NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
408182 | 1ytr | 6561 | cing | 4-filtered-FRED | STAR | entry | full | 180 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ytr # This FRED archive file contains, for PDB entry <1ytr>: # # - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) 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.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_1ytr _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ytr _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2933.26 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 $Bacteriocin_plantaricin_A A . 1 1 stop_ save_ save_Bacteriocin_plantaricin_A _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Bacteriocin plantaricin A" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KSSAYSLQMGATAIKQVKKLFKKWGW _Entity.Number_of_monomers 26 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 LYS . 1 1 2 SER . 1 1 3 SER . 1 1 4 ALA . 1 1 5 TYR . 1 1 6 SER . 1 1 7 LEU . 1 1 8 GLN . 1 1 9 MET . 1 1 10 GLY . 1 1 11 ALA . 1 1 12 THR . 1 1 13 ALA . 1 1 14 ILE . 1 1 15 LYS . 1 1 16 GLN . 1 1 17 VAL . 1 1 18 LYS . 1 1 19 LYS . 1 1 20 LEU . 1 1 21 PHE . 1 1 22 LYS . 1 1 23 LYS . 1 1 24 TRP . 1 1 25 GLY . 1 1 26 TRP . 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 LYS 1 1 1 1 SER 2 2 1 1 SER 3 3 1 1 ALA 4 4 1 1 TYR 5 5 1 1 SER 6 6 1 1 LEU 7 7 1 1 GLN 8 8 1 1 MET 9 9 1 1 GLY 10 10 1 1 ALA 11 11 1 1 THR 12 12 1 1 ALA 13 13 1 1 ILE 14 14 1 1 LYS 15 15 1 1 GLN 16 16 1 1 VAL 17 17 1 1 LYS 18 18 1 1 LYS 19 19 1 1 LEU 20 20 1 1 PHE 21 21 1 1 LYS 22 22 1 1 LYS 23 23 1 1 TRP 24 24 1 1 GLY 25 25 1 1 TRP 26 26 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 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 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 3 SER H . 3 SER HN 1 1 1 1 2 1 1 4 ALA H . 4 ALA HN 1 1 2 1 1 1 1 3 SER H . 3 SER HN 1 1 2 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 3 1 1 1 1 3 SER HB3 . 3 SER HB3 1 1 3 1 2 1 1 4 ALA H . 4 ALA HN 1 1 4 1 1 1 1 4 ALA H . 4 ALA HN 1 1 4 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 5 1 1 1 1 4 ALA H . 4 ALA HN 1 1 5 1 2 1 1 5 TYR H . 5 TYR HN 1 1 6 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 6 1 2 1 1 5 TYR H . 5 TYR HN 1 1 7 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 7 1 2 1 1 5 TYR QD . 5 TYR QD 1 1 8 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 8 1 2 1 1 6 SER H . 6 SER HN 1 1 9 1 1 1 1 5 TYR H . 5 TYR HN 1 1 9 1 2 1 1 5 TYR HB3 . 5 TYR HB3 1 1 10 1 1 1 1 5 TYR H . 5 TYR HN 1 1 10 1 2 1 1 5 TYR QD . 5 TYR QD 1 1 11 1 1 1 1 5 TYR HA . 5 TYR HA 1 1 11 1 2 1 1 6 SER H . 6 SER HN 1 1 12 1 1 1 1 6 SER H . 6 SER HN 1 1 12 1 2 1 1 7 LEU H . 7 LEU HN 1 1 13 1 1 1 1 6 SER HA . 6 SER HA 1 1 13 1 2 1 1 7 LEU H . 7 LEU HN 1 1 14 1 1 1 1 6 SER HB3 . 6 SER HB3 1 1 14 1 2 1 1 7 LEU H . 7 LEU HN 1 1 15 1 1 1 1 6 SER HB3 . 6 SER HB3 1 1 15 1 2 1 1 8 GLN H . 8 GLN HN 1 1 16 1 1 1 1 7 LEU H . 7 LEU HN 1 1 16 1 2 1 1 7 LEU MD1 . 7 LEU QD1 1 1 17 1 1 1 1 7 LEU H . 7 LEU HN 1 1 17 1 2 1 1 7 LEU QD . 7 LEU QQD 1 1 18 1 1 1 1 7 LEU H . 7 LEU HN 1 1 18 1 2 1 1 7 LEU MD2 . 7 LEU QD2 1 1 19 1 1 1 1 7 LEU H . 7 LEU HN 1 1 19 1 2 1 1 7 LEU HG . 7 LEU HG 1 1 20 1 1 1 1 7 LEU H . 7 LEU HN 1 1 20 1 2 1 1 8 GLN H . 8 GLN HN 1 1 21 1 1 1 1 7 LEU HA . 7 LEU HA 1 1 21 1 2 1 1 7 LEU MD1 . 7 LEU QD1 1 1 22 1 1 1 1 7 LEU HA . 7 LEU HA 1 1 22 1 2 1 1 7 LEU QD . 7 LEU QQD 1 1 23 1 1 1 1 7 LEU HA . 7 LEU HA 1 1 23 1 2 1 1 7 LEU MD2 . 7 LEU QD2 1 1 24 1 1 1 1 7 LEU HA . 7 LEU HA 1 1 24 1 2 1 1 7 LEU HG . 7 LEU HG 1 1 25 1 1 1 1 7 LEU QD . 7 LEU QQD 1 1 25 1 2 1 1 8 GLN H . 8 GLN HN 1 1 26 1 1 1 1 7 LEU MD1 . 7 LEU QD1 1 1 26 1 2 1 1 8 GLN H . 8 GLN HN 1 1 27 1 1 1 1 7 LEU MD2 . 7 LEU QD2 1 1 27 1 2 1 1 8 GLN H . 8 GLN HN 1 1 28 1 1 1 1 7 LEU HG . 7 LEU HG 1 1 28 1 2 1 1 8 GLN H . 8 GLN HN 1 1 29 1 1 1 1 8 GLN HA . 8 GLN HA 1 1 29 1 2 1 1 10 GLY H . 10 GLY HN 1 1 30 1 1 1 1 9 MET H . 9 MET HN 1 1 30 1 2 1 1 9 MET HG3 . 9 MET HG3 1 1 31 1 1 1 1 9 MET H . 9 MET HN 1 1 31 1 2 1 1 10 GLY H . 10 GLY HN 1 1 32 1 1 1 1 9 MET H . 9 MET HN 1 1 32 1 2 1 1 10 GLY HA2 . 10 GLY HA1 1 1 33 1 1 1 1 9 MET H . 9 MET HN 1 1 33 1 2 1 1 10 GLY QA . 10 GLY QA 1 1 34 1 1 1 1 9 MET H . 9 MET HN 1 1 34 1 2 1 1 10 GLY HA3 . 10 GLY HA2 1 1 35 1 1 1 1 9 MET HB3 . 9 MET HB3 1 1 35 1 2 1 1 10 GLY H . 10 GLY HN 1 1 36 1 1 1 1 10 GLY H . 10 GLY HN 1 1 36 1 2 1 1 11 ALA HA . 11 ALA HA 1 1 37 1 1 1 1 10 GLY H . 10 GLY HN 1 1 37 1 2 1 1 13 ALA MB . 13 ALA QB 1 1 38 1 1 1 1 10 GLY QA . 10 GLY QA 1 1 38 1 2 1 1 13 ALA MB . 13 ALA QB 1 1 39 1 1 1 1 11 ALA H . 11 ALA HN 1 1 39 1 2 1 1 11 ALA MB . 11 ALA QB 1 1 40 1 1 1 1 11 ALA H . 11 ALA HN 1 1 40 1 2 1 1 12 THR H . 12 THR HN 1 1 41 1 1 1 1 11 ALA H . 11 ALA HN 1 1 41 1 2 1 1 12 THR HA . 12 THR HA 1 1 42 1 1 1 1 11 ALA H . 11 ALA HN 1 1 42 1 2 1 1 13 ALA H . 13 ALA HN 1 1 43 1 1 1 1 11 ALA H . 11 ALA HN 1 1 43 1 2 1 1 13 ALA MB . 13 ALA QB 1 1 44 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 44 1 2 1 1 13 ALA H . 13 ALA HN 1 1 45 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 45 1 2 1 1 14 ILE H . 14 ILE HN 1 1 46 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 46 1 2 1 1 14 ILE HB . 14 ILE HB 1 1 47 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 47 1 2 1 1 14 ILE MD . 14 ILE QD1 1 1 48 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 48 1 2 1 1 14 ILE MG . 14 ILE QG2 1 1 49 1 1 1 1 11 ALA HA . 11 ALA HA 1 1 49 1 2 1 1 15 LYS H . 15 LYS+ HN 1 1 50 1 1 1 1 11 ALA MB . 11 ALA QB 1 1 50 1 2 1 1 12 THR H . 12 THR HN 1 1 51 1 1 1 1 11 ALA MB . 11 ALA QB 1 1 51 1 2 1 1 14 ILE H . 14 ILE HN 1 1 52 1 1 1 1 12 THR H . 12 THR HN 1 1 52 1 2 1 1 12 THR HB . 12 THR HB 1 1 53 1 1 1 1 12 THR H . 12 THR HN 1 1 53 1 2 1 1 12 THR MG . 12 THR QG2 1 1 54 1 1 1 1 12 THR HA . 12 THR HA 1 1 54 1 2 1 1 12 THR MG . 12 THR QG2 1 1 55 1 1 1 1 12 THR HB . 12 THR HB 1 1 55 1 2 1 1 13 ALA H . 13 ALA HN 1 1 56 1 1 1 1 12 THR HB . 12 THR HB 1 1 56 1 2 1 1 15 LYS H . 15 LYS+ HN 1 1 57 1 1 1 1 12 THR MG . 12 THR QG2 1 1 57 1 2 1 1 13 ALA H . 13 ALA HN 1 1 58 1 1 1 1 13 ALA H . 13 ALA HN 1 1 58 1 2 1 1 13 ALA MB . 13 ALA QB 1 1 59 1 1 1 1 13 ALA H . 13 ALA HN 1 1 59 1 2 1 1 14 ILE H . 14 ILE HN 1 1 60 1 1 1 1 13 ALA HA . 13 ALA HA 1 1 60 1 2 1 1 16 GLN H . 16 GLN HN 1 1 61 1 1 1 1 13 ALA HA . 13 ALA HA 1 1 61 1 2 1 1 17 VAL H . 17 VAL HN 1 1 62 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 62 1 2 1 1 14 ILE H . 14 ILE HN 1 1 63 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 63 1 2 1 1 14 ILE HA . 14 ILE HA 1 1 64 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 64 1 2 1 1 15 LYS H . 15 LYS+ HN 1 1 65 1 1 1 1 14 ILE H . 14 ILE HN 1 1 65 1 2 1 1 14 ILE HB . 14 ILE HB 1 1 66 1 1 1 1 14 ILE H . 14 ILE HN 1 1 66 1 2 1 1 14 ILE MD . 14 ILE QD1 1 1 67 1 1 1 1 14 ILE H . 14 ILE HN 1 1 67 1 2 1 1 14 ILE HG13 . 14 ILE HG13 1 1 68 1 1 1 1 14 ILE H . 14 ILE HN 1 1 68 1 2 1 1 14 ILE MG . 14 ILE QG2 1 1 69 1 1 1 1 14 ILE H . 14 ILE HN 1 1 69 1 2 1 1 15 LYS H . 15 LYS+ HN 1 1 70 1 1 1 1 14 ILE H . 14 ILE HN 1 1 70 1 2 1 1 15 LYS HA . 15 LYS+ HA 1 1 71 1 1 1 1 14 ILE H . 14 ILE HN 1 1 71 1 2 1 1 17 VAL QG . 17 VAL QQG 1 1 72 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 72 1 2 1 1 14 ILE MD . 14 ILE QD1 1 1 73 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 73 1 2 1 1 14 ILE HG13 . 14 ILE HG13 1 1 74 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 74 1 2 1 1 16 GLN H . 16 GLN HN 1 1 75 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 75 1 2 1 1 17 VAL H . 17 VAL HN 1 1 76 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 76 1 2 1 1 17 VAL HB . 17 VAL HB 1 1 77 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 77 1 2 1 1 17 VAL MG1 . 17 VAL QG1 1 1 78 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 78 1 2 1 1 17 VAL QG . 17 VAL QQG 1 1 79 1 1 1 1 14 ILE HA . 14 ILE HA 1 1 79 1 2 1 1 17 VAL MG2 . 17 VAL QG2 1 1 80 1 1 1 1 14 ILE HB . 14 ILE HB 1 1 80 1 2 1 1 15 LYS H . 15 LYS+ HN 1 1 81 1 1 1 1 14 ILE MG . 14 ILE QG2 1 1 81 1 2 1 1 15 LYS H . 15 LYS+ HN 1 1 82 1 1 1 1 14 ILE MG . 14 ILE QG2 1 1 82 1 2 1 1 15 LYS HA . 15 LYS+ HA 1 1 83 1 1 1 1 14 ILE MG . 14 ILE QG2 1 1 83 1 2 1 1 17 VAL H . 17 VAL HN 1 1 84 1 1 1 1 15 LYS H . 15 LYS+ HN 1 1 84 1 2 1 1 16 GLN H . 16 GLN HN 1 1 85 1 1 1 1 15 LYS H . 15 LYS+ HN 1 1 85 1 2 1 1 17 VAL H . 17 VAL HN 1 1 86 1 1 1 1 15 LYS HA . 15 LYS+ HA 1 1 86 1 2 1 1 15 LYS HD3 . 15 LYS+ HD3 1 1 87 1 1 1 1 15 LYS HA . 15 LYS+ HA 1 1 87 1 2 1 1 18 LYS H . 18 LYS+ HN 1 1 88 1 1 1 1 15 LYS HD3 . 15 LYS+ HD3 1 1 88 1 2 1 1 16 GLN H . 16 GLN HN 1 1 89 1 1 1 1 16 GLN H . 16 GLN HN 1 1 89 1 2 1 1 16 GLN HB3 . 16 GLN HB3 1 1 90 1 1 1 1 16 GLN H . 16 GLN HN 1 1 90 1 2 1 1 16 GLN HG3 . 16 GLN HG3 1 1 91 1 1 1 1 16 GLN H . 16 GLN HN 1 1 91 1 2 1 1 17 VAL H . 17 VAL HN 1 1 92 1 1 1 1 16 GLN H . 16 GLN HN 1 1 92 1 2 1 1 17 VAL QG . 17 VAL QQG 1 1 93 1 1 1 1 16 GLN HA . 16 GLN HA 1 1 93 1 2 1 1 19 LYS H . 19 LYS+ HN 1 1 94 1 1 1 1 16 GLN HA . 16 GLN HA 1 1 94 1 2 1 1 20 LEU H . 20 LEU HN 1 1 95 1 1 1 1 17 VAL H . 17 VAL HN 1 1 95 1 2 1 1 17 VAL HB . 17 VAL HB 1 1 96 1 1 1 1 17 VAL H . 17 VAL HN 1 1 96 1 2 1 1 17 VAL QG . 17 VAL QQG 1 1 97 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 97 1 2 1 1 17 VAL MG1 . 17 VAL QG1 1 1 98 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 98 1 2 1 1 17 VAL MG2 . 17 VAL QG2 1 1 99 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 99 1 2 1 1 19 LYS H . 19 LYS+ HN 1 1 100 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 100 1 2 1 1 20 LEU H . 20 LEU HN 1 1 101 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 101 1 2 1 1 20 LEU MD1 . 20 LEU QD1 1 1 102 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 102 1 2 1 1 20 LEU QD . 20 LEU QQD 1 1 103 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 103 1 2 1 1 20 LEU MD2 . 20 LEU QD2 1 1 104 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 104 1 2 1 1 20 LEU HG . 20 LEU HG 1 1 105 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 105 1 2 1 1 21 PHE H . 21 PHE HN 1 1 106 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 106 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 107 1 1 1 1 17 VAL QG . 17 VAL QQG 1 1 107 1 2 1 1 18 LYS H . 18 LYS+ HN 1 1 108 1 1 1 1 17 VAL QG . 17 VAL QQG 1 1 108 1 2 1 1 18 LYS HA . 18 LYS+ HA 1 1 109 1 1 1 1 17 VAL QG . 17 VAL QQG 1 1 109 1 2 1 1 20 LEU H . 20 LEU HN 1 1 110 1 1 1 1 17 VAL QG . 17 VAL QQG 1 1 110 1 2 1 1 21 PHE H . 21 PHE HN 1 1 111 1 1 1 1 17 VAL QG . 17 VAL QQG 1 1 111 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 112 1 1 1 1 17 VAL MG1 . 17 VAL QG1 1 1 112 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 113 1 1 1 1 17 VAL MG2 . 17 VAL QG2 1 1 113 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 114 1 1 1 1 18 LYS H . 18 LYS+ HN 1 1 114 1 2 1 1 19 LYS H . 19 LYS+ HN 1 1 115 1 1 1 1 18 LYS H . 18 LYS+ HN 1 1 115 1 2 1 1 19 LYS HA . 19 LYS+ HA 1 1 116 1 1 1 1 18 LYS H . 18 LYS+ HN 1 1 116 1 2 1 1 20 LEU H . 20 LEU HN 1 1 117 1 1 1 1 18 LYS HA . 18 LYS+ HA 1 1 117 1 2 1 1 21 PHE H . 21 PHE HN 1 1 118 1 1 1 1 18 LYS HA . 18 LYS+ HA 1 1 118 1 2 1 1 21 PHE HB3 . 21 PHE HB3 1 1 119 1 1 1 1 18 LYS HA . 18 LYS+ HA 1 1 119 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 120 1 1 1 1 18 LYS HA . 18 LYS+ HA 1 1 120 1 2 1 1 22 LYS H . 22 LYS+ HN 1 1 121 1 1 1 1 19 LYS H . 19 LYS+ HN 1 1 121 1 2 1 1 20 LEU H . 20 LEU HN 1 1 122 1 1 1 1 19 LYS HA . 19 LYS+ HA 1 1 122 1 2 1 1 21 PHE H . 21 PHE HN 1 1 123 1 1 1 1 19 LYS HA . 19 LYS+ HA 1 1 123 1 2 1 1 22 LYS H . 22 LYS+ HN 1 1 124 1 1 1 1 19 LYS HD3 . 19 LYS+ HD3 1 1 124 1 2 1 1 20 LEU H . 20 LEU HN 1 1 125 1 1 1 1 20 LEU H . 20 LEU HN 1 1 125 1 2 1 1 20 LEU MD1 . 20 LEU QD1 1 1 126 1 1 1 1 20 LEU H . 20 LEU HN 1 1 126 1 2 1 1 20 LEU QD . 20 LEU QQD 1 1 127 1 1 1 1 20 LEU H . 20 LEU HN 1 1 127 1 2 1 1 20 LEU MD2 . 20 LEU QD2 1 1 128 1 1 1 1 20 LEU H . 20 LEU HN 1 1 128 1 2 1 1 20 LEU HG . 20 LEU HG 1 1 129 1 1 1 1 20 LEU H . 20 LEU HN 1 1 129 1 2 1 1 21 PHE H . 21 PHE HN 1 1 130 1 1 1 1 20 LEU H . 20 LEU HN 1 1 130 1 2 1 1 22 LYS H . 22 LYS+ HN 1 1 131 1 1 1 1 20 LEU HA . 20 LEU HA 1 1 131 1 2 1 1 20 LEU MD1 . 20 LEU QD1 1 1 132 1 1 1 1 20 LEU HA . 20 LEU HA 1 1 132 1 2 1 1 20 LEU QD . 20 LEU QQD 1 1 133 1 1 1 1 20 LEU HA . 20 LEU HA 1 1 133 1 2 1 1 20 LEU MD2 . 20 LEU QD2 1 1 134 1 1 1 1 20 LEU HA . 20 LEU HA 1 1 134 1 2 1 1 20 LEU HG . 20 LEU HG 1 1 135 1 1 1 1 20 LEU HA . 20 LEU HA 1 1 135 1 2 1 1 22 LYS H . 22 LYS+ HN 1 1 136 1 1 1 1 20 LEU QD . 20 LEU QQD 1 1 136 1 2 1 1 21 PHE H . 21 PHE HN 1 1 137 1 1 1 1 20 LEU QD . 20 LEU QQD 1 1 137 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 138 1 1 1 1 20 LEU QD . 20 LEU QQD 1 1 138 1 2 1 1 24 TRP HE1 . 24 TRP HE1 1 1 139 1 1 1 1 20 LEU QD . 20 LEU QQD 1 1 139 1 2 1 1 24 TRP HH2 . 24 TRP HH2 1 1 140 1 1 1 1 20 LEU MD1 . 20 LEU QD1 1 1 140 1 2 1 1 24 TRP HE1 . 24 TRP HE1 1 1 141 1 1 1 1 20 LEU MD1 . 20 LEU QD1 1 1 141 1 2 1 1 24 TRP HH2 . 24 TRP HH2 1 1 142 1 1 1 1 20 LEU MD1 . 20 LEU QD1 1 1 142 1 2 1 1 24 TRP HZ2 . 24 TRP HZ2 1 1 143 1 1 1 1 20 LEU MD2 . 20 LEU QD2 1 1 143 1 2 1 1 24 TRP HE1 . 24 TRP HE1 1 1 144 1 1 1 1 20 LEU MD2 . 20 LEU QD2 1 1 144 1 2 1 1 24 TRP HH2 . 24 TRP HH2 1 1 145 1 1 1 1 20 LEU MD2 . 20 LEU QD2 1 1 145 1 2 1 1 24 TRP HZ2 . 24 TRP HZ2 1 1 146 1 1 1 1 20 LEU HG . 20 LEU HG 1 1 146 1 2 1 1 21 PHE H . 21 PHE HN 1 1 147 1 1 1 1 20 LEU HG . 20 LEU HG 1 1 147 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 148 1 1 1 1 21 PHE H . 21 PHE HN 1 1 148 1 2 1 1 21 PHE HB3 . 21 PHE HB3 1 1 149 1 1 1 1 21 PHE H . 21 PHE HN 1 1 149 1 2 1 1 21 PHE QD . 21 PHE QD 1 1 150 1 1 1 1 21 PHE H . 21 PHE HN 1 1 150 1 2 1 1 22 LYS H . 22 LYS+ HN 1 1 151 1 1 1 1 21 PHE HA . 21 PHE HA 1 1 151 1 2 1 1 24 TRP H . 24 TRP HN 1 1 152 1 1 1 1 21 PHE HA . 21 PHE HA 1 1 152 1 2 1 1 24 TRP HE3 . 24 TRP HE3 1 1 153 1 1 1 1 21 PHE HB3 . 21 PHE HB3 1 1 153 1 2 1 1 22 LYS H . 22 LYS+ HN 1 1 154 1 1 1 1 23 LYS HG3 . 23 LYS+ HG3 1 1 154 1 2 1 1 24 TRP HD1 . 24 TRP HD1 1 1 155 1 1 1 1 24 TRP H . 24 TRP HN 1 1 155 1 2 1 1 24 TRP HD1 . 24 TRP HD1 1 1 156 1 1 1 1 24 TRP HA . 24 TRP HA 1 1 156 1 2 1 1 24 TRP HD1 . 24 TRP HD1 1 1 157 1 1 1 1 24 TRP HA . 24 TRP HA 1 1 157 1 2 1 1 24 TRP HE3 . 24 TRP HE3 1 1 158 1 1 1 1 26 TRP H . 26 TRP HN 1 1 158 1 2 1 1 26 TRP HB3 . 26 TRP HB3 1 1 159 1 1 1 1 26 TRP H . 26 TRP HN 1 1 159 1 2 1 1 26 TRP HD1 . 26 TRP HD1 1 1 160 1 1 1 1 26 TRP HA . 26 TRP HA 1 1 160 1 2 1 1 26 TRP HD1 . 26 TRP HD1 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 . . . . . . . 5.32 1 1 2 1 . . . . . . . 5.5 1 1 3 1 . . . . . . . 5.5 1 1 4 1 . . . . . . . 3.58 1 1 5 1 . . . . . . . 4.84 1 1 6 1 . . . . . . . 4.16 1 1 7 1 . . . . . . . 4.34 1 1 8 1 . . . . . . . 3.66 1 1 9 1 . . . . . . . 4.12 1 1 10 1 . . . . . . . 4.41 1 1 11 1 . . . . . . . 3.47 1 1 12 1 . . . . . . . 4.73 1 1 13 1 . . . . . . . 3.53 1 1 14 1 . . . . . . . 5.5 1 1 15 1 . . . . . . . 5.5 1 1 16 1 . . . . . . . 4.8 1 1 17 1 . . . . . . . 4.44 1 1 18 1 . . . . . . . 4.8 1 1 19 1 . . . . . . . 3.96 1 1 20 1 . . . . . . . 4.3 1 1 21 1 . . . . . . . 4.65 1 1 22 1 . . . . . . . 4.01 1 1 23 1 . . . . . . . 4.65 1 1 24 1 . . . . . . . 3.82 1 1 25 1 . . . . . . . 4.62 1 1 26 1 . . . . . . . 5.03 1 1 27 1 . . . . . . . 5.03 1 1 28 1 . . . . . . . 4.12 1 1 29 1 . . . . . . . 4.7 1 1 30 1 . . . . . . . 4.11 1 1 31 1 . . . . . . . 3.21 1 1 32 1 . . . . . . . 4.64 1 1 33 1 . . . . . . . 4.35 1 1 34 1 . . . . . . . 4.64 1 1 35 1 . . . . . . . 4.08 1 1 36 1 . . . . . . . 5.5 1 1 37 1 . . . . . . . 4.29 1 1 38 1 . . . . . . . 4.89 1 1 39 1 . . . . . . . 3.11 1 1 40 1 . . . . . . . 4.02 1 1 41 1 . . . . . . . 5.08 1 1 42 1 . . . . . . . 3.63 1 1 43 1 . . . . . . . 3.13 1 1 44 1 . . . . . . . 5.5 1 1 45 1 . . . . . . . 3.82 1 1 46 1 . . . . . . . 3.91 1 1 47 1 . . . . . . . 4.42 1 1 48 1 . . . . . . . 4.72 1 1 49 1 . . . . . . . 5.5 1 1 50 1 . . . . . . . 3.77 1 1 51 1 . . . . . . . 5.5 1 1 52 1 . . . . . . . 3.5 1 1 53 1 . . . . . . . 3.67 1 1 54 1 . . . . . . . 3.52 1 1 55 1 . . . . . . . 5.19 1 1 56 1 . . . . . . . 5.5 1 1 57 1 . . . . . . . 5.37 1 1 58 1 . . . . . . . 3.01 1 1 59 1 . . . . . . . 3.91 1 1 60 1 . . . . . . . 5.28 1 1 61 1 . . . . . . . 4.73 1 1 62 1 . . . . . . . 3.4 1 1 63 1 . . . . . . . 5.46 1 1 64 1 . . . . . . . 5.5 1 1 65 1 . . . . . . . 3.31 1 1 66 1 . . . . . . . 4.45 1 1 67 1 . . . . . . . 4.04 1 1 68 1 . . . . . . . 4.15 1 1 69 1 . . . . . . . 4.18 1 1 70 1 . . . . . . . 5.5 1 1 71 1 . . . . . . . 6.33 1 1 72 1 . . . . . . . 3.99 1 1 73 1 . . . . . . . 3.99 1 1 74 1 . . . . . . . 5.32 1 1 75 1 . . . . . . . 4.72 1 1 76 1 . . . . . . . 3.82 1 1 77 1 . . . . . . . 4.34 1 1 78 1 . . . . . . . 3.14 1 1 79 1 . . . . . . . 4.34 1 1 80 1 . . . . . . . 2.98 1 1 81 1 . . . . . . . 4.01 1 1 82 1 . . . . . . . 4.6 1 1 83 1 . . . . . . . 4.72 1 1 84 1 . . . . . . . 4.1 1 1 85 1 . . . . . . . 4.84 1 1 86 1 . . . . . . . 4.76 1 1 87 1 . . . . . . . 4.4 1 1 88 1 . . . . . . . 3.87 1 1 89 1 . . . . . . . 4.13 1 1 90 1 . . . . . . . 4.25 1 1 91 1 . . . . . . . 3.88 1 1 92 1 . . . . . . . 6.28 1 1 93 1 . . . . . . . 4.15 1 1 94 1 . . . . . . . 5.5 1 1 95 1 . . . . . . . 2.74 1 1 96 1 . . . . . . . 3.85 1 1 97 1 . . . . . . . 3.54 1 1 98 1 . . . . . . . 3.54 1 1 99 1 . . . . . . . 5.12 1 1 100 1 . . . . . . . 4.0 1 1 101 1 . . . . . . . 4.76 1 1 102 1 . . . . . . . 4.12 1 1 103 1 . . . . . . . 4.76 1 1 104 1 . . . . . . . 3.46 1 1 105 1 . . . . . . . 5.5 1 1 106 1 . . . . . . . 5.5 1 1 107 1 . . . . . . . 5.78 1 1 108 1 . . . . . . . 5.68 1 1 109 1 . . . . . . . 6.66 1 1 110 1 . . . . . . . 6.31 1 1 111 1 . . . . . . . 3.95 1 1 112 1 . . . . . . . 4.95 1 1 113 1 . . . . . . . 4.95 1 1 114 1 . . . . . . . 4.17 1 1 115 1 . . . . . . . 5.11 1 1 116 1 . . . . . . . 5.33 1 1 117 1 . . . . . . . 3.8 1 1 118 1 . . . . . . . 4.38 1 1 119 1 . . . . . . . 4.18 1 1 120 1 . . . . . . . 5.5 1 1 121 1 . . . . . . . 3.43 1 1 122 1 . . . . . . . 5.05 1 1 123 1 . . . . . . . 3.93 1 1 124 1 . . . . . . . 4.2 1 1 125 1 . . . . . . . 4.41 1 1 126 1 . . . . . . . 3.74 1 1 127 1 . . . . . . . 4.41 1 1 128 1 . . . . . . . 3.27 1 1 129 1 . . . . . . . 4.2 1 1 130 1 . . . . . . . 5.5 1 1 131 1 . . . . . . . 4.02 1 1 132 1 . . . . . . . 3.64 1 1 133 1 . . . . . . . 4.02 1 1 134 1 . . . . . . . 3.7 1 1 135 1 . . . . . . . 3.69 1 1 136 1 . . . . . . . 6.5 1 1 137 1 . . . . . . . 5.36 1 1 138 1 . . . . . . . 4.58 1 1 139 1 . . . . . . . 3.8 1 1 140 1 . . . . . . . 5.01 1 1 141 1 . . . . . . . 4.54 1 1 142 1 . . . . . . . 4.03 1 1 143 1 . . . . . . . 5.01 1 1 144 1 . . . . . . . 4.54 1 1 145 1 . . . . . . . 4.03 1 1 146 1 . . . . . . . 3.78 1 1 147 1 . . . . . . . 3.76 1 1 148 1 . . . . . . . 3.48 1 1 149 1 . . . . . . . 4.11 1 1 150 1 . . . . . . . 3.37 1 1 151 1 . . . . . . . 2.99 1 1 152 1 . . . . . . . 3.91 1 1 153 1 . . . . . . . 4.13 1 1 154 1 . . . . . . . 4.27 1 1 155 1 . . . . . . . 4.26 1 1 156 1 . . . . . . . 3.41 1 1 157 1 . . . . . . . 5.12 1 1 158 1 . . . . . . . 3.6 1 1 159 1 . . . . . . . 4.61 1 1 160 1 . . . . . . . 3.9 1 1 stop_ save_ save_DYANA/DIANA_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI 1 1 12 THR C 1 1 13 ALA N 1 1 13 ALA CA 1 1 13 ALA C -92.0 -40.0 . . . . . . . . . . . . . . . . 1 1 2 PSI 1 1 13 ALA N 1 1 13 ALA CA 1 1 13 ALA C 1 1 14 ILE N -58.0 -10.0 . . . . . . . . . . . . . . . . 1 1 3 PHI 1 1 13 ALA C 1 1 14 ILE N 1 1 14 ILE CA 1 1 14 ILE C -98.0 -42.0 . . . . . . . . . . . . . . . . 1 1 4 PSI 1 1 14 ILE N 1 1 14 ILE CA 1 1 14 ILE C 1 1 15 LYS N -50.999996 -30.999998 . . . . . . . . . . . . . . . . 1 1 5 PHI 1 1 14 ILE C 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS C -80.0 -44.0 . . . . . . . . . . . . . . . . 1 1 6 PSI 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS C 1 1 16 GLN N -66.0 -14.0 . . . . . . . . . . . . . . . . 1 1 7 PHI 1 1 15 LYS C 1 1 16 GLN N 1 1 16 GLN CA 1 1 16 GLN C -78.0 -58.0 . . . . . . . . . . . . . . . . 1 1 8 PSI 1 1 16 GLN N 1 1 16 GLN CA 1 1 16 GLN C 1 1 17 VAL N -50.0 -26.0 . . . . . . . . . . . . . . . . 1 1 9 PHI 1 1 16 GLN C 1 1 17 VAL N 1 1 17 VAL CA 1 1 17 VAL C -78.0 -53.999996 . . . . . . . . . . . . . . . . 1 1 10 PSI 1 1 17 VAL N 1 1 17 VAL CA 1 1 17 VAL C 1 1 18 LYS N -53.999996 -34.0 . . . . . . . . . . . . . . . . 1 1 11 PHI 1 1 17 VAL C 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS C -74.0 -53.999996 . . . . . . . . . . . . . . . . 1 1 12 PSI 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS C 1 1 19 LYS N -63.0 -15.0 . . . . . . . . . . . . . . . . 1 1 13 PHI 1 1 18 LYS C 1 1 19 LYS N 1 1 19 LYS CA 1 1 19 LYS C -80.0 -47.999996 . . . . . . . . . . . . . . . . 1 1 14 PSI 1 1 19 LYS N 1 1 19 LYS CA 1 1 19 LYS C 1 1 20 LEU N -59.0 -19.0 . . . . . . . . . . . . . . . . 1 1 15 PHI 1 1 19 LYS C 1 1 20 LEU N 1 1 20 LEU CA 1 1 20 LEU C -88.0 -38.0 . . . . . . . . . . . . . . . . 1 1 16 PSI 1 1 20 LEU N 1 1 20 LEU CA 1 1 20 LEU C 1 1 21 PHE N -63.0 -19.0 . . . . . . . . . . . . . . . . 1 1 17 PHI 1 1 20 LEU C 1 1 21 PHE N 1 1 21 PHE CA 1 1 21 PHE C -89.99999 -46.0 . . . . . . . . . . . . . . . . 1 1 18 PSI 1 1 21 PHE N 1 1 21 PHE CA 1 1 21 PHE C 1 1 22 LYS N -60.0 -20.0 . . . . . . . . . . . . . . . . 1 1 19 PHI 1 1 21 PHE C 1 1 22 LYS N 1 1 22 LYS CA 1 1 22 LYS C -83.0 -47.0 . . . . . . . . . . . . . . . . 1 1 20 PSI 1 1 22 LYS N 1 1 22 LYS CA 1 1 22 LYS C 1 1 23 LYS N -53.0 -1.0 . . . . . . . . . . . . . . . . 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 LYS C C -4.825 10.923 2.209 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C -4.687 9.871 3.312 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C -4.002 10.393 4.576 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C -5.462 10.366 6.632 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C -4.798 11.514 7.395 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C -4.435 9.591 5.804 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H -4.554 7.938 2.548 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS HA H -5.684 9.539 3.598 1.00 . A A . 1 LYS HA 1 1 1 9 1 1 1 LYS HB3 H -4.248 11.445 4.719 1.00 . A A . 1 LYS HB3 1 1 1 10 1 1 1 LYS HD3 H -5.951 9.692 7.335 1.00 . A A . 1 LYS HD3 1 1 1 11 1 1 1 LYS HE3 H -3.724 11.510 7.207 1.00 . A A . 1 LYS HE3 1 1 1 12 1 1 1 LYS HG3 H -3.565 9.363 6.420 1.00 . A A . 1 LYS HG3 1 1 1 13 1 1 1 LYS HZ1 H -4.636 13.460 6.789 1.00 . A A . 1 LYS HZ1 1 1 1 14 1 1 1 LYS HZ2 H -5.927 12.686 6.158 1.00 . A A . 1 LYS HZ2 1 1 1 15 1 1 1 LYS HZ3 H -5.949 13.172 7.716 1.00 . A A . 1 LYS HZ3 1 1 1 16 1 1 1 LYS N N -3.976 8.718 2.788 1.00 . A A . 1 LYS N 1 1 1 17 1 1 1 LYS NZ N -5.374 12.813 6.981 1.00 . A A . 1 LYS NZ 1 1 1 18 1 1 1 LYS O O -4.218 11.990 2.283 1.00 . A A . 1 LYS O 1 1 1 19 1 1 2 SER C C -7.319 11.424 -0.342 1.00 . A A . 2 SER C 1 1 1 20 1 1 2 SER CA C -5.854 11.487 0.092 1.00 . A A . 2 SER CA 1 1 1 21 1 1 2 SER CB C -4.936 11.147 -1.083 1.00 . A A . 2 SER CB 1 1 1 22 1 1 2 SER H H -6.117 9.715 1.157 1.00 . A A . 2 SER H 1 1 1 23 1 1 2 SER HA H -5.608 12.479 0.469 1.00 . A A . 2 SER HA 1 1 1 24 1 1 2 SER HB3 H -5.194 10.162 -1.472 1.00 . A A . 2 SER HB3 1 1 1 25 1 1 2 SER HG H -4.501 11.806 -2.922 1.00 . A A . 2 SER HG 1 1 1 26 1 1 2 SER N N -5.628 10.585 1.210 1.00 . A A . 2 SER N 1 1 1 27 1 1 2 SER O O -8.015 12.438 -0.338 1.00 . A A . 2 SER O 1 1 1 28 1 1 2 SER OG O -5.031 12.109 -2.130 1.00 . A A . 2 SER OG 1 1 1 29 1 1 3 SER C C -9.366 8.525 -1.386 1.00 . A A . 3 SER C 1 1 1 30 1 1 3 SER CA C -9.115 10.015 -1.144 1.00 . A A . 3 SER CA 1 1 1 31 1 1 3 SER CB C -9.416 10.817 -2.411 1.00 . A A . 3 SER CB 1 1 1 32 1 1 3 SER H H -7.171 9.403 -0.707 1.00 . A A . 3 SER H 1 1 1 33 1 1 3 SER HA H -9.736 10.380 -0.327 1.00 . A A . 3 SER HA 1 1 1 34 1 1 3 SER HB3 H -9.462 10.141 -3.265 1.00 . A A . 3 SER HB3 1 1 1 35 1 1 3 SER HG H -11.366 11.050 -2.799 1.00 . A A . 3 SER HG 1 1 1 36 1 1 3 SER N N -7.744 10.223 -0.707 1.00 . A A . 3 SER N 1 1 1 37 1 1 3 SER O O -8.428 7.762 -1.613 1.00 . A A . 3 SER O 1 1 1 38 1 1 3 SER OG O -10.642 11.535 -2.309 1.00 . A A . 3 SER OG 1 1 1 39 1 1 4 ALA C C -10.388 5.898 -0.456 1.00 . A A . 4 ALA C 1 1 1 40 1 1 4 ALA CA C -11.023 6.770 -1.539 1.00 . A A . 4 ALA CA 1 1 1 41 1 1 4 ALA CB C -10.619 6.336 -2.949 1.00 . A A . 4 ALA CB 1 1 1 42 1 1 4 ALA H H -11.394 8.782 -1.144 1.00 . A A . 4 ALA H 1 1 1 43 1 1 4 ALA HA H -12.108 6.712 -1.452 1.00 . A A . 4 ALA HA 1 1 1 44 1 1 4 ALA HB1 H -10.572 5.248 -2.995 1.00 . A A . 4 ALA HB1 1 1 1 45 1 1 4 ALA HB2 H -11.355 6.699 -3.667 1.00 . A A . 4 ALA HB2 1 1 1 46 1 1 4 ALA HB3 H -9.641 6.752 -3.191 1.00 . A A . 4 ALA HB3 1 1 1 47 1 1 4 ALA N N -10.637 8.155 -1.329 1.00 . A A . 4 ALA N 1 1 1 48 1 1 4 ALA O O -9.167 5.881 -0.303 1.00 . A A . 4 ALA O 1 1 1 49 1 1 5 TYR C C -11.386 2.922 1.199 1.00 . A A . 5 TYR C 1 1 1 50 1 1 5 TYR CA C -10.781 4.320 1.335 1.00 . A A . 5 TYR CA 1 1 1 51 1 1 5 TYR CB C -11.273 4.951 2.640 1.00 . A A . 5 TYR CB 1 1 1 52 1 1 5 TYR CD1 C -10.082 7.168 2.485 1.00 . A A . 5 TYR CD1 1 1 1 53 1 1 5 TYR CD2 C -9.741 5.833 4.439 1.00 . A A . 5 TYR CD2 1 1 1 54 1 1 5 TYR CE1 C -9.200 8.173 3.019 1.00 . A A . 5 TYR CE1 1 1 1 55 1 1 5 TYR CE2 C -8.859 6.837 4.972 1.00 . A A . 5 TYR CE2 1 1 1 56 1 1 5 TYR CG C -10.335 6.019 3.206 1.00 . A A . 5 TYR CG 1 1 1 57 1 1 5 TYR CZ C -8.632 7.958 4.237 1.00 . A A . 5 TYR CZ 1 1 1 58 1 1 5 TYR H H -12.235 5.213 0.139 1.00 . A A . 5 TYR H 1 1 1 59 1 1 5 TYR HA H -9.696 4.248 1.263 1.00 . A A . 5 TYR HA 1 1 1 60 1 1 5 TYR HB3 H -11.403 4.166 3.384 1.00 . A A . 5 TYR HB3 1 1 1 61 1 1 5 TYR HD1 H -10.551 7.316 1.512 1.00 . A A . 5 TYR HD1 1 1 1 62 1 1 5 TYR HD2 H -9.941 4.924 5.008 1.00 . A A . 5 TYR HD2 1 1 1 63 1 1 5 TYR HE1 H -8.991 9.085 2.461 1.00 . A A . 5 TYR HE1 1 1 1 64 1 1 5 TYR HE2 H -8.384 6.703 5.944 1.00 . A A . 5 TYR HE2 1 1 1 65 1 1 5 TYR HH H -7.634 9.617 4.055 1.00 . A A . 5 TYR HH 1 1 1 66 1 1 5 TYR N N -11.244 5.193 0.270 1.00 . A A . 5 TYR N 1 1 1 67 1 1 5 TYR O O -12.060 2.442 2.109 1.00 . A A . 5 TYR O 1 1 1 68 1 1 5 TYR OH O -7.798 8.908 4.740 1.00 . A A . 5 TYR OH 1 1 1 69 1 1 6 SER C C -10.816 -0.065 0.564 1.00 . A A . 6 SER C 1 1 1 70 1 1 6 SER CA C -11.632 0.972 -0.211 1.00 . A A . 6 SER CA 1 1 1 71 1 1 6 SER CB C -11.603 0.661 -1.708 1.00 . A A . 6 SER CB 1 1 1 72 1 1 6 SER H H -10.573 2.704 -0.679 1.00 . A A . 6 SER H 1 1 1 73 1 1 6 SER HA H -12.665 0.983 0.137 1.00 . A A . 6 SER HA 1 1 1 74 1 1 6 SER HB3 H -11.940 -0.364 -1.872 1.00 . A A . 6 SER HB3 1 1 1 75 1 1 6 SER HG H -13.030 2.056 -1.843 1.00 . A A . 6 SER HG 1 1 1 76 1 1 6 SER N N -11.123 2.306 0.055 1.00 . A A . 6 SER N 1 1 1 77 1 1 6 SER O O -9.610 0.097 0.742 1.00 . A A . 6 SER O 1 1 1 78 1 1 6 SER OG O -12.420 1.555 -2.457 1.00 . A A . 6 SER OG 1 1 1 79 1 1 7 LEU C C -9.876 -2.905 0.845 1.00 . A A . 7 LEU C 1 1 1 80 1 1 7 LEU CA C -10.861 -2.169 1.755 1.00 . A A . 7 LEU CA 1 1 1 81 1 1 7 LEU CB C -11.907 -3.083 2.397 1.00 . A A . 7 LEU CB 1 1 1 82 1 1 7 LEU CD1 C -14.056 -3.380 3.683 1.00 . A A . 7 LEU CD1 1 1 1 83 1 1 7 LEU CD2 C -12.352 -1.653 4.426 1.00 . A A . 7 LEU CD2 1 1 1 84 1 1 7 LEU CG C -12.979 -2.388 3.239 1.00 . A A . 7 LEU CG 1 1 1 85 1 1 7 LEU H H -12.487 -1.230 0.854 1.00 . A A . 7 LEU H 1 1 1 86 1 1 7 LEU HA H -10.301 -1.702 2.565 1.00 . A A . 7 LEU HA 1 1 1 87 1 1 7 LEU HB3 H -11.390 -3.806 3.028 1.00 . A A . 7 LEU HB3 1 1 1 88 1 1 7 LEU HD11 H -13.645 -4.047 4.441 1.00 . A A . 7 LEU HD11 1 1 1 89 1 1 7 LEU HD12 H -14.903 -2.834 4.099 1.00 . A A . 7 LEU HD12 1 1 1 90 1 1 7 LEU HD13 H -14.387 -3.964 2.825 1.00 . A A . 7 LEU HD13 1 1 1 91 1 1 7 LEU HD21 H -11.504 -2.224 4.800 1.00 . A A . 7 LEU HD21 1 1 1 92 1 1 7 LEU HD22 H -12.015 -0.667 4.104 1.00 . A A . 7 LEU HD22 1 1 1 93 1 1 7 LEU HD23 H -13.094 -1.543 5.217 1.00 . A A . 7 LEU HD23 1 1 1 94 1 1 7 LEU HG H -13.468 -1.638 2.618 1.00 . A A . 7 LEU HG 1 1 1 95 1 1 7 LEU N N -11.507 -1.106 1.004 1.00 . A A . 7 LEU N 1 1 1 96 1 1 7 LEU O O -8.677 -2.934 1.116 1.00 . A A . 7 LEU O 1 1 1 97 1 1 8 GLN C C -9.138 -5.542 -0.557 1.00 . A A . 8 GLN C 1 1 1 98 1 1 8 GLN CA C -9.604 -4.219 -1.168 1.00 . A A . 8 GLN CA 1 1 1 99 1 1 8 GLN CB C -8.412 -3.380 -1.632 1.00 . A A . 8 GLN CB 1 1 1 100 1 1 8 GLN CD C -9.906 -2.544 -3.483 1.00 . A A . 8 GLN CD 1 1 1 101 1 1 8 GLN CG C -8.512 -3.062 -3.124 1.00 . A A . 8 GLN CG 1 1 1 102 1 1 8 GLN H H -11.396 -3.457 -0.429 1.00 . A A . 8 GLN H 1 1 1 103 1 1 8 GLN HA H -10.256 -4.413 -2.019 1.00 . A A . 8 GLN HA 1 1 1 104 1 1 8 GLN HB3 H -7.484 -3.916 -1.431 1.00 . A A . 8 GLN HB3 1 1 1 105 1 1 8 GLN HE21 H -9.950 -3.861 -5.019 1.00 . A A . 8 GLN HE21 1 1 1 106 1 1 8 GLN HE22 H -11.361 -2.872 -4.851 1.00 . A A . 8 GLN HE22 1 1 1 107 1 1 8 GLN HG3 H -8.293 -3.958 -3.706 1.00 . A A . 8 GLN HG3 1 1 1 108 1 1 8 GLN N N -10.420 -3.484 -0.217 1.00 . A A . 8 GLN N 1 1 1 109 1 1 8 GLN NE2 N -10.451 -3.142 -4.538 1.00 . A A . 8 GLN NE2 1 1 1 110 1 1 8 GLN O O -9.679 -5.988 0.453 1.00 . A A . 8 GLN O 1 1 1 111 1 1 8 GLN OE1 O -10.451 -1.660 -2.843 1.00 . A A . 8 GLN OE1 1 1 1 112 1 1 9 MET C C -6.384 -7.814 -1.565 1.00 . A A . 9 MET C 1 1 1 113 1 1 9 MET CA C -7.596 -7.397 -0.729 1.00 . A A . 9 MET CA 1 1 1 114 1 1 9 MET CB C -8.673 -8.480 -0.816 1.00 . A A . 9 MET CB 1 1 1 115 1 1 9 MET CE C -8.640 -9.259 -4.814 1.00 . A A . 9 MET CE 1 1 1 116 1 1 9 MET CG C -9.239 -8.579 -2.233 1.00 . A A . 9 MET CG 1 1 1 117 1 1 9 MET H H -7.706 -5.764 -2.019 1.00 . A A . 9 MET H 1 1 1 118 1 1 9 MET HA H -7.291 -7.221 0.302 1.00 . A A . 9 MET HA 1 1 1 119 1 1 9 MET HB3 H -9.476 -8.255 -0.114 1.00 . A A . 9 MET HB3 1 1 1 120 1 1 9 MET HE1 H -8.110 -9.903 -5.515 1.00 . A A . 9 MET HE1 1 1 1 121 1 1 9 MET HE2 H -9.706 -9.275 -5.039 1.00 . A A . 9 MET HE2 1 1 1 122 1 1 9 MET HE3 H -8.266 -8.239 -4.904 1.00 . A A . 9 MET HE3 1 1 1 123 1 1 9 MET HG3 H -9.141 -7.619 -2.741 1.00 . A A . 9 MET HG3 1 1 1 124 1 1 9 MET N N -8.140 -6.133 -1.197 1.00 . A A . 9 MET N 1 1 1 125 1 1 9 MET O O -5.398 -8.317 -1.027 1.00 . A A . 9 MET O 1 1 1 126 1 1 9 MET SD S -8.373 -9.844 -3.149 1.00 . A A . 9 MET SD 1 1 1 127 1 1 10 GLY C C -5.220 -6.842 -4.830 1.00 . A A . 10 GLY C 1 1 1 128 1 1 10 GLY CA C -5.423 -7.938 -3.781 1.00 . A A . 10 GLY CA 1 1 1 129 1 1 10 GLY H H -7.302 -7.182 -3.295 1.00 . A A . 10 GLY H 1 1 1 130 1 1 10 GLY HA2 H -4.499 -8.087 -3.223 1.00 . A A . 10 GLY HA2 1 1 1 131 1 1 10 GLY HA3 H -5.652 -8.881 -4.276 1.00 . A A . 10 GLY HA3 1 1 1 132 1 1 10 GLY N N -6.497 -7.591 -2.866 1.00 . A A . 10 GLY N 1 1 1 133 1 1 10 GLY O O -5.305 -7.102 -6.029 1.00 . A A . 10 GLY O 1 1 1 134 1 1 11 ALA C C -4.171 -3.337 -4.410 1.00 . A A . 11 ALA C 1 1 1 135 1 1 11 ALA CA C -4.742 -4.504 -5.219 1.00 . A A . 11 ALA CA 1 1 1 136 1 1 11 ALA CB C -6.056 -4.141 -5.915 1.00 . A A . 11 ALA CB 1 1 1 137 1 1 11 ALA H H -4.890 -5.436 -3.363 1.00 . A A . 11 ALA H 1 1 1 138 1 1 11 ALA HA H -4.016 -4.802 -5.975 1.00 . A A . 11 ALA HA 1 1 1 139 1 1 11 ALA HB1 H -5.964 -3.157 -6.376 1.00 . A A . 11 ALA HB1 1 1 1 140 1 1 11 ALA HB2 H -6.276 -4.883 -6.684 1.00 . A A . 11 ALA HB2 1 1 1 141 1 1 11 ALA HB3 H -6.863 -4.126 -5.183 1.00 . A A . 11 ALA HB3 1 1 1 142 1 1 11 ALA N N -4.958 -5.639 -4.339 1.00 . A A . 11 ALA N 1 1 1 143 1 1 11 ALA O O -2.972 -3.296 -4.137 1.00 . A A . 11 ALA O 1 1 1 144 1 1 12 THR C C -3.633 -1.653 -2.206 1.00 . A A . 12 THR C 1 1 1 145 1 1 12 THR CA C -4.654 -1.257 -3.275 1.00 . A A . 12 THR CA 1 1 1 146 1 1 12 THR CB C -5.917 -0.613 -2.700 1.00 . A A . 12 THR CB 1 1 1 147 1 1 12 THR CG2 C -5.664 0.801 -2.172 1.00 . A A . 12 THR CG2 1 1 1 148 1 1 12 THR H H -6.028 -2.462 -4.274 1.00 . A A . 12 THR H 1 1 1 149 1 1 12 THR HA H -4.158 -0.553 -3.944 1.00 . A A . 12 THR HA 1 1 1 150 1 1 12 THR HB H -6.360 -1.243 -1.930 1.00 . A A . 12 THR HB 1 1 1 151 1 1 12 THR HG1 H -6.351 0.272 -4.442 1.00 . A A . 12 THR HG1 1 1 1 152 1 1 12 THR HG21 H -5.923 1.528 -2.941 1.00 . A A . 12 THR HG21 1 1 1 153 1 1 12 THR HG22 H -6.278 0.974 -1.288 1.00 . A A . 12 THR HG22 1 1 1 154 1 1 12 THR HG23 H -4.612 0.908 -1.910 1.00 . A A . 12 THR HG23 1 1 1 155 1 1 12 THR N N -5.056 -2.420 -4.047 1.00 . A A . 12 THR N 1 1 1 156 1 1 12 THR O O -2.617 -0.984 -2.035 1.00 . A A . 12 THR O 1 1 1 157 1 1 12 THR OG1 O -6.754 -0.413 -3.837 1.00 . A A . 12 THR OG1 1 1 1 158 1 1 13 ALA C C -1.614 -3.180 -0.954 1.00 . A A . 13 ALA C 1 1 1 159 1 1 13 ALA CA C -3.064 -3.236 -0.468 1.00 . A A . 13 ALA CA 1 1 1 160 1 1 13 ALA CB C -3.491 -4.649 -0.068 1.00 . A A . 13 ALA CB 1 1 1 161 1 1 13 ALA H H -4.770 -3.281 -1.661 1.00 . A A . 13 ALA H 1 1 1 162 1 1 13 ALA HA H -3.174 -2.578 0.395 1.00 . A A . 13 ALA HA 1 1 1 163 1 1 13 ALA HB1 H -2.612 -5.291 -0.009 1.00 . A A . 13 ALA HB1 1 1 1 164 1 1 13 ALA HB2 H -3.982 -4.618 0.906 1.00 . A A . 13 ALA HB2 1 1 1 165 1 1 13 ALA HB3 H -4.183 -5.044 -0.811 1.00 . A A . 13 ALA HB3 1 1 1 166 1 1 13 ALA N N -3.941 -2.741 -1.514 1.00 . A A . 13 ALA N 1 1 1 167 1 1 13 ALA O O -0.724 -2.756 -0.219 1.00 . A A . 13 ALA O 1 1 1 168 1 1 14 ILE C C 0.617 -2.311 -2.443 1.00 . A A . 14 ILE C 1 1 1 169 1 1 14 ILE CA C -0.095 -3.621 -2.784 1.00 . A A . 14 ILE CA 1 1 1 170 1 1 14 ILE CB C -0.182 -3.902 -4.286 1.00 . A A . 14 ILE CB 1 1 1 171 1 1 14 ILE CD1 C -0.926 -5.540 -6.053 1.00 . A A . 14 ILE CD1 1 1 1 172 1 1 14 ILE CG1 C -0.773 -5.288 -4.552 1.00 . A A . 14 ILE CG1 1 1 1 173 1 1 14 ILE CG2 C 1.181 -3.722 -4.956 1.00 . A A . 14 ILE CG2 1 1 1 174 1 1 14 ILE H H -2.151 -3.960 -2.782 1.00 . A A . 14 ILE H 1 1 1 175 1 1 14 ILE HA H 0.461 -4.444 -2.334 1.00 . A A . 14 ILE HA 1 1 1 176 1 1 14 ILE HB H -0.858 -3.173 -4.731 1.00 . A A . 14 ILE HB 1 1 1 177 1 1 14 ILE HD11 H -1.130 -6.597 -6.225 1.00 . A A . 14 ILE HD11 1 1 1 178 1 1 14 ILE HD12 H -1.752 -4.943 -6.439 1.00 . A A . 14 ILE HD12 1 1 1 179 1 1 14 ILE HD13 H -0.005 -5.260 -6.564 1.00 . A A . 14 ILE HD13 1 1 1 180 1 1 14 ILE HG13 H -1.744 -5.373 -4.064 1.00 . A A . 14 ILE HG13 1 1 1 181 1 1 14 ILE HG21 H 1.808 -4.588 -4.744 1.00 . A A . 14 ILE HG21 1 1 1 182 1 1 14 ILE HG22 H 1.047 -3.627 -6.035 1.00 . A A . 14 ILE HG22 1 1 1 183 1 1 14 ILE HG23 H 1.660 -2.823 -4.569 1.00 . A A . 14 ILE HG23 1 1 1 184 1 1 14 ILE N N -1.421 -3.616 -2.190 1.00 . A A . 14 ILE N 1 1 1 185 1 1 14 ILE O O 1.748 -2.322 -1.961 1.00 . A A . 14 ILE O 1 1 1 186 1 1 15 LYS C C 0.940 0.165 -0.979 1.00 . A A . 15 LYS C 1 1 1 187 1 1 15 LYS CA C 0.477 0.104 -2.436 1.00 . A A . 15 LYS CA 1 1 1 188 1 1 15 LYS CB C -0.529 1.195 -2.808 1.00 . A A . 15 LYS CB 1 1 1 189 1 1 15 LYS CD C -0.988 2.451 -0.671 1.00 . A A . 15 LYS CD 1 1 1 190 1 1 15 LYS CE C -1.489 3.846 -0.290 1.00 . A A . 15 LYS CE 1 1 1 191 1 1 15 LYS CG C -0.265 2.478 -2.018 1.00 . A A . 15 LYS CG 1 1 1 192 1 1 15 LYS H H -0.995 -1.212 -3.101 1.00 . A A . 15 LYS H 1 1 1 193 1 1 15 LYS HA H 1.346 0.233 -3.081 1.00 . A A . 15 LYS HA 1 1 1 194 1 1 15 LYS HB3 H -1.542 0.843 -2.609 1.00 . A A . 15 LYS HB3 1 1 1 195 1 1 15 LYS HD3 H -0.314 2.080 0.102 1.00 . A A . 15 LYS HD3 1 1 1 196 1 1 15 LYS HE3 H -2.199 4.200 -1.037 1.00 . A A . 15 LYS HE3 1 1 1 197 1 1 15 LYS HG3 H -0.596 3.341 -2.596 1.00 . A A . 15 LYS HG3 1 1 1 198 1 1 15 LYS HZ1 H -2.626 4.677 1.191 1.00 . A A . 15 LYS HZ1 1 1 1 199 1 1 15 LYS HZ2 H -2.775 3.054 1.087 1.00 . A A . 15 LYS HZ2 1 1 1 200 1 1 15 LYS HZ3 H -1.434 3.710 1.748 1.00 . A A . 15 LYS HZ3 1 1 1 201 1 1 15 LYS N N -0.075 -1.212 -2.708 1.00 . A A . 15 LYS N 1 1 1 202 1 1 15 LYS NZ N -2.133 3.819 1.042 1.00 . A A . 15 LYS NZ 1 1 1 203 1 1 15 LYS O O 1.996 0.722 -0.683 1.00 . A A . 15 LYS O 1 1 1 204 1 1 16 GLN C C 1.833 -1.023 1.540 1.00 . A A . 16 GLN C 1 1 1 205 1 1 16 GLN CA C 0.441 -0.431 1.311 1.00 . A A . 16 GLN CA 1 1 1 206 1 1 16 GLN CB C -0.620 -1.204 2.097 1.00 . A A . 16 GLN CB 1 1 1 207 1 1 16 GLN CD C -1.216 -3.434 3.114 1.00 . A A . 16 GLN CD 1 1 1 208 1 1 16 GLN CG C -0.095 -2.577 2.524 1.00 . A A . 16 GLN CG 1 1 1 209 1 1 16 GLN H H -0.729 -0.864 -0.357 1.00 . A A . 16 GLN H 1 1 1 210 1 1 16 GLN HA H 0.426 0.613 1.623 1.00 . A A . 16 GLN HA 1 1 1 211 1 1 16 GLN HB3 H -1.514 -1.327 1.486 1.00 . A A . 16 GLN HB3 1 1 1 212 1 1 16 GLN HE21 H -0.871 -2.564 4.910 1.00 . A A . 16 GLN HE21 1 1 1 213 1 1 16 GLN HE22 H -2.138 -3.744 4.890 1.00 . A A . 16 GLN HE22 1 1 1 214 1 1 16 GLN HG3 H 0.700 -2.453 3.259 1.00 . A A . 16 GLN HG3 1 1 1 215 1 1 16 GLN N N 0.128 -0.413 -0.107 1.00 . A A . 16 GLN N 1 1 1 216 1 1 16 GLN NE2 N -1.425 -3.231 4.412 1.00 . A A . 16 GLN NE2 1 1 1 217 1 1 16 GLN O O 2.568 -0.569 2.415 1.00 . A A . 16 GLN O 1 1 1 218 1 1 16 GLN OE1 O -1.849 -4.226 2.437 1.00 . A A . 16 GLN OE1 1 1 1 219 1 1 17 VAL C C 4.554 -1.635 0.798 1.00 . A A . 17 VAL C 1 1 1 220 1 1 17 VAL CA C 3.444 -2.687 0.843 1.00 . A A . 17 VAL CA 1 1 1 221 1 1 17 VAL CB C 3.580 -3.748 -0.252 1.00 . A A . 17 VAL CB 1 1 1 222 1 1 17 VAL CG1 C 4.913 -4.489 -0.134 1.00 . A A . 17 VAL CG1 1 1 1 223 1 1 17 VAL CG2 C 2.404 -4.726 -0.217 1.00 . A A . 17 VAL CG2 1 1 1 224 1 1 17 VAL H H 1.548 -2.392 0.030 1.00 . A A . 17 VAL H 1 1 1 225 1 1 17 VAL HA H 3.478 -3.193 1.808 1.00 . A A . 17 VAL HA 1 1 1 226 1 1 17 VAL HB H 3.563 -3.238 -1.215 1.00 . A A . 17 VAL HB 1 1 1 227 1 1 17 VAL HG11 H 5.158 -4.950 -1.091 1.00 . A A . 17 VAL HG11 1 1 1 228 1 1 17 VAL HG12 H 5.698 -3.784 0.139 1.00 . A A . 17 VAL HG12 1 1 1 229 1 1 17 VAL HG13 H 4.834 -5.260 0.632 1.00 . A A . 17 VAL HG13 1 1 1 230 1 1 17 VAL HG21 H 1.594 -4.300 0.376 1.00 . A A . 17 VAL HG21 1 1 1 231 1 1 17 VAL HG22 H 2.053 -4.910 -1.232 1.00 . A A . 17 VAL HG22 1 1 1 232 1 1 17 VAL HG23 H 2.727 -5.666 0.232 1.00 . A A . 17 VAL HG23 1 1 1 233 1 1 17 VAL N N 2.152 -2.028 0.739 1.00 . A A . 17 VAL N 1 1 1 234 1 1 17 VAL O O 5.536 -1.733 1.530 1.00 . A A . 17 VAL O 1 1 1 235 1 1 18 LYS C C 5.443 1.187 1.096 1.00 . A A . 18 LYS C 1 1 1 236 1 1 18 LYS CA C 5.332 0.416 -0.221 1.00 . A A . 18 LYS CA 1 1 1 237 1 1 18 LYS CB C 4.977 1.297 -1.421 1.00 . A A . 18 LYS CB 1 1 1 238 1 1 18 LYS CD C 3.831 3.302 -0.407 1.00 . A A . 18 LYS CD 1 1 1 239 1 1 18 LYS CE C 2.909 3.959 -1.434 1.00 . A A . 18 LYS CE 1 1 1 240 1 1 18 LYS CG C 5.108 2.780 -1.070 1.00 . A A . 18 LYS CG 1 1 1 241 1 1 18 LYS H H 3.557 -0.581 -0.663 1.00 . A A . 18 LYS H 1 1 1 242 1 1 18 LYS HA H 6.295 -0.046 -0.434 1.00 . A A . 18 LYS HA 1 1 1 243 1 1 18 LYS HB3 H 3.959 1.084 -1.745 1.00 . A A . 18 LYS HB3 1 1 1 244 1 1 18 LYS HD3 H 4.089 4.021 0.370 1.00 . A A . 18 LYS HD3 1 1 1 245 1 1 18 LYS HE3 H 2.663 3.245 -2.220 1.00 . A A . 18 LYS HE3 1 1 1 246 1 1 18 LYS HG3 H 5.314 3.355 -1.972 1.00 . A A . 18 LYS HG3 1 1 1 247 1 1 18 LYS HZ1 H 0.950 4.541 -1.474 1.00 . A A . 18 LYS HZ1 1 1 1 248 1 1 18 LYS HZ2 H 1.375 3.775 -0.095 1.00 . A A . 18 LYS HZ2 1 1 1 249 1 1 18 LYS HZ3 H 1.840 5.321 -0.348 1.00 . A A . 18 LYS HZ3 1 1 1 250 1 1 18 LYS N N 4.359 -0.653 -0.070 1.00 . A A . 18 LYS N 1 1 1 251 1 1 18 LYS NZ N 1.668 4.438 -0.785 1.00 . A A . 18 LYS NZ 1 1 1 252 1 1 18 LYS O O 6.530 1.620 1.475 1.00 . A A . 18 LYS O 1 1 1 253 1 1 19 LYS C C 5.091 1.283 4.060 1.00 . A A . 19 LYS C 1 1 1 254 1 1 19 LYS CA C 4.262 2.045 3.024 1.00 . A A . 19 LYS CA 1 1 1 255 1 1 19 LYS CB C 2.813 2.287 3.453 1.00 . A A . 19 LYS CB 1 1 1 256 1 1 19 LYS CD C 2.532 0.577 5.286 1.00 . A A . 19 LYS CD 1 1 1 257 1 1 19 LYS CE C 1.077 0.178 5.539 1.00 . A A . 19 LYS CE 1 1 1 258 1 1 19 LYS CG C 2.644 2.067 4.958 1.00 . A A . 19 LYS CG 1 1 1 259 1 1 19 LYS H H 3.425 0.978 1.443 1.00 . A A . 19 LYS H 1 1 1 260 1 1 19 LYS HA H 4.719 3.021 2.866 1.00 . A A . 19 LYS HA 1 1 1 261 1 1 19 LYS HB3 H 2.151 1.614 2.907 1.00 . A A . 19 LYS HB3 1 1 1 262 1 1 19 LYS HD3 H 3.135 0.348 6.166 1.00 . A A . 19 LYS HD3 1 1 1 263 1 1 19 LYS HE3 H 0.483 0.360 4.644 1.00 . A A . 19 LYS HE3 1 1 1 264 1 1 19 LYS HG3 H 1.752 2.588 5.307 1.00 . A A . 19 LYS HG3 1 1 1 265 1 1 19 LYS HZ1 H 0.215 -1.383 6.538 1.00 . A A . 19 LYS HZ1 1 1 1 266 1 1 19 LYS HZ2 H 0.860 -1.805 5.098 1.00 . A A . 19 LYS HZ2 1 1 1 267 1 1 19 LYS HZ3 H 1.834 -1.525 6.378 1.00 . A A . 19 LYS HZ3 1 1 1 268 1 1 19 LYS N N 4.305 1.334 1.757 1.00 . A A . 19 LYS N 1 1 1 269 1 1 19 LYS NZ N 0.989 -1.250 5.919 1.00 . A A . 19 LYS NZ 1 1 1 270 1 1 19 LYS O O 5.541 1.862 5.047 1.00 . A A . 19 LYS O 1 1 1 271 1 1 20 LEU C C 7.506 -0.830 4.277 1.00 . A A . 20 LEU C 1 1 1 272 1 1 20 LEU CA C 6.035 -0.851 4.697 1.00 . A A . 20 LEU CA 1 1 1 273 1 1 20 LEU CB C 5.431 -2.255 4.755 1.00 . A A . 20 LEU CB 1 1 1 274 1 1 20 LEU CD1 C 7.483 -3.721 4.798 1.00 . A A . 20 LEU CD1 1 1 1 275 1 1 20 LEU CD2 C 5.328 -4.573 3.764 1.00 . A A . 20 LEU CD2 1 1 1 276 1 1 20 LEU CG C 6.212 -3.352 4.029 1.00 . A A . 20 LEU CG 1 1 1 277 1 1 20 LEU H H 4.898 -0.467 2.994 1.00 . A A . 20 LEU H 1 1 1 278 1 1 20 LEU HA H 5.955 -0.425 5.696 1.00 . A A . 20 LEU HA 1 1 1 279 1 1 20 LEU HB3 H 4.426 -2.215 4.335 1.00 . A A . 20 LEU HB3 1 1 1 280 1 1 20 LEU HD11 H 7.545 -4.805 4.898 1.00 . A A . 20 LEU HD11 1 1 1 281 1 1 20 LEU HD12 H 8.355 -3.357 4.255 1.00 . A A . 20 LEU HD12 1 1 1 282 1 1 20 LEU HD13 H 7.455 -3.265 5.787 1.00 . A A . 20 LEU HD13 1 1 1 283 1 1 20 LEU HD21 H 5.822 -5.468 4.142 1.00 . A A . 20 LEU HD21 1 1 1 284 1 1 20 LEU HD22 H 4.371 -4.443 4.269 1.00 . A A . 20 LEU HD22 1 1 1 285 1 1 20 LEU HD23 H 5.163 -4.675 2.692 1.00 . A A . 20 LEU HD23 1 1 1 286 1 1 20 LEU HG H 6.525 -2.965 3.059 1.00 . A A . 20 LEU HG 1 1 1 287 1 1 20 LEU N N 5.267 -0.004 3.799 1.00 . A A . 20 LEU N 1 1 1 288 1 1 20 LEU O O 8.383 -1.195 5.058 1.00 . A A . 20 LEU O 1 1 1 289 1 1 21 PHE C C 9.793 0.936 2.993 1.00 . A A . 21 PHE C 1 1 1 290 1 1 21 PHE CA C 9.080 -0.328 2.511 1.00 . A A . 21 PHE CA 1 1 1 291 1 1 21 PHE CB C 8.957 -0.281 0.987 1.00 . A A . 21 PHE CB 1 1 1 292 1 1 21 PHE CD1 C 10.744 -1.671 -0.085 1.00 . A A . 21 PHE CD1 1 1 1 293 1 1 21 PHE CD2 C 8.566 -2.560 0.027 1.00 . A A . 21 PHE CD2 1 1 1 294 1 1 21 PHE CE1 C 11.192 -2.850 -0.738 1.00 . A A . 21 PHE CE1 1 1 1 295 1 1 21 PHE CE2 C 9.013 -3.739 -0.626 1.00 . A A . 21 PHE CE2 1 1 1 296 1 1 21 PHE CG C 9.440 -1.551 0.283 1.00 . A A . 21 PHE CG 1 1 1 297 1 1 21 PHE CZ C 10.317 -3.859 -0.995 1.00 . A A . 21 PHE CZ 1 1 1 298 1 1 21 PHE H H 7.011 -0.106 2.415 1.00 . A A . 21 PHE H 1 1 1 299 1 1 21 PHE HA H 9.617 -1.206 2.871 1.00 . A A . 21 PHE HA 1 1 1 300 1 1 21 PHE HB3 H 9.529 0.569 0.613 1.00 . A A . 21 PHE HB3 1 1 1 301 1 1 21 PHE HD1 H 11.445 -0.862 0.121 1.00 . A A . 21 PHE HD1 1 1 1 302 1 1 21 PHE HD2 H 7.521 -2.464 0.322 1.00 . A A . 21 PHE HD2 1 1 1 303 1 1 21 PHE HE1 H 12.237 -2.945 -1.033 1.00 . A A . 21 PHE HE1 1 1 1 304 1 1 21 PHE HE2 H 8.312 -4.548 -0.832 1.00 . A A . 21 PHE HE2 1 1 1 305 1 1 21 PHE HZ H 10.661 -4.764 -1.496 1.00 . A A . 21 PHE HZ 1 1 1 306 1 1 21 PHE N N 7.731 -0.401 3.044 1.00 . A A . 21 PHE N 1 1 1 307 1 1 21 PHE O O 11.020 1.019 2.946 1.00 . A A . 21 PHE O 1 1 1 308 1 1 22 LYS C C 10.699 2.863 4.885 1.00 . A A . 22 LYS C 1 1 1 309 1 1 22 LYS CA C 9.533 3.148 3.937 1.00 . A A . 22 LYS CA 1 1 1 310 1 1 22 LYS CB C 8.425 3.998 4.562 1.00 . A A . 22 LYS CB 1 1 1 311 1 1 22 LYS CD C 7.946 2.306 6.370 1.00 . A A . 22 LYS CD 1 1 1 312 1 1 22 LYS CE C 6.746 2.244 7.318 1.00 . A A . 22 LYS CE 1 1 1 313 1 1 22 LYS CG C 8.333 3.756 6.071 1.00 . A A . 22 LYS CG 1 1 1 314 1 1 22 LYS H H 7.998 1.816 3.481 1.00 . A A . 22 LYS H 1 1 1 315 1 1 22 LYS HA H 9.914 3.698 3.076 1.00 . A A . 22 LYS HA 1 1 1 316 1 1 22 LYS HB3 H 7.471 3.761 4.094 1.00 . A A . 22 LYS HB3 1 1 1 317 1 1 22 LYS HD3 H 8.793 1.784 6.815 1.00 . A A . 22 LYS HD3 1 1 1 318 1 1 22 LYS HE3 H 6.342 1.232 7.336 1.00 . A A . 22 LYS HE3 1 1 1 319 1 1 22 LYS HG3 H 7.598 4.430 6.507 1.00 . A A . 22 LYS HG3 1 1 1 320 1 1 22 LYS HZ1 H 6.995 1.891 9.315 1.00 . A A . 22 LYS HZ1 1 1 1 321 1 1 22 LYS HZ2 H 8.110 2.906 8.688 1.00 . A A . 22 LYS HZ2 1 1 1 322 1 1 22 LYS HZ3 H 6.592 3.436 8.971 1.00 . A A . 22 LYS HZ3 1 1 1 323 1 1 22 LYS N N 8.994 1.891 3.446 1.00 . A A . 22 LYS N 1 1 1 324 1 1 22 LYS NZ N 7.143 2.653 8.684 1.00 . A A . 22 LYS NZ 1 1 1 325 1 1 22 LYS O O 11.586 3.699 5.053 1.00 . A A . 22 LYS O 1 1 1 326 1 1 23 LYS C C 12.723 0.404 5.671 1.00 . A A . 23 LYS C 1 1 1 327 1 1 23 LYS CA C 11.702 1.274 6.407 1.00 . A A . 23 LYS CA 1 1 1 328 1 1 23 LYS CB C 11.092 0.599 7.638 1.00 . A A . 23 LYS CB 1 1 1 329 1 1 23 LYS CD C 10.523 -1.831 7.997 1.00 . A A . 23 LYS CD 1 1 1 330 1 1 23 LYS CE C 9.769 -1.898 9.326 1.00 . A A . 23 LYS CE 1 1 1 331 1 1 23 LYS CG C 10.172 -0.554 7.231 1.00 . A A . 23 LYS CG 1 1 1 332 1 1 23 LYS H H 9.935 1.006 5.338 1.00 . A A . 23 LYS H 1 1 1 333 1 1 23 LYS HA H 12.204 2.178 6.751 1.00 . A A . 23 LYS HA 1 1 1 334 1 1 23 LYS HB3 H 10.530 1.331 8.217 1.00 . A A . 23 LYS HB3 1 1 1 335 1 1 23 LYS HD3 H 11.597 -1.865 8.181 1.00 . A A . 23 LYS HD3 1 1 1 336 1 1 23 LYS HE3 H 8.722 -1.638 9.171 1.00 . A A . 23 LYS HE3 1 1 1 337 1 1 23 LYS HG3 H 10.259 -0.732 6.160 1.00 . A A . 23 LYS HG3 1 1 1 338 1 1 23 LYS HZ1 H 9.316 -3.891 9.370 1.00 . A A . 23 LYS HZ1 1 1 1 339 1 1 23 LYS HZ2 H 10.822 -3.553 9.903 1.00 . A A . 23 LYS HZ2 1 1 1 340 1 1 23 LYS HZ3 H 9.529 -3.238 10.851 1.00 . A A . 23 LYS HZ3 1 1 1 341 1 1 23 LYS N N 10.660 1.679 5.480 1.00 . A A . 23 LYS N 1 1 1 342 1 1 23 LYS NZ N 9.866 -3.255 9.909 1.00 . A A . 23 LYS NZ 1 1 1 343 1 1 23 LYS O O 13.912 0.435 5.984 1.00 . A A . 23 LYS O 1 1 1 344 1 1 24 TRP C C 14.030 -0.359 3.110 1.00 . A A . 24 TRP C 1 1 1 345 1 1 24 TRP CA C 13.074 -1.233 3.924 1.00 . A A . 24 TRP CA 1 1 1 346 1 1 24 TRP CB C 12.238 -2.176 3.056 1.00 . A A . 24 TRP CB 1 1 1 347 1 1 24 TRP CD1 C 11.176 -3.206 5.171 1.00 . A A . 24 TRP CD1 1 1 1 348 1 1 24 TRP CD2 C 10.731 -4.346 3.325 1.00 . A A . 24 TRP CD2 1 1 1 349 1 1 24 TRP CE2 C 10.110 -4.997 4.371 1.00 . A A . 24 TRP CE2 1 1 1 350 1 1 24 TRP CE3 C 10.638 -4.825 2.006 1.00 . A A . 24 TRP CE3 1 1 1 351 1 1 24 TRP CG C 11.417 -3.192 3.852 1.00 . A A . 24 TRP CG 1 1 1 352 1 1 24 TRP CH2 C 9.247 -6.659 2.904 1.00 . A A . 24 TRP CH2 1 1 1 353 1 1 24 TRP CZ2 C 9.353 -6.163 4.208 1.00 . A A . 24 TRP CZ2 1 1 1 354 1 1 24 TRP CZ3 C 9.878 -5.992 1.860 1.00 . A A . 24 TRP CZ3 1 1 1 355 1 1 24 TRP H H 11.252 -0.375 4.460 1.00 . A A . 24 TRP H 1 1 1 356 1 1 24 TRP HA H 13.638 -1.855 4.619 1.00 . A A . 24 TRP HA 1 1 1 357 1 1 24 TRP HB3 H 12.903 -2.714 2.379 1.00 . A A . 24 TRP HB3 1 1 1 358 1 1 24 TRP HD1 H 11.555 -2.461 5.871 1.00 . A A . 24 TRP HD1 1 1 1 359 1 1 24 TRP HE1 H 10.050 -4.525 6.536 1.00 . A A . 24 TRP HE1 1 1 1 360 1 1 24 TRP HE3 H 11.119 -4.329 1.163 1.00 . A A . 24 TRP HE3 1 1 1 361 1 1 24 TRP HH2 H 8.672 -7.564 2.707 1.00 . A A . 24 TRP HH2 1 1 1 362 1 1 24 TRP HZ2 H 8.872 -6.658 5.052 1.00 . A A . 24 TRP HZ2 1 1 1 363 1 1 24 TRP HZ3 H 9.773 -6.407 0.857 1.00 . A A . 24 TRP HZ3 1 1 1 364 1 1 24 TRP N N 12.220 -0.354 4.708 1.00 . A A . 24 TRP N 1 1 1 365 1 1 24 TRP NE1 N 10.389 -4.281 5.530 1.00 . A A . 24 TRP NE1 1 1 1 366 1 1 24 TRP O O 13.594 0.442 2.285 1.00 . A A . 24 TRP O 1 1 1 367 1 1 25 GLY C C 17.703 -0.462 2.789 1.00 . A A . 25 GLY C 1 1 1 368 1 1 25 GLY CA C 16.338 0.216 2.670 1.00 . A A . 25 GLY CA 1 1 1 369 1 1 25 GLY H H 15.662 -1.199 4.041 1.00 . A A . 25 GLY H 1 1 1 370 1 1 25 GLY HA2 H 16.067 0.315 1.618 1.00 . A A . 25 GLY HA2 1 1 1 371 1 1 25 GLY HA3 H 16.390 1.224 3.081 1.00 . A A . 25 GLY HA3 1 1 1 372 1 1 25 GLY N N 15.316 -0.544 3.369 1.00 . A A . 25 GLY N 1 1 1 373 1 1 25 GLY O O 18.353 -0.378 3.830 1.00 . A A . 25 GLY O 1 1 1 374 1 1 26 TRP C C 20.428 -0.888 2.298 1.00 . A A . 26 TRP C 1 1 1 375 1 1 26 TRP CA C 19.376 -1.811 1.679 1.00 . A A . 26 TRP CA 1 1 1 376 1 1 26 TRP CB C 19.730 -2.249 0.256 1.00 . A A . 26 TRP CB 1 1 1 377 1 1 26 TRP CD1 C 19.379 0.133 -0.675 1.00 . A A . 26 TRP CD1 1 1 1 378 1 1 26 TRP CD2 C 20.760 -1.091 -1.901 1.00 . A A . 26 TRP CD2 1 1 1 379 1 1 26 TRP CE2 C 20.661 0.147 -2.503 1.00 . A A . 26 TRP CE2 1 1 1 380 1 1 26 TRP CE3 C 21.570 -2.106 -2.442 1.00 . A A . 26 TRP CE3 1 1 1 381 1 1 26 TRP CG C 19.928 -1.089 -0.722 1.00 . A A . 26 TRP CG 1 1 1 382 1 1 26 TRP CH2 C 22.158 -0.510 -4.233 1.00 . A A . 26 TRP CH2 1 1 1 383 1 1 26 TRP CZ2 C 21.346 0.486 -3.676 1.00 . A A . 26 TRP CZ2 1 1 1 384 1 1 26 TRP CZ3 C 22.247 -1.751 -3.614 1.00 . A A . 26 TRP CZ3 1 1 1 385 1 1 26 TRP H H 17.565 -1.182 0.865 1.00 . A A . 26 TRP H 1 1 1 386 1 1 26 TRP HA H 19.278 -2.718 2.275 1.00 . A A . 26 TRP HA 1 1 1 387 1 1 26 TRP HB3 H 18.937 -2.896 -0.121 1.00 . A A . 26 TRP HB3 1 1 1 388 1 1 26 TRP HD1 H 18.691 0.466 0.102 1.00 . A A . 26 TRP HD1 1 1 1 389 1 1 26 TRP HE1 H 19.498 1.944 -1.930 1.00 . A A . 26 TRP HE1 1 1 1 390 1 1 26 TRP HE3 H 21.665 -3.091 -1.985 1.00 . A A . 26 TRP HE3 1 1 1 391 1 1 26 TRP HH2 H 22.718 -0.312 -5.146 1.00 . A A . 26 TRP HH2 1 1 1 392 1 1 26 TRP HZ2 H 21.250 1.471 -4.132 1.00 . A A . 26 TRP HZ2 1 1 1 393 1 1 26 TRP HZ3 H 22.889 -2.502 -4.075 1.00 . A A . 26 TRP HZ3 1 1 1 394 1 1 26 TRP N N 18.099 -1.119 1.709 1.00 . A A . 26 TRP N 1 1 1 395 1 1 26 TRP NE1 N 19.794 0.915 -1.734 1.00 . A A . 26 TRP NE1 1 1 1 396 1 1 26 TRP O O 21.589 -1.270 2.436 1.00 . A A . 26 TRP O 1 1 2 397 1 1 1 LYS C C -3.239 10.562 8.759 1.00 . A A . 1 LYS C 1 1 2 398 1 1 1 LYS CA C -2.208 11.685 8.628 1.00 . A A . 1 LYS CA 1 1 2 399 1 1 1 LYS CB C -1.537 12.059 9.952 1.00 . A A . 1 LYS CB 1 1 2 400 1 1 1 LYS CD C 0.557 11.868 11.346 1.00 . A A . 1 LYS CD 1 1 2 401 1 1 1 LYS CE C 1.903 12.566 11.151 1.00 . A A . 1 LYS CE 1 1 2 402 1 1 1 LYS CG C -0.095 11.549 9.999 1.00 . A A . 1 LYS CG 1 1 2 403 1 1 1 LYS H1 H -3.689 12.664 7.538 1.00 . A A . 1 LYS H1 1 1 2 404 1 1 1 LYS HA H -1.422 11.356 7.950 1.00 . A A . 1 LYS HA 1 1 2 405 1 1 1 LYS HB3 H -2.103 11.638 10.783 1.00 . A A . 1 LYS HB3 1 1 2 406 1 1 1 LYS HD3 H 0.698 10.948 11.912 1.00 . A A . 1 LYS HD3 1 1 2 407 1 1 1 LYS HE3 H 2.193 12.525 10.101 1.00 . A A . 1 LYS HE3 1 1 2 408 1 1 1 LYS HG3 H 0.482 12.004 9.194 1.00 . A A . 1 LYS HG3 1 1 2 409 1 1 1 LYS HZ1 H 2.691 14.242 12.017 1.00 . A A . 1 LYS HZ1 1 1 2 410 1 1 1 LYS HZ2 H 1.645 14.565 10.804 1.00 . A A . 1 LYS HZ2 1 1 2 411 1 1 1 LYS HZ3 H 1.084 14.077 12.258 1.00 . A A . 1 LYS HZ3 1 1 2 412 1 1 1 LYS N N -2.839 12.850 8.032 1.00 . A A . 1 LYS N 1 1 2 413 1 1 1 LYS NZ N 1.825 13.977 11.593 1.00 . A A . 1 LYS NZ 1 1 2 414 1 1 1 LYS O O -4.150 10.643 9.581 1.00 . A A . 1 LYS O 1 1 2 415 1 1 2 SER C C -3.359 7.246 7.148 1.00 . A A . 2 SER C 1 1 2 416 1 1 2 SER CA C -3.964 8.403 7.945 1.00 . A A . 2 SER CA 1 1 2 417 1 1 2 SER CB C -5.334 8.780 7.376 1.00 . A A . 2 SER CB 1 1 2 418 1 1 2 SER H H -2.318 9.484 7.267 1.00 . A A . 2 SER H 1 1 2 419 1 1 2 SER HA H -4.071 8.130 8.995 1.00 . A A . 2 SER HA 1 1 2 420 1 1 2 SER HB3 H -5.725 7.948 6.792 1.00 . A A . 2 SER HB3 1 1 2 421 1 1 2 SER HG H -6.614 8.289 8.833 1.00 . A A . 2 SER HG 1 1 2 422 1 1 2 SER N N -3.061 9.541 7.933 1.00 . A A . 2 SER N 1 1 2 423 1 1 2 SER O O -2.455 7.451 6.339 1.00 . A A . 2 SER O 1 1 2 424 1 1 2 SER OG O -6.263 9.120 8.401 1.00 . A A . 2 SER OG 1 1 2 425 1 1 3 SER C C -4.571 4.151 6.036 1.00 . A A . 3 SER C 1 1 2 426 1 1 3 SER CA C -3.404 4.866 6.720 1.00 . A A . 3 SER CA 1 1 2 427 1 1 3 SER CB C -2.698 3.918 7.692 1.00 . A A . 3 SER CB 1 1 2 428 1 1 3 SER H H -4.618 5.898 8.063 1.00 . A A . 3 SER H 1 1 2 429 1 1 3 SER HA H -2.688 5.225 5.981 1.00 . A A . 3 SER HA 1 1 2 430 1 1 3 SER HB3 H -3.184 2.942 7.664 1.00 . A A . 3 SER HB3 1 1 2 431 1 1 3 SER HG H -0.758 4.203 8.091 1.00 . A A . 3 SER HG 1 1 2 432 1 1 3 SER N N -3.882 6.056 7.404 1.00 . A A . 3 SER N 1 1 2 433 1 1 3 SER O O -5.095 3.170 6.559 1.00 . A A . 3 SER O 1 1 2 434 1 1 3 SER OG O -1.315 3.770 7.383 1.00 . A A . 3 SER OG 1 1 2 435 1 1 4 ALA C C -6.241 4.904 2.831 1.00 . A A . 4 ALA C 1 1 2 436 1 1 4 ALA CA C -6.039 4.097 4.114 1.00 . A A . 4 ALA CA 1 1 2 437 1 1 4 ALA CB C -7.299 4.056 4.982 1.00 . A A . 4 ALA CB 1 1 2 438 1 1 4 ALA H H -4.512 5.471 4.457 1.00 . A A . 4 ALA H 1 1 2 439 1 1 4 ALA HA H -5.760 3.076 3.852 1.00 . A A . 4 ALA HA 1 1 2 440 1 1 4 ALA HB1 H -7.199 3.269 5.730 1.00 . A A . 4 ALA HB1 1 1 2 441 1 1 4 ALA HB2 H -7.427 5.017 5.480 1.00 . A A . 4 ALA HB2 1 1 2 442 1 1 4 ALA HB3 H -8.166 3.854 4.354 1.00 . A A . 4 ALA HB3 1 1 2 443 1 1 4 ALA N N -4.944 4.672 4.876 1.00 . A A . 4 ALA N 1 1 2 444 1 1 4 ALA O O -6.209 6.133 2.854 1.00 . A A . 4 ALA O 1 1 2 445 1 1 5 TYR C C -7.355 3.860 -0.522 1.00 . A A . 5 TYR C 1 1 2 446 1 1 5 TYR CA C -6.654 4.812 0.448 1.00 . A A . 5 TYR CA 1 1 2 447 1 1 5 TYR CB C -5.260 5.136 -0.091 1.00 . A A . 5 TYR CB 1 1 2 448 1 1 5 TYR CD1 C -4.610 7.499 0.504 1.00 . A A . 5 TYR CD1 1 1 2 449 1 1 5 TYR CD2 C -3.657 5.708 1.770 1.00 . A A . 5 TYR CD2 1 1 2 450 1 1 5 TYR CE1 C -3.881 8.451 1.301 1.00 . A A . 5 TYR CE1 1 1 2 451 1 1 5 TYR CE2 C -2.928 6.661 2.567 1.00 . A A . 5 TYR CE2 1 1 2 452 1 1 5 TYR CG C -4.484 6.148 0.756 1.00 . A A . 5 TYR CG 1 1 2 453 1 1 5 TYR CZ C -3.075 7.984 2.294 1.00 . A A . 5 TYR CZ 1 1 2 454 1 1 5 TYR H H -6.472 3.179 1.729 1.00 . A A . 5 TYR H 1 1 2 455 1 1 5 TYR HA H -7.281 5.690 0.602 1.00 . A A . 5 TYR HA 1 1 2 456 1 1 5 TYR HB3 H -5.355 5.524 -1.106 1.00 . A A . 5 TYR HB3 1 1 2 457 1 1 5 TYR HD1 H -5.263 7.845 -0.297 1.00 . A A . 5 TYR HD1 1 1 2 458 1 1 5 TYR HD2 H -3.558 4.642 1.969 1.00 . A A . 5 TYR HD2 1 1 2 459 1 1 5 TYR HE1 H -3.971 9.520 1.113 1.00 . A A . 5 TYR HE1 1 1 2 460 1 1 5 TYR HE2 H -2.272 6.328 3.372 1.00 . A A . 5 TYR HE2 1 1 2 461 1 1 5 TYR HH H -1.835 8.405 3.730 1.00 . A A . 5 TYR HH 1 1 2 462 1 1 5 TYR N N -6.446 4.179 1.739 1.00 . A A . 5 TYR N 1 1 2 463 1 1 5 TYR O O -6.843 3.584 -1.605 1.00 . A A . 5 TYR O 1 1 2 464 1 1 5 TYR OH O -2.386 8.883 3.046 1.00 . A A . 5 TYR OH 1 1 2 465 1 1 6 SER C C -8.857 1.028 -0.650 1.00 . A A . 6 SER C 1 1 2 466 1 1 6 SER CA C -9.294 2.469 -0.918 1.00 . A A . 6 SER CA 1 1 2 467 1 1 6 SER CB C -9.148 2.801 -2.404 1.00 . A A . 6 SER CB 1 1 2 468 1 1 6 SER H H -8.927 3.614 0.783 1.00 . A A . 6 SER H 1 1 2 469 1 1 6 SER HA H -10.330 2.618 -0.613 1.00 . A A . 6 SER HA 1 1 2 470 1 1 6 SER HB3 H -9.965 2.340 -2.960 1.00 . A A . 6 SER HB3 1 1 2 471 1 1 6 SER HG H -9.802 4.656 -2.033 1.00 . A A . 6 SER HG 1 1 2 472 1 1 6 SER N N -8.517 3.385 -0.099 1.00 . A A . 6 SER N 1 1 2 473 1 1 6 SER O O -9.690 0.127 -0.571 1.00 . A A . 6 SER O 1 1 2 474 1 1 6 SER OG O -9.147 4.207 -2.641 1.00 . A A . 6 SER OG 1 1 2 475 1 1 7 LEU C C -7.685 -1.076 0.957 1.00 . A A . 7 LEU C 1 1 2 476 1 1 7 LEU CA C -6.992 -0.462 -0.262 1.00 . A A . 7 LEU CA 1 1 2 477 1 1 7 LEU CB C -5.469 -0.382 -0.127 1.00 . A A . 7 LEU CB 1 1 2 478 1 1 7 LEU CD1 C -3.415 -0.847 1.259 1.00 . A A . 7 LEU CD1 1 1 2 479 1 1 7 LEU CD2 C -5.223 0.702 2.136 1.00 . A A . 7 LEU CD2 1 1 2 480 1 1 7 LEU CG C -4.912 -0.534 1.290 1.00 . A A . 7 LEU CG 1 1 2 481 1 1 7 LEU H H -6.878 1.593 -0.584 1.00 . A A . 7 LEU H 1 1 2 482 1 1 7 LEU HA H -7.206 -1.083 -1.132 1.00 . A A . 7 LEU HA 1 1 2 483 1 1 7 LEU HB3 H -5.139 0.578 -0.525 1.00 . A A . 7 LEU HB3 1 1 2 484 1 1 7 LEU HD11 H -3.120 -1.302 2.205 1.00 . A A . 7 LEU HD11 1 1 2 485 1 1 7 LEU HD12 H -3.205 -1.537 0.442 1.00 . A A . 7 LEU HD12 1 1 2 486 1 1 7 LEU HD13 H -2.855 0.075 1.110 1.00 . A A . 7 LEU HD13 1 1 2 487 1 1 7 LEU HD21 H -5.359 0.405 3.177 1.00 . A A . 7 LEU HD21 1 1 2 488 1 1 7 LEU HD22 H -4.395 1.408 2.066 1.00 . A A . 7 LEU HD22 1 1 2 489 1 1 7 LEU HD23 H -6.135 1.173 1.771 1.00 . A A . 7 LEU HD23 1 1 2 490 1 1 7 LEU HG H -5.410 -1.382 1.763 1.00 . A A . 7 LEU HG 1 1 2 491 1 1 7 LEU N N -7.550 0.854 -0.519 1.00 . A A . 7 LEU N 1 1 2 492 1 1 7 LEU O O -7.418 -0.683 2.091 1.00 . A A . 7 LEU O 1 1 2 493 1 1 8 GLN C C -10.064 -3.899 1.174 1.00 . A A . 8 GLN C 1 1 2 494 1 1 8 GLN CA C -9.296 -2.703 1.738 1.00 . A A . 8 GLN CA 1 1 2 495 1 1 8 GLN CB C -10.238 -1.733 2.453 1.00 . A A . 8 GLN CB 1 1 2 496 1 1 8 GLN CD C -12.447 -0.521 2.341 1.00 . A A . 8 GLN CD 1 1 2 497 1 1 8 GLN CG C -11.469 -1.431 1.596 1.00 . A A . 8 GLN CG 1 1 2 498 1 1 8 GLN H H -8.772 -2.345 -0.247 1.00 . A A . 8 GLN H 1 1 2 499 1 1 8 GLN HA H -8.538 -3.049 2.441 1.00 . A A . 8 GLN HA 1 1 2 500 1 1 8 GLN HB3 H -9.710 -0.805 2.676 1.00 . A A . 8 GLN HB3 1 1 2 501 1 1 8 GLN HE21 H -13.960 -1.713 1.715 1.00 . A A . 8 GLN HE21 1 1 2 502 1 1 8 GLN HE22 H -14.434 -0.367 2.696 1.00 . A A . 8 GLN HE22 1 1 2 503 1 1 8 GLN HG3 H -11.966 -2.364 1.327 1.00 . A A . 8 GLN HG3 1 1 2 504 1 1 8 GLN N N -8.562 -2.031 0.680 1.00 . A A . 8 GLN N 1 1 2 505 1 1 8 GLN NE2 N -13.719 -0.898 2.243 1.00 . A A . 8 GLN NE2 1 1 2 506 1 1 8 GLN O O -10.120 -4.957 1.799 1.00 . A A . 8 GLN O 1 1 2 507 1 1 8 GLN OE1 O -12.071 0.458 2.964 1.00 . A A . 8 GLN OE1 1 1 2 508 1 1 9 MET C C -10.642 -5.301 -1.861 1.00 . A A . 9 MET C 1 1 2 509 1 1 9 MET CA C -11.402 -4.740 -0.658 1.00 . A A . 9 MET CA 1 1 2 510 1 1 9 MET CB C -12.749 -4.178 -1.120 1.00 . A A . 9 MET CB 1 1 2 511 1 1 9 MET CE C -14.249 -1.299 -1.070 1.00 . A A . 9 MET CE 1 1 2 512 1 1 9 MET CG C -12.557 -3.122 -2.209 1.00 . A A . 9 MET CG 1 1 2 513 1 1 9 MET H H -10.588 -2.828 -0.505 1.00 . A A . 9 MET H 1 1 2 514 1 1 9 MET HA H -11.533 -5.519 0.093 1.00 . A A . 9 MET HA 1 1 2 515 1 1 9 MET HB3 H -13.274 -3.740 -0.272 1.00 . A A . 9 MET HB3 1 1 2 516 1 1 9 MET HE1 H -14.469 -0.243 -0.914 1.00 . A A . 9 MET HE1 1 1 2 517 1 1 9 MET HE2 H -14.860 -1.681 -1.888 1.00 . A A . 9 MET HE2 1 1 2 518 1 1 9 MET HE3 H -14.470 -1.855 -0.159 1.00 . A A . 9 MET HE3 1 1 2 519 1 1 9 MET HG3 H -13.365 -3.186 -2.936 1.00 . A A . 9 MET HG3 1 1 2 520 1 1 9 MET N N -10.638 -3.691 -0.002 1.00 . A A . 9 MET N 1 1 2 521 1 1 9 MET O O -10.877 -6.435 -2.275 1.00 . A A . 9 MET O 1 1 2 522 1 1 9 MET SD S -12.522 -1.492 -1.480 1.00 . A A . 9 MET SD 1 1 2 523 1 1 10 GLY C C -8.045 -6.062 -3.193 1.00 . A A . 10 GLY C 1 1 2 524 1 1 10 GLY CA C -8.951 -4.878 -3.539 1.00 . A A . 10 GLY CA 1 1 2 525 1 1 10 GLY H H -9.562 -3.558 -2.048 1.00 . A A . 10 GLY H 1 1 2 526 1 1 10 GLY HA2 H -9.609 -5.149 -4.365 1.00 . A A . 10 GLY HA2 1 1 2 527 1 1 10 GLY HA3 H -8.344 -4.038 -3.875 1.00 . A A . 10 GLY HA3 1 1 2 528 1 1 10 GLY N N -9.747 -4.479 -2.390 1.00 . A A . 10 GLY N 1 1 2 529 1 1 10 GLY O O -8.457 -6.978 -2.482 1.00 . A A . 10 GLY O 1 1 2 530 1 1 11 ALA C C -4.464 -6.568 -3.857 1.00 . A A . 11 ALA C 1 1 2 531 1 1 11 ALA CA C -5.859 -7.061 -3.466 1.00 . A A . 11 ALA CA 1 1 2 532 1 1 11 ALA CB C -6.270 -8.318 -4.234 1.00 . A A . 11 ALA CB 1 1 2 533 1 1 11 ALA H H -6.500 -5.256 -4.288 1.00 . A A . 11 ALA H 1 1 2 534 1 1 11 ALA HA H -5.872 -7.281 -2.399 1.00 . A A . 11 ALA HA 1 1 2 535 1 1 11 ALA HB1 H -7.355 -8.342 -4.339 1.00 . A A . 11 ALA HB1 1 1 2 536 1 1 11 ALA HB2 H -5.810 -8.308 -5.222 1.00 . A A . 11 ALA HB2 1 1 2 537 1 1 11 ALA HB3 H -5.938 -9.201 -3.689 1.00 . A A . 11 ALA HB3 1 1 2 538 1 1 11 ALA N N -6.827 -6.005 -3.712 1.00 . A A . 11 ALA N 1 1 2 539 1 1 11 ALA O O -3.577 -6.468 -3.011 1.00 . A A . 11 ALA O 1 1 2 540 1 1 12 THR C C -2.584 -4.559 -4.875 1.00 . A A . 12 THR C 1 1 2 541 1 1 12 THR CA C -3.042 -5.794 -5.653 1.00 . A A . 12 THR CA 1 1 2 542 1 1 12 THR CB C -3.202 -5.541 -7.154 1.00 . A A . 12 THR CB 1 1 2 543 1 1 12 THR CG2 C -1.916 -5.027 -7.803 1.00 . A A . 12 THR CG2 1 1 2 544 1 1 12 THR H H -5.040 -6.357 -5.823 1.00 . A A . 12 THR H 1 1 2 545 1 1 12 THR HA H -2.292 -6.569 -5.493 1.00 . A A . 12 THR HA 1 1 2 546 1 1 12 THR HB H -4.034 -4.863 -7.348 1.00 . A A . 12 THR HB 1 1 2 547 1 1 12 THR HG1 H -4.179 -7.281 -7.307 1.00 . A A . 12 THR HG1 1 1 2 548 1 1 12 THR HG21 H -1.335 -5.871 -8.177 1.00 . A A . 12 THR HG21 1 1 2 549 1 1 12 THR HG22 H -2.165 -4.363 -8.630 1.00 . A A . 12 THR HG22 1 1 2 550 1 1 12 THR HG23 H -1.328 -4.482 -7.063 1.00 . A A . 12 THR HG23 1 1 2 551 1 1 12 THR N N -4.314 -6.273 -5.141 1.00 . A A . 12 THR N 1 1 2 552 1 1 12 THR O O -1.425 -4.469 -4.472 1.00 . A A . 12 THR O 1 1 2 553 1 1 12 THR OG1 O -3.375 -6.842 -7.709 1.00 . A A . 12 THR OG1 1 1 2 554 1 1 13 ALA C C -2.331 -2.735 -2.763 1.00 . A A . 13 ALA C 1 1 2 555 1 1 13 ALA CA C -3.224 -2.413 -3.964 1.00 . A A . 13 ALA CA 1 1 2 556 1 1 13 ALA CB C -4.534 -1.737 -3.552 1.00 . A A . 13 ALA CB 1 1 2 557 1 1 13 ALA H H -4.457 -3.719 -5.018 1.00 . A A . 13 ALA H 1 1 2 558 1 1 13 ALA HA H -2.684 -1.749 -4.639 1.00 . A A . 13 ALA HA 1 1 2 559 1 1 13 ALA HB1 H -4.372 -1.154 -2.645 1.00 . A A . 13 ALA HB1 1 1 2 560 1 1 13 ALA HB2 H -4.870 -1.077 -4.352 1.00 . A A . 13 ALA HB2 1 1 2 561 1 1 13 ALA HB3 H -5.291 -2.497 -3.364 1.00 . A A . 13 ALA HB3 1 1 2 562 1 1 13 ALA N N -3.518 -3.638 -4.686 1.00 . A A . 13 ALA N 1 1 2 563 1 1 13 ALA O O -1.278 -2.124 -2.586 1.00 . A A . 13 ALA O 1 1 2 564 1 1 14 ILE C C -0.557 -4.217 -1.143 1.00 . A A . 14 ILE C 1 1 2 565 1 1 14 ILE CA C -2.042 -4.105 -0.790 1.00 . A A . 14 ILE CA 1 1 2 566 1 1 14 ILE CB C -2.633 -5.388 -0.204 1.00 . A A . 14 ILE CB 1 1 2 567 1 1 14 ILE CD1 C -5.105 -5.795 -0.493 1.00 . A A . 14 ILE CD1 1 1 2 568 1 1 14 ILE CG1 C -4.029 -5.137 0.371 1.00 . A A . 14 ILE CG1 1 1 2 569 1 1 14 ILE CG2 C -1.689 -6.003 0.830 1.00 . A A . 14 ILE CG2 1 1 2 570 1 1 14 ILE H H -3.643 -4.185 -2.120 1.00 . A A . 14 ILE H 1 1 2 571 1 1 14 ILE HA H -2.161 -3.322 -0.040 1.00 . A A . 14 ILE HA 1 1 2 572 1 1 14 ILE HB H -2.743 -6.113 -1.011 1.00 . A A . 14 ILE HB 1 1 2 573 1 1 14 ILE HD11 H -6.021 -5.902 0.087 1.00 . A A . 14 ILE HD11 1 1 2 574 1 1 14 ILE HD12 H -5.299 -5.175 -1.368 1.00 . A A . 14 ILE HD12 1 1 2 575 1 1 14 ILE HD13 H -4.761 -6.779 -0.815 1.00 . A A . 14 ILE HD13 1 1 2 576 1 1 14 ILE HG13 H -4.212 -4.064 0.431 1.00 . A A . 14 ILE HG13 1 1 2 577 1 1 14 ILE HG21 H -1.641 -5.359 1.707 1.00 . A A . 14 ILE HG21 1 1 2 578 1 1 14 ILE HG22 H -2.060 -6.986 1.123 1.00 . A A . 14 ILE HG22 1 1 2 579 1 1 14 ILE HG23 H -0.694 -6.106 0.399 1.00 . A A . 14 ILE HG23 1 1 2 580 1 1 14 ILE N N -2.786 -3.693 -1.969 1.00 . A A . 14 ILE N 1 1 2 581 1 1 14 ILE O O 0.293 -3.665 -0.447 1.00 . A A . 14 ILE O 1 1 2 582 1 1 15 LYS C C 1.748 -3.762 -2.846 1.00 . A A . 15 LYS C 1 1 2 583 1 1 15 LYS CA C 1.075 -5.125 -2.678 1.00 . A A . 15 LYS CA 1 1 2 584 1 1 15 LYS CB C 1.106 -5.985 -3.943 1.00 . A A . 15 LYS CB 1 1 2 585 1 1 15 LYS CD C 2.931 -4.941 -5.333 1.00 . A A . 15 LYS CD 1 1 2 586 1 1 15 LYS CE C 3.829 -5.376 -6.494 1.00 . A A . 15 LYS CE 1 1 2 587 1 1 15 LYS CG C 2.534 -6.139 -4.469 1.00 . A A . 15 LYS CG 1 1 2 588 1 1 15 LYS H H -0.989 -5.380 -2.786 1.00 . A A . 15 LYS H 1 1 2 589 1 1 15 LYS HA H 1.604 -5.678 -1.901 1.00 . A A . 15 LYS HA 1 1 2 590 1 1 15 LYS HB3 H 0.478 -5.532 -4.710 1.00 . A A . 15 LYS HB3 1 1 2 591 1 1 15 LYS HD3 H 3.452 -4.203 -4.722 1.00 . A A . 15 LYS HD3 1 1 2 592 1 1 15 LYS HE3 H 4.612 -6.040 -6.126 1.00 . A A . 15 LYS HE3 1 1 2 593 1 1 15 LYS HG3 H 2.615 -7.056 -5.052 1.00 . A A . 15 LYS HG3 1 1 2 594 1 1 15 LYS HZ1 H 2.654 -6.911 -7.158 1.00 . A A . 15 LYS HZ1 1 1 2 595 1 1 15 LYS HZ2 H 2.289 -5.470 -7.834 1.00 . A A . 15 LYS HZ2 1 1 2 596 1 1 15 LYS HZ3 H 3.622 -6.283 -8.313 1.00 . A A . 15 LYS HZ3 1 1 2 597 1 1 15 LYS N N -0.291 -4.934 -2.225 1.00 . A A . 15 LYS N 1 1 2 598 1 1 15 LYS NZ N 3.034 -6.065 -7.534 1.00 . A A . 15 LYS NZ 1 1 2 599 1 1 15 LYS O O 2.915 -3.592 -2.494 1.00 . A A . 15 LYS O 1 1 2 600 1 1 16 GLN C C 2.049 -0.903 -2.300 1.00 . A A . 16 GLN C 1 1 2 601 1 1 16 GLN CA C 1.491 -1.479 -3.604 1.00 . A A . 16 GLN CA 1 1 2 602 1 1 16 GLN CB C 0.405 -0.571 -4.184 1.00 . A A . 16 GLN CB 1 1 2 603 1 1 16 GLN CD C -1.376 1.124 -3.624 1.00 . A A . 16 GLN CD 1 1 2 604 1 1 16 GLN CG C -0.131 0.391 -3.121 1.00 . A A . 16 GLN CG 1 1 2 605 1 1 16 GLN H H 0.036 -2.968 -3.669 1.00 . A A . 16 GLN H 1 1 2 606 1 1 16 GLN HA H 2.293 -1.587 -4.334 1.00 . A A . 16 GLN HA 1 1 2 607 1 1 16 GLN HB3 H -0.411 -1.177 -4.576 1.00 . A A . 16 GLN HB3 1 1 2 608 1 1 16 GLN HE21 H -0.580 2.852 -2.931 1.00 . A A . 16 GLN HE21 1 1 2 609 1 1 16 GLN HE22 H -2.131 3.002 -3.688 1.00 . A A . 16 GLN HE22 1 1 2 610 1 1 16 GLN HG3 H 0.641 1.114 -2.858 1.00 . A A . 16 GLN HG3 1 1 2 611 1 1 16 GLN N N 0.983 -2.823 -3.385 1.00 . A A . 16 GLN N 1 1 2 612 1 1 16 GLN NE2 N -1.361 2.435 -3.395 1.00 . A A . 16 GLN NE2 1 1 2 613 1 1 16 GLN O O 3.044 -0.180 -2.314 1.00 . A A . 16 GLN O 1 1 2 614 1 1 16 GLN OE1 O -2.289 0.540 -4.183 1.00 . A A . 16 GLN OE1 1 1 2 615 1 1 17 VAL C C 3.288 -1.073 0.298 1.00 . A A . 17 VAL C 1 1 2 616 1 1 17 VAL CA C 1.801 -0.771 0.101 1.00 . A A . 17 VAL CA 1 1 2 617 1 1 17 VAL CB C 0.917 -1.388 1.187 1.00 . A A . 17 VAL CB 1 1 2 618 1 1 17 VAL CG1 C 1.309 -0.870 2.572 1.00 . A A . 17 VAL CG1 1 1 2 619 1 1 17 VAL CG2 C -0.564 -1.128 0.902 1.00 . A A . 17 VAL CG2 1 1 2 620 1 1 17 VAL H H 0.575 -1.834 -1.206 1.00 . A A . 17 VAL H 1 1 2 621 1 1 17 VAL HA H 1.656 0.309 0.121 1.00 . A A . 17 VAL HA 1 1 2 622 1 1 17 VAL HB H 1.076 -2.467 1.176 1.00 . A A . 17 VAL HB 1 1 2 623 1 1 17 VAL HG11 H 1.107 0.200 2.630 1.00 . A A . 17 VAL HG11 1 1 2 624 1 1 17 VAL HG12 H 0.727 -1.390 3.334 1.00 . A A . 17 VAL HG12 1 1 2 625 1 1 17 VAL HG13 H 2.371 -1.049 2.741 1.00 . A A . 17 VAL HG13 1 1 2 626 1 1 17 VAL HG21 H -0.684 -0.821 -0.136 1.00 . A A . 17 VAL HG21 1 1 2 627 1 1 17 VAL HG22 H -1.133 -2.039 1.080 1.00 . A A . 17 VAL HG22 1 1 2 628 1 1 17 VAL HG23 H -0.926 -0.337 1.559 1.00 . A A . 17 VAL HG23 1 1 2 629 1 1 17 VAL N N 1.385 -1.245 -1.207 1.00 . A A . 17 VAL N 1 1 2 630 1 1 17 VAL O O 4.027 -0.249 0.833 1.00 . A A . 17 VAL O 1 1 2 631 1 1 18 LYS C C 5.956 -1.737 -0.841 1.00 . A A . 18 LYS C 1 1 2 632 1 1 18 LYS CA C 5.068 -2.679 -0.024 1.00 . A A . 18 LYS CA 1 1 2 633 1 1 18 LYS CB C 5.215 -4.152 -0.409 1.00 . A A . 18 LYS CB 1 1 2 634 1 1 18 LYS CD C 6.083 -4.095 -2.776 1.00 . A A . 18 LYS CD 1 1 2 635 1 1 18 LYS CE C 5.721 -5.393 -3.500 1.00 . A A . 18 LYS CE 1 1 2 636 1 1 18 LYS CG C 6.434 -4.364 -1.311 1.00 . A A . 18 LYS CG 1 1 2 637 1 1 18 LYS H H 3.075 -2.924 -0.579 1.00 . A A . 18 LYS H 1 1 2 638 1 1 18 LYS HA H 5.345 -2.590 1.026 1.00 . A A . 18 LYS HA 1 1 2 639 1 1 18 LYS HB3 H 4.316 -4.490 -0.922 1.00 . A A . 18 LYS HB3 1 1 2 640 1 1 18 LYS HD3 H 6.929 -3.621 -3.274 1.00 . A A . 18 LYS HD3 1 1 2 641 1 1 18 LYS HE3 H 5.178 -5.167 -4.417 1.00 . A A . 18 LYS HE3 1 1 2 642 1 1 18 LYS HG3 H 6.799 -5.385 -1.202 1.00 . A A . 18 LYS HG3 1 1 2 643 1 1 18 LYS HZ1 H 7.408 -6.419 -2.970 1.00 . A A . 18 LYS HZ1 1 1 2 644 1 1 18 LYS HZ2 H 6.690 -6.996 -4.319 1.00 . A A . 18 LYS HZ2 1 1 2 645 1 1 18 LYS HZ3 H 7.552 -5.610 -4.381 1.00 . A A . 18 LYS HZ3 1 1 2 646 1 1 18 LYS N N 3.682 -2.258 -0.145 1.00 . A A . 18 LYS N 1 1 2 647 1 1 18 LYS NZ N 6.942 -6.168 -3.819 1.00 . A A . 18 LYS NZ 1 1 2 648 1 1 18 LYS O O 7.076 -1.428 -0.437 1.00 . A A . 18 LYS O 1 1 2 649 1 1 19 LYS C C 6.386 0.919 -2.134 1.00 . A A . 19 LYS C 1 1 2 650 1 1 19 LYS CA C 6.152 -0.410 -2.853 1.00 . A A . 19 LYS CA 1 1 2 651 1 1 19 LYS CB C 5.428 -0.265 -4.193 1.00 . A A . 19 LYS CB 1 1 2 652 1 1 19 LYS CD C 4.416 2.035 -3.978 1.00 . A A . 19 LYS CD 1 1 2 653 1 1 19 LYS CE C 3.200 2.262 -4.879 1.00 . A A . 19 LYS CE 1 1 2 654 1 1 19 LYS CG C 5.472 1.183 -4.686 1.00 . A A . 19 LYS CG 1 1 2 655 1 1 19 LYS H H 4.511 -1.567 -2.298 1.00 . A A . 19 LYS H 1 1 2 656 1 1 19 LYS HA H 7.120 -0.867 -3.058 1.00 . A A . 19 LYS HA 1 1 2 657 1 1 19 LYS HB3 H 4.391 -0.585 -4.088 1.00 . A A . 19 LYS HB3 1 1 2 658 1 1 19 LYS HD3 H 4.848 2.996 -3.695 1.00 . A A . 19 LYS HD3 1 1 2 659 1 1 19 LYS HE3 H 2.764 1.303 -5.159 1.00 . A A . 19 LYS HE3 1 1 2 660 1 1 19 LYS HG3 H 5.305 1.211 -5.763 1.00 . A A . 19 LYS HG3 1 1 2 661 1 1 19 LYS HZ1 H 2.002 3.910 -4.725 1.00 . A A . 19 LYS HZ1 1 1 2 662 1 1 19 LYS HZ2 H 1.344 2.563 -4.079 1.00 . A A . 19 LYS HZ2 1 1 2 663 1 1 19 LYS HZ3 H 2.533 3.353 -3.285 1.00 . A A . 19 LYS HZ3 1 1 2 664 1 1 19 LYS N N 5.422 -1.309 -1.976 1.00 . A A . 19 LYS N 1 1 2 665 1 1 19 LYS NZ N 2.188 3.089 -4.186 1.00 . A A . 19 LYS NZ 1 1 2 666 1 1 19 LYS O O 7.301 1.665 -2.480 1.00 . A A . 19 LYS O 1 1 2 667 1 1 20 LEU C C 6.572 2.170 0.825 1.00 . A A . 20 LEU C 1 1 2 668 1 1 20 LEU CA C 5.647 2.403 -0.371 1.00 . A A . 20 LEU CA 1 1 2 669 1 1 20 LEU CB C 4.257 2.911 0.015 1.00 . A A . 20 LEU CB 1 1 2 670 1 1 20 LEU CD1 C 4.624 3.711 2.378 1.00 . A A . 20 LEU CD1 1 1 2 671 1 1 20 LEU CD2 C 2.347 2.854 1.660 1.00 . A A . 20 LEU CD2 1 1 2 672 1 1 20 LEU CG C 3.862 2.733 1.482 1.00 . A A . 20 LEU CG 1 1 2 673 1 1 20 LEU H H 4.802 0.564 -0.868 1.00 . A A . 20 LEU H 1 1 2 674 1 1 20 LEU HA H 6.100 3.157 -1.016 1.00 . A A . 20 LEU HA 1 1 2 675 1 1 20 LEU HB3 H 3.521 2.401 -0.604 1.00 . A A . 20 LEU HB3 1 1 2 676 1 1 20 LEU HD11 H 5.344 3.162 2.985 1.00 . A A . 20 LEU HD11 1 1 2 677 1 1 20 LEU HD12 H 5.151 4.438 1.759 1.00 . A A . 20 LEU HD12 1 1 2 678 1 1 20 LEU HD13 H 3.922 4.230 3.030 1.00 . A A . 20 LEU HD13 1 1 2 679 1 1 20 LEU HD21 H 1.885 3.083 0.700 1.00 . A A . 20 LEU HD21 1 1 2 680 1 1 20 LEU HD22 H 1.949 1.914 2.041 1.00 . A A . 20 LEU HD22 1 1 2 681 1 1 20 LEU HD23 H 2.127 3.654 2.367 1.00 . A A . 20 LEU HD23 1 1 2 682 1 1 20 LEU HG H 4.143 1.727 1.792 1.00 . A A . 20 LEU HG 1 1 2 683 1 1 20 LEU N N 5.544 1.176 -1.144 1.00 . A A . 20 LEU N 1 1 2 684 1 1 20 LEU O O 7.068 3.123 1.425 1.00 . A A . 20 LEU O 1 1 2 685 1 1 21 PHE C C 9.107 0.583 1.850 1.00 . A A . 21 PHE C 1 1 2 686 1 1 21 PHE CA C 7.632 0.529 2.251 1.00 . A A . 21 PHE CA 1 1 2 687 1 1 21 PHE CB C 7.272 -0.909 2.634 1.00 . A A . 21 PHE CB 1 1 2 688 1 1 21 PHE CD1 C 7.244 -1.171 5.124 1.00 . A A . 21 PHE CD1 1 1 2 689 1 1 21 PHE CD2 C 5.178 -1.001 4.005 1.00 . A A . 21 PHE CD2 1 1 2 690 1 1 21 PHE CE1 C 6.563 -1.286 6.365 1.00 . A A . 21 PHE CE1 1 1 2 691 1 1 21 PHE CE2 C 4.497 -1.115 5.245 1.00 . A A . 21 PHE CE2 1 1 2 692 1 1 21 PHE CG C 6.538 -1.032 3.970 1.00 . A A . 21 PHE CG 1 1 2 693 1 1 21 PHE CZ C 5.204 -1.256 6.399 1.00 . A A . 21 PHE CZ 1 1 2 694 1 1 21 PHE H H 6.368 0.130 0.643 1.00 . A A . 21 PHE H 1 1 2 695 1 1 21 PHE HA H 7.447 1.245 3.052 1.00 . A A . 21 PHE HA 1 1 2 696 1 1 21 PHE HB3 H 8.185 -1.501 2.677 1.00 . A A . 21 PHE HB3 1 1 2 697 1 1 21 PHE HD1 H 8.334 -1.196 5.096 1.00 . A A . 21 PHE HD1 1 1 2 698 1 1 21 PHE HD2 H 4.612 -0.889 3.080 1.00 . A A . 21 PHE HD2 1 1 2 699 1 1 21 PHE HE1 H 7.129 -1.398 7.289 1.00 . A A . 21 PHE HE1 1 1 2 700 1 1 21 PHE HE2 H 3.408 -1.091 5.272 1.00 . A A . 21 PHE HE2 1 1 2 701 1 1 21 PHE HZ H 4.680 -1.343 7.351 1.00 . A A . 21 PHE HZ 1 1 2 702 1 1 21 PHE N N 6.775 0.899 1.136 1.00 . A A . 21 PHE N 1 1 2 703 1 1 21 PHE O O 9.985 0.645 2.710 1.00 . A A . 21 PHE O 1 1 2 704 1 1 22 LYS C C 11.468 1.715 0.729 1.00 . A A . 22 LYS C 1 1 2 705 1 1 22 LYS CA C 10.688 0.605 0.020 1.00 . A A . 22 LYS CA 1 1 2 706 1 1 22 LYS CB C 10.669 0.743 -1.503 1.00 . A A . 22 LYS CB 1 1 2 707 1 1 22 LYS CD C 9.513 2.983 -1.432 1.00 . A A . 22 LYS CD 1 1 2 708 1 1 22 LYS CE C 8.852 3.747 -2.581 1.00 . A A . 22 LYS CE 1 1 2 709 1 1 22 LYS CG C 10.740 2.214 -1.921 1.00 . A A . 22 LYS CG 1 1 2 710 1 1 22 LYS H H 8.614 0.508 -0.147 1.00 . A A . 22 LYS H 1 1 2 711 1 1 22 LYS HA H 11.161 -0.350 0.251 1.00 . A A . 22 LYS HA 1 1 2 712 1 1 22 LYS HB3 H 9.759 0.293 -1.901 1.00 . A A . 22 LYS HB3 1 1 2 713 1 1 22 LYS HD3 H 9.804 3.682 -0.648 1.00 . A A . 22 LYS HD3 1 1 2 714 1 1 22 LYS HE3 H 7.850 4.064 -2.288 1.00 . A A . 22 LYS HE3 1 1 2 715 1 1 22 LYS HG3 H 10.810 2.283 -3.006 1.00 . A A . 22 LYS HG3 1 1 2 716 1 1 22 LYS HZ1 H 10.561 4.864 -2.521 1.00 . A A . 22 LYS HZ1 1 1 2 717 1 1 22 LYS HZ2 H 9.771 4.960 -3.946 1.00 . A A . 22 LYS HZ2 1 1 2 718 1 1 22 LYS HZ3 H 9.201 5.760 -2.642 1.00 . A A . 22 LYS HZ3 1 1 2 719 1 1 22 LYS N N 9.334 0.558 0.545 1.00 . A A . 22 LYS N 1 1 2 720 1 1 22 LYS NZ N 9.662 4.929 -2.952 1.00 . A A . 22 LYS NZ 1 1 2 721 1 1 22 LYS O O 12.693 1.658 0.816 1.00 . A A . 22 LYS O 1 1 2 722 1 1 23 LYS C C 11.245 3.581 3.423 1.00 . A A . 