 . A A . 13 TYR O 1 1 7 2159 1 1 13 TYR OH O 3.991 -3.364 8.270 1.00 . A A . 13 TYR OH 1 1 7 2160 1 1 14 ASN C C 2.489 5.589 2.386 1.00 . A A . 14 ASN C 1 1 7 2161 1 1 14 ASN CA C 3.620 4.546 2.409 1.00 . A A . 14 ASN CA 1 1 7 2162 1 1 14 ASN CB C 4.078 4.191 0.996 1.00 . A A . 14 ASN CB 1 1 7 2163 1 1 14 ASN CG C 4.859 5.344 0.358 1.00 . A A . 14 ASN CG 1 1 7 2164 1 1 14 ASN H H 3.190 2.495 2.579 1.00 . A A . 14 ASN H 1 1 7 2165 1 1 14 ASN HA H 4.468 4.992 2.929 1.00 . A A . 14 ASN HA 1 1 7 2166 1 1 14 ASN HB2 H 4.715 3.308 1.038 1.00 . A A . 14 ASN HB2 1 1 7 2167 1 1 14 ASN HB3 H 3.203 3.973 0.383 1.00 . A A . 14 ASN HB3 1 1 7 2168 1 1 14 ASN HD21 H 4.926 4.446 -1.453 1.00 . A A . 14 ASN HD21 1 1 7 2169 1 1 14 ASN HD22 H 5.609 6.055 -1.292 1.00 . A A . 14 ASN HD22 1 1 7 2170 1 1 14 ASN N N 3.243 3.323 3.138 1.00 . A A . 14 ASN N 1 1 7 2171 1 1 14 ASN ND2 N 5.149 5.247 -0.914 1.00 . A A . 14 ASN ND2 1 1 7 2172 1 1 14 ASN O O 2.731 6.760 2.135 1.00 . A A . 14 ASN O 1 1 7 2173 1 1 14 ASN OD1 O 5.252 6.301 0.999 1.00 . A A . 14 ASN OD1 1 1 7 2174 1 1 15 ALA C C 0.538 7.321 3.927 1.00 . A A . 15 ALA C 1 1 7 2175 1 1 15 ALA CA C 0.158 6.106 3.054 1.00 . A A . 15 ALA CA 1 1 7 2176 1 1 15 ALA CB C -0.979 5.321 3.712 1.00 . A A . 15 ALA CB 1 1 7 2177 1 1 15 ALA H H 1.137 4.250 3.114 1.00 . A A . 15 ALA H 1 1 7 2178 1 1 15 ALA HA H -0.188 6.470 2.086 1.00 . A A . 15 ALA HA 1 1 7 2179 1 1 15 ALA HB1 H -1.308 5.843 4.611 1.00 . A A . 15 ALA HB1 1 1 7 2180 1 1 15 ALA HB2 H -1.813 5.238 3.015 1.00 . A A . 15 ALA HB2 1 1 7 2181 1 1 15 ALA HB3 H -0.628 4.325 3.978 1.00 . A A . 15 ALA HB3 1 1 7 2182 1 1 15 ALA N N 1.297 5.192 2.830 1.00 . A A . 15 ALA N 1 1 7 2183 1 1 15 ALA O O 0.073 8.427 3.666 1.00 . A A . 15 ALA O 1 1 7 2184 1 1 16 LEU C C 3.478 8.695 5.112 1.00 . A A . 16 LEU C 1 1 7 2185 1 1 16 LEU CA C 2.117 8.185 5.635 1.00 . A A . 16 LEU CA 1 1 7 2186 1 1 16 LEU CB C 2.274 7.650 7.060 1.00 . A A . 16 LEU CB 1 1 7 2187 1 1 16 LEU CD1 C 0.754 8.986 8.562 1.00 . A A . 16 LEU CD1 1 1 7 2188 1 1 16 LEU CD2 C 3.148 8.515 9.256 1.00 . A A . 16 LEU CD2 1 1 7 2189 1 1 16 LEU CG C 2.196 8.781 8.090 1.00 . A A . 16 LEU CG 1 1 7 2190 1 1 16 LEU H H 1.976 6.228 4.875 1.00 . A A . 16 LEU H 1 1 7 2191 1 1 16 LEU HA H 1.421 9.024 5.657 1.00 . A A . 16 LEU HA 1 1 7 2192 1 1 16 LEU HB2 H 1.477 6.932 7.259 1.00 . A A . 16 LEU HB2 1 1 7 2193 1 1 16 LEU HB3 H 3.238 7.149 7.150 1.00 . A A . 16 LEU HB3 1 1 7 2194 1 1 16 LEU HD11 H 0.722 9.794 9.293 1.00 . A A . 16 LEU HD11 1 1 7 2195 1 1 16 LEU HD12 H 0.388 8.067 9.019 1.00 . A A . 16 LEU HD12 1 1 7 2196 1 1 16 LEU HD13 H 0.126 9.243 7.709 1.00 . A A . 16 LEU HD13 1 1 7 2197 1 1 16 LEU HD21 H 4.170 8.447 8.883 1.00 . A A . 16 LEU HD21 1 1 7 2198 1 1 16 LEU HD22 H 3.078 9.330 9.976 1.00 . A A . 16 LEU HD22 1 1 7 2199 1 1 16 LEU HD23 H 2.876 7.577 9.741 1.00 . A A . 16 LEU HD23 1 1 7 2200 1 1 16 LEU HG H 2.520 9.699 7.600 1.00 . A A . 16 LEU HG 1 1 7 2201 1 1 16 LEU N N 1.542 7.124 4.785 1.00 . A A . 16 LEU N 1 1 7 2202 1 1 16 LEU O O 3.801 9.867 5.284 1.00 . A A . 16 LEU O 1 1 7 2203 1 1 17 ILE C C 5.412 8.754 2.421 1.00 . A A . 17 ILE C 1 1 7 2204 1 1 17 ILE CA C 5.561 8.146 3.845 1.00 . A A . 17 ILE CA 1 1 7 2205 1 1 17 ILE CB C 6.446 6.865 3.836 1.00 . A A . 17 ILE CB 1 1 7 2206 1 1 17 ILE CD1 C 6.827 6.791 6.431 1.00 . A A . 17 ILE CD1 1 1 7 2207 1 1 17 ILE CG1 C 6.408 6.053 5.148 1.00 . A A . 17 ILE CG1 1 1 7 2208 1 1 17 ILE CG2 C 7.911 7.130 3.445 1.00 . A A . 17 ILE CG2 1 1 7 2209 1 1 17 ILE H H 3.978 6.866 4.348 1.00 . A A . 17 ILE H 1 1 7 2210 1 1 17 ILE HA H 6.050 8.887 4.477 1.00 . A A . 17 ILE HA 1 1 7 2211 1 1 17 ILE HB H 6.036 6.215 3.063 1.00 . A A . 17 ILE HB 1 1 7 2212 1 1 17 ILE HD11 H 7.854 7.141 6.330 1.00 . A A . 17 ILE HD11 1 1 7 2213 1 1 17 ILE HD12 H 6.757 6.112 7.281 1.00 . A A . 17 ILE HD12 1 1 7 2214 1 1 17 ILE HD13 H 6.167 7.643 6.592 1.00 . A A . 17 ILE HD13 1 1 7 2215 1 1 17 ILE HG12 H 5.394 5.677 5.287 1.00 . A A . 17 ILE HG12 1 1 7 2216 1 1 17 ILE HG13 H 7.074 5.198 5.027 1.00 . A A . 17 ILE HG13 1 1 7 2217 1 1 17 ILE HG21 H 7.941 7.704 2.519 1.00 . A A . 17 ILE HG21 1 1 7 2218 1 1 17 ILE HG22 H 8.425 6.180 3.301 1.00 . A A . 17 ILE HG22 1 1 7 2219 1 1 17 ILE HG23 H 8.402 7.693 4.238 1.00 . A A . 17 ILE HG23 1 1 7 2220 1 1 17 ILE N N 4.245 7.821 4.452 1.00 . A A . 17 ILE N 1 1 7 2221 1 1 17 ILE O O 6.396 8.937 1.704 1.00 . A A . 17 ILE O 1 1 7 2222 1 1 18 ARG C C 3.704 8.594 -0.344 1.00 . A A . 18 ARG C 1 1 7 2223 1 1 18 ARG CA C 3.773 9.685 0.742 1.00 . A A . 18 ARG CA 1 1 7 2224 1 1 18 ARG CB C 4.668 10.844 0.265 1.00 . A A . 18 ARG CB 1 1 7 2225 1 1 18 ARG CD C 3.450 12.881 1.124 1.00 . A A . 18 ARG CD 1 1 7 2226 1 1 18 ARG CG C 3.856 12.081 -0.113 1.00 . A A . 18 ARG CG 1 1 7 2227 1 1 18 ARG CZ C 4.252 14.971 2.233 1.00 . A A . 18 ARG CZ 1 1 7 2228 1 1 18 ARG H H 3.414 8.876 2.635 1.00 . A A . 18 ARG H 1 1 7 2229 1 1 18 ARG HA H 2.765 10.085 0.860 1.00 . A A . 18 ARG HA 1 1 7 2230 1 1 18 ARG HB2 H 5.364 11.106 1.062 1.00 . A A . 18 ARG HB2 1 1 7 2231 1 1 18 ARG HB3 H 5.233 10.515 -0.607 1.00 . A A . 18 ARG HB3 1 1 7 2232 1 1 18 ARG HD2 H 2.455 13.299 0.972 1.00 . A A . 18 ARG HD2 1 1 7 2233 1 1 18 ARG HD3 H 3.436 12.223 1.993 1.00 . A A . 18 ARG HD3 1 1 7 2234 1 1 18 ARG HE H 5.239 13.951 0.802 1.00 . A A . 18 ARG HE 1 1 7 2235 1 1 18 ARG HG2 H 4.459 12.715 -0.763 1.00 . A A . 18 ARG HG2 1 1 7 2236 1 1 18 ARG HG3 H 2.959 11.770 -0.649 1.00 . A A . 18 ARG HG3 1 1 7 2237 1 1 18 ARG HH11 H 2.588 14.234 3.063 1.00 . A A . 18 ARG HH11 1 1 7 2238 1 1 18 ARG HH12 H 3.123 15.743 3.730 1.00 . A A . 18 ARG HH12 1 1 7 2239 1 1 18 ARG HH21 H 5.931 15.963 1.689 1.00 . A A . 18 ARG HH21 1 1 7 2240 1 1 18 ARG HH22 H 5.007 16.689 2.958 1.00 . A A . 18 ARG HH22 1 1 7 2241 1 1 18 ARG N N 4.184 9.144 2.058 1.00 . A A . 18 ARG N 1 1 7 2242 1 1 18 ARG NE N 4.411 13.978 1.356 1.00 . A A . 18 ARG NE 1 1 7 2243 1 1 18 ARG NH1 N 3.236 14.995 3.081 1.00 . A A . 18 ARG NH1 1 1 7 2244 1 1 18 ARG NH2 N 5.144 15.953 2.299 1.00 . A A . 18 ARG NH2 1 1 7 2245 1 1 18 ARG O O 4.665 8.306 -1.059 1.00 . A A . 18 ARG O 1 1 7 2246 1 1 19 ALA C C 1.878 7.596 -2.817 1.00 . A A . 19 ALA C 1 1 7 2247 1 1 19 ALA CA C 2.249 6.959 -1.469 1.00 . A A . 19 ALA CA 1 1 7 2248 1 1 19 ALA CB C 1.177 5.975 -0.981 1.00 . A A . 19 ALA CB 1 1 7 2249 1 1 19 ALA H H 1.803 8.140 0.227 1.00 . A A . 19 ALA H 1 1 7 2250 1 1 19 ALA HA H 3.169 6.394 -1.616 1.00 . A A . 19 ALA HA 1 1 7 2251 1 1 19 ALA HB1 H 1.481 5.549 -0.025 1.00 . A A . 19 ALA HB1 1 1 7 2252 1 1 19 ALA HB2 H 1.057 5.176 -1.713 1.00 . A A . 19 ALA HB2 1 1 7 2253 1 1 19 ALA HB3 H 0.229 6.500 -0.860 1.00 . A A . 19 ALA HB3 1 1 7 2254 1 1 19 ALA N N 2.520 7.994 -0.453 1.00 . A A . 19 ALA N 1 1 7 2255 1 1 19 ALA O O 2.588 7.432 -3.807 1.00 . A A . 19 ALA O 1 1 7 2256 1 1 20 PHE C C -0.448 10.283 -3.754 1.00 . A A . 20 PHE C 1 1 7 2257 1 1 20 PHE CA C 0.204 8.916 -4.045 1.00 . A A . 20 PHE CA 1 1 7 2258 1 1 20 PHE CB C -0.762 7.917 -4.694 1.00 . A A . 20 PHE CB 1 1 7 2259 1 1 20 PHE CD1 C 0.328 7.444 -6.896 1.00 . A A . 20 PHE CD1 1 1 7 2260 1 1 20 PHE CD2 C -1.758 8.653 -6.901 1.00 . A A . 20 PHE CD2 1 1 7 2261 1 1 20 PHE CE1 C 0.350 7.467 -8.283 1.00 . A A . 20 PHE CE1 1 1 7 2262 1 1 20 PHE CE2 C -1.740 8.671 -8.289 1.00 . A A . 20 PHE CE2 1 1 7 2263 1 1 20 PHE CG C -0.723 8.036 -6.212 1.00 . A A . 20 PHE CG 1 1 7 2264 1 1 20 PHE CZ C -0.686 8.080 -8.979 1.00 . A A . 20 PHE CZ 1 1 7 2265 1 1 20 PHE H H 0.104 8.238 -2.050 1.00 . A A . 20 PHE H 1 1 7 2266 1 1 20 PHE HA H 1.038 9.075 -4.728 1.00 . A A . 20 PHE HA 1 1 7 2267 1 1 20 PHE HB2 H -0.476 6.906 -4.407 1.00 . A A . 20 PHE HB2 1 1 7 2268 1 1 20 PHE HB3 H -1.775 8.117 -4.343 1.00 . A A . 20 PHE HB3 1 1 7 2269 1 1 20 PHE HD1 H 1.139 6.968 -6.340 1.00 . A A . 20 PHE HD1 1 1 7 2270 1 1 20 PHE HD2 H -2.589 9.104 -6.355 1.00 . A A . 20 PHE HD2 1 1 7 2271 1 1 20 PHE HE1 H 1.188 7.025 -8.820 1.00 . A A . 20 PHE HE1 1 1 7 2272 1 1 20 PHE HE2 H -2.559 9.135 -8.838 1.00 . A A . 20 PHE HE2 1 1 7 2273 1 1 20 PHE HZ H -0.674 8.093 -10.068 1.00 . A A . 20 PHE HZ 1 1 7 2274 1 1 20 PHE N N 0.722 8.255 -2.833 1.00 . A A . 20 PHE N 1 1 7 2275 1 1 20 PHE O O 0.319 11.225 -3.461 1.00 . A A . 20 PHE O 1 1 8 2276 1 1 1 HIS C C -6.405 -13.271 -5.056 1.00 . A A . 1 HIS C 1 1 8 2277 1 1 1 HIS CA C -7.874 -12.961 -5.432 1.00 . A A . 1 HIS CA 1 1 8 2278 1 1 1 HIS CB C -7.975 -12.276 -6.807 1.00 . A A . 1 HIS CB 1 1 8 2279 1 1 1 HIS CD2 C -7.345 -13.698 -8.839 1.00 . A A . 1 HIS CD2 1 1 8 2280 1 1 1 HIS CE1 C -9.253 -14.590 -9.296 1.00 . A A . 1 HIS CE1 1 1 8 2281 1 1 1 HIS CG C -8.217 -13.286 -7.921 1.00 . A A . 1 HIS CG 1 1 8 2282 1 1 1 HIS H1 H -8.016 -11.823 -3.629 1.00 . A A . 1 HIS H1 1 1 8 2283 1 1 1 HIS HA H -8.408 -13.908 -5.492 1.00 . A A . 1 HIS HA 1 1 8 2284 1 1 1 HIS HB2 H -8.802 -11.566 -6.789 1.00 . A A . 1 HIS HB2 1 1 8 2285 1 1 1 HIS HB3 H -7.047 -11.739 -7.008 1.00 . A A . 1 HIS HB3 1 1 8 2286 1 1 1 HIS HD1 H -10.242 -13.712 -7.692 1.00 . A A . 1 HIS HD1 1 1 8 2287 1 1 1 HIS HD2 H -6.300 -13.429 -8.887 1.00 . A A . 1 HIS HD2 1 1 8 2288 1 1 1 HIS HE1 H -10.023 -15.173 -9.780 1.00 . A A . 1 HIS HE1 1 1 8 2289 1 1 1 HIS HE2 H -7.578 -14.957 -10.486 1.00 . A A . 1 HIS HE2 1 1 8 2290 1 1 1 HIS N N -8.556 -12.124 -4.428 1.00 . A A . 1 HIS N 1 1 8 2291 1 1 1 HIS ND1 N -9.405 -13.841 -8.208 1.00 . A A . 1 HIS ND1 1 1 8 2292 1 1 1 HIS NE2 N -7.985 -14.497 -9.684 1.00 . A A . 1 HIS NE2 1 1 8 2293 1 1 1 HIS O O -6.068 -14.410 -4.748 1.00 . A A . 1 HIS O 1 1 8 2294 1 1 2 GLY C C -3.536 -10.886 -4.654 1.00 . A A . 2 GLY C 1 1 8 2295 1 1 2 GLY CA C -4.175 -12.276 -4.590 1.00 . A A . 2 GLY CA 1 1 8 2296 1 1 2 GLY H H -5.902 -11.284 -5.253 1.00 . A A . 2 GLY H 1 1 8 2297 1 1 2 GLY HA2 H -4.119 -12.653 -3.568 1.00 . A A . 2 GLY HA2 1 1 8 2298 1 1 2 GLY HA3 H -3.637 -12.953 -5.254 1.00 . A A . 2 GLY HA3 1 1 8 2299 1 1 2 GLY N N -5.591 -12.207 -5.006 1.00 . A A . 2 GLY N 1 1 8 2300 1 1 2 GLY O O -3.838 -10.027 -3.829 1.00 . A A . 2 GLY O 1 1 8 2301 1 1 3 LEU C C -3.311 -8.098 -6.098 1.00 . A A . 3 LEU C 1 1 8 2302 1 1 3 LEU CA C -2.351 -9.302 -6.146 1.00 . A A . 3 LEU CA 1 1 8 2303 1 1 3 LEU CB C -1.616 -9.323 -7.494 1.00 . A A . 3 LEU CB 1 1 8 2304 1 1 3 LEU CD1 C -1.932 -8.621 -9.871 1.00 . A A . 3 LEU CD1 1 1 8 2305 1 1 3 LEU CD2 C -2.765 -10.869 -9.136 1.00 . A A . 3 LEU CD2 1 1 8 2306 1 1 3 LEU CG C -2.540 -9.415 -8.715 1.00 . A A . 3 LEU CG 1 1 8 2307 1 1 3 LEU H H -2.915 -11.298 -6.549 1.00 . A A . 3 LEU H 1 1 8 2308 1 1 3 LEU HA H -1.595 -9.131 -5.380 1.00 . A A . 3 LEU HA 1 1 8 2309 1 1 3 LEU HB2 H -1.030 -8.408 -7.577 1.00 . A A . 3 LEU HB2 1 1 8 2310 1 1 3 LEU HB3 H -0.936 -10.175 -7.506 1.00 . A A . 3 LEU HB3 1 1 8 2311 1 1 3 LEU HD11 H -2.588 -8.685 -10.741 1.00 . A A . 3 LEU HD11 1 1 8 2312 1 1 3 LEU HD12 H -0.955 -9.035 -10.121 1.00 . A A . 3 LEU HD12 1 1 8 2313 1 1 3 LEU HD13 H -1.820 -7.578 -9.577 1.00 . A A . 3 LEU HD13 1 1 8 2314 1 1 3 LEU HD21 H -1.811 -11.317 -9.416 1.00 . A A . 3 LEU HD21 1 1 8 2315 1 1 3 LEU HD22 H -3.198 -11.426 -8.305 1.00 . A A . 3 LEU HD22 1 1 8 2316 1 1 3 LEU HD23 H -3.444 -10.900 -9.987 1.00 . A A . 3 LEU HD23 1 1 8 2317 1 1 3 LEU HG H -3.503 -8.973 -8.458 1.00 . A A . 3 LEU HG 1 1 8 2318 1 1 3 LEU N N -2.988 -10.601 -5.834 1.00 . A A . 3 LEU N 1 1 8 2319 1 1 3 LEU O O -2.954 -7.038 -5.590 1.00 . A A . 3 LEU O 1 1 8 2320 1 1 4 ALA C C -5.895 -6.835 -4.996 1.00 . A A . 4 ALA C 1 1 8 2321 1 1 4 ALA CA C -5.663 -7.358 -6.428 1.00 . A A . 4 ALA CA 1 1 8 2322 1 1 4 ALA CB C -6.943 -7.994 -6.977 1.00 . A A . 4 ALA CB 1 1 8 2323 1 1 4 ALA H H -4.787 -9.179 -6.996 1.00 . A A . 4 ALA H 1 1 8 2324 1 1 4 ALA HA H -5.408 -6.509 -7.062 1.00 . A A . 4 ALA HA 1 1 8 2325 1 1 4 ALA HB1 H -6.764 -8.358 -7.988 1.00 . A A . 4 ALA HB1 1 1 8 2326 1 1 4 ALA HB2 H -7.739 -7.249 -6.996 1.00 . A A . 4 ALA HB2 1 1 8 2327 1 1 4 ALA HB3 H -7.239 -8.825 -6.338 1.00 . A A . 4 ALA HB3 1 1 8 2328 1 1 4 ALA N N -4.559 -8.338 -6.509 1.00 . A A . 4 ALA N 1 1 8 2329 1 1 4 ALA O O -6.292 -5.690 -4.801 1.00 . A A . 4 ALA O 1 1 8 2330 1 1 5 SER C C -4.155 -6.955 -2.023 1.00 . A A . 5 SER C 1 1 8 2331 1 1 5 SER CA C -5.540 -7.339 -2.586 1.00 . A A . 5 SER CA 1 1 8 2332 1 1 5 SER CB C -6.093 -8.546 -1.829 1.00 . A A . 5 SER CB 1 1 8 2333 1 1 5 SER H H -5.020 -8.508 -4.244 1.00 . A A . 5 SER H 1 1 8 2334 1 1 5 SER HA H -6.218 -6.498 -2.440 1.00 . A A . 5 SER HA 1 1 8 2335 1 1 5 SER HB2 H -6.824 -9.066 -2.448 1.00 . A A . 5 SER HB2 1 1 8 2336 1 1 5 SER HB3 H -5.278 -9.225 -1.577 1.00 . A A . 5 SER HB3 1 1 8 2337 1 1 5 SER HG H -7.021 -8.858 -0.079 1.00 . A A . 5 SER HG 1 1 8 2338 1 1 5 SER N N -5.485 -7.650 -4.027 1.00 . A A . 5 SER N 1 1 8 2339 1 1 5 SER O O -4.053 -6.206 -1.054 1.00 . A A . 5 SER O 1 1 8 2340 1 1 5 SER OG O -6.718 -8.083 -0.633 1.00 . A A . 5 SER OG 1 1 8 2341 1 1 6 THR C C -1.507 -5.464 -2.518 1.00 . A A . 6 THR C 1 1 8 2342 1 1 6 THR CA C -1.687 -6.992 -2.391 1.00 . A A . 6 THR CA 1 1 8 2343 1 1 6 THR CB C -0.726 -7.763 -3.316 1.00 . A A . 6 THR CB 1 1 8 2344 1 1 6 THR CG2 C 0.755 -7.529 -2.996 1.00 . A A . 6 THR CG2 1 1 8 2345 1 1 6 THR H H -3.133 -8.199 -3.288 1.00 . A A . 6 THR H 1 1 8 2346 1 1 6 THR HA H -1.454 -7.271 -1.363 1.00 . A A . 6 THR HA 1 1 8 2347 1 1 6 THR HB H -0.910 -7.449 -4.344 1.00 . A A . 6 THR HB 1 1 8 2348 1 1 6 THR HG1 H -0.264 -9.694 -3.610 1.00 . A A . 6 THR HG1 1 1 8 2349 1 1 6 THR HG21 H 0.986 -6.468 -3.097 1.00 . A A . 6 THR HG21 1 1 8 2350 1 1 6 THR HG22 H 1.372 -8.103 -3.687 1.00 . A A . 6 THR HG22 1 1 8 2351 1 1 6 THR HG23 H 0.961 -7.849 -1.975 1.00 . A A . 6 THR HG23 1 1 8 2352 1 1 6 THR N N -3.083 -7.414 -2.669 1.00 . A A . 6 THR N 1 1 8 2353 1 1 6 THR O O -0.759 -4.864 -1.742 1.00 . A A . 6 THR O 1 1 8 2354 1 1 6 THR OG1 O -1.015 -9.163 -3.211 1.00 . A A . 6 THR OG1 1 1 8 2355 1 1 7 LEU C C -3.372 -2.704 -2.501 1.00 . A A . 7 LEU C 1 1 8 2356 1 1 7 LEU CA C -2.371 -3.362 -3.474 1.00 . A A . 7 LEU CA 1 1 8 2357 1 1 7 LEU CB C -2.639 -2.943 -4.930 1.00 . A A . 7 LEU CB 1 1 8 2358 1 1 7 LEU CD1 C -4.650 -1.570 -5.557 1.00 . A A . 7 LEU CD1 1 1 8 2359 1 1 7 LEU CD2 C -4.271 -3.810 -6.641 1.00 . A A . 7 LEU CD2 1 1 8 2360 1 1 7 LEU CG C -4.111 -2.991 -5.361 1.00 . A A . 7 LEU CG 1 1 8 2361 1 1 7 LEU H H -2.953 -5.330 -3.967 1.00 . A A . 7 LEU H 1 1 8 2362 1 1 7 LEU HA H -1.380 -2.991 -3.212 1.00 . A A . 7 LEU HA 1 1 8 2363 1 1 7 LEU HB2 H -2.283 -1.921 -5.059 1.00 . A A . 7 LEU HB2 1 1 8 2364 1 1 7 LEU HB3 H -2.064 -3.595 -5.589 1.00 . A A . 7 LEU HB3 1 1 8 2365 1 1 7 LEU HD11 H -5.695 -1.616 -5.863 1.00 . A A . 7 LEU HD11 1 1 8 2366 1 1 7 LEU HD12 H -4.570 -1.018 -4.621 1.00 . A A . 7 LEU HD12 1 1 8 2367 1 1 7 LEU HD13 H -4.069 -1.064 -6.328 1.00 . A A . 7 LEU HD13 1 1 8 2368 1 1 7 LEU HD21 H -3.921 -4.827 -6.467 1.00 . A A . 7 LEU HD21 1 1 8 2369 1 1 7 LEU HD22 H -5.321 -3.832 -6.930 1.00 . A A . 7 LEU HD22 1 1 8 2370 1 1 7 LEU HD23 H -3.684 -3.355 -7.439 1.00 . A A . 7 LEU HD23 1 1 8 2371 1 1 7 LEU HG H -4.687 -3.472 -4.570 1.00 . A A . 7 LEU HG 1 1 8 2372 1 1 7 LEU N N -2.325 -4.834 -3.364 1.00 . A A . 7 LEU N 1 1 8 2373 1 1 7 LEU O O -3.502 -1.487 -2.488 1.00 . A A . 7 LEU O 1 1 8 2374 1 1 8 THR C C -4.294 -3.010 0.784 1.00 . A A . 8 THR C 1 1 8 2375 1 1 8 THR CA C -4.960 -3.052 -0.610 1.00 . A A . 8 THR CA 1 1 8 2376 1 1 8 THR CB C -6.191 -3.983 -0.656 1.00 . A A . 8 THR CB 1 1 8 2377 1 1 8 THR CG2 C -7.327 -3.586 0.293 1.00 . A A . 8 THR CG2 1 1 8 2378 1 1 8 THR H H -3.928 -4.500 -1.704 1.00 . A A . 8 THR H 1 1 8 2379 1 1 8 THR HA H -5.284 -2.043 -0.864 1.00 . A A . 8 THR HA 1 1 8 2380 1 1 8 THR HB H -5.868 -4.991 -0.401 1.00 . A A . 8 THR HB 1 1 8 2381 1 1 8 THR HG1 H -7.553 -4.506 -2.041 1.00 . A A . 8 THR HG1 1 1 8 2382 1 1 8 THR HG21 H -6.962 -3.595 1.320 1.00 . A A . 8 THR HG21 1 1 8 2383 1 1 8 THR HG22 H -8.149 -4.294 0.194 1.00 . A A . 8 THR HG22 1 1 8 2384 1 1 8 THR HG23 H -7.677 -2.584 0.042 1.00 . A A . 8 THR HG23 1 1 8 2385 1 1 8 THR N N -3.992 -3.503 -1.636 1.00 . A A . 8 THR N 1 1 8 2386 1 1 8 THR O O -4.803 -2.383 1.710 1.00 . A A . 8 THR O 1 1 8 2387 1 1 8 THR OG1 O -6.691 -3.997 -2.000 1.00 . A A . 8 THR OG1 1 1 8 2388 1 1 9 ARG C C -1.086 -2.664 2.033 1.00 . A A . 9 ARG C 1 1 8 2389 1 1 9 ARG CA C -2.294 -3.610 2.123 1.00 . A A . 9 ARG CA 1 1 8 2390 1 1 9 ARG CB C -1.793 -5.011 2.480 1.00 . A A . 9 ARG CB 1 1 8 2391 1 1 9 ARG CD C -2.435 -7.302 3.277 1.00 . A A . 9 ARG CD 1 1 8 2392 1 1 9 ARG CG C -2.950 -5.985 2.705 1.00 . A A . 9 ARG CG 1 1 8 2393 1 1 9 ARG CZ C -2.278 -8.316 5.556 1.00 . A A . 9 ARG CZ 1 1 8 2394 1 1 9 ARG H H -2.775 -4.201 0.154 1.00 . A A . 9 ARG H 1 1 8 2395 1 1 9 ARG HA H -2.928 -3.264 2.940 1.00 . A A . 9 ARG HA 1 1 8 2396 1 1 9 ARG HB2 H -1.173 -5.382 1.664 1.00 . A A . 9 ARG HB2 1 1 8 2397 1 1 9 ARG HB3 H -1.193 -4.954 3.387 1.00 . A A . 9 ARG HB3 1 1 8 2398 1 1 9 ARG HD2 H -3.011 -8.128 2.859 1.00 . A A . 9 ARG HD2 1 1 8 2399 1 1 9 ARG HD3 H -1.384 -7.424 3.016 1.00 . A A . 9 ARG HD3 1 1 8 2400 1 1 9 ARG HE H -2.951 -6.464 5.145 1.00 . A A . 9 ARG HE 1 1 8 2401 1 1 9 ARG HG2 H -3.663 -5.544 3.401 1.00 . A A . 9 ARG HG2 1 1 8 2402 1 1 9 ARG HG3 H -3.447 -6.178 1.754 1.00 . A A . 9 ARG HG3 1 1 8 2403 1 1 9 ARG HH11 H -1.458 -9.468 4.135 1.00 . A A . 9 ARG HH11 1 1 8 2404 1 1 9 ARG HH12 H -1.467 -10.164 5.725 1.00 . A A . 9 ARG HH12 1 1 8 2405 1 1 9 ARG HH21 H -2.958 -7.414 7.236 1.00 . A A . 9 ARG HH21 1 1 8 2406 1 1 9 ARG HH22 H -2.300 -8.999 7.448 1.00 . A A . 9 ARG HH22 1 1 8 2407 1 1 9 ARG N N -3.107 -3.614 0.889 1.00 . A A . 9 ARG N 1 1 8 2408 1 1 9 ARG NE N -2.580 -7.299 4.745 1.00 . A A . 9 ARG NE 1 1 8 2409 1 1 9 ARG NH1 N -1.685 -9.413 5.105 1.00 . A A . 9 ARG NH1 1 1 8 2410 1 1 9 ARG NH2 N -2.529 -8.230 6.854 1.00 . A A . 9 ARG NH2 1 1 8 2411 1 1 9 ARG O O -0.954 -1.756 2.847 1.00 . A A . 9 ARG O 1 1 8 2412 1 1 10 TRP C C 0.325 -0.396 0.521 1.00 . A A . 10 TRP C 1 1 8 2413 1 1 10 TRP CA C 0.819 -1.850 0.715 1.00 . A A . 10 TRP CA 1 1 8 2414 1 1 10 TRP CB C 1.687 -2.403 -0.428 1.00 . A A . 10 TRP CB 1 1 8 2415 1 1 10 TRP CD1 C 1.461 -1.295 -2.696 1.00 . A A . 10 TRP CD1 1 1 8 2416 1 1 10 TRP CD2 C 2.969 -0.347 -1.402 1.00 . A A . 10 TRP CD2 1 1 8 2417 1 1 10 TRP CE2 C 2.878 0.355 -2.593 1.00 . A A . 10 TRP CE2 1 1 8 2418 1 1 10 TRP CE3 C 3.825 0.077 -0.395 1.00 . A A . 10 TRP CE3 1 1 8 2419 1 1 10 TRP CG C 2.056 -1.389 -1.502 1.00 . A A . 10 TRP CG 1 1 8 2420 1 1 10 TRP CH2 C 4.515 1.915 -1.787 1.00 . A A . 10 TRP CH2 1 1 8 2421 1 1 10 TRP CZ2 C 3.663 1.478 -2.794 1.00 . A A . 10 TRP CZ2 1 1 8 2422 1 1 10 TRP CZ3 C 4.585 1.227 -0.578 1.00 . A A . 10 TRP CZ3 1 1 8 2423 1 1 10 TRP H H -0.351 -3.558 0.330 1.00 . A A . 10 TRP H 1 1 8 2424 1 1 10 TRP HA H 1.443 -1.849 1.608 1.00 . A A . 10 TRP HA 1 1 8 2425 1 1 10 TRP HB2 H 2.610 -2.788 0.004 1.00 . A A . 10 TRP HB2 1 1 8 2426 1 1 10 TRP HB3 H 1.154 -3.229 -0.900 1.00 . A A . 10 TRP HB3 1 1 8 2427 1 1 10 TRP HD1 H 0.689 -1.959 -3.061 1.00 . A A . 10 TRP HD1 1 1 8 2428 1 1 10 TRP HE1 H 1.709 0.024 -4.277 1.00 . A A . 10 TRP HE1 1 1 8 2429 1 1 10 TRP HE3 H 3.994 -0.545 0.486 1.00 . A A . 10 TRP HE3 1 1 8 2430 1 1 10 TRP HH2 H 5.210 2.724 -1.989 1.00 . A A . 10 TRP HH2 1 1 8 2431 1 1 10 TRP HZ2 H 3.713 1.945 -3.779 1.00 . A A . 10 TRP HZ2 1 1 8 2432 1 1 10 TRP HZ3 H 5.207 1.611 0.230 1.00 . A A . 10 TRP HZ3 1 1 8 2433 1 1 10 TRP N N -0.287 -2.794 0.974 1.00 . A A . 10 TRP N 1 1 8 2434 1 1 10 TRP NE1 N 1.961 -0.242 -3.353 1.00 . A A . 10 TRP NE1 1 1 8 2435 1 1 10 TRP O O 0.964 0.545 0.989 1.00 . A A . 10 TRP O 1 1 8 2436 1 1 11 ALA C C -2.047 1.646 1.270 1.00 . A A . 11 ALA C 1 1 8 2437 1 1 11 ALA CA C -1.604 1.040 -0.079 1.00 . A A . 11 ALA CA 1 1 8 2438 1 1 11 ALA CB C -2.818 0.927 -0.996 1.00 . A A . 11 ALA CB 1 1 8 2439 1 1 11 ALA H H -1.448 -1.055 -0.252 1.00 . A A . 11 ALA H 1 1 8 2440 1 1 11 ALA HA H -0.910 1.742 -0.541 1.00 . A A . 11 ALA HA 1 1 8 2441 1 1 11 ALA HB1 H -3.364 1.871 -0.995 1.00 . A A . 11 ALA HB1 1 1 8 2442 1 1 11 ALA HB2 H -3.470 0.130 -0.638 1.00 . A A . 11 ALA HB2 1 1 8 2443 1 1 11 ALA HB3 H -2.487 0.699 -2.010 1.00 . A A . 11 ALA HB3 1 1 8 2444 1 1 11 ALA N N -0.908 -0.263 0.030 1.00 . A A . 11 ALA N 1 1 8 2445 1 1 11 ALA O O -2.569 2.755 1.316 1.00 . A A . 11 ALA O 1 1 8 2446 1 1 12 HIS C C -0.666 1.761 4.433 1.00 . A A . 12 HIS C 1 1 8 2447 1 1 12 HIS CA C -1.989 1.352 3.746 1.00 . A A . 12 HIS CA 1 1 8 2448 1 1 12 HIS CB C -2.728 0.199 4.448 1.00 . A A . 12 HIS CB 1 1 8 2449 1 1 12 HIS CD2 C -1.732 -0.387 6.712 1.00 . A A . 12 HIS CD2 1 1 8 2450 1 1 12 HIS CE1 C -3.045 0.672 8.038 1.00 . A A . 12 HIS CE1 1 1 8 2451 1 1 12 HIS CG C -2.673 0.198 5.974 1.00 . A A . 12 HIS CG 1 1 8 2452 1 1 12 HIS H H -1.385 0.002 2.276 1.00 . A A . 12 HIS H 1 1 8 2453 1 1 12 HIS HA H -2.648 2.220 3.734 1.00 . A A . 12 HIS HA 1 1 8 2454 1 1 12 HIS HB2 H -3.776 0.246 4.153 1.00 . A A . 12 HIS HB2 1 1 8 2455 1 1 12 HIS HB3 H -2.313 -0.743 4.090 1.00 . A A . 12 HIS HB3 1 1 8 2456 1 1 12 HIS HD1 H -4.356 1.285 6.544 1.00 . A A . 12 HIS HD1 1 1 8 2457 1 1 12 HIS HD2 H -0.923 -0.997 6.338 1.00 . A A . 12 HIS HD2 1 1 8 2458 1 1 12 HIS HE1 H -3.482 1.087 8.934 1.00 . A A . 12 HIS HE1 1 1 8 2459 1 1 12 HIS HE2 H -1.403 -0.392 8.776 1.00 . A A . 12 HIS HE2 1 1 8 2460 1 1 12 HIS N N -1.768 0.925 2.349 1.00 . A A . 12 HIS N 1 1 8 2461 1 1 12 HIS ND1 N -3.505 0.840 6.803 1.00 . A A . 12 HIS ND1 1 1 8 2462 1 1 12 HIS NE2 N -1.958 -0.091 7.987 1.00 . A A . 12 HIS NE2 1 1 8 2463 1 1 12 HIS O O -0.685 2.440 5.456 1.00 . A A . 12 HIS O 1 1 8 2464 1 1 13 TYR C C 2.213 3.190 4.007 1.00 . A A . 13 TYR C 1 1 8 2465 1 1 13 TYR CA C 1.817 1.727 4.279 1.00 . A A . 13 TYR CA 1 1 8 2466 1 1 13 TYR CB C 2.768 0.754 3.575 1.00 . A A . 13 TYR CB 1 1 8 2467 1 1 13 TYR CD1 C 4.683 0.551 5.197 1.00 . A A . 13 TYR CD1 1 1 8 2468 1 1 13 TYR CD2 C 3.257 -1.366 4.823 1.00 . A A . 13 TYR CD2 1 1 8 2469 1 1 13 TYR CE1 C 5.462 -0.198 6.063 1.00 . A A . 13 TYR CE1 1 1 8 2470 1 1 13 TYR CE2 C 4.043 -2.113 5.687 1.00 . A A . 13 TYR CE2 1 1 8 2471 1 1 13 TYR CG C 3.586 -0.037 4.574 1.00 . A A . 13 TYR CG 1 1 8 2472 1 1 13 TYR CZ C 5.132 -1.523 6.309 1.00 . A A . 13 TYR CZ 1 1 8 2473 1 1 13 TYR H H 0.429 1.031 2.874 1.00 . A A . 13 TYR H 1 1 8 2474 1 1 13 TYR HA H 1.850 1.543 5.353 1.00 . A A . 13 TYR HA 1 1 8 2475 1 1 13 TYR HB2 H 2.182 0.063 2.968 1.00 . A A . 13 TYR HB2 1 1 8 2476 1 1 13 TYR HB3 H 3.440 1.316 2.927 1.00 . A A . 13 TYR HB3 1 1 8 2477 1 1 13 TYR HD1 H 4.901 1.605 5.028 1.00 . A A . 13 TYR HD1 1 1 8 2478 1 1 13 TYR HD2 H 2.380 -1.806 4.352 1.00 . A A . 13 TYR HD2 1 1 8 2479 1 1 13 TYR HE1 H 6.368 0.251 6.476 1.00 . A A . 13 TYR HE1 1 1 8 2480 1 1 13 TYR HE2 H 3.843 -3.179 5.804 1.00 . A A . 13 TYR HE2 1 1 8 2481 1 1 13 TYR HH H 6.572 -1.664 7.582 1.00 . A A . 13 TYR HH 1 1 8 2482 1 1 13 TYR N N 0.455 1.450 3.785 1.00 . A A . 13 TYR N 1 1 8 2483 1 1 13 TYR O O 2.121 4.062 4.872 1.00 . A A . 13 TYR O 1 1 8 2484 1 1 13 TYR OH O 5.874 -2.255 7.186 1.00 . A A . 13 TYR OH 1 1 8 2485 1 1 14 ASN C C 1.538 5.750 2.279 1.00 . A A . 14 ASN C 1 1 8 2486 1 1 14 ASN CA C 2.747 4.814 2.219 1.00 . A A . 14 ASN CA 1 1 8 2487 1 1 14 ASN CB C 3.259 4.765 0.784 1.00 . A A . 14 ASN CB 1 1 8 2488 1 1 14 ASN CG C 4.782 4.717 0.707 1.00 . A A . 14 ASN CG 1 1 8 2489 1 1 14 ASN H H 2.596 2.726 2.059 1.00 . A A . 14 ASN H 1 1 8 2490 1 1 14 ASN HA H 3.532 5.258 2.830 1.00 . A A . 14 ASN HA 1 1 8 2491 1 1 14 ASN HB2 H 2.852 3.881 0.293 1.00 . A A . 14 ASN HB2 1 1 8 2492 1 1 14 ASN HB3 H 2.911 5.653 0.257 1.00 . A A . 14 ASN HB3 1 1 8 2493 1 1 14 ASN HD21 H 4.638 4.691 -1.289 1.00 . A A . 14 ASN HD21 1 1 8 2494 1 1 14 ASN HD22 H 6.244 4.680 -0.607 1.00 . A A . 14 ASN HD22 1 1 8 2495 1 1 14 ASN N N 2.501 3.458 2.734 1.00 . A A . 14 ASN N 1 1 8 2496 1 1 14 ASN ND2 N 5.252 4.641 -0.511 1.00 . A A . 14 ASN ND2 1 1 8 2497 1 1 14 ASN O O 1.710 6.953 2.141 1.00 . A A . 14 ASN O 1 1 8 2498 1 1 14 ASN OD1 O 5.528 4.723 1.676 1.00 . A A . 14 ASN OD1 1 1 8 2499 1 1 15 ALA C C -0.628 7.158 3.871 1.00 . A A . 15 ALA C 1 1 8 2500 1 1 15 ALA CA C -0.855 6.022 2.852 1.00 . A A . 15 ALA CA 1 1 8 2501 1 1 15 ALA CB C -1.980 5.110 3.343 1.00 . A A . 15 ALA CB 1 1 8 2502 1 1 15 ALA H H 0.258 4.237 2.762 1.00 . A A . 15 ALA H 1 1 8 2503 1 1 15 ALA HA H -1.161 6.466 1.905 1.00 . A A . 15 ALA HA 1 1 8 2504 1 1 15 ALA HB1 H -2.347 5.470 4.304 1.00 . A A . 15 ALA HB1 1 1 8 2505 1 1 15 ALA HB2 H -1.600 4.095 3.457 1.00 . A A . 15 ALA HB2 1 1 8 2506 1 1 15 ALA HB3 H -2.793 5.115 2.618 1.00 . A A . 15 ALA HB3 1 1 8 2507 1 1 15 ALA N N 0.365 5.219 2.620 1.00 . A A . 15 ALA N 1 1 8 2508 1 1 15 ALA O O -1.201 8.236 3.744 1.00 . A A . 15 ALA O 1 1 8 2509 1 1 16 LEU C C 2.149 8.560 5.403 1.00 . A A . 16 LEU C 1 1 8 2510 1 1 16 LEU CA C 0.792 7.924 5.759 1.00 . A A . 16 LEU CA 1 1 8 2511 1 1 16 LEU CB C 0.850 7.328 7.169 1.00 . A A . 16 LEU CB 1 1 8 2512 1 1 16 LEU CD1 C -1.392 6.164 7.515 1.00 . A A . 16 LEU CD1 1 1 8 2513 1 1 16 LEU CD2 C -0.300 7.470 9.388 1.00 . A A . 16 LEU CD2 1 1 8 2514 1 1 16 LEU CG C -0.509 7.362 7.877 1.00 . A A . 16 LEU CG 1 1 8 2515 1 1 16 LEU H H 0.797 6.046 4.802 1.00 . A A . 16 LEU H 1 1 8 2516 1 1 16 LEU HA H 0.055 8.726 5.777 1.00 . A A . 16 LEU HA 1 1 8 2517 1 1 16 LEU HB2 H 1.180 6.292 7.097 1.00 . A A . 16 LEU HB2 1 1 8 2518 1 1 16 LEU HB3 H 1.573 7.890 7.761 1.00 . A A . 16 LEU HB3 1 1 8 2519 1 1 16 LEU HD11 H -1.518 6.120 6.433 1.00 . A A . 16 LEU HD11 1 1 8 2520 1 1 16 LEU HD12 H -2.367 6.274 7.990 1.00 . A A . 16 LEU HD12 1 1 8 2521 1 1 16 LEU HD13 H -0.919 5.246 7.863 1.00 . A A . 16 LEU HD13 1 1 8 2522 1 1 16 LEU HD21 H 0.250 8.384 9.614 1.00 . A A . 16 LEU HD21 1 1 8 2523 1 1 16 LEU HD22 H -1.268 7.494 9.888 1.00 . A A . 16 LEU HD22 1 1 8 2524 1 1 16 LEU HD23 H 0.269 6.608 9.738 1.00 . A A . 16 LEU HD23 1 1 8 2525 1 1 16 LEU HG H -1.028 8.265 7.552 1.00 . A A . 16 LEU HG 1 1 8 2526 1 1 16 LEU N N 0.326 6.926 4.776 1.00 . A A . 16 LEU N 1 1 8 2527 1 1 16 LEU O O 2.371 9.733 5.691 1.00 . A A . 16 LEU O 1 1 8 2528 1 1 17 ILE C C 4.171 9.069 2.890 1.00 . A A . 17 ILE C 1 1 8 2529 1 1 17 ILE CA C 4.323 8.279 4.223 1.00 . A A . 17 ILE CA 1 1 8 2530 1 1 17 ILE CB C 5.302 7.086 4.082 1.00 . A A . 17 ILE CB 1 1 8 2531 1 1 17 ILE CD1 C 5.890 4.771 5.094 1.00 . A A . 17 ILE CD1 1 1 8 2532 1 1 17 ILE CG1 C 5.242 6.147 5.305 1.00 . A A . 17 ILE CG1 1 1 8 2533 1 1 17 ILE CG2 C 6.747 7.594 3.934 1.00 . A A . 17 ILE CG2 1 1 8 2534 1 1 17 ILE H H 2.807 6.848 4.503 1.00 . A A . 17 ILE H 1 1 8 2535 1 1 17 ILE HA H 4.734 8.960 4.968 1.00 . A A . 17 ILE HA 1 1 8 2536 1 1 17 ILE HB H 5.036 6.518 3.190 1.00 . A A . 17 ILE HB 1 1 8 2537 1 1 17 ILE HD11 H 5.386 4.254 4.277 1.00 . A A . 17 ILE HD11 1 1 8 2538 1 1 17 ILE HD12 H 5.799 4.183 6.007 1.00 . A A . 17 ILE HD12 1 1 8 2539 1 1 17 ILE HD13 H 6.944 4.900 4.849 1.00 . A A . 17 ILE HD13 1 1 8 2540 1 1 17 ILE HG12 H 5.753 6.638 6.134 1.00 . A A . 17 ILE HG12 1 1 8 2541 1 1 17 ILE HG13 H 4.198 6.000 5.579 1.00 . A A . 17 ILE HG13 1 1 8 2542 1 1 17 ILE HG21 H 6.813 8.261 3.075 1.00 . A A . 17 ILE HG21 1 1 8 2543 1 1 17 ILE HG22 H 7.036 8.135 4.835 1.00 . A A . 17 ILE HG22 1 1 8 2544 1 1 17 ILE HG23 H 7.418 6.746 3.788 1.00 . A A . 17 ILE HG23 1 1 8 2545 1 1 17 ILE N N 3.006 7.801 4.721 1.00 . A A . 17 ILE N 1 1 8 2546 1 1 17 ILE O O 5.152 9.440 2.244 1.00 . A A . 17 ILE O 1 1 8 2547 1 1 18 ARG C C 2.725 9.261 0.012 1.00 . A A . 18 ARG C 1 1 8 2548 1 1 18 ARG CA C 2.462 10.064 1.303 1.00 . A A . 18 ARG CA 1 1 8 2549 1 1 18 ARG CB C 3.080 11.463 1.301 1.00 . A A . 18 ARG CB 1 1 8 2550 1 1 18 ARG CD C 2.794 13.806 0.781 1.00 . A A . 18 ARG CD 1 1 8 2551 1 1 18 ARG CG C 2.451 12.407 0.291 1.00 . A A . 18 ARG CG 1 1 8 2552 1 1 18 ARG CZ C 2.825 16.051 -0.270 1.00 . A A . 18 ARG CZ 1 1 8 2553 1 1 18 ARG H H 2.158 8.931 3.006 1.00 . A A . 18 ARG H 1 1 8 2554 1 1 18 ARG HA H 1.382 10.188 1.390 1.00 . A A . 18 ARG HA 1 1 8 2555 1 1 18 ARG HB2 H 2.960 11.893 2.295 1.00 . A A . 18 ARG HB2 1 1 8 2556 1 1 18 ARG HB3 H 4.144 11.375 1.083 1.00 . A A . 18 ARG HB3 1 1 8 2557 1 1 18 ARG HD2 H 2.271 14.000 1.717 1.00 . A A . 18 ARG HD2 1 1 8 2558 1 1 18 ARG HD3 H 3.869 13.879 0.944 1.00 . A A . 18 ARG HD3 1 1 8 2559 1 1 18 ARG HE H 1.714 14.483 -0.887 1.00 . A A . 18 ARG HE 1 1 8 2560 1 1 18 ARG HG2 H 2.868 12.238 -0.701 1.00 . A A . 18 ARG HG2 1 1 8 2561 1 1 18 ARG HG3 H 1.369 12.271 0.271 1.00 . A A . 18 ARG HG3 1 1 8 2562 1 1 18 ARG HH11 H 3.966 15.936 1.376 1.00 . A A . 18 ARG HH11 1 1 8 2563 1 1 18 ARG HH12 H 3.994 17.474 0.579 1.00 . A A . 18 ARG HH12 1 1 8 2564 1 1 18 ARG HH21 H 1.775 16.506 -1.929 1.00 . A A . 18 ARG HH21 1 1 8 2565 1 1 18 ARG HH22 H 2.747 17.785 -1.282 1.00 . A A . 18 ARG HH22 1 1 8 2566 1 1 18 ARG N N 2.919 9.353 2.518 1.00 . A A . 18 ARG N 1 1 8 2567 1 1 18 ARG NE N 2.386 14.796 -0.220 1.00 . A A . 18 ARG NE 1 1 8 2568 1 1 18 ARG NH1 N 3.670 16.534 0.634 1.00 . A A . 18 ARG NH1 1 1 8 2569 1 1 18 ARG NH2 N 2.412 16.846 -1.243 1.00 . A A . 18 ARG NH2 1 1 8 2570 1 1 18 ARG O O 1.804 8.772 -0.634 1.00 . A A . 18 ARG O 1 1 8 2571 1 1 19 ALA C C 6.065 8.205 -1.125 1.00 . A A . 19 ALA C 1 1 8 2572 1 1 19 ALA CA C 4.558 8.301 -1.387 1.00 . A A . 19 ALA CA 1 1 8 2573 1 1 19 ALA CB C 4.248 8.950 -2.743 1.00 . A A . 19 ALA CB 1 1 8 2574 1 1 19 ALA H H 4.670 9.217 0.496 1.00 . A A . 19 ALA H 1 1 8 2575 1 1 19 ALA HA H 4.142 7.293 -1.384 1.00 . A A . 19 ALA HA 1 1 8 2576 1 1 19 ALA HB1 H 3.168 8.997 -2.886 1.00 . A A . 19 ALA HB1 1 1 8 2577 1 1 19 ALA HB2 H 4.694 8.356 -3.541 1.00 . A A . 19 ALA HB2 1 1 8 2578 1 1 19 ALA HB3 H 4.662 9.958 -2.765 1.00 . A A . 19 ALA HB3 1 1 8 2579 1 1 19 ALA N N 4.005 9.040 -0.234 1.00 . A A . 19 ALA N 1 1 8 2580 1 1 19 ALA O O 6.477 7.214 -0.540 1.00 . A A . 19 ALA O 1 1 8 2581 1 1 20 PHE C C 8.975 8.427 -1.997 1.00 . A A . 20 PHE C 1 1 8 2582 1 1 20 PHE CA C 8.243 9.449 -1.119 1.00 . A A . 20 PHE CA 1 1 8 2583 1 1 20 PHE CB C 8.667 9.334 0.361 1.00 . A A . 20 PHE CB 1 1 8 2584 1 1 20 PHE CD1 C 11.161 9.824 0.449 1.00 . A A . 20 PHE CD1 1 1 8 2585 1 1 20 PHE CD2 C 10.409 7.561 0.802 1.00 . A A . 20 PHE CD2 1 1 8 2586 1 1 20 PHE CE1 C 12.479 9.399 0.572 1.00 . A A . 20 PHE CE1 1 1 8 2587 1 1 20 PHE CE2 C 11.730 7.143 0.926 1.00 . A A . 20 PHE CE2 1 1 8 2588 1 1 20 PHE CG C 10.121 8.905 0.568 1.00 . A A . 20 PHE CG 1 1 8 2589 1 1 20 PHE CZ C 12.761 8.063 0.813 1.00 . A A . 20 PHE CZ 1 1 8 2590 1 1 20 PHE H H 6.293 10.213 -1.364 1.00 . A A . 20 PHE H 1 1 8 2591 1 1 20 PHE HA H 8.529 10.442 -1.466 1.00 . A A . 20 PHE HA 1 1 8 2592 1 1 20 PHE HB2 H 8.517 10.300 0.842 1.00 . A A . 20 PHE HB2 1 1 8 2593 1 1 20 PHE HB3 H 8.022 8.600 0.844 1.00 . A A . 20 PHE HB3 1 1 8 2594 1 1 20 PHE HD1 H 10.941 10.860 0.196 1.00 . A A . 20 PHE HD1 1 1 8 2595 1 1 20 PHE HD2 H 9.600 6.832 0.831 1.00 . A A . 20 PHE HD2 1 1 8 2596 1 1 20 PHE HE1 H 13.290 10.123 0.478 1.00 . A A . 20 PHE HE1 1 1 8 2597 1 1 20 PHE HE2 H 11.949 6.091 1.117 1.00 . A A . 20 PHE HE2 1 1 8 2598 1 1 20 PHE HZ H 13.799 7.736 0.933 1.00 . A A . 20 PHE HZ 1 1 8 2599 1 1 20 PHE N N 6.761 9.344 -1.241 1.00 . A A . 20 PHE N 1 1 8 2600 1 1 20 PHE O O 9.859 8.848 -2.781 1.00 . A A . 20 PHE O 1 1 9 2601 1 1 1 HIS C C -5.558 -13.950 -4.534 1.00 . A A . 1 HIS C 1 1 9 2602 1 1 1 HIS CA C -6.977 -13.756 -5.123 1.00 . A A . 1 HIS CA 1 1 9 2603 1 1 1 HIS CB C -7.949 -14.892 -4.736 1.00 . A A . 1 HIS CB 1 1 9 2604 1 1 1 HIS CD2 C -8.708 -16.923 -6.074 1.00 . A A . 1 HIS CD2 1 1 9 2605 1 1 1 HIS CE1 C -6.819 -17.731 -6.728 1.00 . A A . 1 HIS CE1 1 1 9 2606 1 1 1 HIS CG C -7.740 -16.197 -5.512 1.00 . A A . 1 HIS CG 1 1 9 2607 1 1 1 HIS H1 H -6.099 -13.633 -7.060 1.00 . A A . 1 HIS H1 1 1 9 2608 1 1 1 HIS HA H -7.375 -12.839 -4.687 1.00 . A A . 1 HIS HA 1 1 9 2609 1 1 1 HIS HB2 H -7.838 -15.099 -3.671 1.00 . A A . 1 HIS HB2 1 1 9 2610 1 1 1 HIS HB3 H -8.967 -14.547 -4.918 1.00 . A A . 1 HIS HB3 1 1 9 2611 1 1 1 HIS HD1 H -5.676 -16.381 -5.622 1.00 . A A . 1 HIS HD1 1 1 9 2612 1 1 1 HIS HD2 H -9.770 -16.779 -5.938 1.00 . A A . 1 HIS HD2 1 1 9 2613 1 1 1 HIS HE1 H -6.080 -18.348 -7.218 1.00 . A A . 1 HIS HE1 1 1 9 2614 1 1 1 HIS HE2 H -8.625 -18.539 -7.388 1.00 . A A . 1 HIS HE2 1 1 9 2615 1 1 1 HIS N N -6.987 -13.570 -6.583 1.00 . A A . 1 HIS N 1 1 9 2616 1 1 1 HIS ND1 N -6.576 -16.707 -5.909 1.00 . A A . 1 HIS ND1 1 1 9 2617 1 1 1 HIS NE2 N -8.138 -17.853 -6.830 1.00 . A A . 1 HIS NE2 1 1 9 2618 1 1 1 HIS O O -5.117 -15.042 -4.184 1.00 . A A . 1 HIS O 1 1 9 2619 1 1 2 GLY C C -2.833 -11.389 -4.462 1.00 . A A . 2 GLY C 1 1 9 2620 1 1 2 GLY CA C -3.383 -12.801 -4.244 1.00 . A A . 2 GLY CA 1 1 9 2621 1 1 2 GLY H H -5.170 -11.977 -4.980 1.00 . A A . 2 GLY H 1 1 9 2622 1 1 2 GLY HA2 H -3.294 -13.066 -3.190 1.00 . A A . 2 GLY HA2 1 1 9 2623 1 1 2 GLY HA3 H -2.811 -13.509 -4.845 1.00 . A A . 2 GLY HA3 1 1 9 2624 1 1 2 GLY N N -4.800 -12.852 -4.644 1.00 . A A . 2 GLY N 1 1 9 2625 1 1 2 GLY O O -3.175 -10.487 -3.706 1.00 . A A . 2 GLY O 1 1 9 2626 1 1 3 LEU C C -2.791 -8.701 -6.096 1.00 . A A . 3 LEU C 1 1 9 2627 1 1 3 LEU CA C -1.786 -9.870 -6.115 1.00 . A A . 3 LEU CA 1 1 9 2628 1 1 3 LEU CB C -1.115 -9.953 -7.494 1.00 . A A . 3 LEU CB 1 1 9 2629 1 1 3 LEU CD1 C -1.488 -9.541 -9.930 1.00 . A A . 3 LEU CD1 1 1 9 2630 1 1 3 LEU CD2 C -2.351 -11.657 -8.909 1.00 . A A . 3 LEU CD2 1 1 9 2631 1 1 3 LEU CG C -2.079 -10.170 -8.668 1.00 . A A . 3 LEU CG 1 1 9 2632 1 1 3 LEU H H -2.276 -11.909 -6.354 1.00 . A A . 3 LEU H 1 1 9 2633 1 1 3 LEU HA H -1.002 -9.616 -5.402 1.00 . A A . 3 LEU HA 1 1 9 2634 1 1 3 LEU HB2 H -0.576 -9.021 -7.666 1.00 . A A . 3 LEU HB2 1 1 9 2635 1 1 3 LEU HB3 H -0.396 -10.772 -7.480 1.00 . A A . 3 LEU HB3 1 1 9 2636 1 1 3 LEU HD11 H -2.170 -9.693 -10.766 1.00 . A A . 3 LEU HD11 1 1 9 2637 1 1 3 LEU HD12 H -0.530 -10.010 -10.154 1.00 . A A . 3 LEU HD12 1 1 9 2638 1 1 3 LEU HD13 H -1.341 -8.473 -9.770 1.00 . A A . 3 LEU HD13 1 1 9 2639 1 1 3 LEU HD21 H -1.418 -12.160 -9.160 1.00 . A A . 3 LEU HD21 1 1 9 2640 1 1 3 LEU HD22 H -2.773 -12.099 -8.007 1.00 . A A . 3 LEU HD22 1 1 9 2641 1 1 3 LEU HD23 H -3.057 -11.768 -9.732 1.00 . A A . 3 LEU HD23 1 1 9 2642 1 1 3 LEU HG H -3.023 -9.674 -8.440 1.00 . A A . 3 LEU HG 1 1 9 2643 1 1 3 LEU N N -2.347 -11.170 -5.683 1.00 . A A . 3 LEU N 1 1 9 2644 1 1 3 LEU O O -2.461 -7.608 -5.645 1.00 . A A . 3 LEU O 1 1 9 2645 1 1 4 ALA C C -5.397 -7.480 -4.980 1.00 . A A . 4 ALA C 1 1 9 2646 1 1 4 ALA CA C -5.181 -8.070 -6.390 1.00 . A A . 4 ALA CA 1 1 9 2647 1 1 4 ALA CB C -6.447 -8.786 -6.871 1.00 . A A . 4 ALA CB 1 1 9 2648 1 1 4 ALA H H -4.248 -9.876 -6.903 1.00 . A A . 4 ALA H 1 1 9 2649 1 1 4 ALA HA H -4.981 -7.245 -7.073 1.00 . A A . 4 ALA HA 1 1 9 2650 1 1 4 ALA HB1 H -6.277 -9.196 -7.867 1.00 . A A . 4 ALA HB1 1 1 9 2651 1 1 4 ALA HB2 H -6.690 -9.595 -6.181 1.00 . A A . 4 ALA HB2 1 1 9 2652 1 1 4 ALA HB3 H -7.274 -8.077 -6.906 1.00 . A A . 4 ALA HB3 1 1 9 2653 1 1 4 ALA N N -4.040 -9.008 -6.457 1.00 . A A . 4 ALA N 1 1 9 2654 1 1 4 ALA O O -5.799 -6.330 -4.839 1.00 . A A . 4 ALA O 1 1 9 2655 1 1 5 SER C C -3.553 -7.410 -2.055 1.00 . A A . 5 SER C 1 1 9 2656 1 1 5 SER CA C -4.936 -7.864 -2.555 1.00 . A A . 5 SER CA 1 1 9 2657 1 1 5 SER CB C -5.396 -9.052 -1.708 1.00 . A A . 5 SER CB 1 1 9 2658 1 1 5 SER H H -4.455 -9.089 -4.179 1.00 . A A . 5 SER H 1 1 9 2659 1 1 5 SER HA H -5.641 -7.045 -2.411 1.00 . A A . 5 SER HA 1 1 9 2660 1 1 5 SER HB2 H -5.661 -9.886 -2.359 1.00 . A A . 5 SER HB2 1 1 9 2661 1 1 5 SER HB3 H -4.596 -9.355 -1.033 1.00 . A A . 5 SER HB3 1 1 9 2662 1 1 5 SER HG H -6.765 -9.359 -0.279 1.00 . A A . 5 SER HG 1 1 9 2663 1 1 5 SER N N -4.934 -8.234 -3.984 1.00 . A A . 5 SER N 1 1 9 2664 1 1 5 SER O O -3.450 -6.630 -1.110 1.00 . A A . 5 SER O 1 1 9 2665 1 1 5 SER OG O -6.538 -8.654 -0.951 1.00 . A A . 5 SER OG 1 1 9 2666 1 1 6 THR C C -0.938 -5.902 -2.649 1.00 . A A . 6 THR C 1 1 9 2667 1 1 6 THR CA C -1.091 -7.427 -2.462 1.00 . A A . 6 THR CA 1 1 9 2668 1 1 6 THR CB C -0.131 -8.217 -3.373 1.00 . A A . 6 THR CB 1 1 9 2669 1 1 6 THR CG2 C 1.347 -7.979 -3.041 1.00 . A A . 6 THR CG2 1 1 9 2670 1 1 6 THR H H -2.536 -8.701 -3.272 1.00 . A A . 6 THR H 1 1 9 2671 1 1 6 THR HA H -0.837 -7.661 -1.429 1.00 . A A . 6 THR HA 1 1 9 2672 1 1 6 THR HB H -0.308 -7.922 -4.406 1.00 . A A . 6 THR HB 1 1 9 2673 1 1 6 THR HG1 H 0.298 -10.149 -3.704 1.00 . A A . 6 THR HG1 1 1 9 2674 1 1 6 THR HG21 H 1.542 -8.284 -2.013 1.00 . A A . 6 THR HG21 1 1 9 2675 1 1 6 THR HG22 H 1.970 -8.563 -3.718 1.00 . A A . 6 THR HG22 1 1 9 2676 1 1 6 THR HG23 H 1.579 -6.920 -3.157 1.00 . A A . 6 THR HG23 1 1 9 2677 1 1 6 THR N N -2.484 -7.881 -2.698 1.00 . A A . 6 THR N 1 1 9 2678 1 1 6 THR O O -0.185 -5.259 -1.918 1.00 . A A . 6 THR O 1 1 9 2679 1 1 6 THR OG1 O -0.411 -9.616 -3.239 1.00 . A A . 6 THR OG1 1 1 9 2680 1 1 7 LEU C C -2.890 -3.161 -2.726 1.00 . A A . 7 LEU C 1 1 9 2681 1 1 7 LEU CA C -1.905 -3.862 -3.678 1.00 . A A . 7 LEU CA 1 1 9 2682 1 1 7 LEU CB C -2.260 -3.558 -5.134 1.00 . A A . 7 LEU CB 1 1 9 2683 1 1 7 LEU CD1 C -1.319 -4.206 -7.363 1.00 . A A . 7 LEU CD1 1 1 9 2684 1 1 7 LEU CD2 C -0.504 -2.134 -6.212 1.00 . A A . 7 LEU CD2 1 1 9 2685 1 1 7 LEU CG C -1.007 -3.566 -6.009 1.00 . A A . 7 LEU CG 1 1 9 2686 1 1 7 LEU H H -2.406 -5.867 -4.075 1.00 . A A . 7 LEU H 1 1 9 2687 1 1 7 LEU HA H -0.919 -3.436 -3.492 1.00 . A A . 7 LEU HA 1 1 9 2688 1 1 7 LEU HB2 H -2.958 -4.312 -5.499 1.00 . A A . 7 LEU HB2 1 1 9 2689 1 1 7 LEU HB3 H -2.730 -2.576 -5.190 1.00 . A A . 7 LEU HB3 1 1 9 2690 1 1 7 LEU HD11 H -0.420 -4.207 -7.980 1.00 . A A . 7 LEU HD11 1 1 9 2691 1 1 7 LEU HD12 H -1.656 -5.231 -7.210 1.00 . A A . 7 LEU HD12 1 1 9 2692 1 1 7 LEU HD13 H -2.102 -3.636 -7.862 1.00 . A A . 7 LEU HD13 1 1 9 2693 1 1 7 LEU HD21 H -1.279 -1.542 -6.699 1.00 . A A . 7 LEU HD21 1 1 9 2694 1 1 7 LEU HD22 H 0.389 -2.147 -6.836 1.00 . A A . 7 LEU HD22 1 1 9 2695 1 1 7 LEU HD23 H -0.264 -1.693 -5.244 1.00 . A A . 7 LEU HD23 1 1 9 2696 1 1 7 LEU HG H -0.231 -4.148 -5.512 1.00 . A A . 7 LEU HG 1 1 9 2697 1 1 7 LEU N N -1.788 -5.327 -3.503 1.00 . A A . 7 LEU N 1 1 9 2698 1 1 7 LEU O O -2.934 -1.938 -2.691 1.00 . A A . 7 LEU O 1 1 9 2699 1 1 8 THR C C -3.724 -3.457 0.613 1.00 . A A . 8 THR C 1 1 9 2700 1 1 8 THR CA C -4.416 -3.479 -0.771 1.00 . A A . 8 THR CA 1 1 9 2701 1 1 8 THR CB C -5.655 -4.397 -0.801 1.00 . A A . 8 THR CB 1 1 9 2702 1 1 8 THR CG2 C -6.779 -3.973 0.153 1.00 . A A . 8 THR CG2 1 1 9 2703 1 1 8 THR H H -3.386 -4.935 -1.852 1.00 . A A . 8 THR H 1 1 9 2704 1 1 8 THR HA H -4.732 -2.465 -1.015 1.00 . A A . 8 THR HA 1 1 9 2705 1 1 8 THR HB H -5.341 -5.406 -0.533 1.00 . A A . 8 THR HB 1 1 9 2706 1 1 8 THR HG1 H -7.048 -4.892 -2.166 1.00 . A A . 8 THR HG1 1 1 9 2707 1 1 8 THR HG21 H -7.118 -2.970 -0.108 1.00 . A A . 8 THR HG21 1 1 9 2708 1 1 8 THR HG22 H -7.611 -4.672 0.069 1.00 . A A . 8 THR HG22 1 1 9 2709 1 1 8 THR HG23 H -6.405 -3.974 1.177 1.00 . A A . 8 THR HG23 1 1 9 2710 1 1 8 THR N N -3.469 -3.939 -1.816 1.00 . A A . 8 THR N 1 1 9 2711 1 1 8 THR O O -4.192 -2.811 1.544 1.00 . A A . 8 THR O 1 1 9 2712 1 1 8 THR OG1 O -6.163 -4.425 -2.140 1.00 . A A . 8 THR OG1 1 1 9 2713 1 1 9 ARG C C -0.593 -3.070 1.896 1.00 . A A . 9 ARG C 1 1 9 2714 1 1 9 ARG CA C -1.714 -4.118 1.913 1.00 . A A . 9 ARG CA 1 1 9 2715 1 1 9 ARG CB C -1.100 -5.500 2.133 1.00 . A A . 9 ARG CB 1 1 9 2716 1 1 9 ARG CD C -1.644 -7.424 3.618 1.00 . A A . 9 ARG CD 1 1 9 2717 1 1 9 ARG CG C -2.182 -6.496 2.532 1.00 . A A . 9 ARG CG 1 1 9 2718 1 1 9 ARG CZ C -3.683 -7.813 5.040 1.00 . A A . 9 ARG CZ 1 1 9 2719 1 1 9 ARG H H -2.258 -4.703 -0.036 1.00 . A A . 9 ARG H 1 1 9 2720 1 1 9 ARG HA H -2.357 -3.902 2.766 1.00 . A A . 9 ARG HA 1 1 9 2721 1 1 9 ARG HB2 H -0.626 -5.834 1.211 1.00 . A A . 9 ARG HB2 1 1 9 2722 1 1 9 ARG HB3 H -0.353 -5.442 2.924 1.00 . A A . 9 ARG HB3 1 1 9 2723 1 1 9 ARG HD2 H -0.895 -8.092 3.192 1.00 . A A . 9 ARG HD2 1 1 9 2724 1 1 9 ARG HD3 H -1.196 -6.833 4.416 1.00 . A A . 9 ARG HD3 1 1 9 2725 1 1 9 ARG HE H -2.842 -9.135 3.786 1.00 . A A . 9 ARG HE 1 1 9 2726 1 1 9 ARG HG2 H -3.049 -5.957 2.913 1.00 . A A . 9 ARG HG2 1 1 9 2727 1 1 9 ARG HG3 H -2.473 -7.085 1.662 1.00 . A A . 9 ARG HG3 1 1 9 2728 1 1 9 ARG HH11 H -2.980 -5.942 5.312 1.00 . A A . 9 ARG HH11 1 1 9 2729 1 1 9 ARG HH12 H -4.386 -6.340 6.240 1.00 . A A . 9 ARG HH12 1 1 9 2730 1 1 9 ARG HH21 H -4.680 -9.566 5.013 1.00 . A A . 9 ARG HH21 1 1 9 2731 1 1 9 ARG HH22 H -5.327 -8.351 6.061 1.00 . A A . 9 ARG HH22 1 1 9 2732 1 1 9 ARG N N -2.557 -4.098 0.700 1.00 . A A . 9 ARG N 1 1 9 2733 1 1 9 ARG NE N -2.763 -8.215 4.157 1.00 . A A . 9 ARG NE 1 1 9 2734 1 1 9 ARG NH1 N -3.682 -6.598 5.581 1.00 . A A . 9 ARG NH1 1 1 9 2735 1 1 9 ARG NH2 N -4.641 -8.650 5.400 1.00 . A A . 9 ARG NH2 1 1 9 2736 1 1 9 ARG O O -0.510 -2.231 2.789 1.00 . A A . 9 ARG O 1 1 9 2737 1 1 10 TRP C C 0.636 -0.605 0.540 1.00 . A A . 10 TRP C 1 1 9 2738 1 1 10 TRP CA C 1.234 -2.029 0.621 1.00 . A A . 10 TRP CA 1 1 9 2739 1 1 10 TRP CB C 2.099 -2.445 -0.583 1.00 . A A . 10 TRP CB 1 1 9 2740 1 1 10 TRP CD1 C 1.683 -1.148 -2.722 1.00 . A A . 10 TRP CD1 1 1 9 2741 1 1 10 TRP CD2 C 3.277 -0.292 -1.472 1.00 . A A . 10 TRP CD2 1 1 9 2742 1 1 10 TRP CE2 C 3.095 0.514 -2.588 1.00 . A A . 10 TRP CE2 1 1 9 2743 1 1 10 TRP CE3 C 4.211 0.052 -0.506 1.00 . A A . 10 TRP CE3 1 1 9 2744 1 1 10 TRP CG C 2.368 -1.334 -1.592 1.00 . A A . 10 TRP CG 1 1 9 2745 1 1 10 TRP CH2 C 4.778 2.021 -1.775 1.00 . A A . 10 TRP CH2 1 1 9 2746 1 1 10 TRP CZ2 C 3.848 1.653 -2.750 1.00 . A A . 10 TRP CZ2 1 1 9 2747 1 1 10 TRP CZ3 C 4.950 1.223 -0.648 1.00 . A A . 10 TRP CZ3 1 1 9 2748 1 1 10 TRP H H 0.167 -3.780 0.127 1.00 . A A . 10 TRP H 1 1 9 2749 1 1 10 TRP HA H 1.883 -2.049 1.497 1.00 . A A . 10 TRP HA 1 1 9 2750 1 1 10 TRP HB2 H 3.057 -2.799 -0.205 1.00 . A A . 10 TRP HB2 1 1 9 2751 1 1 10 TRP HB3 H 1.603 -3.268 -1.098 1.00 . A A . 10 TRP HB3 1 1 9 2752 1 1 10 TRP HD1 H 0.881 -1.786 -3.081 1.00 . A A . 10 TRP HD1 1 1 9 2753 1 1 10 TRP HE1 H 1.786 0.309 -4.194 1.00 . A A . 10 TRP HE1 1 1 9 2754 1 1 10 TRP HE3 H 4.451 -0.642 0.301 1.00 . A A . 10 TRP HE3 1 1 9 2755 1 1 10 TRP HH2 H 5.374 2.920 -1.904 1.00 . A A . 10 TRP HH2 1 1 9 2756 1 1 10 TRP HZ2 H 3.810 2.214 -3.686 1.00 . A A . 10 TRP HZ2 1 1 9 2757 1 1 10 TRP HZ3 H 5.644 1.529 0.132 1.00 . A A . 10 TRP HZ3 1 1 9 2758 1 1 10 TRP N N 0.202 -3.065 0.828 1.00 . A A . 10 TRP N 1 1 9 2759 1 1 10 TRP NE1 N 2.117 -0.038 -3.325 1.00 . A A . 10 TRP NE1 1 1 9 2760 1 1 10 TRP O O 1.211 0.350 1.065 1.00 . A A . 10 TRP O 1 1 9 2761 1 1 11 ALA C C -1.880 1.175 1.444 1.00 . A A . 11 ALA C 1 1 9 2762 1 1 11 ALA CA C -1.445 0.677 0.050 1.00 . A A . 11 ALA CA 1 1 9 2763 1 1 11 ALA CB C -2.680 0.439 -0.819 1.00 . A A . 11 ALA CB 1 1 9 2764 1 1 11 ALA H H -1.083 -1.365 -0.256 1.00 . A A . 11 ALA H 1 1 9 2765 1 1 11 ALA HA H -0.858 1.468 -0.418 1.00 . A A . 11 ALA HA 1 1 9 2766 1 1 11 ALA HB1 H -3.404 1.235 -0.647 1.00 . A A . 11 ALA HB1 1 1 9 2767 1 1 11 ALA HB2 H -3.127 -0.521 -0.560 1.00 . A A . 11 ALA HB2 1 1 9 2768 1 1 11 ALA HB3 H -2.390 0.433 -1.870 1.00 . A A . 11 ALA HB3 1 1 9 2769 1 1 11 ALA N N -0.614 -0.547 0.071 1.00 . A A . 11 ALA N 1 1 9 2770 1 1 11 ALA O O -2.405 2.276 1.583 1.00 . A A . 11 ALA O 1 1 9 2771 1 1 12 HIS C C -0.438 1.052 4.643 1.00 . A A . 12 HIS C 1 1 9 2772 1 1 12 HIS CA C -1.751 0.743 3.890 1.00 . A A . 12 HIS CA 1 1 9 2773 1 1 12 HIS CB C -2.494 -0.420 4.555 1.00 . A A . 12 HIS CB 1 1 9 2774 1 1 12 HIS CD2 C -4.929 -0.553 3.745 1.00 . A A . 12 HIS CD2 1 1 9 2775 1 1 12 HIS CE1 C -5.915 0.471 5.362 1.00 . A A . 12 HIS CE1 1 1 9 2776 1 1 12 HIS CG C -3.998 -0.161 4.616 1.00 . A A . 12 HIS CG 1 1 9 2777 1 1 12 HIS H H -1.090 -0.487 2.337 1.00 . A A . 12 HIS H 1 1 9 2778 1 1 12 HIS HA H -2.388 1.627 3.936 1.00 . A A . 12 HIS HA 1 1 9 2779 1 1 12 HIS HB2 H -2.314 -1.328 3.981 1.00 . A A . 12 HIS HB2 1 1 9 2780 1 1 12 HIS HB3 H -2.114 -0.555 5.567 1.00 . A A . 12 HIS HB3 1 1 9 2781 1 1 12 HIS HD1 H -4.157 0.865 6.412 1.00 . A A . 12 HIS HD1 1 1 9 2782 1 1 12 HIS HD2 H -4.753 -1.091 2.825 1.00 . A A . 12 HIS HD2 1 1 9 2783 1 1 12 HIS HE1 H -6.681 0.909 5.985 1.00 . A A . 12 HIS HE1 1 1 9 2784 1 1 12 HIS HE2 H -7.006 -0.322 3.767 1.00 . A A . 12 HIS HE2 1 1 9 2785 1 1 12 HIS N N -1.534 0.400 2.471 1.00 . A A . 12 HIS N 1 1 9 2786 1 1 12 HIS ND1 N -4.608 0.471 5.612 1.00 . A A . 12 HIS ND1 1 1 9 2787 1 1 12 HIS NE2 N -6.112 -0.164 4.211 1.00 . A A . 12 HIS NE2 1 1 9 2788 1 1 12 HIS O O -0.440 1.254 5.855 1.00 . A A . 12 HIS O 1 1 9 2789 1 1 13 TYR C C 2.443 2.949 3.877 1.00 . A A . 13 TYR C 1 1 9 2790 1 1 13 TYR CA C 1.981 1.572 4.357 1.00 . A A . 13 TYR CA 1 1 9 2791 1 1 13 TYR CB C 3.005 0.529 3.906 1.00 . A A . 13 TYR CB 1 1 9 2792 1 1 13 TYR CD1 C 3.511 -0.206 6.272 1.00 . A A . 13 TYR CD1 1 1 9 2793 1 1 13 TYR CD2 C 3.236 -1.876 4.548 1.00 . A A . 13 TYR CD2 1 1 9 2794 1 1 13 TYR CE1 C 3.832 -1.200 7.183 1.00 . A A . 13 TYR CE1 1 1 9 2795 1 1 13 TYR CE2 C 3.562 -2.867 5.461 1.00 . A A . 13 TYR CE2 1 1 9 2796 1 1 13 TYR CG C 3.216 -0.548 4.954 1.00 . A A . 13 TYR CG 1 1 9 2797 1 1 13 TYR CZ C 3.847 -2.522 6.773 1.00 . A A . 13 TYR CZ 1 1 9 2798 1 1 13 TYR H H 0.583 1.007 2.892 1.00 . A A . 13 TYR H 1 1 9 2799 1 1 13 TYR HA H 1.959 1.580 5.447 1.00 . A A . 13 TYR HA 1 1 9 2800 1 1 13 TYR HB2 H 2.650 0.062 2.987 1.00 . A A . 13 TYR HB2 1 1 9 2801 1 1 13 TYR HB3 H 3.956 1.024 3.709 1.00 . A A . 13 TYR HB3 1 1 9 2802 1 1 13 TYR HD1 H 3.486 0.835 6.590 1.00 . A A . 13 TYR HD1 1 1 9 2803 1 1 13 TYR HD2 H 3.001 -2.127 3.515 1.00 . A A . 13 TYR HD2 1 1 9 2804 1 1 13 TYR HE1 H 4.131 -0.920 8.196 1.00 . A A . 13 TYR HE1 1 1 9 2805 1 1 13 TYR HE2 H 3.680 -3.890 5.102 1.00 . A A . 13 TYR HE2 1 1 9 2806 1 1 13 TYR HH H 4.027 -4.383 7.241 1.00 . A A . 13 TYR HH 1 1 9 2807 1 1 13 TYR N N 0.633 1.219 3.869 1.00 . A A . 13 TYR N 1 1 9 2808 1 1 13 TYR O O 2.552 3.888 4.666 1.00 . A A . 13 TYR O 1 1 9 2809 1 1 13 TYR OH O 4.104 -3.497 7.688 1.00 . A A . 13 TYR OH 1 1 9 2810 1 1 14 ASN C C 1.934 5.448 2.233 1.00 . A A . 14 ASN C 1 1 9 2811 1 1 14 ASN CA C 2.940 4.334 1.902 1.00 . A A . 14 ASN CA 1 1 9 2812 1 1 14 ASN CB C 3.112 4.180 0.386 1.00 . A A . 14 ASN CB 1 1 9 2813 1 1 14 ASN CG C 3.348 5.536 -0.287 1.00 . A A . 14 ASN CG 1 1 9 2814 1 1 14 ASN H H 2.538 2.267 1.948 1.00 . A A . 14 ASN H 1 1 9 2815 1 1 14 ASN HA H 3.904 4.651 2.300 1.00 . A A . 14 ASN HA 1 1 9 2816 1 1 14 ASN HB2 H 3.963 3.528 0.187 1.00 . A A . 14 ASN HB2 1 1 9 2817 1 1 14 ASN HB3 H 2.211 3.730 -0.030 1.00 . A A . 14 ASN HB3 1 1 9 2818 1 1 14 ASN HD21 H 5.101 5.849 0.695 1.00 . A A . 14 ASN HD21 1 1 9 2819 1 1 14 ASN HD22 H 4.539 7.110 -0.352 1.00 . A A . 14 ASN HD22 1 1 9 2820 1 1 14 ASN N N 2.605 3.059 2.558 1.00 . A A . 14 ASN N 1 1 9 2821 1 1 14 ASN ND2 N 4.444 6.197 0.036 1.00 . A A . 14 ASN ND2 1 1 9 2822 1 1 14 ASN O O 2.352 6.589 2.316 1.00 . A A . 14 ASN O 1 1 9 2823 1 1 14 ASN OD1 O 2.489 6.065 -0.972 1.00 . A A . 14 ASN OD1 1 1 9 2824 1 1 15 ALA C C 0.303 7.001 4.274 1.00 . A A . 15 ALA C 1 1 9 2825 1 1 15 ALA CA C -0.266 6.042 3.203 1.00 . A A . 15 ALA CA 1 1 9 2826 1 1 15 ALA CB C -1.443 5.242 3.764 1.00 . A A . 15 ALA CB 1 1 9 2827 1 1 15 ALA H H 0.461 4.129 2.726 1.00 . A A . 15 ALA H 1 1 9 2828 1 1 15 ALA HA H -0.630 6.642 2.369 1.00 . A A . 15 ALA HA 1 1 9 2829 1 1 15 ALA HB1 H -2.195 5.927 4.157 1.00 . A A . 15 ALA HB1 1 1 9 2830 1 1 15 ALA HB2 H -1.091 4.591 4.564 1.00 . A A . 15 ALA HB2 1 1 9 2831 1 1 15 ALA HB3 H -1.882 4.637 2.970 1.00 . A A . 15 ALA HB3 1 1 9 2832 1 1 15 ALA N N 0.733 5.086 2.680 1.00 . A A . 15 ALA N 1 1 9 2833 1 1 15 ALA O O -0.102 8.158 4.345 1.00 . A A . 15 ALA O 1 1 9 2834 1 1 16 LEU C C 3.465 7.841 5.429 1.00 . A A . 16 LEU C 1 1 9 2835 1 1 16 LEU CA C 2.107 7.342 5.960 1.00 . A A . 16 LEU CA 1 1 9 2836 1 1 16 LEU CB C 2.340 6.541 7.244 1.00 . A A . 16 LEU CB 1 1 9 2837 1 1 16 LEU CD1 C 0.108 6.573 8.449 1.00 . A A . 16 LEU CD1 1 1 9 2838 1 1 16 LEU CD2 C 2.280 6.873 9.728 1.00 . A A . 16 LEU CD2 1 1 9 2839 1 1 16 LEU CG C 1.538 7.120 8.414 1.00 . A A . 16 LEU CG 1 1 9 2840 1 1 16 LEU H H 1.654 5.597 4.874 1.00 . A A . 16 LEU H 1 1 9 2841 1 1 16 LEU HA H 1.510 8.216 6.218 1.00 . A A . 16 LEU HA 1 1 9 2842 1 1 16 LEU HB2 H 2.038 5.507 7.080 1.00 . A A . 16 LEU HB2 1 1 9 2843 1 1 16 LEU HB3 H 3.401 6.569 7.493 1.00 . A A . 16 LEU HB3 1 1 9 2844 1 1 16 LEU HD11 H -0.427 7.008 9.293 1.00 . A A . 16 LEU HD11 1 1 9 2845 1 1 16 LEU HD12 H 0.137 5.488 8.556 1.00 . A A . 16 LEU HD12 1 1 9 2846 1 1 16 LEU HD13 H -0.403 6.832 7.521 1.00 . A A . 16 LEU HD13 1 1 9 2847 1 1 16 LEU HD21 H 3.257 7.354 9.689 1.00 . A A . 16 LEU HD21 1 1 9 2848 1 1 16 LEU HD22 H 1.703 7.288 10.554 1.00 . A A . 16 LEU HD22 1 1 9 2849 1 1 16 LEU HD23 H 2.408 5.801 9.877 1.00 . A A . 16 LEU HD23 1 1 9 2850 1 1 16 LEU HG H 1.475 8.198 8.269 1.00 . A A . 16 LEU HG 1 1 9 2851 1 1 16 LEU N N 1.330 6.535 4.993 1.00 . A A . 16 LEU N 1 1 9 2852 1 1 16 LEU O O 3.941 8.900 5.830 1.00 . A A . 16 LEU O 1 1 9 2853 1 1 17 ILE C C 5.112 8.343 2.604 1.00 . A A . 17 ILE C 1 1 9 2854 1 1 17 ILE CA C 5.343 7.432 3.842 1.00 . A A . 17 ILE CA 1 1 9 2855 1 1 17 ILE CB C 6.111 6.136 3.470 1.00 . A A . 17 ILE CB 1 1 9 2856 1 1 17 ILE CD1 C 6.448 3.660 4.150 1.00 . A A . 17 ILE CD1 1 1 9 2857 1 1 17 ILE CG1 C 6.065 5.080 4.593 1.00 . A A . 17 ILE CG1 1 1 9 2858 1 1 17 ILE CG2 C 7.587 6.469 3.186 1.00 . A A . 17 ILE CG2 1 1 9 2859 1 1 17 ILE H H 3.561 6.333 4.074 1.00 . A A . 17 ILE H 1 1 9 2860 1 1 17 ILE HA H 5.947 7.988 4.560 1.00 . A A . 17 ILE HA 1 1 9 2861 1 1 17 ILE HB H 5.667 5.711 2.571 1.00 . A A . 17 ILE HB 1 1 9 2862 1 1 17 ILE HD11 H 5.763 3.325 3.372 1.00 . A A . 17 ILE HD11 1 1 9 2863 1 1 17 ILE HD12 H 6.388 2.984 5.003 1.00 . A A . 17 ILE HD12 1 1 9 2864 1 1 17 ILE HD13 H 7.465 3.664 3.760 1.00 . A A . 17 ILE HD13 1 1 9 2865 1 1 17 ILE HG12 H 6.755 5.389 5.379 1.00 . A A . 17 ILE HG12 1 1 9 2866 1 1 17 ILE HG13 H 5.056 5.056 5.006 1.00 . A A . 17 ILE HG13 1 1 9 2867 1 1 17 ILE HG21 H 7.646 7.215 2.394 1.00 . A A . 17 ILE HG21 1 1 9 2868 1 1 17 ILE HG22 H 8.051 6.862 4.090 1.00 . A A . 17 ILE HG22 1 1 9 2869 1 1 17 ILE HG23 H 8.109 5.564 2.873 1.00 . A A . 17 ILE HG23 1 1 9 2870 1 1 17 ILE N N 4.051 7.092 4.495 1.00 . A A . 17 ILE N 1 1 9 2871 1 1 17 ILE O O 5.998 8.563 1.778 1.00 . A A . 17 ILE O 1 1 9 2872 1 1 18 ARG C C 2.797 10.958 1.976 1.00 . A A . 18 ARG C 1 1 9 2873 1 1 18 ARG CA C 3.472 9.732 1.357 1.00 . A A . 18 ARG CA 1 1 9 2874 1 1 18 ARG CB C 2.466 9.002 0.468 1.00 . A A . 18 ARG CB 1 1 9 2875 1 1 18 ARG CD C 0.971 10.048 -1.248 1.00 . A A . 18 ARG CD 1 1 9 2876 1 1 18 ARG CG C 2.390 9.574 -0.947 1.00 . A A . 18 ARG CG 1 1 9 2877 1 1 18 ARG CZ C -0.293 10.554 -3.351 1.00 . A A . 18 ARG CZ 1 1 9 2878 1 1 18 ARG H H 3.125 8.526 3.019 1.00 . A A . 18 ARG H 1 1 9 2879 1 1 18 ARG HA H 4.339 10.037 0.772 1.00 . A A . 18 ARG HA 1 1 9 2880 1 1 18 ARG HB2 H 2.747 7.950 0.408 1.00 . A A . 18 ARG HB2 1 1 9 2881 1 1 18 ARG HB3 H 1.480 9.077 0.926 1.00 . A A . 18 ARG HB3 1 1 9 2882 1 1 18 ARG HD2 H 0.254 9.326 -0.859 1.00 . A A . 18 ARG HD2 1 1 9 2883 1 1 18 ARG HD3 H 0.803 11.020 -0.781 1.00 . A A . 18 ARG HD3 1 1 9 2884 1 1 18 ARG HE H 1.599 9.886 -3.246 1.00 . A A . 18 ARG HE 1 1 9 2885 1 1 18 ARG HG2 H 3.077 10.416 -1.032 1.00 . A A . 18 ARG HG2 1 1 9 2886 1 1 18 ARG HG3 H 2.672 8.803 -1.664 1.00 . A A . 18 ARG HG3 1 1 9 2887 1 1 18 ARG HH11 H -1.368 10.957 -1.705 1.00 . A A . 18 ARG HH11 1 1 9 2888 1 1 18 ARG HH12 H -2.195 11.238 -3.202 1.00 . A A . 18 ARG HH12 1 1 9 2889 1 1 18 ARG HH21 H 0.483 10.266 -5.194 1.00 . A A . 18 ARG HH21 1 1 9 2890 1 1 18 ARG HH22 H -1.144 10.855 -5.146 1.00 . A A . 18 ARG HH22 1 1 9 2891 1 1 18 ARG N N 3.887 8.840 2.451 1.00 . A A . 18 ARG N 1 1 9 2892 1 1 18 ARG NE N 0.810 10.167 -2.708 1.00 . A A . 18 ARG NE 1 1 9 2893 1 1 18 ARG NH1 N -1.381 10.953 -2.702 1.00 . A A . 18 ARG NH1 1 1 9 2894 1 1 18 ARG NH2 N -0.315 10.563 -4.674 1.00 . A A . 18 ARG NH2 1 1 9 2895 1 1 18 ARG O O 1.961 10.849 2.870 1.00 . A A . 18 ARG O 1 1 9 2896 1 1 19 ALA C C 3.346 14.522 0.946 1.00 . A A . 19 ALA C 1 1 9 2897 1 1 19 ALA CA C 2.739 13.444 1.856 1.00 . A A . 19 ALA CA 1 1 9 2898 1 1 19 ALA CB C 3.076 13.771 3.320 1.00 . A A . 19 ALA CB 1 1 9 2899 1 1 19 ALA H H 3.876 12.082 0.704 1.00 . A A . 19 ALA H 1 1 9 2900 1 1 19 ALA HA H 1.655 13.464 1.739 1.00 . A A . 19 ALA HA 1 1 9 2901 1 1 19 ALA HB1 H 2.647 13.009 3.971 1.00 . A A . 19 ALA HB1 1 1 9 2902 1 1 19 ALA HB2 H 4.158 13.791 3.447 1.00 . A A . 19 ALA HB2 1 1 9 2903 1 1 19 ALA HB3 H 2.662 14.745 3.579 1.00 . A A . 19 ALA HB3 1 1 9 2904 1 1 19 ALA N N 3.227 12.103 1.463 1.00 . A A . 19 ALA N 1 1 9 2905 1 1 19 ALA O O 2.636 15.189 0.200 1.00 . A A . 19 ALA O 1 1 9 2906 1 1 20 PHE C C 5.855 14.802 -1.294 1.00 . A A . 20 PHE C 1 1 9 2907 1 1 20 PHE CA C 5.457 15.444 0.049 1.00 . A A . 20 PHE CA 1 1 9 2908 1 1 20 PHE CB C 6.715 15.854 0.828 1.00 . A A . 20 PHE CB 1 1 9 2909 1 1 20 PHE CD1 C 7.865 17.473 -0.770 1.00 . A A . 20 PHE CD1 1 1 9 2910 1 1 20 PHE CD2 C 7.054 18.299 1.343 1.00 . A A . 20 PHE CD2 1 1 9 2911 1 1 20 PHE CE1 C 8.298 18.752 -1.102 1.00 . A A . 20 PHE CE1 1 1 9 2912 1 1 20 PHE CE2 C 7.514 19.573 1.010 1.00 . A A . 20 PHE CE2 1 1 9 2913 1 1 20 PHE CG C 7.229 17.240 0.450 1.00 . A A . 20 PHE CG 1 1 9 2914 1 1 20 PHE CZ C 8.128 19.793 -0.211 1.00 . A A . 20 PHE CZ 1 1 9 2915 1 1 20 PHE H H 5.213 13.840 1.392 1.00 . A A . 20 PHE H 1 1 9 2916 1 1 20 PHE HA H 4.855 16.332 -0.146 1.00 . A A . 20 PHE HA 1 1 9 2917 1 1 20 PHE HB2 H 6.489 15.840 1.894 1.00 . A A . 20 PHE HB2 1 1 9 2918 1 1 20 PHE HB3 H 7.500 15.126 0.625 1.00 . A A . 20 PHE HB3 1 1 9 2919 1 1 20 PHE HD1 H 8.075 16.648 -1.444 1.00 . A A . 20 PHE HD1 1 1 9 2920 1 1 20 PHE HD2 H 6.578 18.124 2.302 1.00 . A A . 20 PHE HD2 1 1 9 2921 1 1 20 PHE HE1 H 8.739 18.927 -2.087 1.00 . A A . 20 PHE HE1 1 1 9 2922 1 1 20 PHE HE2 H 7.424 20.381 1.736 1.00 . A A . 20 PHE HE2 1 1 9 2923 1 1 20 PHE HZ H 8.495 20.795 -0.465 1.00 . A A . 20 PHE HZ 1 1 9 2924 1 1 20 PHE N N 4.673 14.503 0.872 1.00 . A A . 20 PHE N 1 1 9 2925 1 1 20 PHE O O 5.877 13.551 -1.359 1.00 . A A . 20 PHE O 1 1 10 2926 1 1 1 HIS C C -5.886 -13.246 -5.144 1.00 . A A . 1 HIS C 1 1 10 2927 1 1 1 HIS CA C -7.276 -12.786 -5.649 1.00 . A A . 1 HIS CA 1 1 10 2928 1 1 1 HIS CB C -8.416 -13.699 -5.156 1.00 . A A . 1 HIS CB 1 1 10 2929 1 1 1 HIS CD2 C -8.672 -12.353 -2.974 1.00 . A A . 1 HIS CD2 1 1 10 2930 1 1 1 HIS CE1 C -10.134 -13.548 -1.950 1.00 . A A . 1 HIS CE1 1 1 10 2931 1 1 1 HIS CG C -8.913 -13.426 -3.731 1.00 . A A . 1 HIS CG 1 1 10 2932 1 1 1 HIS H1 H -6.515 -12.968 -7.634 1.00 . A A . 1 HIS H1 1 1 10 2933 1 1 1 HIS HA H -7.458 -11.788 -5.252 1.00 . A A . 1 HIS HA 1 1 10 2934 1 1 1 HIS HB2 H -9.260 -13.576 -5.836 1.00 . A A . 1 HIS HB2 1 1 10 2935 1 1 1 HIS HB3 H -8.078 -14.733 -5.211 1.00 . A A . 1 HIS HB3 1 1 10 2936 1 1 1 HIS HD1 H -10.210 -15.025 -3.411 1.00 . A A . 1 HIS HD1 1 1 10 2937 1 1 1 HIS HD2 H -7.980 -11.559 -3.209 1.00 . A A . 1 HIS HD2 1 1 10 2938 1 1 1 HIS HE1 H -10.843 -13.894 -1.213 1.00 . A A . 1 HIS HE1 1 1 10 2939 1 1 1 HIS HE2 H -9.452 -11.750 -1.134 1.00 . A A . 1 HIS HE2 1 1 10 2940 1 1 1 HIS N N -7.340 -12.701 -7.116 1.00 . A A . 1 HIS N 1 1 10 2941 1 1 1 HIS ND1 N -9.819 -14.169 -3.087 1.00 . A A . 1 HIS ND1 1 1 10 2942 1 1 1 HIS NE2 N -9.424 -12.427 -1.883 1.00 . A A . 1 HIS NE2 1 1 10 2943 1 1 1 HIS O O -5.579 -14.436 -5.079 1.00 . A A . 1 HIS O 1 1 10 2944 1 1 2 GLY C C -2.852 -11.094 -4.551 1.00 . A A . 2 GLY C 1 1 10 2945 1 1 2 GLY CA C -3.606 -12.430 -4.598 1.00 . A A . 2 GLY CA 1 1 10 2946 1 1 2 GLY H H -5.275 -11.281 -5.163 1.00 . A A . 2 GLY H 1 1 10 2947 1 1 2 GLY HA2 H -3.585 -12.885 -3.608 1.00 . A A . 2 GLY HA2 1 1 10 2948 1 1 2 GLY HA3 H -3.111 -13.095 -5.307 1.00 . A A . 2 GLY HA3 1 1 10 2949 1 1 2 GLY N N -5.013 -12.239 -5.012 1.00 . A A . 2 GLY N 1 1 10 2950 1 1 2 GLY O O -2.999 -10.327 -3.603 1.00 . A A . 2 GLY O 1 1 10 2951 1 1 3 LEU C C -2.494 -8.207 -5.694 1.00 . A A . 3 LEU C 1 1 10 2952 1 1 3 LEU CA C -1.569 -9.432 -5.842 1.00 . A A . 3 LEU CA 1 1 10 2953 1 1 3 LEU CB C -0.778 -9.342 -7.154 1.00 . A A . 3 LEU CB 1 1 10 2954 1 1 3 LEU CD1 C -1.111 -8.062 -9.276 1.00 . A A . 3 LEU CD1 1 1 10 2955 1 1 3 LEU CD2 C -1.740 -10.501 -9.176 1.00 . A A . 3 LEU CD2 1 1 10 2956 1 1 3 LEU CG C -1.660 -9.187 -8.397 1.00 . A A . 3 LEU CG 1 1 10 2957 1 1 3 LEU H H -2.176 -11.361 -6.461 1.00 . A A . 3 LEU H 1 1 10 2958 1 1 3 LEU HA H -0.840 -9.373 -5.032 1.00 . A A . 3 LEU HA 1 1 10 2959 1 1 3 LEU HB2 H -0.101 -8.490 -7.097 1.00 . A A . 3 LEU HB2 1 1 10 2960 1 1 3 LEU HB3 H -0.188 -10.251 -7.263 1.00 . A A . 3 LEU HB3 1 1 10 2961 1 1 3 LEU HD11 H -1.739 -7.952 -10.161 1.00 . A A . 3 LEU HD11 1 1 10 2962 1 1 3 LEU HD12 H -1.111 -7.129 -8.713 1.00 . A A . 3 LEU HD12 1 1 10 2963 1 1 3 LEU HD13 H -0.093 -8.303 -9.581 1.00 . A A . 3 LEU HD13 1 1 10 2964 1 1 3 LEU HD21 H -0.739 -10.798 -9.490 1.00 . A A . 3 LEU HD21 1 1 10 2965 1 1 3 LEU HD22 H -2.371 -10.366 -10.054 1.00 . A A . 3 LEU HD22 1 1 10 2966 1 1 3 LEU HD23 H -2.165 -11.275 -8.538 1.00 . A A . 3 LEU HD23 1 1 10 2967 1 1 3 LEU HG H -2.664 -8.915 -8.076 1.00 . A A . 3 LEU HG 1 1 10 2968 1 1 3 LEU N N -2.268 -10.729 -5.691 1.00 . A A . 3 LEU N 1 1 10 2969 1 1 3 LEU O O -2.118 -7.207 -5.093 1.00 . A A . 3 LEU O 1 1 10 2970 1 1 4 ALA C C -4.973 -6.945 -4.423 1.00 . A A . 4 ALA C 1 1 10 2971 1 1 4 ALA CA C -4.798 -7.335 -5.906 1.00 . A A . 4 ALA CA 1 1 10 2972 1 1 4 ALA CB C -6.119 -7.832 -6.497 1.00 . A A . 4 ALA CB 1 1 10 2973 1 1 4 ALA H H -4.023 -9.135 -6.674 1.00 . A A . 4 ALA H 1 1 10 2974 1 1 4 ALA HA H -4.501 -6.441 -6.454 1.00 . A A . 4 ALA HA 1 1 10 2975 1 1 4 ALA HB1 H -5.971 -8.101 -7.543 1.00 . A A . 4 ALA HB1 1 1 10 2976 1 1 4 ALA HB2 H -6.458 -8.707 -5.942 1.00 . A A . 4 ALA HB2 1 1 10 2977 1 1 4 ALA HB3 H -6.868 -7.044 -6.428 1.00 . A A . 4 ALA HB3 1 1 10 2978 1 1 4 ALA N N -3.752 -8.361 -6.110 1.00 . A A . 4 ALA N 1 1 10 2979 1 1 4 ALA O O -5.205 -5.783 -4.110 1.00 . A A . 4 ALA O 1 1 10 2980 1 1 5 SER C C -3.234 -7.289 -1.539 1.00 . A A . 5 SER C 1 1 10 2981 1 1 5 SER CA C -4.616 -7.712 -2.077 1.00 . A A . 5 SER CA 1 1 10 2982 1 1 5 SER CB C -5.066 -9.011 -1.397 1.00 . A A . 5 SER CB 1 1 10 2983 1 1 5 SER H H -4.238 -8.755 -3.848 1.00 . A A . 5 SER H 1 1 10 2984 1 1 5 SER HA H -5.332 -6.931 -1.823 1.00 . A A . 5 SER HA 1 1 10 2985 1 1 5 SER HB2 H -6.030 -9.317 -1.804 1.00 . A A . 5 SER HB2 1 1 10 2986 1 1 5 SER HB3 H -4.329 -9.791 -1.583 1.00 . A A . 5 SER HB3 1 1 10 2987 1 1 5 SER HG H -5.439 -9.652 0.467 1.00 . A A . 5 SER HG 1 1 10 2988 1 1 5 SER N N -4.626 -7.887 -3.543 1.00 . A A . 5 SER N 1 1 10 2989 1 1 5 SER O O -3.148 -6.557 -0.556 1.00 . A A . 5 SER O 1 1 10 2990 1 1 5 SER OG O -5.190 -8.799 0.009 1.00 . A A . 5 SER OG 1 1 10 2991 1 1 6 THR C C -0.667 -5.637 -1.931 1.00 . A A . 6 THR C 1 1 10 2992 1 1 6 THR CA C -0.782 -7.174 -1.938 1.00 . A A . 6 THR CA 1 1 10 2993 1 1 6 THR CB C 0.283 -7.860 -2.830 1.00 . A A . 6 THR CB 1 1 10 2994 1 1 6 THR CG2 C 0.705 -7.131 -4.115 1.00 . A A . 6 THR CG2 1 1 10 2995 1 1 6 THR H H -2.242 -8.164 -3.099 1.00 . A A . 6 THR H 1 1 10 2996 1 1 6 THR HA H -0.586 -7.502 -0.917 1.00 . A A . 6 THR HA 1 1 10 2997 1 1 6 THR HB H -0.093 -8.845 -3.109 1.00 . A A . 6 THR HB 1 1 10 2998 1 1 6 THR HG1 H 2.210 -8.339 -2.629 1.00 . A A . 6 THR HG1 1 1 10 2999 1 1 6 THR HG21 H 0.476 -7.755 -4.979 1.00 . A A . 6 THR HG21 1 1 10 3000 1 1 6 THR HG22 H 1.777 -6.931 -4.084 1.00 . A A . 6 THR HG22 1 1 10 3001 1 1 6 THR HG23 H 0.163 -6.189 -4.193 1.00 . A A . 6 THR HG23 1 1 10 3002 1 1 6 THR N N -2.161 -7.622 -2.265 1.00 . A A . 6 THR N 1 1 10 3003 1 1 6 THR O O 0.046 -5.049 -1.115 1.00 . A A . 6 THR O 1 1 10 3004 1 1 6 THR OG1 O 1.455 -8.042 -2.041 1.00 . A A . 6 THR OG1 1 1 10 3005 1 1 7 LEU C C -2.638 -2.972 -1.796 1.00 . A A . 7 LEU C 1 1 10 3006 1 1 7 LEU CA C -1.633 -3.538 -2.817 1.00 . A A . 7 LEU CA 1 1 10 3007 1 1 7 LEU CB C -1.938 -3.117 -4.268 1.00 . A A . 7 LEU CB 1 1 10 3008 1 1 7 LEU CD1 C -3.763 -1.417 -4.642 1.00 . A A . 7 LEU CD1 1 1 10 3009 1 1 7 LEU CD2 C -3.721 -3.528 -6.003 1.00 . A A . 7 LEU CD2 1 1 10 3010 1 1 7 LEU CG C -3.414 -2.910 -4.640 1.00 . A A . 7 LEU CG 1 1 10 3011 1 1 7 LEU H H -2.141 -5.508 -3.347 1.00 . A A . 7 LEU H 1 1 10 3012 1 1 7 LEU HA H -0.656 -3.127 -2.564 1.00 . A A . 7 LEU HA 1 1 10 3013 1 1 7 LEU HB2 H -1.404 -2.189 -4.471 1.00 . A A . 7 LEU HB2 1 1 10 3014 1 1 7 LEU HB3 H -1.539 -3.889 -4.925 1.00 . A A . 7 LEU HB3 1 1 10 3015 1 1 7 LEU HD11 H -3.539 -0.990 -3.665 1.00 . A A . 7 LEU HD11 1 1 10 3016 1 1 7 LEU HD12 H -4.824 -1.292 -4.859 1.00 . A A . 7 LEU HD12 1 1 10 3017 1 1 7 LEU HD13 H -3.174 -0.908 -5.405 1.00 . A A . 7 LEU HD13 1 1 10 3018 1 1 7 LEU HD21 H -4.782 -3.411 -6.225 1.00 . A A . 7 LEU HD21 1 1 10 3019 1 1 7 LEU HD22 H -3.469 -4.588 -5.986 1.00 . A A . 7 LEU HD22 1 1 10 3020 1 1 7 LEU HD23 H -3.131 -3.027 -6.770 1.00 . A A . 7 LEU HD23 1 1 10 3021 1 1 7 LEU HG H -4.030 -3.406 -3.891 1.00 . A A . 7 LEU HG 1 1 10 3022 1 1 7 LEU N N -1.514 -5.005 -2.751 1.00 . A A . 7 LEU N 1 1 10 3023 1 1 7 LEU O O -2.768 -1.761 -1.683 1.00 . A A . 7 LEU O 1 1 10 3024 1 1 8 THR C C -3.558 -3.429 1.455 1.00 . A A . 8 THR C 1 1 10 3025 1 1 8 THR CA C -4.225 -3.448 0.061 1.00 . A A . 8 THR CA 1 1 10 3026 1 1 8 THR CB C -5.422 -4.419 -0.015 1.00 . A A . 8 THR CB 1 1 10 3027 1 1 8 THR CG2 C -6.586 -4.048 0.911 1.00 . A A . 8 THR CG2 1 1 10 3028 1 1 8 THR H H -3.156 -4.823 -1.093 1.00 . A A . 8 THR H 1 1 10 3029 1 1 8 THR HA H -4.586 -2.443 -0.158 1.00 . A A . 8 THR HA 1 1 10 3030 1 1 8 THR HB H -5.075 -5.418 0.250 1.00 . A A . 8 THR HB 1 1 10 3031 1 1 8 THR HG1 H -6.747 -4.971 -1.424 1.00 . A A . 8 THR HG1 1 1 10 3032 1 1 8 THR HG21 H -6.241 -4.044 1.945 1.00 . A A . 8 THR HG21 1 1 10 3033 1 1 8 THR HG22 H -7.387 -4.779 0.798 1.00 . A A . 8 THR HG22 1 1 10 3034 1 1 8 THR HG23 H -6.959 -3.058 0.647 1.00 . A A . 8 THR HG23 1 1 10 3035 1 1 8 THR N N -3.249 -3.830 -0.984 1.00 . A A . 8 THR N 1 1 10 3036 1 1 8 THR O O -4.081 -2.859 2.409 1.00 . A A . 8 THR O 1 1 10 3037 1 1 8 THR OG1 O -5.897 -4.447 -1.367 1.00 . A A . 8 THR OG1 1 1 10 3038 1 1 9 ARG C C -0.338 -3.055 2.684 1.00 . A A . 9 ARG C 1 1 10 3039 1 1 9 ARG CA C -1.508 -4.049 2.733 1.00 . A A . 9 ARG CA 1 1 10 3040 1 1 9 ARG CB C -0.981 -5.476 2.899 1.00 . A A . 9 ARG CB 1 1 10 3041 1 1 9 ARG CD C -2.291 -6.403 4.839 1.00 . A A . 9 ARG CD 1 1 10 3042 1 1 9 ARG CG C -2.116 -6.409 3.320 1.00 . A A . 9 ARG CG 1 1 10 3043 1 1 9 ARG CZ C -1.937 -8.800 5.458 1.00 . A A . 9 ARG CZ 1 1 10 3044 1 1 9 ARG H H -2.010 -4.526 0.750 1.00 . A A . 9 ARG H 1 1 10 3045 1 1 9 ARG HA H -2.129 -3.808 3.596 1.00 . A A . 9 ARG HA 1 1 10 3046 1 1 9 ARG HB2 H -0.565 -5.819 1.951 1.00 . A A . 9 ARG HB2 1 1 10 3047 1 1 9 ARG HB3 H -0.203 -5.487 3.661 1.00 . A A . 9 ARG HB3 1 1 10 3048 1 1 9 ARG HD2 H -1.919 -5.464 5.249 1.00 . A A . 9 ARG HD2 1 1 10 3049 1 1 9 ARG HD3 H -3.347 -6.518 5.086 1.00 . A A . 9 ARG HD3 1 1 10 3050 1 1 9 ARG HE H -0.613 -7.307 5.742 1.00 . A A . 9 ARG HE 1 1 10 3051 1 1 9 ARG HG2 H -3.043 -6.081 2.850 1.00 . A A . 9 ARG HG2 1 1 10 3052 1 1 9 ARG HG3 H -1.885 -7.422 2.990 1.00 . A A . 9 ARG HG3 1 1 10 3053 1 1 9 ARG HH11 H -3.729 -8.463 4.625 1.00 . A A . 9 ARG HH11 1 1 10 3054 1 1 9 ARG HH12 H -3.432 -10.114 5.066 1.00 . A A . 9 ARG HH12 1 1 10 3055 1 1 9 ARG HH21 H -0.241 -9.505 6.302 1.00 . A A . 9 ARG HH21 1 1 10 3056 1 1 9 ARG HH22 H -1.476 -10.680 6.000 1.00 . A A . 9 ARG HH22 1 1 10 3057 1 1 9 ARG N N -2.350 -3.991 1.522 1.00 . A A . 9 ARG N 1 1 10 3058 1 1 9 ARG NE N -1.524 -7.530 5.403 1.00 . A A . 9 ARG NE 1 1 10 3059 1 1 9 ARG NH1 N -3.135 -9.165 5.014 1.00 . A A . 9 ARG NH1 1 1 10 3060 1 1 9 ARG NH2 N -1.150 -9.736 5.964 1.00 . A A . 9 ARG NH2 1 1 10 3061 1 1 9 ARG O O -0.245 -2.164 3.526 1.00 . A A . 9 ARG O 1 1 10 3062 1 1 10 TRP C C 1.017 -0.704 1.265 1.00 . A A . 10 TRP C 1 1 10 3063 1 1 10 TRP CA C 1.540 -2.151 1.384 1.00 . A A . 10 TRP CA 1 1 10 3064 1 1 10 TRP CB C 2.412 -2.631 0.209 1.00 . A A . 10 TRP CB 1 1 10 3065 1 1 10 TRP CD1 C 2.129 -1.407 -1.989 1.00 . A A . 10 TRP CD1 1 1 10 3066 1 1 10 TRP CD2 C 3.686 -0.532 -0.699 1.00 . A A . 10 TRP CD2 1 1 10 3067 1 1 10 TRP CE2 C 3.573 0.225 -1.854 1.00 . A A . 10 TRP CE2 1 1 10 3068 1 1 10 TRP CE3 C 4.584 -0.168 0.294 1.00 . A A . 10 TRP CE3 1 1 10 3069 1 1 10 TRP CG C 2.759 -1.559 -0.815 1.00 . A A . 10 TRP CG 1 1 10 3070 1 1 10 TRP CH2 C 5.257 1.731 -1.032 1.00 . A A . 10 TRP CH2 1 1 10 3071 1 1 10 TRP CZ2 C 4.369 1.344 -2.030 1.00 . A A . 10 TRP CZ2 1 1 10 3072 1 1 10 TRP CZ3 C 5.358 0.978 0.138 1.00 . A A . 10 TRP CZ3 1 1 10 3073 1 1 10 TRP H H 0.401 -3.866 0.944 1.00 . A A . 10 TRP H 1 1 10 3074 1 1 10 TRP HA H 2.174 -2.178 2.269 1.00 . A A . 10 TRP HA 1 1 10 3075 1 1 10 TRP HB2 H 3.339 -3.039 0.611 1.00 . A A . 10 TRP HB2 1 1 10 3076 1 1 10 TRP HB3 H 1.878 -3.429 -0.305 1.00 . A A . 10 TRP HB3 1 1 10 3077 1 1 10 TRP HD1 H 1.339 -2.042 -2.356 1.00 . A A . 10 TRP HD1 1 1 10 3078 1 1 10 TRP HE1 H 2.351 -0.025 -3.516 1.00 . A A . 10 TRP HE1 1 1 10 3079 1 1 10 TRP HE3 H 4.769 -0.830 1.140 1.00 . A A . 10 TRP HE3 1 1 10 3080 1 1 10 TRP HH2 H 5.891 2.603 -1.172 1.00 . A A . 10 TRP HH2 1 1 10 3081 1 1 10 TRP HZ2 H 4.397 1.851 -2.995 1.00 . A A . 10 TRP HZ2 1 1 10 3082 1 1 10 TRP HZ3 H 6.021 1.305 0.936 1.00 . A A . 10 TRP HZ3 1 1 10 3083 1 1 10 TRP N N 0.458 -3.127 1.617 1.00 . A A . 10 TRP N 1 1 10 3084 1 1 10 TRP NE1 N 2.627 -0.329 -2.612 1.00 . A A . 10 TRP NE1 1 1 10 3085 1 1 10 TRP O O 1.604 0.191 1.869 1.00 . A A . 10 TRP O 1 1 10 3086 1 1 11 ALA C C -1.401 1.284 2.042 1.00 . A A . 11 ALA C 1 1 10 3087 1 1 11 ALA CA C -0.918 0.738 0.683 1.00 . A A . 11 ALA CA 1 1 10 3088 1 1 11 ALA CB C -2.109 0.669 -0.268 1.00 . A A . 11 ALA CB 1 1 10 3089 1 1 11 ALA H H -0.746 -1.351 0.453 1.00 . A A . 11 ALA H 1 1 10 3090 1 1 11 ALA HA H -0.218 1.465 0.273 1.00 . A A . 11 ALA HA 1 1 10 3091 1 1 11 ALA HB1 H -2.609 1.638 -0.296 1.00 . A A . 11 ALA HB1 1 1 10 3092 1 1 11 ALA HB2 H -2.809 -0.090 0.081 1.00 . A A . 11 ALA HB2 1 1 10 3093 1 1 11 ALA HB3 H -1.761 0.411 -1.268 1.00 . A A . 11 ALA HB3 1 1 10 3094 1 1 11 ALA N N -0.210 -0.564 0.754 1.00 . A A . 11 ALA N 1 1 10 3095 1 1 11 ALA O O -1.926 2.392 2.125 1.00 . A A . 11 ALA O 1 1 10 3096 1 1 12 HIS C C -0.065 1.229 5.267 1.00 . A A . 12 HIS C 1 1 10 3097 1 1 12 HIS CA C -1.370 0.937 4.497 1.00 . A A . 12 HIS CA 1 1 10 3098 1 1 12 HIS CB C -2.173 -0.181 5.173 1.00 . A A . 12 HIS CB 1 1 10 3099 1 1 12 HIS CD2 C -4.526 0.380 4.284 1.00 . A A . 12 HIS CD2 1 1 10 3100 1 1 12 HIS CE1 C -5.609 0.452 6.142 1.00 . A A . 12 HIS CE1 1 1 10 3101 1 1 12 HIS CG C -3.666 0.121 5.267 1.00 . A A . 12 HIS CG 1 1 10 3102 1 1 12 HIS H H -0.682 -0.365 3.010 1.00 . A A . 12 HIS H 1 1 10 3103 1 1 12 HIS HA H -1.977 1.842 4.490 1.00 . A A . 12 HIS HA 1 1 10 3104 1 1 12 HIS HB2 H -2.041 -1.099 4.598 1.00 . A A . 12 HIS HB2 1 1 10 3105 1 1 12 HIS HB3 H -1.782 -0.337 6.178 1.00 . A A . 12 HIS HB3 1 1 10 3106 1 1 12 HIS HD1 H -3.959 -0.013 7.320 1.00 . A A . 12 HIS HD1 1 1 10 3107 1 1 12 HIS HD2 H -4.292 0.414 3.231 1.00 . A A . 12 HIS HD2 1 1 10 3108 1 1 12 HIS HE1 H -6.408 0.560 6.861 1.00 . A A . 12 HIS HE1 1 1 10 3109 1 1 12 HIS HE2 H -6.573 0.813 4.321 1.00 . A A . 12 HIS HE2 1 1 10 3110 1 1 12 HIS N N -1.117 0.533 3.101 1.00 . A A . 12 HIS N 1 1 10 3111 1 1 12 HIS ND1 N -4.346 0.161 6.422 1.00 . A A . 12 HIS ND1 1 1 10 3112 1 1 12 HIS NE2 N -5.725 0.590 4.824 1.00 . A A . 12 HIS NE2 1 1 10 3113 1 1 12 HIS O O -0.079 1.425 6.480 1.00 . A A . 12 HIS O 1 1 10 3114 1 1 13 TYR C C 2.834 3.109 4.556 1.00 . A A . 13 TYR C 1 1 10 3115 1 1 13 TYR CA C 2.366 1.724 5.020 1.00 . A A . 13 TYR CA 1 1 10 3116 1 1 13 TYR CB C 3.367 0.658 4.559 1.00 . A A . 13 TYR CB 1 1 10 3117 1 1 13 TYR CD1 C 4.295 0.076 6.819 1.00 . A A . 13 TYR CD1 1 1 10 3118 1 1 13 TYR CD2 C 3.395 -1.698 5.451 1.00 . A A . 13 TYR CD2 1 1 10 3119 1 1 13 TYR CE1 C 4.681 -0.848 7.775 1.00 . A A . 13 TYR CE1 1 1 10 3120 1 1 13 TYR CE2 C 3.783 -2.623 6.410 1.00 . A A . 13 TYR CE2 1 1 10 3121 1 1 13 TYR CG C 3.655 -0.349 5.660 1.00 . A A . 13 TYR CG 1 1 10 3122 1 1 13 TYR CZ C 4.412 -2.194 7.570 1.00 . A A . 13 TYR CZ 1 1 10 3123 1 1 13 TYR H H 0.994 1.143 3.536 1.00 . A A . 13 TYR H 1 1 10 3124 1 1 13 TYR HA H 2.332 1.717 6.109 1.00 . A A . 13 TYR HA 1 1 10 3125 1 1 13 TYR HB2 H 2.954 0.132 3.698 1.00 . A A . 13 TYR HB2 1 1 10 3126 1 1 13 TYR HB3 H 4.298 1.144 4.268 1.00 . A A . 13 TYR HB3 1 1 10 3127 1 1 13 TYR HD1 H 4.491 1.137 6.972 1.00 . A A . 13 TYR HD1 1 1 10 3128 1 1 13 TYR HD2 H 2.905 -2.024 4.534 1.00 . A A . 13 TYR HD2 1 1 10 3129 1 1 13 TYR HE1 H 5.262 -0.506 8.633 1.00 . A A . 13 TYR HE1 1 1 10 3130 1 1 13 TYR HE2 H 3.656 -3.688 6.209 1.00 . A A . 13 TYR HE2 1 1 10 3131 1 1 13 TYR HH H 5.126 -2.608 9.309 1.00 . A A . 13 TYR HH 1 1 10 3132 1 1 13 TYR N N 1.021 1.388 4.509 1.00 . A A . 13 TYR N 1 1 10 3133 1 1 13 TYR O O 2.832 4.084 5.311 1.00 . A A . 13 TYR O 1 1 10 3134 1 1 13 TYR OH O 4.727 -3.096 8.536 1.00 . A A . 13 TYR OH 1 1 10 3135 1 1 14 ASN C C 2.281 5.501 2.624 1.00 . A A . 14 ASN C 1 1 10 3136 1 1 14 ASN CA C 3.401 4.449 2.538 1.00 . A A . 14 ASN CA 1 1 10 3137 1 1 14 ASN CB C 3.716 4.137 1.070 1.00 . A A . 14 ASN CB 1 1 10 3138 1 1 14 ASN CG C 2.506 3.548 0.344 1.00 . A A . 14 ASN CG 1 1 10 3139 1 1 14 ASN H H 2.891 2.421 2.636 1.00 . A A . 14 ASN H 1 1 10 3140 1 1 14 ASN HA H 4.297 4.866 2.998 1.00 . A A . 14 ASN HA 1 1 10 3141 1 1 14 ASN HB2 H 4.021 5.055 0.568 1.00 . A A . 14 ASN HB2 1 1 10 3142 1 1 14 ASN HB3 H 4.536 3.420 1.030 1.00 . A A . 14 ASN HB3 1 1 10 3143 1 1 14 ASN HD21 H 2.438 5.097 -0.938 1.00 . A A . 14 ASN HD21 1 1 10 3144 1 1 14 ASN HD22 H 1.208 3.860 -1.089 1.00 . A A . 14 ASN HD22 1 1 10 3145 1 1 14 ASN N N 3.057 3.201 3.247 1.00 . A A . 14 ASN N 1 1 10 3146 1 1 14 ASN ND2 N 2.010 4.247 -0.646 1.00 . A A . 14 ASN ND2 1 1 10 3147 1 1 14 ASN O O 2.498 6.656 2.275 1.00 . A A . 14 ASN O 1 1 10 3148 1 1 14 ASN OD1 O 1.884 2.588 0.765 1.00 . A A . 14 ASN OD1 1 1 10 3149 1 1 15 ALA C C 0.410 7.181 4.322 1.00 . A A . 15 ALA C 1 1 10 3150 1 1 15 ALA CA C -0.019 6.002 3.423 1.00 . A A . 15 ALA CA 1 1 10 3151 1 1 15 ALA CB C -1.127 5.191 4.100 1.00 . A A . 15 ALA CB 1 1 10 3152 1 1 15 ALA H H 0.929 4.133 3.304 1.00 . A A . 15 ALA H 1 1 10 3153 1 1 15 ALA HA H -0.408 6.405 2.489 1.00 . A A . 15 ALA HA 1 1 10 3154 1 1 15 ALA HB1 H -1.418 4.363 3.453 1.00 . A A . 15 ALA HB1 1 1 10 3155 1 1 15 ALA HB2 H -0.763 4.799 5.050 1.00 . A A . 15 ALA HB2 1 1 10 3156 1 1 15 ALA HB3 H -1.990 5.833 4.279 1.00 . A A . 15 ALA HB3 1 1 10 3157 1 1 15 ALA N N 1.106 5.098 3.108 1.00 . A A . 15 ALA N 1 1 10 3158 1 1 15 ALA O O -0.069 8.298 4.147 1.00 . A A . 15 ALA O 1 1 10 3159 1 1 16 LEU C C 3.436 8.464 5.408 1.00 . A A . 16 LEU C 1 1 10 3160 1 1 16 LEU CA C 2.087 7.971 5.965 1.00 . A A . 16 LEU CA 1 1 10 3161 1 1 16 LEU CB C 2.252 7.428 7.391 1.00 . A A . 16 LEU CB 1 1 10 3162 1 1 16 LEU CD1 C 2.392 9.683 8.585 1.00 . A A . 16 LEU CD1 1 1 10 3163 1 1 16 LEU CD2 C 0.161 8.517 8.344 1.00 . A A . 16 LEU CD2 1 1 10 3164 1 1 16 LEU CG C 1.675 8.332 8.497 1.00 . A A . 16 LEU CG 1 1 10 3165 1 1 16 LEU H H 1.846 6.024 5.192 1.00 . A A . 16 LEU H 1 1 10 3166 1 1 16 LEU HA H 1.413 8.826 6.011 1.00 . A A . 16 LEU HA 1 1 10 3167 1 1 16 LEU HB2 H 1.765 6.455 7.450 1.00 . A A . 16 LEU HB2 1 1 10 3168 1 1 16 LEU HB3 H 3.317 7.295 7.583 1.00 . A A . 16 LEU HB3 1 1 10 3169 1 1 16 LEU HD11 H 3.464 9.519 8.693 1.00 . A A . 16 LEU HD11 1 1 10 3170 1 1 16 LEU HD12 H 2.202 10.255 7.677 1.00 . A A . 16 LEU HD12 1 1 10 3171 1 1 16 LEU HD13 H 2.021 10.236 9.448 1.00 . A A . 16 LEU HD13 1 1 10 3172 1 1 16 LEU HD21 H -0.045 9.081 7.435 1.00 . A A . 16 LEU HD21 1 1 10 3173 1 1 16 LEU HD22 H -0.321 7.541 8.284 1.00 . A A . 16 LEU HD22 1 1 10 3174 1 1 16 LEU HD23 H -0.226 9.061 9.205 1.00 . A A . 16 LEU HD23 1 1 10 3175 1 1 16 LEU HG H 1.840 7.820 9.446 1.00 . A A . 16 LEU HG 1 1 10 3176 1 1 16 LEU N N 1.451 6.940 5.123 1.00 . A A . 16 LEU N 1 1 10 3177 1 1 16 LEU O O 3.778 9.632 5.562 1.00 . A A . 16 LEU O 1 1 10 3178 1 1 17 ILE C C 5.192 8.643 2.665 1.00 . A A . 17 ILE C 1 1 10 3179 1 1 17 ILE CA C 5.424 7.920 4.021 1.00 . A A . 17 ILE CA 1 1 10 3180 1 1 17 ILE CB C 6.277 6.632 3.861 1.00 . A A . 17 ILE CB 1 1 10 3181 1 1 17 ILE CD1 C 6.730 4.324 4.942 1.00 . A A . 17 ILE CD1 1 1 10 3182 1 1 17 ILE CG1 C 6.284 5.779 5.145 1.00 . A A . 17 ILE CG1 1 1 10 3183 1 1 17 ILE CG2 C 7.736 6.992 3.525 1.00 . A A . 17 ILE CG2 1 1 10 3184 1 1 17 ILE H H 3.859 6.638 4.598 1.00 . A A . 17 ILE H 1 1 10 3185 1 1 17 ILE HA H 5.972 8.602 4.671 1.00 . A A . 17 ILE HA 1 1 10 3186 1 1 17 ILE HB H 5.865 6.037 3.046 1.00 . A A . 17 ILE HB 1 1 10 3187 1 1 17 ILE HD11 H 6.058 3.832 4.239 1.00 . A A . 17 ILE HD11 1 1 10 3188 1 1 17 ILE HD12 H 6.705 3.798 5.897 1.00 . A A . 17 ILE HD12 1 1 10 3189 1 1 17 ILE HD13 H 7.745 4.307 4.546 1.00 . A A . 17 ILE HD13 1 1 10 3190 1 1 17 ILE HG12 H 6.962 6.245 5.860 1.00 . A A . 17 ILE HG12 1 1 10 3191 1 1 17 ILE HG13 H 5.279 5.778 5.568 1.00 . A A . 17 ILE HG13 1 1 10 3192 1 1 17 ILE HG21 H 7.761 7.598 2.619 1.00 . A A . 17 ILE HG21 1 1 10 3193 1 1 17 ILE HG22 H 8.308 6.078 3.368 1.00 . A A . 17 ILE HG22 1 1 10 3194 1 1 17 ILE HG23 H 8.171 7.556 4.351 1.00 . A A . 17 ILE HG23 1 1 10 3195 1 1 17 ILE N N 4.143 7.589 4.693 1.00 . A A . 17 ILE N 1 1 10 3196 1 1 17 ILE O O 6.141 8.926 1.939 1.00 . A A . 17 ILE O 1 1 10 3197 1 1 18 ARG C C 3.808 8.684 -0.113 1.00 . A A . 18 ARG C 1 1 10 3198 1 1 18 ARG CA C 3.484 9.588 1.083 1.00 . A A . 18 ARG CA 1 1 10 3199 1 1 18 ARG CB C 4.016 11.002 0.806 1.00 . A A . 18 ARG CB 1 1 10 3200 1 1 18 ARG CD C 3.598 13.491 1.008 1.00 . A A . 18 ARG CD 1 1 10 3201 1 1 18 ARG CG C 3.049 12.087 1.284 1.00 . A A . 18 ARG CG 1 1 10 3202 1 1 18 ARG CZ C 4.017 14.989 -0.959 1.00 . A A . 18 ARG CZ 1 1 10 3203 1 1 18 ARG H H 3.192 8.745 2.977 1.00 . A A . 18 ARG H 1 1 10 3204 1 1 18 ARG HA H 2.398 9.664 1.136 1.00 . A A . 18 ARG HA 1 1 10 3205 1 1 18 ARG HB2 H 4.967 11.126 1.325 1.00 . A A . 18 ARG HB2 1 1 10 3206 1 1 18 ARG HB3 H 4.179 11.117 -0.265 1.00 . A A . 18 ARG HB3 1 1 10 3207 1 1 18 ARG HD2 H 3.050 14.210 1.618 1.00 . A A . 18 ARG HD2 1 1 10 3208 1 1 18 ARG HD3 H 4.649 13.515 1.295 1.00 . A A . 18 ARG HD3 1 1 10 3209 1 1 18 ARG HE H 2.973 13.275 -1.003 1.00 . A A . 18 ARG HE 1 1 10 3210 1 1 18 ARG HG2 H 2.096 11.968 0.767 1.00 . A A . 18 ARG HG2 1 1 10 3211 1 1 18 ARG HG3 H 2.892 11.973 2.356 1.00 . A A . 18 ARG HG3 1 1 10 3212 1 1 18 ARG HH11 H 5.071 15.534 0.658 1.00 . A A . 18 ARG HH11 1 1 10 3213 1 1 18 ARG HH12 H 5.241 16.584 -0.712 1.00 . A A . 18 ARG HH12 1 1 10 3214 1 1 18 ARG HH21 H 3.235 14.675 -2.797 1.00 . A A . 18 ARG HH21 1 1 10 3215 1 1 18 ARG HH22 H 4.197 16.102 -2.626 1.00 . A A . 18 ARG HH22 1 1 10 3216 1 1 18 ARG N N 3.938 9.012 2.371 1.00 . A A . 18 ARG N 1 1 10 3217 1 1 18 ARG NE N 3.488 13.889 -0.412 1.00 . A A . 18 ARG NE 1 1 10 3218 1 1 18 ARG NH1 N 4.847 15.775 -0.284 1.00 . A A . 18 ARG NH1 1 1 10 3219 1 1 18 ARG NH2 N 3.791 15.280 -2.231 1.00 . A A . 18 ARG NH2 1 1 10 3220 1 1 18 ARG O O 4.961 8.506 -0.495 1.00 . A A . 18 ARG O 1 1 10 3221 1 1 19 ALA C C 3.668 8.062 -3.054 1.00 . A A . 19 ALA C 1 1 10 3222 1 1 19 ALA CA C 2.904 7.314 -1.945 1.00 . A A . 19 ALA CA 1 1 10 3223 1 1 19 ALA CB C 1.526 6.896 -2.466 1.00 . A A . 19 ALA CB 1 1 10 3224 1 1 19 ALA H H 1.844 8.179 -0.321 1.00 . A A . 19 ALA H 1 1 10 3225 1 1 19 ALA HA H 3.464 6.414 -1.690 1.00 . A A . 19 ALA HA 1 1 10 3226 1 1 19 ALA HB1 H 1.139 7.667 -3.133 1.00 . A A . 19 ALA HB1 1 1 10 3227 1 1 19 ALA HB2 H 0.843 6.768 -1.626 1.00 . A A . 19 ALA HB2 1 1 10 3228 1 1 19 ALA HB3 H 1.612 5.956 -3.011 1.00 . A A . 19 ALA HB3 1 1 10 3229 1 1 19 ALA N N 2.758 8.133 -0.721 1.00 . A A . 19 ALA N 1 1 10 3230 1 1 19 ALA O O 4.656 7.563 -3.585 1.00 . A A . 19 ALA O 1 1 10 3231 1 1 20 PHE C C 4.874 11.188 -3.582 1.00 . A A . 20 PHE C 1 1 10 3232 1 1 20 PHE CA C 3.877 10.217 -4.249 1.00 . A A . 20 PHE CA 1 1 10 3233 1 1 20 PHE CB C 2.731 10.963 -4.945 1.00 . A A . 20 PHE CB 1 1 10 3234 1 1 20 PHE CD1 C 4.129 11.840 -6.904 1.00 . A A . 20 PHE CD1 1 1 10 3235 1 1 20 PHE CD2 C 2.014 10.766 -7.332 1.00 . A A . 20 PHE CD2 1 1 10 3236 1 1 20 PHE CE1 C 4.300 12.031 -8.269 1.00 . A A . 20 PHE CE1 1 1 10 3237 1 1 20 PHE CE2 C 2.191 10.959 -8.696 1.00 . A A . 20 PHE CE2 1 1 10 3238 1 1 20 PHE CG C 2.982 11.202 -6.433 1.00 . A A . 20 PHE CG 1 1 10 3239 1 1 20 PHE CZ C 3.333 11.592 -9.163 1.00 . A A . 20 PHE CZ 1 1 10 3240 1 1 20 PHE H H 2.527 9.712 -2.718 1.00 . A A . 20 PHE H 1 1 10 3241 1 1 20 PHE HA H 4.408 9.616 -4.988 1.00 . A A . 20 PHE HA 1 1 10 3242 1 1 20 PHE HB2 H 1.820 10.376 -4.838 1.00 . A A . 20 PHE HB2 1 1 10 3243 1 1 20 PHE HB3 H 2.588 11.926 -4.454 1.00 . A A . 20 PHE HB3 1 1 10 3244 1 1 20 PHE HD1 H 4.896 12.182 -6.210 1.00 . A A . 20 PHE HD1 1 1 10 3245 1 1 20 PHE HD2 H 1.114 10.277 -6.961 1.00 . A A . 20 PHE HD2 1 1 10 3246 1 1 20 PHE HE1 H 5.205 12.517 -8.637 1.00 . A A . 20 PHE HE1 1 1 10 3247 1 1 20 PHE HE2 H 1.441 10.591 -9.396 1.00 . A A . 20 PHE HE2 1 1 10 3248 1 1 20 PHE HZ H 3.470 11.747 -10.235 1.00 . A A . 20 PHE HZ 1 1 10 3249 1 1 20 PHE N N 3.278 9.322 -3.247 1.00 . A A . 20 PHE N 1 1 10 3250 1 1 20 PHE O O 4.430 12.265 -3.128 1.00 . A A . 20 PHE O 1 1 11 3251 1 1 1 HIS C C -6.123 -13.377 -5.485 1.00 . A A . 1 HIS C 1 1 11 3252 1 1 1 HIS CA C -7.544 -13.052 -6.002 1.00 . A A . 