23 LYS C 1 1 2 723 1 1 23 LYS CA C 11.331 3.819 1.914 1.00 . A A . 23 LYS CA 1 1 2 724 1 1 23 LYS CB C 10.698 5.136 1.461 1.00 . A A . 23 LYS CB 1 1 2 725 1 1 23 LYS CD C 8.638 6.322 2.301 1.00 . A A . 23 LYS CD 1 1 2 726 1 1 23 LYS CE C 8.191 7.388 1.298 1.00 . A A . 23 LYS CE 1 1 2 727 1 1 23 LYS CG C 9.174 5.083 1.582 1.00 . A A . 23 LYS CG 1 1 2 728 1 1 23 LYS H H 9.728 2.736 1.140 1.00 . A A . 23 LYS H 1 1 2 729 1 1 23 LYS HA H 12.382 3.852 1.628 1.00 . A A . 23 LYS HA 1 1 2 730 1 1 23 LYS HB3 H 10.978 5.342 0.428 1.00 . A A . 23 LYS HB3 1 1 2 731 1 1 23 LYS HD3 H 9.409 6.732 2.953 1.00 . A A . 23 LYS HD3 1 1 2 732 1 1 23 LYS HE3 H 8.854 7.381 0.432 1.00 . A A . 23 LYS HE3 1 1 2 733 1 1 23 LYS HG3 H 8.880 4.186 2.127 1.00 . A A . 23 LYS HG3 1 1 2 734 1 1 23 LYS HZ1 H 6.174 7.330 1.624 1.00 . A A . 23 LYS HZ1 1 1 2 735 1 1 23 LYS HZ2 H 6.577 7.740 0.096 1.00 . A A . 23 LYS HZ2 1 1 2 736 1 1 23 LYS HZ3 H 6.700 6.187 0.584 1.00 . A A . 23 LYS HZ3 1 1 2 737 1 1 23 LYS N N 10.724 2.697 1.215 1.00 . A A . 23 LYS N 1 1 2 738 1 1 23 LYS NZ N 6.797 7.141 0.866 1.00 . A A . 23 LYS NZ 1 1 2 739 1 1 23 LYS O O 12.124 4.003 4.172 1.00 . A A . 23 LYS O 1 1 2 740 1 1 24 TRP C C 11.054 1.631 5.675 1.00 . A A . 24 TRP C 1 1 2 741 1 1 24 TRP CA C 9.965 2.609 5.229 1.00 . A A . 24 TRP CA 1 1 2 742 1 1 24 TRP CB C 8.550 2.078 5.470 1.00 . A A . 24 TRP CB 1 1 2 743 1 1 24 TRP CD1 C 7.561 4.318 4.656 1.00 . A A . 24 TRP CD1 1 1 2 744 1 1 24 TRP CD2 C 6.053 2.978 5.573 1.00 . A A . 24 TRP CD2 1 1 2 745 1 1 24 TRP CE2 C 5.399 4.129 5.184 1.00 . A A . 24 TRP CE2 1 1 2 746 1 1 24 TRP CE3 C 5.368 1.919 6.194 1.00 . A A . 24 TRP CE3 1 1 2 747 1 1 24 TRP CG C 7.449 3.111 5.227 1.00 . A A . 24 TRP CG 1 1 2 748 1 1 24 TRP CH2 C 3.324 3.291 5.990 1.00 . A A . 24 TRP CH2 1 1 2 749 1 1 24 TRP CZ2 C 4.027 4.333 5.374 1.00 . A A . 24 TRP CZ2 1 1 2 750 1 1 24 TRP CZ3 C 3.996 2.138 6.376 1.00 . A A . 24 TRP CZ3 1 1 2 751 1 1 24 TRP H H 9.467 2.568 3.208 1.00 . A A . 24 TRP H 1 1 2 752 1 1 24 TRP HA H 10.052 3.543 5.785 1.00 . A A . 24 TRP HA 1 1 2 753 1 1 24 TRP HB3 H 8.478 1.719 6.497 1.00 . A A . 24 TRP HB3 1 1 2 754 1 1 24 TRP HD1 H 8.494 4.733 4.276 1.00 . A A . 24 TRP HD1 1 1 2 755 1 1 24 TRP HE1 H 6.161 5.962 4.197 1.00 . A A . 24 TRP HE1 1 1 2 756 1 1 24 TRP HE3 H 5.861 1.001 6.510 1.00 . A A . 24 TRP HE3 1 1 2 757 1 1 24 TRP HH2 H 2.252 3.385 6.167 1.00 . A A . 24 TRP HH2 1 1 2 758 1 1 24 TRP HZ2 H 3.534 5.251 5.058 1.00 . A A . 24 TRP HZ2 1 1 2 759 1 1 24 TRP HZ3 H 3.416 1.348 6.853 1.00 . A A . 24 TRP HZ3 1 1 2 760 1 1 24 TRP N N 10.178 2.907 3.823 1.00 . A A . 24 TRP N 1 1 2 761 1 1 24 TRP NE1 N 6.345 4.970 4.609 1.00 . A A . 24 TRP NE1 1 1 2 762 1 1 24 TRP O O 11.525 0.817 4.882 1.00 . A A . 24 TRP O 1 1 2 763 1 1 25 GLY C C 13.674 1.689 7.930 1.00 . A A . 25 GLY C 1 1 2 764 1 1 25 GLY CA C 12.448 0.879 7.502 1.00 . A A . 25 GLY CA 1 1 2 765 1 1 25 GLY H H 11.036 2.409 7.580 1.00 . A A . 25 GLY H 1 1 2 766 1 1 25 GLY HA2 H 12.046 0.341 8.361 1.00 . A A . 25 GLY HA2 1 1 2 767 1 1 25 GLY HA3 H 12.741 0.131 6.766 1.00 . A A . 25 GLY HA3 1 1 2 768 1 1 25 GLY N N 11.424 1.744 6.942 1.00 . A A . 25 GLY N 1 1 2 769 1 1 25 GLY O O 14.691 1.695 7.237 1.00 . A A . 25 GLY O 1 1 2 770 1 1 26 TRP C C 14.496 3.188 11.121 1.00 . A A . 26 TRP C 1 1 2 771 1 1 26 TRP CA C 14.623 3.163 9.597 1.00 . A A . 26 TRP CA 1 1 2 772 1 1 26 TRP CB C 14.616 4.560 8.974 1.00 . A A . 26 TRP CB 1 1 2 773 1 1 26 TRP CD1 C 16.614 4.273 7.365 1.00 . A A . 26 TRP CD1 1 1 2 774 1 1 26 TRP CD2 C 16.712 6.138 8.557 1.00 . A A . 26 TRP CD2 1 1 2 775 1 1 26 TRP CE2 C 17.828 6.107 7.746 1.00 . A A . 26 TRP CE2 1 1 2 776 1 1 26 TRP CE3 C 16.478 7.205 9.442 1.00 . A A . 26 TRP CE3 1 1 2 777 1 1 26 TRP CG C 15.935 4.948 8.302 1.00 . A A . 26 TRP CG 1 1 2 778 1 1 26 TRP CH2 C 18.588 8.189 8.615 1.00 . A A . 26 TRP CH2 1 1 2 779 1 1 26 TRP CZ2 C 18.799 7.116 7.740 1.00 . A A . 26 TRP CZ2 1 1 2 780 1 1 26 TRP CZ3 C 17.458 8.205 9.425 1.00 . A A . 26 TRP CZ3 1 1 2 781 1 1 26 TRP H H 12.709 2.341 9.626 1.00 . A A . 26 TRP H 1 1 2 782 1 1 26 TRP HA H 15.563 2.691 9.309 1.00 . A A . 26 TRP HA 1 1 2 783 1 1 26 TRP HB3 H 14.386 5.291 9.748 1.00 . A A . 26 TRP HB3 1 1 2 784 1 1 26 TRP HD1 H 16.296 3.319 6.946 1.00 . A A . 26 TRP HD1 1 1 2 785 1 1 26 TRP HE1 H 18.495 4.605 6.259 1.00 . A A . 26 TRP HE1 1 1 2 786 1 1 26 TRP HE3 H 15.604 7.252 10.093 1.00 . A A . 26 TRP HE3 1 1 2 787 1 1 26 TRP HH2 H 19.306 9.007 8.660 1.00 . A A . 26 TRP HH2 1 1 2 788 1 1 26 TRP HZ2 H 19.672 7.068 7.091 1.00 . A A . 26 TRP HZ2 1 1 2 789 1 1 26 TRP HZ3 H 17.325 9.055 10.093 1.00 . A A . 26 TRP HZ3 1 1 2 790 1 1 26 TRP N N 13.538 2.352 9.069 1.00 . A A . 26 TRP N 1 1 2 791 1 1 26 TRP NE1 N 17.767 4.937 6.998 1.00 . A A . 26 TRP NE1 1 1 2 792 1 1 26 TRP O O 15.499 3.200 11.832 1.00 . A A . 26 TRP O 1 1 3 793 1 1 1 LYS C C -7.600 16.765 5.899 1.00 . A A . 1 LYS C 1 1 3 794 1 1 1 LYS CA C -8.587 17.303 6.938 1.00 . A A . 1 LYS CA 1 1 3 795 1 1 1 LYS CB C -8.985 18.763 6.709 1.00 . A A . 1 LYS CB 1 1 3 796 1 1 1 LYS CD C -9.847 20.431 5.026 1.00 . A A . 1 LYS CD 1 1 3 797 1 1 1 LYS CE C -8.537 21.124 4.647 1.00 . A A . 1 LYS CE 1 1 3 798 1 1 1 LYS CG C -9.616 18.949 5.328 1.00 . A A . 1 LYS CG 1 1 3 799 1 1 1 LYS H1 H -7.577 16.251 8.426 1.00 . A A . 1 LYS H1 1 1 3 800 1 1 1 LYS HA H -9.499 16.708 6.890 1.00 . A A . 1 LYS HA 1 1 3 801 1 1 1 LYS HB3 H -8.106 19.401 6.802 1.00 . A A . 1 LYS HB3 1 1 3 802 1 1 1 LYS HD3 H -10.281 20.919 5.898 1.00 . A A . 1 LYS HD3 1 1 3 803 1 1 1 LYS HE3 H -7.697 20.453 4.830 1.00 . A A . 1 LYS HE3 1 1 3 804 1 1 1 LYS HG3 H -10.563 18.412 5.282 1.00 . A A . 1 LYS HG3 1 1 3 805 1 1 1 LYS HZ1 H -8.456 20.713 2.646 1.00 . A A . 1 LYS HZ1 1 1 3 806 1 1 1 LYS HZ2 H -9.425 21.974 3.015 1.00 . A A . 1 LYS HZ2 1 1 3 807 1 1 1 LYS HZ3 H -7.802 22.156 3.042 1.00 . A A . 1 LYS HZ3 1 1 3 808 1 1 1 LYS N N -8.025 17.131 8.267 1.00 . A A . 1 LYS N 1 1 3 809 1 1 1 LYS NZ N -8.557 21.524 3.222 1.00 . A A . 1 LYS NZ 1 1 3 810 1 1 1 LYS O O -7.044 17.528 5.113 1.00 . A A . 1 LYS O 1 1 3 811 1 1 2 SER C C -6.509 13.292 5.236 1.00 . A A . 2 SER C 1 1 3 812 1 1 2 SER CA C -6.506 14.804 5.001 1.00 . A A . 2 SER CA 1 1 3 813 1 1 2 SER CB C -5.088 15.360 5.139 1.00 . A A . 2 SER CB 1 1 3 814 1 1 2 SER H H -7.872 14.839 6.573 1.00 . A A . 2 SER H 1 1 3 815 1 1 2 SER HA H -6.893 15.037 4.008 1.00 . A A . 2 SER HA 1 1 3 816 1 1 2 SER HB3 H -4.778 15.308 6.182 1.00 . A A . 2 SER HB3 1 1 3 817 1 1 2 SER HG H -3.238 14.718 4.724 1.00 . A A . 2 SER HG 1 1 3 818 1 1 2 SER N N -7.416 15.453 5.930 1.00 . A A . 2 SER N 1 1 3 819 1 1 2 SER O O -5.922 12.810 6.203 1.00 . A A . 2 SER O 1 1 3 820 1 1 2 SER OG O -4.155 14.647 4.331 1.00 . A A . 2 SER OG 1 1 3 821 1 1 3 SER C C -7.235 10.517 3.035 1.00 . A A . 3 SER C 1 1 3 822 1 1 3 SER CA C -7.264 11.139 4.433 1.00 . A A . 3 SER CA 1 1 3 823 1 1 3 SER CB C -8.530 10.712 5.178 1.00 . A A . 3 SER CB 1 1 3 824 1 1 3 SER H H -7.651 12.986 3.552 1.00 . A A . 3 SER H 1 1 3 825 1 1 3 SER HA H -6.387 10.835 5.005 1.00 . A A . 3 SER HA 1 1 3 826 1 1 3 SER HB3 H -8.456 11.015 6.222 1.00 . A A . 3 SER HB3 1 1 3 827 1 1 3 SER HG H -10.085 10.654 3.919 1.00 . A A . 3 SER HG 1 1 3 828 1 1 3 SER N N -7.177 12.586 4.335 1.00 . A A . 3 SER N 1 1 3 829 1 1 3 SER O O -7.895 11.009 2.121 1.00 . A A . 3 SER O 1 1 3 830 1 1 3 SER OG O -9.704 11.277 4.602 1.00 . A A . 3 SER OG 1 1 3 831 1 1 4 ALA C C -5.504 7.488 1.837 1.00 . A A . 4 ALA C 1 1 3 832 1 1 4 ALA CA C -6.341 8.753 1.644 1.00 . A A . 4 ALA CA 1 1 3 833 1 1 4 ALA CB C -5.738 9.698 0.602 1.00 . A A . 4 ALA CB 1 1 3 834 1 1 4 ALA H H -5.931 9.054 3.663 1.00 . A A . 4 ALA H 1 1 3 835 1 1 4 ALA HA H -7.343 8.470 1.321 1.00 . A A . 4 ALA HA 1 1 3 836 1 1 4 ALA HB1 H -5.042 10.380 1.091 1.00 . A A . 4 ALA HB1 1 1 3 837 1 1 4 ALA HB2 H -5.208 9.116 -0.152 1.00 . A A . 4 ALA HB2 1 1 3 838 1 1 4 ALA HB3 H -6.534 10.270 0.126 1.00 . A A . 4 ALA HB3 1 1 3 839 1 1 4 ALA N N -6.464 9.446 2.915 1.00 . A A . 4 ALA N 1 1 3 840 1 1 4 ALA O O -4.282 7.519 1.694 1.00 . A A . 4 ALA O 1 1 3 841 1 1 5 TYR C C -5.791 4.170 1.210 1.00 . A A . 5 TYR C 1 1 3 842 1 1 5 TYR CA C -5.528 5.130 2.374 1.00 . A A . 5 TYR CA 1 1 3 843 1 1 5 TYR CB C -6.138 4.544 3.649 1.00 . A A . 5 TYR CB 1 1 3 844 1 1 5 TYR CD1 C -5.494 6.478 5.132 1.00 . A A . 5 TYR CD1 1 1 3 845 1 1 5 TYR CD2 C -5.063 4.259 5.911 1.00 . A A . 5 TYR CD2 1 1 3 846 1 1 5 TYR CE1 C -4.936 7.014 6.347 1.00 . A A . 5 TYR CE1 1 1 3 847 1 1 5 TYR CE2 C -4.506 4.795 7.126 1.00 . A A . 5 TYR CE2 1 1 3 848 1 1 5 TYR CG C -5.546 5.112 4.940 1.00 . A A . 5 TYR CG 1 1 3 849 1 1 5 TYR CZ C -4.469 6.145 7.285 1.00 . A A . 5 TYR CZ 1 1 3 850 1 1 5 TYR H H -7.187 6.385 2.273 1.00 . A A . 5 TYR H 1 1 3 851 1 1 5 TYR HA H -4.457 5.317 2.445 1.00 . A A . 5 TYR HA 1 1 3 852 1 1 5 TYR HB3 H -6.000 3.463 3.643 1.00 . A A . 5 TYR HB3 1 1 3 853 1 1 5 TYR HD1 H -5.875 7.152 4.365 1.00 . A A . 5 TYR HD1 1 1 3 854 1 1 5 TYR HD2 H -5.105 3.182 5.759 1.00 . A A . 5 TYR HD2 1 1 3 855 1 1 5 TYR HE1 H -4.889 8.090 6.512 1.00 . A A . 5 TYR HE1 1 1 3 856 1 1 5 TYR HE2 H -4.121 4.133 7.902 1.00 . A A . 5 TYR HE2 1 1 3 857 1 1 5 TYR HH H -4.135 7.630 8.495 1.00 . A A . 5 TYR HH 1 1 3 858 1 1 5 TYR N N -6.193 6.403 2.159 1.00 . A A . 5 TYR N 1 1 3 859 1 1 5 TYR O O -6.301 3.070 1.412 1.00 . A A . 5 TYR O 1 1 3 860 1 1 5 TYR OH O -3.943 6.651 8.432 1.00 . A A . 5 TYR OH 1 1 3 861 1 1 6 SER C C -7.099 3.462 -1.336 1.00 . A A . 6 SER C 1 1 3 862 1 1 6 SER CA C -5.621 3.820 -1.177 1.00 . A A . 6 SER CA 1 1 3 863 1 1 6 SER CB C -4.768 2.550 -1.127 1.00 . A A . 6 SER CB 1 1 3 864 1 1 6 SER H H -5.016 5.521 -0.137 1.00 . A A . 6 SER H 1 1 3 865 1 1 6 SER HA H -5.288 4.449 -2.003 1.00 . A A . 6 SER HA 1 1 3 866 1 1 6 SER HB3 H -4.997 1.928 -1.992 1.00 . A A . 6 SER HB3 1 1 3 867 1 1 6 SER HG H -3.114 3.215 -0.219 1.00 . A A . 6 SER HG 1 1 3 868 1 1 6 SER N N -5.430 4.624 0.018 1.00 . A A . 6 SER N 1 1 3 869 1 1 6 SER O O -7.909 3.742 -0.453 1.00 . A A . 6 SER O 1 1 3 870 1 1 6 SER OG O -3.374 2.844 -1.110 1.00 . A A . 6 SER OG 1 1 3 871 1 1 7 LEU C C -8.956 0.970 -2.394 1.00 . A A . 7 LEU C 1 1 3 872 1 1 7 LEU CA C -8.775 2.446 -2.755 1.00 . A A . 7 LEU CA 1 1 3 873 1 1 7 LEU CB C -9.136 2.774 -4.205 1.00 . A A . 7 LEU CB 1 1 3 874 1 1 7 LEU CD1 C -8.704 1.767 -6.476 1.00 . A A . 7 LEU CD1 1 1 3 875 1 1 7 LEU CD2 C -7.264 3.678 -5.633 1.00 . A A . 7 LEU CD2 1 1 3 876 1 1 7 LEU CG C -8.074 2.436 -5.254 1.00 . A A . 7 LEU CG 1 1 3 877 1 1 7 LEU H H -6.743 2.622 -3.181 1.00 . A A . 7 LEU H 1 1 3 878 1 1 7 LEU HA H -9.430 3.041 -2.117 1.00 . A A . 7 LEU HA 1 1 3 879 1 1 7 LEU HB3 H -9.359 3.838 -4.271 1.00 . A A . 7 LEU HB3 1 1 3 880 1 1 7 LEU HD11 H -9.535 1.138 -6.158 1.00 . A A . 7 LEU HD11 1 1 3 881 1 1 7 LEU HD12 H -9.070 2.532 -7.161 1.00 . A A . 7 LEU HD12 1 1 3 882 1 1 7 LEU HD13 H -7.957 1.154 -6.980 1.00 . A A . 7 LEU HD13 1 1 3 883 1 1 7 LEU HD21 H -7.930 4.430 -6.056 1.00 . A A . 7 LEU HD21 1 1 3 884 1 1 7 LEU HD22 H -6.779 4.080 -4.744 1.00 . A A . 7 LEU HD22 1 1 3 885 1 1 7 LEU HD23 H -6.508 3.407 -6.369 1.00 . A A . 7 LEU HD23 1 1 3 886 1 1 7 LEU HG H -7.378 1.719 -4.817 1.00 . A A . 7 LEU HG 1 1 3 887 1 1 7 LEU N N -7.407 2.846 -2.468 1.00 . A A . 7 LEU N 1 1 3 888 1 1 7 LEU O O -9.947 0.598 -1.768 1.00 . A A . 7 LEU O 1 1 3 889 1 1 8 GLN C C -9.222 -1.898 -3.232 1.00 . A A . 8 GLN C 1 1 3 890 1 1 8 GLN CA C -8.023 -1.256 -2.531 1.00 . A A . 8 GLN CA 1 1 3 891 1 1 8 GLN CB C -8.059 -1.527 -1.025 1.00 . A A . 8 GLN CB 1 1 3 892 1 1 8 GLN CD C -5.692 -0.901 -0.421 1.00 . A A . 8 GLN CD 1 1 3 893 1 1 8 GLN CG C -6.707 -2.041 -0.528 1.00 . A A . 8 GLN CG 1 1 3 894 1 1 8 GLN H H -7.180 0.481 -3.312 1.00 . A A . 8 GLN H 1 1 3 895 1 1 8 GLN HA H -7.097 -1.656 -2.943 1.00 . A A . 8 GLN HA 1 1 3 896 1 1 8 GLN HB3 H -8.835 -2.258 -0.802 1.00 . A A . 8 GLN HB3 1 1 3 897 1 1 8 GLN HE21 H -5.282 -1.506 1.467 1.00 . A A . 8 GLN HE21 1 1 3 898 1 1 8 GLN HE22 H -4.386 -0.129 0.919 1.00 . A A . 8 GLN HE22 1 1 3 899 1 1 8 GLN HG3 H -6.331 -2.805 -1.209 1.00 . A A . 8 GLN HG3 1 1 3 900 1 1 8 GLN N N -7.983 0.170 -2.803 1.00 . A A . 8 GLN N 1 1 3 901 1 1 8 GLN NE2 N -5.068 -0.841 0.752 1.00 . A A . 8 GLN NE2 1 1 3 902 1 1 8 GLN O O -10.369 -1.577 -2.925 1.00 . A A . 8 GLN O 1 1 3 903 1 1 8 GLN OE1 O -5.488 -0.129 -1.344 1.00 . A A . 8 GLN OE1 1 1 3 904 1 1 9 MET C C -9.930 -4.984 -4.622 1.00 . A A . 9 MET C 1 1 3 905 1 1 9 MET CA C -9.954 -3.480 -4.908 1.00 . A A . 9 MET CA 1 1 3 906 1 1 9 MET CB C -9.750 -3.242 -6.405 1.00 . A A . 9 MET CB 1 1 3 907 1 1 9 MET CE C -7.972 -5.724 -8.965 1.00 . A A . 9 MET CE 1 1 3 908 1 1 9 MET CG C -8.521 -3.996 -6.918 1.00 . A A . 9 MET CG 1 1 3 909 1 1 9 MET H H -7.980 -3.047 -4.405 1.00 . A A . 9 MET H 1 1 3 910 1 1 9 MET HA H -10.895 -3.053 -4.562 1.00 . A A . 9 MET HA 1 1 3 911 1 1 9 MET HB3 H -9.630 -2.175 -6.594 1.00 . A A . 9 MET HB3 1 1 3 912 1 1 9 MET HE1 H -7.199 -6.476 -8.806 1.00 . A A . 9 MET HE1 1 1 3 913 1 1 9 MET HE2 H -8.583 -6.009 -9.822 1.00 . A A . 9 MET HE2 1 1 3 914 1 1 9 MET HE3 H -7.505 -4.759 -9.157 1.00 . A A . 9 MET HE3 1 1 3 915 1 1 9 MET HG3 H -7.787 -4.097 -6.120 1.00 . A A . 9 MET HG3 1 1 3 916 1 1 9 MET N N -8.916 -2.792 -4.160 1.00 . A A . 9 MET N 1 1 3 917 1 1 9 MET O O -10.966 -5.645 -4.668 1.00 . A A . 9 MET O 1 1 3 918 1 1 9 MET SD S -9.001 -5.610 -7.512 1.00 . A A . 9 MET SD 1 1 3 919 1 1 10 GLY C C -8.365 -7.121 -2.540 1.00 . A A . 10 GLY C 1 1 3 920 1 1 10 GLY CA C -8.562 -6.892 -4.040 1.00 . A A . 10 GLY CA 1 1 3 921 1 1 10 GLY H H -7.898 -4.935 -4.297 1.00 . A A . 10 GLY H 1 1 3 922 1 1 10 GLY HA2 H -9.434 -7.448 -4.385 1.00 . A A . 10 GLY HA2 1 1 3 923 1 1 10 GLY HA3 H -7.702 -7.277 -4.587 1.00 . A A . 10 GLY HA3 1 1 3 924 1 1 10 GLY N N -8.735 -5.479 -4.333 1.00 . A A . 10 GLY N 1 1 3 925 1 1 10 GLY O O -9.307 -6.989 -1.760 1.00 . A A . 10 GLY O 1 1 3 926 1 1 11 ALA C C -5.297 -7.948 -0.665 1.00 . A A . 11 ALA C 1 1 3 927 1 1 11 ALA CA C -6.803 -7.707 -0.790 1.00 . A A . 11 ALA CA 1 1 3 928 1 1 11 ALA CB C -7.627 -8.887 -0.271 1.00 . A A . 11 ALA CB 1 1 3 929 1 1 11 ALA H H -6.375 -7.564 -2.823 1.00 . A A . 11 ALA H 1 1 3 930 1 1 11 ALA HA H -7.069 -6.816 -0.221 1.00 . A A . 11 ALA HA 1 1 3 931 1 1 11 ALA HB1 H -6.957 -9.691 0.038 1.00 . A A . 11 ALA HB1 1 1 3 932 1 1 11 ALA HB2 H -8.225 -8.566 0.582 1.00 . A A . 11 ALA HB2 1 1 3 933 1 1 11 ALA HB3 H -8.285 -9.247 -1.061 1.00 . A A . 11 ALA HB3 1 1 3 934 1 1 11 ALA N N -7.136 -7.459 -2.182 1.00 . A A . 11 ALA N 1 1 3 935 1 1 11 ALA O O -4.573 -7.107 -0.133 1.00 . A A . 11 ALA O 1 1 3 936 1 1 12 THR C C -2.588 -8.233 -1.378 1.00 . A A . 12 THR C 1 1 3 937 1 1 12 THR CA C -3.464 -9.460 -1.115 1.00 . A A . 12 THR CA 1 1 3 938 1 1 12 THR CB C -3.232 -10.597 -2.112 1.00 . A A . 12 THR CB 1 1 3 939 1 1 12 THR CG2 C -4.177 -11.778 -1.882 1.00 . A A . 12 THR CG2 1 1 3 940 1 1 12 THR H H -5.466 -9.776 -1.595 1.00 . A A . 12 THR H 1 1 3 941 1 1 12 THR HA H -3.234 -9.807 -0.108 1.00 . A A . 12 THR HA 1 1 3 942 1 1 12 THR HB H -2.192 -10.921 -2.098 1.00 . A A . 12 THR HB 1 1 3 943 1 1 12 THR HG1 H -2.859 -9.732 -3.878 1.00 . A A . 12 THR HG1 1 1 3 944 1 1 12 THR HG21 H -4.675 -11.664 -0.920 1.00 . A A . 12 THR HG21 1 1 3 945 1 1 12 THR HG22 H -4.923 -11.806 -2.677 1.00 . A A . 12 THR HG22 1 1 3 946 1 1 12 THR HG23 H -3.606 -12.707 -1.887 1.00 . A A . 12 THR HG23 1 1 3 947 1 1 12 THR N N -4.870 -9.099 -1.164 1.00 . A A . 12 THR N 1 1 3 948 1 1 12 THR O O -1.669 -7.946 -0.612 1.00 . A A . 12 THR O 1 1 3 949 1 1 12 THR OG1 O -3.653 -10.054 -3.361 1.00 . A A . 12 THR OG1 1 1 3 950 1 1 13 ALA C C -1.827 -5.548 -1.578 1.00 . A A . 13 ALA C 1 1 3 951 1 1 13 ALA CA C -2.158 -6.353 -2.837 1.00 . A A . 13 ALA CA 1 1 3 952 1 1 13 ALA CB C -2.966 -5.541 -3.852 1.00 . A A . 13 ALA CB 1 1 3 953 1 1 13 ALA H H -3.654 -7.782 -3.080 1.00 . A A . 13 ALA H 1 1 3 954 1 1 13 ALA HA H -1.230 -6.677 -3.305 1.00 . A A . 13 ALA HA 1 1 3 955 1 1 13 ALA HB1 H -2.730 -5.883 -4.860 1.00 . A A . 13 ALA HB1 1 1 3 956 1 1 13 ALA HB2 H -4.030 -5.677 -3.662 1.00 . A A . 13 ALA HB2 1 1 3 957 1 1 13 ALA HB3 H -2.710 -4.486 -3.758 1.00 . A A . 13 ALA HB3 1 1 3 958 1 1 13 ALA N N -2.905 -7.542 -2.463 1.00 . A A . 13 ALA N 1 1 3 959 1 1 13 ALA O O -0.708 -5.057 -1.427 1.00 . A A . 13 ALA O 1 1 3 960 1 1 14 ILE C C -1.293 -5.059 1.152 1.00 . A A . 14 ILE C 1 1 3 961 1 1 14 ILE CA C -2.647 -4.700 0.534 1.00 . A A . 14 ILE CA 1 1 3 962 1 1 14 ILE CB C -3.833 -4.941 1.469 1.00 . A A . 14 ILE CB 1 1 3 963 1 1 14 ILE CD1 C -6.316 -4.642 1.793 1.00 . A A . 14 ILE CD1 1 1 3 964 1 1 14 ILE CG1 C -5.141 -4.474 0.827 1.00 . A A . 14 ILE CG1 1 1 3 965 1 1 14 ILE CG2 C -3.598 -4.286 2.832 1.00 . A A . 14 ILE CG2 1 1 3 966 1 1 14 ILE H H -3.725 -5.839 -0.837 1.00 . A A . 14 ILE H 1 1 3 967 1 1 14 ILE HA H -2.642 -3.638 0.285 1.00 . A A . 14 ILE HA 1 1 3 968 1 1 14 ILE HB H -3.922 -6.014 1.639 1.00 . A A . 14 ILE HB 1 1 3 969 1 1 14 ILE HD11 H -6.031 -5.322 2.596 1.00 . A A . 14 ILE HD11 1 1 3 970 1 1 14 ILE HD12 H -6.583 -3.674 2.214 1.00 . A A . 14 ILE HD12 1 1 3 971 1 1 14 ILE HD13 H -7.171 -5.053 1.255 1.00 . A A . 14 ILE HD13 1 1 3 972 1 1 14 ILE HG13 H -5.327 -5.045 -0.082 1.00 . A A . 14 ILE HG13 1 1 3 973 1 1 14 ILE HG21 H -2.957 -4.928 3.437 1.00 . A A . 14 ILE HG21 1 1 3 974 1 1 14 ILE HG22 H -3.115 -3.320 2.692 1.00 . A A . 14 ILE HG22 1 1 3 975 1 1 14 ILE HG23 H -4.553 -4.146 3.337 1.00 . A A . 14 ILE HG23 1 1 3 976 1 1 14 ILE N N -2.819 -5.437 -0.706 1.00 . A A . 14 ILE N 1 1 3 977 1 1 14 ILE O O -0.537 -4.176 1.553 1.00 . A A . 14 ILE O 1 1 3 978 1 1 15 LYS C C 1.391 -6.257 0.978 1.00 . A A . 15 LYS C 1 1 3 979 1 1 15 LYS CA C 0.218 -6.842 1.769 1.00 . A A . 15 LYS CA 1 1 3 980 1 1 15 LYS CB C 0.220 -8.371 1.830 1.00 . A A . 15 LYS CB 1 1 3 981 1 1 15 LYS CD C 2.356 -8.832 0.571 1.00 . A A . 15 LYS CD 1 1 3 982 1 1 15 LYS CE C 3.026 -10.123 0.100 1.00 . A A . 15 LYS CE 1 1 3 983 1 1 15 LYS CG C 0.832 -8.969 0.562 1.00 . A A . 15 LYS CG 1 1 3 984 1 1 15 LYS H H -1.650 -7.068 0.878 1.00 . A A . 15 LYS H 1 1 3 985 1 1 15 LYS HA H 0.278 -6.479 2.795 1.00 . A A . 15 LYS HA 1 1 3 986 1 1 15 LYS HB3 H -0.801 -8.734 1.951 1.00 . A A . 15 LYS HB3 1 1 3 987 1 1 15 LYS HD3 H 2.696 -8.587 1.578 1.00 . A A . 15 LYS HD3 1 1 3 988 1 1 15 LYS HE3 H 4.086 -9.944 -0.084 1.00 . A A . 15 LYS HE3 1 1 3 989 1 1 15 LYS HG3 H 0.423 -8.468 -0.315 1.00 . A A . 15 LYS HG3 1 1 3 990 1 1 15 LYS HZ1 H 2.516 -10.793 1.962 1.00 . A A . 15 LYS HZ1 1 1 3 991 1 1 15 LYS HZ2 H 2.224 -11.878 0.775 1.00 . A A . 15 LYS HZ2 1 1 3 992 1 1 15 LYS HZ3 H 3.753 -11.619 1.288 1.00 . A A . 15 LYS HZ3 1 1 3 993 1 1 15 LYS N N -1.029 -6.356 1.208 1.00 . A A . 15 LYS N 1 1 3 994 1 1 15 LYS NZ N 2.867 -11.190 1.113 1.00 . A A . 15 LYS NZ 1 1 3 995 1 1 15 LYS O O 2.402 -5.866 1.559 1.00 . A A . 15 LYS O 1 1 3 996 1 1 16 GLN C C 2.631 -4.269 -0.780 1.00 . A A . 16 GLN C 1 1 3 997 1 1 16 GLN CA C 2.247 -5.686 -1.210 1.00 . A A . 16 GLN CA 1 1 3 998 1 1 16 GLN CB C 1.791 -5.712 -2.671 1.00 . A A . 16 GLN CB 1 1 3 999 1 1 16 GLN CD C 1.080 -7.187 -4.589 1.00 . A A . 16 GLN CD 1 1 3 1000 1 1 16 GLN CG C 1.356 -7.119 -3.085 1.00 . A A . 16 GLN CG 1 1 3 1001 1 1 16 GLN H H 0.390 -6.537 -0.799 1.00 . A A . 16 GLN H 1 1 3 1002 1 1 16 GLN HA H 3.100 -6.353 -1.090 1.00 . A A . 16 GLN HA 1 1 3 1003 1 1 16 GLN HB3 H 2.603 -5.373 -3.314 1.00 . A A . 16 GLN HB3 1 1 3 1004 1 1 16 GLN HE21 H 2.470 -8.652 -4.730 1.00 . A A . 16 GLN HE21 1 1 3 1005 1 1 16 GLN HE22 H 1.703 -8.212 -6.219 1.00 . A A . 16 GLN HE22 1 1 3 1006 1 1 16 GLN HG3 H 0.461 -7.404 -2.534 1.00 . A A . 16 GLN HG3 1 1 3 1007 1 1 16 GLN N N 1.216 -6.217 -0.334 1.00 . A A . 16 GLN N 1 1 3 1008 1 1 16 GLN NE2 N 1.812 -8.091 -5.233 1.00 . A A . 16 GLN NE2 1 1 3 1009 1 1 16 GLN O O 3.753 -3.826 -1.022 1.00 . A A . 16 GLN O 1 1 3 1010 1 1 16 GLN OE1 O 0.257 -6.466 -5.127 1.00 . A A . 16 GLN OE1 1 1 3 1011 1 1 17 VAL C C 3.191 -2.194 1.138 1.00 . A A . 17 VAL C 1 1 3 1012 1 1 17 VAL CA C 1.903 -2.239 0.315 1.00 . A A . 17 VAL CA 1 1 3 1013 1 1 17 VAL CB C 0.681 -1.743 1.089 1.00 . A A . 17 VAL CB 1 1 3 1014 1 1 17 VAL CG1 C 0.886 -0.306 1.574 1.00 . A A . 17 VAL CG1 1 1 3 1015 1 1 17 VAL CG2 C -0.590 -1.860 0.244 1.00 . A A . 17 VAL CG2 1 1 3 1016 1 1 17 VAL H H 0.768 -3.965 0.042 1.00 . A A . 17 VAL H 1 1 3 1017 1 1 17 VAL HA H 2.026 -1.606 -0.564 1.00 . A A . 17 VAL HA 1 1 3 1018 1 1 17 VAL HB H 0.559 -2.378 1.967 1.00 . A A . 17 VAL HB 1 1 3 1019 1 1 17 VAL HG11 H 1.255 -0.318 2.599 1.00 . A A . 17 VAL HG11 1 1 3 1020 1 1 17 VAL HG12 H 1.609 0.194 0.931 1.00 . A A . 17 VAL HG12 1 1 3 1021 1 1 17 VAL HG13 H -0.064 0.229 1.537 1.00 . A A . 17 VAL HG13 1 1 3 1022 1 1 17 VAL HG21 H -0.835 -0.887 -0.181 1.00 . A A . 17 VAL HG21 1 1 3 1023 1 1 17 VAL HG22 H -0.425 -2.576 -0.561 1.00 . A A . 17 VAL HG22 1 1 3 1024 1 1 17 VAL HG23 H -1.413 -2.201 0.871 1.00 . A A . 17 VAL HG23 1 1 3 1025 1 1 17 VAL N N 1.678 -3.596 -0.151 1.00 . A A . 17 VAL N 1 1 3 1026 1 1 17 VAL O O 3.998 -1.278 0.984 1.00 . A A . 17 VAL O 1 1 3 1027 1 1 18 LYS C C 5.765 -3.437 1.966 1.00 . A A . 18 LYS C 1 1 3 1028 1 1 18 LYS CA C 4.521 -3.278 2.843 1.00 . A A . 18 LYS CA 1 1 3 1029 1 1 18 LYS CB C 4.355 -4.390 3.880 1.00 . A A . 18 LYS CB 1 1 3 1030 1 1 18 LYS CD C 5.642 -6.327 2.906 1.00 . A A . 18 LYS CD 1 1 3 1031 1 1 18 LYS CE C 5.089 -7.646 3.448 1.00 . A A . 18 LYS CE 1 1 3 1032 1 1 18 LYS CG C 5.622 -5.240 3.982 1.00 . A A . 18 LYS CG 1 1 3 1033 1 1 18 LYS H H 2.683 -3.933 2.114 1.00 . A A . 18 LYS H 1 1 3 1034 1 1 18 LYS HA H 4.600 -2.338 3.388 1.00 . A A . 18 LYS HA 1 1 3 1035 1 1 18 LYS HB3 H 3.509 -5.023 3.608 1.00 . A A . 18 LYS HB3 1 1 3 1036 1 1 18 LYS HD3 H 6.662 -6.476 2.552 1.00 . A A . 18 LYS HD3 1 1 3 1037 1 1 18 LYS HE3 H 4.074 -7.496 3.820 1.00 . A A . 18 LYS HE3 1 1 3 1038 1 1 18 LYS HG3 H 5.679 -5.699 4.969 1.00 . A A . 18 LYS HG3 1 1 3 1039 1 1 18 LYS HZ1 H 5.998 -9.085 2.316 1.00 . A A . 18 LYS HZ1 1 1 3 1040 1 1 18 LYS HZ2 H 4.424 -9.395 2.623 1.00 . A A . 18 LYS HZ2 1 1 3 1041 1 1 18 LYS HZ3 H 4.834 -8.265 1.517 1.00 . A A . 18 LYS HZ3 1 1 3 1042 1 1 18 LYS N N 3.345 -3.193 1.995 1.00 . A A . 18 LYS N 1 1 3 1043 1 1 18 LYS NZ N 5.086 -8.682 2.390 1.00 . A A . 18 LYS NZ 1 1 3 1044 1 1 18 LYS O O 6.832 -2.922 2.299 1.00 . A A . 18 LYS O 1 1 3 1045 1 1 19 LYS C C 7.113 -3.051 -0.679 1.00 . A A . 19 LYS C 1 1 3 1046 1 1 19 LYS CA C 6.683 -4.383 -0.062 1.00 . A A . 19 LYS CA 1 1 3 1047 1 1 19 LYS CB C 6.295 -5.443 -1.094 1.00 . A A . 19 LYS CB 1 1 3 1048 1 1 19 LYS CD C 5.960 -4.067 -3.181 1.00 . A A . 19 LYS CD 1 1 3 1049 1 1 19 LYS CE C 5.064 -4.744 -4.221 1.00 . A A . 19 LYS CE 1 1 3 1050 1 1 19 LYS CG C 6.851 -5.092 -2.475 1.00 . A A . 19 LYS CG 1 1 3 1051 1 1 19 LYS H H 4.717 -4.566 0.602 1.00 . A A . 19 LYS H 1 1 3 1052 1 1 19 LYS HA H 7.517 -4.783 0.514 1.00 . A A . 19 LYS HA 1 1 3 1053 1 1 19 LYS HB3 H 5.209 -5.526 -1.145 1.00 . A A . 19 LYS HB3 1 1 3 1054 1 1 19 LYS HD3 H 6.581 -3.313 -3.666 1.00 . A A . 19 LYS HD3 1 1 3 1055 1 1 19 LYS HE3 H 4.248 -4.075 -4.497 1.00 . A A . 19 LYS HE3 1 1 3 1056 1 1 19 LYS HG3 H 6.925 -5.995 -3.082 1.00 . A A . 19 LYS HG3 1 1 3 1057 1 1 19 LYS HZ1 H 5.868 -4.324 -6.053 1.00 . A A . 19 LYS HZ1 1 1 3 1058 1 1 19 LYS HZ2 H 6.781 -5.339 -5.157 1.00 . A A . 19 LYS HZ2 1 1 3 1059 1 1 19 LYS HZ3 H 5.422 -5.885 -5.878 1.00 . A A . 19 LYS HZ3 1 1 3 1060 1 1 19 LYS N N 5.587 -4.150 0.865 1.00 . A A . 19 LYS N 1 1 3 1061 1 1 19 LYS NZ N 5.847 -5.102 -5.425 1.00 . A A . 19 LYS NZ 1 1 3 1062 1 1 19 LYS O O 8.245 -2.914 -1.140 1.00 . A A . 19 LYS O 1 1 3 1063 1 1 20 LEU C C 7.014 0.120 -0.123 1.00 . A A . 20 LEU C 1 1 3 1064 1 1 20 LEU CA C 6.457 -0.787 -1.223 1.00 . A A . 20 LEU CA 1 1 3 1065 1 1 20 LEU CB C 5.209 -0.228 -1.908 1.00 . A A . 20 LEU CB 1 1 3 1066 1 1 20 LEU CD1 C 5.295 2.210 -1.272 1.00 . A A . 20 LEU CD1 1 1 3 1067 1 1 20 LEU CD2 C 3.063 1.080 -1.688 1.00 . A A . 20 LEU CD2 1 1 3 1068 1 1 20 LEU CG C 4.495 0.910 -1.176 1.00 . A A . 20 LEU CG 1 1 3 1069 1 1 20 LEU H H 5.269 -2.223 -0.292 1.00 . A A . 20 LEU H 1 1 3 1070 1 1 20 LEU HA H 7.221 -0.906 -1.992 1.00 . A A . 20 LEU HA 1 1 3 1071 1 1 20 LEU HB3 H 4.499 -1.043 -2.049 1.00 . A A . 20 LEU HB3 1 1 3 1072 1 1 20 LEU HD11 H 6.132 2.072 -1.958 1.00 . A A . 20 LEU HD11 1 1 3 1073 1 1 20 LEU HD12 H 4.650 3.008 -1.642 1.00 . A A . 20 LEU HD12 1 1 3 1074 1 1 20 LEU HD13 H 5.674 2.478 -0.286 1.00 . A A . 20 LEU HD13 1 1 3 1075 1 1 20 LEU HD21 H 2.946 2.074 -2.119 1.00 . A A . 20 LEU HD21 1 1 3 1076 1 1 20 LEU HD22 H 2.860 0.328 -2.451 1.00 . A A . 20 LEU HD22 1 1 3 1077 1 1 20 LEU HD23 H 2.365 0.957 -0.861 1.00 . A A . 20 LEU HD23 1 1 3 1078 1 1 20 LEU HG H 4.431 0.650 -0.120 1.00 . A A . 20 LEU HG 1 1 3 1079 1 1 20 LEU N N 6.187 -2.104 -0.670 1.00 . A A . 20 LEU N 1 1 3 1080 1 1 20 LEU O O 7.569 1.179 -0.409 1.00 . A A . 20 LEU O 1 1 3 1081 1 1 21 PHE C C 8.825 0.220 2.461 1.00 . A A . 21 PHE C 1 1 3 1082 1 1 21 PHE CA C 7.324 0.428 2.255 1.00 . A A . 21 PHE CA 1 1 3 1083 1 1 21 PHE CB C 6.576 -0.095 3.483 1.00 . A A . 21 PHE CB 1 1 3 1084 1 1 21 PHE CD1 C 4.288 0.922 3.532 1.00 . A A . 21 PHE CD1 1 1 3 1085 1 1 21 PHE CD2 C 5.888 1.719 5.067 1.00 . A A . 21 PHE CD2 1 1 3 1086 1 1 21 PHE CE1 C 3.332 1.832 4.056 1.00 . A A . 21 PHE CE1 1 1 3 1087 1 1 21 PHE CE2 C 4.931 2.628 5.592 1.00 . A A . 21 PHE CE2 1 1 3 1088 1 1 21 PHE CG C 5.545 0.885 4.049 1.00 . A A . 21 PHE CG 1 1 3 1089 1 1 21 PHE CZ C 3.674 2.666 5.075 1.00 . A A . 21 PHE CZ 1 1 3 1090 1 1 21 PHE H H 6.392 -1.193 1.335 1.00 . A A . 21 PHE H 1 1 3 1091 1 1 21 PHE HA H 7.129 1.481 2.050 1.00 . A A . 21 PHE HA 1 1 3 1092 1 1 21 PHE HB3 H 7.299 -0.335 4.263 1.00 . A A . 21 PHE HB3 1 1 3 1093 1 1 21 PHE HD1 H 4.014 0.254 2.716 1.00 . A A . 21 PHE HD1 1 1 3 1094 1 1 21 PHE HD2 H 6.896 1.689 5.480 1.00 . A A . 21 PHE HD2 1 1 3 1095 1 1 21 PHE HE1 H 2.324 1.861 3.643 1.00 . A A . 21 PHE HE1 1 1 3 1096 1 1 21 PHE HE2 H 5.205 3.296 6.408 1.00 . A A . 21 PHE HE2 1 1 3 1097 1 1 21 PHE HZ H 2.939 3.364 5.477 1.00 . A A . 21 PHE HZ 1 1 3 1098 1 1 21 PHE N N 6.845 -0.330 1.112 1.00 . A A . 21 PHE N 1 1 3 1099 1 1 21 PHE O O 9.479 1.016 3.134 1.00 . A A . 21 PHE O 1 1 3 1100 1 1 22 LYS C C 11.572 0.032 1.540 1.00 . A A . 22 LYS C 1 1 3 1101 1 1 22 LYS CA C 10.741 -1.176 1.979 1.00 . A A . 22 LYS CA 1 1 3 1102 1 1 22 LYS CB C 11.060 -2.456 1.205 1.00 . A A . 22 LYS CB 1 1 3 1103 1 1 22 LYS CD C 10.646 -1.752 -1.181 1.00 . A A . 22 LYS CD 1 1 3 1104 1 1 22 LYS CE C 11.213 -0.766 -2.204 1.00 . A A . 22 LYS CE 1 1 3 1105 1 1 22 LYS CG C 11.706 -2.134 -0.145 1.00 . A A . 22 LYS CG 1 1 3 1106 1 1 22 LYS H H 8.790 -1.495 1.323 1.00 . A A . 22 LYS H 1 1 3 1107 1 1 22 LYS HA H 10.950 -1.374 3.030 1.00 . A A . 22 LYS HA 1 1 3 1108 1 1 22 LYS HB3 H 10.146 -3.028 1.048 1.00 . A A . 22 LYS HB3 1 1 3 1109 1 1 22 LYS HD3 H 9.786 -1.309 -0.680 1.00 . A A . 22 LYS HD3 1 1 3 1110 1 1 22 LYS HE3 H 12.128 -0.319 -1.819 1.00 . A A . 22 LYS HE3 1 1 3 1111 1 1 22 LYS HG3 H 12.269 -2.998 -0.497 1.00 . A A . 22 LYS HG3 1 1 3 1112 1 1 22 LYS HZ1 H 12.415 -1.227 -3.792 1.00 . A A . 22 LYS HZ1 1 1 3 1113 1 1 22 LYS HZ2 H 11.409 -2.440 -3.361 1.00 . A A . 22 LYS HZ2 1 1 3 1114 1 1 22 LYS HZ3 H 10.829 -1.149 -4.175 1.00 . A A . 22 LYS HZ3 1 1 3 1115 1 1 22 LYS N N 9.329 -0.853 1.869 1.00 . A A . 22 LYS N 1 1 3 1116 1 1 22 LYS NZ N 11.489 -1.451 -3.487 1.00 . A A . 22 LYS NZ 1 1 3 1117 1 1 22 LYS O O 12.749 0.136 1.878 1.00 . A A . 22 LYS O 1 1 3 1118 1 1 23 LYS C C 11.281 3.278 1.241 1.00 . A A . 23 LYS C 1 1 3 1119 1 1 23 LYS CA C 11.589 2.110 0.302 1.00 . A A . 23 LYS CA 1 1 3 1120 1 1 23 LYS CB C 11.207 2.376 -1.155 1.00 . A A . 23 LYS CB 1 1 3 1121 1 1 23 LYS CD C 9.290 3.557 -2.292 1.00 . A A . 23 LYS CD 1 1 3 1122 1 1 23 LYS CE C 9.907 4.893 -1.874 1.00 . A A . 23 LYS CE 1 1 3 1123 1 1 23 LYS CG C 9.687 2.443 -1.321 1.00 . A A . 23 LYS CG 1 1 3 1124 1 1 23 LYS H H 9.966 0.822 0.521 1.00 . A A . 23 LYS H 1 1 3 1125 1 1 23 LYS HA H 12.661 1.921 0.326 1.00 . A A . 23 LYS HA 1 1 3 1126 1 1 23 LYS HB3 H 11.611 1.588 -1.790 1.00 . A A . 23 LYS HB3 1 1 3 1127 1 1 23 LYS HD3 H 8.204 3.647 -2.323 1.00 . A A . 23 LYS HD3 1 1 3 1128 1 1 23 LYS HE3 H 10.375 4.795 -0.895 1.00 . A A . 23 LYS HE3 1 1 3 1129 1 1 23 LYS HG3 H 9.219 2.616 -0.353 1.00 . A A . 23 LYS HG3 1 1 3 1130 1 1 23 LYS HZ1 H 10.710 4.914 -3.753 1.00 . A A . 23 LYS HZ1 1 1 3 1131 1 1 23 LYS HZ2 H 10.877 6.330 -2.957 1.00 . A A . 23 LYS HZ2 1 1 3 1132 1 1 23 LYS HZ3 H 11.823 5.058 -2.566 1.00 . A A . 23 LYS HZ3 1 1 3 1133 1 1 23 LYS N N 10.925 0.914 0.792 1.00 . A A . 23 LYS N 1 1 3 1134 1 1 23 LYS NZ N 10.911 5.334 -2.868 1.00 . A A . 23 LYS NZ 1 1 3 1135 1 1 23 LYS O O 12.127 4.145 1.455 1.00 . A A . 23 LYS O 1 1 3 1136 1 1 24 TRP C C 10.484 4.207 3.958 1.00 . A A . 24 TRP C 1 1 3 1137 1 1 24 TRP CA C 9.640 4.312 2.686 1.00 . A A . 24 TRP CA 1 1 3 1138 1 1 24 TRP CB C 8.137 4.222 2.957 1.00 . A A . 24 TRP CB 1 1 3 1139 1 1 24 TRP CD1 C 7.664 4.867 0.503 1.00 . A A . 24 TRP CD1 1 1 3 1140 1 1 24 TRP CD2 C 5.823 4.557 1.696 1.00 . A A . 24 TRP CD2 1 1 3 1141 1 1 24 TRP CE2 C 5.433 4.893 0.416 1.00 . A A . 24 TRP CE2 1 1 3 1142 1 1 24 TRP CE3 C 4.879 4.294 2.704 1.00 . A A . 24 TRP CE3 1 1 3 1143 1 1 24 TRP CG C 7.266 4.543 1.740 1.00 . A A . 24 TRP CG 1 1 3 1144 1 1 24 TRP CH2 C 3.135 4.740 1.014 1.00 . A A . 24 TRP CH2 1 1 3 1145 1 1 24 TRP CZ2 C 4.093 4.998 0.026 1.00 . A A . 24 TRP CZ2 1 1 3 1146 1 1 24 TRP CZ3 C 3.544 4.403 2.298 1.00 . A A . 24 TRP CZ3 1 1 3 1147 1 1 24 TRP H H 9.387 2.555 1.596 1.00 . A A . 24 TRP H 1 1 3 1148 1 1 24 TRP HA H 9.818 5.270 2.199 1.00 . A A . 24 TRP HA 1 1 3 1149 1 1 24 TRP HB3 H 7.881 4.908 3.765 1.00 . A A . 24 TRP HB3 1 1 3 1150 1 1 24 TRP HD1 H 8.706 4.946 0.195 1.00 . A A . 24 TRP HD1 1 1 3 1151 1 1 24 TRP HE1 H 6.635 5.365 -1.385 1.00 . A A . 24 TRP HE1 1 1 3 1152 1 1 24 TRP HE3 H 5.162 4.026 3.723 1.00 . A A . 24 TRP HE3 1 1 3 1153 1 1 24 TRP HH2 H 2.073 4.805 0.776 1.00 . A A . 24 TRP HH2 1 1 3 1154 1 1 24 TRP HZ2 H 3.810 5.266 -0.993 1.00 . A A . 24 TRP HZ2 1 1 3 1155 1 1 24 TRP HZ3 H 2.770 4.209 3.041 1.00 . A A . 24 TRP HZ3 1 1 3 1156 1 1 24 TRP N N 10.069 3.264 1.776 1.00 . A A . 24 TRP N 1 1 3 1157 1 1 24 TRP NE1 N 6.588 5.088 -0.333 1.00 . A A . 24 TRP NE1 1 1 3 1158 1 1 24 TRP O O 10.957 3.126 4.307 1.00 . A A . 24 TRP O 1 1 3 1159 1 1 25 GLY C C 12.058 6.775 6.036 1.00 . A A . 25 GLY C 1 1 3 1160 1 1 25 GLY CA C 11.426 5.395 5.844 1.00 . A A . 25 GLY CA 1 1 3 1161 1 1 25 GLY H H 10.258 6.220 4.327 1.00 . A A . 25 GLY H 1 1 3 1162 1 1 25 GLY HA2 H 10.785 5.162 6.694 1.00 . A A . 25 GLY HA2 1 1 3 1163 1 1 25 GLY HA3 H 12.205 4.634 5.814 1.00 . A A . 25 GLY HA3 1 1 3 1164 1 1 25 GLY N N 10.647 5.345 4.618 1.00 . A A . 25 GLY N 1 1 3 1165 1 1 25 GLY O O 11.720 7.721 5.326 1.00 . A A . 25 GLY O 1 1 3 1166 1 1 26 TRP C C 15.136 7.789 7.466 1.00 . A A . 26 TRP C 1 1 3 1167 1 1 26 TRP CA C 13.646 8.094 7.294 1.00 . A A . 26 TRP CA 1 1 3 1168 1 1 26 TRP CB C 13.032 8.780 8.516 1.00 . A A . 26 TRP CB 1 1 3 1169 1 1 26 TRP CD1 C 14.967 10.438 8.927 1.00 . A A . 26 TRP CD1 1 1 3 1170 1 1 26 TRP CD2 C 12.964 11.354 9.166 1.00 . A A . 26 TRP CD2 1 1 3 1171 1 1 26 TRP CE2 C 13.900 12.338 9.411 1.00 . A A . 26 TRP CE2 1 1 3 1172 1 1 26 TRP CE3 C 11.585 11.620 9.239 1.00 . A A . 26 TRP CE3 1 1 3 1173 1 1 26 TRP CG C 13.664 10.131 8.855 1.00 . A A . 26 TRP CG 1 1 3 1174 1 1 26 TRP CH2 C 12.191 13.942 9.823 1.00 . A A . 26 TRP CH2 1 1 3 1175 1 1 26 TRP CZ2 C 13.559 13.654 9.745 1.00 . A A . 26 TRP CZ2 1 1 3 1176 1 1 26 TRP CZ3 C 11.261 12.941 9.573 1.00 . A A . 26 TRP CZ3 1 1 3 1177 1 1 26 TRP H H 13.233 6.072 7.573 1.00 . A A . 26 TRP H 1 1 3 1178 1 1 26 TRP HA H 13.498 8.763 6.447 1.00 . A A . 26 TRP HA 1 1 3 1179 1 1 26 TRP HB3 H 13.129 8.119 9.378 1.00 . A A . 26 TRP HB3 1 1 3 1180 1 1 26 TRP HD1 H 15.775 9.729 8.745 1.00 . A A . 26 TRP HD1 1 1 3 1181 1 1 26 TRP HE1 H 16.115 12.267 9.385 1.00 . A A . 26 TRP HE1 1 1 3 1182 1 1 26 TRP HE3 H 10.826 10.860 9.049 1.00 . A A . 26 TRP HE3 1 1 3 1183 1 1 26 TRP HH2 H 11.858 14.948 10.078 1.00 . A A . 26 TRP HH2 1 1 3 1184 1 1 26 TRP HZ2 H 14.317 14.414 9.934 1.00 . A A . 26 TRP HZ2 1 1 3 1185 1 1 26 TRP HZ3 H 10.205 13.201 9.643 1.00 . A A . 26 TRP HZ3 1 1 3 1186 1 1 26 TRP N N 12.964 6.846 7.000 1.00 . A A . 26 TRP N 1 1 3 1187 1 1 26 TRP NE1 N 15.156 11.763 9.261 1.00 . A A . 26 TRP NE1 1 1 3 1188 1 1 26 TRP O O 15.612 6.741 7.034 1.00 . A A . 26 TRP O 1 1 4 1189 1 1 1 LYS C C -8.082 6.952 10.042 1.00 . A A . 1 LYS C 1 1 4 1190 1 1 1 LYS CA C -8.266 8.443 10.333 1.00 . A A . 1 LYS CA 1 1 4 1191 1 1 1 LYS CB C -8.810 9.239 9.144 1.00 . A A . 1 LYS CB 1 1 4 1192 1 1 1 LYS CD C -9.876 11.389 9.915 1.00 . A A . 1 LYS CD 1 1 4 1193 1 1 1 LYS CE C -10.811 11.805 11.053 1.00 . A A . 1 LYS CE 1 1 4 1194 1 1 1 LYS CG C -10.123 9.937 9.506 1.00 . A A . 1 LYS CG 1 1 4 1195 1 1 1 LYS H1 H -6.875 9.005 11.777 1.00 . A A . 1 LYS H1 1 1 4 1196 1 1 1 LYS HA H -8.982 8.550 11.147 1.00 . A A . 1 LYS HA 1 1 4 1197 1 1 1 LYS HB3 H -8.970 8.570 8.298 1.00 . A A . 1 LYS HB3 1 1 4 1198 1 1 1 LYS HD3 H -10.028 12.044 9.056 1.00 . A A . 1 LYS HD3 1 1 4 1199 1 1 1 LYS HE3 H -11.819 11.440 10.854 1.00 . A A . 1 LYS HE3 1 1 4 1200 1 1 1 LYS HG3 H -10.609 9.402 10.322 1.00 . A A . 1 LYS HG3 1 1 4 1201 1 1 1 LYS HZ1 H -10.044 12.024 12.933 1.00 . A A . 1 LYS HZ1 1 1 4 1202 1 1 1 LYS HZ2 H -11.063 10.758 12.788 1.00 . A A . 1 LYS HZ2 1 1 4 1203 1 1 1 LYS HZ3 H -9.550 10.661 12.181 1.00 . A A . 1 LYS HZ3 1 1 4 1204 1 1 1 LYS N N -7.005 9.003 10.786 1.00 . A A . 1 LYS N 1 1 4 1205 1 1 1 LYS NZ N -10.327 11.269 12.343 1.00 . A A . 1 LYS NZ 1 1 4 1206 1 1 1 LYS O O -8.628 6.106 10.748 1.00 . A A . 1 LYS O 1 1 4 1207 1 1 2 SER C C -8.323 4.659 8.065 1.00 . A A . 2 SER C 1 1 4 1208 1 1 2 SER CA C -7.045 5.303 8.609 1.00 . A A . 2 SER CA 1 1 4 1209 1 1 2 SER CB C -6.500 4.489 9.784 1.00 . A A . 2 SER CB 1 1 4 1210 1 1 2 SER H H -6.869 7.370 8.432 1.00 . A A . 2 SER H 1 1 4 1211 1 1 2 SER HA H -6.286 5.365 7.829 1.00 . A A . 2 SER HA 1 1 4 1212 1 1 2 SER HB3 H -7.083 3.574 9.894 1.00 . A A . 2 SER HB3 1 1 4 1213 1 1 2 SER HG H -4.576 4.595 10.322 1.00 . A A . 2 SER HG 1 1 4 1214 1 1 2 SER N N -7.309 6.676 9.001 1.00 . A A . 2 SER N 1 1 4 1215 1 1 2 SER O O -9.311 4.526 8.785 1.00 . A A . 2 SER O 1 1 4 1216 1 1 2 SER OG O -5.126 4.156 9.612 1.00 . A A . 2 SER OG 1 1 4 1217 1 1 3 SER C C -9.029 3.241 4.721 1.00 . A A . 3 SER C 1 1 4 1218 1 1 3 SER CA C -9.400 3.651 6.148 1.00 . A A . 3 SER CA 1 1 4 1219 1 1 3 SER CB C -10.610 4.589 6.133 1.00 . A A . 3 SER CB 1 1 4 1220 1 1 3 SER H H -7.454 4.389 6.218 1.00 . A A . 3 SER H 1 1 4 1221 1 1 3 SER HA H -9.630 2.774 6.752 1.00 . A A . 3 SER HA 1 1 4 1222 1 1 3 SER HB3 H -11.163 4.453 5.204 1.00 . A A . 3 SER HB3 1 1 4 1223 1 1 3 SER HG H -11.029 4.637 8.090 1.00 . A A . 3 SER HG 1 1 4 1224 1 1 3 SER N N -8.261 4.277 6.797 1.00 . A A . 3 SER N 1 1 4 1225 1 1 3 SER O O -7.925 3.521 4.259 1.00 . A A . 3 SER O 1 1 4 1226 1 1 3 SER OG O -11.477 4.359 7.240 1.00 . A A . 3 SER OG 1 1 4 1227 1 1 4 ALA C C -9.279 3.308 1.848 1.00 . A A . 4 ALA C 1 1 4 1228 1 1 4 ALA CA C -9.761 2.132 2.700 1.00 . A A . 4 ALA CA 1 1 4 1229 1 1 4 ALA CB C -11.050 1.510 2.160 1.00 . A A . 4 ALA CB 1 1 4 1230 1 1 4 ALA H H -10.870 2.361 4.448 1.00 . A A . 4 ALA H 1 1 4 1231 1 1 4 ALA HA H -8.984 1.368 2.721 1.00 . A A . 4 ALA HA 1 1 4 1232 1 1 4 ALA HB1 H -11.302 0.628 2.750 1.00 . A A . 4 ALA HB1 1 1 4 1233 1 1 4 ALA HB2 H -11.860 2.236 2.229 1.00 . A A . 4 ALA HB2 1 1 4 1234 1 1 4 ALA HB3 H -10.907 1.222 1.119 1.00 . A A . 4 ALA HB3 1 1 4 1235 1 1 4 ALA N N -9.974 2.584 4.065 1.00 . A A . 4 ALA N 1 1 4 1236 1 1 4 ALA O O -9.281 4.451 2.302 1.00 . A A . 4 ALA O 1 1 4 1237 1 1 5 TYR C C -9.483 4.391 -1.301 1.00 . A A . 5 TYR C 1 1 4 1238 1 1 5 TYR CA C -8.398 4.003 -0.294 1.00 . A A . 5 TYR CA 1 1 4 1239 1 1 5 TYR CB C -7.225 3.369 -1.045 1.00 . A A . 5 TYR CB 1 1 4 1240 1 1 5 TYR CD1 C -5.625 2.326 0.599 1.00 . A A . 5 TYR CD1 1 1 4 1241 1 1 5 TYR CD2 C -5.014 4.402 -0.415 1.00 . A A . 5 TYR CD2 1 1 4 1242 1 1 5 TYR CE1 C -4.389 2.323 1.339 1.00 . A A . 5 TYR CE1 1 1 4 1243 1 1 5 TYR CE2 C -3.778 4.399 0.324 1.00 . A A . 5 TYR CE2 1 1 4 1244 1 1 5 TYR CG C -5.912 3.365 -0.261 1.00 . A A . 5 TYR CG 1 1 4 1245 1 1 5 TYR CZ C -3.526 3.360 1.164 1.00 . A A . 5 TYR CZ 1 1 4 1246 1 1 5 TYR H H -8.882 2.056 0.263 1.00 . A A . 5 TYR H 1 1 4 1247 1 1 5 TYR HA H -8.122 4.882 0.288 1.00 . A A . 5 TYR HA 1 1 4 1248 1 1 5 TYR HB3 H -7.075 3.904 -1.983 1.00 . A A . 5 TYR HB3 1 1 4 1249 1 1 5 TYR HD1 H -6.335 1.507 0.721 1.00 . A A . 5 TYR HD1 1 1 4 1250 1 1 5 TYR HD2 H -5.241 5.223 -1.095 1.00 . A A . 5 TYR HD2 1 1 4 1251 1 1 5 TYR HE1 H -4.150 1.508 2.022 1.00 . A A . 5 TYR HE1 1 1 4 1252 1 1 5 TYR HE2 H -3.060 5.211 0.212 1.00 . A A . 5 TYR HE2 1 1 4 1253 1 1 5 TYR HH H -2.121 2.422 2.128 1.00 . A A . 5 TYR HH 1 1 4 1254 1 1 5 TYR N N -8.880 2.988 0.626 1.00 . A A . 5 TYR N 1 1 4 1255 1 1 5 TYR O O -9.321 5.348 -2.056 1.00 . A A . 5 TYR O 1 1 4 1256 1 1 5 TYR OH O -2.359 3.356 1.861 1.00 . A A . 5 TYR OH 1 1 4 1257 1 1 6 SER C C -12.563 2.636 -2.279 1.00 . A A . 6 SER C 1 1 4 1258 1 1 6 SER CA C -11.678 3.880 -2.179 1.00 . A A . 6 SER CA 1 1 4 1259 1 1 6 SER CB C -11.180 4.290 -3.568 1.00 . A A . 6 SER CB 1 1 4 1260 1 1 6 SER H H -10.690 2.852 -0.661 1.00 . A A . 6 SER H 1 1 4 1261 1 1 6 SER HA H -12.229 4.707 -1.733 1.00 . A A . 6 SER HA 1 1 4 1262 1 1 6 SER HB3 H -11.838 3.870 -4.327 1.00 . A A . 6 SER HB3 1 1 4 1263 1 1 6 SER HG H -10.985 6.139 -2.828 1.00 . A A . 6 SER HG 1 1 4 1264 1 1 6 SER N N -10.566 3.628 -1.279 1.00 . A A . 6 SER N 1 1 4 1265 1 1 6 SER O O -13.763 2.742 -2.524 1.00 . A A . 6 SER O 1 1 4 1266 1 1 6 SER OG O -11.125 5.706 -3.719 1.00 . A A . 6 SER OG 1 1 4 1267 1 1 7 LEU C C -11.811 -0.870 -1.484 1.00 . A A . 7 LEU C 1 1 4 1268 1 1 7 LEU CA C -12.651 0.223 -2.149 1.00 . A A . 7 LEU CA 1 1 4 1269 1 1 7 LEU CB C -13.044 -0.098 -3.593 1.00 . A A . 7 LEU CB 1 1 4 1270 1 1 7 LEU CD1 C -13.927 -2.425 -3.190 1.00 . A A . 7 LEU CD1 1 1 4 1271 1 1 7 LEU CD2 C -13.167 -1.733 -5.508 1.00 . A A . 7 LEU CD2 1 1 4 1272 1 1 7 LEU CG C -12.954 -1.569 -4.003 1.00 . A A . 7 LEU CG 1 1 4 1273 1 1 7 LEU H H -10.959 1.408 -1.887 1.00 . A A . 7 LEU H 1 1 4 1274 1 1 7 LEU HA H -13.575 0.341 -1.583 1.00 . A A . 7 LEU HA 1 1 4 1275 1 1 7 LEU HB3 H -12.406 0.484 -4.259 1.00 . A A . 7 LEU HB3 1 1 4 1276 1 1 7 LEU HD11 H -14.910 -2.403 -3.659 1.00 . A A . 7 LEU HD11 1 1 4 1277 1 1 7 LEU HD12 H -13.565 -3.452 -3.153 1.00 . A A . 7 LEU HD12 1 1 4 1278 1 1 7 LEU HD13 H -14.000 -2.029 -2.176 1.00 . A A . 7 LEU HD13 1 1 4 1279 1 1 7 LEU HD21 H -14.225 -1.893 -5.710 1.00 . A A . 7 LEU HD21 1 1 4 1280 1 1 7 LEU HD22 H -12.830 -0.834 -6.023 1.00 . A A . 7 LEU HD22 1 1 4 1281 1 1 7 LEU HD23 H -12.595 -2.590 -5.865 1.00 . A A . 7 LEU HD23 1 1 4 1282 1 1 7 LEU HG H -11.948 -1.925 -3.779 1.00 . A A . 7 LEU HG 1 1 4 1283 1 1 7 LEU N N -11.935 1.485 -2.085 1.00 . A A . 7 LEU N 1 1 4 1284 1 1 7 LEU O O -12.227 -1.455 -0.486 1.00 . A A . 7 LEU O 1 1 4 1285 1 1 8 GLN C C -10.100 -3.497 -2.106 1.00 . A A . 8 GLN C 1 1 4 1286 1 1 8 GLN CA C -9.743 -2.122 -1.540 1.00 . A A . 8 GLN CA 1 1 4 1287 1 1 8 GLN CB C -9.765 -2.136 -0.010 1.00 . A A . 8 GLN CB 1 1 4 1288 1 1 8 GLN CD C -10.827 -3.205 2.012 1.00 . A A . 8 GLN CD 1 1 4 1289 1 1 8 GLN CG C -10.539 -3.346 0.516 1.00 . A A . 8 GLN CG 1 1 4 1290 1 1 8 GLN H H -10.314 -0.629 -2.876 1.00 . A A . 8 GLN H 1 1 4 1291 1 1 8 GLN HA H -8.750 -1.829 -1.880 1.00 . A A . 8 GLN HA 1 1 4 1292 1 1 8 GLN HB3 H -10.223 -1.218 0.359 1.00 . A A . 8 GLN HB3 1 1 4 1293 1 1 8 GLN HE21 H -12.273 -4.609 1.817 1.00 . A A . 8 GLN HE21 1 1 4 1294 1 1 8 GLN HE22 H -12.064 -3.977 3.417 1.00 . A A . 8 GLN HE22 1 1 4 1295 1 1 8 GLN HG3 H -9.965 -4.256 0.336 1.00 . A A . 8 GLN HG3 1 1 4 1296 1 1 8 GLN N N -10.645 -1.110 -2.064 1.00 . A A . 8 GLN N 1 1 4 1297 1 1 8 GLN NE2 N -11.802 -3.996 2.451 1.00 . A A . 8 GLN NE2 1 1 4 1298 1 1 8 GLN O O -11.275 -3.855 -2.181 1.00 . A A . 8 GLN O 1 1 4 1299 1 1 8 GLN OE1 O -10.206 -2.431 2.719 1.00 . A A . 8 GLN OE1 1 1 4 1300 1 1 9 MET C C -8.562 -6.618 -2.192 1.00 . A A . 9 MET C 1 1 4 1301 1 1 9 MET CA C -9.257 -5.558 -3.050 1.00 . A A . 9 MET CA 1 1 4 1302 1 1 9 MET CB C -8.693 -5.601 -4.471 1.00 . A A . 9 MET CB 1 1 4 1303 1 1 9 MET CE C -10.414 -7.906 -6.390 1.00 . A A . 9 MET CE 1 1 4 1304 1 1 9 MET CG C -8.317 -7.030 -4.869 1.00 . A A . 9 MET CG 1 1 4 1305 1 1 9 MET H H -8.114 -3.931 -2.428 1.00 . A A . 9 MET H 1 1 4 1306 1 1 9 MET HA H -10.334 -5.726 -3.045 1.00 . A A . 9 MET HA 1 1 4 1307 1 1 9 MET HB3 H -7.816 -4.958 -4.538 1.00 . A A . 9 MET HB3 1 1 4 1308 1 1 9 MET HE1 H -11.096 -7.056 -6.357 1.00 . A A . 9 MET HE1 1 1 4 1309 1 1 9 MET HE2 H -10.672 -8.546 -7.235 1.00 . A A . 9 MET HE2 1 1 4 1310 1 1 9 MET HE3 H -10.498 -8.474 -5.464 1.00 . A A . 9 MET HE3 1 1 4 1311 1 1 9 MET HG3 H -8.840 -7.743 -4.232 1.00 . A A . 9 MET HG3 1 1 4 1312 1 1 9 MET N N -9.067 -4.230 -2.492 1.00 . A A . 9 MET N 1 1 4 1313 1 1 9 MET O O -9.160 -7.638 -1.853 1.00 . A A . 9 MET O 1 1 4 1314 1 1 9 MET SD S -8.739 -7.319 -6.579 1.00 . A A . 9 MET SD 1 1 4 1315 1 1 10 GLY C C -5.310 -7.772 -1.828 1.00 . A A . 10 GLY C 1 1 4 1316 1 1 10 GLY CA C -6.525 -7.257 -1.055 1.00 . A A . 10 GLY CA 1 1 4 1317 1 1 10 GLY H H -6.829 -5.508 -2.146 1.00 . A A . 10 GLY H 1 1 4 1318 1 1 10 GLY HA2 H -6.195 -6.753 -0.147 1.00 . A A . 10 GLY HA2 1 1 4 1319 1 1 10 GLY HA3 H -7.147 -8.096 -0.746 1.00 . A A . 10 GLY HA3 1 1 4 1320 1 1 10 GLY N N -7.308 -6.340 -1.867 1.00 . A A . 10 GLY N 1 1 4 1321 1 1 10 GLY O O -5.078 -8.978 -1.895 1.00 . A A . 10 GLY O 1 1 4 1322 1 1 11 ALA C C -2.638 -5.895 -3.546 1.00 . A A . 11 ALA C 1 1 4 1323 1 1 11 ALA CA C -3.380 -7.177 -3.159 1.00 . A A . 11 ALA CA 1 1 4 1324 1 1 11 ALA CB C -3.783 -8.008 -4.377 1.00 . A A . 11 ALA CB 1 1 4 1325 1 1 11 ALA H H -4.760 -5.854 -2.333 1.00 . A A . 11 ALA H 1 1 4 1326 1 1 11 ALA HA H -2.735 -7.780 -2.519 1.00 . A A . 11 ALA HA 1 1 4 1327 1 1 11 ALA HB1 H -4.840 -8.266 -4.308 1.00 . A A . 11 ALA HB1 1 1 4 1328 1 1 11 ALA HB2 H -3.609 -7.430 -5.285 1.00 . A A . 11 ALA HB2 1 1 4 1329 1 1 11 ALA HB3 H -3.187 -8.920 -4.409 1.00 . A A . 11 ALA HB3 1 1 4 1330 1 1 11 ALA N N -4.565 -6.832 -2.393 1.00 . A A . 11 ALA N 1 1 4 1331 1 1 11 ALA O O -1.446 -5.757 -3.277 1.00 . A A . 11 ALA O 1 1 4 1332 1 1 12 THR C C -2.311 -2.926 -3.391 1.00 . A A . 12 THR C 1 1 4 1333 1 1 12 THR CA C -2.803 -3.724 -4.600 1.00 . A A . 12 THR CA 1 1 4 1334 1 1 12 THR CB C -3.856 -2.984 -5.428 1.00 . A A . 12 THR CB 1 1 4 1335 1 1 12 THR CG2 C -3.277 -1.774 -6.164 1.00 . A A . 12 THR CG2 1 1 4 1336 1 1 12 THR H H -4.344 -5.109 -4.388 1.00 . A A . 12 THR H 1 1 4 1337 1 1 12 THR HA H -1.932 -3.933 -5.221 1.00 . A A . 12 THR HA 1 1 4 1338 1 1 12 THR HB H -4.705 -2.695 -4.809 1.00 . A A . 12 THR HB 1 1 4 1339 1 1 12 THR HG1 H -5.057 -3.646 -6.885 1.00 . A A . 12 THR HG1 1 1 4 1340 1 1 12 THR HG21 H -2.447 -1.362 -5.590 1.00 . A A . 12 THR HG21 1 1 4 1341 1 1 12 THR HG22 H -2.921 -2.083 -7.147 1.00 . A A . 12 THR HG22 1 1 4 1342 1 1 12 THR HG23 H -4.051 -1.015 -6.279 1.00 . A A . 12 THR HG23 1 1 4 1343 1 1 12 THR N N -3.375 -4.989 -4.172 1.00 . A A . 12 THR N 1 1 4 1344 1 1 12 THR O O -1.194 -2.409 -3.396 1.00 . A A . 12 THR O 1 1 4 1345 1 1 12 THR OG1 O -4.184 -3.900 -6.469 1.00 . A A . 12 THR OG1 1 1 4 1346 1 1 13 ALA C C -1.377 -2.408 -0.795 1.00 . A A . 13 ALA C 1 1 4 1347 1 1 13 ALA CA C -2.833 -2.126 -1.169 1.00 . A A . 13 ALA CA 1 1 4 1348 1 1 13 ALA CB C -3.807 -2.516 -0.056 1.00 . A A . 13 ALA CB 1 1 4 1349 1 1 13 ALA H H -4.073 -3.276 -2.385 1.00 . A A . 13 ALA H 1 1 4 1350 1 1 13 ALA HA H -2.946 -1.062 -1.376 1.00 . A A . 13 ALA HA 1 1 4 1351 1 1 13 ALA HB1 H -4.626 -1.797 -0.019 1.00 . A A . 13 ALA HB1 1 1 4 1352 1 1 13 ALA HB2 H -4.207 -3.511 -0.255 1.00 . A A . 13 ALA HB2 1 1 4 1353 1 1 13 ALA HB3 H -3.284 -2.520 0.900 1.00 . A A . 13 ALA HB3 1 1 4 1354 1 1 13 ALA N N -3.167 -2.852 -2.382 1.00 . A A . 13 ALA N 1 1 4 1355 1 1 13 ALA O O -0.611 -1.485 -0.525 1.00 . A A . 13 ALA O 1 1 4 1356 1 1 14 ILE C C 1.314 -3.161 -1.122 1.00 . A A . 14 ILE C 1 1 4 1357 1 1 14 ILE CA C 0.312 -4.105 -0.455 1.00 . A A . 14 ILE CA 1 1 4 1358 1 1 14 ILE CB C 0.524 -5.578 -0.812 1.00 . A A . 14 ILE CB 1 1 4 1359 1 1 14 ILE CD1 C -0.751 -7.753 -0.761 1.00 . A A . 14 ILE CD1 1 1 4 1360 1 1 14 ILE CG1 C -0.396 -6.480 0.012 1.00 . A A . 14 ILE CG1 1 1 4 1361 1 1 14 ILE CG2 C 1.996 -5.972 -0.663 1.00 . A A . 14 ILE CG2 1 1 4 1362 1 1 14 ILE H H -1.667 -4.435 -1.012 1.00 . A A . 14 ILE H 1 1 4 1363 1 1 14 ILE HA H 0.422 -4.017 0.626 1.00 . A A . 14 ILE HA 1 1 4 1364 1 1 14 ILE HB H 0.259 -5.717 -1.859 1.00 . A A . 14 ILE HB 1 1 4 1365 1 1 14 ILE HD11 H -0.575 -7.593 -1.824 1.00 . A A . 14 ILE HD11 1 1 4 1366 1 1 14 ILE HD12 H -0.130 -8.576 -0.409 1.00 . A A . 14 ILE HD12 1 1 4 1367 1 1 14 ILE HD13 H -1.802 -7.995 -0.599 1.00 . A A . 14 ILE HD13 1 1 4 1368 1 1 14 ILE HG13 H -1.308 -5.939 0.267 1.00 . A A . 14 ILE HG13 1 1 4 1369 1 1 14 ILE HG21 H 2.417 -6.184 -1.646 1.00 . A A . 14 ILE HG21 1 1 4 1370 1 1 14 ILE HG22 H 2.546 -5.154 -0.201 1.00 . A A . 14 ILE HG22 1 1 4 1371 1 1 14 ILE HG23 H 2.072 -6.861 -0.036 1.00 . A A . 14 ILE HG23 1 1 4 1372 1 1 14 ILE N N -1.038 -3.689 -0.791 1.00 . A A . 14 ILE N 1 1 4 1373 1 1 14 ILE O O 2.226 -2.654 -0.470 1.00 . A A . 14 ILE O 1 1 4 1374 1 1 15 LYS C C 2.268 -0.811 -2.365 1.00 . A A . 15 LYS C 1 1 4 1375 1 1 15 LYS CA C 1.984 -2.076 -3.178 1.00 . A A . 15 LYS CA 1 1 4 1376 1 1 15 LYS CB C 1.390 -1.798 -4.559 1.00 . A A . 15 LYS CB 1 1 4 1377 1 1 15 LYS CD C 2.148 0.575 -4.953 1.00 . A A . 15 LYS CD 1 1 4 1378 1 1 15 LYS CE C 2.142 1.502 -6.169 1.00 . A A . 15 LYS CE 1 1 4 1379 1 1 15 LYS CG C 2.306 -0.886 -5.378 1.00 . A A . 15 LYS CG 1 1 4 1380 1 1 15 LYS H H 0.367 -3.367 -2.938 1.00 . A A . 15 LYS H 1 1 4 1381 1 1 15 LYS HA H 2.924 -2.607 -3.333 1.00 . A A . 15 LYS HA 1 1 4 1382 1 1 15 LYS HB3 H 0.410 -1.332 -4.451 1.00 . A A . 15 LYS HB3 1 1 4 1383 1 1 15 LYS HD3 H 2.963 0.852 -4.284 1.00 . A A . 15 LYS HD3 1 1 4 1384 1 1 15 LYS HE3 H 2.460 0.953 -7.055 1.00 . A A . 15 LYS HE3 1 1 4 1385 1 1 15 LYS HG3 H 2.074 -0.988 -6.438 1.00 . A A . 15 LYS HG3 1 1 4 1386 1 1 15 LYS HZ1 H 0.750 2.991 -6.015 1.00 . A A . 15 LYS HZ1 1 1 4 1387 1 1 15 LYS HZ2 H 0.592 2.088 -7.367 1.00 . A A . 15 LYS HZ2 1 1 4 1388 1 1 15 LYS HZ3 H 0.114 1.489 -5.925 1.00 . A A . 15 LYS HZ3 1 1 4 1389 1 1 15 LYS N N 1.110 -2.951 -2.415 1.00 . A A . 15 LYS N 1 1 4 1390 1 1 15 LYS NZ N 0.790 2.063 -6.387 1.00 . A A . 15 LYS NZ 1 1 4 1391 1 1 15 LYS O O 3.424 -0.432 -2.185 1.00 . A A . 15 LYS O 1 1 4 1392 1 1 16 GLN C C 2.265 0.795 0.072 1.00 . A A . 16 GLN C 1 1 4 1393 1 1 16 GLN CA C 1.314 1.019 -1.105 1.00 . A A . 16 GLN CA 1 1 4 1394 1 1 16 GLN CB C -0.057 1.495 -0.620 1.00 . A A . 16 GLN CB 1 1 4 1395 1 1 16 GLN CD C -1.590 2.100 -2.528 1.00 . A A . 16 GLN CD 1 1 4 1396 1 1 16 GLN CG C -0.588 2.628 -1.501 1.00 . A A . 16 GLN CG 1 1 4 1397 1 1 16 GLN H H 0.257 -0.510 -2.046 1.00 . A A . 16 GLN H 1 1 4 1398 1 1 16 GLN HA H 1.732 1.764 -1.782 1.00 . A A . 16 GLN HA 1 1 4 1399 1 1 16 GLN HB3 H 0.017 1.837 0.412 1.00 . A A . 16 GLN HB3 1 1 4 1400 1 1 16 GLN HE21 H -3.086 2.815 -1.365 1.00 . A A . 16 GLN HE21 1 1 4 1401 1 1 16 GLN HE22 H -3.593 2.025 -2.822 1.00 . A A . 16 GLN HE22 1 1 4 1402 1 1 16 GLN HG3 H 0.243 3.114 -2.015 1.00 . A A . 16 GLN HG3 1 1 4 1403 1 1 16 GLN N N 1.194 -0.195 -1.895 1.00 . A A . 16 GLN N 1 1 4 1404 1 1 16 GLN NE2 N -2.861 2.333 -2.212 1.00 . A A . 16 GLN NE2 1 1 4 1405 1 1 16 GLN O O 3.096 1.649 0.376 1.00 . A A . 16 GLN O 1 1 4 1406 1 1 16 GLN OE1 O -1.235 1.520 -3.541 1.00 . A A . 16 GLN OE1 1 1 4 1407 1 1 17 VAL C C 4.418 -0.566 1.450 1.00 . A A . 17 VAL C 1 1 4 1408 1 1 17 VAL CA C 2.945 -0.708 1.842 1.00 . A A . 17 VAL CA 1 1 4 1409 1 1 17 VAL CB C 2.591 -2.109 2.342 1.00 . A A . 17 VAL CB 1 1 4 1410 1 1 17 VAL CG1 C 3.451 -2.495 3.547 1.00 . A A . 17 VAL CG1 1 1 4 1411 1 1 17 VAL CG2 C 1.102 -2.212 2.676 1.00 . A A . 17 VAL CG2 1 1 4 1412 1 1 17 VAL H H 1.432 -1.049 0.451 1.00 . A A . 17 VAL H 1 1 4 1413 1 1 17 VAL HA H 2.725 0.002 2.640 1.00 . A A . 17 VAL HA 1 1 4 1414 1 1 17 VAL HB H 2.803 -2.815 1.540 1.00 . A A . 17 VAL HB 1 1 4 1415 1 1 17 VAL HG11 H 3.419 -3.576 3.686 1.00 . A A . 17 VAL HG11 1 1 4 1416 1 1 17 VAL HG12 H 4.480 -2.181 3.374 1.00 . A A . 17 VAL HG12 1 1 4 1417 1 1 17 VAL HG13 H 3.066 -2.003 4.440 1.00 . A A . 17 VAL HG13 1 1 4 1418 1 1 17 VAL HG21 H 0.956 -2.043 3.742 1.00 . A A . 17 VAL HG21 1 1 4 1419 1 1 17 VAL HG22 H 0.550 -1.460 2.111 1.00 . A A . 17 VAL HG22 1 1 4 1420 1 1 17 VAL HG23 H 0.737 -3.204 2.411 1.00 . A A . 17 VAL HG23 1 1 4 1421 1 1 17 VAL N N 2.111 -0.359 0.704 1.00 . A A . 17 VAL N 1 1 4 1422 1 1 17 VAL O O 5.238 -0.128 2.254 1.00 . A A . 17 VAL O 1 1 4 1423 1 1 18 LYS C C 6.517 0.592 -0.310 1.00 . A A . 18 LYS C 1 1 4 1424 1 1 18 LYS CA C 6.066 -0.870 -0.293 1.00 . A A . 18 LYS CA 1 1 4 1425 1 1 18 LYS CB C 6.171 -1.561 -1.654 1.00 . A A . 18 LYS CB 1 1 4 1426 1 1 18 LYS CD C 6.133 0.325 -3.327 1.00 . A A . 18 LYS CD 1 1 4 1427 1 1 18 LYS CE C 5.626 -0.188 -4.677 1.00 . A A . 18 LYS CE 1 1 4 1428 1 1 18 LYS CG C 7.000 -0.726 -2.632 1.00 . A A . 18 LYS CG 1 1 4 1429 1 1 18 LYS H H 4.035 -1.303 -0.433 1.00 . A A . 18 LYS H 1 1 4 1430 1 1 18 LYS HA H 6.706 -1.421 0.397 1.00 . A A . 18 LYS HA 1 1 4 1431 1 1 18 LYS HB3 H 5.173 -1.720 -2.063 1.00 . A A . 18 LYS HB3 1 1 4 1432 1 1 18 LYS HD3 H 6.710 1.238 -3.476 1.00 . A A . 18 LYS HD3 1 1 4 1433 1 1 18 LYS HE3 H 4.812 0.444 -5.031 1.00 . A A . 18 LYS HE3 1 1 4 1434 1 1 18 LYS HG3 H 7.456 -1.377 -3.376 1.00 . A A . 18 LYS HG3 1 1 4 1435 1 1 18 LYS HZ1 H 6.913 0.735 -5.970 1.00 . A A . 18 LYS HZ1 1 1 4 1436 1 1 18 LYS HZ2 H 7.544 -0.593 -5.257 1.00 . A A . 18 LYS HZ2 1 1 4 1437 1 1 18 LYS HZ3 H 6.451 -0.753 -6.460 1.00 . A A . 18 LYS HZ3 1 1 4 1438 1 1 18 LYS N N 4.708 -0.948 0.214 1.00 . A A . 18 LYS N 1 1 4 1439 1 1 18 LYS NZ N 6.722 -0.201 -5.672 1.00 . A A . 18 LYS NZ 1 1 4 1440 1 1 18 LYS O O 7.679 0.891 -0.038 1.00 . A A . 18 LYS O 1 1 4 1441 1 1 19 LYS C C 6.223 3.387 0.713 1.00 . A A . 19 LYS C 1 1 4 1442 1 1 19 LYS CA C 5.859 2.889 -0.688 1.00 . A A . 19 LYS CA 1 1 4 1443 1 1 19 LYS CB C 4.692 3.644 -1.326 1.00 . A A . 19 LYS CB 1 1 4 1444 1 1 19 LYS CD C 3.588 4.682 0.690 1.00 . A A . 19 LYS CD 1 1 4 1445 1 1 19 LYS CE C 2.115 5.038 0.475 1.00 . A A . 19 LYS CE 1 1 4 1446 1 1 19 LYS CG C 4.407 4.946 -0.575 1.00 . A A . 19 LYS CG 1 1 4 1447 1 1 19 LYS H H 4.632 1.214 -0.852 1.00 . A A . 19 LYS H 1 1 4 1448 1 1 19 LYS HA H 6.724 3.023 -1.337 1.00 . A A . 19 LYS HA 1 1 4 1449 1 1 19 LYS HB3 H 3.802 3.016 -1.323 1.00 . A A . 19 LYS HB3 1 1 4 1450 1 1 19 LYS HD3 H 3.989 5.266 1.517 1.00 . A A . 19 LYS HD3 1 1 4 1451 1 1 19 LYS HE3 H 1.711 4.455 -0.353 1.00 . A A . 19 LYS HE3 1 1 4 1452 1 1 19 LYS HG3 H 3.866 5.634 -1.225 1.00 . A A . 19 LYS HG3 1 1 4 1453 1 1 19 LYS HZ1 H 1.936 4.825 2.499 1.00 . A A . 19 LYS HZ1 1 1 4 1454 1 1 19 LYS HZ2 H 0.608 5.459 1.790 1.00 . A A . 19 LYS HZ2 1 1 4 1455 1 1 19 LYS HZ3 H 0.926 3.864 1.650 1.00 . A A . 19 LYS HZ3 1 1 4 1456 1 1 19 LYS N N 5.574 1.465 -0.632 1.00 . A A . 19 LYS N 1 1 4 1457 1 1 19 LYS NZ N 1.333 4.775 1.703 1.00 . A A . 19 LYS NZ 1 1 4 1458 1 1 19 LYS O O 6.889 4.411 0.858 1.00 . A A . 19 LYS O 1 1 4 1459 1 1 20 LEU C C 7.334 2.317 3.543 1.00 . A A . 20 LEU C 1 1 4 1460 1 1 20 LEU CA C 6.037 2.993 3.091 1.00 . A A . 20 LEU CA 1 1 4 1461 1 1 20 LEU CB C 4.832 2.661 3.973 1.00 . A A . 20 LEU CB 1 1 4 1462 1 1 20 LEU CD1 C 5.922 1.736 6.050 1.00 . A A . 20 LEU CD1 1 1 4 1463 1 1 20 LEU CD2 C 3.615 0.939 5.357 1.00 . A A . 20 LEU CD2 1 1 4 1464 1 1 20 LEU CG C 4.980 1.439 4.881 1.00 . A A . 20 LEU CG 1 1 4 1465 1 1 20 LEU H H 5.228 1.808 1.581 1.00 . A A . 20 LEU H 1 1 4 1466 1 1 20 LEU HA H 6.179 4.072 3.132 1.00 . A A . 20 LEU HA 1 1 4 1467 1 1 20 LEU HB3 H 3.966 2.506 3.328 1.00 . A A . 20 LEU HB3 1 1 4 1468 1 1 20 LEU HD11 H 6.117 2.807 6.097 1.00 . A A . 20 LEU HD11 1 1 4 1469 1 1 20 LEU HD12 H 5.458 1.411 6.982 1.00 . A A . 20 LEU HD12 1 1 4 1470 1 1 20 LEU HD13 H 6.860 1.201 5.907 1.00 . A A . 20 LEU HD13 1 1 4 1471 1 1 20 LEU HD21 H 2.839 1.625 5.018 1.00 . A A . 20 LEU HD21 1 1 4 1472 1 1 20 LEU HD22 H 3.428 -0.053 4.948 1.00 . A A . 20 LEU HD22 1 1 4 1473 1 1 20 LEU HD23 H 3.605 0.891 6.446 1.00 . A A . 20 LEU HD23 1 1 4 1474 1 1 20 LEU HG H 5.433 0.635 4.301 1.00 . A A . 20 LEU HG 1 1 4 1475 1 1 20 LEU N N 5.769 2.640 1.708 1.00 . A A . 20 LEU N 1 1 4 1476 1 1 20 LEU O O 7.915 2.697 4.559 1.00 . A A . 20 LEU O 1 1 4 1477 1 1 21 PHE C C 10.205 1.420 2.725 1.00 . A A . 21 PHE C 1 1 4 1478 1 1 21 PHE CA C 8.966 0.595 3.075 1.00 . A A . 21 PHE CA 1 1 4 1479 1 1 21 PHE CB C 8.954 -0.673 2.218 1.00 . A A . 21 PHE CB 1 1 4 1480 1 1 21 PHE CD1 C 7.578 -2.388 3.417 1.00 . A A . 21 PHE CD1 1 1 4 1481 1 1 21 PHE CD2 C 9.912 -2.694 3.345 1.00 . A A . 21 PHE CD2 1 1 4 1482 1 1 21 PHE CE1 C 7.443 -3.588 4.164 1.00 . A A . 21 PHE CE1 1 1 4 1483 1 1 21 PHE CE2 C 9.777 -3.894 4.093 1.00 . A A . 21 PHE CE2 1 1 4 1484 1 1 21 PHE CG C 8.809 -1.967 3.023 1.00 . A A . 21 PHE CG 1 1 4 1485 1 1 21 PHE CZ C 8.546 -4.316 4.485 1.00 . A A . 21 PHE CZ 1 1 4 1486 1 1 21 PHE H H 7.271 1.024 1.942 1.00 . A A . 21 PHE H 1 1 4 1487 1 1 21 PHE HA H 8.959 0.390 4.145 1.00 . A A . 21 PHE HA 1 1 4 1488 1 1 21 PHE HB3 H 9.877 -0.719 1.641 1.00 . A A . 21 PHE HB3 1 1 4 1489 1 1 21 PHE HD1 H 6.693 -1.806 3.159 1.00 . A A . 21 PHE HD1 1 1 4 1490 1 1 21 PHE HD2 H 10.899 -2.356 3.030 1.00 . A A . 21 PHE HD2 1 1 4 1491 1 1 21 PHE HE1 H 6.456 -3.926 4.479 1.00 . A A . 21 PHE HE1 1 1 4 1492 1 1 21 PHE HE2 H 10.661 -4.477 4.350 1.00 . A A . 21 PHE HE2 1 1 4 1493 1 1 21 PHE HZ H 8.442 -5.237 5.059 1.00 . A A . 21 PHE HZ 1 1 4 1494 1 1 21 PHE N N 7.749 1.327 2.767 1.00 . A A . 21 PHE N 1 1 4 1495 1 1 21 PHE O O 11.303 1.128 3.196 1.00 . A A . 21 PHE O 1 1 4 1496 1 1 22 LYS C C 11.917 3.684 2.701 1.00 . A A . 22 LYS C 1 1 4 1497 1 1 22 LYS CA C 11.075 3.304 1.481 1.00 . A A . 22 LYS CA 1 1 4 1498 1 1 22 LYS CB C 10.530 4.509 0.712 1.00 . A A . 22 LYS CB 1 1 4 1499 1 1 22 LYS CD C 8.921 5.622 2.303 1.00 . A A . 22 LYS CD 1 1 4 1500 1 1 22 LYS CE C 8.871 6.473 3.573 1.00 . A A . 22 LYS CE 1 1 4 1501 1 1 22 LYS CG C 10.300 5.699 1.646 1.00 . A A . 22 LYS CG 1 1 4 1502 1 1 22 LYS H H 9.093 2.665 1.521 1.00 . A A . 22 LYS H 1 1 4 1503 1 1 22 LYS HA H 11.701 2.738 0.792 1.00 . A A . 22 LYS HA 1 1 4 1504 1 1 22 LYS HB3 H 9.594 4.240 0.223 1.00 . A A . 22 LYS HB3 1 1 4 1505 1 1 22 LYS HD3 H 8.686 4.586 2.546 1.00 . A A . 22 LYS HD3 1 1 4 1506 1 1 22 LYS HE3 H 9.778 6.319 4.157 1.00 . A A . 22 LYS HE3 1 1 4 1507 1 1 22 LYS HG3 H 10.389 6.629 1.085 1.00 . A A . 22 LYS HG3 1 1 4 1508 1 1 22 LYS HZ1 H 9.445 8.167 2.585 1.00 . A A . 22 LYS HZ1 1 1 4 1509 1 1 22 LYS HZ2 H 7.832 8.063 2.819 1.00 . A A . 22 LYS HZ2 1 1 4 1510 1 1 22 LYS HZ3 H 8.814 8.456 4.064 1.00 . A A . 22 LYS HZ3 1 1 4 1511 1 1 22 LYS N N 9.989 2.435 1.901 1.00 . A A . 22 LYS N 1 1 4 1512 1 1 22 LYS NZ N 8.729 7.906 3.233 1.00 . A A . 22 LYS NZ 1 1 4 1513 1 1 22 LYS O O 13.102 3.986 2.572 1.00 . A A . 22 LYS O 1 1 4 1514 1 1 23 LYS C C 12.438 2.710 5.774 1.00 . A A . 23 LYS C 1 1 4 1515 1 1 23 LYS CA C 11.948 3.993 5.100 1.00 . A A . 23 LYS CA 1 1 4 1516 1 1 23 LYS CB C 11.041 4.847 5.988 1.00 . A A . 23 LYS CB 1 1 4 1517 1 1 23 LYS CD C 8.980 4.478 7.395 1.00 . A A . 23 LYS CD 1 1 4 1518 1 1 23 LYS CE C 7.877 5.537 7.347 1.00 . A A . 23 LYS CE 1 1 4 1519 1 1 23 LYS CG C 9.618 4.286 6.017 1.00 . A A . 23 LYS CG 1 1 4 1520 1 1 23 LYS H H 10.308 3.409 3.955 1.00 . A A . 23 LYS H 1 1 4 1521 1 1 23 LYS HA H 12.815 4.602 4.845 1.00 . A A . 23 LYS HA 1 1 4 1522 1 1 23 LYS HB3 H 11.025 5.872 5.619 1.00 . A A . 23 LYS HB3 1 1 4 1523 1 1 23 LYS HD3 H 9.743 4.775 8.114 1.00 . A A . 23 LYS HD3 1 1 4 1524 1 1 23 LYS HE3 H 7.132 5.330 8.115 1.00 . A A . 23 LYS HE3 1 1 4 1525 1 1 23 LYS HG3 H 9.635 3.227 5.764 1.00 . A A . 23 LYS HG3 1 1 4 1526 1 1 23 LYS HZ1 H 8.163 7.486 6.802 1.00 . A A . 23 LYS HZ1 1 1 4 1527 1 1 23 LYS HZ2 H 8.116 7.261 8.418 1.00 . A A . 23 LYS HZ2 1 1 4 1528 1 1 23 LYS HZ3 H 9.445 6.830 7.572 1.00 . A A . 23 LYS HZ3 1 1 4 1529 1 1 23 LYS N N 11.273 3.656 3.858 1.00 . A A . 23 LYS N 1 1 4 1530 1 1 23 LYS NZ N 8.447 6.888 7.552 1.00 . A A . 23 LYS NZ 1 1 4 1531 1 1 23 LYS O O 13.521 2.685 6.355 1.00 . A A . 23 LYS O 1 1 4 1532 1 1 24 TRP C C 13.193 -0.148 5.552 1.00 . A A . 24 TRP C 1 1 4 1533 1 1 24 TRP CA C 11.952 0.392 6.265 1.00 . A A . 24 TRP CA 1 1 4 1534 1 1 24 TRP CB C 10.762 -0.568 6.204 1.00 . A A . 24 TRP CB 1 1 4 1535 1 1 24 TRP CD1 C 9.341 1.098 7.569 1.00 . A A . 24 TRP CD1 1 1 4 1536 1 1 24 TRP CD2 C 8.350 -0.862 7.276 1.00 . A A . 24 TRP CD2 1 1 4 1537 1 1 24 TRP CE2 C 7.491 -0.073 8.013 1.00 . A A . 24 TRP CE2 1 1 4 1538 1 1 24 TRP CE3 C 8.010 -2.179 6.920 1.00 . A A . 24 TRP CE3 1 1 4 1539 1 1 24 TRP CG C 9.540 -0.096 6.995 1.00 . A A . 24 TRP CG 1 1 4 1540 1 1 24 TRP CH2 C 5.878 -1.819 8.113 1.00 . A A . 24 TRP CH2 1 1 4 1541 1 1 24 TRP CZ2 C 6.238 -0.510 8.457 1.00 . A A . 24 TRP CZ2 1 1 4 1542 1 1 24 TRP CZ3 C 6.754 -2.602 7.370 1.00 . A A . 24 TRP CZ3 1 1 4 1543 1 1 24 TRP H H 10.737 1.704 5.199 1.00 . A A . 24 TRP H 1 1 4 1544 1 1 24 TRP HA H 12.171 0.559 7.320 1.00 . A A . 24 TRP HA 1 1 4 1545 1 1 24 TRP HB3 H 11.074 -1.541 6.584 1.00 . A A . 24 TRP HB3 1 1 4 1546 1 1 24 TRP HD1 H 10.057 1.919 7.543 1.00 . A A . 24 TRP HD1 1 1 4 1547 1 1 24 TRP HE1 H 7.706 2.012 8.739 1.00 . A A . 24 TRP HE1 1 1 4 1548 1 1 24 TRP HE3 H 8.670 -2.822 6.338 1.00 . A A . 24 TRP HE3 1 1 4 1549 1 1 24 TRP HH2 H 4.915 -2.222 8.427 1.00 . A A . 24 TRP HH2 1 1 4 1550 1 1 24 TRP HZ2 H 5.578 0.133 9.039 1.00 . A A . 24 TRP HZ2 1 1 4 1551 1 1 24 TRP HZ3 H 6.440 -3.616 7.121 1.00 . A A . 24 TRP HZ3 1 1 4 1552 1 1 24 TRP N N 11.616 1.676 5.673 1.00 . A A . 24 TRP N 1 1 4 1553 1 1 24 TRP NE1 N 8.113 1.157 8.198 1.00 . A A . 24 TRP NE1 1 1 4 1554 1 1 24 TRP O O 14.242 -0.324 6.171 1.00 . A A . 24 TRP O 1 1 4 1555 1 1 25 GLY C C 14.507 -2.329 3.890 1.00 . A A . 25 GLY C 1 1 4 1556 1 1 25 GLY CA C 14.128 -0.911 3.456 1.00 . A A . 25 GLY CA 1 1 4 1557 1 1 25 GLY H H 12.177 -0.249 3.765 1.00 . A A . 25 GLY H 1 1 4 1558 1 1 25 GLY HA2 H 13.842 -0.914 2.405 1.00 . A A . 25 GLY HA2 1 1 4 1559 1 1 25 GLY HA3 H 14.993 -0.255 3.549 1.00 . A A . 25 GLY HA3 1 1 4 1560 1 1 25 GLY N N 13.033 -0.395 4.261 1.00 . A A . 25 GLY N 1 1 4 1561 1 1 25 GLY O O 15.014 -2.530 4.992 1.00 . A A . 25 GLY O 1 1 4 1562 1 1 26 TRP C C 15.905 -4.990 2.642 1.00 . A A . 26 TRP C 1 1 4 1563 1 1 26 TRP CA C 14.551 -4.668 3.278 1.00 . A A . 26 TRP CA 1 1 4 1564 1 1 26 TRP CB C 13.428 -5.585 2.789 1.00 . A A . 26 TRP CB 1 1 4 1565 1 1 26 TRP CD1 C 13.277 -6.840 5.039 1.00 . A A . 26 TRP CD1 1 1 4 1566 1 1 26 TRP CD2 C 12.707 -8.090 3.301 1.00 . A A . 26 TRP CD2 1 1 4 1567 1 1 26 TRP CE2 C 12.584 -8.873 4.431 1.00 . A A . 26 TRP CE2 1 1 4 1568 1 1 26 TRP CE3 C 12.414 -8.596 2.023 1.00 . A A . 26 TRP CE3 1 1 4 1569 1 1 26 TRP CG C 13.156 -6.779 3.706 1.00 . A A . 26 TRP CG 1 1 4 1570 1 1 26 TRP CH2 C 11.870 -10.735 3.132 1.00 . A A . 26 TRP CH2 1 1 4 1571 1 1 26 TRP CZ2 C 12.167 -10.209 4.396 1.00 . A A . 26 TRP CZ2 1 1 4 1572 1 1 26 TRP CZ3 C 11.999 -9.933 2.005 1.00 . A A . 26 TRP CZ3 1 1 4 1573 1 1 26 TRP H H 13.831 -3.103 2.107 1.00 . A A . 26 TRP H 1 1 4 1574 1 1 26 TRP HA H 14.609 -4.787 4.360 1.00 . A A . 26 TRP HA 1 1 4 1575 1 1 26 TRP HB3 H 13.680 -5.953 1.795 1.00 . A A . 26 TRP HB3 1 1 4 1576 1 1 26 TRP HD1 H 13.601 -6.008 5.665 1.00 . A A . 26 TRP HD1 1 1 4 1577 1 1 26 TRP HE1 H 12.956 -8.402 6.565 1.00 . A A . 26 TRP HE1 1 1 4 1578 1 1 26 TRP HE3 H 12.503 -7.998 1.116 1.00 . A A . 26 TRP HE3 1 1 4 1579 1 1 26 TRP HH2 H 11.540 -11.769 3.034 1.00 . A A . 26 TRP HH2 1 1 4 1580 1 1 26 TRP HZ2 H 12.077 -10.807 5.302 1.00 . A A . 26 TRP HZ2 1 1 4 1581 1 1 26 TRP HZ3 H 11.759 -10.376 1.038 1.00 . A A . 26 TRP HZ3 1 1 4 1582 1 1 26 TRP N N 14.244 -3.275 3.001 1.00 . A A . 26 TRP N 1 1 4 1583 1 1 26 TRP NE1 N 12.943 -8.089 5.521 1.00 . A A . 26 TRP NE1 1 1 4 1584 1 1 26 TRP O O 16.172 -4.595 1.509 1.00 . A A . 26 TRP O 1 1 5 1585 1 1 1 LYS C C -12.585 13.872 5.222 1.00 . A A . 1 LYS C 1 1 5 1586 1 1 1 LYS CA C -12.462 15.397 5.189 1.00 . A A . 1 LYS CA 1 1 5 1587 1 1 1 LYS CB C -13.332 16.060 4.119 1.00 . A A . 1 LYS CB 1 1 5 1588 1 1 1 LYS CD C -14.124 15.283 1.854 1.00 . A A . 1 LYS CD 1 1 5 1589 1 1 1 LYS CE C -13.711 15.001 0.408 1.00 . A A . 1 LYS CE 1 1 5 1590 1 1 1 LYS CG C -12.906 15.620 2.716 1.00 . A A . 1 LYS CG 1 1 5 1591 1 1 1 LYS H1 H -10.569 15.956 5.855 1.00 . A A . 1 LYS H1 1 1 5 1592 1 1 1 LYS HA H -12.782 15.790 6.153 1.00 . A A . 1 LYS HA 1 1 5 1593 1 1 1 LYS HB3 H -13.255 17.144 4.203 1.00 . A A . 1 LYS HB3 1 1 5 1594 1 1 1 LYS HD3 H -14.831 16.112 1.877 1.00 . A A . 1 LYS HD3 1 1 5 1595 1 1 1 LYS HE3 H -14.106 14.036 0.092 1.00 . A A . 1 LYS HE3 1 1 5 1596 1 1 1 LYS HG3 H -12.253 14.750 2.786 1.00 . A A . 1 LYS HG3 1 1 5 1597 1 1 1 LYS HZ1 H -14.641 15.653 -1.292 1.00 . A A . 1 LYS HZ1 1 1 5 1598 1 1 1 LYS HZ2 H -14.877 16.629 -0.004 1.00 . A A . 1 LYS HZ2 1 1 5 1599 1 1 1 LYS HZ3 H -13.442 16.640 -0.784 1.00 . A A . 1 LYS HZ3 1 1 5 1600 1 1 1 LYS N N -11.068 15.762 5.010 1.00 . A A . 1 LYS N 1 1 5 1601 1 1 1 LYS NZ N -14.207 16.067 -0.491 1.00 . A A . 1 LYS NZ 1 1 5 1602 1 1 1 LYS O O -13.196 13.275 4.337 1.00 . A A . 1 LYS O 1 1 5 1603 1 1 2 SER C C -11.828 11.159 5.056 1.00 . A A . 2 SER C 1 1 5 1604 1 1 2 SER CA C -12.027 11.841 6.412 1.00 . A A . 2 SER CA 1 1 5 1605 1 1 2 SER CB C -13.344 11.389 7.046 1.00 . A A . 2 SER CB 1 1 5 1606 1 1 2 SER H H -11.497 13.778 6.966 1.00 . A A . 2 SER H 1 1 5 1607 1 1 2 SER HA H -11.202 11.605 7.083 1.00 . A A . 2 SER HA 1 1 5 1608 1 1 2 SER HB3 H -13.369 11.697 8.090 1.00 . A A . 2 SER HB3 1 1 5 1609 1 1 2 SER HG H -14.498 12.921 6.473 1.00 . A A . 2 SER HG 1 1 5 1610 1 1 2 SER N N -11.992 13.284 6.252 1.00 . A A . 2 SER N 1 1 5 1611 1 1 2 SER O O -12.794 10.738 4.422 1.00 . A A . 2 SER O 1 1 5 1612 1 1 2 SER OG O -14.476 11.927 6.366 1.00 . A A . 2 SER OG 1 1 5 1613 1 1 3 SER C C -9.416 9.177 3.628 1.00 . A A . 3 SER C 1 1 5 1614 1 1 3 SER CA C -10.231 10.448 3.386 1.00 . A A . 3 SER CA 1 1 5 1615 1 1 3 SER CB C -9.456 11.413 2.486 1.00 . A A . 3 SER CB 1 1 5 1616 1 1 3 SER H H -9.789 11.417 5.176 1.00 . A A . 3 SER H 1 1 5 1617 1 1 3 SER HA H -11.187 10.207 2.919 1.00 . A A . 3 SER HA 1 1 5 1618 1 1 3 SER HB3 H -8.822 10.845 1.807 1.00 . A A . 3 SER HB3 1 1 5 1619 1 1 3 SER HG H -9.864 13.117 1.518 1.00 . A A . 3 SER HG 1 1 5 1620 1 1 3 SER N N -10.569 11.072 4.653 1.00 . A A . 3 SER N 1 1 5 1621 1 1 3 SER O O -8.249 9.248 4.011 1.00 . A A . 3 SER O 1 1 5 1622 1 1 3 SER OG O -10.324 12.255 1.732 1.00 . A A . 3 SER OG 1 1 5 1623 1 1 4 ALA C C -10.125 5.701 2.740 1.00 . A A . 4 ALA C 1 1 5 1624 1 1 4 ALA CA C -9.410 6.759 3.583 1.00 . A A . 4 ALA CA 1 1 5 1625 1 1 4 ALA CB C -9.396 6.407 5.072 1.00 . A A . 4 ALA CB 1 1 5 1626 1 1 4 ALA H H -11.009 7.995 3.083 1.00 . A A . 4 ALA H 1 1 5 1627 1 1 4 ALA HA H -8.380 6.854 3.235 1.00 . A A . 4 ALA HA 1 1 5 1628 1 1 4 ALA HB1 H -10.269 5.800 5.310 1.00 . A A . 4 ALA HB1 1 1 5 1629 1 1 4 ALA HB2 H -8.489 5.848 5.304 1.00 . A A . 4 ALA HB2 1 1 5 1630 1 1 4 ALA HB3 H -9.418 7.324 5.662 1.00 . A A . 4 ALA HB3 1 1 5 1631 1 1 4 ALA N N -10.061 8.044 3.395 1.00 . A A . 4 ALA N 1 1 5 1632 1 1 4 ALA O O -9.536 5.131 1.823 1.00 . A A . 4 ALA O 1 1 5 1633 1 1 5 TYR C C -11.353 3.259 2.009 1.00 . A A . 5 TYR C 1 1 5 1634 1 1 5 TYR CA C -12.185 4.491 2.369 1.00 . A A . 5 TYR CA 1 1 5 1635 1 1 5 TYR CB C -12.643 5.177 1.081 1.00 . A A . 5 TYR CB 1 1 5 1636 1 1 5 TYR CD1 C -14.219 6.716 2.307 1.00 . A A . 5 TYR CD1 1 1 5 1637 1 1 5 TYR CD2 C -12.944 7.612 0.495 1.00 . A A . 5 TYR CD2 1 1 5 1638 1 1 5 TYR CE1 C -14.829 8.004 2.514 1.00 . A A . 5 TYR CE1 1 1 5 1639 1 1 5 TYR CE2 C -13.552 8.900 0.702 1.00 . A A . 5 TYR CE2 1 1 5 1640 1 1 5 TYR CG C -13.290 6.547 1.301 1.00 . A A . 5 TYR CG 1 1 5 1641 1 1 5 TYR CZ C -14.465 9.032 1.702 1.00 . A A . 5 TYR CZ 1 1 5 1642 1 1 5 TYR H H -11.855 5.937 3.831 1.00 . A A . 5 TYR H 1 1 5 1643 1 1 5 TYR HA H -13.005 4.188 3.021 1.00 . A A . 5 TYR HA 1 1 5 1644 1 1 5 TYR HB3 H -13.353 4.530 0.568 1.00 . A A . 5 TYR HB3 1 1 5 1645 1 1 5 TYR HD1 H -14.493 5.875 2.944 1.00 . A A . 5 TYR HD1 1 1 5 1646 1 1 5 TYR HD2 H -12.208 7.477 -0.299 1.00 . A A . 5 TYR HD2 1 1 5 1647 1 1 5 TYR HE1 H -15.565 8.152 3.305 1.00 . A A . 5 TYR HE1 1 1 5 1648 1 1 5 TYR HE2 H -13.288 9.749 0.073 1.00 . A A . 5 TYR HE2 1 1 5 1649 1 1 5 TYR HH H -14.625 10.700 2.687 1.00 . A A . 5 TYR HH 1 1 5 1650 1 1 5 TYR N N -11.384 5.470 3.083 1.00 . A A . 5 TYR N 1 1 5 1651 1 1 5 TYR O O -10.870 3.139 0.884 1.00 . A A . 5 TYR O 1 1 5 1652 1 1 5 TYR OH O -15.041 10.249 1.898 1.00 . A A . 5 TYR OH 1 1 5 1653 1 1 6 SER C C -9.001 1.500 2.408 1.00 . A A . 6 SER C 1 1 5 1654 1 1 6 SER CA C -10.445 1.155 2.783 1.00 . A A . 6 SER CA 1 1 5 1655 1 1 6 SER CB C -11.079 0.278 1.703 1.00 . A A . 6 SER CB 1 1 5 1656 1 1 6 SER H H -11.606 2.478 3.897 1.00 . A A . 6 SER H 1 1 5 1657 1 1 6 SER HA H -10.477 0.634 3.740 1.00 . A A . 6 SER HA 1 1 5 1658 1 1 6 SER HB3 H -11.335 0.893 0.840 1.00 . A A . 6 SER HB3 1 1 5 1659 1 1 6 SER HG H -10.170 -0.818 0.295 1.00 . A A . 6 SER HG 1 1 5 1660 1 1 6 SER N N -11.211 2.374 2.984 1.00 . A A . 6 SER N 1 1 5 1661 1 1 6 SER O O -8.714 2.625 2.004 1.00 . A A . 6 SER O 1 1 5 1662 1 1 6 SER OG O -10.211 -0.777 1.294 1.00 . A A . 6 SER OG 1 1 5 1663 1 1 7 LEU C C -6.344 -0.234 1.083 1.00 . A A . 7 LEU C 1 1 5 1664 1 1 7 LEU CA C -6.728 0.694 2.236 1.00 . A A . 7 LEU CA 1 1 5 1665 1 1 7 LEU CB C -5.866 0.509 3.487 1.00 . A A . 7 LEU CB 1 1 5 1666 1 1 7 LEU CD1 C -5.438 0.954 5.933 1.00 . A A . 7 LEU CD1 1 1 5 1667 1 1 7 LEU CD2 C -6.170 2.840 4.403 1.00 . A A . 7 LEU CD2 1 1 5 1668 1 1 7 LEU CG C -6.266 1.344 4.707 1.00 . A A . 7 LEU CG 1 1 5 1669 1 1 7 LEU H H -8.376 -0.402 2.884 1.00 . A A . 7 LEU H 1 1 5 1670 1 1 7 LEU HA H -6.600 1.725 1.907 1.00 . A A . 7 LEU HA 1 1 5 1671 1 1 7 LEU HB3 H -4.834 0.748 3.231 1.00 . A A . 7 LEU HB3 1 1 5 1672 1 1 7 LEU HD11 H -5.479 -0.127 6.070 1.00 . A A . 7 LEU HD11 1 1 5 1673 1 1 7 LEU HD12 H -4.402 1.261 5.784 1.00 . A A . 7 LEU HD12 1 1 5 1674 1 1 7 LEU HD13 H -5.840 1.449 6.816 1.00 . A A . 7 LEU HD13 1 1 5 1675 1 1 7 LEU HD21 H -5.179 3.068 4.010 1.00 . A A . 7 LEU HD21 1 1 5 1676 1 1 7 LEU HD22 H -6.925 3.109 3.663 1.00 . A A . 7 LEU HD22 1 1 5 1677 1 1 7 LEU HD23 H -6.339 3.408 5.317 1.00 . A A . 7 LEU HD23 1 1 5 1678 1 1 7 LEU HG H -7.308 1.128 4.941 1.00 . A A . 7 LEU HG 1 1 5 1679 1 1 7 LEU N N -8.134 0.511 2.555 1.00 . A A . 7 LEU N 1 1 5 1680 1 1 7 LEU O O -5.945 0.228 0.015 1.00 . A A . 7 LEU O 1 1 5 1681 1 1 8 GLN C C -7.053 -3.754 0.492 1.00 . A A . 8 GLN C 1 1 5 1682 1 1 8 GLN CA C -6.154 -2.526 0.333 1.00 . A A . 8 GLN CA 1 1 5 1683 1 1 8 GLN CB C -4.676 -2.915 0.406 1.00 . A A . 8 GLN CB 1 1 5 1684 1 1 8 GLN CD C -4.257 -2.579 2.871 1.00 . A A . 8 GLN CD 1 1 5 1685 1 1 8 GLN CG C -4.356 -3.601 1.737 1.00 . A A . 8 GLN CG 1 1 5 1686 1 1 8 GLN H H -6.807 -1.896 2.207 1.00 . A A . 8 GLN H 1 1 5 1687 1 1 8 GLN HA H -6.348 -2.046 -0.627 1.00 . A A . 8 GLN HA 1 1 5 1688 1 1 8 GLN HB3 H -4.056 -2.026 0.293 1.00 . A A . 8 GLN HB3 1 1 5 1689 1 1 8 GLN HE21 H -5.587 -3.686 3.921 1.00 . A A . 8 GLN HE21 1 1 5 1690 1 1 8 GLN HE22 H -5.024 -2.254 4.716 1.00 . A A . 8 GLN HE22 1 1 5 1691 1 1 8 GLN HG3 H -3.416 -4.147 1.651 1.00 . A A . 8 GLN HG3 1 1 5 1692 1 1 8 GLN N N -6.481 -1.527 1.337 1.00 . A A . 8 GLN N 1 1 5 1693 1 1 8 GLN NE2 N -5.020 -2.864 3.923 1.00 . A A . 8 GLN NE2 1 1 5 1694 1 1 8 GLN O O -7.605 -3.987 1.566 1.00 . A A . 8 GLN O 1 1 5 1695 1 1 8 GLN OE1 O -3.537 -1.597 2.796 1.00 . A A . 8 GLN OE1 1 1 5 1696 1 1 9 MET C C -7.659 -6.604 -1.777 1.00 . A A . 9 MET C 1 1 5 1697 1 1 9 MET CA C -7.994 -5.704 -0.586 1.00 . A A . 9 MET CA 1 1 5 1698 1 1 9 MET CB C -9.471 -5.309 -0.643 1.00 . A A . 9 MET CB 1 1 5 1699 1 1 9 MET CE C -11.678 -5.751 2.729 1.00 . A A . 9 MET CE 1 1 5 1700 1 1 9 MET CG C -9.989 -4.922 0.744 1.00 . A A . 9 MET CG 1 1 5 1701 1 1 9 MET H H -6.719 -4.308 -1.461 1.00 . A A . 9 MET H 1 1 5 1702 1 1 9 MET HA H -7.755 -6.217 0.345 1.00 . A A . 9 MET HA 1 1 5 1703 1 1 9 MET HB3 H -10.058 -6.139 -1.036 1.00 . A A . 9 MET HB3 1 1 5 1704 1 1 9 MET HE1 H -11.094 -6.635 2.985 1.00 . A A . 9 MET HE1 1 1 5 1705 1 1 9 MET HE2 H -11.245 -4.877 3.216 1.00 . A A . 9 MET HE2 1 1 5 1706 1 1 9 MET HE3 H -12.705 -5.883 3.067 1.00 . A A . 9 MET HE3 1 1 5 1707 1 1 9 MET HG3 H -9.962 -3.839 0.862 1.00 . A A . 9 MET HG3 1 1 5 1708 1 1 9 MET N N -7.171 -4.506 -0.592 1.00 . A A . 9 MET N 1 1 5 1709 1 1 9 MET O O -7.417 -7.799 -1.607 1.00 . A A . 9 MET O 1 1 5 1710 1 1 9 MET SD S -11.658 -5.516 0.959 1.00 . A A . 9 MET SD 1 1 5 1711 1 1 10 GLY C C -6.127 -7.623 -3.987 1.00 . A A . 10 GLY C 1 1 5 1712 1 1 10 GLY CA C -7.356 -6.730 -4.172 1.00 . A A . 10 GLY CA 1 1 5 1713 1 1 10 GLY H H -7.855 -5.026 -3.084 1.00 . A A . 10 GLY H 1 1 5 1714 1 1 10 GLY HA2 H -8.214 -7.340 -4.456 1.00 . A A . 10 GLY HA2 1 1 5 1715 1 1 10 GLY HA3 H -7.181 -6.030 -4.989 1.00 . A A . 10 GLY HA3 1 1 5 1716 1 1 10 GLY N N -7.657 -5.998 -2.955 1.00 . A A . 10 GLY N 1 1 5 1717 1 1 10 GLY O O -6.237 -8.739 -3.481 1.00 . A A . 10 GLY O 1 1 5 1718 1 1 11 ALA C C -2.577 -6.929 -4.714 1.00 . A A . 11 ALA C 1 1 5 1719 1 1 11 ALA CA C -3.737 -7.833 -4.292 1.00 . A A . 11 ALA CA 1 1 5 1720 1 1 11 ALA CB C -3.817 -9.108 -5.131 1.00 . A A . 11 ALA CB 1 1 5 1721 1 1 11 ALA H H -4.904 -6.189 -4.816 1.00 . A A . 11 ALA H 1 1 5 1722 1 1 11 ALA HA H -3.609 -8.109 -3.245 1.00 . A A . 11 ALA HA 1 1 5 1723 1 1 11 ALA HB1 H -4.193 -8.866 -6.126 1.00 . A A . 11 ALA HB1 1 1 5 1724 1 1 11 ALA HB2 H -2.825 -9.551 -5.216 1.00 . A A . 11 ALA HB2 1 1 5 1725 1 1 11 ALA HB3 H -4.492 -9.818 -4.652 1.00 . A A . 11 ALA HB3 1 1 5 1726 1 1 11 ALA N N -4.986 -7.098 -4.405 1.00 . A A . 11 ALA N 1 1 5 1727 1 1 11 ALA O O -1.800 -6.477 -3.874 1.00 . A A . 11 ALA O 1 1 5 1728 1 1 12 THR C C -1.195 -4.650 -5.641 1.00 . A A . 12 THR C 1 1 5 1729 1 1 12 THR CA C -1.447 -5.848 -6.558 1.00 . A A . 12 THR CA 1 1 5 1730 1 1 12 THR CB C -1.846 -5.450 -7.981 1.00 . A A . 12 THR CB 1 1 5 1731 1 1 12 THR CG2 C -2.236 -6.656 -8.838 1.00 . A A . 12 THR CG2 1 1 5 1732 1 1 12 THR H H -3.135 -7.060 -6.691 1.00 . A A . 12 THR H 1 1 5 1733 1 1 12 THR HA H -0.523 -6.426 -6.588 1.00 . A A . 12 THR HA 1 1 5 1734 1 1 12 THR HB H -1.057 -4.870 -8.459 1.00 . A A . 12 THR HB 1 1 5 1735 1 1 12 THR HG1 H -3.720 -5.292 -7.296 1.00 . A A . 12 THR HG1 1 1 5 1736 1 1 12 THR HG21 H -1.640 -7.519 -8.542 1.00 . A A . 12 THR HG21 1 1 5 1737 1 1 12 THR HG22 H -3.293 -6.877 -8.693 1.00 . A A . 12 THR HG22 1 1 5 1738 1 1 12 THR HG23 H -2.052 -6.430 -9.888 1.00 . A A . 12 THR HG23 1 1 5 1739 1 1 12 THR N N -2.498 -6.689 -6.014 1.00 . A A . 12 THR N 1 1 5 1740 1 1 12 THR O O -0.051 -4.352 -5.302 1.00 . A A . 12 THR O 1 1 5 1741 1 1 12 THR OG1 O -3.068 -4.735 -7.811 1.00 . A A . 12 THR OG1 1 1 5 1742 1 1 13 ALA C C -1.138 -3.092 -3.315 1.00 . A A . 13 ALA C 1 1 5 1743 1 1 13 ALA CA C -2.195 -2.835 -4.392 1.00 . A A . 13 ALA CA 1 1 5 1744 1 1 13 ALA CB C -3.573 -2.538 -3.797 1.00 . A A . 13 ALA CB 1 1 5 1745 1 1 13 ALA H H -3.211 -4.243 -5.543 1.00 . A A . 13 ALA H 1 1 5 1746 1 1 13 ALA HA H -1.885 -1.985 -4.999 1.00 . A A . 