1 HIS CA 1 1 11 3253 1 1 1 HIS CB C -8.627 -13.586 -5.039 1.00 . A A . 1 HIS CB 1 1 11 3254 1 1 1 HIS CD2 C -8.757 -16.014 -5.885 1.00 . A A . 1 HIS CD2 1 1 11 3255 1 1 1 HIS CE1 C -8.786 -17.082 -4.026 1.00 . A A . 1 HIS CE1 1 1 11 3256 1 1 1 HIS CG C -8.692 -15.115 -4.901 1.00 . A A . 1 HIS CG 1 1 11 3257 1 1 1 HIS H1 H -7.056 -14.032 -7.829 1.00 . A A . 1 HIS H1 1 1 11 3258 1 1 1 HIS HA H -7.638 -11.966 -6.015 1.00 . A A . 1 HIS HA 1 1 11 3259 1 1 1 HIS HB2 H -8.434 -13.167 -4.052 1.00 . A A . 1 HIS HB2 1 1 11 3260 1 1 1 HIS HB3 H -9.599 -13.229 -5.381 1.00 . A A . 1 HIS HB3 1 1 11 3261 1 1 1 HIS HD1 H -8.722 -15.375 -2.839 1.00 . A A . 1 HIS HD1 1 1 11 3262 1 1 1 HIS HD2 H -8.765 -15.793 -6.942 1.00 . A A . 1 HIS HD2 1 1 11 3263 1 1 1 HIS HE1 H -8.814 -17.882 -3.301 1.00 . A A . 1 HIS HE1 1 1 11 3264 1 1 1 HIS HE2 H -8.864 -18.097 -5.850 1.00 . A A . 1 HIS HE2 1 1 11 3265 1 1 1 HIS N N -7.797 -13.520 -7.371 1.00 . A A . 1 HIS N 1 1 11 3266 1 1 1 HIS ND1 N -8.721 -15.779 -3.752 1.00 . A A . 1 HIS ND1 1 1 11 3267 1 1 1 HIS NE2 N -8.812 -17.223 -5.346 1.00 . A A . 1 HIS NE2 1 1 11 3268 1 1 1 HIS O O -5.766 -14.537 -5.290 1.00 . A A . 1 HIS O 1 1 11 3269 1 1 2 GLY C C -3.160 -11.101 -5.071 1.00 . A A . 2 GLY C 1 1 11 3270 1 1 2 GLY CA C -3.876 -12.455 -5.041 1.00 . A A . 2 GLY CA 1 1 11 3271 1 1 2 GLY H H -5.580 -11.397 -5.693 1.00 . A A . 2 GLY H 1 1 11 3272 1 1 2 GLY HA2 H -3.837 -12.857 -4.029 1.00 . A A . 2 GLY HA2 1 1 11 3273 1 1 2 GLY HA3 H -3.366 -13.140 -5.718 1.00 . A A . 2 GLY HA3 1 1 11 3274 1 1 2 GLY N N -5.287 -12.332 -5.458 1.00 . A A . 2 GLY N 1 1 11 3275 1 1 2 GLY O O -3.283 -10.306 -4.141 1.00 . A A . 2 GLY O 1 1 11 3276 1 1 3 LEU C C -2.936 -8.257 -6.350 1.00 . A A . 3 LEU C 1 1 11 3277 1 1 3 LEU CA C -1.983 -9.463 -6.485 1.00 . A A . 3 LEU CA 1 1 11 3278 1 1 3 LEU CB C -1.251 -9.405 -7.832 1.00 . A A . 3 LEU CB 1 1 11 3279 1 1 3 LEU CD1 C -1.599 -8.427 -10.104 1.00 . A A . 3 LEU CD1 1 1 11 3280 1 1 3 LEU CD2 C -2.391 -10.763 -9.629 1.00 . A A . 3 LEU CD2 1 1 11 3281 1 1 3 LEU CG C -2.185 -9.364 -9.047 1.00 . A A . 3 LEU CG 1 1 11 3282 1 1 3 LEU H H -2.569 -11.429 -6.998 1.00 . A A . 3 LEU H 1 1 11 3283 1 1 3 LEU HA H -1.223 -9.349 -5.711 1.00 . A A . 3 LEU HA 1 1 11 3284 1 1 3 LEU HB2 H -0.618 -8.518 -7.848 1.00 . A A . 3 LEU HB2 1 1 11 3285 1 1 3 LEU HB3 H -0.618 -10.288 -7.917 1.00 . A A . 3 LEU HB3 1 1 11 3286 1 1 3 LEU HD11 H -2.261 -8.396 -10.969 1.00 . A A . 3 LEU HD11 1 1 11 3287 1 1 3 LEU HD12 H -0.619 -8.791 -10.410 1.00 . A A . 3 LEU HD12 1 1 11 3288 1 1 3 LEU HD13 H -1.499 -7.425 -9.686 1.00 . A A . 3 LEU HD13 1 1 11 3289 1 1 3 LEU HD21 H -3.078 -10.707 -10.474 1.00 . A A . 3 LEU HD21 1 1 11 3290 1 1 3 LEU HD22 H -2.808 -11.418 -8.864 1.00 . A A . 3 LEU HD22 1 1 11 3291 1 1 3 LEU HD23 H -1.433 -11.162 -9.965 1.00 . A A . 3 LEU HD23 1 1 11 3292 1 1 3 LEU HG H -3.151 -8.971 -8.730 1.00 . A A . 3 LEU HG 1 1 11 3293 1 1 3 LEU N N -2.637 -10.769 -6.248 1.00 . A A . 3 LEU N 1 1 11 3294 1 1 3 LEU O O -2.575 -7.238 -5.773 1.00 . A A . 3 LEU O 1 1 11 3295 1 1 4 ALA C C -5.429 -7.033 -5.055 1.00 . A A . 4 ALA C 1 1 11 3296 1 1 4 ALA CA C -5.269 -7.457 -6.531 1.00 . A A . 4 ALA CA 1 1 11 3297 1 1 4 ALA CB C -6.588 -8.004 -7.081 1.00 . A A . 4 ALA CB 1 1 11 3298 1 1 4 ALA H H -4.459 -9.250 -7.277 1.00 . A A . 4 ALA H 1 1 11 3299 1 1 4 ALA HA H -5.009 -6.570 -7.108 1.00 . A A . 4 ALA HA 1 1 11 3300 1 1 4 ALA HB1 H -6.454 -8.298 -8.122 1.00 . A A . 4 ALA HB1 1 1 11 3301 1 1 4 ALA HB2 H -6.894 -8.872 -6.495 1.00 . A A . 4 ALA HB2 1 1 11 3302 1 1 4 ALA HB3 H -7.356 -7.233 -7.016 1.00 . A A . 4 ALA HB3 1 1 11 3303 1 1 4 ALA N N -4.198 -8.457 -6.730 1.00 . A A . 4 ALA N 1 1 11 3304 1 1 4 ALA O O -5.746 -5.886 -4.766 1.00 . A A . 4 ALA O 1 1 11 3305 1 1 5 SER C C -3.605 -7.266 -2.189 1.00 . A A . 5 SER C 1 1 11 3306 1 1 5 SER CA C -4.988 -7.714 -2.702 1.00 . A A . 5 SER CA 1 1 11 3307 1 1 5 SER CB C -5.413 -9.005 -2.002 1.00 . A A . 5 SER CB 1 1 11 3308 1 1 5 SER H H -4.585 -8.784 -4.453 1.00 . A A . 5 SER H 1 1 11 3309 1 1 5 SER HA H -5.713 -6.936 -2.460 1.00 . A A . 5 SER HA 1 1 11 3310 1 1 5 SER HB2 H -6.023 -9.604 -2.677 1.00 . A A . 5 SER HB2 1 1 11 3311 1 1 5 SER HB3 H -4.529 -9.570 -1.708 1.00 . A A . 5 SER HB3 1 1 11 3312 1 1 5 SER HG H -6.416 -9.496 -0.336 1.00 . A A . 5 SER HG 1 1 11 3313 1 1 5 SER N N -5.004 -7.927 -4.161 1.00 . A A . 5 SER N 1 1 11 3314 1 1 5 SER O O -3.514 -6.521 -1.214 1.00 . A A . 5 SER O 1 1 11 3315 1 1 5 SER OG O -6.173 -8.667 -0.843 1.00 . A A . 5 SER OG 1 1 11 3316 1 1 6 THR C C -1.056 -5.587 -2.683 1.00 . A A . 6 THR C 1 1 11 3317 1 1 6 THR CA C -1.157 -7.126 -2.642 1.00 . A A . 6 THR CA 1 1 11 3318 1 1 6 THR CB C -0.103 -7.824 -3.540 1.00 . A A . 6 THR CB 1 1 11 3319 1 1 6 THR CG2 C 0.276 -7.130 -4.858 1.00 . A A . 6 THR CG2 1 1 11 3320 1 1 6 THR H H -2.625 -8.163 -3.745 1.00 . A A . 6 THR H 1 1 11 3321 1 1 6 THR HA H -0.936 -7.423 -1.617 1.00 . A A . 6 THR HA 1 1 11 3322 1 1 6 THR HB H -0.469 -8.822 -3.778 1.00 . A A . 6 THR HB 1 1 11 3323 1 1 6 THR HG1 H 1.839 -8.257 -3.377 1.00 . A A . 6 THR HG1 1 1 11 3324 1 1 6 THR HG21 H -0.275 -6.194 -4.948 1.00 . A A . 6 THR HG21 1 1 11 3325 1 1 6 THR HG22 H 1.346 -6.924 -4.867 1.00 . A A . 6 THR HG22 1 1 11 3326 1 1 6 THR HG23 H 0.025 -7.781 -5.696 1.00 . A A . 6 THR HG23 1 1 11 3327 1 1 6 THR N N -2.538 -7.596 -2.928 1.00 . A A . 6 THR N 1 1 11 3328 1 1 6 THR O O -0.344 -4.972 -1.886 1.00 . A A . 6 THR O 1 1 11 3329 1 1 6 THR OG1 O 1.092 -7.963 -2.776 1.00 . A A . 6 THR OG1 1 1 11 3330 1 1 7 LEU C C -3.038 -2.919 -2.608 1.00 . A A . 7 LEU C 1 1 11 3331 1 1 7 LEU CA C -2.037 -3.519 -3.615 1.00 . A A . 7 LEU CA 1 1 11 3332 1 1 7 LEU CB C -2.364 -3.131 -5.069 1.00 . A A . 7 LEU CB 1 1 11 3333 1 1 7 LEU CD1 C -4.400 -1.745 -5.575 1.00 . A A . 7 LEU CD1 1 1 11 3334 1 1 7 LEU CD2 C -4.042 -3.925 -6.773 1.00 . A A . 7 LEU CD2 1 1 11 3335 1 1 7 LEU CG C -3.848 -3.170 -5.459 1.00 . A A . 7 LEU CG 1 1 11 3336 1 1 7 LEU H H -2.545 -5.506 -4.089 1.00 . A A . 7 LEU H 1 1 11 3337 1 1 7 LEU HA H -1.058 -3.100 -3.383 1.00 . A A . 7 LEU HA 1 1 11 3338 1 1 7 LEU HB2 H -1.989 -2.124 -5.248 1.00 . A A . 7 LEU HB2 1 1 11 3339 1 1 7 LEU HB3 H -1.829 -3.818 -5.725 1.00 . A A . 7 LEU HB3 1 1 11 3340 1 1 7 LEU HD11 H -5.453 -1.784 -5.852 1.00 . A A . 7 LEU HD11 1 1 11 3341 1 1 7 LEU HD12 H -3.844 -1.201 -6.339 1.00 . A A . 7 LEU HD12 1 1 11 3342 1 1 7 LEU HD13 H -4.294 -1.235 -4.617 1.00 . A A . 7 LEU HD13 1 1 11 3343 1 1 7 LEU HD21 H -5.105 -3.974 -7.011 1.00 . A A . 7 LEU HD21 1 1 11 3344 1 1 7 LEU HD22 H -3.644 -4.935 -6.673 1.00 . A A . 7 LEU HD22 1 1 11 3345 1 1 7 LEU HD23 H -3.513 -3.404 -7.572 1.00 . A A . 7 LEU HD23 1 1 11 3346 1 1 7 LEU HG H -4.398 -3.691 -4.675 1.00 . A A . 7 LEU HG 1 1 11 3347 1 1 7 LEU N N -1.919 -4.986 -3.508 1.00 . A A . 7 LEU N 1 1 11 3348 1 1 7 LEU O O -3.186 -1.706 -2.549 1.00 . A A . 7 LEU O 1 1 11 3349 1 1 8 THR C C -3.912 -3.349 0.687 1.00 . A A . 8 THR C 1 1 11 3350 1 1 8 THR CA C -4.585 -3.372 -0.706 1.00 . A A . 8 THR CA 1 1 11 3351 1 1 8 THR CB C -5.780 -4.346 -0.758 1.00 . A A . 8 THR CB 1 1 11 3352 1 1 8 THR CG2 C -6.976 -3.884 0.081 1.00 . A A . 8 THR CG2 1 1 11 3353 1 1 8 THR H H -3.511 -4.753 -1.843 1.00 . A A . 8 THR H 1 1 11 3354 1 1 8 THR HA H -4.948 -2.369 -0.930 1.00 . A A . 8 THR HA 1 1 11 3355 1 1 8 THR HB H -5.454 -5.321 -0.398 1.00 . A A . 8 THR HB 1 1 11 3356 1 1 8 THR HG1 H -7.019 -5.056 -2.180 1.00 . A A . 8 THR HG1 1 1 11 3357 1 1 8 THR HG21 H -7.324 -2.918 -0.283 1.00 . A A . 8 THR HG21 1 1 11 3358 1 1 8 THR HG22 H -7.782 -4.614 0.000 1.00 . A A . 8 THR HG22 1 1 11 3359 1 1 8 THR HG23 H -6.673 -3.792 1.125 1.00 . A A . 8 THR HG23 1 1 11 3360 1 1 8 THR N N -3.609 -3.762 -1.750 1.00 . A A . 8 THR N 1 1 11 3361 1 1 8 THR O O -4.433 -2.767 1.635 1.00 . A A . 8 THR O 1 1 11 3362 1 1 8 THR OG1 O -6.204 -4.477 -2.120 1.00 . A A . 8 THR OG1 1 1 11 3363 1 1 9 ARG C C -0.724 -2.914 1.913 1.00 . A A . 9 ARG C 1 1 11 3364 1 1 9 ARG CA C -1.850 -3.963 1.959 1.00 . A A . 9 ARG CA 1 1 11 3365 1 1 9 ARG CB C -1.258 -5.370 2.093 1.00 . A A . 9 ARG CB 1 1 11 3366 1 1 9 ARG CD C -2.380 -6.591 3.997 1.00 . A A . 9 ARG CD 1 1 11 3367 1 1 9 ARG CG C -2.335 -6.385 2.484 1.00 . A A . 9 ARG CG 1 1 11 3368 1 1 9 ARG CZ C -1.368 -8.317 5.518 1.00 . A A . 9 ARG CZ 1 1 11 3369 1 1 9 ARG H H -2.373 -4.462 -0.012 1.00 . A A . 9 ARG H 1 1 11 3370 1 1 9 ARG HA H -2.471 -3.765 2.832 1.00 . A A . 9 ARG HA 1 1 11 3371 1 1 9 ARG HB2 H -0.816 -5.664 1.141 1.00 . A A . 9 ARG HB2 1 1 11 3372 1 1 9 ARG HB3 H -0.484 -5.359 2.860 1.00 . A A . 9 ARG HB3 1 1 11 3373 1 1 9 ARG HD2 H -1.888 -5.756 4.497 1.00 . A A . 9 ARG HD2 1 1 11 3374 1 1 9 ARG HD3 H -3.416 -6.660 4.331 1.00 . A A . 9 ARG HD3 1 1 11 3375 1 1 9 ARG HE H -1.424 -8.396 3.516 1.00 . A A . 9 ARG HE 1 1 11 3376 1 1 9 ARG HG2 H -3.306 -6.021 2.146 1.00 . A A . 9 ARG HG2 1 1 11 3377 1 1 9 ARG HG3 H -2.122 -7.337 1.999 1.00 . A A . 9 ARG HG3 1 1 11 3378 1 1 9 ARG HH11 H -1.988 -6.707 6.547 1.00 . A A . 9 ARG HH11 1 1 11 3379 1 1 9 ARG HH12 H -1.342 -7.990 7.516 1.00 . A A . 9 ARG HH12 1 1 11 3380 1 1 9 ARG HH21 H -0.587 -10.050 4.825 1.00 . A A . 9 ARG HH21 1 1 11 3381 1 1 9 ARG HH22 H -0.554 -9.844 6.543 1.00 . A A . 9 ARG HH22 1 1 11 3382 1 1 9 ARG N N -2.707 -3.917 0.755 1.00 . A A . 9 ARG N 1 1 11 3383 1 1 9 ARG NE N -1.670 -7.846 4.308 1.00 . A A . 9 ARG NE 1 1 11 3384 1 1 9 ARG NH1 N -1.582 -7.615 6.623 1.00 . A A . 9 ARG NH1 1 1 11 3385 1 1 9 ARG NH2 N -0.782 -9.499 5.633 1.00 . A A . 9 ARG NH2 1 1 11 3386 1 1 9 ARG O O -0.667 -2.030 2.764 1.00 . A A . 9 ARG O 1 1 11 3387 1 1 10 TRP C C 0.500 -0.453 0.509 1.00 . A A . 10 TRP C 1 1 11 3388 1 1 10 TRP CA C 1.090 -1.879 0.612 1.00 . A A . 10 TRP CA 1 1 11 3389 1 1 10 TRP CB C 1.966 -2.309 -0.580 1.00 . A A . 10 TRP CB 1 1 11 3390 1 1 10 TRP CD1 C 1.587 -1.064 -2.755 1.00 . A A . 10 TRP CD1 1 1 11 3391 1 1 10 TRP CD2 C 3.142 -0.161 -1.484 1.00 . A A . 10 TRP CD2 1 1 11 3392 1 1 10 TRP CE2 C 2.982 0.618 -2.620 1.00 . A A . 10 TRP CE2 1 1 11 3393 1 1 10 TRP CE3 C 4.063 0.204 -0.511 1.00 . A A . 10 TRP CE3 1 1 11 3394 1 1 10 TRP CG C 2.249 -1.214 -1.598 1.00 . A A . 10 TRP CG 1 1 11 3395 1 1 10 TRP CH2 C 4.661 2.136 -1.823 1.00 . A A . 10 TRP CH2 1 1 11 3396 1 1 10 TRP CZ2 C 3.742 1.749 -2.801 1.00 . A A . 10 TRP CZ2 1 1 11 3397 1 1 10 TRP CZ3 C 4.812 1.363 -0.673 1.00 . A A . 10 TRP CZ3 1 1 11 3398 1 1 10 TRP H H 0.043 -3.650 0.156 1.00 . A A . 10 TRP H 1 1 11 3399 1 1 10 TRP HA H 1.736 -1.885 1.491 1.00 . A A . 10 TRP HA 1 1 11 3400 1 1 10 TRP HB2 H 2.920 -2.662 -0.189 1.00 . A A . 10 TRP HB2 1 1 11 3401 1 1 10 TRP HB3 H 1.473 -3.137 -1.090 1.00 . A A . 10 TRP HB3 1 1 11 3402 1 1 10 TRP HD1 H 0.821 -1.726 -3.126 1.00 . A A . 10 TRP HD1 1 1 11 3403 1 1 10 TRP HE1 H 1.729 0.354 -4.261 1.00 . A A . 10 TRP HE1 1 1 11 3404 1 1 10 TRP HE3 H 4.276 -0.463 0.325 1.00 . A A . 10 TRP HE3 1 1 11 3405 1 1 10 TRP HH2 H 5.228 3.055 -1.940 1.00 . A A . 10 TRP HH2 1 1 11 3406 1 1 10 TRP HZ2 H 3.713 2.296 -3.746 1.00 . A A . 10 TRP HZ2 1 1 11 3407 1 1 10 TRP HZ3 H 5.460 1.715 0.129 1.00 . A A . 10 TRP HZ3 1 1 11 3408 1 1 10 TRP N N 0.061 -2.916 0.838 1.00 . A A . 10 TRP N 1 1 11 3409 1 1 10 TRP NE1 N 2.031 0.041 -3.372 1.00 . A A . 10 TRP NE1 1 1 11 3410 1 1 10 TRP O O 1.090 0.507 1.006 1.00 . A A . 10 TRP O 1 1 11 3411 1 1 11 ALA C C -1.992 1.387 1.385 1.00 . A A . 11 ALA C 1 1 11 3412 1 1 11 ALA CA C -1.548 0.865 0.003 1.00 . A A . 11 ALA CA 1 1 11 3413 1 1 11 ALA CB C -2.780 0.677 -0.879 1.00 . A A . 11 ALA CB 1 1 11 3414 1 1 11 ALA H H -1.228 -1.198 -0.279 1.00 . A A . 11 ALA H 1 1 11 3415 1 1 11 ALA HA H -0.930 1.636 -0.457 1.00 . A A . 11 ALA HA 1 1 11 3416 1 1 11 ALA HB1 H -3.437 1.542 -0.775 1.00 . A A . 11 ALA HB1 1 1 11 3417 1 1 11 ALA HB2 H -2.472 0.580 -1.919 1.00 . A A . 11 ALA HB2 1 1 11 3418 1 1 11 ALA HB3 H -3.313 -0.223 -0.572 1.00 . A A . 11 ALA HB3 1 1 11 3419 1 1 11 ALA N N -0.748 -0.383 0.040 1.00 . A A . 11 ALA N 1 1 11 3420 1 1 11 ALA O O -2.551 2.474 1.497 1.00 . A A . 11 ALA O 1 1 11 3421 1 1 12 HIS C C -0.558 1.427 4.528 1.00 . A A . 12 HIS C 1 1 11 3422 1 1 12 HIS CA C -1.870 0.978 3.841 1.00 . A A . 12 HIS CA 1 1 11 3423 1 1 12 HIS CB C -2.518 -0.254 4.495 1.00 . A A . 12 HIS CB 1 1 11 3424 1 1 12 HIS CD2 C -1.471 -0.870 6.730 1.00 . A A . 12 HIS CD2 1 1 11 3425 1 1 12 HIS CE1 C -2.850 0.030 8.106 1.00 . A A . 12 HIS CE1 1 1 11 3426 1 1 12 HIS CG C -2.457 -0.320 6.025 1.00 . A A . 12 HIS CG 1 1 11 3427 1 1 12 HIS H H -1.222 -0.267 2.299 1.00 . A A . 12 HIS H 1 1 11 3428 1 1 12 HIS HA H -2.580 1.804 3.887 1.00 . A A . 12 HIS HA 1 1 11 3429 1 1 12 HIS HB2 H -3.565 -0.291 4.193 1.00 . A A . 12 HIS HB2 1 1 11 3430 1 1 12 HIS HB3 H -2.018 -1.140 4.103 1.00 . A A . 12 HIS HB3 1 1 11 3431 1 1 12 HIS HD1 H -4.213 0.608 6.642 1.00 . A A . 12 HIS HD1 1 1 11 3432 1 1 12 HIS HD2 H -0.624 -1.404 6.326 1.00 . A A . 12 HIS HD2 1 1 11 3433 1 1 12 HIS HE1 H -3.314 0.371 9.019 1.00 . A A . 12 HIS HE1 1 1 11 3434 1 1 12 HIS HE2 H -1.131 -0.944 8.792 1.00 . A A . 12 HIS HE2 1 1 11 3435 1 1 12 HIS N N -1.653 0.630 2.423 1.00 . A A . 12 HIS N 1 1 11 3436 1 1 12 HIS ND1 N -3.322 0.218 6.876 1.00 . A A . 12 HIS ND1 1 1 11 3437 1 1 12 HIS NE2 N -1.710 -0.649 8.018 1.00 . A A . 12 HIS NE2 1 1 11 3438 1 1 12 HIS O O -0.596 2.019 5.601 1.00 . A A . 12 HIS O 1 1 11 3439 1 1 13 TYR C C 2.414 2.926 3.850 1.00 . A A . 13 TYR C 1 1 11 3440 1 1 13 TYR CA C 1.910 1.559 4.343 1.00 . A A . 13 TYR CA 1 1 11 3441 1 1 13 TYR CB C 2.821 0.425 3.867 1.00 . A A . 13 TYR CB 1 1 11 3442 1 1 13 TYR CD1 C 3.584 -0.847 5.874 1.00 . A A . 13 TYR CD1 1 1 11 3443 1 1 13 TYR CD2 C 5.125 0.729 4.889 1.00 . A A . 13 TYR CD2 1 1 11 3444 1 1 13 TYR CE1 C 4.543 -1.213 6.803 1.00 . A A . 13 TYR CE1 1 1 11 3445 1 1 13 TYR CE2 C 6.084 0.364 5.824 1.00 . A A . 13 TYR CE2 1 1 11 3446 1 1 13 TYR CG C 3.877 0.115 4.916 1.00 . A A . 13 TYR CG 1 1 11 3447 1 1 13 TYR CZ C 5.787 -0.598 6.778 1.00 . A A . 13 TYR CZ 1 1 11 3448 1 1 13 TYR H H 0.541 0.917 2.886 1.00 . A A . 13 TYR H 1 1 11 3449 1 1 13 TYR HA H 1.878 1.561 5.432 1.00 . A A . 13 TYR HA 1 1 11 3450 1 1 13 TYR HB2 H 2.222 -0.467 3.685 1.00 . A A . 13 TYR HB2 1 1 11 3451 1 1 13 TYR HB3 H 3.313 0.725 2.942 1.00 . A A . 13 TYR HB3 1 1 11 3452 1 1 13 TYR HD1 H 2.588 -1.287 5.910 1.00 . A A . 13 TYR HD1 1 1 11 3453 1 1 13 TYR HD2 H 5.342 1.503 4.154 1.00 . A A . 13 TYR HD2 1 1 11 3454 1 1 13 TYR HE1 H 4.328 -2.038 7.484 1.00 . A A . 13 TYR HE1 1 1 11 3455 1 1 13 TYR HE2 H 7.088 0.788 5.758 1.00 . A A . 13 TYR HE2 1 1 11 3456 1 1 13 TYR HH H 6.316 -1.588 8.343 1.00 . A A . 13 TYR HH 1 1 11 3457 1 1 13 TYR N N 0.560 1.281 3.818 1.00 . A A . 13 TYR N 1 1 11 3458 1 1 13 TYR O O 2.447 3.901 4.601 1.00 . A A . 13 TYR O 1 1 11 3459 1 1 13 TYR OH O 6.720 -0.931 7.710 1.00 . A A . 13 TYR OH 1 1 11 3460 1 1 14 ASN C C 1.781 5.336 2.040 1.00 . A A . 14 ASN C 1 1 11 3461 1 1 14 ASN CA C 2.893 4.293 1.848 1.00 . A A . 14 ASN CA 1 1 11 3462 1 1 14 ASN CB C 3.156 4.078 0.354 1.00 . A A . 14 ASN CB 1 1 11 3463 1 1 14 ASN CG C 3.388 5.389 -0.404 1.00 . A A . 14 ASN CG 1 1 11 3464 1 1 14 ASN H H 2.606 2.208 1.942 1.00 . A A . 14 ASN H 1 1 11 3465 1 1 14 ASN HA H 3.804 4.702 2.286 1.00 . A A . 14 ASN HA 1 1 11 3466 1 1 14 ASN HB2 H 4.042 3.451 0.244 1.00 . A A . 14 ASN HB2 1 1 11 3467 1 1 14 ASN HB3 H 2.301 3.563 -0.084 1.00 . A A . 14 ASN HB3 1 1 11 3468 1 1 14 ASN HD21 H 1.486 5.368 -1.083 1.00 . A A . 14 ASN HD21 1 1 11 3469 1 1 14 ASN HD22 H 2.476 6.734 -1.517 1.00 . A A . 14 ASN HD22 1 1 11 3470 1 1 14 ASN N N 2.606 3.019 2.532 1.00 . A A . 14 ASN N 1 1 11 3471 1 1 14 ASN ND2 N 2.356 5.848 -1.082 1.00 . A A . 14 ASN ND2 1 1 11 3472 1 1 14 ASN O O 2.032 6.511 1.840 1.00 . A A . 14 ASN O 1 1 11 3473 1 1 14 ASN OD1 O 4.398 6.063 -0.278 1.00 . A A . 14 ASN OD1 1 1 11 3474 1 1 15 ALA C C 0.000 7.078 3.731 1.00 . A A . 15 ALA C 1 1 11 3475 1 1 15 ALA CA C -0.478 5.891 2.864 1.00 . A A . 15 ALA CA 1 1 11 3476 1 1 15 ALA CB C -1.599 5.124 3.568 1.00 . A A . 15 ALA CB 1 1 11 3477 1 1 15 ALA H H 0.430 3.993 2.773 1.00 . A A . 15 ALA H 1 1 11 3478 1 1 15 ALA HA H -0.878 6.292 1.932 1.00 . A A . 15 ALA HA 1 1 11 3479 1 1 15 ALA HB1 H -2.406 5.811 3.823 1.00 . A A . 15 ALA HB1 1 1 11 3480 1 1 15 ALA HB2 H -1.210 4.666 4.478 1.00 . A A . 15 ALA HB2 1 1 11 3481 1 1 15 ALA HB3 H -1.980 4.347 2.905 1.00 . A A . 15 ALA HB3 1 1 11 3482 1 1 15 ALA N N 0.606 4.942 2.526 1.00 . A A . 15 ALA N 1 1 11 3483 1 1 15 ALA O O -0.468 8.200 3.550 1.00 . A A . 15 ALA O 1 1 11 3484 1 1 16 LEU C C 3.101 8.340 4.685 1.00 . A A . 16 LEU C 1 1 11 3485 1 1 16 LEU CA C 1.766 7.864 5.298 1.00 . A A . 16 LEU CA 1 1 11 3486 1 1 16 LEU CB C 1.990 7.318 6.712 1.00 . A A . 16 LEU CB 1 1 11 3487 1 1 16 LEU CD1 C 1.295 7.463 9.110 1.00 . A A . 16 LEU CD1 1 1 11 3488 1 1 16 LEU CD2 C 2.153 9.514 7.973 1.00 . A A . 16 LEU CD2 1 1 11 3489 1 1 16 LEU CG C 1.357 8.218 7.781 1.00 . A A . 16 LEU CG 1 1 11 3490 1 1 16 LEU H H 1.467 5.924 4.541 1.00 . A A . 16 LEU H 1 1 11 3491 1 1 16 LEU HA H 1.109 8.731 5.376 1.00 . A A . 16 LEU HA 1 1 11 3492 1 1 16 LEU HB2 H 1.554 6.321 6.782 1.00 . A A . 16 LEU HB2 1 1 11 3493 1 1 16 LEU HB3 H 3.062 7.252 6.898 1.00 . A A . 16 LEU HB3 1 1 11 3494 1 1 16 LEU HD11 H 0.730 6.541 8.978 1.00 . A A . 16 LEU HD11 1 1 11 3495 1 1 16 LEU HD12 H 0.805 8.086 9.858 1.00 . A A . 16 LEU HD12 1 1 11 3496 1 1 16 LEU HD13 H 2.306 7.226 9.440 1.00 . A A . 16 LEU HD13 1 1 11 3497 1 1 16 LEU HD21 H 3.163 9.274 8.304 1.00 . A A . 16 LEU HD21 1 1 11 3498 1 1 16 LEU HD22 H 2.200 10.055 7.029 1.00 . A A . 16 LEU HD22 1 1 11 3499 1 1 16 LEU HD23 H 1.662 10.133 8.723 1.00 . A A . 16 LEU HD23 1 1 11 3500 1 1 16 LEU HG H 0.343 8.470 7.473 1.00 . A A . 16 LEU HG 1 1 11 3501 1 1 16 LEU N N 1.066 6.839 4.500 1.00 . A A . 16 LEU N 1 1 11 3502 1 1 16 LEU O O 3.491 9.488 4.875 1.00 . A A . 16 LEU O 1 1 11 3503 1 1 17 ILE C C 4.758 8.435 1.847 1.00 . A A . 17 ILE C 1 1 11 3504 1 1 17 ILE CA C 5.040 7.763 3.221 1.00 . A A . 17 ILE CA 1 1 11 3505 1 1 17 ILE CB C 5.878 6.463 3.081 1.00 . A A . 17 ILE CB 1 1 11 3506 1 1 17 ILE CD1 C 6.480 6.297 5.634 1.00 . A A . 17 ILE CD1 1 1 11 3507 1 1 17 ILE CG1 C 5.945 5.609 4.367 1.00 . A A . 17 ILE CG1 1 1 11 3508 1 1 17 ILE CG2 C 7.302 6.726 2.563 1.00 . A A . 17 ILE CG2 1 1 11 3509 1 1 17 ILE H H 3.471 6.515 3.855 1.00 . A A . 17 ILE H 1 1 11 3510 1 1 17 ILE HA H 5.614 8.466 3.824 1.00 . A A . 17 ILE HA 1 1 11 3511 1 1 17 ILE HB H 5.382 5.852 2.327 1.00 . A A . 17 ILE HB 1 1 11 3512 1 1 17 ILE HD11 H 5.846 7.148 5.881 1.00 . A A . 17 ILE HD11 1 1 11 3513 1 1 17 ILE HD12 H 6.474 5.588 6.463 1.00 . A A . 17 ILE HD12 1 1 11 3514 1 1 17 ILE HD13 H 7.499 6.642 5.458 1.00 . A A . 17 ILE HD13 1 1 11 3515 1 1 17 ILE HG12 H 4.935 5.261 4.583 1.00 . A A . 17 ILE HG12 1 1 11 3516 1 1 17 ILE HG13 H 6.569 4.738 4.164 1.00 . A A . 17 ILE HG13 1 1 11 3517 1 1 17 ILE HG21 H 7.253 7.329 1.656 1.00 . A A . 17 ILE HG21 1 1 11 3518 1 1 17 ILE HG22 H 7.871 7.260 3.324 1.00 . A A . 17 ILE HG22 1 1 11 3519 1 1 17 ILE HG23 H 7.791 5.777 2.343 1.00 . A A . 17 ILE HG23 1 1 11 3520 1 1 17 ILE N N 3.783 7.456 3.954 1.00 . A A . 17 ILE N 1 1 11 3521 1 1 17 ILE O O 5.656 8.721 1.053 1.00 . A A . 17 ILE O 1 1 11 3522 1 1 18 ARG C C 3.270 10.912 0.483 1.00 . A A . 18 ARG C 1 1 11 3523 1 1 18 ARG CA C 3.020 9.404 0.368 1.00 . A A . 18 ARG CA 1 1 11 3524 1 1 18 ARG CB C 1.524 9.135 0.169 1.00 . A A . 18 ARG CB 1 1 11 3525 1 1 18 ARG CD C -0.354 9.696 -1.445 1.00 . A A . 18 ARG CD 1 1 11 3526 1 1 18 ARG CG C 1.140 9.436 -1.280 1.00 . A A . 18 ARG CG 1 1 11 3527 1 1 18 ARG CZ C -0.516 10.616 -3.791 1.00 . A A . 18 ARG CZ 1 1 11 3528 1 1 18 ARG H H 2.762 8.481 2.225 1.00 . A A . 18 ARG H 1 1 11 3529 1 1 18 ARG HA H 3.574 9.010 -0.484 1.00 . A A . 18 ARG HA 1 1 11 3530 1 1 18 ARG HB2 H 1.310 8.090 0.391 1.00 . A A . 18 ARG HB2 1 1 11 3531 1 1 18 ARG HB3 H 0.948 9.774 0.837 1.00 . A A . 18 ARG HB3 1 1 11 3532 1 1 18 ARG HD2 H -0.856 8.787 -1.774 1.00 . A A . 18 ARG HD2 1 1 11 3533 1 1 18 ARG HD3 H -0.778 10.028 -0.497 1.00 . A A . 18 ARG HD3 1 1 11 3534 1 1 18 ARG HE H -0.596 11.676 -2.090 1.00 . A A . 18 ARG HE 1 1 11 3535 1 1 18 ARG HG2 H 1.692 10.313 -1.618 1.00 . A A . 18 ARG HG2 1 1 11 3536 1 1 18 ARG HG3 H 1.417 8.582 -1.899 1.00 . A A . 18 ARG HG3 1 1 11 3537 1 1 18 ARG HH11 H -0.301 8.620 -3.815 1.00 . A A . 18 ARG HH11 1 1 11 3538 1 1 18 ARG HH12 H -0.406 9.367 -5.378 1.00 . A A . 18 ARG HH12 1 1 11 3539 1 1 18 ARG HH21 H -0.735 12.593 -4.149 1.00 . A A . 18 ARG HH21 1 1 11 3540 1 1 18 ARG HH22 H -0.656 11.583 -5.551 1.00 . A A . 18 ARG HH22 1 1 11 3541 1 1 18 ARG N N 3.490 8.754 1.600 1.00 . A A . 18 ARG N 1 1 11 3542 1 1 18 ARG NE N -0.514 10.754 -2.461 1.00 . A A . 18 ARG NE 1 1 11 3543 1 1 18 ARG NH1 N -0.395 9.434 -4.382 1.00 . A A . 18 ARG NH1 1 1 11 3544 1 1 18 ARG NH2 N -0.647 11.687 -4.557 1.00 . A A . 18 ARG NH2 1 1 11 3545 1 1 18 ARG O O 3.217 11.489 1.567 1.00 . A A . 18 ARG O 1 1 11 3546 1 1 19 ALA C C 5.050 13.341 0.098 1.00 . A A . 19 ALA C 1 1 11 3547 1 1 19 ALA CA C 3.869 12.950 -0.814 1.00 . A A . 19 ALA CA 1 1 11 3548 1 1 19 ALA CB C 2.612 13.806 -0.585 1.00 . A A . 19 ALA CB 1 1 11 3549 1 1 19 ALA H H 3.617 10.975 -1.511 1.00 . A A . 19 ALA H 1 1 11 3550 1 1 19 ALA HA H 4.188 13.112 -1.843 1.00 . A A . 19 ALA HA 1 1 11 3551 1 1 19 ALA HB1 H 2.865 14.861 -0.695 1.00 . A A . 19 ALA HB1 1 1 11 3552 1 1 19 ALA HB2 H 1.851 13.538 -1.317 1.00 . A A . 19 ALA HB2 1 1 11 3553 1 1 19 ALA HB3 H 2.228 13.627 0.419 1.00 . A A . 19 ALA HB3 1 1 11 3554 1 1 19 ALA N N 3.558 11.510 -0.672 1.00 . A A . 19 ALA N 1 1 11 3555 1 1 19 ALA O O 4.960 14.137 1.031 1.00 . A A . 19 ALA O 1 1 11 3556 1 1 20 PHE C C 8.588 13.100 -0.336 1.00 . A A . 20 PHE C 1 1 11 3557 1 1 20 PHE CA C 7.398 12.788 0.598 1.00 . A A . 20 PHE CA 1 1 11 3558 1 1 20 PHE CB C 7.618 11.500 1.404 1.00 . A A . 20 PHE CB 1 1 11 3559 1 1 20 PHE CD1 C 7.669 12.189 3.825 1.00 . A A . 20 PHE CD1 1 1 11 3560 1 1 20 PHE CD2 C 9.749 11.550 2.785 1.00 . A A . 20 PHE CD2 1 1 11 3561 1 1 20 PHE CE1 C 8.339 12.398 5.026 1.00 . A A . 20 PHE CE1 1 1 11 3562 1 1 20 PHE CE2 C 10.410 11.762 3.989 1.00 . A A . 20 PHE CE2 1 1 11 3563 1 1 20 PHE CG C 8.375 11.765 2.700 1.00 . A A . 20 PHE CG 1 1 11 3564 1 1 20 PHE CZ C 9.707 12.187 5.103 1.00 . A A . 20 PHE CZ 1 1 11 3565 1 1 20 PHE H H 6.135 11.888 -0.824 1.00 . A A . 20 PHE H 1 1 11 3566 1 1 20 PHE HA H 7.280 13.616 1.296 1.00 . A A . 20 PHE HA 1 1 11 3567 1 1 20 PHE HB2 H 6.649 11.059 1.641 1.00 . A A . 20 PHE HB2 1 1 11 3568 1 1 20 PHE HB3 H 8.191 10.797 0.799 1.00 . A A . 20 PHE HB3 1 1 11 3569 1 1 20 PHE HD1 H 6.597 12.360 3.756 1.00 . A A . 20 PHE HD1 1 1 11 3570 1 1 20 PHE HD2 H 10.302 11.224 1.905 1.00 . A A . 20 PHE HD2 1 1 11 3571 1 1 20 PHE HE1 H 7.775 12.705 5.908 1.00 . A A . 20 PHE HE1 1 1 11 3572 1 1 20 PHE HE2 H 11.487 11.582 4.051 1.00 . A A . 20 PHE HE2 1 1 11 3573 1 1 20 PHE HZ H 10.232 12.364 6.047 1.00 . A A . 20 PHE HZ 1 1 11 3574 1 1 20 PHE N N 6.138 12.620 -0.146 1.00 . A A . 20 PHE N 1 1 11 3575 1 1 20 PHE O O 8.336 13.363 -1.534 1.00 . A A . 20 PHE O 1 1 12 3576 1 1 1 HIS C C -5.292 -13.221 -5.108 1.00 . A A . 1 HIS C 1 1 12 3577 1 1 1 HIS CA C -6.787 -13.021 -5.449 1.00 . A A . 1 HIS CA 1 1 12 3578 1 1 1 HIS CB C -6.988 -12.185 -6.724 1.00 . A A . 1 HIS CB 1 1 12 3579 1 1 1 HIS CD2 C -6.105 -13.962 -8.367 1.00 . A A . 1 HIS CD2 1 1 12 3580 1 1 1 HIS CE1 C -5.138 -12.715 -9.835 1.00 . A A . 1 HIS CE1 1 1 12 3581 1 1 1 HIS CG C -6.243 -12.695 -7.985 1.00 . A A . 1 HIS CG 1 1 12 3582 1 1 1 HIS H1 H -7.011 -12.156 -3.493 1.00 . A A . 1 HIS H1 1 1 12 3583 1 1 1 HIS HA H -7.217 -14.006 -5.629 1.00 . A A . 1 HIS HA 1 1 12 3584 1 1 1 HIS HB2 H -8.055 -12.148 -6.946 1.00 . A A . 1 HIS HB2 1 1 12 3585 1 1 1 HIS HB3 H -6.645 -11.171 -6.518 1.00 . A A . 1 HIS HB3 1 1 12 3586 1 1 1 HIS HD1 H -5.638 -10.928 -8.902 1.00 . A A . 1 HIS HD1 1 1 12 3587 1 1 1 HIS HD2 H -6.485 -14.829 -7.847 1.00 . A A . 1 HIS HD2 1 1 12 3588 1 1 1 HIS HE1 H -4.594 -12.387 -10.709 1.00 . A A . 1 HIS HE1 1 1 12 3589 1 1 1 HIS HE2 H -5.145 -14.788 -10.029 1.00 . A A . 1 HIS HE2 1 1 12 3590 1 1 1 HIS N N -7.534 -12.404 -4.322 1.00 . A A . 1 HIS N 1 1 12 3591 1 1 1 HIS ND1 N -5.660 -11.930 -8.885 1.00 . A A . 1 HIS ND1 1 1 12 3592 1 1 1 HIS NE2 N -5.414 -13.967 -9.506 1.00 . A A . 1 HIS NE2 1 1 12 3593 1 1 1 HIS O O -4.828 -14.347 -4.946 1.00 . A A . 1 HIS O 1 1 12 3594 1 1 2 GLY C C -2.625 -10.630 -4.583 1.00 . A A . 2 GLY C 1 1 12 3595 1 1 2 GLY CA C -3.150 -12.067 -4.619 1.00 . A A . 2 GLY CA 1 1 12 3596 1 1 2 GLY H H -4.993 -11.187 -5.133 1.00 . A A . 2 GLY H 1 1 12 3597 1 1 2 GLY HA2 H -3.024 -12.521 -3.636 1.00 . A A . 2 GLY HA2 1 1 12 3598 1 1 2 GLY HA3 H -2.582 -12.637 -5.354 1.00 . A A . 2 GLY HA3 1 1 12 3599 1 1 2 GLY N N -4.580 -12.091 -4.987 1.00 . A A . 2 GLY N 1 1 12 3600 1 1 2 GLY O O -2.771 -9.921 -3.589 1.00 . A A . 2 GLY O 1 1 12 3601 1 1 3 LEU C C -2.836 -7.680 -5.707 1.00 . A A . 3 LEU C 1 1 12 3602 1 1 3 LEU CA C -1.783 -8.770 -5.978 1.00 . A A . 3 LEU CA 1 1 12 3603 1 1 3 LEU CB C -1.165 -8.567 -7.368 1.00 . A A . 3 LEU CB 1 1 12 3604 1 1 3 LEU CD1 C -1.649 -7.737 -9.671 1.00 . A A . 3 LEU CD1 1 1 12 3605 1 1 3 LEU CD2 C -2.399 -10.034 -9.022 1.00 . A A . 3 LEU CD2 1 1 12 3606 1 1 3 LEU CG C -2.170 -8.605 -8.526 1.00 . A A . 3 LEU CG 1 1 12 3607 1 1 3 LEU H H -2.192 -10.756 -6.566 1.00 . A A . 3 LEU H 1 1 12 3608 1 1 3 LEU HA H -0.981 -8.612 -5.257 1.00 . A A . 3 LEU HA 1 1 12 3609 1 1 3 LEU HB2 H -0.654 -7.605 -7.383 1.00 . A A . 3 LEU HB2 1 1 12 3610 1 1 3 LEU HB3 H -0.429 -9.354 -7.531 1.00 . A A . 3 LEU HB3 1 1 12 3611 1 1 3 LEU HD11 H -2.359 -7.760 -10.497 1.00 . A A . 3 LEU HD11 1 1 12 3612 1 1 3 LEU HD12 H -1.530 -6.711 -9.323 1.00 . A A . 3 LEU HD12 1 1 12 3613 1 1 3 LEU HD13 H -0.686 -8.120 -10.008 1.00 . A A . 3 LEU HD13 1 1 12 3614 1 1 3 LEU HD21 H -1.459 -10.447 -9.389 1.00 . A A . 3 LEU HD21 1 1 12 3615 1 1 3 LEU HD22 H -2.770 -10.649 -8.202 1.00 . A A . 3 LEU HD22 1 1 12 3616 1 1 3 LEU HD23 H -3.131 -10.025 -9.830 1.00 . A A . 3 LEU HD23 1 1 12 3617 1 1 3 LEU HG H -3.120 -8.197 -8.180 1.00 . A A . 3 LEU HG 1 1 12 3618 1 1 3 LEU N N -2.265 -10.154 -5.772 1.00 . A A . 3 LEU N 1 1 12 3619 1 1 3 LEU O O -2.553 -6.692 -5.035 1.00 . A A . 3 LEU O 1 1 12 3620 1 1 4 ALA C C -5.427 -6.814 -4.298 1.00 . A A . 4 ALA C 1 1 12 3621 1 1 4 ALA CA C -5.252 -7.116 -5.801 1.00 . A A . 4 ALA CA 1 1 12 3622 1 1 4 ALA CB C -6.511 -7.781 -6.362 1.00 . A A . 4 ALA CB 1 1 12 3623 1 1 4 ALA H H -4.274 -8.762 -6.659 1.00 . A A . 4 ALA H 1 1 12 3624 1 1 4 ALA HA H -5.107 -6.169 -6.322 1.00 . A A . 4 ALA HA 1 1 12 3625 1 1 4 ALA HB1 H -6.371 -7.986 -7.423 1.00 . A A . 4 ALA HB1 1 1 12 3626 1 1 4 ALA HB2 H -6.695 -8.715 -5.832 1.00 . A A . 4 ALA HB2 1 1 12 3627 1 1 4 ALA HB3 H -7.363 -7.114 -6.230 1.00 . A A . 4 ALA HB3 1 1 12 3628 1 1 4 ALA N N -4.082 -7.978 -6.078 1.00 . A A . 4 ALA N 1 1 12 3629 1 1 4 ALA O O -5.885 -5.739 -3.930 1.00 . A A . 4 ALA O 1 1 12 3630 1 1 5 SER C C -3.485 -7.144 -1.481 1.00 . A A . 5 SER C 1 1 12 3631 1 1 5 SER CA C -4.855 -7.615 -2.010 1.00 . A A . 5 SER CA 1 1 12 3632 1 1 5 SER CB C -5.204 -8.978 -1.409 1.00 . A A . 5 SER CB 1 1 12 3633 1 1 5 SER H H -4.346 -8.471 -3.850 1.00 . A A . 5 SER H 1 1 12 3634 1 1 5 SER HA H -5.612 -6.896 -1.699 1.00 . A A . 5 SER HA 1 1 12 3635 1 1 5 SER HB2 H -5.807 -9.548 -2.116 1.00 . A A . 5 SER HB2 1 1 12 3636 1 1 5 SER HB3 H -4.289 -9.524 -1.183 1.00 . A A . 5 SER HB3 1 1 12 3637 1 1 5 SER HG H -6.134 -9.636 0.246 1.00 . A A . 5 SER HG 1 1 12 3638 1 1 5 SER N N -4.877 -7.713 -3.480 1.00 . A A . 5 SER N 1 1 12 3639 1 1 5 SER O O -3.419 -6.418 -0.493 1.00 . A A . 5 SER O 1 1 12 3640 1 1 5 SER OG O -5.944 -8.765 -0.209 1.00 . A A . 5 SER OG 1 1 12 3641 1 1 6 THR C C -0.973 -5.408 -1.913 1.00 . A A . 6 THR C 1 1 12 3642 1 1 6 THR CA C -1.036 -6.953 -1.910 1.00 . A A . 6 THR CA 1 1 12 3643 1 1 6 THR CB C 0.017 -7.601 -2.842 1.00 . A A . 6 THR CB 1 1 12 3644 1 1 6 THR CG2 C 0.422 -6.825 -4.105 1.00 . A A . 6 THR CG2 1 1 12 3645 1 1 6 THR H H -2.424 -8.230 -2.848 1.00 . A A . 6 THR H 1 1 12 3646 1 1 6 THR HA H -0.785 -7.269 -0.897 1.00 . A A . 6 THR HA 1 1 12 3647 1 1 6 THR HB H -0.368 -8.572 -3.155 1.00 . A A . 6 THR HB 1 1 12 3648 1 1 6 THR HG1 H 1.936 -8.134 -2.663 1.00 . A A . 6 THR HG1 1 1 12 3649 1 1 6 THR HG21 H -0.455 -6.337 -4.530 1.00 . A A . 6 THR HG21 1 1 12 3650 1 1 6 THR HG22 H 1.166 -6.072 -3.846 1.00 . A A . 6 THR HG22 1 1 12 3651 1 1 6 THR HG23 H 0.843 -7.516 -4.836 1.00 . A A . 6 THR HG23 1 1 12 3652 1 1 6 THR N N -2.398 -7.477 -2.188 1.00 . A A . 6 THR N 1 1 12 3653 1 1 6 THR O O -0.243 -4.788 -1.139 1.00 . A A . 6 THR O 1 1 12 3654 1 1 6 THR OG1 O 1.191 -7.827 -2.068 1.00 . A A . 6 THR OG1 1 1 12 3655 1 1 7 LEU C C -3.131 -2.818 -1.850 1.00 . A A . 7 LEU C 1 1 12 3656 1 1 7 LEU CA C -2.049 -3.358 -2.807 1.00 . A A . 7 LEU CA 1 1 12 3657 1 1 7 LEU CB C -2.407 -3.010 -4.252 1.00 . A A . 7 LEU CB 1 1 12 3658 1 1 7 LEU CD1 C -1.703 -3.525 -6.595 1.00 . A A . 7 LEU CD1 1 1 12 3659 1 1 7 LEU CD2 C -0.405 -1.862 -5.250 1.00 . A A . 7 LEU CD2 1 1 12 3660 1 1 7 LEU CG C -1.209 -3.164 -5.195 1.00 . A A . 7 LEU CG 1 1 12 3661 1 1 7 LEU H H -2.448 -5.351 -3.322 1.00 . A A . 7 LEU H 1 1 12 3662 1 1 7 LEU HA H -1.103 -2.873 -2.562 1.00 . A A . 7 LEU HA 1 1 12 3663 1 1 7 LEU HB2 H -3.209 -3.667 -4.587 1.00 . A A . 7 LEU HB2 1 1 12 3664 1 1 7 LEU HB3 H -2.753 -1.977 -4.290 1.00 . A A . 7 LEU HB3 1 1 12 3665 1 1 7 LEU HD11 H -0.849 -3.634 -7.265 1.00 . A A . 7 LEU HD11 1 1 12 3666 1 1 7 LEU HD12 H -2.255 -4.464 -6.555 1.00 . A A . 7 LEU HD12 1 1 12 3667 1 1 7 LEU HD13 H -2.357 -2.735 -6.965 1.00 . A A . 7 LEU HD13 1 1 12 3668 1 1 7 LEU HD21 H -1.040 -1.060 -5.627 1.00 . A A . 7 LEU HD21 1 1 12 3669 1 1 7 LEU HD22 H -0.055 -1.608 -4.250 1.00 . A A . 7 LEU HD22 1 1 12 3670 1 1 7 LEU HD23 H 0.450 -1.990 -5.912 1.00 . A A . 7 LEU HD23 1 1 12 3671 1 1 7 LEU HG H -0.566 -3.964 -4.826 1.00 . A A . 7 LEU HG 1 1 12 3672 1 1 7 LEU N N -1.858 -4.817 -2.713 1.00 . A A . 7 LEU N 1 1 12 3673 1 1 7 LEU O O -3.396 -1.626 -1.844 1.00 . A A . 7 LEU O 1 1 12 3674 1 1 8 THR C C -3.902 -3.274 1.488 1.00 . A A . 8 THR C 1 1 12 3675 1 1 8 THR CA C -4.587 -3.333 0.102 1.00 . A A . 8 THR CA 1 1 12 3676 1 1 8 THR CB C -5.740 -4.357 0.051 1.00 . A A . 8 THR CB 1 1 12 3677 1 1 8 THR CG2 C -6.912 -4.029 0.981 1.00 . A A . 8 THR CG2 1 1 12 3678 1 1 8 THR H H -3.444 -4.660 -1.033 1.00 . A A . 8 THR H 1 1 12 3679 1 1 8 THR HA H -4.996 -2.347 -0.119 1.00 . A A . 8 THR HA 1 1 12 3680 1 1 8 THR HB H -5.346 -5.338 0.319 1.00 . A A . 8 THR HB 1 1 12 3681 1 1 8 THR HG1 H -7.022 -5.013 -1.359 1.00 . A A . 8 THR HG1 1 1 12 3682 1 1 8 THR HG21 H -7.331 -3.060 0.708 1.00 . A A . 8 THR HG21 1 1 12 3683 1 1 8 THR HG22 H -7.679 -4.797 0.885 1.00 . A A . 8 THR HG22 1 1 12 3684 1 1 8 THR HG23 H -6.559 -3.995 2.012 1.00 . A A . 8 THR HG23 1 1 12 3685 1 1 8 THR N N -3.601 -3.674 -0.951 1.00 . A A . 8 THR N 1 1 12 3686 1 1 8 THR O O -4.450 -2.727 2.440 1.00 . A A . 8 THR O 1 1 12 3687 1 1 8 THR OG1 O -6.225 -4.412 -1.295 1.00 . A A . 8 THR OG1 1 1 12 3688 1 1 9 ARG C C -0.682 -2.724 2.672 1.00 . A A . 9 ARG C 1 1 12 3689 1 1 9 ARG CA C -1.825 -3.741 2.771 1.00 . A A . 9 ARG CA 1 1 12 3690 1 1 9 ARG CB C -1.248 -5.126 3.065 1.00 . A A . 9 ARG CB 1 1 12 3691 1 1 9 ARG CD C -2.233 -7.372 2.507 1.00 . A A . 9 ARG CD 1 1 12 3692 1 1 9 ARG CG C -2.355 -6.131 3.391 1.00 . A A . 9 ARG CG 1 1 12 3693 1 1 9 ARG CZ C -0.548 -9.198 2.222 1.00 . A A . 9 ARG CZ 1 1 12 3694 1 1 9 ARG H H -2.296 -4.304 0.793 1.00 . A A . 9 ARG H 1 1 12 3695 1 1 9 ARG HA H -2.460 -3.455 3.610 1.00 . A A . 9 ARG HA 1 1 12 3696 1 1 9 ARG HB2 H -0.693 -5.475 2.194 1.00 . A A . 9 ARG HB2 1 1 12 3697 1 1 9 ARG HB3 H -0.571 -5.056 3.916 1.00 . A A . 9 ARG HB3 1 1 12 3698 1 1 9 ARG HD2 H -3.134 -7.976 2.611 1.00 . A A . 9 ARG HD2 1 1 12 3699 1 1 9 ARG HD3 H -2.124 -7.064 1.467 1.00 . A A . 9 ARG HD3 1 1 12 3700 1 1 9 ARG HE H -0.646 -7.927 3.775 1.00 . A A . 9 ARG HE 1 1 12 3701 1 1 9 ARG HG2 H -2.273 -6.427 4.437 1.00 . A A . 9 ARG HG2 1 1 12 3702 1 1 9 ARG HG3 H -3.326 -5.665 3.224 1.00 . A A . 9 ARG HG3 1 1 12 3703 1 1 9 ARG HH11 H -1.741 -8.999 0.627 1.00 . A A . 9 ARG HH11 1 1 12 3704 1 1 9 ARG HH12 H -0.594 -10.301 0.527 1.00 . A A . 9 ARG HH12 1 1 12 3705 1 1 9 ARG HH21 H 0.858 -9.630 3.611 1.00 . A A . 9 ARG HH21 1 1 12 3706 1 1 9 ARG HH22 H 0.862 -10.635 2.205 1.00 . A A . 9 ARG HH22 1 1 12 3707 1 1 9 ARG N N -2.666 -3.772 1.552 1.00 . A A . 9 ARG N 1 1 12 3708 1 1 9 ARG NE N -1.062 -8.175 2.904 1.00 . A A . 9 ARG NE 1 1 12 3709 1 1 9 ARG NH1 N -0.998 -9.536 1.023 1.00 . A A . 9 ARG NH1 1 1 12 3710 1 1 9 ARG NH2 N 0.479 -9.873 2.720 1.00 . A A . 9 ARG NH2 1 1 12 3711 1 1 9 ARG O O -0.598 -1.812 3.490 1.00 . A A . 9 ARG O 1 1 12 3712 1 1 10 TRP C C 0.584 -0.355 1.178 1.00 . A A . 10 TRP C 1 1 12 3713 1 1 10 TRP CA C 1.158 -1.781 1.337 1.00 . A A . 10 TRP CA 1 1 12 3714 1 1 10 TRP CB C 2.032 -2.268 0.173 1.00 . A A . 10 TRP CB 1 1 12 3715 1 1 10 TRP CD1 C 1.686 -1.072 -2.036 1.00 . A A . 10 TRP CD1 1 1 12 3716 1 1 10 TRP CD2 C 3.256 -0.173 -0.798 1.00 . A A . 10 TRP CD2 1 1 12 3717 1 1 10 TRP CE2 C 3.103 0.573 -1.961 1.00 . A A . 10 TRP CE2 1 1 12 3718 1 1 10 TRP CE3 C 4.194 0.195 0.159 1.00 . A A . 10 TRP CE3 1 1 12 3719 1 1 10 TRP CG C 2.339 -1.204 -0.888 1.00 . A A . 10 TRP CG 1 1 12 3720 1 1 10 TRP CH2 C 4.831 2.069 -1.211 1.00 . A A . 10 TRP CH2 1 1 12 3721 1 1 10 TRP CZ2 C 3.903 1.690 -2.176 1.00 . A A . 10 TRP CZ2 1 1 12 3722 1 1 10 TRP CZ3 C 4.971 1.332 -0.048 1.00 . A A . 10 TRP CZ3 1 1 12 3723 1 1 10 TRP H H 0.082 -3.551 0.948 1.00 . A A . 10 TRP H 1 1 12 3724 1 1 10 TRP HA H 1.799 -1.761 2.219 1.00 . A A . 10 TRP HA 1 1 12 3725 1 1 10 TRP HB2 H 2.979 -2.620 0.584 1.00 . A A . 10 TRP HB2 1 1 12 3726 1 1 10 TRP HB3 H 1.531 -3.107 -0.310 1.00 . A A . 10 TRP HB3 1 1 12 3727 1 1 10 TRP HD1 H 0.892 -1.733 -2.385 1.00 . A A . 10 TRP HD1 1 1 12 3728 1 1 10 TRP HE1 H 1.850 0.290 -3.593 1.00 . A A . 10 TRP HE1 1 1 12 3729 1 1 10 TRP HE3 H 4.396 -0.454 1.009 1.00 . A A . 10 TRP HE3 1 1 12 3730 1 1 10 TRP HH2 H 5.438 2.964 -1.366 1.00 . A A . 10 TRP HH2 1 1 12 3731 1 1 10 TRP HZ2 H 3.895 2.186 -3.145 1.00 . A A . 10 TRP HZ2 1 1 12 3732 1 1 10 TRP HZ3 H 5.633 1.686 0.747 1.00 . A A . 10 TRP HZ3 1 1 12 3733 1 1 10 TRP N N 0.110 -2.793 1.601 1.00 . A A . 10 TRP N 1 1 12 3734 1 1 10 TRP NE1 N 2.148 -0.004 -2.680 1.00 . A A . 10 TRP NE1 1 1 12 3735 1 1 10 TRP O O 1.180 0.613 1.656 1.00 . A A . 10 TRP O 1 1 12 3736 1 1 11 ALA C C -1.931 1.521 1.963 1.00 . A A . 11 ALA C 1 1 12 3737 1 1 11 ALA CA C -1.437 0.972 0.610 1.00 . A A . 11 ALA CA 1 1 12 3738 1 1 11 ALA CB C -2.628 0.788 -0.328 1.00 . A A . 11 ALA CB 1 1 12 3739 1 1 11 ALA H H -1.158 -1.107 0.421 1.00 . A A . 11 ALA H 1 1 12 3740 1 1 11 ALA HA H -0.786 1.727 0.168 1.00 . A A . 11 ALA HA 1 1 12 3741 1 1 11 ALA HB1 H -3.201 1.715 -0.375 1.00 . A A . 11 ALA HB1 1 1 12 3742 1 1 11 ALA HB2 H -3.265 -0.013 0.047 1.00 . A A . 11 ALA HB2 1 1 12 3743 1 1 11 ALA HB3 H -2.269 0.531 -1.325 1.00 . A A . 11 ALA HB3 1 1 12 3744 1 1 11 ALA N N -0.662 -0.286 0.701 1.00 . A A . 11 ALA N 1 1 12 3745 1 1 11 ALA O O -2.556 2.577 2.028 1.00 . A A . 11 ALA O 1 1 12 3746 1 1 12 HIS C C -0.517 1.664 5.140 1.00 . A A . 12 HIS C 1 1 12 3747 1 1 12 HIS CA C -1.818 1.209 4.438 1.00 . A A . 12 HIS CA 1 1 12 3748 1 1 12 HIS CB C -2.504 0.011 5.112 1.00 . A A . 12 HIS CB 1 1 12 3749 1 1 12 HIS CD2 C -1.493 -0.587 7.368 1.00 . A A . 12 HIS CD2 1 1 12 3750 1 1 12 HIS CE1 C -2.811 0.444 8.716 1.00 . A A . 12 HIS CE1 1 1 12 3751 1 1 12 HIS CG C -2.451 -0.006 6.655 1.00 . A A . 12 HIS CG 1 1 12 3752 1 1 12 HIS H H -1.135 -0.076 2.945 1.00 . A A . 12 HIS H 1 1 12 3753 1 1 12 HIS HA H -2.517 2.046 4.441 1.00 . A A . 12 HIS HA 1 1 12 3754 1 1 12 HIS HB2 H -3.550 -0.005 4.804 1.00 . A A . 12 HIS HB2 1 1 12 3755 1 1 12 HIS HB3 H -2.024 -0.898 4.750 1.00 . A A . 12 HIS HB3 1 1 12 3756 1 1 12 HIS HD1 H -4.131 1.074 7.227 1.00 . A A . 12 HIS HD1 1 1 12 3757 1 1 12 HIS HD2 H -0.680 -1.183 6.980 1.00 . A A . 12 HIS HD2 1 1 12 3758 1 1 12 HIS HE1 H -3.252 0.847 9.616 1.00 . A A . 12 HIS HE1 1 1 12 3759 1 1 12 HIS HE2 H -1.153 -0.602 9.432 1.00 . A A . 12 HIS HE2 1 1 12 3760 1 1 12 HIS N N -1.575 0.820 3.036 1.00 . A A . 12 HIS N 1 1 12 3761 1 1 12 HIS ND1 N -3.274 0.612 7.469 1.00 . A A . 12 HIS ND1 1 1 12 3762 1 1 12 HIS NE2 N -1.717 -0.303 8.649 1.00 . A A . 12 HIS NE2 1 1 12 3763 1 1 12 HIS O O -0.569 2.312 6.181 1.00 . A A . 12 HIS O 1 1 12 3764 1 1 13 TYR C C 2.433 3.116 4.517 1.00 . A A . 13 TYR C 1 1 12 3765 1 1 13 TYR CA C 1.968 1.736 4.999 1.00 . A A . 13 TYR CA 1 1 12 3766 1 1 13 TYR CB C 2.945 0.653 4.537 1.00 . A A . 13 TYR CB 1 1 12 3767 1 1 13 TYR CD1 C 2.224 -1.536 5.569 1.00 . A A . 13 TYR CD1 1 1 12 3768 1 1 13 TYR CD2 C 4.119 -0.361 6.493 1.00 . A A . 13 TYR CD2 1 1 12 3769 1 1 13 TYR CE1 C 2.421 -2.567 6.475 1.00 . A A . 13 TYR CE1 1 1 12 3770 1 1 13 TYR CE2 C 4.319 -1.389 7.399 1.00 . A A . 13 TYR CE2 1 1 12 3771 1 1 13 TYR CG C 3.079 -0.444 5.581 1.00 . A A . 13 TYR CG 1 1 12 3772 1 1 13 TYR CZ C 3.463 -2.484 7.393 1.00 . A A . 13 TYR CZ 1 1 12 3773 1 1 13 TYR H H 0.611 0.982 3.590 1.00 . A A . 13 TYR H 1 1 12 3774 1 1 13 TYR HA H 1.942 1.739 6.089 1.00 . A A . 13 TYR HA 1 1 12 3775 1 1 13 TYR HB2 H 2.580 0.218 3.607 1.00 . A A . 13 TYR HB2 1 1 12 3776 1 1 13 TYR HB3 H 3.923 1.103 4.363 1.00 . A A . 13 TYR HB3 1 1 12 3777 1 1 13 TYR HD1 H 1.387 -1.569 4.873 1.00 . A A . 13 TYR HD1 1 1 12 3778 1 1 13 TYR HD2 H 4.769 0.514 6.504 1.00 . A A . 13 TYR HD2 1 1 12 3779 1 1 13 TYR HE1 H 1.803 -3.462 6.399 1.00 . A A . 13 TYR HE1 1 1 12 3780 1 1 13 TYR HE2 H 5.188 -1.366 8.057 1.00 . A A . 13 TYR HE2 1 1 12 3781 1 1 13 TYR HH H 2.901 -4.128 8.216 1.00 . A A . 13 TYR HH 1 1 12 3782 1 1 13 TYR N N 0.620 1.403 4.497 1.00 . A A . 13 TYR N 1 1 12 3783 1 1 13 TYR O O 2.336 4.118 5.227 1.00 . A A . 13 TYR O 1 1 12 3784 1 1 13 TYR OH O 3.657 -3.481 8.291 1.00 . A A . 13 TYR OH 1 1 12 3785 1 1 14 ASN C C 2.037 5.452 2.512 1.00 . A A . 14 ASN C 1 1 12 3786 1 1 14 ASN CA C 3.159 4.402 2.539 1.00 . A A . 14 ASN CA 1 1 12 3787 1 1 14 ASN CB C 3.615 4.082 1.122 1.00 . A A . 14 ASN CB 1 1 12 3788 1 1 14 ASN CG C 4.119 5.330 0.397 1.00 . A A . 14 ASN CG 1 1 12 3789 1 1 14 ASN H H 2.747 2.345 2.651 1.00 . A A . 14 ASN H 1 1 12 3790 1 1 14 ASN HA H 4.006 4.829 3.076 1.00 . A A . 14 ASN HA 1 1 12 3791 1 1 14 ASN HB2 H 4.416 3.344 1.162 1.00 . A A . 14 ASN HB2 1 1 12 3792 1 1 14 ASN HB3 H 2.775 3.665 0.565 1.00 . A A . 14 ASN HB3 1 1 12 3793 1 1 14 ASN HD21 H 3.538 4.595 -1.394 1.00 . A A . 14 ASN HD21 1 1 12 3794 1 1 14 ASN HD22 H 4.154 6.224 -1.358 1.00 . A A . 14 ASN HD22 1 1 12 3795 1 1 14 ASN N N 2.764 3.162 3.228 1.00 . A A . 14 ASN N 1 1 12 3796 1 1 14 ASN ND2 N 3.916 5.364 -0.895 1.00 . A A . 14 ASN ND2 1 1 12 3797 1 1 14 ASN O O 2.313 6.630 2.344 1.00 . A A . 14 ASN O 1 1 12 3798 1 1 14 ASN OD1 O 4.696 6.232 0.988 1.00 . A A . 14 ASN OD1 1 1 12 3799 1 1 15 ALA C C 0.018 7.129 3.990 1.00 . A A . 15 ALA C 1 1 12 3800 1 1 15 ALA CA C -0.324 5.958 3.043 1.00 . A A . 15 ALA CA 1 1 12 3801 1 1 15 ALA CB C -1.503 5.163 3.603 1.00 . A A . 15 ALA CB 1 1 12 3802 1 1 15 ALA H H 0.631 4.085 3.064 1.00 . A A . 15 ALA H 1 1 12 3803 1 1 15 ALA HA H -0.611 6.368 2.074 1.00 . A A . 15 ALA HA 1 1 12 3804 1 1 15 ALA HB1 H -1.845 5.624 4.530 1.00 . A A . 15 ALA HB1 1 1 12 3805 1 1 15 ALA HB2 H -1.188 4.138 3.801 1.00 . A A . 15 ALA HB2 1 1 12 3806 1 1 15 ALA HB3 H -2.316 5.160 2.878 1.00 . A A . 15 ALA HB3 1 1 12 3807 1 1 15 ALA N N 0.816 5.040 2.846 1.00 . A A . 15 ALA N 1 1 12 3808 1 1 15 ALA O O -0.459 8.244 3.798 1.00 . A A . 15 ALA O 1 1 12 3809 1 1 16 LEU C C 2.912 8.395 5.433 1.00 . A A . 16 LEU C 1 1 12 3810 1 1 16 LEU CA C 1.513 7.882 5.828 1.00 . A A . 16 LEU CA 1 1 12 3811 1 1 16 LEU CB C 1.541 7.276 7.238 1.00 . A A . 16 LEU CB 1 1 12 3812 1 1 16 LEU CD1 C 0.328 6.003 9.021 1.00 . A A . 16 LEU CD1 1 1 12 3813 1 1 16 LEU CD2 C -0.857 7.882 7.855 1.00 . A A . 16 LEU CD2 1 1 12 3814 1 1 16 LEU CG C 0.171 6.756 7.701 1.00 . A A . 16 LEU CG 1 1 12 3815 1 1 16 LEU H H 1.388 5.971 4.955 1.00 . A A . 16 LEU H 1 1 12 3816 1 1 16 LEU HA H 0.833 8.733 5.840 1.00 . A A . 16 LEU HA 1 1 12 3817 1 1 16 LEU HB2 H 2.248 6.447 7.245 1.00 . A A . 16 LEU HB2 1 1 12 3818 1 1 16 LEU HB3 H 1.884 8.036 7.940 1.00 . A A . 16 LEU HB3 1 1 12 3819 1 1 16 LEU HD11 H -0.644 5.634 9.348 1.00 . A A . 16 LEU HD11 1 1 12 3820 1 1 16 LEU HD12 H 1.007 5.161 8.882 1.00 . A A . 16 LEU HD12 1 1 12 3821 1 1 16 LEU HD13 H 0.735 6.675 9.777 1.00 . A A . 16 LEU HD13 1 1 12 3822 1 1 16 LEU HD21 H -0.522 8.577 8.624 1.00 . A A . 16 LEU HD21 1 1 12 3823 1 1 16 LEU HD22 H -0.961 8.412 6.907 1.00 . A A . 16 LEU HD22 1 1 12 3824 1 1 16 LEU HD23 H -1.819 7.459 8.141 1.00 . A A . 16 LEU HD23 1 1 12 3825 1 1 16 LEU HG H -0.199 6.056 6.951 1.00 . A A . 16 LEU HG 1 1 12 3826 1 1 16 LEU N N 0.977 6.881 4.885 1.00 . A A . 16 LEU N 1 1 12 3827 1 1 16 LEU O O 3.231 9.559 5.660 1.00 . A A . 16 LEU O 1 1 12 3828 1 1 17 ILE C C 4.962 8.653 2.912 1.00 . A A . 17 ILE C 1 1 12 3829 1 1 17 ILE CA C 5.048 7.885 4.258 1.00 . A A . 17 ILE CA 1 1 12 3830 1 1 17 ILE CB C 5.924 6.608 4.155 1.00 . A A . 17 ILE CB 1 1 12 3831 1 1 17 ILE CD1 C 6.351 4.304 5.269 1.00 . A A . 17 ILE CD1 1 1 12 3832 1 1 17 ILE CG1 C 5.815 5.734 5.420 1.00 . A A . 17 ILE CG1 1 1 12 3833 1 1 17 ILE CG2 C 7.403 6.989 3.959 1.00 . A A . 17 ILE CG2 1 1 12 3834 1 1 17 ILE H H 3.415 6.604 4.589 1.00 . A A . 17 ILE H 1 1 12 3835 1 1 17 ILE HA H 5.521 8.548 4.983 1.00 . A A . 17 ILE HA 1 1 12 3836 1 1 17 ILE HB H 5.595 6.024 3.295 1.00 . A A . 17 ILE HB 1 1 12 3837 1 1 17 ILE HD11 H 7.407 4.338 5.003 1.00 . A A . 17 ILE HD11 1 1 12 3838 1 1 17 ILE HD12 H 6.230 3.769 6.211 1.00 . A A . 17 ILE HD12 1 1 12 3839 1 1 17 ILE HD13 H 5.795 3.789 4.485 1.00 . A A . 17 ILE HD13 1 1 12 3840 1 1 17 ILE HG12 H 6.376 6.222 6.217 1.00 . A A . 17 ILE HG12 1 1 12 3841 1 1 17 ILE HG13 H 4.768 5.683 5.716 1.00 . A A . 17 ILE HG13 1 1 12 3842 1 1 17 ILE HG21 H 7.504 7.609 3.068 1.00 . A A . 17 ILE HG21 1 1 12 3843 1 1 17 ILE HG22 H 7.753 7.545 4.829 1.00 . A A . 17 ILE HG22 1 1 12 3844 1 1 17 ILE HG23 H 8.000 6.084 3.842 1.00 . A A . 17 ILE HG23 1 1 12 3845 1 1 17 ILE N N 3.703 7.539 4.784 1.00 . A A . 17 ILE N 1 1 12 3846 1 1 17 ILE O O 5.982 9.053 2.348 1.00 . A A . 17 ILE O 1 1 12 3847 1 1 18 ARG C C 3.972 8.904 -0.043 1.00 . A A . 18 ARG C 1 1 12 3848 1 1 18 ARG CA C 3.418 9.632 1.185 1.00 . A A . 18 ARG CA 1 1 12 3849 1 1 18 ARG CB C 3.834 11.106 1.203 1.00 . A A . 18 ARG CB 1 1 12 3850 1 1 18 ARG CD C 3.513 13.243 2.351 1.00 . A A . 18 ARG CD 1 1 12 3851 1 1 18 ARG CG C 2.802 11.973 1.908 1.00 . A A . 18 ARG CG 1 1 12 3852 1 1 18 ARG CZ C 2.707 15.351 3.403 1.00 . A A . 18 ARG CZ 1 1 12 3853 1 1 18 ARG H H 2.933 8.576 2.910 1.00 . A A . 18 ARG H 1 1 12 3854 1 1 18 ARG HA H 2.331 9.618 1.092 1.00 . A A . 18 ARG HA 1 1 12 3855 1 1 18 ARG HB2 H 4.787 11.197 1.724 1.00 . A A . 18 ARG HB2 1 1 12 3856 1 1 18 ARG HB3 H 3.953 11.455 0.177 1.00 . A A . 18 ARG HB3 1 1 12 3857 1 1 18 ARG HD2 H 4.096 13.040 3.250 1.00 . A A . 18 ARG HD2 1 1 12 3858 1 1 18 ARG HD3 H 4.177 13.586 1.557 1.00 . A A . 18 ARG HD3 1 1 12 3859 1 1 18 ARG HE H 1.633 14.157 2.189 1.00 . A A . 18 ARG HE 1 1 12 3860 1 1 18 ARG HG2 H 1.994 12.221 1.219 1.00 . A A . 18 ARG HG2 1 1 12 3861 1 1 18 ARG HG3 H 2.400 11.447 2.774 1.00 . A A . 18 ARG HG3 1 1 12 3862 1 1 18 ARG HH11 H 4.521 14.815 4.067 1.00 . A A . 18 ARG HH11 1 1 12 3863 1 1 18 ARG HH12 H 3.935 16.325 4.687 1.00 . A A . 18 ARG HH12 1 1 12 3864 1 1 18 ARG HH21 H 0.886 16.129 3.014 1.00 . A A . 18 ARG HH21 1 1 12 3865 1 1 18 ARG HH22 H 1.878 17.047 4.097 1.00 . A A . 18 ARG HH22 1 1 12 3866 1 1 18 ARG N N 3.739 8.961 2.461 1.00 . A A . 18 ARG N 1 1 12 3867 1 1 18 ARG NE N 2.514 14.281 2.638 1.00 . A A . 18 ARG NE 1 1 12 3868 1 1 18 ARG NH1 N 3.812 15.520 4.114 1.00 . A A . 18 ARG NH1 1 1 12 3869 1 1 18 ARG NH2 N 1.738 16.248 3.517 1.00 . A A . 18 ARG NH2 1 1 12 3870 1 1 18 ARG O O 3.216 8.224 -0.737 1.00 . A A . 18 ARG O 1 1 12 3871 1 1 19 ALA C C 5.185 8.362 -2.710 1.00 . A A . 19 ALA C 1 1 12 3872 1 1 19 ALA CA C 6.043 8.592 -1.451 1.00 . A A . 19 ALA CA 1 1 12 3873 1 1 19 ALA CB C 6.804 7.340 -0.990 1.00 . A A . 19 ALA CB 1 1 12 3874 1 1 19 ALA H H 5.802 9.631 0.358 1.00 . A A . 19 ALA H 1 1 12 3875 1 1 19 ALA HA H 6.793 9.340 -1.711 1.00 . A A . 19 ALA HA 1 1 12 3876 1 1 19 ALA HB1 H 7.767 7.291 -1.499 1.00 . A A . 19 ALA HB1 1 1 12 3877 1 1 19 ALA HB2 H 6.220 6.451 -1.231 1.00 . A A . 19 ALA HB2 1 1 12 3878 1 1 19 ALA HB3 H 6.964 7.389 0.087 1.00 . A A . 19 ALA HB3 1 1 12 3879 1 1 19 ALA N N 5.259 9.142 -0.328 1.00 . A A . 19 ALA N 1 1 12 3880 1 1 19 ALA O O 4.952 7.248 -3.181 1.00 . A A . 19 ALA O 1 1 12 3881 1 1 20 PHE C C 4.136 10.326 -5.357 1.00 . A A . 20 PHE C 1 1 12 3882 1 1 20 PHE CA C 3.572 9.522 -4.177 1.00 . A A . 20 PHE CA 1 1 12 3883 1 1 20 PHE CB C 2.262 10.123 -3.638 1.00 . A A . 20 PHE CB 1 1 12 3884 1 1 20 PHE CD1 C 0.744 9.265 -5.465 1.00 . A A . 20 PHE CD1 1 1 12 3885 1 1 20 PHE CD2 C 0.822 11.639 -5.083 1.00 . A A . 20 PHE CD2 1 1 12 3886 1 1 20 PHE CE1 C -0.135 9.462 -6.520 1.00 . A A . 20 PHE CE1 1 1 12 3887 1 1 20 PHE CE2 C -0.065 11.836 -6.135 1.00 . A A . 20 PHE CE2 1 1 12 3888 1 1 20 PHE CG C 1.222 10.350 -4.743 1.00 . A A . 20 PHE CG 1 1 12 3889 1 1 20 PHE CZ C -0.545 10.748 -6.853 1.00 . A A . 20 PHE CZ 1 1 12 3890 1 1 20 PHE H H 4.682 10.321 -2.574 1.00 . A A . 20 PHE H 1 1 12 3891 1 1 20 PHE HA H 3.374 8.505 -4.515 1.00 . A A . 20 PHE HA 1 1 12 3892 1 1 20 PHE HB2 H 1.843 9.441 -2.898 1.00 . A A . 20 PHE HB2 1 1 12 3893 1 1 20 PHE HB3 H 2.481 11.076 -3.156 1.00 . A A . 20 PHE HB3 1 1 12 3894 1 1 20 PHE HD1 H 1.093 8.260 -5.225 1.00 . A A . 20 PHE HD1 1 1 12 3895 1 1 20 PHE HD2 H 1.245 12.500 -4.562 1.00 . A A . 20 PHE HD2 1 1 12 3896 1 1 20 PHE HE1 H -0.488 8.609 -7.098 1.00 . A A . 20 PHE HE1 1 1 12 3897 1 1 20 PHE HE2 H -0.387 12.845 -6.395 1.00 . A A . 20 PHE HE2 1 1 12 3898 1 1 20 PHE HZ H -1.266 10.899 -7.657 1.00 . A A . 20 PHE HZ 1 1 12 3899 1 1 20 PHE N N 4.558 9.469 -3.081 1.00 . A A . 20 PHE N 1 1 12 3900 1 1 20 PHE O O 4.819 9.708 -6.201 1.00 . A A . 20 PHE O 1 1 13 3901 1 1 1 HIS C C -6.496 -12.385 -5.671 1.00 . A A . 1 HIS C 1 1 13 3902 1 1 1 HIS CA C -7.827 -11.820 -6.218 1.00 . A A . 1 HIS CA 1 1 13 3903 1 1 1 HIS CB C -9.019 -12.603 -5.638 1.00 . A A . 1 HIS CB 1 1 13 3904 1 1 1 HIS CD2 C -10.867 -11.397 -4.366 1.00 . A A . 1 HIS CD2 1 1 13 3905 1 1 1 HIS CE1 C -12.074 -10.647 -5.985 1.00 . A A . 1 HIS CE1 1 1 13 3906 1 1 1 HIS CG C -10.285 -11.755 -5.509 1.00 . A A . 1 HIS CG 1 1 13 3907 1 1 1 HIS H1 H -7.082 -12.145 -8.199 1.00 . A A . 1 HIS H1 1 1 13 3908 1 1 1 HIS HA H -7.913 -10.792 -5.866 1.00 . A A . 1 HIS HA 1 1 13 3909 1 1 1 HIS HB2 H -9.233 -13.447 -6.295 1.00 . A A . 1 HIS HB2 1 1 13 3910 1 1 1 HIS HB3 H -8.747 -12.982 -4.653 1.00 . A A . 1 HIS HB3 1 1 13 3911 1 1 1 HIS HD1 H -10.847 -11.407 -7.481 1.00 . A A . 1 HIS HD1 1 1 13 3912 1 1 1 HIS HD2 H -10.509 -11.625 -3.373 1.00 . A A . 1 HIS HD2 1 1 13 3913 1 1 1 HIS HE1 H -12.864 -10.159 -6.536 1.00 . A A . 1 HIS HE1 1 1 13 3914 1 1 1 HIS HE2 H -12.608 -10.305 -3.996 1.00 . A A . 1 HIS HE2 1 1 13 3915 1 1 1 HIS N N -7.879 -11.783 -7.694 1.00 . A A . 1 HIS N 1 1 13 3916 1 1 1 HIS ND1 N -11.035 -11.293 -6.509 1.00 . A A . 1 HIS ND1 1 1 13 3917 1 1 1 HIS NE2 N -11.966 -10.710 -4.662 1.00 . A A . 1 HIS NE2 1 1 13 3918 1 1 1 HIS O O -6.287 -13.594 -5.603 1.00 . A A . 1 HIS O 1 1 13 3919 1 1 2 GLY C C -3.313 -10.516 -4.948 1.00 . A A . 2 GLY C 1 1 13 3920 1 1 2 GLY CA C -4.185 -11.773 -5.033 1.00 . A A . 2 GLY CA 1 1 13 3921 1 1 2 GLY H H -5.710 -10.479 -5.687 1.00 . A A . 2 GLY H 1 1 13 3922 1 1 2 GLY HA2 H -4.249 -12.231 -4.045 1.00 . A A . 2 GLY HA2 1 1 13 3923 1 1 2 GLY HA3 H -3.724 -12.479 -5.725 1.00 . A A . 2 GLY HA3 1 1 13 3924 1 1 2 GLY N N -5.546 -11.455 -5.508 1.00 . A A . 2 GLY N 1 1 13 3925 1 1 2 GLY O O -3.396 -9.758 -3.985 1.00 . A A . 2 GLY O 1 1 13 3926 1 1 3 LEU C C -2.651 -7.661 -6.049 1.00 . A A . 3 LEU C 1 1 13 3927 1 1 3 LEU CA C -1.850 -8.971 -6.193 1.00 . A A . 3 LEU CA 1 1 13 3928 1 1 3 LEU CB C -1.025 -8.943 -7.486 1.00 . A A . 3 LEU CB 1 1 13 3929 1 1 3 LEU CD1 C -1.106 -7.794 -9.703 1.00 . A A . 3 LEU CD1 1 1 13 3930 1 1 3 LEU CD2 C -2.174 -10.054 -9.441 1.00 . A A . 3 LEU CD2 1 1 13 3931 1 1 3 LEU CG C -1.859 -8.725 -8.753 1.00 . A A . 3 LEU CG 1 1 13 3932 1 1 3 LEU H H -2.639 -10.819 -6.852 1.00 . A A . 3 LEU H 1 1 13 3933 1 1 3 LEU HA H -1.137 -8.994 -5.369 1.00 . A A . 3 LEU HA 1 1 13 3934 1 1 3 LEU HB2 H -0.286 -8.145 -7.413 1.00 . A A . 3 LEU HB2 1 1 13 3935 1 1 3 LEU HB3 H -0.503 -9.895 -7.580 1.00 . A A . 3 LEU HB3 1 1 13 3936 1 1 3 LEU HD11 H -1.699 -7.637 -10.604 1.00 . A A . 3 LEU HD11 1 1 13 3937 1 1 3 LEU HD12 H -0.149 -8.244 -9.969 1.00 . A A . 3 LEU HD12 1 1 13 3938 1 1 3 LEU HD13 H -0.932 -6.837 -9.211 1.00 . A A . 3 LEU HD13 1 1 13 3939 1 1 3 LEU HD21 H -2.793 -9.870 -10.319 1.00 . A A . 3 LEU HD21 1 1 13 3940 1 1 3 LEU HD22 H -2.711 -10.704 -8.749 1.00 . A A . 3 LEU HD22 1 1 13 3941 1 1 3 LEU HD23 H -1.245 -10.535 -9.744 1.00 . A A . 3 LEU HD23 1 1 13 3942 1 1 3 LEU HG H -2.798 -8.248 -8.472 1.00 . A A . 3 LEU HG 1 1 13 3943 1 1 3 LEU N N -2.677 -10.193 -6.072 1.00 . A A . 3 LEU N 1 1 13 3944 1 1 3 LEU O O -2.204 -6.724 -5.396 1.00 . A A . 3 LEU O 1 1 13 3945 1 1 4 ALA C C -5.029 -6.182 -4.850 1.00 . A A . 4 ALA C 1 1 13 3946 1 1 4 ALA CA C -4.841 -6.549 -6.339 1.00 . A A . 4 ALA CA 1 1 13 3947 1 1 4 ALA CB C -6.183 -6.910 -6.979 1.00 . A A . 4 ALA CB 1 1 13 3948 1 1 4 ALA H H -4.143 -8.294 -7.278 1.00 . A A . 4 ALA H 1 1 13 3949 1 1 4 ALA HA H -4.453 -5.668 -6.853 1.00 . A A . 4 ALA HA 1 1 13 3950 1 1 4 ALA HB1 H -6.029 -7.165 -8.027 1.00 . A A . 4 ALA HB1 1 1 13 3951 1 1 4 ALA HB2 H -6.615 -7.764 -6.457 1.00 . A A . 4 ALA HB2 1 1 13 3952 1 1 4 ALA HB3 H -6.860 -6.059 -6.907 1.00 . A A . 4 ALA HB3 1 1 13 3953 1 1 4 ALA N N -3.884 -7.657 -6.556 1.00 . A A . 4 ALA N 1 1 13 3954 1 1 4 ALA O O -5.140 -5.009 -4.513 1.00 . A A . 4 ALA O 1 1 13 3955 1 1 5 SER C C -3.461 -6.780 -1.906 1.00 . A A . 5 SER C 1 1 13 3956 1 1 5 SER CA C -4.849 -7.044 -2.518 1.00 . A A . 5 SER CA 1 1 13 3957 1 1 5 SER CB C -5.437 -8.311 -1.893 1.00 . A A . 5 SER CB 1 1 13 3958 1 1 5 SER H H -4.510 -8.074 -4.304 1.00 . A A . 5 SER H 1 1 13 3959 1 1 5 SER HA H -5.499 -6.206 -2.266 1.00 . A A . 5 SER HA 1 1 13 3960 1 1 5 SER HB2 H -5.812 -8.967 -2.678 1.00 . A A . 5 SER HB2 1 1 13 3961 1 1 5 SER HB3 H -4.666 -8.828 -1.320 1.00 . A A . 5 SER HB3 1 1 13 3962 1 1 5 SER HG H -6.844 -8.743 -0.536 1.00 . A A . 5 SER HG 1 1 13 3963 1 1 5 SER N N -4.813 -7.177 -3.988 1.00 . A A . 5 SER N 1 1 13 3964 1 1 5 SER O O -3.353 -6.112 -0.878 1.00 . A A . 5 SER O 1 1 13 3965 1 1 5 SER OG O -6.507 -7.938 -1.026 1.00 . A A . 5 SER OG 1 1 13 3966 1 1 6 THR C C -0.713 -5.402 -2.161 1.00 . A A . 6 THR C 1 1 13 3967 1 1 6 THR CA C -0.992 -6.919 -2.202 1.00 . A A . 6 THR CA 1 1 13 3968 1 1 6 THR CB C 0.029 -7.698 -3.069 1.00 . A A . 6 THR CB 1 1 13 3969 1 1 6 THR CG2 C 0.573 -6.998 -4.325 1.00 . A A . 6 THR CG2 1 1 13 3970 1 1 6 THR H H -2.498 -7.719 -3.443 1.00 . A A . 6 THR H 1 1 13 3971 1 1 6 THR HA H -0.873 -7.283 -1.182 1.00 . A A . 6 THR HA 1 1 13 3972 1 1 6 THR HB H -0.437 -8.634 -3.379 1.00 . A A . 6 THR HB 1 1 13 3973 1 1 6 THR HG1 H 1.887 -8.377 -2.812 1.00 . A A . 6 THR HG1 1 1 13 3974 1 1 6 THR HG21 H 0.302 -7.575 -5.209 1.00 . A A . 6 THR HG21 1 1 13 3975 1 1 6 THR HG22 H 1.659 -6.923 -4.258 1.00 . A A . 6 THR HG22 1 1 13 3976 1 1 6 THR HG23 H 0.144 -5.998 -4.397 1.00 . A A . 6 THR HG23 1 1 13 3977 1 1 6 THR N N -2.396 -7.207 -2.593 1.00 . A A . 6 THR N 1 1 13 3978 1 1 6 THR O O 0.009 -4.908 -1.293 1.00 . A A . 6 THR O 1 1 13 3979 1 1 6 THR OG1 O 1.146 -8.013 -2.244 1.00 . A A . 6 THR OG1 1 1 13 3980 1 1 7 LEU C C -2.351 -2.561 -2.011 1.00 . A A . 7 LEU C 1 1 13 3981 1 1 7 LEU CA C -1.399 -3.199 -3.037 1.00 . A A . 7 LEU CA 1 1 13 3982 1 1 7 LEU CB C -1.623 -2.665 -4.467 1.00 . A A . 7 LEU CB 1 1 13 3983 1 1 7 LEU CD1 C -3.637 -1.125 -4.652 1.00 . A A . 7 LEU CD1 1 1 13 3984 1 1 7 LEU CD2 C -3.152 -2.783 -6.456 1.00 . A A . 7 LEU CD2 1 1 13 3985 1 1 7 LEU CG C -3.074 -2.518 -4.954 1.00 . A A . 7 LEU CG 1 1 13 3986 1 1 7 LEU H H -2.083 -5.090 -3.654 1.00 . A A . 7 LEU H 1 1 13 3987 1 1 7 LEU HA H -0.389 -2.909 -2.750 1.00 . A A . 7 LEU HA 1 1 13 3988 1 1 7 LEU HB2 H -1.141 -1.689 -4.542 1.00 . A A . 7 LEU HB2 1 1 13 3989 1 1 7 LEU HB3 H -1.116 -3.344 -5.152 1.00 . A A . 7 LEU HB3 1 1 13 3990 1 1 7 LEU HD11 H -3.582 -0.935 -3.581 1.00 . A A . 7 LEU HD11 1 1 13 3991 1 1 7 LEU HD12 H -3.053 -0.375 -5.184 1.00 . A A . 7 LEU HD12 1 1 13 3992 1 1 7 LEU HD13 H -4.675 -1.074 -4.977 1.00 . A A . 7 LEU HD13 1 1 13 3993 1 1 7 LEU HD21 H -4.191 -2.732 -6.781 1.00 . A A . 7 LEU HD21 1 1 13 3994 1 1 7 LEU HD22 H -2.752 -3.774 -6.673 1.00 . A A . 7 LEU HD22 1 1 13 3995 1 1 7 LEU HD23 H -2.568 -2.032 -6.988 1.00 . A A . 7 LEU HD23 1 1 13 3996 1 1 7 LEU HG H -3.689 -3.258 -4.440 1.00 . A A . 7 LEU HG 1 1 13 3997 1 1 7 LEU N N -1.439 -4.672 -3.012 1.00 . A A . 7 LEU N 1 1 13 3998 1 1 7 LEU O O -2.295 -1.358 -1.815 1.00 . A A . 7 LEU O 1 1 13 3999 1 1 8 THR C C -3.492 -2.978 1.137 1.00 . A A . 8 THR C 1 1 13 4000 1 1 8 THR CA C -4.102 -2.897 -0.277 1.00 . A A . 8 THR CA 1 1 13 4001 1 1 8 THR CB C -5.398 -3.719 -0.422 1.00 . A A . 8 THR CB 1 1 13 4002 1 1 8 THR CG2 C -6.535 -3.278 0.508 1.00 . A A . 8 THR CG2 1 1 13 4003 1 1 8 THR H H -3.144 -4.356 -1.429 1.00 . A A . 8 THR H 1 1 13 4004 1 1 8 THR HA H -4.338 -1.854 -0.485 1.00 . A A . 8 THR HA 1 1 13 4005 1 1 8 THR HB H -5.169 -4.765 -0.216 1.00 . A A . 8 THR HB 1 1 13 4006 1 1 8 THR HG1 H -6.731 -4.055 -1.889 1.00 . A A . 8 THR HG1 1 1 13 4007 1 1 8 THR HG21 H -6.212 -3.372 1.545 1.00 . A A . 8 THR HG21 1 1 13 4008 1 1 8 THR HG22 H -7.408 -3.909 0.341 1.00 . A A . 8 THR HG22 1 1 13 4009 1 1 8 THR HG23 H -6.792 -2.240 0.300 1.00 . A A . 8 THR HG23 1 1 13 4010 1 1 8 THR N N -3.132 -3.364 -1.297 1.00 . A A . 8 THR N 1 1 13 4011 1 1 8 THR O O -3.973 -2.342 2.073 1.00 . A A . 8 THR O 1 1 13 4012 1 1 8 THR OG1 O -5.841 -3.611 -1.779 1.00 . A A . 8 THR OG1 1 1 13 4013 1 1 9 ARG C C -0.356 -2.946 2.458 1.00 . A A . 9 ARG C 1 1 13 4014 1 1 9 ARG CA C -1.613 -3.829 2.500 1.00 . A A . 9 ARG CA 1 1 13 4015 1 1 9 ARG CB C -1.288 -5.304 2.764 1.00 . A A . 9 ARG CB 1 1 13 4016 1 1 9 ARG CD C 0.528 -5.185 4.566 1.00 . A A . 9 ARG CD 1 1 13 4017 1 1 9 ARG CG C -0.906 -5.596 4.222 1.00 . A A . 9 ARG CG 1 1 13 4018 1 1 9 ARG CZ C 1.957 -5.899 6.496 1.00 . A A . 9 ARG CZ 1 1 13 4019 1 1 9 ARG H H -2.040 -4.243 0.482 1.00 . A A . 9 ARG H 1 1 13 4020 1 1 9 ARG HA H -2.243 -3.475 3.316 1.00 . A A . 9 ARG HA 1 1 13 4021 1 1 9 ARG HB2 H -2.164 -5.900 2.511 1.00 . A A . 9 ARG HB2 1 1 13 4022 1 1 9 ARG HB3 H -0.462 -5.602 2.118 1.00 . A A . 9 ARG HB3 1 1 13 4023 1 1 9 ARG HD2 H 1.226 -5.740 3.939 1.00 . A A . 9 ARG HD2 1 1 13 4024 1 1 9 ARG HD3 H 0.652 -4.117 4.390 1.00 . A A . 9 ARG HD3 1 1 13 4025 1 1 9 ARG HE H 0.033 -5.332 6.602 1.00 . A A . 9 ARG HE 1 1 13 4026 1 1 9 ARG HG2 H -1.592 -5.062 4.878 1.00 . A A . 9 ARG HG2 1 1 13 4027 1 1 9 ARG HG3 H -1.011 -6.666 4.399 1.00 . A A . 9 ARG HG3 1 1 13 4028 1 1 9 ARG HH11 H 2.990 -5.863 4.776 1.00 . A A . 9 ARG HH11 1 1 13 4029 1 1 9 ARG HH12 H 3.898 -6.365 6.165 1.00 . A A . 9 ARG HH12 1 1 13 4030 1 1 9 ARG HH21 H 1.257 -6.003 8.388 1.00 . A A . 9 ARG HH21 1 1 13 4031 1 1 9 ARG HH22 H 2.917 -6.442 8.178 1.00 . A A . 9 ARG HH22 1 1 13 4032 1 1 9 ARG N N -2.377 -3.701 1.248 1.00 . A A . 9 ARG N 1 1 13 4033 1 1 9 ARG NE N 0.797 -5.483 5.982 1.00 . A A . 9 ARG NE 1 1 13 4034 1 1 9 ARG NH1 N 3.043 -6.061 5.752 1.00 . A A . 9 ARG NH1 1 1 13 4035 1 1 9 ARG NH2 N 2.048 -6.137 7.795 1.00 . A A . 9 ARG NH2 1 1 13 4036 1 1 9 ARG O O -0.266 -2.023 3.253 1.00 . A A . 9 ARG O 1 1 13 4037 1 1 10 TRP C C 1.322 -0.704 1.221 1.00 . A A . 10 TRP C 1 1 13 4038 1 1 10 TRP CA C 1.694 -2.202 1.330 1.00 . A A . 10 TRP CA 1 1 13 4039 1 1 10 TRP CB C 2.591 -2.726 0.195 1.00 . A A . 10 TRP CB 1 1 13 4040 1 1 10 TRP CD1 C 2.509 -1.451 -1.998 1.00 . A A . 10 TRP CD1 1 1 13 4041 1 1 10 TRP CD2 C 4.037 -0.703 -0.599 1.00 . A A . 10 TRP CD2 1 1 13 4042 1 1 10 TRP CE2 C 4.033 0.083 -1.740 1.00 . A A . 10 TRP CE2 1 1 13 4043 1 1 10 TRP CE3 C 4.886 -0.425 0.455 1.00 . A A . 10 TRP CE3 1 1 13 4044 1 1 10 TRP CG C 3.056 -1.668 -0.797 1.00 . A A . 10 TRP CG 1 1 13 4045 1 1 10 TRP CH2 C 5.743 1.465 -0.773 1.00 . A A . 10 TRP CH2 1 1 13 4046 1 1 10 TRP CZ2 C 4.904 1.164 -1.835 1.00 . A A . 10 TRP CZ2 1 1 13 4047 1 1 10 TRP CZ3 C 5.739 0.674 0.374 1.00 . A A . 10 TRP CZ3 1 1 13 4048 1 1 10 TRP H H 0.449 -3.811 0.767 1.00 . A A . 10 TRP H 1 1 13 4049 1 1 10 TRP HA H 2.266 -2.313 2.252 1.00 . A A . 10 TRP HA 1 1 13 4050 1 1 10 TRP HB2 H 3.469 -3.196 0.637 1.00 . A A . 10 TRP HB2 1 1 13 4051 1 1 10 TRP HB3 H 2.033 -3.483 -0.355 1.00 . A A . 10 TRP HB3 1 1 13 4052 1 1 10 TRP HD1 H 1.709 -2.032 -2.431 1.00 . A A . 10 TRP HD1 1 1 13 4053 1 1 10 TRP HE1 H 2.924 -0.064 -3.487 1.00 . A A . 10 TRP HE1 1 1 13 4054 1 1 10 TRP HE3 H 4.966 -1.105 1.303 1.00 . A A . 10 TRP HE3 1 1 13 4055 1 1 10 TRP HH2 H 6.382 2.348 -0.822 1.00 . A A . 10 TRP HH2 1 1 13 4056 1 1 10 TRP HZ2 H 5.024 1.688 -2.784 1.00 . A A . 10 TRP HZ2 1 1 13 4057 1 1 10 TRP HZ3 H 6.408 0.901 1.198 1.00 . A A . 10 TRP HZ3 1 1 13 4058 1 1 10 TRP N N 0.514 -3.088 1.458 1.00 . A A . 10 TRP N 1 1 13 4059 1 1 10 TRP NE1 N 3.110 -0.392 -2.566 1.00 . A A . 10 TRP NE1 1 1 13 4060 1 1 10 TRP O O 1.997 0.161 1.784 1.00 . A A . 10 TRP O 1 1 13 4061 1 1 11 ALA C C -0.984 1.403 1.966 1.00 . A A . 11 ALA C 1 1 13 4062 1 1 11 ALA CA C -0.442 0.908 0.614 1.00 . A A . 11 ALA CA 1 1 13 4063 1 1 11 ALA CB C -1.552 1.019 -0.429 1.00 . A A . 11 ALA CB 1 1 13 4064 1 1 11 ALA H H -0.454 -1.180 0.323 1.00 . A A . 11 ALA H 1 1 13 4065 1 1 11 ALA HA H 0.354 1.590 0.315 1.00 . A A . 11 ALA HA 1 1 13 4066 1 1 11 ALA HB1 H -1.902 2.050 -0.480 1.00 . A A . 11 ALA HB1 1 1 13 4067 1 1 11 ALA HB2 H -1.167 0.719 -1.403 1.00 . A A . 11 ALA HB2 1 1 13 4068 1 1 11 ALA HB3 H -2.380 0.367 -0.150 1.00 . A A . 11 ALA HB3 1 1 13 4069 1 1 11 ALA N N 0.138 -0.450 0.660 1.00 . A A . 11 ALA N 1 1 13 4070 1 1 11 ALA O O -1.549 2.486 2.023 1.00 . A A . 11 ALA O 1 1 13 4071 1 1 12 HIS C C 0.202 1.730 5.088 1.00 . A A . 12 HIS C 1 1 13 4072 1 1 12 HIS CA C -1.037 1.094 4.424 1.00 . A A . 12 HIS CA 1 1 13 4073 1 1 12 HIS CB C -1.620 -0.073 5.246 1.00 . A A . 12 HIS CB 1 1 13 4074 1 1 12 HIS CD2 C 0.526 -1.369 5.934 1.00 . A A . 12 HIS CD2 1 1 13 4075 1 1 12 HIS CE1 C 0.078 -1.755 7.988 1.00 . A A . 12 HIS CE1 1 1 13 4076 1 1 12 HIS CG C -0.684 -0.867 6.175 1.00 . A A . 12 HIS CG 1 1 13 4077 1 1 12 HIS H H -0.427 -0.295 2.970 1.00 . A A . 12 HIS H 1 1 13 4078 1 1 12 HIS HA H -1.806 1.865 4.364 1.00 . A A . 12 HIS HA 1 1 13 4079 1 1 12 HIS HB2 H -2.435 0.322 5.852 1.00 . A A . 12 HIS HB2 1 1 13 4080 1 1 12 HIS HB3 H -2.045 -0.783 4.537 1.00 . A A . 12 HIS HB3 1 1 13 4081 1 1 12 HIS HD1 H -1.805 -0.871 7.920 1.00 . A A . 12 HIS HD1 1 1 13 4082 1 1 12 HIS HD2 H 1.037 -1.340 4.983 1.00 . A A . 12 HIS HD2 1 1 13 4083 1 1 12 HIS HE1 H 0.156 -2.086 9.013 1.00 . A A . 12 HIS HE1 1 1 13 4084 1 1 12 HIS HE2 H 1.903 -2.355 7.161 1.00 . A A . 12 HIS HE2 1 1 13 4085 1 1 12 HIS N N -0.744 0.656 3.041 1.00 . A A . 12 HIS N 1 1 13 4086 1 1 12 HIS ND1 N -0.961 -1.123 7.452 1.00 . A A . 12 HIS ND1 1 1 13 4087 1 1 12 HIS NE2 N 1.003 -1.909 7.048 1.00 . A A . 12 HIS NE2 1 1 13 4088 1 1 12 HIS O O 0.096 2.384 6.121 1.00 . A A . 12 HIS O 1 1 13 4089 1 1 13 TYR C C 2.986 3.266 4.313 1.00 . A A . 13 TYR C 1 1 13 4090 1 1 13 TYR CA C 2.683 1.907 4.960 1.00 . A A . 13 TYR CA 1 1 13 4091 1 1 13 TYR CB C 3.731 0.864 4.561 1.00 . A A . 13 TYR CB 1 1 13 4092 1 1 13 TYR CD1 C 5.648 1.176 6.174 1.00 . A A . 13 TYR CD1 1 1 13 4093 1 1 13 TYR CD2 C 4.228 -0.762 6.416 1.00 . A A . 13 TYR CD2 1 1 13 4094 1 1 13 TYR CE1 C 6.430 0.724 7.226 1.00 . A A . 13 TYR CE1 1 1 13 4095 1 1 13 TYR CE2 C 5.012 -1.208 7.467 1.00 . A A . 13 TYR CE2 1 1 13 4096 1 1 13 TYR CG C 4.544 0.429 5.765 1.00 . A A . 13 TYR CG 1 1 13 4097 1 1 13 TYR CZ C 6.103 -0.456 7.872 1.00 . A A . 13 TYR CZ 1 1 13 4098 1 1 13 TYR H H 1.401 0.779 3.748 1.00 . A A . 13 TYR H 1 1 13 4099 1 1 13 TYR HA H 2.679 2.017 6.043 1.00 . A A . 13 TYR HA 1 1 13 4100 1 1 13 TYR HB2 H 3.227 -0.005 4.137 1.00 . A A . 13 TYR HB2 1 1 13 4101 1 1 13 TYR HB3 H 4.398 1.292 3.814 1.00 . A A . 13 TYR HB3 1 1 13 4102 1 1 13 TYR HD1 H 5.869 2.126 5.693 1.00 . A A . 13 TYR HD1 1 1 13 4103 1 1 13 TYR HD2 H 3.362 -1.339 6.100 1.00 . A A . 13 TYR HD2 1 1 13 4104 1 1 13 TYR HE1 H 7.335 1.276 7.494 1.00 . A A . 13 TYR HE1 1 1 13 4105 1 1 13 TYR HE2 H 4.793 -2.185 7.905 1.00 . A A . 13 TYR HE2 1 1 13 4106 1 1 13 TYR HH H 6.441 -1.696 9.307 1.00 . A A . 13 TYR HH 1 1 13 4107 1 1 13 TYR N N 1.366 1.420 4.517 1.00 . A A . 13 TYR N 1 1 13 4108 1 1 13 TYR O O 2.932 4.307 4.963 1.00 . A A . 13 TYR O 1 1 13 4109 1 1 13 TYR OH O 6.845 -0.863 8.941 1.00 . A A . 13 TYR OH 1 1 13 4110 1 1 14 ASN C C 1.998 5.287 1.971 1.00 . A A . 14 ASN C 1 1 13 4111 1 1 14 ASN CA C 3.278 4.460 2.171 1.00 . A A . 14 ASN CA 1 1 13 4112 1 1 14 ASN CB C 3.946 4.134 0.834 1.00 . A A . 14 ASN CB 1 1 13 4113 1 1 14 ASN CG C 5.473 4.183 0.950 1.00 . A A . 14 ASN CG 1 1 13 4114 1 1 14 ASN H H 3.094 2.379 2.475 1.00 . A A . 14 ASN H 1 1 13 4115 1 1 14 ASN HA H 3.974 5.102 2.712 1.00 . A A . 14 ASN HA 1 1 13 4116 1 1 14 ASN HB2 H 3.643 3.136 0.517 1.00 . A A . 14 ASN HB2 1 1 13 4117 1 1 14 ASN HB3 H 3.623 4.860 0.089 1.00 . A A . 14 ASN HB3 1 1 13 4118 1 1 14 ASN HD21 H 5.542 2.700 2.321 1.00 . A A . 14 ASN HD21 1 1 13 4119 1 1 14 ASN HD22 H 7.053 3.409 1.817 1.00 . A A . 14 ASN HD22 1 1 13 4120 1 1 14 ASN N N 3.122 3.240 2.987 1.00 . A A . 14 ASN N 1 1 13 4121 1 1 14 ASN ND2 N 6.058 3.349 1.779 1.00 . A A . 14 ASN ND2 1 1 13 4122 1 1 14 ASN O O 2.060 6.363 1.379 1.00 . A A . 14 ASN O 1 1 13 4123 1 1 14 ASN OD1 O 6.155 4.930 0.272 1.00 . A A . 14 ASN OD1 1 1 13 4124 1 1 15 ALA C C -0.209 7.018 3.152 1.00 . A A . 15 ALA C 1 1 13 4125 1 1 15 ALA CA C -0.386 5.583 2.640 1.00 . A A . 15 ALA CA 1 1 13 4126 1 1 15 ALA CB C -1.368 4.903 3.599 1.00 . A A . 15 ALA CB 1 1 13 4127 1 1 15 ALA H H 0.880 3.956 3.037 1.00 . A A . 15 ALA H 1 1 13 4128 1 1 15 ALA HA H -0.818 5.608 1.639 1.00 . A A . 15 ALA HA 1 1 13 4129 1 1 15 ALA HB1 H -1.583 5.571 4.433 1.00 . A A . 15 ALA HB1 1 1 13 4130 1 1 15 ALA HB2 H -2.293 4.674 3.069 1.00 . A A . 15 ALA HB2 1 1 13 4131 1 1 15 ALA HB3 H -0.927 3.981 3.976 1.00 . A A . 15 ALA HB3 1 1 13 4132 1 1 15 ALA N N 0.902 4.852 2.599 1.00 . A A . 15 ALA N 1 1 13 4133 1 1 15 ALA O O -0.566 7.975 2.470 1.00 . A A . 15 ALA O 1 1 13 4134 1 1 16 LEU C C 2.190 8.998 4.351 1.00 . A A . 16 LEU C 1 1 13 4135 1 1 16 LEU CA C 0.865 8.413 4.874 1.00 . A A . 16 LEU CA 1 1 13 4136 1 1 16 LEU CB C 0.858 8.221 6.393 1.00 . A A . 16 LEU CB 1 1 13 4137 1 1 16 LEU CD1 C -0.295 9.338 8.313 1.00 . A A . 16 LEU CD1 1 1 13 4138 1 1 16 LEU CD2 C 1.990 10.097 7.648 1.00 . A A . 16 LEU CD2 1 1 13 4139 1 1 16 LEU CG C 0.656 9.547 7.135 1.00 . A A . 16 LEU CG 1 1 13 4140 1 1 16 LEU H H 0.972 6.320 4.664 1.00 . A A . 16 LEU H 1 1 13 4141 1 1 16 LEU HA H 0.067 9.111 4.621 1.00 . A A . 16 LEU HA 1 1 13 4142 1 1 16 LEU HB2 H 0.054 7.536 6.663 1.00 . A A . 16 LEU HB2 1 1 13 4143 1 1 16 LEU HB3 H 1.811 7.789 6.699 1.00 . A A . 16 LEU HB3 1 1 13 4144 1 1 16 LEU HD11 H -1.245 8.946 7.949 1.00 . A A . 16 LEU HD11 1 1 13 4145 1 1 16 LEU HD12 H -0.465 10.289 8.817 1.00 . A A . 16 LEU HD12 1 1 13 4146 1 1 16 LEU HD13 H 0.144 8.628 9.014 1.00 . A A . 16 LEU HD13 1 1 13 4147 1 1 16 LEU HD21 H 1.821 11.048 8.153 1.00 . A A . 16 LEU HD21 1 1 13 4148 1 1 16 LEU HD22 H 2.669 10.247 6.808 1.00 . A A . 16 LEU HD22 1 1 13 4149 1 1 16 LEU HD23 H 2.430 9.387 8.349 1.00 . A A . 16 LEU HD23 1 1 13 4150 1 1 16 LEU HG H 0.215 10.272 6.450 1.00 . A A . 16 LEU HG 1 1 13 4151 1 1 16 LEU N N 0.557 7.124 4.236 1.00 . A A . 16 LEU N 1 1 13 4152 1 1 16 LEU O O 2.387 10.210 4.381 1.00 . A A . 16 LEU O 1 1 13 4153 1 1 17 ILE C C 3.985 9.069 1.626 1.00 . A A . 17 ILE C 1 1 13 4154 1 1 17 ILE CA C 4.255 8.546 3.060 1.00 . A A . 17 ILE CA 1 1 13 4155 1 1 17 ILE CB C 5.279 7.381 3.072 1.00 . A A . 17 ILE CB 1 1 13 4156 1 1 17 ILE CD1 C 6.126 5.369 4.486 1.00 . A A . 17 ILE CD1 1 1 13 4157 1 1 17 ILE CG1 C 5.338 6.688 4.447 1.00 . A A . 17 ILE CG1 1 1 13 4158 1 1 17 ILE CG2 C 6.688 7.900 2.728 1.00 . A A . 17 ILE CG2 1 1 13 4159 1 1 17 ILE H H 2.656 7.241 3.427 1.00 . A A . 17 ILE H 1 1 13 4160 1 1 17 ILE HA H 4.675 9.366 3.643 1.00 . A A . 17 ILE HA 1 1 13 4161 1 1 17 ILE HB H 4.984 6.647 2.322 1.00 . A A . 17 ILE HB 1 1 13 4162 1 1 17 ILE HD11 H 6.869 5.367 3.688 1.00 . A A . 17 ILE HD11 1 1 13 4163 1 1 17 ILE HD12 H 6.627 5.273 5.449 1.00 . A A . 17 ILE HD12 1 1 13 4164 1 1 17 ILE HD13 H 5.441 4.533 4.347 1.00 . A A . 17 ILE HD13 1 1 13 4165 1 1 17 ILE HG12 H 5.802 7.378 5.152 1.00 . A A . 17 ILE HG12 1 1 13 4166 1 1 17 ILE HG13 H 4.319 6.490 4.778 1.00 . A A . 17 ILE HG13 1 1 13 4167 1 1 17 ILE HG21 H 6.666 8.394 1.756 1.00 . A A . 17 ILE HG21 1 1 13 4168 1 1 17 ILE HG22 H 7.009 8.611 3.489 1.00 . A A . 17 ILE HG22 1 1 13 4169 1 1 17 ILE HG23 H 7.386 7.064 2.695 1.00 . A A . 17 ILE HG23 1 1 13 4170 1 1 17 ILE N N 2.979 8.148 3.691 1.00 . A A . 17 ILE N 1 1 13 4171 1 1 17 ILE O O 4.919 9.288 0.859 1.00 . A A . 17 ILE O 1 1 13 4172 1 1 18 ARG C C 3.060 9.458 -1.218 1.00 . A A . 18 ARG C 1 1 13 4173 1 1 18 ARG CA C 2.264 9.935 0.016 1.00 . A A . 18 ARG CA 1 1 13 4174 1 1 18 ARG CB C 2.235 11.467 0.167 1.00 . A A . 18 ARG CB 1 1 13 4175 1 1 18 ARG CD C 3.641 13.567 0.528 1.00 . A A . 18 ARG CD 1 1 13 4176 1 1 18 ARG CG C 3.615 12.051 0.497 1.00 . A A . 18 ARG CG 1 1 13 4177 1 1 18 ARG CZ C 3.676 15.317 2.282 1.00 . A A . 18 ARG CZ 1 1 13 4178 1 1 18 ARG H H 1.957 9.036 1.881 1.00 . A A . 18 ARG H 1 1 13 4179 1 1 18 ARG HA H 1.233 9.619 -0.140 1.00 . A A . 18 ARG HA 1 1 13 4180 1 1 18 ARG HB2 H 1.886 11.904 -0.768 1.00 . A A . 18 ARG HB2 1 1 13 4181 1 1 18 ARG HB3 H 1.539 11.732 0.963 1.00 . A A . 18 ARG HB3 1 1 13 4182 1 1 18 ARG HD2 H 4.570 13.923 0.082 1.00 . A A . 18 ARG HD2 1 1 13 4183 1 1 18 ARG HD3 H 2.796 13.956 -0.040 1.00 . A A . 18 ARG HD3 1 1 13 4184 1 1 18 ARG HE H 3.430 13.337 2.616 1.00 . A A . 18 ARG HE 1 1 13 4185 1 1 18 ARG HG2 H 3.931 11.675 1.469 1.00 . A A . 18 ARG HG2 1 1 13 4186 1 1 18 ARG HG3 H 4.322 11.709 -0.259 1.00 . A A . 18 ARG HG3 1 1 13 4187 1 1 18 ARG HH11 H 4.033 15.969 0.429 1.00 . A A . 18 ARG HH11 1 1 13 4188 1 1 18 ARG HH12 H 4.025 17.213 1.641 1.00 . A A . 18 ARG HH12 1 1 13 4189 1 1 18 ARG HH21 H 3.422 14.974 4.256 1.00 . A A . 18 ARG HH21 1 1 13 4190 1 1 18 ARG HH22 H 3.679 16.627 3.804 1.00 . A A . 18 ARG HH22 1 1 13 4191 1 1 18 ARG N N 2.710 9.305 1.280 1.00 . A A . 18 ARG N 1 1 13 4192 1 1 18 ARG NE N 3.555 14.041 1.919 1.00 . A A . 18 ARG NE 1 1 13 4193 1 1 18 ARG NH1 N 3.933 16.257 1.382 1.00 . A A . 18 ARG NH1 1 1 13 4194 1 1 18 ARG NH2 N 3.584 15.666 3.555 1.00 . A A . 18 ARG NH2 1 1 13 4195 1 1 18 ARG O O 3.861 10.164 -1.828 1.00 . A A . 18 ARG O 1 1 13 4196 1 1 19 ALA C C 2.773 6.499 -3.271 1.00 . A A . 19 ALA C 1 1 13 4197 1 1 19 ALA CA C 3.674 7.479 -2.520 1.00 . A A . 19 ALA CA 1 1 13 4198 1 1 19 ALA CB C 4.930 6.794 -1.971 1.00 . A A . 19 ALA CB 1 1 13 4199 1 1 19 ALA H H 2.309 7.602 -0.901 1.00 . A A . 19 ALA H 1 1 13 4200 1 1 19 ALA HA H 3.997 8.240 -3.229 1.00 . A A . 19 ALA HA 1 1 13 4201 1 1 19 ALA HB1 H 5.543 7.525 -1.444 1.00 . A A . 19 ALA HB1 1 1 13 4202 1 1 19 ALA HB2 H 5.501 6.369 -2.796 1.00 . A A . 19 ALA HB2 1 1 13 4203 1 1 19 ALA HB3 H 4.640 5.999 -1.283 1.00 . A A . 19 ALA HB3 1 1 13 4204 1 1 19 ALA N N 2.939 8.157 -1.441 1.00 . A A . 19 ALA N 1 1 13 4205 1 1 19 ALA O O 2.572 6.645 -4.474 1.00 . A A . 19 ALA O 1 1 13 4206 1 1 20 PHE C C 1.814 3.941 -4.420 1.00 . A A . 20 PHE C 1 1 13 4207 1 1 20 PHE CA C 1.291 4.519 -3.089 1.00 . A A . 20 PHE CA 1 1 13 4208 1 1 20 PHE CB C -0.127 5.150 -3.153 1.00 . A A . 20 PHE CB 1 1 13 4209 1 1 20 PHE CD1 C -1.472 3.133 -3.910 1.00 . A A . 20 PHE CD1 1 1 13 4210 1 1 20 PHE CD2 C -1.486 5.110 -5.283 1.00 . A A . 20 PHE CD2 1 1 13 4211 1 1 20 PHE CE1 C -2.163 2.450 -4.905 1.00 . A A . 20 PHE CE1 1 1 13 4212 1 1 20 PHE CE2 C -2.176 4.417 -6.274 1.00 . A A . 20 PHE CE2 1 1 13 4213 1 1 20 PHE CG C -1.136 4.475 -4.087 1.00 . A A . 20 PHE CG 1 1 13 4214 1 1 20 PHE CZ C -2.518 3.090 -6.080 1.00 . A A . 20 PHE CZ 1 1 13 4215 1 1 20 PHE H H 2.512 5.371 -1.593 1.00 . A A . 20 PHE H 1 1 13 4216 1 1 20 PHE HA H 1.246 3.697 -2.375 1.00 . A A . 20 PHE HA 1 1 13 4217 1 1 20 PHE HB2 H -0.544 5.155 -2.146 1.00 . A A . 20 PHE HB2 1 1 13 4218 1 1 20 PHE HB3 H -0.014 6.184 -3.479 1.00 . A A . 20 PHE HB3 1 1 13 4219 1 1 20 PHE HD1 H -1.078 2.589 -3.056 1.00 . A A . 20 PHE HD1 1 1 13 4220 1 1 20 PHE HD2 H -1.042 6.075 -5.522 1.00 . A A . 20 PHE HD2 1 1 13 4221 1 1 20 PHE HE1 H -2.423 1.405 -4.751 1.00 . A A . 20 PHE HE1 1 1 13 4222 1 1 20 PHE HE2 H -2.405 4.911 -7.220 1.00 . A A . 20 PHE HE2 1 1 13 4223 1 1 20 PHE HZ H -3.113 2.562 -6.834 1.00 . A A . 20 PHE HZ 1 1 13 4224 1 1 20 PHE N N 2.226 5.524 -2.538 1.00 . A A . 20 PHE N 1 1 13 4225 1 1 20 PHE O O 2.950 3.402 -4.395 1.00 . A A . 20 PHE O 1 1 14 4226 1 1 1 HIS C C -6.314 -13.412 -5.279 1.00 . A A . 1 HIS C 1 1 14 4227 1 1 1 HIS CA C -7.700 -12.975 -5.809 1.00 . A A . 1 HIS CA 1 1 14 4228 1 1 1 HIS CB C -8.827 -13.751 -5.110 1.00 . A A . 1 HIS CB 1 1 14 4229 1 1 1 HIS CD2 C -8.467 -13.002 -2.673 1.00 . A A . 1 HIS CD2 1 1 14 4230 1 1 1 HIS CE1 C -10.421 -12.227 -2.211 1.00 . A A . 1 HIS CE1 1 1 14 4231 1 1 1 HIS CG C -9.234 -13.163 -3.750 1.00 . A A . 1 HIS CG 1 1 14 4232 1 1 1 HIS H1 H -7.010 -13.535 -7.765 1.00 . A A . 1 HIS H1 1 1 14 4233 1 1 1 HIS HA H -7.829 -11.916 -5.585 1.00 . A A . 1 HIS HA 1 1 14 4234 1 1 1 HIS HB2 H -9.700 -13.764 -5.761 1.00 . A A . 1 HIS HB2 1 1 14 4235 1 1 1 HIS HB3 H -8.492 -14.777 -4.954 1.00 . A A . 1 HIS HB3 1 1 14 4236 1 1 1 HIS HD1 H -11.239 -12.700 -4.064 1.00 . A A . 1 HIS HD1 1 1 14 4237 1 1 1 HIS HD2 H -7.433 -13.299 -2.582 1.00 . A A . 1 HIS HD2 1 1 14 4238 1 1 1 HIS HE1 H -11.250 -11.780 -1.685 1.00 . A A . 1 HIS HE1 1 1 14 4239 1 1 1 HIS HE2 H -8.874 -12.153 -0.807 1.00 . A A . 1 HIS HE2 1 1 14 4240 1 1 1 HIS N N -7.806 -13.150 -7.277 1.00 . A A . 1 HIS N 1 1 14 4241 1 1 1 HIS ND1 N -10.443 -12.689 -3.458 1.00 . A A . 1 HIS ND1 1 1 14 4242 1 1 1 HIS NE2 N -9.195 -12.413 -1.728 1.00 . A A . 1 HIS NE2 1 1 14 4243 1 1 1 HIS O O -6.021 -14.600 -5.152 1.00 . A A . 1 HIS O 1 1 14 4244 1 1 2 GLY C C -3.246 -11.299 -4.760 1.00 . A A . 2 GLY C 1 1 14 4245 1 1 2 GLY CA C -4.029 -12.617 -4.750 1.00 . A A . 2 GLY CA 1 1 14 4246 1 1 2 GLY H H -5.661 -11.461 -5.408 1.00 . A A . 2 GLY H 1 1 14 4247 1 1 2 GLY HA2 H -4.034 -13.019 -3.737 1.00 . A A . 2 GLY HA2 1 1 14 4248 1 1 2 GLY HA3 H -3.539 -13.328 -5.415 1.00 . A A . 2 GLY HA3 1 1 14 4249 1 1 2 GLY N N -5.425 -12.414 -5.197 1.00 . A A . 2 GLY N 1 1 14 4250 1 1 2 GLY O O -3.350 -10.498 -3.834 1.00 . A A . 2 GLY O 1 1 14 4251 1 1 3 LEU C C -2.830 -8.468 -6.027 1.00 . A A . 3 LEU C 1 1 14 4252 1 1 3 LEU CA C -1.938 -9.722 -6.132 1.00 . A A . 3 LEU CA 1 1 14 4253 1 1 3 LEU CB C -1.159 -9.703 -7.454 1.00 . A A . 3 LEU CB 1 1 14 4254 1 1 3 LEU CD1 C -1.398 -8.688 -9.724 1.00 . A A . 3 LEU CD1 1 1 14 4255 1 1 3 LEU CD2 C -2.277 -11.006 -9.305 1.00 . A A . 3 LEU CD2 1 1 14 4256 1 1 3 LEU CG C -2.047 -9.620 -8.700 1.00 . A A . 3 LEU CG 1 1 14 4257 1 1 3 LEU H H -2.606 -11.657 -6.665 1.00 . A A . 3 LEU H 1 1 14 4258 1 1 3 LEU HA H -1.201 -9.649 -5.333 1.00 . A A . 3 LEU HA 1 1 14 4259 1 1 3 LEU HB2 H -0.495 -8.839 -7.448 1.00 . A A . 3 LEU HB2 1 1 14 4260 1 1 3 LEU HB3 H -0.555 -10.608 -7.516 1.00 . A A . 3 LEU HB3 1 1 14 4261 1 1 3 LEU HD11 H -2.029 -8.626 -10.611 1.00 . A A . 3 LEU HD11 1 1 14 4262 1 1 3 LEU HD12 H -0.419 -9.078 -10.001 1.00 . A A . 3 LEU HD12 1 1 14 4263 1 1 3 LEU HD13 H -1.284 -7.694 -9.290 1.00 . A A . 3 LEU HD13 1 1 14 4264 1 1 3 LEU HD21 H -2.932 -10.920 -10.171 1.00 . A A . 3 LEU HD21 1 1 14 4265 1 1 3 LEU HD22 H -2.739 -11.656 -8.562 1.00 . A A . 3 LEU HD22 1 1 14 4266 1 1 3 LEU HD23 H -1.321 -11.430 -9.614 1.00 . A A . 3 LEU HD23 1 1 14 4267 1 1 3 LEU HG H -3.012 -9.202 -8.411 1.00 . A A . 3 LEU HG 1 1 14 4268 1 1 3 LEU N N -2.668 -10.994 -5.921 1.00 . A A . 3 LEU N 1 1 14 4269 1 1 3 LEU O O -2.431 -7.465 -5.447 1.00 . A A . 3 LEU O 1 1 14 4270 1 1 4 ALA C C -5.271 -7.102 -4.824 1.00 . A A . 4 ALA C 1 1 14 4271 1 1 4 ALA CA C -5.105 -7.536 -6.296 1.00 . A A . 4 ALA CA 1 1 14 4272 1 1 4 ALA CB C -6.436 -8.032 -6.865 1.00 . A A . 4 ALA CB 1 1 14 4273 1 1 4 ALA H H -4.310 -9.275 -7.166 1.00 . A A . 4 ALA H 1 1 14 4274 1 1 4 ALA HA H -4.803 -6.660 -6.870 1.00 . A A . 4 ALA HA 1 1 14 4275 1 1 4 ALA HB1 H -6.299 -8.333 -7.903 1.00 . A A . 4 ALA HB1 1 1 14 4276 1 1 4 ALA HB2 H -6.785 -8.885 -6.282 1.00 . A A . 4 ALA HB2 1 1 14 4277 1 1 4 ALA HB3 H -7.174 -7.231 -6.814 1.00 . A A . 4 ALA HB3 1 1 14 4278 1 1 4 ALA N N -4.076 -8.582 -6.489 1.00 . A A . 4 ALA N 1 1 14 4279 1 1 4 ALA O O -5.454 -5.921 -4.549 1.00 . A A . 4 ALA O 1 1 14 4280 1 1 5 SER C C -3.574 -7.421 -1.901 1.00 . A A . 5 SER C 1 1 14 4281 1 1 5 SER CA C -4.958 -7.817 -2.455 1.00 . A A . 5 SER CA 1 1 14 4282 1 1 5 SER CB C -5.441 -9.088 -1.754 1.00 . A A . 5 SER CB 1 1 14 4283 1 1 5 SER H H -4.597 -8.918 -4.195 1.00 . A A . 5 SER H 1 1 14 4284 1 1 5 SER HA H -5.659 -7.014 -2.228 1.00 . A A . 5 SER HA 1 1 14 4285 1 1 5 SER HB2 H -5.848 -9.780 -2.492 1.00 . A A . 5 SER HB2 1 1 14 4286 1 1 5 SER HB3 H -4.606 -9.558 -1.234 1.00 . A A . 5 SER HB3 1 1 14 4287 1 1 5 SER HG H -6.763 -9.559 -0.325 1.00 . A A . 5 SER HG 1 1 14 4288 1 1 5 SER N N -4.952 -8.028 -3.917 1.00 . A A . 5 SER N 1 1 14 4289 1 1 5 SER O O -3.485 -6.675 -0.929 1.00 . A A . 5 SER O 1 1 14 4290 1 1 5 SER OG O -6.455 -8.738 -0.814 1.00 . A A . 5 SER OG 1 1 14 4291 1 1 6 THR C C -0.932 -5.865 -2.307 1.00 . A A . 6 THR C 1 1 14 4292 1 1 6 THR CA C -1.107 -7.400 -2.272 1.00 . A A . 6 THR CA 1 1 14 4293 1 1 6 THR CB C -0.063 -8.147 -3.137 1.00 . A A . 6 THR CB 1 1 14 4294 1 1 6 THR CG2 C 0.385 -7.477 -4.445 1.00 . A A . 6 THR CG2 1 1 14 4295 1 1 6 THR H H -2.589 -8.381 -3.412 1.00 . A A . 6 THR H 1 1 14 4296 1 1 6 THR HA H -0.931 -7.707 -1.241 1.00 . A A . 6 THR HA 1 1 14 4297 1 1 6 THR HB H -0.468 -9.129 -3.382 1.00 . A A . 6 THR HB 1 1 14 4298 1 1 6 THR HG1 H 1.847 -8.682 -2.918 1.00 . A A . 6 THR HG1 1 1 14 4299 1 1 6 THR HG21 H 0.132 -8.121 -5.289 1.00 . A A . 6 THR HG21 1 1 14 4300 1 1 6 THR HG22 H 1.463 -7.317 -4.422 1.00 . A A . 6 THR HG22 1 1 14 4301 1 1 6 THR HG23 H -0.122 -6.518 -4.554 1.00 . A A . 6 THR HG23 1 1 14 4302 1 1 6 THR N N -2.499 -7.807 -2.600 1.00 . A A . 6 THR N 1 1 14 4303 1 1 6 THR O O -0.214 -5.275 -1.500 1.00 . A A . 6 THR O 1 1 14 4304 1 1 6 THR OG1 O 1.103 -8.338 -2.341 1.00 . A A . 6 THR OG1 1 1 14 4305 1 1 7 LEU C C -2.900 -3.130 -2.377 1.00 . A A . 7 LEU C 1 1 14 4306 1 1 7 LEU CA C -1.845 -3.775 -3.292 1.00 . A A . 7 LEU CA 1 1 14 4307 1 1 7 LEU CB C -2.136 -3.439 -4.756 1.00 . A A . 7 LEU CB 1 1 14 4308 1 1 7 LEU CD1 C -1.212 -3.884 -7.038 1.00 . A A . 7 LEU CD1 1 1 14 4309 1 1 7 LEU CD2 C -0.194 -2.102 -5.610 1.00 . A A . 7 LEU CD2 1 1 14 4310 1 1 7 LEU CG C -0.864 -3.480 -5.606 1.00 . A A . 7 LEU CG 1 1 14 4311 1 1 7 LEU H H -2.360 -5.750 -3.763 1.00 . A A . 7 LEU H 1 1 14 4312 1 1 7 LEU HA H -0.874 -3.348 -3.037 1.00 . A A . 7 LEU HA 1 1 14 4313 1 1 7 LEU HB2 H -2.848 -4.164 -5.150 1.00 . A A . 7 LEU HB2 1 1 14 4314 1 1 7 LEU HB3 H -2.573 -2.442 -4.814 1.00 . A A . 7 LEU HB3 1 1 14 4315 1 1 7 LEU HD11 H -1.688 -4.864 -7.033 1.00 . A A . 7 LEU HD11 1 1 14 4316 1 1 7 LEU HD12 H -0.301 -3.926 -7.635 1.00 . A A . 7 LEU HD12 1 1 14 4317 1 1 7 LEU HD13 H -1.894 -3.150 -7.467 1.00 . A A . 7 LEU HD13 1 1 14 4318 1 1 7 LEU HD21 H 0.717 -2.143 -6.207 1.00 . A A . 7 LEU HD21 1 1 14 4319 1 1 7 LEU HD22 H 0.054 -1.815 -4.588 1.00 . A A . 7 LEU HD22 1 1 14 4320 1 1 7 LEU HD23 H -0.876 -1.367 -6.038 1.00 . A A . 7 LEU HD23 1 1 14 4321 1 1 7 LEU HG H -0.175 -4.212 -5.184 1.00 . A A . 7 LEU HG 1 1 14 4322 1 1 7 LEU N N -1.744 -5.240 -3.161 1.00 . A A . 7 LEU N 1 1 14 4323 1 1 7 LEU O O -3.042 -1.914 -2.385 1.00 . A A . 7 LEU O 1 1 14 4324 1 1 8 THR C C -3.792 -3.437 0.942 1.00 . A A . 8 THR C 1 1 14 4325 1 1 8 THR CA C -4.449 -3.479 -0.456 1.00 . A A . 8 THR CA 1 1 14 4326 1 1 8 THR CB C -5.675 -4.416 -0.515 1.00 . A A . 8 THR CB 1 1 14 4327 1 1 8 THR CG2 C -6.811 -4.041 0.444 1.00 . A A . 8 THR CG2 1 1 14 4328 1 1 8 THR H H -3.394 -4.922 -1.538 1.00 . A A . 8 THR H 1 1 14 4329 1 1 8 THR HA H -4.777 -2.471 -0.711 1.00 . A A . 8 THR HA 1 1 14 4330 1 1 8 THR HB H -5.345 -5.427 -0.277 1.00 . A A . 8 THR HB 1 1 14 4331 1 1 8 THR HG1 H -7.048 -4.899 -1.899 1.00 . A A . 8 THR HG1 1 1 14 4332 1 1 8 THR HG21 H -7.168 -3.039 0.210 1.00 . A A . 8 THR HG21 1 1 14 4333 1 1 8 THR HG22 H -7.629 -4.754 0.334 1.00 . A A . 8 THR HG22 1 1 14 4334 1 1 8 THR HG23 H -6.443 -4.066 1.469 1.00 . A A . 8 THR HG23 1 1 14 4335 1 1 8 THR N N -3.474 -3.924 -1.479 1.00 . A A . 