13 ALA HA 1 1 5 1747 1 1 13 ALA HB1 H -4.165 -3.452 -3.777 1.00 . A A . 13 ALA HB1 1 1 5 1748 1 1 13 ALA HB2 H -3.456 -2.159 -2.782 1.00 . A A . 13 ALA HB2 1 1 5 1749 1 1 13 ALA HB3 H -4.078 -1.791 -4.407 1.00 . A A . 13 ALA HB3 1 1 5 1750 1 1 13 ALA N N -2.283 -3.994 -5.263 1.00 . A A . 13 ALA N 1 1 5 1751 1 1 13 ALA O O -0.290 -2.240 -3.059 1.00 . A A . 13 ALA O 1 1 5 1752 1 1 14 ILE C C 1.135 -4.302 -2.121 1.00 . A A . 14 ILE C 1 1 5 1753 1 1 14 ILE CA C -0.287 -4.648 -1.671 1.00 . A A . 14 ILE CA 1 1 5 1754 1 1 14 ILE CB C -0.471 -6.120 -1.294 1.00 . A A . 14 ILE CB 1 1 5 1755 1 1 14 ILE CD1 C -2.303 -7.827 -1.003 1.00 . A A . 14 ILE CD1 1 1 5 1756 1 1 14 ILE CG1 C -1.882 -6.376 -0.762 1.00 . A A . 14 ILE CG1 1 1 5 1757 1 1 14 ILE CG2 C 0.606 -6.570 -0.304 1.00 . A A . 14 ILE CG2 1 1 5 1758 1 1 14 ILE H H -1.918 -4.957 -2.930 1.00 . A A . 14 ILE H 1 1 5 1759 1 1 14 ILE HA H -0.524 -4.056 -0.788 1.00 . A A . 14 ILE HA 1 1 5 1760 1 1 14 ILE HB H -0.352 -6.721 -2.194 1.00 . A A . 14 ILE HB 1 1 5 1761 1 1 14 ILE HD11 H -1.722 -8.243 -1.825 1.00 . A A . 14 ILE HD11 1 1 5 1762 1 1 14 ILE HD12 H -2.123 -8.411 -0.100 1.00 . A A . 14 ILE HD12 1 1 5 1763 1 1 14 ILE HD13 H -3.364 -7.862 -1.252 1.00 . A A . 14 ILE HD13 1 1 5 1764 1 1 14 ILE HG13 H -2.587 -5.704 -1.252 1.00 . A A . 14 ILE HG13 1 1 5 1765 1 1 14 ILE HG21 H 0.458 -7.623 -0.062 1.00 . A A . 14 ILE HG21 1 1 5 1766 1 1 14 ILE HG22 H 1.590 -6.434 -0.751 1.00 . A A . 14 ILE HG22 1 1 5 1767 1 1 14 ILE HG23 H 0.533 -5.975 0.607 1.00 . A A . 14 ILE HG23 1 1 5 1768 1 1 14 ILE N N -1.225 -4.269 -2.714 1.00 . A A . 14 ILE N 1 1 5 1769 1 1 14 ILE O O 1.860 -3.605 -1.414 1.00 . A A . 14 ILE O 1 1 5 1770 1 1 15 LYS C C 3.165 -3.080 -3.669 1.00 . A A . 15 LYS C 1 1 5 1771 1 1 15 LYS CA C 2.811 -4.559 -3.845 1.00 . A A . 15 LYS CA 1 1 5 1772 1 1 15 LYS CB C 2.886 -5.041 -5.295 1.00 . A A . 15 LYS CB 1 1 5 1773 1 1 15 LYS CD C 4.213 -3.128 -6.263 1.00 . A A . 15 LYS CD 1 1 5 1774 1 1 15 LYS CE C 4.951 -2.850 -7.575 1.00 . A A . 15 LYS CE 1 1 5 1775 1 1 15 LYS CG C 4.208 -4.624 -5.944 1.00 . A A . 15 LYS CG 1 1 5 1776 1 1 15 LYS H H 0.894 -5.372 -3.862 1.00 . A A . 15 LYS H 1 1 5 1777 1 1 15 LYS HA H 3.522 -5.153 -3.271 1.00 . A A . 15 LYS HA 1 1 5 1778 1 1 15 LYS HB3 H 2.052 -4.628 -5.862 1.00 . A A . 15 LYS HB3 1 1 5 1779 1 1 15 LYS HD3 H 4.691 -2.580 -5.450 1.00 . A A . 15 LYS HD3 1 1 5 1780 1 1 15 LYS HE3 H 5.845 -3.470 -7.634 1.00 . A A . 15 LYS HE3 1 1 5 1781 1 1 15 LYS HG3 H 4.363 -5.195 -6.859 1.00 . A A . 15 LYS HG3 1 1 5 1782 1 1 15 LYS HZ1 H 4.152 -2.383 -9.397 1.00 . A A . 15 LYS HZ1 1 1 5 1783 1 1 15 LYS HZ2 H 4.344 -3.987 -9.160 1.00 . A A . 15 LYS HZ2 1 1 5 1784 1 1 15 LYS HZ3 H 3.123 -3.193 -8.422 1.00 . A A . 15 LYS HZ3 1 1 5 1785 1 1 15 LYS N N 1.491 -4.805 -3.294 1.00 . A A . 15 LYS N 1 1 5 1786 1 1 15 LYS NZ N 4.071 -3.125 -8.732 1.00 . A A . 15 LYS NZ 1 1 5 1787 1 1 15 LYS O O 4.284 -2.746 -3.285 1.00 . A A . 15 LYS O 1 1 5 1788 1 1 16 GLN C C 2.828 -0.440 -2.420 1.00 . A A . 16 GLN C 1 1 5 1789 1 1 16 GLN CA C 2.380 -0.798 -3.839 1.00 . A A . 16 GLN CA 1 1 5 1790 1 1 16 GLN CB C 1.107 -0.040 -4.220 1.00 . A A . 16 GLN CB 1 1 5 1791 1 1 16 GLN CD C -0.457 0.486 -6.127 1.00 . A A . 16 GLN CD 1 1 5 1792 1 1 16 GLN CG C 0.586 -0.494 -5.585 1.00 . A A . 16 GLN CG 1 1 5 1793 1 1 16 GLN H H 1.279 -2.513 -4.271 1.00 . A A . 16 GLN H 1 1 5 1794 1 1 16 GLN HA H 3.170 -0.552 -4.549 1.00 . A A . 16 GLN HA 1 1 5 1795 1 1 16 GLN HB3 H 1.311 1.031 -4.243 1.00 . A A . 16 GLN HB3 1 1 5 1796 1 1 16 GLN HE21 H -1.338 -1.061 -7.092 1.00 . A A . 16 GLN HE21 1 1 5 1797 1 1 16 GLN HE22 H -2.099 0.480 -7.312 1.00 . A A . 16 GLN HE22 1 1 5 1798 1 1 16 GLN HG3 H 0.147 -1.488 -5.497 1.00 . A A . 16 GLN HG3 1 1 5 1799 1 1 16 GLN N N 2.187 -2.233 -3.960 1.00 . A A . 16 GLN N 1 1 5 1800 1 1 16 GLN NE2 N -1.374 -0.079 -6.908 1.00 . A A . 16 GLN NE2 1 1 5 1801 1 1 16 GLN O O 3.716 0.391 -2.237 1.00 . A A . 16 GLN O 1 1 5 1802 1 1 16 GLN OE1 O -0.431 1.674 -5.855 1.00 . A A . 16 GLN OE1 1 1 5 1803 1 1 17 VAL C C 4.015 -1.046 0.159 1.00 . A A . 17 VAL C 1 1 5 1804 1 1 17 VAL CA C 2.513 -0.845 -0.056 1.00 . A A . 17 VAL CA 1 1 5 1805 1 1 17 VAL CB C 1.656 -1.742 0.839 1.00 . A A . 17 VAL CB 1 1 5 1806 1 1 17 VAL CG1 C 2.267 -3.139 0.962 1.00 . A A . 17 VAL CG1 1 1 5 1807 1 1 17 VAL CG2 C 1.455 -1.107 2.218 1.00 . A A . 17 VAL CG2 1 1 5 1808 1 1 17 VAL H H 1.470 -1.759 -1.611 1.00 . A A . 17 VAL H 1 1 5 1809 1 1 17 VAL HA H 2.263 0.192 0.165 1.00 . A A . 17 VAL HA 1 1 5 1810 1 1 17 VAL HB H 0.677 -1.844 0.372 1.00 . A A . 17 VAL HB 1 1 5 1811 1 1 17 VAL HG11 H 2.624 -3.291 1.981 1.00 . A A . 17 VAL HG11 1 1 5 1812 1 1 17 VAL HG12 H 1.511 -3.888 0.727 1.00 . A A . 17 VAL HG12 1 1 5 1813 1 1 17 VAL HG13 H 3.101 -3.233 0.267 1.00 . A A . 17 VAL HG13 1 1 5 1814 1 1 17 VAL HG21 H 0.835 -1.761 2.831 1.00 . A A . 17 VAL HG21 1 1 5 1815 1 1 17 VAL HG22 H 2.424 -0.970 2.699 1.00 . A A . 17 VAL HG22 1 1 5 1816 1 1 17 VAL HG23 H 0.964 -0.140 2.105 1.00 . A A . 17 VAL HG23 1 1 5 1817 1 1 17 VAL N N 2.192 -1.085 -1.453 1.00 . A A . 17 VAL N 1 1 5 1818 1 1 17 VAL O O 4.625 -0.360 0.976 1.00 . A A . 17 VAL O 1 1 5 1819 1 1 18 LYS C C 6.792 -1.073 -0.949 1.00 . A A . 18 LYS C 1 1 5 1820 1 1 18 LYS CA C 5.985 -2.289 -0.492 1.00 . A A . 18 LYS CA 1 1 5 1821 1 1 18 LYS CB C 6.316 -3.571 -1.259 1.00 . A A . 18 LYS CB 1 1 5 1822 1 1 18 LYS CD C 7.297 -2.774 -3.442 1.00 . A A . 18 LYS CD 1 1 5 1823 1 1 18 LYS CE C 7.118 -3.849 -4.515 1.00 . A A . 18 LYS CE 1 1 5 1824 1 1 18 LYS CG C 7.596 -3.403 -2.080 1.00 . A A . 18 LYS CG 1 1 5 1825 1 1 18 LYS H H 4.062 -2.543 -1.253 1.00 . A A . 18 LYS H 1 1 5 1826 1 1 18 LYS HA H 6.207 -2.476 0.558 1.00 . A A . 18 LYS HA 1 1 5 1827 1 1 18 LYS HB3 H 5.488 -3.828 -1.920 1.00 . A A . 18 LYS HB3 1 1 5 1828 1 1 18 LYS HD3 H 8.109 -2.104 -3.723 1.00 . A A . 18 LYS HD3 1 1 5 1829 1 1 18 LYS HE3 H 6.473 -3.475 -5.310 1.00 . A A . 18 LYS HE3 1 1 5 1830 1 1 18 LYS HG3 H 8.072 -4.374 -2.221 1.00 . A A . 18 LYS HG3 1 1 5 1831 1 1 18 LYS HZ1 H 8.801 -3.485 -5.616 1.00 . A A . 18 LYS HZ1 1 1 5 1832 1 1 18 LYS HZ2 H 9.060 -4.461 -4.334 1.00 . A A . 18 LYS HZ2 1 1 5 1833 1 1 18 LYS HZ3 H 8.314 -5.043 -5.665 1.00 . A A . 18 LYS HZ3 1 1 5 1834 1 1 18 LYS N N 4.566 -1.990 -0.590 1.00 . A A . 18 LYS N 1 1 5 1835 1 1 18 LYS NZ N 8.430 -4.241 -5.078 1.00 . A A . 18 LYS NZ 1 1 5 1836 1 1 18 LYS O O 7.842 -0.772 -0.384 1.00 . A A . 18 LYS O 1 1 5 1837 1 1 19 LYS C C 6.888 1.895 -1.470 1.00 . A A . 19 LYS C 1 1 5 1838 1 1 19 LYS CA C 6.929 0.771 -2.508 1.00 . A A . 19 LYS CA 1 1 5 1839 1 1 19 LYS CB C 6.317 1.157 -3.857 1.00 . A A . 19 LYS CB 1 1 5 1840 1 1 19 LYS CD C 4.875 3.101 -3.148 1.00 . A A . 19 LYS CD 1 1 5 1841 1 1 19 LYS CE C 3.682 3.361 -4.070 1.00 . A A . 19 LYS CE 1 1 5 1842 1 1 19 LYS CG C 6.104 2.670 -3.950 1.00 . A A . 19 LYS CG 1 1 5 1843 1 1 19 LYS H H 5.415 -0.657 -2.422 1.00 . A A . 19 LYS H 1 1 5 1844 1 1 19 LYS HA H 7.971 0.507 -2.691 1.00 . A A . 19 LYS HA 1 1 5 1845 1 1 19 LYS HB3 H 5.364 0.644 -3.987 1.00 . A A . 19 LYS HB3 1 1 5 1846 1 1 19 LYS HD3 H 5.104 4.003 -2.580 1.00 . A A . 19 LYS HD3 1 1 5 1847 1 1 19 LYS HE3 H 3.509 2.491 -4.704 1.00 . A A . 19 LYS HE3 1 1 5 1848 1 1 19 LYS HG3 H 5.983 2.960 -4.992 1.00 . A A . 19 LYS HG3 1 1 5 1849 1 1 19 LYS HZ1 H 2.731 3.928 -2.352 1.00 . A A . 19 LYS HZ1 1 1 5 1850 1 1 19 LYS HZ2 H 1.955 4.395 -3.712 1.00 . A A . 19 LYS HZ2 1 1 5 1851 1 1 19 LYS HZ3 H 1.894 2.835 -3.230 1.00 . A A . 19 LYS HZ3 1 1 5 1852 1 1 19 LYS N N 6.271 -0.406 -1.968 1.00 . A A . 19 LYS N 1 1 5 1853 1 1 19 LYS NZ N 2.467 3.653 -3.277 1.00 . A A . 19 LYS NZ 1 1 5 1854 1 1 19 LYS O O 7.648 2.857 -1.562 1.00 . A A . 19 LYS O 1 1 5 1855 1 1 20 LEU C C 6.776 2.370 1.708 1.00 . A A . 20 LEU C 1 1 5 1856 1 1 20 LEU CA C 5.843 2.722 0.548 1.00 . A A . 20 LEU CA 1 1 5 1857 1 1 20 LEU CB C 4.374 2.851 0.957 1.00 . A A . 20 LEU CB 1 1 5 1858 1 1 20 LEU CD1 C 4.568 3.154 3.453 1.00 . A A . 20 LEU CD1 1 1 5 1859 1 1 20 LEU CD2 C 2.496 2.082 2.455 1.00 . A A . 20 LEU CD2 1 1 5 1860 1 1 20 LEU CG C 4.008 2.280 2.329 1.00 . A A . 20 LEU CG 1 1 5 1861 1 1 20 LEU H H 5.378 0.948 -0.440 1.00 . A A . 20 LEU H 1 1 5 1862 1 1 20 LEU HA H 6.148 3.685 0.139 1.00 . A A . 20 LEU HA 1 1 5 1863 1 1 20 LEU HB3 H 3.762 2.353 0.204 1.00 . A A . 20 LEU HB3 1 1 5 1864 1 1 20 LEU HD11 H 5.287 2.579 4.037 1.00 . A A . 20 LEU HD11 1 1 5 1865 1 1 20 LEU HD12 H 5.062 4.025 3.024 1.00 . A A . 20 LEU HD12 1 1 5 1866 1 1 20 LEU HD13 H 3.753 3.481 4.100 1.00 . A A . 20 LEU HD13 1 1 5 1867 1 1 20 LEU HD21 H 2.078 2.872 3.079 1.00 . A A . 20 LEU HD21 1 1 5 1868 1 1 20 LEU HD22 H 2.041 2.120 1.465 1.00 . A A . 20 LEU HD22 1 1 5 1869 1 1 20 LEU HD23 H 2.294 1.112 2.911 1.00 . A A . 20 LEU HD23 1 1 5 1870 1 1 20 LEU HG H 4.470 1.297 2.425 1.00 . A A . 20 LEU HG 1 1 5 1871 1 1 20 LEU N N 5.993 1.733 -0.506 1.00 . A A . 20 LEU N 1 1 5 1872 1 1 20 LEU O O 7.053 3.210 2.564 1.00 . A A . 20 LEU O 1 1 5 1873 1 1 21 PHE C C 9.513 1.301 2.610 1.00 . A A . 21 PHE C 1 1 5 1874 1 1 21 PHE CA C 8.132 0.655 2.740 1.00 . A A . 21 PHE CA 1 1 5 1875 1 1 21 PHE CB C 8.271 -0.858 2.557 1.00 . A A . 21 PHE CB 1 1 5 1876 1 1 21 PHE CD1 C 6.639 -1.832 4.188 1.00 . A A . 21 PHE CD1 1 1 5 1877 1 1 21 PHE CD2 C 8.933 -2.229 4.545 1.00 . A A . 21 PHE CD2 1 1 5 1878 1 1 21 PHE CE1 C 6.328 -2.586 5.350 1.00 . A A . 21 PHE CE1 1 1 5 1879 1 1 21 PHE CE2 C 8.622 -2.983 5.707 1.00 . A A . 21 PHE CE2 1 1 5 1880 1 1 21 PHE CG C 7.935 -1.670 3.809 1.00 . A A . 21 PHE CG 1 1 5 1881 1 1 21 PHE CZ C 7.326 -3.145 6.086 1.00 . A A . 21 PHE CZ 1 1 5 1882 1 1 21 PHE H H 7.006 0.451 0.999 1.00 . A A . 21 PHE H 1 1 5 1883 1 1 21 PHE HA H 7.692 0.933 3.698 1.00 . A A . 21 PHE HA 1 1 5 1884 1 1 21 PHE HB3 H 9.294 -1.084 2.253 1.00 . A A . 21 PHE HB3 1 1 5 1885 1 1 21 PHE HD1 H 5.840 -1.384 3.598 1.00 . A A . 21 PHE HD1 1 1 5 1886 1 1 21 PHE HD2 H 9.972 -2.099 4.242 1.00 . A A . 21 PHE HD2 1 1 5 1887 1 1 21 PHE HE1 H 5.288 -2.715 5.653 1.00 . A A . 21 PHE HE1 1 1 5 1888 1 1 21 PHE HE2 H 9.422 -3.431 6.297 1.00 . A A . 21 PHE HE2 1 1 5 1889 1 1 21 PHE HZ H 7.086 -3.723 6.977 1.00 . A A . 21 PHE HZ 1 1 5 1890 1 1 21 PHE N N 7.236 1.128 1.700 1.00 . A A . 21 PHE N 1 1 5 1891 1 1 21 PHE O O 10.300 1.289 3.556 1.00 . A A . 21 PHE O 1 1 5 1892 1 1 22 LYS C C 11.398 3.405 2.344 1.00 . A A . 22 LYS C 1 1 5 1893 1 1 22 LYS CA C 11.038 2.499 1.165 1.00 . A A . 22 LYS CA 1 1 5 1894 1 1 22 LYS CB C 10.997 3.227 -0.181 1.00 . A A . 22 LYS CB 1 1 5 1895 1 1 22 LYS CD C 9.020 4.777 0.036 1.00 . A A . 22 LYS CD 1 1 5 1896 1 1 22 LYS CE C 8.572 6.107 0.644 1.00 . A A . 22 LYS CE 1 1 5 1897 1 1 22 LYS CG C 10.546 4.678 -0.005 1.00 . A A . 22 LYS CG 1 1 5 1898 1 1 22 LYS H H 9.121 1.854 0.667 1.00 . A A . 22 LYS H 1 1 5 1899 1 1 22 LYS HA H 11.794 1.718 1.085 1.00 . A A . 22 LYS HA 1 1 5 1900 1 1 22 LYS HB3 H 10.316 2.710 -0.857 1.00 . A A . 22 LYS HB3 1 1 5 1901 1 1 22 LYS HD3 H 8.614 3.951 0.620 1.00 . A A . 22 LYS HD3 1 1 5 1902 1 1 22 LYS HE3 H 9.161 6.323 1.536 1.00 . A A . 22 LYS HE3 1 1 5 1903 1 1 22 LYS HG3 H 10.931 5.284 -0.825 1.00 . A A . 22 LYS HG3 1 1 5 1904 1 1 22 LYS HZ1 H 8.005 7.880 -0.201 1.00 . A A . 22 LYS HZ1 1 1 5 1905 1 1 22 LYS HZ2 H 9.620 7.641 -0.209 1.00 . A A . 22 LYS HZ2 1 1 5 1906 1 1 22 LYS HZ3 H 8.670 6.834 -1.265 1.00 . A A . 22 LYS HZ3 1 1 5 1907 1 1 22 LYS N N 9.766 1.849 1.431 1.00 . A A . 22 LYS N 1 1 5 1908 1 1 22 LYS NZ N 8.729 7.205 -0.337 1.00 . A A . 22 LYS NZ 1 1 5 1909 1 1 22 LYS O O 12.574 3.673 2.589 1.00 . A A . 22 LYS O 1 1 5 1910 1 1 23 LYS C C 10.491 3.894 5.471 1.00 . A A . 23 LYS C 1 1 5 1911 1 1 23 LYS CA C 10.560 4.726 4.189 1.00 . A A . 23 LYS CA 1 1 5 1912 1 1 23 LYS CB C 9.563 5.885 4.154 1.00 . A A . 23 LYS CB 1 1 5 1913 1 1 23 LYS CD C 7.136 6.101 4.804 1.00 . A A . 23 LYS CD 1 1 5 1914 1 1 23 LYS CE C 6.816 7.496 4.262 1.00 . A A . 23 LYS CE 1 1 5 1915 1 1 23 LYS CG C 8.141 5.380 3.903 1.00 . A A . 23 LYS CG 1 1 5 1916 1 1 23 LYS H H 9.413 3.633 2.836 1.00 . A A . 23 LYS H 1 1 5 1917 1 1 23 LYS HA H 11.558 5.155 4.107 1.00 . A A . 23 LYS HA 1 1 5 1918 1 1 23 LYS HB3 H 9.846 6.590 3.371 1.00 . A A . 23 LYS HB3 1 1 5 1919 1 1 23 LYS HD3 H 7.540 6.183 5.813 1.00 . A A . 23 LYS HD3 1 1 5 1920 1 1 23 LYS HE3 H 5.847 7.824 4.636 1.00 . A A . 23 LYS HE3 1 1 5 1921 1 1 23 LYS HG3 H 8.096 4.307 4.086 1.00 . A A . 23 LYS HG3 1 1 5 1922 1 1 23 LYS HZ1 H 8.401 8.076 5.416 1.00 . A A . 23 LYS HZ1 1 1 5 1923 1 1 23 LYS HZ2 H 8.463 8.647 3.886 1.00 . A A . 23 LYS HZ2 1 1 5 1924 1 1 23 LYS HZ3 H 7.434 9.312 4.966 1.00 . A A . 23 LYS HZ3 1 1 5 1925 1 1 23 LYS N N 10.366 3.855 3.041 1.00 . A A . 23 LYS N 1 1 5 1926 1 1 23 LYS NZ N 7.864 8.461 4.665 1.00 . A A . 23 LYS NZ 1 1 5 1927 1 1 23 LYS O O 11.220 4.161 6.427 1.00 . A A . 23 LYS O 1 1 5 1928 1 1 24 TRP C C 10.668 1.126 6.696 1.00 . A A . 24 TRP C 1 1 5 1929 1 1 24 TRP CA C 9.439 2.033 6.601 1.00 . A A . 24 TRP CA 1 1 5 1930 1 1 24 TRP CB C 8.126 1.254 6.507 1.00 . A A . 24 TRP CB 1 1 5 1931 1 1 24 TRP CD1 C 6.815 3.477 6.484 1.00 . A A . 24 TRP CD1 1 1 5 1932 1 1 24 TRP CD2 C 5.510 1.690 6.374 1.00 . A A . 24 TRP CD2 1 1 5 1933 1 1 24 TRP CE2 C 4.691 2.801 6.354 1.00 . A A . 24 TRP CE2 1 1 5 1934 1 1 24 TRP CE3 C 4.980 0.389 6.318 1.00 . A A . 24 TRP CE3 1 1 5 1935 1 1 24 TRP CG C 6.879 2.138 6.458 1.00 . A A . 24 TRP CG 1 1 5 1936 1 1 24 TRP CH2 C 2.745 1.438 6.218 1.00 . A A . 24 TRP CH2 1 1 5 1937 1 1 24 TRP CZ2 C 3.296 2.724 6.277 1.00 . A A . 24 TRP CZ2 1 1 5 1938 1 1 24 TRP CZ3 C 3.583 0.329 6.241 1.00 . A A . 24 TRP CZ3 1 1 5 1939 1 1 24 TRP H H 9.023 2.695 4.670 1.00 . A A . 24 TRP H 1 1 5 1940 1 1 24 TRP HA H 9.371 2.663 7.489 1.00 . A A . 24 TRP HA 1 1 5 1941 1 1 24 TRP HB3 H 8.051 0.584 7.363 1.00 . A A . 24 TRP HB3 1 1 5 1942 1 1 24 TRP HD1 H 7.685 4.131 6.545 1.00 . A A . 24 TRP HD1 1 1 5 1943 1 1 24 TRP HE1 H 5.182 4.962 6.428 1.00 . A A . 24 TRP HE1 1 1 5 1944 1 1 24 TRP HE3 H 5.605 -0.504 6.332 1.00 . A A . 24 TRP HE3 1 1 5 1945 1 1 24 TRP HH2 H 1.665 1.307 6.157 1.00 . A A . 24 TRP HH2 1 1 5 1946 1 1 24 TRP HZ2 H 2.671 3.617 6.262 1.00 . A A . 24 TRP HZ2 1 1 5 1947 1 1 24 TRP HZ3 H 3.121 -0.657 6.193 1.00 . A A . 24 TRP HZ3 1 1 5 1948 1 1 24 TRP N N 9.611 2.905 5.452 1.00 . A A . 24 TRP N 1 1 5 1949 1 1 24 TRP NE1 N 5.510 3.922 6.423 1.00 . A A . 24 TRP NE1 1 1 5 1950 1 1 24 TRP O O 11.496 1.287 7.591 1.00 . A A . 24 TRP O 1 1 5 1951 1 1 25 GLY C C 11.599 -1.940 6.640 1.00 . A A . 25 GLY C 1 1 5 1952 1 1 25 GLY CA C 11.861 -0.741 5.726 1.00 . A A . 25 GLY CA 1 1 5 1953 1 1 25 GLY H H 10.069 0.068 5.035 1.00 . A A . 25 GLY H 1 1 5 1954 1 1 25 GLY HA2 H 12.019 -1.086 4.705 1.00 . A A . 25 GLY HA2 1 1 5 1955 1 1 25 GLY HA3 H 12.774 -0.234 6.037 1.00 . A A . 25 GLY HA3 1 1 5 1956 1 1 25 GLY N N 10.747 0.192 5.760 1.00 . A A . 25 GLY N 1 1 5 1957 1 1 25 GLY O O 10.627 -1.950 7.394 1.00 . A A . 25 GLY O 1 1 5 1958 1 1 26 TRP C C 12.119 -3.693 8.801 1.00 . A A . 26 TRP C 1 1 5 1959 1 1 26 TRP CA C 12.362 -4.122 7.352 1.00 . A A . 26 TRP CA 1 1 5 1960 1 1 26 TRP CB C 13.591 -5.018 7.192 1.00 . A A . 26 TRP CB 1 1 5 1961 1 1 26 TRP CD1 C 12.614 -6.221 5.128 1.00 . A A . 26 TRP CD1 1 1 5 1962 1 1 26 TRP CD2 C 14.011 -7.483 6.296 1.00 . A A . 26 TRP CD2 1 1 5 1963 1 1 26 TRP CE2 C 13.565 -8.238 5.231 1.00 . A A . 26 TRP CE2 1 1 5 1964 1 1 26 TRP CE3 C 14.919 -8.005 7.234 1.00 . A A . 26 TRP CE3 1 1 5 1965 1 1 26 TRP CG C 13.391 -6.182 6.220 1.00 . A A . 26 TRP CG 1 1 5 1966 1 1 26 TRP CH2 C 14.877 -10.098 5.925 1.00 . A A . 26 TRP CH2 1 1 5 1967 1 1 26 TRP CZ2 C 13.972 -9.557 5.003 1.00 . A A . 26 TRP CZ2 1 1 5 1968 1 1 26 TRP CZ3 C 15.316 -9.325 6.992 1.00 . A A . 26 TRP CZ3 1 1 5 1969 1 1 26 TRP H H 13.272 -2.905 5.928 1.00 . A A . 26 TRP H 1 1 5 1970 1 1 26 TRP HA H 11.506 -4.687 6.982 1.00 . A A . 26 TRP HA 1 1 5 1971 1 1 26 TRP HB3 H 13.867 -5.417 8.169 1.00 . A A . 26 TRP HB3 1 1 5 1972 1 1 26 TRP HD1 H 12.000 -5.389 4.782 1.00 . A A . 26 TRP HD1 1 1 5 1973 1 1 26 TRP HE1 H 12.158 -7.740 3.592 1.00 . A A . 26 TRP HE1 1 1 5 1974 1 1 26 TRP HE3 H 15.286 -7.429 8.083 1.00 . A A . 26 TRP HE3 1 1 5 1975 1 1 26 TRP HH2 H 15.235 -11.121 5.805 1.00 . A A . 26 TRP HH2 1 1 5 1976 1 1 26 TRP HZ2 H 13.605 -10.134 4.153 1.00 . A A . 26 TRP HZ2 1 1 5 1977 1 1 26 TRP HZ3 H 16.021 -9.778 7.690 1.00 . A A . 26 TRP HZ3 1 1 5 1978 1 1 26 TRP N N 12.484 -2.921 6.544 1.00 . A A . 26 TRP N 1 1 5 1979 1 1 26 TRP NE1 N 12.688 -7.446 4.498 1.00 . A A . 26 TRP NE1 1 1 5 1980 1 1 26 TRP O O 12.868 -4.074 9.699 1.00 . A A . 26 TRP O 1 1 6 1981 1 1 1 LYS C C -7.625 10.457 5.104 1.00 . A A . 1 LYS C 1 1 6 1982 1 1 1 LYS CA C -6.465 9.520 5.444 1.00 . A A . 1 LYS CA 1 1 6 1983 1 1 1 LYS CB C -5.172 9.842 4.692 1.00 . A A . 1 LYS CB 1 1 6 1984 1 1 1 LYS CD C -4.291 12.178 5.050 1.00 . A A . 1 LYS CD 1 1 6 1985 1 1 1 LYS CE C -3.506 13.092 5.991 1.00 . A A . 1 LYS CE 1 1 6 1986 1 1 1 LYS CG C -4.253 10.728 5.535 1.00 . A A . 1 LYS CG 1 1 6 1987 1 1 1 LYS H1 H -6.381 7.689 4.453 1.00 . A A . 1 LYS H1 1 1 6 1988 1 1 1 LYS HA H -6.248 9.609 6.509 1.00 . A A . 1 LYS HA 1 1 6 1989 1 1 1 LYS HB3 H -5.409 10.346 3.754 1.00 . A A . 1 LYS HB3 1 1 6 1990 1 1 1 LYS HD3 H -5.326 12.517 4.987 1.00 . A A . 1 LYS HD3 1 1 6 1991 1 1 1 LYS HE3 H -3.902 13.010 7.003 1.00 . A A . 1 LYS HE3 1 1 6 1992 1 1 1 LYS HG3 H -3.231 10.350 5.484 1.00 . A A . 1 LYS HG3 1 1 6 1993 1 1 1 LYS HZ1 H -1.897 12.066 5.260 1.00 . A A . 1 LYS HZ1 1 1 6 1994 1 1 1 LYS HZ2 H -1.522 13.553 5.820 1.00 . A A . 1 LYS HZ2 1 1 6 1995 1 1 1 LYS HZ3 H -1.820 12.337 6.869 1.00 . A A . 1 LYS HZ3 1 1 6 1996 1 1 1 LYS N N -6.869 8.146 5.197 1.00 . A A . 1 LYS N 1 1 6 1997 1 1 1 LYS NZ N -2.070 12.734 5.984 1.00 . A A . 1 LYS NZ 1 1 6 1998 1 1 1 LYS O O -8.133 11.162 5.975 1.00 . A A . 1 LYS O 1 1 6 1999 1 1 2 SER C C -9.744 10.655 2.130 1.00 . A A . 2 SER C 1 1 6 2000 1 1 2 SER CA C -9.099 11.276 3.370 1.00 . A A . 2 SER CA 1 1 6 2001 1 1 2 SER CB C -8.610 12.693 3.061 1.00 . A A . 2 SER CB 1 1 6 2002 1 1 2 SER H H -7.589 9.861 3.134 1.00 . A A . 2 SER H 1 1 6 2003 1 1 2 SER HA H -9.810 11.310 4.195 1.00 . A A . 2 SER HA 1 1 6 2004 1 1 2 SER HB3 H -9.277 13.156 2.335 1.00 . A A . 2 SER HB3 1 1 6 2005 1 1 2 SER HG H -8.605 12.929 5.049 1.00 . A A . 2 SER HG 1 1 6 2006 1 1 2 SER N N -8.008 10.436 3.837 1.00 . A A . 2 SER N 1 1 6 2007 1 1 2 SER O O -9.167 9.767 1.504 1.00 . A A . 2 SER O 1 1 6 2008 1 1 2 SER OG O -8.547 13.503 4.232 1.00 . A A . 2 SER OG 1 1 6 2009 1 1 3 SER C C -12.140 9.220 0.915 1.00 . A A . 3 SER C 1 1 6 2010 1 1 3 SER CA C -11.663 10.651 0.657 1.00 . A A . 3 SER CA 1 1 6 2011 1 1 3 SER CB C -10.800 10.703 -0.605 1.00 . A A . 3 SER CB 1 1 6 2012 1 1 3 SER H H -11.395 11.869 2.325 1.00 . A A . 3 SER H 1 1 6 2013 1 1 3 SER HA H -12.513 11.323 0.543 1.00 . A A . 3 SER HA 1 1 6 2014 1 1 3 SER HB3 H -10.015 9.951 -0.539 1.00 . A A . 3 SER HB3 1 1 6 2015 1 1 3 SER HG H -11.849 11.363 -2.176 1.00 . A A . 3 SER HG 1 1 6 2016 1 1 3 SER N N -10.933 11.147 1.812 1.00 . A A . 3 SER N 1 1 6 2017 1 1 3 SER O O -13.342 8.959 0.947 1.00 . A A . 3 SER O 1 1 6 2018 1 1 3 SER OG O -11.567 10.487 -1.786 1.00 . A A . 3 SER OG 1 1 6 2019 1 1 4 ALA C C -10.622 6.430 2.506 1.00 . A A . 4 ALA C 1 1 6 2020 1 1 4 ALA CA C -11.480 6.934 1.344 1.00 . A A . 4 ALA CA 1 1 6 2021 1 1 4 ALA CB C -11.263 6.122 0.065 1.00 . A A . 4 ALA CB 1 1 6 2022 1 1 4 ALA H H -10.199 8.551 1.063 1.00 . A A . 4 ALA H 1 1 6 2023 1 1 4 ALA HA H -12.532 6.870 1.625 1.00 . A A . 4 ALA HA 1 1 6 2024 1 1 4 ALA HB1 H -11.562 5.088 0.235 1.00 . A A . 4 ALA HB1 1 1 6 2025 1 1 4 ALA HB2 H -11.864 6.546 -0.739 1.00 . A A . 4 ALA HB2 1 1 6 2026 1 1 4 ALA HB3 H -10.210 6.156 -0.212 1.00 . A A . 4 ALA HB3 1 1 6 2027 1 1 4 ALA N N -11.174 8.331 1.090 1.00 . A A . 4 ALA N 1 1 6 2028 1 1 4 ALA O O -9.440 6.756 2.595 1.00 . A A . 4 ALA O 1 1 6 2029 1 1 5 TYR C C -10.694 3.569 4.563 1.00 . A A . 5 TYR C 1 1 6 2030 1 1 5 TYR CA C -10.559 5.092 4.520 1.00 . A A . 5 TYR CA 1 1 6 2031 1 1 5 TYR CB C -11.246 5.688 5.750 1.00 . A A . 5 TYR CB 1 1 6 2032 1 1 5 TYR CD1 C -12.241 7.885 5.015 1.00 . A A . 5 TYR CD1 1 1 6 2033 1 1 5 TYR CD2 C -10.377 7.930 6.510 1.00 . A A . 5 TYR CD2 1 1 6 2034 1 1 5 TYR CE1 C -12.282 9.325 5.023 1.00 . A A . 5 TYR CE1 1 1 6 2035 1 1 5 TYR CE2 C -10.417 9.370 6.517 1.00 . A A . 5 TYR CE2 1 1 6 2036 1 1 5 TYR CG C -11.290 7.218 5.758 1.00 . A A . 5 TYR CG 1 1 6 2037 1 1 5 TYR CZ C -11.369 9.996 5.774 1.00 . A A . 5 TYR CZ 1 1 6 2038 1 1 5 TYR H H -12.212 5.383 3.288 1.00 . A A . 5 TYR H 1 1 6 2039 1 1 5 TYR HA H -9.504 5.354 4.436 1.00 . A A . 5 TYR HA 1 1 6 2040 1 1 5 TYR HB3 H -10.729 5.345 6.646 1.00 . A A . 5 TYR HB3 1 1 6 2041 1 1 5 TYR HD1 H -12.963 7.323 4.421 1.00 . A A . 5 TYR HD1 1 1 6 2042 1 1 5 TYR HD2 H -9.624 7.402 7.096 1.00 . A A . 5 TYR HD2 1 1 6 2043 1 1 5 TYR HE1 H -13.029 9.864 4.440 1.00 . A A . 5 TYR HE1 1 1 6 2044 1 1 5 TYR HE2 H -9.702 9.943 7.106 1.00 . A A . 5 TYR HE2 1 1 6 2045 1 1 5 TYR HH H -11.797 11.681 6.642 1.00 . A A . 5 TYR HH 1 1 6 2046 1 1 5 TYR N N -11.251 5.643 3.367 1.00 . A A . 5 TYR N 1 1 6 2047 1 1 5 TYR O O -11.205 3.015 5.536 1.00 . A A . 5 TYR O 1 1 6 2048 1 1 5 TYR OH O -11.407 11.355 5.781 1.00 . A A . 5 TYR OH 1 1 6 2049 1 1 6 SER C C -8.889 0.916 3.168 1.00 . A A . 6 SER C 1 1 6 2050 1 1 6 SER CA C -10.289 1.486 3.402 1.00 . A A . 6 SER CA 1 1 6 2051 1 1 6 SER CB C -11.234 1.048 2.281 1.00 . A A . 6 SER CB 1 1 6 2052 1 1 6 SER H H -9.812 3.393 2.712 1.00 . A A . 6 SER H 1 1 6 2053 1 1 6 SER HA H -10.684 1.150 4.361 1.00 . A A . 6 SER HA 1 1 6 2054 1 1 6 SER HB3 H -11.571 0.029 2.468 1.00 . A A . 6 SER HB3 1 1 6 2055 1 1 6 SER HG H -13.173 1.379 1.914 1.00 . A A . 6 SER HG 1 1 6 2056 1 1 6 SER N N -10.227 2.935 3.498 1.00 . A A . 6 SER N 1 1 6 2057 1 1 6 SER O O -8.093 1.498 2.432 1.00 . A A . 6 SER O 1 1 6 2058 1 1 6 SER OG O -12.364 1.909 2.169 1.00 . A A . 6 SER OG 1 1 6 2059 1 1 7 LEU C C -7.074 -1.177 2.206 1.00 . A A . 7 LEU C 1 1 6 2060 1 1 7 LEU CA C -7.339 -0.869 3.680 1.00 . A A . 7 LEU CA 1 1 6 2061 1 1 7 LEU CB C -7.270 -2.099 4.588 1.00 . A A . 7 LEU CB 1 1 6 2062 1 1 7 LEU CD1 C -5.557 -1.191 6.201 1.00 . A A . 7 LEU CD1 1 1 6 2063 1 1 7 LEU CD2 C -8.032 -0.989 6.720 1.00 . A A . 7 LEU CD2 1 1 6 2064 1 1 7 LEU CG C -6.940 -1.831 6.057 1.00 . A A . 7 LEU CG 1 1 6 2065 1 1 7 LEU H H -9.283 -0.680 4.406 1.00 . A A . 7 LEU H 1 1 6 2066 1 1 7 LEU HA H -6.581 -0.168 4.029 1.00 . A A . 7 LEU HA 1 1 6 2067 1 1 7 LEU HB3 H -6.519 -2.780 4.186 1.00 . A A . 7 LEU HB3 1 1 6 2068 1 1 7 LEU HD11 H -5.301 -1.112 7.258 1.00 . A A . 7 LEU HD11 1 1 6 2069 1 1 7 LEU HD12 H -4.816 -1.809 5.693 1.00 . A A . 7 LEU HD12 1 1 6 2070 1 1 7 LEU HD13 H -5.568 -0.197 5.754 1.00 . A A . 7 LEU HD13 1 1 6 2071 1 1 7 LEU HD21 H -9.010 -1.351 6.406 1.00 . A A . 7 LEU HD21 1 1 6 2072 1 1 7 LEU HD22 H -7.945 -1.068 7.803 1.00 . A A . 7 LEU HD22 1 1 6 2073 1 1 7 LEU HD23 H -7.918 0.054 6.422 1.00 . A A . 7 LEU HD23 1 1 6 2074 1 1 7 LEU HG H -6.908 -2.787 6.580 1.00 . A A . 7 LEU HG 1 1 6 2075 1 1 7 LEU N N -8.630 -0.214 3.809 1.00 . A A . 7 LEU N 1 1 6 2076 1 1 7 LEU O O -6.771 -0.276 1.424 1.00 . A A . 7 LEU O 1 1 6 2077 1 1 8 GLN C C -8.070 -3.864 0.069 1.00 . A A . 8 GLN C 1 1 6 2078 1 1 8 GLN CA C -6.970 -2.890 0.502 1.00 . A A . 8 GLN CA 1 1 6 2079 1 1 8 GLN CB C -5.586 -3.523 0.349 1.00 . A A . 8 GLN CB 1 1 6 2080 1 1 8 GLN CD C -4.018 -1.547 0.312 1.00 . A A . 8 GLN CD 1 1 6 2081 1 1 8 GLN CG C -4.678 -2.650 -0.520 1.00 . A A . 8 GLN CG 1 1 6 2082 1 1 8 GLN H H -7.440 -3.179 2.510 1.00 . A A . 8 GLN H 1 1 6 2083 1 1 8 GLN HA H -7.020 -1.985 -0.104 1.00 . A A . 8 GLN HA 1 1 6 2084 1 1 8 GLN HB3 H -5.682 -4.512 -0.100 1.00 . A A . 8 GLN HB3 1 1 6 2085 1 1 8 GLN HE21 H -4.647 -0.199 -1.061 1.00 . A A . 8 GLN HE21 1 1 6 2086 1 1 8 GLN HE22 H -3.754 0.460 0.268 1.00 . A A . 8 GLN HE22 1 1 6 2087 1 1 8 GLN HG3 H -5.259 -2.202 -1.326 1.00 . A A . 8 GLN HG3 1 1 6 2088 1 1 8 GLN N N -7.194 -2.452 1.869 1.00 . A A . 8 GLN N 1 1 6 2089 1 1 8 GLN NE2 N -4.151 -0.328 -0.203 1.00 . A A . 8 GLN NE2 1 1 6 2090 1 1 8 GLN O O -8.819 -4.369 0.904 1.00 . A A . 8 GLN O 1 1 6 2091 1 1 8 GLN OE1 O -3.429 -1.788 1.352 1.00 . A A . 8 GLN OE1 1 1 6 2092 1 1 9 MET C C -8.560 -5.772 -2.981 1.00 . A A . 9 MET C 1 1 6 2093 1 1 9 MET CA C -9.123 -5.002 -1.786 1.00 . A A . 9 MET CA 1 1 6 2094 1 1 9 MET CB C -10.351 -4.203 -2.226 1.00 . A A . 9 MET CB 1 1 6 2095 1 1 9 MET CE C -10.975 -0.812 -1.948 1.00 . A A . 9 MET CE 1 1 6 2096 1 1 9 MET CG C -9.952 -3.047 -3.147 1.00 . A A . 9 MET CG 1 1 6 2097 1 1 9 MET H H -7.516 -3.682 -1.905 1.00 . A A . 9 MET H 1 1 6 2098 1 1 9 MET HA H -9.369 -5.695 -0.981 1.00 . A A . 9 MET HA 1 1 6 2099 1 1 9 MET HB3 H -10.870 -3.812 -1.351 1.00 . A A . 9 MET HB3 1 1 6 2100 1 1 9 MET HE1 H -11.685 -1.006 -1.144 1.00 . A A . 9 MET HE1 1 1 6 2101 1 1 9 MET HE2 H -9.962 -0.985 -1.587 1.00 . A A . 9 MET HE2 1 1 6 2102 1 1 9 MET HE3 H -11.072 0.223 -2.276 1.00 . A A . 9 MET HE3 1 1 6 2103 1 1 9 MET HG3 H -9.664 -3.433 -4.125 1.00 . A A . 9 MET HG3 1 1 6 2104 1 1 9 MET N N -8.129 -4.097 -1.233 1.00 . A A . 9 MET N 1 1 6 2105 1 1 9 MET O O -8.726 -6.987 -3.075 1.00 . A A . 9 MET O 1 1 6 2106 1 1 9 MET SD S -11.313 -1.905 -3.318 1.00 . A A . 9 MET SD 1 1 6 2107 1 1 10 GLY C C -6.312 -6.726 -4.672 1.00 . A A . 10 GLY C 1 1 6 2108 1 1 10 GLY CA C -7.314 -5.633 -5.051 1.00 . A A . 10 GLY CA 1 1 6 2109 1 1 10 GLY H H -7.774 -4.046 -3.781 1.00 . A A . 10 GLY H 1 1 6 2110 1 1 10 GLY HA2 H -8.100 -6.056 -5.677 1.00 . A A . 10 GLY HA2 1 1 6 2111 1 1 10 GLY HA3 H -6.815 -4.864 -5.640 1.00 . A A . 10 GLY HA3 1 1 6 2112 1 1 10 GLY N N -7.904 -5.034 -3.865 1.00 . A A . 10 GLY N 1 1 6 2113 1 1 10 GLY O O -6.696 -7.867 -4.426 1.00 . A A . 10 GLY O 1 1 6 2114 1 1 11 ALA C C -2.632 -6.647 -4.647 1.00 . A A . 11 ALA C 1 1 6 2115 1 1 11 ALA CA C -3.986 -7.267 -4.294 1.00 . A A . 11 ALA CA 1 1 6 2116 1 1 11 ALA CB C -4.222 -8.598 -5.014 1.00 . A A . 11 ALA CB 1 1 6 2117 1 1 11 ALA H H -4.741 -5.405 -4.840 1.00 . A A . 11 ALA H 1 1 6 2118 1 1 11 ALA HA H -4.029 -7.437 -3.218 1.00 . A A . 11 ALA HA 1 1 6 2119 1 1 11 ALA HB1 H -3.285 -8.946 -5.450 1.00 . A A . 11 ALA HB1 1 1 6 2120 1 1 11 ALA HB2 H -4.587 -9.337 -4.300 1.00 . A A . 11 ALA HB2 1 1 6 2121 1 1 11 ALA HB3 H -4.960 -8.458 -5.802 1.00 . A A . 11 ALA HB3 1 1 6 2122 1 1 11 ALA N N -5.046 -6.336 -4.638 1.00 . A A . 11 ALA N 1 1 6 2123 1 1 11 ALA O O -1.905 -6.194 -3.764 1.00 . A A . 11 ALA O 1 1 6 2124 1 1 12 THR C C -0.735 -4.814 -5.643 1.00 . A A . 12 THR C 1 1 6 2125 1 1 12 THR CA C -1.083 -6.087 -6.418 1.00 . A A . 12 THR CA 1 1 6 2126 1 1 12 THR CB C -1.212 -5.865 -7.926 1.00 . A A . 12 THR CB 1 1 6 2127 1 1 12 THR CG2 C -2.462 -5.064 -8.295 1.00 . A A . 12 THR CG2 1 1 6 2128 1 1 12 THR H H -2.934 -7.016 -6.649 1.00 . A A . 12 THR H 1 1 6 2129 1 1 12 THR HA H -0.289 -6.808 -6.223 1.00 . A A . 12 THR HA 1 1 6 2130 1 1 12 THR HB H -1.183 -6.813 -8.463 1.00 . A A . 12 THR HB 1 1 6 2131 1 1 12 THR HG1 H 0.134 -5.105 -9.196 1.00 . A A . 12 THR HG1 1 1 6 2132 1 1 12 THR HG21 H -2.321 -4.020 -8.019 1.00 . A A . 12 THR HG21 1 1 6 2133 1 1 12 THR HG22 H -2.635 -5.136 -9.369 1.00 . A A . 12 THR HG22 1 1 6 2134 1 1 12 THR HG23 H -3.323 -5.468 -7.761 1.00 . A A . 12 THR HG23 1 1 6 2135 1 1 12 THR N N -2.336 -6.646 -5.938 1.00 . A A . 12 THR N 1 1 6 2136 1 1 12 THR O O 0.382 -4.669 -5.151 1.00 . A A . 12 THR O 1 1 6 2137 1 1 12 THR OG1 O -0.134 -4.988 -8.241 1.00 . A A . 12 THR OG1 1 1 6 2138 1 1 13 ALA C C -0.702 -2.920 -3.587 1.00 . A A . 13 ALA C 1 1 6 2139 1 1 13 ALA CA C -1.525 -2.669 -4.852 1.00 . A A . 13 ALA CA 1 1 6 2140 1 1 13 ALA CB C -2.888 -2.044 -4.548 1.00 . A A . 13 ALA CB 1 1 6 2141 1 1 13 ALA H H -2.620 -4.051 -5.962 1.00 . A A . 13 ALA H 1 1 6 2142 1 1 13 ALA HA H -0.970 -1.999 -5.510 1.00 . A A . 13 ALA HA 1 1 6 2143 1 1 13 ALA HB1 H -3.058 -1.200 -5.215 1.00 . A A . 13 ALA HB1 1 1 6 2144 1 1 13 ALA HB2 H -3.671 -2.788 -4.698 1.00 . A A . 13 ALA HB2 1 1 6 2145 1 1 13 ALA HB3 H -2.907 -1.701 -3.515 1.00 . A A . 13 ALA HB3 1 1 6 2146 1 1 13 ALA N N -1.714 -3.925 -5.559 1.00 . A A . 13 ALA N 1 1 6 2147 1 1 13 ALA O O 0.176 -2.128 -3.247 1.00 . A A . 13 ALA O 1 1 6 2148 1 1 14 ILE C C 1.191 -4.247 -1.924 1.00 . A A . 14 ILE C 1 1 6 2149 1 1 14 ILE CA C -0.317 -4.388 -1.705 1.00 . A A . 14 ILE CA 1 1 6 2150 1 1 14 ILE CB C -0.742 -5.781 -1.239 1.00 . A A . 14 ILE CB 1 1 6 2151 1 1 14 ILE CD1 C -2.735 -7.263 -0.796 1.00 . A A . 14 ILE CD1 1 1 6 2152 1 1 14 ILE CG1 C -2.240 -5.821 -0.926 1.00 . A A . 14 ILE CG1 1 1 6 2153 1 1 14 ILE CG2 C 0.103 -6.246 -0.051 1.00 . A A . 14 ILE CG2 1 1 6 2154 1 1 14 ILE H H -1.731 -4.661 -3.209 1.00 . A A . 14 ILE H 1 1 6 2155 1 1 14 ILE HA H -0.621 -3.683 -0.931 1.00 . A A . 14 ILE HA 1 1 6 2156 1 1 14 ILE HB H -0.565 -6.483 -2.053 1.00 . A A . 14 ILE HB 1 1 6 2157 1 1 14 ILE HD11 H -2.591 -7.784 -1.742 1.00 . A A . 14 ILE HD11 1 1 6 2158 1 1 14 ILE HD12 H -2.172 -7.772 -0.013 1.00 . A A . 14 ILE HD12 1 1 6 2159 1 1 14 ILE HD13 H -3.794 -7.262 -0.539 1.00 . A A . 14 ILE HD13 1 1 6 2160 1 1 14 ILE HG13 H -2.793 -5.313 -1.716 1.00 . A A . 14 ILE HG13 1 1 6 2161 1 1 14 ILE HG21 H 1.159 -6.206 -0.319 1.00 . A A . 14 ILE HG21 1 1 6 2162 1 1 14 ILE HG22 H -0.079 -5.592 0.802 1.00 . A A . 14 ILE HG22 1 1 6 2163 1 1 14 ILE HG23 H -0.168 -7.268 0.211 1.00 . A A . 14 ILE HG23 1 1 6 2164 1 1 14 ILE N N -1.016 -4.024 -2.925 1.00 . A A . 14 ILE N 1 1 6 2165 1 1 14 ILE O O 1.875 -3.583 -1.147 1.00 . A A . 14 ILE O 1 1 6 2166 1 1 15 LYS C C 3.566 -3.388 -3.248 1.00 . A A . 15 LYS C 1 1 6 2167 1 1 15 LYS CA C 3.078 -4.837 -3.317 1.00 . A A . 15 LYS CA 1 1 6 2168 1 1 15 LYS CB C 3.334 -5.509 -4.668 1.00 . A A . 15 LYS CB 1 1 6 2169 1 1 15 LYS CD C 4.471 -3.626 -5.901 1.00 . A A . 15 LYS CD 1 1 6 2170 1 1 15 LYS CE C 4.878 -3.396 -7.358 1.00 . A A . 15 LYS CE 1 1 6 2171 1 1 15 LYS CG C 3.218 -4.500 -5.813 1.00 . A A . 15 LYS CG 1 1 6 2172 1 1 15 LYS H H 1.100 -5.421 -3.612 1.00 . A A . 15 LYS H 1 1 6 2173 1 1 15 LYS HA H 3.609 -5.416 -2.563 1.00 . A A . 15 LYS HA 1 1 6 2174 1 1 15 LYS HB3 H 2.617 -6.317 -4.817 1.00 . A A . 15 LYS HB3 1 1 6 2175 1 1 15 LYS HD3 H 5.290 -4.101 -5.361 1.00 . A A . 15 LYS HD3 1 1 6 2176 1 1 15 LYS HE3 H 5.582 -2.566 -7.418 1.00 . A A . 15 LYS HE3 1 1 6 2177 1 1 15 LYS HG3 H 2.341 -3.871 -5.662 1.00 . A A . 15 LYS HG3 1 1 6 2178 1 1 15 LYS HZ1 H 6.454 -4.666 -7.643 1.00 . A A . 15 LYS HZ1 1 1 6 2179 1 1 15 LYS HZ2 H 5.008 -5.423 -7.584 1.00 . A A . 15 LYS HZ2 1 1 6 2180 1 1 15 LYS HZ3 H 5.440 -4.589 -8.920 1.00 . A A . 15 LYS HZ3 1 1 6 2181 1 1 15 LYS N N 1.664 -4.883 -2.986 1.00 . A A . 15 LYS N 1 1 6 2182 1 1 15 LYS NZ N 5.495 -4.618 -7.921 1.00 . A A . 15 LYS NZ 1 1 6 2183 1 1 15 LYS O O 4.656 -3.120 -2.744 1.00 . A A . 15 LYS O 1 1 6 2184 1 1 16 GLN C C 3.376 -0.601 -2.345 1.00 . A A . 16 GLN C 1 1 6 2185 1 1 16 GLN CA C 3.071 -1.078 -3.767 1.00 . A A . 16 GLN CA 1 1 6 2186 1 1 16 GLN CB C 1.947 -0.251 -4.393 1.00 . A A . 16 GLN CB 1 1 6 2187 1 1 16 GLN CD C 0.672 0.177 -6.527 1.00 . A A . 16 GLN CD 1 1 6 2188 1 1 16 GLN CG C 1.545 -0.816 -5.758 1.00 . A A . 16 GLN CG 1 1 6 2189 1 1 16 GLN H H 1.853 -2.719 -4.172 1.00 . A A . 16 GLN H 1 1 6 2190 1 1 16 GLN HA H 3.965 -0.994 -4.385 1.00 . A A . 16 GLN HA 1 1 6 2191 1 1 16 GLN HB3 H 2.270 0.784 -4.506 1.00 . A A . 16 GLN HB3 1 1 6 2192 1 1 16 GLN HE21 H 2.317 0.750 -7.559 1.00 . A A . 16 GLN HE21 1 1 6 2193 1 1 16 GLN HE22 H 0.851 1.568 -7.988 1.00 . A A . 16 GLN HE22 1 1 6 2194 1 1 16 GLN HG3 H 1.003 -1.753 -5.622 1.00 . A A . 16 GLN HG3 1 1 6 2195 1 1 16 GLN N N 2.737 -2.493 -3.764 1.00 . A A . 16 GLN N 1 1 6 2196 1 1 16 GLN NE2 N 1.335 0.891 -7.433 1.00 . A A . 16 GLN NE2 1 1 6 2197 1 1 16 GLN O O 4.337 0.133 -2.127 1.00 . A A . 16 GLN O 1 1 6 2198 1 1 16 GLN OE1 O -0.524 0.289 -6.313 1.00 . A A . 16 GLN OE1 1 1 6 2199 1 1 17 VAL C C 4.116 -1.042 0.435 1.00 . A A . 17 VAL C 1 1 6 2200 1 1 17 VAL CA C 2.706 -0.665 -0.022 1.00 . A A . 17 VAL CA 1 1 6 2201 1 1 17 VAL CB C 1.609 -1.310 0.828 1.00 . A A . 17 VAL CB 1 1 6 2202 1 1 17 VAL CG1 C 1.965 -2.757 1.175 1.00 . A A . 17 VAL CG1 1 1 6 2203 1 1 17 VAL CG2 C 1.344 -0.492 2.093 1.00 . A A . 17 VAL CG2 1 1 6 2204 1 1 17 VAL H H 1.758 -1.635 -1.603 1.00 . A A . 17 VAL H 1 1 6 2205 1 1 17 VAL HA H 2.592 0.417 0.044 1.00 . A A . 17 VAL HA 1 1 6 2206 1 1 17 VAL HB H 0.692 -1.322 0.238 1.00 . A A . 17 VAL HB 1 1 6 2207 1 1 17 VAL HG11 H 1.143 -3.413 0.884 1.00 . A A . 17 VAL HG11 1 1 6 2208 1 1 17 VAL HG12 H 2.868 -3.048 0.639 1.00 . A A . 17 VAL HG12 1 1 6 2209 1 1 17 VAL HG13 H 2.135 -2.842 2.248 1.00 . A A . 17 VAL HG13 1 1 6 2210 1 1 17 VAL HG21 H 1.020 0.511 1.816 1.00 . A A . 17 VAL HG21 1 1 6 2211 1 1 17 VAL HG22 H 0.564 -0.976 2.681 1.00 . A A . 17 VAL HG22 1 1 6 2212 1 1 17 VAL HG23 H 2.258 -0.429 2.684 1.00 . A A . 17 VAL HG23 1 1 6 2213 1 1 17 VAL N N 2.538 -1.039 -1.416 1.00 . A A . 17 VAL N 1 1 6 2214 1 1 17 VAL O O 4.708 -0.352 1.264 1.00 . A A . 17 VAL O 1 1 6 2215 1 1 18 LYS C C 6.981 -1.582 -0.239 1.00 . A A . 18 LYS C 1 1 6 2216 1 1 18 LYS CA C 5.943 -2.611 0.216 1.00 . A A . 18 LYS CA 1 1 6 2217 1 1 18 LYS CB C 6.174 -4.011 -0.356 1.00 . A A . 18 LYS CB 1 1 6 2218 1 1 18 LYS CD C 7.581 -3.631 -2.414 1.00 . A A . 18 LYS CD 1 1 6 2219 1 1 18 LYS CE C 7.370 -4.785 -3.394 1.00 . A A . 18 LYS CE 1 1 6 2220 1 1 18 LYS CG C 7.571 -4.131 -0.967 1.00 . A A . 18 LYS CG 1 1 6 2221 1 1 18 LYS H H 4.125 -2.689 -0.798 1.00 . A A . 18 LYS H 1 1 6 2222 1 1 18 LYS HA H 5.992 -2.694 1.302 1.00 . A A . 18 LYS HA 1 1 6 2223 1 1 18 LYS HB3 H 5.421 -4.226 -1.114 1.00 . A A . 18 LYS HB3 1 1 6 2224 1 1 18 LYS HD3 H 8.530 -3.137 -2.625 1.00 . A A . 18 LYS HD3 1 1 6 2225 1 1 18 LYS HE3 H 7.153 -4.393 -4.388 1.00 . A A . 18 LYS HE3 1 1 6 2226 1 1 18 LYS HG3 H 7.899 -5.170 -0.937 1.00 . A A . 18 LYS HG3 1 1 6 2227 1 1 18 LYS HZ1 H 8.333 -6.572 -3.151 1.00 . A A . 18 LYS HZ1 1 1 6 2228 1 1 18 LYS HZ2 H 8.920 -5.676 -4.385 1.00 . A A . 18 LYS HZ2 1 1 6 2229 1 1 18 LYS HZ3 H 9.277 -5.274 -2.844 1.00 . A A . 18 LYS HZ3 1 1 6 2230 1 1 18 LYS N N 4.614 -2.135 -0.124 1.00 . A A . 18 LYS N 1 1 6 2231 1 1 18 LYS NZ N 8.573 -5.646 -3.448 1.00 . A A . 18 LYS NZ 1 1 6 2232 1 1 18 LYS O O 7.990 -1.373 0.433 1.00 . A A . 18 LYS O 1 1 6 2233 1 1 19 LYS C C 7.597 1.266 -1.023 1.00 . A A . 19 LYS C 1 1 6 2234 1 1 19 LYS CA C 7.593 0.034 -1.931 1.00 . A A . 19 LYS CA 1 1 6 2235 1 1 19 LYS CB C 7.223 0.342 -3.383 1.00 . A A . 19 LYS CB 1 1 6 2236 1 1 19 LYS CD C 6.009 2.532 -3.082 1.00 . A A . 19 LYS CD 1 1 6 2237 1 1 19 LYS CE C 5.004 2.847 -4.191 1.00 . A A . 19 LYS CE 1 1 6 2238 1 1 19 LYS CG C 7.255 1.848 -3.650 1.00 . A A . 19 LYS CG 1 1 6 2239 1 1 19 LYS H H 5.874 -1.143 -1.918 1.00 . A A . 19 LYS H 1 1 6 2240 1 1 19 LYS HA H 8.596 -0.392 -1.937 1.00 . A A . 19 LYS HA 1 1 6 2241 1 1 19 LYS HB3 H 6.228 -0.048 -3.599 1.00 . A A . 19 LYS HB3 1 1 6 2242 1 1 19 LYS HD3 H 6.296 3.453 -2.574 1.00 . A A . 19 LYS HD3 1 1 6 2243 1 1 19 LYS HE3 H 4.781 1.941 -4.755 1.00 . A A . 19 LYS HE3 1 1 6 2244 1 1 19 LYS HG3 H 7.316 2.029 -4.723 1.00 . A A . 19 LYS HG3 1 1 6 2245 1 1 19 LYS HZ1 H 2.971 2.896 -3.979 1.00 . A A . 19 LYS HZ1 1 1 6 2246 1 1 19 LYS HZ2 H 3.779 3.310 -2.621 1.00 . A A . 19 LYS HZ2 1 1 6 2247 1 1 19 LYS HZ3 H 3.675 4.364 -3.863 1.00 . A A . 19 LYS HZ3 1 1 6 2248 1 1 19 LYS N N 6.697 -0.968 -1.378 1.00 . A A . 19 LYS N 1 1 6 2249 1 1 19 LYS NZ N 3.756 3.398 -3.617 1.00 . A A . 19 LYS NZ 1 1 6 2250 1 1 19 LYS O O 8.502 2.095 -1.100 1.00 . A A . 19 LYS O 1 1 6 2251 1 1 20 LEU C C 7.167 2.125 2.043 1.00 . A A . 20 LEU C 1 1 6 2252 1 1 20 LEU CA C 6.447 2.464 0.736 1.00 . A A . 20 LEU CA 1 1 6 2253 1 1 20 LEU CB C 4.976 2.838 0.924 1.00 . A A . 20 LEU CB 1 1 6 2254 1 1 20 LEU CD1 C 4.908 3.372 3.388 1.00 . A A . 20 LEU CD1 1 1 6 2255 1 1 20 LEU CD2 C 2.831 2.517 2.210 1.00 . A A . 20 LEU CD2 1 1 6 2256 1 1 20 LEU CG C 4.359 2.476 2.277 1.00 . A A . 20 LEU CG 1 1 6 2257 1 1 20 LEU H H 5.841 0.668 -0.129 1.00 . A A . 20 LEU H 1 1 6 2258 1 1 20 LEU HA H 6.942 3.320 0.281 1.00 . A A . 20 LEU HA 1 1 6 2259 1 1 20 LEU HB3 H 4.394 2.353 0.140 1.00 . A A . 20 LEU HB3 1 1 6 2260 1 1 20 LEU HD11 H 5.554 4.135 2.954 1.00 . A A . 20 LEU HD11 1 1 6 2261 1 1 20 LEU HD12 H 4.081 3.852 3.912 1.00 . A A . 20 LEU HD12 1 1 6 2262 1 1 20 LEU HD13 H 5.482 2.769 4.091 1.00 . A A . 20 LEU HD13 1 1 6 2263 1 1 20 LEU HD21 H 2.469 3.409 2.721 1.00 . A A . 20 LEU HD21 1 1 6 2264 1 1 20 LEU HD22 H 2.512 2.541 1.168 1.00 . A A . 20 LEU HD22 1 1 6 2265 1 1 20 LEU HD23 H 2.422 1.631 2.695 1.00 . A A . 20 LEU HD23 1 1 6 2266 1 1 20 LEU HG H 4.643 1.452 2.519 1.00 . A A . 20 LEU HG 1 1 6 2267 1 1 20 LEU N N 6.573 1.346 -0.185 1.00 . A A . 20 LEU N 1 1 6 2268 1 1 20 LEU O O 7.451 3.012 2.847 1.00 . A A . 20 LEU O 1 1 6 2269 1 1 21 PHE C C 9.598 0.782 3.394 1.00 . A A . 21 PHE C 1 1 6 2270 1 1 21 PHE CA C 8.123 0.373 3.410 1.00 . A A . 21 PHE CA 1 1 6 2271 1 1 21 PHE CB C 8.028 -1.153 3.412 1.00 . A A . 21 PHE CB 1 1 6 2272 1 1 21 PHE CD1 C 6.047 -1.705 4.841 1.00 . A A . 21 PHE CD1 1 1 6 2273 1 1 21 PHE CD2 C 8.186 -2.284 5.641 1.00 . A A . 21 PHE CD2 1 1 6 2274 1 1 21 PHE CE1 C 5.461 -2.246 6.015 1.00 . A A . 21 PHE CE1 1 1 6 2275 1 1 21 PHE CE2 C 7.600 -2.824 6.816 1.00 . A A . 21 PHE CE2 1 1 6 2276 1 1 21 PHE CG C 7.397 -1.735 4.678 1.00 . A A . 21 PHE CG 1 1 6 2277 1 1 21 PHE CZ C 6.250 -2.794 6.978 1.00 . A A . 21 PHE CZ 1 1 6 2278 1 1 21 PHE H H 7.207 0.126 1.555 1.00 . A A . 21 PHE H 1 1 6 2279 1 1 21 PHE HA H 7.630 0.836 4.265 1.00 . A A . 21 PHE HA 1 1 6 2280 1 1 21 PHE HB3 H 9.029 -1.569 3.293 1.00 . A A . 21 PHE HB3 1 1 6 2281 1 1 21 PHE HD1 H 5.415 -1.267 4.069 1.00 . A A . 21 PHE HD1 1 1 6 2282 1 1 21 PHE HD2 H 9.268 -2.307 5.511 1.00 . A A . 21 PHE HD2 1 1 6 2283 1 1 21 PHE HE1 H 4.380 -2.222 6.146 1.00 . A A . 21 PHE HE1 1 1 6 2284 1 1 21 PHE HE2 H 8.232 -3.263 7.588 1.00 . A A . 21 PHE HE2 1 1 6 2285 1 1 21 PHE HZ H 5.800 -3.209 7.880 1.00 . A A . 21 PHE HZ 1 1 6 2286 1 1 21 PHE N N 7.442 0.840 2.215 1.00 . A A . 21 PHE N 1 1 6 2287 1 1 21 PHE O O 10.251 0.798 4.436 1.00 . A A . 21 PHE O 1 1 6 2288 1 1 22 LYS C C 11.763 2.677 2.973 1.00 . A A . 22 LYS C 1 1 6 2289 1 1 22 LYS CA C 11.464 1.505 2.035 1.00 . A A . 22 LYS CA 1 1 6 2290 1 1 22 LYS CB C 11.764 1.802 0.565 1.00 . A A . 22 LYS CB 1 1 6 2291 1 1 22 LYS CD C 10.243 3.754 0.077 1.00 . A A . 22 LYS CD 1 1 6 2292 1 1 22 LYS CE C 10.054 5.208 0.512 1.00 . A A . 22 LYS CE 1 1 6 2293 1 1 22 LYS CG C 11.692 3.303 0.283 1.00 . A A . 22 LYS CG 1 1 6 2294 1 1 22 LYS H H 9.540 1.082 1.359 1.00 . A A . 22 LYS H 1 1 6 2295 1 1 22 LYS HA H 12.089 0.661 2.328 1.00 . A A . 22 LYS HA 1 1 6 2296 1 1 22 LYS HB3 H 11.051 1.274 -0.068 1.00 . A A . 22 LYS HB3 1 1 6 2297 1 1 22 LYS HD3 H 9.574 3.110 0.647 1.00 . A A . 22 LYS HD3 1 1 6 2298 1 1 22 LYS HE3 H 10.953 5.563 1.018 1.00 . A A . 22 LYS HE3 1 1 6 2299 1 1 22 LYS HG3 H 12.279 3.540 -0.604 1.00 . A A . 22 LYS HG3 1 1 6 2300 1 1 22 LYS HZ1 H 10.340 5.784 -1.429 1.00 . A A . 22 LYS HZ1 1 1 6 2301 1 1 22 LYS HZ2 H 8.803 5.975 -0.910 1.00 . A A . 22 LYS HZ2 1 1 6 2302 1 1 22 LYS HZ3 H 9.962 7.019 -0.430 1.00 . A A . 22 LYS HZ3 1 1 6 2303 1 1 22 LYS N N 10.079 1.099 2.202 1.00 . A A . 22 LYS N 1 1 6 2304 1 1 22 LYS NZ N 9.766 6.066 -0.659 1.00 . A A . 22 LYS NZ 1 1 6 2305 1 1 22 LYS O O 12.922 2.955 3.276 1.00 . A A . 22 LYS O 1 1 6 2306 1 1 23 LYS C C 10.545 4.017 5.736 1.00 . A A . 23 LYS C 1 1 6 2307 1 1 23 LYS CA C 10.830 4.469 4.303 1.00 . A A . 23 LYS CA 1 1 6 2308 1 1 23 LYS CB C 9.944 5.626 3.837 1.00 . A A . 23 LYS CB 1 1 6 2309 1 1 23 LYS CD C 7.631 6.287 4.594 1.00 . A A . 23 LYS CD 1 1 6 2310 1 1 23 LYS CE C 6.157 6.191 4.196 1.00 . A A . 23 LYS CE 1 1 6 2311 1 1 23 LYS CG C 8.466 5.232 3.865 1.00 . A A . 23 LYS CG 1 1 6 2312 1 1 23 LYS H H 9.756 3.101 3.155 1.00 . A A . 23 LYS H 1 1 6 2313 1 1 23 LYS HA H 11.863 4.810 4.246 1.00 . A A . 23 LYS HA 1 1 6 2314 1 1 23 LYS HB3 H 10.226 5.920 2.826 1.00 . A A . 23 LYS HB3 1 1 6 2315 1 1 23 LYS HD3 H 8.011 7.282 4.360 1.00 . A A . 23 LYS HD3 1 1 6 2316 1 1 23 LYS HE3 H 5.722 5.281 4.607 1.00 . A A . 23 LYS HE3 1 1 6 2317 1 1 23 LYS HG3 H 8.352 4.268 4.361 1.00 . A A . 23 LYS HG3 1 1 6 2318 1 1 23 LYS HZ1 H 6.013 7.939 5.246 1.00 . A A . 23 LYS HZ1 1 1 6 2319 1 1 23 LYS HZ2 H 5.079 7.904 3.907 1.00 . A A . 23 LYS HZ2 1 1 6 2320 1 1 23 LYS HZ3 H 4.632 7.067 5.237 1.00 . A A . 23 LYS HZ3 1 1 6 2321 1 1 23 LYS N N 10.696 3.334 3.407 1.00 . A A . 23 LYS N 1 1 6 2322 1 1 23 LYS NZ N 5.410 7.371 4.686 1.00 . A A . 23 LYS NZ 1 1 6 2323 1 1 23 LYS O O 11.064 4.599 6.689 1.00 . A A . 23 LYS O 1 1 6 2324 1 1 24 TRP C C 10.545 1.616 7.658 1.00 . A A . 24 TRP C 1 1 6 2325 1 1 24 TRP CA C 9.366 2.447 7.149 1.00 . A A . 24 TRP CA 1 1 6 2326 1 1 24 TRP CB C 8.062 1.650 7.073 1.00 . A A . 24 TRP CB 1 1 6 2327 1 1 24 TRP CD1 C 6.741 3.850 6.790 1.00 . A A . 24 TRP CD1 1 1 6 2328 1 1 24 TRP CD2 C 5.447 2.053 6.841 1.00 . A A . 24 TRP CD2 1 1 6 2329 1 1 24 TRP CE2 C 4.624 3.150 6.689 1.00 . A A . 24 TRP CE2 1 1 6 2330 1 1 24 TRP CE3 C 4.924 0.750 6.910 1.00 . A A . 24 TRP CE3 1 1 6 2331 1 1 24 TRP CG C 6.812 2.517 6.907 1.00 . A A . 24 TRP CG 1 1 6 2332 1 1 24 TRP CH2 C 2.688 1.767 6.656 1.00 . A A . 24 TRP CH2 1 1 6 2333 1 1 24 TRP CZ2 C 3.231 3.056 6.590 1.00 . A A . 24 TRP CZ2 1 1 6 2334 1 1 24 TRP CZ3 C 3.530 0.673 6.810 1.00 . A A . 24 TRP CZ3 1 1 6 2335 1 1 24 TRP H H 9.307 2.516 5.067 1.00 . A A . 24 TRP H 1 1 6 2336 1 1 24 TRP HA H 9.185 3.288 7.817 1.00 . A A . 24 TRP HA 1 1 6 2337 1 1 24 TRP HB3 H 7.960 1.053 7.980 1.00 . A A . 24 TRP HB3 1 1 6 2338 1 1 24 TRP HD1 H 7.606 4.513 6.801 1.00 . A A . 24 TRP HD1 1 1 6 2339 1 1 24 TRP HE1 H 5.104 5.310 6.545 1.00 . A A . 24 TRP HE1 1 1 6 2340 1 1 24 TRP HE3 H 5.552 -0.132 7.031 1.00 . A A . 24 TRP HE3 1 1 6 2341 1 1 24 TRP HH2 H 1.609 1.623 6.586 1.00 . A A . 24 TRP HH2 1 1 6 2342 1 1 24 TRP HZ2 H 2.602 3.938 6.469 1.00 . A A . 24 TRP HZ2 1 1 6 2343 1 1 24 TRP HZ3 H 3.073 -0.316 6.858 1.00 . A A . 24 TRP HZ3 1 1 6 2344 1 1 24 TRP N N 9.724 2.983 5.846 1.00 . A A . 24 TRP N 1 1 6 2345 1 1 24 TRP NE1 N 5.437 4.278 6.656 1.00 . A A . 24 TRP NE1 1 1 6 2346 1 1 24 TRP O O 11.140 1.941 8.685 1.00 . A A . 24 TRP O 1 1 6 2347 1 1 25 GLY C C 12.386 -1.170 6.088 1.00 . A A . 25 GLY C 1 1 6 2348 1 1 25 GLY CA C 11.946 -0.319 7.283 1.00 . A A . 25 GLY CA 1 1 6 2349 1 1 25 GLY H H 10.360 0.303 6.084 1.00 . A A . 25 GLY H 1 1 6 2350 1 1 25 GLY HA2 H 12.788 0.273 7.642 1.00 . A A . 25 GLY HA2 1 1 6 2351 1 1 25 GLY HA3 H 11.639 -0.969 8.103 1.00 . A A . 25 GLY HA3 1 1 6 2352 1 1 25 GLY N N 10.849 0.560 6.917 1.00 . A A . 25 GLY N 1 1 6 2353 1 1 25 GLY O O 12.651 -0.642 5.009 1.00 . A A . 25 GLY O 1 1 6 2354 1 1 26 TRP C C 11.648 -3.652 4.378 1.00 . A A . 26 TRP C 1 1 6 2355 1 1 26 TRP CA C 12.857 -3.400 5.280 1.00 . A A . 26 TRP CA 1 1 6 2356 1 1 26 TRP CB C 13.431 -4.684 5.882 1.00 . A A . 26 TRP CB 1 1 6 2357 1 1 26 TRP CD1 C 15.099 -3.474 7.438 1.00 . A A . 26 TRP CD1 1 1 6 2358 1 1 26 TRP CD2 C 15.896 -5.365 6.601 1.00 . A A . 26 TRP CD2 1 1 6 2359 1 1 26 TRP CE2 C 16.877 -4.823 7.407 1.00 . A A . 26 TRP CE2 1 1 6 2360 1 1 26 TRP CE3 C 16.095 -6.577 5.919 1.00 . A A . 26 TRP CE3 1 1 6 2361 1 1 26 TRP CG C 14.753 -4.485 6.628 1.00 . A A . 26 TRP CG 1 1 6 2362 1 1 26 TRP CH2 C 18.346 -6.635 6.936 1.00 . A A . 26 TRP CH2 1 1 6 2363 1 1 26 TRP CZ2 C 18.125 -5.426 7.606 1.00 . A A . 26 TRP CZ2 1 1 6 2364 1 1 26 TRP CZ3 C 17.347 -7.167 6.127 1.00 . A A . 26 TRP CZ3 1 1 6 2365 1 1 26 TRP H H 12.236 -2.893 7.203 1.00 . A A . 26 TRP H 1 1 6 2366 1 1 26 TRP HA H 13.659 -2.931 4.710 1.00 . A A . 26 TRP HA 1 1 6 2367 1 1 26 TRP HB3 H 13.583 -5.411 5.084 1.00 . A A . 26 TRP HB3 1 1 6 2368 1 1 26 TRP HD1 H 14.452 -2.629 7.676 1.00 . A A . 26 TRP HD1 1 1 6 2369 1 1 26 TRP HE1 H 16.898 -2.961 8.609 1.00 . A A . 26 TRP HE1 1 1 6 2370 1 1 26 TRP HE3 H 15.337 -7.025 5.276 1.00 . A A . 26 TRP HE3 1 1 6 2371 1 1 26 TRP HH2 H 19.296 -7.157 7.047 1.00 . A A . 26 TRP HH2 1 1 6 2372 1 1 26 TRP HZ2 H 18.884 -4.979 8.248 1.00 . A A . 26 TRP HZ2 1 1 6 2373 1 1 26 TRP HZ3 H 17.555 -8.110 5.621 1.00 . A A . 26 TRP HZ3 1 1 6 2374 1 1 26 TRP N N 12.452 -2.472 6.322 1.00 . A A . 26 TRP N 1 1 6 2375 1 1 26 TRP NE1 N 16.377 -3.638 7.932 1.00 . A A . 26 TRP NE1 1 1 6 2376 1 1 26 TRP O O 11.794 -4.170 3.270 1.00 . A A . 26 TRP O 1 1 7 2377 1 1 1 LYS C C -16.105 10.575 2.189 1.00 . A A . 1 LYS C 1 1 7 2378 1 1 1 LYS CA C -16.838 11.331 1.078 1.00 . A A . 1 LYS CA 1 1 7 2379 1 1 1 LYS CB C -17.195 12.772 1.447 1.00 . A A . 1 LYS CB 1 1 7 2380 1 1 1 LYS CD C -19.699 12.927 1.697 1.00 . A A . 1 LYS CD 1 1 7 2381 1 1 1 LYS CE C -20.607 11.738 2.020 1.00 . A A . 1 LYS CE 1 1 7 2382 1 1 1 LYS CG C -18.364 12.813 2.434 1.00 . A A . 1 LYS CG 1 1 7 2383 1 1 1 LYS H1 H -17.901 9.608 0.585 1.00 . A A . 1 LYS H1 1 1 7 2384 1 1 1 LYS HA H -16.190 11.373 0.203 1.00 . A A . 1 LYS HA 1 1 7 2385 1 1 1 LYS HB3 H -17.455 13.328 0.547 1.00 . A A . 1 LYS HB3 1 1 7 2386 1 1 1 LYS HD3 H -19.523 12.974 0.622 1.00 . A A . 1 LYS HD3 1 1 7 2387 1 1 1 LYS HE3 H -20.360 11.341 3.005 1.00 . A A . 1 LYS HE3 1 1 7 2388 1 1 1 LYS HG3 H -18.243 13.660 3.110 1.00 . A A . 1 LYS HG3 1 1 7 2389 1 1 1 LYS HZ1 H -22.415 12.089 2.905 1.00 . A A . 1 LYS HZ1 1 1 7 2390 1 1 1 LYS HZ2 H -22.096 13.088 1.654 1.00 . A A . 1 LYS HZ2 1 1 7 2391 1 1 1 LYS HZ3 H -22.534 11.540 1.372 1.00 . A A . 1 LYS HZ3 1 1 7 2392 1 1 1 LYS N N -18.032 10.593 0.702 1.00 . A A . 1 LYS N 1 1 7 2393 1 1 1 LYS NZ N -22.029 12.147 1.985 1.00 . A A . 1 LYS NZ 1 1 7 2394 1 1 1 LYS O O -16.682 10.295 3.239 1.00 . A A . 1 LYS O 1 1 7 2395 1 1 2 SER C C -12.582 9.475 2.389 1.00 . A A . 2 SER C 1 1 7 2396 1 1 2 SER CA C -14.029 9.548 2.881 1.00 . A A . 2 SER CA 1 1 7 2397 1 1 2 SER CB C -14.577 8.141 3.129 1.00 . A A . 2 SER CB 1 1 7 2398 1 1 2 SER H H -14.385 10.497 1.062 1.00 . A A . 2 SER H 1 1 7 2399 1 1 2 SER HA H -14.091 10.128 3.803 1.00 . A A . 2 SER HA 1 1 7 2400 1 1 2 SER HB3 H -14.436 7.535 2.234 1.00 . A A . 2 SER HB3 1 1 7 2401 1 1 2 SER HG H -13.002 7.261 3.994 1.00 . A A . 2 SER HG 1 1 7 2402 1 1 2 SER N N -14.846 10.266 1.918 1.00 . A A . 2 SER N 1 1 7 2403 1 1 2 SER O O -12.326 9.553 1.188 1.00 . A A . 2 SER O 1 1 7 2404 1 1 2 SER OG O -13.941 7.507 4.235 1.00 . A A . 2 SER OG 1 1 7 2405 1 1 3 SER C C -9.494 8.607 4.181 1.00 . A A . 3 SER C 1 1 7 2406 1 1 3 SER CA C -10.258 9.245 3.020 1.00 . A A . 3 SER CA 1 1 7 2407 1 1 3 SER CB C -9.683 10.627 2.701 1.00 . A A . 3 SER CB 1 1 7 2408 1 1 3 SER H H -11.888 9.267 4.316 1.00 . A A . 3 SER H 1 1 7 2409 1 1 3 SER HA H -10.201 8.614 2.132 1.00 . A A . 3 SER HA 1 1 7 2410 1 1 3 SER HB3 H -8.750 10.765 3.247 1.00 . A A . 3 SER HB3 1 1 7 2411 1 1 3 SER HG H -9.777 11.695 1.011 1.00 . A A . 3 SER HG 1 1 7 2412 1 1 3 SER N N -11.673 9.329 3.342 1.00 . A A . 3 SER N 1 1 7 2413 1 1 3 SER O O -9.060 9.300 5.099 1.00 . A A . 3 SER O 1 1 7 2414 1 1 3 SER OG O -9.447 10.798 1.306 1.00 . A A . 3 SER OG 1 1 7 2415 1 1 4 ALA C C -7.273 6.135 4.611 1.00 . A A . 4 ALA C 1 1 7 2416 1 1 4 ALA CA C -8.648 6.552 5.136 1.00 . A A . 4 ALA CA 1 1 7 2417 1 1 4 ALA CB C -9.494 5.355 5.574 1.00 . A A . 4 ALA CB 1 1 7 2418 1 1 4 ALA H H -9.708 6.735 3.352 1.00 . A A . 4 ALA H 1 1 7 2419 1 1 4 ALA HA H -8.516 7.218 5.990 1.00 . A A . 4 ALA HA 1 1 7 2420 1 1 4 ALA HB1 H -8.936 4.762 6.300 1.00 . A A . 4 ALA HB1 1 1 7 2421 1 1 4 ALA HB2 H -10.419 5.708 6.028 1.00 . A A . 4 ALA HB2 1 1 7 2422 1 1 4 ALA HB3 H -9.727 4.738 4.705 1.00 . A A . 4 ALA HB3 1 1 7 2423 1 1 4 ALA N N -9.352 7.292 4.103 1.00 . A A . 4 ALA N 1 1 7 2424 1 1 4 ALA O O -6.975 6.314 3.432 1.00 . A A . 4 ALA O 1 1 7 2425 1 1 5 TYR C C -5.185 4.088 4.050 1.00 . A A . 5 TYR C 1 1 7 2426 1 1 5 TYR CA C -5.135 5.144 5.157 1.00 . A A . 5 TYR CA 1 1 7 2427 1 1 5 TYR CB C -4.548 4.513 6.421 1.00 . A A . 5 TYR CB 1 1 7 2428 1 1 5 TYR CD1 C -6.312 2.743 6.761 1.00 . A A . 5 TYR CD1 1 1 7 2429 1 1 5 TYR CD2 C -4.019 2.067 6.735 1.00 . A A . 5 TYR CD2 1 1 7 2430 1 1 5 TYR CE1 C -6.712 1.376 6.973 1.00 . A A . 5 TYR CE1 1 1 7 2431 1 1 5 TYR CE2 C -4.419 0.700 6.947 1.00 . A A . 5 TYR CE2 1 1 7 2432 1 1 5 TYR CG C -4.973 3.060 6.647 1.00 . A A . 5 TYR CG 1 1 7 2433 1 1 5 TYR CZ C -5.745 0.423 7.056 1.00 . A A . 5 TYR CZ 1 1 7 2434 1 1 5 TYR H H -6.722 5.446 6.472 1.00 . A A . 5 TYR H 1 1 7 2435 1 1 5 TYR HA H -4.578 6.009 4.799 1.00 . A A . 5 TYR HA 1 1 7 2436 1 1 5 TYR HB3 H -4.849 5.106 7.284 1.00 . A A . 5 TYR HB3 1 1 7 2437 1 1 5 TYR HD1 H -7.065 3.527 6.691 1.00 . A A . 5 TYR HD1 1 1 7 2438 1 1 5 TYR HD2 H -2.961 2.318 6.645 1.00 . A A . 5 TYR HD2 1 1 7 2439 1 1 5 TYR HE1 H -7.765 1.111 7.065 1.00 . A A . 5 TYR HE1 1 1 7 2440 1 1 5 TYR HE2 H -3.675 -0.093 7.020 1.00 . A A . 5 TYR HE2 1 1 7 2441 1 1 5 TYR HH H -6.047 -1.383 6.402 1.00 . A A . 5 TYR HH 1 1 7 2442 1 1 5 TYR N N -6.472 5.587 5.515 1.00 . A A . 5 TYR N 1 1 7 2443 1 1 5 TYR O O -4.174 3.806 3.410 1.00 . A A . 5 TYR O 1 1 7 2444 1 1 5 TYR OH O -6.123 -0.869 7.256 1.00 . A A . 5 TYR OH 1 1 7 2445 1 1 6 SER C C -7.974 2.632 2.248 1.00 . A A . 6 SER C 1 1 7 2446 1 1 6 SER CA C -6.569 2.515 2.841 1.00 . A A . 6 SER CA 1 1 7 2447 1 1 6 SER CB C -6.350 1.113 3.415 1.00 . A A . 6 SER CB 1 1 7 2448 1 1 6 SER H H -7.192 3.768 4.384 1.00 . A A . 6 SER H 1 1 7 2449 1 1 6 SER HA H -5.814 2.718 2.082 1.00 . A A . 6 SER HA 1 1 7 2450 1 1 6 SER HB3 H -6.681 0.369 2.691 1.00 . A A . 6 SER HB3 1 1 7 2451 1 1 6 SER HG H -4.604 1.674 4.218 1.00 . A A . 6 SER HG 1 1 7 2452 1 1 6 SER N N -6.373 3.533 3.860 1.00 . A A . 6 SER N 1 1 7 2453 1 1 6 SER O O -8.859 3.235 2.852 1.00 . A A . 6 SER O 1 1 7 2454 1 1 6 SER OG O -4.983 0.879 3.745 1.00 . A A . 6 SER OG 1 1 7 2455 1 1 7 LEU C C -9.689 0.708 -0.241 1.00 . A A . 7 LEU C 1 1 7 2456 1 1 7 LEU CA C -9.417 2.076 0.388 1.00 . A A . 7 LEU CA 1 1 7 2457 1 1 7 LEU CB C -9.464 3.233 -0.612 1.00 . A A . 7 LEU CB 1 1 7 2458 1 1 7 LEU CD1 C -8.318 3.143 -2.857 1.00 . A A . 7 LEU CD1 1 1 7 2459 1 1 7 LEU CD2 C -7.720 4.961 -1.191 1.00 . A A . 7 LEU CD2 1 1 7 2460 1 1 7 LEU CG C -8.169 3.510 -1.379 1.00 . A A . 7 LEU CG 1 1 7 2461 1 1 7 LEU H H -7.409 1.557 0.585 1.00 . A A . 7 LEU H 1 1 7 2462 1 1 7 LEU HA H -10.182 2.269 1.140 1.00 . A A . 7 LEU HA 1 1 7 2463 1 1 7 LEU HB3 H -9.747 4.139 -0.076 1.00 . A A . 7 LEU HB3 1 1 7 2464 1 1 7 LEU HD11 H -9.154 3.695 -3.286 1.00 . A A . 7 LEU HD11 1 1 7 2465 1 1 7 LEU HD12 H -7.401 3.400 -3.388 1.00 . A A . 7 LEU HD12 1 1 7 2466 1 1 7 LEU HD13 H -8.504 2.073 -2.948 1.00 . A A . 7 LEU HD13 1 1 7 2467 1 1 7 LEU HD21 H -7.876 5.257 -0.153 1.00 . A A . 7 LEU HD21 1 1 7 2468 1 1 7 LEU HD22 H -6.663 5.049 -1.438 1.00 . A A . 7 LEU HD22 1 1 7 2469 1 1 7 LEU HD23 H -8.303 5.609 -1.846 1.00 . A A . 7 LEU HD23 1 1 7 2470 1 1 7 LEU HG H -7.385 2.875 -0.966 1.00 . A A . 7 LEU HG 1 1 7 2471 1 1 7 LEU N N -8.135 2.046 1.071 1.00 . A A . 7 LEU N 1 1 7 2472 1 1 7 LEU O O -10.779 0.159 -0.094 1.00 . A A . 7 LEU O 1 1 7 2473 1 1 8 GLN C C -7.518 -1.915 -1.364 1.00 . A A . 8 GLN C 1 1 7 2474 1 1 8 GLN CA C -8.793 -1.096 -1.581 1.00 . A A . 8 GLN CA 1 1 7 2475 1 1 8 GLN CB C -9.095 -0.933 -3.071 1.00 . A A . 8 GLN CB 1 1 7 2476 1 1 8 GLN CD C -10.891 -0.948 -4.841 1.00 . A A . 8 GLN CD 1 1 7 2477 1 1 8 GLN CG C -10.595 -1.056 -3.343 1.00 . A A . 8 GLN CG 1 1 7 2478 1 1 8 GLN H H -7.794 0.651 -1.042 1.00 . A A . 8 GLN H 1 1 7 2479 1 1 8 GLN HA H -9.636 -1.590 -1.097 1.00 . A A . 8 GLN HA 1 1 7 2480 1 1 8 GLN HB3 H -8.555 -1.691 -3.640 1.00 . A A . 8 GLN HB3 1 1 7 2481 1 1 8 GLN HE21 H -12.042 0.671 -4.448 1.00 . A A . 8 GLN HE21 1 1 7 2482 1 1 8 GLN HE22 H -11.944 0.219 -6.117 1.00 . A A . 8 GLN HE22 1 1 7 2483 1 1 8 GLN HG3 H -11.131 -0.274 -2.806 1.00 . A A . 8 GLN HG3 1 1 7 2484 1 1 8 GLN N N -8.677 0.197 -0.929 1.00 . A A . 8 GLN N 1 1 7 2485 1 1 8 GLN NE2 N -11.692 0.065 -5.162 1.00 . A A . 8 GLN NE2 1 1 7 2486 1 1 8 GLN O O -6.413 -1.383 -1.452 1.00 . A A . 8 GLN O 1 1 7 2487 1 1 8 GLN OE1 O -10.423 -1.730 -5.651 1.00 . A A . 8 GLN OE1 1 1 7 2488 1 1 9 MET C C -6.602 -5.244 -1.865 1.00 . A A . 9 MET C 1 1 7 2489 1 1 9 MET CA C -6.597 -4.092 -0.857 1.00 . A A . 9 MET CA 1 1 7 2490 1 1 9 MET CB C -6.675 -4.655 0.563 1.00 . A A . 9 MET CB 1 1 7 2491 1 1 9 MET CE C -10.730 -4.686 0.946 1.00 . A A . 9 MET CE 1 1 7 2492 1 1 9 MET CG C -8.057 -5.253 0.840 1.00 . A A . 9 MET CG 1 1 7 2493 1 1 9 MET H H -8.619 -3.620 -1.017 1.00 . A A . 9 MET H 1 1 7 2494 1 1 9 MET HA H -5.702 -3.485 -0.995 1.00 . A A . 9 MET HA 1 1 7 2495 1 1 9 MET HB3 H -6.467 -3.864 1.284 1.00 . A A . 9 MET HB3 1 1 7 2496 1 1 9 MET HE1 H -11.539 -4.146 1.437 1.00 . A A . 9 MET HE1 1 1 7 2497 1 1 9 MET HE2 H -10.842 -4.604 -0.136 1.00 . A A . 9 MET HE2 1 1 7 2498 1 1 9 MET HE3 H -10.765 -5.737 1.235 1.00 . A A . 9 MET HE3 1 1 7 2499 1 1 9 MET HG3 H -7.975 -6.053 1.577 1.00 . A A . 9 MET HG3 1 1 7 2500 1 1 9 MET N N -7.716 -3.195 -1.086 1.00 . A A . 9 MET N 1 1 7 2501 1 1 9 MET O O -5.545 -5.734 -2.259 1.00 . A A . 9 MET O 1 1 7 2502 1 1 9 MET SD S -9.163 -3.986 1.436 1.00 . A A . 9 MET SD 1 1 7 2503 1 1 10 GLY C C -6.909 -7.814 -2.979 1.00 . A A . 10 GLY C 1 1 7 2504 1 1 10 GLY CA C -7.963 -6.729 -3.205 1.00 . A A . 10 GLY CA 1 1 7 2505 1 1 10 GLY H H -8.660 -5.240 -1.926 1.00 . A A . 10 GLY H 1 1 7 2506 1 1 10 GLY HA2 H -8.959 -7.160 -3.110 1.00 . A A . 10 GLY HA2 1 1 7 2507 1 1 10 GLY HA3 H -7.878 -6.341 -4.220 1.00 . A A . 10 GLY HA3 1 1 7 2508 1 1 10 GLY N N -7.805 -5.643 -2.251 1.00 . A A . 10 GLY N 1 1 7 2509 1 1 10 GLY O O -7.084 -8.687 -2.130 1.00 . A A . 10 GLY O 1 1 7 2510 1 1 11 ALA C C -3.471 -8.069 -4.202 1.00 . A A . 11 ALA C 1 1 7 2511 1 1 11 ALA CA C -4.756 -8.689 -3.649 1.00 . A A . 11 ALA CA 1 1 7 2512 1 1 11 ALA CB C -5.145 -9.975 -4.381 1.00 . A A . 11 ALA CB 1 1 7 2513 1 1 11 ALA H H -5.703 -7.012 -4.443 1.00 . A A . 11 ALA H 1 1 7 2514 1 1 11 ALA HA H -4.615 -8.916 -2.593 1.00 . A A . 11 ALA HA 1 1 7 2515 1 1 11 ALA HB1 H -5.491 -10.714 -3.659 1.00 . A A . 11 ALA HB1 1 1 7 2516 1 1 11 ALA HB2 H -5.942 -9.761 -5.092 1.00 . A A . 11 ALA HB2 1 1 7 2517 1 1 11 ALA HB3 H -4.278 -10.366 -4.914 1.00 . A A . 11 ALA HB3 1 1 7 2518 1 1 11 ALA N N -5.838 -7.726 -3.754 1.00 . A A . 11 ALA N 1 1 7 2519 1 1 11 ALA O O -2.480 -7.942 -3.484 1.00 . A A . 11 ALA O 1 1 7 2520 1 1 12 THR C C -1.979 -5.805 -5.418 1.00 . A A . 12 THR C 1 1 7 2521 1 1 12 THR CA C -2.382 -7.096 -6.131 1.00 . A A . 12 THR CA 1 1 7 2522 1 1 12 THR CB C -2.736 -6.893 -7.605 1.00 . A A . 12 THR CB 1 1 7 2523 1 1 12 THR CG2 C -3.187 -8.189 -8.283 1.00 . A A . 12 THR CG2 1 1 7 2524 1 1 12 THR H H -4.338 -7.808 -6.050 1.00 . A A . 12 THR H 1 1 7 2525 1 1 12 THR HA H -1.539 -7.783 -6.049 1.00 . A A . 12 THR HA 1 1 7 2526 1 1 12 THR HB H -1.905 -6.441 -8.146 1.00 . A A . 12 THR HB 1 1 7 2527 1 1 12 THR HG1 H -3.664 -5.122 -7.542 1.00 . A A . 12 THR HG1 1 1 7 2528 1 1 12 THR HG21 H -3.062 -9.023 -7.593 1.00 . A A . 12 THR HG21 1 1 7 2529 1 1 12 THR HG22 H -4.236 -8.104 -8.565 1.00 . A A . 12 THR HG22 1 1 7 2530 1 1 12 THR HG23 H -2.584 -8.362 -9.175 1.00 . A A . 12 THR HG23 1 1 7 2531 1 1 12 THR N N -3.528 -7.700 -5.473 1.00 . A A . 12 THR N 1 1 7 2532 1 1 12 THR O O -0.797 -5.571 -5.170 1.00 . A A . 12 THR O 1 1 7 2533 1 1 12 THR OG1 O -3.911 -6.090 -7.573 1.00 . A A . 12 THR OG1 1 1 7 2534 1 1 13 ALA C C -1.719 -3.942 -3.320 1.00 . A A . 13 ALA C 1 1 7 2535 1 1 13 ALA CA C -2.749 -3.734 -4.432 1.00 . A A . 13 ALA CA 1 1 7 2536 1 1 13 ALA CB C -4.075 -3.184 -3.903 1.00 . A A . 13 ALA CB 1 1 7 2537 1 1 13 ALA H H -3.942 -5.195 -5.316 1.00 . A A . 13 ALA H 1 1 7 2538 1 1 13 ALA HA H -2.344 -3.035 -5.163 1.00 . A A . 13 ALA HA 1 1 7 2539 1 1 13 ALA HB1 H -4.469 -2.450 -4.606 1.00 . A A . 13 ALA HB1 1 1 7 2540 1 1 13 ALA HB2 H -4.788 -4.000 -3.791 1.00 . A A . 13 ALA HB2 1 1 7 2541 1 1 13 ALA HB3 H -3.911 -2.709 -2.936 1.00 . A A . 13 ALA HB3 1 1 7 2542 1 1 13 ALA N N -2.984 -4.997 -5.110 1.00 . A A . 13 ALA N 1 1 7 2543 1 1 13 ALA O O -0.764 -3.176 -3.202 1.00 . A A . 13 ALA O 1 1 7 2544 1 1 14 ILE C C 0.397 -5.125 -1.894 1.00 . A A . 14 ILE C 1 1 7 2545 1 1 14 ILE CA C -1.051 -5.300 -1.433 1.00 . A A . 14 ILE CA 1 1 7 2546 1 1 14 ILE CB C -1.356 -6.693 -0.878 1.00 . A A . 14 ILE CB 1 1 7 2547 1 1 14 ILE CD1 C -3.318 -8.186 -0.348 1.00 . A A . 14 ILE CD1 1 1 7 2548 1 1 14 ILE CG1 C -2.774 -6.757 -0.306 1.00 . A A . 14 ILE CG1 1 1 7 2549 1 1 14 ILE CG2 C -0.303 -7.117 0.148 1.00 . A A . 14 ILE CG2 1 1 7 2550 1 1 14 ILE H H -2.726 -5.601 -2.634 1.00 . A A . 14 ILE H 1 1 7 2551 1 1 14 ILE HA H -1.247 -4.585 -0.634 1.00 . A A . 14 ILE HA 1 1 7 2552 1 1 14 ILE HB H -1.308 -7.406 -1.702 1.00 . A A . 14 ILE HB 1 1 7 2553 1 1 14 ILE HD11 H -4.406 -8.163 -0.307 1.00 . A A . 14 ILE HD11 1 1 7 2554 1 1 14 ILE HD12 H -3.001 -8.669 -1.273 1.00 . A A . 14 ILE HD12 1 1 7 2555 1 1 14 ILE HD13 H -2.934 -8.747 0.504 1.00 . A A . 14 ILE HD13 1 1 7 2556 1 1 14 ILE HG13 H -3.430 -6.098 -0.875 1.00 . A A . 14 ILE HG13 1 1 7 2557 1 1 14 ILE HG21 H -0.498 -6.615 1.096 1.00 . A A . 14 ILE HG21 1 1 7 2558 1 1 14 ILE HG22 H -0.352 -8.197 0.292 1.00 . A A . 14 ILE HG22 1 1 7 2559 1 1 14 ILE HG23 H 0.687 -6.842 -0.213 1.00 . A A . 14 ILE HG23 1 1 7 2560 1 1 14 ILE N N -1.947 -4.982 -2.532 1.00 . A A . 14 ILE N 1 1 7 2561 1 1 14 ILE O O 1.189 -4.463 -1.227 1.00 . A A . 14 ILE O 1 1 7 2562 1 1 15 LYS C C 2.497 -4.193 -3.596 1.00 . A A . 15 LYS C 1 1 7 2563 1 1 15 LYS CA C 2.037 -5.652 -3.592 1.00 . A A . 15 LYS CA 1 1 7 2564 1 1 15 LYS CB C 2.082 -6.314 -4.971 1.00 . A A . 15 LYS CB 1 1 7 2565 1 1 15 LYS CD C 3.650 -4.787 -6.224 1.00 . A A . 15 LYS CD 1 1 7 2566 1 1 15 LYS CE C 4.413 -4.876 -7.548 1.00 . A A . 15 LYS CE 1 1 7 2567 1 1 15 LYS CG C 3.470 -6.173 -5.602 1.00 . A A . 15 LYS CG 1 1 7 2568 1 1 15 LYS H H 0.048 -6.269 -3.571 1.00 . A A . 15 LYS H 1 1 7 2569 1 1 15 LYS HA H 2.698 -6.221 -2.939 1.00 . A A . 15 LYS HA 1 1 7 2570 1 1 15 LYS HB3 H 1.335 -5.860 -5.621 1.00 . A A . 15 LYS HB3 1 1 7 2571 1 1 15 LYS HD3 H 4.190 -4.141 -5.533 1.00 . A A . 15 LYS HD3 1 1 7 2572 1 1 15 LYS HE3 H 4.529 -5.920 -7.838 1.00 . A A . 15 LYS HE3 1 1 7 2573 1 1 15 LYS HG3 H 3.606 -6.939 -6.364 1.00 . A A . 15 LYS HG3 1 1 7 2574 1 1 15 LYS HZ1 H 4.050 -3.205 -8.666 1.00 . A A . 15 LYS HZ1 1 1 7 2575 1 1 15 LYS HZ2 H 3.831 -4.599 -9.487 1.00 . A A . 15 LYS HZ2 1 1 7 2576 1 1 15 LYS HZ3 H 2.718 -4.111 -8.396 1.00 . A A . 15 LYS HZ3 1 1 7 2577 1 1 15 LYS N N 0.698 -5.732 -3.034 1.00 . A A . 15 LYS N 1 1 7 2578 1 1 15 LYS NZ N 3.695 -4.138 -8.611 1.00 . A A . 15 LYS NZ 1 1 7 2579 1 1 15 LYS O O 3.627 -3.893 -3.212 1.00 . A A . 15 LYS O 1 1 7 2580 1 1 16 GLN C C 2.374 -1.403 -2.726 1.00 . A A . 16 GLN C 1 1 7 2581 1 1 16 GLN CA C 1.899 -1.903 -4.092 1.00 . A A . 16 GLN CA 1 1 7 2582 1 1 16 GLN CB C 0.685 -1.106 -4.575 1.00 . A A . 16 GLN CB 1 1 7 2583 1 1 16 GLN CD C -1.228 -1.194 -6.217 1.00 . A A . 16 GLN CD 1 1 7 2584 1 1 16 GLN CG C 0.228 -1.586 -5.955 1.00 . A A . 16 GLN CG 1 1 7 2585 1 1 16 GLN H H 0.683 -3.575 -4.345 1.00 . A A . 16 GLN H 1 1 7 2586 1 1 16 GLN HA H 2.703 -1.806 -4.822 1.00 . A A . 16 GLN HA 1 1 7 2587 1 1 16 GLN HB3 H 0.936 -0.046 -4.620 1.00 . A A . 16 GLN HB3 1 1 7 2588 1 1 16 GLN HE21 H -1.009 -1.841 -8.123 1.00 . A A . 16 GLN HE21 1 1 7 2589 1 1 16 GLN HE22 H -2.575 -1.216 -7.727 1.00 . A A . 16 GLN HE22 1 1 7 2590 1 1 16 GLN HG3 H 0.336 -2.668 -6.022 1.00 . A A . 16 GLN HG3 1 1 7 2591 1 1 16 GLN N N 1.599 -3.323 -4.034 1.00 . A A . 16 GLN N 1 1 7 2592 1 1 16 GLN NE2 N -1.638 -1.437 -7.459 1.00 . A A . 16 GLN NE2 1 1 7 2593 1 1 16 GLN O O 3.305 -0.605 -2.642 1.00 . A A . 16 GLN O 1 1 7 2594 1 1 16 GLN OE1 O -1.932 -0.704 -5.349 1.00 . A A . 16 GLN OE1 1 1 7 2595 1 1 17 VAL C C 3.549 -1.736 -0.103 1.00 . A A . 17 VAL C 1 1 7 2596 1 1 17 VAL CA C 2.054 -1.509 -0.331 1.00 . A A . 17 VAL CA 1 1 7 2597 1 1 17 VAL CB C 1.176 -2.269 0.666 1.00 . A A . 17 VAL CB 1 1 7 2598 1 1 17 VAL CG1 C 1.497 -1.855 2.103 1.00 . A A . 17 VAL CG1 1 1 7 2599 1 1 17 VAL CG2 C -0.308 -2.065 0.355 1.00 . A A . 17 VAL CG2 1 1 7 2600 1 1 17 VAL H H 0.955 -2.545 -1.766 1.00 . A A . 17 VAL H 1 1 7 2601 1 1 17 VAL HA H 1.841 -0.446 -0.228 1.00 . A A . 17 VAL HA 1 1 7 2602 1 1 17 VAL HB H 1.396 -3.331 0.565 1.00 . A A . 17 VAL HB 1 1 7 2603 1 1 17 VAL HG11 H 1.044 -2.566 2.795 1.00 . A A . 17 VAL HG11 1 1 7 2604 1 1 17 VAL HG12 H 2.576 -1.846 2.247 1.00 . A A . 17 VAL HG12 1 1 7 2605 1 1 17 VAL HG13 H 1.096 -0.859 2.294 1.00 . A A . 17 VAL HG13 1 1 7 2606 1 1 17 VAL HG21 H -0.421 -1.736 -0.678 1.00 . A A . 17 VAL HG21 1 1 7 2607 1 1 17 VAL HG22 H -0.842 -3.005 0.498 1.00 . A A . 17 VAL HG22 1 1 7 2608 1 1 17 VAL HG23 H -0.719 -1.308 1.023 1.00 . A A . 17 VAL HG23 1 1 7 2609 1 1 17 VAL N N 1.711 -1.895 -1.689 1.00 . A A . 17 VAL N 1 1 7 2610 1 1 17 VAL O O 4.207 -0.942 0.568 1.00 . A A . 17 VAL O 1 1 7 2611 1 1 18 LYS C C 6.298 -2.089 -1.226 1.00 . A A . 18 LYS C 1 1 7 2612 1 1 18 LYS CA C 5.451 -3.164 -0.543 1.00 . A A . 18 LYS CA 1 1 7 2613 1 1 18 LYS CB C 5.711 -4.578 -1.068 1.00 . A A . 18 LYS CB 1 1 7 2614 1 1 18 LYS CD C 6.682 -4.224 -3.369 1.00 . A A . 18 LYS CD 1 1 7 2615 1 1 18 LYS CE C 6.431 -5.459 -4.236 1.00 . A A . 18 LYS CE 1 1 7 2616 1 1 18 LYS CG C 6.981 -4.621 -1.921 1.00 . A A . 18 LYS CG 1 1 7 2617 1 1 18 LYS H H 3.504 -3.465 -1.220 1.00 . A A . 18 LYS H 1 1 7 2618 1 1 18 LYS HA H 5.688 -3.167 0.521 1.00 . A A . 18 LYS HA 1 1 7 2619 1 1 18 LYS HB3 H 4.860 -4.913 -1.660 1.00 . A A . 18 LYS HB3 1 1 7 2620 1 1 18 LYS HD3 H 7.520 -3.655 -3.773 1.00 . A A . 18 LYS HD3 1 1 7 2621 1 1 18 LYS HE3 H 5.843 -5.183 -5.110 1.00 . A A . 18 LYS HE3 1 1 7 2622 1 1 18 LYS HG3 H 7.406 -5.624 -1.896 1.00 . A A . 18 LYS HG3 1 1 7 2623 1 1 18 LYS HZ1 H 8.132 -5.491 -5.366 1.00 . A A . 18 LYS HZ1 1 1 7 2624 1 1 18 LYS HZ2 H 8.327 -6.130 -3.875 1.00 . A A . 18 LYS HZ2 1 1 7 2625 1 1 18 LYS HZ3 H 7.544 -6.977 -5.031 1.00 . A A . 18 LYS HZ3 1 1 7 2626 1 1 18 LYS N N 4.045 -2.824 -0.675 1.00 . A A . 18 LYS N 1 1 7 2627 1 1 18 LYS NZ N 7.713 -6.063 -4.662 1.00 . A A . 18 LYS NZ 1 1 7 2628 1 1 18 LYS O O 7.386 -1.758 -0.754 1.00 . A A . 18 LYS O 1 1 7 2629 1 1 19 LYS C C 6.546 0.731 -2.233 1.00 . A A . 19 LYS C 1 1 7 2630 1 1 19 LYS CA C 6.464 -0.542 -3.077 1.00 . A A . 19 LYS CA 1 1 7 2631 1 1 19 LYS CB C 5.801 -0.336 -4.441 1.00 . A A . 19 LYS CB 1 1 7 2632 1 1 19 LYS CD C 4.594 1.838 -4.017 1.00 . A A . 19 LYS CD 1 1 7 2633 1 1 19 LYS CE C 3.368 2.050 -4.908 1.00 . A A . 19 LYS CE 1 1 7 2634 1 1 19 LYS CG C 5.722 1.152 -4.791 1.00 . A A . 19 LYS CG 1 1 7 2635 1 1 19 LYS H H 4.885 -1.849 -2.703 1.00 . A A . 19 LYS H 1 1 7 2636 1 1 19 LYS HA H 7.477 -0.900 -3.263 1.00 . A A . 19 LYS HA 1 1 7 2637 1 1 19 LYS HB3 H 4.799 -0.765 -4.431 1.00 . A A . 19 LYS HB3 1 1 7 2638 1 1 19 LYS HD3 H 4.941 2.799 -3.637 1.00 . A A . 19 LYS HD3 1 1 7 2639 1 1 19 LYS HE3 H 3.078 1.105 -5.368 1.00 . A A . 19 LYS HE3 1 1 7 2640 1 1 19 LYS HG3 H 5.556 1.268 -5.863 1.00 . A A . 19 LYS HG3 1 1 7 2641 1 1 19 LYS HZ1 H 1.463 2.768 -4.722 1.00 . A A . 19 LYS HZ1 1 1 7 2642 1 1 19 LYS HZ2 H 1.973 1.923 -3.420 1.00 . A A . 19 LYS HZ2 1 1 7 2643 1 1 19 LYS HZ3 H 2.520 3.440 -3.674 1.00 . A A . 19 LYS HZ3 1 1 7 2644 1 1 19 LYS N N 5.770 -1.574 -2.325 1.00 . A A . 19 LYS N 1 1 7 2645 1 1 19 LYS NZ N 2.239 2.589 -4.117 1.00 . A A . 19 LYS NZ 1 1 7 2646 1 1 19 LYS O O 7.356 1.614 -2.512 1.00 . A A . 19 LYS O 1 1 7 2647 1 1 20 LEU C C 6.522 1.649 0.901 1.00 . A A . 20 LEU C 1 1 7 2648 1 1 20 LEU CA C 5.663 1.935 -0.331 1.00 . A A . 20 LEU CA 1 1 7 2649 1 1 20 LEU CB C 4.217 2.313 0.001 1.00 . A A . 20 LEU CB 1 1 7 2650 1 1 20 LEU CD1 C 4.410 2.955 2.432 1.00 . A A . 20 LEU CD1 1 1 7 2651 1 1 20 LEU CD2 C 2.227 2.032 1.524 1.00 . A A . 20 LEU CD2 1 1 7 2652 1 1 20 LEU CG C 3.755 2.006 1.426 1.00 . A A . 20 LEU CG 1 1 7 2653 1 1 20 LEU H H 5.041 0.062 -0.998 1.00 . A A . 20 LEU H 1 1 7 2654 1 1 20 LEU HA H 6.100 2.776 -0.870 1.00 . A A . 20 LEU HA 1 1 7 2655 1 1 20 LEU HB3 H 3.558 1.793 -0.695 1.00 . A A . 20 LEU HB3 1 1 7 2656 1 1 20 LEU HD11 H 4.956 3.731 1.896 1.00 . A A . 20 LEU HD11 1 1 7 2657 1 1 20 LEU HD12 H 3.640 3.414 3.052 1.00 . A A . 20 LEU HD12 1 1 7 2658 1 1 20 LEU HD13 H 5.099 2.395 3.064 1.00 . A A . 20 LEU HD13 1 1 7 2659 1 1 20 LEU HD21 H 1.824 1.095 1.143 1.00 . A A . 20 LEU HD21 1 1 7 2660 1 1 20 LEU HD22 H 1.933 2.159 2.566 1.00 . A A . 20 LEU HD22 1 1 7 2661 1 1 20 LEU HD23 H 1.840 2.862 0.934 1.00 . A A . 20 LEU HD23 1 1 7 2662 1 1 20 LEU HG H 4.076 0.996 1.680 1.00 . A A . 20 LEU HG 1 1 7 2663 1 1 20 LEU N N 5.697 0.785 -1.218 1.00 . A A . 20 LEU N 1 1 7 2664 1 1 20 LEU O O 6.858 2.562 1.654 1.00 . A A . 20 LEU O 1 1 7 2665 1 1 21 PHE C C 9.157 0.070 1.871 1.00 . A A . 21 PHE C 1 1 7 2666 1 1 21 PHE CA C 7.668 -0.041 2.199 1.00 . A A . 21 PHE CA 1 1 7 2667 1 1 21 PHE CB C 7.326 -1.506 2.479 1.00 . A A . 21 PHE CB 1 1 7 2668 1 1 21 PHE CD1 C 7.278 -1.948 4.943 1.00 . A A . 21 PHE CD1 1 1 7 2669 1 1 21 PHE CD2 C 5.220 -1.715 3.818 1.00 . A A . 21 PHE CD2 1 1 7 2670 1 1 21 PHE CE1 C 6.586 -2.157 6.165 1.00 . A A . 21 PHE CE1 1 1 7 2671 1 1 21 PHE CE2 C 4.529 -1.925 5.040 1.00 . A A . 21 PHE CE2 1 1 7 2672 1 1 21 PHE CG C 6.581 -1.731 3.795 1.00 . A A . 21 PHE CG 1 1 7 2673 1 1 21 PHE CZ C 5.226 -2.141 6.188 1.00 . A A . 21 PHE CZ 1 1 7 2674 1 1 21 PHE H H 6.576 -0.360 0.454 1.00 . A A . 21 PHE H 1 1 7 2675 1 1 21 PHE HA H 7.430 0.621 3.032 1.00 . A A . 21 PHE HA 1 1 7 2676 1 1 21 PHE HB3 H 8.249 -2.087 2.490 1.00 . A A . 21 PHE HB3 1 1 7 2677 1 1 21 PHE HD1 H 8.368 -1.960 4.925 1.00 . A A . 21 PHE HD1 1 1 7 2678 1 1 21 PHE HD2 H 4.663 -1.542 2.899 1.00 . A A . 21 PHE HD2 1 1 7 2679 1 1 21 PHE HE1 H 7.144 -2.330 7.084 1.00 . A A . 21 PHE HE1 1 1 7 2680 1 1 21 PHE HE2 H 3.439 -1.912 5.059 1.00 . A A . 21 PHE HE2 1 1 7 2681 1 1 21 PHE HZ H 4.695 -2.302 7.126 1.00 . A A . 21 PHE HZ 1 1 7 2682 1 1 21 PHE N N 6.853 0.377 1.070 1.00 . A A . 21 PHE N 1 1 7 2683 1 1 21 PHE O O 9.994 0.107 2.773 1.00 . A A . 21 PHE O 1 1 7 2684 1 1 22 LYS C C 11.395 1.575 0.560 1.00 . A A . 22 LYS C 1 1 7 2685 1 1 22 LYS CA C 10.819 0.228 0.121 1.00 . A A . 22 LYS CA 1 1 7 2686 1 1 22 LYS CB C 10.902 -0.014 -1.388 1.00 . A A . 22 LYS CB 1 1 7 2687 1 1 22 LYS CD C 9.780 2.222 -1.708 1.00 . A A . 22 LYS CD 1 1 7 2688 1 1 22 LYS CE C 9.372 3.119 -2.879 1.00 . A A . 22 LYS CE 1 1 7 2689 1 1 22 LYS CG C 9.801 0.750 -2.126 1.00 . A A . 22 LYS CG 1 1 7 2690 1 1 22 LYS H H 8.758 0.091 -0.147 1.00 . A A . 22 LYS H 1 1 7 2691 1 1 22 LYS HA H 11.387 -0.566 0.606 1.00 . A A . 22 LYS HA 1 1 7 2692 1 1 22 LYS HB3 H 10.810 -1.080 -1.594 1.00 . A A . 22 LYS HB3 1 1 7 2693 1 1 22 LYS HD3 H 10.764 2.515 -1.345 1.00 . A A . 22 LYS HD3 1 1 7 2694 1 1 22 LYS HE3 H 9.151 2.507 -3.753 1.00 . A A . 22 LYS HE3 1 1 7 2695 1 1 22 LYS HG3 H 8.833 0.294 -1.917 1.00 . A A . 22 LYS HG3 1 1 7 2696 1 1 22 LYS HZ1 H 7.649 4.114 -3.344 1.00 . A A . 22 LYS HZ1 1 1 7 2697 1 1 22 LYS HZ2 H 7.626 3.429 -1.862 1.00 . A A . 22 LYS HZ2 1 1 7 2698 1 1 22 LYS HZ3 H 8.484 4.795 -2.117 1.00 . A A . 22 LYS HZ3 1 1 7 2699 1 1 22 LYS N N 9.444 0.121 0.579 1.00 . A A . 22 LYS N 1 1 7 2700 1 1 22 LYS NZ N 8.186 3.930 -2.521 1.00 . A A . 22 LYS NZ 1 1 7 2701 1 1 22 LYS O O 12.601 1.799 0.467 1.00 . A A . 22 LYS O 1 1 7 2702 1 1 23 LYS C C 10.623 3.888 2.981 1.00 . A A . 23 LYS C 1 1 7 2703 1 1 23 LYS CA C 10.912 3.757 1.484 1.00 . A A . 23 LYS CA 1 1 7 2704 1 1 23 LYS CB C 10.251 4.844 0.632 1.00 . A A . 23 LYS CB 1 1 7 2705 1 1 23 LYS CD C 8.053 6.068 0.794 1.00 . A A . 23 LYS CD 1 1 7 2706 1 1 23 LYS CE C 7.886 6.743 -0.569 1.00 . A A . 23 LYS CE 1 1 7 2707 1 1 23 LYS CG C 8.728 4.703 0.650 1.00 . A A . 23 LYS CG 1 1 7 2708 1 1 23 LYS H H 9.528 2.248 1.103 1.00 . A A . 23 LYS H 1 1 7 2709 1 1 23 LYS HA H 11.988 3.840 1.332 1.00 . A A . 23 LYS HA 1 1 7 2710 1 1 23 LYS HB3 H 10.615 4.778 -0.393 1.00 . A A . 23 LYS HB3 1 1 7 2711 1 1 23 LYS HD3 H 8.647 6.705 1.448 1.00 . A A . 23 LYS HD3 1 1 7 2712 1 1 23 LYS HE3 H 8.734 6.499 -1.209 1.00 . A A . 23 LYS HE3 1 1 7 2713 1 1 23 LYS HG3 H 8.428 4.056 1.475 1.00 . A A . 23 LYS HG3 1 1 7 2714 1 1 23 LYS HZ1 H 6.842 5.735 -2.009 1.00 . A A . 23 LYS HZ1 1 1 7 2715 1 1 23 LYS HZ2 H 6.085 5.778 -0.562 1.00 . A A . 23 LYS HZ2 1 1 7 2716 1 1 23 LYS HZ3 H 6.108 7.106 -1.510 1.00 . A A . 23 LYS HZ3 1 1 7 2717 1 1 23 LYS N N 10.507 2.438 1.031 1.00 . A A . 23 LYS N 1 1 7 2718 1 1 23 LYS NZ N 6.628 6.305 -1.214 1.00 . A A . 23 LYS NZ 1 1 7 2719 1 1 23 LYS O O 10.765 4.969 3.552 1.00 . A A . 23 LYS O 1 1 7 2720 1 1 24 TRP C C 11.096 2.117 5.726 1.00 . A A . 24 TRP C 1 1 7 2721 1 1 24 TRP CA C 9.912 2.750 4.993 1.00 . A A . 24 TRP CA 1 1 7 2722 1 1 24 TRP CB C 8.590 2.024 5.252 1.00 . A A . 24 TRP CB 1 1 7 2723 1 1 24 TRP CD1 C 7.268 4.083 4.430 1.00 . A A . 24 TRP CD1 1 1 7 2724 1 1 24 TRP CD2 C 6.008 2.600 5.488 1.00 . A A . 24 TRP CD2 1 1 7 2725 1 1 24 TRP CE2 C 5.187 3.641 5.104 1.00 . A A . 24 TRP CE2 1 1 7 2726 1 1 24 TRP CE3 C 5.505 1.489 6.187 1.00 . A A . 24 TRP CE3 1 1 7 2727 1 1 24 TRP CG C 7.349 2.896 5.047 1.00 . A A . 24 TRP CG 1 1 7 2728 1 1 24 TRP CH2 C 3.290 2.577 6.071 1.00 . A A . 24 TRP CH2 1 1 7 2729 1 1 24 TRP CZ2 C 3.814 3.674 5.376 1.00 . A A . 24 TRP CZ2 1 1 7 2730 1 1 24 TRP CZ3 C 4.130 1.538 6.450 1.00 . A A . 24 TRP CZ3 1 1 7 2731 1 1 24 TRP H H 10.109 1.899 3.101 1.00 . A A . 24 TRP H 1 1 7 2732 1 1 24 TRP HA H 9.777 3.781 5.321 1.00 . A A . 24 TRP HA 1 1 7 2733 1 1 24 TRP HB3 H 8.591 1.646 6.274 1.00 . A A . 24 TRP HB3 1 1 7 2734 1 1 24 TRP HD1 H 8.116 4.598 3.977 1.00 . A A . 24 TRP HD1 1 1 7 2735 1 1 24 TRP HE1 H 5.640 5.513 4.008 1.00 . A A . 24 TRP HE1 1 1 7 2736 1 1 24 TRP HE3 H 6.132 0.655 6.501 1.00 . A A . 24 TRP HE3 1 1 7 2737 1 1 24 TRP HH2 H 2.228 2.540 6.314 1.00 . A A . 24 TRP HH2 1 1 7 2738 1 1 24 TRP HZ2 H 3.186 4.508 5.062 1.00 . A A . 24 TRP HZ2 1 1 7 2739 1 1 24 TRP HZ3 H 3.688 0.700 6.991 1.00 . A A . 24 TRP HZ3 1 1 7 2740 1 1 24 TRP N N 10.221 2.773 3.573 1.00 . A A . 24 TRP N 1 1 7 2741 1 1 24 TRP NE1 N 5.978 4.571 4.441 1.00 . A A . 24 TRP NE1 1 1 7 2742 1 1 24 TRP O O 11.899 1.410 5.119 1.00 . A A . 24 TRP O 1 1 7 2743 1 1 25 GLY C C 11.683 1.176 9.092 1.00 . A A . 25 GLY C 1 1 7 2744 1 1 25 GLY CA C 12.239 1.860 7.841 1.00 . A A . 25 GLY CA 1 1 7 2745 1 1 25 GLY H H 10.509 2.969 7.505 1.00 . A A . 25 GLY H 1 1 7 2746 1 1 25 GLY HA2 H 12.825 1.146 7.262 1.00 . A A . 25 GLY HA2 1 1 7 2747 1 1 25 GLY HA3 H 12.913 2.665 8.132 1.00 . A A . 25 GLY HA3 1 1 7 2748 1 1 25 GLY N N 11.167 2.393 7.019 1.00 . A A . 25 GLY N 1 1 7 2749 1 1 25 GLY O O 10.903 0.230 8.991 1.00 . A A . 25 GLY O 1 1 7 2750 1 1 26 TRP C C 10.232 1.613 11.759 1.00 . A A . 26 TRP C 1 1 7 2751 1 1 26 TRP CA C 11.662 1.129 11.509 1.00 . A A . 26 TRP CA 1 1 7 2752 1 1 26 TRP CB C 12.625 1.502 12.638 1.00 . A A . 26 TRP CB 1 1 7 2753 1 1 26 TRP CD1 C 12.109 4.012 12.335 1.00 . A A . 26 TRP CD1 1 1 7 2754 1 1 26 TRP CD2 C 14.019 3.634 13.392 1.00 . A A . 26 TRP CD2 1 1 7 2755 1 1 26 TRP CE2 C 13.864 5.002 13.296 1.00 . A A . 26 TRP CE2 1 1 7 2756 1 1 26 TRP CE3 C 15.142 3.065 14.017 1.00 . A A . 26 TRP CE3 1 1 7 2757 1 1 26 TRP CG C 12.880 3.005 12.768 1.00 . A A . 26 TRP CG 1 1 7 2758 1 1 26 TRP CH2 C 15.923 5.371 14.430 1.00 . A A . 26 TRP CH2 1 1 7 2759 1 1 26 TRP CZ2 C 14.795 5.915 13.805 1.00 . A A . 26 TRP CZ2 1 1 7 2760 1 1 26 TRP CZ3 C 16.064 3.992 14.519 1.00 . A A . 26 TRP CZ3 1 1 7 2761 1 1 26 TRP H H 12.743 2.449 10.314 1.00 . A A . 26 TRP H 1 1 7 2762 1 1 26 TRP HA H 11.678 0.042 11.425 1.00 . A A . 26 TRP HA 1 1 7 2763 1 1 26 TRP HB3 H 13.576 0.996 12.472 1.00 . A A . 26 TRP HB3 1 1 7 2764 1 1 26 TRP HD1 H 11.162 3.880 11.813 1.00 . A A . 