8 THR N 1 1 14 4336 1 1 8 THR O O -4.298 -2.811 1.870 1.00 . A A . 8 THR O 1 1 14 4337 1 1 8 THR OG1 O -6.177 -4.410 -1.856 1.00 . A A . 8 THR OG1 1 1 14 4338 1 1 9 ARG C C -0.601 -3.123 2.234 1.00 . A A . 9 ARG C 1 1 14 4339 1 1 9 ARG CA C -1.797 -4.083 2.279 1.00 . A A . 9 ARG CA 1 1 14 4340 1 1 9 ARG CB C -1.306 -5.514 2.488 1.00 . A A . 9 ARG CB 1 1 14 4341 1 1 9 ARG CD C -2.494 -6.722 4.334 1.00 . A A . 9 ARG CD 1 1 14 4342 1 1 9 ARG CG C -2.465 -6.448 2.829 1.00 . A A . 9 ARG CG 1 1 14 4343 1 1 9 ARG CZ C -1.739 -9.121 4.221 1.00 . A A . 9 ARG CZ 1 1 14 4344 1 1 9 ARG H H -2.282 -4.630 0.308 1.00 . A A . 9 ARG H 1 1 14 4345 1 1 9 ARG HA H -2.432 -3.808 3.121 1.00 . A A . 9 ARG HA 1 1 14 4346 1 1 9 ARG HB2 H -0.825 -5.862 1.575 1.00 . A A . 9 ARG HB2 1 1 14 4347 1 1 9 ARG HB3 H -0.582 -5.530 3.303 1.00 . A A . 9 ARG HB3 1 1 14 4348 1 1 9 ARG HD2 H -1.567 -6.372 4.788 1.00 . A A . 9 ARG HD2 1 1 14 4349 1 1 9 ARG HD3 H -3.341 -6.205 4.785 1.00 . A A . 9 ARG HD3 1 1 14 4350 1 1 9 ARG HE H -3.490 -8.459 4.961 1.00 . A A . 9 ARG HE 1 1 14 4351 1 1 9 ARG HG2 H -3.404 -5.981 2.530 1.00 . A A . 9 ARG HG2 1 1 14 4352 1 1 9 ARG HG3 H -2.341 -7.388 2.293 1.00 . A A . 9 ARG HG3 1 1 14 4353 1 1 9 ARG HH11 H -0.324 -7.881 3.517 1.00 . A A . 9 ARG HH11 1 1 14 4354 1 1 9 ARG HH12 H 0.086 -9.564 3.454 1.00 . A A . 9 ARG HH12 1 1 14 4355 1 1 9 ARG HH21 H -2.906 -10.649 4.837 1.00 . A A . 9 ARG HH21 1 1 14 4356 1 1 9 ARG HH22 H -1.364 -11.093 4.186 1.00 . A A . 9 ARG HH22 1 1 14 4357 1 1 9 ARG N N -2.608 -4.041 1.045 1.00 . A A . 9 ARG N 1 1 14 4358 1 1 9 ARG NE N -2.629 -8.174 4.544 1.00 . A A . 9 ARG NE 1 1 14 4359 1 1 9 ARG NH1 N -0.555 -8.838 3.690 1.00 . A A . 9 ARG NH1 1 1 14 4360 1 1 9 ARG NH2 N -2.029 -10.394 4.434 1.00 . A A . 9 ARG NH2 1 1 14 4361 1 1 9 ARG O O -0.492 -2.227 3.067 1.00 . A A . 9 ARG O 1 1 14 4362 1 1 10 TRP C C 0.822 -0.823 0.770 1.00 . A A . 10 TRP C 1 1 14 4363 1 1 10 TRP CA C 1.320 -2.275 0.951 1.00 . A A . 10 TRP CA 1 1 14 4364 1 1 10 TRP CB C 2.193 -2.815 -0.192 1.00 . A A . 10 TRP CB 1 1 14 4365 1 1 10 TRP CD1 C 1.981 -1.648 -2.431 1.00 . A A . 10 TRP CD1 1 1 14 4366 1 1 10 TRP CD2 C 3.512 -0.766 -1.131 1.00 . A A . 10 TRP CD2 1 1 14 4367 1 1 10 TRP CE2 C 3.430 -0.036 -2.306 1.00 . A A . 10 TRP CE2 1 1 14 4368 1 1 10 TRP CE3 C 4.390 -0.390 -0.121 1.00 . A A . 10 TRP CE3 1 1 14 4369 1 1 10 TRP CG C 2.575 -1.782 -1.252 1.00 . A A . 10 TRP CG 1 1 14 4370 1 1 10 TRP CH2 C 5.125 1.451 -1.479 1.00 . A A . 10 TRP CH2 1 1 14 4371 1 1 10 TRP CZ2 C 4.252 1.069 -2.489 1.00 . A A . 10 TRP CZ2 1 1 14 4372 1 1 10 TRP CZ3 C 5.182 0.738 -0.289 1.00 . A A . 10 TRP CZ3 1 1 14 4373 1 1 10 TRP H H 0.164 -3.985 0.530 1.00 . A A . 10 TRP H 1 1 14 4374 1 1 10 TRP HA H 1.938 -2.284 1.849 1.00 . A A . 10 TRP HA 1 1 14 4375 1 1 10 TRP HB2 H 3.112 -3.212 0.242 1.00 . A A . 10 TRP HB2 1 1 14 4376 1 1 10 TRP HB3 H 1.660 -3.632 -0.679 1.00 . A A . 10 TRP HB3 1 1 14 4377 1 1 10 TRP HD1 H 1.184 -2.291 -2.808 1.00 . A A . 10 TRP HD1 1 1 14 4378 1 1 10 TRP HE1 H 2.237 -0.300 -3.988 1.00 . A A . 10 TRP HE1 1 1 14 4379 1 1 10 TRP HE3 H 4.544 -1.036 0.744 1.00 . A A . 10 TRP HE3 1 1 14 4380 1 1 10 TRP HH2 H 5.834 2.257 -1.658 1.00 . A A . 10 TRP HH2 1 1 14 4381 1 1 10 TRP HZ2 H 4.294 1.562 -3.459 1.00 . A A . 10 TRP HZ2 1 1 14 4382 1 1 10 TRP HZ3 H 5.817 1.090 0.527 1.00 . A A . 10 TRP HZ3 1 1 14 4383 1 1 10 TRP N N 0.216 -3.229 1.186 1.00 . A A . 10 TRP N 1 1 14 4384 1 1 10 TRP NE1 N 2.495 -0.598 -3.069 1.00 . A A . 10 TRP NE1 1 1 14 4385 1 1 10 TRP O O 1.445 0.121 1.259 1.00 . A A . 10 TRP O 1 1 14 4386 1 1 11 ALA C C -1.577 1.187 1.493 1.00 . A A . 11 ALA C 1 1 14 4387 1 1 11 ALA CA C -1.117 0.595 0.145 1.00 . A A . 11 ALA CA 1 1 14 4388 1 1 11 ALA CB C -2.325 0.459 -0.778 1.00 . A A . 11 ALA CB 1 1 14 4389 1 1 11 ALA H H -0.933 -1.492 -0.037 1.00 . A A . 11 ALA H 1 1 14 4390 1 1 11 ALA HA H -0.433 1.310 -0.312 1.00 . A A . 11 ALA HA 1 1 14 4391 1 1 11 ALA HB1 H -2.903 1.383 -0.761 1.00 . A A . 11 ALA HB1 1 1 14 4392 1 1 11 ALA HB2 H -1.985 0.262 -1.795 1.00 . A A . 11 ALA HB2 1 1 14 4393 1 1 11 ALA HB3 H -2.951 -0.366 -0.438 1.00 . A A . 11 ALA HB3 1 1 14 4394 1 1 11 ALA N N -0.405 -0.696 0.256 1.00 . A A . 11 ALA N 1 1 14 4395 1 1 11 ALA O O -2.058 2.314 1.547 1.00 . A A . 11 ALA O 1 1 14 4396 1 1 12 HIS C C -0.265 1.219 4.720 1.00 . A A . 12 HIS C 1 1 14 4397 1 1 12 HIS CA C -1.564 0.894 3.958 1.00 . A A . 12 HIS CA 1 1 14 4398 1 1 12 HIS CB C -2.343 -0.218 4.666 1.00 . A A . 12 HIS CB 1 1 14 4399 1 1 12 HIS CD2 C -4.764 0.247 3.946 1.00 . A A . 12 HIS CD2 1 1 14 4400 1 1 12 HIS CE1 C -5.646 0.692 5.860 1.00 . A A . 12 HIS CE1 1 1 14 4401 1 1 12 HIS CG C -3.816 0.139 4.874 1.00 . A A . 12 HIS CG 1 1 14 4402 1 1 12 HIS H H -0.938 -0.472 2.504 1.00 . A A . 12 HIS H 1 1 14 4403 1 1 12 HIS HA H -2.184 1.790 3.933 1.00 . A A . 12 HIS HA 1 1 14 4404 1 1 12 HIS HB2 H -2.280 -1.129 4.071 1.00 . A A . 12 HIS HB2 1 1 14 4405 1 1 12 HIS HB3 H -1.887 -0.398 5.640 1.00 . A A . 12 HIS HB3 1 1 14 4406 1 1 12 HIS HD1 H -3.891 0.377 6.936 1.00 . A A . 12 HIS HD1 1 1 14 4407 1 1 12 HIS HD2 H -4.639 0.085 2.886 1.00 . A A . 12 HIS HD2 1 1 14 4408 1 1 12 HIS HE1 H -6.362 0.955 6.624 1.00 . A A . 12 HIS HE1 1 1 14 4409 1 1 12 HIS HE2 H -6.789 0.747 4.111 1.00 . A A . 12 HIS HE2 1 1 14 4410 1 1 12 HIS N N -1.315 0.455 2.572 1.00 . A A . 12 HIS N 1 1 14 4411 1 1 12 HIS ND1 N -4.362 0.412 6.054 1.00 . A A . 12 HIS ND1 1 1 14 4412 1 1 12 HIS NE2 N -5.896 0.591 4.558 1.00 . A A . 12 HIS NE2 1 1 14 4413 1 1 12 HIS O O -0.304 1.641 5.874 1.00 . A A . 12 HIS O 1 1 14 4414 1 1 13 TYR C C 2.657 2.834 4.084 1.00 . A A . 13 TYR C 1 1 14 4415 1 1 13 TYR CA C 2.203 1.435 4.531 1.00 . A A . 13 TYR CA 1 1 14 4416 1 1 13 TYR CB C 3.142 0.346 4.000 1.00 . A A . 13 TYR CB 1 1 14 4417 1 1 13 TYR CD1 C 3.925 -0.858 6.036 1.00 . A A . 13 TYR CD1 1 1 14 4418 1 1 13 TYR CD2 C 5.519 0.529 4.878 1.00 . A A . 13 TYR CD2 1 1 14 4419 1 1 13 TYR CE1 C 4.906 -1.250 6.932 1.00 . A A . 13 TYR CE1 1 1 14 4420 1 1 13 TYR CE2 C 6.506 0.140 5.775 1.00 . A A . 13 TYR CE2 1 1 14 4421 1 1 13 TYR CG C 4.233 0.026 5.015 1.00 . A A . 13 TYR CG 1 1 14 4422 1 1 13 TYR CZ C 6.192 -0.742 6.806 1.00 . A A . 13 TYR CZ 1 1 14 4423 1 1 13 TYR H H 0.849 0.752 3.082 1.00 . A A . 13 TYR H 1 1 14 4424 1 1 13 TYR HA H 2.180 1.393 5.620 1.00 . A A . 13 TYR HA 1 1 14 4425 1 1 13 TYR HB2 H 2.566 -0.556 3.795 1.00 . A A . 13 TYR HB2 1 1 14 4426 1 1 13 TYR HB3 H 3.605 0.694 3.077 1.00 . A A . 13 TYR HB3 1 1 14 4427 1 1 13 TYR HD1 H 2.905 -1.226 6.147 1.00 . A A . 13 TYR HD1 1 1 14 4428 1 1 13 TYR HD2 H 5.762 1.215 4.066 1.00 . A A . 13 TYR HD2 1 1 14 4429 1 1 13 TYR HE1 H 4.676 -2.002 7.687 1.00 . A A . 13 TYR HE1 1 1 14 4430 1 1 13 TYR HE2 H 7.532 0.468 5.611 1.00 . A A . 13 TYR HE2 1 1 14 4431 1 1 13 TYR HH H 7.979 -0.602 7.516 1.00 . A A . 13 TYR HH 1 1 14 4432 1 1 13 TYR N N 0.857 1.148 4.003 1.00 . A A . 13 TYR N 1 1 14 4433 1 1 13 TYR O O 2.611 3.796 4.853 1.00 . A A . 13 TYR O 1 1 14 4434 1 1 13 TYR OH O 7.131 -1.085 7.722 1.00 . A A . 13 TYR OH 1 1 14 4435 1 1 14 ASN C C 2.022 5.295 2.181 1.00 . A A . 14 ASN C 1 1 14 4436 1 1 14 ASN CA C 3.148 4.251 2.113 1.00 . A A . 14 ASN CA 1 1 14 4437 1 1 14 ASN CB C 3.572 3.988 0.669 1.00 . A A . 14 ASN CB 1 1 14 4438 1 1 14 ASN CG C 5.051 4.312 0.434 1.00 . A A . 14 ASN CG 1 1 14 4439 1 1 14 ASN H H 2.707 2.195 2.143 1.00 . A A . 14 ASN H 1 1 14 4440 1 1 14 ASN HA H 4.010 4.670 2.631 1.00 . A A . 14 ASN HA 1 1 14 4441 1 1 14 ASN HB2 H 3.396 2.939 0.433 1.00 . A A . 14 ASN HB2 1 1 14 4442 1 1 14 ASN HB3 H 2.967 4.608 0.007 1.00 . A A . 14 ASN HB3 1 1 14 4443 1 1 14 ASN HD21 H 4.708 4.474 -1.533 1.00 . A A . 14 ASN HD21 1 1 14 4444 1 1 14 ASN HD22 H 6.353 4.715 -0.999 1.00 . A A . 14 ASN HD22 1 1 14 4445 1 1 14 ASN N N 2.822 2.969 2.768 1.00 . A A . 14 ASN N 1 1 14 4446 1 1 14 ASN ND2 N 5.401 4.495 -0.817 1.00 . A A . 14 ASN ND2 1 1 14 4447 1 1 14 ASN O O 2.286 6.484 2.032 1.00 . A A . 14 ASN O 1 1 14 4448 1 1 14 ASN OD1 O 5.883 4.412 1.324 1.00 . A A . 14 ASN OD1 1 1 14 4449 1 1 15 ALA C C -0.022 6.815 3.910 1.00 . A A . 15 ALA C 1 1 14 4450 1 1 15 ALA CA C -0.333 5.695 2.901 1.00 . A A . 15 ALA CA 1 1 14 4451 1 1 15 ALA CB C -1.463 4.816 3.443 1.00 . A A . 15 ALA CB 1 1 14 4452 1 1 15 ALA H H 0.731 3.892 2.895 1.00 . A A . 15 ALA H 1 1 14 4453 1 1 15 ALA HA H -0.660 6.147 1.964 1.00 . A A . 15 ALA HA 1 1 14 4454 1 1 15 ALA HB1 H -1.834 5.237 4.379 1.00 . A A . 15 ALA HB1 1 1 14 4455 1 1 15 ALA HB2 H -1.086 3.809 3.622 1.00 . A A . 15 ALA HB2 1 1 14 4456 1 1 15 ALA HB3 H -2.275 4.777 2.716 1.00 . A A . 15 ALA HB3 1 1 14 4457 1 1 15 ALA N N 0.848 4.848 2.632 1.00 . A A . 15 ALA N 1 1 14 4458 1 1 15 ALA O O -0.476 7.945 3.749 1.00 . A A . 15 ALA O 1 1 14 4459 1 1 16 LEU C C 2.750 8.104 5.432 1.00 . A A . 16 LEU C 1 1 14 4460 1 1 16 LEU CA C 1.394 7.491 5.819 1.00 . A A . 16 LEU CA 1 1 14 4461 1 1 16 LEU CB C 1.459 6.841 7.208 1.00 . A A . 16 LEU CB 1 1 14 4462 1 1 16 LEU CD1 C 1.039 8.967 8.553 1.00 . A A . 16 LEU CD1 1 1 14 4463 1 1 16 LEU CD2 C -0.904 7.474 7.920 1.00 . A A . 16 LEU CD2 1 1 14 4464 1 1 16 LEU CG C 0.587 7.528 8.274 1.00 . A A . 16 LEU CG 1 1 14 4465 1 1 16 LEU H H 1.284 5.596 4.900 1.00 . A A . 16 LEU H 1 1 14 4466 1 1 16 LEU HA H 0.670 8.305 5.873 1.00 . A A . 16 LEU HA 1 1 14 4467 1 1 16 LEU HB2 H 1.131 5.805 7.114 1.00 . A A . 16 LEU HB2 1 1 14 4468 1 1 16 LEU HB3 H 2.495 6.849 7.548 1.00 . A A . 16 LEU HB3 1 1 14 4469 1 1 16 LEU HD11 H 2.101 8.973 8.801 1.00 . A A . 16 LEU HD11 1 1 14 4470 1 1 16 LEU HD12 H 0.870 9.578 7.667 1.00 . A A . 16 LEU HD12 1 1 14 4471 1 1 16 LEU HD13 H 0.468 9.372 9.389 1.00 . A A . 16 LEU HD13 1 1 14 4472 1 1 16 LEU HD21 H -1.489 7.868 8.751 1.00 . A A . 16 LEU HD21 1 1 14 4473 1 1 16 LEU HD22 H -1.195 6.442 7.728 1.00 . A A . 16 LEU HD22 1 1 14 4474 1 1 16 LEU HD23 H -1.087 8.075 7.029 1.00 . A A . 16 LEU HD23 1 1 14 4475 1 1 16 LEU HG H 0.716 6.968 9.200 1.00 . A A . 16 LEU HG 1 1 14 4476 1 1 16 LEU N N 0.890 6.514 4.835 1.00 . A A . 16 LEU N 1 1 14 4477 1 1 16 LEU O O 3.062 9.231 5.811 1.00 . A A . 16 LEU O 1 1 14 4478 1 1 17 ILE C C 4.571 8.792 2.831 1.00 . A A . 17 ILE C 1 1 14 4479 1 1 17 ILE CA C 4.792 7.844 4.040 1.00 . A A . 17 ILE CA 1 1 14 4480 1 1 17 ILE CB C 5.659 6.608 3.674 1.00 . A A . 17 ILE CB 1 1 14 4481 1 1 17 ILE CD1 C 6.075 5.894 6.168 1.00 . A A . 17 ILE CD1 1 1 14 4482 1 1 17 ILE CG1 C 5.657 5.492 4.743 1.00 . A A . 17 ILE CG1 1 1 14 4483 1 1 17 ILE CG2 C 7.111 6.972 3.321 1.00 . A A . 17 ILE CG2 1 1 14 4484 1 1 17 ILE H H 3.207 6.485 4.276 1.00 . A A . 17 ILE H 1 1 14 4485 1 1 17 ILE HA H 5.313 8.403 4.817 1.00 . A A . 17 ILE HA 1 1 14 4486 1 1 17 ILE HB H 5.220 6.176 2.775 1.00 . A A . 17 ILE HB 1 1 14 4487 1 1 17 ILE HD11 H 5.398 6.661 6.543 1.00 . A A . 17 ILE HD11 1 1 14 4488 1 1 17 ILE HD12 H 6.031 5.021 6.819 1.00 . A A . 17 ILE HD12 1 1 14 4489 1 1 17 ILE HD13 H 7.093 6.284 6.151 1.00 . A A . 17 ILE HD13 1 1 14 4490 1 1 17 ILE HG12 H 4.654 5.068 4.789 1.00 . A A . 17 ILE HG12 1 1 14 4491 1 1 17 ILE HG13 H 6.342 4.713 4.407 1.00 . A A . 17 ILE HG13 1 1 14 4492 1 1 17 ILE HG21 H 7.116 7.759 2.568 1.00 . A A . 17 ILE HG21 1 1 14 4493 1 1 17 ILE HG22 H 7.626 7.323 4.216 1.00 . A A . 17 ILE HG22 1 1 14 4494 1 1 17 ILE HG23 H 7.622 6.092 2.931 1.00 . A A . 17 ILE HG23 1 1 14 4495 1 1 17 ILE N N 3.498 7.384 4.597 1.00 . A A . 17 ILE N 1 1 14 4496 1 1 17 ILE O O 5.527 9.186 2.159 1.00 . A A . 17 ILE O 1 1 14 4497 1 1 18 ARG C C 2.952 9.383 0.088 1.00 . A A . 18 ARG C 1 1 14 4498 1 1 18 ARG CA C 2.855 10.051 1.466 1.00 . A A . 18 ARG CA 1 1 14 4499 1 1 18 ARG CB C 3.609 11.386 1.445 1.00 . A A . 18 ARG CB 1 1 14 4500 1 1 18 ARG CD C 3.469 13.673 2.466 1.00 . A A . 18 ARG CD 1 1 14 4501 1 1 18 ARG CG C 2.689 12.566 1.754 1.00 . A A . 18 ARG CG 1 1 14 4502 1 1 18 ARG CZ C 4.345 13.968 4.799 1.00 . A A . 18 ARG CZ 1 1 14 4503 1 1 18 ARG H H 2.554 8.749 3.064 1.00 . A A . 18 ARG H 1 1 14 4504 1 1 18 ARG HA H 1.804 10.275 1.644 1.00 . A A . 18 ARG HA 1 1 14 4505 1 1 18 ARG HB2 H 4.402 11.354 2.192 1.00 . A A . 18 ARG HB2 1 1 14 4506 1 1 18 ARG HB3 H 4.053 11.530 0.460 1.00 . A A . 18 ARG HB3 1 1 14 4507 1 1 18 ARG HD2 H 4.400 13.865 1.933 1.00 . A A . 18 ARG HD2 1 1 14 4508 1 1 18 ARG HD3 H 2.868 14.582 2.492 1.00 . A A . 18 ARG HD3 1 1 14 4509 1 1 18 ARG HE H 3.506 12.300 4.063 1.00 . A A . 18 ARG HE 1 1 14 4510 1 1 18 ARG HG2 H 2.278 12.956 0.822 1.00 . A A . 18 ARG HG2 1 1 14 4511 1 1 18 ARG HG3 H 1.875 12.229 2.395 1.00 . A A . 18 ARG HG3 1 1 14 4512 1 1 18 ARG HH11 H 4.658 15.587 3.659 1.00 . A A . 18 ARG HH11 1 1 14 4513 1 1 18 ARG HH12 H 5.195 15.735 5.303 1.00 . A A . 18 ARG HH12 1 1 14 4514 1 1 18 ARG HH21 H 4.206 12.525 6.210 1.00 . A A . 18 ARG HH21 1 1 14 4515 1 1 18 ARG HH22 H 4.937 14.007 6.722 1.00 . A A . 18 ARG HH22 1 1 14 4516 1 1 18 ARG N N 3.313 9.176 2.572 1.00 . A A . 18 ARG N 1 1 14 4517 1 1 18 ARG NE N 3.767 13.238 3.843 1.00 . A A . 18 ARG NE 1 1 14 4518 1 1 18 ARG NH1 N 4.771 15.203 4.575 1.00 . A A . 18 ARG NH1 1 1 14 4519 1 1 18 ARG NH2 N 4.513 13.455 6.009 1.00 . A A . 18 ARG NH2 1 1 14 4520 1 1 18 ARG O O 1.956 9.277 -0.621 1.00 . A A . 18 ARG O 1 1 14 4521 1 1 19 ALA C C 4.294 9.192 -2.682 1.00 . A A . 19 ALA C 1 1 14 4522 1 1 19 ALA CA C 4.526 8.241 -1.496 1.00 . A A . 19 ALA CA 1 1 14 4523 1 1 19 ALA CB C 3.752 6.929 -1.679 1.00 . A A . 19 ALA CB 1 1 14 4524 1 1 19 ALA H H 4.877 8.925 0.477 1.00 . A A . 19 ALA H 1 1 14 4525 1 1 19 ALA HA H 5.589 8.004 -1.457 1.00 . A A . 19 ALA HA 1 1 14 4526 1 1 19 ALA HB1 H 2.763 7.143 -2.084 1.00 . A A . 19 ALA HB1 1 1 14 4527 1 1 19 ALA HB2 H 4.294 6.280 -2.369 1.00 . A A . 19 ALA HB2 1 1 14 4528 1 1 19 ALA HB3 H 3.650 6.430 -0.715 1.00 . A A . 19 ALA HB3 1 1 14 4529 1 1 19 ALA N N 4.151 8.883 -0.217 1.00 . A A . 19 ALA N 1 1 14 4530 1 1 19 ALA O O 3.481 8.966 -3.580 1.00 . A A . 19 ALA O 1 1 14 4531 1 1 20 PHE C C 6.169 12.205 -3.864 1.00 . A A . 20 PHE C 1 1 14 4532 1 1 20 PHE CA C 4.910 11.346 -3.670 1.00 . A A . 20 PHE CA 1 1 14 4533 1 1 20 PHE CB C 3.699 12.192 -3.243 1.00 . A A . 20 PHE CB 1 1 14 4534 1 1 20 PHE CD1 C 2.455 11.996 -5.422 1.00 . A A . 20 PHE CD1 1 1 14 4535 1 1 20 PHE CD2 C 2.902 14.200 -4.556 1.00 . A A . 20 PHE CD2 1 1 14 4536 1 1 20 PHE CE1 C 1.782 12.551 -6.501 1.00 . A A . 20 PHE CE1 1 1 14 4537 1 1 20 PHE CE2 C 2.228 14.757 -5.636 1.00 . A A . 20 PHE CE2 1 1 14 4538 1 1 20 PHE CG C 3.012 12.821 -4.454 1.00 . A A . 20 PHE CG 1 1 14 4539 1 1 20 PHE CZ C 1.668 13.934 -6.608 1.00 . A A . 20 PHE CZ 1 1 14 4540 1 1 20 PHE H H 5.789 10.400 -1.986 1.00 . A A . 20 PHE H 1 1 14 4541 1 1 20 PHE HA H 4.672 10.884 -4.629 1.00 . A A . 20 PHE HA 1 1 14 4542 1 1 20 PHE HB2 H 2.986 11.553 -2.722 1.00 . A A . 20 PHE HB2 1 1 14 4543 1 1 20 PHE HB3 H 4.032 12.981 -2.570 1.00 . A A . 20 PHE HB3 1 1 14 4544 1 1 20 PHE HD1 H 2.545 10.911 -5.332 1.00 . A A . 20 PHE HD1 1 1 14 4545 1 1 20 PHE HD2 H 3.329 14.843 -3.785 1.00 . A A . 20 PHE HD2 1 1 14 4546 1 1 20 PHE HE1 H 1.336 11.904 -7.254 1.00 . A A . 20 PHE HE1 1 1 14 4547 1 1 20 PHE HE2 H 2.127 15.839 -5.715 1.00 . A A . 20 PHE HE2 1 1 14 4548 1 1 20 PHE HZ H 1.140 14.370 -7.454 1.00 . A A . 20 PHE HZ 1 1 14 4549 1 1 20 PHE N N 5.083 10.265 -2.678 1.00 . A A . 20 PHE N 1 1 14 4550 1 1 20 PHE O O 7.056 11.744 -4.615 1.00 . A A . 20 PHE O 1 1 15 4551 1 1 1 HIS C C -6.512 -13.571 -5.224 1.00 . A A . 1 HIS C 1 1 15 4552 1 1 1 HIS CA C -7.870 -13.176 -5.848 1.00 . A A . 1 HIS CA 1 1 15 4553 1 1 1 HIS CB C -9.019 -13.514 -4.884 1.00 . A A . 1 HIS CB 1 1 15 4554 1 1 1 HIS CD2 C -10.035 -12.170 -2.967 1.00 . A A . 1 HIS CD2 1 1 15 4555 1 1 1 HIS CE1 C -10.337 -10.255 -3.907 1.00 . A A . 1 HIS CE1 1 1 15 4556 1 1 1 HIS CG C -9.607 -12.265 -4.224 1.00 . A A . 1 HIS CG 1 1 15 4557 1 1 1 HIS H1 H -7.387 -14.433 -7.508 1.00 . A A . 1 HIS H1 1 1 15 4558 1 1 1 HIS HA H -7.867 -12.096 -5.996 1.00 . A A . 1 HIS HA 1 1 15 4559 1 1 1 HIS HB2 H -9.807 -14.021 -5.441 1.00 . A A . 1 HIS HB2 1 1 15 4560 1 1 1 HIS HB3 H -8.647 -14.183 -4.108 1.00 . A A . 1 HIS HB3 1 1 15 4561 1 1 1 HIS HD1 H -9.593 -10.851 -5.753 1.00 . A A . 1 HIS HD1 1 1 15 4562 1 1 1 HIS HD2 H -10.024 -12.962 -2.231 1.00 . A A . 1 HIS HD2 1 1 15 4563 1 1 1 HIS HE1 H -10.611 -9.223 -4.071 1.00 . A A . 1 HIS HE1 1 1 15 4564 1 1 1 HIS HE2 H -10.859 -10.569 -1.912 1.00 . A A . 1 HIS HE2 1 1 15 4565 1 1 1 HIS N N -8.100 -13.809 -7.158 1.00 . A A . 1 HIS N 1 1 15 4566 1 1 1 HIS ND1 N -9.796 -11.076 -4.805 1.00 . A A . 1 HIS ND1 1 1 15 4567 1 1 1 HIS NE2 N -10.478 -10.933 -2.774 1.00 . A A . 1 HIS NE2 1 1 15 4568 1 1 1 HIS O O -6.241 -14.747 -4.995 1.00 . A A . 1 HIS O 1 1 15 4569 1 1 2 GLY C C -3.437 -11.459 -4.756 1.00 . A A . 2 GLY C 1 1 15 4570 1 1 2 GLY CA C -4.232 -12.768 -4.702 1.00 . A A . 2 GLY CA 1 1 15 4571 1 1 2 GLY H H -5.820 -11.642 -5.495 1.00 . A A . 2 GLY H 1 1 15 4572 1 1 2 GLY HA2 H -4.273 -13.119 -3.671 1.00 . A A . 2 GLY HA2 1 1 15 4573 1 1 2 GLY HA3 H -3.727 -13.514 -5.315 1.00 . A A . 2 GLY HA3 1 1 15 4574 1 1 2 GLY N N -5.607 -12.582 -5.207 1.00 . A A . 2 GLY N 1 1 15 4575 1 1 2 GLY O O -3.677 -10.564 -3.949 1.00 . A A . 2 GLY O 1 1 15 4576 1 1 3 LEU C C -2.814 -8.749 -6.169 1.00 . A A . 3 LEU C 1 1 15 4577 1 1 3 LEU CA C -1.961 -10.033 -6.129 1.00 . A A . 3 LEU CA 1 1 15 4578 1 1 3 LEU CB C -1.100 -10.167 -7.394 1.00 . A A . 3 LEU CB 1 1 15 4579 1 1 3 LEU CD1 C -1.432 -8.684 -9.394 1.00 . A A . 3 LEU CD1 1 1 15 4580 1 1 3 LEU CD2 C -1.702 -11.193 -9.619 1.00 . A A . 3 LEU CD2 1 1 15 4581 1 1 3 LEU CG C -1.871 -9.980 -8.706 1.00 . A A . 3 LEU CG 1 1 15 4582 1 1 3 LEU H H -2.647 -11.986 -6.562 1.00 . A A . 3 LEU H 1 1 15 4583 1 1 3 LEU HA H -1.273 -9.927 -5.290 1.00 . A A . 3 LEU HA 1 1 15 4584 1 1 3 LEU HB2 H -0.301 -9.426 -7.351 1.00 . A A . 3 LEU HB2 1 1 15 4585 1 1 3 LEU HB3 H -0.654 -11.161 -7.399 1.00 . A A . 3 LEU HB3 1 1 15 4586 1 1 3 LEU HD11 H -1.986 -8.560 -10.325 1.00 . A A . 3 LEU HD11 1 1 15 4587 1 1 3 LEU HD12 H -0.364 -8.731 -9.610 1.00 . A A . 3 LEU HD12 1 1 15 4588 1 1 3 LEU HD13 H -1.634 -7.838 -8.737 1.00 . A A . 3 LEU HD13 1 1 15 4589 1 1 3 LEU HD21 H -0.646 -11.329 -9.851 1.00 . A A . 3 LEU HD21 1 1 15 4590 1 1 3 LEU HD22 H -2.260 -11.034 -10.542 1.00 . A A . 3 LEU HD22 1 1 15 4591 1 1 3 LEU HD23 H -2.081 -12.083 -9.115 1.00 . A A . 3 LEU HD23 1 1 15 4592 1 1 3 LEU HG H -2.930 -9.888 -8.462 1.00 . A A . 3 LEU HG 1 1 15 4593 1 1 3 LEU N N -2.751 -11.260 -5.881 1.00 . A A . 3 LEU N 1 1 15 4594 1 1 3 LEU O O -2.394 -7.707 -5.674 1.00 . A A . 3 LEU O 1 1 15 4595 1 1 4 ALA C C -5.318 -7.239 -5.269 1.00 . A A . 4 ALA C 1 1 15 4596 1 1 4 ALA CA C -5.064 -7.819 -6.675 1.00 . A A . 4 ALA CA 1 1 15 4597 1 1 4 ALA CB C -6.365 -8.372 -7.265 1.00 . A A . 4 ALA CB 1 1 15 4598 1 1 4 ALA H H -4.246 -9.646 -7.298 1.00 . A A . 4 ALA H 1 1 15 4599 1 1 4 ALA HA H -4.723 -7.007 -7.317 1.00 . A A . 4 ALA HA 1 1 15 4600 1 1 4 ALA HB1 H -6.170 -8.778 -8.258 1.00 . A A . 4 ALA HB1 1 1 15 4601 1 1 4 ALA HB2 H -6.750 -9.161 -6.619 1.00 . A A . 4 ALA HB2 1 1 15 4602 1 1 4 ALA HB3 H -7.100 -7.571 -7.339 1.00 . A A . 4 ALA HB3 1 1 15 4603 1 1 4 ALA N N -4.035 -8.879 -6.696 1.00 . A A . 4 ALA N 1 1 15 4604 1 1 4 ALA O O -5.533 -6.040 -5.127 1.00 . A A . 4 ALA O 1 1 15 4605 1 1 5 SER C C -3.801 -7.388 -2.205 1.00 . A A . 5 SER C 1 1 15 4606 1 1 5 SER CA C -5.175 -7.714 -2.825 1.00 . A A . 5 SER CA 1 1 15 4607 1 1 5 SER CB C -5.829 -8.855 -2.041 1.00 . A A . 5 SER CB 1 1 15 4608 1 1 5 SER H H -4.726 -8.994 -4.418 1.00 . A A . 5 SER H 1 1 15 4609 1 1 5 SER HA H -5.808 -6.831 -2.735 1.00 . A A . 5 SER HA 1 1 15 4610 1 1 5 SER HB2 H -6.742 -9.170 -2.547 1.00 . A A . 5 SER HB2 1 1 15 4611 1 1 5 SER HB3 H -5.140 -9.697 -1.975 1.00 . A A . 5 SER HB3 1 1 15 4612 1 1 5 SER HG H -6.389 -9.151 -0.133 1.00 . A A . 5 SER HG 1 1 15 4613 1 1 5 SER N N -5.083 -8.074 -4.256 1.00 . A A . 5 SER N 1 1 15 4614 1 1 5 SER O O -3.697 -6.616 -1.255 1.00 . A A . 5 SER O 1 1 15 4615 1 1 5 SER OG O -6.145 -8.390 -0.731 1.00 . A A . 5 SER OG 1 1 15 4616 1 1 6 THR C C -1.033 -6.049 -2.586 1.00 . A A . 6 THR C 1 1 15 4617 1 1 6 THR CA C -1.324 -7.559 -2.442 1.00 . A A . 6 THR CA 1 1 15 4618 1 1 6 THR CB C -0.369 -8.434 -3.278 1.00 . A A . 6 THR CB 1 1 15 4619 1 1 6 THR CG2 C 1.114 -8.229 -2.951 1.00 . A A . 6 THR CG2 1 1 15 4620 1 1 6 THR H H -2.796 -8.520 -3.578 1.00 . A A . 6 THR H 1 1 15 4621 1 1 6 THR HA H -1.190 -7.826 -1.393 1.00 . A A . 6 THR HA 1 1 15 4622 1 1 6 THR HB H -0.522 -8.196 -4.330 1.00 . A A . 6 THR HB 1 1 15 4623 1 1 6 THR HG1 H 0.036 -10.398 -3.366 1.00 . A A . 6 THR HG1 1 1 15 4624 1 1 6 THR HG21 H 1.293 -8.470 -1.903 1.00 . A A . 6 THR HG21 1 1 15 4625 1 1 6 THR HG22 H 1.720 -8.881 -3.582 1.00 . A A . 6 THR HG22 1 1 15 4626 1 1 6 THR HG23 H 1.387 -7.190 -3.136 1.00 . A A . 6 THR HG23 1 1 15 4627 1 1 6 THR N N -2.724 -7.880 -2.817 1.00 . A A . 6 THR N 1 1 15 4628 1 1 6 THR O O -0.305 -5.467 -1.781 1.00 . A A . 6 THR O 1 1 15 4629 1 1 6 THR OG1 O -0.721 -9.809 -3.075 1.00 . A A . 6 THR OG1 1 1 15 4630 1 1 7 LEU C C -2.713 -3.234 -2.713 1.00 . A A . 7 LEU C 1 1 15 4631 1 1 7 LEU CA C -1.774 -3.947 -3.703 1.00 . A A . 7 LEU CA 1 1 15 4632 1 1 7 LEU CB C -2.106 -3.679 -5.183 1.00 . A A . 7 LEU CB 1 1 15 4633 1 1 7 LEU CD1 C -2.138 -1.116 -5.426 1.00 . A A . 7 LEU CD1 1 1 15 4634 1 1 7 LEU CD2 C -3.471 -2.602 -6.965 1.00 . A A . 7 LEU CD2 1 1 15 4635 1 1 7 LEU CG C -2.921 -2.429 -5.550 1.00 . A A . 7 LEU CG 1 1 15 4636 1 1 7 LEU H H -2.374 -5.909 -4.117 1.00 . A A . 7 LEU H 1 1 15 4637 1 1 7 LEU HA H -0.766 -3.574 -3.522 1.00 . A A . 7 LEU HA 1 1 15 4638 1 1 7 LEU HB2 H -1.165 -3.636 -5.732 1.00 . A A . 7 LEU HB2 1 1 15 4639 1 1 7 LEU HB3 H -2.664 -4.541 -5.547 1.00 . A A . 7 LEU HB3 1 1 15 4640 1 1 7 LEU HD11 H -1.756 -1.014 -4.410 1.00 . A A . 7 LEU HD11 1 1 15 4641 1 1 7 LEU HD12 H -1.305 -1.122 -6.128 1.00 . A A . 7 LEU HD12 1 1 15 4642 1 1 7 LEU HD13 H -2.797 -0.277 -5.652 1.00 . A A . 7 LEU HD13 1 1 15 4643 1 1 7 LEU HD21 H -4.110 -3.485 -7.000 1.00 . A A . 7 LEU HD21 1 1 15 4644 1 1 7 LEU HD22 H -4.051 -1.722 -7.240 1.00 . A A . 7 LEU HD22 1 1 15 4645 1 1 7 LEU HD23 H -2.644 -2.724 -7.665 1.00 . A A . 7 LEU HD23 1 1 15 4646 1 1 7 LEU HG H -3.770 -2.375 -4.869 1.00 . A A . 7 LEU HG 1 1 15 4647 1 1 7 LEU N N -1.742 -5.412 -3.521 1.00 . A A . 7 LEU N 1 1 15 4648 1 1 7 LEU O O -2.556 -2.042 -2.485 1.00 . A A . 7 LEU O 1 1 15 4649 1 1 8 THR C C -3.878 -3.429 0.414 1.00 . A A . 8 THR C 1 1 15 4650 1 1 8 THR CA C -4.490 -3.455 -0.999 1.00 . A A . 8 THR CA 1 1 15 4651 1 1 8 THR CB C -5.792 -4.277 -1.083 1.00 . A A . 8 THR CB 1 1 15 4652 1 1 8 THR CG2 C -6.920 -3.779 -0.171 1.00 . A A . 8 THR CG2 1 1 15 4653 1 1 8 THR H H -3.495 -4.990 -1.996 1.00 . A A . 8 THR H 1 1 15 4654 1 1 8 THR HA H -4.723 -2.429 -1.283 1.00 . A A . 8 THR HA 1 1 15 4655 1 1 8 THR HB H -5.565 -5.310 -0.819 1.00 . A A . 8 THR HB 1 1 15 4656 1 1 8 THR HG1 H -7.154 -4.650 -2.501 1.00 . A A . 8 THR HG1 1 1 15 4657 1 1 8 THR HG21 H -7.176 -2.753 -0.437 1.00 . A A . 8 THR HG21 1 1 15 4658 1 1 8 THR HG22 H -7.797 -4.416 -0.296 1.00 . A A . 8 THR HG22 1 1 15 4659 1 1 8 THR HG23 H -6.590 -3.814 0.867 1.00 . A A . 8 THR HG23 1 1 15 4660 1 1 8 THR N N -3.522 -3.989 -1.978 1.00 . A A . 8 THR N 1 1 15 4661 1 1 8 THR O O -4.371 -2.716 1.273 1.00 . A A . 8 THR O 1 1 15 4662 1 1 8 THR OG1 O -6.243 -4.245 -2.442 1.00 . A A . 8 THR OG1 1 1 15 4663 1 1 9 ARG C C -0.809 -3.136 1.907 1.00 . A A . 9 ARG C 1 1 15 4664 1 1 9 ARG CA C -2.001 -4.103 1.889 1.00 . A A . 9 ARG CA 1 1 15 4665 1 1 9 ARG CB C -1.509 -5.513 2.207 1.00 . A A . 9 ARG CB 1 1 15 4666 1 1 9 ARG CD C -2.111 -7.798 3.005 1.00 . A A . 9 ARG CD 1 1 15 4667 1 1 9 ARG CG C -2.655 -6.413 2.661 1.00 . A A . 9 ARG CG 1 1 15 4668 1 1 9 ARG CZ C -3.455 -9.430 1.668 1.00 . A A . 9 ARG CZ 1 1 15 4669 1 1 9 ARG H H -2.402 -4.735 -0.081 1.00 . A A . 9 ARG H 1 1 15 4670 1 1 9 ARG HA H -2.692 -3.801 2.677 1.00 . A A . 9 ARG HA 1 1 15 4671 1 1 9 ARG HB2 H -1.049 -5.941 1.316 1.00 . A A . 9 ARG HB2 1 1 15 4672 1 1 9 ARG HB3 H -0.765 -5.458 3.002 1.00 . A A . 9 ARG HB3 1 1 15 4673 1 1 9 ARG HD2 H -1.042 -7.726 3.206 1.00 . A A . 9 ARG HD2 1 1 15 4674 1 1 9 ARG HD3 H -2.619 -8.171 3.894 1.00 . A A . 9 ARG HD3 1 1 15 4675 1 1 9 ARG HE H -1.561 -8.868 1.273 1.00 . A A . 9 ARG HE 1 1 15 4676 1 1 9 ARG HG2 H -3.129 -5.980 3.542 1.00 . A A . 9 ARG HG2 1 1 15 4677 1 1 9 ARG HG3 H -3.388 -6.500 1.859 1.00 . A A . 9 ARG HG3 1 1 15 4678 1 1 9 ARG HH11 H -4.492 -8.599 3.169 1.00 . A A . 9 ARG HH11 1 1 15 4679 1 1 9 ARG HH12 H -5.363 -9.793 2.270 1.00 . A A . 9 ARG HH12 1 1 15 4680 1 1 9 ARG HH21 H -2.733 -10.402 0.054 1.00 . A A . 9 ARG HH21 1 1 15 4681 1 1 9 ARG HH22 H -4.356 -10.798 0.508 1.00 . A A . 9 ARG HH22 1 1 15 4682 1 1 9 ARG N N -2.739 -4.097 0.609 1.00 . A A . 9 ARG N 1 1 15 4683 1 1 9 ARG NE N -2.332 -8.740 1.891 1.00 . A A . 9 ARG NE 1 1 15 4684 1 1 9 ARG NH1 N -4.532 -9.270 2.429 1.00 . A A . 9 ARG NH1 1 1 15 4685 1 1 9 ARG NH2 N -3.519 -10.278 0.655 1.00 . A A . 9 ARG NH2 1 1 15 4686 1 1 9 ARG O O -0.743 -2.239 2.743 1.00 . A A . 9 ARG O 1 1 15 4687 1 1 10 TRP C C 0.703 -0.860 0.490 1.00 . A A . 10 TRP C 1 1 15 4688 1 1 10 TRP CA C 1.184 -2.312 0.721 1.00 . A A . 10 TRP CA 1 1 15 4689 1 1 10 TRP CB C 2.122 -2.872 -0.363 1.00 . A A . 10 TRP CB 1 1 15 4690 1 1 10 TRP CD1 C 2.061 -1.756 -2.636 1.00 . A A . 10 TRP CD1 1 1 15 4691 1 1 10 TRP CD2 C 3.502 -0.834 -1.243 1.00 . A A . 10 TRP CD2 1 1 15 4692 1 1 10 TRP CE2 C 3.502 -0.129 -2.435 1.00 . A A . 10 TRP CE2 1 1 15 4693 1 1 10 TRP CE3 C 4.328 -0.459 -0.199 1.00 . A A . 10 TRP CE3 1 1 15 4694 1 1 10 TRP CG C 2.577 -1.860 -1.403 1.00 . A A . 10 TRP CG 1 1 15 4695 1 1 10 TRP CH2 C 5.190 1.341 -1.550 1.00 . A A . 10 TRP CH2 1 1 15 4696 1 1 10 TRP CZ2 C 4.358 0.952 -2.594 1.00 . A A . 10 TRP CZ2 1 1 15 4697 1 1 10 TRP CZ3 C 5.166 0.646 -0.340 1.00 . A A . 10 TRP CZ3 1 1 15 4698 1 1 10 TRP H H 0.023 -4.003 0.244 1.00 . A A . 10 TRP H 1 1 15 4699 1 1 10 TRP HA H 1.749 -2.310 1.653 1.00 . A A . 10 TRP HA 1 1 15 4700 1 1 10 TRP HB2 H 3.004 -3.288 0.124 1.00 . A A . 10 TRP HB2 1 1 15 4701 1 1 10 TRP HB3 H 1.599 -3.677 -0.880 1.00 . A A . 10 TRP HB3 1 1 15 4702 1 1 10 TRP HD1 H 1.317 -2.413 -3.056 1.00 . A A . 10 TRP HD1 1 1 15 4703 1 1 10 TRP HE1 H 2.434 -0.436 -4.190 1.00 . A A . 10 TRP HE1 1 1 15 4704 1 1 10 TRP HE3 H 4.367 -1.047 0.719 1.00 . A A . 10 TRP HE3 1 1 15 4705 1 1 10 TRP HH2 H 5.784 2.248 -1.628 1.00 . A A . 10 TRP HH2 1 1 15 4706 1 1 10 TRP HZ2 H 4.431 1.453 -3.560 1.00 . A A . 10 TRP HZ2 1 1 15 4707 1 1 10 TRP HZ3 H 5.652 1.072 0.531 1.00 . A A . 10 TRP HZ3 1 1 15 4708 1 1 10 TRP N N 0.064 -3.254 0.908 1.00 . A A . 10 TRP N 1 1 15 4709 1 1 10 TRP NE1 N 2.625 -0.704 -3.253 1.00 . A A . 10 TRP NE1 1 1 15 4710 1 1 10 TRP O O 1.328 0.085 0.968 1.00 . A A . 10 TRP O 1 1 15 4711 1 1 11 ALA C C -1.603 1.223 1.160 1.00 . A A . 11 ALA C 1 1 15 4712 1 1 11 ALA CA C -1.193 0.586 -0.183 1.00 . A A . 11 ALA CA 1 1 15 4713 1 1 11 ALA CB C -2.434 0.484 -1.068 1.00 . A A . 11 ALA CB 1 1 15 4714 1 1 11 ALA H H -1.043 -1.512 -0.352 1.00 . A A . 11 ALA H 1 1 15 4715 1 1 11 ALA HA H -0.499 1.270 -0.671 1.00 . A A . 11 ALA HA 1 1 15 4716 1 1 11 ALA HB1 H -3.021 1.398 -0.978 1.00 . A A . 11 ALA HB1 1 1 15 4717 1 1 11 ALA HB2 H -2.129 0.349 -2.106 1.00 . A A . 11 ALA HB2 1 1 15 4718 1 1 11 ALA HB3 H -3.037 -0.368 -0.752 1.00 . A A . 11 ALA HB3 1 1 15 4719 1 1 11 ALA N N -0.510 -0.723 -0.051 1.00 . A A . 11 ALA N 1 1 15 4720 1 1 11 ALA O O -2.026 2.377 1.204 1.00 . A A . 11 ALA O 1 1 15 4721 1 1 12 HIS C C -0.307 1.361 4.331 1.00 . A A . 12 HIS C 1 1 15 4722 1 1 12 HIS CA C -1.623 0.986 3.621 1.00 . A A . 12 HIS CA 1 1 15 4723 1 1 12 HIS CB C -2.388 -0.076 4.422 1.00 . A A . 12 HIS CB 1 1 15 4724 1 1 12 HIS CD2 C -4.533 -1.324 3.823 1.00 . A A . 12 HIS CD2 1 1 15 4725 1 1 12 HIS CE1 C -5.849 0.309 3.359 1.00 . A A . 12 HIS CE1 1 1 15 4726 1 1 12 HIS CG C -3.852 -0.196 4.002 1.00 . A A . 12 HIS CG 1 1 15 4727 1 1 12 HIS H H -1.036 -0.447 2.206 1.00 . A A . 12 HIS H 1 1 15 4728 1 1 12 HIS HA H -2.245 1.879 3.561 1.00 . A A . 12 HIS HA 1 1 15 4729 1 1 12 HIS HB2 H -1.903 -1.040 4.272 1.00 . A A . 12 HIS HB2 1 1 15 4730 1 1 12 HIS HB3 H -2.344 0.180 5.480 1.00 . A A . 12 HIS HB3 1 1 15 4731 1 1 12 HIS HD1 H -4.491 1.778 3.922 1.00 . A A . 12 HIS HD1 1 1 15 4732 1 1 12 HIS HD2 H -4.150 -2.323 3.973 1.00 . A A . 12 HIS HD2 1 1 15 4733 1 1 12 HIS HE1 H -6.718 0.873 3.053 1.00 . A A . 12 HIS HE1 1 1 15 4734 1 1 12 HIS HE2 H -6.504 -1.669 3.218 1.00 . A A . 12 HIS HE2 1 1 15 4735 1 1 12 HIS N N -1.399 0.489 2.249 1.00 . A A . 12 HIS N 1 1 15 4736 1 1 12 HIS ND1 N -4.678 0.819 3.732 1.00 . A A . 12 HIS ND1 1 1 15 4737 1 1 12 HIS NE2 N -5.764 -1.014 3.428 1.00 . A A . 12 HIS NE2 1 1 15 4738 1 1 12 HIS O O -0.317 1.757 5.493 1.00 . A A . 12 HIS O 1 1 15 4739 1 1 13 TYR C C 2.481 3.235 3.651 1.00 . A A . 13 TYR C 1 1 15 4740 1 1 13 TYR CA C 2.113 1.792 4.036 1.00 . A A . 13 TYR CA 1 1 15 4741 1 1 13 TYR CB C 3.100 0.796 3.422 1.00 . A A . 13 TYR CB 1 1 15 4742 1 1 13 TYR CD1 C 4.021 0.019 5.626 1.00 . A A . 13 TYR CD1 1 1 15 4743 1 1 13 TYR CD2 C 5.576 0.675 3.902 1.00 . A A . 13 TYR CD2 1 1 15 4744 1 1 13 TYR CE1 C 5.077 -0.336 6.448 1.00 . A A . 13 TYR CE1 1 1 15 4745 1 1 13 TYR CE2 C 6.634 0.320 4.727 1.00 . A A . 13 TYR CE2 1 1 15 4746 1 1 13 TYR CG C 4.270 0.523 4.353 1.00 . A A . 13 TYR CG 1 1 15 4747 1 1 13 TYR CZ C 6.378 -0.174 5.999 1.00 . A A . 13 TYR CZ 1 1 15 4748 1 1 13 TYR H H 0.751 1.072 2.611 1.00 . A A . 13 TYR H 1 1 15 4749 1 1 13 TYR HA H 2.135 1.694 5.120 1.00 . A A . 13 TYR HA 1 1 15 4750 1 1 13 TYR HB2 H 2.581 -0.141 3.217 1.00 . A A . 13 TYR HB2 1 1 15 4751 1 1 13 TYR HB3 H 3.480 1.205 2.485 1.00 . A A . 13 TYR HB3 1 1 15 4752 1 1 13 TYR HD1 H 2.995 -0.091 5.976 1.00 . A A . 13 TYR HD1 1 1 15 4753 1 1 13 TYR HD2 H 5.764 1.048 2.897 1.00 . A A . 13 TYR HD2 1 1 15 4754 1 1 13 TYR HE1 H 4.869 -0.804 7.412 1.00 . A A . 13 TYR HE1 1 1 15 4755 1 1 13 TYR HE2 H 7.649 0.354 4.328 1.00 . A A . 13 TYR HE2 1 1 15 4756 1 1 13 TYR HH H 8.267 -0.260 6.378 1.00 . A A . 13 TYR HH 1 1 15 4757 1 1 13 TYR N N 0.768 1.435 3.546 1.00 . A A . 13 TYR N 1 1 15 4758 1 1 13 TYR O O 2.681 4.096 4.509 1.00 . A A . 13 TYR O 1 1 15 4759 1 1 13 TYR OH O 7.408 -0.470 6.836 1.00 . A A . 13 TYR OH 1 1 15 4760 1 1 14 ASN C C 1.513 5.865 2.345 1.00 . A A . 14 ASN C 1 1 15 4761 1 1 14 ASN CA C 2.516 4.865 1.766 1.00 . A A . 14 ASN CA 1 1 15 4762 1 1 14 ASN CB C 2.300 4.886 0.250 1.00 . A A . 14 ASN CB 1 1 15 4763 1 1 14 ASN CG C 3.149 3.867 -0.495 1.00 . A A . 14 ASN CG 1 1 15 4764 1 1 14 ASN H H 2.394 2.777 1.665 1.00 . A A . 14 ASN H 1 1 15 4765 1 1 14 ASN HA H 3.522 5.229 1.974 1.00 . A A . 14 ASN HA 1 1 15 4766 1 1 14 ASN HB2 H 1.249 4.687 0.042 1.00 . A A . 14 ASN HB2 1 1 15 4767 1 1 14 ASN HB3 H 2.549 5.881 -0.120 1.00 . A A . 14 ASN HB3 1 1 15 4768 1 1 14 ASN HD21 H 3.638 5.209 -1.918 1.00 . A A . 14 ASN HD21 1 1 15 4769 1 1 14 ASN HD22 H 4.264 3.587 -2.089 1.00 . A A . 14 ASN HD22 1 1 15 4770 1 1 14 ASN N N 2.379 3.511 2.352 1.00 . A A . 14 ASN N 1 1 15 4771 1 1 14 ASN ND2 N 3.733 4.270 -1.600 1.00 . A A . 14 ASN ND2 1 1 15 4772 1 1 14 ASN O O 1.706 7.063 2.205 1.00 . A A . 14 ASN O 1 1 15 4773 1 1 14 ASN OD1 O 3.188 2.698 -0.147 1.00 . A A . 14 ASN OD1 1 1 15 4774 1 1 15 ALA C C 0.224 7.170 4.741 1.00 . A A . 15 ALA C 1 1 15 4775 1 1 15 ALA CA C -0.482 6.201 3.770 1.00 . A A . 15 ALA CA 1 1 15 4776 1 1 15 ALA CB C -1.433 5.276 4.533 1.00 . A A . 15 ALA CB 1 1 15 4777 1 1 15 ALA H H 0.319 4.385 3.076 1.00 . A A . 15 ALA H 1 1 15 4778 1 1 15 ALA HA H -1.067 6.788 3.062 1.00 . A A . 15 ALA HA 1 1 15 4779 1 1 15 ALA HB1 H -2.146 5.875 5.100 1.00 . A A . 15 ALA HB1 1 1 15 4780 1 1 15 ALA HB2 H -0.860 4.649 5.216 1.00 . A A . 15 ALA HB2 1 1 15 4781 1 1 15 ALA HB3 H -1.972 4.644 3.825 1.00 . A A . 15 ALA HB3 1 1 15 4782 1 1 15 ALA N N 0.472 5.369 3.010 1.00 . A A . 15 ALA N 1 1 15 4783 1 1 15 ALA O O -0.262 8.271 4.975 1.00 . A A . 15 ALA O 1 1 15 4784 1 1 16 LEU C C 3.490 8.238 5.242 1.00 . A A . 16 LEU C 1 1 15 4785 1 1 16 LEU CA C 2.302 7.628 6.016 1.00 . A A . 16 LEU CA 1 1 15 4786 1 1 16 LEU CB C 2.769 6.765 7.193 1.00 . A A . 16 LEU CB 1 1 15 4787 1 1 16 LEU CD1 C 2.395 6.648 9.660 1.00 . A A . 16 LEU CD1 1 1 15 4788 1 1 16 LEU CD2 C 4.176 8.155 8.762 1.00 . A A . 16 LEU CD2 1 1 15 4789 1 1 16 LEU CG C 2.789 7.563 8.500 1.00 . A A . 16 LEU CG 1 1 15 4790 1 1 16 LEU H H 1.794 5.886 4.948 1.00 . A A . 16 LEU H 1 1 15 4791 1 1 16 LEU HA H 1.701 8.446 6.413 1.00 . A A . 16 LEU HA 1 1 15 4792 1 1 16 LEU HB2 H 2.095 5.916 7.303 1.00 . A A . 16 LEU HB2 1 1 15 4793 1 1 16 LEU HB3 H 3.775 6.399 6.986 1.00 . A A . 16 LEU HB3 1 1 15 4794 1 1 16 LEU HD11 H 2.409 7.215 10.591 1.00 . A A . 16 LEU HD11 1 1 15 4795 1 1 16 LEU HD12 H 3.103 5.823 9.728 1.00 . A A . 16 LEU HD12 1 1 15 4796 1 1 16 LEU HD13 H 1.393 6.255 9.489 1.00 . A A . 16 LEU HD13 1 1 15 4797 1 1 16 LEU HD21 H 4.904 7.349 8.852 1.00 . A A . 16 LEU HD21 1 1 15 4798 1 1 16 LEU HD22 H 4.456 8.807 7.935 1.00 . A A . 16 LEU HD22 1 1 15 4799 1 1 16 LEU HD23 H 4.155 8.730 9.688 1.00 . A A . 16 LEU HD23 1 1 15 4800 1 1 16 LEU HG H 2.065 8.375 8.429 1.00 . A A . 16 LEU HG 1 1 15 4801 1 1 16 LEU N N 1.431 6.792 5.167 1.00 . A A . 16 LEU N 1 1 15 4802 1 1 16 LEU O O 3.925 9.342 5.550 1.00 . A A . 16 LEU O 1 1 15 4803 1 1 17 ILE C C 4.432 8.903 2.146 1.00 . A A . 17 ILE C 1 1 15 4804 1 1 17 ILE CA C 5.016 8.005 3.273 1.00 . A A . 17 ILE CA 1 1 15 4805 1 1 17 ILE CB C 5.769 6.771 2.703 1.00 . A A . 17 ILE CB 1 1 15 4806 1 1 17 ILE CD1 C 6.935 6.115 4.964 1.00 . A A . 17 ILE CD1 1 1 15 4807 1 1 17 ILE CG1 C 6.095 5.683 3.749 1.00 . A A . 17 ILE CG1 1 1 15 4808 1 1 17 ILE CG2 C 7.055 7.149 1.947 1.00 . A A . 17 ILE CG2 1 1 15 4809 1 1 17 ILE H H 3.604 6.626 4.002 1.00 . A A . 17 ILE H 1 1 15 4810 1 1 17 ILE HA H 5.726 8.600 3.847 1.00 . A A . 17 ILE HA 1 1 15 4811 1 1 17 ILE HB H 5.104 6.311 1.973 1.00 . A A . 17 ILE HB 1 1 15 4812 1 1 17 ILE HD11 H 6.410 6.899 5.508 1.00 . A A . 17 ILE HD11 1 1 15 4813 1 1 17 ILE HD12 H 7.092 5.258 5.620 1.00 . A A . 17 ILE HD12 1 1 15 4814 1 1 17 ILE HD13 H 7.899 6.492 4.623 1.00 . A A . 17 ILE HD13 1 1 15 4815 1 1 17 ILE HG12 H 5.149 5.295 4.126 1.00 . A A . 17 ILE HG12 1 1 15 4816 1 1 17 ILE HG13 H 6.619 4.872 3.245 1.00 . A A . 17 ILE HG13 1 1 15 4817 1 1 17 ILE HG21 H 6.829 7.917 1.208 1.00 . A A . 17 ILE HG21 1 1 15 4818 1 1 17 ILE HG22 H 7.454 6.267 1.446 1.00 . A A . 17 ILE HG22 1 1 15 4819 1 1 17 ILE HG23 H 7.792 7.530 2.654 1.00 . A A . 17 ILE HG23 1 1 15 4820 1 1 17 ILE N N 3.949 7.539 4.200 1.00 . A A . 17 ILE N 1 1 15 4821 1 1 17 ILE O O 5.063 9.186 1.127 1.00 . A A . 17 ILE O 1 1 15 4822 1 1 18 ARG C C 3.224 11.541 1.241 1.00 . A A . 18 ARG C 1 1 15 4823 1 1 18 ARG CA C 2.447 10.233 1.428 1.00 . A A . 18 ARG CA 1 1 15 4824 1 1 18 ARG CB C 1.045 10.492 2.002 1.00 . A A . 18 ARG CB 1 1 15 4825 1 1 18 ARG CD C -0.342 11.248 3.973 1.00 . A A . 18 ARG CD 1 1 15 4826 1 1 18 ARG CG C 1.061 11.178 3.374 1.00 . A A . 18 ARG CG 1 1 15 4827 1 1 18 ARG CZ C -1.396 13.430 3.338 1.00 . A A . 18 ARG CZ 1 1 15 4828 1 1 18 ARG H H 2.613 8.926 3.043 1.00 . A A . 18 ARG H 1 1 15 4829 1 1 18 ARG HA H 2.342 9.749 0.458 1.00 . A A . 18 ARG HA 1 1 15 4830 1 1 18 ARG HB2 H 0.489 11.118 1.302 1.00 . A A . 18 ARG HB2 1 1 15 4831 1 1 18 ARG HB3 H 0.531 9.536 2.100 1.00 . A A . 18 ARG HB3 1 1 15 4832 1 1 18 ARG HD2 H -1.050 10.779 3.289 1.00 . A A . 18 ARG HD2 1 1 15 4833 1 1 18 ARG HD3 H -0.353 10.715 4.924 1.00 . A A . 18 ARG HD3 1 1 15 4834 1 1 18 ARG HE H -0.485 13.023 5.087 1.00 . A A . 18 ARG HE 1 1 15 4835 1 1 18 ARG HG2 H 1.707 10.614 4.046 1.00 . A A . 18 ARG HG2 1 1 15 4836 1 1 18 ARG HG3 H 1.454 12.189 3.264 1.00 . A A . 18 ARG HG3 1 1 15 4837 1 1 18 ARG HH11 H -1.450 12.092 1.848 1.00 . A A . 18 ARG HH11 1 1 15 4838 1 1 18 ARG HH12 H -2.196 13.617 1.486 1.00 . A A . 18 ARG HH12 1 1 15 4839 1 1 18 ARG HH21 H -1.489 15.008 4.592 1.00 . A A . 18 ARG HH21 1 1 15 4840 1 1 18 ARG HH22 H -2.212 15.244 3.037 1.00 . A A . 18 ARG HH22 1 1 15 4841 1 1 18 ARG N N 3.182 9.327 2.329 1.00 . A A . 18 ARG N 1 1 15 4842 1 1 18 ARG NE N -0.738 12.650 4.198 1.00 . A A . 18 ARG NE 1 1 15 4843 1 1 18 ARG NH1 N -1.708 13.018 2.115 1.00 . A A . 18 ARG NH1 1 1 15 4844 1 1 18 ARG NH2 N -1.722 14.664 3.685 1.00 . A A . 18 ARG NH2 1 1 15 4845 1 1 18 ARG O O 4.010 11.939 2.099 1.00 . A A . 18 ARG O 1 1 15 4846 1 1 19 ALA C C 5.273 13.105 -0.399 1.00 . A A . 19 ALA C 1 1 15 4847 1 1 19 ALA CA C 3.753 13.358 -0.365 1.00 . A A . 19 ALA CA 1 1 15 4848 1 1 19 ALA CB C 3.364 14.566 0.506 1.00 . A A . 19 ALA CB 1 1 15 4849 1 1 19 ALA H H 2.457 11.715 -0.628 1.00 . A A . 19 ALA H 1 1 15 4850 1 1 19 ALA HA H 3.436 13.578 -1.385 1.00 . A A . 19 ALA HA 1 1 15 4851 1 1 19 ALA HB1 H 2.282 14.693 0.492 1.00 . A A . 19 ALA HB1 1 1 15 4852 1 1 19 ALA HB2 H 3.696 14.395 1.531 1.00 . A A . 19 ALA HB2 1 1 15 4853 1 1 19 ALA HB3 H 3.841 15.465 0.115 1.00 . A A . 19 ALA HB3 1 1 15 4854 1 1 19 ALA N N 3.042 12.133 0.062 1.00 . A A . 19 ALA N 1 1 15 4855 1 1 19 ALA O O 6.070 13.556 0.423 1.00 . A A . 19 ALA O 1 1 15 4856 1 1 20 PHE C C 7.450 12.238 -3.065 1.00 . A A . 20 PHE C 1 1 15 4857 1 1 20 PHE CA C 7.005 11.853 -1.642 1.00 . A A . 20 PHE CA 1 1 15 4858 1 1 20 PHE CB C 7.100 10.336 -1.447 1.00 . A A . 20 PHE CB 1 1 15 4859 1 1 20 PHE CD1 C 8.637 9.891 0.496 1.00 . A A . 20 PHE CD1 1 1 15 4860 1 1 20 PHE CD2 C 9.500 9.555 -1.729 1.00 . A A . 20 PHE CD2 1 1 15 4861 1 1 20 PHE CE1 C 9.848 9.463 1.029 1.00 . A A . 20 PHE CE1 1 1 15 4862 1 1 20 PHE CE2 C 10.708 9.131 -1.191 1.00 . A A . 20 PHE CE2 1 1 15 4863 1 1 20 PHE CG C 8.459 9.932 -0.884 1.00 . A A . 20 PHE CG 1 1 15 4864 1 1 20 PHE CZ C 10.882 9.085 0.184 1.00 . A A . 20 PHE CZ 1 1 15 4865 1 1 20 PHE H H 4.925 11.832 -1.941 1.00 . A A . 20 PHE H 1 1 15 4866 1 1 20 PHE HA H 7.664 12.340 -0.924 1.00 . A A . 20 PHE HA 1 1 15 4867 1 1 20 PHE HB2 H 6.318 10.014 -0.759 1.00 . A A . 20 PHE HB2 1 1 15 4868 1 1 20 PHE HB3 H 6.954 9.846 -2.410 1.00 . A A . 20 PHE HB3 1 1 15 4869 1 1 20 PHE HD1 H 7.818 10.176 1.155 1.00 . A A . 20 PHE HD1 1 1 15 4870 1 1 20 PHE HD2 H 9.373 9.618 -2.810 1.00 . A A . 20 PHE HD2 1 1 15 4871 1 1 20 PHE HE1 H 9.969 9.401 2.111 1.00 . A A . 20 PHE HE1 1 1 15 4872 1 1 20 PHE HE2 H 11.521 8.831 -1.855 1.00 . A A . 20 PHE HE2 1 1 15 4873 1 1 20 PHE HZ H 11.838 8.764 0.606 1.00 . A A . 20 PHE HZ 1 1 15 4874 1 1 20 PHE N N 5.618 12.271 -1.372 1.00 . A A . 20 PHE N 1 1 15 4875 1 1 20 PHE O O 6.555 12.383 -3.931 1.00 . A A . 20 PHE O 1 1 16 4876 1 1 1 HIS C C -5.128 -13.329 -5.136 1.00 . A A . 1 HIS C 1 1 16 4877 1 1 1 HIS CA C -6.544 -13.058 -5.677 1.00 . A A . 