26 TRP HD1 1 1 7 2765 1 1 26 TRP HE1 H 12.244 6.215 12.394 1.00 . A A . 26 TRP HE1 1 1 7 2766 1 1 26 TRP HE3 H 15.287 1.988 14.104 1.00 . A A . 26 TRP HE3 1 1 7 2767 1 1 26 TRP HH2 H 16.687 6.027 14.848 1.00 . A A . 26 TRP HH2 1 1 7 2768 1 1 26 TRP HZ2 H 14.650 6.992 13.717 1.00 . A A . 26 TRP HZ2 1 1 7 2769 1 1 26 TRP HZ3 H 16.955 3.604 15.013 1.00 . A A . 26 TRP HZ3 1 1 7 2770 1 1 26 TRP N N 12.107 1.679 10.241 1.00 . A A . 26 TRP N 1 1 7 2771 1 1 26 TRP NE1 N 12.666 5.240 12.634 1.00 . A A . 26 TRP NE1 1 1 7 2772 1 1 26 TRP O O 9.287 0.827 11.705 1.00 . A A . 26 TRP O 1 1 8 2773 1 1 1 LYS C C -8.650 10.668 8.899 1.00 . A A . 1 LYS C 1 1 8 2774 1 1 1 LYS CA C -9.825 11.449 8.307 1.00 . A A . 1 LYS CA 1 1 8 2775 1 1 1 LYS CB C -9.407 12.497 7.273 1.00 . A A . 1 LYS CB 1 1 8 2776 1 1 1 LYS CD C -6.925 12.891 7.479 1.00 . A A . 1 LYS CD 1 1 8 2777 1 1 1 LYS CE C -5.923 13.204 8.593 1.00 . A A . 1 LYS CE 1 1 8 2778 1 1 1 LYS CG C -8.318 13.415 7.832 1.00 . A A . 1 LYS CG 1 1 8 2779 1 1 1 LYS H1 H -11.574 12.034 9.274 1.00 . A A . 1 LYS H1 1 1 8 2780 1 1 1 LYS HA H -10.488 10.746 7.803 1.00 . A A . 1 LYS HA 1 1 8 2781 1 1 1 LYS HB3 H -10.273 13.091 6.981 1.00 . A A . 1 LYS HB3 1 1 8 2782 1 1 1 LYS HD3 H -6.588 13.341 6.546 1.00 . A A . 1 LYS HD3 1 1 8 2783 1 1 1 LYS HE3 H -5.023 12.605 8.459 1.00 . A A . 1 LYS HE3 1 1 8 2784 1 1 1 LYS HG3 H -8.420 13.488 8.914 1.00 . A A . 1 LYS HG3 1 1 8 2785 1 1 1 LYS HZ1 H -6.386 15.183 8.807 1.00 . A A . 1 LYS HZ1 1 1 8 2786 1 1 1 LYS HZ2 H -4.863 14.815 9.268 1.00 . A A . 1 LYS HZ2 1 1 8 2787 1 1 1 LYS HZ3 H -5.237 14.899 7.680 1.00 . A A . 1 LYS HZ3 1 1 8 2788 1 1 1 LYS N N -10.581 12.067 9.382 1.00 . A A . 1 LYS N 1 1 8 2789 1 1 1 LYS NZ N -5.574 14.642 8.587 1.00 . A A . 1 LYS NZ 1 1 8 2790 1 1 1 LYS O O -8.015 11.121 9.850 1.00 . A A . 1 LYS O 1 1 8 2791 1 1 2 SER C C -6.976 7.614 7.704 1.00 . A A . 2 SER C 1 1 8 2792 1 1 2 SER CA C -7.309 8.659 8.770 1.00 . A A . 2 SER CA 1 1 8 2793 1 1 2 SER CB C -7.663 7.975 10.092 1.00 . A A . 2 SER CB 1 1 8 2794 1 1 2 SER H H -8.917 9.147 7.539 1.00 . A A . 2 SER H 1 1 8 2795 1 1 2 SER HA H -6.464 9.331 8.925 1.00 . A A . 2 SER HA 1 1 8 2796 1 1 2 SER HB3 H -7.845 8.732 10.855 1.00 . A A . 2 SER HB3 1 1 8 2797 1 1 2 SER HG H -9.163 6.908 10.876 1.00 . A A . 2 SER HG 1 1 8 2798 1 1 2 SER N N -8.395 9.507 8.312 1.00 . A A . 2 SER N 1 1 8 2799 1 1 2 SER O O -7.535 6.519 7.708 1.00 . A A . 2 SER O 1 1 8 2800 1 1 2 SER OG O -8.810 7.139 9.970 1.00 . A A . 2 SER OG 1 1 8 2801 1 1 3 SER C C -6.803 6.895 4.759 1.00 . A A . 3 SER C 1 1 8 2802 1 1 3 SER CA C -5.652 7.098 5.747 1.00 . A A . 3 SER CA 1 1 8 2803 1 1 3 SER CB C -5.185 5.750 6.302 1.00 . A A . 3 SER CB 1 1 8 2804 1 1 3 SER H H -5.615 8.882 6.820 1.00 . A A . 3 SER H 1 1 8 2805 1 1 3 SER HA H -4.815 7.599 5.261 1.00 . A A . 3 SER HA 1 1 8 2806 1 1 3 SER HB3 H -4.820 5.128 5.484 1.00 . A A . 3 SER HB3 1 1 8 2807 1 1 3 SER HG H -4.365 6.677 7.875 1.00 . A A . 3 SER HG 1 1 8 2808 1 1 3 SER N N -6.066 7.989 6.816 1.00 . A A . 3 SER N 1 1 8 2809 1 1 3 SER O O -6.736 7.350 3.619 1.00 . A A . 3 SER O 1 1 8 2810 1 1 3 SER OG O -4.157 5.902 7.277 1.00 . A A . 3 SER OG 1 1 8 2811 1 1 4 ALA C C -8.540 5.532 3.006 1.00 . A A . 4 ALA C 1 1 8 2812 1 1 4 ALA CA C -8.998 5.941 4.408 1.00 . A A . 4 ALA CA 1 1 8 2813 1 1 4 ALA CB C -9.906 7.173 4.388 1.00 . A A . 4 ALA CB 1 1 8 2814 1 1 4 ALA H H -7.881 5.843 6.163 1.00 . A A . 4 ALA H 1 1 8 2815 1 1 4 ALA HA H -9.541 5.112 4.859 1.00 . A A . 4 ALA HA 1 1 8 2816 1 1 4 ALA HB1 H -9.530 7.889 3.659 1.00 . A A . 4 ALA HB1 1 1 8 2817 1 1 4 ALA HB2 H -10.918 6.873 4.116 1.00 . A A . 4 ALA HB2 1 1 8 2818 1 1 4 ALA HB3 H -9.916 7.632 5.377 1.00 . A A . 4 ALA HB3 1 1 8 2819 1 1 4 ALA N N -7.834 6.210 5.234 1.00 . A A . 4 ALA N 1 1 8 2820 1 1 4 ALA O O -7.517 4.867 2.853 1.00 . A A . 4 ALA O 1 1 8 2821 1 1 5 TYR C C -8.861 4.124 0.436 1.00 . A A . 5 TYR C 1 1 8 2822 1 1 5 TYR CA C -9.006 5.634 0.635 1.00 . A A . 5 TYR CA 1 1 8 2823 1 1 5 TYR CB C -7.664 6.307 0.343 1.00 . A A . 5 TYR CB 1 1 8 2824 1 1 5 TYR CD1 C -8.505 7.804 -1.504 1.00 . A A . 5 TYR CD1 1 1 8 2825 1 1 5 TYR CD2 C -7.181 8.779 0.231 1.00 . A A . 5 TYR CD2 1 1 8 2826 1 1 5 TYR CE1 C -8.621 9.091 -2.139 1.00 . A A . 5 TYR CE1 1 1 8 2827 1 1 5 TYR CE2 C -7.298 10.067 -0.403 1.00 . A A . 5 TYR CE2 1 1 8 2828 1 1 5 TYR CG C -7.787 7.675 -0.331 1.00 . A A . 5 TYR CG 1 1 8 2829 1 1 5 TYR CZ C -8.012 10.159 -1.557 1.00 . A A . 5 TYR CZ 1 1 8 2830 1 1 5 TYR H H -10.149 6.489 2.152 1.00 . A A . 5 TYR H 1 1 8 2831 1 1 5 TYR HA H -9.825 5.998 0.014 1.00 . A A . 5 TYR HA 1 1 8 2832 1 1 5 TYR HB3 H -7.072 5.652 -0.295 1.00 . A A . 5 TYR HB3 1 1 8 2833 1 1 5 TYR HD1 H -8.983 6.932 -1.948 1.00 . A A . 5 TYR HD1 1 1 8 2834 1 1 5 TYR HD2 H -6.615 8.677 1.158 1.00 . A A . 5 TYR HD2 1 1 8 2835 1 1 5 TYR HE1 H -9.184 9.207 -3.064 1.00 . A A . 5 TYR HE1 1 1 8 2836 1 1 5 TYR HE2 H -6.825 10.947 0.032 1.00 . A A . 5 TYR HE2 1 1 8 2837 1 1 5 TYR HH H -8.971 11.819 -1.874 1.00 . A A . 5 TYR HH 1 1 8 2838 1 1 5 TYR N N -9.320 5.948 2.019 1.00 . A A . 5 TYR N 1 1 8 2839 1 1 5 TYR O O -8.043 3.676 -0.366 1.00 . A A . 5 TYR O 1 1 8 2840 1 1 5 TYR OH O -8.121 11.374 -2.157 1.00 . A A . 5 TYR OH 1 1 8 2841 1 1 6 SER C C -8.285 1.405 1.573 1.00 . A A . 6 SER C 1 1 8 2842 1 1 6 SER CA C -9.638 1.930 1.092 1.00 . A A . 6 SER CA 1 1 8 2843 1 1 6 SER CB C -9.915 1.457 -0.336 1.00 . A A . 6 SER CB 1 1 8 2844 1 1 6 SER H H -10.331 3.752 1.828 1.00 . A A . 6 SER H 1 1 8 2845 1 1 6 SER HA H -10.438 1.586 1.750 1.00 . A A . 6 SER HA 1 1 8 2846 1 1 6 SER HB3 H -10.058 0.376 -0.338 1.00 . A A . 6 SER HB3 1 1 8 2847 1 1 6 SER HG H -10.791 2.700 -1.636 1.00 . A A . 6 SER HG 1 1 8 2848 1 1 6 SER N N -9.668 3.381 1.179 1.00 . A A . 6 SER N 1 1 8 2849 1 1 6 SER O O -7.277 2.105 1.488 1.00 . A A . 6 SER O 1 1 8 2850 1 1 6 SER OG O -11.064 2.088 -0.894 1.00 . A A . 6 SER OG 1 1 8 2851 1 1 7 LEU C C -6.904 -1.804 1.872 1.00 . A A . 7 LEU C 1 1 8 2852 1 1 7 LEU CA C -7.090 -0.452 2.562 1.00 . A A . 7 LEU CA 1 1 8 2853 1 1 7 LEU CB C -7.115 -0.538 4.089 1.00 . A A . 7 LEU CB 1 1 8 2854 1 1 7 LEU CD1 C -8.157 -2.566 5.166 1.00 . A A . 7 LEU CD1 1 1 8 2855 1 1 7 LEU CD2 C -8.904 -0.237 5.841 1.00 . A A . 7 LEU CD2 1 1 8 2856 1 1 7 LEU CG C -8.386 -1.124 4.707 1.00 . A A . 7 LEU CG 1 1 8 2857 1 1 7 LEU H H -9.128 -0.387 2.133 1.00 . A A . 7 LEU H 1 1 8 2858 1 1 7 LEU HA H -6.255 0.193 2.289 1.00 . A A . 7 LEU HA 1 1 8 2859 1 1 7 LEU HB3 H -6.967 0.464 4.492 1.00 . A A . 7 LEU HB3 1 1 8 2860 1 1 7 LEU HD11 H -7.095 -2.726 5.346 1.00 . A A . 7 LEU HD11 1 1 8 2861 1 1 7 LEU HD12 H -8.713 -2.746 6.087 1.00 . A A . 7 LEU HD12 1 1 8 2862 1 1 7 LEU HD13 H -8.503 -3.252 4.393 1.00 . A A . 7 LEU HD13 1 1 8 2863 1 1 7 LEU HD21 H -9.910 -0.551 6.116 1.00 . A A . 7 LEU HD21 1 1 8 2864 1 1 7 LEU HD22 H -8.245 -0.329 6.704 1.00 . A A . 7 LEU HD22 1 1 8 2865 1 1 7 LEU HD23 H -8.925 0.801 5.509 1.00 . A A . 7 LEU HD23 1 1 8 2866 1 1 7 LEU HG H -9.159 -1.149 3.939 1.00 . A A . 7 LEU HG 1 1 8 2867 1 1 7 LEU N N -8.304 0.175 2.067 1.00 . A A . 7 LEU N 1 1 8 2868 1 1 7 LEU O O -5.867 -2.057 1.261 1.00 . A A . 7 LEU O 1 1 8 2869 1 1 8 GLN C C -9.145 -4.200 0.555 1.00 . A A . 8 GLN C 1 1 8 2870 1 1 8 GLN CA C -7.887 -3.962 1.390 1.00 . A A . 8 GLN CA 1 1 8 2871 1 1 8 GLN CB C -7.721 -5.047 2.456 1.00 . A A . 8 GLN CB 1 1 8 2872 1 1 8 GLN CD C -6.972 -7.435 2.769 1.00 . A A . 8 GLN CD 1 1 8 2873 1 1 8 GLN CG C -7.630 -6.434 1.817 1.00 . A A . 8 GLN CG 1 1 8 2874 1 1 8 GLN H H -8.765 -2.429 2.493 1.00 . A A . 8 GLN H 1 1 8 2875 1 1 8 GLN HA H -7.008 -3.960 0.744 1.00 . A A . 8 GLN HA 1 1 8 2876 1 1 8 GLN HB3 H -8.566 -5.017 3.145 1.00 . A A . 8 GLN HB3 1 1 8 2877 1 1 8 GLN HE21 H -8.556 -8.665 2.496 1.00 . A A . 8 GLN HE21 1 1 8 2878 1 1 8 GLN HE22 H -7.332 -9.260 3.566 1.00 . A A . 8 GLN HE22 1 1 8 2879 1 1 8 GLN HG3 H -7.055 -6.374 0.892 1.00 . A A . 8 GLN HG3 1 1 8 2880 1 1 8 GLN N N -7.924 -2.641 1.994 1.00 . A A . 8 GLN N 1 1 8 2881 1 1 8 GLN NE2 N -7.679 -8.545 2.959 1.00 . A A . 8 GLN NE2 1 1 8 2882 1 1 8 GLN O O -10.225 -3.726 0.903 1.00 . A A . 8 GLN O 1 1 8 2883 1 1 8 GLN OE1 O -5.894 -7.212 3.297 1.00 . A A . 8 GLN OE1 1 1 8 2884 1 1 9 MET C C -9.611 -6.102 -2.598 1.00 . A A . 9 MET C 1 1 8 2885 1 1 9 MET CA C -10.074 -5.243 -1.421 1.00 . A A . 9 MET CA 1 1 8 2886 1 1 9 MET CB C -10.683 -3.941 -1.946 1.00 . A A . 9 MET CB 1 1 8 2887 1 1 9 MET CE C -10.550 -1.623 -4.831 1.00 . A A . 9 MET CE 1 1 8 2888 1 1 9 MET CG C -9.651 -3.132 -2.735 1.00 . A A . 9 MET CG 1 1 8 2889 1 1 9 MET H H -8.084 -5.318 -0.809 1.00 . A A . 9 MET H 1 1 8 2890 1 1 9 MET HA H -10.788 -5.800 -0.815 1.00 . A A . 9 MET HA 1 1 8 2891 1 1 9 MET HB3 H -11.056 -3.348 -1.113 1.00 . A A . 9 MET HB3 1 1 8 2892 1 1 9 MET HE1 H -9.625 -1.933 -5.317 1.00 . A A . 9 MET HE1 1 1 8 2893 1 1 9 MET HE2 H -11.329 -2.359 -5.028 1.00 . A A . 9 MET HE2 1 1 8 2894 1 1 9 MET HE3 H -10.859 -0.653 -5.222 1.00 . A A . 9 MET HE3 1 1 8 2895 1 1 9 MET HG3 H -9.417 -3.640 -3.671 1.00 . A A . 9 MET HG3 1 1 8 2896 1 1 9 MET N N -8.966 -4.936 -0.532 1.00 . A A . 9 MET N 1 1 8 2897 1 1 9 MET O O -10.334 -6.991 -3.046 1.00 . A A . 9 MET O 1 1 8 2898 1 1 9 MET SD S -10.283 -1.498 -3.071 1.00 . A A . 9 MET SD 1 1 8 2899 1 1 10 GLY C C -6.645 -7.387 -3.735 1.00 . A A . 10 GLY C 1 1 8 2900 1 1 10 GLY CA C -7.838 -6.543 -4.185 1.00 . A A . 10 GLY CA 1 1 8 2901 1 1 10 GLY H H -7.824 -5.083 -2.697 1.00 . A A . 10 GLY H 1 1 8 2902 1 1 10 GLY HA2 H -8.599 -7.187 -4.626 1.00 . A A . 10 GLY HA2 1 1 8 2903 1 1 10 GLY HA3 H -7.524 -5.845 -4.961 1.00 . A A . 10 GLY HA3 1 1 8 2904 1 1 10 GLY N N -8.407 -5.808 -3.067 1.00 . A A . 10 GLY N 1 1 8 2905 1 1 10 GLY O O -6.812 -8.370 -3.014 1.00 . A A . 10 GLY O 1 1 8 2906 1 1 11 ALA C C -3.040 -6.882 -4.333 1.00 . A A . 11 ALA C 1 1 8 2907 1 1 11 ALA CA C -4.246 -7.679 -3.832 1.00 . A A . 11 ALA CA 1 1 8 2908 1 1 11 ALA CB C -4.291 -9.095 -4.413 1.00 . A A . 11 ALA CB 1 1 8 2909 1 1 11 ALA H H -5.340 -6.173 -4.765 1.00 . A A . 11 ALA H 1 1 8 2910 1 1 11 ALA HA H -4.199 -7.748 -2.745 1.00 . A A . 11 ALA HA 1 1 8 2911 1 1 11 ALA HB1 H -3.958 -9.072 -5.450 1.00 . A A . 11 ALA HB1 1 1 8 2912 1 1 11 ALA HB2 H -3.636 -9.746 -3.835 1.00 . A A . 11 ALA HB2 1 1 8 2913 1 1 11 ALA HB3 H -5.313 -9.474 -4.367 1.00 . A A . 11 ALA HB3 1 1 8 2914 1 1 11 ALA N N -5.467 -6.974 -4.180 1.00 . A A . 11 ALA N 1 1 8 2915 1 1 11 ALA O O -2.249 -6.379 -3.537 1.00 . A A . 11 ALA O 1 1 8 2916 1 1 12 THR C C -1.554 -4.776 -5.494 1.00 . A A . 12 THR C 1 1 8 2917 1 1 12 THR CA C -1.841 -6.064 -6.268 1.00 . A A . 12 THR CA 1 1 8 2918 1 1 12 THR CB C -2.199 -5.824 -7.736 1.00 . A A . 12 THR CB 1 1 8 2919 1 1 12 THR CG2 C -3.617 -5.274 -7.910 1.00 . A A . 12 THR CG2 1 1 8 2920 1 1 12 THR H H -3.584 -7.204 -6.292 1.00 . A A . 12 THR H 1 1 8 2921 1 1 12 THR HA H -0.943 -6.680 -6.208 1.00 . A A . 12 THR HA 1 1 8 2922 1 1 12 THR HB H -2.059 -6.730 -8.324 1.00 . A A . 12 THR HB 1 1 8 2923 1 1 12 THR HG1 H -1.433 -4.590 -9.112 1.00 . A A . 12 THR HG1 1 1 8 2924 1 1 12 THR HG21 H -4.165 -5.378 -6.973 1.00 . A A . 12 THR HG21 1 1 8 2925 1 1 12 THR HG22 H -3.567 -4.221 -8.187 1.00 . A A . 12 THR HG22 1 1 8 2926 1 1 12 THR HG23 H -4.129 -5.831 -8.694 1.00 . A A . 12 THR HG23 1 1 8 2927 1 1 12 THR N N -2.937 -6.792 -5.652 1.00 . A A . 12 THR N 1 1 8 2928 1 1 12 THR O O -0.403 -4.483 -5.174 1.00 . A A . 12 THR O 1 1 8 2929 1 1 12 THR OG1 O -1.357 -4.744 -8.127 1.00 . A A . 12 THR OG1 1 1 8 2930 1 1 13 ALA C C -1.465 -2.957 -3.369 1.00 . A A . 13 ALA C 1 1 8 2931 1 1 13 ALA CA C -2.497 -2.790 -4.486 1.00 . A A . 13 ALA CA 1 1 8 2932 1 1 13 ALA CB C -3.870 -2.372 -3.955 1.00 . A A . 13 ALA CB 1 1 8 2933 1 1 13 ALA H H -3.553 -4.285 -5.480 1.00 . A A . 13 ALA H 1 1 8 2934 1 1 13 ALA HA H -2.145 -2.031 -5.184 1.00 . A A . 13 ALA HA 1 1 8 2935 1 1 13 ALA HB1 H -4.573 -3.196 -4.076 1.00 . A A . 13 ALA HB1 1 1 8 2936 1 1 13 ALA HB2 H -3.788 -2.115 -2.898 1.00 . A A . 13 ALA HB2 1 1 8 2937 1 1 13 ALA HB3 H -4.227 -1.506 -4.512 1.00 . A A . 13 ALA HB3 1 1 8 2938 1 1 13 ALA N N -2.621 -4.040 -5.216 1.00 . A A . 13 ALA N 1 1 8 2939 1 1 13 ALA O O -0.597 -2.105 -3.188 1.00 . A A . 13 ALA O 1 1 8 2940 1 1 14 ILE C C 0.753 -4.098 -2.010 1.00 . A A . 14 ILE C 1 1 8 2941 1 1 14 ILE CA C -0.684 -4.349 -1.552 1.00 . A A . 14 ILE CA 1 1 8 2942 1 1 14 ILE CB C -0.921 -5.763 -1.017 1.00 . A A . 14 ILE CB 1 1 8 2943 1 1 14 ILE CD1 C -2.665 -7.369 -0.156 1.00 . A A . 14 ILE CD1 1 1 8 2944 1 1 14 ILE CG1 C -2.333 -5.903 -0.445 1.00 . A A . 14 ILE CG1 1 1 8 2945 1 1 14 ILE CG2 C 0.152 -6.151 0.002 1.00 . A A . 14 ILE CG2 1 1 8 2946 1 1 14 ILE H H -2.304 -4.748 -2.800 1.00 . A A . 14 ILE H 1 1 8 2947 1 1 14 ILE HA H -0.915 -3.656 -0.743 1.00 . A A . 14 ILE HA 1 1 8 2948 1 1 14 ILE HB H -0.842 -6.461 -1.850 1.00 . A A . 14 ILE HB 1 1 8 2949 1 1 14 ILE HD11 H -3.127 -7.816 -1.036 1.00 . A A . 14 ILE HD11 1 1 8 2950 1 1 14 ILE HD12 H -1.749 -7.907 0.087 1.00 . A A . 14 ILE HD12 1 1 8 2951 1 1 14 ILE HD13 H -3.355 -7.426 0.685 1.00 . A A . 14 ILE HD13 1 1 8 2952 1 1 14 ILE HG13 H -3.058 -5.493 -1.148 1.00 . A A . 14 ILE HG13 1 1 8 2953 1 1 14 ILE HG21 H -0.052 -5.655 0.951 1.00 . A A . 14 ILE HG21 1 1 8 2954 1 1 14 ILE HG22 H 0.142 -7.232 0.147 1.00 . A A . 14 ILE HG22 1 1 8 2955 1 1 14 ILE HG23 H 1.131 -5.842 -0.366 1.00 . A A . 14 ILE HG23 1 1 8 2956 1 1 14 ILE N N -1.595 -4.060 -2.647 1.00 . A A . 14 ILE N 1 1 8 2957 1 1 14 ILE O O 1.493 -3.355 -1.366 1.00 . A A . 14 ILE O 1 1 8 2958 1 1 15 LYS C C 2.853 -3.112 -3.620 1.00 . A A . 15 LYS C 1 1 8 2959 1 1 15 LYS CA C 2.443 -4.585 -3.671 1.00 . A A . 15 LYS CA 1 1 8 2960 1 1 15 LYS CB C 2.513 -5.194 -5.074 1.00 . A A . 15 LYS CB 1 1 8 2961 1 1 15 LYS CD C 3.939 -3.433 -6.179 1.00 . A A . 15 LYS CD 1 1 8 2962 1 1 15 LYS CE C 4.708 -3.301 -7.495 1.00 . A A . 15 LYS CE 1 1 8 2963 1 1 15 LYS CG C 3.860 -4.894 -5.734 1.00 . A A . 15 LYS CG 1 1 8 2964 1 1 15 LYS H H 0.498 -5.333 -3.637 1.00 . A A . 15 LYS H 1 1 8 2965 1 1 15 LYS HA H 3.122 -5.156 -3.038 1.00 . A A . 15 LYS HA 1 1 8 2966 1 1 15 LYS HB3 H 1.706 -4.796 -5.687 1.00 . A A . 15 LYS HB3 1 1 8 2967 1 1 15 LYS HD3 H 4.428 -2.840 -5.407 1.00 . A A . 15 LYS HD3 1 1 8 2968 1 1 15 LYS HE3 H 4.963 -4.291 -7.875 1.00 . A A . 15 LYS HE3 1 1 8 2969 1 1 15 LYS HG3 H 3.999 -5.549 -6.596 1.00 . A A . 15 LYS HG3 1 1 8 2970 1 1 15 LYS HZ1 H 4.502 -2.005 -9.062 1.00 . A A . 15 LYS HZ1 1 1 8 2971 1 1 15 LYS HZ2 H 3.419 -3.227 -9.078 1.00 . A A . 15 LYS HZ2 1 1 8 2972 1 1 15 LYS HZ3 H 3.236 -1.989 -8.030 1.00 . A A . 15 LYS HZ3 1 1 8 2973 1 1 15 LYS N N 1.106 -4.730 -3.120 1.00 . A A . 15 LYS N 1 1 8 2974 1 1 15 LYS NZ N 3.900 -2.571 -8.498 1.00 . A A . 15 LYS NZ 1 1 8 2975 1 1 15 LYS O O 3.981 -2.791 -3.247 1.00 . A A . 15 LYS O 1 1 8 2976 1 1 16 GLN C C 2.612 -0.363 -2.610 1.00 . A A . 16 GLN C 1 1 8 2977 1 1 16 GLN CA C 2.167 -0.824 -3.999 1.00 . A A . 16 GLN CA 1 1 8 2978 1 1 16 GLN CB C 0.930 -0.051 -4.463 1.00 . A A . 16 GLN CB 1 1 8 2979 1 1 16 GLN CD C -1.041 1.343 -3.737 1.00 . A A . 16 GLN CD 1 1 8 2980 1 1 16 GLN CG C 0.235 0.631 -3.284 1.00 . A A . 16 GLN CG 1 1 8 2981 1 1 16 GLN H H 1.001 -2.525 -4.300 1.00 . A A . 16 GLN H 1 1 8 2982 1 1 16 GLN HA H 2.973 -0.672 -4.717 1.00 . A A . 16 GLN HA 1 1 8 2983 1 1 16 GLN HB3 H 0.236 -0.733 -4.955 1.00 . A A . 16 GLN HB3 1 1 8 2984 1 1 16 GLN HE21 H -1.100 2.278 -1.943 1.00 . A A . 16 GLN HE21 1 1 8 2985 1 1 16 GLN HE22 H -2.386 2.682 -3.031 1.00 . A A . 16 GLN HE22 1 1 8 2986 1 1 16 GLN HG3 H 0.914 1.349 -2.824 1.00 . A A . 16 GLN HG3 1 1 8 2987 1 1 16 GLN N N 1.916 -2.255 -3.998 1.00 . A A . 16 GLN N 1 1 8 2988 1 1 16 GLN NE2 N -1.550 2.170 -2.829 1.00 . A A . 16 GLN NE2 1 1 8 2989 1 1 16 GLN O O 3.535 0.442 -2.487 1.00 . A A . 16 GLN O 1 1 8 2990 1 1 16 GLN OE1 O -1.530 1.155 -4.839 1.00 . A A . 16 GLN OE1 1 1 8 2991 1 1 17 VAL C C 3.739 -0.787 0.030 1.00 . A A . 17 VAL C 1 1 8 2992 1 1 17 VAL CA C 2.250 -0.543 -0.226 1.00 . A A . 17 VAL CA 1 1 8 2993 1 1 17 VAL CB C 1.344 -1.318 0.731 1.00 . A A . 17 VAL CB 1 1 8 2994 1 1 17 VAL CG1 C 1.886 -2.728 0.978 1.00 . A A . 17 VAL CG1 1 1 8 2995 1 1 17 VAL CG2 C 1.163 -0.563 2.049 1.00 . A A . 17 VAL CG2 1 1 8 2996 1 1 17 VAL H H 1.187 -1.544 -1.710 1.00 . A A . 17 VAL H 1 1 8 2997 1 1 17 VAL HA H 2.043 0.520 -0.100 1.00 . A A . 17 VAL HA 1 1 8 2998 1 1 17 VAL HB H 0.365 -1.414 0.262 1.00 . A A . 17 VAL HB 1 1 8 2999 1 1 17 VAL HG11 H 1.100 -3.458 0.787 1.00 . A A . 17 VAL HG11 1 1 8 3000 1 1 17 VAL HG12 H 2.727 -2.916 0.310 1.00 . A A . 17 VAL HG12 1 1 8 3001 1 1 17 VAL HG13 H 2.218 -2.814 2.013 1.00 . A A . 17 VAL HG13 1 1 8 3002 1 1 17 VAL HG21 H 0.506 -1.132 2.707 1.00 . A A . 17 VAL HG21 1 1 8 3003 1 1 17 VAL HG22 H 2.132 -0.431 2.529 1.00 . A A . 17 VAL HG22 1 1 8 3004 1 1 17 VAL HG23 H 0.720 0.413 1.850 1.00 . A A . 17 VAL HG23 1 1 8 3005 1 1 17 VAL N N 1.936 -0.891 -1.601 1.00 . A A . 17 VAL N 1 1 8 3006 1 1 17 VAL O O 4.369 -0.059 0.794 1.00 . A A . 17 VAL O 1 1 8 3007 1 1 18 LYS C C 6.525 -1.032 -1.028 1.00 . A A . 18 LYS C 1 1 8 3008 1 1 18 LYS CA C 5.660 -2.167 -0.477 1.00 . A A . 18 LYS CA 1 1 8 3009 1 1 18 LYS CB C 5.944 -3.524 -1.123 1.00 . A A . 18 LYS CB 1 1 8 3010 1 1 18 LYS CD C 6.991 -2.968 -3.348 1.00 . A A . 18 LYS CD 1 1 8 3011 1 1 18 LYS CE C 6.782 -4.126 -4.327 1.00 . A A . 18 LYS CE 1 1 8 3012 1 1 18 LYS CG C 7.243 -3.487 -1.932 1.00 . A A . 18 LYS CG 1 1 8 3013 1 1 18 LYS H H 3.739 -2.404 -1.244 1.00 . A A . 18 LYS H 1 1 8 3014 1 1 18 LYS HA H 5.862 -2.268 0.589 1.00 . A A . 18 LYS HA 1 1 8 3015 1 1 18 LYS HB3 H 5.115 -3.803 -1.773 1.00 . A A . 18 LYS HB3 1 1 8 3016 1 1 18 LYS HD3 H 7.838 -2.362 -3.673 1.00 . A A . 18 LYS HD3 1 1 8 3017 1 1 18 LYS HE3 H 6.166 -3.796 -5.164 1.00 . A A . 18 LYS HE3 1 1 8 3018 1 1 18 LYS HG3 H 7.676 -4.486 -1.977 1.00 . A A . 18 LYS HG3 1 1 8 3019 1 1 18 LYS HZ1 H 8.012 -4.819 -5.805 1.00 . A A . 18 LYS HZ1 1 1 8 3020 1 1 18 LYS HZ2 H 8.786 -3.930 -4.676 1.00 . A A . 18 LYS HZ2 1 1 8 3021 1 1 18 LYS HZ3 H 8.329 -5.461 -4.337 1.00 . A A . 18 LYS HZ3 1 1 8 3022 1 1 18 LYS N N 4.258 -1.816 -0.624 1.00 . A A . 18 LYS N 1 1 8 3023 1 1 18 LYS NZ N 8.082 -4.624 -4.826 1.00 . A A . 18 LYS NZ 1 1 8 3024 1 1 18 LYS O O 7.581 -0.727 -0.476 1.00 . A A . 18 LYS O 1 1 8 3025 1 1 19 LYS C C 6.757 1.871 -1.808 1.00 . A A . 19 LYS C 1 1 8 3026 1 1 19 LYS CA C 6.762 0.659 -2.741 1.00 . A A . 19 LYS CA 1 1 8 3027 1 1 19 LYS CB C 6.184 0.949 -4.128 1.00 . A A . 19 LYS CB 1 1 8 3028 1 1 19 LYS CD C 4.821 3.009 -3.616 1.00 . A A . 19 LYS CD 1 1 8 3029 1 1 19 LYS CE C 3.652 3.236 -4.577 1.00 . A A . 19 LYS CE 1 1 8 3030 1 1 19 LYS CG C 6.040 2.455 -4.358 1.00 . A A . 19 LYS CG 1 1 8 3031 1 1 19 LYS H H 5.186 -0.690 -2.553 1.00 . A A . 19 LYS H 1 1 8 3032 1 1 19 LYS HA H 7.793 0.337 -2.883 1.00 . A A . 19 LYS HA 1 1 8 3033 1 1 19 LYS HB3 H 5.211 0.468 -4.228 1.00 . A A . 19 LYS HB3 1 1 8 3034 1 1 19 LYS HD3 H 5.084 3.948 -3.129 1.00 . A A . 19 LYS HD3 1 1 8 3035 1 1 19 LYS HE3 H 3.452 2.323 -5.138 1.00 . A A . 19 LYS HE3 1 1 8 3036 1 1 19 LYS HG3 H 5.943 2.656 -5.425 1.00 . A A . 19 LYS HG3 1 1 8 3037 1 1 19 LYS HZ1 H 1.680 3.763 -4.469 1.00 . A A . 19 LYS HZ1 1 1 8 3038 1 1 19 LYS HZ2 H 2.206 2.933 -3.165 1.00 . A A . 19 LYS HZ2 1 1 8 3039 1 1 19 LYS HZ3 H 2.615 4.502 -3.353 1.00 . A A . 19 LYS HZ3 1 1 8 3040 1 1 19 LYS N N 6.046 -0.436 -2.110 1.00 . A A . 19 LYS N 1 1 8 3041 1 1 19 LYS NZ N 2.440 3.641 -3.830 1.00 . A A . 19 LYS NZ 1 1 8 3042 1 1 19 LYS O O 7.559 2.790 -1.973 1.00 . A A . 19 LYS O 1 1 8 3043 1 1 20 LEU C C 6.632 2.634 1.312 1.00 . A A . 20 LEU C 1 1 8 3044 1 1 20 LEU CA C 5.726 2.919 0.113 1.00 . A A . 20 LEU CA 1 1 8 3045 1 1 20 LEU CB C 4.260 3.143 0.489 1.00 . A A . 20 LEU CB 1 1 8 3046 1 1 20 LEU CD1 C 4.441 3.651 2.952 1.00 . A A . 20 LEU CD1 1 1 8 3047 1 1 20 LEU CD2 C 2.336 2.587 2.020 1.00 . A A . 20 LEU CD2 1 1 8 3048 1 1 20 LEU CG C 3.856 2.709 1.899 1.00 . A A . 20 LEU CG 1 1 8 3049 1 1 20 LEU H H 5.197 1.085 -0.720 1.00 . A A . 20 LEU H 1 1 8 3050 1 1 20 LEU HA H 6.076 3.829 -0.376 1.00 . A A . 20 LEU HA 1 1 8 3051 1 1 20 LEU HB3 H 3.637 2.608 -0.227 1.00 . A A . 20 LEU HB3 1 1 8 3052 1 1 20 LEU HD11 H 4.966 4.468 2.457 1.00 . A A . 20 LEU HD11 1 1 8 3053 1 1 20 LEU HD12 H 3.636 4.057 3.565 1.00 . A A . 20 LEU HD12 1 1 8 3054 1 1 20 LEU HD13 H 5.138 3.102 3.584 1.00 . A A . 20 LEU HD13 1 1 8 3055 1 1 20 LEU HD21 H 1.943 3.454 2.553 1.00 . A A . 20 LEU HD21 1 1 8 3056 1 1 20 LEU HD22 H 1.894 2.542 1.025 1.00 . A A . 20 LEU HD22 1 1 8 3057 1 1 20 LEU HD23 H 2.086 1.680 2.570 1.00 . A A . 20 LEU HD23 1 1 8 3058 1 1 20 LEU HG H 4.274 1.720 2.085 1.00 . A A . 20 LEU HG 1 1 8 3059 1 1 20 LEU N N 5.846 1.836 -0.847 1.00 . A A . 20 LEU N 1 1 8 3060 1 1 20 LEU O O 6.935 3.535 2.094 1.00 . A A . 20 LEU O 1 1 8 3061 1 1 21 PHE C C 9.314 1.535 2.342 1.00 . A A . 21 PHE C 1 1 8 3062 1 1 21 PHE CA C 7.905 0.963 2.511 1.00 . A A . 21 PHE CA 1 1 8 3063 1 1 21 PHE CB C 7.980 -0.564 2.469 1.00 . A A . 21 PHE CB 1 1 8 3064 1 1 21 PHE CD1 C 6.289 -1.324 4.154 1.00 . A A . 21 PHE CD1 1 1 8 3065 1 1 21 PHE CD2 C 8.563 -1.768 4.585 1.00 . A A . 21 PHE CD2 1 1 8 3066 1 1 21 PHE CE1 C 5.934 -1.954 5.374 1.00 . A A . 21 PHE CE1 1 1 8 3067 1 1 21 PHE CE2 C 8.206 -2.399 5.807 1.00 . A A . 21 PHE CE2 1 1 8 3068 1 1 21 PHE CG C 7.596 -1.243 3.784 1.00 . A A . 21 PHE CG 1 1 8 3069 1 1 21 PHE CZ C 6.900 -2.478 6.176 1.00 . A A . 21 PHE CZ 1 1 8 3070 1 1 21 PHE H H 6.789 0.652 0.781 1.00 . A A . 21 PHE H 1 1 8 3071 1 1 21 PHE HA H 7.468 1.345 3.434 1.00 . A A . 21 PHE HA 1 1 8 3072 1 1 21 PHE HB3 H 8.993 -0.861 2.200 1.00 . A A . 21 PHE HB3 1 1 8 3073 1 1 21 PHE HD1 H 5.515 -0.903 3.511 1.00 . A A . 21 PHE HD1 1 1 8 3074 1 1 21 PHE HD2 H 9.609 -1.705 4.289 1.00 . A A . 21 PHE HD2 1 1 8 3075 1 1 21 PHE HE1 H 4.887 -2.018 5.670 1.00 . A A . 21 PHE HE1 1 1 8 3076 1 1 21 PHE HE2 H 8.981 -2.819 6.449 1.00 . A A . 21 PHE HE2 1 1 8 3077 1 1 21 PHE HZ H 6.627 -2.963 7.114 1.00 . A A . 21 PHE HZ 1 1 8 3078 1 1 21 PHE N N 7.040 1.378 1.420 1.00 . A A . 21 PHE N 1 1 8 3079 1 1 21 PHE O O 10.090 1.577 3.296 1.00 . A A . 21 PHE O 1 1 8 3080 1 1 22 LYS C C 11.292 3.525 1.911 1.00 . A A . 22 LYS C 1 1 8 3081 1 1 22 LYS CA C 10.903 2.531 0.815 1.00 . A A . 22 LYS CA 1 1 8 3082 1 1 22 LYS CB C 10.907 3.133 -0.592 1.00 . A A . 22 LYS CB 1 1 8 3083 1 1 22 LYS CD C 9.001 4.783 -0.545 1.00 . A A . 22 LYS CD 1 1 8 3084 1 1 22 LYS CE C 8.607 6.181 -0.063 1.00 . A A . 22 LYS CE 1 1 8 3085 1 1 22 LYS CG C 10.521 4.613 -0.555 1.00 . A A . 22 LYS CG 1 1 8 3086 1 1 22 LYS H H 8.965 1.926 0.352 1.00 . A A . 22 LYS H 1 1 8 3087 1 1 22 LYS HA H 11.625 1.714 0.818 1.00 . A A . 22 LYS HA 1 1 8 3088 1 1 22 LYS HB3 H 10.210 2.587 -1.227 1.00 . A A . 22 LYS HB3 1 1 8 3089 1 1 22 LYS HD3 H 8.551 4.031 0.103 1.00 . A A . 22 LYS HD3 1 1 8 3090 1 1 22 LYS HE3 H 9.197 6.448 0.814 1.00 . A A . 22 LYS HE3 1 1 8 3091 1 1 22 LYS HG3 H 10.942 5.124 -1.421 1.00 . A A . 22 LYS HG3 1 1 8 3092 1 1 22 LYS HZ1 H 8.937 8.085 -0.729 1.00 . A A . 22 LYS HZ1 1 1 8 3093 1 1 22 LYS HZ2 H 9.647 6.940 -1.652 1.00 . A A . 22 LYS HZ2 1 1 8 3094 1 1 22 LYS HZ3 H 8.035 7.184 -1.749 1.00 . A A . 22 LYS HZ3 1 1 8 3095 1 1 22 LYS N N 9.602 1.962 1.122 1.00 . A A . 22 LYS N 1 1 8 3096 1 1 22 LYS NZ N 8.824 7.178 -1.135 1.00 . A A . 22 LYS NZ 1 1 8 3097 1 1 22 LYS O O 12.476 3.762 2.147 1.00 . A A . 22 LYS O 1 1 8 3098 1 1 23 LYS C C 10.383 4.335 4.968 1.00 . A A . 23 LYS C 1 1 8 3099 1 1 23 LYS CA C 10.493 5.043 3.617 1.00 . A A . 23 LYS CA 1 1 8 3100 1 1 23 LYS CB C 9.546 6.234 3.467 1.00 . A A . 23 LYS CB 1 1 8 3101 1 1 23 LYS CD C 7.120 6.609 4.049 1.00 . A A . 23 LYS CD 1 1 8 3102 1 1 23 LYS CE C 6.798 7.918 3.327 1.00 . A A . 23 LYS CE 1 1 8 3103 1 1 23 LYS CG C 8.107 5.764 3.240 1.00 . A A . 23 LYS CG 1 1 8 3104 1 1 23 LYS H H 9.314 3.880 2.353 1.00 . A A . 23 LYS H 1 1 8 3105 1 1 23 LYS HA H 11.510 5.423 3.508 1.00 . A A . 23 LYS HA 1 1 8 3106 1 1 23 LYS HB3 H 9.866 6.855 2.630 1.00 . A A . 23 LYS HB3 1 1 8 3107 1 1 23 LYS HD3 H 7.541 6.824 5.031 1.00 . A A . 23 LYS HD3 1 1 8 3108 1 1 23 LYS HE3 H 7.519 8.085 2.526 1.00 . A A . 23 LYS HE3 1 1 8 3109 1 1 23 LYS HG3 H 8.014 4.716 3.525 1.00 . A A . 23 LYS HG3 1 1 8 3110 1 1 23 LYS HZ1 H 5.472 7.951 1.772 1.00 . A A . 23 LYS HZ1 1 1 8 3111 1 1 23 LYS HZ2 H 4.990 7.016 3.021 1.00 . A A . 23 LYS HZ2 1 1 8 3112 1 1 23 LYS HZ3 H 4.897 8.643 3.135 1.00 . A A . 23 LYS HZ3 1 1 8 3113 1 1 23 LYS N N 10.273 4.080 2.552 1.00 . A A . 23 LYS N 1 1 8 3114 1 1 23 LYS NZ N 5.428 7.879 2.769 1.00 . A A . 23 LYS NZ 1 1 8 3115 1 1 23 LYS O O 11.117 4.655 5.903 1.00 . A A . 23 LYS O 1 1 8 3116 1 1 24 TRP C C 10.452 1.712 6.460 1.00 . A A . 24 TRP C 1 1 8 3117 1 1 24 TRP CA C 9.246 2.630 6.253 1.00 . A A . 24 TRP CA 1 1 8 3118 1 1 24 TRP CB C 7.919 1.870 6.201 1.00 . A A . 24 TRP CB 1 1 8 3119 1 1 24 TRP CD1 C 6.656 4.106 5.942 1.00 . A A . 24 TRP CD1 1 1 8 3120 1 1 24 TRP CD2 C 5.311 2.347 6.028 1.00 . A A . 24 TRP CD2 1 1 8 3121 1 1 24 TRP CE2 C 4.517 3.468 5.889 1.00 . A A . 24 TRP CE2 1 1 8 3122 1 1 24 TRP CE3 C 4.753 1.060 6.112 1.00 . A A . 24 TRP CE3 1 1 8 3123 1 1 24 TRP CG C 6.691 2.771 6.060 1.00 . A A . 24 TRP CG 1 1 8 3124 1 1 24 TRP CH2 C 2.542 2.141 5.907 1.00 . A A . 24 TRP CH2 1 1 8 3125 1 1 24 TRP CZ2 C 3.120 3.413 5.824 1.00 . A A . 24 TRP CZ2 1 1 8 3126 1 1 24 TRP CZ3 C 3.356 1.023 6.046 1.00 . A A . 24 TRP CZ3 1 1 8 3127 1 1 24 TRP H H 8.869 3.131 4.266 1.00 . A A . 24 TRP H 1 1 8 3128 1 1 24 TRP HA H 9.173 3.341 7.075 1.00 . A A . 24 TRP HA 1 1 8 3129 1 1 24 TRP HB3 H 7.817 1.274 7.107 1.00 . A A . 24 TRP HB3 1 1 8 3130 1 1 24 TRP HD1 H 7.540 4.745 5.930 1.00 . A A . 24 TRP HD1 1 1 8 3131 1 1 24 TRP HE1 H 5.056 5.612 5.728 1.00 . A A . 24 TRP HE1 1 1 8 3132 1 1 24 TRP HE3 H 5.359 0.160 6.222 1.00 . A A . 24 TRP HE3 1 1 8 3133 1 1 24 TRP HH2 H 1.459 2.027 5.862 1.00 . A A . 24 TRP HH2 1 1 8 3134 1 1 24 TRP HZ2 H 2.514 4.313 5.715 1.00 . A A . 24 TRP HZ2 1 1 8 3135 1 1 24 TRP HZ3 H 2.871 0.047 6.107 1.00 . A A . 24 TRP HZ3 1 1 8 3136 1 1 24 TRP N N 9.462 3.385 5.030 1.00 . A A . 24 TRP N 1 1 8 3137 1 1 24 TRP NE1 N 5.361 4.571 5.835 1.00 . A A . 24 TRP NE1 1 1 8 3138 1 1 24 TRP O O 11.302 1.980 7.308 1.00 . A A . 24 TRP O 1 1 8 3139 1 1 25 GLY C C 11.963 -0.571 7.216 1.00 . A A . 25 GLY C 1 1 8 3140 1 1 25 GLY CA C 11.577 -0.310 5.758 1.00 . A A . 25 GLY CA 1 1 8 3141 1 1 25 GLY H H 9.793 0.437 4.985 1.00 . A A . 25 GLY H 1 1 8 3142 1 1 25 GLY HA2 H 11.280 -1.247 5.284 1.00 . A A . 25 GLY HA2 1 1 8 3143 1 1 25 GLY HA3 H 12.441 0.064 5.210 1.00 . A A . 25 GLY HA3 1 1 8 3144 1 1 25 GLY N N 10.488 0.648 5.672 1.00 . A A . 25 GLY N 1 1 8 3145 1 1 25 GLY O O 12.815 0.123 7.769 1.00 . A A . 25 GLY O 1 1 8 3146 1 1 26 TRP C C 12.462 -3.186 9.180 1.00 . A A . 26 TRP C 1 1 8 3147 1 1 26 TRP CA C 11.584 -1.933 9.178 1.00 . A A . 26 TRP CA 1 1 8 3148 1 1 26 TRP CB C 10.280 -2.116 9.957 1.00 . A A . 26 TRP CB 1 1 8 3149 1 1 26 TRP CD1 C 10.359 0.293 10.880 1.00 . A A . 26 TRP CD1 1 1 8 3150 1 1 26 TRP CD2 C 9.243 -1.107 12.184 1.00 . A A . 26 TRP CD2 1 1 8 3151 1 1 26 TRP CE2 C 9.209 0.134 12.787 1.00 . A A . 26 TRP CE2 1 1 8 3152 1 1 26 TRP CE3 C 8.619 -2.222 12.770 1.00 . A A . 26 TRP CE3 1 1 8 3153 1 1 26 TRP CG C 9.988 -0.992 10.954 1.00 . A A . 26 TRP CG 1 1 8 3154 1 1 26 TRP CH2 C 7.935 -0.718 14.606 1.00 . A A . 26 TRP CH2 1 1 8 3155 1 1 26 TRP CZ2 C 8.564 0.378 14.006 1.00 . A A . 26 TRP CZ2 1 1 8 3156 1 1 26 TRP CZ3 C 7.977 -1.962 13.987 1.00 . A A . 26 TRP CZ3 1 1 8 3157 1 1 26 TRP H H 10.627 -2.132 7.339 1.00 . A A . 26 TRP H 1 1 8 3158 1 1 26 TRP HA H 12.118 -1.104 9.642 1.00 . A A . 26 TRP HA 1 1 8 3159 1 1 26 TRP HB3 H 10.321 -3.063 10.496 1.00 . A A . 26 TRP HB3 1 1 8 3160 1 1 26 TRP HD1 H 10.942 0.717 10.063 1.00 . A A . 26 TRP HD1 1 1 8 3161 1 1 26 TRP HE1 H 10.073 2.075 12.152 1.00 . A A . 26 TRP HE1 1 1 8 3162 1 1 26 TRP HE3 H 8.631 -3.212 12.314 1.00 . A A . 26 TRP HE3 1 1 8 3163 1 1 26 TRP HH2 H 7.414 -0.598 15.557 1.00 . A A . 26 TRP HH2 1 1 8 3164 1 1 26 TRP HZ2 H 8.552 1.368 14.460 1.00 . A A . 26 TRP HZ2 1 1 8 3165 1 1 26 TRP HZ3 H 7.477 -2.793 14.483 1.00 . A A . 26 TRP HZ3 1 1 8 3166 1 1 26 TRP N N 11.318 -1.573 7.796 1.00 . A A . 26 TRP N 1 1 8 3167 1 1 26 TRP NE1 N 9.910 1.013 11.968 1.00 . A A . 26 TRP NE1 1 1 8 3168 1 1 26 TRP O O 12.435 -3.969 8.231 1.00 . A A . 26 TRP O 1 1 9 3169 1 1 1 LYS C C -9.301 15.252 7.970 1.00 . A A . 1 LYS C 1 1 9 3170 1 1 1 LYS CA C -9.814 16.620 8.421 1.00 . A A . 1 LYS CA 1 1 9 3171 1 1 1 LYS CB C -11.057 16.547 9.310 1.00 . A A . 1 LYS CB 1 1 9 3172 1 1 1 LYS CD C -10.266 17.863 11.311 1.00 . A A . 1 LYS CD 1 1 9 3173 1 1 1 LYS CE C -10.193 19.263 11.923 1.00 . A A . 1 LYS CE 1 1 9 3174 1 1 1 LYS CG C -11.227 17.834 10.121 1.00 . A A . 1 LYS CG 1 1 9 3175 1 1 1 LYS H1 H -10.690 17.043 6.579 1.00 . A A . 1 LYS H1 1 1 9 3176 1 1 1 LYS HA H -9.031 17.109 9.001 1.00 . A A . 1 LYS HA 1 1 9 3177 1 1 1 LYS HB3 H -10.977 15.696 9.985 1.00 . A A . 1 LYS HB3 1 1 9 3178 1 1 1 LYS HD3 H -9.272 17.551 10.989 1.00 . A A . 1 LYS HD3 1 1 9 3179 1 1 1 LYS HE3 H -10.657 19.985 11.251 1.00 . A A . 1 LYS HE3 1 1 9 3180 1 1 1 LYS HG3 H -12.254 17.911 10.477 1.00 . A A . 1 LYS HG3 1 1 9 3181 1 1 1 LYS HZ1 H -10.526 18.547 13.808 1.00 . A A . 1 LYS HZ1 1 1 9 3182 1 1 1 LYS HZ2 H -10.696 20.166 13.686 1.00 . A A . 1 LYS HZ2 1 1 9 3183 1 1 1 LYS HZ3 H -11.858 19.176 13.104 1.00 . A A . 1 LYS HZ3 1 1 9 3184 1 1 1 LYS N N -10.072 17.445 7.254 1.00 . A A . 1 LYS N 1 1 9 3185 1 1 1 LYS NZ N -10.874 19.291 13.237 1.00 . A A . 1 LYS NZ 1 1 9 3186 1 1 1 LYS O O -8.164 14.883 8.264 1.00 . A A . 1 LYS O 1 1 9 3187 1 1 2 SER C C -9.803 13.214 5.239 1.00 . A A . 2 SER C 1 1 9 3188 1 1 2 SER CA C -9.809 13.215 6.769 1.00 . A A . 2 SER CA 1 1 9 3189 1 1 2 SER CB C -10.775 12.152 7.296 1.00 . A A . 2 SER CB 1 1 9 3190 1 1 2 SER H H -11.084 14.841 7.028 1.00 . A A . 2 SER H 1 1 9 3191 1 1 2 SER HA H -8.809 13.020 7.156 1.00 . A A . 2 SER HA 1 1 9 3192 1 1 2 SER HB3 H -11.199 11.599 6.458 1.00 . A A . 2 SER HB3 1 1 9 3193 1 1 2 SER HG H -9.262 10.945 7.805 1.00 . A A . 2 SER HG 1 1 9 3194 1 1 2 SER N N -10.162 14.535 7.264 1.00 . A A . 2 SER N 1 1 9 3195 1 1 2 SER O O -10.571 13.941 4.611 1.00 . A A . 2 SER O 1 1 9 3196 1 1 2 SER OG O -10.135 11.245 8.189 1.00 . A A . 2 SER OG 1 1 9 3197 1 1 3 SER C C -9.611 11.080 2.736 1.00 . A A . 3 SER C 1 1 9 3198 1 1 3 SER CA C -8.811 12.284 3.239 1.00 . A A . 3 SER CA 1 1 9 3199 1 1 3 SER CB C -7.346 12.162 2.811 1.00 . A A . 3 SER CB 1 1 9 3200 1 1 3 SER H H -8.306 11.800 5.201 1.00 . A A . 3 SER H 1 1 9 3201 1 1 3 SER HA H -9.228 13.211 2.847 1.00 . A A . 3 SER HA 1 1 9 3202 1 1 3 SER HB3 H -6.850 13.124 2.944 1.00 . A A . 3 SER HB3 1 1 9 3203 1 1 3 SER HG H -6.015 11.596 4.193 1.00 . A A . 3 SER HG 1 1 9 3204 1 1 3 SER N N -8.927 12.388 4.683 1.00 . A A . 3 SER N 1 1 9 3205 1 1 3 SER O O -10.448 11.215 1.844 1.00 . A A . 3 SER O 1 1 9 3206 1 1 3 SER OG O -6.654 11.165 3.557 1.00 . A A . 3 SER OG 1 1 9 3207 1 1 4 ALA C C -10.033 7.751 4.148 1.00 . A A . 4 ALA C 1 1 9 3208 1 1 4 ALA CA C -10.009 8.705 2.953 1.00 . A A . 4 ALA CA 1 1 9 3209 1 1 4 ALA CB C -9.322 8.092 1.731 1.00 . A A . 4 ALA CB 1 1 9 3210 1 1 4 ALA H H -8.645 9.829 4.054 1.00 . A A . 4 ALA H 1 1 9 3211 1 1 4 ALA HA H -11.034 8.964 2.685 1.00 . A A . 4 ALA HA 1 1 9 3212 1 1 4 ALA HB1 H -9.700 7.082 1.570 1.00 . A A . 4 ALA HB1 1 1 9 3213 1 1 4 ALA HB2 H -9.530 8.702 0.852 1.00 . A A . 4 ALA HB2 1 1 9 3214 1 1 4 ALA HB3 H -8.246 8.054 1.900 1.00 . A A . 4 ALA HB3 1 1 9 3215 1 1 4 ALA N N -9.327 9.931 3.329 1.00 . A A . 4 ALA N 1 1 9 3216 1 1 4 ALA O O -9.135 7.781 4.989 1.00 . A A . 4 ALA O 1 1 9 3217 1 1 5 TYR C C -11.918 4.695 4.775 1.00 . A A . 5 TYR C 1 1 9 3218 1 1 5 TYR CA C -11.221 5.965 5.266 1.00 . A A . 5 TYR CA 1 1 9 3219 1 1 5 TYR CB C -12.104 6.644 6.315 1.00 . A A . 5 TYR CB 1 1 9 3220 1 1 5 TYR CD1 C -13.752 7.813 4.806 1.00 . A A . 5 TYR CD1 1 1 9 3221 1 1 5 TYR CD2 C -14.597 6.290 6.443 1.00 . A A . 5 TYR CD2 1 1 9 3222 1 1 5 TYR CE1 C -15.095 8.078 4.360 1.00 . A A . 5 TYR CE1 1 1 9 3223 1 1 5 TYR CE2 C -15.940 6.554 5.995 1.00 . A A . 5 TYR CE2 1 1 9 3224 1 1 5 TYR CG C -13.531 6.925 5.840 1.00 . A A . 5 TYR CG 1 1 9 3225 1 1 5 TYR CZ C -16.123 7.435 4.976 1.00 . A A . 5 TYR CZ 1 1 9 3226 1 1 5 TYR H H -11.795 6.908 3.500 1.00 . A A . 5 TYR H 1 1 9 3227 1 1 5 TYR HA H -10.226 5.707 5.630 1.00 . A A . 5 TYR HA 1 1 9 3228 1 1 5 TYR HB3 H -11.639 7.585 6.613 1.00 . A A . 5 TYR HB3 1 1 9 3229 1 1 5 TYR HD1 H -12.909 8.315 4.330 1.00 . A A . 5 TYR HD1 1 1 9 3230 1 1 5 TYR HD2 H -14.423 5.588 7.259 1.00 . A A . 5 TYR HD2 1 1 9 3231 1 1 5 TYR HE1 H -15.283 8.777 3.545 1.00 . A A . 5 TYR HE1 1 1 9 3232 1 1 5 TYR HE2 H -16.791 6.060 6.464 1.00 . A A . 5 TYR HE2 1 1 9 3233 1 1 5 TYR HH H -17.633 8.636 4.743 1.00 . A A . 5 TYR HH 1 1 9 3234 1 1 5 TYR N N -11.069 6.926 4.188 1.00 . A A . 5 TYR N 1 1 9 3235 1 1 5 TYR O O -12.932 4.282 5.337 1.00 . A A . 5 TYR O 1 1 9 3236 1 1 5 TYR OH O -17.390 7.685 4.554 1.00 . A A . 5 TYR OH 1 1 9 3237 1 1 6 SER C C -10.798 1.857 2.967 1.00 . A A . 6 SER C 1 1 9 3238 1 1 6 SER CA C -11.903 2.897 3.158 1.00 . A A . 6 SER CA 1 1 9 3239 1 1 6 SER CB C -12.598 3.184 1.825 1.00 . A A . 6 SER CB 1 1 9 3240 1 1 6 SER H H -10.525 4.454 3.279 1.00 . A A . 6 SER H 1 1 9 3241 1 1 6 SER HA H -12.638 2.545 3.881 1.00 . A A . 6 SER HA 1 1 9 3242 1 1 6 SER HB3 H -13.026 2.261 1.433 1.00 . A A . 6 SER HB3 1 1 9 3243 1 1 6 SER HG H -14.096 4.047 2.832 1.00 . A A . 6 SER HG 1 1 9 3244 1 1 6 SER N N -11.348 4.111 3.731 1.00 . A A . 6 SER N 1 1 9 3245 1 1 6 SER O O -9.615 2.171 3.096 1.00 . A A . 6 SER O 1 1 9 3246 1 1 6 SER OG O -13.623 4.164 1.958 1.00 . A A . 6 SER OG 1 1 9 3247 1 1 7 LEU C C -10.545 -1.089 1.086 1.00 . A A . 7 LEU C 1 1 9 3248 1 1 7 LEU CA C -10.282 -0.450 2.451 1.00 . A A . 7 LEU CA 1 1 9 3249 1 1 7 LEU CB C -10.341 -1.440 3.615 1.00 . A A . 7 LEU CB 1 1 9 3250 1 1 7 LEU CD1 C -10.901 -3.791 4.336 1.00 . A A . 7 LEU CD1 1 1 9 3251 1 1 7 LEU CD2 C -12.752 -2.173 3.710 1.00 . A A . 7 LEU CD2 1 1 9 3252 1 1 7 LEU CG C -11.309 -2.613 3.450 1.00 . A A . 7 LEU CG 1 1 9 3253 1 1 7 LEU H H -12.184 0.391 2.558 1.00 . A A . 7 LEU H 1 1 9 3254 1 1 7 LEU HA H -9.281 -0.020 2.443 1.00 . A A . 7 LEU HA 1 1 9 3255 1 1 7 LEU HB3 H -10.613 -0.894 4.518 1.00 . A A . 7 LEU HB3 1 1 9 3256 1 1 7 LEU HD11 H -11.574 -4.629 4.160 1.00 . A A . 7 LEU HD11 1 1 9 3257 1 1 7 LEU HD12 H -9.880 -4.089 4.098 1.00 . A A . 7 LEU HD12 1 1 9 3258 1 1 7 LEU HD13 H -10.957 -3.494 5.384 1.00 . A A . 7 LEU HD13 1 1 9 3259 1 1 7 LEU HD21 H -13.066 -2.523 4.694 1.00 . A A . 7 LEU HD21 1 1 9 3260 1 1 7 LEU HD22 H -12.811 -1.085 3.676 1.00 . A A . 7 LEU HD22 1 1 9 3261 1 1 7 LEU HD23 H -13.404 -2.597 2.947 1.00 . A A . 7 LEU HD23 1 1 9 3262 1 1 7 LEU HG H -11.258 -2.956 2.416 1.00 . A A . 7 LEU HG 1 1 9 3263 1 1 7 LEU N N -11.221 0.639 2.661 1.00 . A A . 7 LEU N 1 1 9 3264 1 1 7 LEU O O -11.665 -1.512 0.801 1.00 . A A . 7 LEU O 1 1 9 3265 1 1 8 GLN C C -8.207 -1.956 -1.635 1.00 . A A . 8 GLN C 1 1 9 3266 1 1 8 GLN CA C -9.600 -1.718 -1.050 1.00 . A A . 8 GLN CA 1 1 9 3267 1 1 8 GLN CB C -10.439 -0.830 -1.972 1.00 . A A . 8 GLN CB 1 1 9 3268 1 1 8 GLN CD C -12.480 -0.904 -3.451 1.00 . A A . 8 GLN CD 1 1 9 3269 1 1 8 GLN CG C -11.848 -1.398 -2.147 1.00 . A A . 8 GLN CG 1 1 9 3270 1 1 8 GLN H H -8.589 -0.791 0.518 1.00 . A A . 8 GLN H 1 1 9 3271 1 1 8 GLN HA H -10.111 -2.671 -0.910 1.00 . A A . 8 GLN HA 1 1 9 3272 1 1 8 GLN HB3 H -9.951 -0.748 -2.944 1.00 . A A . 8 GLN HB3 1 1 9 3273 1 1 8 GLN HE21 H -12.337 -2.788 -4.178 1.00 . A A . 8 GLN HE21 1 1 9 3274 1 1 8 GLN HE22 H -13.033 -1.627 -5.259 1.00 . A A . 8 GLN HE22 1 1 9 3275 1 1 8 GLN HG3 H -12.470 -1.102 -1.303 1.00 . A A . 8 GLN HG3 1 1 9 3276 1 1 8 GLN N N -9.496 -1.138 0.278 1.00 . A A . 8 GLN N 1 1 9 3277 1 1 8 GLN NE2 N -12.629 -1.851 -4.372 1.00 . A A . 8 GLN NE2 1 1 9 3278 1 1 8 GLN O O -7.455 -1.010 -1.863 1.00 . A A . 8 GLN O 1 1 9 3279 1 1 8 GLN OE1 O -12.810 0.260 -3.609 1.00 . A A . 8 GLN OE1 1 1 9 3280 1 1 9 MET C C -6.730 -4.877 -3.256 1.00 . A A . 9 MET C 1 1 9 3281 1 1 9 MET CA C -6.616 -3.601 -2.419 1.00 . A A . 9 MET CA 1 1 9 3282 1 1 9 MET CB C -5.615 -3.823 -1.282 1.00 . A A . 9 MET CB 1 1 9 3283 1 1 9 MET CE C -3.740 -1.439 1.408 1.00 . A A . 9 MET CE 1 1 9 3284 1 1 9 MET CG C -5.203 -2.494 -0.647 1.00 . A A . 9 MET CG 1 1 9 3285 1 1 9 MET H H -8.523 -3.991 -1.676 1.00 . A A . 9 MET H 1 1 9 3286 1 1 9 MET HA H -6.317 -2.767 -3.053 1.00 . A A . 9 MET HA 1 1 9 3287 1 1 9 MET HB3 H -4.734 -4.337 -1.664 1.00 . A A . 9 MET HB3 1 1 9 3288 1 1 9 MET HE1 H -4.708 -0.944 1.335 1.00 . A A . 9 MET HE1 1 1 9 3289 1 1 9 MET HE2 H -3.656 -1.933 2.376 1.00 . A A . 9 MET HE2 1 1 9 3290 1 1 9 MET HE3 H -2.946 -0.699 1.308 1.00 . A A . 9 MET HE3 1 1 9 3291 1 1 9 MET HG3 H -5.937 -2.196 0.102 1.00 . A A . 9 MET HG3 1 1 9 3292 1 1 9 MET N N -7.905 -3.226 -1.864 1.00 . A A . 9 MET N 1 1 9 3293 1 1 9 MET O O -6.361 -4.887 -4.429 1.00 . A A . 9 MET O 1 1 9 3294 1 1 9 MET SD S -3.593 -2.650 0.106 1.00 . A A . 9 MET SD 1 1 9 3295 1 1 10 GLY C C -6.268 -8.156 -2.937 1.00 . A A . 10 GLY C 1 1 9 3296 1 1 10 GLY CA C -7.407 -7.198 -3.291 1.00 . A A . 10 GLY CA 1 1 9 3297 1 1 10 GLY H H -7.537 -5.902 -1.665 1.00 . A A . 10 GLY H 1 1 9 3298 1 1 10 GLY HA2 H -8.361 -7.641 -3.006 1.00 . A A . 10 GLY HA2 1 1 9 3299 1 1 10 GLY HA3 H -7.436 -7.045 -4.370 1.00 . A A . 10 GLY HA3 1 1 9 3300 1 1 10 GLY N N -7.241 -5.921 -2.620 1.00 . A A . 10 GLY N 1 1 9 3301 1 1 10 GLY O O -6.354 -8.894 -1.957 1.00 . A A . 10 GLY O 1 1 9 3302 1 1 11 ALA C C -2.821 -8.278 -4.088 1.00 . A A . 11 ALA C 1 1 9 3303 1 1 11 ALA CA C -4.071 -8.969 -3.539 1.00 . A A . 11 ALA CA 1 1 9 3304 1 1 11 ALA CB C -4.317 -10.332 -4.190 1.00 . A A . 11 ALA CB 1 1 9 3305 1 1 11 ALA H H -5.164 -7.511 -4.550 1.00 . A A . 11 ALA H 1 1 9 3306 1 1 11 ALA HA H -3.957 -9.109 -2.464 1.00 . A A . 11 ALA HA 1 1 9 3307 1 1 11 ALA HB1 H -4.377 -11.098 -3.417 1.00 . A A . 11 ALA HB1 1 1 9 3308 1 1 11 ALA HB2 H -5.252 -10.304 -4.749 1.00 . A A . 11 ALA HB2 1 1 9 3309 1 1 11 ALA HB3 H -3.495 -10.564 -4.868 1.00 . A A . 11 ALA HB3 1 1 9 3310 1 1 11 ALA N N -5.226 -8.114 -3.754 1.00 . A A . 11 ALA N 1 1 9 3311 1 1 11 ALA O O -2.037 -7.712 -3.328 1.00 . A A . 11 ALA O 1 1 9 3312 1 1 12 THR C C -1.200 -6.390 -5.412 1.00 . A A . 12 THR C 1 1 9 3313 1 1 12 THR CA C -1.533 -7.735 -6.061 1.00 . A A . 12 THR CA 1 1 9 3314 1 1 12 THR CB C -1.850 -7.627 -7.553 1.00 . A A . 12 THR CB 1 1 9 3315 1 1 12 THR CG2 C -3.203 -6.964 -7.819 1.00 . A A . 12 THR CG2 1 1 9 3316 1 1 12 THR H H -3.317 -8.810 -6.013 1.00 . A A . 12 THR H 1 1 9 3317 1 1 12 THR HA H -0.667 -8.382 -5.919 1.00 . A A . 12 THR HA 1 1 9 3318 1 1 12 THR HB H -1.794 -8.604 -8.035 1.00 . A A . 12 THR HB 1 1 9 3319 1 1 12 THR HG1 H -0.588 -6.955 -8.954 1.00 . A A . 12 THR HG1 1 1 9 3320 1 1 12 THR HG21 H -3.184 -5.939 -7.448 1.00 . A A . 12 THR HG21 1 1 9 3321 1 1 12 THR HG22 H -3.402 -6.960 -8.890 1.00 . A A . 12 THR HG22 1 1 9 3322 1 1 12 THR HG23 H -3.987 -7.521 -7.305 1.00 . A A . 12 THR HG23 1 1 9 3323 1 1 12 THR N N -2.674 -8.347 -5.403 1.00 . A A . 12 THR N 1 1 9 3324 1 1 12 THR O O -0.044 -6.121 -5.090 1.00 . A A . 12 THR O 1 1 9 3325 1 1 12 THR OG1 O -0.900 -6.685 -8.044 1.00 . A A . 12 THR OG1 1 1 9 3326 1 1 13 ALA C C -1.069 -4.370 -3.480 1.00 . A A . 13 ALA C 1 1 9 3327 1 1 13 ALA CA C -2.068 -4.271 -4.634 1.00 . A A . 13 ALA CA 1 1 9 3328 1 1 13 ALA CB C -3.430 -3.738 -4.183 1.00 . A A . 13 ALA CB 1 1 9 3329 1 1 13 ALA H H -3.172 -5.807 -5.504 1.00 . A A . 13 ALA H 1 1 9 3330 1 1 13 ALA HA H -1.665 -3.603 -5.396 1.00 . A A . 13 ALA HA 1 1 9 3331 1 1 13 ALA HB1 H -3.355 -3.371 -3.159 1.00 . A A . 13 ALA HB1 1 1 9 3332 1 1 13 ALA HB2 H -3.738 -2.925 -4.840 1.00 . A A . 13 ALA HB2 1 1 9 3333 1 1 13 ALA HB3 H -4.167 -4.540 -4.228 1.00 . A A . 13 ALA HB3 1 1 9 3334 1 1 13 ALA N N -2.236 -5.581 -5.239 1.00 . A A . 13 ALA N 1 1 9 3335 1 1 13 ALA O O -0.214 -3.501 -3.315 1.00 . A A . 13 ALA O 1 1 9 3336 1 1 14 ILE C C 1.120 -5.441 -2.006 1.00 . A A . 14 ILE C 1 1 9 3337 1 1 14 ILE CA C -0.330 -5.664 -1.574 1.00 . A A . 14 ILE CA 1 1 9 3338 1 1 14 ILE CB C -0.585 -7.043 -0.963 1.00 . A A . 14 ILE CB 1 1 9 3339 1 1 14 ILE CD1 C -2.511 -8.598 -0.481 1.00 . A A . 14 ILE CD1 1 1 9 3340 1 1 14 ILE CG1 C -2.016 -7.152 -0.431 1.00 . A A . 14 ILE CG1 1 1 9 3341 1 1 14 ILE CG2 C 0.453 -7.367 0.112 1.00 . A A . 14 ILE CG2 1 1 9 3342 1 1 14 ILE H H -1.907 -6.141 -2.848 1.00 . A A . 14 ILE H 1 1 9 3343 1 1 14 ILE HA H -0.582 -4.924 -0.814 1.00 . A A . 14 ILE HA 1 1 9 3344 1 1 14 ILE HB H -0.477 -7.790 -1.751 1.00 . A A . 14 ILE HB 1 1 9 3345 1 1 14 ILE HD11 H -2.171 -9.068 -1.404 1.00 . A A . 14 ILE HD11 1 1 9 3346 1 1 14 ILE HD12 H -2.115 -9.148 0.373 1.00 . A A . 14 ILE HD12 1 1 9 3347 1 1 14 ILE HD13 H -3.601 -8.610 -0.447 1.00 . A A . 14 ILE HD13 1 1 9 3348 1 1 14 ILE HG13 H -2.677 -6.516 -1.021 1.00 . A A . 14 ILE HG13 1 1 9 3349 1 1 14 ILE HG21 H 1.454 -7.266 -0.307 1.00 . A A . 14 ILE HG21 1 1 9 3350 1 1 14 ILE HG22 H 0.338 -6.678 0.948 1.00 . A A . 14 ILE HG22 1 1 9 3351 1 1 14 ILE HG23 H 0.307 -8.390 0.462 1.00 . A A . 14 ILE HG23 1 1 9 3352 1 1 14 ILE N N -1.210 -5.438 -2.708 1.00 . A A . 14 ILE N 1 1 9 3353 1 1 14 ILE O O 1.842 -4.659 -1.389 1.00 . A A . 14 ILE O 1 1 9 3354 1 1 15 LYS C C 3.252 -4.555 -3.649 1.00 . A A . 15 LYS C 1 1 9 3355 1 1 15 LYS CA C 2.855 -6.031 -3.584 1.00 . A A . 15 LYS CA 1 1 9 3356 1 1 15 LYS CB C 2.973 -6.758 -4.925 1.00 . A A . 15 LYS CB 1 1 9 3357 1 1 15 LYS CD C 3.446 -5.036 -6.705 1.00 . A A . 15 LYS CD 1 1 9 3358 1 1 15 LYS CE C 4.349 -4.758 -7.907 1.00 . A A . 15 LYS CE 1 1 9 3359 1 1 15 LYS CG C 4.048 -6.117 -5.804 1.00 . A A . 15 LYS CG 1 1 9 3360 1 1 15 LYS H H 0.910 -6.775 -3.559 1.00 . A A . 15 LYS H 1 1 9 3361 1 1 15 LYS HA H 3.518 -6.536 -2.883 1.00 . A A . 15 LYS HA 1 1 9 3362 1 1 15 LYS HB3 H 2.014 -6.736 -5.442 1.00 . A A . 15 LYS HB3 1 1 9 3363 1 1 15 LYS HD3 H 3.304 -4.119 -6.132 1.00 . A A . 15 LYS HD3 1 1 9 3364 1 1 15 LYS HE3 H 5.114 -5.531 -7.982 1.00 . A A . 15 LYS HE3 1 1 9 3365 1 1 15 LYS HG3 H 4.525 -6.881 -6.418 1.00 . A A . 15 LYS HG3 1 1 9 3366 1 1 15 LYS HZ1 H 3.511 -3.776 -9.492 1.00 . A A . 15 LYS HZ1 1 1 9 3367 1 1 15 LYS HZ2 H 3.985 -5.299 -9.845 1.00 . A A . 15 LYS HZ2 1 1 9 3368 1 1 15 LYS HZ3 H 2.628 -5.048 -8.970 1.00 . A A . 15 LYS HZ3 1 1 9 3369 1 1 15 LYS N N 1.503 -6.142 -3.062 1.00 . A A . 15 LYS N 1 1 9 3370 1 1 15 LYS NZ N 3.553 -4.717 -9.155 1.00 . A A . 15 LYS NZ 1 1 9 3371 1 1 15 LYS O O 4.375 -4.194 -3.303 1.00 . A A . 15 LYS O 1 1 9 3372 1 1 16 GLN C C 2.994 -1.738 -2.866 1.00 . A A . 16 GLN C 1 1 9 3373 1 1 16 GLN CA C 2.545 -2.311 -4.212 1.00 . A A . 16 GLN CA 1 1 9 3374 1 1 16 GLN CB C 1.298 -1.588 -4.726 1.00 . A A . 16 GLN CB 1 1 9 3375 1 1 16 GLN CD C -0.636 -0.089 -4.114 1.00 . A A . 16 GLN CD 1 1 9 3376 1 1 16 GLN CG C 0.624 -0.793 -3.606 1.00 . A A . 16 GLN CG 1 1 9 3377 1 1 16 GLN H H 1.396 -4.041 -4.377 1.00 . A A . 16 GLN H 1 1 9 3378 1 1 16 GLN HA H 3.345 -2.208 -4.944 1.00 . A A . 16 GLN HA 1 1 9 3379 1 1 16 GLN HB3 H 0.596 -2.313 -5.136 1.00 . A A . 16 GLN HB3 1 1 9 3380 1 1 16 GLN HE21 H -0.481 1.205 -2.565 1.00 . A A . 16 GLN HE21 1 1 9 3381 1 1 16 GLN HE22 H -1.824 1.476 -3.626 1.00 . A A . 16 GLN HE22 1 1 9 3382 1 1 16 GLN HG3 H 1.320 -0.057 -3.206 1.00 . A A . 16 GLN HG3 1 1 9 3383 1 1 16 GLN N N 2.307 -3.740 -4.097 1.00 . A A . 16 GLN N 1 1 9 3384 1 1 16 GLN NE2 N -1.012 0.950 -3.375 1.00 . A A . 16 GLN NE2 1 1 9 3385 1 1 16 GLN O O 3.927 -0.937 -2.809 1.00 . A A . 16 GLN O 1 1 9 3386 1 1 16 GLN OE1 O -1.227 -0.464 -5.114 1.00 . A A . 16 GLN OE1 1 1 9 3387 1 1 17 VAL C C 4.110 -1.969 -0.189 1.00 . A A . 17 VAL C 1 1 9 3388 1 1 17 VAL CA C 2.630 -1.710 -0.476 1.00 . A A . 17 VAL CA 1 1 9 3389 1 1 17 VAL CB C 1.699 -2.375 0.541 1.00 . A A . 17 VAL CB 1 1 9 3390 1 1 17 VAL CG1 C 2.188 -3.781 0.893 1.00 . A A . 17 VAL CG1 1 1 9 3391 1 1 17 VAL CG2 C 1.553 -1.514 1.797 1.00 . A A . 17 VAL CG2 1 1 9 3392 1 1 17 VAL H H 1.554 -2.821 -1.871 1.00 . A A . 17 VAL H 1 1 9 3393 1 1 17 VAL HA H 2.449 -0.635 -0.445 1.00 . A A . 17 VAL HA 1 1 9 3394 1 1 17 VAL HB H 0.714 -2.468 0.083 1.00 . A A . 17 VAL HB 1 1 9 3395 1 1 17 VAL HG11 H 3.035 -4.042 0.258 1.00 . A A . 17 VAL HG11 1 1 9 3396 1 1 17 VAL HG12 H 2.495 -3.808 1.938 1.00 . A A . 17 VAL HG12 1 1 9 3397 1 1 17 VAL HG13 H 1.381 -4.497 0.734 1.00 . A A . 17 VAL HG13 1 1 9 3398 1 1 17 VAL HG21 H 1.141 -0.542 1.526 1.00 . A A . 17 VAL HG21 1 1 9 3399 1 1 17 VAL HG22 H 0.884 -2.009 2.501 1.00 . A A . 17 VAL HG22 1 1 9 3400 1 1 17 VAL HG23 H 2.531 -1.378 2.260 1.00 . A A . 17 VAL HG23 1 1 9 3401 1 1 17 VAL N N 2.312 -2.170 -1.817 1.00 . A A . 17 VAL N 1 1 9 3402 1 1 17 VAL O O 4.754 -1.196 0.519 1.00 . A A . 17 VAL O 1 1 9 3403 1 1 18 LYS C C 6.895 -2.369 -1.210 1.00 . A A . 18 LYS C 1 1 9 3404 1 1 18 LYS CA C 5.999 -3.431 -0.570 1.00 . A A . 18 LYS CA 1 1 9 3405 1 1 18 LYS CB C 6.251 -4.845 -1.095 1.00 . A A . 18 LYS CB 1 1 9 3406 1 1 18 LYS CD C 7.374 -4.499 -3.326 1.00 . A A . 18 LYS CD 1 1 9 3407 1 1 18 LYS CE C 7.159 -5.722 -4.221 1.00 . A A . 18 LYS CE 1 1 9 3408 1 1 18 LYS CG C 7.570 -4.916 -1.868 1.00 . A A . 18 LYS CG 1 1 9 3409 1 1 18 LYS H H 4.076 -3.683 -1.330 1.00 . A A . 18 LYS H 1 1 9 3410 1 1 18 LYS HA H 6.193 -3.446 0.503 1.00 . A A . 18 LYS HA 1 1 9 3411 1 1 18 LYS HB3 H 5.429 -5.148 -1.744 1.00 . A A . 18 LYS HB3 1 1 9 3412 1 1 18 LYS HD3 H 8.245 -3.942 -3.670 1.00 . A A . 18 LYS HD3 1 1 9 3413 1 1 18 LYS HE3 H 6.258 -6.251 -3.913 1.00 . A A . 18 LYS HE3 1 1 9 3414 1 1 18 LYS HG3 H 7.966 -5.931 -1.825 1.00 . A A . 18 LYS HG3 1 1 9 3415 1 1 18 LYS HZ1 H 6.403 -4.546 -5.712 1.00 . A A . 18 LYS HZ1 1 1 9 3416 1 1 18 LYS HZ2 H 7.938 -5.033 -5.981 1.00 . A A . 18 LYS HZ2 1 1 9 3417 1 1 18 LYS HZ3 H 6.701 -6.081 -6.181 1.00 . A A . 18 LYS HZ3 1 1 9 3418 1 1 18 LYS N N 4.607 -3.060 -0.754 1.00 . A A . 18 LYS N 1 1 9 3419 1 1 18 LYS NZ N 7.041 -5.312 -5.639 1.00 . A A . 18 LYS NZ 1 1 9 3420 1 1 18 LYS O O 7.963 -2.054 -0.686 1.00 . A A . 18 LYS O 1 1 9 3421 1 1 19 LYS C C 7.203 0.459 -2.217 1.00 . A A . 19 LYS C 1 1 9 3422 1 1 19 LYS CA C 7.172 -0.823 -3.050 1.00 . A A . 19 LYS CA 1 1 9 3423 1 1 19 LYS CB C 6.600 -0.630 -4.455 1.00 . A A . 19 LYS CB 1 1 9 3424 1 1 19 LYS CD C 5.283 1.493 -4.114 1.00 . A A . 19 LYS CD 1 1 9 3425 1 1 19 LYS CE C 4.118 1.658 -5.092 1.00 . A A . 19 LYS CE 1 1 9 3426 1 1 19 LYS CG C 6.492 0.856 -4.803 1.00 . A A . 19 LYS CG 1 1 9 3427 1 1 19 LYS H H 5.558 -2.105 -2.752 1.00 . A A . 19 LYS H 1 1 9 3428 1 1 19 LYS HA H 8.194 -1.185 -3.165 1.00 . A A . 19 LYS HA 1 1 9 3429 1 1 19 LYS HB3 H 5.617 -1.095 -4.519 1.00 . A A . 19 LYS HB3 1 1 9 3430 1 1 19 LYS HD3 H 5.562 2.466 -3.708 1.00 . A A . 19 LYS HD3 1 1 9 3431 1 1 19 LYS HE3 H 3.178 1.707 -4.542 1.00 . A A . 19 LYS HE3 1 1 9 3432 1 1 19 LYS HG3 H 6.404 0.974 -5.883 1.00 . A A . 19 LYS HG3 1 1 9 3433 1 1 19 LYS HZ1 H 3.439 3.086 -6.387 1.00 . A A . 19 LYS HZ1 1 1 9 3434 1 1 19 LYS HZ2 H 4.521 3.651 -5.302 1.00 . A A . 19 LYS HZ2 1 1 9 3435 1 1 19 LYS HZ3 H 5.026 2.746 -6.564 1.00 . A A . 19 LYS HZ3 1 1 9 3436 1 1 19 LYS N N 6.427 -1.844 -2.332 1.00 . A A . 19 LYS N 1 1 9 3437 1 1 19 LYS NZ N 4.290 2.884 -5.902 1.00 . A A . 19 LYS NZ 1 1 9 3438 1 1 19 LYS O O 8.029 1.339 -2.454 1.00 . A A . 19 LYS O 1 1 9 3439 1 1 20 LEU C C 7.109 1.477 0.830 1.00 . A A . 20 LEU C 1 1 9 3440 1 1 20 LEU CA C 6.204 1.686 -0.387 1.00 . A A . 20 LEU CA 1 1 9 3441 1 1 20 LEU CB C 4.746 1.976 -0.024 1.00 . A A . 20 LEU CB 1 1 9 3442 1 1 20 LEU CD1 C 4.961 2.658 2.393 1.00 . A A . 20 LEU CD1 1 1 9 3443 1 1 20 LEU CD2 C 2.815 1.600 1.553 1.00 . A A . 20 LEU CD2 1 1 9 3444 1 1 20 LEU CG C 4.337 1.661 1.415 1.00 . A A . 20 LEU CG 1 1 9 3445 1 1 20 LEU H H 5.623 -0.194 -1.069 1.00 . A A . 20 LEU H 1 1 9 3446 1 1 20 LEU HA H 6.574 2.544 -0.948 1.00 . A A . 20 LEU HA 1 1 9 3447 1 1 20 LEU HB3 H 4.106 1.404 -0.696 1.00 . A A . 20 LEU HB3 1 1 9 3448 1 1 20 LEU HD11 H 5.455 3.454 1.836 1.00 . A A . 20 LEU HD11 1 1 9 3449 1 1 20 LEU HD12 H 4.181 3.087 3.023 1.00 . A A . 20 LEU HD12 1 1 9 3450 1 1 20 LEU HD13 H 5.692 2.145 3.019 1.00 . A A . 20 LEU HD13 1 1 9 3451 1 1 20 LEU HD21 H 2.365 1.507 0.564 1.00 . A A . 20 LEU HD21 1 1 9 3452 1 1 20 LEU HD22 H 2.538 0.738 2.160 1.00 . A A . 20 LEU HD22 1 1 9 3453 1 1 20 LEU HD23 H 2.456 2.511 2.031 1.00 . A A . 20 LEU HD23 1 1 9 3454 1 1 20 LEU HG H 4.722 0.674 1.673 1.00 . A A . 20 LEU HG 1 1 9 3455 1 1 20 LEU N N 6.292 0.526 -1.256 1.00 . A A . 20 LEU N 1 1 9 3456 1 1 20 LEU O O 7.431 2.428 1.540 1.00 . A A . 20 LEU O 1 1 9 3457 1 1 21 PHE C C 9.783 0.383 1.919 1.00 . A A . 21 PHE C 1 1 9 3458 1 1 21 PHE CA C 8.357 -0.121 2.149 1.00 . A A . 21 PHE CA 1 1 9 3459 1 1 21 PHE CB C 8.377 -1.648 2.241 1.00 . A A . 21 PHE CB 1 1 9 3460 1 1 21 PHE CD1 C 6.655 -2.236 3.961 1.00 . A A . 21 PHE CD1 1 1 9 3461 1 1 21 PHE CD2 C 8.918 -2.641 4.476 1.00 . A A . 21 PHE CD2 1 1 9 3462 1 1 21 PHE CE1 C 6.276 -2.743 5.231 1.00 . A A . 21 PHE CE1 1 1 9 3463 1 1 21 PHE CE2 C 8.538 -3.149 5.746 1.00 . A A . 21 PHE CE2 1 1 9 3464 1 1 21 PHE CG C 7.969 -2.195 3.610 1.00 . A A . 21 PHE CG 1 1 9 3465 1 1 21 PHE CZ C 7.225 -3.189 6.098 1.00 . A A . 21 PHE CZ 1 1 9 3466 1 1 21 PHE H H 7.230 -0.543 0.449 1.00 . A A . 21 PHE H 1 1 9 3467 1 1 21 PHE HA H 7.943 0.357 3.037 1.00 . A A . 21 PHE HA 1 1 9 3468 1 1 21 PHE HB3 H 9.381 -2.002 2.005 1.00 . A A . 21 PHE HB3 1 1 9 3469 1 1 21 PHE HD1 H 5.894 -1.878 3.267 1.00 . A A . 21 PHE HD1 1 1 9 3470 1 1 21 PHE HD2 H 9.970 -2.608 4.194 1.00 . A A . 21 PHE HD2 1 1 9 3471 1 1 21 PHE HE1 H 5.223 -2.775 5.514 1.00 . A A . 21 PHE HE1 1 1 9 3472 1 1 21 PHE HE2 H 9.300 -3.506 6.440 1.00 . A A . 21 PHE HE2 1 1 9 3473 1 1 21 PHE HZ H 6.934 -3.579 7.073 1.00 . A A . 21 PHE HZ 1 1 9 3474 1 1 21 PHE N N 7.495 0.225 1.031 1.00 . A A . 21 PHE N 1 1 9 3475 1 1 21 PHE O O 10.561 0.508 2.864 1.00 . A A . 21 PHE O 1 1 9 3476 1 1 22 LYS C C 11.726 2.395 1.120 1.00 . A A . 22 LYS C 1 1 9 3477 1 1 22 LYS CA C 11.400 1.150 0.292 1.00 . A A . 22 LYS CA 1 1 9 3478 1 1 22 LYS CB C 11.488 1.374 -1.218 1.00 . A A . 22 LYS CB 1 1 9 3479 1 1 22 LYS CD C 9.773 3.181 -1.607 1.00 . A A . 22 LYS CD 1 1 9 3480 1 1 22 LYS CE C 9.527 4.643 -1.227 1.00 . A A . 22 LYS CE 1 1 9 3481 1 1 22 LYS CG C 11.265 2.847 -1.567 1.00 . A A . 22 LYS CG 1 1 9 3482 1 1 22 LYS H H 9.443 0.557 -0.104 1.00 . A A . 22 LYS H 1 1 9 3483 1 1 22 LYS HA H 12.119 0.370 0.545 1.00 . A A . 22 LYS HA 1 1 9 3484 1 1 22 LYS HB3 H 10.744 0.760 -1.725 1.00 . A A . 22 LYS HB3 1 1 9 3485 1 1 22 LYS HD3 H 9.232 2.528 -0.924 1.00 . A A . 22 LYS HD3 1 1 9 3486 1 1 22 LYS HE3 H 10.453 5.091 -0.866 1.00 . A A . 22 LYS HE3 1 1 9 3487 1 1 22 LYS HG3 H 11.717 3.068 -2.535 1.00 . A A . 22 LYS HG3 1 1 9 3488 1 1 22 LYS HZ1 H 8.717 4.768 -3.099 1.00 . A A . 22 LYS HZ1 1 1 9 3489 1 1 22 LYS HZ2 H 8.252 5.977 -2.105 1.00 . A A . 22 LYS HZ2 1 1 9 3490 1 1 22 LYS HZ3 H 9.751 5.983 -2.754 1.00 . A A . 22 LYS HZ3 1 1 9 3491 1 1 22 LYS N N 10.081 0.661 0.659 1.00 . A A . 22 LYS N 1 1 9 3492 1 1 22 LYS NZ N 9.021 5.404 -2.390 1.00 . A A . 22 LYS NZ 1 1 9 3493 1 1 22 LYS O O 12.889 2.771 1.252 1.00 . A A . 22 LYS O 1 1 9 3494 1 1 23 LYS C C 10.768 3.817 3.946 1.00 . A A . 23 LYS C 1 1 9 3495 1 1 23 LYS CA C 10.835 4.197 2.465 1.00 . A A . 23 LYS CA 1 1 9 3496 1 1 23 LYS CB C 9.815 5.261 2.057 1.00 . A A . 23 LYS CB 1 1 9 3497 1 1 23 LYS CD C 7.577 5.815 3.080 1.00 . A A . 23 LYS CD 1 1 9 3498 1 1 23 LYS CE C 6.075 5.613 2.869 1.00 . A A . 23 LYS CE 1 1 9 3499 1 1 23 LYS CG C 8.386 4.774 2.303 1.00 . A A . 23 LYS CG 1 1 9 3500 1 1 23 LYS H H 9.732 2.690 1.542 1.00 . A A . 23 LYS H 1 1 9 3501 1 1 23 LYS HA H 11.825 4.603 2.258 1.00 . A A . 23 LYS HA 1 1 9 3502 1 1 23 LYS HB3 H 9.942 5.508 1.003 1.00 . A A . 23 LYS HB3 1 1 9 3503 1 1 23 LYS HD3 H 7.862 6.816 2.757 1.00 . A A . 23 LYS HD3 1 1 9 3504 1 1 23 LYS HE3 H 5.750 4.704 3.376 1.00 . A A . 23 LYS HE3 1 1 9 3505 1 1 23 LYS HG3 H 8.408 3.837 2.860 1.00 . A A . 23 LYS HG3 1 1 9 3506 1 1 23 LYS HZ1 H 5.508 7.575 2.818 1.00 . A A . 23 LYS HZ1 1 1 9 3507 1 1 23 LYS HZ2 H 4.339 6.573 3.359 1.00 . A A . 23 LYS HZ2 1 1 9 3508 1 1 23 LYS HZ3 H 5.596 6.960 4.328 1.00 . A A . 23 LYS HZ3 1 1 9 3509 1 1 23 LYS N N 10.676 3.002 1.655 1.00 . A A . 23 LYS N 1 1 9 3510 1 1 23 LYS NZ N 5.319 6.774 3.385 1.00 . A A . 23 LYS NZ 1 1 9 3511 1 1 23 LYS O O 11.296 4.530 4.798 1.00 . A A . 23 LYS O 1 1 9 3512 1 1 24 TRP C C 11.261 1.478 5.949 1.00 . A A . 24 TRP C 1 1 9 3513 1 1 24 TRP CA C 9.973 2.210 5.569 1.00 . A A . 24 TRP CA 1 1 9 3514 1 1 24 TRP CB C 8.724 1.339 5.714 1.00 . A A . 24 TRP CB 1 1 9 3515 1 1 24 TRP CD1 C 7.239 3.434 5.461 1.00 . A A . 24 TRP CD1 1 1 9 3516 1 1 24 TRP CD2 C 6.080 1.577 5.810 1.00 . A A . 24 TRP CD2 1 1 9 3517 1 1 24 TRP CE2 C 5.175 2.613 5.693 1.00 . A A . 24 TRP CE2 1 1 9 3518 1 1 24 TRP CE3 C 5.657 0.257 6.037 1.00 . A A . 24 TRP CE3 1 1 9 3519 1 1 24 TRP CG C 7.409 2.120 5.658 1.00 . A A . 24 TRP CG 1 1 9 3520 1 1 24 TRP CH2 C 3.345 1.127 6.018 1.00 . A A . 24 TRP CH2 1 1 9 3521 1 1 24 TRP CZ2 C 3.790 2.435 5.791 1.00 . A A . 24 TRP CZ2 1 1 9 3522 1 1 24 TRP CZ3 C 4.270 0.095 6.132 1.00 . A A . 24 TRP CZ3 1 1 9 3523 1 1 24 TRP H H 9.689 2.120 3.508 1.00 . A A . 24 TRP H 1 1 9 3524 1 1 24 TRP HA H 9.832 3.076 6.217 1.00 . A A . 24 TRP HA 1 1 9 3525 1 1 24 TRP HB3 H 8.776 0.802 6.661 1.00 . A A . 24 TRP HB3 1 1 9 3526 1 1 24 TRP HD1 H 8.052 4.143 5.309 1.00 . A A . 24 TRP HD1 1 1 9 3527 1 1 24 TRP HE1 H 5.492 4.778 5.338 1.00 . A A . 24 TRP HE1 1 1 9 3528 1 1 24 TRP HE3 H 6.351 -0.578 6.133 1.00 . A A . 24 TRP HE3 1 1 9 3529 1 1 24 TRP HH2 H 2.279 0.919 6.104 1.00 . A A . 24 TRP HH2 1 1 9 3530 1 1 24 TRP HZ2 H 3.095 3.269 5.695 1.00 . A A . 24 TRP HZ2 1 1 9 3531 1 1 24 TRP HZ3 H 3.887 -0.910 6.309 1.00 . A A . 24 TRP HZ3 1 1 9 3532 1 1 24 TRP N N 10.116 2.695 4.207 1.00 . A A . 24 TRP N 1 1 9 3533 1 1 24 TRP NE1 N 5.902 3.777 5.474 1.00 . A A . 24 TRP NE1 1 1 9 3534 1 1 24 TRP O O 11.527 0.385 5.450 1.00 . A A . 24 TRP O 1 1 9 3535 1 1 25 GLY C C 13.593 1.951 8.715 1.00 . A A . 25 GLY C 1 1 9 3536 1 1 25 GLY CA C 13.280 1.530 7.278 1.00 . A A . 25 GLY CA 1 1 9 3537 1 1 25 GLY H H 11.802 2.997 7.227 1.00 . A A . 25 GLY H 1 1 9 3538 1 1 25 GLY HA2 H 13.226 0.442 7.218 1.00 . A A . 25 GLY HA2 1 1 9 3539 1 1 25 GLY HA3 H 14.089 1.846 6.619 1.00 . A A . 25 GLY HA3 1 1 9 3540 1 1 25 GLY N N 12.026 2.108 6.827 1.00 . A A . 25 GLY N 1 1 9 3541 1 1 25 GLY O O 13.929 3.107 8.968 1.00 . A A . 25 GLY O 1 1 9 3542 1 1 26 TRP C C 15.158 0.778 11.332 1.00 . A A . 26 TRP C 1 1 9 3543 1 1 26 TRP CA C 13.735 1.248 11.025 1.00 . A A . 26 TRP CA 1 1 9 3544 1 1 26 TRP CB C 12.681 0.583 11.913 1.00 . A A . 26 TRP CB 1 1 9 3545 1 1 26 TRP CD1 C 10.801 2.348 11.992 1.00 . A A . 26 TRP CD1 1 1 9 3546 1 1 26 TRP CD2 C 11.611 1.843 13.991 1.00 . A A . 26 TRP CD2 1 1 9 3547 1 1 26 TRP CE2 C 10.622 2.789 14.174 1.00 . A A . 26 TRP CE2 1 1 9 3548 1 1 26 TRP CE3 C 12.326 1.312 15.079 1.00 . A A . 26 TRP CE3 1 1 9 3549 1 1 26 TRP CG C 11.717 1.566 12.579 1.00 . A A . 26 TRP CG 1 1 9 3550 1 1 26 TRP CH2 C 10.958 2.770 16.530 1.00 . A A . 26 TRP CH2 1 1 9 3551 1 1 26 TRP CZ2 C 10.259 3.285 15.431 1.00 . A A . 26 TRP CZ2 1 1 9 3552 1 1 26 TRP CZ3 C 11.951 1.818 16.329 1.00 . A A . 26 TRP CZ3 1 1 9 3553 1 1 26 TRP H H 13.195 0.053 9.406 1.00 . A A . 26 TRP H 1 1 9 3554 1 1 26 TRP HA H 13.654 2.323 11.189 1.00 . A A . 26 TRP HA 1 1 9 3555 1 1 26 TRP HB3 H 13.186 0.004 12.687 1.00 . A A . 26 TRP HB3 1 1 9 3556 1 1 26 TRP HD1 H 10.620 2.382 10.918 1.00 . A A . 26 TRP HD1 1 1 9 3557 1 1 26 TRP HE1 H 9.319 3.821 12.708 1.00 . A A . 26 TRP HE1 1 1 9 3558 1 1 26 TRP HE3 H 13.110 0.564 14.962 1.00 . A A . 26 TRP HE3 1 1 9 3559 1 1 26 TRP HH2 H 10.725 3.115 17.537 1.00 . A A . 26 TRP HH2 1 1 9 3560 1 1 26 TRP HZ2 H 9.474 4.032 15.549 1.00 . A A . 26 TRP HZ2 1 1 9 3561 1 1 26 TRP HZ3 H 12.475 1.440 17.207 1.00 . A A . 26 TRP HZ3 1 1 9 3562 1 1 26 TRP N N 13.470 0.991 9.621 1.00 . A A . 26 TRP N 1 1 9 3563 1 1 26 TRP NE1 N 10.114 3.106 12.919 1.00 . A A . 26 TRP NE1 1 1 9 3564 1 1 26 TRP O O 15.971 0.616 10.423 1.00 . A A . 26 TRP O 1 1 10 3565 1 1 1 LYS C C -8.451 12.201 2.176 1.00 . A A . 1 LYS C 1 1 10 3566 1 1 1 LYS CA C -8.730 12.409 0.686 1.00 . A A . 1 LYS CA 1 1 10 3567 1 1 1 LYS CB C -10.025 13.173 0.403 1.00 . A A . 1 LYS CB 1 1 10 3568 1 1 1 LYS CD C -9.664 15.034 -1.260 1.00 . A A . 1 LYS CD 1 1 10 3569 1 1 1 LYS CE C -9.175 16.473 -1.441 1.00 . A A . 1 LYS CE 1 1 10 3570 1 1 1 LYS CG C -9.751 14.668 0.223 1.00 . A A . 1 LYS CG 1 1 10 3571 1 1 1 LYS H1 H -8.903 11.158 -0.971 1.00 . A A . 1 LYS H1 1 1 10 3572 1 1 1 LYS HA H -7.913 12.990 0.259 1.00 . A A . 1 LYS HA 1 1 10 3573 1 1 1 LYS HB3 H -10.726 13.025 1.224 1.00 . A A . 1 LYS HB3 1 1 10 3574 1 1 1 LYS HD3 H -10.642 14.918 -1.725 1.00 . A A . 1 LYS HD3 1 1 10 3575 1 1 1 LYS HE3 H -8.085 16.498 -1.420 1.00 . A A . 1 LYS HE3 1 1 10 3576 1 1 1 LYS HG3 H -8.819 14.934 0.723 1.00 . A A . 1 LYS HG3 1 1 10 3577 1 1 1 LYS HZ1 H -8.921 17.033 -3.390 1.00 . A A . 1 LYS HZ1 1 1 10 3578 1 1 1 LYS HZ2 H -10.418 16.466 -3.064 1.00 . A A . 1 LYS HZ2 1 1 10 3579 1 1 1 LYS HZ3 H -9.988 17.964 -2.577 1.00 . A A . 1 LYS HZ3 1 1 10 3580 1 1 1 LYS N N -8.742 11.120 0.015 1.00 . A A . 1 LYS N 1 1 10 3581 1 1 1 LYS NZ N -9.665 17.029 -2.723 1.00 . A A . 1 LYS NZ 1 1 10 3582 1 1 1 LYS O O -8.342 11.066 2.638 1.00 . A A . 1 LYS O 1 1 10 3583 1 1 2 SER C C -6.650 12.784 4.567 1.00 . A A . 2 SER C 1 1 10 3584 1 1 2 SER CA C -8.079 13.268 4.314 1.00 . A A . 2 SER CA 1 1 10 3585 1 1 2 SER CB C -9.082 12.362 5.031 1.00 . A A . 2 SER CB 1 1 10 3586 1 1 2 SER H H -8.433 14.234 2.502 1.00 . A A . 2 SER H 1 1 10 3587 1 1 2 SER HA H -8.204 14.293 4.664 1.00 . A A . 2 SER HA 1 1 10 3588 1 1 2 SER HB3 H -8.936 12.439 6.107 1.00 . A A . 2 SER HB3 1 1 10 3589 1 1 2 SER HG H -10.451 13.306 3.917 1.00 . A A . 2 SER HG 1 1 10 3590 1 1 2 SER N N -8.343 13.314 2.886 1.00 . A A . 2 SER N 1 1 10 3591 1 1 2 SER O O -5.844 13.499 5.159 1.00 . A A . 2 SER O 1 1 10 3592 1 1 2 SER OG O -10.429 12.696 4.709 1.00 . A A . 2 SER OG 1 1 10 3593 1 1 3 SER C C -5.046 9.564 3.700 1.00 . A A . 3 SER C 1 1 10 3594 1 1 3 SER CA C -5.063 10.983 4.274 1.00 . A A . 3 SER CA 1 1 10 3595 1 1 3 SER CB C -4.652 10.964 5.747 1.00 . A A . 3 SER CB 1 1 10 3596 1 1 3 SER H H -7.042 10.996 3.624 1.00 . A A . 3 SER H 1 1 10 3597 1 1 3 SER HA H -4.385 11.629 3.717 1.00 . A A . 3 SER HA 1 1 10 3598 1 1 3 SER HB3 H -4.488 11.986 6.091 1.00 . A A . 3 SER HB3 1 1 10 3599 1 1 3 SER HG H -6.512 10.813 6.470 1.00 . A A . 3 SER HG 1 1 10 3600 1 1 3 SER N N -6.381 11.571 4.105 1.00 . A A . 3 SER N 1 1 10 3601 1 1 3 SER O O -4.278 9.270 2.786 1.00 . A A . 3 SER O 1 1 10 3602 1 1 3 SER OG O -5.637 10.341 6.568 1.00 . A A . 3 SER OG 1 1 10 3603 1 1 4 ALA C C -4.653 6.646 4.048 1.00 . A A . 4 ALA C 1 1 10 3604 1 1 4 ALA CA C -5.996 7.343 3.817 1.00 . A A . 4 ALA CA 1 1 10 3605 1 1 4 ALA CB C -6.427 7.307 2.350 1.00 . A A . 4 ALA CB 1 1 10 3606 1 1 4 ALA H H -6.524 8.971 5.005 1.00 . A A . 4 ALA H 1 1 10 3607 1 1 4 ALA HA H -6.759 6.851 4.420 1.00 . A A . 4 ALA HA 1 1 10 3608 1 1 4 ALA HB1 H -7.494 7.518 2.280 1.00 . A A . 4 ALA HB1 1 1 10 3609 1 1 4 ALA HB2 H -5.870 8.057 1.789 1.00 . A A . 4 ALA HB2 1 1 10 3610 1 1 4 ALA HB3 H -6.224 6.319 1.935 1.00 . A A . 4 ALA HB3 1 1 10 3611 1 1 4 ALA N N -5.902 8.723 4.262 1.00 . A A . 4 ALA N 1 1 10 3612 1 1 4 ALA O O -3.598 7.264 3.915 1.00 . A A . 4 ALA O 1 1 10 3613 1 1 5 TYR C C -3.893 3.110 4.874 1.00 . A A . 5 TYR C 1 1 10 3614 1 1 5 TYR CA C -3.541 4.581 4.638 1.00 . A A . 5 TYR CA 1 1 10 3615 1 1 5 TYR CB C -2.917 5.154 5.912 1.00 . A A . 5 TYR CB 1 1 10 3616 1 1 5 TYR CD1 C -5.004 5.285 7.321 1.00 . A A . 5 TYR CD1 1 1 10 3617 1 1 5 TYR CD2 C -3.114 4.114 8.200 1.00 . A A . 5 TYR CD2 1 1 10 3618 1 1 5 TYR CE1 C -5.745 4.991 8.520 1.00 . A A . 5 TYR CE1 1 1 10 3619 1 1 5 TYR CE2 C -3.856 3.820 9.399 1.00 . A A . 5 TYR CE2 1 1 10 3620 1 1 5 TYR CG C -3.705 4.841 7.186 1.00 . A A . 5 TYR CG 1 1 10 3621 1 1 5 TYR CZ C -5.134 4.273 9.500 1.00 . A A . 5 TYR CZ 1 1 10 3622 1 1 5 TYR H H -5.599 4.873 4.494 1.00 . A A . 5 TYR H 1 1 10 3623 1 1 5 TYR HA H -2.899 4.657 3.761 1.00 . A A . 5 TYR HA 1 1 10 3624 1 1 5 TYR HB3 H -2.830 6.236 5.807 1.00 . A A . 5 TYR HB3 1 1 10 3625 1 1 5 TYR HD1 H -5.469 5.860 6.520 1.00 . A A . 5 TYR HD1 1 1 10 3626 1 1 5 TYR HD2 H -2.088 3.763 8.094 1.00 . A A . 5 TYR HD2 1 1 10 3627 1 1 5 TYR HE1 H -6.772 5.337 8.639 1.00 . A A . 5 TYR HE1 1 1 10 3628 1 1 5 TYR HE2 H -3.402 3.247 10.208 1.00 . A A . 5 TYR HE2 1 1 10 3629 1 1 5 TYR HH H -6.740 3.644 10.396 1.00 . A A . 5 TYR HH 1 1 10 3630 1 1 5 TYR N N -4.736 5.369 4.388 1.00 . A A . 5 TYR N 1 1 10 3631 1 1 5 TYR O O -3.591 2.558 5.930 1.00 . A A . 5 TYR O 1 1 10 3632 1 1 5 TYR OH O -5.834 3.995 10.632 1.00 . A A . 5 TYR OH 1 1 10 3633 1 1 6 SER C C -4.820 0.466 2.580 1.00 . A A . 6 SER C 1 1 10 3634 1 1 6 SER CA C -4.923 1.124 3.957 1.00 . A A . 6 SER CA 1 1 10 3635 1 1 6 SER CB C -6.344 0.987 4.506 1.00 . A A . 6 SER CB 1 1 10 3636 1 1 6 SER H H -4.769 2.976 3.016 1.00 . A A . 6 SER H 1 1 10 3637 1 1 6 SER HA H -4.220 0.666 4.653 1.00 . A A . 6 SER HA 1 1 10 3638 1 1 6 SER HB3 H -6.741 0.006 4.245 1.00 . A A . 6 SER HB3 1 1 10 3639 1 1 6 SER HG H -5.594 1.678 6.228 1.00 . A A . 6 SER HG 1 1 10 3640 1 1 6 SER N N -4.527 2.519 3.872 1.00 . A A . 6 SER N 1 1 10 3641 1 1 6 SER O O -4.286 -0.635 2.452 1.00 . A A . 6 SER O 1 1 10 3642 1 1 6 SER OG O -6.389 1.156 5.920 1.00 . A A . 6 SER OG 1 1 10 3643 1 1 7 LEU C C -5.788 -0.789 0.208 1.00 . A A . 7 LEU C 1 1 10 3644 1 1 7 LEU CA C -5.314 0.665 0.220 1.00 . A A . 7 LEU CA 1 1 10 3645 1 1 7 LEU CB C -3.930 0.866 -0.398 1.00 . A A . 7 LEU CB 1 1 10 3646 1 1 7 LEU CD1 C -3.143 3.215 -0.871 1.00 . A A . 7 LEU CD1 1 1 10 3647 1 1 7 LEU CD2 C -3.105 1.464 -2.706 1.00 . A A . 7 LEU CD2 1 1 10 3648 1 1 7 LEU CG C -3.818 1.971 -1.451 1.00 . A A . 7 LEU CG 1 1 10 3649 1 1 7 LEU H H -5.773 2.062 1.696 1.00 . A A . 7 LEU H 1 1 10 3650 1 1 7 LEU HA H -6.017 1.263 -0.361 1.00 . A A . 7 LEU HA 1 1 10 3651 1 1 7 LEU HB3 H -3.616 -0.073 -0.853 1.00 . A A . 7 LEU HB3 1 1 10 3652 1 1 7 LEU HD11 H -2.883 3.898 -1.680 1.00 . A A . 7 LEU HD11 1 1 10 3653 1 1 7 LEU HD12 H -3.826 3.712 -0.182 1.00 . A A . 7 LEU HD12 1 1 10 3654 1 1 7 LEU HD13 H -2.238 2.923 -0.339 1.00 . A A . 7 LEU HD13 1 1 10 3655 1 1 7 LEU HD21 H -3.739 0.738 -3.215 1.00 . A A . 7 LEU HD21 1 1 10 3656 1 1 7 LEU HD22 H -2.903 2.301 -3.373 1.00 . A A . 7 LEU HD22 1 1 10 3657 1 1 7 LEU HD23 H -2.165 0.989 -2.422 1.00 . A A . 7 LEU HD23 1 1 10 3658 1 1 7 LEU HG H -4.826 2.261 -1.749 1.00 . A A . 7 LEU HG 1 1 10 3659 1 1 7 LEU N N -5.340 1.168 1.583 1.00 . A A . 7 LEU N 1 1 10 3660 1 1 7 LEU O O -4.994 -1.706 0.411 1.00 . A A . 7 LEU O 1 1 10 3661 1 1 8 GLN C C -8.858 -2.306 -1.037 1.00 . A A . 8 GLN C 1 1 10 3662 1 1 8 GLN CA C -7.669 -2.283 -0.074 1.00 . A A . 8 GLN CA 1 1 10 3663 1 1 8 GLN CB C -8.088 -2.741 1.325 1.00 . A A . 8 GLN CB 1 1 10 3664 1 1 8 GLN CD C -7.346 -3.958 3.406 1.00 . A A . 8 GLN CD 1 1 10 3665 1 1 8 GLN CG C -7.032 -3.664 1.938 1.00 . A A . 8 GLN CG 1 1 10 3666 1 1 8 GLN H H -7.719 -0.204 -0.197 1.00 . A A . 8 GLN H 1 1 10 3667 1 1 8 GLN HA H -6.881 -2.938 -0.444 1.00 . A A . 8 GLN HA 1 1 10 3668 1 1 8 GLN HB3 H -9.044 -3.262 1.271 1.00 . A A . 8 GLN HB3 1 1 10 3669 1 1 8 GLN HE21 H -7.961 -5.807 2.855 1.00 . A A . 8 GLN HE21 1 1 10 3670 1 1 8 GLN HE22 H -8.069 -5.464 4.550 1.00 . A A . 8 GLN HE22 1 1 10 3671 1 1 8 GLN HG3 H -6.048 -3.201 1.858 1.00 . A A . 8 GLN HG3 1 1 10 3672 1 1 8 GLN N N -7.081 -0.955 -0.033 1.00 . A A . 8 GLN N 1 1 10 3673 1 1 8 GLN NE2 N -7.832 -5.177 3.621 1.00 . A A . 8 GLN NE2 1 1 10 3674 1 1 8 GLN O O -9.684 -1.394 -1.032 1.00 . A A . 8 GLN O 1 1 10 3675 1 1 8 GLN OE1 O -7.160 -3.132 4.284 1.00 . A A . 8 GLN OE1 1 1 10 3676 1 1 9 MET C C -9.975 -4.917 -3.414 1.00 . A A . 9 MET C 1 1 10 3677 1 1 9 MET CA C -9.982 -3.513 -2.806 1.00 . A A . 9 MET CA 1 1 10 3678 1 1 9 MET CB C -9.821 -2.475 -3.919 1.00 . A A . 9 MET CB 1 1 10 3679 1 1 9 MET CE C -7.562 -2.056 -7.171 1.00 . A A . 9 MET CE 1 1 10 3680 1 1 9 MET CG C -8.518 -2.696 -4.690 1.00 . A A . 9 MET CG 1 1 10 3681 1 1 9 MET H H -8.233 -4.096 -1.838 1.00 . A A . 9 MET H 1 1 10 3682 1 1 9 MET HA H -10.904 -3.355 -2.246 1.00 . A A . 9 MET HA 1 1 10 3683 1 1 9 MET HB3 H -9.828 -1.473 -3.490 1.00 . A A . 9 MET HB3 1 1 10 3684 1 1 9 MET HE1 H -6.680 -1.532 -7.541 1.00 . A A . 9 MET HE1 1 1 10 3685 1 1 9 MET HE2 H -7.303 -3.091 -6.952 1.00 . A A . 9 MET HE2 1 1 10 3686 1 1 9 MET HE3 H -8.344 -2.030 -7.930 1.00 . A A . 9 MET HE3 1 1 10 3687 1 1 9 MET HG3 H -8.607 -3.576 -5.327 1.00 . A A . 9 MET HG3 1 1 10 3688 1 1 9 MET N N -8.908 -3.359 -1.840 1.00 . A A . 9 MET N 1 1 10 3689 1 1 9 MET O O -11.032 -5.516 -3.613 1.00 . A A . 9 MET O 1 1 10 3690 1 1 9 MET SD S -8.147 -1.260 -5.685 1.00 . A A . 9 MET SD 1 1 10 3691 1 1 10 GLY C C -7.875 -7.660 -3.313 1.00 . A A . 10 GLY C 1 1 10 3692 1 1 10 GLY CA C -8.617 -6.725 -4.271 1.00 . A A . 10 GLY CA 1 1 10 3693 1 1 10 GLY H H -7.920 -4.909 -3.525 1.00 . A A . 10 GLY H 1 1 10 3694 1 1 10 GLY HA2 H -9.596 -7.142 -4.506 1.00 . A A . 10 GLY HA2 1 1 10 3695 1 1 10 GLY HA3 H -8.068 -6.651 -5.210 1.00 . A A . 10 GLY HA3 1 1 10 3696 1 1 10 GLY N N -8.774 -5.402 -3.690 1.00 . A A . 10 GLY N 1 1 10 3697 1 1 10 GLY O O -8.498 -8.371 -2.527 1.00 . A A . 10 GLY O 1 1 10 3698 1 1 11 ALA C C -4.260 -8.322 -2.993 1.00 . A A . 11 ALA C 1 1 10 3699 1 1 11 ALA CA C -5.720 -8.462 -2.561 1.00 . A A . 11 ALA CA 1 1 10 3700 1 1 11 ALA CB C -6.213 -9.909 -2.628 1.00 . A A . 11 ALA CB 1 1 10 3701 1 1 11 ALA H H -6.055 -7.045 -4.052 1.00 . A A . 11 ALA H 1 1 10 3702 1 1 11 ALA HA H -5.824 -8.103 -1.538 1.00 . A A . 11 ALA HA 1 1 10 3703 1 1 11 ALA HB1 H -5.405 -10.551 -2.981 1.00 . A A . 11 ALA HB1 1 1 10 3704 1 1 11 ALA HB2 H -6.527 -10.232 -1.636 1.00 . A A . 11 ALA HB2 1 1 10 3705 1 1 11 ALA HB3 H -7.056 -9.975 -3.316 1.00 . A A . 11 ALA HB3 1 1 10 3706 1 1 11 ALA N N -6.554 -7.627 -3.409 1.00 . A A . 11 ALA N 1 1 10 3707 1 1 11 ALA O O -3.388 -8.045 -2.169 1.00 . A A . 11 ALA O 1 1 10 3708 1 1 12 THR C C -2.186 -6.980 -4.741 1.00 . A A . 12 THR C 1 1 10 3709 1 1 12 THR CA C -2.695 -8.421 -4.835 1.00 . A A . 12 THR CA 1 1 10 3710 1 1 12 THR CB C -2.730 -8.960 -6.267 1.00 . A A . 12 THR CB 1 1 10 3711 1 1 12 THR CG2 C -3.611 -10.203 -6.402 1.00 . A A . 12 THR CG2 1 1 10 3712 1 1 12 THR H H -4.749 -8.746 -4.947 1.00 . A A . 12 THR H 1 1 10 3713 1 1 12 THR HA H -2.028 -9.036 -4.231 1.00 . A A . 12 THR HA 1 1 10 3714 1 1 12 THR HB H -1.722 -9.153 -6.634 1.00 . A A . 12 THR HB 1 1 10 3715 1 1 12 THR HG1 H -4.398 -7.960 -6.743 1.00 . A A . 12 THR HG1 1 1 10 3716 1 1 12 THR HG21 H -3.932 -10.530 -5.414 1.00 . A A . 12 THR HG21 1 1 10 3717 1 1 12 THR HG22 H -4.485 -9.965 -7.009 1.00 . A A . 12 THR HG22 1 1 10 3718 1 1 12 THR HG23 H -3.043 -11.001 -6.882 1.00 . A A . 12 THR HG23 1 1 10 3719 1 1 12 THR N N -4.035 -8.521 -4.284 1.00 . A A . 12 THR N 1 1 10 3720 1 1 12 THR O O -1.047 -6.746 -4.336 1.00 . A A . 12 THR O 1 1 10 3721 1 1 12 THR OG1 O -3.431 -7.957 -6.998 1.00 . A A . 12 THR OG1 1 1 10 3722 1 1 13 ALA C C -1.971 -4.338 -3.776 1.00 . A A . 13 ALA C 1 1 10 3723 1 1 13 ALA CA C -2.706 -4.643 -5.083 1.00 . A A . 13 ALA CA 1 1 10 3724 1 1 13 ALA CB C -3.972 -3.801 -5.250 1.00 . A A . 13 ALA CB 1 1 10 3725 1 1 13 ALA H H -3.977 -6.253 -5.448 1.00 . A A . 13 ALA H 1 1 10 3726 1 1 13 ALA HA H -2.038 -4.444 -5.921 1.00 . A A . 13 ALA HA 1 1 10 3727 1 1 13 ALA HB1 H -4.130 -3.590 -6.308 1.00 . A A . 13 ALA HB1 1 1 10 3728 1 1 13 ALA HB2 H -4.829 -4.350 -4.858 1.00 . A A . 13 ALA HB2 1 1 10 3729 1 1 13 ALA HB3 H -3.859 -2.864 -4.706 1.00 . A A . 13 ALA HB3 1 1 10 3730 1 1 13 ALA N N -3.053 -6.054 -5.120 1.00 . A A . 13 ALA N 1 1 10 3731 1 1 13 ALA O O -0.976 -3.616 -3.774 1.00 . A A . 13 ALA O 1 1 10 3732 1 1 14 ILE C C -0.380 -4.889 -1.483 1.00 . A A . 14 ILE C 1 1 10 3733 1 1 14 ILE CA C -1.896 -4.700 -1.387 1.00 . A A . 14 ILE CA 1 1 10 3734 1 1 14 ILE CB C -2.563 -5.606 -0.348 1.00 . A A . 14 ILE CB 1 1 10 3735 1 1 14 ILE CD1 C -4.818 -6.451 0.399 1.00 . A A . 14 ILE CD1 1 1 10 3736 1 1 14 ILE CG1 C -4.050 -5.276 -0.208 1.00 . A A . 14 ILE CG1 1 1 10 3737 1 1 14 ILE CG2 C -1.831 -5.536 0.992 1.00 . A A . 14 ILE CG2 1 1 10 3738 1 1 14 ILE H H -3.300 -5.490 -2.707 1.00 . A A . 14 ILE H 1 1 10 3739 1 1 14 ILE HA H -2.098 -3.671 -1.092 1.00 . A A . 14 ILE HA 1 1 10 3740 1 1 14 ILE HB H -2.494 -6.636 -0.700 1.00 . A A . 14 ILE HB 1 1 10 3741 1 1 14 ILE HD11 H -4.847 -6.345 1.483 1.00 . A A . 14 ILE HD11 1 1 10 3742 1 1 14 ILE HD12 H -5.836 -6.462 0.007 1.00 . A A . 14 ILE HD12 1 1 10 3743 1 1 14 ILE HD13 H -4.320 -7.385 0.137 1.00 . A A . 14 ILE HD13 1 1 10 3744 1 1 14 ILE HG13 H -4.466 -5.030 -1.185 1.00 . A A . 14 ILE HG13 1 1 10 3745 1 1 14 ILE HG21 H -0.904 -4.976 0.871 1.00 . A A . 14 ILE HG21 1 1 10 3746 1 1 14 ILE HG22 H -2.463 -5.037 1.727 1.00 . A A . 14 ILE HG22 1 1 10 3747 1 1 14 ILE HG23 H -1.603 -6.545 1.335 1.00 . A A . 14 ILE HG23 1 1 10 3748 1 1 14 ILE N N -2.490 -4.904 -2.696 1.00 . A A . 14 ILE N 1 1 10 3749 1 1 14 ILE O O 0.384 -4.024 -1.062 1.00 . A A . 14 ILE O 1 1 10 3750 1 1 15 LYS C C 2.149 -5.116 -2.754 1.00 . A A . 15 LYS C 1 1 10 3751 1 1 15 LYS CA C 1.417 -6.340 -2.199 1.00 . A A . 15 LYS CA 1 1 10 3752 1 1 15 LYS CB C 1.594 -7.600 -3.050 1.00 . A A . 15 LYS CB 1 1 10 3753 1 1 15 LYS CD C 2.095 -6.647 -5.331 1.00 . A A . 15 LYS CD 1 1 10 3754 1 1 15 LYS CE C 2.358 -7.419 -6.625 1.00 . A A . 15 LYS CE 1 1 10 3755 1 1 15 LYS CG C 2.666 -7.390 -4.122 1.00 . A A . 15 LYS CG 1 1 10 3756 1 1 15 LYS H H -0.621 -6.726 -2.382 1.00 . A A . 15 LYS H 1 1 10 3757 1 1 15 LYS HA H 1.815 -6.562 -1.209 1.00 . A A . 15 LYS HA 1 1 10 3758 1 1 15 LYS HB3 H 0.647 -7.859 -3.524 1.00 . A A . 15 LYS HB3 1 1 10 3759 1 1 15 LYS HD3 H 2.542 -5.655 -5.398 1.00 . A A . 15 LYS HD3 1 1 10 3760 1 1 15 LYS HE3 H 3.408 -7.707 -6.677 1.00 . A A . 15 LYS HE3 1 1 10 3761 1 1 15 LYS HG3 H 3.063 -8.355 -4.438 1.00 . A A . 15 LYS HG3 1 1 10 3762 1 1 15 LYS HZ1 H 1.805 -9.286 -6.002 1.00 . A A . 15 LYS HZ1 1 1 10 3763 1 1 15 LYS HZ2 H 0.553 -8.372 -6.517 1.00 . A A . 15 LYS HZ2 1 1 10 3764 1 1 15 LYS HZ3 H 1.578 -9.037 -7.600 1.00 . A A . 15 LYS HZ3 1 1 10 3765 1 1 15 LYS N N 0.007 -6.027 -2.041 1.00 . A A . 15 LYS N 1 1 10 3766 1 1 15 LYS NZ N 1.504 -8.626 -6.692 1.00 . A A . 15 LYS NZ 1 1 10 3767 1 1 15 LYS O O 3.239 -4.780 -2.295 1.00 . A A . 15 LYS O 1 1 10 3768 1 1 16 GLN C C 2.399 -2.240 -3.294 1.00 . A A . 16 GLN C 1 1 10 3769 1 1 16 GLN CA C 2.096 -3.302 -4.353 1.00 . A A . 16 GLN CA 1 1 10 3770 1 1 16 GLN CB C 1.172 -2.747 -5.438 1.00 . A A . 16 GLN CB 1 1 10 3771 1 1 16 GLN CD C 2.081 -4.066 -7.386 1.00 . A A . 16 GLN CD 1 1 10 3772 1 1 16 GLN CG C 0.864 -3.811 -6.494 1.00 . A A . 16 GLN CG 1 1 10 3773 1 1 16 GLN H H 0.632 -4.762 -4.099 1.00 . A A . 16 GLN H 1 1 10 3774 1 1 16 GLN HA H 3.024 -3.642 -4.813 1.00 . A A . 16 GLN HA 1 1 10 3775 1 1 16 GLN HB3 H 1.640 -1.884 -5.913 1.00 . A A . 16 GLN HB3 1 1 10 3776 1 1 16 GLN HE21 H 0.860 -3.975 -8.998 1.00 . A A . 16 GLN HE21 1 1 10 3777 1 1 16 GLN HE22 H 2.530 -4.267 -9.350 1.00 . A A . 16 GLN HE22 1 1 10 3778 1 1 16 GLN HG3 H 0.022 -3.488 -7.106 1.00 . A A . 16 GLN HG3 1 1 10 3779 1 1 16 GLN N N 1.519 -4.482 -3.732 1.00 . A A . 16 GLN N 1 1 10 3780 1 1 16 GLN NE2 N 1.800 -4.107 -8.686 1.00 . A A . 16 GLN NE2 1 1 10 3781 1 1 16 GLN O O 3.457 -1.613 -3.325 1.00 . A A . 16 GLN O 1 1 10 3782 1 1 16 GLN OE1 O 3.201 -4.216 -6.925 1.00 . A A . 16 GLN OE1 1 1 10 3783 1 1 17 VAL C C 2.914 -1.359 -0.574 1.00 . A A . 17 VAL C 1 1 10 3784 1 1 17 VAL CA C 1.604 -1.095 -1.319 1.00 . A A . 17 VAL CA 1 1 10 3785 1 1 17 VAL CB C 0.378 -1.124 -0.403 1.00 . A A . 17 VAL CB 1 1 10 3786 1 1 17 VAL CG1 C 0.496 -2.243 0.634 1.00 . A A . 17 VAL CG1 1 1 10 3787 1 1 17 VAL CG2 C 0.168 0.231 0.275 1.00 . A A . 17 VAL CG2 1 1 10 3788 1 1 17 VAL H H 0.593 -2.583 -2.368 1.00 . A A . 17 VAL H 1 1 10 3789 1 1 17 VAL HA H 1.656 -0.108 -1.780 1.00 . A A . 17 VAL HA 1 1 10 3790 1 1 17 VAL HB H -0.496 -1.329 -1.019 1.00 . A A . 17 VAL HB 1 1 10 3791 1 1 17 VAL HG11 H 0.608 -1.808 1.627 1.00 . A A . 17 VAL HG11 1 1 10 3792 1 1 17 VAL HG12 H -0.402 -2.860 0.607 1.00 . A A . 17 VAL HG12 1 1 10 3793 1 1 17 VAL HG13 H 1.367 -2.859 0.406 1.00 . A A . 17 VAL HG13 1 1 10 3794 1 1 17 VAL HG21 H 0.026 0.999 -0.485 1.00 . A A . 17 VAL HG21 1 1 10 3795 1 1 17 VAL HG22 H -0.715 0.185 0.913 1.00 . A A . 17 VAL HG22 1 1 10 3796 1 1 17 VAL HG23 H 1.041 0.476 0.880 1.00 . A A . 17 VAL HG23 1 1 10 3797 1 1 17 VAL N N 1.451 -2.070 -2.384 1.00 . A A . 17 VAL N 1 1 10 3798 1 1 17 VAL O O 3.566 -0.427 -0.107 1.00 . A A . 17 VAL O 1 1 10 3799 1 1 18 LYS C C 5.687 -2.477 -0.565 1.00 . A A . 18 LYS C 1 1 10 3800 1 1 18 LYS CA C 4.481 -3.034 0.193 1.00 . A A . 18 LYS CA 1 1 10 3801 1 1 18 LYS CB C 4.517 -4.552 0.379 1.00 . A A . 18 LYS CB 1 1 10 3802 1 1 18 LYS CD C 6.046 -5.380 -1.447 1.00 . A A . 18 LYS CD 1 1 10 3803 1 1 18 LYS CE C 5.706 -6.833 -1.779 1.00 . A A . 18 LYS CE 1 1 10 3804 1 1 18 LYS CG C 5.904 -5.112 0.052 1.00 . A A . 18 LYS CG 1 1 10 3805 1 1 18 LYS H H 2.724 -3.387 -0.870 1.00 . A A . 18 LYS H 1 1 10 3806 1 1 18 LYS HA H 4.461 -2.588 1.188 1.00 . A A . 18 LYS HA 1 1 10 3807 1 1 18 LYS HB3 H 3.771 -5.020 -0.263 1.00 . A A . 18 LYS HB3 1 1 10 3808 1 1 18 LYS HD3 H 7.066 -5.160 -1.764 1.00 . A A . 18 LYS HD3 1 1 10 3809 1 1 18 LYS HE3 H 5.595 -6.951 -2.857 1.00 . A A . 18 LYS HE3 1 1 10 3810 1 1 18 LYS HG3 H 6.068 -6.035 0.607 1.00 . A A . 18 LYS HG3 1 1 10 3811 1 1 18 LYS HZ1 H 7.558 -7.692 -1.890 1.00 . A A . 18 LYS HZ1 1 1 10 3812 1 1 18 LYS HZ2 H 7.036 -7.463 -0.360 1.00 . A A . 18 LYS HZ2 1 1 10 3813 1 1 18 LYS HZ3 H 6.419 -8.678 -1.261 1.00 . A A . 18 LYS HZ3 1 1 10 3814 1 1 18 LYS N N 3.260 -2.635 -0.486 1.00 . A A . 18 LYS N 1 1 10 3815 1 1 18 LYS NZ N 6.766 -7.740 -1.282 1.00 . A A . 18 LYS NZ 1 1 10 3816 1 1 18 LYS O O 6.676 -2.074 0.046 1.00 . A A . 18 LYS O 1 1 10 3817 1 1 19 LYS C C 6.779 -0.465 -2.526 1.00 . A A . 19 LYS C 1 1 10 3818 1 1 19 LYS CA C 6.635 -1.974 -2.732 1.00 . A A . 19 LYS CA 1 1 10 3819 1 1 19 LYS CB C 6.395 -2.375 -4.189 1.00 . A A . 19 LYS CB 1 1 10 3820 1 1 19 LYS CD C 5.527 -0.195 -5.113 1.00 . A A . 19 LYS CD 1 1 10 3821 1 1 19 LYS CE C 4.639 -0.351 -6.349 1.00 . A A . 19 LYS CE 1 1 10 3822 1 1 19 LYS CG C 6.676 -1.205 -5.134 1.00 . A A . 19 LYS CG 1 1 10 3823 1 1 19 LYS H H 4.758 -2.804 -2.373 1.00 . A A . 19 LYS H 1 1 10 3824 1 1 19 LYS HA H 7.558 -2.457 -2.413 1.00 . A A . 19 LYS HA 1 1 10 3825 1 1 19 LYS HB3 H 5.365 -2.708 -4.314 1.00 . A A . 19 LYS HB3 1 1 10 3826 1 1 19 LYS HD3 H 5.929 0.818 -5.075 1.00 . A A . 19 LYS HD3 1 1 10 3827 1 1 19 LYS HE3 H 4.311 -1.387 -6.439 1.00 . A A . 19 LYS HE3 1 1 10 3828 1 1 19 LYS HG3 H 6.820 -1.578 -6.147 1.00 . A A . 19 LYS HG3 1 1 10 3829 1 1 19 LYS HZ1 H 2.650 0.000 -6.033 1.00 . A A . 19 LYS HZ1 1 1 10 3830 1 1 19 LYS HZ2 H 3.615 1.223 -5.542 1.00 . A A . 19 LYS HZ2 1 1 10 3831 1 1 19 LYS HZ3 H 3.324 1.002 -7.133 1.00 . A A . 19 LYS HZ3 1 1 10 3832 1 1 19 LYS N N 5.566 -2.474 -1.884 1.00 . A A . 19 LYS N 1 1 10 3833 1 1 19 LYS NZ N 3.462 0.541 -6.256 1.00 . A A . 19 LYS NZ 1 1 10 3834 1 1 19 LYS O O 7.805 0.117 -2.875 1.00 . A A . 19 LYS O 1 1 10 3835 1 1 20 LEU C C 6.321 1.820 -0.313 1.00 . A A . 20 LEU C 1 1 10 3836 1 1 20 LEU CA C 5.736 1.555 -1.701 1.00 . A A . 20 LEU CA 1 1 10 3837 1 1 20 LEU CB C 4.333 2.133 -1.899 1.00 . A A . 20 LEU CB 1 1 10 3838 1 1 20 LEU CD1 C 4.210 3.817 -0.026 1.00 . A A . 20 LEU CD1 1 1 10 3839 1 1 20 LEU CD2 C 2.096 2.711 -0.888 1.00 . A A . 20 LEU CD2 1 1 10 3840 1 1 20 LEU CG C 3.595 2.552 -0.625 1.00 . A A . 20 LEU CG 1 1 10 3841 1 1 20 LEU H H 4.907 -0.356 -1.677 1.00 . A A . 20 LEU H 1 1 10 3842 1 1 20 LEU HA H 6.384 2.022 -2.444 1.00 . A A . 20 LEU HA 1 1 10 3843 1 1 20 LEU HB3 H 3.726 1.393 -2.420 1.00 . A A . 20 LEU HB3 1 1 10 3844 1 1 20 LEU HD11 H 3.441 4.585 0.068 1.00 . A A . 20 LEU HD11 1 1 10 3845 1 1 20 LEU HD12 H 4.620 3.591 0.959 1.00 . A A . 20 LEU HD12 1 1 10 3846 1 1 20 LEU HD13 H 5.006 4.179 -0.677 1.00 . A A . 20 LEU HD13 1 1 10 3847 1 1 20 LEU HD21 H 1.533 2.246 -0.078 1.00 . A A . 20 LEU HD21 1 1 10 3848 1 1 20 LEU HD22 H 1.847 3.771 -0.942 1.00 . A A . 20 LEU HD22 1 1 10 3849 1 1 20 LEU HD23 H 1.839 2.229 -1.832 1.00 . A A . 20 LEU HD23 1 1 10 3850 1 1 20 LEU HG H 3.710 1.758 0.112 1.00 . A A . 20 LEU HG 1 1 10 3851 1 1 20 LEU N N 5.738 0.125 -1.959 1.00 . A A . 20 LEU N 1 1 10 3852 1 1 20 LEU O O 6.703 2.947 0.000 1.00 . A A . 20 LEU O 1 1 10 3853 1 1 21 PHE C C 8.421 1.062 1.810 1.00 . A A . 21 PHE C 1 1 10 3854 1 1 21 PHE CA C 6.904 0.867 1.833 1.00 . A A . 21 PHE CA 1 1 10 3855 1 1 21 PHE CB C 6.582 -0.450 2.543 1.00 . A A . 21 PHE CB 1 1 10 3856 1 1 21 PHE CD1 C 4.477 0.004 3.821 1.00 . A A . 21 PHE CD1 1 1 10 3857 1 1 21 PHE CD2 C 6.449 -0.404 5.044 1.00 . A A . 21 PHE CD2 1 1 10 3858 1 1 21 PHE CE1 C 3.758 0.164 5.035 1.00 . A A . 21 PHE CE1 1 1 10 3859 1 1 21 PHE CE2 C 5.731 -0.244 6.257 1.00 . A A . 21 PHE CE2 1 1 10 3860 1 1 21 PHE CG C 5.807 -0.277 3.851 1.00 . A A . 21 PHE CG 1 1 10 3861 1 1 21 PHE CZ C 4.400 0.036 6.228 1.00 . A A . 21 PHE CZ 1 1 10 3862 1 1 21 PHE H H 6.060 -0.150 0.222 1.00 . A A . 21 PHE H 1 1 10 3863 1 1 21 PHE HA H 6.435 1.733 2.299 1.00 . A A . 21 PHE HA 1 1 10 3864 1 1 21 PHE HB3 H 7.515 -0.975 2.751 1.00 . A A . 21 PHE HB3 1 1 10 3865 1 1 21 PHE HD1 H 3.963 0.106 2.866 1.00 . A A . 21 PHE HD1 1 1 10 3866 1 1 21 PHE HD2 H 7.516 -0.629 5.066 1.00 . A A . 21 PHE HD2 1 1 10 3867 1 1 21 PHE HE1 H 2.692 0.389 5.011 1.00 . A A . 21 PHE HE1 1 1 10 3868 1 1 21 PHE HE2 H 6.245 -0.346 7.213 1.00 . A A . 21 PHE HE2 1 1 10 3869 1 1 21 PHE HZ H 3.848 0.159 7.159 1.00 . A A . 21 PHE HZ 1 1 10 3870 1 1 21 PHE N N 6.372 0.763 0.484 1.00 . A A . 21 PHE N 1 1 10 3871 1 1 21 PHE O O 9.010 1.491 2.801 1.00 . A A . 21 PHE O 1 1 10 3872 1 1 22 LYS C C 10.894 2.232 1.051 1.00 . A A . 22 LYS C 1 1 10 3873 1 1 22 LYS CA C 10.448 0.876 0.503 1.00 . A A . 22 LYS CA 1 1 10 3874 1 1 22 LYS CB C 10.845 0.641 -0.956 1.00 . A A . 22 LYS CB 1 1 10 3875 1 1 22 LYS CD C 9.467 2.319 -2.239 1.00 . A A . 22 LYS CD 1 1 10 3876 1 1 22 LYS CE C 9.381 3.803 -2.598 1.00 . A A . 22 LYS CE 1 1 10 3877 1 1 22 LYS CG C 10.865 1.956 -1.737 1.00 . A A . 22 LYS CG 1 1 10 3878 1 1 22 LYS H H 8.524 0.393 -0.134 1.00 . A A . 22 LYS H 1 1 10 3879 1 1 22 LYS HA H 10.919 0.091 1.095 1.00 . A A . 22 LYS HA 1 1 10 3880 1 1 22 LYS HB3 H 10.142 -0.052 -1.421 1.00 . A A . 22 LYS HB3 1 1 10 3881 1 1 22 LYS HD3 H 8.729 2.082 -1.473 1.00 . A A . 22 LYS HD3 1 1 10 3882 1 1 22 LYS HE3 H 9.858 4.399 -1.820 1.00 . A A . 22 LYS HE3 1 1 10 3883 1 1 22 LYS HG3 H 11.549 1.870 -2.582 1.00 . A A . 22 LYS HG3 1 1 10 3884 1 1 22 LYS HZ1 H 10.650 3.303 -4.120 1.00 . A A . 22 LYS HZ1 1 1 10 3885 1 1 22 LYS HZ2 H 9.340 4.142 -4.614 1.00 . A A . 22 LYS HZ2 1 1 10 3886 1 1 22 LYS HZ3 H 10.560 4.911 -3.848 1.00 . A A . 22 LYS HZ3 1 1 10 3887 1 1 22 LYS N N 9.011 0.741 0.668 1.00 . A A . 22 LYS N 1 1 10 3888 1 1 22 LYS NZ N 10.035 4.060 -3.900 1.00 . A A . 22 LYS NZ 1 1 10 3889 1 1 22 LYS O O 12.042 2.393 1.462 1.00 . A A . 22 LYS O 1 1 10 3890 1 1 23 LYS C C 9.755 4.637 2.971 1.00 . A A . 23 LYS C 1 1 10 3891 1 1 23 LYS CA C 10.246 4.513 1.528 1.00 . A A . 23 LYS CA 1 1 10 3892 1 1 23 LYS CB C 9.658 5.565 0.585 1.00 . A A . 23 LYS CB 1 1 10 3893 1 1 23 LYS CD C 7.346 6.488 0.181 1.00 . A A . 23 LYS CD 1 1 10 3894 1 1 23 LYS CE C 6.687 6.658 -1.190 1.00 . A A . 23 LYS CE 1 1 10 3895 1 1 23 LYS CG C 8.211 5.226 0.220 1.00 . A A . 23 LYS CG 1 1 10 3896 1 1 23 LYS H H 9.032 3.037 0.701 1.00 . A A . 23 LYS H 1 1 10 3897 1 1 23 LYS HA H 11.329 4.643 1.519 1.00 . A A . 23 LYS HA 1 1 10 3898 1 1 23 LYS HB3 H 10.261 5.625 -0.321 1.00 . A A . 23 LYS HB3 1 1 10 3899 1 1 23 LYS HD3 H 7.958 7.360 0.405 1.00 . A A . 23 LYS HD3 1 1 10 3900 1 1 23 LYS HE3 H 5.865 7.369 -1.118 1.00 . A A . 23 LYS HE3 1 1 10 3901 1 1 23 LYS HG3 H 7.805 4.523 0.946 1.00 . A A . 23 LYS HG3 1 1 10 3902 1 1 23 LYS HZ1 H 8.577 7.192 -1.755 1.00 . A A . 23 LYS HZ1 1 1 10 3903 1 1 23 LYS HZ2 H 7.713 6.491 -2.950 1.00 . A A . 23 LYS HZ2 1 1 10 3904 1 1 23 LYS HZ3 H 7.405 8.035 -2.519 1.00 . A A . 23 LYS HZ3 1 1 10 3905 1 1 23 LYS N N 9.964 3.175 1.038 1.00 . A A . 23 LYS N 1 1 10 3906 1 1 23 LYS NZ N 7.676 7.133 -2.184 1.00 . A A . 23 LYS NZ 1 1 10 3907 1 1 23 LYS O O 10.359 5.343 3.778 1.00 . A A . 23 LYS O 1 1 10 3908 1 1 24 TRP C C 8.992 3.156 5.511 1.00 . A A . 24 TRP C 1 1 10 3909 1 1 24 TRP CA C 8.083 3.966 4.584 1.00 . A A . 24 TRP CA 1 1 10 3910 1 1 24 TRP CB C 6.641 3.455 4.564 1.00 . A A . 24 TRP CB 1 1 10 3911 1 1 24 TRP CD1 C 5.981 5.364 2.959 1.00 . A A . 24 TRP CD1 1 1 10 3912 1 1 24 TRP CD2 C 4.244 4.206 3.701 1.00 . A A . 24 TRP CD2 1 1 10 3913 1 1 24 TRP CE2 C 3.758 5.187 2.861 1.00 . A A . 24 TRP CE2 1 1 10 3914 1 1 24 TRP CE3 C 3.385 3.295 4.340 1.00 . A A . 24 TRP CE3 1 1 10 3915 1 1 24 TRP CG C 5.681 4.330 3.756 1.00 . A A . 24 TRP CG 1 1 10 3916 1 1 24 TRP CH2 C 1.521 4.454 3.206 1.00 . A A . 24 TRP CH2 1 1 10 3917 1 1 24 TRP CZ2 C 2.396 5.350 2.581 1.00 . A A . 24 TRP CZ2 1 1 10 3918 1 1 24 TRP CZ3 C 2.026 3.472 4.049 1.00 . A A . 24 TRP CZ3 1 1 10 3919 1 1 24 TRP H H 8.177 3.372 2.591 1.00 . A A . 24 TRP H 1 1 10 3920 1 1 24 TRP HA H 8.046 5.005 4.914 1.00 . A A . 24 TRP HA 1 1 10 3921 1 1 24 TRP HB3 H 6.277 3.384 5.590 1.00 . A A . 24 TRP HB3 1 1 10 3922 1 1 24 TRP HD1 H 6.993 5.726 2.778 1.00 . A A . 24 TRP HD1 1 1 10 3923 1 1 24 TRP HE1 H 4.813 6.760 1.710 1.00 . A A . 24 TRP HE1 1 1 10 3924 1 1 24 TRP HE3 H 3.744 2.513 5.007 1.00 . A A . 24 TRP HE3 1 1 10 3925 1 1 24 TRP HH2 H 0.447 4.526 3.032 1.00 . A A . 24 TRP HH2 1 1 10 3926 1 1 24 TRP HZ2 H 2.037 6.133 1.914 1.00 . A A . 24 TRP HZ2 1 1 10 3927 1 1 24 TRP HZ3 H 1.315 2.792 4.519 1.00 . A A . 24 TRP HZ3 1 1 10 3928 1 1 24 TRP N N 8.663 3.942 3.252 1.00 . A A . 24 TRP N 1 1 10 3929 1 1 24 TRP NE1 N 4.847 5.913 2.394 1.00 . A A . 24 TRP NE1 1 1 10 3930 1 1 24 TRP O O 9.709 2.264 5.058 1.00 . A A . 24 TRP O 1 1 10 3931 1 1 25 GLY C C 8.925 2.504 9.041 1.00 . A A . 25 GLY C 1 1 10 3932 1 1 25 GLY CA C 9.741 2.808 7.784 1.00 . A A . 25 GLY CA 1 1 10 3933 1 1 25 GLY H H 8.347 4.220 7.150 1.00 . A A . 25 GLY H 1 1 10 3934 1 1 25 GLY HA2 H 10.130 1.880 7.364 1.00 . A A . 25 GLY HA2 1 1 10 3935 1 1 25 GLY HA3 H 10.602 3.424 8.044 1.00 . A A . 25 GLY HA3 1 1 10 3936 1 1 25 GLY N N 8.933 3.494 6.790 1.00 . A A . 25 GLY N 1 1 10 3937 1 1 25 GLY O O 7.773 2.081 8.950 1.00 . A A . 25 GLY O 1 1 10 3938 1 1 26 TRP C C 8.383 3.826 11.991 1.00 . A A . 26 TRP C 1 1 10 3939 1 1 26 TRP CA C 8.899 2.488 11.460 1.00 . A A . 26 TRP CA 1 1 10 3940 1 1 26 TRP CB C 9.843 1.781 12.434 1.00 . A A . 26 TRP CB 1 1 10 3941 1 1 26 TRP CD1 C 8.670 -0.497 12.131 1.00 . A A . 26 TRP CD1 1 1 10 3942 1 1 26 TRP CD2 C 10.815 -0.681 12.655 1.00 . A A . 26 TRP CD2 1 1 10 3943 1 1 26 TRP CE2 C 10.312 -1.959 12.522 1.00 . A A . 26 TRP CE2 1 1 10 3944 1 1 26 TRP CE3 C 12.162 -0.454 12.987 1.00 . A A . 26 TRP CE3 1 1 10 3945 1 1 26 TRP CG C 9.746 0.255 12.400 1.00 . A A . 26 TRP CG 1 1 10 3946 1 1 26 TRP CH2 C 12.432 -2.909 13.035 1.00 . A A . 26 TRP CH2 1 1 10 3947 1 1 26 TRP CZ2 C 11.087 -3.111 12.704 1.00 . A A . 26 TRP CZ2 1 1 10 3948 1 1 26 TRP CZ3 C 12.924 -1.616 13.164 1.00 . A A . 26 TRP CZ3 1 1 10 3949 1 1 26 TRP H H 10.490 3.076 10.251 1.00 . A A . 26 TRP H 1 1 10 3950 1 1 26 TRP HA H 8.063 1.811 11.281 1.00 . A A . 26 TRP HA 1 1 10 3951 1 1 26 TRP HB3 H 9.629 2.126 13.446 1.00 . A A . 26 TRP HB3 1 1 10 3952 1 1 26 TRP HD1 H 7.685 -0.096 11.893 1.00 . A A . 26 TRP HD1 1 1 10 3953 1 1 26 TRP HE1 H 8.272 -2.666 12.018 1.00 . A A . 26 TRP HE1 1 1 10 3954 1 1 26 TRP HE3 H 12.584 0.545 13.097 1.00 . A A . 26 TRP HE3 1 1 10 3955 1 1 26 TRP HH2 H 13.090 -3.764 13.191 1.00 . A A . 26 TRP HH2 1 1 10 3956 1 1 26 TRP HZ2 H 10.665 -4.109 12.594 1.00 . A A . 26 TRP HZ2 1 1 10 3957 1 1 26 TRP HZ3 H 13.976 -1.497 13.423 1.00 . A A . 26 TRP HZ3 1 1 10 3958 1 1 26 TRP N N 9.553 2.732 10.186 1.00 . A A . 26 TRP N 1 1 10 3959 1 1 26 TRP NE1 N 8.966 -1.844 12.194 1.00 . A A . 26 TRP NE1 1 1 10 3960 1 1 26 TRP O O 7.828 3.892 13.087 1.00 . A A . 26 TRP O 1 1 11 3961 1 1 1 LYS C C -7.588 13.556 4.008 1.00 . A A . 1 LYS C 1 1 11 3962 1 1 1 LYS CA C -7.957 14.409 2.792 1.00 . A A . 1 LYS CA 1 1 11 3963 1 1 1 LYS CB C -7.512 15.869 2.908 1.00 . A A . 1 LYS CB 1 1 11 3964 1 1 1 LYS CD C -8.533 17.945 3.911 1.00 . A A . 1 LYS CD 1 1 11 3965 1 1 1 LYS CE C -7.617 18.958 4.601 1.00 . A A . 1 LYS CE 1 1 11 3966 1 1 1 LYS CG C -8.067 16.513 4.180 1.00 . A A . 1 LYS CG 1 1 11 3967 1 1 1 LYS H1 H -9.800 13.439 2.758 1.00 . A A . 1 LYS H1 1 1 11 3968 1 1 1 LYS HA H -7.465 13.991 1.915 1.00 . A A . 1 LYS HA 1 1 11 3969 1 1 1 LYS HB3 H -7.853 16.426 2.035 1.00 . A A . 1 LYS HB3 1 1 11 3970 1 1 1 LYS HD3 H -9.555 18.072 4.268 1.00 . A A . 1 LYS HD3 1 1 11 3971 1 1 1 LYS HE3 H -6.903 19.359 3.882 1.00 . A A . 1 LYS HE3 1 1 11 3972 1 1 1 LYS HG3 H -7.301 16.515 4.955 1.00 . A A . 1 LYS HG3 1 1 11 3973 1 1 1 LYS HZ1 H -8.415 20.839 4.560 1.00 . A A . 1 LYS HZ1 1 1 11 3974 1 1 1 LYS HZ2 H -9.350 19.751 5.339 1.00 . A A . 1 LYS HZ2 1 1 11 3975 1 1 1 LYS HZ3 H -8.007 20.336 6.059 1.00 . A A . 1 LYS HZ3 1 1 11 3976 1 1 1 LYS N N -9.390 14.331 2.568 1.00 . A A . 1 LYS N 1 1 11 3977 1 1 1 LYS NZ N -8.411 20.061 5.187 1.00 . A A . 1 LYS NZ 1 1 11 3978 1 1 1 LYS O O -7.053 14.068 4.991 1.00 . A A . 1 LYS O 1 1 11 3979 1 1 2 SER C C -6.318 10.560 4.664 1.00 . A A . 2 SER C 1 1 11 3980 1 1 2 SER CA C -7.595 11.341 4.979 1.00 . A A . 2 SER CA 1 1 11 3981 1 1 2 SER CB C -8.763 10.380 5.210 1.00 . A A . 2 SER CB 1 1 11 3982 1 1 2 SER H H -8.323 11.862 3.099 1.00 . A A . 2 SER H 1 1 11 3983 1 1 2 SER HA H -7.456 11.962 5.865 1.00 . A A . 2 SER HA 1 1 11 3984 1 1 2 SER HB3 H -8.630 9.494 4.591 1.00 . A A . 2 SER HB3 1 1 11 3985 1 1 2 SER HG H -8.034 10.232 7.069 1.00 . A A . 2 SER HG 1 1 11 3986 1 1 2 SER N N -7.889 12.270 3.901 1.00 . A A . 2 SER N 1 1 11 3987 1 1 2 SER O O -5.871 10.531 3.518 1.00 . A A . 2 SER O 1 1 11 3988 1 1 2 SER OG O -8.872 9.991 6.577 1.00 . A A . 2 SER OG 1 1 11 3989 1 1 3 SER C C -4.849 7.682 5.764 1.00 . A A . 3 SER C 1 1 11 3990 1 1 3 SER CA C -4.550 9.167 5.548 1.00 . A A . 3 SER CA 1 1 11 3991 1 1 3 SER CB C -3.469 9.638 6.523 1.00 . A A . 3 SER CB 1 1 11 3992 1 1 3 SER H H -6.137 9.975 6.629 1.00 . A A . 3 SER H 1 1 11 3993 1 1 3 SER HA H -4.220 9.345 4.525 1.00 . A A . 3 SER HA 1 1 11 3994 1 1 3 SER HB3 H -3.582 9.112 7.471 1.00 . A A . 3 SER HB3 1 1 11 3995 1 1 3 SER HG H -2.139 9.596 5.029 1.00 . A A . 3 SER HG 1 1 11 3996 1 1 3 SER N N -5.767 9.946 5.700 1.00 . A A . 3 SER N 1 1 11 3997 1 1 3 SER O O -4.542 7.130 6.820 1.00 . A A . 3 SER O 1 1 11 3998 1 1 3 SER OG O -2.158 9.416 6.012 1.00 . A A . 3 SER OG 1 1 11 3999 1 1 4 ALA C C -6.413 5.236 3.484 1.00 . A A . 4 ALA C 1 1 11 4000 1 1 4 ALA CA C -5.791 5.667 4.814 1.00 . A A . 4 ALA CA 1 1 11 4001 1 1 4 ALA CB C -6.727 5.424 6.000 1.00 . A A . 4 ALA CB 1 1 11 4002 1 1 4 ALA H H -5.694 7.534 3.893 1.00 . A A . 4 ALA H 1 1 11 4003 1 1 4 ALA HA H -4.870 5.107 4.973 1.00 . A A . 4 ALA HA 1 1 11 4004 1 1 4 ALA HB1 H -7.590 4.847 5.670 1.00 . A A . 4 ALA HB1 1 1 11 4005 1 1 4 ALA HB2 H -6.195 4.872 6.774 1.00 . A A . 4 ALA HB2 1 1 11 4006 1 1 4 ALA HB3 H -7.060 6.381 6.401 1.00 . A A . 4 ALA HB3 1 1 11 4007 1 1 4 ALA N N -5.447 7.077 4.748 1.00 . A A . 4 ALA N 1 1 11 4008 1 1 4 ALA O O -5.866 4.381 2.787 1.00 . A A . 4 ALA O 1 1 11 4009 1 1 5 TYR C C -8.181 4.039 1.630 1.00 . A A . 5 TYR C 1 1 11 4010 1 1 5 TYR CA C -8.247 5.537 1.936 1.00 . A A . 5 TYR CA 1 1 11 4011 1 1 5 TYR CB C -7.517 6.304 0.832 1.00 . A A . 5 TYR CB 1 1 11 4012 1 1 5 TYR CD1 C -8.703 8.490 1.243 1.00 . A A . 5 TYR CD1 1 1 11 4013 1 1 5 TYR CD2 C -8.494 7.720 -1.010 1.00 . A A . 5 TYR CD2 1 1 11 4014 1 1 5 TYR CE1 C -9.405 9.658 0.779 1.00 . A A . 5 TYR CE1 1 1 11 4015 1 1 5 TYR CE2 C -9.196 8.888 -1.474 1.00 . A A . 5 TYR CE2 1 1 11 4016 1 1 5 TYR CG C -8.263 7.545 0.339 1.00 . A A . 5 TYR CG 1 1 11 4017 1 1 5 TYR CZ C -9.617 9.800 -0.556 1.00 . A A . 5 TYR CZ 1 1 11 4018 1 1 5 TYR H H -7.983 6.540 3.743 1.00 . A A . 5 TYR H 1 1 11 4019 1 1 5 TYR HA H -9.290 5.829 2.059 1.00 . A A . 5 TYR HA 1 1 11 4020 1 1 5 TYR HB3 H -7.349 5.634 -0.011 1.00 . A A . 5 TYR HB3 1 1 11 4021 1 1 5 TYR HD1 H -8.520 8.351 2.308 1.00 . A A . 5 TYR HD1 1 1 11 4022 1 1 5 TYR HD2 H -8.147 6.974 -1.724 1.00 . A A . 5 TYR HD2 1 1 11 4023 1 1 5 TYR HE1 H -9.759 10.413 1.482 1.00 . A A . 5 TYR HE1 1 1 11 4024 1 1 5 TYR HE2 H -9.387 9.039 -2.537 1.00 . A A . 5 TYR HE2 1 1 11 4025 1 1 5 TYR HH H -9.777 11.730 -0.738 1.00 . A A . 5 TYR HH 1 1 11 4026 1 1 5 TYR N N -7.545 5.846 3.171 1.00 . A A . 5 TYR N 1 1 11 4027 1 1 5 TYR O O -7.352 3.600 0.836 1.00 . A A . 5 TYR O 1 1 11 4028 1 1 5 TYR OH O -10.280 10.904 -0.995 1.00 . A A . 5 TYR OH 1 1 11 4029 1 1 6 SER C C -7.753 1.238 2.380 1.00 . A A . 6 SER C 1 1 11 4030 1 1 6 SER CA C -9.121 1.857 2.084 1.00 . A A . 6 SER CA 1 1 11 4031 1 1 6 SER CB C -9.563 1.508 0.661 1.00 . A A . 6 SER CB 1 1 11 4032 1 1 6 SER H H -9.739 3.660 2.922 1.00 . A A . 6 SER H 1 1 11 4033 1 1 6 SER HA H -9.865 1.497 2.793 1.00 . A A . 6 SER HA 1 1 11 4034 1 1 6 SER HB3 H -9.647 0.426 0.562 1.00 . A A . 6 SER HB3 1 1 11 4035 1 1 6 SER HG H -10.667 3.067 0.063 1.00 . A A . 6 SER HG 1 1 11 4036 1 1 6 SER N N -9.067 3.296 2.276 1.00 . A A . 6 SER N 1 1 11 4037 1 1 6 SER O O -6.756 1.950 2.489 1.00 . A A . 6 SER O 1 1 11 4038 1 1 6 SER OG O -10.809 2.113 0.326 1.00 . A A . 6 SER OG 1 1 11 4039 1 1 7 LEU C C -6.518 -2.120 2.004 1.00 . A A . 7 LEU C 1 1 11 4040 1 1 7 LEU CA C -6.521 -0.804 2.784 1.00 . A A . 7 LEU CA 1 1 11 4041 1 1 7 LEU CB C -6.340 -0.984 4.293 1.00 . A A . 7 LEU CB 1 1 11 4042 1 1 7 LEU CD1 C -7.406 -2.810 5.668 1.00 . A A . 7 LEU CD1 1 1 11 4043 1 1 7 LEU CD2 C -7.948 -0.377 6.139 1.00 . A A . 7 LEU CD2 1 1 11 4044 1 1 7 LEU CG C -7.586 -1.413 5.072 1.00 . A A . 7 LEU CG 1 1 11 4045 1 1 7 LEU H H -8.566 -0.653 2.412 1.00 . A A . 7 LEU H 1 1 11 4046 1 1 7 LEU HA H -5.693 -0.190 2.432 1.00 . A A . 7 LEU HA 1 1 11 4047 1 1 7 LEU HB3 H -5.980 -0.044 4.710 1.00 . A A . 7 LEU HB3 1 1 11 4048 1 1 7 LEU HD11 H -6.453 -2.861 6.194 1.00 . A A . 7 LEU HD11 1 1 11 4049 1 1 7 LEU HD12 H -8.218 -3.014 6.365 1.00 . A A . 7 LEU HD12 1 1 11 4050 1 1 7 LEU HD13 H -7.420 -3.550 4.868 1.00 . A A . 7 LEU HD13 1 1 11 4051 1 1 7 LEU HD21 H -7.042 -0.043 6.644 1.00 . A A . 7 LEU HD21 1 1 11 4052 1 1 7 LEU HD22 H -8.436 0.476 5.667 1.00 . A A . 7 LEU HD22 1 1 11 4053 1 1 7 LEU HD23 H -8.625 -0.826 6.866 1.00 . A A . 7 LEU HD23 1 1 11 4054 1 1 7 LEU HG H -8.423 -1.464 4.376 1.00 . A A . 7 LEU HG 1 1 11 4055 1 1 7 LEU N N -7.750 -0.081 2.502 1.00 . A A . 7 LEU N 1 1 11 4056 1 1 7 LEU O O -5.542 -2.442 1.328 1.00 . A A . 7 LEU O 1 1 11 4057 1 1 8 GLN C C -9.031 -4.131 0.589 1.00 . A A . 8 GLN C 1 1 11 4058 1 1 8 GLN CA C -7.757 -4.118 1.437 1.00 . A A . 8 GLN CA 1 1 11 4059 1 1 8 GLN CB C -7.748 -5.281 2.431 1.00 . A A . 8 GLN CB 1 1 11 4060 1 1 8 GLN CD C -7.788 -7.672 1.630 1.00 . A A . 8 GLN CD 1 1 11 4061 1 1 8 GLN CG C -6.911 -6.448 1.903 1.00 . A A . 8 GLN CG 1 1 11 4062 1 1 8 GLN H H -8.409 -2.576 2.675 1.00 . A A . 8 GLN H 1 1 11 4063 1 1 8 GLN HA H -6.882 -4.194 0.790 1.00 . A A . 8 GLN HA 1 1 11 4064 1 1 8 GLN HB3 H -8.770 -5.615 2.615 1.00 . A A . 8 GLN HB3 1 1 11 4065 1 1 8 GLN HE21 H -6.485 -8.787 2.706 1.00 . A A . 8 GLN HE21 1 1 11 4066 1 1 8 GLN HE22 H -7.836 -9.651 2.052 1.00 . A A . 8 GLN HE22 1 1 11 4067 1 1 8 GLN HG3 H -6.140 -6.704 2.629 1.00 . A A . 8 GLN HG3 1 1 11 4068 1 1 8 GLN N N -7.620 -2.845 2.122 1.00 . A A . 8 GLN N 1 1 11 4069 1 1 8 GLN NE2 N -7.332 -8.796 2.174 1.00 . A A . 8 GLN NE2 1 1 11 4070 1 1 8 GLN O O -10.081 -3.674 1.036 1.00 . A A . 8 GLN O 1 1 11 4071 1 1 8 GLN OE1 O -8.810 -7.600 0.968 1.00 . A A . 8 GLN OE1 1 1 11 4072 1 1 9 MET C C -9.719 -5.683 -2.696 1.00 . A A . 9 MET C 1 1 11 4073 1 1 9 MET CA C -10.022 -4.738 -1.532 1.00 . A A . 9 MET CA 1 1 11 4074 1 1 9 MET CB C -10.337 -3.343 -2.075 1.00 . A A . 9 MET CB 1 1 11 4075 1 1 9 MET CE C -7.591 -0.573 -1.770 1.00 . A A . 9 MET CE 1 1 11 4076 1 1 9 MET CG C -9.084 -2.685 -2.657 1.00 . A A . 9 MET CG 1 1 11 4077 1 1 9 MET H H -8.036 -5.029 -0.974 1.00 . A A . 9 MET H 1 1 11 4078 1 1 9 MET HA H -10.850 -5.131 -0.941 1.00 . A A . 9 MET HA 1 1 11 4079 1 1 9 MET HB3 H -10.740 -2.720 -1.277 1.00 . A A . 9 MET HB3 1 1 11 4080 1 1 9 MET HE1 H -6.877 -0.348 -2.563 1.00 . A A . 9 MET HE1 1 1 11 4081 1 1 9 MET HE2 H -7.668 0.281 -1.098 1.00 . A A . 9 MET HE2 1 1 11 4082 1 1 9 MET HE3 H -7.251 -1.445 -1.213 1.00 . A A . 9 MET HE3 1 1 11 4083 1 1 9 MET HG3 H -8.978 -2.953 -3.708 1.00 . A A . 9 MET HG3 1 1 11 4084 1 1 9 MET N N -8.894 -4.659 -0.618 1.00 . A A . 9 MET N 1 1 11 4085 1 1 9 MET O O -10.556 -6.505 -3.067 1.00 . A A . 9 MET O 1 1 11 4086 1 1 9 MET SD S -9.190 -0.912 -2.487 1.00 . A A . 9 MET SD 1 1 11 4087 1 1 10 GLY C C -7.130 -7.456 -3.889 1.00 . A A . 10 GLY C 1 1 11 4088 1 1 10 GLY CA C -8.096 -6.366 -4.355 1.00 . A A . 10 GLY CA 1 1 11 4089 1 1 10 GLY H H -7.845 -4.865 -2.932 1.00 . A A . 10 GLY H 1 1 11 4090 1 1 10 GLY HA2 H -8.968 -6.822 -4.824 1.00 . A A . 10 GLY HA2 1 1 11 4091 1 1 10 GLY HA3 H -7.615 -5.747 -5.111 1.00 . A A . 10 GLY HA3 1 1 11 4092 1 1 10 GLY N N -8.520 -5.535 -3.240 1.00 . A A . 10 GLY N 1 1 11 4093 1 1 10 GLY O O -7.558 -8.519 -3.438 1.00 . A A . 10 GLY O 1 1 11 4094 1 1 11 ALA C C -3.480 -7.685 -4.234 1.00 . A A . 11 ALA C 1 1 11 4095 1 1 11 ALA CA C -4.816 -8.100 -3.613 1.00 . A A . 11 ALA CA 1 1 11 4096 1 1 11 ALA CB C -5.232 -9.516 -4.017 1.00 . A A . 11 ALA CB 1 1 11 4097 1 1 11 ALA H H -5.506 -6.292 -4.383 1.00 . A A . 11 ALA H 1 1 11 4098 1 1 11 ALA HA H -4.730 -8.056 -2.527 1.00 . A A . 11 ALA HA 1 1 11 4099 1 1 11 ALA HB1 H -5.990 -9.462 -4.799 1.00 . A A . 11 ALA HB1 1 1 11 4100 1 1 11 ALA HB2 H -4.363 -10.058 -4.390 1.00 . A A . 11 ALA HB2 1 1 11 4101 1 1 11 ALA HB3 H -5.640 -10.036 -3.151 1.00 . A A . 11 ALA HB3 1 1 11 4102 1 1 11 ALA N N -5.846 -7.158 -4.015 1.00 . A A . 11 ALA N 1 1 11 4103 1 1 11 ALA O O -2.440 -7.749 -3.580 1.00 . A A . 11 ALA O 1 1 11 4104 1 1 12 THR C C -1.888 -5.484 -5.695 1.00 . A A . 12 THR C 1 1 11 4105 1 1 12 THR CA C -2.362 -6.845 -6.208 1.00 . A A . 12 THR CA 1 1 11 4106 1 1 12 THR CB C -2.683 -6.853 -7.704 1.00 . A A . 12 THR CB 1 1 11 4107 1 1 12 THR CG2 C -1.442 -7.081 -8.568 1.00 . A A . 12 THR CG2 1 1 11 4108 1 1 12 THR H H -4.402 -7.222 -6.016 1.00 . A A . 12 THR H 1 1 11 4109 1 1 12 THR HA H -1.565 -7.559 -6.003 1.00 . A A . 12 THR HA 1 1 11 4110 1 1 12 THR HB H -3.199 -5.937 -7.996 1.00 . A A . 12 THR HB 1 1 11 4111 1 1 12 THR HG1 H -4.353 -7.804 -8.266 1.00 . A A . 12 THR HG1 1 1 11 4112 1 1 12 THR HG21 H -1.675 -6.847 -9.608 1.00 . A A . 12 THR HG21 1 1 11 4113 1 1 12 THR HG22 H -0.635 -6.436 -8.223 1.00 . A A . 12 THR HG22 1 1 11 4114 1 1 12 THR HG23 H -1.133 -8.124 -8.492 1.00 . A A . 12 THR HG23 1 1 11 4115 1 1 12 THR N N -3.552 -7.271 -5.491 1.00 . A A . 12 THR N 1 1 11 4116 1 1 12 THR O O -0.708 -5.305 -5.399 1.00 . A A . 12 THR O 1 1 11 4117 1 1 12 THR OG1 O -3.456 -8.036 -7.886 1.00 . A A . 12 THR OG1 1 1 11 4118 1 1 13 ALA C C -1.600 -3.310 -3.920 1.00 . A A . 13 ALA C 1 1 11 4119 1 1 13 ALA CA C -2.527 -3.220 -5.135 1.00 . A A . 13 ALA CA 1 1 11 4120 1 1 13 ALA CB C -3.828 -2.479 -4.821 1.00 . A A . 13 ALA CB 1 1 11 4121 1 1 13 ALA H H -3.790 -4.713 -5.850 1.00 . A A . 13 ALA H 1 1 11 4122 1 1 13 ALA HA H -2.009 -2.695 -5.938 1.00 . A A . 13 ALA HA 1 1 11 4123 1 1 13 ALA HB1 H -4.624 -3.202 -4.643 1.00 . A A . 13 ALA HB1 1 1 11 4124 1 1 13 ALA HB2 H -3.691 -1.865 -3.931 1.00 . A A . 13 ALA HB2 1 1 11 4125 1 1 13 ALA HB3 H -4.097 -1.843 -5.664 1.00 . A A . 13 ALA HB3 1 1 11 4126 1 1 13 ALA N N -2.833 -4.559 -5.606 1.00 . A A . 13 ALA N 1 1 11 4127 1 1 13 ALA O O -0.642 -2.547 -3.807 1.00 . A A . 13 ALA O 1 1 11 4128 1 1 14 ILE C C 0.359 -4.351 -2.191 1.00 . A A . 14 ILE C 1 1 11 4129 1 1 14 ILE CA C -1.127 -4.451 -1.840 1.00 . A A . 14 ILE CA 1 1 11 4130 1 1 14 ILE CB C -1.511 -5.765 -1.159 1.00 . A A . 14 ILE CB 1 1 11 4131 1 1 14 ILE CD1 C -3.998 -6.180 -1.225 1.00 . A A . 14 ILE CD1 1 1 11 4132 1 1 14 ILE CG1 C -2.833 -5.625 -0.402 1.00 . A A . 14 ILE CG1 1 1 11 4133 1 1 14 ILE CG2 C -0.383 -6.264 -0.254 1.00 . A A . 14 ILE CG2 1 1 11 4134 1 1 14 ILE H H -2.700 -4.866 -3.142 1.00 . A A . 14 ILE H 1 1 11 4135 1 1 14 ILE HA H -1.373 -3.646 -1.149 1.00 . A A . 14 ILE HA 1 1 11 4136 1 1 14 ILE HB H -1.661 -6.520 -1.931 1.00 . A A . 14 ILE HB 1 1 11 4137 1 1 14 ILE HD11 H -4.821 -5.467 -1.215 1.00 . A A . 14 ILE HD11 1 1 11 4138 1 1 14 ILE HD12 H -3.671 -6.343 -2.253 1.00 . A A . 14 ILE HD12 1 1 11 4139 1 1 14 ILE HD13 H -4.329 -7.125 -0.795 1.00 . A A . 14 ILE HD13 1 1 11 4140 1 1 14 ILE HG13 H -3.014 -4.576 -0.171 1.00 . A A . 14 ILE HG13 1 1 11 4141 1 1 14 ILE HG21 H -0.678 -7.205 0.210 1.00 . A A . 14 ILE HG21 1 1 11 4142 1 1 14 ILE HG22 H 0.518 -6.418 -0.848 1.00 . A A . 14 ILE HG22 1 1 11 4143 1 1 14 ILE HG23 H -0.184 -5.523 0.521 1.00 . A A . 14 ILE HG23 1 1 11 4144 1 1 14 ILE N N -1.918 -4.250 -3.042 1.00 . A A . 14 ILE N 1 1 11 4145 1 1 14 ILE O O 1.093 -3.572 -1.585 1.00 . A A . 14 ILE O 1 1 11 4146 1 1 15 LYS C C 2.641 -3.722 -3.751 1.00 . A A . 15 LYS C 1 1 11 4147 1 1 15 LYS CA C 2.143 -5.163 -3.609 1.00 . A A . 15 LYS CA 1 1 11 4148 1 1 15 LYS CB C 2.294 -5.995 -4.884 1.00 . A A . 15 LYS CB 1 1 11 4149 1 1 15 LYS CD C 3.009 -4.427 -6.726 1.00 . A A . 15 LYS CD 1 1 11 4150 1 1 15 LYS CE C 3.966 -4.341 -7.915 1.00 . A A . 15 LYS CE 1 1 11 4151 1 1 15 LYS CG C 3.467 -5.494 -5.729 1.00 . A A . 15 LYS CG 1 1 11 4152 1 1 15 LYS H H 0.155 -5.782 -3.658 1.00 . A A . 15 LYS H 1 1 11 4153 1 1 15 LYS HA H 2.728 -5.655 -2.832 1.00 . A A . 15 LYS HA 1 1 11 4154 1 1 15 LYS HB3 H 1.374 -5.944 -5.466 1.00 . A A . 15 LYS HB3 1 1 11 4155 1 1 15 LYS HD3 H 2.954 -3.458 -6.227 1.00 . A A . 15 LYS HD3 1 1 11 4156 1 1 15 LYS HE3 H 4.308 -5.340 -8.188 1.00 . A A . 15 LYS HE3 1 1 11 4157 1 1 15 LYS HG3 H 3.916 -6.329 -6.267 1.00 . A A . 15 LYS HG3 1 1 11 4158 1 1 15 LYS HZ1 H 2.959 -2.803 -8.808 1.00 . A A . 15 LYS HZ1 1 1 11 4159 1 1 15 LYS HZ2 H 3.952 -3.608 -9.823 1.00 . A A . 15 LYS HZ2 1 1 11 4160 1 1 15 LYS HZ3 H 2.532 -4.275 -9.371 1.00 . A A . 15 LYS HZ3 1 1 11 4161 1 1 15 LYS N N 0.758 -5.151 -3.170 1.00 . A A . 15 LYS N 1 1 11 4162 1 1 15 LYS NZ N 3.298 -3.705 -9.073 1.00 . A A . 15 LYS NZ 1 1 11 4163 1 1 15 LYS O O 3.759 -3.406 -3.349 1.00 . A A . 15 LYS O 1 1 11 4164 1 1 16 GLN C C 2.520 -0.844 -3.195 1.00 . A A . 16 GLN C 1 1 11 4165 1 1 16 GLN CA C 2.124 -1.490 -4.524 1.00 . A A . 16 GLN CA 1 1 11 4166 1 1 16 GLN CB C 0.966 -0.734 -5.177 1.00 . A A . 16 GLN CB 1 1 11 4167 1 1 16 GLN CD C -0.953 0.858 -4.798 1.00 . A A . 16 GLN CD 1 1 11 4168 1 1 16 GLN CG C 0.232 0.137 -4.155 1.00 . A A . 16 GLN CG 1 1 11 4169 1 1 16 GLN H H 0.877 -3.154 -4.647 1.00 . A A . 16 GLN H 1 1 11 4170 1 1 16 GLN HA H 2.977 -1.493 -5.202 1.00 . A A . 16 GLN HA 1 1 11 4171 1 1 16 GLN HB3 H 0.269 -1.444 -5.623 1.00 . A A . 16 GLN HB3 1 1 11 4172 1 1 16 GLN HE21 H 0.311 2.337 -5.359 1.00 . A A . 16 GLN HE21 1 1 11 4173 1 1 16 GLN HE22 H -1.342 2.561 -5.823 1.00 . A A . 16 GLN HE22 1 1 11 4174 1 1 16 GLN HG3 H 0.922 0.868 -3.733 1.00 . A A . 16 GLN HG3 1 1 11 4175 1 1 16 GLN N N 1.786 -2.889 -4.324 1.00 . A A . 16 GLN N 1 1 11 4176 1 1 16 GLN NE2 N -0.635 2.014 -5.374 1.00 . A A . 16 GLN NE2 1 1 11 4177 1 1 16 GLN O O 3.498 -0.101 -3.128 1.00 . A A . 16 GLN O 1 1 11 4178 1 1 16 GLN OE1 O -2.082 0.396 -4.774 1.00 . A A . 16 GLN OE1 1 1 11 4179 1 1 17 VAL C C 3.437 -0.927 -0.440 1.00 . A A . 17 VAL C 1 1 11 4180 1 1 17 VAL CA C 1.996 -0.610 -0.844 1.00 . A A . 17 VAL CA 1 1 11 4181 1 1 17 VAL CB C 0.964 -1.147 0.149 1.00 . A A . 17 VAL CB 1 1 11 4182 1 1 17 VAL CG1 C 1.352 -2.542 0.643 1.00 . A A . 17 VAL CG1 1 1 11 4183 1 1 17 VAL CG2 C 0.780 -0.181 1.322 1.00 . A A . 17 VAL CG2 1 1 11 4184 1 1 17 VAL H H 0.946 -1.756 -2.231 1.00 . A A . 17 VAL H 1 1 11 4185 1 1 17 VAL HA H 1.878 0.472 -0.903 1.00 . A A . 17 VAL HA 1 1 11 4186 1 1 17 VAL HB H 0.009 -1.228 -0.371 1.00 . A A . 17 VAL HB 1 1 11 4187 1 1 17 VAL HG11 H 0.517 -3.226 0.491 1.00 . A A . 17 VAL HG11 1 1 11 4188 1 1 17 VAL HG12 H 2.219 -2.897 0.085 1.00 . A A . 17 VAL HG12 1 1 11 4189 1 1 17 VAL HG13 H 1.596 -2.497 1.704 1.00 . A A . 17 VAL HG13 1 1 11 4190 1 1 17 VAL HG21 H 0.482 0.798 0.944 1.00 . A A . 17 VAL HG21 1 1 11 4191 1 1 17 VAL HG22 H 0.006 -0.563 1.989 1.00 . A A . 17 VAL HG22 1 1 11 4192 1 1 17 VAL HG23 H 1.718 -0.090 1.869 1.00 . A A . 17 VAL HG23 1 1 11 4193 1 1 17 VAL N N 1.740 -1.151 -2.169 1.00 . A A . 17 VAL N 1 1 11 4194 1 1 17 VAL O O 4.079 -0.137 0.251 1.00 . A A . 17 VAL O 1 1 11 4195 1 1 18 LYS C C 6.253 -1.555 -1.232 1.00 . A A . 18 LYS C 1 1 11 4196 1 1 18 LYS CA C 5.256 -2.515 -0.578 1.00 . A A . 18 LYS CA 1 1 11 4197 1 1 18 LYS CB C 5.457 -3.978 -0.980 1.00 . A A . 18 LYS CB 1 1 11 4198 1 1 18 LYS CD C 6.733 -3.872 -3.153 1.00 . A A . 18 LYS CD 1 1 11 4199 1 1 18 LYS CE C 6.503 -5.149 -3.963 1.00 . A A . 18 LYS CE 1 1 11 4200 1 1 18 LYS CG C 6.814 -4.180 -1.657 1.00 . A A . 18 LYS CG 1 1 11 4201 1 1 18 LYS H H 3.373 -2.720 -1.447 1.00 . A A . 18 LYS H 1 1 11 4202 1 1 18 LYS HA H 5.379 -2.457 0.503 1.00 . A A . 18 LYS HA 1 1 11 4203 1 1 18 LYS HB3 H 4.659 -4.285 -1.657 1.00 . A A . 18 LYS HB3 1 1 11 4204 1 1 18 LYS HD3 H 7.655 -3.391 -3.479 1.00 . A A . 18 LYS HD3 1 1 11 4205 1 1 18 LYS HE3 H 5.555 -5.604 -3.675 1.00 . A A . 18 LYS HE3 1 1 11 4206 1 1 18 LYS HG3 H 7.149 -5.206 -1.510 1.00 . A A . 18 LYS HG3 1 1 11 4207 1 1 18 LYS HZ1 H 7.421 -4.608 -5.707 1.00 . A A . 18 LYS HZ1 1 1 11 4208 1 1 18 LYS HZ2 H 6.185 -5.655 -5.918 1.00 . A A . 18 LYS HZ2 1 1 11 4209 1 1 18 LYS HZ3 H 5.878 -4.085 -5.591 1.00 . A A . 18 LYS HZ3 1 1 11 4210 1 1 18 LYS N N 3.903 -2.083 -0.886 1.00 . A A . 18 LYS N 1 1 11 4211 1 1 18 LYS NZ N 6.496 -4.849 -5.412 1.00 . A A . 18 LYS NZ 1 1 11 4212 1 1 18 LYS O O 7.297 -1.253 -0.657 1.00 . A A . 18 LYS O 1 1 11 4213 1 1 19 LYS C C 6.806 1.153 -2.423 1.00 . A A . 19 LYS C 1 1 11 4214 1 1 19 LYS CA C 6.746 -0.185 -3.163 1.00 . A A . 19 LYS CA 1 1 11 4215 1 1 19 LYS CB C 6.273 -0.065 -4.613 1.00 . A A . 19 LYS CB 1 1 11 4216 1 1 19 LYS CD C 5.072 2.150 -4.513 1.00 . A A . 19 LYS CD 1 1 11 4217 1 1 19 LYS CE C 3.982 2.307 -5.576 1.00 . A A . 19 LYS CE 1 1 11 4218 1 1 19 LYS CG C 6.279 1.395 -5.073 1.00 . A A . 19 LYS CG 1 1 11 4219 1 1 19 LYS H H 5.044 -1.354 -2.886 1.00 . A A . 19 LYS H 1 1 11 4220 1 1 19 LYS HA H 7.748 -0.613 -3.185 1.00 . A A . 19 LYS HA 1 1 11 4221 1 1 19 LYS HB3 H 5.269 -0.476 -4.708 1.00 . A A . 19 LYS HB3 1 1 11 4222 1 1 19 LYS HD3 H 5.384 3.132 -4.160 1.00 . A A . 19 LYS HD3 1 1 11 4223 1 1 19 LYS HE3 H 3.016 2.461 -5.096 1.00 . A A . 19 LYS HE3 1 1 11 4224 1 1 19 LYS HG3 H 6.266 1.437 -6.161 1.00 . A A . 19 LYS HG3 1 1 11 4225 1 1 19 LYS HZ1 H 3.800 3.335 -7.334 1.00 . A A . 19 LYS HZ1 1 1 11 4226 1 1 19 LYS HZ2 H 3.999 4.299 -6.031 1.00 . A A . 19 LYS HZ2 1 1 11 4227 1 1 19 LYS HZ3 H 5.272 3.480 -6.642 1.00 . A A . 19 LYS HZ3 1 1 11 4228 1 1 19 LYS N N 5.895 -1.103 -2.424 1.00 . A A . 19 LYS N 1 1 11 4229 1 1 19 LYS NZ N 4.289 3.448 -6.468 1.00 . A A . 19 LYS NZ 1 1 11 4230 1 1 19 LYS O O 7.701 1.961 -2.665 1.00 . A A . 19 LYS O 1 1 11 4231 1 1 20 LEU C C 6.573 2.397 0.534 1.00 . A A . 20 LEU C 1 1 11 4232 1 1 20 LEU CA C 5.774 2.572 -0.758 1.00 . A A . 20 LEU CA 1 1 11 4233 1 1 20 LEU CB C 4.317 2.982 -0.529 1.00 . A A . 20 LEU CB 1 1 11 4234 1 1 20 LEU CD1 C 4.455 3.832 1.840 1.00 . A A . 20 LEU CD1 1 1 11 4235 1 1 20 LEU CD2 C 2.266 2.922 0.937 1.00 . A A . 20 LEU CD2 1 1 11 4236 1 1 20 LEU CG C 3.792 2.824 0.899 1.00 . A A . 20 LEU CG 1 1 11 4237 1 1 20 LEU H H 5.117 0.684 -1.344 1.00 . A A . 20 LEU H 1 1 11 4238 1 1 20 LEU HA H 6.240 3.360 -1.350 1.00 . A A . 20 LEU HA 1 1 11 4239 1 1 20 LEU HB3 H 3.685 2.392 -1.194 1.00 . A A . 20 LEU HB3 1 1 11 4240 1 1 20 LEU HD11 H 5.084 3.302 2.555 1.00 . A A . 20 LEU HD11 1 1 11 4241 1 1 20 LEU HD12 H 5.067 4.523 1.261 1.00 . A A . 20 LEU HD12 1 1 11 4242 1 1 20 LEU HD13 H 3.686 4.389 2.376 1.00 . A A . 20 LEU HD13 1 1 11 4243 1 1 20 LEU HD21 H 1.872 2.849 -0.077 1.00 . A A . 20 LEU HD21 1 1 11 4244 1 1 20 LEU HD22 H 1.865 2.110 1.542 1.00 . A A . 20 LEU HD22 1 1 11 4245 1 1 20 LEU HD23 H 1.974 3.878 1.372 1.00 . A A . 20 LEU HD23 1 1 11 4246 1 1 20 LEU HG H 4.060 1.829 1.254 1.00 . A A . 20 LEU HG 1 1 11 4247 1 1 20 LEU N N 5.842 1.346 -1.536 1.00 . A A . 20 LEU N 1 1 11 4248 1 1 20 LEU O O 6.931 3.378 1.184 1.00 . A A . 20 LEU O 1 1 11 4249 1 1 21 PHE C C 9.043 1.260 1.935 1.00 . A A . 21 PHE C 1 1 11 4250 1 1 21 PHE CA C 7.582 0.825 2.070 1.00 . A A . 21 PHE CA 1 1 11 4251 1 1 21 PHE CB C 7.529 -0.695 2.244 1.00 . A A . 21 PHE CB 1 1 11 4252 1 1 21 PHE CD1 C 5.687 -1.086 3.895 1.00 . A A . 21 PHE CD1 1 1 11 4253 1 1 21 PHE CD2 C 7.889 -1.607 4.548 1.00 . A A . 21 PHE CD2 1 1 11 4254 1 1 21 PHE CE1 C 5.211 -1.505 5.165 1.00 . A A . 21 PHE CE1 1 1 11 4255 1 1 21 PHE CE2 C 7.413 -2.025 5.819 1.00 . A A . 21 PHE CE2 1 1 11 4256 1 1 21 PHE CG C 7.016 -1.145 3.613 1.00 . A A . 21 PHE CG 1 1 11 4257 1 1 21 PHE CZ C 6.084 -1.966 6.101 1.00 . A A . 21 PHE CZ 1 1 11 4258 1 1 21 PHE H H 6.537 0.348 0.332 1.00 . A A . 21 PHE H 1 1 11 4259 1 1 21 PHE HA H 7.118 1.368 2.893 1.00 . A A . 21 PHE HA 1 1 11 4260 1 1 21 PHE HB3 H 8.527 -1.103 2.090 1.00 . A A . 21 PHE HB3 1 1 11 4261 1 1 21 PHE HD1 H 4.986 -0.716 3.146 1.00 . A A . 21 PHE HD1 1 1 11 4262 1 1 21 PHE HD2 H 8.954 -1.654 4.323 1.00 . A A . 21 PHE HD2 1 1 11 4263 1 1 21 PHE HE1 H 4.145 -1.458 5.391 1.00 . A A . 21 PHE HE1 1 1 11 4264 1 1 21 PHE HE2 H 8.113 -2.395 6.569 1.00 . A A . 21 PHE HE2 1 1 11 4265 1 1 21 PHE HZ H 5.718 -2.288 7.076 1.00 . A A . 21 PHE HZ 1 1 11 4266 1 1 21 PHE N N 6.831 1.141 0.867 1.00 . A A . 21 PHE N 1 1 11 4267 1 1 21 PHE O O 9.758 1.365 2.930 1.00 . A A . 21 PHE O 1 1 11 4268 1 1 22 LYS C C 11.215 3.002 1.418 1.00 . A A . 22 LYS C 1 1 11 4269 1 1 22 LYS CA C 10.805 1.922 0.416 1.00 . A A . 22 LYS CA 1 1 11 4270 1 1 22 LYS CB C 10.945 2.353 -1.046 1.00 . A A . 22 LYS CB 1 1 11 4271 1 1 22 LYS CD C 9.057 4.019 -1.193 1.00 . A A . 22 LYS CD 1 1 11 4272 1 1 22 LYS CE C 8.689 5.418 -0.696 1.00 . A A . 22 LYS CE 1 1 11 4273 1 1 22 LYS CG C 10.575 3.827 -1.219 1.00 . A A . 22 LYS CG 1 1 11 4274 1 1 22 LYS H H 8.855 1.412 -0.110 1.00 . A A . 22 LYS H 1 1 11 4275 1 1 22 LYS HA H 11.450 1.054 0.559 1.00 . A A . 22 LYS HA 1 1 11 4276 1 1 22 LYS HB3 H 10.301 1.737 -1.673 1.00 . A A . 22 LYS HB3 1 1 11 4277 1 1 22 LYS HD3 H 8.603 3.268 -0.547 1.00 . A A . 22 LYS HD3 1 1 11 4278 1 1 22 LYS HE3 H 9.568 6.062 -0.722 1.00 . A A . 22 LYS HE3 1 1 11 4279 1 1 22 LYS HG3 H 10.975 4.198 -2.163 1.00 . A A . 22 LYS HG3 1 1 11 4280 1 1 22 LYS HZ1 H 6.757 5.519 -1.353 1.00 . A A . 22 LYS HZ1 1 1 11 4281 1 1 22 LYS HZ2 H 7.507 6.969 -1.308 1.00 . A A . 22 LYS HZ2 1 1 11 4282 1 1 22 LYS HZ3 H 7.856 5.905 -2.497 1.00 . A A . 22 LYS HZ3 1 1 11 4283 1 1 22 LYS N N 9.442 1.501 0.694 1.00 . A A . 22 LYS N 1 1 11 4284 1 1 22 LYS NZ N 7.615 6.000 -1.531 1.00 . A A . 22 LYS NZ 1 1 11 4285 1 1 22 LYS O O 12.338 2.994 1.921 1.00 . A A . 22 LYS O 1 1 11 4286 1 1 23 LYS C C 10.330 4.487 4.042 1.00 . A A . 23 LYS C 1 1 11 4287 1 1 23 LYS CA C 10.534 4.992 2.612 1.00 . A A . 23 LYS CA 1 1 11 4288 1 1 23 LYS CB C 9.675 6.209 2.261 1.00 . A A . 23 LYS CB 1 1 11 4289 1 1 23 LYS CD C 7.301 6.933 1.815 1.00 . A A . 23 LYS CD 1 1 11 4290 1 1 23 LYS CE C 6.288 7.576 2.764 1.00 . A A . 23 LYS CE 1 1 11 4291 1 1 23 LYS CG C 8.198 5.943 2.559 1.00 . A A . 23 LYS CG 1 1 11 4292 1 1 23 LYS H H 9.373 3.907 1.266 1.00 . A A . 23 LYS H 1 1 11 4293 1 1 23 LYS HA H 11.576 5.289 2.496 1.00 . A A . 23 LYS HA 1 1 11 4294 1 1 23 LYS HB3 H 9.798 6.454 1.206 1.00 . A A . 23 LYS HB3 1 1 11 4295 1 1 23 LYS HD3 H 6.776 6.419 1.010 1.00 . A A . 23 LYS HD3 1 1 11 4296 1 1 23 LYS HE3 H 6.783 7.868 3.690 1.00 . A A . 23 LYS HE3 1 1 11 4297 1 1 23 LYS HG3 H 8.021 6.021 3.632 1.00 . A A . 23 LYS HG3 1 1 11 4298 1 1 23 LYS HZ1 H 5.748 9.547 2.744 1.00 . A A . 23 LYS HZ1 1 1 11 4299 1 1 23 LYS HZ2 H 6.129 8.960 1.269 1.00 . A A . 23 LYS HZ2 1 1 11 4300 1 1 23 LYS HZ3 H 4.699 8.576 1.956 1.00 . A A . 23 LYS HZ3 1 1 11 4301 1 1 23 LYS N N 10.283 3.907 1.679 1.00 . A A . 23 LYS N 1 1 11 4302 1 1 23 LYS NZ N 5.666 8.761 2.132 1.00 . A A . 23 LYS NZ 1 1 11 4303 1 1 23 LYS O O 11.162 4.728 4.914 1.00 . A A . 23 LYS O 1 1 11 4304 1 1 24 TRP C C 10.053 2.360 5.990 1.00 . A A . 24 TRP C 1 1 11 4305 1 1 24 TRP CA C 8.893 3.255 5.547 1.00 . A A . 24 TRP CA 1 1 11 4306 1 1 24 TRP CB C 7.550 2.521 5.519 1.00 . A A . 24 TRP CB 1 1 11 4307 1 1 24 TRP CD1 C 6.327 4.769 5.185 1.00 . A A . 24 TRP CD1 1 1 11 4308 1 1 24 TRP CD2 C 4.991 3.011 5.002 1.00 . A A . 24 TRP CD2 1 1 11 4309 1 1 24 TRP CE2 C 4.220 4.138 4.804 1.00 . A A . 24 TRP CE2 1 1 11 4310 1 1 24 TRP CE3 C 4.432 1.722 4.949 1.00 . A A . 24 TRP CE3 1 1 11 4311 1 1 24 TRP CG C 6.350 3.431 5.248 1.00 . A A . 24 TRP CG 1 1 11 4312 1 1 24 TRP CH2 C 2.268 2.815 4.482 1.00 . A A . 24 TRP CH2 1 1 11 4313 1 1 24 TRP CZ2 C 2.845 4.089 4.539 1.00 . A A . 24 TRP CZ2 1 1 11 4314 1 1 24 TRP CZ3 C 3.058 1.690 4.684 1.00 . A A . 24 TRP CZ3 1 1 11 4315 1 1 24 TRP H H 8.545 3.604 3.523 1.00 . A A . 24 TRP H 1 1 11 4316 1 1 24 TRP HA H 8.784 4.091 6.236 1.00 . A A . 24 TRP HA 1 1 11 4317 1 1 24 TRP HB3 H 7.402 2.019 6.476 1.00 . A A . 24 TRP HB3 1 1 11 4318 1 1 24 TRP HD1 H 7.200 5.405 5.328 1.00 . A A . 24 TRP HD1 1 1 11 4319 1 1 24 TRP HE1 H 4.765 6.286 4.817 1.00 . A A . 24 TRP HE1 1 1 11 4320 1 1 24 TRP HE3 H 5.020 0.816 5.103 1.00 . A A . 24 TRP HE3 1 1 11 4321 1 1 24 TRP HH2 H 1.202 2.706 4.280 1.00 . A A . 24 TRP HH2 1 1 11 4322 1 1 24 TRP HZ2 H 2.258 4.994 4.386 1.00 . A A . 24 TRP HZ2 1 1 11 4323 1 1 24 TRP HZ3 H 2.575 0.714 4.632 1.00 . A A . 24 TRP HZ3 1 1 11 4324 1 1 24 TRP N N 9.217 3.795 4.238 1.00 . A A . 24 TRP N 1 1 11 4325 1 1 24 TRP NE1 N 5.057 5.241 4.919 1.00 . A A . 24 TRP NE1 1 1 11 4326 1 1 24 TRP O O 10.730 1.757 5.157 1.00 . A A . 24 TRP O 1 1 11 4327 1 1 25 GLY C C 10.771 0.162 8.389 1.00 . A A . 25 GLY C 1 1 11 4328 1 1 25 GLY CA C 11.314 1.491 7.862 1.00 . A A . 25 GLY CA 1 1 11 4329 1 1 25 GLY H H 9.692 2.795 7.969 1.00 . A A . 25 GLY H 1 1 11 4330 1 1 25 GLY HA2 H 12.072 1.303 7.102 1.00 . A A . 25 GLY HA2 1 1 11 4331 1 1 25 GLY HA3 H 11.801 2.037 8.670 1.00 . A A . 25 GLY HA3 1 1 11 4332 1 1 25 GLY N N 10.247 2.301 7.299 1.00 . A A . 25 GLY N 1 1 11 4333 1 1 25 GLY O O 10.577 -0.781 7.624 1.00 . A A . 25 GLY O 1 1 11 4334 1 1 26 TRP C C 8.913 -0.650 11.294 1.00 . A A . 26 TRP C 1 1 11 4335 1 1 26 TRP CA C 10.028 -1.070 10.334 1.00 . A A . 26 TRP CA 1 1 11 4336 1 1 26 TRP CB C 11.150 -1.850 11.024 1.00 . A A . 26 TRP CB 1 1 11 4337 1 1 26 TRP CD1 C 12.447 -2.765 8.989 1.00 . A A . 26 TRP CD1 1 1 11 4338 1 1 26 TRP CD2 C 11.809 -4.346 10.403 1.00 . A A . 26 TRP CD2 1 1 11 4339 1 1 26 TRP CE2 C 12.484 -4.964 9.371 1.00 . A A . 26 TRP CE2 1 1 11 4340 1 1 26 TRP CE3 C 11.272 -5.084 11.473 1.00 . A A . 26 TRP CE3 1 1 11 4341 1 1 26 TRP CG C 11.790 -2.926 10.146 1.00 . A A . 26 TRP CG 1 1 11 4342 1 1 26 TRP CH2 C 12.160 -7.103 10.362 1.00 . A A . 26 TRP CH2 1 1 11 4343 1 1 26 TRP CZ2 C 12.687 -6.348 9.307 1.00 . A A . 26 TRP CZ2 1 1 11 4344 1 1 26 TRP CZ3 C 11.483 -6.466 11.394 1.00 . A A . 26 TRP CZ3 1 1 11 4345 1 1 26 TRP H H 10.705 0.900 10.311 1.00 . A A . 26 TRP H 1 1 11 4346 1 1 26 TRP HA H 9.625 -1.717 9.554 1.00 . A A . 26 TRP HA 1 1 11 4347 1 1 26 TRP HB3 H 10.752 -2.317 11.924 1.00 . A A . 26 TRP HB3 1 1 11 4348 1 1 26 TRP HD1 H 12.613 -1.802 8.507 1.00 . A A . 26 TRP HD1 1 1 11 4349 1 1 26 TRP HE1 H 13.442 -4.120 7.559 1.00 . A A . 26 TRP HE1 1 1 11 4350 1 1 26 TRP HE3 H 10.734 -4.620 12.299 1.00 . A A . 26 TRP HE3 1 1 11 4351 1 1 26 TRP HH2 H 12.283 -8.186 10.374 1.00 . A A . 26 TRP HH2 1 1 11 4352 1 1 26 TRP HZ2 H 13.225 -6.812 8.480 1.00 . A A . 26 TRP HZ2 1 1 11 4353 1 1 26 TRP HZ3 H 11.086 -7.085 12.199 1.00 . A A . 26 TRP HZ3 1 1 11 4354 1 1 26 TRP N N 10.544 0.128 9.694 1.00 . A A . 26 TRP N 1 1 11 4355 1 1 26 TRP NE1 N 12.885 -3.972 8.483 1.00 . A A . 26 TRP NE1 1 1 11 4356 1 1 26 TRP O O 8.456 -1.452 12.107 1.00 . A A . 26 TRP O 1 1 12 4357 1 1 1 LYS C C -3.143 7.107 6.601 1.00 . A A . 1 LYS C 1 1 12 4358 1 1 1 LYS CA C -1.755 6.498 6.390 1.00 . A A . 1 LYS CA 1 1 12 4359 1 1 1 LYS CB C -0.952 6.334 7.684 1.00 . A A . 1 LYS CB 1 1 12 4360 1 1 1 LYS CD C -1.640 4.265 8.951 1.00 . A A . 1 LYS CD 1 1 12 4361 1 1 1 LYS CE C -2.385 3.078 8.338 1.00 . A A . 1 LYS CE 1 1 12 4362 1 1 1 LYS CG C -0.643 4.860 7.954 1.00 . A A . 1 LYS CG 1 1 12 4363 1 1 1 LYS H1 H -1.326 8.251 5.350 1.00 . A A . 1 LYS H1 1 1 12 4364 1 1 1 LYS HA H -1.875 5.505 5.958 1.00 . A A . 1 LYS HA 1 1 12 4365 1 1 1 LYS HB3 H -1.514 6.751 8.520 1.00 . A A . 1 LYS HB3 1 1 12 4366 1 1 1 LYS HD3 H -2.355 5.029 9.255 1.00 . A A . 1 LYS HD3 1 1 12 4367 1 1 1 LYS HE3 H -2.968 2.570 9.106 1.00 . A A . 1 LYS HE3 1 1 12 4368 1 1 1 LYS HG3 H 0.369 4.763 8.345 1.00 . A A . 1 LYS HG3 1 1 12 4369 1 1 1 LYS HZ1 H -2.943 3.183 6.374 1.00 . A A . 1 LYS HZ1 1 1 12 4370 1 1 1 LYS HZ2 H -4.204 3.190 7.412 1.00 . A A . 1 LYS HZ2 1 1 12 4371 1 1 1 LYS HZ3 H -3.293 4.532 7.224 1.00 . A A . 1 LYS HZ3 1 1 12 4372 1 1 1 LYS N N -1.017 7.304 5.433 1.00 . A A . 1 LYS N 1 1 12 4373 1 1 1 LYS NZ N -3.279 3.532 7.248 1.00 . A A . 1 LYS NZ 1 1 12 4374 1 1 1 LYS O O -4.153 6.483 6.281 1.00 . A A . 1 LYS O 1 1 12 4375 1 1 2 SER C C -5.373 8.783 6.243 1.00 . A A . 2 SER C 1 1 12 4376 1 1 2 SER CA C -4.394 9.018 7.395 1.00 . A A . 2 SER CA 1 1 12 4377 1 1 2 SER CB C -4.154 10.517 7.591 1.00 . A A . 2 SER CB 1 1 12 4378 1 1 2 SER H H -2.320 8.819 7.396 1.00 . A A . 2 SER H 1 1 12 4379 1 1 2 SER HA H -4.780 8.589 8.320 1.00 . A A . 2 SER HA 1 1 12 4380 1 1 2 SER HB3 H -3.961 10.982 6.624 1.00 . A A . 2 SER HB3 1 1 12 4381 1 1 2 SER HG H -6.063 10.558 8.189 1.00 . A A . 2 SER HG 1 1 12 4382 1 1 2 SER N N -3.147 8.318 7.138 1.00 . A A . 2 SER N 1 1 12 4383 1 1 2 SER O O -6.478 8.286 6.455 1.00 . A A . 2 SER O 1 1 12 4384 1 1 2 SER OG O -5.265 11.158 8.211 1.00 . A A . 2 SER OG 1 1 12 4385 1 1 3 SER C C -5.952 7.499 3.566 1.00 . A A . 3 SER C 1 1 12 4386 1 1 3 SER CA C -5.755 8.986 3.864 1.00 . A A . 3 SER CA 1 1 12 4387 1 1 3 SER CB C -5.132 9.692 2.658 1.00 . A A . 3 SER CB 1 1 12 4388 1 1 3 SER H H -4.032 9.554 4.886 1.00 . A A . 3 SER H 1 1 12 4389 1 1 3 SER HA H -6.709 9.457 4.107 1.00 . A A . 3 SER HA 1 1 12 4390 1 1 3 SER HB3 H -5.235 10.770 2.776 1.00 . A A . 3 SER HB3 1 1 12 4391 1 1 3 SER HG H -3.666 8.500 1.998 1.00 . A A . 3 SER HG 1 1 12 4392 1 1 3 SER N N -4.932 9.151 5.049 1.00 . A A . 3 SER N 1 1 12 4393 1 1 3 SER O O -5.002 6.803 3.210 1.00 . A A . 3 SER O 1 1 12 4394 1 1 3 SER OG O -3.756 9.361 2.499 1.00 . A A . 3 SER OG 1 1 12 4395 1 1 4 ALA C C -8.506 5.578 2.305 1.00 . A A . 4 ALA C 1 1 12 4396 1 1 4 ALA CA C -7.524 5.663 3.473 1.00 . A A . 4 ALA CA 1 1 12 4397 1 1 4 ALA CB C -8.084 5.035 4.752 1.00 . A A . 4 ALA CB 1 1 12 4398 1 1 4 ALA H H -7.957 7.627 4.011 1.00 . A A . 4 ALA H 1 1 12 4399 1 1 4 ALA HA H -6.604 5.145 3.203 1.00 . A A . 4 ALA HA 1 1 12 4400 1 1 4 ALA HB1 H -8.374 4.004 4.554 1.00 . A A . 4 ALA HB1 1 1 12 4401 1 1 4 ALA HB2 H -7.320 5.055 5.530 1.00 . A A . 4 ALA HB2 1 1 12 4402 1 1 4 ALA HB3 H -8.954 5.602 5.083 1.00 . A A . 4 ALA HB3 1 1 12 4403 1 1 4 ALA N N -7.191 7.054 3.722 1.00 . A A . 4 ALA N 1 1 12 4404 1 1 4 ALA O O -9.658 5.993 2.425 1.00 . A A . 4 ALA O 1 1 12 4405 1 1 5 TYR C C -8.622 3.526 -0.644 1.00 . A A . 5 TYR C 1 1 12 4406 1 1 5 TYR CA C -8.837 4.894 0.007 1.00 . A A . 5 TYR CA 1 1 12 4407 1 1 5 TYR CB C -8.371 5.985 -0.960 1.00 . A A . 5 TYR CB 1 1 12 4408 1 1 5 TYR CD1 C -9.417 7.816 0.421 1.00 . A A . 5 TYR CD1 1 1 12 4409 1 1 5 TYR CD2 C -7.287 8.230 -0.583 1.00 . A A . 5 TYR CD2 1 1 12 4410 1 1 5 TYR CE1 C -9.404 9.139 0.991 1.00 . A A . 5 TYR CE1 1 1 12 4411 1 1 5 TYR CE2 C -7.275 9.551 -0.013 1.00 . A A . 5 TYR CE2 1 1 12 4412 1 1 5 TYR CG C -8.358 7.389 -0.354 1.00 . A A . 5 TYR CG 1 1 12 4413 1 1 5 TYR CZ C -8.334 9.941 0.746 1.00 . A A . 5 TYR CZ 1 1 12 4414 1 1 5 TYR H H -7.078 4.703 1.107 1.00 . A A . 5 TYR H 1 1 12 4415 1 1 5 TYR HA H -9.881 4.987 0.305 1.00 . A A . 5 TYR HA 1 1 12 4416 1 1 5 TYR HB3 H -9.022 5.983 -1.833 1.00 . A A . 5 TYR HB3 1 1 12 4417 1 1 5 TYR HD1 H -10.263 7.153 0.601 1.00 . A A . 5 TYR HD1 1 1 12 4418 1 1 5 TYR HD2 H -6.451 7.892 -1.195 1.00 . A A . 5 TYR HD2 1 1 12 4419 1 1 5 TYR HE1 H -10.234 9.489 1.605 1.00 . A A . 5 TYR HE1 1 1 12 4420 1 1 5 TYR HE2 H -6.436 10.226 -0.185 1.00 . A A . 5 TYR HE2 1 1 12 4421 1 1 5 TYR HH H -7.864 11.175 2.173 1.00 . A A . 5 TYR HH 1 1 12 4422 1 1 5 TYR N N -8.016 5.038 1.198 1.00 . A A . 5 TYR N 1 1 12 4423 1 1 5 TYR O O -8.404 3.437 -1.851 1.00 . A A . 5 TYR O 1 1 12 4424 1 1 5 TYR OH O -8.323 11.190 1.285 1.00 . A A . 5 TYR OH 1 1 12 4425 1 1 6 SER C C -9.636 0.765 -1.262 1.00 . A A . 6 SER C 1 1 12 4426 1 1 6 SER CA C -8.510 1.136 -0.295 1.00 . A A . 6 SER CA 1 1 12 4427 1 1 6 SER CB C -8.460 0.142 0.867 1.00 . A A . 6 SER CB 1 1 12 4428 1 1 6 SER H H -8.870 2.576 1.166 1.00 . A A . 6 SER H 1 1 12 4429 1 1 6 SER HA H -7.549 1.138 -0.810 1.00 . A A . 6 SER HA 1 1 12 4430 1 1 6 SER HB3 H -7.484 0.198 1.350 1.00 . A A . 6 SER HB3 1 1 12 4431 1 1 6 SER HG H -9.125 0.246 2.752 1.00 . A A . 6 SER HG 1 1 12 4432 1 1 6 SER N N -8.692 2.495 0.185 1.00 . A A . 6 SER N 1 1 12 4433 1 1 6 SER O O -10.765 1.229 -1.111 1.00 . A A . 6 SER O 1 1 12 4434 1 1 6 SER OG O -9.480 0.395 1.830 1.00 . A A . 6 SER OG 1 1 12 4435 1 1 7 LEU C C -10.741 -1.914 -2.871 1.00 . A A . 7 LEU C 1 1 12 4436 1 1 7 LEU CA C -10.259 -0.504 -3.224 1.00 . A A . 7 LEU CA 1 1 12 4437 1 1 7 LEU CB C -9.674 -0.389 -4.632 1.00 . A A . 7 LEU CB 1 1 12 4438 1 1 7 LEU CD1 C -11.748 -1.397 -5.654 1.00 . A A . 7 LEU CD1 1 1 12 4439 1 1 7 LEU CD2 C -9.662 -1.071 -7.060 1.00 . A A . 7 LEU CD2 1 1 12 4440 1 1 7 LEU CG C -10.218 -1.376 -5.668 1.00 . A A . 7 LEU CG 1 1 12 4441 1 1 7 LEU H H -8.370 -0.440 -2.348 1.00 . A A . 7 LEU H 1 1 12 4442 1 1 7 LEU HA H -11.110 0.175 -3.171 1.00 . A A . 7 LEU HA 1 1 12 4443 1 1 7 LEU HB3 H -8.593 -0.521 -4.568 1.00 . A A . 7 LEU HB3 1 1 12 4444 1 1 7 LEU HD11 H -12.097 -2.430 -5.651 1.00 . A A . 7 LEU HD11 1 1 12 4445 1 1 7 LEU HD12 H -12.110 -0.889 -4.759 1.00 . A A . 7 LEU HD12 1 1 12 4446 1 1 7 LEU HD13 H -12.126 -0.887 -6.539 1.00 . A A . 7 LEU HD13 1 1 12 4447 1 1 7 LEU HD21 H -10.400 -1.345 -7.814 1.00 . A A . 7 LEU HD21 1 1 12 4448 1 1 7 LEU HD22 H -9.440 -0.008 -7.138 1.00 . A A . 7 LEU HD22 1 1 12 4449 1 1 7 LEU HD23 H -8.750 -1.646 -7.221 1.00 . A A . 7 LEU HD23 1 1 12 4450 1 1 7 LEU HG H -9.879 -2.376 -5.398 1.00 . A A . 7 LEU HG 1 1 12 4451 1 1 7 LEU N N -9.291 -0.067 -2.233 1.00 . A A . 7 LEU N 1 1 12 4452 1 1 7 LEU O O -11.944 -2.172 -2.839 1.00 . A A . 7 LEU O 1 1 12 4453 1 1 8 GLN C C -9.439 -4.533 -0.934 1.00 . A A . 8 GLN C 1 1 12 4454 1 1 8 GLN CA C -10.090 -4.163 -2.269 1.00 . A A . 8 GLN CA 1 1 12 4455 1 1 8 GLN CB C -9.652 -5.122 -3.377 1.00 . A A . 8 GLN CB 1 1 12 4456 1 1 8 GLN CD C -11.095 -7.094 -3.999 1.00 . A A . 8 GLN CD 1 1 12 4457 1 1 8 GLN CG C -10.031 -6.565 -3.035 1.00 . A A . 8 GLN CG 1 1 12 4458 1 1 8 GLN H H -8.803 -2.569 -2.646 1.00 . A A . 8 GLN H 1 1 12 4459 1 1 8 GLN HA H -11.176 -4.199 -2.174 1.00 . A A . 8 GLN HA 1 1 12 4460 1 1 8 GLN HB3 H -8.573 -5.050 -3.519 1.00 . A A . 8 GLN HB3 1 1 12 4461 1 1 8 GLN HE21 H -12.490 -6.079 -2.942 1.00 . A A . 8 GLN HE21 1 1 12 4462 1 1 8 GLN HE22 H -13.094 -6.974 -4.295 1.00 . A A . 8 GLN HE22 1 1 12 4463 1 1 8 GLN HG3 H -10.404 -6.614 -2.012 1.00 . A A . 8 GLN HG3 1 1 12 4464 1 1 8 GLN N N -9.779 -2.787 -2.617 1.00 . A A . 8 GLN N 1 1 12 4465 1 1 8 GLN NE2 N -12.329 -6.682 -3.722 1.00 . A A . 8 GLN NE2 1 1 12 4466 1 1 8 GLN O O -9.824 -4.014 0.113 1.00 . A A . 8 GLN O 1 1 12 4467 1 1 8 GLN OE1 O -10.814 -7.829 -4.931 1.00 . A A . 8 GLN OE1 1 1 12 4468 1 1 9 MET C C -6.713 -6.935 -0.176 1.00 . A A . 9 MET C 1 1 12 4469 1 1 9 MET CA C -7.758 -5.874 0.173 1.00 . A A . 9 MET CA 1 1 12 4470 1 1 9 MET CB C -8.758 -6.453 1.176 1.00 . A A . 9 MET CB 1 1 12 4471 1 1 9 MET CE C -11.801 -9.045 0.828 1.00 . A A . 9 MET CE 1 1 12 4472 1 1 9 MET CG C -9.420 -7.716 0.624 1.00 . A A . 9 MET CG 1 1 12 4473 1 1 9 MET H H -8.160 -5.845 -1.870 1.00 . A A . 9 MET H 1 1 12 4474 1 1 9 MET HA H -7.266 -4.986 0.571 1.00 . A A . 9 MET HA 1 1 12 4475 1 1 9 MET HB3 H -9.520 -5.709 1.406 1.00 . A A . 9 MET HB3 1 1 12 4476 1 1 9 MET HE1 H -12.750 -8.946 1.356 1.00 . A A . 9 MET HE1 1 1 12 4477 1 1 9 MET HE2 H -11.836 -8.462 -0.093 1.00 . A A . 9 MET HE2 1 1 12 4478 1 1 9 MET HE3 H -11.628 -10.094 0.587 1.00 . A A . 9 MET HE3 1 1 12 4479 1 1 9 MET HG3 H -8.657 -8.432 0.317 1.00 . A A . 9 MET HG3 1 1 12 4480 1 1 9 MET N N -8.466 -5.428 -1.015 1.00 . A A . 9 MET N 1 1 12 4481 1 1 9 MET O O -5.652 -6.993 0.444 1.00 . A A . 9 MET O 1 1 12 4482 1 1 9 MET SD S -10.477 -8.445 1.863 1.00 . A A . 9 MET SD 1 1 12 4483 1 1 10 GLY C C -5.695 -8.567 -3.049 1.00 . A A . 10 GLY C 1 1 12 4484 1 1 10 GLY CA C -6.153 -8.802 -1.608 1.00 . A A . 10 GLY CA 1 1 12 4485 1 1 10 GLY H H -7.914 -7.690 -1.667 1.00 . A A . 10 GLY H 1 1 12 4486 1 1 10 GLY HA2 H -5.285 -8.844 -0.949 1.00 . A A . 10 GLY HA2 1 1 12 4487 1 1 10 GLY HA3 H -6.657 -9.766 -1.534 1.00 . A A . 10 GLY HA3 1 1 12 4488 1 1 10 GLY N N -7.049 -7.746 -1.168 1.00 . A A . 10 GLY N 1 1 12 4489 1 1 10 GLY O O -5.637 -9.503 -3.846 1.00 . A A . 10 GLY O 1 1 12 4490 1 1 11 ALA C C -4.434 -5.498 -4.655 1.00 . A A . 11 ALA C 1 1 12 4491 1 1 11 ALA CA C -4.931 -6.945 -4.671 1.00 . A A . 11 ALA CA 1 1 12 4492 1 1 11 ALA CB C -6.068 -7.159 -5.674 1.00 . A A . 11 ALA CB 1 1 12 4493 1 1 11 ALA H H -5.432 -6.559 -2.686 1.00 . A A . 11 ALA H 1 1 12 4494 1 1 11 ALA HA H -4.103 -7.602 -4.936 1.00 . A A . 11 ALA HA 1 1 12 4495 1 1 11 ALA HB1 H -5.692 -7.703 -6.539 1.00 . A A . 11 ALA HB1 1 1 12 4496 1 1 11 ALA HB2 H -6.864 -7.735 -5.201 1.00 . A A . 11 ALA HB2 1 1 12 4497 1 1 11 ALA HB3 H -6.458 -6.193 -5.992 1.00 . A A . 11 ALA HB3 1 1 12 4498 1 1 11 ALA N N -5.382 -7.314 -3.340 1.00 . A A . 11 ALA N 1 1 12 4499 1 1 11 ALA O O -3.312 -5.219 -5.075 1.00 . A A . 11 ALA O 1 1 12 4500 1 1 12 THR C C -3.991 -2.951 -2.927 1.00 . A A . 12 THR C 1 1 12 4501 1 1 12 THR CA C -4.955 -3.206 -4.087 1.00 . A A . 12 THR CA 1 1 12 4502 1 1 12 THR CB C -6.258 -2.413 -3.979 1.00 . A A . 12 THR CB 1 1 12 4503 1 1 12 THR CG2 C -7.307 -2.868 -4.997 1.00 . A A . 12 THR CG2 1 1 12 4504 1 1 12 THR H H -6.204 -4.852 -3.825 1.00 . A A . 12 THR H 1 1 12 4505 1 1 12 THR HA H -4.434 -2.926 -5.003 1.00 . A A . 12 THR HA 1 1 12 4506 1 1 12 THR HB H -6.071 -1.342 -4.066 1.00 . A A . 12 THR HB 1 1 12 4507 1 1 12 THR HG1 H -7.004 -1.996 -2.169 1.00 . A A . 12 THR HG1 1 1 12 4508 1 1 12 THR HG21 H -6.855 -3.576 -5.692 1.00 . A A . 12 THR HG21 1 1 12 4509 1 1 12 THR HG22 H -8.134 -3.350 -4.474 1.00 . A A . 12 THR HG22 1 1 12 4510 1 1 12 THR HG23 H -7.680 -2.005 -5.547 1.00 . A A . 12 THR HG23 1 1 12 4511 1 1 12 THR N N -5.293 -4.617 -4.165 1.00 . A A . 12 THR N 1 1 12 4512 1 1 12 THR O O -2.997 -2.244 -3.084 1.00 . A A . 12 THR O 1 1 12 4513 1 1 12 THR OG1 O -6.801 -2.805 -2.722 1.00 . A A . 12 THR OG1 1 1 12 4514 1 1 13 ALA C C -2.042 -3.715 -0.948 1.00 . A A . 13 ALA C 1 1 12 4515 1 1 13 ALA CA C -3.496 -3.386 -0.600 1.00 . A A . 13 ALA CA 1 1 12 4516 1 1 13 ALA CB C -4.042 -4.275 0.520 1.00 . A A . 13 ALA CB 1 1 12 4517 1 1 13 ALA H H -5.130 -4.115 -1.667 1.00 . A A . 13 ALA H 1 1 12 4518 1 1 13 ALA HA H -3.558 -2.345 -0.285 1.00 . A A . 13 ALA HA 1 1 12 4519 1 1 13 ALA HB1 H -4.671 -5.054 0.092 1.00 . A A . 13 ALA HB1 1 1 12 4520 1 1 13 ALA HB2 H -3.212 -4.732 1.059 1.00 . A A . 13 ALA HB2 1 1 12 4521 1 1 13 ALA HB3 H -4.632 -3.669 1.208 1.00 . A A . 13 ALA HB3 1 1 12 4522 1 1 13 ALA N N -4.319 -3.541 -1.787 1.00 . A A . 13 ALA N 1 1 12 4523 1 1 13 ALA O O -1.119 -3.090 -0.427 1.00 . A A . 13 ALA O 1 1 12 4524 1 1 14 ILE C C 0.287 -3.878 -2.559 1.00 . A A . 14 ILE C 1 1 12 4525 1 1 14 ILE CA C -0.559 -5.113 -2.248 1.00 . A A . 14 ILE CA 1 1 12 4526 1 1 14 ILE CB C -0.655 -6.102 -3.412 1.00 . A A . 14 ILE CB 1 1 12 4527 1 1 14 ILE CD1 C -2.499 -7.777 -3.019 1.00 . A A . 14 ILE CD1 1 1 12 4528 1 1 14 ILE CG1 C -0.997 -7.507 -2.911 1.00 . A A . 14 ILE CG1 1 1 12 4529 1 1 14 ILE CG2 C 0.624 -6.088 -4.251 1.00 . A A . 14 ILE CG2 1 1 12 4530 1 1 14 ILE H H -2.640 -5.198 -2.243 1.00 . A A . 14 ILE H 1 1 12 4531 1 1 14 ILE HA H -0.102 -5.644 -1.413 1.00 . A A . 14 ILE HA 1 1 12 4532 1 1 14 ILE HB H -1.471 -5.785 -4.063 1.00 . A A . 14 ILE HB 1 1 12 4533 1 1 14 ILE HD11 H -2.860 -8.204 -2.084 1.00 . A A . 14 ILE HD11 1 1 12 4534 1 1 14 ILE HD12 H -3.023 -6.843 -3.220 1.00 . A A . 14 ILE HD12 1 1 12 4535 1 1 14 ILE HD13 H -2.684 -8.478 -3.833 1.00 . A A . 14 ILE HD13 1 1 12 4536 1 1 14 ILE HG13 H -0.677 -7.616 -1.876 1.00 . A A . 14 ILE HG13 1 1 12 4537 1 1 14 ILE HG21 H 0.773 -5.092 -4.670 1.00 . A A . 14 ILE HG21 1 1 12 4538 1 1 14 ILE HG22 H 1.475 -6.348 -3.621 1.00 . A A . 14 ILE HG22 1 1 12 4539 1 1 14 ILE HG23 H 0.536 -6.813 -5.059 1.00 . A A . 14 ILE HG23 1 1 12 4540 1 1 14 ILE N N -1.884 -4.695 -1.825 1.00 . A A . 14 ILE N 1 1 12 4541 1 1 14 ILE O O 1.435 -3.782 -2.128 1.00 . A A . 14 ILE O 1 1 12 4542 1 1 15 LYS C C 0.771 -0.974 -2.414 1.00 . A A . 15 LYS C 1 1 12 4543 1 1 15 LYS CA C 0.371 -1.736 -3.679 1.00 . A A . 15 LYS CA 1 1 12 4544 1 1 15 LYS CB C -0.488 -0.917 -4.645 1.00 . A A . 15 LYS CB 1 1 12 4545 1 1 15 LYS CD C -0.531 1.275 -3.398 1.00 . A A . 15 LYS CD 1 1 12 4546 1 1 15 LYS CE C -1.267 2.594 -3.642 1.00 . A A . 15 LYS CE 1 1 12 4547 1 1 15 LYS CG C -1.361 0.086 -3.887 1.00 . A A . 15 LYS CG 1 1 12 4548 1 1 15 LYS H H -1.247 -3.047 -3.652 1.00 . A A . 15 LYS H 1 1 12 4549 1 1 15 LYS HA H 1.277 -2.018 -4.215 1.00 . A A . 15 LYS HA 1 1 12 4550 1 1 15 LYS HB3 H -1.120 -1.584 -5.232 1.00 . A A . 15 LYS HB3 1 1 12 4551 1 1 15 LYS HD3 H 0.429 1.290 -3.914 1.00 . A A . 15 LYS HD3 1 1 12 4552 1 1 15 LYS HE3 H -1.647 2.622 -4.663 1.00 . A A . 15 LYS HE3 1 1 12 4553 1 1 15 LYS HG3 H -1.833 -0.407 -3.037 1.00 . A A . 15 LYS HG3 1 1 12 4554 1 1 15 LYS HZ1 H -2.119 3.378 -1.957 1.00 . A A . 15 LYS HZ1 1 1 12 4555 1 1 15 LYS HZ2 H -3.187 3.111 -3.164 1.00 . A A . 15 LYS HZ2 1 1 12 4556 1 1 15 LYS HZ3 H -2.611 1.856 -2.290 1.00 . A A . 15 LYS HZ3 1 1 12 4557 1 1 15 LYS N N -0.313 -2.962 -3.306 1.00 . A A . 15 LYS N 1 1 12 4558 1 1 15 LYS NZ N -2.386 2.747 -2.686 1.00 . A A . 15 LYS NZ 1 1 12 4559 1 1 15 LYS O O 1.868 -0.424 -2.339 1.00 . A A . 15 LYS O 1 1 12 4560 1 1 16 GLN C C 1.398 -0.791 0.444 1.00 . A A . 16 GLN C 1 1 12 4561 1 1 16 GLN CA C 0.104 -0.282 -0.195 1.00 . A A . 16 GLN CA 1 1 12 4562 1 1 16 GLN CB C -1.081 -0.447 0.758 1.00 . A A . 16 GLN CB 1 1 12 4563 1 1 16 GLN CD C -3.533 0.022 1.109 1.00 . A A . 16 GLN CD 1 1 12 4564 1 1 16 GLN CG C -2.382 0.019 0.101 1.00 . A A . 16 GLN CG 1 1 12 4565 1 1 16 GLN H H -1.030 -1.418 -1.523 1.00 . A A . 16 GLN H 1 1 12 4566 1 1 16 GLN HA H 0.210 0.772 -0.455 1.00 . A A . 16 GLN HA 1 1 12 4567 1 1 16 GLN HB3 H -0.904 0.127 1.668 1.00 . A A . 16 GLN HB3 1 1 12 4568 1 1 16 GLN HE21 H -4.785 -0.514 -0.390 1.00 . A A . 16 GLN HE21 1 1 12 4569 1 1 16 GLN HE22 H -5.528 -0.322 1.163 1.00 . A A . 16 GLN HE22 1 1 12 4570 1 1 16 GLN HG3 H -2.627 -0.639 -0.734 1.00 . A A . 16 GLN HG3 1 1 12 4571 1 1 16 GLN N N -0.140 -0.967 -1.453 1.00 . A A . 16 GLN N 1 1 12 4572 1 1 16 GLN NE2 N -4.713 -0.298 0.583 1.00 . A A . 16 GLN NE2 1 1 12 4573 1 1 16 GLN O O 2.042 -0.073 1.206 1.00 . A A . 16 GLN O 1 1 12 4574 1 1 16 GLN OE1 O -3.363 0.299 2.285 1.00 . A A . 16 GLN OE1 1 1 12 4575 1 1 17 VAL C C 4.130 -1.704 0.415 1.00 . A A . 17 VAL C 1 1 12 4576 1 1 17 VAL CA C 2.943 -2.641 0.643 1.00 . A A . 17 VAL CA 1 1 12 4577 1 1 17 VAL CB C 3.144 -4.024 0.021 1.00 . A A . 17 VAL CB 1 1 12 4578 1 1 17 VAL CG1 C 4.397 -4.701 0.580 1.00 . A A . 17 VAL CG1 1 1 12 4579 1 1 17 VAL CG2 C 1.909 -4.903 0.225 1.00 . A A . 17 VAL CG2 1 1 12 4580 1 1 17 VAL H H 1.208 -2.606 -0.510 1.00 . A A . 17 VAL H 1 1 12 4581 1 1 17 VAL HA H 2.800 -2.771 1.716 1.00 . A A . 17 VAL HA 1 1 12 4582 1 1 17 VAL HB H 3.286 -3.892 -1.052 1.00 . A A . 17 VAL HB 1 1 12 4583 1 1 17 VAL HG11 H 4.613 -5.600 0.004 1.00 . A A . 17 VAL HG11 1 1 12 4584 1 1 17 VAL HG12 H 5.242 -4.014 0.512 1.00 . A A . 17 VAL HG12 1 1 12 4585 1 1 17 VAL HG13 H 4.231 -4.968 1.623 1.00 . A A . 17 VAL HG13 1 1 12 4586 1 1 17 VAL HG21 H 1.044 -4.273 0.433 1.00 . A A . 17 VAL HG21 1 1 12 4587 1 1 17 VAL HG22 H 1.724 -5.488 -0.676 1.00 . A A . 17 VAL HG22 1 1 12 4588 1 1 17 VAL HG23 H 2.077 -5.576 1.067 1.00 . A A . 17 VAL HG23 1 1 12 4589 1 1 17 VAL N N 1.738 -2.027 0.110 1.00 . A A . 17 VAL N 1 1 12 4590 1 1 17 VAL O O 4.958 -1.518 1.305 1.00 . A A . 17 VAL O 1 1 12 4591 1 1 18 LYS C C 5.153 1.030 -0.272 1.00 . A A . 18 LYS C 1 1 12 4592 1 1 18 LYS CA C 5.249 -0.226 -1.139 1.00 . A A . 18 LYS CA 1 1 12 4593 1 1 18 LYS CB C 5.232 0.060 -2.642 1.00 . A A . 18 LYS CB 1 1 12 4594 1 1 18 LYS CD C 4.105 2.309 -2.811 1.00 . A A . 18 LYS CD 1 1 12 4595 1 1 18 LYS CE C 3.439 2.448 -4.182 1.00 . A A . 18 LYS CE 1 1 12 4596 1 1 18 LYS CG C 5.429 1.552 -2.918 1.00 . A A . 18 LYS CG 1 1 12 4597 1 1 18 LYS H H 3.499 -1.296 -1.501 1.00 . A A . 18 LYS H 1 1 12 4598 1 1 18 LYS HA H 6.191 -0.727 -0.918 1.00 . A A . 18 LYS HA 1 1 12 4599 1 1 18 LYS HB3 H 4.285 -0.270 -3.068 1.00 . A A . 18 LYS HB3 1 1 12 4600 1 1 18 LYS HD3 H 4.280 3.298 -2.386 1.00 . A A . 18 LYS HD3 1 1 12 4601 1 1 18 LYS HE3 H 2.410 2.785 -4.061 1.00 . A A . 18 LYS HE3 1 1 12 4602 1 1 18 LYS HG3 H 5.851 1.688 -3.914 1.00 . A A . 18 LYS HG3 1 1 12 4603 1 1 18 LYS HZ1 H 5.097 3.553 -4.639 1.00 . A A . 18 LYS HZ1 1 1 12 4604 1 1 18 LYS HZ2 H 4.273 3.038 -5.952 1.00 . A A . 18 LYS HZ2 1 1 12 4605 1 1 18 LYS HZ3 H 3.694 4.276 -5.058 1.00 . A A . 18 LYS HZ3 1 1 12 4606 1 1 18 LYS N N 4.176 -1.139 -0.783 1.00 . A A . 18 LYS N 1 1 12 4607 1 1 18 LYS NZ N 4.186 3.406 -5.025 1.00 . A A . 18 LYS NZ 1 1 12 4608 1 1 18 LYS O O 6.169 1.631 0.073 1.00 . A A . 18 LYS O 1 1 12 4609 1 1 19 LYS C C 4.254 2.334 2.273 1.00 . A A . 19 LYS C 1 1 12 4610 1 1 19 LYS CA C 3.677 2.566 0.875 1.00 . A A . 19 LYS CA 1 1 12 4611 1 1 19 LYS CB C 2.189 2.921 0.875 1.00 . A A . 19 LYS CB 1 1 12 4612 1 1 19 LYS CD C 1.547 2.215 3.209 1.00 . A A . 19 LYS CD 1 1 12 4613 1 1 19 LYS CE C 0.064 1.866 3.357 1.00 . A A . 19 LYS CE 1 1 12 4614 1 1 19 LYS CG C 1.738 3.398 2.257 1.00 . A A . 19 LYS CG 1 1 12 4615 1 1 19 LYS H H 3.099 0.897 -0.229 1.00 . A A . 19 LYS H 1 1 12 4616 1 1 19 LYS HA H 4.208 3.399 0.416 1.00 . A A . 19 LYS HA 1 1 12 4617 1 1 19 LYS HB3 H 1.604 2.051 0.578 1.00 . A A . 19 LYS HB3 1 1 12 4618 1 1 19 LYS HD3 H 1.966 2.458 4.185 1.00 . A A . 19 LYS HD3 1 1 12 4619 1 1 19 LYS HE3 H -0.041 0.829 3.677 1.00 . A A . 19 LYS HE3 1 1 12 4620 1 1 19 LYS HG3 H 0.805 3.953 2.168 1.00 . A A . 19 LYS HG3 1 1 12 4621 1 1 19 LYS HZ1 H -0.405 2.426 5.266 1.00 . A A . 19 LYS HZ1 1 1 12 4622 1 1 19 LYS HZ2 H -0.213 3.687 4.245 1.00 . A A . 19 LYS HZ2 1 1 12 4623 1 1 19 LYS HZ3 H -1.570 2.779 4.178 1.00 . A A . 19 LYS HZ3 1 1 12 4624 1 1 19 LYS N N 3.921 1.391 0.055 1.00 . A A . 19 LYS N 1 1 12 4625 1 1 19 LYS NZ N -0.584 2.762 4.341 1.00 . A A . 19 LYS NZ 1 1 12 4626 1 1 19 LYS O O 4.453 3.283 3.031 1.00 . A A . 19 LYS O 1 1 12 4627 1 1 20 LEU C C 6.570 0.525 3.741 1.00 . A A . 20 LEU C 1 1 12 4628 1 1 20 LEU CA C 5.056 0.700 3.867 1.00 . A A . 20 LEU CA 1 1 12 4629 1 1 20 LEU CB C 4.337 -0.530 4.423 1.00 . A A . 20 LEU CB 1 1 12 4630 1 1 20 LEU CD1 C 6.222 -1.877 5.420 1.00 . A A . 20 LEU CD1 1 1 12 4631 1 1 20 LEU CD2 C 4.176 -3.046 4.481 1.00 . A A . 20 LEU CD2 1 1 12 4632 1 1 20 LEU CG C 5.117 -1.846 4.363 1.00 . A A . 20 LEU CG 1 1 12 4633 1 1 20 LEU H H 4.341 0.303 1.950 1.00 . A A . 20 LEU H 1 1 12 4634 1 1 20 LEU HA H 4.859 1.526 4.551 1.00 . A A . 20 LEU HA 1 1 12 4635 1 1 20 LEU HB3 H 3.402 -0.659 3.877 1.00 . A A . 20 LEU HB3 1 1 12 4636 1 1 20 LEU HD11 H 7.186 -1.699 4.944 1.00 . A A . 20 LEU HD11 1 1 12 4637 1 1 20 LEU HD12 H 6.036 -1.102 6.164 1.00 . A A . 20 LEU HD12 1 1 12 4638 1 1 20 LEU HD13 H 6.232 -2.852 5.907 1.00 . A A . 20 LEU HD13 1 1 12 4639 1 1 20 LEU HD21 H 4.543 -3.721 5.256 1.00 . A A . 20 LEU HD21 1 1 12 4640 1 1 20 LEU HD22 H 3.176 -2.700 4.745 1.00 . A A . 20 LEU HD22 1 1 12 4641 1 1 20 LEU HD23 H 4.139 -3.574 3.529 1.00 . A A . 20 LEU HD23 1 1 12 4642 1 1 20 LEU HG H 5.602 -1.911 3.389 1.00 . A A . 20 LEU HG 1 1 12 4643 1 1 20 LEU N N 4.506 1.068 2.573 1.00 . A A . 20 LEU N 1 1 12 4644 1 1 20 LEU O O 7.281 0.498 4.744 1.00 . A A . 20 LEU O 1 1 12 4645 1 1 21 PHE C C 9.176 1.577 2.305 1.00 . A A . 21 PHE C 1 1 12 4646 1 1 21 PHE CA C 8.437 0.239 2.230 1.00 . A A . 21 PHE CA 1 1 12 4647 1 1 21 PHE CB C 8.557 -0.319 0.810 1.00 . A A . 21 PHE CB 1 1 12 4648 1 1 21 PHE CD1 C 7.952 -2.749 0.811 1.00 . A A . 21 PHE CD1 1 1 12 4649 1 1 21 PHE CD2 C 10.230 -2.175 0.646 1.00 . A A . 21 PHE CD2 1 1 12 4650 1 1 21 PHE CE1 C 8.295 -4.126 0.758 1.00 . A A . 21 PHE CE1 1 1 12 4651 1 1 21 PHE CE2 C 10.573 -3.551 0.593 1.00 . A A . 21 PHE CE2 1 1 12 4652 1 1 21 PHE CG C 8.926 -1.802 0.754 1.00 . A A . 21 PHE CG 1 1 12 4653 1 1 21 PHE CZ C 9.598 -4.498 0.650 1.00 . A A . 21 PHE CZ 1 1 12 4654 1 1 21 PHE H H 6.435 0.435 1.689 1.00 . A A . 21 PHE H 1 1 12 4655 1 1 21 PHE HA H 8.831 -0.435 2.991 1.00 . A A . 21 PHE HA 1 1 12 4656 1 1 21 PHE HB3 H 9.310 0.254 0.269 1.00 . A A . 21 PHE HB3 1 1 12 4657 1 1 21 PHE HD1 H 6.907 -2.450 0.897 1.00 . A A . 21 PHE HD1 1 1 12 4658 1 1 21 PHE HD2 H 11.012 -1.416 0.600 1.00 . A A . 21 PHE HD2 1 1 12 4659 1 1 21 PHE HE1 H 7.513 -4.884 0.804 1.00 . A A . 21 PHE HE1 1 1 12 4660 1 1 21 PHE HE2 H 11.618 -3.850 0.506 1.00 . A A . 21 PHE HE2 1 1 12 4661 1 1 21 PHE HZ H 9.862 -5.555 0.609 1.00 . A A . 21 PHE HZ 1 1 12 4662 1 1 21 PHE N N 7.020 0.411 2.499 1.00 . A A . 21 PHE N 1 1 12 4663 1 1 21 PHE O O 10.390 1.609 2.500 1.00 . A A . 21 PHE O 1 1 12 4664 1 1 22 LYS C C 9.694 4.184 3.530 1.00 . A A . 22 LYS C 1 1 12 4665 1 1 22 LYS CA C 8.978 3.985 2.192 1.00 . A A . 22 LYS CA 1 1 12 4666 1 1 22 LYS CB C 7.902 5.034 1.908 1.00 . A A . 22 LYS CB 1 1 12 4667 1 1 22 LYS CD C 6.798 4.364 4.074 1.00 . A A . 22 LYS CD 1 1 12 4668 1 1 22 LYS CE C 5.612 4.850 4.908 1.00 . A A . 22 LYS CE 1 1 12 4669 1 1 22 LYS CG C 6.583 4.664 2.589 1.00 . A A . 22 LYS CG 1 1 12 4670 1 1 22 LYS H H 7.426 2.613 1.987 1.00 . A A . 22 LYS H 1 1 12 4671 1 1 22 LYS HA H 9.716 4.054 1.393 1.00 . A A . 22 LYS HA 1 1 12 4672 1 1 22 LYS HB3 H 7.748 5.119 0.832 1.00 . A A . 22 LYS HB3 1 1 12 4673 1 1 22 LYS HD3 H 7.712 4.849 4.418 1.00 . A A . 22 LYS HD3 1 1 12 4674 1 1 22 LYS HE3 H 4.979 5.503 4.307 1.00 . A A . 22 LYS HE3 1 1 12 4675 1 1 22 LYS HG3 H 6.147 3.794 2.098 1.00 . A A . 22 LYS HG3 1 1 12 4676 1 1 22 LYS HZ1 H 4.253 3.994 6.172 1.00 . A A . 22 LYS HZ1 1 1 12 4677 1 1 22 LYS HZ2 H 4.235 3.359 4.668 1.00 . A A . 22 LYS HZ2 1 1 12 4678 1 1 22 LYS HZ3 H 5.438 2.974 5.702 1.00 . A A . 22 LYS HZ3 1 1 12 4679 1 1 22 LYS N N 8.412 2.648 2.145 1.00 . A A . 22 LYS N 1 1 12 4680 1 1 22 LYS NZ N 4.821 3.700 5.403 1.00 . A A . 22 LYS NZ 1 1 12 4681 1 1 22 LYS O O 10.494 5.106 3.679 1.00 . A A . 22 LYS O 1 1 12 4682 1 1 23 LYS C C 11.018 2.257 5.932 1.00 . A A . 23 LYS C 1 1 12 4683 1 1 23 LYS CA C 9.981 3.373 5.790 1.00 . A A . 23 LYS CA 1 1 12 4684 1 1 23 LYS CB C 8.900 3.348 6.874 1.00 . A A . 23 LYS CB 1 1 12 4685 1 1 23 LYS CD C 7.349 1.743 8.047 1.00 . A A . 23 LYS CD 1 1 12 4686 1 1 23 LYS CE C 6.079 2.556 8.301 1.00 . A A . 23 LYS CE 1 1 12 4687 1 1 23 LYS CG C 7.990 2.129 6.713 1.00 . A A . 23 LYS CG 1 1 12 4688 1 1 23 LYS H H 8.727 2.558 4.340 1.00 . A A . 23 LYS H 1 1 12 4689 1 1 23 LYS HA H 10.493 4.333 5.867 1.00 . A A . 23 LYS HA 1 1 12 4690 1 1 23 LYS HB3 H 8.307 4.260 6.820 1.00 . A A . 23 LYS HB3 1 1 12 4691 1 1 23 LYS HD3 H 8.059 1.910 8.857 1.00 . A A . 23 LYS HD3 1 1 12 4692 1 1 23 LYS HE3 H 6.038 3.402 7.615 1.00 . A A . 23 LYS HE3 1 1 12 4693 1 1 23 LYS HG3 H 8.567 1.289 6.325 1.00 . A A . 23 LYS HG3 1 1 12 4694 1 1 23 LYS HZ1 H 4.712 1.566 7.148 1.00 . A A . 23 LYS HZ1 1 1 12 4695 1 1 23 LYS HZ2 H 5.023 0.827 8.572 1.00 . A A . 23 LYS HZ2 1 1 12 4696 1 1 23 LYS HZ3 H 4.086 2.164 8.534 1.00 . A A . 23 LYS HZ3 1 1 12 4697 1 1 23 LYS N N 9.379 3.305 4.470 1.00 . A A . 23 LYS N 1 1 12 4698 1 1 23 LYS NZ N 4.877 1.710 8.124 1.00 . A A . 23 LYS NZ 1 1 12 4699 1 1 23 LYS O O 11.909 2.335 6.777 1.00 . A A . 23 LYS O 1 1 12 4700 1 1 24 TRP C C 13.114 0.571 4.508 1.00 . A A . 24 TRP C 1 1 12 4701 1 1 24 TRP CA C 11.783 0.115 5.110 1.00 . A A . 24 TRP CA 1 1 12 4702 1 1 24 TRP CB C 11.180 -1.090 4.385 1.00 . A A . 24 TRP CB 1 1 12 4703 1 1 24 TRP CD1 C 9.570 -1.480 6.364 1.00 . A A . 24 TRP CD1 1 1 12 4704 1 1 24 TRP CD2 C 9.496 -3.091 4.845 1.00 . A A . 24 TRP CD2 1 1 12 4705 1 1 24 TRP CE2 C 8.596 -3.419 5.839 1.00 . A A . 24 TRP CE2 1 1 12 4706 1 1 24 TRP CE3 C 9.686 -3.921 3.725 1.00 . A A . 24 TRP CE3 1 1 12 4707 1 1 24 TRP CG C 10.119 -1.837 5.194 1.00 . A A . 24 TRP CG 1 1 12 4708 1 1 24 TRP CH2 C 7.990 -5.424 4.709 1.00 . A A . 24 TRP CH2 1 1 12 4709 1 1 24 TRP CZ2 C 7.817 -4.582 5.814 1.00 . A A . 24 TRP CZ2 1 1 12 4710 1 1 24 TRP CZ3 C 8.899 -5.079 3.716 1.00 . A A . 24 TRP CZ3 1 1 12 4711 1 1 24 TRP H H 10.143 1.189 4.405 1.00 . A A . 24 TRP H 1 1 12 4712 1 1 24 TRP HA H 11.926 -0.180 6.150 1.00 . A A . 24 TRP HA 1 1 12 4713 1 1 24 TRP HB3 H 11.981 -1.784 4.127 1.00 . A A . 24 TRP HB3 1 1 12 4714 1 1 24 TRP HD1 H 9.824 -0.571 6.908 1.00 . A A . 24 TRP HD1 1 1 12 4715 1 1 24 TRP HE1 H 8.056 -2.358 7.708 1.00 . A A . 24 TRP HE1 1 1 12 4716 1 1 24 TRP HE3 H 10.390 -3.684 2.928 1.00 . A A . 24 TRP HE3 1 1 12 4717 1 1 24 TRP HH2 H 7.412 -6.345 4.628 1.00 . A A . 24 TRP HH2 1 1 12 4718 1 1 24 TRP HZ2 H 7.113 -4.818 6.612 1.00 . A A . 24 TRP HZ2 1 1 12 4719 1 1 24 TRP HZ3 H 9.007 -5.758 2.870 1.00 . A A . 24 TRP HZ3 1 1 12 4720 1 1 24 TRP N N 10.870 1.245 5.089 1.00 . A A . 24 TRP N 1 1 12 4721 1 1 24 TRP NE1 N 8.643 -2.408 6.792 1.00 . A A . 24 TRP NE1 1 1 12 4722 1 1 24 TRP O O 13.133 1.287 3.508 1.00 . A A . 24 TRP O 1 1 12 4723 1 1 25 GLY C C 16.225 -0.711 4.048 1.00 . A A . 25 GLY C 1 1 12 4724 1 1 25 GLY CA C 15.525 0.493 4.681 1.00 . A A . 25 GLY CA 1 1 12 4725 1 1 25 GLY H H 14.168 -0.444 5.955 1.00 . A A . 25 GLY H 1 1 12 4726 1 1 25 GLY HA2 H 15.457 1.303 3.955 1.00 . A A . 25 GLY HA2 1 1 12 4727 1 1 25 GLY HA3 H 16.116 0.863 5.519 1.00 . A A . 25 GLY HA3 1 1 12 4728 1 1 25 GLY N N 14.193 0.138 5.142 1.00 . A A . 25 GLY N 1 1 12 4729 1 1 25 GLY O O 16.152 -1.822 4.571 1.00 . A A . 25 GLY O 1 1 12 4730 1 1 26 TRP C C 19.082 -1.399 2.597 1.00 . A A . 26 TRP C 1 1 12 4731 1 1 26 TRP CA C 17.602 -1.497 2.221 1.00 . A A . 26 TRP CA 1 1 12 4732 1 1 26 TRP CB C 17.359 -1.400 0.714 1.00 . A A . 26 TRP CB 1 1 12 4733 1 1 26 TRP CD1 C 15.619 -3.301 0.570 1.00 . A A . 26 TRP CD1 1 1 12 4734 1 1 26 TRP CD2 C 17.086 -3.330 -1.090 1.00 . A A . 26 TRP CD2 1 1 12 4735 1 1 26 TRP CE2 C 16.222 -4.388 -1.285 1.00 . A A . 26 TRP CE2 1 1 12 4736 1 1 26 TRP CE3 C 18.143 -3.074 -1.982 1.00 . A A . 26 TRP CE3 1 1 12 4737 1 1 26 TRP CG C 16.688 -2.635 0.111 1.00 . A A . 26 TRP CG 1 1 12 4738 1 1 26 TRP CH2 C 17.368 -5.037 -3.266 1.00 . A A . 26 TRP CH2 1 1 12 4739 1 1 26 TRP CZ2 C 16.324 -5.274 -2.364 1.00 . A A . 26 TRP CZ2 1 1 12 4740 1 1 26 TRP CZ3 C 18.231 -3.968 -3.056 1.00 . A A . 26 TRP CZ3 1 1 12 4741 1 1 26 TRP H H 16.943 0.458 2.513 1.00 . A A . 26 TRP H 1 1 12 4742 1 1 26 TRP HA H 17.196 -2.455 2.547 1.00 . A A . 26 TRP HA 1 1 12 4743 1 1 26 TRP HB3 H 18.314 -1.237 0.213 1.00 . A A . 26 TRP HB3 1 1 12 4744 1 1 26 TRP HD1 H 15.071 -3.032 1.473 1.00 . A A . 26 TRP HD1 1 1 12 4745 1 1 26 TRP HE1 H 14.479 -5.070 -0.095 1.00 . A A . 26 TRP HE1 1 1 12 4746 1 1 26 TRP HE3 H 18.838 -2.245 -1.851 1.00 . A A . 26 TRP HE3 1 1 12 4747 1 1 26 TRP HH2 H 17.505 -5.690 -4.128 1.00 . A A . 26 TRP HH2 1 1 12 4748 1 1 26 TRP HZ2 H 15.628 -6.102 -2.496 1.00 . A A . 26 TRP HZ2 1 1 12 4749 1 1 26 TRP HZ3 H 19.032 -3.814 -3.778 1.00 . A A . 26 TRP HZ3 1 1 12 4750 1 1 26 TRP N N 16.888 -0.449 2.932 1.00 . A A . 26 TRP N 1 1 12 4751 1 1 26 TRP NE1 N 15.301 -4.370 -0.242 1.00 . A A . 26 TRP NE1 1 1 12 4752 1 1 26 TRP O O 19.470 -1.771 3.702 1.00 . A A . 26 TRP O 1 1 13 4753 1 1 1 LYS C C -17.785 7.652 -0.906 1.00 . A A . 1 LYS C 1 1 13 4754 1 1 1 LYS CA C -16.515 7.979 -0.119 1.00 . A A . 1 LYS CA 1 1 13 4755 1 1 1 LYS CB C -15.226 7.563 -0.831 1.00 . A A . 1 LYS CB 1 1 13 4756 1 1 1 LYS CD C -13.924 8.877 -2.546 1.00 . A A . 1 LYS CD 1 1 13 4757 1 1 1 LYS CE C -12.834 7.974 -3.129 1.00 . A A . 1 LYS CE 1 1 13 4758 1 1 1 LYS CG C -15.203 8.085 -2.271 1.00 . A A . 1 LYS CG 1 1 13 4759 1 1 1 LYS H1 H -16.606 6.362 1.192 1.00 . A A . 1 LYS H1 1 1 13 4760 1 1 1 LYS HA H -16.467 9.057 0.029 1.00 . A A . 1 LYS HA 1 1 13 4761 1 1 1 LYS HB3 H -15.142 6.476 -0.834 1.00 . A A . 1 LYS HB3 1 1 13 4762 1 1 1 LYS HD3 H -13.566 9.332 -1.621 1.00 . A A . 1 LYS HD3 1 1 13 4763 1 1 1 LYS HE3 H -12.910 6.977 -2.698 1.00 . A A . 1 LYS HE3 1 1 13 4764 1 1 1 LYS HG3 H -16.072 8.718 -2.445 1.00 . A A . 1 LYS HG3 1 1 13 4765 1 1 1 LYS HZ1 H -12.163 7.428 -4.981 1.00 . A A . 1 LYS HZ1 1 1 13 4766 1 1 1 LYS HZ2 H -13.789 7.385 -4.838 1.00 . A A . 1 LYS HZ2 1 1 13 4767 1 1 1 LYS HZ3 H -13.020 8.818 -4.982 1.00 . A A . 1 LYS HZ3 1 1 13 4768 1 1 1 LYS N N -16.590 7.362 1.194 1.00 . A A . 1 LYS N 1 1 13 4769 1 1 1 LYS NZ N -12.961 7.896 -4.602 1.00 . A A . 1 LYS NZ 1 1 13 4770 1 1 1 LYS O O -18.564 8.547 -1.231 1.00 . A A . 1 LYS O 1 1 13 4771 1 1 2 SER C C -19.040 4.402 -2.150 1.00 . A A . 2 SER C 1 1 13 4772 1 1 2 SER CA C -19.119 5.914 -1.930 1.00 . A A . 2 SER CA 1 1 13 4773 1 1 2 SER CB C -19.235 6.640 -3.271 1.00 . A A . 2 SER CB 1 1 13 4774 1 1 2 SER H H -17.317 5.648 -0.919 1.00 . A A . 2 SER H 1 1 13 4775 1 1 2 SER HA H -19.976 6.166 -1.306 1.00 . A A . 2 SER HA 1 1 13 4776 1 1 2 SER HB3 H -19.266 5.908 -4.079 1.00 . A A . 2 SER HB3 1 1 13 4777 1 1 2 SER HG H -20.269 8.181 -4.019 1.00 . A A . 2 SER HG 1 1 13 4778 1 1 2 SER N N -17.955 6.369 -1.188 1.00 . A A . 2 SER N 1 1 13 4779 1 1 2 SER O O -18.223 3.927 -2.937 1.00 . A A . 2 SER O 1 1 13 4780 1 1 2 SER OG O -20.395 7.464 -3.333 1.00 . A A . 2 SER OG 1 1 13 4781 1 1 3 SER C C -18.516 1.681 -1.606 1.00 . A A . 3 SER C 1 1 13 4782 1 1 3 SER CA C -19.939 2.239 -1.549 1.00 . A A . 3 SER CA 1 1 13 4783 1 1 3 SER CB C -20.732 1.799 -2.781 1.00 . A A . 3 SER CB 1 1 13 4784 1 1 3 SER H H -20.563 4.081 -0.804 1.00 . A A . 