1 HIS CA 1 1 16 4878 1 1 1 HIS CB C -7.583 -12.990 -4.548 1.00 . A A . 1 HIS CB 1 1 16 4879 1 1 1 HIS CD2 C -9.245 -14.854 -4.054 1.00 . A A . 1 HIS CD2 1 1 16 4880 1 1 1 HIS CE1 C -7.947 -16.401 -3.303 1.00 . A A . 1 HIS CE1 1 1 16 4881 1 1 1 HIS CG C -8.011 -14.366 -3.990 1.00 . A A . 1 HIS CG 1 1 16 4882 1 1 1 HIS H1 H -6.321 -14.791 -6.918 1.00 . A A . 1 HIS H1 1 1 16 4883 1 1 1 HIS HA H -6.524 -12.079 -6.156 1.00 . A A . 1 HIS HA 1 1 16 4884 1 1 1 HIS HB2 H -7.159 -12.408 -3.731 1.00 . A A . 1 HIS HB2 1 1 16 4885 1 1 1 HIS HB3 H -8.468 -12.475 -4.921 1.00 . A A . 1 HIS HB3 1 1 16 4886 1 1 1 HIS HD1 H -6.212 -15.258 -3.451 1.00 . A A . 1 HIS HD1 1 1 16 4887 1 1 1 HIS HD2 H -10.124 -14.322 -4.385 1.00 . A A . 1 HIS HD2 1 1 16 4888 1 1 1 HIS HE1 H -7.586 -17.344 -2.921 1.00 . A A . 1 HIS HE1 1 1 16 4889 1 1 1 HIS HE2 H -9.987 -16.749 -3.582 1.00 . A A . 1 HIS HE2 1 1 16 4890 1 1 1 HIS N N -6.962 -14.040 -6.703 1.00 . A A . 1 HIS N 1 1 16 4891 1 1 1 HIS ND1 N -7.215 -15.310 -3.528 1.00 . A A . 1 HIS ND1 1 1 16 4892 1 1 1 HIS NE2 N -9.201 -16.116 -3.636 1.00 . A A . 1 HIS NE2 1 1 16 4893 1 1 1 HIS O O -4.765 -14.474 -4.858 1.00 . A A . 1 HIS O 1 1 16 4894 1 1 2 GLY C C -2.225 -10.979 -4.718 1.00 . A A . 2 GLY C 1 1 16 4895 1 1 2 GLY CA C -2.916 -12.344 -4.658 1.00 . A A . 2 GLY CA 1 1 16 4896 1 1 2 GLY H H -4.634 -11.337 -5.351 1.00 . A A . 2 GLY H 1 1 16 4897 1 1 2 GLY HA2 H -2.889 -12.709 -3.631 1.00 . A A . 2 GLY HA2 1 1 16 4898 1 1 2 GLY HA3 H -2.382 -13.044 -5.300 1.00 . A A . 2 GLY HA3 1 1 16 4899 1 1 2 GLY N N -4.323 -12.259 -5.100 1.00 . A A . 2 GLY N 1 1 16 4900 1 1 2 GLY O O -2.410 -10.147 -3.832 1.00 . A A . 2 GLY O 1 1 16 4901 1 1 3 LEU C C -2.014 -8.198 -6.125 1.00 . A A . 3 LEU C 1 1 16 4902 1 1 3 LEU CA C -1.018 -9.375 -6.144 1.00 . A A . 3 LEU CA 1 1 16 4903 1 1 3 LEU CB C -0.210 -9.367 -7.449 1.00 . A A . 3 LEU CB 1 1 16 4904 1 1 3 LEU CD1 C -0.585 -8.290 -9.673 1.00 . A A . 3 LEU CD1 1 1 16 4905 1 1 3 LEU CD2 C -1.079 -10.745 -9.374 1.00 . A A . 3 LEU CD2 1 1 16 4906 1 1 3 LEU CG C -1.081 -9.368 -8.709 1.00 . A A . 3 LEU CG 1 1 16 4907 1 1 3 LEU H H -1.543 -11.371 -6.604 1.00 . A A . 3 LEU H 1 1 16 4908 1 1 3 LEU HA H -0.310 -9.202 -5.334 1.00 . A A . 3 LEU HA 1 1 16 4909 1 1 3 LEU HB2 H 0.425 -8.481 -7.462 1.00 . A A . 3 LEU HB2 1 1 16 4910 1 1 3 LEU HB3 H 0.423 -10.253 -7.467 1.00 . A A . 3 LEU HB3 1 1 16 4911 1 1 3 LEU HD11 H -1.204 -8.290 -10.569 1.00 . A A . 3 LEU HD11 1 1 16 4912 1 1 3 LEU HD12 H -0.646 -7.315 -9.190 1.00 . A A . 3 LEU HD12 1 1 16 4913 1 1 3 LEU HD13 H 0.450 -8.495 -9.946 1.00 . A A . 3 LEU HD13 1 1 16 4914 1 1 3 LEU HD21 H -1.471 -11.485 -8.677 1.00 . A A . 3 LEU HD21 1 1 16 4915 1 1 3 LEU HD22 H -1.704 -10.719 -10.266 1.00 . A A . 3 LEU HD22 1 1 16 4916 1 1 3 LEU HD23 H -0.059 -11.012 -9.652 1.00 . A A . 3 LEU HD23 1 1 16 4917 1 1 3 LEU HG H -2.104 -9.127 -8.420 1.00 . A A . 3 LEU HG 1 1 16 4918 1 1 3 LEU N N -1.655 -10.686 -5.884 1.00 . A A . 3 LEU N 1 1 16 4919 1 1 3 LEU O O -1.718 -7.134 -5.596 1.00 . A A . 3 LEU O 1 1 16 4920 1 1 4 ALA C C -4.622 -7.032 -4.999 1.00 . A A . 4 ALA C 1 1 16 4921 1 1 4 ALA CA C -4.363 -7.496 -6.447 1.00 . A A . 4 ALA CA 1 1 16 4922 1 1 4 ALA CB C -5.628 -8.108 -7.050 1.00 . A A . 4 ALA CB 1 1 16 4923 1 1 4 ALA H H -3.464 -9.300 -7.049 1.00 . A A . 4 ALA H 1 1 16 4924 1 1 4 ALA HA H -4.099 -6.619 -7.039 1.00 . A A . 4 ALA HA 1 1 16 4925 1 1 4 ALA HB1 H -5.425 -8.430 -8.072 1.00 . A A . 4 ALA HB1 1 1 16 4926 1 1 4 ALA HB2 H -6.425 -7.364 -7.055 1.00 . A A . 4 ALA HB2 1 1 16 4927 1 1 4 ALA HB3 H -5.937 -8.967 -6.454 1.00 . A A . 4 ALA HB3 1 1 16 4928 1 1 4 ALA N N -3.249 -8.465 -6.549 1.00 . A A . 4 ALA N 1 1 16 4929 1 1 4 ALA O O -5.181 -5.967 -4.778 1.00 . A A . 4 ALA O 1 1 16 4930 1 1 5 SER C C -2.849 -7.014 -2.052 1.00 . A A . 5 SER C 1 1 16 4931 1 1 5 SER CA C -4.205 -7.515 -2.596 1.00 . A A . 5 SER CA 1 1 16 4932 1 1 5 SER CB C -4.659 -8.759 -1.830 1.00 . A A . 5 SER CB 1 1 16 4933 1 1 5 SER H H -3.666 -8.672 -4.254 1.00 . A A . 5 SER H 1 1 16 4934 1 1 5 SER HA H -4.945 -6.730 -2.443 1.00 . A A . 5 SER HA 1 1 16 4935 1 1 5 SER HB2 H -5.438 -9.271 -2.395 1.00 . A A . 5 SER HB2 1 1 16 4936 1 1 5 SER HB3 H -3.812 -9.429 -1.687 1.00 . A A . 5 SER HB3 1 1 16 4937 1 1 5 SER HG H -5.464 -9.167 -0.038 1.00 . A A . 5 SER HG 1 1 16 4938 1 1 5 SER N N -4.149 -7.826 -4.039 1.00 . A A . 5 SER N 1 1 16 4939 1 1 5 SER O O -2.813 -6.244 -1.095 1.00 . A A . 5 SER O 1 1 16 4940 1 1 5 SER OG O -5.174 -8.364 -0.559 1.00 . A A . 5 SER OG 1 1 16 4941 1 1 6 THR C C -0.332 -5.262 -2.468 1.00 . A A . 6 THR C 1 1 16 4942 1 1 6 THR CA C -0.391 -6.806 -2.428 1.00 . A A . 6 THR CA 1 1 16 4943 1 1 6 THR CB C 0.714 -7.463 -3.291 1.00 . A A . 6 THR CB 1 1 16 4944 1 1 6 THR CG2 C 1.066 -6.791 -4.628 1.00 . A A . 6 THR CG2 1 1 16 4945 1 1 6 THR H H -1.797 -7.876 -3.578 1.00 . A A . 6 THR H 1 1 16 4946 1 1 6 THR HA H -0.191 -7.096 -1.397 1.00 . A A . 6 THR HA 1 1 16 4947 1 1 6 THR HB H 0.416 -8.491 -3.496 1.00 . A A . 6 THR HB 1 1 16 4948 1 1 6 THR HG1 H 2.680 -7.735 -3.111 1.00 . A A . 6 THR HG1 1 1 16 4949 1 1 6 THR HG21 H 0.881 -7.488 -5.445 1.00 . A A . 6 THR HG21 1 1 16 4950 1 1 6 THR HG22 H 2.118 -6.505 -4.626 1.00 . A A . 6 THR HG22 1 1 16 4951 1 1 6 THR HG23 H 0.449 -5.903 -4.761 1.00 . A A . 6 THR HG23 1 1 16 4952 1 1 6 THR N N -1.750 -7.315 -2.754 1.00 . A A . 6 THR N 1 1 16 4953 1 1 6 THR O O 0.320 -4.626 -1.641 1.00 . A A . 6 THR O 1 1 16 4954 1 1 6 THR OG1 O 1.909 -7.493 -2.519 1.00 . A A . 6 THR OG1 1 1 16 4955 1 1 7 LEU C C -2.227 -2.655 -2.346 1.00 . A A . 7 LEU C 1 1 16 4956 1 1 7 LEU CA C -1.363 -3.244 -3.480 1.00 . A A . 7 LEU CA 1 1 16 4957 1 1 7 LEU CB C -1.843 -2.940 -4.915 1.00 . A A . 7 LEU CB 1 1 16 4958 1 1 7 LEU CD1 C -4.410 -3.054 -4.709 1.00 . A A . 7 LEU CD1 1 1 16 4959 1 1 7 LEU CD2 C -3.271 -0.803 -4.962 1.00 . A A . 7 LEU CD2 1 1 16 4960 1 1 7 LEU CG C -3.205 -2.300 -5.270 1.00 . A A . 7 LEU CG 1 1 16 4961 1 1 7 LEU H H -1.743 -5.249 -3.948 1.00 . A A . 7 LEU H 1 1 16 4962 1 1 7 LEU HA H -0.379 -2.787 -3.384 1.00 . A A . 7 LEU HA 1 1 16 4963 1 1 7 LEU HB2 H -1.076 -2.317 -5.375 1.00 . A A . 7 LEU HB2 1 1 16 4964 1 1 7 LEU HB3 H -1.824 -3.897 -5.437 1.00 . A A . 7 LEU HB3 1 1 16 4965 1 1 7 LEU HD11 H -5.074 -2.354 -4.204 1.00 . A A . 7 LEU HD11 1 1 16 4966 1 1 7 LEU HD12 H -4.069 -3.807 -3.999 1.00 . A A . 7 LEU HD12 1 1 16 4967 1 1 7 LEU HD13 H -4.946 -3.540 -5.525 1.00 . A A . 7 LEU HD13 1 1 16 4968 1 1 7 LEU HD21 H -3.293 -0.656 -3.882 1.00 . A A . 7 LEU HD21 1 1 16 4969 1 1 7 LEU HD22 H -2.395 -0.307 -5.379 1.00 . A A . 7 LEU HD22 1 1 16 4970 1 1 7 LEU HD23 H -4.173 -0.381 -5.405 1.00 . A A . 7 LEU HD23 1 1 16 4971 1 1 7 LEU HG H -3.291 -2.379 -6.353 1.00 . A A . 7 LEU HG 1 1 16 4972 1 1 7 LEU N N -1.161 -4.699 -3.348 1.00 . A A . 7 LEU N 1 1 16 4973 1 1 7 LEU O O -2.149 -1.465 -2.097 1.00 . A A . 7 LEU O 1 1 16 4974 1 1 8 THR C C -3.142 -3.132 0.837 1.00 . A A . 8 THR C 1 1 16 4975 1 1 8 THR CA C -3.866 -3.119 -0.528 1.00 . A A . 8 THR CA 1 1 16 4976 1 1 8 THR CB C -5.083 -4.067 -0.547 1.00 . A A . 8 THR CB 1 1 16 4977 1 1 8 THR CG2 C -6.222 -3.615 0.374 1.00 . A A . 8 THR CG2 1 1 16 4978 1 1 8 THR H H -2.883 -4.499 -1.748 1.00 . A A . 8 THR H 1 1 16 4979 1 1 8 THR HA H -4.218 -2.106 -0.721 1.00 . A A . 8 THR HA 1 1 16 4980 1 1 8 THR HB H -4.758 -5.060 -0.239 1.00 . A A . 8 THR HB 1 1 16 4981 1 1 8 THR HG1 H -6.442 -4.651 -1.913 1.00 . A A . 8 THR HG1 1 1 16 4982 1 1 8 THR HG21 H -6.570 -2.629 0.065 1.00 . A A . 8 THR HG21 1 1 16 4983 1 1 8 THR HG22 H -7.045 -4.328 0.311 1.00 . A A . 8 THR HG22 1 1 16 4984 1 1 8 THR HG23 H -5.862 -3.567 1.402 1.00 . A A . 8 THR HG23 1 1 16 4985 1 1 8 THR N N -2.939 -3.508 -1.619 1.00 . A A . 8 THR N 1 1 16 4986 1 1 8 THR O O -3.628 -2.579 1.819 1.00 . A A . 8 THR O 1 1 16 4987 1 1 8 THR OG1 O -5.584 -4.140 -1.887 1.00 . A A . 8 THR OG1 1 1 16 4988 1 1 9 ARG C C 0.074 -2.788 2.017 1.00 . A A . 9 ARG C 1 1 16 4989 1 1 9 ARG CA C -1.103 -3.773 2.065 1.00 . A A . 9 ARG CA 1 1 16 4990 1 1 9 ARG CB C -0.636 -5.211 2.247 1.00 . A A . 9 ARG CB 1 1 16 4991 1 1 9 ARG CD C -0.344 -6.855 4.031 1.00 . A A . 9 ARG CD 1 1 16 4992 1 1 9 ARG CG C -0.075 -5.410 3.650 1.00 . A A . 9 ARG CG 1 1 16 4993 1 1 9 ARG CZ C 0.473 -8.408 5.781 1.00 . A A . 9 ARG CZ 1 1 16 4994 1 1 9 ARG H H -1.620 -4.253 0.081 1.00 . A A . 9 ARG H 1 1 16 4995 1 1 9 ARG HA H -1.725 -3.511 2.921 1.00 . A A . 9 ARG HA 1 1 16 4996 1 1 9 ARG HB2 H -1.479 -5.885 2.096 1.00 . A A . 9 ARG HB2 1 1 16 4997 1 1 9 ARG HB3 H 0.139 -5.433 1.514 1.00 . A A . 9 ARG HB3 1 1 16 4998 1 1 9 ARG HD2 H -1.415 -7.000 4.165 1.00 . A A . 9 ARG HD2 1 1 16 4999 1 1 9 ARG HD3 H 0.014 -7.512 3.238 1.00 . A A . 9 ARG HD3 1 1 16 5000 1 1 9 ARG HE H 0.747 -6.407 5.777 1.00 . A A . 9 ARG HE 1 1 16 5001 1 1 9 ARG HG2 H 0.998 -5.219 3.651 1.00 . A A . 9 ARG HG2 1 1 16 5002 1 1 9 ARG HG3 H -0.571 -4.739 4.351 1.00 . A A . 9 ARG HG3 1 1 16 5003 1 1 9 ARG HH11 H -0.621 -9.300 4.360 1.00 . A A . 9 ARG HH11 1 1 16 5004 1 1 9 ARG HH12 H 0.015 -10.370 5.569 1.00 . A A . 9 ARG HH12 1 1 16 5005 1 1 9 ARG HH21 H 1.597 -7.833 7.358 1.00 . A A . 9 ARG HH21 1 1 16 5006 1 1 9 ARG HH22 H 1.254 -9.527 7.253 1.00 . A A . 9 ARG HH22 1 1 16 5007 1 1 9 ARG N N -1.945 -3.716 0.857 1.00 . A A . 9 ARG N 1 1 16 5008 1 1 9 ARG NE N 0.352 -7.179 5.284 1.00 . A A . 9 ARG NE 1 1 16 5009 1 1 9 ARG NH1 N -0.088 -9.454 5.192 1.00 . A A . 9 ARG NH1 1 1 16 5010 1 1 9 ARG NH2 N 1.164 -8.602 6.893 1.00 . A A . 9 ARG NH2 1 1 16 5011 1 1 9 ARG O O 0.209 -1.961 2.916 1.00 . A A . 9 ARG O 1 1 16 5012 1 1 10 TRP C C 1.317 -0.356 0.694 1.00 . A A . 10 TRP C 1 1 16 5013 1 1 10 TRP CA C 1.895 -1.789 0.703 1.00 . A A . 10 TRP CA 1 1 16 5014 1 1 10 TRP CB C 2.708 -2.174 -0.541 1.00 . A A . 10 TRP CB 1 1 16 5015 1 1 10 TRP CD1 C 2.272 -0.797 -2.623 1.00 . A A . 10 TRP CD1 1 1 16 5016 1 1 10 TRP CD2 C 3.918 -0.018 -1.406 1.00 . A A . 10 TRP CD2 1 1 16 5017 1 1 10 TRP CE2 C 3.724 0.811 -2.504 1.00 . A A . 10 TRP CE2 1 1 16 5018 1 1 10 TRP CE3 C 4.893 0.285 -0.460 1.00 . A A . 10 TRP CE3 1 1 16 5019 1 1 10 TRP CG C 2.975 -1.026 -1.525 1.00 . A A . 10 TRP CG 1 1 16 5020 1 1 10 TRP CH2 C 5.483 2.251 -1.715 1.00 . A A . 10 TRP CH2 1 1 16 5021 1 1 10 TRP CZ2 C 4.520 1.940 -2.669 1.00 . A A . 10 TRP CZ2 1 1 16 5022 1 1 10 TRP CZ3 C 5.661 1.435 -0.611 1.00 . A A . 10 TRP CZ3 1 1 16 5023 1 1 10 TRP H H 0.886 -3.596 0.307 1.00 . A A . 10 TRP H 1 1 16 5024 1 1 10 TRP HA H 2.581 -1.840 1.548 1.00 . A A . 10 TRP HA 1 1 16 5025 1 1 10 TRP HB2 H 3.666 -2.581 -0.216 1.00 . A A . 10 TRP HB2 1 1 16 5026 1 1 10 TRP HB3 H 2.165 -2.955 -1.073 1.00 . A A . 10 TRP HB3 1 1 16 5027 1 1 10 TRP HD1 H 1.442 -1.415 -2.979 1.00 . A A . 10 TRP HD1 1 1 16 5028 1 1 10 TRP HE1 H 2.368 0.686 -4.071 1.00 . A A . 10 TRP HE1 1 1 16 5029 1 1 10 TRP HE3 H 5.122 -0.422 0.334 1.00 . A A . 10 TRP HE3 1 1 16 5030 1 1 10 TRP HH2 H 6.076 3.162 -1.826 1.00 . A A . 10 TRP HH2 1 1 16 5031 1 1 10 TRP HZ2 H 4.444 2.531 -3.579 1.00 . A A . 10 TRP HZ2 1 1 16 5032 1 1 10 TRP HZ3 H 6.352 1.731 0.182 1.00 . A A . 10 TRP HZ3 1 1 16 5033 1 1 10 TRP N N 0.862 -2.821 0.941 1.00 . A A . 10 TRP N 1 1 16 5034 1 1 10 TRP NE1 N 2.720 0.306 -3.212 1.00 . A A . 10 TRP NE1 1 1 16 5035 1 1 10 TRP O O 1.886 0.523 1.342 1.00 . A A . 10 TRP O 1 1 16 5036 1 1 11 ALA C C -1.092 1.514 1.701 1.00 . A A . 11 ALA C 1 1 16 5037 1 1 11 ALA CA C -0.698 1.040 0.290 1.00 . A A . 11 ALA CA 1 1 16 5038 1 1 11 ALA CB C -1.967 0.970 -0.560 1.00 . A A . 11 ALA CB 1 1 16 5039 1 1 11 ALA H H -0.449 -1.018 -0.100 1.00 . A A . 11 ALA H 1 1 16 5040 1 1 11 ALA HA H -0.061 1.811 -0.143 1.00 . A A . 11 ALA HA 1 1 16 5041 1 1 11 ALA HB1 H -2.557 1.874 -0.408 1.00 . A A . 11 ALA HB1 1 1 16 5042 1 1 11 ALA HB2 H -1.695 0.886 -1.612 1.00 . A A . 11 ALA HB2 1 1 16 5043 1 1 11 ALA HB3 H -2.553 0.099 -0.265 1.00 . A A . 11 ALA HB3 1 1 16 5044 1 1 11 ALA N N 0.061 -0.231 0.248 1.00 . A A . 11 ALA N 1 1 16 5045 1 1 11 ALA O O -1.608 2.616 1.873 1.00 . A A . 11 ALA O 1 1 16 5046 1 1 12 HIS C C 0.411 1.306 4.845 1.00 . A A . 12 HIS C 1 1 16 5047 1 1 12 HIS CA C -0.929 1.038 4.131 1.00 . A A . 12 HIS CA 1 1 16 5048 1 1 12 HIS CB C -1.662 -0.124 4.805 1.00 . A A . 12 HIS CB 1 1 16 5049 1 1 12 HIS CD2 C -3.998 0.773 4.146 1.00 . A A . 12 HIS CD2 1 1 16 5050 1 1 12 HIS CE1 C -5.171 -0.051 5.754 1.00 . A A . 12 HIS CE1 1 1 16 5051 1 1 12 HIS CG C -3.192 0.048 4.923 1.00 . A A . 12 HIS CG 1 1 16 5052 1 1 12 HIS H H -0.305 -0.176 2.541 1.00 . A A . 12 HIS H 1 1 16 5053 1 1 12 HIS HA H -1.549 1.932 4.207 1.00 . A A . 12 HIS HA 1 1 16 5054 1 1 12 HIS HB2 H -1.467 -1.027 4.227 1.00 . A A . 12 HIS HB2 1 1 16 5055 1 1 12 HIS HB3 H -1.251 -0.258 5.806 1.00 . A A . 12 HIS HB3 1 1 16 5056 1 1 12 HIS HD1 H -3.570 -1.059 6.632 1.00 . A A . 12 HIS HD1 1 1 16 5057 1 1 12 HIS HD2 H -3.711 1.310 3.254 1.00 . A A . 12 HIS HD2 1 1 16 5058 1 1 12 HIS HE1 H -5.998 -0.298 6.401 1.00 . A A . 12 HIS HE1 1 1 16 5059 1 1 12 HIS HE2 H -6.045 1.175 4.307 1.00 . A A . 12 HIS HE2 1 1 16 5060 1 1 12 HIS N N -0.753 0.708 2.705 1.00 . A A . 12 HIS N 1 1 16 5061 1 1 12 HIS ND1 N -3.906 -0.459 5.896 1.00 . A A . 12 HIS ND1 1 1 16 5062 1 1 12 HIS NE2 N -5.222 0.716 4.671 1.00 . A A . 12 HIS NE2 1 1 16 5063 1 1 12 HIS O O 0.464 1.436 6.066 1.00 . A A . 12 HIS O 1 1 16 5064 1 1 13 TYR C C 3.318 3.111 4.054 1.00 . A A . 13 TYR C 1 1 16 5065 1 1 13 TYR CA C 2.829 1.733 4.527 1.00 . A A . 13 TYR CA 1 1 16 5066 1 1 13 TYR CB C 3.722 0.616 3.986 1.00 . A A . 13 TYR CB 1 1 16 5067 1 1 13 TYR CD1 C 4.371 -0.810 5.921 1.00 . A A . 13 TYR CD1 1 1 16 5068 1 1 13 TYR CD2 C 6.001 0.758 5.086 1.00 . A A . 13 TYR CD2 1 1 16 5069 1 1 13 TYR CE1 C 5.284 -1.280 6.850 1.00 . A A . 13 TYR CE1 1 1 16 5070 1 1 13 TYR CE2 C 6.921 0.292 6.014 1.00 . A A . 13 TYR CE2 1 1 16 5071 1 1 13 TYR CG C 4.735 0.195 5.042 1.00 . A A . 13 TYR CG 1 1 16 5072 1 1 13 TYR CZ C 6.558 -0.720 6.901 1.00 . A A . 13 TYR CZ 1 1 16 5073 1 1 13 TYR H H 1.398 1.259 3.066 1.00 . A A . 13 TYR H 1 1 16 5074 1 1 13 TYR HA H 2.837 1.703 5.617 1.00 . A A . 13 TYR HA 1 1 16 5075 1 1 13 TYR HB2 H 3.104 -0.240 3.716 1.00 . A A . 13 TYR HB2 1 1 16 5076 1 1 13 TYR HB3 H 4.250 0.975 3.103 1.00 . A A . 13 TYR HB3 1 1 16 5077 1 1 13 TYR HD1 H 3.355 -1.207 5.898 1.00 . A A . 13 TYR HD1 1 1 16 5078 1 1 13 TYR HD2 H 6.272 1.570 4.411 1.00 . A A . 13 TYR HD2 1 1 16 5079 1 1 13 TYR HE1 H 5.019 -2.140 7.464 1.00 . A A . 13 TYR HE1 1 1 16 5080 1 1 13 TYR HE2 H 7.946 0.661 5.995 1.00 . A A . 13 TYR HE2 1 1 16 5081 1 1 13 TYR HH H 7.001 -1.835 8.403 1.00 . A A . 13 TYR HH 1 1 16 5082 1 1 13 TYR N N 1.461 1.477 4.043 1.00 . A A . 13 TYR N 1 1 16 5083 1 1 13 TYR O O 3.330 4.082 4.813 1.00 . A A . 13 TYR O 1 1 16 5084 1 1 13 TYR OH O 7.440 -1.142 7.834 1.00 . A A . 13 TYR OH 1 1 16 5085 1 1 14 ASN C C 2.706 5.531 2.248 1.00 . A A . 14 ASN C 1 1 16 5086 1 1 14 ASN CA C 3.830 4.495 2.076 1.00 . A A . 14 ASN CA 1 1 16 5087 1 1 14 ASN CB C 4.095 4.294 0.583 1.00 . A A . 14 ASN CB 1 1 16 5088 1 1 14 ASN CG C 2.847 3.778 -0.139 1.00 . A A . 14 ASN CG 1 1 16 5089 1 1 14 ASN H H 3.468 2.424 2.126 1.00 . A A . 14 ASN H 1 1 16 5090 1 1 14 ASN HA H 4.736 4.901 2.527 1.00 . A A . 14 ASN HA 1 1 16 5091 1 1 14 ASN HB2 H 4.397 5.243 0.142 1.00 . A A . 14 ASN HB2 1 1 16 5092 1 1 14 ASN HB3 H 4.900 3.569 0.461 1.00 . A A . 14 ASN HB3 1 1 16 5093 1 1 14 ASN HD21 H 2.103 5.658 -0.305 1.00 . A A . 14 ASN HD21 1 1 16 5094 1 1 14 ASN HD22 H 1.132 4.386 -0.932 1.00 . A A . 14 ASN HD22 1 1 16 5095 1 1 14 ASN N N 3.521 3.215 2.742 1.00 . A A . 14 ASN N 1 1 16 5096 1 1 14 ASN ND2 N 1.958 4.681 -0.452 1.00 . A A . 14 ASN ND2 1 1 16 5097 1 1 14 ASN O O 2.906 6.686 1.910 1.00 . A A . 14 ASN O 1 1 16 5098 1 1 14 ASN OD1 O 2.588 2.592 -0.243 1.00 . A A . 14 ASN OD1 1 1 16 5099 1 1 15 ALA C C 0.843 7.252 3.873 1.00 . A A . 15 ALA C 1 1 16 5100 1 1 15 ALA CA C 0.406 6.042 3.019 1.00 . A A . 15 ALA CA 1 1 16 5101 1 1 15 ALA CB C -0.698 5.254 3.727 1.00 . A A . 15 ALA CB 1 1 16 5102 1 1 15 ALA H H 1.340 4.160 2.895 1.00 . A A . 15 ALA H 1 1 16 5103 1 1 15 ALA HA H 0.005 6.416 2.077 1.00 . A A . 15 ALA HA 1 1 16 5104 1 1 15 ALA HB1 H -0.993 4.406 3.110 1.00 . A A . 15 ALA HB1 1 1 16 5105 1 1 15 ALA HB2 H -0.329 4.895 4.687 1.00 . A A . 15 ALA HB2 1 1 16 5106 1 1 15 ALA HB3 H -1.560 5.902 3.889 1.00 . A A . 15 ALA HB3 1 1 16 5107 1 1 15 ALA N N 1.525 5.124 2.711 1.00 . A A . 15 ALA N 1 1 16 5108 1 1 15 ALA O O 0.406 8.375 3.631 1.00 . A A . 15 ALA O 1 1 16 5109 1 1 16 LEU C C 3.890 8.563 4.846 1.00 . A A . 16 LEU C 1 1 16 5110 1 1 16 LEU CA C 2.567 8.068 5.463 1.00 . A A . 16 LEU CA 1 1 16 5111 1 1 16 LEU CB C 2.783 7.528 6.879 1.00 . A A . 16 LEU CB 1 1 16 5112 1 1 16 LEU CD1 C 1.987 7.670 9.248 1.00 . A A . 16 LEU CD1 1 1 16 5113 1 1 16 LEU CD2 C 2.988 9.692 8.176 1.00 . A A . 16 LEU CD2 1 1 16 5114 1 1 16 LEU CG C 2.143 8.438 7.934 1.00 . A A . 16 LEU CG 1 1 16 5115 1 1 16 LEU H H 2.303 6.116 4.718 1.00 . A A . 16 LEU H 1 1 16 5116 1 1 16 LEU HA H 1.892 8.922 5.532 1.00 . A A . 16 LEU HA 1 1 16 5117 1 1 16 LEU HB2 H 2.340 6.536 6.951 1.00 . A A . 16 LEU HB2 1 1 16 5118 1 1 16 LEU HB3 H 3.853 7.455 7.074 1.00 . A A . 16 LEU HB3 1 1 16 5119 1 1 16 LEU HD11 H 1.386 6.777 9.078 1.00 . A A . 16 LEU HD11 1 1 16 5120 1 1 16 LEU HD12 H 1.493 8.306 9.983 1.00 . A A . 16 LEU HD12 1 1 16 5121 1 1 16 LEU HD13 H 2.970 7.381 9.619 1.00 . A A . 16 LEU HD13 1 1 16 5122 1 1 16 LEU HD21 H 3.971 9.402 8.547 1.00 . A A . 16 LEU HD21 1 1 16 5123 1 1 16 LEU HD22 H 3.101 10.242 7.241 1.00 . A A . 16 LEU HD22 1 1 16 5124 1 1 16 LEU HD23 H 2.494 10.326 8.912 1.00 . A A . 16 LEU HD23 1 1 16 5125 1 1 16 LEU HG H 1.155 8.741 7.584 1.00 . A A . 16 LEU HG 1 1 16 5126 1 1 16 LEU N N 1.898 7.029 4.659 1.00 . A A . 16 LEU N 1 1 16 5127 1 1 16 LEU O O 4.196 9.750 4.927 1.00 . A A . 16 LEU O 1 1 16 5128 1 1 17 ILE C C 5.529 8.648 1.990 1.00 . A A . 17 ILE C 1 1 16 5129 1 1 17 ILE CA C 5.830 8.006 3.376 1.00 . A A . 17 ILE CA 1 1 16 5130 1 1 17 ILE CB C 6.719 6.740 3.252 1.00 . A A . 17 ILE CB 1 1 16 5131 1 1 17 ILE CD1 C 7.347 4.519 4.440 1.00 . A A . 17 ILE CD1 1 1 16 5132 1 1 17 ILE CG1 C 6.784 5.942 4.570 1.00 . A A . 17 ILE CG1 1 1 16 5133 1 1 17 ILE CG2 C 8.153 7.138 2.858 1.00 . A A . 17 ILE CG2 1 1 16 5134 1 1 17 ILE H H 4.310 6.726 4.063 1.00 . A A . 17 ILE H 1 1 16 5135 1 1 17 ILE HA H 6.383 8.739 3.964 1.00 . A A . 17 ILE HA 1 1 16 5136 1 1 17 ILE HB H 6.306 6.097 2.473 1.00 . A A . 17 ILE HB 1 1 16 5137 1 1 17 ILE HD11 H 6.723 3.943 3.757 1.00 . A A . 17 ILE HD11 1 1 16 5138 1 1 17 ILE HD12 H 7.353 4.040 5.419 1.00 . A A . 17 ILE HD12 1 1 16 5139 1 1 17 ILE HD13 H 8.365 4.565 4.052 1.00 . A A . 17 ILE HD13 1 1 16 5140 1 1 17 ILE HG12 H 7.400 6.495 5.278 1.00 . A A . 17 ILE HG12 1 1 16 5141 1 1 17 ILE HG13 H 5.774 5.871 4.972 1.00 . A A . 17 ILE HG13 1 1 16 5142 1 1 17 ILE HG21 H 8.130 7.704 1.926 1.00 . A A . 17 ILE HG21 1 1 16 5143 1 1 17 ILE HG22 H 8.588 7.753 3.646 1.00 . A A . 17 ILE HG22 1 1 16 5144 1 1 17 ILE HG23 H 8.755 6.239 2.723 1.00 . A A . 17 ILE HG23 1 1 16 5145 1 1 17 ILE N N 4.586 7.683 4.121 1.00 . A A . 17 ILE N 1 1 16 5146 1 1 17 ILE O O 6.409 8.832 1.151 1.00 . A A . 17 ILE O 1 1 16 5147 1 1 18 ARG C C 3.466 11.130 0.749 1.00 . A A . 18 ARG C 1 1 16 5148 1 1 18 ARG CA C 3.808 9.657 0.520 1.00 . A A . 18 ARG CA 1 1 16 5149 1 1 18 ARG CB C 2.560 8.992 -0.070 1.00 . A A . 18 ARG CB 1 1 16 5150 1 1 18 ARG CD C 1.717 8.334 -2.311 1.00 . A A . 18 ARG CD 1 1 16 5151 1 1 18 ARG CG C 2.878 8.185 -1.326 1.00 . A A . 18 ARG CG 1 1 16 5152 1 1 18 ARG CZ C 0.463 6.173 -2.388 1.00 . A A . 18 ARG CZ 1 1 16 5153 1 1 18 ARG H H 3.538 8.624 2.330 1.00 . A A . 18 ARG H 1 1 16 5154 1 1 18 ARG HA H 4.610 9.600 -0.216 1.00 . A A . 18 ARG HA 1 1 16 5155 1 1 18 ARG HB2 H 2.125 8.329 0.678 1.00 . A A . 18 ARG HB2 1 1 16 5156 1 1 18 ARG HB3 H 1.835 9.766 -0.323 1.00 . A A . 18 ARG HB3 1 1 16 5157 1 1 18 ARG HD2 H 0.852 8.742 -1.789 1.00 . A A . 18 ARG HD2 1 1 16 5158 1 1 18 ARG HD3 H 2.008 9.012 -3.113 1.00 . A A . 18 ARG HD3 1 1 16 5159 1 1 18 ARG HE H 1.824 6.796 -3.741 1.00 . A A . 18 ARG HE 1 1 16 5160 1 1 18 ARG HG2 H 3.795 8.560 -1.780 1.00 . A A . 18 ARG HG2 1 1 16 5161 1 1 18 ARG HG3 H 3.003 7.134 -1.064 1.00 . A A . 18 ARG HG3 1 1 16 5162 1 1 18 ARG HH11 H -0.010 7.277 -0.780 1.00 . A A . 18 ARG HH11 1 1 16 5163 1 1 18 ARG HH12 H -0.841 5.762 -0.883 1.00 . A A . 18 ARG HH12 1 1 16 5164 1 1 18 ARG HH21 H 0.761 4.781 -3.820 1.00 . A A . 18 ARG HH21 1 1 16 5165 1 1 18 ARG HH22 H -0.412 4.367 -2.619 1.00 . A A . 18 ARG HH22 1 1 16 5166 1 1 18 ARG N N 4.265 8.999 1.759 1.00 . A A . 18 ARG N 1 1 16 5167 1 1 18 ARG NE N 1.366 7.023 -2.885 1.00 . A A . 18 ARG NE 1 1 16 5168 1 1 18 ARG NH1 N -0.175 6.409 -1.250 1.00 . A A . 18 ARG NH1 1 1 16 5169 1 1 18 ARG NH2 N 0.263 5.004 -2.984 1.00 . A A . 18 ARG NH2 1 1 16 5170 1 1 18 ARG O O 3.916 11.982 -0.010 1.00 . A A . 18 ARG O 1 1 16 5171 1 1 19 ALA C C 1.337 13.326 0.989 1.00 . A A . 19 ALA C 1 1 16 5172 1 1 19 ALA CA C 2.145 12.716 2.154 1.00 . A A . 19 ALA CA 1 1 16 5173 1 1 19 ALA CB C 3.269 13.636 2.656 1.00 . A A . 19 ALA CB 1 1 16 5174 1 1 19 ALA H H 2.390 10.650 2.412 1.00 . A A . 19 ALA H 1 1 16 5175 1 1 19 ALA HA H 1.452 12.574 2.983 1.00 . A A . 19 ALA HA 1 1 16 5176 1 1 19 ALA HB1 H 2.854 14.611 2.913 1.00 . A A . 19 ALA HB1 1 1 16 5177 1 1 19 ALA HB2 H 3.732 13.195 3.538 1.00 . A A . 19 ALA HB2 1 1 16 5178 1 1 19 ALA HB3 H 4.018 13.755 1.874 1.00 . A A . 19 ALA HB3 1 1 16 5179 1 1 19 ALA N N 2.674 11.384 1.797 1.00 . A A . 19 ALA N 1 1 16 5180 1 1 19 ALA O O 1.781 14.183 0.227 1.00 . A A . 19 ALA O 1 1 16 5181 1 1 20 PHE C C -1.996 13.987 0.424 1.00 . A A . 20 PHE C 1 1 16 5182 1 1 20 PHE CA C -0.835 13.181 -0.189 1.00 . A A . 20 PHE CA 1 1 16 5183 1 1 20 PHE CB C -1.330 11.913 -0.901 1.00 . A A . 20 PHE CB 1 1 16 5184 1 1 20 PHE CD1 C -3.769 12.224 -1.528 1.00 . A A . 20 PHE CD1 1 1 16 5185 1 1 20 PHE CD2 C -2.108 12.426 -3.255 1.00 . A A . 20 PHE CD2 1 1 16 5186 1 1 20 PHE CE1 C -4.768 12.523 -2.443 1.00 . A A . 20 PHE CE1 1 1 16 5187 1 1 20 PHE CE2 C -3.108 12.710 -4.176 1.00 . A A . 20 PHE CE2 1 1 16 5188 1 1 20 PHE CG C -2.438 12.183 -1.929 1.00 . A A . 20 PHE CG 1 1 16 5189 1 1 20 PHE CZ C -4.439 12.761 -3.772 1.00 . A A . 20 PHE CZ 1 1 16 5190 1 1 20 PHE H H -0.141 11.996 1.407 1.00 . A A . 20 PHE H 1 1 16 5191 1 1 20 PHE HA H -0.323 13.811 -0.917 1.00 . A A . 20 PHE HA 1 1 16 5192 1 1 20 PHE HB2 H -0.487 11.443 -1.408 1.00 . A A . 20 PHE HB2 1 1 16 5193 1 1 20 PHE HB3 H -1.716 11.224 -0.150 1.00 . A A . 20 PHE HB3 1 1 16 5194 1 1 20 PHE HD1 H -4.043 12.006 -0.495 1.00 . A A . 20 PHE HD1 1 1 16 5195 1 1 20 PHE HD2 H -1.064 12.397 -3.570 1.00 . A A . 20 PHE HD2 1 1 16 5196 1 1 20 PHE HE1 H -5.803 12.604 -2.111 1.00 . A A . 20 PHE HE1 1 1 16 5197 1 1 20 PHE HE2 H -2.852 12.868 -5.223 1.00 . A A . 20 PHE HE2 1 1 16 5198 1 1 20 PHE HZ H -5.224 12.959 -4.498 1.00 . A A . 20 PHE HZ 1 1 16 5199 1 1 20 PHE N N 0.137 12.777 0.850 1.00 . A A . 20 PHE N 1 1 16 5200 1 1 20 PHE O O -2.000 15.226 0.264 1.00 . A A . 20 PHE O 1 1 17 5201 1 1 1 HIS C C -7.739 -12.399 -6.575 1.00 . A A . 1 HIS C 1 1 17 5202 1 1 1 HIS CA C -9.077 -11.680 -6.846 1.00 . A A . 1 HIS CA 1 1 17 5203 1 1 1 HIS CB C -8.945 -10.737 -8.050 1.00 . A A . 1 HIS CB 1 1 17 5204 1 1 1 HIS CD2 C -10.921 -9.117 -8.005 1.00 . A A . 1 HIS CD2 1 1 17 5205 1 1 1 HIS CE1 C -12.086 -9.822 -9.675 1.00 . A A . 1 HIS CE1 1 1 17 5206 1 1 1 HIS CG C -10.287 -10.153 -8.547 1.00 . A A . 1 HIS CG 1 1 17 5207 1 1 1 HIS H1 H -8.990 -10.949 -4.826 1.00 . A A . 1 HIS H1 1 1 17 5208 1 1 1 HIS HA H -9.821 -12.438 -7.093 1.00 . A A . 1 HIS HA 1 1 17 5209 1 1 1 HIS HB2 H -8.296 -9.908 -7.766 1.00 . A A . 1 HIS HB2 1 1 17 5210 1 1 1 HIS HB3 H -8.477 -11.281 -8.870 1.00 . A A . 1 HIS HB3 1 1 17 5211 1 1 1 HIS HD1 H -10.744 -11.323 -10.206 1.00 . A A . 1 HIS HD1 1 1 17 5212 1 1 1 HIS HD2 H -10.590 -8.542 -7.153 1.00 . A A . 1 HIS HD2 1 1 17 5213 1 1 1 HIS HE1 H -12.867 -9.923 -10.415 1.00 . A A . 1 HIS HE1 1 1 17 5214 1 1 1 HIS HE2 H -12.726 -8.203 -8.523 1.00 . A A . 1 HIS HE2 1 1 17 5215 1 1 1 HIS N N -9.562 -10.933 -5.658 1.00 . A A . 1 HIS N 1 1 17 5216 1 1 1 HIS ND1 N -10.991 -10.584 -9.570 1.00 . A A . 1 HIS ND1 1 1 17 5217 1 1 1 HIS NE2 N -12.036 -8.919 -8.702 1.00 . A A . 1 HIS NE2 1 1 17 5218 1 1 1 HIS O O -7.661 -13.625 -6.618 1.00 . A A . 1 HIS O 1 1 17 5219 1 1 2 GLY C C -4.405 -10.910 -5.642 1.00 . A A . 2 GLY C 1 1 17 5220 1 1 2 GLY CA C -5.369 -12.077 -5.893 1.00 . A A . 2 GLY CA 1 1 17 5221 1 1 2 GLY H H -6.803 -10.589 -6.293 1.00 . A A . 2 GLY H 1 1 17 5222 1 1 2 GLY HA2 H -5.449 -12.676 -4.986 1.00 . A A . 2 GLY HA2 1 1 17 5223 1 1 2 GLY HA3 H -4.976 -12.696 -6.699 1.00 . A A . 2 GLY HA3 1 1 17 5224 1 1 2 GLY N N -6.710 -11.588 -6.270 1.00 . A A . 2 GLY N 1 1 17 5225 1 1 2 GLY O O -4.463 -10.249 -4.604 1.00 . A A . 2 GLY O 1 1 17 5226 1 1 3 LEU C C -3.489 -8.031 -6.390 1.00 . A A . 3 LEU C 1 1 17 5227 1 1 3 LEU CA C -2.795 -9.368 -6.700 1.00 . A A . 3 LEU CA 1 1 17 5228 1 1 3 LEU CB C -1.979 -9.248 -7.994 1.00 . A A . 3 LEU CB 1 1 17 5229 1 1 3 LEU CD1 C -2.007 -7.825 -10.049 1.00 . A A . 3 LEU CD1 1 1 17 5230 1 1 3 LEU CD2 C -3.192 -10.040 -10.061 1.00 . A A . 3 LEU CD2 1 1 17 5231 1 1 3 LEU CG C -2.804 -8.827 -9.216 1.00 . A A . 3 LEU CG 1 1 17 5232 1 1 3 LEU H H -3.721 -11.062 -7.556 1.00 . A A . 3 LEU H 1 1 17 5233 1 1 3 LEU HA H -2.083 -9.548 -5.894 1.00 . A A . 3 LEU HA 1 1 17 5234 1 1 3 LEU HB2 H -1.197 -8.505 -7.837 1.00 . A A . 3 LEU HB2 1 1 17 5235 1 1 3 LEU HB3 H -1.512 -10.209 -8.203 1.00 . A A . 3 LEU HB3 1 1 17 5236 1 1 3 LEU HD11 H -2.594 -7.526 -10.918 1.00 . A A . 3 LEU HD11 1 1 17 5237 1 1 3 LEU HD12 H -1.077 -8.287 -10.381 1.00 . A A . 3 LEU HD12 1 1 17 5238 1 1 3 LEU HD13 H -1.781 -6.948 -9.444 1.00 . A A . 3 LEU HD13 1 1 17 5239 1 1 3 LEU HD21 H -3.803 -9.716 -10.903 1.00 . A A . 3 LEU HD21 1 1 17 5240 1 1 3 LEU HD22 H -3.760 -10.743 -9.450 1.00 . A A . 3 LEU HD22 1 1 17 5241 1 1 3 LEU HD23 H -2.291 -10.528 -10.432 1.00 . A A . 3 LEU HD23 1 1 17 5242 1 1 3 LEU HG H -3.716 -8.341 -8.868 1.00 . A A . 3 LEU HG 1 1 17 5243 1 1 3 LEU N N -3.724 -10.521 -6.717 1.00 . A A . 3 LEU N 1 1 17 5244 1 1 3 LEU O O -2.992 -7.252 -5.580 1.00 . A A . 3 LEU O 1 1 17 5245 1 1 4 ALA C C -5.751 -6.503 -5.065 1.00 . A A . 4 ALA C 1 1 17 5246 1 1 4 ALA CA C -5.595 -6.737 -6.579 1.00 . A A . 4 ALA CA 1 1 17 5247 1 1 4 ALA CB C -6.965 -6.951 -7.229 1.00 . A A . 4 ALA CB 1 1 17 5248 1 1 4 ALA H H -5.015 -8.424 -7.679 1.00 . A A . 4 ALA H 1 1 17 5249 1 1 4 ALA HA H -5.156 -5.839 -7.012 1.00 . A A . 4 ALA HA 1 1 17 5250 1 1 4 ALA HB1 H -6.838 -7.115 -8.299 1.00 . A A . 4 ALA HB1 1 1 17 5251 1 1 4 ALA HB2 H -7.447 -7.820 -6.782 1.00 . A A . 4 ALA HB2 1 1 17 5252 1 1 4 ALA HB3 H -7.585 -6.070 -7.067 1.00 . A A . 4 ALA HB3 1 1 17 5253 1 1 4 ALA N N -4.712 -7.876 -6.903 1.00 . A A . 4 ALA N 1 1 17 5254 1 1 4 ALA O O -5.705 -5.361 -4.635 1.00 . A A . 4 ALA O 1 1 17 5255 1 1 5 SER C C -4.301 -7.326 -2.172 1.00 . A A . 5 SER C 1 1 17 5256 1 1 5 SER CA C -5.686 -7.554 -2.812 1.00 . A A . 5 SER CA 1 1 17 5257 1 1 5 SER CB C -6.279 -8.874 -2.315 1.00 . A A . 5 SER CB 1 1 17 5258 1 1 5 SER H H -5.325 -8.455 -4.672 1.00 . A A . 5 SER H 1 1 17 5259 1 1 5 SER HA H -6.347 -6.741 -2.509 1.00 . A A . 5 SER HA 1 1 17 5260 1 1 5 SER HB2 H -7.125 -9.153 -2.943 1.00 . A A . 5 SER HB2 1 1 17 5261 1 1 5 SER HB3 H -5.519 -9.654 -2.359 1.00 . A A . 5 SER HB3 1 1 17 5262 1 1 5 SER HG H -7.122 -9.564 -0.632 1.00 . A A . 5 SER HG 1 1 17 5263 1 1 5 SER N N -5.619 -7.580 -4.289 1.00 . A A . 5 SER N 1 1 17 5264 1 1 5 SER O O -4.153 -6.504 -1.270 1.00 . A A . 5 SER O 1 1 17 5265 1 1 5 SER OG O -6.717 -8.713 -0.969 1.00 . A A . 5 SER OG 1 1 17 5266 1 1 6 THR C C -1.411 -6.234 -2.515 1.00 . A A . 6 THR C 1 1 17 5267 1 1 6 THR CA C -1.846 -7.710 -2.370 1.00 . A A . 6 THR CA 1 1 17 5268 1 1 6 THR CB C -0.870 -8.614 -3.148 1.00 . A A . 6 THR CB 1 1 17 5269 1 1 6 THR CG2 C -1.236 -10.099 -3.032 1.00 . A A . 6 THR CG2 1 1 17 5270 1 1 6 THR H H -3.406 -8.710 -3.374 1.00 . A A . 6 THR H 1 1 17 5271 1 1 6 THR HA H -1.749 -7.970 -1.316 1.00 . A A . 6 THR HA 1 1 17 5272 1 1 6 THR HB H 0.119 -8.483 -2.708 1.00 . A A . 6 THR HB 1 1 17 5273 1 1 6 THR HG1 H -1.557 -7.641 -4.794 1.00 . A A . 6 THR HG1 1 1 17 5274 1 1 6 THR HG21 H -1.212 -10.398 -1.984 1.00 . A A . 6 THR HG21 1 1 17 5275 1 1 6 THR HG22 H -0.519 -10.696 -3.597 1.00 . A A . 6 THR HG22 1 1 17 5276 1 1 6 THR HG23 H -2.237 -10.259 -3.432 1.00 . A A . 6 THR HG23 1 1 17 5277 1 1 6 THR N N -3.267 -7.943 -2.747 1.00 . A A . 6 THR N 1 1 17 5278 1 1 6 THR O O -0.590 -5.737 -1.744 1.00 . A A . 6 THR O 1 1 17 5279 1 1 6 THR OG1 O -0.783 -8.233 -4.525 1.00 . A A . 6 THR OG1 1 1 17 5280 1 1 7 LEU C C -2.958 -3.208 -2.855 1.00 . A A . 7 LEU C 1 1 17 5281 1 1 7 LEU CA C -1.942 -4.073 -3.627 1.00 . A A . 7 LEU CA 1 1 17 5282 1 1 7 LEU CB C -2.039 -3.757 -5.124 1.00 . A A . 7 LEU CB 1 1 17 5283 1 1 7 LEU CD1 C -0.975 -5.219 -6.881 1.00 . A A . 7 LEU CD1 1 1 17 5284 1 1 7 LEU CD2 C -0.210 -2.847 -6.568 1.00 . A A . 7 LEU CD2 1 1 17 5285 1 1 7 LEU CG C -0.746 -4.097 -5.868 1.00 . A A . 7 LEU CG 1 1 17 5286 1 1 7 LEU H H -2.795 -5.947 -3.993 1.00 . A A . 7 LEU H 1 1 17 5287 1 1 7 LEU HA H -0.943 -3.793 -3.291 1.00 . A A . 7 LEU HA 1 1 17 5288 1 1 7 LEU HB2 H -2.859 -4.332 -5.556 1.00 . A A . 7 LEU HB2 1 1 17 5289 1 1 7 LEU HB3 H -2.247 -2.694 -5.246 1.00 . A A . 7 LEU HB3 1 1 17 5290 1 1 7 LEU HD11 H -0.387 -5.025 -7.779 1.00 . A A . 7 LEU HD11 1 1 17 5291 1 1 7 LEU HD12 H -2.033 -5.263 -7.142 1.00 . A A . 7 LEU HD12 1 1 17 5292 1 1 7 LEU HD13 H -0.669 -6.170 -6.445 1.00 . A A . 7 LEU HD13 1 1 17 5293 1 1 7 LEU HD21 H -0.007 -2.074 -5.827 1.00 . A A . 7 LEU HD21 1 1 17 5294 1 1 7 LEU HD22 H 0.711 -3.093 -7.097 1.00 . A A . 7 LEU HD22 1 1 17 5295 1 1 7 LEU HD23 H -0.950 -2.482 -7.280 1.00 . A A . 7 LEU HD23 1 1 17 5296 1 1 7 LEU HG H -0.006 -4.431 -5.142 1.00 . A A . 7 LEU HG 1 1 17 5297 1 1 7 LEU N N -2.100 -5.524 -3.409 1.00 . A A . 7 LEU N 1 1 17 5298 1 1 7 LEU O O -2.875 -1.988 -2.913 1.00 . A A . 7 LEU O 1 1 17 5299 1 1 8 THR C C -4.184 -3.182 0.371 1.00 . A A . 8 THR C 1 1 17 5300 1 1 8 THR CA C -4.717 -3.203 -1.078 1.00 . A A . 8 THR CA 1 1 17 5301 1 1 8 THR CB C -6.075 -3.924 -1.208 1.00 . A A . 8 THR CB 1 1 17 5302 1 1 8 THR CG2 C -7.192 -3.404 -0.294 1.00 . A A . 8 THR CG2 1 1 17 5303 1 1 8 THR H H -3.779 -4.847 -1.963 1.00 . A A . 8 THR H 1 1 17 5304 1 1 8 THR HA H -4.851 -2.171 -1.402 1.00 . A A . 8 THR HA 1 1 17 5305 1 1 8 THR HB H -5.928 -4.986 -1.010 1.00 . A A . 8 THR HB 1 1 17 5306 1 1 8 THR HG1 H -7.331 -4.312 -2.727 1.00 . A A . 8 THR HG1 1 1 17 5307 1 1 8 THR HG21 H -7.380 -2.353 -0.513 1.00 . A A . 8 THR HG21 1 1 17 5308 1 1 8 THR HG22 H -8.101 -3.980 -0.466 1.00 . A A . 8 THR HG22 1 1 17 5309 1 1 8 THR HG23 H -6.888 -3.509 0.747 1.00 . A A . 8 THR HG23 1 1 17 5310 1 1 8 THR N N -3.739 -3.846 -1.987 1.00 . A A . 8 THR N 1 1 17 5311 1 1 8 THR O O -4.657 -2.415 1.204 1.00 . A A . 8 THR O 1 1 17 5312 1 1 8 THR OG1 O -6.512 -3.765 -2.557 1.00 . A A . 8 THR OG1 1 1 17 5313 1 1 9 ARG C C -1.177 -3.160 1.936 1.00 . A A . 9 ARG C 1 1 17 5314 1 1 9 ARG CA C -2.458 -4.010 1.932 1.00 . A A . 9 ARG CA 1 1 17 5315 1 1 9 ARG CB C -2.140 -5.456 2.311 1.00 . A A . 9 ARG CB 1 1 17 5316 1 1 9 ARG CD C -0.777 -6.394 4.214 1.00 . A A . 9 ARG CD 1 1 17 5317 1 1 9 ARG CG C -2.012 -5.579 3.829 1.00 . A A . 9 ARG CG 1 1 17 5318 1 1 9 ARG CZ C 0.305 -5.068 6.050 1.00 . A A . 9 ARG CZ 1 1 17 5319 1 1 9 ARG H H -2.805 -4.617 -0.055 1.00 . A A . 9 ARG H 1 1 17 5320 1 1 9 ARG HA H -3.139 -3.604 2.680 1.00 . A A . 9 ARG HA 1 1 17 5321 1 1 9 ARG HB2 H -2.943 -6.105 1.962 1.00 . A A . 9 ARG HB2 1 1 17 5322 1 1 9 ARG HB3 H -1.202 -5.755 1.843 1.00 . A A . 9 ARG HB3 1 1 17 5323 1 1 9 ARG HD2 H -1.059 -7.149 4.949 1.00 . A A . 9 ARG HD2 1 1 17 5324 1 1 9 ARG HD3 H -0.377 -6.885 3.326 1.00 . A A . 9 ARG HD3 1 1 17 5325 1 1 9 ARG HE H 0.945 -5.170 4.160 1.00 . A A . 9 ARG HE 1 1 17 5326 1 1 9 ARG HG2 H -1.929 -4.581 4.261 1.00 . A A . 9 ARG HG2 1 1 17 5327 1 1 9 ARG HG3 H -2.902 -6.067 4.225 1.00 . A A . 9 ARG HG3 1 1 17 5328 1 1 9 ARG HH11 H -1.435 -5.868 6.665 1.00 . A A . 9 ARG HH11 1 1 17 5329 1 1 9 ARG HH12 H -0.593 -4.924 7.852 1.00 . A A . 9 ARG HH12 1 1 17 5330 1 1 9 ARG HH21 H 1.983 -3.959 5.780 1.00 . A A . 9 ARG HH21 1 1 17 5331 1 1 9 ARG HH22 H 1.315 -3.946 7.367 1.00 . A A . 9 ARG HH22 1 1 17 5332 1 1 9 ARG N N -3.131 -3.961 0.620 1.00 . A A . 9 ARG N 1 1 17 5333 1 1 9 ARG NE N 0.255 -5.512 4.793 1.00 . A A . 9 ARG NE 1 1 17 5334 1 1 9 ARG NH1 N -0.652 -5.311 6.934 1.00 . A A . 9 ARG NH1 1 1 17 5335 1 1 9 ARG NH2 N 1.318 -4.305 6.435 1.00 . A A . 9 ARG NH2 1 1 17 5336 1 1 9 ARG O O -1.104 -2.185 2.671 1.00 . A A . 9 ARG O 1 1 17 5337 1 1 10 TRP C C 0.583 -1.055 0.600 1.00 . A A . 10 TRP C 1 1 17 5338 1 1 10 TRP CA C 0.948 -2.535 0.861 1.00 . A A . 10 TRP CA 1 1 17 5339 1 1 10 TRP CB C 1.877 -3.153 -0.194 1.00 . A A . 10 TRP CB 1 1 17 5340 1 1 10 TRP CD1 C 1.925 -1.988 -2.449 1.00 . A A . 10 TRP CD1 1 1 17 5341 1 1 10 TRP CD2 C 3.447 -1.248 -1.054 1.00 . A A . 10 TRP CD2 1 1 17 5342 1 1 10 TRP CE2 C 3.519 -0.528 -2.240 1.00 . A A . 10 TRP CE2 1 1 17 5343 1 1 10 TRP CE3 C 4.286 -0.939 0.010 1.00 . A A . 10 TRP CE3 1 1 17 5344 1 1 10 TRP CG C 2.425 -2.165 -1.232 1.00 . A A . 10 TRP CG 1 1 17 5345 1 1 10 TRP CH2 C 5.276 0.822 -1.296 1.00 . A A . 10 TRP CH2 1 1 17 5346 1 1 10 TRP CZ2 C 4.450 0.497 -2.368 1.00 . A A . 10 TRP CZ2 1 1 17 5347 1 1 10 TRP CZ3 C 5.189 0.113 -0.110 1.00 . A A . 10 TRP CZ3 1 1 17 5348 1 1 10 TRP H H -0.215 -4.258 0.492 1.00 . A A . 10 TRP H 1 1 17 5349 1 1 10 TRP HA H 1.489 -2.561 1.807 1.00 . A A . 10 TRP HA 1 1 17 5350 1 1 10 TRP HB2 H 2.723 -3.606 0.323 1.00 . A A . 10 TRP HB2 1 1 17 5351 1 1 10 TRP HB3 H 1.332 -3.938 -0.718 1.00 . A A . 10 TRP HB3 1 1 17 5352 1 1 10 TRP HD1 H 1.092 -2.550 -2.874 1.00 . A A . 10 TRP HD1 1 1 17 5353 1 1 10 TRP HE1 H 2.441 -0.719 -4.006 1.00 . A A . 10 TRP HE1 1 1 17 5354 1 1 10 TRP HE3 H 4.329 -1.593 0.880 1.00 . A A . 10 TRP HE3 1 1 17 5355 1 1 10 TRP HH2 H 6.043 1.589 -1.419 1.00 . A A . 10 TRP HH2 1 1 17 5356 1 1 10 TRP HZ2 H 4.640 0.935 -3.348 1.00 . A A . 10 TRP HZ2 1 1 17 5357 1 1 10 TRP HZ3 H 5.838 0.368 0.731 1.00 . A A . 10 TRP HZ3 1 1 17 5358 1 1 10 TRP N N -0.237 -3.412 1.024 1.00 . A A . 10 TRP N 1 1 17 5359 1 1 10 TRP NE1 N 2.588 -1.007 -3.057 1.00 . A A . 10 TRP NE1 1 1 17 5360 1 1 10 TRP O O 1.264 -0.138 1.067 1.00 . A A . 10 TRP O 1 1 17 5361 1 1 11 ALA C C -1.669 1.165 1.047 1.00 . A A . 11 ALA C 1 1 17 5362 1 1 11 ALA CA C -1.168 0.485 -0.239 1.00 . A A . 11 ALA CA 1 1 17 5363 1 1 11 ALA CB C -2.311 0.407 -1.248 1.00 . A A . 11 ALA CB 1 1 17 5364 1 1 11 ALA H H -1.145 -1.613 -0.330 1.00 . A A . 11 ALA H 1 1 17 5365 1 1 11 ALA HA H -0.395 1.124 -0.667 1.00 . A A . 11 ALA HA 1 1 17 5366 1 1 11 ALA HB1 H -2.860 1.348 -1.249 1.00 . A A . 11 ALA HB1 1 1 17 5367 1 1 11 ALA HB2 H -2.984 -0.406 -0.974 1.00 . A A . 11 ALA HB2 1 1 17 5368 1 1 11 ALA HB3 H -1.906 0.223 -2.243 1.00 . A A . 11 ALA HB3 1 1 17 5369 1 1 11 ALA N N -0.575 -0.850 -0.029 1.00 . A A . 11 ALA N 1 1 17 5370 1 1 11 ALA O O -2.059 2.327 1.007 1.00 . A A . 11 ALA O 1 1 17 5371 1 1 12 HIS C C -0.690 1.724 4.140 1.00 . A A . 12 HIS C 1 1 17 5372 1 1 12 HIS CA C -1.913 1.021 3.511 1.00 . A A . 12 HIS CA 1 1 17 5373 1 1 12 HIS CB C -2.533 -0.073 4.402 1.00 . A A . 12 HIS CB 1 1 17 5374 1 1 12 HIS CD2 C -1.018 -1.811 5.567 1.00 . A A . 12 HIS CD2 1 1 17 5375 1 1 12 HIS CE1 C -0.422 -0.677 7.305 1.00 . A A . 12 HIS CE1 1 1 17 5376 1 1 12 HIS CG C -1.628 -0.631 5.525 1.00 . A A . 12 HIS CG 1 1 17 5377 1 1 12 HIS H H -1.280 -0.490 2.201 1.00 . A A . 12 HIS H 1 1 17 5378 1 1 12 HIS HA H -2.678 1.783 3.361 1.00 . A A . 12 HIS HA 1 1 17 5379 1 1 12 HIS HB2 H -3.437 0.329 4.859 1.00 . A A . 12 HIS HB2 1 1 17 5380 1 1 12 HIS HB3 H -2.817 -0.906 3.758 1.00 . A A . 12 HIS HB3 1 1 17 5381 1 1 12 HIS HD1 H -1.491 1.019 6.759 1.00 . A A . 12 HIS HD1 1 1 17 5382 1 1 12 HIS HD2 H -1.116 -2.609 4.845 1.00 . A A . 12 HIS HD2 1 1 17 5383 1 1 12 HIS HE1 H 0.052 -0.387 8.232 1.00 . A A . 12 HIS HE1 1 1 17 5384 1 1 12 HIS HE2 H 0.329 -2.585 6.959 1.00 . A A . 12 HIS HE2 1 1 17 5385 1 1 12 HIS N N -1.588 0.468 2.182 1.00 . A A . 12 HIS N 1 1 17 5386 1 1 12 HIS ND1 N -1.275 0.051 6.587 1.00 . A A . 12 HIS ND1 1 1 17 5387 1 1 12 HIS NE2 N -0.265 -1.824 6.664 1.00 . A A . 12 HIS NE2 1 1 17 5388 1 1 12 HIS O O -0.834 2.522 5.065 1.00 . A A . 12 HIS O 1 1 17 5389 1 1 13 TYR C C 1.993 3.287 3.575 1.00 . A A . 13 TYR C 1 1 17 5390 1 1 13 TYR CA C 1.797 1.869 4.135 1.00 . A A . 13 TYR CA 1 1 17 5391 1 1 13 TYR CB C 2.923 0.910 3.718 1.00 . A A . 13 TYR CB 1 1 17 5392 1 1 13 TYR CD1 C 4.891 1.412 5.216 1.00 . A A . 13 TYR CD1 1 1 17 5393 1 1 13 TYR CD2 C 5.009 2.123 2.921 1.00 . A A . 13 TYR CD2 1 1 17 5394 1 1 13 TYR CE1 C 6.156 1.937 5.443 1.00 . A A . 13 TYR CE1 1 1 17 5395 1 1 13 TYR CE2 C 6.267 2.658 3.145 1.00 . A A . 13 TYR CE2 1 1 17 5396 1 1 13 TYR CG C 4.321 1.495 3.954 1.00 . A A . 13 TYR CG 1 1 17 5397 1 1 13 TYR CZ C 6.840 2.561 4.406 1.00 . A A . 13 TYR CZ 1 1 17 5398 1 1 13 TYR H H 0.570 0.642 2.960 1.00 . A A . 13 TYR H 1 1 17 5399 1 1 13 TYR HA H 1.790 1.930 5.223 1.00 . A A . 13 TYR HA 1 1 17 5400 1 1 13 TYR HB2 H 2.828 -0.010 4.294 1.00 . A A . 13 TYR HB2 1 1 17 5401 1 1 13 TYR HB3 H 2.813 0.675 2.659 1.00 . A A . 13 TYR HB3 1 1 17 5402 1 1 13 TYR HD1 H 4.329 0.972 6.039 1.00 . A A . 13 TYR HD1 1 1 17 5403 1 1 13 TYR HD2 H 4.562 2.222 1.932 1.00 . A A . 13 TYR HD2 1 1 17 5404 1 1 13 TYR HE1 H 6.621 1.797 6.418 1.00 . A A . 13 TYR HE1 1 1 17 5405 1 1 13 TYR HE2 H 6.795 3.163 2.334 1.00 . A A . 13 TYR HE2 1 1 17 5406 1 1 13 TYR HH H 8.279 3.051 5.593 1.00 . A A . 13 TYR HH 1 1 17 5407 1 1 13 TYR N N 0.501 1.317 3.697 1.00 . A A . 13 TYR N 1 1 17 5408 1 1 13 TYR O O 1.719 4.266 4.268 1.00 . A A . 13 TYR O 1 1 17 5409 1 1 13 TYR OH O 8.075 3.078 4.617 1.00 . A A . 13 TYR OH 1 1 17 5410 1 1 14 ASN C C 1.288 5.531 1.655 1.00 . A A . 14 ASN C 1 1 17 5411 1 1 14 ASN CA C 2.513 4.608 1.539 1.00 . A A . 14 ASN CA 1 1 17 5412 1 1 14 ASN CB C 2.842 4.356 0.059 1.00 . A A . 14 ASN CB 1 1 17 5413 1 1 14 ASN CG C 1.617 3.930 -0.759 1.00 . A A . 14 ASN CG 1 1 17 5414 1 1 14 ASN H H 2.570 2.523 1.779 1.00 . A A . 14 ASN H 1 1 17 5415 1 1 14 ASN HA H 3.363 5.128 1.983 1.00 . A A . 14 ASN HA 1 1 17 5416 1 1 14 ASN HB2 H 3.255 5.268 -0.372 1.00 . A A . 14 ASN HB2 1 1 17 5417 1 1 14 ASN HB3 H 3.592 3.567 -0.001 1.00 . A A . 14 ASN HB3 1 1 17 5418 1 1 14 ASN HD21 H 2.169 1.976 -0.832 1.00 . A A . 