3 SER H 1 1 13 4785 1 1 3 SER HA H -20.449 1.896 -0.648 1.00 . A A . 3 SER HA 1 1 13 4786 1 1 3 SER HB3 H -20.903 0.723 -2.739 1.00 . A A . 3 SER HB3 1 1 13 4787 1 1 3 SER HG H -21.841 3.415 -3.185 1.00 . A A . 3 SER HG 1 1 13 4788 1 1 3 SER N N -19.901 3.687 -1.440 1.00 . A A . 3 SER N 1 1 13 4789 1 1 3 SER O O -18.098 1.143 -2.630 1.00 . A A . 3 SER O 1 1 13 4790 1 1 3 SER OG O -21.984 2.474 -2.880 1.00 . A A . 3 SER OG 1 1 13 4791 1 1 4 ALA C C -15.917 1.577 1.013 1.00 . A A . 4 ALA C 1 1 13 4792 1 1 4 ALA CA C -16.444 1.344 -0.404 1.00 . A A . 4 ALA CA 1 1 13 4793 1 1 4 ALA CB C -15.588 2.037 -1.466 1.00 . A A . 4 ALA CB 1 1 13 4794 1 1 4 ALA H H -18.160 2.266 0.334 1.00 . A A . 4 ALA H 1 1 13 4795 1 1 4 ALA HA H -16.456 0.273 -0.608 1.00 . A A . 4 ALA HA 1 1 13 4796 1 1 4 ALA HB1 H -14.755 1.391 -1.740 1.00 . A A . 4 ALA HB1 1 1 13 4797 1 1 4 ALA HB2 H -16.196 2.240 -2.348 1.00 . A A . 4 ALA HB2 1 1 13 4798 1 1 4 ALA HB3 H -15.204 2.976 -1.067 1.00 . A A . 4 ALA HB3 1 1 13 4799 1 1 4 ALA N N -17.812 1.827 -0.494 1.00 . A A . 4 ALA N 1 1 13 4800 1 1 4 ALA O O -16.437 2.421 1.742 1.00 . A A . 4 ALA O 1 1 13 4801 1 1 5 TYR C C -12.873 1.500 2.586 1.00 . A A . 5 TYR C 1 1 13 4802 1 1 5 TYR CA C -14.288 0.926 2.678 1.00 . A A . 5 TYR CA 1 1 13 4803 1 1 5 TYR CB C -14.214 -0.498 3.230 1.00 . A A . 5 TYR CB 1 1 13 4804 1 1 5 TYR CD1 C -16.700 -0.792 3.530 1.00 . A A . 5 TYR CD1 1 1 13 4805 1 1 5 TYR CD2 C -15.261 -1.395 5.342 1.00 . A A . 5 TYR CD2 1 1 13 4806 1 1 5 TYR CE1 C -17.846 -1.178 4.312 1.00 . A A . 5 TYR CE1 1 1 13 4807 1 1 5 TYR CE2 C -16.407 -1.781 6.123 1.00 . A A . 5 TYR CE2 1 1 13 4808 1 1 5 TYR CG C -15.431 -0.909 4.061 1.00 . A A . 5 TYR CG 1 1 13 4809 1 1 5 TYR CZ C -17.643 -1.653 5.570 1.00 . A A . 5 TYR CZ 1 1 13 4810 1 1 5 TYR H H -14.475 0.130 0.762 1.00 . A A . 5 TYR H 1 1 13 4811 1 1 5 TYR HA H -14.906 1.598 3.275 1.00 . A A . 5 TYR HA 1 1 13 4812 1 1 5 TYR HB3 H -13.319 -0.592 3.845 1.00 . A A . 5 TYR HB3 1 1 13 4813 1 1 5 TYR HD1 H -16.833 -0.408 2.519 1.00 . A A . 5 TYR HD1 1 1 13 4814 1 1 5 TYR HD2 H -14.259 -1.488 5.761 1.00 . A A . 5 TYR HD2 1 1 13 4815 1 1 5 TYR HE1 H -18.853 -1.091 3.905 1.00 . A A . 5 TYR HE1 1 1 13 4816 1 1 5 TYR HE2 H -16.286 -2.167 7.135 1.00 . A A . 5 TYR HE2 1 1 13 4817 1 1 5 TYR HH H -19.019 -2.939 6.053 1.00 . A A . 5 TYR HH 1 1 13 4818 1 1 5 TYR N N -14.891 0.814 1.360 1.00 . A A . 5 TYR N 1 1 13 4819 1 1 5 TYR O O -12.246 1.783 3.606 1.00 . A A . 5 TYR O 1 1 13 4820 1 1 5 TYR OH O -18.725 -2.018 6.308 1.00 . A A . 5 TYR OH 1 1 13 4821 1 1 6 SER C C -10.786 2.208 -0.386 1.00 . A A . 6 SER C 1 1 13 4822 1 1 6 SER CA C -11.081 2.189 1.115 1.00 . A A . 6 SER CA 1 1 13 4823 1 1 6 SER CB C -10.019 1.373 1.854 1.00 . A A . 6 SER CB 1 1 13 4824 1 1 6 SER H H -12.927 1.422 0.530 1.00 . A A . 6 SER H 1 1 13 4825 1 1 6 SER HA H -11.101 3.203 1.514 1.00 . A A . 6 SER HA 1 1 13 4826 1 1 6 SER HB3 H -9.579 0.646 1.171 1.00 . A A . 6 SER HB3 1 1 13 4827 1 1 6 SER HG H -9.357 3.102 2.617 1.00 . A A . 6 SER HG 1 1 13 4828 1 1 6 SER N N -12.411 1.655 1.354 1.00 . A A . 6 SER N 1 1 13 4829 1 1 6 SER O O -11.515 1.606 -1.174 1.00 . A A . 6 SER O 1 1 13 4830 1 1 6 SER OG O -8.990 2.199 2.393 1.00 . A A . 6 SER OG 1 1 13 4831 1 1 7 LEU C C -9.499 1.655 -2.814 1.00 . A A . 7 LEU C 1 1 13 4832 1 1 7 LEU CA C -9.317 3.012 -2.131 1.00 . A A . 7 LEU CA 1 1 13 4833 1 1 7 LEU CB C -7.896 3.568 -2.240 1.00 . A A . 7 LEU CB 1 1 13 4834 1 1 7 LEU CD1 C -5.442 2.996 -2.149 1.00 . A A . 7 LEU CD1 1 1 13 4835 1 1 7 LEU CD2 C -6.798 3.146 -0.010 1.00 . A A . 7 LEU CD2 1 1 13 4836 1 1 7 LEU CG C -6.810 2.788 -1.498 1.00 . A A . 7 LEU CG 1 1 13 4837 1 1 7 LEU H H -9.129 3.394 -0.092 1.00 . A A . 7 LEU H 1 1 13 4838 1 1 7 LEU HA H -9.983 3.732 -2.609 1.00 . A A . 7 LEU HA 1 1 13 4839 1 1 7 LEU HB3 H -7.898 4.593 -1.866 1.00 . A A . 7 LEU HB3 1 1 13 4840 1 1 7 LEU HD11 H -5.056 3.978 -1.876 1.00 . A A . 7 LEU HD11 1 1 13 4841 1 1 7 LEU HD12 H -4.753 2.224 -1.802 1.00 . A A . 7 LEU HD12 1 1 13 4842 1 1 7 LEU HD13 H -5.541 2.932 -3.232 1.00 . A A . 7 LEU HD13 1 1 13 4843 1 1 7 LEU HD21 H -7.331 2.379 0.553 1.00 . A A . 7 LEU HD21 1 1 13 4844 1 1 7 LEU HD22 H -5.768 3.203 0.341 1.00 . A A . 7 LEU HD22 1 1 13 4845 1 1 7 LEU HD23 H -7.286 4.109 0.136 1.00 . A A . 7 LEU HD23 1 1 13 4846 1 1 7 LEU HG H -7.044 1.725 -1.570 1.00 . A A . 7 LEU HG 1 1 13 4847 1 1 7 LEU N N -9.717 2.907 -0.738 1.00 . A A . 7 LEU N 1 1 13 4848 1 1 7 LEU O O -10.015 1.581 -3.928 1.00 . A A . 7 LEU O 1 1 13 4849 1 1 8 GLN C C -9.518 -1.716 -1.518 1.00 . A A . 8 GLN C 1 1 13 4850 1 1 8 GLN CA C -9.175 -0.736 -2.642 1.00 . A A . 8 GLN CA 1 1 13 4851 1 1 8 GLN CB C -7.889 -1.152 -3.358 1.00 . A A . 8 GLN CB 1 1 13 4852 1 1 8 GLN CD C -7.444 0.889 -4.771 1.00 . A A . 8 GLN CD 1 1 13 4853 1 1 8 GLN CG C -7.846 -0.587 -4.779 1.00 . A A . 8 GLN CG 1 1 13 4854 1 1 8 GLN H H -8.647 0.683 -1.211 1.00 . A A . 8 GLN H 1 1 13 4855 1 1 8 GLN HA H -9.990 -0.701 -3.365 1.00 . A A . 8 GLN HA 1 1 13 4856 1 1 8 GLN HB3 H -7.822 -2.239 -3.392 1.00 . A A . 8 GLN HB3 1 1 13 4857 1 1 8 GLN HE21 H -7.827 0.956 -6.758 1.00 . A A . 8 GLN HE21 1 1 13 4858 1 1 8 GLN HE22 H -7.283 2.444 -6.058 1.00 . A A . 8 GLN HE22 1 1 13 4859 1 1 8 GLN HG3 H -8.823 -0.700 -5.249 1.00 . A A . 8 GLN HG3 1 1 13 4860 1 1 8 GLN N N -9.066 0.615 -2.117 1.00 . A A . 8 GLN N 1 1 13 4861 1 1 8 GLN NE2 N -7.525 1.478 -5.961 1.00 . A A . 8 GLN NE2 1 1 13 4862 1 1 8 GLN O O -10.658 -1.762 -1.057 1.00 . A A . 8 GLN O 1 1 13 4863 1 1 8 GLN OE1 O -7.084 1.456 -3.753 1.00 . A A . 8 GLN OE1 1 1 13 4864 1 1 9 MET C C -7.477 -4.372 0.061 1.00 . A A . 9 MET C 1 1 13 4865 1 1 9 MET CA C -8.693 -3.451 -0.050 1.00 . A A . 9 MET CA 1 1 13 4866 1 1 9 MET CB C -9.943 -4.288 -0.334 1.00 . A A . 9 MET CB 1 1 13 4867 1 1 9 MET CE C -10.533 -7.046 -3.183 1.00 . A A . 9 MET CE 1 1 13 4868 1 1 9 MET CG C -9.966 -4.764 -1.788 1.00 . A A . 9 MET CG 1 1 13 4869 1 1 9 MET H H -7.589 -2.431 -1.492 1.00 . A A . 9 MET H 1 1 13 4870 1 1 9 MET HA H -8.803 -2.872 0.866 1.00 . A A . 9 MET HA 1 1 13 4871 1 1 9 MET HB3 H -10.835 -3.697 -0.127 1.00 . A A . 9 MET HB3 1 1 13 4872 1 1 9 MET HE1 H -10.450 -6.568 -4.158 1.00 . A A . 9 MET HE1 1 1 13 4873 1 1 9 MET HE2 H -9.538 -7.312 -2.823 1.00 . A A . 9 MET HE2 1 1 13 4874 1 1 9 MET HE3 H -11.139 -7.948 -3.270 1.00 . A A . 9 MET HE3 1 1 13 4875 1 1 9 MET HG3 H -9.016 -5.234 -2.041 1.00 . A A . 9 MET HG3 1 1 13 4876 1 1 9 MET N N -8.512 -2.476 -1.110 1.00 . A A . 9 MET N 1 1 13 4877 1 1 9 MET O O -7.076 -4.748 1.162 1.00 . A A . 9 MET O 1 1 13 4878 1 1 9 MET SD S -11.302 -5.921 -2.031 1.00 . A A . 9 MET SD 1 1 13 4879 1 1 10 GLY C C -5.064 -5.495 -2.501 1.00 . A A . 10 GLY C 1 1 13 4880 1 1 10 GLY CA C -5.760 -5.580 -1.141 1.00 . A A . 10 GLY CA 1 1 13 4881 1 1 10 GLY H H -7.254 -4.400 -1.986 1.00 . A A . 10 GLY H 1 1 13 4882 1 1 10 GLY HA2 H -5.060 -5.300 -0.353 1.00 . A A . 10 GLY HA2 1 1 13 4883 1 1 10 GLY HA3 H -6.062 -6.609 -0.947 1.00 . A A . 10 GLY HA3 1 1 13 4884 1 1 10 GLY N N -6.922 -4.710 -1.094 1.00 . A A . 10 GLY N 1 1 13 4885 1 1 10 GLY O O -4.858 -6.511 -3.161 1.00 . A A . 10 GLY O 1 1 13 4886 1 1 11 ALA C C -3.137 -2.824 -4.025 1.00 . A A . 11 ALA C 1 1 13 4887 1 1 11 ALA CA C -4.057 -4.040 -4.150 1.00 . A A . 11 ALA CA 1 1 13 4888 1 1 11 ALA CB C -5.104 -3.868 -5.252 1.00 . A A . 11 ALA CB 1 1 13 4889 1 1 11 ALA H H -4.896 -3.450 -2.337 1.00 . A A . 11 ALA H 1 1 13 4890 1 1 11 ALA HA H -3.455 -4.920 -4.374 1.00 . A A . 11 ALA HA 1 1 13 4891 1 1 11 ALA HB1 H -5.480 -4.846 -5.554 1.00 . A A . 11 ALA HB1 1 1 13 4892 1 1 11 ALA HB2 H -5.929 -3.261 -4.879 1.00 . A A . 11 ALA HB2 1 1 13 4893 1 1 11 ALA HB3 H -4.649 -3.374 -6.111 1.00 . A A . 11 ALA HB3 1 1 13 4894 1 1 11 ALA N N -4.724 -4.272 -2.880 1.00 . A A . 11 ALA N 1 1 13 4895 1 1 11 ALA O O -2.040 -2.925 -3.478 1.00 . A A . 11 ALA O 1 1 13 4896 1 1 12 THR C C -2.134 -0.339 -3.147 1.00 . A A . 12 THR C 1 1 13 4897 1 1 12 THR CA C -2.853 -0.468 -4.492 1.00 . A A . 12 THR CA 1 1 13 4898 1 1 12 THR CB C -3.807 0.692 -4.785 1.00 . A A . 12 THR CB 1 1 13 4899 1 1 12 THR CG2 C -4.610 0.478 -6.069 1.00 . A A . 12 THR CG2 1 1 13 4900 1 1 12 THR H H -4.512 -1.629 -4.982 1.00 . A A . 12 THR H 1 1 13 4901 1 1 12 THR HA H -2.084 -0.511 -5.262 1.00 . A A . 12 THR HA 1 1 13 4902 1 1 12 THR HB H -3.270 1.639 -4.814 1.00 . A A . 12 THR HB 1 1 13 4903 1 1 12 THR HG1 H -5.111 -0.330 -3.662 1.00 . A A . 12 THR HG1 1 1 13 4904 1 1 12 THR HG21 H -4.013 -0.090 -6.782 1.00 . A A . 12 THR HG21 1 1 13 4905 1 1 12 THR HG22 H -5.522 -0.073 -5.840 1.00 . A A . 12 THR HG22 1 1 13 4906 1 1 12 THR HG23 H -4.869 1.445 -6.501 1.00 . A A . 12 THR HG23 1 1 13 4907 1 1 12 THR N N -3.618 -1.703 -4.540 1.00 . A A . 12 THR N 1 1 13 4908 1 1 12 THR O O -0.933 -0.078 -3.104 1.00 . A A . 12 THR O 1 1 13 4909 1 1 12 THR OG1 O -4.781 0.610 -3.748 1.00 . A A . 12 THR OG1 1 1 13 4910 1 1 13 ALA C C -0.963 -1.080 -0.715 1.00 . A A . 13 ALA C 1 1 13 4911 1 1 13 ALA CA C -2.351 -0.434 -0.740 1.00 . A A . 13 ALA CA 1 1 13 4912 1 1 13 ALA CB C -3.316 -1.086 0.252 1.00 . A A . 13 ALA CB 1 1 13 4913 1 1 13 ALA H H -3.876 -0.739 -2.125 1.00 . A A . 13 ALA H 1 1 13 4914 1 1 13 ALA HA H -2.255 0.623 -0.493 1.00 . A A . 13 ALA HA 1 1 13 4915 1 1 13 ALA HB1 H -4.105 -1.601 -0.294 1.00 . A A . 13 ALA HB1 1 1 13 4916 1 1 13 ALA HB2 H -2.773 -1.804 0.868 1.00 . A A . 13 ALA HB2 1 1 13 4917 1 1 13 ALA HB3 H -3.754 -0.319 0.890 1.00 . A A . 13 ALA HB3 1 1 13 4918 1 1 13 ALA N N -2.900 -0.527 -2.082 1.00 . A A . 13 ALA N 1 1 13 4919 1 1 13 ALA O O -0.047 -0.567 -0.075 1.00 . A A . 13 ALA O 1 1 13 4920 1 1 14 ILE C C 1.539 -1.932 -1.776 1.00 . A A . 14 ILE C 1 1 13 4921 1 1 14 ILE CA C 0.406 -2.918 -1.487 1.00 . A A . 14 ILE CA 1 1 13 4922 1 1 14 ILE CB C 0.315 -4.063 -2.497 1.00 . A A . 14 ILE CB 1 1 13 4923 1 1 14 ILE CD1 C -1.159 -5.955 -3.274 1.00 . A A . 14 ILE CD1 1 1 13 4924 1 1 14 ILE CG1 C -0.765 -5.068 -2.092 1.00 . A A . 14 ILE CG1 1 1 13 4925 1 1 14 ILE CG2 C 1.677 -4.733 -2.692 1.00 . A A . 14 ILE CG2 1 1 13 4926 1 1 14 ILE H H -1.604 -2.608 -1.937 1.00 . A A . 14 ILE H 1 1 13 4927 1 1 14 ILE HA H 0.579 -3.366 -0.507 1.00 . A A . 14 ILE HA 1 1 13 4928 1 1 14 ILE HB H 0.021 -3.645 -3.461 1.00 . A A . 14 ILE HB 1 1 13 4929 1 1 14 ILE HD11 H -1.950 -6.641 -2.967 1.00 . A A . 14 ILE HD11 1 1 13 4930 1 1 14 ILE HD12 H -1.518 -5.331 -4.093 1.00 . A A . 14 ILE HD12 1 1 13 4931 1 1 14 ILE HD13 H -0.292 -6.527 -3.605 1.00 . A A . 14 ILE HD13 1 1 13 4932 1 1 14 ILE HG13 H -1.642 -4.536 -1.723 1.00 . A A . 14 ILE HG13 1 1 13 4933 1 1 14 ILE HG21 H 1.576 -5.566 -3.387 1.00 . A A . 14 ILE HG21 1 1 13 4934 1 1 14 ILE HG22 H 2.385 -4.008 -3.093 1.00 . A A . 14 ILE HG22 1 1 13 4935 1 1 14 ILE HG23 H 2.040 -5.102 -1.732 1.00 . A A . 14 ILE HG23 1 1 13 4936 1 1 14 ILE N N -0.853 -2.197 -1.420 1.00 . A A . 14 ILE N 1 1 13 4937 1 1 14 ILE O O 2.533 -1.892 -1.051 1.00 . A A . 14 ILE O 1 1 13 4938 1 1 15 LYS C C 2.785 0.621 -1.998 1.00 . A A . 15 LYS C 1 1 13 4939 1 1 15 LYS CA C 2.347 -0.175 -3.229 1.00 . A A . 15 LYS CA 1 1 13 4940 1 1 15 LYS CB C 1.814 0.698 -4.368 1.00 . A A . 15 LYS CB 1 1 13 4941 1 1 15 LYS CD C 2.053 2.987 -3.338 1.00 . A A . 15 LYS CD 1 1 13 4942 1 1 15 LYS CE C 1.574 4.387 -3.727 1.00 . A A . 15 LYS CE 1 1 13 4943 1 1 15 LYS CG C 1.072 1.918 -3.823 1.00 . A A . 15 LYS CG 1 1 13 4944 1 1 15 LYS H H 0.541 -1.197 -3.419 1.00 . A A . 15 LYS H 1 1 13 4945 1 1 15 LYS HA H 3.209 -0.718 -3.615 1.00 . A A . 15 LYS HA 1 1 13 4946 1 1 15 LYS HB3 H 1.146 0.112 -4.999 1.00 . A A . 15 LYS HB3 1 1 13 4947 1 1 15 LYS HD3 H 3.038 2.804 -3.768 1.00 . A A . 15 LYS HD3 1 1 13 4948 1 1 15 LYS HE3 H 1.160 4.370 -4.734 1.00 . A A . 15 LYS HE3 1 1 13 4949 1 1 15 LYS HG3 H 0.423 1.616 -3.001 1.00 . A A . 15 LYS HG3 1 1 13 4950 1 1 15 LYS HZ1 H 0.854 5.731 -2.365 1.00 . A A . 15 LYS HZ1 1 1 13 4951 1 1 15 LYS HZ2 H -0.313 5.015 -3.254 1.00 . A A . 15 LYS HZ2 1 1 13 4952 1 1 15 LYS HZ3 H 0.421 4.189 -2.051 1.00 . A A . 15 LYS HZ3 1 1 13 4953 1 1 15 LYS N N 1.352 -1.159 -2.835 1.00 . A A . 15 LYS N 1 1 13 4954 1 1 15 LYS NZ N 0.551 4.869 -2.772 1.00 . A A . 15 LYS NZ 1 1 13 4955 1 1 15 LYS O O 3.969 0.903 -1.826 1.00 . A A . 15 LYS O 1 1 13 4956 1 1 16 GLN C C 3.127 1.003 0.888 1.00 . A A . 16 GLN C 1 1 13 4957 1 1 16 GLN CA C 2.076 1.719 0.037 1.00 . A A . 16 GLN CA 1 1 13 4958 1 1 16 GLN CB C 0.791 1.954 0.835 1.00 . A A . 16 GLN CB 1 1 13 4959 1 1 16 GLN CD C -0.310 3.642 2.351 1.00 . A A . 16 GLN CD 1 1 13 4960 1 1 16 GLN CG C 0.597 3.442 1.136 1.00 . A A . 16 GLN CG 1 1 13 4961 1 1 16 GLN H H 0.844 0.728 -1.319 1.00 . A A . 16 GLN H 1 1 13 4962 1 1 16 GLN HA H 2.465 2.679 -0.303 1.00 . A A . 16 GLN HA 1 1 13 4963 1 1 16 GLN HB3 H 0.831 1.393 1.768 1.00 . A A . 16 GLN HB3 1 1 13 4964 1 1 16 GLN HE21 H 1.073 2.691 3.482 1.00 . A A . 16 GLN HE21 1 1 13 4965 1 1 16 GLN HE22 H -0.337 3.226 4.333 1.00 . A A . 16 GLN HE22 1 1 13 4966 1 1 16 GLN HG3 H 0.164 3.938 0.267 1.00 . A A . 16 GLN HG3 1 1 13 4967 1 1 16 GLN N N 1.806 0.962 -1.173 1.00 . A A . 16 GLN N 1 1 13 4968 1 1 16 GLN NE2 N 0.183 3.145 3.482 1.00 . A A . 16 GLN NE2 1 1 13 4969 1 1 16 GLN O O 4.052 1.634 1.397 1.00 . A A . 16 GLN O 1 1 13 4970 1 1 16 GLN OE1 O -1.388 4.209 2.268 1.00 . A A . 16 GLN OE1 1 1 13 4971 1 1 17 VAL C C 5.293 -0.906 1.271 1.00 . A A . 17 VAL C 1 1 13 4972 1 1 17 VAL CA C 3.870 -1.111 1.797 1.00 . A A . 17 VAL CA 1 1 13 4973 1 1 17 VAL CB C 3.429 -2.576 1.775 1.00 . A A . 17 VAL CB 1 1 13 4974 1 1 17 VAL CG1 C 3.895 -3.268 0.492 1.00 . A A . 17 VAL CG1 1 1 13 4975 1 1 17 VAL CG2 C 3.934 -3.319 3.013 1.00 . A A . 17 VAL CG2 1 1 13 4976 1 1 17 VAL H H 2.193 -0.808 0.599 1.00 . A A . 17 VAL H 1 1 13 4977 1 1 17 VAL HA H 3.823 -0.760 2.828 1.00 . A A . 17 VAL HA 1 1 13 4978 1 1 17 VAL HB H 2.340 -2.599 1.791 1.00 . A A . 17 VAL HB 1 1 13 4979 1 1 17 VAL HG11 H 3.039 -3.727 -0.004 1.00 . A A . 17 VAL HG11 1 1 13 4980 1 1 17 VAL HG12 H 4.351 -2.535 -0.172 1.00 . A A . 17 VAL HG12 1 1 13 4981 1 1 17 VAL HG13 H 4.626 -4.038 0.740 1.00 . A A . 17 VAL HG13 1 1 13 4982 1 1 17 VAL HG21 H 3.709 -4.382 2.916 1.00 . A A . 17 VAL HG21 1 1 13 4983 1 1 17 VAL HG22 H 5.011 -3.182 3.105 1.00 . A A . 17 VAL HG22 1 1 13 4984 1 1 17 VAL HG23 H 3.440 -2.923 3.901 1.00 . A A . 17 VAL HG23 1 1 13 4985 1 1 17 VAL N N 2.948 -0.302 1.016 1.00 . A A . 17 VAL N 1 1 13 4986 1 1 17 VAL O O 6.252 -0.937 2.040 1.00 . A A . 17 VAL O 1 1 13 4987 1 1 18 LYS C C 7.285 0.811 -0.154 1.00 . A A . 18 LYS C 1 1 13 4988 1 1 18 LYS CA C 6.671 -0.490 -0.672 1.00 . A A . 18 LYS CA 1 1 13 4989 1 1 18 LYS CB C 6.531 -0.542 -2.194 1.00 . A A . 18 LYS CB 1 1 13 4990 1 1 18 LYS CD C 6.569 1.872 -2.925 1.00 . A A . 18 LYS CD 1 1 13 4991 1 1 18 LYS CE C 5.814 1.991 -4.251 1.00 . A A . 18 LYS CE 1 1 13 4992 1 1 18 LYS CG C 7.357 0.561 -2.859 1.00 . A A . 18 LYS CG 1 1 13 4993 1 1 18 LYS H H 4.596 -0.676 -0.653 1.00 . A A . 18 LYS H 1 1 13 4994 1 1 18 LYS HA H 7.319 -1.318 -0.380 1.00 . A A . 18 LYS HA 1 1 13 4995 1 1 18 LYS HB3 H 5.482 -0.431 -2.470 1.00 . A A . 18 LYS HB3 1 1 13 4996 1 1 18 LYS HD3 H 7.250 2.716 -2.813 1.00 . A A . 18 LYS HD3 1 1 13 4997 1 1 18 LYS HE3 H 4.857 1.474 -4.178 1.00 . A A . 18 LYS HE3 1 1 13 4998 1 1 18 LYS HG3 H 7.642 0.252 -3.864 1.00 . A A . 18 LYS HG3 1 1 13 4999 1 1 18 LYS HZ1 H 5.951 3.595 -5.509 1.00 . A A . 18 LYS HZ1 1 1 13 5000 1 1 18 LYS HZ2 H 4.610 3.611 -4.577 1.00 . A A . 18 LYS HZ2 1 1 13 5001 1 1 18 LYS HZ3 H 6.060 3.994 -3.929 1.00 . A A . 18 LYS HZ3 1 1 13 5002 1 1 18 LYS N N 5.383 -0.700 -0.035 1.00 . A A . 18 LYS N 1 1 13 5003 1 1 18 LYS NZ N 5.591 3.413 -4.595 1.00 . A A . 18 LYS NZ 1 1 13 5004 1 1 18 LYS O O 8.500 0.905 0.016 1.00 . A A . 18 LYS O 1 1 13 5005 1 1 19 LYS C C 7.447 2.909 1.979 1.00 . A A . 19 LYS C 1 1 13 5006 1 1 19 LYS CA C 6.859 3.078 0.577 1.00 . A A . 19 LYS CA 1 1 13 5007 1 1 19 LYS CB C 5.719 4.096 0.506 1.00 . A A . 19 LYS CB 1 1 13 5008 1 1 19 LYS CD C 4.945 4.143 2.905 1.00 . A A . 19 LYS CD 1 1 13 5009 1 1 19 LYS CE C 3.498 4.611 3.079 1.00 . A A . 19 LYS CE 1 1 13 5010 1 1 19 LYS CG C 5.643 4.924 1.791 1.00 . A A . 19 LYS CG 1 1 13 5011 1 1 19 LYS H H 5.431 1.701 -0.060 1.00 . A A . 19 LYS H 1 1 13 5012 1 1 19 LYS HA H 7.648 3.430 -0.089 1.00 . A A . 19 LYS HA 1 1 13 5013 1 1 19 LYS HB3 H 4.773 3.579 0.346 1.00 . A A . 19 LYS HB3 1 1 13 5014 1 1 19 LYS HD3 H 5.488 4.274 3.841 1.00 . A A . 19 LYS HD3 1 1 13 5015 1 1 19 LYS HE3 H 2.884 3.786 3.439 1.00 . A A . 19 LYS HE3 1 1 13 5016 1 1 19 LYS HG3 H 5.104 5.852 1.598 1.00 . A A . 19 LYS HG3 1 1 13 5017 1 1 19 LYS HZ1 H 2.509 5.796 4.418 1.00 . A A . 19 LYS HZ1 1 1 13 5018 1 1 19 LYS HZ2 H 4.091 5.596 4.769 1.00 . A A . 19 LYS HZ2 1 1 13 5019 1 1 19 LYS HZ3 H 3.645 6.593 3.556 1.00 . A A . 19 LYS HZ3 1 1 13 5020 1 1 19 LYS N N 6.417 1.785 0.081 1.00 . A A . 19 LYS N 1 1 13 5021 1 1 19 LYS NZ N 3.430 5.741 4.032 1.00 . A A . 19 LYS NZ 1 1 13 5022 1 1 19 LYS O O 8.207 3.756 2.444 1.00 . A A . 19 LYS O 1 1 13 5023 1 1 20 LEU C C 8.833 0.686 3.862 1.00 . A A . 20 LEU C 1 1 13 5024 1 1 20 LEU CA C 7.552 1.517 3.954 1.00 . A A . 20 LEU CA 1 1 13 5025 1 1 20 LEU CB C 6.451 0.859 4.787 1.00 . A A . 20 LEU CB 1 1 13 5026 1 1 20 LEU CD1 C 7.775 -0.867 6.062 1.00 . A A . 20 LEU CD1 1 1 13 5027 1 1 20 LEU CD2 C 5.318 -1.257 5.563 1.00 . A A . 20 LEU CD2 1 1 13 5028 1 1 20 LEU CG C 6.629 -0.633 5.077 1.00 . A A . 20 LEU CG 1 1 13 5029 1 1 20 LEU H H 6.454 1.123 2.229 1.00 . A A . 20 LEU H 1 1 13 5030 1 1 20 LEU HA H 7.791 2.468 4.429 1.00 . A A . 20 LEU HA 1 1 13 5031 1 1 20 LEU HB3 H 5.500 0.998 4.271 1.00 . A A . 20 LEU HB3 1 1 13 5032 1 1 20 LEU HD11 H 8.578 -1.410 5.563 1.00 . A A . 20 LEU HD11 1 1 13 5033 1 1 20 LEU HD12 H 8.152 0.092 6.416 1.00 . A A . 20 LEU HD12 1 1 13 5034 1 1 20 LEU HD13 H 7.413 -1.450 6.908 1.00 . A A . 20 LEU HD13 1 1 13 5035 1 1 20 LEU HD21 H 4.665 -0.475 5.950 1.00 . A A . 20 LEU HD21 1 1 13 5036 1 1 20 LEU HD22 H 4.827 -1.763 4.732 1.00 . A A . 20 LEU HD22 1 1 13 5037 1 1 20 LEU HD23 H 5.531 -1.977 6.353 1.00 . A A . 20 LEU HD23 1 1 13 5038 1 1 20 LEU HG H 6.897 -1.132 4.145 1.00 . A A . 20 LEU HG 1 1 13 5039 1 1 20 LEU N N 7.072 1.808 2.614 1.00 . A A . 20 LEU N 1 1 13 5040 1 1 20 LEU O O 9.586 0.590 4.830 1.00 . A A . 20 LEU O 1 1 13 5041 1 1 21 PHE C C 11.480 0.145 2.383 1.00 . A A . 21 PHE C 1 1 13 5042 1 1 21 PHE CA C 10.219 -0.716 2.459 1.00 . A A . 21 PHE CA 1 1 13 5043 1 1 21 PHE CB C 10.016 -1.422 1.117 1.00 . A A . 21 PHE CB 1 1 13 5044 1 1 21 PHE CD1 C 9.356 -3.774 1.666 1.00 . A A . 21 PHE CD1 1 1 13 5045 1 1 21 PHE CD2 C 11.468 -3.415 0.685 1.00 . A A . 21 PHE CD2 1 1 13 5046 1 1 21 PHE CE1 C 9.612 -5.171 1.703 1.00 . A A . 21 PHE CE1 1 1 13 5047 1 1 21 PHE CE2 C 11.723 -4.811 0.722 1.00 . A A . 21 PHE CE2 1 1 13 5048 1 1 21 PHE CG C 10.290 -2.926 1.157 1.00 . A A . 21 PHE CG 1 1 13 5049 1 1 21 PHE CZ C 10.790 -5.660 1.231 1.00 . A A . 21 PHE CZ 1 1 13 5050 1 1 21 PHE H H 8.424 0.187 1.907 1.00 . A A . 21 PHE H 1 1 13 5051 1 1 21 PHE HA H 10.301 -1.407 3.299 1.00 . A A . 21 PHE HA 1 1 13 5052 1 1 21 PHE HB3 H 10.669 -0.963 0.375 1.00 . A A . 21 PHE HB3 1 1 13 5053 1 1 21 PHE HD1 H 8.413 -3.383 2.044 1.00 . A A . 21 PHE HD1 1 1 13 5054 1 1 21 PHE HD2 H 12.216 -2.735 0.277 1.00 . A A . 21 PHE HD2 1 1 13 5055 1 1 21 PHE HE1 H 8.863 -5.851 2.111 1.00 . A A . 21 PHE HE1 1 1 13 5056 1 1 21 PHE HE2 H 12.667 -5.203 0.344 1.00 . A A . 21 PHE HE2 1 1 13 5057 1 1 21 PHE HZ H 10.986 -6.732 1.259 1.00 . A A . 21 PHE HZ 1 1 13 5058 1 1 21 PHE N N 9.041 0.104 2.689 1.00 . A A . 21 PHE N 1 1 13 5059 1 1 21 PHE O O 12.593 -0.369 2.486 1.00 . A A . 21 PHE O 1 1 13 5060 1 1 22 LYS C C 13.396 2.057 3.205 1.00 . A A . 22 LYS C 1 1 13 5061 1 1 22 LYS CA C 12.372 2.377 2.115 1.00 . A A . 22 LYS CA 1 1 13 5062 1 1 22 LYS CB C 11.858 3.819 2.157 1.00 . A A . 22 LYS CB 1 1 13 5063 1 1 22 LYS CD C 10.505 3.739 4.284 1.00 . A A . 22 LYS CD 1 1 13 5064 1 1 22 LYS CE C 10.658 3.767 5.806 1.00 . A A . 22 LYS CE 1 1 13 5065 1 1 22 LYS CG C 11.745 4.318 3.598 1.00 . A A . 22 LYS CG 1 1 13 5066 1 1 22 LYS H H 10.356 1.850 2.123 1.00 . A A . 22 LYS H 1 1 13 5067 1 1 22 LYS HA H 12.845 2.232 1.143 1.00 . A A . 22 LYS HA 1 1 13 5068 1 1 22 LYS HB3 H 10.885 3.876 1.670 1.00 . A A . 22 LYS HB3 1 1 13 5069 1 1 22 LYS HD3 H 10.346 2.715 3.949 1.00 . A A . 22 LYS HD3 1 1 13 5070 1 1 22 LYS HE3 H 11.581 4.281 6.076 1.00 . A A . 22 LYS HE3 1 1 13 5071 1 1 22 LYS HG3 H 11.695 5.407 3.607 1.00 . A A . 22 LYS HG3 1 1 13 5072 1 1 22 LYS HZ1 H 8.885 4.779 5.716 1.00 . A A . 22 LYS HZ1 1 1 13 5073 1 1 22 LYS HZ2 H 9.015 3.806 7.021 1.00 . A A . 22 LYS HZ2 1 1 13 5074 1 1 22 LYS HZ3 H 9.826 5.223 6.975 1.00 . A A . 22 LYS HZ3 1 1 13 5075 1 1 22 LYS N N 11.265 1.440 2.206 1.00 . A A . 22 LYS N 1 1 13 5076 1 1 22 LYS NZ N 9.503 4.449 6.430 1.00 . A A . 22 LYS NZ 1 1 13 5077 1 1 22 LYS O O 14.601 2.096 2.961 1.00 . A A . 22 LYS O 1 1 13 5078 1 1 23 LYS C C 14.135 -0.053 5.435 1.00 . A A . 23 LYS C 1 1 13 5079 1 1 23 LYS CA C 13.734 1.422 5.515 1.00 . A A . 23 LYS CA 1 1 13 5080 1 1 23 LYS CB C 13.052 1.804 6.831 1.00 . A A . 23 LYS CB 1 1 13 5081 1 1 23 LYS CD C 10.966 1.499 8.215 1.00 . A A . 23 LYS CD 1 1 13 5082 1 1 23 LYS CE C 11.413 0.966 9.578 1.00 . A A . 23 LYS CE 1 1 13 5083 1 1 23 LYS CG C 11.828 0.923 7.090 1.00 . A A . 23 LYS CG 1 1 13 5084 1 1 23 LYS H H 11.898 1.720 4.577 1.00 . A A . 23 LYS H 1 1 13 5085 1 1 23 LYS HA H 14.634 2.031 5.430 1.00 . A A . 23 LYS HA 1 1 13 5086 1 1 23 LYS HB3 H 12.750 2.851 6.797 1.00 . A A . 23 LYS HB3 1 1 13 5087 1 1 23 LYS HD3 H 9.921 1.242 8.044 1.00 . A A . 23 LYS HD3 1 1 13 5088 1 1 23 LYS HE3 H 12.486 0.775 9.565 1.00 . A A . 23 LYS HE3 1 1 13 5089 1 1 23 LYS HG3 H 12.151 -0.084 7.354 1.00 . A A . 23 LYS HG3 1 1 13 5090 1 1 23 LYS HZ1 H 10.097 1.988 10.760 1.00 . A A . 23 LYS HZ1 1 1 13 5091 1 1 23 LYS HZ2 H 11.508 1.640 11.504 1.00 . A A . 23 LYS HZ2 1 1 13 5092 1 1 23 LYS HZ3 H 11.443 2.838 10.396 1.00 . A A . 23 LYS HZ3 1 1 13 5093 1 1 23 LYS N N 12.879 1.749 4.386 1.00 . A A . 23 LYS N 1 1 13 5094 1 1 23 LYS NZ N 11.089 1.937 10.646 1.00 . A A . 23 LYS NZ 1 1 13 5095 1 1 23 LYS O O 15.321 -0.377 5.439 1.00 . A A . 23 LYS O 1 1 13 5096 1 1 24 TRP C C 14.486 -2.577 4.282 1.00 . A A . 24 TRP C 1 1 13 5097 1 1 24 TRP CA C 13.356 -2.337 5.286 1.00 . A A . 24 TRP CA 1 1 13 5098 1 1 24 TRP CB C 12.070 -3.083 4.927 1.00 . A A . 24 TRP CB 1 1 13 5099 1 1 24 TRP CD1 C 11.104 -2.530 7.256 1.00 . A A . 24 TRP CD1 1 1 13 5100 1 1 24 TRP CD2 C 9.663 -3.574 5.937 1.00 . A A . 24 TRP CD2 1 1 13 5101 1 1 24 TRP CE2 C 9.027 -3.340 7.139 1.00 . A A . 24 TRP CE2 1 1 13 5102 1 1 24 TRP CE3 C 9.008 -4.228 4.878 1.00 . A A . 24 TRP CE3 1 1 13 5103 1 1 24 TRP CG C 11.003 -3.047 6.024 1.00 . A A . 24 TRP CG 1 1 13 5104 1 1 24 TRP CH2 C 7.035 -4.378 6.355 1.00 . A A . 24 TRP CH2 1 1 13 5105 1 1 24 TRP CZ2 C 7.705 -3.726 7.396 1.00 . A A . 24 TRP CZ2 1 1 13 5106 1 1 24 TRP CZ3 C 7.689 -4.607 5.150 1.00 . A A . 24 TRP CZ3 1 1 13 5107 1 1 24 TRP H H 12.161 -0.632 5.363 1.00 . A A . 24 TRP H 1 1 13 5108 1 1 24 TRP HA H 13.657 -2.681 6.275 1.00 . A A . 24 TRP HA 1 1 13 5109 1 1 24 TRP HB3 H 12.314 -4.121 4.704 1.00 . A A . 24 TRP HB3 1 1 13 5110 1 1 24 TRP HD1 H 12.000 -2.048 7.648 1.00 . A A . 24 TRP HD1 1 1 13 5111 1 1 24 TRP HE1 H 9.749 -2.354 8.989 1.00 . A A . 24 TRP HE1 1 1 13 5112 1 1 24 TRP HE3 H 9.489 -4.424 3.919 1.00 . A A . 24 TRP HE3 1 1 13 5113 1 1 24 TRP HH2 H 6.003 -4.705 6.489 1.00 . A A . 24 TRP HH2 1 1 13 5114 1 1 24 TRP HZ2 H 7.226 -3.529 8.355 1.00 . A A . 24 TRP HZ2 1 1 13 5115 1 1 24 TRP HZ3 H 7.135 -5.118 4.362 1.00 . A A . 24 TRP HZ3 1 1 13 5116 1 1 24 TRP N N 13.123 -0.905 5.366 1.00 . A A . 24 TRP N 1 1 13 5117 1 1 24 TRP NE1 N 9.931 -2.685 7.967 1.00 . A A . 24 TRP NE1 1 1 13 5118 1 1 24 TRP O O 14.390 -2.169 3.125 1.00 . A A . 24 TRP O 1 1 13 5119 1 1 25 GLY C C 17.738 -4.318 4.697 1.00 . A A . 25 GLY C 1 1 13 5120 1 1 25 GLY CA C 16.676 -3.537 3.919 1.00 . A A . 25 GLY CA 1 1 13 5121 1 1 25 GLY H H 15.599 -3.567 5.702 1.00 . A A . 25 GLY H 1 1 13 5122 1 1 25 GLY HA2 H 16.355 -4.116 3.054 1.00 . A A . 25 GLY HA2 1 1 13 5123 1 1 25 GLY HA3 H 17.106 -2.610 3.541 1.00 . A A . 25 GLY HA3 1 1 13 5124 1 1 25 GLY N N 15.529 -3.239 4.760 1.00 . A A . 25 GLY N 1 1 13 5125 1 1 25 GLY O O 18.379 -3.775 5.595 1.00 . A A . 25 GLY O 1 1 13 5126 1 1 26 TRP C C 20.259 -5.958 4.582 1.00 . A A . 26 TRP C 1 1 13 5127 1 1 26 TRP CA C 18.862 -6.441 4.975 1.00 . A A . 26 TRP CA 1 1 13 5128 1 1 26 TRP CB C 18.617 -7.910 4.622 1.00 . A A . 26 TRP CB 1 1 13 5129 1 1 26 TRP CD1 C 19.686 -7.592 2.295 1.00 . A A . 26 TRP CD1 1 1 13 5130 1 1 26 TRP CD2 C 19.601 -9.711 2.937 1.00 . A A . 26 TRP CD2 1 1 13 5131 1 1 26 TRP CE2 C 20.189 -9.680 1.688 1.00 . A A . 26 TRP CE2 1 1 13 5132 1 1 26 TRP CE3 C 19.401 -10.921 3.623 1.00 . A A . 26 TRP CE3 1 1 13 5133 1 1 26 TRP CG C 19.280 -8.356 3.318 1.00 . A A . 26 TRP CG 1 1 13 5134 1 1 26 TRP CH2 C 20.435 -12.047 1.684 1.00 . A A . 26 TRP CH2 1 1 13 5135 1 1 26 TRP CZ2 C 20.624 -10.830 1.018 1.00 . A A . 26 TRP CZ2 1 1 13 5136 1 1 26 TRP CZ3 C 19.842 -12.061 2.940 1.00 . A A . 26 TRP CZ3 1 1 13 5137 1 1 26 TRP H H 17.364 -6.014 3.593 1.00 . A A . 26 TRP H 1 1 13 5138 1 1 26 TRP HA H 18.724 -6.345 6.052 1.00 . A A . 26 TRP HA 1 1 13 5139 1 1 26 TRP HB3 H 17.543 -8.080 4.549 1.00 . A A . 26 TRP HB3 1 1 13 5140 1 1 26 TRP HD1 H 19.588 -6.506 2.264 1.00 . A A . 26 TRP HD1 1 1 13 5141 1 1 26 TRP HE1 H 20.648 -7.977 0.346 1.00 . A A . 26 TRP HE1 1 1 13 5142 1 1 26 TRP HE3 H 18.940 -10.971 4.609 1.00 . A A . 26 TRP HE3 1 1 13 5143 1 1 26 TRP HH2 H 20.752 -12.980 1.217 1.00 . A A . 26 TRP HH2 1 1 13 5144 1 1 26 TRP HZ2 H 21.086 -10.779 0.033 1.00 . A A . 26 TRP HZ2 1 1 13 5145 1 1 26 TRP HZ3 H 19.711 -13.026 3.428 1.00 . A A . 26 TRP HZ3 1 1 13 5146 1 1 26 TRP N N 17.889 -5.580 4.324 1.00 . A A . 26 TRP N 1 1 13 5147 1 1 26 TRP NE1 N 20.242 -8.350 1.286 1.00 . A A . 26 TRP NE1 1 1 13 5148 1 1 26 TRP O O 20.609 -4.801 4.816 1.00 . A A . 26 TRP O 1 1 14 5149 1 1 1 LYS C C -2.952 10.503 -0.208 1.00 . A A . 1 LYS C 1 1 14 5150 1 1 1 LYS CA C -4.197 10.684 -1.079 1.00 . A A . 1 LYS CA 1 1 14 5151 1 1 1 LYS CB C -4.633 12.142 -1.234 1.00 . A A . 1 LYS CB 1 1 14 5152 1 1 1 LYS CD C -4.131 14.307 -2.424 1.00 . A A . 1 LYS CD 1 1 14 5153 1 1 1 LYS CE C -5.309 14.751 -3.293 1.00 . A A . 1 LYS CE 1 1 14 5154 1 1 1 LYS CG C -3.970 12.786 -2.453 1.00 . A A . 1 LYS CG 1 1 14 5155 1 1 1 LYS H1 H -5.941 9.553 -1.214 1.00 . A A . 1 LYS H1 1 1 14 5156 1 1 1 LYS HA H -3.977 10.305 -2.078 1.00 . A A . 1 LYS HA 1 1 14 5157 1 1 1 LYS HB3 H -4.371 12.701 -0.335 1.00 . A A . 1 LYS HB3 1 1 14 5158 1 1 1 LYS HD3 H -3.215 14.780 -2.779 1.00 . A A . 1 LYS HD3 1 1 14 5159 1 1 1 LYS HE3 H -5.966 15.405 -2.719 1.00 . A A . 1 LYS HE3 1 1 14 5160 1 1 1 LYS HG3 H -4.414 12.387 -3.365 1.00 . A A . 1 LYS HG3 1 1 14 5161 1 1 1 LYS HZ1 H -5.609 15.788 -5.029 1.00 . A A . 1 LYS HZ1 1 1 14 5162 1 1 1 LYS HZ2 H -4.259 16.236 -4.226 1.00 . A A . 1 LYS HZ2 1 1 14 5163 1 1 1 LYS HZ3 H -4.284 14.832 -5.059 1.00 . A A . 1 LYS HZ3 1 1 14 5164 1 1 1 LYS N N -5.281 9.882 -0.539 1.00 . A A . 1 LYS N 1 1 14 5165 1 1 1 LYS NZ N -4.826 15.459 -4.499 1.00 . A A . 1 LYS NZ 1 1 14 5166 1 1 1 LYS O O -2.643 11.354 0.625 1.00 . A A . 1 LYS O 1 1 14 5167 1 1 2 SER C C -1.408 8.903 1.805 1.00 . A A . 2 SER C 1 1 14 5168 1 1 2 SER CA C -1.066 9.086 0.325 1.00 . A A . 2 SER CA 1 1 14 5169 1 1 2 SER CB C -0.017 10.187 0.154 1.00 . A A . 2 SER CB 1 1 14 5170 1 1 2 SER H H -2.527 8.701 -1.108 1.00 . A A . 2 SER H 1 1 14 5171 1 1 2 SER HA H -0.686 8.156 -0.098 1.00 . A A . 2 SER HA 1 1 14 5172 1 1 2 SER HB3 H -0.436 11.139 0.478 1.00 . A A . 2 SER HB3 1 1 14 5173 1 1 2 SER HG H 1.843 10.637 0.742 1.00 . A A . 2 SER HG 1 1 14 5174 1 1 2 SER N N -2.270 9.388 -0.430 1.00 . A A . 2 SER N 1 1 14 5175 1 1 2 SER O O -1.674 9.876 2.509 1.00 . A A . 2 SER O 1 1 14 5176 1 1 2 SER OG O 1.169 9.914 0.896 1.00 . A A . 2 SER OG 1 1 14 5177 1 1 3 SER C C -3.045 7.928 4.009 1.00 . A A . 3 SER C 1 1 14 5178 1 1 3 SER CA C -1.694 7.327 3.617 1.00 . A A . 3 SER CA 1 1 14 5179 1 1 3 SER CB C -0.596 7.833 4.556 1.00 . A A . 3 SER CB 1 1 14 5180 1 1 3 SER H H -1.171 6.863 1.655 1.00 . A A . 3 SER H 1 1 14 5181 1 1 3 SER HA H -1.732 6.239 3.658 1.00 . A A . 3 SER HA 1 1 14 5182 1 1 3 SER HB3 H -0.836 8.844 4.883 1.00 . A A . 3 SER HB3 1 1 14 5183 1 1 3 SER HG H 0.303 7.334 6.272 1.00 . A A . 3 SER HG 1 1 14 5184 1 1 3 SER N N -1.389 7.650 2.234 1.00 . A A . 3 SER N 1 1 14 5185 1 1 3 SER O O -3.136 9.117 4.308 1.00 . A A . 3 SER O 1 1 14 5186 1 1 3 SER OG O -0.437 6.991 5.695 1.00 . A A . 3 SER OG 1 1 14 5187 1 1 4 ALA C C -6.073 6.433 5.203 1.00 . A A . 4 ALA C 1 1 14 5188 1 1 4 ALA CA C -5.403 7.509 4.345 1.00 . A A . 4 ALA CA 1 1 14 5189 1 1 4 ALA CB C -6.192 7.811 3.069 1.00 . A A . 4 ALA CB 1 1 14 5190 1 1 4 ALA H H -3.978 6.110 3.751 1.00 . A A . 4 ALA H 1 1 14 5191 1 1 4 ALA HA H -5.315 8.424 4.929 1.00 . A A . 4 ALA HA 1 1 14 5192 1 1 4 ALA HB1 H -7.184 8.176 3.333 1.00 . A A . 4 ALA HB1 1 1 14 5193 1 1 4 ALA HB2 H -5.667 8.570 2.490 1.00 . A A . 4 ALA HB2 1 1 14 5194 1 1 4 ALA HB3 H -6.285 6.902 2.476 1.00 . A A . 4 ALA HB3 1 1 14 5195 1 1 4 ALA N N -4.061 7.077 3.995 1.00 . A A . 4 ALA N 1 1 14 5196 1 1 4 ALA O O -6.187 6.586 6.418 1.00 . A A . 4 ALA O 1 1 14 5197 1 1 5 TYR C C -7.415 3.105 4.266 1.00 . A A . 5 TYR C 1 1 14 5198 1 1 5 TYR CA C -7.153 4.269 5.223 1.00 . A A . 5 TYR CA 1 1 14 5199 1 1 5 TYR CB C -8.492 4.818 5.718 1.00 . A A . 5 TYR CB 1 1 14 5200 1 1 5 TYR CD1 C -8.210 4.395 8.189 1.00 . A A . 5 TYR CD1 1 1 14 5201 1 1 5 TYR CD2 C -8.708 6.620 7.470 1.00 . A A . 5 TYR CD2 1 1 14 5202 1 1 5 TYR CE1 C -8.189 4.842 9.557 1.00 . A A . 5 TYR CE1 1 1 14 5203 1 1 5 TYR CE2 C -8.687 7.067 8.839 1.00 . A A . 5 TYR CE2 1 1 14 5204 1 1 5 TYR CG C -8.469 5.293 7.173 1.00 . A A . 5 TYR CG 1 1 14 5205 1 1 5 TYR CZ C -8.429 6.156 9.814 1.00 . A A . 5 TYR CZ 1 1 14 5206 1 1 5 TYR H H -6.401 5.253 3.549 1.00 . A A . 5 TYR H 1 1 14 5207 1 1 5 TYR HA H -6.493 3.930 6.023 1.00 . A A . 5 TYR HA 1 1 14 5208 1 1 5 TYR HB3 H -9.252 4.044 5.612 1.00 . A A . 5 TYR HB3 1 1 14 5209 1 1 5 TYR HD1 H -8.022 3.347 7.954 1.00 . A A . 5 TYR HD1 1 1 14 5210 1 1 5 TYR HD2 H -8.912 7.329 6.668 1.00 . A A . 5 TYR HD2 1 1 14 5211 1 1 5 TYR HE1 H -7.986 4.143 10.369 1.00 . A A . 5 TYR HE1 1 1 14 5212 1 1 5 TYR HE2 H -8.874 8.111 9.086 1.00 . A A . 5 TYR HE2 1 1 14 5213 1 1 5 TYR HH H -9.128 6.119 11.628 1.00 . A A . 5 TYR HH 1 1 14 5214 1 1 5 TYR N N -6.497 5.370 4.537 1.00 . A A . 5 TYR N 1 1 14 5215 1 1 5 TYR O O -8.419 2.405 4.394 1.00 . A A . 5 TYR O 1 1 14 5216 1 1 5 TYR OH O -8.409 6.578 11.107 1.00 . A A . 5 TYR OH 1 1 14 5217 1 1 6 SER C C -7.140 0.595 3.022 1.00 . A A . 6 SER C 1 1 14 5218 1 1 6 SER CA C -6.616 1.865 2.349 1.00 . A A . 6 SER CA 1 1 14 5219 1 1 6 SER CB C -5.275 1.589 1.667 1.00 . A A . 6 SER CB 1 1 14 5220 1 1 6 SER H H -5.682 3.506 3.230 1.00 . A A . 6 SER H 1 1 14 5221 1 1 6 SER HA H -7.330 2.229 1.610 1.00 . A A . 6 SER HA 1 1 14 5222 1 1 6 SER HB3 H -5.035 2.411 0.991 1.00 . A A . 6 SER HB3 1 1 14 5223 1 1 6 SER HG H -3.680 0.619 2.388 1.00 . A A . 6 SER HG 1 1 14 5224 1 1 6 SER N N -6.496 2.932 3.327 1.00 . A A . 6 SER N 1 1 14 5225 1 1 6 SER O O -6.704 0.244 4.117 1.00 . A A . 6 SER O 1 1 14 5226 1 1 6 SER OG O -4.218 1.431 2.611 1.00 . A A . 6 SER OG 1 1 14 5227 1 1 7 LEU C C -7.807 -2.477 2.415 1.00 . A A . 7 LEU C 1 1 14 5228 1 1 7 LEU CA C -8.655 -1.283 2.857 1.00 . A A . 7 LEU CA 1 1 14 5229 1 1 7 LEU CB C -10.125 -1.388 2.445 1.00 . A A . 7 LEU CB 1 1 14 5230 1 1 7 LEU CD1 C -10.793 -2.735 0.420 1.00 . A A . 7 LEU CD1 1 1 14 5231 1 1 7 LEU CD2 C -11.461 -0.295 0.606 1.00 . A A . 7 LEU CD2 1 1 14 5232 1 1 7 LEU CG C -10.405 -1.349 0.941 1.00 . A A . 7 LEU CG 1 1 14 5233 1 1 7 LEU H H -8.416 0.233 1.448 1.00 . A A . 7 LEU H 1 1 14 5234 1 1 7 LEU HA H -8.628 -1.223 3.945 1.00 . A A . 7 LEU HA 1 1 14 5235 1 1 7 LEU HB3 H -10.673 -0.571 2.917 1.00 . A A . 7 LEU HB3 1 1 14 5236 1 1 7 LEU HD11 H -11.168 -3.341 1.245 1.00 . A A . 7 LEU HD11 1 1 14 5237 1 1 7 LEU HD12 H -11.568 -2.634 -0.340 1.00 . A A . 7 LEU HD12 1 1 14 5238 1 1 7 LEU HD13 H -9.917 -3.217 -0.016 1.00 . A A . 7 LEU HD13 1 1 14 5239 1 1 7 LEU HD21 H -11.372 0.541 1.299 1.00 . A A . 7 LEU HD21 1 1 14 5240 1 1 7 LEU HD22 H -11.310 0.060 -0.414 1.00 . A A . 7 LEU HD22 1 1 14 5241 1 1 7 LEU HD23 H -12.454 -0.736 0.694 1.00 . A A . 7 LEU HD23 1 1 14 5242 1 1 7 LEU HG H -9.487 -1.059 0.429 1.00 . A A . 7 LEU HG 1 1 14 5243 1 1 7 LEU N N -8.067 -0.059 2.338 1.00 . A A . 7 LEU N 1 1 14 5244 1 1 7 LEU O O -7.532 -3.375 3.210 1.00 . A A . 7 LEU O 1 1 14 5245 1 1 8 GLN C C -7.340 -4.856 0.705 1.00 . A A . 8 GLN C 1 1 14 5246 1 1 8 GLN CA C -6.603 -3.520 0.594 1.00 . A A . 8 GLN CA 1 1 14 5247 1 1 8 GLN CB C -5.239 -3.586 1.282 1.00 . A A . 8 GLN CB 1 1 14 5248 1 1 8 GLN CD C -3.782 -1.539 1.071 1.00 . A A . 8 GLN CD 1 1 14 5249 1 1 8 GLN CG C -4.169 -2.881 0.446 1.00 . A A . 8 GLN CG 1 1 14 5250 1 1 8 GLN H H -7.643 -1.716 0.510 1.00 . A A . 8 GLN H 1 1 14 5251 1 1 8 GLN HA H -6.462 -3.260 -0.455 1.00 . A A . 8 GLN HA 1 1 14 5252 1 1 8 GLN HB3 H -4.957 -4.627 1.438 1.00 . A A . 8 GLN HB3 1 1 14 5253 1 1 8 GLN HE21 H -2.662 -1.152 -0.570 1.00 . A A . 8 GLN HE21 1 1 14 5254 1 1 8 GLN HE22 H -2.655 0.087 0.640 1.00 . A A . 8 GLN HE22 1 1 14 5255 1 1 8 GLN HG3 H -4.540 -2.721 -0.566 1.00 . A A . 8 GLN HG3 1 1 14 5256 1 1 8 GLN N N -7.415 -2.450 1.151 1.00 . A A . 8 GLN N 1 1 14 5257 1 1 8 GLN NE2 N -2.965 -0.807 0.318 1.00 . A A . 8 GLN NE2 1 1 14 5258 1 1 8 GLN O O -7.594 -5.339 1.807 1.00 . A A . 8 GLN O 1 1 14 5259 1 1 8 GLN OE1 O -4.197 -1.191 2.163 1.00 . A A . 8 GLN OE1 1 1 14 5260 1 1 9 MET C C -8.211 -7.347 -1.871 1.00 . A A . 9 MET C 1 1 14 5261 1 1 9 MET CA C -8.362 -6.687 -0.499 1.00 . A A . 9 MET CA 1 1 14 5262 1 1 9 MET CB C -9.846 -6.464 -0.201 1.00 . A A . 9 MET CB 1 1 14 5263 1 1 9 MET CE C -11.053 -8.479 2.669 1.00 . A A . 9 MET CE 1 1 14 5264 1 1 9 MET CG C -10.087 -6.316 1.302 1.00 . A A . 9 MET CG 1 1 14 5265 1 1 9 MET H H -7.449 -5.016 -1.344 1.00 . A A . 9 MET H 1 1 14 5266 1 1 9 MET HA H -7.893 -7.309 0.264 1.00 . A A . 9 MET HA 1 1 14 5267 1 1 9 MET HB3 H -10.428 -7.301 -0.585 1.00 . A A . 9 MET HB3 1 1 14 5268 1 1 9 MET HE1 H -11.647 -8.597 3.575 1.00 . A A . 9 MET HE1 1 1 14 5269 1 1 9 MET HE2 H -11.144 -9.376 2.056 1.00 . A A . 9 MET HE2 1 1 14 5270 1 1 9 MET HE3 H -10.007 -8.326 2.937 1.00 . A A . 9 MET HE3 1 1 14 5271 1 1 9 MET HG3 H -10.091 -5.261 1.577 1.00 . A A . 9 MET HG3 1 1 14 5272 1 1 9 MET N N -7.661 -5.416 -0.452 1.00 . A A . 9 MET N 1 1 14 5273 1 1 9 MET O O -7.922 -8.539 -1.963 1.00 . A A . 9 MET O 1 1 14 5274 1 1 9 MET SD S -11.643 -7.067 1.750 1.00 . A A . 9 MET SD 1 1 14 5275 1 1 10 GLY C C -7.069 -7.923 -4.431 1.00 . A A . 10 GLY C 1 1 14 5276 1 1 10 GLY CA C -8.302 -7.033 -4.268 1.00 . A A . 10 GLY CA 1 1 14 5277 1 1 10 GLY H H -8.648 -5.574 -2.821 1.00 . A A . 10 GLY H 1 1 14 5278 1 1 10 GLY HA2 H -9.199 -7.595 -4.530 1.00 . A A . 10 GLY HA2 1 1 14 5279 1 1 10 GLY HA3 H -8.242 -6.191 -4.957 1.00 . A A . 10 GLY HA3 1 1 14 5280 1 1 10 GLY N N -8.413 -6.542 -2.905 1.00 . A A . 10 GLY N 1 1 14 5281 1 1 10 GLY O O -7.125 -9.123 -4.167 1.00 . A A . 10 GLY O 1 1 14 5282 1 1 11 ALA C C -3.641 -7.034 -5.469 1.00 . A A . 11 ALA C 1 1 14 5283 1 1 11 ALA CA C -4.738 -8.023 -5.070 1.00 . A A . 11 ALA CA 1 1 14 5284 1 1 11 ALA CB C -4.947 -9.117 -6.121 1.00 . A A . 11 ALA CB 1 1 14 5285 1 1 11 ALA H H -5.946 -6.326 -5.081 1.00 . A A . 11 ALA H 1 1 14 5286 1 1 11 ALA HA H -4.468 -8.490 -4.124 1.00 . A A . 11 ALA HA 1 1 14 5287 1 1 11 ALA HB1 H -6.008 -9.359 -6.187 1.00 . A A . 11 ALA HB1 1 1 14 5288 1 1 11 ALA HB2 H -4.593 -8.763 -7.089 1.00 . A A . 11 ALA HB2 1 1 14 5289 1 1 11 ALA HB3 H -4.388 -10.007 -5.832 1.00 . A A . 11 ALA HB3 1 1 14 5290 1 1 11 ALA N N -5.983 -7.301 -4.868 1.00 . A A . 11 ALA N 1 1 14 5291 1 1 11 ALA O O -2.599 -6.963 -4.819 1.00 . A A . 11 ALA O 1 1 14 5292 1 1 12 THR C C -2.689 -4.253 -5.960 1.00 . A A . 12 THR C 1 1 14 5293 1 1 12 THR CA C -2.960 -5.315 -7.028 1.00 . A A . 12 THR CA 1 1 14 5294 1 1 12 THR CB C -3.510 -4.737 -8.334 1.00 . A A . 12 THR CB 1 1 14 5295 1 1 12 THR CG2 C -3.939 -5.825 -9.321 1.00 . A A . 12 THR CG2 1 1 14 5296 1 1 12 THR H H -4.761 -6.360 -7.059 1.00 . A A . 12 THR H 1 1 14 5297 1 1 12 THR HA H -2.015 -5.821 -7.224 1.00 . A A . 12 THR HA 1 1 14 5298 1 1 12 THR HB H -2.791 -4.058 -8.792 1.00 . A A . 12 THR HB 1 1 14 5299 1 1 12 THR HG1 H -4.599 -3.128 -7.855 1.00 . A A . 12 THR HG1 1 1 14 5300 1 1 12 THR HG21 H -4.911 -6.220 -9.026 1.00 . A A . 12 THR HG21 1 1 14 5301 1 1 12 THR HG22 H -4.008 -5.400 -10.323 1.00 . A A . 12 THR HG22 1 1 14 5302 1 1 12 THR HG23 H -3.204 -6.629 -9.317 1.00 . A A . 12 THR HG23 1 1 14 5303 1 1 12 THR N N -3.911 -6.296 -6.535 1.00 . A A . 12 THR N 1 1 14 5304 1 1 12 THR O O -1.535 -3.930 -5.680 1.00 . A A . 12 THR O 1 1 14 5305 1 1 12 THR OG1 O -4.733 -4.114 -7.950 1.00 . A A . 12 THR OG1 1 1 14 5306 1 1 13 ALA C C -2.496 -3.061 -3.435 1.00 . A A . 13 ALA C 1 1 14 5307 1 1 13 ALA CA C -3.663 -2.720 -4.363 1.00 . A A . 13 ALA CA 1 1 14 5308 1 1 13 ALA CB C -4.992 -2.610 -3.614 1.00 . A A . 13 ALA CB 1 1 14 5309 1 1 13 ALA H H -4.705 -4.007 -5.627 1.00 . A A . 13 ALA H 1 1 14 5310 1 1 13 ALA HA H -3.458 -1.770 -4.857 1.00 . A A . 13 ALA HA 1 1 14 5311 1 1 13 ALA HB1 H -5.513 -3.566 -3.657 1.00 . A A . 13 ALA HB1 1 1 14 5312 1 1 13 ALA HB2 H -4.802 -2.344 -2.574 1.00 . A A . 13 ALA HB2 1 1 14 5313 1 1 13 ALA HB3 H -5.607 -1.839 -4.079 1.00 . A A . 13 ALA HB3 1 1 14 5314 1 1 13 ALA N N -3.770 -3.739 -5.394 1.00 . A A . 13 ALA N 1 1 14 5315 1 1 13 ALA O O -1.679 -2.199 -3.114 1.00 . A A . 13 ALA O 1 1 14 5316 1 1 14 ILE C C -0.051 -4.290 -2.656 1.00 . A A . 14 ILE C 1 1 14 5317 1 1 14 ILE CA C -1.403 -4.788 -2.140 1.00 . A A . 14 ILE CA 1 1 14 5318 1 1 14 ILE CB C -1.476 -6.307 -1.974 1.00 . A A . 14 ILE CB 1 1 14 5319 1 1 14 ILE CD1 C -2.956 -8.248 -1.340 1.00 . A A . 14 ILE CD1 1 1 14 5320 1 1 14 ILE CG1 C -2.805 -6.726 -1.340 1.00 . A A . 14 ILE CG1 1 1 14 5321 1 1 14 ILE CG2 C -0.274 -6.830 -1.185 1.00 . A A . 14 ILE CG2 1 1 14 5322 1 1 14 ILE H H -3.123 -5.017 -3.292 1.00 . A A . 14 ILE H 1 1 14 5323 1 1 14 ILE HA H -1.582 -4.347 -1.160 1.00 . A A . 14 ILE HA 1 1 14 5324 1 1 14 ILE HB H -1.433 -6.761 -2.964 1.00 . A A . 14 ILE HB 1 1 14 5325 1 1 14 ILE HD11 H -2.364 -8.672 -0.529 1.00 . A A . 14 ILE HD11 1 1 14 5326 1 1 14 ILE HD12 H -4.005 -8.509 -1.199 1.00 . A A . 14 ILE HD12 1 1 14 5327 1 1 14 ILE HD13 H -2.606 -8.648 -2.293 1.00 . A A . 14 ILE HD13 1 1 14 5328 1 1 14 ILE HG13 H -3.631 -6.274 -1.889 1.00 . A A . 14 ILE HG13 1 1 14 5329 1 1 14 ILE HG21 H -0.195 -7.909 -1.319 1.00 . A A . 14 ILE HG21 1 1 14 5330 1 1 14 ILE HG22 H 0.635 -6.351 -1.547 1.00 . A A . 14 ILE HG22 1 1 14 5331 1 1 14 ILE HG23 H -0.408 -6.604 -0.127 1.00 . A A . 14 ILE HG23 1 1 14 5332 1 1 14 ILE N N -2.455 -4.322 -3.026 1.00 . A A . 14 ILE N 1 1 14 5333 1 1 14 ILE O O 0.710 -3.671 -1.914 1.00 . A A . 14 ILE O 1 1 14 5334 1 1 15 LYS C C 1.728 -2.702 -4.210 1.00 . A A . 15 LYS C 1 1 14 5335 1 1 15 LYS CA C 1.454 -4.169 -4.546 1.00 . A A . 15 LYS CA 1 1 14 5336 1 1 15 LYS CB C 1.424 -4.460 -6.048 1.00 . A A . 15 LYS CB 1 1 14 5337 1 1 15 LYS CD C 0.860 -2.199 -7.011 1.00 . A A . 15 LYS CD 1 1 14 5338 1 1 15 LYS CE C 0.685 -1.816 -8.482 1.00 . A A . 15 LYS CE 1 1 14 5339 1 1 15 LYS CG C 1.945 -3.265 -6.848 1.00 . A A . 15 LYS CG 1 1 14 5340 1 1 15 LYS H H -0.418 -5.083 -4.519 1.00 . A A . 15 LYS H 1 1 14 5341 1 1 15 LYS HA H 2.249 -4.777 -4.115 1.00 . A A . 15 LYS HA 1 1 14 5342 1 1 15 LYS HB3 H 0.404 -4.692 -6.356 1.00 . A A . 15 LYS HB3 1 1 14 5343 1 1 15 LYS HD3 H 1.124 -1.315 -6.431 1.00 . A A . 15 LYS HD3 1 1 14 5344 1 1 15 LYS HE3 H 0.887 -2.680 -9.115 1.00 . A A . 15 LYS HE3 1 1 14 5345 1 1 15 LYS HG3 H 2.282 -3.600 -7.829 1.00 . A A . 15 LYS HG3 1 1 14 5346 1 1 15 LYS HZ1 H -0.647 -0.413 -9.142 1.00 . A A . 15 LYS HZ1 1 1 14 5347 1 1 15 LYS HZ2 H -1.161 -1.949 -9.350 1.00 . A A . 15 LYS HZ2 1 1 14 5348 1 1 15 LYS HZ3 H -1.187 -1.275 -7.864 1.00 . A A . 15 LYS HZ3 1 1 14 5349 1 1 15 LYS N N 0.206 -4.580 -3.923 1.00 . A A . 15 LYS N 1 1 14 5350 1 1 15 LYS NZ N -0.689 -1.323 -8.729 1.00 . A A . 15 LYS NZ 1 1 14 5351 1 1 15 LYS O O 2.862 -2.331 -3.910 1.00 . A A . 15 LYS O 1 1 14 5352 1 1 16 GLN C C 1.395 -0.281 -2.588 1.00 . A A . 16 GLN C 1 1 14 5353 1 1 16 GLN CA C 0.783 -0.487 -3.975 1.00 . A A . 16 GLN CA 1 1 14 5354 1 1 16 GLN CB C -0.576 0.205 -4.084 1.00 . A A . 16 GLN CB 1 1 14 5355 1 1 16 GLN CD C -2.421 0.820 -5.689 1.00 . A A . 16 GLN CD 1 1 14 5356 1 1 16 GLN CG C -1.262 -0.138 -5.408 1.00 . A A . 16 GLN CG 1 1 14 5357 1 1 16 GLN H H -0.249 -2.215 -4.514 1.00 . A A . 16 GLN H 1 1 14 5358 1 1 16 GLN HA H 1.451 -0.086 -4.737 1.00 . A A . 16 GLN HA 1 1 14 5359 1 1 16 GLN HB3 H -0.446 1.284 -4.007 1.00 . A A . 16 GLN HB3 1 1 14 5360 1 1 16 GLN HE21 H -1.068 2.214 -6.261 1.00 . A A . 16 GLN HE21 1 1 14 5361 1 1 16 GLN HE22 H -2.725 2.709 -6.351 1.00 . A A . 16 GLN HE22 1 1 14 5362 1 1 16 GLN HG3 H -1.633 -1.162 -5.376 1.00 . A A . 16 GLN HG3 1 1 14 5363 1 1 16 GLN N N 0.670 -1.906 -4.270 1.00 . A A . 16 GLN N 1 1 14 5364 1 1 16 GLN NE2 N -2.040 2.014 -6.138 1.00 . A A . 16 GLN NE2 1 1 14 5365 1 1 16 GLN O O 2.274 0.562 -2.413 1.00 . A A . 16 GLN O 1 1 14 5366 1 1 16 GLN OE1 O -3.584 0.498 -5.512 1.00 . A A . 16 GLN OE1 1 1 14 5367 1 1 17 VAL C C 2.912 -1.143 -0.265 1.00 . A A . 17 VAL C 1 1 14 5368 1 1 17 VAL CA C 1.391 -0.977 -0.272 1.00 . A A . 17 VAL CA 1 1 14 5369 1 1 17 VAL CB C 0.674 -2.003 0.606 1.00 . A A . 17 VAL CB 1 1 14 5370 1 1 17 VAL CG1 C 1.313 -3.387 0.466 1.00 . A A . 17 VAL CG1 1 1 14 5371 1 1 17 VAL CG2 C 0.652 -1.555 2.069 1.00 . A A . 17 VAL CG2 1 1 14 5372 1 1 17 VAL H H 0.189 -1.746 -1.789 1.00 . A A . 17 VAL H 1 1 14 5373 1 1 17 VAL HA H 1.146 0.018 0.102 1.00 . A A . 17 VAL HA 1 1 14 5374 1 1 17 VAL HB H -0.358 -2.075 0.263 1.00 . A A . 17 VAL HB 1 1 14 5375 1 1 17 VAL HG11 H 2.069 -3.359 -0.319 1.00 . A A . 17 VAL HG11 1 1 14 5376 1 1 17 VAL HG12 H 1.779 -3.669 1.410 1.00 . A A . 17 VAL HG12 1 1 14 5377 1 1 17 VAL HG13 H 0.546 -4.117 0.207 1.00 . A A . 17 VAL HG13 1 1 14 5378 1 1 17 VAL HG21 H 1.674 -1.485 2.443 1.00 . A A . 17 VAL HG21 1 1 14 5379 1 1 17 VAL HG22 H 0.171 -0.581 2.143 1.00 . A A . 17 VAL HG22 1 1 14 5380 1 1 17 VAL HG23 H 0.097 -2.281 2.664 1.00 . A A . 17 VAL HG23 1 1 14 5381 1 1 17 VAL N N 0.905 -1.063 -1.637 1.00 . A A . 17 VAL N 1 1 14 5382 1 1 17 VAL O O 3.603 -0.541 0.555 1.00 . A A . 17 VAL O 1 1 14 5383 1 1 18 LYS C C 5.528 -0.927 -1.710 1.00 . A A . 18 LYS C 1 1 14 5384 1 1 18 LYS CA C 4.816 -2.217 -1.301 1.00 . A A . 18 LYS CA 1 1 14 5385 1 1 18 LYS CB C 5.079 -3.391 -2.246 1.00 . A A . 18 LYS CB 1 1 14 5386 1 1 18 LYS CD C 5.814 -2.320 -4.407 1.00 . A A . 18 LYS CD 1 1 14 5387 1 1 18 LYS CE C 5.518 -3.267 -5.572 1.00 . A A . 18 LYS CE 1 1 14 5388 1 1 18 LYS CG C 6.264 -3.097 -3.169 1.00 . A A . 18 LYS CG 1 1 14 5389 1 1 18 LYS H H 2.821 -2.449 -1.853 1.00 . A A . 18 LYS H 1 1 14 5390 1 1 18 LYS HA H 5.173 -2.512 -0.314 1.00 . A A . 18 LYS HA 1 1 14 5391 1 1 18 LYS HB3 H 4.189 -3.588 -2.844 1.00 . A A . 18 LYS HB3 1 1 14 5392 1 1 18 LYS HD3 H 6.591 -1.612 -4.699 1.00 . A A . 18 LYS HD3 1 1 14 5393 1 1 18 LYS HE3 H 4.996 -2.728 -6.364 1.00 . A A . 18 LYS HE3 1 1 14 5394 1 1 18 LYS HG3 H 6.734 -4.032 -3.473 1.00 . A A . 18 LYS HG3 1 1 14 5395 1 1 18 LYS HZ1 H 7.520 -3.662 -5.464 1.00 . A A . 18 LYS HZ1 1 1 14 5396 1 1 18 LYS HZ2 H 6.665 -4.832 -6.214 1.00 . A A . 18 LYS HZ2 1 1 14 5397 1 1 18 LYS HZ3 H 6.982 -3.430 -6.988 1.00 . A A . 18 LYS HZ3 1 1 14 5398 1 1 18 LYS N N 3.390 -1.963 -1.190 1.00 . A A . 18 LYS N 1 1 14 5399 1 1 18 LYS NZ N 6.773 -3.845 -6.102 1.00 . A A . 18 LYS NZ 1 1 14 5400 1 1 18 LYS O O 6.639 -0.655 -1.253 1.00 . A A . 18 LYS O 1 1 14 5401 1 1 19 LYS C C 5.517 2.073 -1.873 1.00 . A A . 19 LYS C 1 1 14 5402 1 1 19 LYS CA C 5.418 1.090 -3.040 1.00 . A A . 19 LYS CA 1 1 14 5403 1 1 19 LYS CB C 4.607 1.621 -4.224 1.00 . A A . 19 LYS CB 1 1 14 5404 1 1 19 LYS CD C 3.242 3.396 -3.064 1.00 . A A . 19 LYS CD 1 1 14 5405 1 1 19 LYS CE C 1.919 3.711 -3.764 1.00 . A A . 19 LYS CE 1 1 14 5406 1 1 19 LYS CG C 4.350 3.123 -4.083 1.00 . A A . 19 LYS CG 1 1 14 5407 1 1 19 LYS H H 3.960 -0.394 -2.932 1.00 . A A . 19 LYS H 1 1 14 5408 1 1 19 LYS HA H 6.424 0.884 -3.405 1.00 . A A . 19 LYS HA 1 1 14 5409 1 1 19 LYS HB3 H 3.657 1.090 -4.287 1.00 . A A . 19 LYS HB3 1 1 14 5410 1 1 19 LYS HD3 H 3.527 4.233 -2.427 1.00 . A A . 19 LYS HD3 1 1 14 5411 1 1 19 LYS HE3 H 1.086 3.495 -3.095 1.00 . A A . 19 LYS HE3 1 1 14 5412 1 1 19 LYS HG3 H 4.071 3.539 -5.051 1.00 . A A . 19 LYS HG3 1 1 14 5413 1 1 19 LYS HZ1 H 2.364 5.688 -3.507 1.00 . A A . 19 LYS HZ1 1 1 14 5414 1 1 19 LYS HZ2 H 2.309 5.231 -5.074 1.00 . A A . 19 LYS HZ2 1 1 14 5415 1 1 19 LYS HZ3 H 0.924 5.433 -4.233 1.00 . A A . 19 LYS HZ3 1 1 14 5416 1 1 19 LYS N N 4.862 -0.165 -2.565 1.00 . A A . 19 LYS N 1 1 14 5417 1 1 19 LYS NZ N 1.876 5.131 -4.178 1.00 . A A . 19 LYS NZ 1 1 14 5418 1 1 19 LYS O O 6.233 3.071 -1.955 1.00 . A A . 19 LYS O 1 1 14 5419 1 1 20 LEU C C 5.785 2.049 1.389 1.00 . A A . 20 LEU C 1 1 14 5420 1 1 20 LEU CA C 4.785 2.602 0.371 1.00 . A A . 20 LEU CA 1 1 14 5421 1 1 20 LEU CB C 3.365 2.749 0.921 1.00 . A A . 20 LEU CB 1 1 14 5422 1 1 20 LEU CD1 C 3.761 2.649 3.409 1.00 . A A . 20 LEU CD1 1 1 14 5423 1 1 20 LEU CD2 C 1.558 1.854 2.435 1.00 . A A . 20 LEU CD2 1 1 14 5424 1 1 20 LEU CG C 3.065 1.991 2.217 1.00 . A A . 20 LEU CG 1 1 14 5425 1 1 20 LEU H H 4.209 0.945 -0.753 1.00 . A A . 20 LEU H 1 1 14 5426 1 1 20 LEU HA H 5.117 3.594 0.066 1.00 . A A . 20 LEU HA 1 1 14 5427 1 1 20 LEU HB3 H 2.664 2.413 0.157 1.00 . A A . 20 LEU HB3 1 1 14 5428 1 1 20 LEU HD11 H 3.020 2.899 4.170 1.00 . A A . 20 LEU HD11 1 1 14 5429 1 1 20 LEU HD12 H 4.493 1.960 3.830 1.00 . A A . 20 LEU HD12 1 1 14 5430 1 1 20 LEU HD13 H 4.264 3.559 3.081 1.00 . A A . 20 LEU HD13 1 1 14 5431 1 1 20 LEU HD21 H 1.040 1.962 1.482 1.00 . A A . 20 LEU HD21 1 1 14 5432 1 1 20 LEU HD22 H 1.340 0.873 2.858 1.00 . A A . 20 LEU HD22 1 1 14 5433 1 1 20 LEU HD23 H 1.218 2.630 3.122 1.00 . A A . 20 LEU HD23 1 1 14 5434 1 1 20 LEU HG H 3.470 0.983 2.124 1.00 . A A . 20 LEU HG 1 1 14 5435 1 1 20 LEU N N 4.789 1.758 -0.811 1.00 . A A . 20 LEU N 1 1 14 5436 1 1 20 LEU O O 6.164 2.742 2.332 1.00 . A A . 20 LEU O 1 1 14 5437 1 1 21 PHE C C 8.482 0.868 2.034 1.00 . A A . 21 PHE C 1 1 14 5438 1 1 21 PHE CA C 7.130 0.151 2.051 1.00 . A A . 21 PHE CA 1 1 14 5439 1 1 21 PHE CB C 7.317 -1.276 1.531 1.00 . A A . 21 PHE CB 1 1 14 5440 1 1 21 PHE CD1 C 6.020 -2.535 3.264 1.00 . A A . 21 PHE CD1 1 1 14 5441 1 1 21 PHE CD2 C 8.275 -3.126 2.920 1.00 . A A . 21 PHE CD2 1 1 14 5442 1 1 21 PHE CE1 C 5.911 -3.534 4.268 1.00 . A A . 21 PHE CE1 1 1 14 5443 1 1 21 PHE CE2 C 8.165 -4.126 3.923 1.00 . A A . 21 PHE CE2 1 1 14 5444 1 1 21 PHE CG C 7.199 -2.352 2.612 1.00 . A A . 21 PHE CG 1 1 14 5445 1 1 21 PHE CZ C 6.986 -4.309 4.576 1.00 . A A . 21 PHE CZ 1 1 14 5446 1 1 21 PHE H H 5.868 0.248 0.396 1.00 . A A . 21 PHE H 1 1 14 5447 1 1 21 PHE HA H 6.713 0.190 3.057 1.00 . A A . 21 PHE HA 1 1 14 5448 1 1 21 PHE HB3 H 8.296 -1.354 1.060 1.00 . A A . 21 PHE HB3 1 1 14 5449 1 1 21 PHE HD1 H 5.159 -1.914 3.018 1.00 . A A . 21 PHE HD1 1 1 14 5450 1 1 21 PHE HD2 H 9.220 -2.980 2.398 1.00 . A A . 21 PHE HD2 1 1 14 5451 1 1 21 PHE HE1 H 4.966 -3.680 4.791 1.00 . A A . 21 PHE HE1 1 1 14 5452 1 1 21 PHE HE2 H 9.026 -4.746 4.171 1.00 . A A . 21 PHE HE2 1 1 14 5453 1 1 21 PHE HZ H 6.902 -5.075 5.346 1.00 . A A . 21 PHE HZ 1 1 14 5454 1 1 21 PHE N N 6.182 0.805 1.165 1.00 . A A . 21 PHE N 1 1 14 5455 1 1 21 PHE O O 9.289 0.701 2.947 1.00 . A A . 21 PHE O 1 1 14 5456 1 1 22 LYS C C 10.007 3.466 1.930 1.00 . A A . 22 LYS C 1 1 14 5457 1 1 22 LYS CA C 9.925 2.397 0.838 1.00 . A A . 22 LYS CA 1 1 14 5458 1 1 22 LYS CB C 10.048 2.956 -0.581 1.00 . A A . 22 LYS CB 1 1 14 5459 1 1 22 LYS CD C 7.914 4.224 -0.132 1.00 . A A . 22 LYS CD 1 1 14 5460 1 1 22 LYS CE C 8.637 5.551 0.106 1.00 . A A . 22 LYS CE 1 1 14 5461 1 1 22 LYS CG C 8.678 3.355 -1.133 1.00 . A A . 22 LYS CG 1 1 14 5462 1 1 22 LYS H H 8.024 1.784 0.248 1.00 . A A . 22 LYS H 1 1 14 5463 1 1 22 LYS HA H 10.746 1.695 0.980 1.00 . A A . 22 LYS HA 1 1 14 5464 1 1 22 LYS HB3 H 10.504 2.210 -1.231 1.00 . A A . 22 LYS HB3 1 1 14 5465 1 1 22 LYS HD3 H 7.809 3.689 0.812 1.00 . A A . 22 LYS HD3 1 1 14 5466 1 1 22 LYS HE3 H 9.408 5.421 0.866 1.00 . A A . 22 LYS HE3 1 1 14 5467 1 1 22 LYS HG3 H 8.100 2.460 -1.361 1.00 . A A . 22 LYS HG3 1 1 14 5468 1 1 22 LYS HZ1 H 8.610 5.901 -1.907 1.00 . A A . 22 LYS HZ1 1 1 14 5469 1 1 22 LYS HZ2 H 9.452 7.016 -1.062 1.00 . A A . 22 LYS HZ2 1 1 14 5470 1 1 22 LYS HZ3 H 10.093 5.538 -1.328 1.00 . A A . 22 LYS HZ3 1 1 14 5471 1 1 22 LYS N N 8.685 1.653 0.986 1.00 . A A . 22 LYS N 1 1 14 5472 1 1 22 LYS NZ N 9.247 6.041 -1.150 1.00 . A A . 22 LYS NZ 1 1 14 5473 1 1 22 LYS O O 11.023 4.146 2.063 1.00 . A A . 22 LYS O 1 1 14 5474 1 1 23 LYS C C 8.681 3.824 5.094 1.00 . A A . 23 LYS C 1 1 14 5475 1 1 23 LYS CA C 8.860 4.553 3.760 1.00 . A A . 23 LYS CA 1 1 14 5476 1 1 23 LYS CB C 7.775 5.594 3.478 1.00 . A A . 23 LYS CB 1 1 14 5477 1 1 23 LYS CD C 5.515 5.877 4.563 1.00 . A A . 23 LYS CD 1 1 14 5478 1 1 23 LYS CE C 4.941 7.062 3.784 1.00 . A A . 23 LYS CE 1 1 14 5479 1 1 23 LYS CG C 6.379 4.994 3.659 1.00 . A A . 23 LYS CG 1 1 14 5480 1 1 23 LYS H H 8.101 3.022 2.570 1.00 . A A . 23 LYS H 1 1 14 5481 1 1 23 LYS HA H 9.814 5.080 3.780 1.00 . A A . 23 LYS HA 1 1 14 5482 1 1 23 LYS HB3 H 7.882 5.971 2.461 1.00 . A A . 23 LYS HB3 1 1 14 5483 1 1 23 LYS HD3 H 6.112 6.242 5.399 1.00 . A A . 23 LYS HD3 1 1 14 5484 1 1 23 LYS HE3 H 5.588 7.296 2.938 1.00 . A A . 23 LYS HE3 1 1 14 5485 1 1 23 LYS HG3 H 6.461 3.997 4.092 1.00 . A A . 23 LYS HG3 1 1 14 5486 1 1 23 LYS HZ1 H 3.477 7.068 2.358 1.00 . A A . 23 LYS HZ1 1 1 14 5487 1 1 23 LYS HZ2 H 3.424 5.765 3.341 1.00 . A A . 23 LYS HZ2 1 1 14 5488 1 1 23 LYS HZ3 H 2.906 7.217 3.881 1.00 . A A . 23 LYS HZ3 1 1 14 5489 1 1 23 LYS N N 8.924 3.579 2.684 1.00 . A A . 23 LYS N 1 1 14 5490 1 1 23 LYS NZ N 3.577 6.753 3.302 1.00 . A A . 23 LYS NZ 1 1 14 5491 1 1 23 LYS O O 9.099 4.320 6.138 1.00 . A A . 23 LYS O 1 1 14 5492 1 1 24 TRP C C 9.081 1.039 6.483 1.00 . A A . 24 TRP C 1 1 14 5493 1 1 24 TRP CA C 7.817 1.854 6.200 1.00 . A A . 24 TRP CA 1 1 14 5494 1 1 24 TRP CB C 6.570 0.985 6.031 1.00 . A A . 24 TRP CB 1 1 14 5495 1 1 24 TRP CD1 C 5.086 3.003 6.650 1.00 . A A . 24 TRP CD1 1 1 14 5496 1 1 24 TRP CD2 C 3.934 1.140 6.318 1.00 . A A . 24 TRP CD2 1 1 14 5497 1 1 24 TRP CE2 C 3.031 2.131 6.639 1.00 . A A . 24 TRP CE2 1 1 14 5498 1 1 24 TRP CE3 C 3.514 -0.175 6.047 1.00 . A A . 24 TRP CE3 1 1 14 5499 1 1 24 TRP CG C 5.259 1.714 6.329 1.00 . A A . 24 TRP CG 1 1 14 5500 1 1 24 TRP CH2 C 1.208 0.613 6.452 1.00 . A A . 24 TRP CH2 1 1 14 5501 1 1 24 TRP CZ2 C 1.650 1.914 6.719 1.00 . A A . 24 TRP CZ2 1 1 14 5502 1 1 24 TRP CZ3 C 2.131 -0.376 6.131 1.00 . A A . 24 TRP CZ3 1 1 14 5503 1 1 24 TRP H H 7.721 2.261 4.159 1.00 . A A . 24 TRP H 1 1 14 5504 1 1 24 TRP HA H 7.620 2.535 7.029 1.00 . A A . 24 TRP HA 1 1 14 5505 1 1 24 TRP HB3 H 6.651 0.120 6.689 1.00 . A A . 24 TRP HB3 1 1 14 5506 1 1 24 TRP HD1 H 5.896 3.726 6.744 1.00 . A A . 24 TRP HD1 1 1 14 5507 1 1 24 TRP HE1 H 3.342 4.274 7.117 1.00 . A A . 24 TRP HE1 1 1 14 5508 1 1 24 TRP HE3 H 4.208 -0.976 5.791 1.00 . A A . 24 TRP HE3 1 1 14 5509 1 1 24 TRP HH2 H 0.145 0.374 6.496 1.00 . A A . 24 TRP HH2 1 1 14 5510 1 1 24 TRP HZ2 H 0.956 2.715 6.974 1.00 . A A . 24 TRP HZ2 1 1 14 5511 1 1 24 TRP HZ3 H 1.752 -1.377 5.929 1.00 . A A . 24 TRP HZ3 1 1 14 5512 1 1 24 TRP N N 8.058 2.658 5.013 1.00 . A A . 24 TRP N 1 1 14 5513 1 1 24 TRP NE1 N 3.752 3.301 6.847 1.00 . A A . 24 TRP NE1 1 1 14 5514 1 1 24 TRP O O 9.786 0.639 5.558 1.00 . A A . 24 TRP O 1 1 14 5515 1 1 25 GLY C C 11.738 0.947 8.239 1.00 . A A . 25 GLY C 1 1 14 5516 1 1 25 GLY CA C 10.494 0.056 8.181 1.00 . A A . 25 GLY CA 1 1 14 5517 1 1 25 GLY H H 8.750 1.146 8.512 1.00 . A A . 25 GLY H 1 1 14 5518 1 1 25 GLY HA2 H 10.314 -0.386 9.161 1.00 . A A . 25 GLY HA2 1 1 14 5519 1 1 25 GLY HA3 H 10.664 -0.766 7.486 1.00 . A A . 25 GLY HA3 1 1 14 5520 1 1 25 GLY N N 9.329 0.817 7.765 1.00 . A A . 25 GLY N 1 1 14 5521 1 1 25 GLY O O 11.628 2.171 8.257 1.00 . A A . 25 GLY O 1 1 14 5522 1 1 26 TRP C C 14.211 1.964 7.126 1.00 . A A . 26 TRP C 1 1 14 5523 1 1 26 TRP CA C 14.155 1.013 8.323 1.00 . A A . 26 TRP CA 1 1 14 5524 1 1 26 TRP CB C 15.335 0.041 8.372 1.00 . A A . 26 TRP CB 1 1 14 5525 1 1 26 TRP CD1 C 14.503 -1.218 6.278 1.00 . A A . 26 TRP CD1 1 1 14 5526 1 1 26 TRP CD2 C 16.681 -1.439 6.625 1.00 . A A . 26 TRP CD2 1 1 14 5527 1 1 26 TRP CE2 C 16.369 -2.154 5.486 1.00 . A A . 26 TRP CE2 1 1 14 5528 1 1 26 TRP CE3 C 17.996 -1.379 7.115 1.00 . A A . 26 TRP CE3 1 1 14 5529 1 1 26 TRP CG C 15.468 -0.839 7.128 1.00 . A A . 26 TRP CG 1 1 14 5530 1 1 26 TRP CH2 C 18.638 -2.819 5.212 1.00 . A A . 26 TRP CH2 1 1 14 5531 1 1 26 TRP CZ2 C 17.320 -2.864 4.742 1.00 . A A . 26 TRP CZ2 1 1 14 5532 1 1 26 TRP CZ3 C 18.935 -2.094 6.361 1.00 . A A . 26 TRP CZ3 1 1 14 5533 1 1 26 TRP H H 12.972 -0.701 8.254 1.00 . A A . 26 TRP H 1 1 14 5534 1 1 26 TRP HA H 14.173 1.582 9.252 1.00 . A A . 26 TRP HA 1 1 14 5535 1 1 26 TRP HB3 H 15.230 -0.599 9.248 1.00 . A A . 26 TRP HB3 1 1 14 5536 1 1 26 TRP HD1 H 13.456 -0.933 6.373 1.00 . A A . 26 TRP HD1 1 1 14 5537 1 1 26 TRP HE1 H 14.432 -2.455 4.451 1.00 . A A . 26 TRP HE1 1 1 14 5538 1 1 26 TRP HE3 H 18.268 -0.823 8.012 1.00 . A A . 26 TRP HE3 1 1 14 5539 1 1 26 TRP HH2 H 19.427 -3.349 4.680 1.00 . A A . 26 TRP HH2 1 1 14 5540 1 1 26 TRP HZ2 H 17.048 -3.421 3.846 1.00 . A A . 26 TRP HZ2 1 1 14 5541 1 1 26 TRP HZ3 H 19.971 -2.081 6.698 1.00 . A A . 26 TRP HZ3 1 1 14 5542 1 1 26 TRP N N 12.892 0.295 8.268 1.00 . A A . 26 TRP N 1 1 14 5543 1 1 26 TRP NE1 N 15.003 -2.016 5.269 1.00 . A A . 26 TRP NE1 1 1 14 5544 1 1 26 TRP O O 15.070 2.842 7.066 1.00 . A A . 26 TRP O 1 1 15 5545 1 1 1 LYS C C -10.329 8.394 6.518 1.00 . A A . 1 LYS C 1 1 15 5546 1 1 1 LYS CA C -9.052 7.562 6.646 1.00 . A A . 1 LYS CA 1 1 15 5547 1 1 1 LYS CB C -7.981 7.917 5.610 1.00 . A A . 1 LYS CB 1 1 15 5548 1 1 1 LYS CD C -7.361 7.863 3.167 1.00 . A A . 1 LYS CD 1 1 15 5549 1 1 1 LYS CE C -7.179 6.648 2.254 1.00 . A A . 1 LYS CE 1 1 15 5550 1 1 1 LYS CG C -8.470 7.616 4.192 1.00 . A A . 1 LYS CG 1 1 15 5551 1 1 1 LYS H1 H -9.938 5.891 5.774 1.00 . A A . 1 LYS H1 1 1 15 5552 1 1 1 LYS HA H -8.619 7.741 7.630 1.00 . A A . 1 LYS HA 1 1 15 5553 1 1 1 LYS HB3 H -7.072 7.350 5.814 1.00 . A A . 1 LYS HB3 1 1 15 5554 1 1 1 LYS HD3 H -6.426 8.079 3.682 1.00 . A A . 1 LYS HD3 1 1 15 5555 1 1 1 LYS HE3 H -8.140 6.358 1.828 1.00 . A A . 1 LYS HE3 1 1 15 5556 1 1 1 LYS HG3 H -9.331 8.243 3.960 1.00 . A A . 1 LYS HG3 1 1 15 5557 1 1 1 LYS HZ1 H -6.725 7.154 0.327 1.00 . A A . 1 LYS HZ1 1 1 15 5558 1 1 1 LYS HZ2 H -5.671 7.750 1.423 1.00 . A A . 1 LYS HZ2 1 1 15 5559 1 1 1 LYS HZ3 H -5.622 6.168 1.020 1.00 . A A . 1 LYS HZ3 1 1 15 5560 1 1 1 LYS N N -9.387 6.151 6.567 1.00 . A A . 1 LYS N 1 1 15 5561 1 1 1 LYS NZ N -6.222 6.955 1.168 1.00 . A A . 1 LYS NZ 1 1 15 5562 1 1 1 LYS O O -10.585 9.273 7.340 1.00 . A A . 1 LYS O 1 1 15 5563 1 1 2 SER C C -13.335 7.876 4.526 1.00 . A A . 2 SER C 1 1 15 5564 1 1 2 SER CA C -12.341 8.795 5.238 1.00 . A A . 2 SER CA 1 1 15 5565 1 1 2 SER CB C -12.102 10.060 4.412 1.00 . A A . 2 SER CB 1 1 15 5566 1 1 2 SER H H -10.881 7.371 4.820 1.00 . A A . 2 SER H 1 1 15 5567 1 1 2 SER HA H -12.715 9.071 6.224 1.00 . A A . 2 SER HA 1 1 15 5568 1 1 2 SER HB3 H -11.811 9.783 3.399 1.00 . A A . 2 SER HB3 1 1 15 5569 1 1 2 SER HG H -13.282 11.493 5.161 1.00 . A A . 2 SER HG 1 1 15 5570 1 1 2 SER N N -11.096 8.087 5.483 1.00 . A A . 2 SER N 1 1 15 5571 1 1 2 SER O O -14.428 7.626 5.032 1.00 . A A . 2 SER O 1 1 15 5572 1 1 2 SER OG O -13.258 10.892 4.361 1.00 . A A . 2 SER OG 1 1 15 5573 1 1 3 SER C C -12.890 5.543 1.770 1.00 . A A . 3 SER C 1 1 15 5574 1 1 3 SER CA C -13.760 6.511 2.574 1.00 . A A . 3 SER CA 1 1 15 5575 1 1 3 SER CB C -14.674 7.306 1.639 1.00 . A A . 3 SER CB 1 1 15 5576 1 1 3 SER H H -12.029 7.606 2.957 1.00 . A A . 3 SER H 1 1 15 5577 1 1 3 SER HA H -14.366 5.969 3.300 1.00 . A A . 3 SER HA 1 1 15 5578 1 1 3 SER HB3 H -14.869 6.721 0.741 1.00 . A A . 3 SER HB3 1 1 15 5579 1 1 3 SER HG H -16.468 8.194 1.638 1.00 . A A . 3 SER HG 1 1 15 5580 1 1 3 SER N N -12.920 7.398 3.362 1.00 . A A . 3 SER N 1 1 15 5581 1 1 3 SER O O -11.860 5.936 1.225 1.00 . A A . 3 SER O 1 1 15 5582 1 1 3 SER OG O -15.910 7.646 2.262 1.00 . A A . 3 SER OG 1 1 15 5583 1 1 4 ALA C C -13.608 2.389 0.237 1.00 . A A . 4 ALA C 1 1 15 5584 1 1 4 ALA CA C -12.613 3.270 0.994 1.00 . A A . 4 ALA CA 1 1 15 5585 1 1 4 ALA CB C -11.748 2.467 1.969 1.00 . A A . 4 ALA CB 1 1 15 5586 1 1 4 ALA H H -14.177 3.986 2.169 1.00 . A A . 4 ALA H 1 1 15 5587 1 1 4 ALA HA H -11.961 3.768 0.276 1.00 . A A . 4 ALA HA 1 1 15 5588 1 1 4 ALA HB1 H -11.340 3.135 2.727 1.00 . A A . 4 ALA HB1 1 1 15 5589 1 1 4 ALA HB2 H -12.355 1.700 2.448 1.00 . A A . 4 ALA HB2 1 1 15 5590 1 1 4 ALA HB3 H -10.930 1.994 1.424 1.00 . A A . 4 ALA HB3 1 1 15 5591 1 1 4 ALA N N -13.337 4.297 1.722 1.00 . A A . 4 ALA N 1 1 15 5592 1 1 4 ALA O O -14.638 2.870 -0.232 1.00 . A A . 4 ALA O 1 1 15 5593 1 1 5 TYR C C -14.453 0.649 -1.961 1.00 . A A . 5 TYR C 1 1 15 5594 1 1 5 TYR CA C -14.117 0.159 -0.551 1.00 . A A . 5 TYR CA 1 1 15 5595 1 1 5 TYR CB C -15.407 0.075 0.267 1.00 . A A . 5 TYR CB 1 1 15 5596 1 1 5 TYR CD1 C -15.163 -2.361 0.875 1.00 . A A . 5 TYR CD1 1 1 15 5597 1 1 5 TYR CD2 C -15.699 -0.808 2.611 1.00 . A A . 5 TYR CD2 1 1 15 5598 1 1 5 TYR CE1 C -15.180 -3.436 1.833 1.00 . A A . 5 TYR CE1 1 1 15 5599 1 1 5 TYR CE2 C -15.716 -1.883 3.569 1.00 . A A . 5 TYR CE2 1 1 15 5600 1 1 5 TYR CG C -15.424 -1.069 1.284 1.00 . A A . 5 TYR CG 1 1 15 5601 1 1 5 TYR CZ C -15.455 -3.144 3.131 1.00 . A A . 5 TYR CZ 1 1 15 5602 1 1 5 TYR H H -12.427 0.728 0.525 1.00 . A A . 5 TYR H 1 1 15 5603 1 1 5 TYR HA H -13.577 -0.785 -0.621 1.00 . A A . 5 TYR HA 1 1 15 5604 1 1 5 TYR HB3 H -16.250 -0.047 -0.414 1.00 . A A . 5 TYR HB3 1 1 15 5605 1 1 5 TYR HD1 H -14.947 -2.567 -0.173 1.00 . A A . 5 TYR HD1 1 1 15 5606 1 1 5 TYR HD2 H -15.905 0.212 2.934 1.00 . A A . 5 TYR HD2 1 1 15 5607 1 1 5 TYR HE1 H -14.976 -4.461 1.523 1.00 . A A . 5 TYR HE1 1 1 15 5608 1 1 5 TYR HE2 H -15.931 -1.690 4.619 1.00 . A A . 5 TYR HE2 1 1 15 5609 1 1 5 TYR HH H -14.598 -4.195 4.525 1.00 . A A . 5 TYR HH 1 1 15 5610 1 1 5 TYR N N -13.266 1.112 0.141 1.00 . A A . 5 TYR N 1 1 15 5611 1 1 5 TYR O O -15.433 0.205 -2.559 1.00 . A A . 5 TYR O 1 1 15 5612 1 1 5 TYR OH O -15.470 -4.160 4.036 1.00 . A A . 5 TYR OH 1 1 15 5613 1 1 6 SER C C -12.681 1.670 -4.706 1.00 . A A . 6 SER C 1 1 15 5614 1 1 6 SER CA C -13.819 2.109 -3.782 1.00 . A A . 6 SER CA 1 1 15 5615 1 1 6 SER CB C -13.904 3.636 -3.734 1.00 . A A . 6 SER CB 1 1 15 5616 1 1 6 SER H H -12.827 1.911 -1.960 1.00 . A A . 6 SER H 1 1 15 5617 1 1 6 SER HA H -14.770 1.703 -4.125 1.00 . A A . 6 SER HA 1 1 15 5618 1 1 6 SER HB3 H -12.948 4.062 -4.040 1.00 . A A . 6 SER HB3 1 1 15 5619 1 1 6 SER HG H -14.699 3.992 -5.537 1.00 . A A . 6 SER HG 1 1 15 5620 1 1 6 SER N N -13.622 1.555 -2.452 1.00 . A A . 6 SER N 1 1 15 5621 1 1 6 SER O O -12.759 1.848 -5.920 1.00 . A A . 6 SER O 1 1 15 5622 1 1 6 SER OG O -14.938 4.139 -4.577 1.00 . A A . 6 SER OG 1 1 15 5623 1 1 7 LEU C C -9.679 -0.319 -3.978 1.00 . A A . 7 LEU C 1 1 15 5624 1 1 7 LEU CA C -10.499 0.636 -4.848 1.00 . A A . 7 LEU CA 1 1 15 5625 1 1 7 LEU CB C -9.695 1.822 -5.385 1.00 . A A . 7 LEU CB 1 1 15 5626 1 1 7 LEU CD1 C -7.715 0.704 -6.476 1.00 . A A . 7 LEU CD1 1 1 15 5627 1 1 7 LEU CD2 C -7.477 3.020 -5.466 1.00 . A A . 7 LEU CD2 1 1 15 5628 1 1 7 LEU CG C -8.173 1.661 -5.372 1.00 . A A . 7 LEU CG 1 1 15 5629 1 1 7 LEU H H -11.596 0.962 -3.106 1.00 . A A . 7 LEU H 1 1 15 5630 1 1 7 LEU HA H -10.874 0.084 -5.709 1.00 . A A . 7 LEU HA 1 1 15 5631 1 1 7 LEU HB3 H -9.951 2.705 -4.799 1.00 . A A . 7 LEU HB3 1 1 15 5632 1 1 7 LEU HD11 H -7.251 -0.174 -6.026 1.00 . A A . 7 LEU HD11 1 1 15 5633 1 1 7 LEU HD12 H -8.574 0.398 -7.072 1.00 . A A . 7 LEU HD12 1 1 15 5634 1 1 7 LEU HD13 H -6.991 1.209 -7.116 1.00 . A A . 7 LEU HD13 1 1 15 5635 1 1 7 LEU HD21 H -6.477 2.946 -5.037 1.00 . A A . 7 LEU HD21 1 1 15 5636 1 1 7 LEU HD22 H -7.402 3.319 -6.511 1.00 . A A . 7 LEU HD22 1 1 15 5637 1 1 7 LEU HD23 H -8.055 3.762 -4.915 1.00 . A A . 7 LEU HD23 1 1 15 5638 1 1 7 LEU HG H -7.885 1.215 -4.421 1.00 . A A . 7 LEU HG 1 1 15 5639 1 1 7 LEU N N -11.651 1.103 -4.094 1.00 . A A . 7 LEU N 1 1 15 5640 1 1 7 LEU O O -9.469 -1.474 -4.346 1.00 . A A . 7 LEU O 1 1 15 5641 1 1 8 GLN C C -9.338 -1.610 -1.190 1.00 . A A . 8 GLN C 1 1 15 5642 1 1 8 GLN CA C -8.449 -0.596 -1.913 1.00 . A A . 8 GLN CA 1 1 15 5643 1 1 8 GLN CB C -7.712 0.300 -0.915 1.00 . A A . 8 GLN CB 1 1 15 5644 1 1 8 GLN CD C -8.125 2.323 0.534 1.00 . A A . 8 GLN CD 1 1 15 5645 1 1 8 GLN CG C -8.698 0.999 0.025 1.00 . A A . 8 GLN CG 1 1 15 5646 1 1 8 GLN H H -9.417 1.137 -2.547 1.00 . A A . 8 GLN H 1 1 15 5647 1 1 8 GLN HA H -7.719 -1.118 -2.531 1.00 . A A . 8 GLN HA 1 1 15 5648 1 1 8 GLN HB3 H -7.127 1.045 -1.453 1.00 . A A . 8 GLN HB3 1 1 15 5649 1 1 8 GLN HE21 H -9.580 3.292 -0.486 1.00 . A A . 8 GLN HE21 1 1 15 5650 1 1 8 GLN HE22 H -8.486 4.309 0.390 1.00 . A A . 8 GLN HE22 1 1 15 5651 1 1 8 GLN HG3 H -8.924 0.348 0.869 1.00 . A A . 8 GLN HG3 1 1 15 5652 1 1 8 GLN N N -9.241 0.197 -2.839 1.00 . A A . 8 GLN N 1 1 15 5653 1 1 8 GLN NE2 N -8.785 3.396 0.111 1.00 . A A . 8 GLN NE2 1 1 15 5654 1 1 8 GLN O O -10.547 -1.417 -1.084 1.00 . A A . 8 GLN O 1 1 15 5655 1 1 8 GLN OE1 O -7.146 2.366 1.262 1.00 . A A . 8 GLN OE1 1 1 15 5656 1 1 9 MET C C -8.460 -4.800 0.492 1.00 . A A . 9 MET C 1 1 15 5657 1 1 9 MET CA C -9.419 -3.713 0.001 1.00 . A A . 9 MET CA 1 1 15 5658 1 1 9 MET CB C -10.466 -4.335 -0.925 1.00 . A A . 9 MET CB 1 1 15 5659 1 1 9 MET CE C -9.022 -7.046 -3.672 1.00 . A A . 9 MET CE 1 1 15 5660 1 1 9 MET CG C -9.815 -4.884 -2.197 1.00 . A A . 9 MET CG 1 1 15 5661 1 1 9 MET H H -7.716 -2.818 -0.800 1.00 . A A . 9 MET H 1 1 15 5662 1 1 9 MET HA H -9.885 -3.219 0.854 1.00 . A A . 9 MET HA 1 1 15 5663 1 1 9 MET HB3 H -11.214 -3.587 -1.188 1.00 . A A . 9 MET HB3 1 1 15 5664 1 1 9 MET HE1 H -7.956 -7.267 -3.738 1.00 . A A . 9 MET HE1 1 1 15 5665 1 1 9 MET HE2 H -9.595 -7.922 -3.975 1.00 . A A . 9 MET HE2 1 1 15 5666 1 1 9 MET HE3 H -9.261 -6.210 -4.329 1.00 . A A . 9 MET HE3 1 1 15 5667 1 1 9 MET HG3 H -8.904 -4.328 -2.418 1.00 . A A . 9 MET HG3 1 1 15 5668 1 1 9 MET N N -8.702 -2.669 -0.710 1.00 . A A . 9 MET N 1 1 15 5669 1 1 9 MET O O -8.615 -5.317 1.597 1.00 . A A . 9 MET O 1 1 15 5670 1 1 9 MET SD S -9.437 -6.616 -1.989 1.00 . A A . 9 MET SD 1 1 15 5671 1 1 10 GLY C C -5.534 -6.354 -1.181 1.00 . A A . 10 GLY C 1 1 15 5672 1 1 10 GLY CA C -6.506 -6.130 -0.021 1.00 . A A . 10 GLY CA 1 1 15 5673 1 1 10 GLY H H -7.371 -4.689 -1.252 1.00 . A A . 10 GLY H 1 1 15 5674 1 1 10 GLY HA2 H -5.954 -5.828 0.868 1.00 . A A . 10 GLY HA2 1 1 15 5675 1 1 10 GLY HA3 H -7.011 -7.065 0.220 1.00 . A A . 10 GLY HA3 1 1 15 5676 1 1 10 GLY N N -7.490 -5.114 -0.355 1.00 . A A . 10 GLY N 1 1 15 5677 1 1 10 GLY O O -5.270 -7.492 -1.563 1.00 . A A . 10 GLY O 1 1 15 5678 1 1 11 ALA C C -3.245 -4.035 -2.834 1.00 . A A . 11 ALA C 1 1 15 5679 1 1 11 ALA CA C -4.092 -5.309 -2.818 1.00 . A A . 11 ALA CA 1 1 15 5680 1 1 11 ALA CB C -4.860 -5.515 -4.125 1.00 . A A . 11 ALA CB 1 1 15 5681 1 1 11 ALA H H -5.249 -4.326 -1.392 1.00 . A A . 11 ALA H 1 1 15 5682 1 1 11 ALA HA H -3.440 -6.167 -2.655 1.00 . A A . 11 ALA HA 1 1 15 5683 1 1 11 ALA HB1 H -5.890 -5.791 -3.901 1.00 . A A . 11 ALA HB1 1 1 15 5684 1 1 11 ALA HB2 H -4.849 -4.591 -4.703 1.00 . A A . 11 ALA HB2 1 1 15 5685 1 1 11 ALA HB3 H -4.387 -6.310 -4.703 1.00 . A A . 11 ALA HB3 1 1 15 5686 1 1 11 ALA N N -5.029 -5.248 -1.709 1.00 . A A . 11 ALA N 1 1 15 5687 1 1 11 ALA O O -2.084 -4.052 -2.426 1.00 . A A . 11 ALA O 1 1 15 5688 1 1 12 THR C C -2.359 -1.437 -2.113 1.00 . A A . 12 THR C 1 1 15 5689 1 1 12 THR CA C -3.173 -1.682 -3.385 1.00 . A A . 12 THR CA 1 1 15 5690 1 1 12 THR CB C -4.222 -0.600 -3.652 1.00 . A A . 12 THR CB 1 1 15 5691 1 1 12 THR CG2 C -5.143 -0.953 -4.821 1.00 . A A . 12 THR CG2 1 1 15 5692 1 1 12 THR H H -4.801 -2.956 -3.640 1.00 . A A . 12 THR H 1 1 15 5693 1 1 12 THR HA H -2.468 -1.717 -4.215 1.00 . A A . 12 THR HA 1 1 15 5694 1 1 12 THR HB H -3.750 0.371 -3.807 1.00 . A A . 12 THR HB 1 1 15 5695 1 1 12 THR HG1 H -5.439 -1.578 -2.399 1.00 . A A . 12 THR HG1 1 1 15 5696 1 1 12 THR HG21 H -5.297 -0.071 -5.442 1.00 . A A . 12 THR HG21 1 1 15 5697 1 1 12 THR HG22 H -4.686 -1.742 -5.419 1.00 . A A . 12 THR HG22 1 1 15 5698 1 1 12 THR HG23 H -6.103 -1.298 -4.437 1.00 . A A . 12 THR HG23 1 1 15 5699 1 1 12 THR N N -3.857 -2.962 -3.310 1.00 . A A . 12 THR N 1 1 15 5700 1 1 12 THR O O -1.187 -1.068 -2.183 1.00 . A A . 12 THR O 1 1 15 5701 1 1 12 THR OG1 O -5.074 -0.653 -2.511 1.00 . A A . 12 THR OG1 1 1 15 5702 1 1 13 ALA C C -0.925 -1.984 0.229 1.00 . A A . 13 ALA C 1 1 15 5703 1 1 13 ALA CA C -2.361 -1.461 0.305 1.00 . A A . 13 ALA CA 1 1 15 5704 1 1 13 ALA CB C -3.177 -2.153 1.399 1.00 . A A . 13 ALA CB 1 1 15 5705 1 1 13 ALA H H -3.963 -1.953 -0.931 1.00 . A A . 13 ALA H 1 1 15 5706 1 1 13 ALA HA H -2.338 -0.390 0.509 1.00 . A A . 13 ALA HA 1 1 15 5707 1 1 13 ALA HB1 H -3.557 -1.406 2.096 1.00 . A A . 13 ALA HB1 1 1 15 5708 1 1 13 ALA HB2 H -4.014 -2.686 0.946 1.00 . A A . 13 ALA HB2 1 1 15 5709 1 1 13 ALA HB3 H -2.543 -2.860 1.933 1.00 . A A . 13 ALA HB3 1 1 15 5710 1 1 13 ALA N N -3.010 -1.653 -0.980 1.00 . A A . 13 ALA N 1 1 15 5711 1 1 13 ALA O O 0.014 -1.292 0.622 1.00 . A A . 13 ALA O 1 1 15 5712 1 1 14 ILE C C 1.514 -2.791 -0.912 1.00 . A A . 14 ILE C 1 1 15 5713 1 1 14 ILE CA C 0.506 -3.826 -0.409 1.00 . A A . 14 ILE CA 1 1 15 5714 1 1 14 ILE CB C 0.417 -5.075 -1.289 1.00 . A A . 14 ILE CB 1 1 15 5715 1 1 14 ILE CD1 C -1.274 -6.887 -1.756 1.00 . A A . 14 ILE CD1 1 1 15 5716 1 1 14 ILE CG1 C -0.520 -6.114 -0.672 1.00 . A A . 14 ILE CG1 1 1 15 5717 1 1 14 ILE CG2 C 1.807 -5.649 -1.568 1.00 . A A . 14 ILE CG2 1 1 15 5718 1 1 14 ILE H H -1.568 -3.758 -0.594 1.00 . A A . 14 ILE H 1 1 15 5719 1 1 14 ILE HA H 0.814 -4.153 0.584 1.00 . A A . 14 ILE HA 1 1 15 5720 1 1 14 ILE HB H -0.011 -4.785 -2.249 1.00 . A A . 14 ILE HB 1 1 15 5721 1 1 14 ILE HD11 H -1.391 -6.255 -2.636 1.00 . A A . 14 ILE HD11 1 1 15 5722 1 1 14 ILE HD12 H -0.711 -7.781 -2.023 1.00 . A A . 14 ILE HD12 1 1 15 5723 1 1 14 ILE HD13 H -2.256 -7.174 -1.382 1.00 . A A . 14 ILE HD13 1 1 15 5724 1 1 14 ILE HG13 H -1.232 -5.621 -0.010 1.00 . A A . 14 ILE HG13 1 1 15 5725 1 1 14 ILE HG21 H 2.505 -4.835 -1.762 1.00 . A A . 14 ILE HG21 1 1 15 5726 1 1 14 ILE HG22 H 2.145 -6.219 -0.702 1.00 . A A . 14 ILE HG22 1 1 15 5727 1 1 14 ILE HG23 H 1.761 -6.304 -2.438 1.00 . A A . 14 ILE HG23 1 1 15 5728 1 1 14 ILE N N -0.799 -3.202 -0.277 1.00 . A A . 14 ILE N 1 1 15 5729 1 1 14 ILE O O 2.562 -2.590 -0.300 1.00 . A A . 14 ILE O 1 1 15 5730 1 1 15 LYS C C 2.566 -0.239 -1.512 1.00 . A A . 15 LYS C 1 1 15 5731 1 1 15 LYS CA C 2.021 -1.149 -2.614 1.00 . A A . 15 LYS CA 1 1 15 5732 1 1 15 LYS CB C 1.280 -0.397 -3.722 1.00 . A A . 15 LYS CB 1 1 15 5733 1 1 15 LYS CD C 2.151 1.935 -3.317 1.00 . A A . 15 LYS CD 1 1 15 5734 1 1 15 LYS CE C 2.260 3.255 -4.083 1.00 . A A . 15 LYS CE 1 1 15 5735 1 1 15 LYS CG C 2.135 0.744 -4.277 1.00 . A A . 15 LYS CG 1 1 15 5736 1 1 15 LYS H H 0.307 -2.328 -2.514 1.00 . A A . 15 LYS H 1 1 15 5737 1 1 15 LYS HA H 2.859 -1.666 -3.081 1.00 . A A . 15 LYS HA 1 1 15 5738 1 1 15 LYS HB3 H 0.344 0.003 -3.332 1.00 . A A . 15 LYS HB3 1 1 15 5739 1 1 15 LYS HD3 H 2.990 1.840 -2.628 1.00 . A A . 15 LYS HD3 1 1 15 5740 1 1 15 LYS HE3 H 1.451 3.328 -4.810 1.00 . A A . 15 LYS HE3 1 1 15 5741 1 1 15 LYS HG3 H 1.745 1.058 -5.246 1.00 . A A . 15 LYS HG3 1 1 15 5742 1 1 15 LYS HZ1 H 1.244 4.660 -3.000 1.00 . A A . 15 LYS HZ1 1 1 15 5743 1 1 15 LYS HZ2 H 2.617 4.145 -2.278 1.00 . A A . 15 LYS HZ2 1 1 15 5744 1 1 15 LYS HZ3 H 2.696 5.177 -3.541 1.00 . A A . 15 LYS HZ3 1 1 15 5745 1 1 15 LYS N N 1.161 -2.159 -2.023 1.00 . A A . 15 LYS N 1 1 15 5746 1 1 15 LYS NZ N 2.199 4.402 -3.149 1.00 . A A . 15 LYS NZ 1 1 15 5747 1 1 15 LYS O O 3.752 0.090 -1.503 1.00 . A A . 15 LYS O 1 1 15 5748 1 1 16 GLN C C 3.206 0.385 1.287 1.00 . A A . 16 GLN C 1 1 15 5749 1 1 16 GLN CA C 2.052 1.006 0.497 1.00 . A A . 16 GLN CA 1 1 15 5750 1 1 16 GLN CB C 0.854 1.288 1.405 1.00 . A A . 16 GLN CB 1 1 15 5751 1 1 16 GLN CD C -0.316 0.665 3.550 1.00 . A A . 16 GLN CD 1 1 15 5752 1 1 16 GLN CG C 0.928 0.452 2.685 1.00 . A A . 16 GLN CG 1 1 15 5753 1 1 16 GLN H H 0.713 -0.131 -0.622 1.00 . A A . 16 GLN H 1 1 15 5754 1 1 16 GLN HA H 2.378 1.938 0.036 1.00 . A A . 16 GLN HA 1 1 15 5755 1 1 16 GLN HB3 H -0.071 1.065 0.873 1.00 . A A . 16 GLN HB3 1 1 15 5756 1 1 16 GLN HE21 H 0.899 0.929 5.149 1.00 . A A . 16 GLN HE21 1 1 15 5757 1 1 16 GLN HE22 H -0.798 1.053 5.478 1.00 . A A . 16 GLN HE22 1 1 15 5758 1 1 16 GLN HG3 H 1.819 0.724 3.251 1.00 . A A . 16 GLN HG3 1 1 15 5759 1 1 16 GLN N N 1.675 0.141 -0.609 1.00 . A A . 16 GLN N 1 1 15 5760 1 1 16 GLN NE2 N -0.050 0.902 4.831 1.00 . A A . 16 GLN NE2 1 1 15 5761 1 1 16 GLN O O 4.147 1.080 1.668 1.00 . A A . 16 GLN O 1 1 15 5762 1 1 16 GLN OE1 O -1.443 0.614 3.086 1.00 . A A . 16 GLN OE1 1 1 15 5763 1 1 17 VAL C C 5.482 -1.382 1.604 1.00 . A A . 17 VAL C 1 1 15 5764 1 1 17 VAL CA C 4.118 -1.638 2.248 1.00 . A A . 17 VAL CA 1 1 15 5765 1 1 17 VAL CB C 3.761 -3.124 2.320 1.00 . A A . 17 VAL CB 1 1 15 5766 1 1 17 VAL CG1 C 4.187 -3.854 1.045 1.00 . A A . 17 VAL CG1 1 1 15 5767 1 1 17 VAL CG2 C 4.377 -3.776 3.559 1.00 . A A . 17 VAL CG2 1 1 15 5768 1 1 17 VAL H H 2.327 -1.473 1.196 1.00 . A A . 17 VAL H 1 1 15 5769 1 1 17 VAL HA H 4.130 -1.244 3.264 1.00 . A A . 17 VAL HA 1 1 15 5770 1 1 17 VAL HB H 2.676 -3.204 2.405 1.00 . A A . 17 VAL HB 1 1 15 5771 1 1 17 VAL HG11 H 4.999 -4.544 1.277 1.00 . A A . 17 VAL HG11 1 1 15 5772 1 1 17 VAL HG12 H 3.340 -4.409 0.643 1.00 . A A . 17 VAL HG12 1 1 15 5773 1 1 17 VAL HG13 H 4.528 -3.127 0.308 1.00 . A A . 17 VAL HG13 1 1 15 5774 1 1 17 VAL HG21 H 4.067 -4.820 3.613 1.00 . A A . 17 VAL HG21 1 1 15 5775 1 1 17 VAL HG22 H 5.464 -3.724 3.494 1.00 . A A . 17 VAL HG22 1 1 15 5776 1 1 17 VAL HG23 H 4.042 -3.250 4.452 1.00 . A A . 17 VAL HG23 1 1 15 5777 1 1 17 VAL N N 3.096 -0.916 1.510 1.00 . A A . 17 VAL N 1 1 15 5778 1 1 17 VAL O O 6.497 -1.319 2.296 1.00 . A A . 17 VAL O 1 1 15 5779 1 1 18 LYS C C 7.254 0.368 -0.058 1.00 . A A . 18 LYS C 1 1 15 5780 1 1 18 LYS CA C 6.685 -0.995 -0.459 1.00 . A A . 18 LYS CA 1 1 15 5781 1 1 18 LYS CB C 6.435 -1.139 -1.961 1.00 . A A . 18 LYS CB 1 1 15 5782 1 1 18 LYS CD C 6.227 1.226 -2.811 1.00 . A A . 18 LYS CD 1 1 15 5783 1 1 18 LYS CE C 5.412 1.245 -4.105 1.00 . A A . 18 LYS CE 1 1 15 5784 1 1 18 LYS CG C 7.119 -0.015 -2.741 1.00 . A A . 18 LYS CG 1 1 15 5785 1 1 18 LYS H H 4.632 -1.294 -0.268 1.00 . A A . 18 LYS H 1 1 15 5786 1 1 18 LYS HA H 7.402 -1.765 -0.175 1.00 . A A . 18 LYS HA 1 1 15 5787 1 1 18 LYS HB3 H 5.363 -1.123 -2.158 1.00 . A A . 18 LYS HB3 1 1 15 5788 1 1 18 LYS HD3 H 6.841 2.125 -2.751 1.00 . A A . 18 LYS HD3 1 1 15 5789 1 1 18 LYS HE3 H 4.486 1.797 -3.951 1.00 . A A . 18 LYS HE3 1 1 15 5790 1 1 18 LYS HG3 H 7.352 -0.356 -3.749 1.00 . A A . 18 LYS HG3 1 1 15 5791 1 1 18 LYS HZ1 H 5.867 1.519 -6.079 1.00 . A A . 18 LYS HZ1 1 1 15 5792 1 1 18 LYS HZ2 H 6.076 2.859 -5.169 1.00 . A A . 18 LYS HZ2 1 1 15 5793 1 1 18 LYS HZ3 H 7.160 1.640 -5.089 1.00 . A A . 18 LYS HZ3 1 1 15 5794 1 1 18 LYS N N 5.462 -1.241 0.287 1.00 . A A . 18 LYS N 1 1 15 5795 1 1 18 LYS NZ N 6.192 1.866 -5.199 1.00 . A A . 18 LYS NZ 1 1 15 5796 1 1 18 LYS O O 8.469 0.532 0.042 1.00 . A A . 18 LYS O 1 1 15 5797 1 1 19 LYS C C 7.388 2.611 1.936 1.00 . A A . 19 LYS C 1 1 15 5798 1 1 19 LYS CA C 6.746 2.654 0.548 1.00 . A A . 19 LYS CA 1 1 15 5799 1 1 19 LYS CB C 5.558 3.613 0.449 1.00 . A A . 19 LYS CB 1 1 15 5800 1 1 19 LYS CD C 4.935 3.790 2.887 1.00 . A A . 19 LYS CD 1 1 15 5801 1 1 19 LYS CE C 3.466 4.148 3.122 1.00 . A A . 19 LYS CE 1 1 15 5802 1 1 19 LYS CG C 5.494 4.532 1.671 1.00 . A A . 19 LYS CG 1 1 15 5803 1 1 19 LYS H H 5.363 1.169 0.077 1.00 . A A . 19 LYS H 1 1 15 5804 1 1 19 LYS HA H 7.494 2.993 -0.169 1.00 . A A . 19 LYS HA 1 1 15 5805 1 1 19 LYS HB3 H 4.632 3.044 0.369 1.00 . A A . 19 LYS HB3 1 1 15 5806 1 1 19 LYS HD3 H 5.521 4.042 3.772 1.00 . A A . 19 LYS HD3 1 1 15 5807 1 1 19 LYS HE3 H 2.976 3.350 3.679 1.00 . A A . 19 LYS HE3 1 1 15 5808 1 1 19 LYS HG3 H 4.867 5.395 1.448 1.00 . A A . 19 LYS HG3 1 1 15 5809 1 1 19 LYS HZ1 H 3.375 6.188 3.223 1.00 . A A . 19 LYS HZ1 1 1 15 5810 1 1 19 LYS HZ2 H 2.496 5.437 4.376 1.00 . A A . 19 LYS HZ2 1 1 15 5811 1 1 19 LYS HZ3 H 4.123 5.502 4.503 1.00 . A A . 19 LYS HZ3 1 1 15 5812 1 1 19 LYS N N 6.349 1.310 0.160 1.00 . A A . 19 LYS N 1 1 15 5813 1 1 19 LYS NZ N 3.356 5.421 3.867 1.00 . A A . 19 LYS NZ 1 1 15 5814 1 1 19 LYS O O 8.074 3.551 2.336 1.00 . A A . 19 LYS O 1 1 15 5815 1 1 20 LEU C C 8.980 0.514 3.881 1.00 . A A . 20 LEU C 1 1 15 5816 1 1 20 LEU CA C 7.690 1.332 3.966 1.00 . A A . 20 LEU CA 1 1 15 5817 1 1 20 LEU CB C 6.639 0.727 4.900 1.00 . A A . 20 LEU CB 1 1 15 5818 1 1 20 LEU CD1 C 8.024 -0.873 6.270 1.00 . A A . 20 LEU CD1 1 1 15 5819 1 1 20 LEU CD2 C 5.568 -1.349 5.850 1.00 . A A . 20 LEU CD2 1 1 15 5820 1 1 20 LEU CG C 6.855 -0.736 5.294 1.00 . A A . 20 LEU CG 1 1 15 5821 1 1 20 LEU H H 6.585 0.750 2.299 1.00 . A A . 20 LEU H 1 1 15 5822 1 1 20 LEU HA H 7.934 2.321 4.354 1.00 . A A . 20 LEU HA 1 1 15 5823 1 1 20 LEU HB3 H 5.664 0.814 4.420 1.00 . A A . 20 LEU HB3 1 1 15 5824 1 1 20 LEU HD11 H 7.683 -1.370 7.179 1.00 . A A . 20 LEU HD11 1 1 15 5825 1 1 20 LEU HD12 H 8.815 -1.464 5.808 1.00 . A A . 20 LEU HD12 1 1 15 5826 1 1 20 LEU HD13 H 8.409 0.117 6.519 1.00 . A A . 20 LEU HD13 1 1 15 5827 1 1 20 LEU HD21 H 5.489 -2.385 5.525 1.00 . A A . 20 LEU HD21 1 1 15 5828 1 1 20 LEU HD22 H 5.589 -1.310 6.940 1.00 . A A . 20 LEU HD22 1 1 15 5829 1 1 20 LEU HD23 H 4.710 -0.786 5.484 1.00 . A A . 20 LEU HD23 1 1 15 5830 1 1 20 LEU HG H 7.117 -1.296 4.396 1.00 . A A . 20 LEU HG 1 1 15 5831 1 1 20 LEU N N 7.145 1.510 2.632 1.00 . A A . 20 LEU N 1 1 15 5832 1 1 20 LEU O O 9.764 0.484 4.827 1.00 . A A . 20 LEU O 1 1 15 5833 1 1 21 PHE C C 11.610 -0.095 2.546 1.00 . A A . 21 PHE C 1 1 15 5834 1 1 21 PHE CA C 10.340 -0.946 2.514 1.00 . A A . 21 PHE CA 1 1 15 5835 1 1 21 PHE CB C 10.196 -1.574 1.126 1.00 . A A . 21 PHE CB 1 1 15 5836 1 1 21 PHE CD1 C 9.669 -3.930 1.790 1.00 . A A . 21 PHE CD1 1 1 15 5837 1 1 21 PHE CD2 C 11.508 -3.567 0.363 1.00 . A A . 21 PHE CD2 1 1 15 5838 1 1 21 PHE CE1 C 9.921 -5.327 1.759 1.00 . A A . 21 PHE CE1 1 1 15 5839 1 1 21 PHE CE2 C 11.760 -4.963 0.332 1.00 . A A . 21 PHE CE2 1 1 15 5840 1 1 21 PHE CG C 10.468 -3.079 1.092 1.00 . A A . 21 PHE CG 1 1 15 5841 1 1 21 PHE CZ C 10.962 -5.814 1.029 1.00 . A A . 21 PHE CZ 1 1 15 5842 1 1 21 PHE H H 8.515 -0.100 1.971 1.00 . A A . 21 PHE H 1 1 15 5843 1 1 21 PHE HA H 10.380 -1.684 3.316 1.00 . A A . 21 PHE HA 1 1 15 5844 1 1 21 PHE HB3 H 10.881 -1.076 0.441 1.00 . A A . 21 PHE HB3 1 1 15 5845 1 1 21 PHE HD1 H 8.836 -3.540 2.374 1.00 . A A . 21 PHE HD1 1 1 15 5846 1 1 21 PHE HD2 H 12.148 -2.884 -0.197 1.00 . A A . 21 PHE HD2 1 1 15 5847 1 1 21 PHE HE1 H 9.281 -6.010 2.318 1.00 . A A . 21 PHE HE1 1 1 15 5848 1 1 21 PHE HE2 H 12.593 -5.353 -0.252 1.00 . A A . 21 PHE HE2 1 1 15 5849 1 1 21 PHE HZ H 11.154 -6.887 1.005 1.00 . A A . 21 PHE HZ 1 1 15 5850 1 1 21 PHE N N 9.159 -0.130 2.737 1.00 . A A . 21 PHE N 1 1 15 5851 1 1 21 PHE O O 12.709 -0.617 2.728 1.00 . A A . 21 PHE O 1 1 15 5852 1 1 22 LYS C C 13.133 2.196 3.777 1.00 . A A . 22 LYS C 1 1 15 5853 1 1 22 LYS CA C 12.534 2.134 2.371 1.00 . A A . 22 LYS CA 1 1 15 5854 1 1 22 LYS CB C 12.099 3.497 1.827 1.00 . A A . 22 LYS CB 1 1 15 5855 1 1 22 LYS CD C 10.434 3.580 3.719 1.00 . A A . 22 LYS CD 1 1 15 5856 1 1 22 LYS CE C 11.281 4.546 4.552 1.00 . A A . 22 LYS CE 1 1 15 5857 1 1 22 LYS CG C 10.655 3.809 2.222 1.00 . A A . 22 LYS CG 1 1 15 5858 1 1 22 LYS H H 10.521 1.621 2.217 1.00 . A A . 22 LYS H 1 1 15 5859 1 1 22 LYS HA H 13.289 1.742 1.690 1.00 . A A . 22 LYS HA 1 1 15 5860 1 1 22 LYS HB3 H 12.193 3.505 0.741 1.00 . A A . 22 LYS HB3 1 1 15 5861 1 1 22 LYS HD3 H 10.690 2.553 3.975 1.00 . A A . 22 LYS HD3 1 1 15 5862 1 1 22 LYS HE3 H 12.285 4.141 4.678 1.00 . A A . 22 LYS HE3 1 1 15 5863 1 1 22 LYS HG3 H 9.973 3.180 1.650 1.00 . A A . 22 LYS HG3 1 1 15 5864 1 1 22 LYS HZ1 H 11.799 5.779 3.007 1.00 . A A . 22 LYS HZ1 1 1 15 5865 1 1 22 LYS HZ2 H 10.428 6.229 3.768 1.00 . A A . 22 LYS HZ2 1 1 15 5866 1 1 22 LYS HZ3 H 11.878 6.498 4.470 1.00 . A A . 22 LYS HZ3 1 1 15 5867 1 1 22 LYS N N 11.418 1.204 2.365 1.00 . A A . 22 LYS N 1 1 15 5868 1 1 22 LYS NZ N 11.352 5.870 3.896 1.00 . A A . 22 LYS NZ 1 1 15 5869 1 1 22 LYS O O 14.159 2.842 3.991 1.00 . A A . 22 LYS O 1 1 15 5870 1 1 23 LYS C C 13.260 0.045 6.469 1.00 . A A . 23 LYS C 1 1 15 5871 1 1 23 LYS CA C 12.923 1.486 6.080 1.00 . A A . 23 LYS CA 1 1 15 5872 1 1 23 LYS CB C 11.893 2.146 6.998 1.00 . A A . 23 LYS CB 1 1 15 5873 1 1 23 LYS CD C 10.311 1.080 8.647 1.00 . A A . 23 LYS CD 1 1 15 5874 1 1 23 LYS CE C 9.458 2.245 9.153 1.00 . A A . 23 LYS CE 1 1 15 5875 1 1 23 LYS CG C 10.660 1.257 7.167 1.00 . A A . 23 LYS CG 1 1 15 5876 1 1 23 LYS H H 11.636 0.993 4.518 1.00 . A A . 23 LYS H 1 1 15 5877 1 1 23 LYS HA H 13.835 2.081 6.137 1.00 . A A . 23 LYS HA 1 1 15 5878 1 1 23 LYS HB3 H 11.597 3.110 6.583 1.00 . A A . 23 LYS HB3 1 1 15 5879 1 1 23 LYS HD3 H 11.226 1.012 9.234 1.00 . A A . 23 LYS HD3 1 1 15 5880 1 1 23 LYS HE3 H 8.808 1.904 9.959 1.00 . A A . 23 LYS HE3 1 1 15 5881 1 1 23 LYS HG3 H 10.843 0.284 6.714 1.00 . A A . 23 LYS HG3 1 1 15 5882 1 1 23 LYS HZ1 H 10.140 4.171 9.099 1.00 . A A . 23 LYS HZ1 1 1 15 5883 1 1 23 LYS HZ2 H 10.124 3.526 10.599 1.00 . A A . 23 LYS HZ2 1 1 15 5884 1 1 23 LYS HZ3 H 11.281 3.087 9.534 1.00 . A A . 23 LYS HZ3 1 1 15 5885 1 1 23 LYS N N 12.469 1.516 4.699 1.00 . A A . 23 LYS N 1 1 15 5886 1 1 23 LYS NZ N 10.320 3.347 9.636 1.00 . A A . 23 LYS NZ 1 1 15 5887 1 1 23 LYS O O 14.105 -0.187 7.333 1.00 . A A . 23 LYS O 1 1 15 5888 1 1 24 TRP C C 13.976 -2.766 5.227 1.00 . A A . 24 TRP C 1 1 15 5889 1 1 24 TRP CA C 12.796 -2.297 6.083 1.00 . A A . 24 TRP CA 1 1 15 5890 1 1 24 TRP CB C 11.520 -3.103 5.835 1.00 . A A . 24 TRP CB 1 1 15 5891 1 1 24 TRP CD1 C 10.622 -2.378 8.143 1.00 . A A . 24 TRP CD1 1 1 15 5892 1 1 24 TRP CD2 C 9.234 -3.709 7.043 1.00 . A A . 24 TRP CD2 1 1 15 5893 1 1 24 TRP CE2 C 8.639 -3.398 8.248 1.00 . A A . 24 TRP CE2 1 1 15 5894 1 1 24 TRP CE3 C 8.600 -4.545 6.107 1.00 . A A . 24 TRP CE3 1 1 15 5895 1 1 24 TRP CG C 10.513 -3.045 6.986 1.00 . A A . 24 TRP CG 1 1 15 5896 1 1 24 TRP CH2 C 6.729 -4.715 7.713 1.00 . A A . 24 TRP CH2 1 1 15 5897 1 1 24 TRP CZ2 C 7.380 -3.880 8.630 1.00 . A A . 24 TRP CZ2 1 1 15 5898 1 1 24 TRP CZ3 C 7.343 -5.019 6.504 1.00 . A A . 24 TRP CZ3 1 1 15 5899 1 1 24 TRP H H 11.894 -0.689 5.115 1.00 . A A . 24 TRP H 1 1 15 5900 1 1 24 TRP HA H 13.038 -2.402 7.141 1.00 . A A . 24 TRP HA 1 1 15 5901 1 1 24 TRP HB3 H 11.789 -4.144 5.655 1.00 . A A . 24 TRP HB3 1 1 15 5902 1 1 24 TRP HD1 H 11.480 -1.767 8.421 1.00 . A A . 24 TRP HD1 1 1 15 5903 1 1 24 TRP HE1 H 9.344 -2.133 9.926 1.00 . A A . 24 TRP HE1 1 1 15 5904 1 1 24 TRP HE3 H 9.048 -4.805 5.149 1.00 . A A . 24 TRP HE3 1 1 15 5905 1 1 24 TRP HH2 H 5.747 -5.125 7.947 1.00 . A A . 24 TRP HH2 1 1 15 5906 1 1 24 TRP HZ2 H 6.932 -3.620 9.588 1.00 . A A . 24 TRP HZ2 1 1 15 5907 1 1 24 TRP HZ3 H 6.808 -5.671 5.814 1.00 . A A . 24 TRP HZ3 1 1 15 5908 1 1 24 TRP N N 12.580 -0.885 5.815 1.00 . A A . 24 TRP N 1 1 15 5909 1 1 24 TRP NE1 N 9.509 -2.563 8.939 1.00 . A A . 24 TRP NE1 1 1 15 5910 1 1 24 TRP O O 15.044 -3.074 5.752 1.00 . A A . 24 TRP O 1 1 15 5911 1 1 25 GLY C C 15.226 -2.064 2.109 1.00 . A A . 25 GLY C 1 1 15 5912 1 1 25 GLY CA C 14.770 -3.229 2.990 1.00 . A A . 25 GLY CA 1 1 15 5913 1 1 25 GLY H H 12.869 -2.550 3.505 1.00 . A A . 25 GLY H 1 1 15 5914 1 1 25 GLY HA2 H 15.621 -3.630 3.540 1.00 . A A . 25 GLY HA2 1 1 15 5915 1 1 25 GLY HA3 H 14.388 -4.035 2.364 1.00 . A A . 25 GLY HA3 1 1 15 5916 1 1 25 GLY N N 13.741 -2.803 3.924 1.00 . A A . 25 GLY N 1 1 15 5917 1 1 25 GLY O O 14.478 -1.599 1.252 1.00 . A A . 25 GLY O 1 1 15 5918 1 1 26 TRP C C 16.734 -0.777 0.110 1.00 . A A . 26 TRP C 1 1 15 5919 1 1 26 TRP CA C 17.020 -0.525 1.592 1.00 . A A . 26 TRP CA 1 1 15 5920 1 1 26 TRP CB C 18.510 -0.360 1.893 1.00 . A A . 26 TRP CB 1 1 15 5921 1 1 26 TRP CD1 C 18.352 2.190 2.266 1.00 . A A . 26 TRP CD1 1 1 15 5922 1 1 26 TRP CD2 C 20.265 1.558 1.345 1.00 . A A . 26 TRP CD2 1 1 15 5923 1 1 26 TRP CE2 C 20.310 2.929 1.489 1.00 . A A . 26 TRP CE2 1 1 15 5924 1 1 26 TRP CE3 C 21.340 0.844 0.785 1.00 . A A . 26 TRP CE3 1 1 15 5925 1 1 26 TRP CG C 18.996 1.090 1.851 1.00 . A A . 26 TRP CG 1 1 15 5926 1 1 26 TRP CH2 C 22.489 3.017 0.536 1.00 . A A . 26 TRP CH2 1 1 15 5927 1 1 26 TRP CZ2 C 21.406 3.706 1.096 1.00 . A A . 26 TRP CZ2 1 1 15 5928 1 1 26 TRP CZ3 C 22.429 1.635 0.398 1.00 . A A . 26 TRP CZ3 1 1 15 5929 1 1 26 TRP H H 17.056 -2.011 3.051 1.00 . A A . 26 TRP H 1 1 15 5930 1 1 26 TRP HA H 16.526 0.391 1.916 1.00 . A A . 26 TRP HA 1 1 15 5931 1 1 26 TRP HB3 H 19.083 -0.945 1.174 1.00 . A A . 26 TRP HB3 1 1 15 5932 1 1 26 TRP HD1 H 17.355 2.186 2.706 1.00 . A A . 26 TRP HD1 1 1 15 5933 1 1 26 TRP HE1 H 18.819 4.347 2.315 1.00 . A A . 26 TRP HE1 1 1 15 5934 1 1 26 TRP HE3 H 21.329 -0.239 0.661 1.00 . A A . 26 TRP HE3 1 1 15 5935 1 1 26 TRP HH2 H 23.374 3.562 0.209 1.00 . A A . 26 TRP HH2 1 1 15 5936 1 1 26 TRP HZ2 H 21.417 4.789 1.219 1.00 . A A . 26 TRP HZ2 1 1 15 5937 1 1 26 TRP HZ3 H 23.290 1.132 -0.041 1.00 . A A . 26 TRP HZ3 1 1 15 5938 1 1 26 TRP N N 16.454 -1.626 2.352 1.00 . A A . 26 TRP N 1 1 15 5939 1 1 26 TRP NE1 N 19.109 3.326 2.065 1.00 . A A . 26 TRP NE1 1 1 15 5940 1 1 26 TRP O O 17.444 -1.542 -0.541 1.00 . A A . 26 TRP O 1 1 16 5941 1 1 1 LYS C C -10.853 8.122 -0.826 1.00 . A A . 1 LYS C 1 1 16 5942 1 1 1 LYS CA C -11.370 6.683 -0.842 1.00 . A A . 1 LYS CA 1 1 16 5943 1 1 1 LYS CB C -12.834 6.560 -1.269 1.00 . A A . 1 LYS CB 1 1 16 5944 1 1 1 LYS CD C -12.480 5.427 -3.494 1.00 . A A . 1 LYS CD 1 1 16 5945 1 1 1 LYS CE C -13.378 6.299 -4.374 1.00 . A A . 1 LYS CE 1 1 16 5946 1 1 1 LYS CG C -13.061 5.286 -2.086 1.00 . A A . 1 LYS CG 1 1 16 5947 1 1 1 LYS H1 H -11.925 5.518 0.794 1.00 . A A . 1 LYS H1 1 1 16 5948 1 1 1 LYS HA H -10.777 6.110 -1.555 1.00 . A A . 1 LYS HA 1 1 16 5949 1 1 1 LYS HB3 H -13.119 7.431 -1.859 1.00 . A A . 1 LYS HB3 1 1 16 5950 1 1 1 LYS HD3 H -12.368 4.442 -3.946 1.00 . A A . 1 LYS HD3 1 1 16 5951 1 1 1 LYS HE3 H -14.364 6.390 -3.919 1.00 . A A . 1 LYS HE3 1 1 16 5952 1 1 1 LYS HG3 H -14.129 5.077 -2.149 1.00 . A A . 1 LYS HG3 1 1 16 5953 1 1 1 LYS HZ1 H -12.986 8.207 -3.755 1.00 . A A . 1 LYS HZ1 1 1 16 5954 1 1 1 LYS HZ2 H -11.791 7.555 -4.657 1.00 . A A . 1 LYS HZ2 1 1 16 5955 1 1 1 LYS HZ3 H -13.166 8.070 -5.373 1.00 . A A . 1 LYS HZ3 1 1 16 5956 1 1 1 LYS N N -11.170 6.086 0.468 1.00 . A A . 1 LYS N 1 1 16 5957 1 1 1 LYS NZ N -12.782 7.641 -4.554 1.00 . A A . 1 LYS NZ 1 1 16 5958 1 1 1 LYS O O -9.886 8.447 -1.514 1.00 . A A . 1 LYS O 1 1 16 5959 1 1 2 SER C C -10.692 10.652 1.510 1.00 . A A . 2 SER C 1 1 16 5960 1 1 2 SER CA C -11.140 10.347 0.080 1.00 . A A . 2 SER CA 1 1 16 5961 1 1 2 SER CB C -12.296 11.266 -0.321 1.00 . A A . 2 SER CB 1 1 16 5962 1 1 2 SER H H -12.306 8.677 0.521 1.00 . A A . 2 SER H 1 1 16 5963 1 1 2 SER HA H -10.313 10.478 -0.617 1.00 . A A . 2 SER HA 1 1 16 5964 1 1 2 SER HB3 H -12.492 11.157 -1.388 1.00 . A A . 2 SER HB3 1 1 16 5965 1 1 2 SER HG H -14.019 11.816 0.534 1.00 . A A . 2 SER HG 1 1 16 5966 1 1 2 SER N N -11.520 8.949 -0.034 1.00 . A A . 2 SER N 1 1 16 5967 1 1 2 SER O O -9.572 11.112 1.728 1.00 . A A . 2 SER O 1 1 16 5968 1 1 2 SER OG O -13.485 10.981 0.412 1.00 . A A . 2 SER OG 1 1 16 5969 1 1 3 SER C C -11.179 9.290 4.596 1.00 . A A . 3 SER C 1 1 16 5970 1 1 3 SER CA C -11.298 10.622 3.851 1.00 . A A . 3 SER CA 1 1 16 5971 1 1 3 SER CB C -12.376 11.495 4.495 1.00 . A A . 3 SER CB 1 1 16 5972 1 1 3 SER H H -12.496 10.007 2.262 1.00 . A A . 3 SER H 1 1 16 5973 1 1 3 SER HA H -10.347 11.153 3.863 1.00 . A A . 3 SER HA 1 1 16 5974 1 1 3 SER HB3 H -12.460 11.247 5.553 1.00 . A A . 3 SER HB3 1 1 16 5975 1 1 3 SER HG H -12.259 13.176 3.414 1.00 . A A . 3 SER HG 1 1 16 5976 1 1 3 SER N N -11.588 10.382 2.448 1.00 . A A . 3 SER N 1 1 16 5977 1 1 3 SER O O -12.092 8.896 5.320 1.00 . A A . 3 SER O 1 1 16 5978 1 1 3 SER OG O -12.091 12.885 4.356 1.00 . A A . 3 SER OG 1 1 16 5979 1 1 4 ALA C C -8.289 7.087 5.060 1.00 . A A . 4 ALA C 1 1 16 5980 1 1 4 ALA CA C -9.795 7.356 5.038 1.00 . A A . 4 ALA CA 1 1 16 5981 1 1 4 ALA CB C -10.573 6.258 4.310 1.00 . A A . 4 ALA CB 1 1 16 5982 1 1 4 ALA H H -9.307 8.963 3.804 1.00 . A A . 4 ALA H 1 1 16 5983 1 1 4 ALA HA H -10.158 7.425 6.063 1.00 . A A . 4 ALA HA 1 1 16 5984 1 1 4 ALA HB1 H -11.375 5.895 4.953 1.00 . A A . 4 ALA HB1 1 1 16 5985 1 1 4 ALA HB2 H -10.997 6.662 3.391 1.00 . A A . 4 ALA HB2 1 1 16 5986 1 1 4 ALA HB3 H -9.900 5.435 4.070 1.00 . A A . 4 ALA HB3 1 1 16 5987 1 1 4 ALA N N -10.044 8.635 4.394 1.00 . A A . 4 ALA N 1 1 16 5988 1 1 4 ALA O O -7.505 7.885 4.546 1.00 . A A . 4 ALA O 1 1 16 5989 1 1 5 TYR C C -6.198 4.471 4.753 1.00 . A A . 5 TYR C 1 1 16 5990 1 1 5 TYR CA C -6.531 5.578 5.755 1.00 . A A . 5 TYR CA 1 1 16 5991 1 1 5 TYR CB C -6.337 5.041 7.174 1.00 . A A . 5 TYR CB 1 1 16 5992 1 1 5 TYR CD1 C -5.858 2.568 7.090 1.00 . A A . 5 TYR CD1 1 1 16 5993 1 1 5 TYR CD2 C -8.038 3.275 7.766 1.00 . A A . 5 TYR CD2 1 1 16 5994 1 1 5 TYR CE1 C -6.253 1.192 7.254 1.00 . A A . 5 TYR CE1 1 1 16 5995 1 1 5 TYR CE2 C -8.434 1.901 7.931 1.00 . A A . 5 TYR CE2 1 1 16 5996 1 1 5 TYR CG C -6.758 3.580 7.348 1.00 . A A . 5 TYR CG 1 1 16 5997 1 1 5 TYR CZ C -7.522 0.927 7.667 1.00 . A A . 5 TYR CZ 1 1 16 5998 1 1 5 TYR H H -8.574 5.320 6.074 1.00 . A A . 5 TYR H 1 1 16 5999 1 1 5 TYR HA H -5.926 6.456 5.530 1.00 . A A . 5 TYR HA 1 1 16 6000 1 1 5 TYR HB3 H -6.910 5.658 7.867 1.00 . A A . 5 TYR HB3 1 1 16 6001 1 1 5 TYR HD1 H -4.847 2.808 6.761 1.00 . A A . 5 TYR HD1 1 1 16 6002 1 1 5 TYR HD2 H -8.749 4.076 7.971 1.00 . A A . 5 TYR HD2 1 1 16 6003 1 1 5 TYR HE1 H -5.552 0.383 7.053 1.00 . A A . 5 TYR HE1 1 1 16 6004 1 1 5 TYR HE2 H -9.441 1.646 8.260 1.00 . A A . 5 TYR HE2 1 1 16 6005 1 1 5 TYR HH H -8.606 -0.604 7.160 1.00 . A A . 5 TYR HH 1 1 16 6006 1 1 5 TYR N N -7.930 5.962 5.659 1.00 . A A . 5 TYR N 1 1 16 6007 1 1 5 TYR O O -5.142 3.846 4.842 1.00 . A A . 5 TYR O 1 1 16 6008 1 1 5 TYR OH O -7.895 -0.371 7.822 1.00 . A A . 5 TYR OH 1 1 16 6009 1 1 6 SER C C -7.879 3.498 1.629 1.00 . A A . 6 SER C 1 1 16 6010 1 1 6 SER CA C -6.933 3.241 2.804 1.00 . A A . 6 SER CA 1 1 16 6011 1 1 6 SER CB C -7.167 1.843 3.378 1.00 . A A . 6 SER CB 1 1 16 6012 1 1 6 SER H H -7.972 4.775 3.755 1.00 . A A . 6 SER H 1 1 16 6013 1 1 6 SER HA H -5.894 3.334 2.486 1.00 . A A . 6 SER HA 1 1 16 6014 1 1 6 SER HB3 H -6.289 1.533 3.946 1.00 . A A . 6 SER HB3 1 1 16 6015 1 1 6 SER HG H -9.042 2.367 3.837 1.00 . A A . 6 SER HG 1 1 16 6016 1 1 6 SER N N -7.116 4.263 3.821 1.00 . A A . 6 SER N 1 1 16 6017 1 1 6 SER O O -8.773 4.337 1.719 1.00 . A A . 6 SER O 1 1 16 6018 1 1 6 SER OG O -8.316 1.797 4.219 1.00 . A A . 6 SER OG 1 1 16 6019 1 1 7 LEU C C -8.800 1.506 -1.186 1.00 . A A . 7 LEU C 1 1 16 6020 1 1 7 LEU CA C -8.468 2.896 -0.639 1.00 . A A . 7 LEU CA 1 1 16 6021 1 1 7 LEU CB C -7.786 3.811 -1.657 1.00 . A A . 7 LEU CB 1 1 16 6022 1 1 7 LEU CD1 C -6.123 2.689 -3.186 1.00 . A A . 7 LEU CD1 1 1 16 6023 1 1 7 LEU CD2 C -5.504 4.835 -1.982 1.00 . A A . 7 LEU CD2 1 1 16 6024 1 1 7 LEU CG C -6.304 3.533 -1.922 1.00 . A A . 7 LEU CG 1 1 16 6025 1 1 7 LEU H H -6.918 2.079 0.488 1.00 . A A . 7 LEU H 1 1 16 6026 1 1 7 LEU HA H -9.398 3.381 -0.342 1.00 . A A . 7 LEU HA 1 1 16 6027 1 1 7 LEU HB3 H -7.885 4.841 -1.314 1.00 . A A . 7 LEU HB3 1 1 16 6028 1 1 7 LEU HD11 H -5.823 3.334 -4.012 1.00 . A A . 7 LEU HD11 1 1 16 6029 1 1 7 LEU HD12 H -5.353 1.938 -3.013 1.00 . A A . 7 LEU HD12 1 1 16 6030 1 1 7 LEU HD13 H -7.063 2.196 -3.431 1.00 . A A . 7 LEU HD13 1 1 16 6031 1 1 7 LEU HD21 H -4.439 4.609 -1.936 1.00 . A A . 7 LEU HD21 1 1 16 6032 1 1 7 LEU HD22 H -5.724 5.354 -2.914 1.00 . A A . 7 LEU HD22 1 1 16 6033 1 1 7 LEU HD23 H -5.778 5.469 -1.139 1.00 . A A . 7 LEU HD23 1 1 16 6034 1 1 7 LEU HG H -5.911 2.951 -1.088 1.00 . A A . 7 LEU HG 1 1 16 6035 1 1 7 LEU N N -7.648 2.759 0.553 1.00 . A A . 7 LEU N 1 1 16 6036 1 1 7 LEU O O -9.969 1.142 -1.299 1.00 . A A . 7 LEU O 1 1 16 6037 1 1 8 GLN C C -6.788 -1.484 -1.552 1.00 . A A . 8 GLN C 1 1 16 6038 1 1 8 GLN CA C -7.915 -0.574 -2.045 1.00 . A A . 8 GLN CA 1 1 16 6039 1 1 8 GLN CB C -7.974 -0.553 -3.574 1.00 . A A . 8 GLN CB 1 1 16 6040 1 1 8 GLN CD C -8.654 -2.163 -5.392 1.00 . A A . 8 GLN CD 1 1 16 6041 1 1 8 GLN CG C -9.078 -1.477 -4.093 1.00 . A A . 8 GLN CG 1 1 16 6042 1 1 8 GLN H H -6.802 1.071 -1.417 1.00 . A A . 8 GLN H 1 1 16 6043 1 1 8 GLN HA H -8.870 -0.925 -1.655 1.00 . A A . 8 GLN HA 1 1 16 6044 1 1 8 GLN HB3 H -7.013 -0.865 -3.983 1.00 . A A . 8 GLN HB3 1 1 16 6045 1 1 8 GLN HE21 H -10.347 -1.469 -6.257 1.00 . A A . 8 GLN HE21 1 1 16 6046 1 1 8 GLN HE22 H -9.324 -2.413 -7.286 1.00 . A A . 8 GLN HE22 1 1 16 6047 1 1 8 GLN HG3 H -9.989 -0.901 -4.261 1.00 . A A . 8 GLN HG3 1 1 16 6048 1 1 8 GLN N N -7.749 0.767 -1.512 1.00 . A A . 8 GLN N 1 1 16 6049 1 1 8 GLN NE2 N -9.513 -2.002 -6.395 1.00 . A A . 8 GLN NE2 1 1 16 6050 1 1 8 GLN O O -5.706 -1.009 -1.210 1.00 . A A . 8 GLN O 1 1 16 6051 1 1 8 GLN OE1 O -7.615 -2.797 -5.478 1.00 . A A . 8 GLN OE1 1 1 16 6052 1 1 9 MET C C -6.226 -5.054 -1.887 1.00 . A A . 9 MET C 1 1 16 6053 1 1 9 MET CA C -6.104 -3.756 -1.086 1.00 . A A . 9 MET CA 1 1 16 6054 1 1 9 MET CB C -6.318 -4.052 0.401 1.00 . A A . 9 MET CB 1 1 16 6055 1 1 9 MET CE C -10.028 -4.987 1.811 1.00 . A A . 9 MET CE 1 1 16 6056 1 1 9 MET CG C -7.774 -3.810 0.803 1.00 . A A . 9 MET CG 1 1 16 6057 1 1 9 MET H H -7.962 -3.155 -1.811 1.00 . A A . 9 MET H 1 1 16 6058 1 1 9 MET HA H -5.130 -3.301 -1.264 1.00 . A A . 9 MET HA 1 1 16 6059 1 1 9 MET HB3 H -5.662 -3.420 0.999 1.00 . A A . 9 MET HB3 1 1 16 6060 1 1 9 MET HE1 H -10.350 -5.993 1.539 1.00 . A A . 9 MET HE1 1 1 16 6061 1 1 9 MET HE2 H -10.529 -4.681 2.729 1.00 . A A . 9 MET HE2 1 1 16 6062 1 1 9 MET HE3 H -10.285 -4.295 1.008 1.00 . A A . 9 MET HE3 1 1 16 6063 1 1 9 MET HG3 H -8.423 -3.912 -0.067 1.00 . A A . 9 MET HG3 1 1 16 6064 1 1 9 MET N N -7.080 -2.776 -1.531 1.00 . A A . 9 MET N 1 1 16 6065 1 1 9 MET O O -5.230 -5.575 -2.387 1.00 . A A . 9 MET O 1 1 16 6066 1 1 9 MET SD S -8.261 -4.976 2.064 1.00 . A A . 9 MET SD 1 1 16 6067 1 1 10 GLY C C -6.761 -7.878 -2.287 1.00 . A A . 10 GLY C 1 1 16 6068 1 1 10 GLY CA C -7.720 -6.766 -2.716 1.00 . A A . 10 GLY CA 1 1 16 6069 1 1 10 GLY H H -8.260 -5.109 -1.575 1.00 . A A . 10 GLY H 1 1 16 6070 1 1 10 GLY HA2 H -8.749 -7.081 -2.545 1.00 . A A . 10 GLY HA2 1 1 16 6071 1 1 10 GLY HA3 H -7.618 -6.584 -3.786 1.00 . A A . 10 GLY HA3 1 1 16 6072 1 1 10 GLY N N -7.456 -5.539 -1.984 1.00 . A A . 10 GLY N 1 1 16 6073 1 1 10 GLY O O -7.044 -8.618 -1.345 1.00 . A A . 10 GLY O 1 1 16 6074 1 1 11 ALA C C -3.325 -8.586 -3.376 1.00 . A A . 11 ALA C 1 1 16 6075 1 1 11 ALA CA C -4.644 -8.971 -2.703 1.00 . A A . 11 ALA CA 1 1 16 6076 1 1 11 ALA CB C -5.151 -10.342 -3.157 1.00 . A A . 11 ALA CB 1 1 16 6077 1 1 11 ALA H H -5.424 -7.356 -3.763 1.00 . A A . 11 ALA H 1 1 16 6078 1 1 11 ALA HA H -4.500 -8.989 -1.623 1.00 . A A . 11 ALA HA 1 1 16 6079 1 1 11 ALA HB1 H -5.965 -10.211 -3.869 1.00 . A A . 11 ALA HB1 1 1 16 6080 1 1 11 ALA HB2 H -4.338 -10.892 -3.630 1.00 . A A . 11 ALA HB2 1 1 16 6081 1 1 11 ALA HB3 H -5.511 -10.900 -2.292 1.00 . A A . 11 ALA HB3 1 1 16 6082 1 1 11 ALA N N -5.646 -7.962 -2.999 1.00 . A A . 11 ALA N 1 1 16 6083 1 1 11 ALA O O -2.294 -8.480 -2.713 1.00 . A A . 11 ALA O 1 1 16 6084 1 1 12 THR C C -1.722 -6.636 -5.027 1.00 . A A . 12 THR C 1 1 16 6085 1 1 12 THR CA C -2.225 -8.017 -5.453 1.00 . A A . 12 THR CA 1 1 16 6086 1 1 12 THR CB C -2.585 -8.101 -6.937 1.00 . A A . 12 THR CB 1 1 16 6087 1 1 12 THR CG2 C -3.140 -9.472 -7.328 1.00 . A A . 12 THR CG2 1 1 16 6088 1 1 12 THR H H -4.243 -8.477 -5.215 1.00 . A A . 12 THR H 1 1 16 6089 1 1 12 THR HA H -1.430 -8.728 -5.230 1.00 . A A . 12 THR HA 1 1 16 6090 1 1 12 THR HB H -1.732 -7.834 -7.561 1.00 . A A . 12 THR HB 1 1 16 6091 1 1 12 THR HG1 H -3.970 -7.160 -8.035 1.00 . A A . 12 THR HG1 1 1 16 6092 1 1 12 THR HG21 H -2.709 -10.237 -6.682 1.00 . A A . 12 THR HG21 1 1 16 6093 1 1 12 THR HG22 H -4.225 -9.471 -7.217 1.00 . A A . 12 THR HG22 1 1 16 6094 1 1 12 THR HG23 H -2.882 -9.687 -8.366 1.00 . A A . 12 THR HG23 1 1 16 6095 1 1 12 THR N N -3.400 -8.388 -4.683 1.00 . A A . 12 THR N 1 1 16 6096 1 1 12 THR O O -0.527 -6.448 -4.804 1.00 . A A . 12 THR O 1 1 16 6097 1 1 12 THR OG1 O -3.700 -7.224 -7.074 1.00 . A A . 12 THR OG1 1 1 16 6098 1 1 13 ALA C C -1.328 -4.388 -3.374 1.00 . A A . 13 ALA C 1 1 16 6099 1 1 13 ALA CA C -2.327 -4.348 -4.531 1.00 . A A . 13 ALA CA 1 1 16 6100 1 1 13 ALA CB C -3.608 -3.593 -4.169 1.00 . A A . 13 ALA CB 1 1 16 6101 1 1 13 ALA H H -3.630 -5.867 -5.110 1.00 . A A . 13 ALA H 1 1 16 6102 1 1 13 ALA HA H -1.861 -3.857 -5.386 1.00 . A A . 13 ALA HA 1 1 16 6103 1 1 13 ALA HB1 H -3.856 -2.892 -4.966 1.00 . A A . 13 ALA HB1 1 1 16 6104 1 1 13 ALA HB2 H -4.426 -4.304 -4.044 1.00 . A A . 13 ALA HB2 1 1 16 6105 1 1 13 ALA HB3 H -3.457 -3.046 -3.239 1.00 . A A . 13 ALA HB3 1 1 16 6106 1 1 13 ALA N N -2.660 -5.705 -4.926 1.00 . A A . 13 ALA N 1 1 16 6107 1 1 13 ALA O O -0.385 -3.599 -3.336 1.00 . A A . 13 ALA O 1 1 16 6108 1 1 14 ILE C C 0.760 -5.451 -1.762 1.00 . A A . 14 ILE C 1 1 16 6109 1 1 14 ILE CA C -0.699 -5.469 -1.304 1.00 . A A . 14 ILE CA 1 1 16 6110 1 1 14 ILE CB C -1.080 -6.722 -0.512 1.00 . A A . 14 ILE CB 1 1 16 6111 1 1 14 ILE CD1 C -2.875 -7.846 0.857 1.00 . A A . 14 ILE CD1 1 1 16 6112 1 1 14 ILE CG1 C -2.529 -6.646 -0.027 1.00 . A A . 14 ILE CG1 1 1 16 6113 1 1 14 ILE CG2 C -0.101 -6.959 0.641 1.00 . A A . 14 ILE CG2 1 1 16 6114 1 1 14 ILE H H -2.337 -5.954 -2.498 1.00 . A A . 14 ILE H 1 1 16 6115 1 1 14 ILE HA H -0.868 -4.612 -0.652 1.00 . A A . 14 ILE HA 1 1 16 6116 1 1 14 ILE HB H -1.007 -7.583 -1.177 1.00 . A A . 14 ILE HB 1 1 16 6117 1 1 14 ILE HD11 H -3.127 -7.499 1.859 1.00 . A A . 14 ILE HD11 1 1 16 6118 1 1 14 ILE HD12 H -3.727 -8.377 0.431 1.00 . A A . 14 ILE HD12 1 1 16 6119 1 1 14 ILE HD13 H -2.018 -8.518 0.910 1.00 . A A . 14 ILE HD13 1 1 16 6120 1 1 14 ILE HG13 H -3.201 -6.615 -0.884 1.00 . A A . 14 ILE HG13 1 1 16 6121 1 1 14 ILE HG21 H -0.081 -8.021 0.887 1.00 . A A . 14 ILE HG21 1 1 16 6122 1 1 14 ILE HG22 H 0.896 -6.638 0.343 1.00 . A A . 14 ILE HG22 1 1 16 6123 1 1 14 ILE HG23 H -0.422 -6.390 1.513 1.00 . A A . 14 ILE HG23 1 1 16 6124 1 1 14 ILE N N -1.568 -5.316 -2.459 1.00 . A A . 14 ILE N 1 1 16 6125 1 1 14 ILE O O 1.561 -4.662 -1.261 1.00 . A A . 14 ILE O 1 1 16 6126 1 1 15 LYS C C 2.953 -5.013 -3.493 1.00 . A A . 15 LYS C 1 1 16 6127 1 1 15 LYS CA C 2.410 -6.421 -3.239 1.00 . A A . 15 LYS CA 1 1 16 6128 1 1 15 LYS CB C 2.438 -7.323 -4.474 1.00 . A A . 15 LYS CB 1 1 16 6129 1 1 15 LYS CD C 3.112 -5.931 -6.466 1.00 . A A . 15 LYS CD 1 1 16 6130 1 1 15 LYS CE C 4.086 -5.876 -7.646 1.00 . A A . 15 LYS CE 1 1 16 6131 1 1 15 LYS CG C 3.583 -6.934 -5.412 1.00 . A A . 15 LYS CG 1 1 16 6132 1 1 15 LYS H H 0.403 -6.965 -3.111 1.00 . A A . 15 LYS H 1 1 16 6133 1 1 15 LYS HA H 3.029 -6.898 -2.478 1.00 . A A . 15 LYS HA 1 1 16 6134 1 1 15 LYS HB3 H 1.489 -7.249 -5.004 1.00 . A A . 15 LYS HB3 1 1 16 6135 1 1 15 LYS HD3 H 3.024 -4.941 -6.018 1.00 . A A . 15 LYS HD3 1 1 16 6136 1 1 15 LYS HE3 H 3.976 -6.772 -8.257 1.00 . A A . 15 LYS HE3 1 1 16 6137 1 1 15 LYS HG3 H 3.976 -7.825 -5.902 1.00 . A A . 15 LYS HG3 1 1 16 6138 1 1 15 LYS HZ1 H 2.864 -4.622 -8.699 1.00 . A A . 15 LYS HZ1 1 1 16 6139 1 1 15 LYS HZ2 H 4.099 -3.856 -7.957 1.00 . A A . 15 LYS HZ2 1 1 16 6140 1 1 15 LYS HZ3 H 4.375 -4.727 -9.311 1.00 . A A . 15 LYS HZ3 1 1 16 6141 1 1 15 LYS N N 1.061 -6.327 -2.708 1.00 . A A . 15 LYS N 1 1 16 6142 1 1 15 LYS NZ N 3.835 -4.673 -8.470 1.00 . A A . 15 LYS NZ 1 1 16 6143 1 1 15 LYS O O 4.107 -4.723 -3.180 1.00 . A A . 15 LYS O 1 1 16 6144 1 1 16 GLN C C 2.978 -2.106 -3.092 1.00 . A A . 16 GLN C 1 1 16 6145 1 1 16 GLN CA C 2.474 -2.805 -4.356 1.00 . A A . 16 GLN CA 1 1 16 6146 1 1 16 GLN CB C 1.307 -2.037 -4.978 1.00 . A A . 16 GLN CB 1 1 16 6147 1 1 16 GLN CD C -0.473 -0.292 -4.595 1.00 . A A . 16 GLN CD 1 1 16 6148 1 1 16 GLN CG C 0.710 -1.043 -3.981 1.00 . A A . 16 GLN CG 1 1 16 6149 1 1 16 GLN H H 1.159 -4.420 -4.307 1.00 . A A . 16 GLN H 1 1 16 6150 1 1 16 GLN HA H 3.281 -2.880 -5.084 1.00 . A A . 16 GLN HA 1 1 16 6151 1 1 16 GLN HB3 H 0.537 -2.737 -5.303 1.00 . A A . 16 GLN HB3 1 1 16 6152 1 1 16 GLN HE21 H 0.569 1.430 -4.381 1.00 . A A . 16 GLN HE21 1 1 16 6153 1 1 16 GLN HE22 H -1.005 1.599 -5.085 1.00 . A A . 16 GLN HE22 1 1 16 6154 1 1 16 GLN HG3 H 1.475 -0.331 -3.669 1.00 . A A . 16 GLN HG3 1 1 16 6155 1 1 16 GLN N N 2.095 -4.176 -4.056 1.00 . A A . 16 GLN N 1 1 16 6156 1 1 16 GLN NE2 N -0.288 1.021 -4.695 1.00 . A A . 16 GLN NE2 1 1 16 6157 1 1 16 GLN O O 3.986 -1.400 -3.128 1.00 . A A . 16 GLN O 1 1 16 6158 1 1 16 GLN OE1 O -1.488 -0.867 -4.954 1.00 . A A . 16 GLN OE1 1 1 16 6159 1 1 17 VAL C C 4.071 -2.073 -0.403 1.00 . A A . 17 VAL C 1 1 16 6160 1 1 17 VAL CA C 2.617 -1.725 -0.730 1.00 . A A . 17 VAL CA 1 1 16 6161 1 1 17 VAL CB C 1.636 -2.170 0.355 1.00 . A A . 17 VAL CB 1 1 16 6162 1 1 17 VAL CG1 C 2.008 -3.552 0.897 1.00 . A A . 17 VAL CG1 1 1 16 6163 1 1 17 VAL CG2 C 1.563 -1.140 1.484 1.00 . A A . 17 VAL CG2 1 1 16 6164 1 1 17 VAL H H 1.437 -2.900 -1.982 1.00 . A A . 17 VAL H 1 1 16 6165 1 1 17 VAL HA H 2.531 -0.644 -0.840 1.00 . A A . 17 VAL HA 1 1 16 6166 1 1 17 VAL HB H 0.646 -2.244 -0.097 1.00 . A A . 17 VAL HB 1 1 16 6167 1 1 17 VAL HG11 H 2.324 -3.462 1.937 1.00 . A A . 17 VAL HG11 1 1 16 6168 1 1 17 VAL HG12 H 1.143 -4.212 0.836 1.00 . A A . 17 VAL HG12 1 1 16 6169 1 1 17 VAL HG13 H 2.823 -3.968 0.305 1.00 . A A . 17 VAL HG13 1 1 16 6170 1 1 17 VAL HG21 H 2.544 -1.036 1.945 1.00 . A A . 17 VAL HG21 1 1 16 6171 1 1 17 VAL HG22 H 1.248 -0.178 1.078 1.00 . A A . 17 VAL HG22 1 1 16 6172 1 1 17 VAL HG23 H 0.842 -1.472 2.232 1.00 . A A . 17 VAL HG23 1 1 16 6173 1 1 17 VAL N N 2.255 -2.326 -2.004 1.00 . A A . 17 VAL N 1 1 16 6174 1 1 17 VAL O O 4.782 -1.272 0.201 1.00 . A A . 17 VAL O 1 1 16 6175 1 1 18 LYS C C 6.804 -2.849 -1.346 1.00 . A A . 18 LYS C 1 1 16 6176 1 1 18 LYS CA C 5.823 -3.731 -0.571 1.00 . A A . 18 LYS CA 1 1 16 6177 1 1 18 LYS CB C 5.945 -5.222 -0.897 1.00 . A A . 18 LYS CB 1 1 16 6178 1 1 18 LYS CD C 7.067 -5.293 -3.155 1.00 . A A . 18 LYS CD 1 1 16 6179 1 1 18 LYS CE C 6.733 -6.606 -3.865 1.00 . A A . 18 LYS CE 1 1 16 6180 1 1 18 LYS CG C 7.244 -5.513 -1.651 1.00 . A A . 18 LYS CG 1 1 16 6181 1 1 18 LYS H H 3.881 -3.914 -1.305 1.00 . A A . 18 LYS H 1 1 16 6182 1 1 18 LYS HA H 6.021 -3.616 0.493 1.00 . A A . 18 LYS HA 1 1 16 6183 1 1 18 LYS HB3 H 5.093 -5.538 -1.498 1.00 . A A . 18 LYS HB3 1 1 16 6184 1 1 18 LYS HD3 H 7.980 -4.870 -3.574 1.00 . A A . 18 LYS HD3 1 1 16 6185 1 1 18 LYS HE3 H 5.789 -7.001 -3.488 1.00 . A A . 18 LYS HE3 1 1 16 6186 1 1 18 LYS HG3 H 7.555 -6.541 -1.464 1.00 . A A . 18 LYS HG3 1 1 16 6187 1 1 18 LYS HZ1 H 7.558 -6.273 -5.705 1.00 . A A . 18 LYS HZ1 1 1 16 6188 1 1 18 LYS HZ2 H 6.208 -7.191 -5.751 1.00 . A A . 18 LYS HZ2 1 1 16 6189 1 1 18 LYS HZ3 H 6.091 -5.580 -5.512 1.00 . A A . 18 LYS HZ3 1 1 16 6190 1 1 18 LYS N N 4.467 -3.268 -0.815 1.00 . A A . 18 LYS N 1 1 16 6191 1 1 18 LYS NZ N 6.640 -6.396 -5.326 1.00 . A A . 18 LYS NZ 1 1 16 6192 1 1 18 LYS O O 7.894 -2.552 -0.859 1.00 . A A . 18 LYS O 1 1 16 6193 1 1 19 LYS C C 7.379 -0.246 -2.729 1.00 . A A . 19 LYS C 1 1 16 6194 1 1 19 LYS CA C 7.212 -1.616 -3.387 1.00 . A A . 19 LYS CA 1 1 16 6195 1 1 19 LYS CB C 6.639 -1.553 -4.804 1.00 . A A . 19 LYS CB 1 1 16 6196 1 1 19 LYS CD C 5.540 0.716 -4.728 1.00 . A A . 19 LYS CD 1 1 16 6197 1 1 19 LYS CE C 4.380 0.881 -5.711 1.00 . A A . 19 LYS CE 1 1 16 6198 1 1 19 LYS CG C 6.665 -0.121 -5.342 1.00 . A A . 19 LYS CG 1 1 16 6199 1 1 19 LYS H H 5.496 -2.705 -2.929 1.00 . A A . 19 LYS H 1 1 16 6200 1 1 19 LYS HA H 8.192 -2.088 -3.456 1.00 . A A . 19 LYS HA 1 1 16 6201 1 1 19 LYS HB3 H 5.616 -1.927 -4.803 1.00 . A A . 19 LYS HB3 1 1 16 6202 1 1 19 LYS HD3 H 5.924 1.695 -4.445 1.00 . A A . 19 LYS HD3 1 1 16 6203 1 1 19 LYS HE3 H 4.062 -0.097 -6.075 1.00 . A A . 19 LYS HE3 1 1 16 6204 1 1 19 LYS HG3 H 6.561 -0.134 -6.427 1.00 . A A . 19 LYS HG3 1 1 16 6205 1 1 19 LYS HZ1 H 3.433 1.677 -4.084 1.00 . A A . 19 LYS HZ1 1 1 16 6206 1 1 19 LYS HZ2 H 3.111 2.466 -5.478 1.00 . A A . 19 LYS HZ2 1 1 16 6207 1 1 19 LYS HZ3 H 2.412 1.021 -5.176 1.00 . A A . 19 LYS HZ3 1 1 16 6208 1 1 19 LYS N N 6.383 -2.458 -2.540 1.00 . A A . 19 LYS N 1 1 16 6209 1 1 19 LYS NZ N 3.242 1.567 -5.059 1.00 . A A . 19 LYS NZ 1 1 16 6210 1 1 19 LYS O O 8.275 0.516 -3.091 1.00 . A A . 19 LYS O 1 1 16 6211 1 1 20 LEU C C 7.313 1.115 0.247 1.00 . A A . 20 LEU C 1 1 16 6212 1 1 20 LEU CA C 6.541 1.294 -1.062 1.00 . A A . 20 LEU CA 1 1 16 6213 1 1 20 LEU CB C 5.128 1.845 -0.872 1.00 . A A . 20 LEU CB 1 1 16 6214 1 1 20 LEU CD1 C 5.253 2.792 1.462 1.00 . A A . 20 LEU CD1 1 1 16 6215 1 1 20 LEU CD2 C 3.044 1.943 0.546 1.00 . A A . 20 LEU CD2 1 1 16 6216 1 1 20 LEU CG C 4.565 1.775 0.550 1.00 . A A . 20 LEU CG 1 1 16 6217 1 1 20 LEU H H 5.776 -0.596 -1.485 1.00 . A A . 20 LEU H 1 1 16 6218 1 1 20 LEU HA H 7.083 2.004 -1.687 1.00 . A A . 20 LEU HA 1 1 16 6219 1 1 20 LEU HB3 H 4.454 1.302 -1.534 1.00 . A A . 20 LEU HB3 1 1 16 6220 1 1 20 LEU HD11 H 4.502 3.441 1.912 1.00 . A A . 20 LEU HD11 1 1 16 6221 1 1 20 LEU HD12 H 5.797 2.267 2.247 1.00 . A A . 20 LEU HD12 1 1 16 6222 1 1 20 LEU HD13 H 5.949 3.394 0.877 1.00 . A A . 20 LEU HD13 1 1 16 6223 1 1 20 LEU HD21 H 2.603 1.274 1.285 1.00 . A A . 20 LEU HD21 1 1 16 6224 1 1 20 LEU HD22 H 2.792 2.974 0.795 1.00 . A A . 20 LEU HD22 1 1 16 6225 1 1 20 LEU HD23 H 2.654 1.702 -0.442 1.00 . A A . 20 LEU HD23 1 1 16 6226 1 1 20 LEU HG H 4.779 0.785 0.953 1.00 . A A . 20 LEU HG 1 1 16 6227 1 1 20 LEU N N 6.502 0.028 -1.773 1.00 . A A . 20 LEU N 1 1 16 6228 1 1 20 LEU O O 7.723 2.093 0.870 1.00 . A A . 20 LEU O 1 1 16 6229 1 1 21 PHE C C 9.658 -0.002 1.771 1.00 . A A . 21 PHE C 1 1 16 6230 1 1 21 PHE CA C 8.201 -0.464 1.851 1.00 . A A . 21 PHE CA 1 1 16 6231 1 1 21 PHE CB C 8.169 -1.985 2.003 1.00 . A A . 21 PHE CB 1 1 16 6232 1 1 21 PHE CD1 C 6.505 -2.182 3.864 1.00 . A A . 21 PHE CD1 1 1 16 6233 1 1 21 PHE CD2 C 8.625 -3.166 4.164 1.00 . A A . 21 PHE CD2 1 1 16 6234 1 1 21 PHE CE1 C 6.117 -2.625 5.156 1.00 . A A . 21 PHE CE1 1 1 16 6235 1 1 21 PHE CE2 C 8.237 -3.609 5.456 1.00 . A A . 21 PHE CE2 1 1 16 6236 1 1 21 PHE CG C 7.751 -2.462 3.395 1.00 . A A . 21 PHE CG 1 1 16 6237 1 1 21 PHE CZ C 6.991 -3.329 5.925 1.00 . A A . 21 PHE CZ 1 1 16 6238 1 1 21 PHE H H 7.150 -0.934 0.115 1.00 . A A . 21 PHE H 1 1 16 6239 1 1 21 PHE HA H 7.701 0.060 2.664 1.00 . A A . 21 PHE HA 1 1 16 6240 1 1 21 PHE HB3 H 9.157 -2.384 1.775 1.00 . A A . 21 PHE HB3 1 1 16 6241 1 1 21 PHE HD1 H 5.804 -1.619 3.248 1.00 . A A . 21 PHE HD1 1 1 16 6242 1 1 21 PHE HD2 H 9.623 -3.390 3.787 1.00 . A A . 21 PHE HD2 1 1 16 6243 1 1 21 PHE HE1 H 5.118 -2.402 5.532 1.00 . A A . 21 PHE HE1 1 1 16 6244 1 1 21 PHE HE2 H 8.937 -4.172 6.071 1.00 . A A . 21 PHE HE2 1 1 16 6245 1 1 21 PHE HZ H 6.693 -3.669 6.917 1.00 . A A . 21 PHE HZ 1 1 16 6246 1 1 21 PHE N N 7.487 -0.143 0.627 1.00 . A A . 21 PHE N 1 1 16 6247 1 1 21 PHE O O 10.324 0.141 2.796 1.00 . A A . 21 PHE O 1 1 16 6248 1 1 22 LYS C C 11.647 2.077 0.870 1.00 . A A . 22 LYS C 1 1 16 6249 1 1 22 LYS CA C 11.476 0.659 0.319 1.00 . A A . 22 LYS CA 1 1 16 6250 1 1 22 LYS CB C 11.844 0.526 -1.160 1.00 . A A . 22 LYS CB 1 1 16 6251 1 1 22 LYS CD C 9.952 2.122 -1.645 1.00 . A A . 22 LYS CD 1 1 16 6252 1 1 22 LYS CE C 10.884 3.318 -1.856 1.00 . A A . 22 LYS CE 1 1 16 6253 1 1 22 LYS CG C 10.637 0.816 -2.054 1.00 . A A . 22 LYS CG 1 1 16 6254 1 1 22 LYS H H 9.562 0.099 -0.282 1.00 . A A . 22 LYS H 1 1 16 6255 1 1 22 LYS HA H 12.132 -0.009 0.876 1.00 . A A . 22 LYS HA 1 1 16 6256 1 1 22 LYS HB3 H 12.214 -0.480 -1.357 1.00 . A A . 22 LYS HB3 1 1 16 6257 1 1 22 LYS HD3 H 9.655 2.068 -0.598 1.00 . A A . 22 LYS HD3 1 1 16 6258 1 1 22 LYS HE3 H 11.536 3.435 -0.989 1.00 . A A . 22 LYS HE3 1 1 16 6259 1 1 22 LYS HG3 H 9.926 -0.008 -1.988 1.00 . A A . 22 LYS HG3 1 1 16 6260 1 1 22 LYS HZ1 H 11.109 2.862 -3.835 1.00 . A A . 22 LYS HZ1 1 1 16 6261 1 1 22 LYS HZ2 H 12.165 3.986 -3.301 1.00 . A A . 22 LYS HZ2 1 1 16 6262 1 1 22 LYS HZ3 H 12.382 2.415 -2.915 1.00 . A A . 22 LYS HZ3 1 1 16 6263 1 1 22 LYS N N 10.110 0.217 0.545 1.00 . A A . 22 LYS N 1 1 16 6264 1 1 22 LYS NZ N 11.701 3.130 -3.075 1.00 . A A . 22 LYS NZ 1 1 16 6265 1 1 22 LYS O O 12.754 2.613 0.881 1.00 . A A . 22 LYS O 1 1 16 6266 1 1 23 LYS C C 10.098 3.939 3.325 1.00 . A A . 23 LYS C 1 1 16 6267 1 1 23 LYS CA C 10.546 3.987 1.864 1.00 . A A . 23 LYS CA 1 1 16 6268 1 1 23 LYS CB C 9.710 4.930 0.995 1.00 . A A . 23 LYS CB 1 1 16 6269 1 1 23 LYS CD C 7.448 5.942 1.460 1.00 . A A . 23 LYS CD 1 1 16 6270 1 1 23 LYS CE C 6.241 6.086 0.531 1.00 . A A . 23 LYS CE 1 1 16 6271 1 1 23 LYS CG C 8.216 4.651 1.166 1.00 . A A . 23 LYS CG 1 1 16 6272 1 1 23 LYS H H 9.637 2.200 1.300 1.00 . A A . 23 LYS H 1 1 16 6273 1 1 23 LYS HA H 11.576 4.345 1.829 1.00 . A A . 23 LYS HA 1 1 16 6274 1 1 23 LYS HB3 H 9.990 4.809 -0.051 1.00 . A A . 23 LYS HB3 1 1 16 6275 1 1 23 LYS HD3 H 8.110 6.799 1.338 1.00 . A A . 23 LYS HD3 1 1 16 6276 1 1 23 LYS HE3 H 6.100 5.166 -0.037 1.00 . A A . 23 LYS HE3 1 1 16 6277 1 1 23 LYS HG3 H 8.065 3.941 1.978 1.00 . A A . 23 LYS HG3 1 1 16 6278 1 1 23 LYS HZ1 H 4.726 5.563 1.801 1.00 . A A . 23 LYS HZ1 1 1 16 6279 1 1 23 LYS HZ2 H 5.214 7.113 1.969 1.00 . A A . 23 LYS HZ2 1 1 16 6280 1 1 23 LYS HZ3 H 4.293 6.681 0.692 1.00 . A A . 23 LYS HZ3 1 1 16 6281 1 1 23 LYS N N 10.534 2.643 1.313 1.00 . A A . 23 LYS N 1 1 16 6282 1 1 23 LYS NZ N 5.019 6.385 1.312 1.00 . A A . 23 LYS NZ 1 1 16 6283 1 1 23 LYS O O 10.494 4.783 4.128 1.00 . A A . 23 LYS O 1 1 16 6284 1 1 24 TRP C C 9.796 1.957 5.769 1.00 . A A . 24 TRP C 1 1 16 6285 1 1 24 TRP CA C 8.772 2.775 4.979 1.00 . A A . 24 TRP CA 1 1 16 6286 1 1 24 TRP CB C 7.381 2.139 4.969 1.00 . A A . 24 TRP CB 1 1 16 6287 1 1 24 TRP CD1 C 6.345 4.433 4.400 1.00 . A A . 24 TRP CD1 1 1 16 6288 1 1 24 TRP CD2 C 4.845 2.810 4.557 1.00 . A A . 24 TRP CD2 1 1 16 6289 1 1 24 TRP CE2 C 4.164 3.972 4.252 1.00 . A A . 24 TRP CE2 1 1 16 6290 1 1 24 TRP CE3 C 4.168 1.589 4.725 1.00 . A A . 24 TRP CE3 1 1 16 6291 1 1 24 TRP CG C 6.251 3.120 4.650 1.00 . A A . 24 TRP CG 1 1 16 6292 1 1 24 TRP CH2 C 2.081 2.823 4.252 1.00 . A A . 24 TRP CH2 1 1 16 6293 1 1 24 TRP CZ2 C 2.776 4.028 4.089 1.00 . A A . 24 TRP CZ2 1 1 16 6294 1 1 24 TRP CZ3 C 2.780 1.661 4.558 1.00 . A A . 24 TRP CZ3 1 1 16 6295 1 1 24 TRP H H 8.961 2.262 2.969 1.00 . A A . 24 TRP H 1 1 16 6296 1 1 24 TRP HA H 8.665 3.765 5.421 1.00 . A A . 24 TRP HA 1 1 16 6297 1 1 24 TRP HB3 H 7.192 1.686 5.941 1.00 . A A . 24 TRP HB3 1 1 16 6298 1 1 24 TRP HD1 H 7.281 4.991 4.392 1.00 . A A . 24 TRP HD1 1 1 16 6299 1 1 24 TRP HE1 H 4.903 6.037 3.924 1.00 . A A . 24 TRP HE1 1 1 16 6300 1 1 24 TRP HE3 H 4.682 0.658 4.966 1.00 . A A . 24 TRP HE3 1 1 16 6301 1 1 24 TRP HH2 H 0.997 2.796 4.138 1.00 . A A . 24 TRP HH2 1 1 16 6302 1 1 24 TRP HZ2 H 2.262 4.958 3.848 1.00 . A A . 24 TRP HZ2 1 1 16 6303 1 1 24 TRP HZ3 H 2.207 0.742 4.677 1.00 . A A . 24 TRP HZ3 1 1 16 6304 1 1 24 TRP N N 9.278 2.943 3.628 1.00 . A A . 24 TRP N 1 1 16 6305 1 1 24 TRP NE1 N 5.106 4.990 4.154 1.00 . A A . 24 TRP NE1 1 1 16 6306 1 1 24 TRP O O 10.557 1.183 5.190 1.00 . A A . 24 TRP O 1 1 16 6307 1 1 25 GLY C C 10.214 1.481 9.403 1.00 . A A . 25 GLY C 1 1 16 6308 1 1 25 GLY CA C 10.702 1.448 7.953 1.00 . A A . 25 GLY CA 1 1 16 6309 1 1 25 GLY H H 9.161 2.789 7.541 1.00 . A A . 25 GLY H 1 1 16 6310 1 1 25 GLY HA2 H 10.800 0.414 7.622 1.00 . A A . 25 GLY HA2 1 1 16 6311 1 1 25 GLY HA3 H 11.692 1.899 7.889 1.00 . A A . 25 GLY HA3 1 1 16 6312 1 1 25 GLY N N 9.784 2.157 7.079 1.00 . A A . 25 GLY N 1 1 16 6313 1 1 25 GLY O O 9.660 0.500 9.897 1.00 . A A . 25 GLY O 1 1 16 6314 1 1 26 TRP C C 8.508 2.621 11.494 1.00 . A A . 26 TRP C 1 1 16 6315 1 1 26 TRP CA C 10.026 2.793 11.426 1.00 . A A . 26 TRP CA 1 1 16 6316 1 1 26 TRP CB C 10.501 4.139 11.975 1.00 . A A . 26 TRP CB 1 1 16 6317 1 1 26 TRP CD1 C 8.647 5.385 10.682 1.00 . A A . 26 TRP CD1 1 1 16 6318 1 1 26 TRP CD2 C 9.490 6.566 12.357 1.00 . A A . 26 TRP CD2 1 1 16 6319 1 1 26 TRP CE2 C 8.519 7.339 11.755 1.00 . A A . 26 TRP CE2 1 1 16 6320 1 1 26 TRP CE3 C 10.219 7.035 13.464 1.00 . A A . 26 TRP CE3 1 1 16 6321 1 1 26 TRP CG C 9.565 5.307 11.655 1.00 . A A . 26 TRP CG 1 1 16 6322 1 1 26 TRP CH2 C 8.902 9.117 13.289 1.00 . A A . 26 TRP CH2 1 1 16 6323 1 1 26 TRP CZ2 C 8.188 8.628 12.189 1.00 . A A . 26 TRP CZ2 1 1 16 6324 1 1 26 TRP CZ3 C 9.877 8.325 13.884 1.00 . A A . 26 TRP CZ3 1 1 16 6325 1 1 26 TRP H H 10.888 3.412 9.634 1.00 . A A . 26 TRP H 1 1 16 6326 1 1 26 TRP HA H 10.515 2.019 12.018 1.00 . A A . 26 TRP HA 1 1 16 6327 1 1 26 TRP HB3 H 11.489 4.358 11.567 1.00 . A A . 26 TRP HB3 1 1 16 6328 1 1 26 TRP HD1 H 8.446 4.592 9.963 1.00 . A A . 26 TRP HD1 1 1 16 6329 1 1 26 TRP HE1 H 7.202 6.918 10.023 1.00 . A A . 26 TRP HE1 1 1 16 6330 1 1 26 TRP HE3 H 10.992 6.444 13.956 1.00 . A A . 26 TRP HE3 1 1 16 6331 1 1 26 TRP HH2 H 8.694 10.114 13.678 1.00 . A A . 26 TRP HH2 1 1 16 6332 1 1 26 TRP HZ2 H 7.416 9.220 11.696 1.00 . A A . 26 TRP HZ2 1 1 16 6333 1 1 26 TRP HZ3 H 10.412 8.738 14.739 1.00 . A A . 26 TRP HZ3 1 1 16 6334 1 1 26 TRP N N 10.437 2.619 10.043 1.00 . A A . 26 TRP N 1 1 16 6335 1 1 26 TRP NE1 N 7.990 6.599 10.703 1.00 . A A . 26 TRP NE1 1 1 16 6336 1 1 26 TRP O O 7.957 2.350 12.560 1.00 . A A . 26 TRP O 1 1 17 6337 1 1 1 LYS C C -2.882 13.050 3.813 1.00 . A A . 1 LYS C 1 1 17 6338 1 1 1 LYS CA C -2.613 14.553 3.905 1.00 . A A . 1 LYS CA 1 1 17 6339 1 1 1 LYS CB C -1.132 14.921 3.778 1.00 . A A . 1 LYS CB 1 1 17 6340 1 1 1 LYS CD C 0.518 16.577 2.832 1.00 . A A . 1 LYS CD 1 1 17 6341 1 1 1 LYS CE C 1.052 17.589 3.847 1.00 . A A . 1 LYS CE 1 1 17 6342 1 1 1 LYS CG C -0.961 16.274 3.085 1.00 . A A . 1 LYS CG 1 1 17 6343 1 1 1 LYS H1 H -3.329 14.372 5.853 1.00 . A A . 1 LYS H1 1 1 17 6344 1 1 1 LYS HA H -3.138 15.050 3.089 1.00 . A A . 1 LYS HA 1 1 17 6345 1 1 1 LYS HB3 H -0.610 14.149 3.213 1.00 . A A . 1 LYS HB3 1 1 17 6346 1 1 1 LYS HD3 H 0.645 16.967 1.822 1.00 . A A . 1 LYS HD3 1 1 17 6347 1 1 1 LYS HE3 H 2.132 17.683 3.742 1.00 . A A . 1 LYS HE3 1 1 17 6348 1 1 1 LYS HG3 H -1.396 17.060 3.701 1.00 . A A . 1 LYS HG3 1 1 17 6349 1 1 1 LYS HZ1 H -0.563 18.841 3.871 1.00 . A A . 1 LYS HZ1 1 1 17 6350 1 1 1 LYS HZ2 H 0.843 19.581 4.251 1.00 . A A . 1 LYS HZ2 1 1 17 6351 1 1 1 LYS HZ3 H 0.519 19.192 2.698 1.00 . A A . 1 LYS HZ3 1 1 17 6352 1 1 1 LYS N N -3.159 15.064 5.151 1.00 . A A . 1 LYS N 1 1 17 6353 1 1 1 LYS NZ N 0.411 18.908 3.651 1.00 . A A . 1 LYS NZ 1 1 17 6354 1 1 1 LYS O O -3.617 12.601 2.933 1.00 . A A . 1 LYS O 1 1 17 6355 1 1 2 SER C C -3.919 10.510 4.598 1.00 . A A . 2 SER C 1 1 17 6356 1 1 2 SER CA C -2.441 10.871 4.764 1.00 . A A . 2 SER CA 1 1 17 6357 1 1 2 SER CB C -1.894 10.283 6.066 1.00 . A A . 2 SER CB 1 1 17 6358 1 1 2 SER H H -1.680 12.688 5.443 1.00 . A A . 2 SER H 1 1 17 6359 1 1 2 SER HA H -1.859 10.494 3.923 1.00 . A A . 2 SER HA 1 1 17 6360 1 1 2 SER HB3 H -2.364 9.318 6.254 1.00 . A A . 2 SER HB3 1 1 17 6361 1 1 2 SER HG H -0.052 10.941 5.644 1.00 . A A . 2 SER HG 1 1 17 6362 1 1 2 SER N N -2.275 12.314 4.731 1.00 . A A . 2 SER N 1 1 17 6363 1 1 2 SER O O -4.764 10.972 5.364 1.00 . A A . 2 SER O 1 1 17 6364 1 1 2 SER OG O -0.479 10.122 6.026 1.00 . A A . 2 SER OG 1 1 17 6365 1 1 3 SER C C -5.942 8.128 4.270 1.00 . A A . 3 SER C 1 1 17 6366 1 1 3 SER CA C -5.547 9.260 3.319 1.00 . A A . 3 SER CA 1 1 17 6367 1 1 3 SER CB C -5.698 8.810 1.864 1.00 . A A . 3 SER CB 1 1 17 6368 1 1 3 SER H H -3.493 9.317 2.977 1.00 . A A . 3 SER H 1 1 17 6369 1 1 3 SER HA H -6.167 10.140 3.493 1.00 . A A . 3 SER HA 1 1 17 6370 1 1 3 SER HB3 H -4.956 8.042 1.643 1.00 . A A . 3 SER HB3 1 1 17 6371 1 1 3 SER HG H -6.938 7.486 1.017 1.00 . A A . 3 SER HG 1 1 17 6372 1 1 3 SER N N -4.185 9.688 3.594 1.00 . A A . 3 SER N 1 1 17 6373 1 1 3 SER O O -6.807 8.306 5.125 1.00 . A A . 3 SER O 1 1 17 6374 1 1 3 SER OG O -7.001 8.299 1.597 1.00 . A A . 3 SER OG 1 1 17 6375 1 1 4 ALA C C -4.516 4.748 4.634 1.00 . A A . 4 ALA C 1 1 17 6376 1 1 4 ALA CA C -5.562 5.830 4.917 1.00 . A A . 4 ALA CA 1 1 17 6377 1 1 4 ALA CB C -6.989 5.341 4.661 1.00 . A A . 4 ALA CB 1 1 17 6378 1 1 4 ALA H H -4.587 6.855 3.388 1.00 . A A . 4 ALA H 1 1 17 6379 1 1 4 ALA HA H -5.479 6.140 5.959 1.00 . A A . 4 ALA HA 1 1 17 6380 1 1 4 ALA HB1 H -7.239 4.559 5.377 1.00 . A A . 4 ALA HB1 1 1 17 6381 1 1 4 ALA HB2 H -7.683 6.174 4.775 1.00 . A A . 4 ALA HB2 1 1 17 6382 1 1 4 ALA HB3 H -7.060 4.945 3.648 1.00 . A A . 4 ALA HB3 1 1 17 6383 1 1 4 ALA N N -5.289 6.990 4.087 1.00 . A A . 4 ALA N 1 1 17 6384 1 1 4 ALA O O -3.788 4.333 5.535 1.00 . A A . 4 ALA O 1 1 17 6385 1 1 5 TYR C C -3.529 2.128 3.951 1.00 . A A . 5 TYR C 1 1 17 6386 1 1 5 TYR CA C -3.531 3.299 2.967 1.00 . A A . 5 TYR CA 1 1 17 6387 1 1 5 TYR CB C -2.154 3.965 2.980 1.00 . A A . 5 TYR CB 1 1 17 6388 1 1 5 TYR CD1 C -1.707 4.843 0.659 1.00 . A A . 5 TYR CD1 1 1 17 6389 1 1 5 TYR CD2 C -2.178 6.417 2.397 1.00 . A A . 5 TYR CD2 1 1 17 6390 1 1 5 TYR CE1 C -1.570 5.924 -0.283 1.00 . A A . 5 TYR CE1 1 1 17 6391 1 1 5 TYR CE2 C -2.040 7.498 1.454 1.00 . A A . 5 TYR CE2 1 1 17 6392 1 1 5 TYR CG C -2.008 5.113 1.979 1.00 . A A . 5 TYR CG 1 1 17 6393 1 1 5 TYR CZ C -1.744 7.197 0.161 1.00 . A A . 5 TYR CZ 1 1 17 6394 1 1 5 TYR H H -5.071 4.666 2.654 1.00 . A A . 5 TYR H 1 1 17 6395 1 1 5 TYR HA H -3.836 2.937 1.985 1.00 . A A . 5 TYR HA 1 1 17 6396 1 1 5 TYR HB3 H -1.396 3.211 2.766 1.00 . A A . 5 TYR HB3 1 1 17 6397 1 1 5 TYR HD1 H -1.572 3.813 0.330 1.00 . A A . 5 TYR HD1 1 1 17 6398 1 1 5 TYR HD2 H -2.417 6.630 3.438 1.00 . A A . 5 TYR HD2 1 1 17 6399 1 1 5 TYR HE1 H -1.332 5.725 -1.328 1.00 . A A . 5 TYR HE1 1 1 17 6400 1 1 5 TYR HE2 H -2.172 8.532 1.770 1.00 . A A . 5 TYR HE2 1 1 17 6401 1 1 5 TYR HH H -0.889 8.010 -1.384 1.00 . A A . 5 TYR HH 1 1 17 6402 1 1 5 TYR N N -4.476 4.324 3.380 1.00 . A A . 5 TYR N 1 1 17 6403 1 1 5 TYR O O -2.612 1.996 4.761 1.00 . A A . 5 TYR O 1 1 17 6404 1 1 5 TYR OH O -1.614 8.218 -0.728 1.00 . A A . 5 TYR OH 1 1 17 6405 1 1 6 SER C C -5.783 -0.783 4.194 1.00 . A A . 6 SER C 1 1 17 6406 1 1 6 SER CA C -4.691 0.152 4.721 1.00 . A A . 6 SER CA 1 1 17 6407 1 1 6 SER CB C -5.005 0.577 6.157 1.00 . A A . 6 SER CB 1 1 17 6408 1 1 6 SER H H -5.305 1.422 3.188 1.00 . A A . 6 SER H 1 1 17 6409 1 1 6 SER HA H -3.720 -0.340 4.692 1.00 . A A . 6 SER HA 1 1 17 6410 1 1 6 SER HB3 H -4.891 -0.279 6.821 1.00 . A A . 6 SER HB3 1 1 17 6411 1 1 6 SER HG H -4.420 2.491 6.150 1.00 . A A . 6 SER HG 1 1 17 6412 1 1 6 SER N N -4.564 1.308 3.849 1.00 . A A . 6 SER N 1 1 17 6413 1 1 6 SER O O -5.615 -2.001 4.196 1.00 . A A . 6 SER O 1 1 17 6414 1 1 6 SER OG O -4.159 1.635 6.597 1.00 . A A . 6 SER OG 1 1 17 6415 1 1 7 LEU C C -7.509 -1.812 2.070 1.00 . A A . 7 LEU C 1 1 17 6416 1 1 7 LEU CA C -7.995 -0.939 3.228 1.00 . A A . 7 LEU CA 1 1 17 6417 1 1 7 LEU CB C -9.148 -0.007 2.852 1.00 . A A . 7 LEU CB 1 1 17 6418 1 1 7 LEU CD1 C -10.775 0.780 1.094 1.00 . A A . 7 LEU CD1 1 1 17 6419 1 1 7 LEU CD2 C -8.279 1.059 0.739 1.00 . A A . 7 LEU CD2 1 1 17 6420 1 1 7 LEU CG C -9.385 0.199 1.354 1.00 . A A . 7 LEU CG 1 1 17 6421 1 1 7 LEU H H -7.005 0.816 3.759 1.00 . A A . 7 LEU H 1 1 17 6422 1 1 7 LEU HA H -8.353 -1.589 4.025 1.00 . A A . 7 LEU HA 1 1 17 6423 1 1 7 LEU HB3 H -8.967 0.966 3.309 1.00 . A A . 7 LEU HB3 1 1 17 6424 1 1 7 LEU HD11 H -11.061 0.588 0.059 1.00 . A A . 7 LEU HD11 1 1 17 6425 1 1 7 LEU HD12 H -11.496 0.312 1.763 1.00 . A A . 7 LEU HD12 1 1 17 6426 1 1 7 LEU HD13 H -10.759 1.855 1.272 1.00 . A A . 7 LEU HD13 1 1 17 6427 1 1 7 LEU HD21 H -7.831 0.528 -0.101 1.00 . A A . 7 LEU HD21 1 1 17 6428 1 1 7 LEU HD22 H -8.703 2.000 0.389 1.00 . A A . 7 LEU HD22 1 1 17 6429 1 1 7 LEU HD23 H -7.516 1.262 1.490 1.00 . A A . 7 LEU HD23 1 1 17 6430 1 1 7 LEU HG H -9.345 -0.774 0.866 1.00 . A A . 7 LEU HG 1 1 17 6431 1 1 7 LEU N N -6.876 -0.176 3.756 1.00 . A A . 7 LEU N 1 1 17 6432 1 1 7 LEU O O -7.260 -1.314 0.973 1.00 . A A . 7 LEU O 1 1 17 6433 1 1 8 GLN C C -8.024 -5.084 1.068 1.00 . A A . 8 GLN C 1 1 17 6434 1 1 8 GLN CA C -6.934 -4.048 1.350 1.00 . A A . 8 GLN CA 1 1 17 6435 1 1 8 GLN CB C -5.632 -4.727 1.783 1.00 . A A . 8 GLN CB 1 1 17 6436 1 1 8 GLN CD C -3.122 -4.750 1.544 1.00 . A A . 8 GLN CD 1 1 17 6437 1 1 8 GLN CG C -4.421 -4.051 1.136 1.00 . A A . 8 GLN CG 1 1 17 6438 1 1 8 GLN H H -7.590 -3.498 3.249 1.00 . A A . 8 GLN H 1 1 17 6439 1 1 8 GLN HA H -6.747 -3.455 0.455 1.00 . A A . 8 GLN HA 1 1 17 6440 1 1 8 GLN HB3 H -5.657 -5.780 1.504 1.00 . A A . 8 GLN HB3 1 1 17 6441 1 1 8 GLN HE21 H -2.145 -3.001 1.252 1.00 . A A . 8 GLN HE21 1 1 17 6442 1 1 8 GLN HE22 H -1.155 -4.324 1.769 1.00 . A A . 8 GLN HE22 1 1 17 6443 1 1 8 GLN HG3 H -4.383 -3.003 1.435 1.00 . A A . 8 GLN HG3 1 1 17 6444 1 1 8 GLN N N -7.386 -3.100 2.353 1.00 . A A . 8 GLN N 1 1 17 6445 1 1 8 GLN NE2 N -2.052 -3.960 1.519 1.00 . A A . 8 GLN NE2 1 1 17 6446 1 1 8 GLN O O -8.486 -5.768 1.980 1.00 . A A . 8 GLN O 1 1 17 6447 1 1 8 GLN OE1 O -3.093 -5.928 1.858 1.00 . A A . 8 GLN OE1 1 1 17 6448 1 1 9 MET C C -9.210 -6.563 -2.056 1.00 . A A . 9 MET C 1 1 17 6449 1 1 9 MET CA C -9.431 -6.109 -0.611 1.00 . A A . 9 MET CA 1 1 17 6450 1 1 9 MET CB C -10.806 -5.450 -0.487 1.00 . A A . 9 MET CB 1 1 17 6451 1 1 9 MET CE C -12.812 -7.518 2.172 1.00 . A A . 9 MET CE 1 1 17 6452 1 1 9 MET CG C -11.344 -5.568 0.940 1.00 . A A . 9 MET CG 1 1 17 6453 1 1 9 MET H H -8.022 -4.609 -0.935 1.00 . A A . 9 MET H 1 1 17 6454 1 1 9 MET HA H -9.336 -6.960 0.062 1.00 . A A . 9 MET HA 1 1 17 6455 1 1 9 MET HB3 H -11.503 -5.920 -1.181 1.00 . A A . 9 MET HB3 1 1 17 6456 1 1 9 MET HE1 H -13.735 -7.591 2.747 1.00 . A A . 9 MET HE1 1 1 17 6457 1 1 9 MET HE2 H -12.604 -8.477 1.698 1.00 . A A . 9 MET HE2 1 1 17 6458 1 1 9 MET HE3 H -11.990 -7.255 2.836 1.00 . A A . 9 MET HE3 1 1 17 6459 1 1 9 MET HG3 H -11.360 -4.586 1.413 1.00 . A A . 9 MET HG3 1 1 17 6460 1 1 9 MET N N -8.404 -5.168 -0.199 1.00 . A A . 9 MET N 1 1 17 6461 1 1 9 MET O O -9.299 -7.752 -2.358 1.00 . A A . 9 MET O 1 1 17 6462 1 1 9 MET SD S -12.989 -6.261 0.918 1.00 . A A . 9 MET SD 1 1 17 6463 1 1 10 GLY C C -7.593 -6.923 -4.488 1.00 . A A . 10 GLY C 1 1 17 6464 1 1 10 GLY CA C -8.694 -5.874 -4.317 1.00 . A A . 10 GLY CA 1 1 17 6465 1 1 10 GLY H H -8.858 -4.625 -2.658 1.00 . A A . 10 GLY H 1 1 17 6466 1 1 10 GLY HA2 H -9.616 -6.231 -4.777 1.00 . A A . 10 GLY HA2 1 1 17 6467 1 1 10 GLY HA3 H -8.412 -4.958 -4.835 1.00 . A A . 10 GLY HA3 1 1 17 6468 1 1 10 GLY N N -8.928 -5.591 -2.911 1.00 . A A . 10 GLY N 1 1 17 6469 1 1 10 GLY O O -7.832 -8.115 -4.303 1.00 . A A . 10 GLY O 1 1 17 6470 1 1 11 ALA C C -4.069 -6.496 -5.500 1.00 . A A . 11 ALA C 1 1 17 6471 1 1 11 ALA CA C -5.272 -7.322 -5.039 1.00 . A A . 11 ALA CA 1 1 17 6472 1 1 11 ALA CB C -5.644 -8.420 -6.037 1.00 . A A . 11 ALA CB 1 1 17 6473 1 1 11 ALA H H -6.224 -5.470 -4.988 1.00 . A A . 11 ALA H 1 1 17 6474 1 1 11 ALA HA H -5.038 -7.784 -4.079 1.00 . A A . 11 ALA HA 1 1 17 6475 1 1 11 ALA HB1 H -6.589 -8.169 -6.518 1.00 . A A . 11 ALA HB1 1 1 17 6476 1 1 11 ALA HB2 H -4.863 -8.502 -6.794 1.00 . A A . 11 ALA HB2 1 1 17 6477 1 1 11 ALA HB3 H -5.743 -9.369 -5.512 1.00 . A A . 11 ALA HB3 1 1 17 6478 1 1 11 ALA N N -6.410 -6.441 -4.840 1.00 . A A . 11 ALA N 1 1 17 6479 1 1 11 ALA O O -3.167 -6.214 -4.713 1.00 . A A . 11 ALA O 1 1 17 6480 1 1 12 THR C C -2.526 -4.301 -6.346 1.00 . A A . 12 THR C 1 1 17 6481 1 1 12 THR CA C -3.017 -5.347 -7.349 1.00 . A A . 12 THR CA 1 1 17 6482 1 1 12 THR CB C -3.522 -4.740 -8.659 1.00 . A A . 12 THR CB 1 1 17 6483 1 1 12 THR CG2 C -4.117 -5.790 -9.600 1.00 . A A . 12 THR CG2 1 1 17 6484 1 1 12 THR H H -4.832 -6.367 -7.407 1.00 . A A . 12 THR H 1 1 17 6485 1 1 12 THR HA H -2.178 -6.011 -7.556 1.00 . A A . 12 THR HA 1 1 17 6486 1 1 12 THR HB H -2.734 -4.175 -9.156 1.00 . A A . 12 THR HB 1 1 17 6487 1 1 12 THR HG1 H -5.144 -3.644 -9.077 1.00 . A A . 12 THR HG1 1 1 17 6488 1 1 12 THR HG21 H -4.037 -6.775 -9.142 1.00 . A A . 12 THR HG21 1 1 17 6489 1 1 12 THR HG22 H -5.165 -5.560 -9.786 1.00 . A A . 12 THR HG22 1 1 17 6490 1 1 12 THR HG23 H -3.571 -5.783 -10.544 1.00 . A A . 12 THR HG23 1 1 17 6491 1 1 12 THR N N -4.094 -6.134 -6.774 1.00 . A A . 12 THR N 1 1 17 6492 1 1 12 THR O O -1.334 -4.234 -6.048 1.00 . A A . 12 THR O 1 1 17 6493 1 1 12 THR OG1 O -4.642 -3.951 -8.268 1.00 . A A . 12 THR OG1 1 1 17 6494 1 1 13 ALA C C -2.086 -2.996 -3.916 1.00 . A A . 13 ALA C 1 1 17 6495 1 1 13 ALA CA C -3.145 -2.473 -4.889 1.00 . A A . 13 ALA CA 1 1 17 6496 1 1 13 ALA CB C -4.421 -2.024 -4.174 1.00 . A A . 13 ALA CB 1 1 17 6497 1 1 13 ALA H H -4.434 -3.573 -6.100 1.00 . A A . 13 ALA H 1 1 17 6498 1 1 13 ALA HA H -2.735 -1.626 -5.438 1.00 . A A . 13 ALA HA 1 1 17 6499 1 1 13 ALA HB1 H -5.226 -2.728 -4.392 1.00 . A A . 13 ALA HB1 1 1 17 6500 1 1 13 ALA HB2 H -4.246 -1.995 -3.099 1.00 . A A . 13 ALA HB2 1 1 17 6501 1 1 13 ALA HB3 H -4.704 -1.032 -4.524 1.00 . A A . 13 ALA HB3 1 1 17 6502 1 1 13 ALA N N -3.468 -3.511 -5.852 1.00 . A A . 13 ALA N 1 1 17 6503 1 1 13 ALA O O -1.185 -2.260 -3.520 1.00 . A A . 13 ALA O 1 1 17 6504 1 1 14 ILE C C 0.126 -4.455 -2.986 1.00 . A A . 14 ILE C 1 1 17 6505 1 1 14 ILE CA C -1.298 -4.896 -2.643 1.00 . A A . 14 ILE CA 1 1 17 6506 1 1 14 ILE CB C -1.489 -6.414 -2.643 1.00 . A A . 14 ILE CB 1 1 17 6507 1 1 14 ILE CD1 C -3.244 -8.223 -2.561 1.00 . A A . 14 ILE CD1 1 1 17 6508 1 1 14 ILE CG1 C -2.890 -6.791 -2.156 1.00 . A A . 14 ILE CG1 1 1 17 6509 1 1 14 ILE CG2 C -0.394 -7.104 -1.828 1.00 . A A . 14 ILE CG2 1 1 17 6510 1 1 14 ILE H H -2.967 -4.857 -3.888 1.00 . A A . 14 ILE H 1 1 17 6511 1 1 14 ILE HA H -1.537 -4.541 -1.639 1.00 . A A . 14 ILE HA 1 1 17 6512 1 1 14 ILE HB H -1.399 -6.769 -3.670 1.00 . A A . 14 ILE HB 1 1 17 6513 1 1 14 ILE HD11 H -2.557 -8.917 -2.078 1.00 . A A . 14 ILE HD11 1 1 17 6514 1 1 14 ILE HD12 H -4.265 -8.445 -2.250 1.00 . A A . 14 ILE HD12 1 1 17 6515 1 1 14 ILE HD13 H -3.163 -8.326 -3.643 1.00 . A A . 14 ILE HD13 1 1 17 6516 1 1 14 ILE HG13 H -3.622 -6.099 -2.574 1.00 . A A . 14 ILE HG13 1 1 17 6517 1 1 14 ILE HG21 H 0.576 -6.686 -2.096 1.00 . A A . 14 ILE HG21 1 1 17 6518 1 1 14 ILE HG22 H -0.577 -6.946 -0.766 1.00 . A A . 14 ILE HG22 1 1 17 6519 1 1 14 ILE HG23 H -0.401 -8.173 -2.043 1.00 . A A . 14 ILE HG23 1 1 17 6520 1 1 14 ILE N N -2.230 -4.264 -3.561 1.00 . A A . 14 ILE N 1 1 17 6521 1 1 14 ILE O O 0.810 -3.852 -2.160 1.00 . A A . 14 ILE O 1 1 17 6522 1 1 15 LYS C C 2.088 -2.919 -4.454 1.00 . A A . 15 LYS C 1 1 17 6523 1 1 15 LYS CA C 1.862 -4.416 -4.669 1.00 . A A . 15 LYS CA 1 1 17 6524 1 1 15 LYS CB C 2.063 -4.867 -6.118 1.00 . A A . 15 LYS CB 1 1 17 6525 1 1 15 LYS CD C 0.088 -6.145 -7.025 1.00 . A A . 15 LYS CD 1 1 17 6526 1 1 15 LYS CE C -0.056 -7.183 -8.140 1.00 . A A . 15 LYS CE 1 1 17 6527 1 1 15 LYS CG C 1.458 -6.252 -6.351 1.00 . A A . 15 LYS CG 1 1 17 6528 1 1 15 LYS H H -0.031 -5.263 -4.873 1.00 . A A . 15 LYS H 1 1 17 6529 1 1 15 LYS HA H 2.578 -4.966 -4.059 1.00 . A A . 15 LYS HA 1 1 17 6530 1 1 15 LYS HB3 H 3.128 -4.887 -6.352 1.00 . A A . 15 LYS HB3 1 1 17 6531 1 1 15 LYS HD3 H -0.043 -5.144 -7.434 1.00 . A A . 15 LYS HD3 1 1 17 6532 1 1 15 LYS HE3 H 0.865 -7.231 -8.720 1.00 . A A . 15 LYS HE3 1 1 17 6533 1 1 15 LYS HG3 H 1.359 -6.774 -5.400 1.00 . A A . 15 LYS HG3 1 1 17 6534 1 1 15 LYS HZ1 H 0.333 -8.760 -6.900 1.00 . A A . 15 LYS HZ1 1 1 17 6535 1 1 15 LYS HZ2 H -1.261 -8.490 -7.132 1.00 . A A . 15 LYS HZ2 1 1 17 6536 1 1 15 LYS HZ3 H -0.373 -9.194 -8.307 1.00 . A A . 15 LYS HZ3 1 1 17 6537 1 1 15 LYS N N 0.531 -4.772 -4.208 1.00 . A A . 15 LYS N 1 1 17 6538 1 1 15 LYS NZ N -0.364 -8.514 -7.575 1.00 . A A . 15 LYS NZ 1 1 17 6539 1 1 15 LYS O O 3.181 -2.501 -4.073 1.00 . A A . 15 LYS O 1 1 17 6540 1 1 16 GLN C C 1.536 -0.355 -3.121 1.00 . A A . 16 GLN C 1 1 17 6541 1 1 16 GLN CA C 1.110 -0.709 -4.547 1.00 . A A . 16 GLN CA 1 1 17 6542 1 1 16 GLN CB C -0.226 -0.051 -4.899 1.00 . A A . 16 GLN CB 1 1 17 6543 1 1 16 GLN CD C -2.239 1.172 -3.999 1.00 . A A . 16 GLN CD 1 1 17 6544 1 1 16 GLN CG C -0.871 0.578 -3.662 1.00 . A A . 16 GLN CG 1 1 17 6545 1 1 16 GLN H H 0.154 -2.498 -5.019 1.00 . A A . 16 GLN H 1 1 17 6546 1 1 16 GLN HA H 1.869 -0.376 -5.254 1.00 . A A . 16 GLN HA 1 1 17 6547 1 1 16 GLN HB3 H -0.900 -0.794 -5.326 1.00 . A A . 16 GLN HB3 1 1 17 6548 1 1 16 GLN HE21 H -2.188 2.167 -2.236 1.00 . A A . 16 GLN HE21 1 1 17 6549 1 1 16 GLN HE22 H -3.608 2.429 -3.195 1.00 . A A . 16 GLN HE22 1 1 17 6550 1 1 16 GLN HG3 H -0.219 1.357 -3.265 1.00 . A A . 16 GLN HG3 1 1 17 6551 1 1 16 GLN N N 1.039 -2.151 -4.709 1.00 . A A . 16 GLN N 1 1 17 6552 1 1 16 GLN NE2 N -2.718 1.990 -3.067 1.00 . A A . 16 GLN NE2 1 1 17 6553 1 1 16 GLN O O 2.326 0.566 -2.915 1.00 . A A . 16 GLN O 1 1 17 6554 1 1 16 GLN OE1 O -2.822 0.906 -5.038 1.00 . A A . 16 GLN OE1 1 1 17 6555 1 1 17 VAL C C 2.823 -0.984 -0.570 1.00 . A A . 17 VAL C 1 1 17 6556 1 1 17 VAL CA C 1.311 -0.882 -0.771 1.00 . A A . 17 VAL CA 1 1 17 6557 1 1 17 VAL CB C 0.523 -1.860 0.104 1.00 . A A . 17 VAL CB 1 1 17 6558 1 1 17 VAL CG1 C 1.219 -3.220 0.168 1.00 . A A . 17 VAL CG1 1 1 17 6559 1 1 17 VAL CG2 C 0.306 -1.287 1.507 1.00 . A A . 17 VAL CG2 1 1 17 6560 1 1 17 VAL H H 0.354 -1.853 -2.347 1.00 . A A . 17 VAL H 1 1 17 6561 1 1 17 VAL HA H 0.991 0.129 -0.519 1.00 . A A . 17 VAL HA 1 1 17 6562 1 1 17 VAL HB H -0.455 -2.005 -0.353 1.00 . A A . 17 VAL HB 1 1 17 6563 1 1 17 VAL HG11 H 2.030 -3.248 -0.559 1.00 . A A . 17 VAL HG11 1 1 17 6564 1 1 17 VAL HG12 H 1.623 -3.375 1.169 1.00 . A A . 17 VAL HG12 1 1 17 6565 1 1 17 VAL HG13 H 0.500 -4.007 -0.059 1.00 . A A . 17 VAL HG13 1 1 17 6566 1 1 17 VAL HG21 H -0.242 -0.348 1.435 1.00 . A A . 17 VAL HG21 1 1 17 6567 1 1 17 VAL HG22 H -0.265 -1.997 2.105 1.00 . A A . 17 VAL HG22 1 1 17 6568 1 1 17 VAL HG23 H 1.273 -1.109 1.980 1.00 . A A . 17 VAL HG23 1 1 17 6569 1 1 17 VAL N N 0.995 -1.105 -2.172 1.00 . A A . 17 VAL N 1 1 17 6570 1 1 17 VAL O O 3.390 -0.290 0.272 1.00 . A A . 17 VAL O 1 1 17 6571 1 1 18 LYS C C 5.589 -0.776 -1.702 1.00 . A A . 18 LYS C 1 1 17 6572 1 1 18 LYS CA C 4.872 -2.058 -1.278 1.00 . A A . 18 LYS CA 1 1 17 6573 1 1 18 LYS CB C 5.286 -3.290 -2.086 1.00 . A A . 18 LYS CB 1 1 17 6574 1 1 18 LYS CD C 6.178 -2.337 -4.243 1.00 . A A . 18 LYS CD 1 1 17 6575 1 1 18 LYS CE C 6.038 -3.373 -5.360 1.00 . A A . 18 LYS CE 1 1 17 6576 1 1 18 LYS CG C 6.539 -3.005 -2.916 1.00 . A A . 18 LYS CG 1 1 17 6577 1 1 18 LYS H H 2.967 -2.417 -2.041 1.00 . A A . 18 LYS H 1 1 17 6578 1 1 18 LYS HA H 5.115 -2.261 -0.234 1.00 . A A . 18 LYS HA 1 1 17 6579 1 1 18 LYS HB3 H 4.470 -3.588 -2.744 1.00 . A A . 18 LYS HB3 1 1 17 6580 1 1 18 LYS HD3 H 6.946 -1.611 -4.510 1.00 . A A . 18 LYS HD3 1 1 17 6581 1 1 18 LYS HE3 H 5.311 -4.132 -5.070 1.00 . A A . 18 LYS HE3 1 1 17 6582 1 1 18 LYS HG3 H 7.072 -3.936 -3.107 1.00 . A A . 18 LYS HG3 1 1 17 6583 1 1 18 LYS HZ1 H 5.193 -3.405 -7.220 1.00 . A A . 18 LYS HZ1 1 1 17 6584 1 1 18 LYS HZ2 H 4.948 -2.005 -6.416 1.00 . A A . 18 LYS HZ2 1 1 17 6585 1 1 18 LYS HZ3 H 6.408 -2.324 -7.074 1.00 . A A . 18 LYS HZ3 1 1 17 6586 1 1 18 LYS N N 3.435 -1.856 -1.359 1.00 . A A . 18 LYS N 1 1 17 6587 1 1 18 LYS NZ N 5.612 -2.724 -6.620 1.00 . A A . 18 LYS NZ 1 1 17 6588 1 1 18 LYS O O 6.643 -0.442 -1.165 1.00 . A A . 18 LYS O 1 1 17 6589 1 1 19 LYS C C 5.493 2.215 -2.068 1.00 . A A . 19 LYS C 1 1 17 6590 1 1 19 LYS CA C 5.553 1.150 -3.165 1.00 . A A . 19 LYS CA 1 1 17 6591 1 1 19 LYS CB C 4.863 1.567 -4.465 1.00 . A A . 19 LYS CB 1 1 17 6592 1 1 19 LYS CD C 3.307 3.369 -3.631 1.00 . A A . 19 LYS CD 1 1 17 6593 1 1 19 LYS CE C 2.090 3.604 -4.528 1.00 . A A . 19 LYS CE 1 1 17 6594 1 1 19 LYS CG C 4.553 3.066 -4.466 1.00 . A A . 19 LYS CG 1 1 17 6595 1 1 19 LYS H H 4.127 -0.366 -3.094 1.00 . A A . 19 LYS H 1 1 17 6596 1 1 19 LYS HA H 6.599 0.959 -3.402 1.00 . A A . 19 LYS HA 1 1 17 6597 1 1 19 LYS HB3 H 3.939 1.002 -4.588 1.00 . A A . 19 LYS HB3 1 1 17 6598 1 1 19 LYS HD3 H 3.485 4.250 -3.015 1.00 . A A . 19 LYS HD3 1 1 17 6599 1 1 19 LYS HE3 H 1.175 3.454 -3.955 1.00 . A A . 19 LYS HE3 1 1 17 6600 1 1 19 LYS HG3 H 4.402 3.409 -5.489 1.00 . A A . 19 LYS HG3 1 1 17 6601 1 1 19 LYS HZ1 H 1.678 4.975 -5.987 1.00 . A A . 19 LYS HZ1 1 1 17 6602 1 1 19 LYS HZ2 H 1.619 5.592 -4.476 1.00 . A A . 19 LYS HZ2 1 1 17 6603 1 1 19 LYS HZ3 H 3.062 5.281 -5.175 1.00 . A A . 19 LYS HZ3 1 1 17 6604 1 1 19 LYS N N 4.986 -0.089 -2.662 1.00 . A A . 19 LYS N 1 1 17 6605 1 1 19 LYS NZ N 2.115 4.974 -5.086 1.00 . A A . 19 LYS NZ 1 1 17 6606 1 1 19 LYS O O 6.202 3.219 -2.133 1.00 . A A . 19 LYS O 1 1 17 6607 1 1 20 LEU C C 5.466 2.522 1.133 1.00 . A A . 20 LEU C 1 1 17 6608 1 1 20 LEU CA C 4.477 2.886 0.022 1.00 . A A . 20 LEU CA 1 1 17 6609 1 1 20 LEU CB C 3.019 2.919 0.485 1.00 . A A . 20 LEU CB 1 1 17 6610 1 1 20 LEU CD1 C 3.335 3.029 2.983 1.00 . A A . 20 LEU CD1 1 1 17 6611 1 1 20 LEU CD2 C 1.221 2.021 2.008 1.00 . A A . 20 LEU CD2 1 1 17 6612 1 1 20 LEU CG C 2.724 2.240 1.823 1.00 . A A . 20 LEU CG 1 1 17 6613 1 1 20 LEU H H 4.066 1.143 -1.042 1.00 . A A . 20 LEU H 1 1 17 6614 1 1 20 LEU HA H 4.722 3.883 -0.345 1.00 . A A . 20 LEU HA 1 1 17 6615 1 1 20 LEU HB3 H 2.406 2.446 -0.283 1.00 . A A . 20 LEU HB3 1 1 17 6616 1 1 20 LEU HD11 H 3.723 3.977 2.613 1.00 . A A . 20 LEU HD11 1 1 17 6617 1 1 20 LEU HD12 H 2.571 3.218 3.737 1.00 . A A . 20 LEU HD12 1 1 17 6618 1 1 20 LEU HD13 H 4.147 2.453 3.427 1.00 . A A . 20 LEU HD13 1 1 17 6619 1 1 20 LEU HD21 H 0.863 2.636 2.834 1.00 . A A . 20 LEU HD21 1 1 17 6620 1 1 20 LEU HD22 H 0.698 2.302 1.093 1.00 . A A . 20 LEU HD22 1 1 17 6621 1 1 20 LEU HD23 H 1.031 0.971 2.228 1.00 . A A . 20 LEU HD23 1 1 17 6622 1 1 20 LEU HG H 3.195 1.257 1.819 1.00 . A A . 20 LEU HG 1 1 17 6623 1 1 20 LEU N N 4.640 1.961 -1.087 1.00 . A A . 20 LEU N 1 1 17 6624 1 1 20 LEU O O 5.731 3.330 2.021 1.00 . A A . 20 LEU O 1 1 17 6625 1 1 21 PHE C C 8.278 1.546 1.893 1.00 . A A . 21 PHE C 1 1 17 6626 1 1 21 PHE CA C 6.936 0.825 2.031 1.00 . A A . 21 PHE CA 1 1 17 6627 1 1 21 PHE CB C 7.143 -0.668 1.763 1.00 . A A . 21 PHE CB 1 1 17 6628 1 1 21 PHE CD1 C 5.569 -1.884 3.284 1.00 . A A . 21 PHE CD1 1 1 17 6629 1 1 21 PHE CD2 C 7.878 -2.037 3.725 1.00 . A A . 21 PHE CD2 1 1 17 6630 1 1 21 PHE CE1 C 5.299 -2.715 4.403 1.00 . A A . 21 PHE CE1 1 1 17 6631 1 1 21 PHE CE2 C 7.608 -2.868 4.845 1.00 . A A . 21 PHE CE2 1 1 17 6632 1 1 21 PHE CG C 6.852 -1.563 2.969 1.00 . A A . 21 PHE CG 1 1 17 6633 1 1 21 PHE CZ C 6.324 -3.190 5.160 1.00 . A A . 21 PHE CZ 1 1 17 6634 1 1 21 PHE H H 5.762 0.654 0.319 1.00 . A A . 21 PHE H 1 1 17 6635 1 1 21 PHE HA H 6.515 1.029 3.015 1.00 . A A . 21 PHE HA 1 1 17 6636 1 1 21 PHE HB3 H 8.173 -0.830 1.443 1.00 . A A . 21 PHE HB3 1 1 17 6637 1 1 21 PHE HD1 H 4.747 -1.503 2.677 1.00 . A A . 21 PHE HD1 1 1 17 6638 1 1 21 PHE HD2 H 8.907 -1.781 3.473 1.00 . A A . 21 PHE HD2 1 1 17 6639 1 1 21 PHE HE1 H 4.271 -2.971 4.655 1.00 . A A . 21 PHE HE1 1 1 17 6640 1 1 21 PHE HE2 H 8.430 -3.250 5.452 1.00 . A A . 21 PHE HE2 1 1 17 6641 1 1 21 PHE HZ H 6.117 -3.828 6.020 1.00 . A A . 21 PHE HZ 1 1 17 6642 1 1 21 PHE N N 5.984 1.305 1.045 1.00 . A A . 21 PHE N 1 1 17 6643 1 1 21 PHE O O 9.103 1.510 2.805 1.00 . A A . 21 PHE O 1 1 17 6644 1 1 22 LYS C C 10.060 3.742 1.708 1.00 . A A . 22 LYS C 1 1 17 6645 1 1 22 LYS CA C 9.684 2.914 0.477 1.00 . A A . 22 LYS CA 1 1 17 6646 1 1 22 LYS CB C 9.546 3.742 -0.802 1.00 . A A . 22 LYS CB 1 1 17 6647 1 1 22 LYS CD C 7.430 5.015 -0.291 1.00 . A A . 22 LYS CD 1 1 17 6648 1 1 22 LYS CE C 6.930 6.132 0.627 1.00 . A A . 22 LYS CE 1 1 17 6649 1 1 22 LYS CG C 8.942 5.115 -0.504 1.00 . A A . 22 LYS CG 1 1 17 6650 1 1 22 LYS H H 7.780 2.210 0.010 1.00 . A A . 22 LYS H 1 1 17 6651 1 1 22 LYS HA H 10.469 2.179 0.303 1.00 . A A . 22 LYS HA 1 1 17 6652 1 1 22 LYS HB3 H 8.918 3.211 -1.517 1.00 . A A . 22 LYS HB3 1 1 17 6653 1 1 22 LYS HD3 H 7.184 4.045 0.142 1.00 . A A . 22 LYS HD3 1 1 17 6654 1 1 22 LYS HE3 H 7.692 6.906 0.715 1.00 . A A . 22 LYS HE3 1 1 17 6655 1 1 22 LYS HG3 H 9.152 5.796 -1.330 1.00 . A A . 22 LYS HG3 1 1 17 6656 1 1 22 LYS HZ1 H 5.016 6.815 0.839 1.00 . A A . 22 LYS HZ1 1 1 17 6657 1 1 22 LYS HZ2 H 5.872 7.616 -0.299 1.00 . A A . 22 LYS HZ2 1 1 17 6658 1 1 22 LYS HZ3 H 5.303 6.117 -0.609 1.00 . A A . 22 LYS HZ3 1 1 17 6659 1 1 22 LYS N N 8.456 2.185 0.746 1.00 . A A . 22 LYS N 1 1 17 6660 1 1 22 LYS NZ N 5.679 6.717 0.096 1.00 . A A . 22 LYS NZ 1 1 17 6661 1 1 22 LYS O O 11.230 3.813 2.079 1.00 . A A . 22 LYS O 1 1 17 6662 1 1 23 LYS C C 9.339 4.265 4.721 1.00 . A A . 23 LYS C 1 1 17 6663 1 1 23 LYS CA C 9.254 5.167 3.489 1.00 . A A . 23 LYS CA 1 1 17 6664 1 1 23 LYS CB C 8.175 6.247 3.589 1.00 . A A . 23 LYS CB 1 1 17 6665 1 1 23 LYS CD C 5.679 6.606 3.587 1.00 . A A . 23 LYS CD 1 1 17 6666 1 1 23 LYS CE C 4.745 6.784 4.786 1.00 . A A . 23 LYS CE 1 1 17 6667 1 1 23 LYS CG C 6.813 5.633 3.916 1.00 . A A . 23 LYS CG 1 1 17 6668 1 1 23 LYS H H 8.095 4.284 2.000 1.00 . A A . 23 LYS H 1 1 17 6669 1 1 23 LYS HA H 10.211 5.677 3.367 1.00 . A A . 23 LYS HA 1 1 17 6670 1 1 23 LYS HB3 H 8.114 6.795 2.648 1.00 . A A . 23 LYS HB3 1 1 17 6671 1 1 23 LYS HD3 H 5.113 6.235 2.732 1.00 . A A . 23 LYS HD3 1 1 17 6672 1 1 23 LYS HE3 H 4.343 5.818 5.089 1.00 . A A . 23 LYS HE3 1 1 17 6673 1 1 23 LYS HG3 H 6.774 5.367 4.973 1.00 . A A . 23 LYS HG3 1 1 17 6674 1 1 23 LYS HZ1 H 5.991 8.191 5.591 1.00 . A A . 23 LYS HZ1 1 1 17 6675 1 1 23 LYS HZ2 H 4.811 7.705 6.610 1.00 . A A . 23 LYS HZ2 1 1 17 6676 1 1 23 LYS HZ3 H 6.092 6.734 6.322 1.00 . A A . 23 LYS HZ3 1 1 17 6677 1 1 23 LYS N N 9.045 4.347 2.308 1.00 . A A . 23 LYS N 1 1 17 6678 1 1 23 LYS NZ N 5.469 7.404 5.919 1.00 . A A . 23 LYS NZ 1 1 17 6679 1 1 23 LYS O O 10.252 4.404 5.534 1.00 . A A . 23 LYS O 1 1 17 6680 1 1 24 TRP C C 9.677 1.722 6.020 1.00 . A A . 24 TRP C 1 1 17 6681 1 1 24 TRP CA C 8.328 2.439 5.943 1.00 . A A . 24 TRP CA 1 1 17 6682 1 1 24 TRP CB C 7.146 1.476 5.810 1.00 . A A . 24 TRP CB 1 1 17 6683 1 1 24 TRP CD1 C 5.511 3.425 6.251 1.00 . A A . 24 TRP CD1 1 1 17 6684 1 1 24 TRP CD2 C 4.492 1.530 5.723 1.00 . A A . 24 TRP CD2 1 1 17 6685 1 1 24 TRP CE2 C 3.514 2.481 5.929 1.00 . A A . 24 TRP CE2 1 1 17 6686 1 1 24 TRP CE3 C 4.166 0.208 5.369 1.00 . A A . 24 TRP CE3 1 1 17 6687 1 1 24 TRP CG C 5.778 2.150 5.933 1.00 . A A . 24 TRP CG 1 1 17 6688 1 1 24 TRP CH2 C 1.796 0.903 5.456 1.00 . A A . 24 TRP CH2 1 1 17 6689 1 1 24 TRP CZ2 C 2.145 2.212 5.807 1.00 . A A . 24 TRP CZ2 1 1 17 6690 1 1 24 TRP CZ3 C 2.794 -0.044 5.251 1.00 . A A . 24 TRP CZ3 1 1 17 6691 1 1 24 TRP H H 7.635 3.257 4.157 1.00 . A A . 24 TRP H 1 1 17 6692 1 1 24 TRP HA H 8.163 3.022 6.849 1.00 . A A . 24 TRP HA 1 1 17 6693 1 1 24 TRP HB3 H 7.230 0.708 6.579 1.00 . A A . 24 TRP HB3 1 1 17 6694 1 1 24 TRP HD1 H 6.271 4.174 6.472 1.00 . A A . 24 TRP HD1 1 1 17 6695 1 1 24 TRP HE1 H 3.670 4.621 6.488 1.00 . A A . 24 TRP HE1 1 1 17 6696 1 1 24 TRP HE3 H 4.920 -0.561 5.200 1.00 . A A . 24 TRP HE3 1 1 17 6697 1 1 24 TRP HH2 H 0.749 0.625 5.344 1.00 . A A . 24 TRP HH2 1 1 17 6698 1 1 24 TRP HZ2 H 1.391 2.981 5.976 1.00 . A A . 24 TRP HZ2 1 1 17 6699 1 1 24 TRP HZ3 H 2.487 -1.054 4.979 1.00 . A A . 24 TRP HZ3 1 1 17 6700 1 1 24 TRP N N 8.374 3.363 4.822 1.00 . A A . 24 TRP N 1 1 17 6701 1 1 24 TRP NE1 N 4.153 3.669 6.261 1.00 . A A . 24 TRP NE1 1 1 17 6702 1 1 24 TRP O O 10.398 1.639 5.027 1.00 . A A . 24 TRP O 1 1 17 6703 1 1 25 GLY C C 11.372 0.098 8.895 1.00 . A A . 25 GLY C 1 1 17 6704 1 1 25 GLY CA C 11.228 0.513 7.429 1.00 . A A . 25 GLY CA 1 1 17 6705 1 1 25 GLY H H 9.385 1.291 8.012 1.00 . A A . 25 GLY H 1 1 17 6706 1 1 25 GLY HA2 H 11.266 -0.370 6.792 1.00 . A A . 25 GLY HA2 1 1 17 6707 1 1 25 GLY HA3 H 12.065 1.150 7.144 1.00 . A A . 25 GLY HA3 1 1 17 6708 1 1 25 GLY N N 9.978 1.221 7.209 1.00 . A A . 25 GLY N 1 1 17 6709 1 1 25 GLY O O 11.774 0.902 9.734 1.00 . A A . 25 GLY O 1 1 17 6710 1 1 26 TRP C C 12.469 -1.263 11.096 1.00 . A A . 26 TRP C 1 1 17 6711 1 1 26 TRP CA C 11.123 -1.688 10.507 1.00 . A A . 26 TRP CA 1 1 17 6712 1 1 26 TRP CB C 10.919 -3.204 10.513 1.00 . A A . 26 TRP CB 1 1 17 6713 1 1 26 TRP CD1 C 8.352 -3.001 10.688 1.00 . A A . 26 TRP CD1 1 1 17 6714 1 1 26 TRP CD2 C 9.015 -4.837 9.640 1.00 . A A . 26 TRP CD2 1 1 17 6715 1 1 26 TRP CE2 C 7.636 -4.851 9.664 1.00 . A A . 26 TRP CE2 1 1 17 6716 1 1 26 TRP CE3 C 9.748 -5.875 9.038 1.00 . A A . 26 TRP CE3 1 1 17 6717 1 1 26 TRP CG C 9.467 -3.638 10.303 1.00 . A A . 26 TRP CG 1 1 17 6718 1 1 26 TRP CH2 C 7.578 -6.924 8.498 1.00 . A A . 26 TRP CH2 1 1 17 6719 1 1 26 TRP CZ2 C 6.870 -5.880 9.103 1.00 . A A . 26 TRP CZ2 1 1 17 6720 1 1 26 TRP CZ3 C 8.968 -6.896 8.482 1.00 . A A . 26 TRP CZ3 1 1 17 6721 1 1 26 TRP H H 10.709 -1.804 8.468 1.00 . A A . 26 TRP H 1 1 17 6722 1 1 26 TRP HA H 10.309 -1.255 11.089 1.00 . A A . 26 TRP HA 1 1 17 6723 1 1 26 TRP HB3 H 11.274 -3.603 11.464 1.00 . A A . 26 TRP HB3 1 1 17 6724 1 1 26 TRP HD1 H 8.341 -2.051 11.223 1.00 . A A . 26 TRP HD1 1 1 17 6725 1 1 26 TRP HE1 H 6.189 -3.402 10.513 1.00 . A A . 26 TRP HE1 1 1 17 6726 1 1 26 TRP HE3 H 10.838 -5.887 9.005 1.00 . A A . 26 TRP HE3 1 1 17 6727 1 1 26 TRP HH2 H 7.043 -7.757 8.042 1.00 . A A . 26 TRP HH2 1 1 17 6728 1 1 26 TRP HZ2 H 5.780 -5.868 9.135 1.00 . A A . 26 TRP HZ2 1 1 17 6729 1 1 26 TRP HZ3 H 9.486 -7.725 8.003 1.00 . A A . 26 TRP HZ3 1 1 17 6730 1 1 26 TRP N N 11.036 -1.156 9.158 1.00 . A A . 26 TRP N 1 1 17 6731 1 1 26 TRP NE1 N 7.220 -3.700 10.322 1.00 . A A . 26 TRP NE1 1 1 17 6732 1 1 26 TRP O O 13.522 -1.605 10.559 1.00 . A A . 26 TRP O 1 1 18 6733 1 1 1 LYS C C -2.863 11.678 -0.852 1.00 . A A . 1 LYS C 1 1 18 6734 1 1 1 LYS CA C -1.699 12.667 -0.761 1.00 . A A . 1 LYS CA 1 1 18 6735 1 1 1 LYS CB C -1.495 13.250 0.639 1.00 . A A . 1 LYS CB 1 1 18 6736 1 1 1 LYS CD C 0.001 15.049 1.581 1.00 . A A . 1 LYS CD 1 1 18 6737 1 1 1 LYS CE C 0.972 16.018 0.905 1.00 . A A . 1 LYS CE 1 1 18 6738 1 1 1 LYS CG C -0.050 13.713 0.834 1.00 . A A . 1 LYS CG 1 1 18 6739 1 1 1 LYS H1 H -1.764 14.656 -1.378 1.00 . A A . 1 LYS H1 1 1 18 6740 1 1 1 LYS HA H -0.780 12.145 -1.030 1.00 . A A . 1 LYS HA 1 1 18 6741 1 1 1 LYS HB3 H -1.745 12.500 1.388 1.00 . A A . 1 LYS HB3 1 1 18 6742 1 1 1 LYS HD3 H 0.308 14.880 2.613 1.00 . A A . 1 LYS HD3 1 1 18 6743 1 1 1 LYS HE3 H 0.888 17.004 1.361 1.00 . A A . 1 LYS HE3 1 1 18 6744 1 1 1 LYS HG3 H 0.437 13.817 -0.135 1.00 . A A . 1 LYS HG3 1 1 18 6745 1 1 1 LYS HZ1 H 2.568 15.341 1.990 1.00 . A A . 1 LYS HZ1 1 1 18 6746 1 1 1 LYS HZ2 H 2.469 14.687 0.497 1.00 . A A . 1 LYS HZ2 1 1 18 6747 1 1 1 LYS HZ3 H 2.994 16.222 0.682 1.00 . A A . 1 LYS HZ3 1 1 18 6748 1 1 1 LYS N N -1.895 13.730 -1.732 1.00 . A A . 1 LYS N 1 1 18 6749 1 1 1 LYS NZ N 2.363 15.527 1.029 1.00 . A A . 1 LYS NZ 1 1 18 6750 1 1 1 LYS O O -3.784 11.722 -0.039 1.00 . A A . 1 LYS O 1 1 18 6751 1 1 2 SER C C -3.633 8.652 -1.073 1.00 . A A . 2 SER C 1 1 18 6752 1 1 2 SER CA C -3.817 9.810 -2.056 1.00 . A A . 2 SER CA 1 1 18 6753 1 1 2 SER CB C -3.802 9.292 -3.496 1.00 . A A . 2 SER CB 1 1 18 6754 1 1 2 SER H H -2.029 10.779 -2.506 1.00 . A A . 2 SER H 1 1 18 6755 1 1 2 SER HA H -4.759 10.326 -1.867 1.00 . A A . 2 SER HA 1 1 18 6756 1 1 2 SER HB3 H -4.317 8.332 -3.541 1.00 . A A . 2 SER HB3 1 1 18 6757 1 1 2 SER HG H -3.724 10.667 -4.948 1.00 . A A . 2 SER HG 1 1 18 6758 1 1 2 SER N N -2.783 10.808 -1.849 1.00 . A A . 2 SER N 1 1 18 6759 1 1 2 SER O O -3.103 7.603 -1.437 1.00 . A A . 2 SER O 1 1 18 6760 1 1 2 SER OG O -4.421 10.205 -4.399 1.00 . A A . 2 SER OG 1 1 18 6761 1 1 3 SER C C -5.316 7.170 1.383 1.00 . A A . 3 SER C 1 1 18 6762 1 1 3 SER CA C -3.970 7.872 1.191 1.00 . A A . 3 SER CA 1 1 18 6763 1 1 3 SER CB C -3.499 8.486 2.511 1.00 . A A . 3 SER CB 1 1 18 6764 1 1 3 SER H H -4.509 9.739 0.440 1.00 . A A . 3 SER H 1 1 18 6765 1 1 3 SER HA H -3.220 7.168 0.830 1.00 . A A . 3 SER HA 1 1 18 6766 1 1 3 SER HB3 H -4.286 8.389 3.257 1.00 . A A . 3 SER HB3 1 1 18 6767 1 1 3 SER HG H -2.205 6.961 2.584 1.00 . A A . 3 SER HG 1 1 18 6768 1 1 3 SER N N -4.080 8.882 0.153 1.00 . A A . 3 SER N 1 1 18 6769 1 1 3 SER O O -6.360 7.819 1.403 1.00 . A A . 3 SER O 1 1 18 6770 1 1 3 SER OG O -2.309 7.868 2.993 1.00 . A A . 3 SER OG 1 1 18 6771 1 1 4 ALA C C -6.504 4.562 3.153 1.00 . A A . 4 ALA C 1 1 18 6772 1 1 4 ALA CA C -6.448 5.057 1.706 1.00 . A A . 4 ALA CA 1 1 18 6773 1 1 4 ALA CB C -6.463 3.909 0.695 1.00 . A A . 4 ALA CB 1 1 18 6774 1 1 4 ALA H H -4.394 5.333 1.499 1.00 . A A . 4 ALA H 1 1 18 6775 1 1 4 ALA HA H -7.307 5.702 1.518 1.00 . A A . 4 ALA HA 1 1 18 6776 1 1 4 ALA HB1 H -7.272 4.064 -0.019 1.00 . A A . 4 ALA HB1 1 1 18 6777 1 1 4 ALA HB2 H -5.511 3.878 0.166 1.00 . A A . 4 ALA HB2 1 1 18 6778 1 1 4 ALA HB3 H -6.618 2.966 1.220 1.00 . A A . 4 ALA HB3 1 1 18 6779 1 1 4 ALA N N -5.248 5.853 1.517 1.00 . A A . 4 ALA N 1 1 18 6780 1 1 4 ALA O O -5.477 4.485 3.826 1.00 . A A . 4 ALA O 1 1 18 6781 1 1 5 TYR C C -8.633 2.401 4.939 1.00 . A A . 5 TYR C 1 1 18 6782 1 1 5 TYR CA C -7.916 3.753 4.942 1.00 . A A . 5 TYR CA 1 1 18 6783 1 1 5 TYR CB C -8.807 4.788 5.632 1.00 . A A . 5 TYR CB 1 1 18 6784 1 1 5 TYR CD1 C -7.213 6.739 5.561 1.00 . A A . 5 TYR CD1 1 1 18 6785 1 1 5 TYR CD2 C -8.160 6.127 7.668 1.00 . A A . 5 TYR CD2 1 1 18 6786 1 1 5 TYR CE1 C -6.486 7.807 6.198 1.00 . A A . 5 TYR CE1 1 1 18 6787 1 1 5 TYR CE2 C -7.433 7.194 8.306 1.00 . A A . 5 TYR CE2 1 1 18 6788 1 1 5 TYR CG C -8.035 5.922 6.309 1.00 . A A . 5 TYR CG 1 1 18 6789 1 1 5 TYR CZ C -6.632 7.981 7.539 1.00 . A A . 5 TYR CZ 1 1 18 6790 1 1 5 TYR H H -8.543 4.304 3.034 1.00 . A A . 5 TYR H 1 1 18 6791 1 1 5 TYR HA H -6.937 3.636 5.407 1.00 . A A . 5 TYR HA 1 1 18 6792 1 1 5 TYR HB3 H -9.421 4.284 6.378 1.00 . A A . 5 TYR HB3 1 1 18 6793 1 1 5 TYR HD1 H -7.113 6.577 4.488 1.00 . A A . 5 TYR HD1 1 1 18 6794 1 1 5 TYR HD2 H -8.810 5.481 8.259 1.00 . A A . 