14 ASN HD21 1 1 17 5419 1 1 14 ASN HD22 H 0.611 2.426 -1.476 1.00 . A A . 14 ASN HD22 1 1 17 5420 1 1 14 ASN N N 2.320 3.348 2.283 1.00 . A A . 14 ASN N 1 1 17 5421 1 1 14 ASN ND2 N 1.457 2.653 -0.998 1.00 . A A . 14 ASN ND2 1 1 17 5422 1 1 14 ASN O O 1.444 6.732 1.573 1.00 . A A . 14 ASN O 1 1 17 5423 1 1 14 ASN OD1 O 0.759 4.725 -1.112 1.00 . A A . 14 ASN OD1 1 1 17 5424 1 1 15 ALA C C -0.902 6.889 3.216 1.00 . A A . 15 ALA C 1 1 17 5425 1 1 15 ALA CA C -1.115 5.773 2.174 1.00 . A A . 15 ALA CA 1 1 17 5426 1 1 15 ALA CB C -2.243 4.858 2.650 1.00 . A A . 15 ALA CB 1 1 17 5427 1 1 15 ALA H H 0.010 3.993 2.054 1.00 . A A . 15 ALA H 1 1 17 5428 1 1 15 ALA HA H -1.411 6.229 1.229 1.00 . A A . 15 ALA HA 1 1 17 5429 1 1 15 ALA HB1 H -2.803 5.354 3.443 1.00 . A A . 15 ALA HB1 1 1 17 5430 1 1 15 ALA HB2 H -2.910 4.639 1.816 1.00 . A A . 15 ALA HB2 1 1 17 5431 1 1 15 ALA HB3 H -1.820 3.928 3.032 1.00 . A A . 15 ALA HB3 1 1 17 5432 1 1 15 ALA N N 0.113 4.979 1.952 1.00 . A A . 15 ALA N 1 1 17 5433 1 1 15 ALA O O -1.179 8.052 2.942 1.00 . A A . 15 ALA O 1 1 17 5434 1 1 16 LEU C C 1.677 7.816 5.338 1.00 . A A . 16 LEU C 1 1 17 5435 1 1 16 LEU CA C 0.180 7.446 5.379 1.00 . A A . 16 LEU CA 1 1 17 5436 1 1 16 LEU CB C -0.180 6.789 6.718 1.00 . A A . 16 LEU CB 1 1 17 5437 1 1 16 LEU CD1 C -1.139 8.589 8.235 1.00 . A A . 16 LEU CD1 1 1 17 5438 1 1 16 LEU CD2 C 0.516 6.875 9.127 1.00 . A A . 16 LEU CD2 1 1 17 5439 1 1 16 LEU CG C 0.072 7.705 7.923 1.00 . A A . 16 LEU CG 1 1 17 5440 1 1 16 LEU H H 0.139 5.590 4.384 1.00 . A A . 16 LEU H 1 1 17 5441 1 1 16 LEU HA H -0.403 8.360 5.276 1.00 . A A . 16 LEU HA 1 1 17 5442 1 1 16 LEU HB2 H -1.234 6.510 6.701 1.00 . A A . 16 LEU HB2 1 1 17 5443 1 1 16 LEU HB3 H 0.420 5.887 6.836 1.00 . A A . 16 LEU HB3 1 1 17 5444 1 1 16 LEU HD11 H -0.916 9.221 9.094 1.00 . A A . 16 LEU HD11 1 1 17 5445 1 1 16 LEU HD12 H -1.362 9.216 7.372 1.00 . A A . 16 LEU HD12 1 1 17 5446 1 1 16 LEU HD13 H -2.000 7.961 8.459 1.00 . A A . 16 LEU HD13 1 1 17 5447 1 1 16 LEU HD21 H -0.263 6.156 9.380 1.00 . A A . 16 LEU HD21 1 1 17 5448 1 1 16 LEU HD22 H 0.693 7.534 9.977 1.00 . A A . 16 LEU HD22 1 1 17 5449 1 1 16 LEU HD23 H 1.436 6.344 8.881 1.00 . A A . 16 LEU HD23 1 1 17 5450 1 1 16 LEU HG H 0.898 8.366 7.661 1.00 . A A . 16 LEU HG 1 1 17 5451 1 1 16 LEU N N -0.194 6.527 4.284 1.00 . A A . 16 LEU N 1 1 17 5452 1 1 16 LEU O O 2.058 8.891 5.792 1.00 . A A . 16 LEU O 1 1 17 5453 1 1 17 ILE C C 4.221 7.856 3.261 1.00 . A A . 17 ILE C 1 1 17 5454 1 1 17 ILE CA C 3.963 7.133 4.614 1.00 . A A . 17 ILE CA 1 1 17 5455 1 1 17 ILE CB C 4.699 5.770 4.738 1.00 . A A . 17 ILE CB 1 1 17 5456 1 1 17 ILE CD1 C 4.779 5.581 7.370 1.00 . A A . 17 ILE CD1 1 1 17 5457 1 1 17 ILE CG1 C 4.345 4.984 6.020 1.00 . A A . 17 ILE CG1 1 1 17 5458 1 1 17 ILE CG2 C 6.227 5.890 4.610 1.00 . A A . 17 ILE CG2 1 1 17 5459 1 1 17 ILE H H 2.190 5.995 4.559 1.00 . A A . 17 ILE H 1 1 17 5460 1 1 17 ILE HA H 4.319 7.781 5.415 1.00 . A A . 17 ILE HA 1 1 17 5461 1 1 17 ILE HB H 4.364 5.160 3.898 1.00 . A A . 17 ILE HB 1 1 17 5462 1 1 17 ILE HD11 H 4.317 6.559 7.499 1.00 . A A . 17 ILE HD11 1 1 17 5463 1 1 17 ILE HD12 H 4.463 4.921 8.177 1.00 . A A . 17 ILE HD12 1 1 17 5464 1 1 17 ILE HD13 H 5.864 5.685 7.389 1.00 . A A . 17 ILE HD13 1 1 17 5465 1 1 17 ILE HG12 H 3.261 4.875 6.046 1.00 . A A . 17 ILE HG12 1 1 17 5466 1 1 17 ILE HG13 H 4.781 3.988 5.937 1.00 . A A . 17 ILE HG13 1 1 17 5467 1 1 17 ILE HG21 H 6.706 5.182 5.287 1.00 . A A . 17 ILE HG21 1 1 17 5468 1 1 17 ILE HG22 H 6.535 6.903 4.868 1.00 . A A . 17 ILE HG22 1 1 17 5469 1 1 17 ILE HG23 H 6.524 5.669 3.585 1.00 . A A . 17 ILE HG23 1 1 17 5470 1 1 17 ILE N N 2.509 6.910 4.818 1.00 . A A . 17 ILE N 1 1 17 5471 1 1 17 ILE O O 5.325 7.870 2.713 1.00 . A A . 17 ILE O 1 1 17 5472 1 1 18 ARG C C 4.305 10.355 1.578 1.00 . A A . 18 ARG C 1 1 17 5473 1 1 18 ARG CA C 3.272 9.241 1.446 1.00 . A A . 18 ARG CA 1 1 17 5474 1 1 18 ARG CB C 1.943 9.878 1.028 1.00 . A A . 18 ARG CB 1 1 17 5475 1 1 18 ARG CD C 0.692 10.064 -1.163 1.00 . A A . 18 ARG CD 1 1 17 5476 1 1 18 ARG CG C 1.320 9.117 -0.143 1.00 . A A . 18 ARG CG 1 1 17 5477 1 1 18 ARG CZ C -1.517 9.091 -1.805 1.00 . A A . 18 ARG CZ 1 1 17 5478 1 1 18 ARG H H 2.239 8.244 2.968 1.00 . A A . 18 ARG H 1 1 17 5479 1 1 18 ARG HA H 3.594 8.570 0.649 1.00 . A A . 18 ARG HA 1 1 17 5480 1 1 18 ARG HB2 H 1.255 9.862 1.874 1.00 . A A . 18 ARG HB2 1 1 17 5481 1 1 18 ARG HB3 H 2.121 10.911 0.729 1.00 . A A . 18 ARG HB3 1 1 17 5482 1 1 18 ARG HD2 H 0.131 10.840 -0.643 1.00 . A A . 18 ARG HD2 1 1 17 5483 1 1 18 ARG HD3 H 1.476 10.523 -1.765 1.00 . A A . 18 ARG HD3 1 1 17 5484 1 1 18 ARG HE H 0.199 8.876 -2.836 1.00 . A A . 18 ARG HE 1 1 17 5485 1 1 18 ARG HG2 H 2.096 8.531 -0.636 1.00 . A A . 18 ARG HG2 1 1 17 5486 1 1 18 ARG HG3 H 0.553 8.444 0.238 1.00 . A A . 18 ARG HG3 1 1 17 5487 1 1 18 ARG HH11 H -1.550 9.978 -0.005 1.00 . A A . 18 ARG HH11 1 1 17 5488 1 1 18 ARG HH12 H -3.076 9.352 -0.534 1.00 . A A . 18 ARG HH12 1 1 17 5489 1 1 18 ARG HH21 H -1.825 8.013 -3.488 1.00 . A A . 18 ARG HH21 1 1 17 5490 1 1 18 ARG HH22 H -3.209 8.242 -2.473 1.00 . A A . 18 ARG HH22 1 1 17 5491 1 1 18 ARG N N 3.174 8.460 2.695 1.00 . A A . 18 ARG N 1 1 17 5492 1 1 18 ARG NE N -0.217 9.299 -2.035 1.00 . A A . 18 ARG NE 1 1 17 5493 1 1 18 ARG NH1 N -2.107 9.516 -0.697 1.00 . A A . 18 ARG NH1 1 1 17 5494 1 1 18 ARG NH2 N -2.241 8.393 -2.668 1.00 . A A . 18 ARG NH2 1 1 17 5495 1 1 18 ARG O O 4.590 10.839 2.671 1.00 . A A . 18 ARG O 1 1 17 5496 1 1 19 ALA C C 7.127 11.363 1.317 1.00 . A A . 19 ALA C 1 1 17 5497 1 1 19 ALA CA C 5.997 11.648 0.308 1.00 . A A . 19 ALA CA 1 1 17 5498 1 1 19 ALA CB C 5.403 13.058 0.464 1.00 . A A . 19 ALA CB 1 1 17 5499 1 1 19 ALA H H 4.712 10.127 -0.394 1.00 . A A . 19 ALA H 1 1 17 5500 1 1 19 ALA HA H 6.415 11.569 -0.696 1.00 . A A . 19 ALA HA 1 1 17 5501 1 1 19 ALA HB1 H 6.196 13.800 0.368 1.00 . A A . 19 ALA HB1 1 1 17 5502 1 1 19 ALA HB2 H 4.654 13.225 -0.309 1.00 . A A . 19 ALA HB2 1 1 17 5503 1 1 19 ALA HB3 H 4.937 13.150 1.446 1.00 . A A . 19 ALA HB3 1 1 17 5504 1 1 19 ALA N N 4.931 10.634 0.437 1.00 . A A . 19 ALA N 1 1 17 5505 1 1 19 ALA O O 7.387 12.119 2.250 1.00 . A A . 19 ALA O 1 1 17 5506 1 1 20 PHE C C 8.483 9.801 3.541 1.00 . A A . 20 PHE C 1 1 17 5507 1 1 20 PHE CA C 8.816 9.697 2.030 1.00 . A A . 20 PHE CA 1 1 17 5508 1 1 20 PHE CB C 10.130 10.359 1.578 1.00 . A A . 20 PHE CB 1 1 17 5509 1 1 20 PHE CD1 C 11.842 9.162 3.013 1.00 . A A . 20 PHE CD1 1 1 17 5510 1 1 20 PHE CD2 C 11.532 11.537 3.286 1.00 . A A . 20 PHE CD2 1 1 17 5511 1 1 20 PHE CE1 C 12.741 9.163 4.071 1.00 . A A . 20 PHE CE1 1 1 17 5512 1 1 20 PHE CE2 C 12.430 11.536 4.343 1.00 . A A . 20 PHE CE2 1 1 17 5513 1 1 20 PHE CG C 11.247 10.352 2.620 1.00 . A A . 20 PHE CG 1 1 17 5514 1 1 20 PHE CZ C 13.040 10.349 4.732 1.00 . A A . 20 PHE CZ 1 1 17 5515 1 1 20 PHE H H 7.550 9.612 0.351 1.00 . A A . 20 PHE H 1 1 17 5516 1 1 20 PHE HA H 8.922 8.634 1.816 1.00 . A A . 20 PHE HA 1 1 17 5517 1 1 20 PHE HB2 H 10.486 9.846 0.685 1.00 . A A . 20 PHE HB2 1 1 17 5518 1 1 20 PHE HB3 H 9.915 11.396 1.319 1.00 . A A . 20 PHE HB3 1 1 17 5519 1 1 20 PHE HD1 H 11.546 8.222 2.547 1.00 . A A . 20 PHE HD1 1 1 17 5520 1 1 20 PHE HD2 H 10.965 12.439 3.052 1.00 . A A . 20 PHE HD2 1 1 17 5521 1 1 20 PHE HE1 H 13.207 8.230 4.388 1.00 . A A . 20 PHE HE1 1 1 17 5522 1 1 20 PHE HE2 H 12.628 12.461 4.885 1.00 . A A . 20 PHE HE2 1 1 17 5523 1 1 20 PHE HZ H 13.783 10.358 5.529 1.00 . A A . 20 PHE HZ 1 1 17 5524 1 1 20 PHE N N 7.744 10.194 1.136 1.00 . A A . 20 PHE N 1 1 17 5525 1 1 20 PHE O O 8.848 10.807 4.192 1.00 . A A . 20 PHE O 1 1 18 5526 1 1 1 HIS C C -5.836 -12.499 -5.771 1.00 . A A . 1 HIS C 1 1 18 5527 1 1 1 HIS CA C -7.260 -11.968 -6.072 1.00 . A A . 1 HIS CA 1 1 18 5528 1 1 1 HIS CB C -8.258 -13.116 -6.299 1.00 . A A . 1 HIS CB 1 1 18 5529 1 1 1 HIS CD2 C -10.330 -11.831 -5.468 1.00 . A A . 1 HIS CD2 1 1 18 5530 1 1 1 HIS CE1 C -11.461 -13.436 -4.580 1.00 . A A . 1 HIS CE1 1 1 18 5531 1 1 1 HIS CG C -9.622 -12.946 -5.593 1.00 . A A . 1 HIS CG 1 1 18 5532 1 1 1 HIS H1 H -6.439 -10.832 -7.693 1.00 . A A . 1 HIS H1 1 1 18 5533 1 1 1 HIS HA H -7.592 -11.426 -5.186 1.00 . A A . 1 HIS HA 1 1 18 5534 1 1 1 HIS HB2 H -8.440 -13.199 -7.370 1.00 . A A . 1 HIS HB2 1 1 18 5535 1 1 1 HIS HB3 H -7.803 -14.044 -5.953 1.00 . A A . 1 HIS HB3 1 1 18 5536 1 1 1 HIS HD1 H -10.039 -14.897 -4.999 1.00 . A A . 1 HIS HD1 1 1 18 5537 1 1 1 HIS HD2 H -10.039 -10.851 -5.815 1.00 . A A . 1 HIS HD2 1 1 18 5538 1 1 1 HIS HE1 H -12.242 -13.989 -4.080 1.00 . A A . 1 HIS HE1 1 1 18 5539 1 1 1 HIS HE2 H -12.202 -11.488 -4.597 1.00 . A A . 1 HIS HE2 1 1 18 5540 1 1 1 HIS N N -7.305 -11.015 -7.206 1.00 . A A . 1 HIS N 1 1 18 5541 1 1 1 HIS ND1 N -10.312 -13.941 -5.051 1.00 . A A . 1 HIS ND1 1 1 18 5542 1 1 1 HIS NE2 N -11.466 -12.136 -4.838 1.00 . A A . 1 HIS NE2 1 1 18 5543 1 1 1 HIS O O -5.528 -13.684 -5.893 1.00 . A A . 1 HIS O 1 1 18 5544 1 1 2 GLY C C -2.770 -10.474 -4.940 1.00 . A A . 2 GLY C 1 1 18 5545 1 1 2 GLY CA C -3.529 -11.780 -5.205 1.00 . A A . 2 GLY CA 1 1 18 5546 1 1 2 GLY H H -5.232 -10.562 -5.438 1.00 . A A . 2 GLY H 1 1 18 5547 1 1 2 GLY HA2 H -3.451 -12.420 -4.326 1.00 . A A . 2 GLY HA2 1 1 18 5548 1 1 2 GLY HA3 H -3.078 -12.289 -6.057 1.00 . A A . 2 GLY HA3 1 1 18 5549 1 1 2 GLY N N -4.958 -11.528 -5.491 1.00 . A A . 2 GLY N 1 1 18 5550 1 1 2 GLY O O -2.805 -9.936 -3.835 1.00 . A A . 2 GLY O 1 1 18 5551 1 1 3 LEU C C -2.490 -7.412 -5.470 1.00 . A A . 3 LEU C 1 1 18 5552 1 1 3 LEU CA C -1.604 -8.564 -5.975 1.00 . A A . 3 LEU CA 1 1 18 5553 1 1 3 LEU CB C -0.956 -8.177 -7.312 1.00 . A A . 3 LEU CB 1 1 18 5554 1 1 3 LEU CD1 C -1.374 -6.722 -9.298 1.00 . A A . 3 LEU CD1 1 1 18 5555 1 1 3 LEU CD2 C -2.285 -9.058 -9.273 1.00 . A A . 3 LEU CD2 1 1 18 5556 1 1 3 LEU CG C -1.956 -7.829 -8.422 1.00 . A A . 3 LEU CG 1 1 18 5557 1 1 3 LEU H H -2.309 -10.315 -6.924 1.00 . A A . 3 LEU H 1 1 18 5558 1 1 3 LEU HA H -0.793 -8.674 -5.255 1.00 . A A . 3 LEU HA 1 1 18 5559 1 1 3 LEU HB2 H -0.306 -7.318 -7.148 1.00 . A A . 3 LEU HB2 1 1 18 5560 1 1 3 LEU HB3 H -0.348 -9.015 -7.651 1.00 . A A . 3 LEU HB3 1 1 18 5561 1 1 3 LEU HD11 H -2.082 -6.473 -10.088 1.00 . A A . 3 LEU HD11 1 1 18 5562 1 1 3 LEU HD12 H -1.184 -5.838 -8.688 1.00 . A A . 3 LEU HD12 1 1 18 5563 1 1 3 LEU HD13 H -0.439 -7.063 -9.743 1.00 . A A . 3 LEU HD13 1 1 18 5564 1 1 3 LEU HD21 H -1.377 -9.422 -9.753 1.00 . A A . 3 LEU HD21 1 1 18 5565 1 1 3 LEU HD22 H -2.700 -9.841 -8.637 1.00 . A A . 3 LEU HD22 1 1 18 5566 1 1 3 LEU HD23 H -3.015 -8.786 -10.036 1.00 . A A . 3 LEU HD23 1 1 18 5567 1 1 3 LEU HG H -2.875 -7.465 -7.963 1.00 . A A . 3 LEU HG 1 1 18 5568 1 1 3 LEU N N -2.305 -9.869 -6.030 1.00 . A A . 3 LEU N 1 1 18 5569 1 1 3 LEU O O -2.063 -6.633 -4.620 1.00 . A A . 3 LEU O 1 1 18 5570 1 1 4 ALA C C -4.873 -6.463 -3.813 1.00 . A A . 4 ALA C 1 1 18 5571 1 1 4 ALA CA C -4.798 -6.516 -5.352 1.00 . A A . 4 ALA CA 1 1 18 5572 1 1 4 ALA CB C -6.160 -6.881 -5.948 1.00 . A A . 4 ALA CB 1 1 18 5573 1 1 4 ALA H H -4.085 -8.086 -6.549 1.00 . A A . 4 ALA H 1 1 18 5574 1 1 4 ALA HA H -4.532 -5.521 -5.709 1.00 . A A . 4 ALA HA 1 1 18 5575 1 1 4 ALA HB1 H -6.084 -6.913 -7.035 1.00 . A A . 4 ALA HB1 1 1 18 5576 1 1 4 ALA HB2 H -6.896 -6.133 -5.657 1.00 . A A . 4 ALA HB2 1 1 18 5577 1 1 4 ALA HB3 H -6.469 -7.858 -5.576 1.00 . A A . 4 ALA HB3 1 1 18 5578 1 1 4 ALA N N -3.773 -7.462 -5.837 1.00 . A A . 4 ALA N 1 1 18 5579 1 1 4 ALA O O -5.008 -5.382 -3.259 1.00 . A A . 4 ALA O 1 1 18 5580 1 1 5 SER C C -3.018 -7.244 -1.193 1.00 . A A . 5 SER C 1 1 18 5581 1 1 5 SER CA C -4.385 -7.724 -1.713 1.00 . A A . 5 SER CA 1 1 18 5582 1 1 5 SER CB C -4.593 -9.190 -1.315 1.00 . A A . 5 SER CB 1 1 18 5583 1 1 5 SER H H -4.079 -8.325 -3.691 1.00 . A A . 5 SER H 1 1 18 5584 1 1 5 SER HA H -5.164 -7.124 -1.244 1.00 . A A . 5 SER HA 1 1 18 5585 1 1 5 SER HB2 H -5.624 -9.476 -1.520 1.00 . A A . 5 SER HB2 1 1 18 5586 1 1 5 SER HB3 H -3.922 -9.820 -1.900 1.00 . A A . 5 SER HB3 1 1 18 5587 1 1 5 SER HG H -4.285 -10.354 0.297 1.00 . A A . 5 SER HG 1 1 18 5588 1 1 5 SER N N -4.495 -7.576 -3.180 1.00 . A A . 5 SER N 1 1 18 5589 1 1 5 SER O O -2.953 -6.459 -0.255 1.00 . A A . 5 SER O 1 1 18 5590 1 1 5 SER OG O -4.319 -9.378 0.075 1.00 . A A . 5 SER OG 1 1 18 5591 1 1 6 THR C C -0.408 -5.635 -1.560 1.00 . A A . 6 THR C 1 1 18 5592 1 1 6 THR CA C -0.560 -7.171 -1.564 1.00 . A A . 6 THR CA 1 1 18 5593 1 1 6 THR CB C 0.490 -7.800 -2.500 1.00 . A A . 6 THR CB 1 1 18 5594 1 1 6 THR CG2 C 0.416 -9.333 -2.506 1.00 . A A . 6 THR CG2 1 1 18 5595 1 1 6 THR H H -1.992 -8.368 -2.550 1.00 . A A . 6 THR H 1 1 18 5596 1 1 6 THR HA H -0.333 -7.516 -0.555 1.00 . A A . 6 THR HA 1 1 18 5597 1 1 6 THR HB H 1.475 -7.519 -2.128 1.00 . A A . 6 THR HB 1 1 18 5598 1 1 6 THR HG1 H -0.527 -6.845 -3.975 1.00 . A A . 6 THR HG1 1 1 18 5599 1 1 6 THR HG21 H 0.592 -9.708 -1.498 1.00 . A A . 6 THR HG21 1 1 18 5600 1 1 6 THR HG22 H 1.175 -9.732 -3.180 1.00 . A A . 6 THR HG22 1 1 18 5601 1 1 6 THR HG23 H -0.571 -9.647 -2.843 1.00 . A A . 6 THR HG23 1 1 18 5602 1 1 6 THR N N -1.940 -7.629 -1.878 1.00 . A A . 6 THR N 1 1 18 5603 1 1 6 THR O O 0.352 -5.074 -0.770 1.00 . A A . 6 THR O 1 1 18 5604 1 1 6 THR OG1 O 0.368 -7.293 -3.832 1.00 . A A . 6 THR OG1 1 1 18 5605 1 1 7 LEU C C -2.520 -2.946 -1.452 1.00 . A A . 7 LEU C 1 1 18 5606 1 1 7 LEU CA C -1.427 -3.512 -2.379 1.00 . A A . 7 LEU CA 1 1 18 5607 1 1 7 LEU CB C -1.726 -3.101 -3.826 1.00 . A A . 7 LEU CB 1 1 18 5608 1 1 7 LEU CD1 C -0.779 -4.050 -5.949 1.00 . A A . 7 LEU CD1 1 1 18 5609 1 1 7 LEU CD2 C -0.065 -1.784 -5.158 1.00 . A A . 7 LEU CD2 1 1 18 5610 1 1 7 LEU CG C -0.488 -3.189 -4.721 1.00 . A A . 7 LEU CG 1 1 18 5611 1 1 7 LEU H H -1.948 -5.469 -2.890 1.00 . A A . 7 LEU H 1 1 18 5612 1 1 7 LEU HA H -0.474 -3.069 -2.090 1.00 . A A . 7 LEU HA 1 1 18 5613 1 1 7 LEU HB2 H -2.496 -3.761 -4.226 1.00 . A A . 7 LEU HB2 1 1 18 5614 1 1 7 LEU HB3 H -2.097 -2.076 -3.834 1.00 . A A . 7 LEU HB3 1 1 18 5615 1 1 7 LEU HD11 H -1.080 -5.048 -5.631 1.00 . A A . 7 LEU HD11 1 1 18 5616 1 1 7 LEU HD12 H -1.584 -3.596 -6.528 1.00 . A A . 7 LEU HD12 1 1 18 5617 1 1 7 LEU HD13 H 0.118 -4.119 -6.565 1.00 . A A . 7 LEU HD13 1 1 18 5618 1 1 7 LEU HD21 H -0.880 -1.316 -5.711 1.00 . A A . 7 LEU HD21 1 1 18 5619 1 1 7 LEU HD22 H 0.817 -1.850 -5.795 1.00 . A A . 7 LEU HD22 1 1 18 5620 1 1 7 LEU HD23 H 0.167 -1.184 -4.277 1.00 . A A . 7 LEU HD23 1 1 18 5621 1 1 7 LEU HG H 0.326 -3.643 -4.156 1.00 . A A . 7 LEU HG 1 1 18 5622 1 1 7 LEU N N -1.291 -4.979 -2.318 1.00 . A A . 7 LEU N 1 1 18 5623 1 1 7 LEU O O -2.744 -1.742 -1.441 1.00 . A A . 7 LEU O 1 1 18 5624 1 1 8 THR C C -3.378 -3.423 1.861 1.00 . A A . 8 THR C 1 1 18 5625 1 1 8 THR CA C -4.048 -3.429 0.470 1.00 . A A . 8 THR CA 1 1 18 5626 1 1 8 THR CB C -5.249 -4.397 0.383 1.00 . A A . 8 THR CB 1 1 18 5627 1 1 8 THR CG2 C -6.338 -4.206 1.444 1.00 . A A . 8 THR CG2 1 1 18 5628 1 1 8 THR H H -2.948 -4.781 -0.677 1.00 . A A . 8 THR H 1 1 18 5629 1 1 8 THR HA H -4.411 -2.421 0.264 1.00 . A A . 8 THR HA 1 1 18 5630 1 1 8 THR HB H -4.874 -5.419 0.453 1.00 . A A . 8 THR HB 1 1 18 5631 1 1 8 THR HG1 H -6.618 -4.846 -1.020 1.00 . A A . 8 THR HG1 1 1 18 5632 1 1 8 THR HG21 H -6.750 -3.200 1.364 1.00 . A A . 8 THR HG21 1 1 18 5633 1 1 8 THR HG22 H -7.131 -4.937 1.289 1.00 . A A . 8 THR HG22 1 1 18 5634 1 1 8 THR HG23 H -5.907 -4.343 2.436 1.00 . A A . 8 THR HG23 1 1 18 5635 1 1 8 THR N N -3.067 -3.788 -0.582 1.00 . A A . 8 THR N 1 1 18 5636 1 1 8 THR O O -3.909 -2.867 2.820 1.00 . A A . 8 THR O 1 1 18 5637 1 1 8 THR OG1 O -5.846 -4.222 -0.901 1.00 . A A . 8 THR OG1 1 1 18 5638 1 1 9 ARG C C -0.201 -2.997 3.122 1.00 . A A . 9 ARG C 1 1 18 5639 1 1 9 ARG CA C -1.360 -3.997 3.173 1.00 . A A . 9 ARG CA 1 1 18 5640 1 1 9 ARG CB C -0.780 -5.372 3.505 1.00 . A A . 9 ARG CB 1 1 18 5641 1 1 9 ARG CD C -2.235 -7.206 2.595 1.00 . A A . 9 ARG CD 1 1 18 5642 1 1 9 ARG CG C -1.834 -6.425 3.845 1.00 . A A . 9 ARG CG 1 1 18 5643 1 1 9 ARG CZ C -1.445 -9.522 3.119 1.00 . A A . 9 ARG CZ 1 1 18 5644 1 1 9 ARG H H -1.809 -4.514 1.172 1.00 . A A . 9 ARG H 1 1 18 5645 1 1 9 ARG HA H -2.011 -3.706 3.997 1.00 . A A . 9 ARG HA 1 1 18 5646 1 1 9 ARG HB2 H -0.198 -5.722 2.652 1.00 . A A . 9 ARG HB2 1 1 18 5647 1 1 9 ARG HB3 H -0.114 -5.266 4.362 1.00 . A A . 9 ARG HB3 1 1 18 5648 1 1 9 ARG HD2 H -3.169 -6.809 2.198 1.00 . A A . 9 ARG HD2 1 1 18 5649 1 1 9 ARG HD3 H -1.452 -7.122 1.841 1.00 . A A . 9 ARG HD3 1 1 18 5650 1 1 9 ARG HE H -3.359 -8.884 3.152 1.00 . A A . 9 ARG HE 1 1 18 5651 1 1 9 ARG HG2 H -1.426 -7.115 4.583 1.00 . A A . 9 ARG HG2 1 1 18 5652 1 1 9 ARG HG3 H -2.713 -5.932 4.259 1.00 . A A . 9 ARG HG3 1 1 18 5653 1 1 9 ARG HH11 H 0.078 -8.330 2.571 1.00 . A A . 9 ARG HH11 1 1 18 5654 1 1 9 ARG HH12 H 0.533 -9.946 2.998 1.00 . A A . 9 ARG HH12 1 1 18 5655 1 1 9 ARG HH21 H -2.694 -10.975 3.755 1.00 . A A . 9 ARG HH21 1 1 18 5656 1 1 9 ARG HH22 H -1.025 -11.418 3.641 1.00 . A A . 9 ARG HH22 1 1 18 5657 1 1 9 ARG N N -2.172 -3.988 1.938 1.00 . A A . 9 ARG N 1 1 18 5658 1 1 9 ARG NE N -2.417 -8.618 2.967 1.00 . A A . 9 ARG NE 1 1 18 5659 1 1 9 ARG NH1 N -0.170 -9.250 2.871 1.00 . A A . 9 ARG NH1 1 1 18 5660 1 1 9 ARG NH2 N -1.751 -10.745 3.525 1.00 . A A . 9 ARG NH2 1 1 18 5661 1 1 9 ARG O O -0.128 -2.108 3.966 1.00 . A A . 9 ARG O 1 1 18 5662 1 1 10 TRP C C 1.186 -0.649 1.716 1.00 . A A . 10 TRP C 1 1 18 5663 1 1 10 TRP CA C 1.718 -2.091 1.870 1.00 . A A . 10 TRP CA 1 1 18 5664 1 1 10 TRP CB C 2.602 -2.582 0.713 1.00 . A A . 10 TRP CB 1 1 18 5665 1 1 10 TRP CD1 C 2.331 -1.304 -1.461 1.00 . A A . 10 TRP CD1 1 1 18 5666 1 1 10 TRP CD2 C 3.949 -0.532 -0.187 1.00 . A A . 10 TRP CD2 1 1 18 5667 1 1 10 TRP CE2 C 3.845 0.257 -1.329 1.00 . A A . 10 TRP CE2 1 1 18 5668 1 1 10 TRP CE3 C 4.891 -0.237 0.789 1.00 . A A . 10 TRP CE3 1 1 18 5669 1 1 10 TRP CG C 2.977 -1.507 -0.310 1.00 . A A . 10 TRP CG 1 1 18 5670 1 1 10 TRP CH2 C 5.635 1.646 -0.514 1.00 . A A . 10 TRP CH2 1 1 18 5671 1 1 10 TRP CZ2 C 4.700 1.336 -1.502 1.00 . A A . 10 TRP CZ2 1 1 18 5672 1 1 10 TRP CZ3 C 5.725 0.869 0.627 1.00 . A A . 10 TRP CZ3 1 1 18 5673 1 1 10 TRP H H 0.594 -3.811 1.408 1.00 . A A . 10 TRP H 1 1 18 5674 1 1 10 TRP HA H 2.336 -2.104 2.767 1.00 . A A . 10 TRP HA 1 1 18 5675 1 1 10 TRP HB2 H 3.524 -2.981 1.137 1.00 . A A . 10 TRP HB2 1 1 18 5676 1 1 10 TRP HB3 H 2.082 -3.387 0.196 1.00 . A A . 10 TRP HB3 1 1 18 5677 1 1 10 TRP HD1 H 1.502 -1.896 -1.829 1.00 . A A . 10 TRP HD1 1 1 18 5678 1 1 10 TRP HE1 H 2.584 0.098 -2.970 1.00 . A A . 10 TRP HE1 1 1 18 5679 1 1 10 TRP HE3 H 5.066 -0.930 1.611 1.00 . A A . 10 TRP HE3 1 1 18 5680 1 1 10 TRP HH2 H 6.302 2.498 -0.650 1.00 . A A . 10 TRP HH2 1 1 18 5681 1 1 10 TRP HZ2 H 4.729 1.862 -2.454 1.00 . A A . 10 TRP HZ2 1 1 18 5682 1 1 10 TRP HZ3 H 6.422 1.144 1.421 1.00 . A A . 10 TRP HZ3 1 1 18 5683 1 1 10 TRP N N 0.633 -3.073 2.084 1.00 . A A . 10 TRP N 1 1 18 5684 1 1 10 TRP NE1 N 2.864 -0.239 -2.070 1.00 . A A . 10 TRP NE1 1 1 18 5685 1 1 10 TRP O O 1.785 0.299 2.228 1.00 . A A . 10 TRP O 1 1 18 5686 1 1 11 ALA C C -1.388 1.188 2.455 1.00 . A A . 11 ALA C 1 1 18 5687 1 1 11 ALA CA C -0.779 0.729 1.112 1.00 . A A . 11 ALA CA 1 1 18 5688 1 1 11 ALA CB C -1.880 0.624 0.060 1.00 . A A . 11 ALA CB 1 1 18 5689 1 1 11 ALA H H -0.554 -1.349 0.900 1.00 . A A . 11 ALA H 1 1 18 5690 1 1 11 ALA HA H -0.079 1.498 0.785 1.00 . A A . 11 ALA HA 1 1 18 5691 1 1 11 ALA HB1 H -2.343 1.601 -0.082 1.00 . A A . 11 ALA HB1 1 1 18 5692 1 1 11 ALA HB2 H -2.634 -0.089 0.391 1.00 . A A . 11 ALA HB2 1 1 18 5693 1 1 11 ALA HB3 H -1.450 0.286 -0.883 1.00 . A A . 11 ALA HB3 1 1 18 5694 1 1 11 ALA N N -0.039 -0.546 1.197 1.00 . A A . 11 ALA N 1 1 18 5695 1 1 11 ALA O O -2.180 2.122 2.499 1.00 . A A . 11 ALA O 1 1 18 5696 1 1 12 HIS C C -0.017 1.288 5.723 1.00 . A A . 12 HIS C 1 1 18 5697 1 1 12 HIS CA C -1.290 0.935 4.922 1.00 . A A . 12 HIS CA 1 1 18 5698 1 1 12 HIS CB C -2.056 -0.202 5.602 1.00 . A A . 12 HIS CB 1 1 18 5699 1 1 12 HIS CD2 C -4.429 0.462 4.853 1.00 . A A . 12 HIS CD2 1 1 18 5700 1 1 12 HIS CE1 C -5.474 0.299 6.729 1.00 . A A . 12 HIS CE1 1 1 18 5701 1 1 12 HIS CG C -3.555 0.097 5.779 1.00 . A A . 12 HIS CG 1 1 18 5702 1 1 12 HIS H H -0.543 -0.368 3.469 1.00 . A A . 12 HIS H 1 1 18 5703 1 1 12 HIS HA H -1.933 1.814 4.891 1.00 . A A . 12 HIS HA 1 1 18 5704 1 1 12 HIS HB2 H -1.952 -1.102 4.995 1.00 . A A . 12 HIS HB2 1 1 18 5705 1 1 12 HIS HB3 H -1.615 -0.386 6.582 1.00 . A A . 12 HIS HB3 1 1 18 5706 1 1 12 HIS HD1 H -3.787 -0.285 7.805 1.00 . A A . 12 HIS HD1 1 1 18 5707 1 1 12 HIS HD2 H -4.217 0.626 3.807 1.00 . A A . 12 HIS HD2 1 1 18 5708 1 1 12 HIS HE1 H -6.254 0.311 7.475 1.00 . A A . 12 HIS HE1 1 1 18 5709 1 1 12 HIS HE2 H -6.482 0.864 4.993 1.00 . A A . 12 HIS HE2 1 1 18 5710 1 1 12 HIS N N -0.988 0.528 3.535 1.00 . A A . 12 HIS N 1 1 18 5711 1 1 12 HIS ND1 N -4.189 -0.014 6.938 1.00 . A A . 12 HIS ND1 1 1 18 5712 1 1 12 HIS NE2 N -5.621 0.591 5.445 1.00 . A A . 12 HIS NE2 1 1 18 5713 1 1 12 HIS O O -0.082 1.567 6.917 1.00 . A A . 12 HIS O 1 1 18 5714 1 1 13 TYR C C 2.885 3.078 5.018 1.00 . A A . 13 TYR C 1 1 18 5715 1 1 13 TYR CA C 2.434 1.707 5.548 1.00 . A A . 13 TYR CA 1 1 18 5716 1 1 13 TYR CB C 3.443 0.620 5.156 1.00 . A A . 13 TYR CB 1 1 18 5717 1 1 13 TYR CD1 C 2.568 -1.650 5.821 1.00 . A A . 13 TYR CD1 1 1 18 5718 1 1 13 TYR CD2 C 4.274 -0.601 7.166 1.00 . A A . 13 TYR CD2 1 1 18 5719 1 1 13 TYR CE1 C 2.613 -2.773 6.635 1.00 . A A . 13 TYR CE1 1 1 18 5720 1 1 13 TYR CE2 C 4.324 -1.722 7.977 1.00 . A A . 13 TYR CE2 1 1 18 5721 1 1 13 TYR CG C 3.399 -0.573 6.090 1.00 . A A . 13 TYR CG 1 1 18 5722 1 1 13 TYR CZ C 3.485 -2.796 7.715 1.00 . A A . 13 TYR CZ 1 1 18 5723 1 1 13 TYR H H 1.116 1.034 4.059 1.00 . A A . 13 TYR H 1 1 18 5724 1 1 13 TYR HA H 2.372 1.754 6.635 1.00 . A A . 13 TYR HA 1 1 18 5725 1 1 13 TYR HB2 H 3.217 0.282 4.145 1.00 . A A . 13 TYR HB2 1 1 18 5726 1 1 13 TYR HB3 H 4.447 1.046 5.171 1.00 . A A . 13 TYR HB3 1 1 18 5727 1 1 13 TYR HD1 H 1.893 -1.611 4.971 1.00 . A A . 13 TYR HD1 1 1 18 5728 1 1 13 TYR HD2 H 4.915 0.256 7.365 1.00 . A A . 13 TYR HD2 1 1 18 5729 1 1 13 TYR HE1 H 2.017 -3.645 6.364 1.00 . A A . 13 TYR HE1 1 1 18 5730 1 1 13 TYR HE2 H 5.078 -1.778 8.763 1.00 . A A . 13 TYR HE2 1 1 18 5731 1 1 13 TYR HH H 2.803 -4.514 8.258 1.00 . A A . 13 TYR HH 1 1 18 5732 1 1 13 TYR N N 1.107 1.345 5.009 1.00 . A A . 13 TYR N 1 1 18 5733 1 1 13 TYR O O 2.586 4.121 5.599 1.00 . A A . 13 TYR O 1 1 18 5734 1 1 13 TYR OH O 3.500 -3.865 8.553 1.00 . A A . 13 TYR OH 1 1 18 5735 1 1 14 ASN C C 2.634 5.122 2.698 1.00 . A A . 14 ASN C 1 1 18 5736 1 1 14 ASN CA C 3.852 4.271 3.086 1.00 . A A . 14 ASN CA 1 1 18 5737 1 1 14 ASN CB C 4.672 3.914 1.845 1.00 . A A . 14 ASN CB 1 1 18 5738 1 1 14 ASN CG C 5.586 5.070 1.434 1.00 . A A . 14 ASN CG 1 1 18 5739 1 1 14 ASN H H 3.704 2.194 3.370 1.00 . A A . 14 ASN H 1 1 18 5740 1 1 14 ASN HA H 4.482 4.867 3.746 1.00 . A A . 14 ASN HA 1 1 18 5741 1 1 14 ASN HB2 H 5.279 3.036 2.058 1.00 . A A . 14 ASN HB2 1 1 18 5742 1 1 14 ASN HB3 H 3.992 3.690 1.023 1.00 . A A . 14 ASN HB3 1 1 18 5743 1 1 14 ASN HD21 H 4.113 6.017 0.434 1.00 . A A . 14 ASN HD21 1 1 18 5744 1 1 14 ASN HD22 H 5.693 6.740 0.395 1.00 . A A . 14 ASN HD22 1 1 18 5745 1 1 14 ASN N N 3.456 3.055 3.813 1.00 . A A . 14 ASN N 1 1 18 5746 1 1 14 ASN ND2 N 5.092 5.982 0.633 1.00 . A A . 14 ASN ND2 1 1 18 5747 1 1 14 ASN O O 2.808 6.260 2.304 1.00 . A A . 14 ASN O 1 1 18 5748 1 1 14 ASN OD1 O 6.726 5.179 1.862 1.00 . A A . 14 ASN OD1 1 1 18 5749 1 1 15 ALA C C 0.266 6.819 3.435 1.00 . A A . 15 ALA C 1 1 18 5750 1 1 15 ALA CA C 0.180 5.449 2.734 1.00 . A A . 15 ALA CA 1 1 18 5751 1 1 15 ALA CB C -1.002 4.702 3.344 1.00 . A A . 15 ALA CB 1 1 18 5752 1 1 15 ALA H H 1.253 3.661 3.052 1.00 . A A . 15 ALA H 1 1 18 5753 1 1 15 ALA HA H -0.016 5.609 1.674 1.00 . A A . 15 ALA HA 1 1 18 5754 1 1 15 ALA HB1 H -1.393 5.269 4.189 1.00 . A A . 15 ALA HB1 1 1 18 5755 1 1 15 ALA HB2 H -0.674 3.721 3.686 1.00 . A A . 15 ALA HB2 1 1 18 5756 1 1 15 ALA HB3 H -1.784 4.584 2.593 1.00 . A A . 15 ALA HB3 1 1 18 5757 1 1 15 ALA N N 1.407 4.630 2.873 1.00 . A A . 15 ALA N 1 1 18 5758 1 1 15 ALA O O -0.233 7.814 2.916 1.00 . A A . 15 ALA O 1 1 18 5759 1 1 16 LEU C C 2.695 8.658 5.032 1.00 . A A . 16 LEU C 1 1 18 5760 1 1 16 LEU CA C 1.293 8.078 5.302 1.00 . A A . 16 LEU CA 1 1 18 5761 1 1 16 LEU CB C 1.094 7.791 6.793 1.00 . A A . 16 LEU CB 1 1 18 5762 1 1 16 LEU CD1 C -0.323 8.233 8.808 1.00 . A A . 16 LEU CD1 1 1 18 5763 1 1 16 LEU CD2 C 0.694 10.166 7.598 1.00 . A A . 16 LEU CD2 1 1 18 5764 1 1 16 LEU CG C 0.097 8.764 7.436 1.00 . A A . 16 LEU CG 1 1 18 5765 1 1 16 LEU H H 1.449 6.017 4.884 1.00 . A A . 16 LEU H 1 1 18 5766 1 1 16 LEU HA H 0.560 8.827 5.006 1.00 . A A . 16 LEU HA 1 1 18 5767 1 1 16 LEU HB2 H 0.724 6.772 6.912 1.00 . A A . 16 LEU HB2 1 1 18 5768 1 1 16 LEU HB3 H 2.054 7.883 7.301 1.00 . A A . 16 LEU HB3 1 1 18 5769 1 1 16 LEU HD11 H -0.749 7.236 8.697 1.00 . A A . 16 LEU HD11 1 1 18 5770 1 1 16 LEU HD12 H 0.548 8.185 9.461 1.00 . A A . 16 LEU HD12 1 1 18 5771 1 1 16 LEU HD13 H -1.067 8.900 9.243 1.00 . A A . 16 LEU HD13 1 1 18 5772 1 1 16 LEU HD21 H -0.051 10.830 8.035 1.00 . A A . 16 LEU HD21 1 1 18 5773 1 1 16 LEU HD22 H 0.995 10.549 6.623 1.00 . A A . 16 LEU HD22 1 1 18 5774 1 1 16 LEU HD23 H 1.565 10.116 8.253 1.00 . A A . 16 LEU HD23 1 1 18 5775 1 1 16 LEU HG H -0.787 8.831 6.801 1.00 . A A . 16 LEU HG 1 1 18 5776 1 1 16 LEU N N 1.017 6.850 4.535 1.00 . A A . 16 LEU N 1 1 18 5777 1 1 16 LEU O O 2.883 9.869 5.080 1.00 . A A . 16 LEU O 1 1 18 5778 1 1 17 ILE C C 5.114 8.551 2.803 1.00 . A A . 17 ILE C 1 1 18 5779 1 1 17 ILE CA C 5.030 8.173 4.309 1.00 . A A . 17 ILE CA 1 1 18 5780 1 1 17 ILE CB C 5.998 7.020 4.692 1.00 . A A . 17 ILE CB 1 1 18 5781 1 1 17 ILE CD1 C 5.745 7.348 7.290 1.00 . A A . 17 ILE CD1 1 1 18 5782 1 1 17 ILE CG1 C 5.733 6.396 6.081 1.00 . A A . 17 ILE CG1 1 1 18 5783 1 1 17 ILE CG2 C 7.476 7.428 4.584 1.00 . A A . 17 ILE CG2 1 1 18 5784 1 1 17 ILE H H 3.487 6.806 4.717 1.00 . A A . 17 ILE H 1 1 18 5785 1 1 17 ILE HA H 5.308 9.052 4.891 1.00 . A A . 17 ILE HA 1 1 18 5786 1 1 17 ILE HB H 5.842 6.227 3.961 1.00 . A A . 17 ILE HB 1 1 18 5787 1 1 17 ILE HD11 H 6.721 7.826 7.367 1.00 . A A . 17 ILE HD11 1 1 18 5788 1 1 17 ILE HD12 H 5.545 6.783 8.200 1.00 . A A . 17 ILE HD12 1 1 18 5789 1 1 17 ILE HD13 H 4.976 8.110 7.161 1.00 . A A . 17 ILE HD13 1 1 18 5790 1 1 17 ILE HG12 H 4.764 5.899 6.050 1.00 . A A . 17 ILE HG12 1 1 18 5791 1 1 17 ILE HG13 H 6.498 5.638 6.251 1.00 . A A . 17 ILE HG13 1 1 18 5792 1 1 17 ILE HG21 H 7.662 7.868 3.605 1.00 . A A . 17 ILE HG21 1 1 18 5793 1 1 17 ILE HG22 H 7.709 8.158 5.360 1.00 . A A . 17 ILE HG22 1 1 18 5794 1 1 17 ILE HG23 H 8.107 6.549 4.713 1.00 . A A . 17 ILE HG23 1 1 18 5795 1 1 17 ILE N N 3.648 7.789 4.695 1.00 . A A . 17 ILE N 1 1 18 5796 1 1 17 ILE O O 6.181 8.749 2.223 1.00 . A A . 17 ILE O 1 1 18 5797 1 1 18 ARG C C 3.693 10.585 0.644 1.00 . A A . 18 ARG C 1 1 18 5798 1 1 18 ARG CA C 3.810 9.063 0.746 1.00 . A A . 18 ARG CA 1 1 18 5799 1 1 18 ARG CB C 2.551 8.400 0.168 1.00 . A A . 18 ARG CB 1 1 18 5800 1 1 18 ARG CD C 2.764 8.779 -2.348 1.00 . A A . 18 ARG CD 1 1 18 5801 1 1 18 ARG CG C 2.792 7.761 -1.204 1.00 . A A . 18 ARG CG 1 1 18 5802 1 1 18 ARG CZ C 4.757 8.121 -3.727 1.00 . A A . 18 ARG CZ 1 1 18 5803 1 1 18 ARG H H 3.098 8.432 2.608 1.00 . A A . 18 ARG H 1 1 18 5804 1 1 18 ARG HA H 4.687 8.727 0.193 1.00 . A A . 18 ARG HA 1 1 18 5805 1 1 18 ARG HB2 H 2.217 7.625 0.859 1.00 . A A . 18 ARG HB2 1 1 18 5806 1 1 18 ARG HB3 H 1.767 9.151 0.075 1.00 . A A . 18 ARG HB3 1 1 18 5807 1 1 18 ARG HD2 H 1.728 9.011 -2.594 1.00 . A A . 18 ARG HD2 1 1 18 5808 1 1 18 ARG HD3 H 3.270 9.690 -2.029 1.00 . A A . 18 ARG HD3 1 1 18 5809 1 1 18 ARG HE H 2.835 7.952 -4.288 1.00 . A A . 18 ARG HE 1 1 18 5810 1 1 18 ARG HG2 H 3.761 7.263 -1.197 1.00 . A A . 18 ARG HG2 1 1 18 5811 1 1 18 ARG HG3 H 2.016 7.017 -1.383 1.00 . A A . 18 ARG HG3 1 1 18 5812 1 1 18 ARG HH11 H 5.295 8.752 -1.900 1.00 . A A . 18 ARG HH11 1 1 18 5813 1 1 18 ARG HH12 H 6.613 8.361 -2.953 1.00 . A A . 18 ARG HH12 1 1 18 5814 1 1 18 ARG HH21 H 4.619 7.362 -5.602 1.00 . A A . 18 ARG HH21 1 1 18 5815 1 1 18 ARG HH22 H 6.221 7.544 -4.978 1.00 . A A . 18 ARG HH22 1 1 18 5816 1 1 18 ARG N N 3.952 8.697 2.164 1.00 . A A . 18 ARG N 1 1 18 5817 1 1 18 ARG NE N 3.438 8.244 -3.548 1.00 . A A . 18 ARG NE 1 1 18 5818 1 1 18 ARG NH1 N 5.633 8.449 -2.786 1.00 . A A . 18 ARG NH1 1 1 18 5819 1 1 18 ARG NH2 N 5.233 7.630 -4.863 1.00 . A A . 18 ARG NH2 1 1 18 5820 1 1 18 ARG O O 3.055 11.244 1.463 1.00 . A A . 18 ARG O 1 1 18 5821 1 1 19 ALA C C 4.040 12.774 -2.159 1.00 . A A . 19 ALA C 1 1 18 5822 1 1 19 ALA CA C 4.355 12.547 -0.672 1.00 . A A . 19 ALA CA 1 1 18 5823 1 1 19 ALA CB C 5.701 13.143 -0.238 1.00 . A A . 19 ALA CB 1 1 18 5824 1 1 19 ALA H H 4.922 10.548 -0.978 1.00 . A A . 19 ALA H 1 1 18 5825 1 1 19 ALA HA H 3.568 13.015 -0.081 1.00 . A A . 19 ALA HA 1 1 18 5826 1 1 19 ALA HB1 H 5.712 14.212 -0.453 1.00 . A A . 19 ALA HB1 1 1 18 5827 1 1 19 ALA HB2 H 6.508 12.654 -0.783 1.00 . A A . 19 ALA HB2 1 1 18 5828 1 1 19 ALA HB3 H 5.838 12.988 0.832 1.00 . A A . 19 ALA HB3 1 1 18 5829 1 1 19 ALA N N 4.364 11.108 -0.372 1.00 . A A . 19 ALA N 1 1 18 5830 1 1 19 ALA O O 4.869 13.214 -2.953 1.00 . A A . 19 ALA O 1 1 18 5831 1 1 20 PHE C C 2.508 13.926 -4.476 1.00 . A A . 20 PHE C 1 1 18 5832 1 1 20 PHE CA C 2.304 12.506 -3.909 1.00 . A A . 20 PHE CA 1 1 18 5833 1 1 20 PHE CB C 0.817 12.118 -3.900 1.00 . A A . 20 PHE CB 1 1 18 5834 1 1 20 PHE CD1 C 0.651 10.794 -6.030 1.00 . A A . 20 PHE CD1 1 1 18 5835 1 1 20 PHE CD2 C -0.651 12.814 -5.861 1.00 . A A . 20 PHE CD2 1 1 18 5836 1 1 20 PHE CE1 C 0.131 10.561 -7.295 1.00 . A A . 20 PHE CE1 1 1 18 5837 1 1 20 PHE CE2 C -1.175 12.575 -7.129 1.00 . A A . 20 PHE CE2 1 1 18 5838 1 1 20 PHE CG C 0.258 11.916 -5.310 1.00 . A A . 20 PHE CG 1 1 18 5839 1 1 20 PHE CZ C -0.785 11.450 -7.843 1.00 . A A . 20 PHE CZ 1 1 18 5840 1 1 20 PHE H H 2.230 11.873 -1.900 1.00 . A A . 20 PHE H 1 1 18 5841 1 1 20 PHE HA H 2.838 11.802 -4.547 1.00 . A A . 20 PHE HA 1 1 18 5842 1 1 20 PHE HB2 H 0.701 11.190 -3.341 1.00 . A A . 20 PHE HB2 1 1 18 5843 1 1 20 PHE HB3 H 0.249 12.905 -3.403 1.00 . A A . 20 PHE HB3 1 1 18 5844 1 1 20 PHE HD1 H 1.396 10.119 -5.611 1.00 . A A . 20 PHE HD1 1 1 18 5845 1 1 20 PHE HD2 H -0.945 13.708 -5.310 1.00 . A A . 20 PHE HD2 1 1 18 5846 1 1 20 PHE HE1 H 0.450 9.684 -7.859 1.00 . A A . 20 PHE HE1 1 1 18 5847 1 1 20 PHE HE2 H -1.905 13.264 -7.554 1.00 . A A . 20 PHE HE2 1 1 18 5848 1 1 20 PHE HZ H -1.198 11.262 -8.836 1.00 . A A . 20 PHE HZ 1 1 18 5849 1 1 20 PHE N N 2.825 12.371 -2.531 1.00 . A A . 20 PHE N 1 1 18 5850 1 1 20 PHE O O 3.399 14.080 -5.340 1.00 . A A . 20 PHE O 1 1 19 5851 1 1 1 HIS C C -6.429 -12.690 -5.934 1.00 . A A . 1 HIS C 1 1 19 5852 1 1 1 HIS CA C -7.886 -12.189 -6.092 1.00 . A A . 1 HIS CA 1 1 19 5853 1 1 1 HIS CB C -8.010 -11.187 -7.251 1.00 . A A . 1 HIS CB 1 1 19 5854 1 1 1 HIS CD2 C -6.934 -12.440 -9.219 1.00 . A A . 1 HIS CD2 1 1 19 5855 1 1 1 HIS CE1 C -8.562 -12.466 -10.627 1.00 . A A . 1 HIS CE1 1 1 19 5856 1 1 1 HIS CG C -7.968 -11.832 -8.655 1.00 . A A . 1 HIS CG 1 1 19 5857 1 1 1 HIS H1 H -7.759 -11.513 -4.057 1.00 . A A . 1 HIS H1 1 1 19 5858 1 1 1 HIS HA H -8.518 -13.048 -6.318 1.00 . A A . 1 HIS HA 1 1 19 5859 1 1 1 HIS HB2 H -8.950 -10.646 -7.144 1.00 . A A . 1 HIS HB2 1 1 19 5860 1 1 1 HIS HB3 H -7.188 -10.476 -7.177 1.00 . A A . 1 HIS HB3 1 1 19 5861 1 1 1 HIS HD1 H -9.868 -11.411 -9.394 1.00 . A A . 1 HIS HD1 1 1 19 5862 1 1 1 HIS HD2 H -5.963 -12.593 -8.771 1.00 . A A . 1 HIS HD2 1 1 19 5863 1 1 1 HIS HE1 H -9.151 -12.643 -11.515 1.00 . A A . 1 HIS HE1 1 1 19 5864 1 1 1 HIS HE2 H -6.725 -13.320 -11.105 1.00 . A A . 1 HIS HE2 1 1 19 5865 1 1 1 HIS N N -8.388 -11.565 -4.845 1.00 . A A . 1 HIS N 1 1 19 5866 1 1 1 HIS ND1 N -8.975 -11.838 -9.514 1.00 . A A . 1 HIS ND1 1 1 19 5867 1 1 1 HIS NE2 N -7.305 -12.830 -10.438 1.00 . A A . 1 HIS NE2 1 1 19 5868 1 1 1 HIS O O -6.167 -13.886 -6.016 1.00 . A A . 1 HIS O 1 1 19 5869 1 1 2 GLY C C -3.305 -10.726 -5.165 1.00 . A A . 2 GLY C 1 1 19 5870 1 1 2 GLY CA C -4.094 -12.017 -5.416 1.00 . A A . 2 GLY CA 1 1 19 5871 1 1 2 GLY H H -5.767 -10.763 -5.652 1.00 . A A . 2 GLY H 1 1 19 5872 1 1 2 GLY HA2 H -4.012 -12.659 -4.538 1.00 . A A . 2 GLY HA2 1 1 19 5873 1 1 2 GLY HA3 H -3.670 -12.533 -6.277 1.00 . A A . 2 GLY HA3 1 1 19 5874 1 1 2 GLY N N -5.522 -11.736 -5.674 1.00 . A A . 2 GLY N 1 1 19 5875 1 1 2 GLY O O -3.392 -10.128 -4.092 1.00 . A A . 2 GLY O 1 1 19 5876 1 1 3 LEU C C -2.899 -7.701 -5.807 1.00 . A A . 3 LEU C 1 1 19 5877 1 1 3 LEU CA C -2.034 -8.900 -6.235 1.00 . A A . 3 LEU CA 1 1 19 5878 1 1 3 LEU CB C -1.342 -8.595 -7.570 1.00 . A A . 3 LEU CB 1 1 19 5879 1 1 3 LEU CD1 C -1.736 -7.099 -9.533 1.00 . A A . 3 LEU CD1 1 1 19 5880 1 1 3 LEU CD2 C -2.570 -9.470 -9.596 1.00 . A A . 3 LEU CD2 1 1 19 5881 1 1 3 LEU CG C -2.311 -8.252 -8.708 1.00 . A A . 3 LEU CG 1 1 19 5882 1 1 3 LEU H H -2.739 -10.683 -7.124 1.00 . A A . 3 LEU H 1 1 19 5883 1 1 3 LEU HA H -1.246 -9.002 -5.488 1.00 . A A . 3 LEU HA 1 1 19 5884 1 1 3 LEU HB2 H -0.671 -7.749 -7.424 1.00 . A A . 3 LEU HB2 1 1 19 5885 1 1 3 LEU HB3 H -0.751 -9.463 -7.864 1.00 . A A . 3 LEU HB3 1 1 19 5886 1 1 3 LEU HD11 H -2.423 -6.853 -10.343 1.00 . A A . 3 LEU HD11 1 1 19 5887 1 1 3 LEU HD12 H -0.774 -7.395 -9.950 1.00 . A A . 3 LEU HD12 1 1 19 5888 1 1 3 LEU HD13 H -1.602 -6.227 -8.893 1.00 . A A . 3 LEU HD13 1 1 19 5889 1 1 3 LEU HD21 H -3.281 -9.204 -10.378 1.00 . A A . 3 LEU HD21 1 1 19 5890 1 1 3 LEU HD22 H -2.979 -10.280 -8.992 1.00 . A A . 3 LEU HD22 1 1 19 5891 1 1 3 LEU HD23 H -1.634 -9.793 -10.052 1.00 . A A . 3 LEU HD23 1 1 19 5892 1 1 3 LEU HG H -3.258 -7.931 -8.275 1.00 . A A . 3 LEU HG 1 1 19 5893 1 1 3 LEU N N -2.770 -10.185 -6.257 1.00 . A A . 3 LEU N 1 1 19 5894 1 1 3 LEU O O -2.458 -6.861 -5.024 1.00 . A A . 3 LEU O 1 1 19 5895 1 1 4 ALA C C -5.309 -6.663 -4.220 1.00 . A A . 4 ALA C 1 1 19 5896 1 1 4 ALA CA C -5.202 -6.779 -5.752 1.00 . A A . 4 ALA CA 1 1 19 5897 1 1 4 ALA CB C -6.557 -7.149 -6.357 1.00 . A A . 4 ALA CB 1 1 19 5898 1 1 4 ALA H H -4.490 -8.412 -6.862 1.00 . A A . 4 ALA H 1 1 19 5899 1 1 4 ALA HA H -4.916 -5.803 -6.142 1.00 . A A . 4 ALA HA 1 1 19 5900 1 1 4 ALA HB1 H -6.463 -7.227 -7.440 1.00 . A A . 4 ALA HB1 1 1 19 5901 1 1 4 ALA HB2 H -7.288 -6.379 -6.111 1.00 . A A . 4 ALA HB2 1 1 19 5902 1 1 4 ALA HB3 H -6.887 -8.106 -5.952 1.00 . A A . 4 ALA HB3 1 1 19 5903 1 1 4 ALA N N -4.180 -7.754 -6.180 1.00 . A A . 4 ALA N 1 1 19 5904 1 1 4 ALA O O -5.592 -5.593 -3.705 1.00 . A A . 4 ALA O 1 1 19 5905 1 1 5 SER C C -3.479 -7.328 -1.508 1.00 . A A . 5 SER C 1 1 19 5906 1 1 5 SER CA C -4.855 -7.769 -2.043 1.00 . A A . 5 SER CA 1 1 19 5907 1 1 5 SER CB C -5.168 -9.186 -1.556 1.00 . A A . 5 SER CB 1 1 19 5908 1 1 5 SER H H -4.502 -8.515 -3.973 1.00 . A A . 5 SER H 1 1 19 5909 1 1 5 SER HA H -5.612 -7.092 -1.647 1.00 . A A . 5 SER HA 1 1 19 5910 1 1 5 SER HB2 H -6.146 -9.491 -1.931 1.00 . A A . 5 SER HB2 1 1 19 5911 1 1 5 SER HB3 H -4.407 -9.874 -1.924 1.00 . A A . 5 SER HB3 1 1 19 5912 1 1 5 SER HG H -5.336 -10.134 0.207 1.00 . A A . 5 SER HG 1 1 19 5913 1 1 5 SER N N -4.912 -7.725 -3.519 1.00 . A A . 5 SER N 1 1 19 5914 1 1 5 SER O O -3.391 -6.528 -0.580 1.00 . A A . 5 SER O 1 1 19 5915 1 1 5 SER OG O -5.177 -9.206 -0.130 1.00 . A A . 5 SER OG 1 1 19 5916 1 1 6 THR C C -0.839 -5.783 -1.981 1.00 . A A . 6 THR C 1 1 19 5917 1 1 6 THR CA C -1.024 -7.313 -1.897 1.00 . A A . 6 THR CA 1 1 19 5918 1 1 6 THR CB C 0.018 -8.020 -2.786 1.00 . A A . 6 THR CB 1 1 19 5919 1 1 6 THR CG2 C -0.106 -9.547 -2.722 1.00 . A A . 6 THR CG2 1 1 19 5920 1 1 6 THR H H -2.481 -8.509 -2.840 1.00 . A A . 6 THR H 1 1 19 5921 1 1 6 THR HA H -0.812 -7.602 -0.868 1.00 . A A . 6 THR HA 1 1 19 5922 1 1 6 THR HB H 1.006 -7.753 -2.411 1.00 . A A . 6 THR HB 1 1 19 5923 1 1 6 THR HG1 H -0.932 -7.091 -4.325 1.00 . A A . 6 THR HG1 1 1 19 5924 1 1 6 THR HG21 H 0.043 -9.882 -1.695 1.00 . A A . 6 THR HG21 1 1 19 5925 1 1 6 THR HG22 H 0.649 -10.000 -3.365 1.00 . A A . 6 THR HG22 1 1 19 5926 1 1 6 THR HG23 H -1.098 -9.846 -3.062 1.00 . A A . 6 THR HG23 1 1 19 5927 1 1 6 THR N N -2.414 -7.751 -2.191 1.00 . A A . 6 THR N 1 1 19 5928 1 1 6 THR O O -0.069 -5.198 -1.219 1.00 . A A . 6 THR O 1 1 19 5929 1 1 6 THR OG1 O -0.064 -7.575 -4.142 1.00 . A A . 6 THR OG1 1 1 19 5930 1 1 7 LEU C C -2.728 -3.021 -1.917 1.00 . A A . 7 LEU C 1 1 19 5931 1 1 7 LEU CA C -1.761 -3.677 -2.919 1.00 . A A . 7 LEU CA 1 1 19 5932 1 1 7 LEU CB C -2.070 -3.249 -4.368 1.00 . A A . 7 LEU CB 1 1 19 5933 1 1 7 LEU CD1 C -4.574 -2.684 -4.487 1.00 . A A . 7 LEU CD1 1 1 19 5934 1 1 7 LEU CD2 C -3.367 -3.556 -6.483 1.00 . A A . 7 LEU CD2 1 1 19 5935 1 1 7 LEU CG C -3.446 -3.609 -4.958 1.00 . A A . 7 LEU CG 1 1 19 5936 1 1 7 LEU H H -2.347 -5.639 -3.361 1.00 . A A . 7 LEU H 1 1 19 5937 1 1 7 LEU HA H -0.767 -3.294 -2.687 1.00 . A A . 7 LEU HA 1 1 19 5938 1 1 7 LEU HB2 H -1.975 -2.165 -4.411 1.00 . A A . 7 LEU HB2 1 1 19 5939 1 1 7 LEU HB3 H -1.306 -3.680 -5.015 1.00 . A A . 7 LEU HB3 1 1 19 5940 1 1 7 LEU HD11 H -4.640 -2.714 -3.399 1.00 . A A . 7 LEU HD11 1 1 19 5941 1 1 7 LEU HD12 H -4.365 -1.663 -4.810 1.00 . A A . 7 LEU HD12 1 1 19 5942 1 1 7 LEU HD13 H -5.520 -3.014 -4.918 1.00 . A A . 7 LEU HD13 1 1 19 5943 1 1 7 LEU HD21 H -3.162 -2.535 -6.801 1.00 . A A . 7 LEU HD21 1 1 19 5944 1 1 7 LEU HD22 H -2.567 -4.212 -6.828 1.00 . A A . 7 LEU HD22 1 1 19 5945 1 1 7 LEU HD23 H -4.315 -3.885 -6.907 1.00 . A A . 7 LEU HD23 1 1 19 5946 1 1 7 LEU HG H -3.692 -4.628 -4.661 1.00 . A A . 7 LEU HG 1 1 19 5947 1 1 7 LEU N N -1.685 -5.145 -2.797 1.00 . A A . 7 LEU N 1 1 19 5948 1 1 7 LEU O O -2.802 -1.802 -1.869 1.00 . A A . 7 LEU O 1 1 19 5949 1 1 8 THR C C -3.780 -3.326 1.277 1.00 . A A . 8 THR C 1 1 19 5950 1 1 8 THR CA C -4.426 -3.379 -0.123 1.00 . A A . 8 THR CA 1 1 19 5951 1 1 8 THR CB C -5.666 -4.298 -0.194 1.00 . A A . 8 THR CB 1 1 19 5952 1 1 8 THR CG2 C -6.736 -4.076 0.882 1.00 . A A . 8 THR CG2 1 1 19 5953 1 1 8 THR H H -3.380 -4.824 -1.215 1.00 . A A . 8 THR H 1 1 19 5954 1 1 8 THR HA H -4.743 -2.369 -0.383 1.00 . A A . 8 THR HA 1 1 19 5955 1 1 8 THR HB H -5.329 -5.333 -0.136 1.00 . A A . 8 THR HB 1 1 19 5956 1 1 8 THR HG1 H -7.066 -4.676 -1.583 1.00 . A A . 8 THR HG1 1 1 19 5957 1 1 8 THR HG21 H -7.113 -3.056 0.814 1.00 . A A . 8 THR HG21 1 1 19 5958 1 1 8 THR HG22 H -7.556 -4.777 0.730 1.00 . A A . 8 THR HG22 1 1 19 5959 1 1 8 THR HG23 H -6.299 -4.237 1.867 1.00 . A A . 8 THR HG23 1 1 19 5960 1 1 8 THR N N -3.451 -3.826 -1.146 1.00 . A A . 8 THR N 1 1 19 5961 1 1 8 THR O O -4.299 -2.699 2.196 1.00 . A A . 8 THR O 1 1 19 5962 1 1 8 THR OG1 O -6.264 -4.090 -1.473 1.00 . A A . 8 THR OG1 1 1 19 5963 1 1 9 ARG C C -0.647 -2.939 2.625 1.00 . A A . 9 ARG C 1 1 19 5964 1 1 9 ARG CA C -1.831 -3.921 2.652 1.00 . A A . 9 ARG CA 1 1 19 5965 1 1 9 ARG CB C -1.404 -5.353 2.967 1.00 . A A . 9 ARG CB 1 1 19 5966 1 1 9 ARG CD C -0.974 -6.861 4.934 1.00 . A A . 9 ARG CD 1 1 19 5967 1 1 9 ARG CG C -0.855 -5.442 4.391 1.00 . A A . 9 ARG CG 1 1 19 5968 1 1 9 ARG CZ C -2.798 -8.240 5.934 1.00 . A A . 9 ARG CZ 1 1 19 5969 1 1 9 ARG H H -2.244 -4.515 0.671 1.00 . A A . 9 ARG H 1 1 19 5970 1 1 9 ARG HA H -2.505 -3.599 3.445 1.00 . A A . 9 ARG HA 1 1 19 5971 1 1 9 ARG HB2 H -2.265 -6.015 2.871 1.00 . A A . 9 ARG HB2 1 1 19 5972 1 1 9 ARG HB3 H -0.631 -5.662 2.263 1.00 . A A . 9 ARG HB3 1 1 19 5973 1 1 9 ARG HD2 H -0.634 -7.568 4.176 1.00 . A A . 9 ARG HD2 1 1 19 5974 1 1 9 ARG HD3 H -0.354 -6.960 5.825 1.00 . A A . 9 ARG HD3 1 1 19 5975 1 1 9 ARG HE H -3.053 -6.474 5.001 1.00 . A A . 9 ARG HE 1 1 19 5976 1 1 9 ARG HG2 H 0.195 -5.145 4.389 1.00 . A A . 9 ARG HG2 1 1 19 5977 1 1 9 ARG HG3 H -1.418 -4.765 5.034 1.00 . A A . 9 ARG HG3 1 1 19 5978 1 1 9 ARG HH11 H -0.988 -9.083 6.067 1.00 . A A . 9 ARG HH11 1 1 19 5979 1 1 9 ARG HH12 H -2.269 -9.997 6.795 1.00 . A A . 9 ARG HH12 1 1 19 5980 1 1 9 ARG HH21 H -4.747 -7.690 5.992 1.00 . A A . 9 ARG HH21 1 1 19 5981 1 1 9 ARG HH22 H -4.368 -9.205 6.737 1.00 . A A . 9 ARG HH22 1 1 19 5982 1 1 9 ARG N N -2.598 -3.927 1.396 1.00 . A A . 9 ARG N 1 1 19 5983 1 1 9 ARG NE N -2.380 -7.155 5.282 1.00 . A A . 9 ARG NE 1 1 19 5984 1 1 9 ARG NH1 N -1.954 -9.194 6.298 1.00 . A A . 9 ARG NH1 1 1 19 5985 1 1 9 ARG NH2 N -4.081 -8.390 6.238 1.00 . A A . 9 ARG NH2 1 1 19 5986 1 1 9 ARG O O -0.576 -2.052 3.472 1.00 . A A . 9 ARG O 1 1 19 5987 1 1 10 TRP C C 0.700 -0.560 1.224 1.00 . A A . 10 TRP C 1 1 19 5988 1 1 10 TRP CA C 1.252 -1.997 1.380 1.00 . A A . 10 TRP CA 1 1 19 5989 1 1 10 TRP CB C 2.160 -2.474 0.237 1.00 . A A . 10 TRP CB 1 1 19 5990 1 1 10 TRP CD1 C 1.896 -1.244 -1.966 1.00 . A A . 10 TRP CD1 1 1 19 5991 1 1 10 TRP CD2 C 3.437 -0.380 -0.660 1.00 . A A . 10 TRP CD2 1 1 19 5992 1 1 10 TRP CE2 C 3.332 0.385 -1.818 1.00 . A A . 10 TRP CE2 1 1 19 5993 1 1 10 TRP CE3 C 4.338 -0.030 0.336 1.00 . A A . 10 TRP CE3 1 1 19 5994 1 1 10 TRP CG C 2.513 -1.399 -0.795 1.00 . A A . 10 TRP CG 1 1 19 5995 1 1 10 TRP CH2 C 5.042 1.857 -0.981 1.00 . A A . 10 TRP CH2 1 1 19 5996 1 1 10 TRP CZ2 C 4.147 1.495 -1.988 1.00 . A A . 10 TRP CZ2 1 1 19 5997 1 1 10 TRP CZ3 C 5.130 1.106 0.177 1.00 . A A . 10 TRP CZ3 1 1 19 5998 1 1 10 TRP H H 0.165 -3.741 0.912 1.00 . A A . 10 TRP H 1 1 19 5999 1 1 10 TRP HA H 1.859 -2.002 2.285 1.00 . A A . 10 TRP HA 1 1 19 6000 1 1 10 TRP HB2 H 3.089 -2.842 0.674 1.00 . A A . 10 TRP HB2 1 1 19 6001 1 1 10 TRP HB3 H 1.667 -3.299 -0.277 1.00 . A A . 10 TRP HB3 1 1 19 6002 1 1 10 TRP HD1 H 1.109 -1.885 -2.352 1.00 . A A . 10 TRP HD1 1 1 19 6003 1 1 10 TRP HE1 H 2.129 0.140 -3.494 1.00 . A A . 10 TRP HE1 1 1 19 6004 1 1 10 TRP HE3 H 4.512 -0.697 1.179 1.00 . A A . 10 TRP HE3 1 1 19 6005 1 1 10 TRP HH2 H 5.657 2.752 -1.103 1.00 . A A . 10 TRP HH2 1 1 19 6006 1 1 10 TRP HZ2 H 4.177 2.009 -2.946 1.00 . A A . 10 TRP HZ2 1 1 19 6007 1 1 10 TRP HZ3 H 5.772 1.438 0.996 1.00 . A A . 10 TRP HZ3 1 1 19 6008 1 1 10 TRP N N 0.180 -2.998 1.582 1.00 . A A . 10 TRP N 1 1 19 6009 1 1 10 TRP NE1 N 2.396 -0.169 -2.578 1.00 . A A . 10 TRP NE1 1 1 19 6010 1 1 10 TRP O O 1.291 0.399 1.727 1.00 . A A . 10 TRP O 1 1 19 6011 1 1 11 ALA C C -1.813 1.325 1.945 1.00 . A A . 11 ALA C 1 1 19 6012 1 1 11 ALA CA C -1.282 0.795 0.599 1.00 . A A . 11 ALA CA 1 1 19 6013 1 1 11 ALA CB C -2.455 0.659 -0.369 1.00 . A A . 11 ALA CB 1 1 19 6014 1 1 11 ALA H H -1.017 -1.282 0.381 1.00 . A A . 11 ALA H 1 1 19 6015 1 1 11 ALA HA H -0.609 1.550 0.192 1.00 . A A . 11 ALA HA 1 1 19 6016 1 1 11 ALA HB1 H -3.043 1.576 -0.360 1.00 . A A . 11 ALA HB1 1 1 19 6017 1 1 11 ALA HB2 H -3.082 -0.178 -0.063 1.00 . A A . 11 ALA HB2 1 1 19 6018 1 1 11 ALA HB3 H -2.077 0.480 -1.376 1.00 . A A . 11 ALA HB3 1 1 19 6019 1 1 11 ALA N N -0.524 -0.471 0.695 1.00 . A A . 11 ALA N 1 1 19 6020 1 1 11 ALA O O -2.360 2.422 2.012 1.00 . A A . 11 ALA O 1 1 19 6021 1 1 12 HIS C C -0.570 1.342 5.212 1.00 . A A . 12 HIS C 1 1 19 6022 1 1 12 HIS CA C -1.837 0.996 4.401 1.00 . A A . 12 HIS CA 1 1 19 6023 1 1 12 HIS CB C -2.597 -0.153 5.067 1.00 . A A . 12 HIS CB 1 1 19 6024 1 1 12 HIS CD2 C -4.950 0.466 4.216 1.00 . A A . 12 HIS CD2 1 1 19 6025 1 1 12 HIS CE1 C -6.071 0.272 6.045 1.00 . A A . 12 HIS CE1 1 1 19 6026 1 1 12 HIS CG C -4.111 0.107 5.180 1.00 . A A . 12 HIS CG 1 1 19 6027 1 1 12 HIS H H -1.071 -0.300 2.946 1.00 . A A . 12 HIS H 1 1 19 6028 1 1 12 HIS HA H -2.484 1.873 4.372 1.00 . A A . 12 HIS HA 1 1 19 6029 1 1 12 HIS HB2 H -2.439 -1.062 4.488 1.00 . A A . 12 HIS HB2 1 1 19 6030 1 1 12 HIS HB3 H -2.196 -0.299 6.069 1.00 . A A . 12 HIS HB3 1 1 19 6031 1 1 12 HIS HD1 H -4.421 -0.294 7.191 1.00 . A A . 12 HIS HD1 1 1 19 6032 1 1 12 HIS HD2 H -4.696 0.642 3.182 1.00 . A A . 12 HIS HD2 1 1 19 6033 1 1 12 HIS HE1 H -6.883 0.266 6.758 1.00 . A A . 12 HIS HE1 1 1 19 6034 1 1 12 HIS HE2 H -7.012 0.833 4.274 1.00 . A A . 12 HIS HE2 1 1 19 6035 1 1 12 HIS N N -1.525 0.592 3.016 1.00 . A A . 12 HIS N 1 1 19 6036 1 1 12 HIS ND1 N -4.789 -0.022 6.306 1.00 . A A . 12 HIS ND1 1 1 19 6037 1 1 12 HIS NE2 N -6.166 0.571 4.760 1.00 . A A . 12 HIS NE2 1 1 19 6038 1 1 12 HIS O O -0.623 1.527 6.424 1.00 . A A . 12 HIS O 1 1 19 6039 1 1 13 TYR C C 2.391 3.133 4.504 1.00 . A A . 13 TYR C 1 1 19 6040 1 1 13 TYR CA C 1.863 1.802 5.062 1.00 . A A . 13 TYR CA 1 1 19 6041 1 1 13 TYR CB C 2.801 0.639 4.728 1.00 . A A . 13 TYR CB 1 1 19 6042 1 1 13 TYR CD1 C 2.885 -0.441 6.988 1.00 . A A . 13 TYR CD1 1 1 19 6043 1 1 13 TYR CD2 C 4.947 0.362 6.031 1.00 . A A . 13 TYR CD2 1 1 19 6044 1 1 13 TYR CE1 C 3.577 -0.934 8.083 1.00 . A A . 13 TYR CE1 1 1 19 6045 1 1 13 TYR CE2 C 5.643 -0.134 7.124 1.00 . A A . 13 TYR CE2 1 1 19 6046 1 1 13 TYR CG C 3.570 0.199 5.966 1.00 . A A . 13 TYR CG 1 1 19 6047 1 1 13 TYR CZ C 4.956 -0.770 8.150 1.00 . A A . 13 TYR CZ 1 1 19 6048 1 1 13 TYR H H 0.557 1.213 3.527 1.00 . A A . 13 TYR H 1 1 19 6049 1 1 13 TYR HA H 1.772 1.883 6.145 1.00 . A A . 13 TYR HA 1 1 19 6050 1 1 13 TYR HB2 H 2.214 -0.199 4.354 1.00 . A A . 13 TYR HB2 1 1 19 6051 1 1 13 TYR HB3 H 3.506 0.955 3.959 1.00 . A A . 13 TYR HB3 1 1 19 6052 1 1 13 TYR HD1 H 1.799 -0.541 6.937 1.00 . A A . 13 TYR HD1 1 1 19 6053 1 1 13 TYR HD2 H 5.480 0.870 5.227 1.00 . A A . 13 TYR HD2 1 1 19 6054 1 1 13 TYR HE1 H 3.036 -1.507 8.835 1.00 . A A . 13 TYR HE1 1 1 19 6055 1 1 13 TYR HE2 H 6.733 -0.097 7.129 1.00 . A A . 13 TYR HE2 1 1 19 6056 1 1 13 TYR HH H 4.983 -1.599 9.886 1.00 . A A . 13 TYR HH 1 1 19 6057 1 1 13 TYR N N 0.542 1.479 4.491 1.00 . A A . 13 TYR N 1 1 19 6058 1 1 13 TYR O O 2.323 4.172 5.162 1.00 . A A . 13 TYR O 1 1 19 6059 1 1 13 TYR OH O 5.634 -1.216 9.235 1.00 . A A . 13 TYR OH 1 1 19 6060 1 1 14 ASN C C 1.985 5.364 2.409 1.00 . A A . 14 ASN C 1 1 19 6061 1 1 14 ASN CA C 3.103 4.313 2.454 1.00 . A A . 14 ASN CA 1 1 19 6062 1 1 14 ASN CB C 3.514 3.965 1.025 1.00 . A A . 14 ASN CB 1 1 19 6063 1 1 14 ASN CG C 4.134 5.167 0.304 1.00 . A A . 14 ASN CG 1 1 19 6064 1 1 14 ASN H H 2.810 2.246 2.709 1.00 . A A . 14 ASN H 1 1 19 6065 1 1 14 ASN HA H 3.964 4.764 2.949 1.00 . A A . 14 ASN HA 1 1 19 6066 1 1 14 ASN HB2 H 4.244 3.156 1.054 1.00 . A A . 14 ASN HB2 1 1 19 6067 1 1 14 ASN HB3 H 2.636 3.632 0.473 1.00 . A A . 14 ASN HB3 1 1 19 6068 1 1 14 ASN HD21 H 3.007 4.847 -1.338 1.00 . A A . 14 ASN HD21 1 1 19 6069 1 1 14 ASN HD22 H 4.109 6.201 -1.361 1.00 . A A . 14 ASN HD22 1 1 19 6070 1 1 14 ASN N N 2.726 3.106 3.213 1.00 . A A . 14 ASN N 1 1 19 6071 1 1 14 ASN ND2 N 3.722 5.397 -0.919 1.00 . A A . 14 ASN ND2 1 1 19 6072 1 1 14 ASN O O 2.264 6.515 2.121 1.00 . A A . 14 ASN O 1 1 19 6073 1 1 14 ASN OD1 O 4.971 5.891 0.820 1.00 . A A . 14 ASN OD1 1 1 19 6074 1 1 15 ALA C C 0.024 7.190 3.814 1.00 . A A . 15 ALA C 1 1 19 6075 1 1 15 ALA CA C -0.354 5.963 2.954 1.00 . A A . 15 ALA CA 1 1 19 6076 1 1 15 ALA CB C -1.546 5.229 3.572 1.00 . A A . 15 ALA CB 1 1 19 6077 1 1 15 ALA H H 0.548 4.068 3.060 1.00 . A A . 15 ALA H 1 1 19 6078 1 1 15 ALA HA H -0.645 6.315 1.965 1.00 . A A . 15 ALA HA 1 1 19 6079 1 1 15 ALA HB1 H -1.911 5.788 4.433 1.00 . A A . 15 ALA HB1 1 1 19 6080 1 1 15 ALA HB2 H -2.342 5.143 2.832 1.00 . A A . 15 ALA HB2 1 1 19 6081 1 1 15 ALA HB3 H -1.236 4.234 3.890 1.00 . A A . 15 ALA HB3 1 1 19 6082 1 1 15 ALA N N 0.761 5.006 2.796 1.00 . A A . 15 ALA N 1 1 19 6083 1 1 15 ALA O O -0.425 8.299 3.538 1.00 . A A . 15 ALA O 1 1 19 6084 1 1 16 LEU C C 2.967 8.513 5.055 1.00 . A A . 16 LEU C 1 1 19 6085 1 1 16 LEU CA C 1.583 8.047 5.550 1.00 . A A . 16 LEU CA 1 1 19 6086 1 1 16 LEU CB C 1.693 7.567 6.999 1.00 . A A . 16 LEU CB 1 1 19 6087 1 1 16 LEU CD1 C -0.551 8.102 8.036 1.00 . A A . 16 LEU CD1 1 1 19 6088 1 1 16 LEU CD2 C 1.595 8.519 9.321 1.00 . A A . 16 LEU CD2 1 1 19 6089 1 1 16 LEU CG C 0.927 8.493 7.947 1.00 . A A . 16 LEU CG 1 1 19 6090 1 1 16 LEU H H 1.385 6.074 4.840 1.00 . A A . 16 LEU H 1 1 19 6091 1 1 16 LEU HA H 0.912 8.906 5.532 1.00 . A A . 16 LEU HA 1 1 19 6092 1 1 16 LEU HB2 H 1.280 6.561 7.073 1.00 . A A . 16 LEU HB2 1 1 19 6093 1 1 16 LEU HB3 H 2.744 7.545 7.290 1.00 . A A . 16 LEU HB3 1 1 19 6094 1 1 16 LEU HD11 H -1.066 8.779 8.718 1.00 . A A . 16 LEU HD11 1 1 19 6095 1 1 16 LEU HD12 H -0.635 7.080 8.408 1.00 . A A . 16 LEU HD12 1 1 19 6096 1 1 16 LEU HD13 H -1.005 8.166 7.047 1.00 . A A . 16 LEU HD13 1 1 19 6097 1 1 16 LEU HD21 H 2.619 8.880 9.221 1.00 . A A . 16 LEU HD21 1 1 19 6098 1 1 16 LEU HD22 H 1.039 9.181 9.984 1.00 . A A . 16 LEU HD22 1 1 19 6099 1 1 16 LEU HD23 H 1.605 7.512 9.739 1.00 . A A . 16 LEU HD23 1 1 19 6100 1 1 16 LEU HG H 0.978 9.502 7.536 1.00 . A A . 16 LEU HG 1 1 19 6101 1 1 16 LEU N N 0.987 6.985 4.716 1.00 . A A . 16 LEU N 1 1 19 6102 1 1 16 LEU O O 3.328 9.673 5.233 1.00 . A A . 16 LEU O 1 1 19 6103 1 1 17 ILE C C 4.907 8.479 2.391 1.00 . A A . 17 ILE C 1 1 19 6104 1 1 17 ILE CA C 5.048 7.884 3.824 1.00 . A A . 17 ILE CA 1 1 19 6105 1 1 17 ILE CB C 5.912 6.596 3.844 1.00 . A A . 17 ILE CB 1 1 19 6106 1 1 17 ILE CD1 C 6.275 4.375 5.127 1.00 . A A . 17 ILE CD1 1 1 19 6107 1 1 17 ILE CG1 C 5.811 5.838 5.184 1.00 . A A . 17 ILE CG1 1 1 19 6108 1 1 17 ILE CG2 C 7.389 6.951 3.604 1.00 . A A . 17 ILE CG2 1 1 19 6109 1 1 17 ILE H H 3.433 6.652 4.360 1.00 . A A . 17 ILE H 1 1 19 6110 1 1 17 ILE HA H 5.548 8.628 4.444 1.00 . A A . 17 ILE HA 1 1 19 6111 1 1 17 ILE HB H 5.576 5.937 3.043 1.00 . A A . 17 ILE HB 1 1 19 6112 1 1 17 ILE HD11 H 5.666 3.828 4.408 1.00 . A A . 17 ILE HD11 1 1 19 6113 1 1 17 ILE HD12 H 6.170 3.921 6.112 1.00 . A A . 17 ILE HD12 1 1 19 6114 1 1 17 ILE HD13 H 7.320 4.337 4.820 1.00 . A A . 17 ILE HD13 1 1 19 6115 1 1 17 ILE HG12 H 6.426 6.361 5.917 1.00 . A A . 17 ILE HG12 1 1 19 6116 1 1 17 ILE HG13 H 4.774 5.861 5.519 1.00 . A A . 17 ILE HG13 1 1 19 6117 1 1 17 ILE HG21 H 7.485 7.489 2.660 1.00 . A A . 17 ILE HG21 1 1 19 6118 1 1 17 ILE HG22 H 7.981 6.036 3.563 1.00 . A A . 17 ILE HG22 1 1 19 6119 1 1 17 ILE HG23 H 7.748 7.580 4.419 1.00 . A A . 17 ILE HG23 1 1 19 6120 1 1 17 ILE N N 3.722 7.604 4.437 1.00 . A A . 17 ILE N 1 1 19 6121 1 1 17 ILE O O 5.884 8.725 1.680 1.00 . A A . 17 ILE O 1 1 19 6122 1 1 18 ARG C C 3.477 10.922 0.718 1.00 . A A . 18 ARG C 1 1 19 6123 1 1 18 ARG CA C 3.331 9.400 0.699 1.00 . A A . 18 ARG CA 1 1 19 6124 1 1 18 ARG CB C 1.906 8.994 0.319 1.00 . A A . 18 ARG CB 1 1 19 6125 1 1 18 ARG CD C 0.532 7.470 -1.195 1.00 . A A . 18 ARG CD 1 1 19 6126 1 1 18 ARG CG C 1.893 8.127 -0.941 1.00 . A A . 18 ARG CG 1 1 19 6127 1 1 18 ARG CZ C -1.229 9.284 -1.285 1.00 . A A . 18 ARG CZ 1 1 19 6128 1 1 18 ARG H H 2.887 8.566 2.561 1.00 . A A . 18 ARG H 1 1 19 6129 1 1 18 ARG HA H 4.016 8.996 -0.047 1.00 . A A . 18 ARG HA 1 1 19 6130 1 1 18 ARG HB2 H 1.461 8.435 1.143 1.00 . A A . 18 ARG HB2 1 1 19 6131 1 1 18 ARG HB3 H 1.316 9.893 0.137 1.00 . A A . 18 ARG HB3 1 1 19 6132 1 1 18 ARG HD2 H 0.681 6.598 -1.831 1.00 . A A . 18 ARG HD2 1 1 19 6133 1 1 18 ARG HD3 H 0.115 7.144 -0.242 1.00 . A A . 18 ARG HD3 1 1 19 6134 1 1 18 ARG HE H -0.509 8.259 -2.841 1.00 . A A . 18 ARG HE 1 1 19 6135 1 1 18 ARG HG2 H 2.152 8.747 -1.799 1.00 . A A . 18 ARG HG2 1 1 19 6136 1 1 18 ARG HG3 H 2.643 7.344 -0.833 1.00 . A A . 18 ARG HG3 1 1 19 6137 1 1 18 ARG HH11 H -0.619 9.000 0.614 1.00 . A A . 18 ARG HH11 1 1 19 6138 1 1 18 ARG HH12 H -1.844 10.204 0.414 1.00 . A A . 18 ARG HH12 1 1 19 6139 1 1 18 ARG HH21 H -2.093 9.852 -3.027 1.00 . A A . 18 ARG HH21 1 1 19 6140 1 1 18 ARG HH22 H -2.636 10.681 -1.609 1.00 . A A . 18 ARG HH22 1 1 19 6141 1 1 18 ARG N N 3.678 8.830 2.013 1.00 . A A . 18 ARG N 1 1 19 6142 1 1 18 ARG NE N -0.435 8.374 -1.855 1.00 . A A . 18 ARG NE 1 1 19 6143 1 1 18 ARG NH1 N -1.243 9.512 0.020 1.00 . A A . 18 ARG NH1 1 1 19 6144 1 1 18 ARG NH2 N -2.051 9.999 -2.043 1.00 . A A . 18 ARG NH2 1 1 19 6145 1 1 18 ARG O O 2.603 11.658 1.176 1.00 . A A . 18 ARG O 1 1 19 6146 1 1 19 ALA C C 6.357 12.906 -0.610 1.00 . A A . 19 ALA C 1 1 19 6147 1 1 19 ALA CA C 5.099 12.741 0.263 1.00 . A A . 19 ALA CA 1 1 19 6148 1 1 19 ALA CB C 5.301 13.313 1.677 1.00 . A A . 19 ALA CB 1 1 19 6149 1 1 19 ALA H H 5.420 10.650 0.241 1.00 . A A . 19 ALA H 1 1 19 6150 1 1 19 ALA HA H 4.288 13.295 -0.210 1.00 . A A . 19 ALA HA 1 1 19 6151 1 1 19 ALA HB1 H 5.603 14.358 1.607 1.00 . A A . 19 ALA HB1 1 1 19 6152 1 1 19 ALA HB2 H 4.367 13.242 2.235 1.00 . A A . 19 ALA HB2 1 1 19 6153 1 1 19 ALA HB3 H 6.076 12.744 2.191 1.00 . A A . 19 ALA HB3 1 1 19 6154 1 1 19 ALA N N 4.689 11.324 0.352 1.00 . A A . 19 ALA N 1 1 19 6155 1 1 19 ALA O O 7.446 13.271 -0.169 1.00 . A A . 19 ALA O 1 1 19 6156 1 1 20 PHE C C 7.122 13.970 -3.742 1.00 . A A . 20 PHE C 1 1 19 6157 1 1 20 PHE CA C 7.237 12.680 -2.906 1.00 . A A . 20 PHE CA 1 1 19 6158 1 1 20 PHE CB C 7.230 11.430 -3.796 1.00 . A A . 20 PHE CB 1 1 19 6159 1 1 20 PHE CD1 C 9.750 11.182 -4.034 1.00 . A A . 20 PHE CD1 1 1 19 6160 1 1 20 PHE CD2 C 8.458 9.291 -3.290 1.00 . A A . 20 PHE CD2 1 1 19 6161 1 1 20 PHE CE1 C 10.903 10.407 -3.997 1.00 . A A . 20 PHE CE1 1 1 19 6162 1 1 20 PHE CE2 C 9.612 8.517 -3.257 1.00 . A A . 20 PHE CE2 1 1 19 6163 1 1 20 PHE CG C 8.524 10.624 -3.678 1.00 . A A . 20 PHE CG 1 1 19 6164 1 1 20 PHE CZ C 10.833 9.075 -3.611 1.00 . A A . 20 PHE CZ 1 1 19 6165 1 1 20 PHE H H 5.327 12.132 -2.186 1.00 . A A . 20 PHE H 1 1 19 6166 1 1 20 PHE HA H 8.195 12.709 -2.386 1.00 . A A . 20 PHE HA 1 1 19 6167 1 1 20 PHE HB2 H 6.391 10.796 -3.510 1.00 . A A . 20 PHE HB2 1 1 19 6168 1 1 20 PHE HB3 H 7.104 11.739 -4.833 1.00 . A A . 20 PHE HB3 1 1 19 6169 1 1 20 PHE HD1 H 9.807 12.224 -4.348 1.00 . A A . 20 PHE HD1 1 1 19 6170 1 1 20 PHE HD2 H 7.499 8.851 -3.016 1.00 . A A . 20 PHE HD2 1 1 19 6171 1 1 20 PHE HE1 H 11.864 10.852 -4.255 1.00 . A A . 20 PHE HE1 1 1 19 6172 1 1 20 PHE HE2 H 9.556 7.472 -2.949 1.00 . A A . 20 PHE HE2 1 1 19 6173 1 1 20 PHE HZ H 11.739 8.466 -3.586 1.00 . A A . 20 PHE HZ 1 1 19 6174 1 1 20 PHE N N 6.176 12.560 -1.882 1.00 . A A . 20 PHE N 1 1 19 6175 1 1 20 PHE O O 6.430 13.945 -4.786 1.00 . A A . 20 PHE O 1 1 20 6176 1 1 1 HIS C C -6.174 -12.671 -6.075 1.00 . A A . 1 HIS C 1 1 20 6177 1 1 1 HIS CA C -7.643 -12.221 -6.210 1.00 . A A . 1 HIS CA 1 1 20 6178 1 1 1 HIS CB C -7.789 -11.220 -7.368 1.00 . A A . 1 HIS CB 1 1 20 6179 1 1 1 HIS CD2 C -10.313 -11.686 -7.634 1.00 . A A . 1 HIS CD2 1 1 20 6180 1 1 1 HIS CE1 C -10.847 -10.178 -9.075 1.00 . A A . 1 HIS CE1 1 1 20 6181 1 1 1 HIS CG C -9.218 -10.984 -7.916 1.00 . A A . 1 HIS CG 1 1 20 6182 1 1 1 HIS H1 H -7.588 -11.625 -4.145 1.00 . A A . 1 HIS H1 1 1 20 6183 1 1 1 HIS HA H -8.227 -13.103 -6.470 1.00 . A A . 1 HIS HA 1 1 20 6184 1 1 1 HIS HB2 H -7.388 -10.260 -7.040 1.00 . A A . 1 HIS HB2 1 1 20 6185 1 1 1 HIS HB3 H -7.175 -11.580 -8.194 1.00 . A A . 1 HIS HB3 1 1 20 6186 1 1 1 HIS HD1 H -8.927 -9.398 -9.236 1.00 . A A . 1 HIS HD1 1 1 20 6187 1 1 1 HIS HD2 H -10.376 -12.518 -6.948 1.00 . A A . 1 HIS HD2 1 1 20 6188 1 1 1 HIS HE1 H -11.414 -9.567 -9.763 1.00 . A A . 1 HIS HE1 1 1 20 6189 1 1 1 HIS HE2 H -12.271 -11.510 -8.339 1.00 . A A . 1 HIS HE2 1 1 20 6190 1 1 1 HIS N N -8.203 -11.680 -4.944 1.00 . A A . 1 HIS N 1 1 20 6191 1 1 1 HIS ND1 N -9.544 -10.059 -8.800 1.00 . A A . 1 HIS ND1 1 1 20 6192 1 1 1 HIS NE2 N -11.316 -11.183 -8.349 1.00 . A A . 1 HIS NE2 1 1 20 6193 1 1 1 HIS O O -5.856 -13.847 -6.232 1.00 . A A . 1 HIS O 1 1 20 6194 1 1 2 GLY C C -3.142 -10.614 -5.210 1.00 . A A . 2 GLY C 1 1 20 6195 1 1 2 GLY CA C -3.872 -11.928 -5.501 1.00 . A A . 2 GLY CA 1 1 20 6196 1 1 2 GLY H H -5.599 -10.737 -5.675 1.00 . A A . 2 GLY H 1 1 20 6197 1 1 2 GLY HA2 H -3.763 -12.597 -4.646 1.00 . A A . 2 GLY HA2 1 1 20 6198 1 1 2 GLY HA3 H -3.426 -12.396 -6.379 1.00 . A A . 2 GLY HA3 1 1 20 6199 1 1 2 GLY N N -5.308 -11.695 -5.755 1.00 . A A . 2 GLY N 1 1 20 6200 1 1 2 GLY O O -3.208 -10.076 -4.103 1.00 . A A . 2 GLY O 1 1 20 6201 1 1 3 LEU C C -2.927 -7.534 -5.745 1.00 . A A . 3 LEU C 1 1 20 6202 1 1 3 LEU CA C -2.022 -8.673 -6.246 1.00 . A A . 3 LEU CA 1 1 20 6203 1 1 3 LEU CB C -1.388 -8.282 -7.588 1.00 . A A . 3 LEU CB 1 1 20 6204 1 1 3 LEU CD1 C -1.845 -6.849 -9.581 1.00 . A A . 3 LEU CD1 1 1 20 6205 1 1 3 LEU CD2 C -2.718 -9.200 -9.533 1.00 . A A . 3 LEU CD2 1 1 20 6206 1 1 3 LEU CG C -2.402 -7.960 -8.693 1.00 . A A . 3 LEU CG 1 1 20 6207 1 1 3 LEU H H -2.704 -10.432 -7.193 1.00 . A A . 3 LEU H 1 1 20 6208 1 1 3 LEU HA H -1.207 -8.766 -5.528 1.00 . A A . 3 LEU HA 1 1 20 6209 1 1 3 LEU HB2 H -0.753 -7.410 -7.433 1.00 . A A . 3 LEU HB2 1 1 20 6210 1 1 3 LEU HB3 H -0.766 -9.111 -7.926 1.00 . A A . 3 LEU HB3 1 1 20 6211 1 1 3 LEU HD11 H -2.562 -6.618 -10.368 1.00 . A A . 3 LEU HD11 1 1 20 6212 1 1 3 LEU HD12 H -0.908 -7.179 -10.031 1.00 . A A . 3 LEU HD12 1 1 20 6213 1 1 3 LEU HD13 H -1.665 -5.958 -8.979 1.00 . A A . 3 LEU HD13 1 1 20 6214 1 1 3 LEU HD21 H -3.457 -8.945 -10.293 1.00 . A A . 3 LEU HD21 1 1 20 6215 1 1 3 LEU HD22 H -3.113 -9.985 -8.889 1.00 . A A . 3 LEU HD22 1 1 20 6216 1 1 3 LEU HD23 H -1.806 -9.553 -10.017 1.00 . A A . 3 LEU HD23 1 1 20 6217 1 1 3 LEU HG H -3.323 -7.608 -8.230 1.00 . A A . 3 LEU HG 1 1 20 6218 1 1 3 LEU N N -2.697 -9.989 -6.297 1.00 . A A . 3 LEU N 1 1 20 6219 1 1 3 LEU O O -2.512 -6.741 -4.904 1.00 . A A . 3 LEU O 1 1 20 6220 1 1 4 ALA C C -5.321 -6.614 -4.088 1.00 . A A . 4 ALA C 1 1 20 6221 1 1 4 ALA CA C -5.249 -6.677 -5.626 1.00 . A A . 4 ALA CA 1 1 20 6222 1 1 4 ALA CB C -6.608 -7.075 -6.210 1.00 . A A . 4 ALA CB 1 1 20 6223 1 1 4 ALA H H -4.514 -8.248 -6.809 1.00 . A A . 4 ALA H 1 1 20 6224 1 1 4 ALA HA H -5.004 -5.681 -5.993 1.00 . A A . 4 ALA HA 1 1 20 6225 1 1 4 ALA HB1 H -6.539 -7.115 -7.297 1.00 . A A . 4 ALA HB1 1 1 20 6226 1 1 4 ALA HB2 H -7.357 -6.339 -5.920 1.00 . A A . 4 ALA HB2 1 1 20 6227 1 1 4 ALA HB3 H -6.895 -8.055 -5.828 1.00 . A A . 4 ALA HB3 1 1 20 6228 1 1 4 ALA N N -4.210 -7.609 -6.107 1.00 . A A . 4 ALA N 1 1 20 6229 1 1 4 ALA O O -5.498 -5.538 -3.537 1.00 . A A . 4 ALA O 1 1 20 6230 1 1 5 SER C C -3.463 -7.408 -1.419 1.00 . A A . 5 SER C 1 1 20 6231 1 1 5 SER CA C -4.831 -7.845 -1.981 1.00 . A A . 5 SER CA 1 1 20 6232 1 1 5 SER CB C -5.103 -9.304 -1.616 1.00 . A A . 5 SER CB 1 1 20 6233 1 1 5 SER H H -4.459 -8.450 -3.952 1.00 . A A . 5 SER H 1 1 20 6234 1 1 5 SER HA H -5.608 -7.222 -1.538 1.00 . A A . 5 SER HA 1 1 20 6235 1 1 5 SER HB2 H -5.841 -9.721 -2.301 1.00 . A A . 5 SER HB2 1 1 20 6236 1 1 5 SER HB3 H -4.178 -9.877 -1.683 1.00 . A A . 5 SER HB3 1 1 20 6237 1 1 5 SER HG H -5.780 -10.309 -0.019 1.00 . A A . 5 SER HG 1 1 20 6238 1 1 5 SER N N -4.891 -7.704 -3.450 1.00 . A A . 5 SER N 1 1 20 6239 1 1 5 SER O O -3.393 -6.675 -0.437 1.00 . A A . 5 SER O 1 1 20 6240 1 1 5 SER OG O -5.604 -9.360 -0.283 1.00 . A A . 5 SER OG 1 1 20 6241 1 1 6 THR C C -0.887 -5.721 -1.844 1.00 . A A . 6 THR C 1 1 20 6242 1 1 6 THR CA C -1.010 -7.262 -1.834 1.00 . A A . 6 THR CA 1 1 20 6243 1 1 6 THR CB C 0.049 -7.872 -2.772 1.00 . A A . 6 THR CB 1 1 20 6244 1 1 6 THR CG2 C 0.003 -9.406 -2.776 1.00 . A A . 6 THR CG2 1 1 20 6245 1 1 6 THR H H -2.427 -8.462 -2.829 1.00 . A A . 6 THR H 1 1 20 6246 1 1 6 THR HA H -0.770 -7.595 -0.824 1.00 . A A . 6 THR HA 1 1 20 6247 1 1 6 THR HB H 1.028 -7.573 -2.402 1.00 . A A . 6 THR HB 1 1 20 6248 1 1 6 THR HG1 H -0.974 -6.925 -4.251 1.00 . A A . 6 THR HG1 1 1 20 6249 1 1 6 THR HG21 H 0.188 -9.777 -1.768 1.00 . A A . 6 THR HG21 1 1 20 6250 1 1 6 THR HG22 H 0.767 -9.790 -3.451 1.00 . A A . 6 THR HG22 1 1 20 6251 1 1 6 THR HG23 H -0.979 -9.739 -3.111 1.00 . A A . 6 THR HG23 1 1 20 6252 1 1 6 THR N N -2.386 -7.743 -2.135 1.00 . A A . 6 THR N 1 1 20 6253 1 1 6 THR O O -0.128 -5.140 -1.070 1.00 . A A . 6 THR O 1 1 20 6254 1 1 6 THR OG1 O -0.080 -7.372 -4.105 1.00 . A A . 6 THR OG1 1 1 20 6255 1 1 7 LEU C C -3.041 -3.080 -1.735 1.00 . A A . 7 LEU C 1 1 20 6256 1 1 7 LEU CA C -1.939 -3.622 -2.667 1.00 . A A . 7 LEU CA 1 1 20 6257 1 1 7 LEU CB C -2.237 -3.181 -4.104 1.00 . A A . 7 LEU CB 1 1 20 6258 1 1 7 LEU CD1 C -0.980 -4.185 -6.046 1.00 . A A . 7 LEU CD1 1 1 20 6259 1 1 7 LEU CD2 C -0.867 -1.711 -5.591 1.00 . A A . 7 LEU CD2 1 1 20 6260 1 1 7 LEU CG C -0.976 -3.103 -4.966 1.00 . A A . 7 LEU CG 1 1 20 6261 1 1 7 LEU H H -2.420 -5.589 -3.191 1.00 . A A . 7 LEU H 1 1 20 6262 1 1 7 LEU HA H -0.994 -3.169 -2.367 1.00 . A A . 7 LEU HA 1 1 20 6263 1 1 7 LEU HB2 H -2.924 -3.898 -4.554 1.00 . A A . 7 LEU HB2 1 1 20 6264 1 1 7 LEU HB3 H -2.713 -2.201 -4.083 1.00 . A A . 7 LEU HB3 1 1 20 6265 1 1 7 LEU HD11 H -1.058 -5.166 -5.578 1.00 . A A . 7 LEU HD11 1 1 20 6266 1 1 7 LEU HD12 H -1.830 -4.031 -6.711 1.00 . A A . 7 LEU HD12 1 1 20 6267 1 1 7 LEU HD13 H -0.055 -4.129 -6.621 1.00 . A A . 7 LEU HD13 1 1 20 6268 1 1 7 LEU HD21 H -1.743 -1.524 -6.213 1.00 . A A . 7 LEU HD21 1 1 20 6269 1 1 7 LEU HD22 H 0.032 -1.658 -6.204 1.00 . A A . 7 LEU HD22 1 1 20 6270 1 1 7 LEU HD23 H -0.814 -0.961 -4.802 1.00 . A A . 7 LEU HD23 1 1 20 6271 1 1 7 LEU HG H -0.109 -3.260 -4.323 1.00 . A A . 7 LEU HG 1 1 20 6272 1 1 7 LEU N N -1.777 -5.089 -2.610 1.00 . A A . 7 LEU N 1 1 20 6273 1 1 7 LEU O O -3.280 -1.882 -1.712 1.00 . A A . 7 LEU O 1 1 20 6274 1 1 8 THR C C -3.877 -3.541 1.573 1.00 . A A . 8 THR C 1 1 20 6275 1 1 8 THR CA C -4.552 -3.585 0.182 1.00 . A A . 8 THR CA 1 1 20 6276 1 1 8 THR CB C -5.737 -4.571 0.101 1.00 . A A . 8 THR CB 1 1 20 6277 1 1 8 THR CG2 C -6.799 -4.444 1.199 1.00 . A A . 8 THR CG2 1 1 20 6278 1 1 8 THR H H -3.420 -4.926 -0.953 1.00 . A A . 8 THR H 1 1 20 6279 1 1 8 THR HA H -4.932 -2.587 -0.037 1.00 . A A . 8 THR HA 1 1 20 6280 1 1 8 THR HB H -5.341 -5.586 0.123 1.00 . A A . 8 THR HB 1 1 20 6281 1 1 8 THR HG1 H -7.144 -4.988 -1.270 1.00 . A A . 8 THR HG1 1 1 20 6282 1 1 8 THR HG21 H -7.235 -3.445 1.169 1.00 . A A . 8 THR HG21 1 1 20 6283 1 1 8 THR HG22 H -7.580 -5.187 1.038 1.00 . A A . 8 THR HG22 1 1 20 6284 1 1 8 THR HG23 H -6.337 -4.609 2.172 1.00 . A A . 8 THR HG23 1 1 20 6285 1 1 8 THR N N -3.568 -3.940 -0.870 1.00 . A A . 8 THR N 1 1 20 6286 1 1 8 THR O O -4.423 -2.995 2.527 1.00 . A A . 8 THR O 1 1 20 6287 1 1 8 THR OG1 O -6.371 -4.363 -1.161 1.00 . A A . 8 THR OG1 1 1 20 6288 1 1 9 ARG C C -0.665 -3.033 2.817 1.00 . A A . 9 ARG C 1 1 20 6289 1 1 9 ARG CA C -1.823 -4.037 2.864 1.00 . A A . 9 ARG CA 1 1 20 6290 1 1 9 ARG CB C -1.270 -5.430 3.152 1.00 . A A . 9 ARG CB 1 1 20 6291 1 1 9 ARG CD C -1.817 -7.582 4.313 1.00 . A A . 9 ARG CD 1 1 20 6292 1 1 9 ARG CG C -2.385 -6.416 3.505 1.00 . A A . 9 ARG CG 1 1 20 6293 1 1 9 ARG CZ C -0.471 -7.650 6.429 1.00 . A A . 9 ARG CZ 1 1 20 6294 1 1 9 ARG H H -2.261 -4.545 0.865 1.00 . A A . 9 ARG H 1 1 20 6295 1 1 9 ARG HA H -2.471 -3.758 3.695 1.00 . A A . 9 ARG HA 1 1 20 6296 1 1 9 ARG HB2 H -0.745 -5.792 2.268 1.00 . A A . 9 ARG HB2 1 1 20 6297 1 1 9 ARG HB3 H -0.569 -5.371 3.985 1.00 . A A . 9 ARG HB3 1 1 20 6298 1 1 9 ARG HD2 H -2.587 -8.342 4.447 1.00 . A A . 9 ARG HD2 1 1 20 6299 1 1 9 ARG HD3 H -0.967 -8.012 3.784 1.00 . A A . 9 ARG HD3 1 1 20 6300 1 1 9 ARG HE H -1.811 -6.239 5.936 1.00 . A A . 9 ARG HE 1 1 20 6301 1 1 9 ARG HG2 H -3.145 -5.905 4.096 1.00 . A A . 9 ARG HG2 1 1 20 6302 1 1 9 ARG HG3 H -2.835 -6.797 2.588 1.00 . A A . 9 ARG HG3 1 1 20 6303 1 1 9 ARG HH11 H 0.016 -9.133 5.172 1.00 . A A . 9 ARG HH11 1 1 20 6304 1 1 9 ARG HH12 H 0.875 -9.139 6.679 1.00 . A A . 9 ARG HH12 1 1 20 6305 1 1 9 ARG HH21 H -0.663 -6.273 7.902 1.00 . A A . 9 ARG HH21 1 1 20 6306 1 1 9 ARG HH22 H 0.486 -7.531 8.195 1.00 . A A . 9 ARG HH22 1 1 20 6307 1 1 9 ARG N N -2.644 -4.041 1.634 1.00 . A A . 9 ARG N 1 1 20 6308 1 1 9 ARG NE N -1.379 -7.085 5.632 1.00 . A A . 9 ARG NE 1 1 20 6309 1 1 9 ARG NH1 N 0.202 -8.732 6.067 1.00 . A A . 9 ARG NH1 1 1 20 6310 1 1 9 ARG NH2 N -0.192 -7.101 7.604 1.00 . A A . 9 ARG NH2 1 1 20 6311 1 1 9 ARG O O -0.582 -2.141 3.655 1.00 . A A . 9 ARG O 1 1 20 6312 1 1 10 TRP C C 0.670 -0.677 1.371 1.00 . A A . 10 TRP C 1 1 20 6313 1 1 10 TRP CA C 1.222 -2.111 1.535 1.00 . A A . 10 TRP CA 1 1 20 6314 1 1 10 TRP CB C 2.098 -2.614 0.380 1.00 . A A . 10 TRP CB 1 1 20 6315 1 1 10 TRP CD1 C 1.814 -1.385 -1.825 1.00 . A A . 10 TRP CD1 1 1 20 6316 1 1 10 TRP CD2 C 3.381 -0.542 -0.547 1.00 . A A . 10 TRP CD2 1 1 20 6317 1 1 10 TRP CE2 C 3.267 0.224 -1.700 1.00 . A A . 10 TRP CE2 1 1 20 6318 1 1 10 TRP CE3 C 4.320 -0.223 0.426 1.00 . A A . 10 TRP CE3 1 1 20 6319 1 1 10 TRP CG C 2.443 -1.549 -0.668 1.00 . A A . 10 TRP CG 1 1 20 6320 1 1 10 TRP CH2 C 5.039 1.645 -0.912 1.00 . A A . 10 TRP CH2 1 1 20 6321 1 1 10 TRP CZ2 C 4.107 1.315 -1.890 1.00 . A A . 10 TRP CZ2 1 1 20 6322 1 1 10 TRP CZ3 C 5.142 0.881 0.239 1.00 . A A . 10 TRP CZ3 1 1 20 6323 1 1 10 TRP H H 0.127 -3.858 1.108 1.00 . A A . 10 TRP H 1 1 20 6324 1 1 10 TRP HA H 1.848 -2.108 2.428 1.00 . A A . 10 TRP HA 1 1 20 6325 1 1 10 TRP HB2 H 3.026 -3.009 0.793 1.00 . A A . 10 TRP HB2 1 1 20 6326 1 1 10 TRP HB3 H 1.569 -3.424 -0.121 1.00 . A A . 10 TRP HB3 1 1 20 6327 1 1 10 TRP HD1 H 1.013 -2.023 -2.199 1.00 . A A . 10 TRP HD1 1 1 20 6328 1 1 10 TRP HE1 H 2.045 -0.011 -3.361 1.00 . A A . 10 TRP HE1 1 1 20 6329 1 1 10 TRP HE3 H 4.479 -0.880 1.280 1.00 . A A . 10 TRP HE3 1 1 20 6330 1 1 10 TRP HH2 H 5.663 2.533 -1.035 1.00 . A A . 10 TRP HH2 1 1 20 6331 1 1 10 TRP HZ2 H 4.118 1.834 -2.847 1.00 . A A . 10 TRP HZ2 1 1 20 6332 1 1 10 TRP HZ3 H 5.833 1.173 1.033 1.00 . A A . 10 TRP HZ3 1 1 20 6333 1 1 10 TRP N N 0.153 -3.105 1.766 1.00 . A A . 10 TRP N 1 1 20 6334 1 1 10 TRP NE1 N 2.313 -0.320 -2.446 1.00 . A A . 10 TRP NE1 1 1 20 6335 1 1 10 TRP O O 1.264 0.286 1.862 1.00 . A A . 10 TRP O 1 1 20 6336 1 1 11 ALA C C -1.916 1.151 2.113 1.00 . A A . 11 ALA C 1 1 20 6337 1 1 11 ALA CA C -1.321 0.671 0.774 1.00 . A A . 11 ALA CA 1 1 20 6338 1 1 11 ALA CB C -2.437 0.528 -0.261 1.00 . A A . 11 ALA CB 1 1 20 6339 1 1 11 ALA H H -1.066 -1.409 0.583 1.00 . A A . 11 ALA H 1 1 20 6340 1 1 11 ALA HA H -0.637 1.442 0.420 1.00 . A A . 11 ALA HA 1 1 20 6341 1 1 11 ALA HB1 H -2.920 1.494 -0.411 1.00 . A A . 11 ALA HB1 1 1 20 6342 1 1 11 ALA HB2 H -3.172 -0.194 0.095 1.00 . A A . 11 ALA HB2 1 1 20 6343 1 1 11 ALA HB3 H -2.015 0.183 -1.205 1.00 . A A . 11 ALA HB3 1 1 20 6344 1 1 11 ALA N N -0.564 -0.595 0.868 1.00 . A A . 11 ALA N 1 1 20 6345 1 1 11 ALA O O -2.732 2.067 2.155 1.00 . A A . 11 ALA O 1 1 20 6346 1 1 12 HIS C C -0.493 1.348 5.327 1.00 . A A . 12 HIS C 1 1 20 6347 1 1 12 HIS CA C -1.780 0.901 4.593 1.00 . A A . 12 HIS CA 1 1 20 6348 1 1 12 HIS CB C -2.491 -0.292 5.251 1.00 . A A . 12 HIS CB 1 1 20 6349 1 1 12 HIS CD2 C -1.513 -0.925 7.513 1.00 . A A . 12 HIS CD2 1 1 20 6350 1 1 12 HIS CE1 C -2.848 0.089 8.856 1.00 . A A . 12 HIS CE1 1 1 20 6351 1 1 12 HIS CG C -2.459 -0.330 6.792 1.00 . A A . 12 HIS CG 1 1 20 6352 1 1 12 HIS H H -1.044 -0.384 3.126 1.00 . A A . 12 HIS H 1 1 20 6353 1 1 12 HIS HA H -2.473 1.743 4.576 1.00 . A A . 12 HIS HA 1 1 20 6354 1 1 12 HIS HB2 H -3.534 -0.271 4.939 1.00 . A A . 12 HIS HB2 1 1 20 6355 1 1 12 HIS HB3 H -2.039 -1.209 4.875 1.00 . A A . 12 HIS HB3 1 1 20 6356 1 1 12 HIS HD1 H -4.151 0.733 7.360 1.00 . A A . 12 HIS HD1 1 1 20 6357 1 1 12 HIS HD2 H -0.696 -1.516 7.127 1.00 . A A . 12 HIS HD2 1 1 20 6358 1 1 12 HIS HE1 H -3.301 0.479 9.755 1.00 . A A . 12 HIS HE1 1 1 20 6359 1 1 12 HIS HE2 H -1.202 -0.974 9.581 1.00 . A A . 12 HIS HE2 1 1 20 6360 1 1 12 HIS N N -1.499 0.507 3.199 1.00 . A A . 12 HIS N 1 1 20 6361 1 1 12 HIS ND1 N -3.293 0.275 7.608 1.00 . A A . 12 HIS ND1 1 1 20 6362 1 1 12 HIS NE2 N -1.753 -0.660 8.795 1.00 . A A . 12 HIS NE2 1 1 20 6363 1 1 12 HIS O O -0.562 1.949 6.394 1.00 . A A . 12 HIS O 1 1 20 6364 1 1 13 TYR C C 2.481 2.809 4.701 1.00 . A A . 13 TYR C 1 1 20 6365 1 1 13 TYR CA C 1.987 1.444 5.213 1.00 . A A . 13 TYR CA 1 1 20 6366 1 1 13 TYR CB C 2.916 0.313 4.768 1.00 . A A . 13 TYR CB 1 1 20 6367 1 1 13 TYR CD1 C 4.679 -0.010 6.529 1.00 . A A . 13 TYR CD1 1 1 20 6368 1 1 13 TYR CD2 C 2.826 -1.553 6.445 1.00 . A A . 13 TYR CD2 1 1 20 6369 1 1 13 TYR CE1 C 5.239 -0.737 7.569 1.00 . A A . 13 TYR CE1 1 1 20 6370 1 1 13 TYR CE2 C 3.382 -2.283 7.485 1.00 . A A . 13 TYR CE2 1 1 20 6371 1 1 13 TYR CG C 3.480 -0.428 5.973 1.00 . A A . 13 TYR CG 1 1 20 6372 1 1 13 TYR CZ C 4.584 -1.865 8.050 1.00 . A A . 13 TYR CZ 1 1 20 6373 1 1 13 TYR H H 0.656 0.733 3.762 1.00 . A A . 13 TYR H 1 1 20 6374 1 1 13 TYR HA H 1.941 1.464 6.302 1.00 . A A . 13 TYR HA 1 1 20 6375 1 1 13 TYR HB2 H 2.358 -0.386 4.145 1.00 . A A . 13 TYR HB2 1 1 20 6376 1 1 13 TYR HB3 H 3.738 0.733 4.189 1.00 . A A . 13 TYR HB3 1 1 20 6377 1 1 13 TYR HD1 H 5.170 0.894 6.167 1.00 . A A . 13 TYR HD1 1 1 20 6378 1 1 13 TYR HD2 H 1.866 -1.847 6.021 1.00 . A A . 13 TYR HD2 1 1 20 6379 1 1 13 TYR HE1 H 6.220 -0.460 7.953 1.00 . A A . 13 TYR HE1 1 1 20 6380 1 1 13 TYR HE2 H 2.912 -3.218 7.786 1.00 . A A . 13 TYR HE2 1 1 20 6381 1 1 13 TYR HH H 4.484 -3.281 9.346 1.00 . A A . 13 TYR HH 1 1 20 6382 1 1 13 TYR N N 0.648 1.141 4.675 1.00 . A A . 13 TYR N 1 1 20 6383 1 1 13 TYR O O 2.315 3.842 5.351 1.00 . A A . 13 TYR O 1 1 20 6384 1 1 13 TYR OH O 5.114 -2.551 9.090 1.00 . A A . 13 TYR OH 1 1 20 6385 1 1 14 ASN C C 2.116 4.958 2.388 1.00 . A A . 14 ASN C 1 1 20 6386 1 1 14 ASN CA C 3.288 4.038 2.727 1.00 . A A . 14 ASN CA 1 1 20 6387 1 1 14 ASN CB C 4.045 3.734 1.445 1.00 . A A . 14 ASN CB 1 1 20 6388 1 1 14 ASN CG C 5.557 3.826 1.644 1.00 . A A . 14 ASN CG 1 1 20 6389 1 1 14 ASN H H 2.877 1.980 2.879 1.00 . A A . 14 ASN H 1 1 20 6390 1 1 14 ASN HA H 3.961 4.591 3.383 1.00 . A A . 14 ASN HA 1 1 20 6391 1 1 14 ASN HB2 H 3.794 2.725 1.117 1.00 . A A . 14 ASN HB2 1 1 20 6392 1 1 14 ASN HB3 H 3.744 4.444 0.675 1.00 . A A . 14 ASN HB3 1 1 20 6393 1 1 14 ASN HD21 H 5.660 5.303 0.286 1.00 . A A . 14 ASN HD21 1 1 20 6394 1 1 14 ASN HD22 H 7.166 4.743 0.961 1.00 . A A . 14 ASN HD22 1 1 20 6395 1 1 14 ASN N N 2.887 2.810 3.435 1.00 . A A . 14 ASN N 1 1 20 6396 1 1 14 ASN ND2 N 6.177 4.683 0.869 1.00 . A A . 14 ASN ND2 1 1 20 6397 1 1 14 ASN O O 2.349 6.072 1.952 1.00 . A A . 14 ASN O 1 1 20 6398 1 1 14 ASN OD1 O 6.172 3.134 2.444 1.00 . A A . 14 ASN OD1 1 1 20 6399 1 1 15 ALA C C -0.191 6.688 3.212 1.00 . A A . 15 ALA C 1 1 20 6400 1 1 15 ALA CA C -0.325 5.349 2.468 1.00 . A A . 15 ALA CA 1 1 20 6401 1 1 15 ALA CB C -1.522 4.618 3.064 1.00 . A A . 15 ALA CB 1 1 20 6402 1 1 15 ALA H H 0.704 3.526 2.724 1.00 . A A . 15 ALA H 1 1 20 6403 1 1 15 ALA HA H -0.521 5.548 1.415 1.00 . A A . 15 ALA HA 1 1 20 6404 1 1 15 ALA HB1 H -1.904 5.179 3.917 1.00 . A A . 15 ALA HB1 1 1 20 6405 1 1 15 ALA HB2 H -1.215 3.624 3.392 1.00 . A A . 15 ALA HB2 1 1 20 6406 1 1 15 ALA HB3 H -2.304 4.526 2.310 1.00 . A A . 15 ALA HB3 1 1 20 6407 1 1 15 ALA N N 0.881 4.496 2.579 1.00 . A A . 15 ALA N 1 1 20 6408 1 1 15 ALA O O -0.758 7.693 2.796 1.00 . A A . 15 ALA O 1 1 20 6409 1 1 16 LEU C C 2.341 8.399 4.828 1.00 . A A . 16 LEU C 1 1 20 6410 1 1 16 LEU CA C 0.926 7.857 5.084 1.00 . A A . 16 LEU CA 1 1 20 6411 1 1 16 LEU CB C 0.701 7.572 6.576 1.00 . A A . 16 LEU CB 1 1 20 6412 1 1 16 LEU CD1 C -0.747 9.603 7.036 1.00 . A A . 16 LEU CD1 1 1 20 6413 1 1 16 LEU CD2 C -1.855 7.395 6.489 1.00 . A A . 16 LEU CD2 1 1 20 6414 1 1 16 LEU CG C -0.643 8.077 7.133 1.00 . A A . 16 LEU CG 1 1 20 6415 1 1 16 LEU H H 1.002 5.807 4.604 1.00 . A A . 16 LEU H 1 1 20 6416 1 1 16 LEU HA H 0.225 8.640 4.797 1.00 . A A . 16 LEU HA 1 1 20 6417 1 1 16 LEU HB2 H 0.760 6.495 6.736 1.00 . A A . 16 LEU HB2 1 1 20 6418 1 1 16 LEU HB3 H 1.502 8.052 7.138 1.00 . A A . 16 LEU HB3 1 1 20 6419 1 1 16 LEU HD11 H 0.128 10.058 7.502 1.00 . A A . 16 LEU HD11 1 1 20 6420 1 1 16 LEU HD12 H -0.795 9.897 5.987 1.00 . A A . 16 LEU HD12 1 1 20 6421 1 1 16 LEU HD13 H -1.648 9.939 7.549 1.00 . A A . 16 LEU HD13 1 1 20 6422 1 1 16 LEU HD21 H -1.912 7.672 5.436 1.00 . A A . 16 LEU HD21 1 1 20 6423 1 1 16 LEU HD22 H -1.752 6.313 6.574 1.00 . A A . 16 LEU HD22 1 1 20 6424 1 1 16 LEU HD23 H -2.764 7.714 6.998 1.00 . A A . 16 LEU HD23 1 1 20 6425 1 1 16 LEU HG H -0.663 7.825 8.194 1.00 . A A . 16 LEU HG 1 1 20 6426 1 1 16 LEU N N 0.593 6.663 4.289 1.00 . A A . 16 LEU N 1 1 20 6427 1 1 16 LEU O O 2.563 9.604 4.904 1.00 . A A . 16 LEU O 1 1 20 6428 1 1 17 ILE C C 4.707 8.290 2.564 1.00 . A A . 17 ILE C 1 1 20 6429 1 1 17 ILE CA C 4.644 7.855 4.057 1.00 . A A . 17 ILE CA 1 1 20 6430 1 1 17 ILE CB C 5.592 6.669 4.369 1.00 . A A . 17 ILE CB 1 1 20 6431 1 1 17 ILE CD1 C 5.922 4.653 5.967 1.00 . A A . 17 ILE CD1 1 1 20 6432 1 1 17 ILE CG1 C 5.306 6.043 5.751 1.00 . A A . 17 ILE CG1 1 1 20 6433 1 1 17 ILE CG2 C 7.052 7.153 4.355 1.00 . A A . 17 ILE CG2 1 1 20 6434 1 1 17 ILE H H 3.065 6.527 4.467 1.00 . A A . 17 ILE H 1 1 20 6435 1 1 17 ILE HA H 4.961 8.703 4.664 1.00 . A A . 17 ILE HA 1 1 20 6436 1 1 17 ILE HB H 5.466 5.904 3.602 1.00 . A A . 17 ILE HB 1 1 20 6437 1 1 17 ILE HD11 H 7.005 4.717 5.869 1.00 . A A . 17 ILE HD11 1 1 20 6438 1 1 17 ILE HD12 H 5.668 4.294 6.965 1.00 . A A . 17 ILE HD12 1 1 20 6439 1 1 17 ILE HD13 H 5.529 3.962 5.223 1.00 . A A . 17 ILE HD13 1 1 20 6440 1 1 17 ILE HG12 H 5.702 6.712 6.514 1.00 . A A . 17 ILE HG12 1 1 20 6441 1 1 17 ILE HG13 H 4.227 5.968 5.881 1.00 . A A . 17 ILE HG13 1 1 20 6442 1 1 17 ILE HG21 H 7.277 7.600 3.387 1.00 . A A . 17 ILE HG21 1 1 20 6443 1 1 17 ILE HG22 H 7.195 7.896 5.140 1.00 . A A . 17 ILE HG22 1 1 20 6444 1 1 17 ILE HG23 H 7.717 6.308 4.529 1.00 . A A . 17 ILE HG23 1 1 20 6445 1 1 17 ILE N N 3.259 7.506 4.458 1.00 . A A . 17 ILE N 1 1 20 6446 1 1 17 ILE O O 5.771 8.417 1.955 1.00 . A A . 17 ILE O 1 1 20 6447 1 1 18 ARG C C 3.795 10.407 0.444 1.00 . A A . 18 ARG C 1 1 20 6448 1 1 18 ARG CA C 3.376 8.938 0.566 1.00 . A A . 18 ARG CA 1 1 20 6449 1 1 18 ARG CB C 1.948 8.670 0.056 1.00 . A A . 18 ARG CB 1 1 20 6450 1 1 18 ARG CD C 0.538 10.784 0.011 1.00 . A A . 18 ARG CD 1 1 20 6451 1 1 18 ARG CG C 0.826 9.464 0.735 1.00 . A A . 18 ARG CG 1 1 20 6452 1 1 18 ARG CZ C -1.763 11.378 0.829 1.00 . A A . 18 ARG CZ 1 1 20 6453 1 1 18 ARG H H 2.682 8.210 2.392 1.00 . A A . 18 ARG H 1 1 20 6454 1 1 18 ARG HA H 4.059 8.351 -0.049 1.00 . A A . 18 ARG HA 1 1 20 6455 1 1 18 ARG HB2 H 1.921 8.886 -1.013 1.00 . A A . 18 ARG HB2 1 1 20 6456 1 1 18 ARG HB3 H 1.739 7.610 0.197 1.00 . A A . 18 ARG HB3 1 1 20 6457 1 1 18 ARG HD2 H 1.464 11.350 -0.088 1.00 . A A . 18 ARG HD2 1 1 20 6458 1 1 18 ARG HD3 H 0.138 10.571 -0.980 1.00 . A A . 18 ARG HD3 1 1 20 6459 1 1 18 ARG HE H -0.050 12.313 1.320 1.00 . A A . 18 ARG HE 1 1 20 6460 1 1 18 ARG HG2 H -0.082 8.859 0.738 1.00 . A A . 18 ARG HG2 1 1 20 6461 1 1 18 ARG HG3 H 1.114 9.679 1.764 1.00 . A A . 18 ARG HG3 1 1 20 6462 1 1 18 ARG HH11 H -1.785 9.777 -0.376 1.00 . A A . 18 ARG HH11 1 1 20 6463 1 1 18 ARG HH12 H -3.340 10.261 0.224 1.00 . A A . 18 ARG HH12 1 1 20 6464 1 1 18 ARG HH21 H -2.102 12.905 2.106 1.00 . A A . 18 ARG HH21 1 1 20 6465 1 1 18 ARG HH22 H -3.501 12.009 1.619 1.00 . A A . 18 ARG HH22 1 1 20 6466 1 1 18 ARG N N 3.538 8.489 1.957 1.00 . A A . 18 ARG N 1 1 20 6467 1 1 18 ARG NE N -0.443 11.580 0.771 1.00 . A A . 18 ARG NE 1 1 20 6468 1 1 18 ARG NH1 N -2.355 10.397 0.163 1.00 . A A . 18 ARG NH1 1 1 20 6469 1 1 18 ARG NH2 N -2.518 12.170 1.577 1.00 . A A . 18 ARG NH2 1 1 20 6470 1 1 18 ARG O O 3.389 11.264 1.225 1.00 . A A . 18 ARG O 1 1 20 6471 1 1 19 ALA C C 5.974 11.939 -2.050 1.00 . A A . 19 ALA C 1 1 20 6472 1 1 19 ALA CA C 5.405 11.903 -0.632 1.00 . A A . 19 ALA CA 1 1 20 6473 1 1 19 ALA CB C 6.458 12.273 0.420 1.00 . A A . 19 ALA CB 1 1 20 6474 1 1 19 ALA H H 5.255 9.797 -0.813 1.00 . A A . 19 ALA H 1 1 20 6475 1 1 19 ALA HA H 4.600 12.635 -0.575 1.00 . A A . 19 ALA HA 1 1 20 6476 1 1 19 ALA HB1 H 6.010 12.235 1.413 1.00 . A A . 19 ALA HB1 1 1 20 6477 1 1 19 ALA HB2 H 7.287 11.568 0.368 1.00 . A A . 19 ALA HB2 1 1 20 6478 1 1 19 ALA HB3 H 6.826 13.281 0.226 1.00 . A A . 19 ALA HB3 1 1 20 6479 1 1 19 ALA N N 4.833 10.573 -0.355 1.00 . A A . 19 ALA N 1 1 20 6480 1 1 19 ALA O O 5.450 12.654 -2.897 1.00 . A A . 19 ALA O 1 1 20 6481 1 1 20 PHE C C 7.929 12.345 -4.248 1.00 . A A . 20 PHE C 1 1 20 6482 1 1 20 PHE CA C 7.645 10.963 -3.618 1.00 . A A . 20 PHE CA 1 1 20 6483 1 1 20 PHE CB C 6.799 10.016 -4.500 1.00 . A A . 20 PHE CB 1 1 20 6484 1 1 20 PHE CD1 C 8.241 9.701 -6.566 1.00 . A A . 20 PHE CD1 1 1 20 6485 1 1 20 PHE CD2 C 6.141 10.849 -6.803 1.00 . A A . 20 PHE CD2 1 1 20 6486 1 1 20 PHE CE1 C 8.544 9.993 -7.891 1.00 . A A . 20 PHE CE1 1 1 20 6487 1 1 20 PHE CE2 C 6.451 11.156 -8.122 1.00 . A A . 20 PHE CE2 1 1 20 6488 1 1 20 PHE CG C 7.039 10.127 -6.018 1.00 . A A . 20 PHE CG 1 1 20 6489 1 1 20 PHE CZ C 7.653 10.723 -8.670 1.00 . A A . 20 PHE CZ 1 1 20 6490 1 1 20 PHE H H 7.430 10.604 -1.551 1.00 . A A . 20 PHE H 1 1 20 6491 1 1 20 PHE HA H 8.607 10.479 -3.453 1.00 . A A . 20 PHE HA 1 1 20 6492 1 1 20 PHE HB2 H 7.020 8.992 -4.199 1.00 . A A . 20 PHE HB2 1 1 20 6493 1 1 20 PHE HB3 H 5.745 10.213 -4.303 1.00 . A A . 20 PHE HB3 1 1 20 6494 1 1 20 PHE HD1 H 8.984 9.213 -5.935 1.00 . A A . 20 PHE HD1 1 1 20 6495 1 1 20 PHE HD2 H 5.301 11.360 -6.326 1.00 . A A . 20 PHE HD2 1 1 20 6496 1 1 20 PHE HE1 H 9.460 9.607 -8.336 1.00 . A A . 20 PHE HE1 1 1 20 6497 1 1 20 PHE HE2 H 5.793 11.806 -8.698 1.00 . A A . 20 PHE HE2 1 1 20 6498 1 1 20 PHE HZ H 7.884 10.940 -9.711 1.00 . A A . 20 PHE HZ 1 1 20 6499 1 1 20 PHE N N 6.990 11.103 -2.295 1.00 . A A . 20 PHE N 1 1 20 6500 1 1 20 PHE O O 8.769 13.068 -3.671 1.00 . A A . 20 PHE O 1 1 stop_ save_
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