5 TYR HD2 1 1 18 6795 1 1 5 TYR HE1 H -5.833 8.461 5.619 1.00 . A A . 5 TYR HE1 1 1 18 6796 1 1 5 TYR HE2 H -7.524 7.367 9.378 1.00 . A A . 5 TYR HE2 1 1 18 6797 1 1 5 TYR HH H -5.632 8.698 9.044 1.00 . A A . 5 TYR HH 1 1 18 6798 1 1 5 TYR N N -7.713 4.239 3.587 1.00 . A A . 5 TYR N 1 1 18 6799 1 1 5 TYR O O -9.853 2.342 5.084 1.00 . A A . 5 TYR O 1 1 18 6800 1 1 5 TYR OH O -5.946 8.989 8.141 1.00 . A A . 5 TYR OH 1 1 18 6801 1 1 6 SER C C -7.258 -1.015 4.590 1.00 . A A . 6 SER C 1 1 18 6802 1 1 6 SER CA C -8.390 0.003 4.744 1.00 . A A . 6 SER CA 1 1 18 6803 1 1 6 SER CB C -9.407 -0.159 3.613 1.00 . A A . 6 SER CB 1 1 18 6804 1 1 6 SER H H -6.853 1.408 4.651 1.00 . A A . 6 SER H 1 1 18 6805 1 1 6 SER HA H -8.891 -0.123 5.704 1.00 . A A . 6 SER HA 1 1 18 6806 1 1 6 SER HB3 H -8.880 -0.324 2.672 1.00 . A A . 6 SER HB3 1 1 18 6807 1 1 6 SER HG H -11.081 -1.185 3.227 1.00 . A A . 6 SER HG 1 1 18 6808 1 1 6 SER N N -7.844 1.350 4.769 1.00 . A A . 6 SER N 1 1 18 6809 1 1 6 SER O O -6.108 -0.642 4.362 1.00 . A A . 6 SER O 1 1 18 6810 1 1 6 SER OG O -10.302 -1.242 3.851 1.00 . A A . 6 SER OG 1 1 18 6811 1 1 7 LEU C C -6.448 -3.688 3.122 1.00 . A A . 7 LEU C 1 1 18 6812 1 1 7 LEU CA C -6.653 -3.357 4.601 1.00 . A A . 7 LEU CA 1 1 18 6813 1 1 7 LEU CB C -7.077 -4.559 5.447 1.00 . A A . 7 LEU CB 1 1 18 6814 1 1 7 LEU CD1 C -7.964 -5.506 7.609 1.00 . A A . 7 LEU CD1 1 1 18 6815 1 1 7 LEU CD2 C -6.162 -3.720 7.642 1.00 . A A . 7 LEU CD2 1 1 18 6816 1 1 7 LEU CG C -7.392 -4.268 6.916 1.00 . A A . 7 LEU CG 1 1 18 6817 1 1 7 LEU H H -8.561 -2.578 4.908 1.00 . A A . 7 LEU H 1 1 18 6818 1 1 7 LEU HA H -5.710 -2.994 5.007 1.00 . A A . 7 LEU HA 1 1 18 6819 1 1 7 LEU HB3 H -6.283 -5.305 5.407 1.00 . A A . 7 LEU HB3 1 1 18 6820 1 1 7 LEU HD11 H -7.458 -5.654 8.564 1.00 . A A . 7 LEU HD11 1 1 18 6821 1 1 7 LEU HD12 H -9.032 -5.366 7.781 1.00 . A A . 7 LEU HD12 1 1 18 6822 1 1 7 LEU HD13 H -7.809 -6.382 6.978 1.00 . A A . 7 LEU HD13 1 1 18 6823 1 1 7 LEU HD21 H -5.282 -3.849 7.012 1.00 . A A . 7 LEU HD21 1 1 18 6824 1 1 7 LEU HD22 H -6.307 -2.661 7.853 1.00 . A A . 7 LEU HD22 1 1 18 6825 1 1 7 LEU HD23 H -6.022 -4.262 8.577 1.00 . A A . 7 LEU HD23 1 1 18 6826 1 1 7 LEU HG H -8.160 -3.495 6.954 1.00 . A A . 7 LEU HG 1 1 18 6827 1 1 7 LEU N N -7.623 -2.282 4.722 1.00 . A A . 7 LEU N 1 1 18 6828 1 1 7 LEU O O -5.349 -3.530 2.592 1.00 . A A . 7 LEU O 1 1 18 6829 1 1 8 GLN C C -8.880 -4.465 0.482 1.00 . A A . 8 GLN C 1 1 18 6830 1 1 8 GLN CA C -7.475 -4.497 1.086 1.00 . A A . 8 GLN CA 1 1 18 6831 1 1 8 GLN CB C -6.824 -5.867 0.887 1.00 . A A . 8 GLN CB 1 1 18 6832 1 1 8 GLN CD C -7.007 -8.340 1.352 1.00 . A A . 8 GLN CD 1 1 18 6833 1 1 8 GLN CG C -7.699 -6.980 1.468 1.00 . A A . 8 GLN CG 1 1 18 6834 1 1 8 GLN H H -8.414 -4.268 2.932 1.00 . A A . 8 GLN H 1 1 18 6835 1 1 8 GLN HA H -6.853 -3.735 0.617 1.00 . A A . 8 GLN HA 1 1 18 6836 1 1 8 GLN HB3 H -5.845 -5.882 1.369 1.00 . A A . 8 GLN HB3 1 1 18 6837 1 1 8 GLN HE21 H -8.018 -8.655 -0.373 1.00 . A A . 8 GLN HE21 1 1 18 6838 1 1 8 GLN HE22 H -6.958 -9.937 0.108 1.00 . A A . 8 GLN HE22 1 1 18 6839 1 1 8 GLN HG3 H -8.654 -7.007 0.942 1.00 . A A . 8 GLN HG3 1 1 18 6840 1 1 8 GLN N N -7.524 -4.142 2.494 1.00 . A A . 8 GLN N 1 1 18 6841 1 1 8 GLN NE2 N -7.356 -9.034 0.273 1.00 . A A . 8 GLN NE2 1 1 18 6842 1 1 8 GLN O O -9.870 -4.614 1.197 1.00 . A A . 8 GLN O 1 1 18 6843 1 1 8 GLN OE1 O -6.209 -8.731 2.186 1.00 . A A . 8 GLN OE1 1 1 18 6844 1 1 9 MET C C -10.002 -4.539 -3.021 1.00 . A A . 9 MET C 1 1 18 6845 1 1 9 MET CA C -10.190 -4.219 -1.536 1.00 . A A . 9 MET CA 1 1 18 6846 1 1 9 MET CB C -10.800 -2.823 -1.388 1.00 . A A . 9 MET CB 1 1 18 6847 1 1 9 MET CE C -14.216 -2.979 0.245 1.00 . A A . 9 MET CE 1 1 18 6848 1 1 9 MET CG C -11.512 -2.677 -0.041 1.00 . A A . 9 MET CG 1 1 18 6849 1 1 9 MET H H -8.112 -4.152 -1.402 1.00 . A A . 9 MET H 1 1 18 6850 1 1 9 MET HA H -10.818 -4.978 -1.070 1.00 . A A . 9 MET HA 1 1 18 6851 1 1 9 MET HB3 H -11.506 -2.643 -2.198 1.00 . A A . 9 MET HB3 1 1 18 6852 1 1 9 MET HE1 H -14.570 -2.759 1.252 1.00 . A A . 9 MET HE1 1 1 18 6853 1 1 9 MET HE2 H -15.057 -2.966 -0.448 1.00 . A A . 9 MET HE2 1 1 18 6854 1 1 9 MET HE3 H -13.747 -3.963 0.231 1.00 . A A . 9 MET HE3 1 1 18 6855 1 1 9 MET HG3 H -10.859 -2.174 0.672 1.00 . A A . 9 MET HG3 1 1 18 6856 1 1 9 MET N N -8.922 -4.272 -0.828 1.00 . A A . 9 MET N 1 1 18 6857 1 1 9 MET O O -10.685 -5.406 -3.564 1.00 . A A . 9 MET O 1 1 18 6858 1 1 9 MET SD S -13.021 -1.746 -0.247 1.00 . A A . 9 MET SD 1 1 18 6859 1 1 10 GLY C C -7.958 -5.285 -5.266 1.00 . A A . 10 GLY C 1 1 18 6860 1 1 10 GLY CA C -8.788 -4.018 -5.046 1.00 . A A . 10 GLY CA 1 1 18 6861 1 1 10 GLY H H -8.523 -3.118 -3.186 1.00 . A A . 10 GLY H 1 1 18 6862 1 1 10 GLY HA2 H -9.721 -4.088 -5.603 1.00 . A A . 10 GLY HA2 1 1 18 6863 1 1 10 GLY HA3 H -8.249 -3.154 -5.436 1.00 . A A . 10 GLY HA3 1 1 18 6864 1 1 10 GLY N N -9.073 -3.821 -3.636 1.00 . A A . 10 GLY N 1 1 18 6865 1 1 10 GLY O O -8.502 -6.386 -5.317 1.00 . A A . 10 GLY O 1 1 18 6866 1 1 11 ALA C C -4.346 -5.655 -5.911 1.00 . A A . 11 ALA C 1 1 18 6867 1 1 11 ALA CA C -5.744 -6.197 -5.604 1.00 . A A . 11 ALA CA 1 1 18 6868 1 1 11 ALA CB C -6.282 -7.091 -6.723 1.00 . A A . 11 ALA CB 1 1 18 6869 1 1 11 ALA H H -6.218 -4.185 -5.347 1.00 . A A . 11 ALA H 1 1 18 6870 1 1 11 ALA HA H -5.704 -6.776 -4.681 1.00 . A A . 11 ALA HA 1 1 18 6871 1 1 11 ALA HB1 H -5.530 -7.183 -7.508 1.00 . A A . 11 ALA HB1 1 1 18 6872 1 1 11 ALA HB2 H -6.512 -8.077 -6.321 1.00 . A A . 11 ALA HB2 1 1 18 6873 1 1 11 ALA HB3 H -7.188 -6.647 -7.138 1.00 . A A . 11 ALA HB3 1 1 18 6874 1 1 11 ALA N N -6.654 -5.085 -5.391 1.00 . A A . 11 ALA N 1 1 18 6875 1 1 11 ALA O O -3.359 -6.110 -5.334 1.00 . A A . 11 ALA O 1 1 18 6876 1 1 12 THR C C -2.464 -3.271 -6.054 1.00 . A A . 12 THR C 1 1 18 6877 1 1 12 THR CA C -3.046 -4.084 -7.211 1.00 . A A . 12 THR CA 1 1 18 6878 1 1 12 THR CB C -3.294 -3.254 -8.472 1.00 . A A . 12 THR CB 1 1 18 6879 1 1 12 THR CG2 C -2.008 -2.643 -9.033 1.00 . A A . 12 THR CG2 1 1 18 6880 1 1 12 THR H H -5.114 -4.329 -7.285 1.00 . A A . 12 THR H 1 1 18 6881 1 1 12 THR HA H -2.335 -4.879 -7.434 1.00 . A A . 12 THR HA 1 1 18 6882 1 1 12 THR HB H -4.044 -2.485 -8.290 1.00 . A A . 12 THR HB 1 1 18 6883 1 1 12 THR HG1 H -4.202 -3.773 -10.179 1.00 . A A . 12 THR HG1 1 1 18 6884 1 1 12 THR HG21 H -2.230 -2.119 -9.963 1.00 . A A . 12 THR HG21 1 1 18 6885 1 1 12 THR HG22 H -1.594 -1.940 -8.309 1.00 . A A . 12 THR HG22 1 1 18 6886 1 1 12 THR HG23 H -1.283 -3.434 -9.226 1.00 . A A . 12 THR HG23 1 1 18 6887 1 1 12 THR N N -4.306 -4.693 -6.820 1.00 . A A . 12 THR N 1 1 18 6888 1 1 12 THR O O -1.295 -3.428 -5.707 1.00 . A A . 12 THR O 1 1 18 6889 1 1 12 THR OG1 O -3.677 -4.215 -9.452 1.00 . A A . 12 THR OG1 1 1 18 6890 1 1 13 ALA C C -2.051 -2.415 -3.403 1.00 . A A . 13 ALA C 1 1 18 6891 1 1 13 ALA CA C -2.891 -1.584 -4.374 1.00 . A A . 13 ALA CA 1 1 18 6892 1 1 13 ALA CB C -4.124 -0.974 -3.705 1.00 . A A . 13 ALA CB 1 1 18 6893 1 1 13 ALA H H -4.257 -2.301 -5.774 1.00 . A A . 13 ALA H 1 1 18 6894 1 1 13 ALA HA H -2.276 -0.779 -4.777 1.00 . A A . 13 ALA HA 1 1 18 6895 1 1 13 ALA HB1 H -4.281 0.036 -4.082 1.00 . A A . 13 ALA HB1 1 1 18 6896 1 1 13 ALA HB2 H -4.999 -1.585 -3.929 1.00 . A A . 13 ALA HB2 1 1 18 6897 1 1 13 ALA HB3 H -3.972 -0.939 -2.626 1.00 . A A . 13 ALA HB3 1 1 18 6898 1 1 13 ALA N N -3.307 -2.421 -5.486 1.00 . A A . 13 ALA N 1 1 18 6899 1 1 13 ALA O O -1.005 -1.963 -2.938 1.00 . A A . 13 ALA O 1 1 18 6900 1 1 14 ILE C C -0.342 -4.446 -2.489 1.00 . A A . 14 ILE C 1 1 18 6901 1 1 14 ILE CA C -1.845 -4.512 -2.216 1.00 . A A . 14 ILE CA 1 1 18 6902 1 1 14 ILE CB C -2.426 -5.925 -2.313 1.00 . A A . 14 ILE CB 1 1 18 6903 1 1 14 ILE CD1 C -4.603 -7.196 -2.397 1.00 . A A . 14 ILE CD1 1 1 18 6904 1 1 14 ILE CG1 C -3.891 -5.948 -1.870 1.00 . A A . 14 ILE CG1 1 1 18 6905 1 1 14 ILE CG2 C -1.574 -6.923 -1.526 1.00 . A A . 14 ILE CG2 1 1 18 6906 1 1 14 ILE H H -3.390 -3.975 -3.507 1.00 . A A . 14 ILE H 1 1 18 6907 1 1 14 ILE HA H -2.029 -4.158 -1.202 1.00 . A A . 14 ILE HA 1 1 18 6908 1 1 14 ILE HB H -2.400 -6.234 -3.358 1.00 . A A . 14 ILE HB 1 1 18 6909 1 1 14 ILE HD11 H -4.568 -7.980 -1.641 1.00 . A A . 14 ILE HD11 1 1 18 6910 1 1 14 ILE HD12 H -5.642 -6.952 -2.621 1.00 . A A . 14 ILE HD12 1 1 18 6911 1 1 14 ILE HD13 H -4.107 -7.542 -3.303 1.00 . A A . 14 ILE HD13 1 1 18 6912 1 1 14 ILE HG13 H -4.398 -5.054 -2.234 1.00 . A A . 14 ILE HG13 1 1 18 6913 1 1 14 ILE HG21 H -1.824 -7.938 -1.836 1.00 . A A . 14 ILE HG21 1 1 18 6914 1 1 14 ILE HG22 H -0.519 -6.733 -1.722 1.00 . A A . 14 ILE HG22 1 1 18 6915 1 1 14 ILE HG23 H -1.772 -6.808 -0.460 1.00 . A A . 14 ILE HG23 1 1 18 6916 1 1 14 ILE N N -2.539 -3.615 -3.124 1.00 . A A . 14 ILE N 1 1 18 6917 1 1 14 ILE O O 0.457 -4.339 -1.560 1.00 . A A . 14 ILE O 1 1 18 6918 1 1 15 LYS C C 1.996 -3.121 -3.743 1.00 . A A . 15 LYS C 1 1 18 6919 1 1 15 LYS CA C 1.393 -4.459 -4.174 1.00 . A A . 15 LYS CA 1 1 18 6920 1 1 15 LYS CB C 1.525 -4.739 -5.673 1.00 . A A . 15 LYS CB 1 1 18 6921 1 1 15 LYS CD C 2.910 -2.740 -6.342 1.00 . A A . 15 LYS CD 1 1 18 6922 1 1 15 LYS CE C 3.386 -2.207 -7.694 1.00 . A A . 15 LYS CE 1 1 18 6923 1 1 15 LYS CG C 1.553 -3.435 -6.473 1.00 . A A . 15 LYS CG 1 1 18 6924 1 1 15 LYS H H -0.657 -4.598 -4.517 1.00 . A A . 15 LYS H 1 1 18 6925 1 1 15 LYS HA H 1.916 -5.259 -3.650 1.00 . A A . 15 LYS HA 1 1 18 6926 1 1 15 LYS HB3 H 0.691 -5.356 -6.005 1.00 . A A . 15 LYS HB3 1 1 18 6927 1 1 15 LYS HD3 H 3.644 -3.441 -5.944 1.00 . A A . 15 LYS HD3 1 1 18 6928 1 1 15 LYS HE3 H 3.832 -1.221 -7.567 1.00 . A A . 15 LYS HE3 1 1 18 6929 1 1 15 LYS HG3 H 0.764 -2.771 -6.120 1.00 . A A . 15 LYS HG3 1 1 18 6930 1 1 15 LYS HZ1 H 4.957 -3.510 -7.578 1.00 . A A . 15 LYS HZ1 1 1 18 6931 1 1 15 LYS HZ2 H 3.895 -3.872 -8.765 1.00 . A A . 15 LYS HZ2 1 1 18 6932 1 1 15 LYS HZ3 H 4.939 -2.631 -8.954 1.00 . A A . 15 LYS HZ3 1 1 18 6933 1 1 15 LYS N N -0.001 -4.511 -3.768 1.00 . A A . 15 LYS N 1 1 18 6934 1 1 15 LYS NZ N 4.374 -3.129 -8.296 1.00 . A A . 15 LYS NZ 1 1 18 6935 1 1 15 LYS O O 3.103 -3.079 -3.206 1.00 . A A . 15 LYS O 1 1 18 6936 1 1 16 GLN C C 2.084 -0.673 -2.160 1.00 . A A . 16 GLN C 1 1 18 6937 1 1 16 GLN CA C 1.689 -0.724 -3.637 1.00 . A A . 16 GLN CA 1 1 18 6938 1 1 16 GLN CB C 0.612 0.316 -3.953 1.00 . A A . 16 GLN CB 1 1 18 6939 1 1 16 GLN CD C -0.106 2.084 -5.601 1.00 . A A . 16 GLN CD 1 1 18 6940 1 1 16 GLN CG C 0.761 0.843 -5.381 1.00 . A A . 16 GLN CG 1 1 18 6941 1 1 16 GLN H H 0.343 -2.103 -4.430 1.00 . A A . 16 GLN H 1 1 18 6942 1 1 16 GLN HA H 2.562 -0.535 -4.261 1.00 . A A . 16 GLN HA 1 1 18 6943 1 1 16 GLN HB3 H 0.682 1.143 -3.247 1.00 . A A . 16 GLN HB3 1 1 18 6944 1 1 16 GLN HE21 H 1.396 2.884 -6.697 1.00 . A A . 16 GLN HE21 1 1 18 6945 1 1 16 GLN HE22 H -0.015 3.875 -6.541 1.00 . A A . 16 GLN HE22 1 1 18 6946 1 1 16 GLN HG3 H 0.479 0.067 -6.091 1.00 . A A . 16 GLN HG3 1 1 18 6947 1 1 16 GLN N N 1.242 -2.060 -3.992 1.00 . A A . 16 GLN N 1 1 18 6948 1 1 16 GLN NE2 N 0.473 3.026 -6.341 1.00 . A A . 16 GLN NE2 1 1 18 6949 1 1 16 GLN O O 2.803 0.231 -1.737 1.00 . A A . 16 GLN O 1 1 18 6950 1 1 16 GLN OE1 O -1.227 2.180 -5.130 1.00 . A A . 16 GLN OE1 1 1 18 6951 1 1 17 VAL C C 3.398 -1.581 0.220 1.00 . A A . 17 VAL C 1 1 18 6952 1 1 17 VAL CA C 1.890 -1.732 0.006 1.00 . A A . 17 VAL CA 1 1 18 6953 1 1 17 VAL CB C 1.332 -3.033 0.586 1.00 . A A . 17 VAL CB 1 1 18 6954 1 1 17 VAL CG1 C 1.814 -3.245 2.023 1.00 . A A . 17 VAL CG1 1 1 18 6955 1 1 17 VAL CG2 C -0.195 -3.056 0.510 1.00 . A A . 17 VAL CG2 1 1 18 6956 1 1 17 VAL H H 1.013 -2.385 -1.766 1.00 . A A . 17 VAL H 1 1 18 6957 1 1 17 VAL HA H 1.382 -0.900 0.493 1.00 . A A . 17 VAL HA 1 1 18 6958 1 1 17 VAL HB H 1.710 -3.858 -0.019 1.00 . A A . 17 VAL HB 1 1 18 6959 1 1 17 VAL HG11 H 2.741 -3.820 2.013 1.00 . A A . 17 VAL HG11 1 1 18 6960 1 1 17 VAL HG12 H 1.992 -2.277 2.492 1.00 . A A . 17 VAL HG12 1 1 18 6961 1 1 17 VAL HG13 H 1.054 -3.788 2.584 1.00 . A A . 17 VAL HG13 1 1 18 6962 1 1 17 VAL HG21 H -0.541 -4.088 0.443 1.00 . A A . 17 VAL HG21 1 1 18 6963 1 1 17 VAL HG22 H -0.610 -2.592 1.405 1.00 . A A . 17 VAL HG22 1 1 18 6964 1 1 17 VAL HG23 H -0.524 -2.504 -0.371 1.00 . A A . 17 VAL HG23 1 1 18 6965 1 1 17 VAL N N 1.597 -1.654 -1.416 1.00 . A A . 17 VAL N 1 1 18 6966 1 1 17 VAL O O 3.834 -0.778 1.045 1.00 . A A . 17 VAL O 1 1 18 6967 1 1 18 LYS C C 6.106 -0.962 -0.922 1.00 . A A . 18 LYS C 1 1 18 6968 1 1 18 LYS CA C 5.602 -2.325 -0.442 1.00 . A A . 18 LYS CA 1 1 18 6969 1 1 18 LYS CB C 6.219 -3.508 -1.191 1.00 . A A . 18 LYS CB 1 1 18 6970 1 1 18 LYS CD C 6.741 -2.609 -3.488 1.00 . A A . 18 LYS CD 1 1 18 6971 1 1 18 LYS CE C 8.126 -3.244 -3.623 1.00 . A A . 18 LYS CE 1 1 18 6972 1 1 18 LYS CG C 5.808 -3.499 -2.664 1.00 . A A . 18 LYS CG 1 1 18 6973 1 1 18 LYS H H 3.790 -3.012 -1.206 1.00 . A A . 18 LYS H 1 1 18 6974 1 1 18 LYS HA H 5.862 -2.440 0.611 1.00 . A A . 18 LYS HA 1 1 18 6975 1 1 18 LYS HB3 H 5.902 -4.443 -0.727 1.00 . A A . 18 LYS HB3 1 1 18 6976 1 1 18 LYS HD3 H 6.830 -1.631 -3.014 1.00 . A A . 18 LYS HD3 1 1 18 6977 1 1 18 LYS HE3 H 8.033 -4.251 -4.028 1.00 . A A . 18 LYS HE3 1 1 18 6978 1 1 18 LYS HG3 H 4.782 -3.141 -2.757 1.00 . A A . 18 LYS HG3 1 1 18 6979 1 1 18 LYS HZ1 H 9.663 -1.938 -3.956 1.00 . A A . 18 LYS HZ1 1 1 18 6980 1 1 18 LYS HZ2 H 9.457 -3.023 -5.159 1.00 . A A . 18 LYS HZ2 1 1 18 6981 1 1 18 LYS HZ3 H 8.423 -1.768 -5.006 1.00 . A A . 18 LYS HZ3 1 1 18 6982 1 1 18 LYS N N 4.153 -2.363 -0.537 1.00 . A A . 18 LYS N 1 1 18 6983 1 1 18 LYS NZ N 8.987 -2.426 -4.508 1.00 . A A . 18 LYS NZ 1 1 18 6984 1 1 18 LYS O O 7.140 -0.482 -0.461 1.00 . A A . 18 LYS O 1 1 18 6985 1 1 19 LYS C C 5.653 1.969 -1.276 1.00 . A A . 19 LYS C 1 1 18 6986 1 1 19 LYS CA C 5.708 0.919 -2.388 1.00 . A A . 19 LYS CA 1 1 18 6987 1 1 19 LYS CB C 4.828 1.253 -3.593 1.00 . A A . 19 LYS CB 1 1 18 6988 1 1 19 LYS CD C 3.413 3.119 -2.656 1.00 . A A . 19 LYS CD 1 1 18 6989 1 1 19 LYS CE C 2.071 3.296 -3.370 1.00 . A A . 19 LYS CE 1 1 18 6990 1 1 19 LYS CG C 4.518 2.751 -3.648 1.00 . A A . 19 LYS CG 1 1 18 6991 1 1 19 LYS H H 4.511 -0.776 -2.209 1.00 . A A . 19 LYS H 1 1 18 6992 1 1 19 LYS HA H 6.734 0.851 -2.748 1.00 . A A . 19 LYS HA 1 1 18 6993 1 1 19 LYS HB3 H 3.897 0.688 -3.536 1.00 . A A . 19 LYS HB3 1 1 18 6994 1 1 19 LYS HD3 H 3.678 4.041 -2.137 1.00 . A A . 19 LYS HD3 1 1 18 6995 1 1 19 LYS HE3 H 1.917 2.478 -4.073 1.00 . A A . 19 LYS HE3 1 1 18 6996 1 1 19 LYS HG3 H 4.211 3.025 -4.658 1.00 . A A . 19 LYS HG3 1 1 18 6997 1 1 19 LYS HZ1 H 1.057 2.564 -1.754 1.00 . A A . 19 LYS HZ1 1 1 18 6998 1 1 19 LYS HZ2 H 0.996 4.191 -1.880 1.00 . A A . 19 LYS HZ2 1 1 18 6999 1 1 19 LYS HZ3 H 0.090 3.261 -2.871 1.00 . A A . 19 LYS HZ3 1 1 18 7000 1 1 19 LYS N N 5.350 -0.379 -1.840 1.00 . A A . 19 LYS N 1 1 18 7001 1 1 19 LYS NZ N 0.963 3.331 -2.389 1.00 . A A . 19 LYS NZ 1 1 18 7002 1 1 19 LYS O O 6.294 3.015 -1.373 1.00 . A A . 19 LYS O 1 1 18 7003 1 1 20 LEU C C 5.792 2.227 1.936 1.00 . A A . 20 LEU C 1 1 18 7004 1 1 20 LEU CA C 4.734 2.558 0.882 1.00 . A A . 20 LEU CA 1 1 18 7005 1 1 20 LEU CB C 3.301 2.519 1.416 1.00 . A A . 20 LEU CB 1 1 18 7006 1 1 20 LEU CD1 C 3.691 2.423 3.906 1.00 . A A . 20 LEU CD1 1 1 18 7007 1 1 20 LEU CD2 C 1.600 1.396 2.902 1.00 . A A . 20 LEU CD2 1 1 18 7008 1 1 20 LEU CG C 3.083 1.709 2.696 1.00 . A A . 20 LEU CG 1 1 18 7009 1 1 20 LEU H H 4.363 0.802 -0.175 1.00 . A A . 20 LEU H 1 1 18 7010 1 1 20 LEU HA H 4.915 3.569 0.517 1.00 . A A . 20 LEU HA 1 1 18 7011 1 1 20 LEU HB3 H 2.656 2.111 0.638 1.00 . A A . 20 LEU HB3 1 1 18 7012 1 1 20 LEU HD11 H 4.526 1.838 4.291 1.00 . A A . 20 LEU HD11 1 1 18 7013 1 1 20 LEU HD12 H 4.046 3.409 3.606 1.00 . A A . 20 LEU HD12 1 1 18 7014 1 1 20 LEU HD13 H 2.934 2.530 4.682 1.00 . A A . 20 LEU HD13 1 1 18 7015 1 1 20 LEU HD21 H 1.312 1.651 3.921 1.00 . A A . 20 LEU HD21 1 1 18 7016 1 1 20 LEU HD22 H 1.005 1.979 2.199 1.00 . A A . 20 LEU HD22 1 1 18 7017 1 1 20 LEU HD23 H 1.426 0.333 2.730 1.00 . A A . 20 LEU HD23 1 1 18 7018 1 1 20 LEU HG H 3.603 0.757 2.590 1.00 . A A . 20 LEU HG 1 1 18 7019 1 1 20 LEU N N 4.881 1.655 -0.247 1.00 . A A . 20 LEU N 1 1 18 7020 1 1 20 LEU O O 6.066 3.036 2.822 1.00 . A A . 20 LEU O 1 1 18 7021 1 1 21 PHE C C 8.745 1.176 2.378 1.00 . A A . 21 PHE C 1 1 18 7022 1 1 21 PHE CA C 7.380 0.587 2.738 1.00 . A A . 21 PHE CA 1 1 18 7023 1 1 21 PHE CB C 7.449 -0.937 2.625 1.00 . A A . 21 PHE CB 1 1 18 7024 1 1 21 PHE CD1 C 7.412 -1.958 4.912 1.00 . A A . 21 PHE CD1 1 1 18 7025 1 1 21 PHE CD2 C 5.443 -2.055 3.623 1.00 . A A . 21 PHE CD2 1 1 18 7026 1 1 21 PHE CE1 C 6.755 -2.645 5.967 1.00 . A A . 21 PHE CE1 1 1 18 7027 1 1 21 PHE CE2 C 4.787 -2.743 4.679 1.00 . A A . 21 PHE CE2 1 1 18 7028 1 1 21 PHE CG C 6.742 -1.677 3.763 1.00 . A A . 21 PHE CG 1 1 18 7029 1 1 21 PHE CZ C 5.456 -3.023 5.828 1.00 . A A . 21 PHE CZ 1 1 18 7030 1 1 21 PHE H H 6.128 0.383 1.084 1.00 . A A . 21 PHE H 1 1 18 7031 1 1 21 PHE HA H 7.087 0.931 3.730 1.00 . A A . 21 PHE HA 1 1 18 7032 1 1 21 PHE HB3 H 8.496 -1.242 2.603 1.00 . A A . 21 PHE HB3 1 1 18 7033 1 1 21 PHE HD1 H 8.453 -1.655 5.024 1.00 . A A . 21 PHE HD1 1 1 18 7034 1 1 21 PHE HD2 H 4.905 -1.831 2.702 1.00 . A A . 21 PHE HD2 1 1 18 7035 1 1 21 PHE HE1 H 7.293 -2.869 6.889 1.00 . A A . 21 PHE HE1 1 1 18 7036 1 1 21 PHE HE2 H 3.745 -3.046 4.567 1.00 . A A . 21 PHE HE2 1 1 18 7037 1 1 21 PHE HZ H 4.953 -3.551 6.638 1.00 . A A . 21 PHE HZ 1 1 18 7038 1 1 21 PHE N N 6.358 1.036 1.807 1.00 . A A . 21 PHE N 1 1 18 7039 1 1 21 PHE O O 9.651 1.207 3.210 1.00 . A A . 21 PHE O 1 1 18 7040 1 1 22 LYS C C 10.607 3.220 1.688 1.00 . A A . 22 LYS C 1 1 18 7041 1 1 22 LYS CA C 10.090 2.215 0.657 1.00 . A A . 22 LYS CA 1 1 18 7042 1 1 22 LYS CB C 9.896 2.811 -0.739 1.00 . A A . 22 LYS CB 1 1 18 7043 1 1 22 LYS CD C 8.193 4.492 0.058 1.00 . A A . 22 LYS CD 1 1 18 7044 1 1 22 LYS CE C 7.249 5.358 -0.778 1.00 . A A . 22 LYS CE 1 1 18 7045 1 1 22 LYS CG C 9.532 4.295 -0.656 1.00 . A A . 22 LYS CG 1 1 18 7046 1 1 22 LYS H H 8.109 1.600 0.466 1.00 . A A . 22 LYS H 1 1 18 7047 1 1 22 LYS HA H 10.818 1.408 0.564 1.00 . A A . 22 LYS HA 1 1 18 7048 1 1 22 LYS HB3 H 9.109 2.268 -1.264 1.00 . A A . 22 LYS HB3 1 1 18 7049 1 1 22 LYS HD3 H 8.360 4.960 1.028 1.00 . A A . 22 LYS HD3 1 1 18 7050 1 1 22 LYS HE3 H 6.237 5.294 -0.376 1.00 . A A . 22 LYS HE3 1 1 18 7051 1 1 22 LYS HG3 H 9.479 4.717 -1.659 1.00 . A A . 22 LYS HG3 1 1 18 7052 1 1 22 LYS HZ1 H 8.174 6.965 0.081 1.00 . A A . 22 LYS HZ1 1 1 18 7053 1 1 22 LYS HZ2 H 8.326 6.917 -1.544 1.00 . A A . 22 LYS HZ2 1 1 18 7054 1 1 22 LYS HZ3 H 6.909 7.371 -0.869 1.00 . A A . 22 LYS HZ3 1 1 18 7055 1 1 22 LYS N N 8.850 1.629 1.137 1.00 . A A . 22 LYS N 1 1 18 7056 1 1 22 LYS NZ N 7.701 6.767 -0.777 1.00 . A A . 22 LYS NZ 1 1 18 7057 1 1 22 LYS O O 11.806 3.487 1.752 1.00 . A A . 22 LYS O 1 1 18 7058 1 1 23 LYS C C 10.143 4.006 4.844 1.00 . A A . 23 LYS C 1 1 18 7059 1 1 23 LYS CA C 10.024 4.718 3.495 1.00 . A A . 23 LYS CA 1 1 18 7060 1 1 23 LYS CB C 9.025 5.876 3.497 1.00 . A A . 23 LYS CB 1 1 18 7061 1 1 23 LYS CD C 6.852 6.085 4.757 1.00 . A A . 23 LYS CD 1 1 18 7062 1 1 23 LYS CE C 6.338 7.449 4.292 1.00 . A A . 23 LYS CE 1 1 18 7063 1 1 23 LYS CG C 7.590 5.363 3.629 1.00 . A A . 23 LYS CG 1 1 18 7064 1 1 23 LYS H H 8.704 3.525 2.411 1.00 . A A . 23 LYS H 1 1 18 7065 1 1 23 LYS HA H 10.999 5.133 3.236 1.00 . A A . 23 LYS HA 1 1 18 7066 1 1 23 LYS HB3 H 9.127 6.450 2.575 1.00 . A A . 23 LYS HB3 1 1 18 7067 1 1 23 LYS HD3 H 7.519 6.215 5.609 1.00 . A A . 23 LYS HD3 1 1 18 7068 1 1 23 LYS HE3 H 5.288 7.562 4.566 1.00 . A A . 23 LYS HE3 1 1 18 7069 1 1 23 LYS HG3 H 7.600 4.290 3.823 1.00 . A A . 23 LYS HG3 1 1 18 7070 1 1 23 LYS HZ1 H 7.709 8.962 4.198 1.00 . A A . 23 LYS HZ1 1 1 18 7071 1 1 23 LYS HZ2 H 6.521 9.223 5.288 1.00 . A A . 23 LYS HZ2 1 1 18 7072 1 1 23 LYS HZ3 H 7.716 8.162 5.621 1.00 . A A . 23 LYS HZ3 1 1 18 7073 1 1 23 LYS N N 9.678 3.748 2.470 1.00 . A A . 23 LYS N 1 1 18 7074 1 1 23 LYS NZ N 7.135 8.538 4.899 1.00 . A A . 23 LYS NZ 1 1 18 7075 1 1 23 LYS O O 10.965 4.382 5.678 1.00 . A A . 23 LYS O 1 1 18 7076 1 1 24 TRP C C 10.653 1.495 6.354 1.00 . A A . 24 TRP C 1 1 18 7077 1 1 24 TRP CA C 9.311 2.223 6.250 1.00 . A A . 24 TRP CA 1 1 18 7078 1 1 24 TRP CB C 8.111 1.277 6.308 1.00 . A A . 24 TRP CB 1 1 18 7079 1 1 24 TRP CD1 C 6.496 3.287 6.201 1.00 . A A . 24 TRP CD1 1 1 18 7080 1 1 24 TRP CD2 C 5.490 1.386 6.732 1.00 . A A . 24 TRP CD2 1 1 18 7081 1 1 24 TRP CE2 C 4.525 2.370 6.709 1.00 . A A . 24 TRP CE2 1 1 18 7082 1 1 24 TRP CE3 C 5.170 0.052 7.039 1.00 . A A . 24 TRP CE3 1 1 18 7083 1 1 24 TRP CG C 6.760 1.989 6.403 1.00 . A A . 24 TRP CG 1 1 18 7084 1 1 24 TRP CH2 C 2.831 0.804 7.293 1.00 . A A . 24 TRP CH2 1 1 18 7085 1 1 24 TRP CZ2 C 3.174 2.126 6.984 1.00 . A A . 24 TRP CZ2 1 1 18 7086 1 1 24 TRP CZ3 C 3.816 -0.177 7.311 1.00 . A A . 24 TRP CZ3 1 1 18 7087 1 1 24 TRP H H 8.644 2.691 4.334 1.00 . A A . 24 TRP H 1 1 18 7088 1 1 24 TRP HA H 9.203 2.923 7.079 1.00 . A A . 24 TRP HA 1 1 18 7089 1 1 24 TRP HB3 H 8.223 0.616 7.168 1.00 . A A . 24 TRP HB3 1 1 18 7090 1 1 24 TRP HD1 H 7.246 4.031 5.934 1.00 . A A . 24 TRP HD1 1 1 18 7091 1 1 24 TRP HE1 H 4.679 4.538 6.273 1.00 . A A . 24 TRP HE1 1 1 18 7092 1 1 24 TRP HE3 H 5.914 -0.745 7.063 1.00 . A A . 24 TRP HE3 1 1 18 7093 1 1 24 TRP HH2 H 1.796 0.545 7.517 1.00 . A A . 24 TRP HH2 1 1 18 7094 1 1 24 TRP HZ2 H 2.429 2.922 6.960 1.00 . A A . 24 TRP HZ2 1 1 18 7095 1 1 24 TRP HZ3 H 3.512 -1.195 7.555 1.00 . A A . 24 TRP HZ3 1 1 18 7096 1 1 24 TRP N N 9.310 2.991 5.017 1.00 . A A . 24 TRP N 1 1 18 7097 1 1 24 TRP NE1 N 5.156 3.563 6.376 1.00 . A A . 24 TRP NE1 1 1 18 7098 1 1 24 TRP O O 10.861 0.476 5.697 1.00 . A A . 24 TRP O 1 1 18 7099 1 1 25 GLY C C 12.737 0.080 8.026 1.00 . A A . 25 GLY C 1 1 18 7100 1 1 25 GLY CA C 12.843 1.462 7.378 1.00 . A A . 25 GLY CA 1 1 18 7101 1 1 25 GLY H H 11.350 2.876 7.711 1.00 . A A . 25 GLY H 1 1 18 7102 1 1 25 GLY HA2 H 13.355 1.381 6.420 1.00 . A A . 25 GLY HA2 1 1 18 7103 1 1 25 GLY HA3 H 13.446 2.117 8.007 1.00 . A A . 25 GLY HA3 1 1 18 7104 1 1 25 GLY N N 11.527 2.047 7.181 1.00 . A A . 25 GLY N 1 1 18 7105 1 1 25 GLY O O 11.652 -0.344 8.419 1.00 . A A . 25 GLY O 1 1 18 7106 1 1 26 TRP C C 15.391 -2.229 9.032 1.00 . A A . 26 TRP C 1 1 18 7107 1 1 26 TRP CA C 13.930 -1.910 8.710 1.00 . A A . 26 TRP CA 1 1 18 7108 1 1 26 TRP CB C 13.280 -2.946 7.792 1.00 . A A . 26 TRP CB 1 1 18 7109 1 1 26 TRP CD1 C 13.894 -4.816 9.460 1.00 . A A . 26 TRP CD1 1 1 18 7110 1 1 26 TRP CD2 C 12.591 -5.511 7.811 1.00 . A A . 26 TRP CD2 1 1 18 7111 1 1 26 TRP CE2 C 12.842 -6.598 8.623 1.00 . A A . 26 TRP CE2 1 1 18 7112 1 1 26 TRP CE3 C 11.786 -5.625 6.664 1.00 . A A . 26 TRP CE3 1 1 18 7113 1 1 26 TRP CG C 13.276 -4.367 8.361 1.00 . A A . 26 TRP CG 1 1 18 7114 1 1 26 TRP CH2 C 11.521 -8.013 7.239 1.00 . A A . 26 TRP CH2 1 1 18 7115 1 1 26 TRP CZ2 C 12.326 -7.876 8.376 1.00 . A A . 26 TRP CZ2 1 1 18 7116 1 1 26 TRP CZ3 C 11.277 -6.909 6.431 1.00 . A A . 26 TRP CZ3 1 1 18 7117 1 1 26 TRP H H 14.759 -0.233 7.794 1.00 . A A . 26 TRP H 1 1 18 7118 1 1 26 TRP HA H 13.344 -1.886 9.628 1.00 . A A . 26 TRP HA 1 1 18 7119 1 1 26 TRP HB3 H 13.805 -2.950 6.836 1.00 . A A . 26 TRP HB3 1 1 18 7120 1 1 26 TRP HD1 H 14.507 -4.197 10.117 1.00 . A A . 26 TRP HD1 1 1 18 7121 1 1 26 TRP HE1 H 14.045 -6.770 10.477 1.00 . A A . 26 TRP HE1 1 1 18 7122 1 1 26 TRP HE3 H 11.573 -4.783 6.006 1.00 . A A . 26 TRP HE3 1 1 18 7123 1 1 26 TRP HH2 H 11.087 -8.981 6.989 1.00 . A A . 26 TRP HH2 1 1 18 7124 1 1 26 TRP HZ2 H 12.539 -8.718 9.034 1.00 . A A . 26 TRP HZ2 1 1 18 7125 1 1 26 TRP HZ3 H 10.646 -7.052 5.554 1.00 . A A . 26 TRP HZ3 1 1 18 7126 1 1 26 TRP N N 13.880 -0.585 8.116 1.00 . A A . 26 TRP N 1 1 18 7127 1 1 26 TRP NE1 N 13.660 -6.162 9.659 1.00 . A A . 26 TRP NE1 1 1 18 7128 1 1 26 TRP O O 16.008 -1.564 9.863 1.00 . A A . 26 TRP O 1 1 19 7129 1 1 1 LYS C C -5.420 1.204 10.503 1.00 . A A . 1 LYS C 1 1 19 7130 1 1 1 LYS CA C -4.720 1.683 11.776 1.00 . A A . 1 LYS CA 1 1 19 7131 1 1 1 LYS CB C -4.989 0.798 12.996 1.00 . A A . 1 LYS CB 1 1 19 7132 1 1 1 LYS CD C -3.410 -0.687 14.283 1.00 . A A . 1 LYS CD 1 1 19 7133 1 1 1 LYS CE C -2.251 -0.727 15.283 1.00 . A A . 1 LYS CE 1 1 19 7134 1 1 1 LYS CG C -3.773 0.755 13.922 1.00 . A A . 1 LYS CG 1 1 19 7135 1 1 1 LYS H1 H -5.822 3.421 11.453 1.00 . A A . 1 LYS H1 1 1 19 7136 1 1 1 LYS HA H -3.644 1.674 11.604 1.00 . A A . 1 LYS HA 1 1 19 7137 1 1 1 LYS HB3 H -5.239 -0.212 12.670 1.00 . A A . 1 LYS HB3 1 1 19 7138 1 1 1 LYS HD3 H -3.135 -1.234 13.382 1.00 . A A . 1 LYS HD3 1 1 19 7139 1 1 1 LYS HE3 H -2.620 -0.499 16.283 1.00 . A A . 1 LYS HE3 1 1 19 7140 1 1 1 LYS HG3 H -3.981 1.320 14.830 1.00 . A A . 1 LYS HG3 1 1 19 7141 1 1 1 LYS HZ1 H -2.271 -2.752 15.556 1.00 . A A . 1 LYS HZ1 1 1 19 7142 1 1 1 LYS HZ2 H -1.279 -2.265 14.354 1.00 . A A . 1 LYS HZ2 1 1 19 7143 1 1 1 LYS HZ3 H -0.835 -2.059 15.912 1.00 . A A . 1 LYS HZ3 1 1 19 7144 1 1 1 LYS N N -5.106 3.056 12.049 1.00 . A A . 1 LYS N 1 1 19 7145 1 1 1 LYS NZ N -1.607 -2.059 15.276 1.00 . A A . 1 LYS NZ 1 1 19 7146 1 1 1 LYS O O -6.637 1.032 10.486 1.00 . A A . 1 LYS O 1 1 19 7147 1 1 2 SER C C -6.346 1.403 7.785 1.00 . A A . 2 SER C 1 1 19 7148 1 1 2 SER CA C -5.146 0.546 8.192 1.00 . A A . 2 SER CA 1 1 19 7149 1 1 2 SER CB C -5.545 -0.930 8.256 1.00 . A A . 2 SER CB 1 1 19 7150 1 1 2 SER H H -3.630 1.143 9.489 1.00 . A A . 2 SER H 1 1 19 7151 1 1 2 SER HA H -4.329 0.669 7.481 1.00 . A A . 2 SER HA 1 1 19 7152 1 1 2 SER HB3 H -5.747 -1.295 7.249 1.00 . A A . 2 SER HB3 1 1 19 7153 1 1 2 SER HG H -3.786 -1.882 8.210 1.00 . A A . 2 SER HG 1 1 19 7154 1 1 2 SER N N -4.619 1.001 9.467 1.00 . A A . 2 SER N 1 1 19 7155 1 1 2 SER O O -7.482 1.098 8.144 1.00 . A A . 2 SER O 1 1 19 7156 1 1 2 SER OG O -4.532 -1.731 8.858 1.00 . A A . 2 SER OG 1 1 19 7157 1 1 3 SER C C -6.811 3.798 5.142 1.00 . A A . 3 SER C 1 1 19 7158 1 1 3 SER CA C -7.094 3.363 6.582 1.00 . A A . 3 SER CA 1 1 19 7159 1 1 3 SER CB C -7.203 4.587 7.494 1.00 . A A . 3 SER CB 1 1 19 7160 1 1 3 SER H H -5.126 2.702 6.753 1.00 . A A . 3 SER H 1 1 19 7161 1 1 3 SER HA H -8.018 2.789 6.634 1.00 . A A . 3 SER HA 1 1 19 7162 1 1 3 SER HB3 H -6.601 5.399 7.085 1.00 . A A . 3 SER HB3 1 1 19 7163 1 1 3 SER HG H -8.570 5.969 7.970 1.00 . A A . 3 SER HG 1 1 19 7164 1 1 3 SER N N -6.053 2.460 7.041 1.00 . A A . 3 SER N 1 1 19 7165 1 1 3 SER O O -6.117 4.788 4.914 1.00 . A A . 3 SER O 1 1 19 7166 1 1 3 SER OG O -8.552 5.025 7.642 1.00 . A A . 3 SER OG 1 1 19 7167 1 1 4 ALA C C -8.019 4.556 2.424 1.00 . A A . 4 ALA C 1 1 19 7168 1 1 4 ALA CA C -7.182 3.332 2.798 1.00 . A A . 4 ALA CA 1 1 19 7169 1 1 4 ALA CB C -7.547 2.100 1.968 1.00 . A A . 4 ALA CB 1 1 19 7170 1 1 4 ALA H H -7.929 2.235 4.404 1.00 . A A . 4 ALA H 1 1 19 7171 1 1 4 ALA HA H -6.127 3.562 2.641 1.00 . A A . 4 ALA HA 1 1 19 7172 1 1 4 ALA HB1 H -6.756 1.902 1.245 1.00 . A A . 4 ALA HB1 1 1 19 7173 1 1 4 ALA HB2 H -7.662 1.239 2.626 1.00 . A A . 4 ALA HB2 1 1 19 7174 1 1 4 ALA HB3 H -8.483 2.282 1.440 1.00 . A A . 4 ALA HB3 1 1 19 7175 1 1 4 ALA N N -7.365 3.037 4.209 1.00 . A A . 4 ALA N 1 1 19 7176 1 1 4 ALA O O -8.960 4.911 3.134 1.00 . A A . 4 ALA O 1 1 19 7177 1 1 5 TYR C C -9.039 6.070 -0.506 1.00 . A A . 5 TYR C 1 1 19 7178 1 1 5 TYR CA C -8.353 6.347 0.833 1.00 . A A . 5 TYR CA 1 1 19 7179 1 1 5 TYR CB C -7.286 7.425 0.632 1.00 . A A . 5 TYR CB 1 1 19 7180 1 1 5 TYR CD1 C -5.636 7.046 2.500 1.00 . A A . 5 TYR CD1 1 1 19 7181 1 1 5 TYR CD2 C -6.916 9.065 2.512 1.00 . A A . 5 TYR CD2 1 1 19 7182 1 1 5 TYR CE1 C -4.981 7.454 3.715 1.00 . A A . 5 TYR CE1 1 1 19 7183 1 1 5 TYR CE2 C -6.261 9.473 3.727 1.00 . A A . 5 TYR CE2 1 1 19 7184 1 1 5 TYR CG C -6.590 7.859 1.923 1.00 . A A . 5 TYR CG 1 1 19 7185 1 1 5 TYR CZ C -5.326 8.648 4.269 1.00 . A A . 5 TYR CZ 1 1 19 7186 1 1 5 TYR H H -6.882 4.875 0.739 1.00 . A A . 5 TYR H 1 1 19 7187 1 1 5 TYR HA H -9.109 6.609 1.572 1.00 . A A . 5 TYR HA 1 1 19 7188 1 1 5 TYR HB3 H -7.748 8.297 0.170 1.00 . A A . 5 TYR HB3 1 1 19 7189 1 1 5 TYR HD1 H -5.379 6.094 2.036 1.00 . A A . 5 TYR HD1 1 1 19 7190 1 1 5 TYR HD2 H -7.670 9.707 2.056 1.00 . A A . 5 TYR HD2 1 1 19 7191 1 1 5 TYR HE1 H -4.225 6.822 4.182 1.00 . A A . 5 TYR HE1 1 1 19 7192 1 1 5 TYR HE2 H -6.509 10.422 4.202 1.00 . A A . 5 TYR HE2 1 1 19 7193 1 1 5 TYR HH H -4.335 8.236 5.890 1.00 . A A . 5 TYR HH 1 1 19 7194 1 1 5 TYR N N -7.647 5.170 1.309 1.00 . A A . 5 TYR N 1 1 19 7195 1 1 5 TYR O O -9.955 6.791 -0.900 1.00 . A A . 5 TYR O 1 1 19 7196 1 1 5 TYR OH O -4.706 9.034 5.417 1.00 . A A . 5 TYR OH 1 1 19 7197 1 1 6 SER C C -8.127 3.772 -3.223 1.00 . A A . 6 SER C 1 1 19 7198 1 1 6 SER CA C -9.126 4.644 -2.457 1.00 . A A . 6 SER CA 1 1 19 7199 1 1 6 SER CB C -9.498 5.876 -3.284 1.00 . A A . 6 SER CB 1 1 19 7200 1 1 6 SER H H -7.824 4.443 -0.844 1.00 . A A . 6 SER H 1 1 19 7201 1 1 6 SER HA H -10.028 4.077 -2.225 1.00 . A A . 6 SER HA 1 1 19 7202 1 1 6 SER HB3 H -9.283 5.686 -4.335 1.00 . A A . 6 SER HB3 1 1 19 7203 1 1 6 SER HG H -11.407 5.412 -2.905 1.00 . A A . 6 SER HG 1 1 19 7204 1 1 6 SER N N -8.569 5.024 -1.171 1.00 . A A . 6 SER N 1 1 19 7205 1 1 6 SER O O -8.521 2.953 -4.052 1.00 . A A . 6 SER O 1 1 19 7206 1 1 6 SER OG O -10.871 6.225 -3.136 1.00 . A A . 6 SER OG 1 1 19 7207 1 1 7 LEU C C -5.818 1.782 -3.053 1.00 . A A . 7 LEU C 1 1 19 7208 1 1 7 LEU CA C -5.797 3.223 -3.565 1.00 . A A . 7 LEU CA 1 1 19 7209 1 1 7 LEU CB C -4.448 3.923 -3.381 1.00 . A A . 7 LEU CB 1 1 19 7210 1 1 7 LEU CD1 C -2.864 2.322 -4.515 1.00 . A A . 7 LEU CD1 1 1 19 7211 1 1 7 LEU CD2 C -2.057 3.770 -2.596 1.00 . A A . 7 LEU CD2 1 1 19 7212 1 1 7 LEU CG C -3.237 3.006 -3.199 1.00 . A A . 7 LEU CG 1 1 19 7213 1 1 7 LEU H H -6.543 4.647 -2.241 1.00 . A A . 7 LEU H 1 1 19 7214 1 1 7 LEU HA H -6.011 3.212 -4.634 1.00 . A A . 7 LEU HA 1 1 19 7215 1 1 7 LEU HB3 H -4.517 4.578 -2.513 1.00 . A A . 7 LEU HB3 1 1 19 7216 1 1 7 LEU HD11 H -3.629 1.589 -4.774 1.00 . A A . 7 LEU HD11 1 1 19 7217 1 1 7 LEU HD12 H -2.795 3.069 -5.306 1.00 . A A . 7 LEU HD12 1 1 19 7218 1 1 7 LEU HD13 H -1.903 1.820 -4.405 1.00 . A A . 7 LEU HD13 1 1 19 7219 1 1 7 LEU HD21 H -1.948 3.500 -1.545 1.00 . A A . 7 LEU HD21 1 1 19 7220 1 1 7 LEU HD22 H -1.144 3.513 -3.133 1.00 . A A . 7 LEU HD22 1 1 19 7221 1 1 7 LEU HD23 H -2.238 4.842 -2.679 1.00 . A A . 7 LEU HD23 1 1 19 7222 1 1 7 LEU HG H -3.506 2.220 -2.494 1.00 . A A . 7 LEU HG 1 1 19 7223 1 1 7 LEU N N -6.854 3.979 -2.917 1.00 . A A . 7 LEU N 1 1 19 7224 1 1 7 LEU O O -5.607 0.843 -3.819 1.00 . A A . 7 LEU O 1 1 19 7225 1 1 8 GLN C C -7.572 -0.046 -0.829 1.00 . A A . 8 GLN C 1 1 19 7226 1 1 8 GLN CA C -6.124 0.341 -1.134 1.00 . A A . 8 GLN CA 1 1 19 7227 1 1 8 GLN CB C -5.268 0.304 0.134 1.00 . A A . 8 GLN CB 1 1 19 7228 1 1 8 GLN CD C -2.809 0.427 -0.406 1.00 . A A . 8 GLN CD 1 1 19 7229 1 1 8 GLN CG C -3.986 -0.498 -0.092 1.00 . A A . 8 GLN CG 1 1 19 7230 1 1 8 GLN H H -6.243 2.421 -1.142 1.00 . A A . 8 GLN H 1 1 19 7231 1 1 8 GLN HA H -5.703 -0.346 -1.868 1.00 . A A . 8 GLN HA 1 1 19 7232 1 1 8 GLN HB3 H -5.839 -0.139 0.950 1.00 . A A . 8 GLN HB3 1 1 19 7233 1 1 8 GLN HE21 H -2.633 -0.482 -2.206 1.00 . A A . 8 GLN HE21 1 1 19 7234 1 1 8 GLN HE22 H -1.489 0.781 -1.900 1.00 . A A . 8 GLN HE22 1 1 19 7235 1 1 8 GLN HG3 H -4.131 -1.199 -0.915 1.00 . A A . 8 GLN HG3 1 1 19 7236 1 1 8 GLN N N -6.073 1.652 -1.759 1.00 . A A . 8 GLN N 1 1 19 7237 1 1 8 GLN NE2 N -2.266 0.225 -1.603 1.00 . A A . 8 GLN NE2 1 1 19 7238 1 1 8 GLN O O -8.248 0.626 -0.051 1.00 . A A . 8 GLN O 1 1 19 7239 1 1 8 GLN OE1 O -2.419 1.269 0.386 1.00 . A A . 8 GLN OE1 1 1 19 7240 1 1 9 MET C C -9.511 -3.047 -1.777 1.00 . A A . 9 MET C 1 1 19 7241 1 1 9 MET CA C -9.363 -1.613 -1.264 1.00 . A A . 9 MET CA 1 1 19 7242 1 1 9 MET CB C -10.342 -0.702 -2.008 1.00 . A A . 9 MET CB 1 1 19 7243 1 1 9 MET CE C -12.283 1.952 -2.880 1.00 . A A . 9 MET CE 1 1 19 7244 1 1 9 MET CG C -10.656 0.551 -1.187 1.00 . A A . 9 MET CG 1 1 19 7245 1 1 9 MET H H -7.451 -1.669 -2.090 1.00 . A A . 9 MET H 1 1 19 7246 1 1 9 MET HA H -9.533 -1.584 -0.188 1.00 . A A . 9 MET HA 1 1 19 7247 1 1 9 MET HB3 H -11.263 -1.245 -2.215 1.00 . A A . 9 MET HB3 1 1 19 7248 1 1 9 MET HE1 H -11.398 1.660 -3.445 1.00 . A A . 9 MET HE1 1 1 19 7249 1 1 9 MET HE2 H -13.174 1.773 -3.481 1.00 . A A . 9 MET HE2 1 1 19 7250 1 1 9 MET HE3 H -12.220 3.012 -2.631 1.00 . A A . 9 MET HE3 1 1 19 7251 1 1 9 MET HG3 H -10.022 1.376 -1.511 1.00 . A A . 9 MET HG3 1 1 19 7252 1 1 9 MET N N -8.007 -1.128 -1.459 1.00 . A A . 9 MET N 1 1 19 7253 1 1 9 MET O O -10.018 -3.914 -1.066 1.00 . A A . 9 MET O 1 1 19 7254 1 1 9 MET SD S -12.375 0.992 -1.378 1.00 . A A . 9 MET SD 1 1 19 7255 1 1 10 GLY C C -8.766 -5.663 -2.619 1.00 . A A . 10 GLY C 1 1 19 7256 1 1 10 GLY CA C -9.136 -4.567 -3.620 1.00 . A A . 10 GLY CA 1 1 19 7257 1 1 10 GLY H H -8.649 -2.542 -3.576 1.00 . A A . 10 GLY H 1 1 19 7258 1 1 10 GLY HA2 H -10.144 -4.738 -3.997 1.00 . A A . 10 GLY HA2 1 1 19 7259 1 1 10 GLY HA3 H -8.463 -4.611 -4.477 1.00 . A A . 10 GLY HA3 1 1 19 7260 1 1 10 GLY N N -9.059 -3.252 -3.005 1.00 . A A . 10 GLY N 1 1 19 7261 1 1 10 GLY O O -9.625 -6.159 -1.891 1.00 . A A . 10 GLY O 1 1 19 7262 1 1 11 ALA C C -5.483 -7.192 -1.902 1.00 . A A . 11 ALA C 1 1 19 7263 1 1 11 ALA CA C -6.993 -7.038 -1.714 1.00 . A A . 11 ALA CA 1 1 19 7264 1 1 11 ALA CB C -7.749 -8.344 -1.969 1.00 . A A . 11 ALA CB 1 1 19 7265 1 1 11 ALA H H -6.795 -5.601 -3.209 1.00 . A A . 11 ALA H 1 1 19 7266 1 1 11 ALA HA H -7.193 -6.710 -0.694 1.00 . A A . 11 ALA HA 1 1 19 7267 1 1 11 ALA HB1 H -8.355 -8.244 -2.868 1.00 . A A . 11 ALA HB1 1 1 19 7268 1 1 11 ALA HB2 H -7.035 -9.156 -2.101 1.00 . A A . 11 ALA HB2 1 1 19 7269 1 1 11 ALA HB3 H -8.394 -8.562 -1.118 1.00 . A A . 11 ALA HB3 1 1 19 7270 1 1 11 ALA N N -7.487 -6.010 -2.615 1.00 . A A . 11 ALA N 1 1 19 7271 1 1 11 ALA O O -4.718 -7.058 -0.948 1.00 . A A . 11 ALA O 1 1 19 7272 1 1 12 THR C C -2.903 -6.381 -3.111 1.00 . A A . 12 THR C 1 1 19 7273 1 1 12 THR CA C -3.693 -7.644 -3.464 1.00 . A A . 12 THR CA 1 1 19 7274 1 1 12 THR CB C -3.593 -8.029 -4.941 1.00 . A A . 12 THR CB 1 1 19 7275 1 1 12 THR CG2 C -4.403 -9.283 -5.275 1.00 . A A . 12 THR CG2 1 1 19 7276 1 1 12 THR H H -5.726 -7.577 -3.910 1.00 . A A . 12 THR H 1 1 19 7277 1 1 12 THR HA H -3.294 -8.451 -2.849 1.00 . A A . 12 THR HA 1 1 19 7278 1 1 12 THR HB H -2.552 -8.146 -5.244 1.00 . A A . 12 THR HB 1 1 19 7279 1 1 12 THR HG1 H -3.934 -6.896 -6.555 1.00 . A A . 12 THR HG1 1 1 19 7280 1 1 12 THR HG21 H -4.939 -9.132 -6.212 1.00 . A A . 12 THR HG21 1 1 19 7281 1 1 12 THR HG22 H -3.729 -10.135 -5.376 1.00 . A A . 12 THR HG22 1 1 19 7282 1 1 12 THR HG23 H -5.118 -9.479 -4.475 1.00 . A A . 12 THR HG23 1 1 19 7283 1 1 12 THR N N -5.098 -7.471 -3.139 1.00 . A A . 12 THR N 1 1 19 7284 1 1 12 THR O O -1.865 -6.456 -2.456 1.00 . A A . 12 THR O 1 1 19 7285 1 1 12 THR OG1 O -4.279 -6.982 -5.621 1.00 . A A . 12 THR OG1 1 1 19 7286 1 1 13 ALA C C -2.260 -3.954 -1.864 1.00 . A A . 13 ALA C 1 1 19 7287 1 1 13 ALA CA C -2.785 -3.973 -3.301 1.00 . A A . 13 ALA CA 1 1 19 7288 1 1 13 ALA CB C -3.774 -2.838 -3.574 1.00 . A A . 13 ALA CB 1 1 19 7289 1 1 13 ALA H H -4.273 -5.198 -4.093 1.00 . A A . 13 ALA H 1 1 19 7290 1 1 13 ALA HA H -1.944 -3.878 -3.987 1.00 . A A . 13 ALA HA 1 1 19 7291 1 1 13 ALA HB1 H -3.680 -2.079 -2.799 1.00 . A A . 13 ALA HB1 1 1 19 7292 1 1 13 ALA HB2 H -3.559 -2.395 -4.547 1.00 . A A . 13 ALA HB2 1 1 19 7293 1 1 13 ALA HB3 H -4.790 -3.234 -3.573 1.00 . A A . 13 ALA HB3 1 1 19 7294 1 1 13 ALA N N -3.428 -5.250 -3.561 1.00 . A A . 13 ALA N 1 1 19 7295 1 1 13 ALA O O -1.111 -3.585 -1.624 1.00 . A A . 13 ALA O 1 1 19 7296 1 1 14 ILE C C -1.332 -4.911 0.602 1.00 . A A . 14 ILE C 1 1 19 7297 1 1 14 ILE CA C -2.764 -4.391 0.461 1.00 . A A . 14 ILE CA 1 1 19 7298 1 1 14 ILE CB C -3.792 -5.194 1.259 1.00 . A A . 14 ILE CB 1 1 19 7299 1 1 14 ILE CD1 C -5.214 -3.112 1.226 1.00 . A A . 14 ILE CD1 1 1 19 7300 1 1 14 ILE CG1 C -5.201 -4.633 1.061 1.00 . A A . 14 ILE CG1 1 1 19 7301 1 1 14 ILE CG2 C -3.405 -5.263 2.739 1.00 . A A . 14 ILE CG2 1 1 19 7302 1 1 14 ILE H H -4.059 -4.654 -1.150 1.00 . A A . 14 ILE H 1 1 19 7303 1 1 14 ILE HA H -2.798 -3.366 0.832 1.00 . A A . 14 ILE HA 1 1 19 7304 1 1 14 ILE HB H -3.796 -6.216 0.880 1.00 . A A . 14 ILE HB 1 1 19 7305 1 1 14 ILE HD11 H -6.168 -2.801 1.650 1.00 . A A . 14 ILE HD11 1 1 19 7306 1 1 14 ILE HD12 H -4.406 -2.812 1.892 1.00 . A A . 14 ILE HD12 1 1 19 7307 1 1 14 ILE HD13 H -5.077 -2.640 0.253 1.00 . A A . 14 ILE HD13 1 1 19 7308 1 1 14 ILE HG13 H -5.882 -5.087 1.782 1.00 . A A . 14 ILE HG13 1 1 19 7309 1 1 14 ILE HG21 H -4.170 -5.811 3.289 1.00 . A A . 14 ILE HG21 1 1 19 7310 1 1 14 ILE HG22 H -2.448 -5.775 2.840 1.00 . A A . 14 ILE HG22 1 1 19 7311 1 1 14 ILE HG23 H -3.321 -4.253 3.140 1.00 . A A . 14 ILE HG23 1 1 19 7312 1 1 14 ILE N N -3.126 -4.356 -0.946 1.00 . A A . 14 ILE N 1 1 19 7313 1 1 14 ILE O O -0.537 -4.353 1.356 1.00 . A A . 14 ILE O 1 1 19 7314 1 1 15 LYS C C 1.310 -5.548 -0.566 1.00 . A A . 15 LYS C 1 1 19 7315 1 1 15 LYS CA C 0.275 -6.575 -0.103 1.00 . A A . 15 LYS CA 1 1 19 7316 1 1 15 LYS CB C 0.293 -7.875 -0.911 1.00 . A A . 15 LYS CB 1 1 19 7317 1 1 15 LYS CD C 2.717 -7.912 -1.603 1.00 . A A . 15 LYS CD 1 1 19 7318 1 1 15 LYS CE C 3.766 -8.923 -2.072 1.00 . A A . 15 LYS CE 1 1 19 7319 1 1 15 LYS CG C 1.636 -8.594 -0.763 1.00 . A A . 15 LYS CG 1 1 19 7320 1 1 15 LYS H H -1.700 -6.422 -0.746 1.00 . A A . 15 LYS H 1 1 19 7321 1 1 15 LYS HA H 0.489 -6.837 0.934 1.00 . A A . 15 LYS HA 1 1 19 7322 1 1 15 LYS HB3 H 0.106 -7.656 -1.962 1.00 . A A . 15 LYS HB3 1 1 19 7323 1 1 15 LYS HD3 H 3.199 -7.129 -1.018 1.00 . A A . 15 LYS HD3 1 1 19 7324 1 1 15 LYS HE3 H 3.663 -9.850 -1.508 1.00 . A A . 15 LYS HE3 1 1 19 7325 1 1 15 LYS HG3 H 1.531 -9.633 -1.073 1.00 . A A . 15 LYS HG3 1 1 19 7326 1 1 15 LYS HZ1 H 3.915 -10.128 -3.716 1.00 . A A . 15 LYS HZ1 1 1 19 7327 1 1 15 LYS HZ2 H 2.649 -9.097 -3.776 1.00 . A A . 15 LYS HZ2 1 1 19 7328 1 1 15 LYS HZ3 H 4.164 -8.548 -4.041 1.00 . A A . 15 LYS HZ3 1 1 19 7329 1 1 15 LYS N N -1.047 -5.974 -0.136 1.00 . A A . 15 LYS N 1 1 19 7330 1 1 15 LYS NZ N 3.611 -9.196 -3.518 1.00 . A A . 15 LYS NZ 1 1 19 7331 1 1 15 LYS O O 2.342 -5.368 0.077 1.00 . A A . 15 LYS O 1 1 19 7332 1 1 16 GLN C C 2.272 -2.876 -1.164 1.00 . A A . 16 GLN C 1 1 19 7333 1 1 16 GLN CA C 1.886 -3.898 -2.236 1.00 . A A . 16 GLN CA 1 1 19 7334 1 1 16 GLN CB C 1.248 -3.209 -3.445 1.00 . A A . 16 GLN CB 1 1 19 7335 1 1 16 GLN CD C 0.905 -5.518 -4.401 1.00 . A A . 16 GLN CD 1 1 19 7336 1 1 16 GLN CG C 1.357 -4.085 -4.695 1.00 . A A . 16 GLN CG 1 1 19 7337 1 1 16 GLN H H 0.154 -5.053 -2.196 1.00 . A A . 16 GLN H 1 1 19 7338 1 1 16 GLN HA H 2.771 -4.443 -2.563 1.00 . A A . 16 GLN HA 1 1 19 7339 1 1 16 GLN HB3 H 1.738 -2.252 -3.623 1.00 . A A . 16 GLN HB3 1 1 19 7340 1 1 16 GLN HE21 H 2.799 -6.137 -4.762 1.00 . A A . 16 GLN HE21 1 1 19 7341 1 1 16 GLN HE22 H 1.678 -7.388 -4.337 1.00 . A A . 16 GLN HE22 1 1 19 7342 1 1 16 GLN HG3 H 2.386 -4.090 -5.052 1.00 . A A . 16 GLN HG3 1 1 19 7343 1 1 16 GLN N N 0.997 -4.901 -1.679 1.00 . A A . 16 GLN N 1 1 19 7344 1 1 16 GLN NE2 N 1.874 -6.422 -4.509 1.00 . A A . 16 GLN NE2 1 1 19 7345 1 1 16 GLN O O 3.268 -2.168 -1.306 1.00 . A A . 16 GLN O 1 1 19 7346 1 1 16 GLN OE1 O -0.246 -5.783 -4.097 1.00 . A A . 16 GLN OE1 1 1 19 7347 1 1 17 VAL C C 3.169 -2.015 1.414 1.00 . A A . 17 VAL C 1 1 19 7348 1 1 17 VAL CA C 1.706 -1.908 0.979 1.00 . A A . 17 VAL CA 1 1 19 7349 1 1 17 VAL CB C 0.722 -2.177 2.119 1.00 . A A . 17 VAL CB 1 1 19 7350 1 1 17 VAL CG1 C 1.092 -1.370 3.365 1.00 . A A . 17 VAL CG1 1 1 19 7351 1 1 17 VAL CG2 C -0.716 -1.886 1.683 1.00 . A A . 17 VAL CG2 1 1 19 7352 1 1 17 VAL H H 0.654 -3.410 -0.009 1.00 . A A . 17 VAL H 1 1 19 7353 1 1 17 VAL HA H 1.524 -0.900 0.606 1.00 . A A . 17 VAL HA 1 1 19 7354 1 1 17 VAL HB H 0.786 -3.235 2.374 1.00 . A A . 17 VAL HB 1 1 19 7355 1 1 17 VAL HG11 H 1.647 -0.480 3.069 1.00 . A A . 17 VAL HG11 1 1 19 7356 1 1 17 VAL HG12 H 0.183 -1.074 3.889 1.00 . A A . 17 VAL HG12 1 1 19 7357 1 1 17 VAL HG13 H 1.709 -1.981 4.024 1.00 . A A . 17 VAL HG13 1 1 19 7358 1 1 17 VAL HG21 H -0.836 -2.146 0.632 1.00 . A A . 17 VAL HG21 1 1 19 7359 1 1 17 VAL HG22 H -1.405 -2.477 2.285 1.00 . A A . 17 VAL HG22 1 1 19 7360 1 1 17 VAL HG23 H -0.929 -0.826 1.822 1.00 . A A . 17 VAL HG23 1 1 19 7361 1 1 17 VAL N N 1.462 -2.831 -0.116 1.00 . A A . 17 VAL N 1 1 19 7362 1 1 17 VAL O O 3.864 -1.006 1.521 1.00 . A A . 17 VAL O 1 1 19 7363 1 1 18 LYS C C 5.917 -3.119 0.944 1.00 . A A . 18 LYS C 1 1 19 7364 1 1 18 LYS CA C 4.961 -3.499 2.076 1.00 . A A . 18 LYS CA 1 1 19 7365 1 1 18 LYS CB C 5.116 -4.944 2.553 1.00 . A A . 18 LYS CB 1 1 19 7366 1 1 18 LYS CD C 5.927 -6.202 0.523 1.00 . A A . 18 LYS CD 1 1 19 7367 1 1 18 LYS CE C 7.001 -7.025 1.238 1.00 . A A . 18 LYS CE 1 1 19 7368 1 1 18 LYS CG C 4.739 -5.931 1.447 1.00 . A A . 18 LYS CG 1 1 19 7369 1 1 18 LYS H H 3.021 -4.063 1.566 1.00 . A A . 18 LYS H 1 1 19 7370 1 1 18 LYS HA H 5.163 -2.854 2.930 1.00 . A A . 18 LYS HA 1 1 19 7371 1 1 18 LYS HB3 H 4.487 -5.112 3.427 1.00 . A A . 18 LYS HB3 1 1 19 7372 1 1 18 LYS HD3 H 6.353 -5.257 0.186 1.00 . A A . 18 LYS HD3 1 1 19 7373 1 1 18 LYS HE3 H 6.533 -7.821 1.816 1.00 . A A . 18 LYS HE3 1 1 19 7374 1 1 18 LYS HG3 H 3.906 -5.531 0.868 1.00 . A A . 18 LYS HG3 1 1 19 7375 1 1 18 LYS HZ1 H 7.448 -7.879 -0.564 1.00 . A A . 18 LYS HZ1 1 1 19 7376 1 1 18 LYS HZ2 H 8.638 -6.924 0.018 1.00 . A A . 18 LYS HZ2 1 1 19 7377 1 1 18 LYS HZ3 H 8.393 -8.406 0.660 1.00 . A A . 18 LYS HZ3 1 1 19 7378 1 1 18 LYS N N 3.593 -3.247 1.654 1.00 . A A . 18 LYS N 1 1 19 7379 1 1 18 LYS NZ N 7.946 -7.605 0.259 1.00 . A A . 18 LYS NZ 1 1 19 7380 1 1 18 LYS O O 7.055 -2.728 1.193 1.00 . A A . 18 LYS O 1 1 19 7381 1 1 19 LYS C C 6.520 -1.423 -1.452 1.00 . A A . 19 LYS C 1 1 19 7382 1 1 19 LYS CA C 6.214 -2.923 -1.449 1.00 . A A . 19 LYS CA 1 1 19 7383 1 1 19 LYS CB C 5.520 -3.412 -2.721 1.00 . A A . 19 LYS CB 1 1 19 7384 1 1 19 LYS CD C 4.907 -1.233 -3.834 1.00 . A A . 19 LYS CD 1 1 19 7385 1 1 19 LYS CE C 3.748 -1.344 -4.828 1.00 . A A . 19 LYS CE 1 1 19 7386 1 1 19 LYS CG C 5.802 -2.473 -3.895 1.00 . A A . 19 LYS CG 1 1 19 7387 1 1 19 LYS H H 4.491 -3.566 -0.472 1.00 . A A . 19 LYS H 1 1 19 7388 1 1 19 LYS HA H 7.155 -3.466 -1.366 1.00 . A A . 19 LYS HA 1 1 19 7389 1 1 19 LYS HB3 H 4.445 -3.474 -2.551 1.00 . A A . 19 LYS HB3 1 1 19 7390 1 1 19 LYS HD3 H 5.495 -0.343 -4.056 1.00 . A A . 19 LYS HD3 1 1 19 7391 1 1 19 LYS HE3 H 3.332 -2.352 -4.799 1.00 . A A . 19 LYS HE3 1 1 19 7392 1 1 19 LYS HG3 H 5.636 -2.999 -4.835 1.00 . A A . 19 LYS HG3 1 1 19 7393 1 1 19 LYS HZ1 H 1.865 -0.574 -5.024 1.00 . A A . 19 LYS HZ1 1 1 19 7394 1 1 19 LYS HZ2 H 2.492 -0.392 -3.526 1.00 . A A . 19 LYS HZ2 1 1 19 7395 1 1 19 LYS HZ3 H 3.009 0.560 -4.749 1.00 . A A . 19 LYS HZ3 1 1 19 7396 1 1 19 LYS N N 5.418 -3.247 -0.277 1.00 . A A . 19 LYS N 1 1 19 7397 1 1 19 LYS NZ N 2.694 -0.358 -4.506 1.00 . A A . 19 LYS NZ 1 1 19 7398 1 1 19 LYS O O 7.492 -0.986 -2.067 1.00 . A A . 19 LYS O 1 1 19 7399 1 1 20 LEU C C 6.695 1.102 0.548 1.00 . A A . 20 LEU C 1 1 19 7400 1 1 20 LEU CA C 5.839 0.763 -0.675 1.00 . A A . 20 LEU CA 1 1 19 7401 1 1 20 LEU CB C 4.478 1.462 -0.686 1.00 . A A . 20 LEU CB 1 1 19 7402 1 1 20 LEU CD1 C 4.792 3.217 1.098 1.00 . A A . 20 LEU CD1 1 1 19 7403 1 1 20 LEU CD2 C 2.484 2.279 0.623 1.00 . A A . 20 LEU CD2 1 1 19 7404 1 1 20 LEU CG C 3.985 1.992 0.663 1.00 . A A . 20 LEU CG 1 1 19 7405 1 1 20 LEU H H 4.884 -1.041 -0.263 1.00 . A A . 20 LEU H 1 1 19 7406 1 1 20 LEU HA H 6.373 1.083 -1.569 1.00 . A A . 20 LEU HA 1 1 19 7407 1 1 20 LEU HB3 H 3.736 0.763 -1.072 1.00 . A A . 20 LEU HB3 1 1 19 7408 1 1 20 LEU HD11 H 4.111 4.023 1.368 1.00 . A A . 20 LEU HD11 1 1 19 7409 1 1 20 LEU HD12 H 5.408 2.959 1.959 1.00 . A A . 20 LEU HD12 1 1 19 7410 1 1 20 LEU HD13 H 5.432 3.541 0.278 1.00 . A A . 20 LEU HD13 1 1 19 7411 1 1 20 LEU HD21 H 2.124 2.193 -0.402 1.00 . A A . 20 LEU HD21 1 1 19 7412 1 1 20 LEU HD22 H 1.959 1.561 1.254 1.00 . A A . 20 LEU HD22 1 1 19 7413 1 1 20 LEU HD23 H 2.297 3.289 0.990 1.00 . A A . 20 LEU HD23 1 1 19 7414 1 1 20 LEU HG H 4.146 1.218 1.414 1.00 . A A . 20 LEU HG 1 1 19 7415 1 1 20 LEU N N 5.672 -0.677 -0.759 1.00 . A A . 20 LEU N 1 1 19 7416 1 1 20 LEU O O 7.191 2.222 0.672 1.00 . A A . 20 LEU O 1 1 19 7417 1 1 21 PHE C C 9.119 0.080 2.348 1.00 . A A . 21 PHE C 1 1 19 7418 1 1 21 PHE CA C 7.630 0.295 2.627 1.00 . A A . 21 PHE CA 1 1 19 7419 1 1 21 PHE CB C 7.153 -0.756 3.631 1.00 . A A . 21 PHE CB 1 1 19 7420 1 1 21 PHE CD1 C 4.897 -0.121 4.513 1.00 . A A . 21 PHE CD1 1 1 19 7421 1 1 21 PHE CD2 C 6.765 0.208 5.909 1.00 . A A . 21 PHE CD2 1 1 19 7422 1 1 21 PHE CE1 C 4.048 0.393 5.527 1.00 . A A . 21 PHE CE1 1 1 19 7423 1 1 21 PHE CE2 C 5.915 0.722 6.924 1.00 . A A . 21 PHE CE2 1 1 19 7424 1 1 21 PHE CG C 6.238 -0.203 4.725 1.00 . A A . 21 PHE CG 1 1 19 7425 1 1 21 PHE CZ C 4.575 0.804 6.712 1.00 . A A . 21 PHE CZ 1 1 19 7426 1 1 21 PHE H H 6.436 -0.792 1.311 1.00 . A A . 21 PHE H 1 1 19 7427 1 1 21 PHE HA H 7.470 1.318 2.968 1.00 . A A . 21 PHE HA 1 1 19 7428 1 1 21 PHE HB3 H 8.024 -1.217 4.099 1.00 . A A . 21 PHE HB3 1 1 19 7429 1 1 21 PHE HD1 H 4.475 -0.451 3.563 1.00 . A A . 21 PHE HD1 1 1 19 7430 1 1 21 PHE HD2 H 7.840 0.143 6.080 1.00 . A A . 21 PHE HD2 1 1 19 7431 1 1 21 PHE HE1 H 2.973 0.458 5.357 1.00 . A A . 21 PHE HE1 1 1 19 7432 1 1 21 PHE HE2 H 6.338 1.052 7.873 1.00 . A A . 21 PHE HE2 1 1 19 7433 1 1 21 PHE HZ H 3.922 1.199 7.491 1.00 . A A . 21 PHE HZ 1 1 19 7434 1 1 21 PHE N N 6.842 0.115 1.419 1.00 . A A . 21 PHE N 1 1 19 7435 1 1 21 PHE O O 9.968 0.503 3.131 1.00 . A A . 21 PHE O 1 1 19 7436 1 1 22 LYS C C 11.555 0.454 0.816 1.00 . A A . 22 LYS C 1 1 19 7437 1 1 22 LYS CA C 10.761 -0.855 0.838 1.00 . A A . 22 LYS CA 1 1 19 7438 1 1 22 LYS CB C 10.796 -1.618 -0.487 1.00 . A A . 22 LYS CB 1 1 19 7439 1 1 22 LYS CD C 9.951 0.155 -2.071 1.00 . A A . 22 LYS CD 1 1 19 7440 1 1 22 LYS CE C 10.394 1.519 -2.600 1.00 . A A . 22 LYS CE 1 1 19 7441 1 1 22 LYS CG C 11.157 -0.687 -1.646 1.00 . A A . 22 LYS CG 1 1 19 7442 1 1 22 LYS H H 8.693 -0.919 0.600 1.00 . A A . 22 LYS H 1 1 19 7443 1 1 22 LYS HA H 11.192 -1.508 1.598 1.00 . A A . 22 LYS HA 1 1 19 7444 1 1 22 LYS HB3 H 9.824 -2.076 -0.674 1.00 . A A . 22 LYS HB3 1 1 19 7445 1 1 22 LYS HD3 H 9.281 0.289 -1.222 1.00 . A A . 22 LYS HD3 1 1 19 7446 1 1 22 LYS HE3 H 11.366 1.781 -2.182 1.00 . A A . 22 LYS HE3 1 1 19 7447 1 1 22 LYS HG3 H 11.511 -1.274 -2.493 1.00 . A A . 22 LYS HG3 1 1 19 7448 1 1 22 LYS HZ1 H 9.667 1.958 -4.460 1.00 . A A . 22 LYS HZ1 1 1 19 7449 1 1 22 LYS HZ2 H 11.298 1.982 -4.374 1.00 . A A . 22 LYS HZ2 1 1 19 7450 1 1 22 LYS HZ3 H 10.503 0.556 -4.398 1.00 . A A . 22 LYS HZ3 1 1 19 7451 1 1 22 LYS N N 9.389 -0.578 1.230 1.00 . A A . 22 LYS N 1 1 19 7452 1 1 22 LYS NZ N 10.472 1.503 -4.078 1.00 . A A . 22 LYS NZ 1 1 19 7453 1 1 22 LYS O O 12.783 0.439 0.872 1.00 . A A . 22 LYS O 1 1 19 7454 1 1 23 LYS C C 11.524 3.419 2.129 1.00 . A A . 23 LYS C 1 1 19 7455 1 1 23 LYS CA C 11.439 2.867 0.704 1.00 . A A . 23 LYS CA 1 1 19 7456 1 1 23 LYS CB C 10.697 3.787 -0.268 1.00 . A A . 23 LYS CB 1 1 19 7457 1 1 23 LYS CD C 8.539 5.091 -0.299 1.00 . A A . 23 LYS CD 1 1 19 7458 1 1 23 LYS CE C 7.308 4.945 -1.196 1.00 . A A . 23 LYS CE 1 1 19 7459 1 1 23 LYS CG C 9.187 3.731 -0.031 1.00 . A A . 23 LYS CG 1 1 19 7460 1 1 23 LYS H H 9.820 1.556 0.690 1.00 . A A . 23 LYS H 1 1 19 7461 1 1 23 LYS HA H 12.451 2.742 0.322 1.00 . A A . 23 LYS HA 1 1 19 7462 1 1 23 LYS HB3 H 10.919 3.492 -1.293 1.00 . A A . 23 LYS HB3 1 1 19 7463 1 1 23 LYS HD3 H 9.262 5.755 -0.774 1.00 . A A . 23 LYS HD3 1 1 19 7464 1 1 23 LYS HE3 H 6.509 5.593 -0.835 1.00 . A A . 23 LYS HE3 1 1 19 7465 1 1 23 LYS HG3 H 8.987 3.425 0.996 1.00 . A A . 23 LYS HG3 1 1 19 7466 1 1 23 LYS HZ1 H 7.419 4.521 -3.192 1.00 . A A . 23 LYS HZ1 1 1 19 7467 1 1 23 LYS HZ2 H 7.113 6.094 -2.875 1.00 . A A . 23 LYS HZ2 1 1 19 7468 1 1 23 LYS HZ3 H 8.618 5.497 -2.664 1.00 . A A . 23 LYS HZ3 1 1 19 7469 1 1 23 LYS N N 10.819 1.553 0.734 1.00 . A A . 23 LYS N 1 1 19 7470 1 1 23 LYS NZ N 7.642 5.293 -2.595 1.00 . A A . 23 LYS NZ 1 1 19 7471 1 1 23 LYS O O 12.500 4.075 2.487 1.00 . A A . 23 LYS O 1 1 19 7472 1 1 24 TRP C C 11.530 2.866 5.065 1.00 . A A . 24 TRP C 1 1 19 7473 1 1 24 TRP CA C 10.433 3.591 4.281 1.00 . A A . 24 TRP CA 1 1 19 7474 1 1 24 TRP CB C 9.039 3.384 4.874 1.00 . A A . 24 TRP CB 1 1 19 7475 1 1 24 TRP CD1 C 8.020 4.756 2.940 1.00 . A A . 24 TRP CD1 1 1 19 7476 1 1 24 TRP CD2 C 6.516 4.081 4.420 1.00 . A A . 24 TRP CD2 1 1 19 7477 1 1 24 TRP CE2 C 5.846 4.796 3.448 1.00 . A A . 24 TRP CE2 1 1 19 7478 1 1 24 TRP CE3 C 5.836 3.512 5.511 1.00 . A A . 24 TRP CE3 1 1 19 7479 1 1 24 TRP CG C 7.919 4.061 4.081 1.00 . A A . 24 TRP CG 1 1 19 7480 1 1 24 TRP CH2 C 3.764 4.453 4.548 1.00 . A A . 24 TRP CH2 1 1 19 7481 1 1 24 TRP CZ2 C 4.463 5.010 3.470 1.00 . A A . 24 TRP CZ2 1 1 19 7482 1 1 24 TRP CZ3 C 4.453 3.735 5.518 1.00 . A A . 24 TRP CZ3 1 1 19 7483 1 1 24 TRP H H 9.697 2.597 2.604 1.00 . A A . 24 TRP H 1 1 19 7484 1 1 24 TRP HA H 10.622 4.664 4.282 1.00 . A A . 24 TRP HA 1 1 19 7485 1 1 24 TRP HB3 H 9.028 3.764 5.895 1.00 . A A . 24 TRP HB3 1 1 19 7486 1 1 24 TRP HD1 H 8.956 4.933 2.409 1.00 . A A . 24 TRP HD1 1 1 19 7487 1 1 24 TRP HE1 H 6.594 5.810 1.625 1.00 . A A . 24 TRP HE1 1 1 19 7488 1 1 24 TRP HE3 H 6.341 2.943 6.290 1.00 . A A . 24 TRP HE3 1 1 19 7489 1 1 24 TRP HH2 H 2.685 4.582 4.626 1.00 . A A . 24 TRP HH2 1 1 19 7490 1 1 24 TRP HZ2 H 3.957 5.579 2.690 1.00 . A A . 24 TRP HZ2 1 1 19 7491 1 1 24 TRP HZ3 H 3.877 3.315 6.344 1.00 . A A . 24 TRP HZ3 1 1 19 7492 1 1 24 TRP N N 10.488 3.132 2.904 1.00 . A A . 24 TRP N 1 1 19 7493 1 1 24 TRP NE1 N 6.790 5.220 2.520 1.00 . A A . 24 TRP NE1 1 1 19 7494 1 1 24 TRP O O 12.089 1.880 4.589 1.00 . A A . 24 TRP O 1 1 19 7495 1 1 25 GLY C C 13.751 3.876 7.673 1.00 . A A . 25 GLY C 1 1 19 7496 1 1 25 GLY CA C 12.823 2.797 7.107 1.00 . A A . 25 GLY CA 1 1 19 7497 1 1 25 GLY H H 11.344 4.186 6.633 1.00 . A A . 25 GLY H 1 1 19 7498 1 1 25 GLY HA2 H 12.349 2.255 7.926 1.00 . A A . 25 GLY HA2 1 1 19 7499 1 1 25 GLY HA3 H 13.406 2.073 6.540 1.00 . A A . 25 GLY HA3 1 1 19 7500 1 1 25 GLY N N 11.804 3.383 6.254 1.00 . A A . 25 GLY N 1 1 19 7501 1 1 25 GLY O O 13.434 4.506 8.680 1.00 . A A . 25 GLY O 1 1 19 7502 1 1 26 TRP C C 15.659 6.295 6.563 1.00 . A A . 26 TRP C 1 1 19 7503 1 1 26 TRP CA C 15.853 5.044 7.422 1.00 . A A . 26 TRP CA 1 1 19 7504 1 1 26 TRP CB C 17.273 4.481 7.347 1.00 . A A . 26 TRP CB 1 1 19 7505 1 1 26 TRP CD1 C 17.928 4.820 9.820 1.00 . A A . 26 TRP CD1 1 1 19 7506 1 1 26 TRP CD2 C 19.487 5.502 8.401 1.00 . A A . 26 TRP CD2 1 1 19 7507 1 1 26 TRP CE2 C 19.959 5.738 9.676 1.00 . A A . 26 TRP CE2 1 1 19 7508 1 1 26 TRP CE3 C 20.250 5.828 7.266 1.00 . A A . 26 TRP CE3 1 1 19 7509 1 1 26 TRP CG C 18.175 4.910 8.506 1.00 . A A . 26 TRP CG 1 1 19 7510 1 1 26 TRP CH2 C 21.987 6.643 8.823 1.00 . A A . 26 TRP CH2 1 1 19 7511 1 1 26 TRP CZ2 C 21.210 6.309 9.938 1.00 . A A . 26 TRP CZ2 1 1 19 7512 1 1 26 TRP CZ3 C 21.498 6.399 7.544 1.00 . A A . 26 TRP CZ3 1 1 19 7513 1 1 26 TRP H H 15.127 3.536 6.181 1.00 . A A . 26 TRP H 1 1 19 7514 1 1 26 TRP HA H 15.659 5.277 8.469 1.00 . A A . 26 TRP HA 1 1 19 7515 1 1 26 TRP HB3 H 17.730 4.798 6.409 1.00 . A A . 26 TRP HB3 1 1 19 7516 1 1 26 TRP HD1 H 17.012 4.413 10.245 1.00 . A A . 26 TRP HD1 1 1 19 7517 1 1 26 TRP HE1 H 19.035 5.353 11.654 1.00 . A A . 26 TRP HE1 1 1 19 7518 1 1 26 TRP HE3 H 19.900 5.652 6.249 1.00 . A A . 26 TRP HE3 1 1 19 7519 1 1 26 TRP HH2 H 22.972 7.091 8.955 1.00 . A A . 26 TRP HH2 1 1 19 7520 1 1 26 TRP HZ2 H 21.559 6.486 10.955 1.00 . A A . 26 TRP HZ2 1 1 19 7521 1 1 26 TRP HZ3 H 22.130 6.671 6.699 1.00 . A A . 26 TRP HZ3 1 1 19 7522 1 1 26 TRP N N 14.878 4.053 7.000 1.00 . A A . 26 TRP N 1 1 19 7523 1 1 26 TRP NE1 N 18.981 5.310 10.567 1.00 . A A . 26 TRP NE1 1 1 19 7524 1 1 26 TRP O O 15.687 6.220 5.335 1.00 . A A . 26 TRP O 1 1 20 7525 1 1 1 LYS C C -1.838 13.191 4.124 1.00 . A A . 1 LYS C 1 1 20 7526 1 1 1 LYS CA C -2.351 13.357 2.692 1.00 . A A . 1 LYS CA 1 1 20 7527 1 1 1 LYS CB C -3.798 13.846 2.609 1.00 . A A . 1 LYS CB 1 1 20 7528 1 1 1 LYS CD C -3.442 16.319 2.942 1.00 . A A . 1 LYS CD 1 1 20 7529 1 1 1 LYS CE C -3.066 17.605 2.203 1.00 . A A . 1 LYS CE 1 1 20 7530 1 1 1 LYS CG C -3.874 15.229 1.961 1.00 . A A . 1 LYS CG 1 1 20 7531 1 1 1 LYS H1 H -2.628 12.070 1.078 1.00 . A A . 1 LYS H1 1 1 20 7532 1 1 1 LYS HA H -1.731 14.098 2.188 1.00 . A A . 1 LYS HA 1 1 20 7533 1 1 1 LYS HB3 H -4.230 13.884 3.609 1.00 . A A . 1 LYS HB3 1 1 20 7534 1 1 1 LYS HD3 H -2.590 15.969 3.527 1.00 . A A . 1 LYS HD3 1 1 20 7535 1 1 1 LYS HE3 H -2.320 17.387 1.438 1.00 . A A . 1 LYS HE3 1 1 20 7536 1 1 1 LYS HG3 H -4.893 15.421 1.624 1.00 . A A . 1 LYS HG3 1 1 20 7537 1 1 1 LYS HZ1 H -5.067 17.658 1.791 1.00 . A A . 1 LYS HZ1 1 1 20 7538 1 1 1 LYS HZ2 H -4.392 19.137 1.937 1.00 . A A . 1 LYS HZ2 1 1 20 7539 1 1 1 LYS HZ3 H -4.138 18.253 0.588 1.00 . A A . 1 LYS HZ3 1 1 20 7540 1 1 1 LYS N N -2.195 12.101 1.979 1.00 . A A . 1 LYS N 1 1 20 7541 1 1 1 LYS NZ N -4.262 18.213 1.579 1.00 . A A . 1 LYS NZ 1 1 20 7542 1 1 1 LYS O O -0.860 13.827 4.515 1.00 . A A . 1 LYS O 1 1 20 7543 1 1 2 SER C C -1.047 11.019 6.304 1.00 . A A . 2 SER C 1 1 20 7544 1 1 2 SER CA C -2.149 12.078 6.249 1.00 . A A . 2 SER CA 1 1 20 7545 1 1 2 SER CB C -3.358 11.631 7.073 1.00 . A A . 2 SER CB 1 1 20 7546 1 1 2 SER H H -3.317 11.822 4.543 1.00 . A A . 2 SER H 1 1 20 7547 1 1 2 SER HA H -1.783 13.031 6.631 1.00 . A A . 2 SER HA 1 1 20 7548 1 1 2 SER HB3 H -3.605 10.599 6.823 1.00 . A A . 2 SER HB3 1 1 20 7549 1 1 2 SER HG H -3.420 10.900 8.934 1.00 . A A . 2 SER HG 1 1 20 7550 1 1 2 SER N N -2.522 12.335 4.869 1.00 . A A . 2 SER N 1 1 20 7551 1 1 2 SER O O 0.028 11.264 6.849 1.00 . A A . 2 SER O 1 1 20 7552 1 1 2 SER OG O -3.118 11.734 8.473 1.00 . A A . 2 SER OG 1 1 20 7553 1 1 3 SER C C -0.786 7.761 4.622 1.00 . A A . 3 SER C 1 1 20 7554 1 1 3 SER CA C -0.401 8.764 5.711 1.00 . A A . 3 SER CA 1 1 20 7555 1 1 3 SER CB C -0.331 8.069 7.072 1.00 . A A . 3 SER CB 1 1 20 7556 1 1 3 SER H H -2.230 9.671 5.292 1.00 . A A . 3 SER H 1 1 20 7557 1 1 3 SER HA H 0.562 9.221 5.487 1.00 . A A . 3 SER HA 1 1 20 7558 1 1 3 SER HB3 H -1.188 7.405 7.185 1.00 . A A . 3 SER HB3 1 1 20 7559 1 1 3 SER HG H 0.662 6.345 7.289 1.00 . A A . 3 SER HG 1 1 20 7560 1 1 3 SER N N -1.353 9.863 5.733 1.00 . A A . 3 SER N 1 1 20 7561 1 1 3 SER O O -0.099 7.646 3.608 1.00 . A A . 3 SER O 1 1 20 7562 1 1 3 SER OG O 0.872 7.321 7.228 1.00 . A A . 3 SER OG 1 1 20 7563 1 1 4 ALA C C -3.522 5.289 4.552 1.00 . A A . 4 ALA C 1 1 20 7564 1 1 4 ALA CA C -2.368 6.070 3.921 1.00 . A A . 4 ALA CA 1 1 20 7565 1 1 4 ALA CB C -1.212 5.161 3.497 1.00 . A A . 4 ALA CB 1 1 20 7566 1 1 4 ALA H H -2.436 7.159 5.695 1.00 . A A . 4 ALA H 1 1 20 7567 1 1 4 ALA HA H -2.736 6.602 3.044 1.00 . A A . 4 ALA HA 1 1 20 7568 1 1 4 ALA HB1 H -0.810 5.504 2.544 1.00 . A A . 4 ALA HB1 1 1 20 7569 1 1 4 ALA HB2 H -0.429 5.193 4.254 1.00 . A A . 4 ALA HB2 1 1 20 7570 1 1 4 ALA HB3 H -1.574 4.139 3.391 1.00 . A A . 4 ALA HB3 1 1 20 7571 1 1 4 ALA N N -1.884 7.060 4.869 1.00 . A A . 4 ALA N 1 1 20 7572 1 1 4 ALA O O -3.363 4.686 5.611 1.00 . A A . 4 ALA O 1 1 20 7573 1 1 5 TYR C C -6.455 3.767 3.250 1.00 . A A . 5 TYR C 1 1 20 7574 1 1 5 TYR CA C -5.841 4.631 4.353 1.00 . A A . 5 TYR CA 1 1 20 7575 1 1 5 TYR CB C -6.842 5.720 4.747 1.00 . A A . 5 TYR CB 1 1 20 7576 1 1 5 TYR CD1 C -5.603 6.605 6.757 1.00 . A A . 5 TYR CD1 1 1 20 7577 1 1 5 TYR CD2 C -7.897 5.992 7.021 1.00 . A A . 5 TYR CD2 1 1 20 7578 1 1 5 TYR CE1 C -5.542 6.980 8.146 1.00 . A A . 5 TYR CE1 1 1 20 7579 1 1 5 TYR CE2 C -7.838 6.368 8.410 1.00 . A A . 5 TYR CE2 1 1 20 7580 1 1 5 TYR CG C -6.778 6.119 6.224 1.00 . A A . 5 TYR CG 1 1 20 7581 1 1 5 TYR CZ C -6.663 6.843 8.904 1.00 . A A . 5 TYR CZ 1 1 20 7582 1 1 5 TYR H H -4.781 5.821 3.012 1.00 . A A . 5 TYR H 1 1 20 7583 1 1 5 TYR HA H -5.540 3.990 5.182 1.00 . A A . 5 TYR HA 1 1 20 7584 1 1 5 TYR HB3 H -7.849 5.374 4.518 1.00 . A A . 5 TYR HB3 1 1 20 7585 1 1 5 TYR HD1 H -4.718 6.705 6.127 1.00 . A A . 5 TYR HD1 1 1 20 7586 1 1 5 TYR HD2 H -8.827 5.608 6.599 1.00 . A A . 5 TYR HD2 1 1 20 7587 1 1 5 TYR HE1 H -4.619 7.366 8.580 1.00 . A A . 5 TYR HE1 1 1 20 7588 1 1 5 TYR HE2 H -8.714 6.273 9.051 1.00 . A A . 5 TYR HE2 1 1 20 7589 1 1 5 TYR HH H -5.761 7.699 10.398 1.00 . A A . 5 TYR HH 1 1 20 7590 1 1 5 TYR N N -4.660 5.328 3.873 1.00 . A A . 5 TYR N 1 1 20 7591 1 1 5 TYR O O -7.499 4.109 2.696 1.00 . A A . 5 TYR O 1 1 20 7592 1 1 5 TYR OH O -6.608 7.197 10.215 1.00 . A A . 5 TYR OH 1 1 20 7593 1 1 6 SER C C -7.075 0.627 2.570 1.00 . A A . 6 SER C 1 1 20 7594 1 1 6 SER CA C -6.246 1.747 1.936 1.00 . A A . 6 SER CA 1 1 20 7595 1 1 6 SER CB C -5.073 1.160 1.149 1.00 . A A . 6 SER CB 1 1 20 7596 1 1 6 SER H H -4.932 2.392 3.419 1.00 . A A . 6 SER H 1 1 20 7597 1 1 6 SER HA H -6.864 2.350 1.271 1.00 . A A . 6 SER HA 1 1 20 7598 1 1 6 SER HB3 H -4.488 0.511 1.801 1.00 . A A . 6 SER HB3 1 1 20 7599 1 1 6 SER HG H -5.600 -0.548 0.248 1.00 . A A . 6 SER HG 1 1 20 7600 1 1 6 SER N N -5.781 2.663 2.964 1.00 . A A . 6 SER N 1 1 20 7601 1 1 6 SER O O -6.848 0.259 3.722 1.00 . A A . 6 SER O 1 1 20 7602 1 1 6 SER OG O -5.510 0.420 0.013 1.00 . A A . 6 SER OG 1 1 20 7603 1 1 7 LEU C C -8.277 -2.301 1.861 1.00 . A A . 7 LEU C 1 1 20 7604 1 1 7 LEU CA C -8.878 -0.953 2.261 1.00 . A A . 7 LEU CA 1 1 20 7605 1 1 7 LEU CB C -10.310 -0.747 1.761 1.00 . A A . 7 LEU CB 1 1 20 7606 1 1 7 LEU CD1 C -11.629 -1.049 -0.366 1.00 . A A . 7 LEU CD1 1 1 20 7607 1 1 7 LEU CD2 C -10.573 1.193 0.171 1.00 . A A . 7 LEU CD2 1 1 20 7608 1 1 7 LEU CG C -10.455 -0.327 0.297 1.00 . A A . 7 LEU CG 1 1 20 7609 1 1 7 LEU H H -8.193 0.423 0.854 1.00 . A A . 7 LEU H 1 1 20 7610 1 1 7 LEU HA H -8.906 -0.896 3.348 1.00 . A A . 7 LEU HA 1 1 20 7611 1 1 7 LEU HB3 H -10.786 0.011 2.384 1.00 . A A . 7 LEU HB3 1 1 20 7612 1 1 7 LEU HD11 H -12.198 -0.342 -0.969 1.00 . A A . 7 LEU HD11 1 1 20 7613 1 1 7 LEU HD12 H -11.252 -1.848 -1.005 1.00 . A A . 7 LEU HD12 1 1 20 7614 1 1 7 LEU HD13 H -12.276 -1.474 0.402 1.00 . A A . 7 LEU HD13 1 1 20 7615 1 1 7 LEU HD21 H -11.498 1.445 -0.347 1.00 . A A . 7 LEU HD21 1 1 20 7616 1 1 7 LEU HD22 H -10.579 1.641 1.165 1.00 . A A . 7 LEU HD22 1 1 20 7617 1 1 7 LEU HD23 H -9.723 1.577 -0.395 1.00 . A A . 7 LEU HD23 1 1 20 7618 1 1 7 LEU HG H -9.552 -0.626 -0.235 1.00 . A A . 7 LEU HG 1 1 20 7619 1 1 7 LEU N N -8.016 0.118 1.790 1.00 . A A . 7 LEU N 1 1 20 7620 1 1 7 LEU O O -8.291 -3.249 2.644 1.00 . A A . 7 LEU O 1 1 20 7621 1 1 8 GLN C C -8.210 -4.658 -0.021 1.00 . A A . 8 GLN C 1 1 20 7622 1 1 8 GLN CA C -7.154 -3.560 0.127 1.00 . A A . 8 GLN CA 1 1 20 7623 1 1 8 GLN CB C -6.005 -4.022 1.026 1.00 . A A . 8 GLN CB 1 1 20 7624 1 1 8 GLN CD C -3.867 -2.784 1.528 1.00 . A A . 8 GLN CD 1 1 20 7625 1 1 8 GLN CG C -4.656 -3.560 0.472 1.00 . A A . 8 GLN CG 1 1 20 7626 1 1 8 GLN H H -7.752 -1.569 0.009 1.00 . A A . 8 GLN H 1 1 20 7627 1 1 8 GLN HA H -6.757 -3.295 -0.853 1.00 . A A . 8 GLN HA 1 1 20 7628 1 1 8 GLN HB3 H -6.016 -5.109 1.106 1.00 . A A . 8 GLN HB3 1 1 20 7629 1 1 8 GLN HE21 H -2.861 -1.864 0.032 1.00 . A A . 8 GLN HE21 1 1 20 7630 1 1 8 GLN HE22 H -2.403 -1.389 1.633 1.00 . A A . 8 GLN HE22 1 1 20 7631 1 1 8 GLN HG3 H -4.815 -2.931 -0.404 1.00 . A A . 8 GLN HG3 1 1 20 7632 1 1 8 GLN N N -7.760 -2.344 0.641 1.00 . A A . 8 GLN N 1 1 20 7633 1 1 8 GLN NE2 N -2.969 -1.943 1.023 1.00 . A A . 8 GLN NE2 1 1 20 7634 1 1 8 GLN O O -8.860 -5.035 0.953 1.00 . A A . 8 GLN O 1 1 20 7635 1 1 8 GLN OE1 O -4.060 -2.939 2.723 1.00 . A A . 8 GLN OE1 1 1 20 7636 1 1 9 MET C C -8.980 -6.893 -2.851 1.00 . A A . 9 MET C 1 1 20 7637 1 1 9 MET CA C -9.314 -6.187 -1.536 1.00 . A A . 9 MET CA 1 1 20 7638 1 1 9 MET CB C -10.715 -5.580 -1.623 1.00 . A A . 9 MET CB 1 1 20 7639 1 1 9 MET CE C -12.931 -7.586 -0.104 1.00 . A A . 9 MET CE 1 1 20 7640 1 1 9 MET CG C -11.314 -5.384 -0.228 1.00 . A A . 9 MET CG 1 1 20 7641 1 1 9 MET H H -7.815 -4.828 -2.035 1.00 . A A . 9 MET H 1 1 20 7642 1 1 9 MET HA H -9.237 -6.892 -0.708 1.00 . A A . 9 MET HA 1 1 20 7643 1 1 9 MET HB3 H -11.361 -6.230 -2.212 1.00 . A A . 9 MET HB3 1 1 20 7644 1 1 9 MET HE1 H -12.478 -7.993 -1.008 1.00 . A A . 9 MET HE1 1 1 20 7645 1 1 9 MET HE2 H -12.316 -7.842 0.758 1.00 . A A . 9 MET HE2 1 1 20 7646 1 1 9 MET HE3 H -13.929 -8.006 0.023 1.00 . A A . 9 MET HE3 1 1 20 7647 1 1 9 MET HG3 H -11.189 -4.348 0.088 1.00 . A A . 9 MET HG3 1 1 20 7648 1 1 9 MET N N -8.348 -5.141 -1.248 1.00 . A A . 9 MET N 1 1 20 7649 1 1 9 MET O O -8.853 -8.116 -2.889 1.00 . A A . 9 MET O 1 1 20 7650 1 1 9 MET SD S -13.048 -5.811 -0.245 1.00 . A A . 9 MET SD 1 1 20 7651 1 1 10 GLY C C -7.543 -7.787 -5.110 1.00 . A A . 10 GLY C 1 1 20 7652 1 1 10 GLY CA C -8.534 -6.625 -5.213 1.00 . A A . 10 GLY CA 1 1 20 7653 1 1 10 GLY H H -8.955 -5.099 -3.859 1.00 . A A . 10 GLY H 1 1 20 7654 1 1 10 GLY HA2 H -9.448 -6.965 -5.702 1.00 . A A . 10 GLY HA2 1 1 20 7655 1 1 10 GLY HA3 H -8.112 -5.837 -5.838 1.00 . A A . 10 GLY HA3 1 1 20 7656 1 1 10 GLY N N -8.849 -6.093 -3.899 1.00 . A A . 10 GLY N 1 1 20 7657 1 1 10 GLY O O -7.941 -8.950 -5.114 1.00 . A A . 10 GLY O 1 1 20 7658 1 1 11 ALA C C -3.871 -7.778 -5.239 1.00 . A A . 11 ALA C 1 1 20 7659 1 1 11 ALA CA C -5.218 -8.428 -4.918 1.00 . A A . 11 ALA CA 1 1 20 7660 1 1 11 ALA CB C -5.535 -9.602 -5.847 1.00 . A A . 11 ALA CB 1 1 20 7661 1 1 11 ALA H H -5.954 -6.481 -5.019 1.00 . A A . 11 ALA H 1 1 20 7662 1 1 11 ALA HA H -5.204 -8.788 -3.890 1.00 . A A . 11 ALA HA 1 1 20 7663 1 1 11 ALA HB1 H -4.607 -10.088 -6.148 1.00 . A A . 11 ALA HB1 1 1 20 7664 1 1 11 ALA HB2 H -6.169 -10.318 -5.324 1.00 . A A . 11 ALA HB2 1 1 20 7665 1 1 11 ALA HB3 H -6.056 -9.235 -6.731 1.00 . A A . 11 ALA HB3 1 1 20 7666 1 1 11 ALA N N -6.270 -7.430 -5.021 1.00 . A A . 11 ALA N 1 1 20 7667 1 1 11 ALA O O -2.874 -8.045 -4.570 1.00 . A A . 11 ALA O 1 1 20 7668 1 1 12 THR C C -2.285 -5.184 -5.650 1.00 . A A . 12 THR C 1 1 20 7669 1 1 12 THR CA C -2.676 -6.246 -6.679 1.00 . A A . 12 THR CA 1 1 20 7670 1 1 12 THR CB C -2.916 -5.676 -8.079 1.00 . A A . 12 THR CB 1 1 20 7671 1 1 12 THR CG2 C -1.697 -4.931 -8.625 1.00 . A A . 12 THR CG2 1 1 20 7672 1 1 12 THR H H -4.700 -6.724 -6.801 1.00 . A A . 12 THR H 1 1 20 7673 1 1 12 THR HA H -1.862 -6.970 -6.717 1.00 . A A . 12 THR HA 1 1 20 7674 1 1 12 THR HB H -3.800 -5.038 -8.092 1.00 . A A . 12 THR HB 1 1 20 7675 1 1 12 THR HG1 H -3.663 -6.654 -9.657 1.00 . A A . 12 THR HG1 1 1 20 7676 1 1 12 THR HG21 H -1.069 -5.624 -9.185 1.00 . A A . 12 THR HG21 1 1 20 7677 1 1 12 THR HG22 H -2.026 -4.128 -9.283 1.00 . A A . 12 THR HG22 1 1 20 7678 1 1 12 THR HG23 H -1.126 -4.513 -7.797 1.00 . A A . 12 THR HG23 1 1 20 7679 1 1 12 THR N N -3.885 -6.936 -6.262 1.00 . A A . 12 THR N 1 1 20 7680 1 1 12 THR O O -1.133 -5.122 -5.223 1.00 . A A . 12 THR O 1 1 20 7681 1 1 12 THR OG1 O -3.021 -6.829 -8.910 1.00 . A A . 12 THR OG1 1 1 20 7682 1 1 13 ALA C C -2.172 -3.857 -3.170 1.00 . A A . 13 ALA C 1 1 20 7683 1 1 13 ALA CA C -3.041 -3.319 -4.308 1.00 . A A . 13 ALA CA 1 1 20 7684 1 1 13 ALA CB C -4.386 -2.785 -3.811 1.00 . A A . 13 ALA CB 1 1 20 7685 1 1 13 ALA H H -4.202 -4.432 -5.632 1.00 . A A . 13 ALA H 1 1 20 7686 1 1 13 ALA HA H -2.508 -2.512 -4.812 1.00 . A A . 13 ALA HA 1 1 20 7687 1 1 13 ALA HB1 H -4.321 -2.574 -2.744 1.00 . A A . 13 ALA HB1 1 1 20 7688 1 1 13 ALA HB2 H -4.634 -1.869 -4.348 1.00 . A A . 13 ALA HB2 1 1 20 7689 1 1 13 ALA HB3 H -5.161 -3.530 -3.989 1.00 . A A . 13 ALA HB3 1 1 20 7690 1 1 13 ALA N N -3.267 -4.375 -5.279 1.00 . A A . 13 ALA N 1 1 20 7691 1 1 13 ALA O O -1.219 -3.201 -2.748 1.00 . A A . 13 ALA O 1 1 20 7692 1 1 14 ILE C C -0.294 -5.465 -1.840 1.00 . A A . 14 ILE C 1 1 20 7693 1 1 14 ILE CA C -1.794 -5.679 -1.625 1.00 . A A . 14 ILE CA 1 1 20 7694 1 1 14 ILE CB C -2.193 -7.150 -1.494 1.00 . A A . 14 ILE CB 1 1 20 7695 1 1 14 ILE CD1 C -4.699 -6.891 -1.629 1.00 . A A . 14 ILE CD1 1 1 20 7696 1 1 14 ILE CG1 C -3.519 -7.293 -0.743 1.00 . A A . 14 ILE CG1 1 1 20 7697 1 1 14 ILE CG2 C -1.075 -7.966 -0.844 1.00 . A A . 14 ILE CG2 1 1 20 7698 1 1 14 ILE H H -3.305 -5.572 -3.054 1.00 . A A . 14 ILE H 1 1 20 7699 1 1 14 ILE HA H -2.083 -5.183 -0.698 1.00 . A A . 14 ILE HA 1 1 20 7700 1 1 14 ILE HB H -2.346 -7.552 -2.495 1.00 . A A . 14 ILE HB 1 1 20 7701 1 1 14 ILE HD11 H -4.845 -5.812 -1.571 1.00 . A A . 14 ILE HD11 1 1 20 7702 1 1 14 ILE HD12 H -4.491 -7.174 -2.661 1.00 . A A . 14 ILE HD12 1 1 20 7703 1 1 14 ILE HD13 H -5.600 -7.400 -1.287 1.00 . A A . 14 ILE HD13 1 1 20 7704 1 1 14 ILE HG13 H -3.502 -6.671 0.152 1.00 . A A . 14 ILE HG13 1 1 20 7705 1 1 14 ILE HG21 H -1.392 -9.004 -0.747 1.00 . A A . 14 ILE HG21 1 1 20 7706 1 1 14 ILE HG22 H -0.181 -7.917 -1.466 1.00 . A A . 14 ILE HG22 1 1 20 7707 1 1 14 ILE HG23 H -0.854 -7.560 0.142 1.00 . A A . 14 ILE HG23 1 1 20 7708 1 1 14 ILE N N -2.529 -5.045 -2.705 1.00 . A A . 14 ILE N 1 1 20 7709 1 1 14 ILE O O 0.426 -5.104 -0.911 1.00 . A A . 14 ILE O 1 1 20 7710 1 1 15 LYS C C 1.944 -4.080 -3.205 1.00 . A A . 15 LYS C 1 1 20 7711 1 1 15 LYS CA C 1.533 -5.538 -3.423 1.00 . A A . 15 LYS CA 1 1 20 7712 1 1 15 LYS CB C 1.793 -6.044 -4.843 1.00 . A A . 15 LYS CB 1 1 20 7713 1 1 15 LYS CD C 2.986 -4.029 -5.779 1.00 . A A . 15 LYS CD 1 1 20 7714 1 1 15 LYS CE C 3.493 -3.676 -7.178 1.00 . A A . 15 LYS CE 1 1 20 7715 1 1 15 LYS CG C 1.729 -4.899 -5.854 1.00 . A A . 15 LYS CG 1 1 20 7716 1 1 15 LYS H H -0.459 -5.993 -3.823 1.00 . A A . 15 LYS H 1 1 20 7717 1 1 15 LYS HA H 2.114 -6.165 -2.745 1.00 . A A . 15 LYS HA 1 1 20 7718 1 1 15 LYS HB3 H 1.056 -6.804 -5.102 1.00 . A A . 15 LYS HB3 1 1 20 7719 1 1 15 LYS HD3 H 3.765 -4.557 -5.228 1.00 . A A . 15 LYS HD3 1 1 20 7720 1 1 15 LYS HE3 H 2.804 -4.061 -7.929 1.00 . A A . 15 LYS HE3 1 1 20 7721 1 1 15 LYS HG3 H 0.848 -4.286 -5.661 1.00 . A A . 15 LYS HG3 1 1 20 7722 1 1 15 LYS HZ1 H 2.723 -1.799 -7.417 1.00 . A A . 15 LYS HZ1 1 1 20 7723 1 1 15 LYS HZ2 H 4.086 -1.835 -6.519 1.00 . A A . 15 LYS HZ2 1 1 20 7724 1 1 15 LYS HZ3 H 4.173 -2.006 -8.140 1.00 . A A . 15 LYS HZ3 1 1 20 7725 1 1 15 LYS N N 0.132 -5.699 -3.073 1.00 . A A . 15 LYS N 1 1 20 7726 1 1 15 LYS NZ N 3.630 -2.210 -7.325 1.00 . A A . 15 LYS NZ 1 1 20 7727 1 1 15 LYS O O 3.000 -3.806 -2.636 1.00 . A A . 15 LYS O 1 1 20 7728 1 1 16 GLN C C 1.640 -1.410 -2.073 1.00 . A A . 16 GLN C 1 1 20 7729 1 1 16 GLN CA C 1.349 -1.759 -3.534 1.00 . A A . 16 GLN CA 1 1 20 7730 1 1 16 GLN CB C 0.178 -0.933 -4.072 1.00 . A A . 16 GLN CB 1 1 20 7731 1 1 16 GLN CD C -0.563 0.503 -6.008 1.00 . A A . 16 GLN CD 1 1 20 7732 1 1 16 GLN CG C 0.356 -0.637 -5.562 1.00 . A A . 16 GLN CG 1 1 20 7733 1 1 16 GLN H H 0.231 -3.412 -4.132 1.00 . A A . 16 GLN H 1 1 20 7734 1 1 16 GLN HA H 2.232 -1.566 -4.143 1.00 . A A . 16 GLN HA 1 1 20 7735 1 1 16 GLN HB3 H 0.104 0.003 -3.518 1.00 . A A . 16 GLN HB3 1 1 20 7736 1 1 16 GLN HE21 H 0.337 0.455 -7.821 1.00 . A A . 16 GLN HE21 1 1 20 7737 1 1 16 GLN HE22 H -0.916 1.638 -7.646 1.00 . A A . 16 GLN HE22 1 1 20 7738 1 1 16 GLN HG3 H 0.137 -1.533 -6.143 1.00 . A A . 16 GLN HG3 1 1 20 7739 1 1 16 GLN N N 1.088 -3.181 -3.670 1.00 . A A . 16 GLN N 1 1 20 7740 1 1 16 GLN NE2 N -0.364 0.898 -7.263 1.00 . A A . 16 GLN NE2 1 1 20 7741 1 1 16 GLN O O 2.216 -0.363 -1.784 1.00 . A A . 16 GLN O 1 1 20 7742 1 1 16 GLN OE1 O -1.395 0.992 -5.262 1.00 . A A . 16 GLN OE1 1 1 20 7743 1 1 17 VAL C C 2.899 -1.729 0.482 1.00 . A A . 17 VAL C 1 1 20 7744 1 1 17 VAL CA C 1.438 -2.109 0.233 1.00 . A A . 17 VAL CA 1 1 20 7745 1 1 17 VAL CB C 1.004 -3.356 1.006 1.00 . A A . 17 VAL CB 1 1 20 7746 1 1 17 VAL CG1 C 1.420 -3.263 2.476 1.00 . A A . 17 VAL CG1 1 1 20 7747 1 1 17 VAL CG2 C -0.503 -3.587 0.876 1.00 . A A . 17 VAL CG2 1 1 20 7748 1 1 17 VAL H H 0.761 -3.158 -1.433 1.00 . A A . 17 VAL H 1 1 20 7749 1 1 17 VAL HA H 0.803 -1.281 0.547 1.00 . A A . 17 VAL HA 1 1 20 7750 1 1 17 VAL HB H 1.513 -4.216 0.569 1.00 . A A . 17 VAL HB 1 1 20 7751 1 1 17 VAL HG11 H 1.434 -2.218 2.783 1.00 . A A . 17 VAL HG11 1 1 20 7752 1 1 17 VAL HG12 H 0.707 -3.813 3.091 1.00 . A A . 17 VAL HG12 1 1 20 7753 1 1 17 VAL HG13 H 2.415 -3.692 2.600 1.00 . A A . 17 VAL HG13 1 1 20 7754 1 1 17 VAL HG21 H -1.025 -3.007 1.637 1.00 . A A . 17 VAL HG21 1 1 20 7755 1 1 17 VAL HG22 H -0.834 -3.270 -0.114 1.00 . A A . 17 VAL HG22 1 1 20 7756 1 1 17 VAL HG23 H -0.721 -4.646 1.011 1.00 . A A . 17 VAL HG23 1 1 20 7757 1 1 17 VAL N N 1.229 -2.308 -1.190 1.00 . A A . 17 VAL N 1 1 20 7758 1 1 17 VAL O O 3.182 -0.749 1.170 1.00 . A A . 17 VAL O 1 1 20 7759 1 1 18 LYS C C 5.580 -0.970 -0.631 1.00 . A A . 18 LYS C 1 1 20 7760 1 1 18 LYS CA C 5.214 -2.286 0.058 1.00 . A A . 18 LYS CA 1 1 20 7761 1 1 18 LYS CB C 6.016 -3.487 -0.445 1.00 . A A . 18 LYS CB 1 1 20 7762 1 1 18 LYS CD C 6.560 -2.926 -2.843 1.00 . A A . 18 LYS CD 1 1 20 7763 1 1 18 LYS CE C 8.008 -3.420 -2.859 1.00 . A A . 18 LYS CE 1 1 20 7764 1 1 18 LYS CG C 5.699 -3.783 -1.912 1.00 . A A . 18 LYS CG 1 1 20 7765 1 1 18 LYS H H 3.551 -3.320 -0.650 1.00 . A A . 18 LYS H 1 1 20 7766 1 1 18 LYS HA H 5.418 -2.185 1.125 1.00 . A A . 18 LYS HA 1 1 20 7767 1 1 18 LYS HB3 H 5.787 -4.362 0.164 1.00 . A A . 18 LYS HB3 1 1 20 7768 1 1 18 LYS HD3 H 6.529 -1.886 -2.516 1.00 . A A . 18 LYS HD3 1 1 20 7769 1 1 18 LYS HE3 H 8.370 -3.536 -1.837 1.00 . A A . 18 LYS HE3 1 1 20 7770 1 1 18 LYS HG3 H 4.644 -3.589 -2.106 1.00 . A A . 18 LYS HG3 1 1 20 7771 1 1 18 LYS HZ1 H 8.976 -5.151 -3.351 1.00 . A A . 18 LYS HZ1 1 1 20 7772 1 1 18 LYS HZ2 H 7.351 -5.304 -3.301 1.00 . A A . 18 LYS HZ2 1 1 20 7773 1 1 18 LYS HZ3 H 8.061 -4.547 -4.562 1.00 . A A . 18 LYS HZ3 1 1 20 7774 1 1 18 LYS N N 3.790 -2.526 -0.092 1.00 . A A . 18 LYS N 1 1 20 7775 1 1 18 LYS NZ N 8.107 -4.711 -3.576 1.00 . A A . 18 LYS NZ 1 1 20 7776 1 1 18 LYS O O 6.522 -0.291 -0.222 1.00 . A A . 18 LYS O 1 1 20 7777 1 1 19 LYS C C 4.793 1.780 -1.511 1.00 . A A . 19 LYS C 1 1 20 7778 1 1 19 LYS CA C 5.051 0.574 -2.416 1.00 . A A . 19 LYS CA 1 1 20 7779 1 1 19 LYS CB C 4.221 0.581 -3.701 1.00 . A A . 19 LYS CB 1 1 20 7780 1 1 19 LYS CD C 2.530 2.376 -3.173 1.00 . A A . 19 LYS CD 1 1 20 7781 1 1 19 LYS CE C 1.227 2.241 -3.965 1.00 . A A . 19 LYS CE 1 1 20 7782 1 1 19 LYS CG C 3.737 1.993 -4.033 1.00 . A A . 19 LYS CG 1 1 20 7783 1 1 19 LYS H H 4.055 -1.206 -1.993 1.00 . A A . 19 LYS H 1 1 20 7784 1 1 19 LYS HA H 6.101 0.582 -2.710 1.00 . A A . 19 LYS HA 1 1 20 7785 1 1 19 LYS HB3 H 3.364 -0.084 -3.589 1.00 . A A . 19 LYS HB3 1 1 20 7786 1 1 19 LYS HD3 H 2.641 3.401 -2.820 1.00 . A A . 19 LYS HD3 1 1 20 7787 1 1 19 LYS HE3 H 0.390 2.108 -3.280 1.00 . A A . 19 LYS HE3 1 1 20 7788 1 1 19 LYS HG3 H 3.468 2.051 -5.088 1.00 . A A . 19 LYS HG3 1 1 20 7789 1 1 19 LYS HZ1 H 1.634 3.426 -5.580 1.00 . A A . 19 LYS HZ1 1 1 20 7790 1 1 19 LYS HZ2 H 0.061 3.442 -5.137 1.00 . A A . 19 LYS HZ2 1 1 20 7791 1 1 19 LYS HZ3 H 1.166 4.263 -4.258 1.00 . A A . 19 LYS HZ3 1 1 20 7792 1 1 19 LYS N N 4.819 -0.648 -1.667 1.00 . A A . 19 LYS N 1 1 20 7793 1 1 19 LYS NZ N 1.004 3.440 -4.803 1.00 . A A . 19 LYS NZ 1 1 20 7794 1 1 19 LYS O O 5.310 2.868 -1.757 1.00 . A A . 19 LYS O 1 1 20 7795 1 1 20 LEU C C 4.664 2.581 1.616 1.00 . A A . 20 LEU C 1 1 20 7796 1 1 20 LEU CA C 3.659 2.599 0.463 1.00 . A A . 20 LEU CA 1 1 20 7797 1 1 20 LEU CB C 2.202 2.473 0.913 1.00 . A A . 20 LEU CB 1 1 20 7798 1 1 20 LEU CD1 C 2.407 2.879 3.394 1.00 . A A . 20 LEU CD1 1 1 20 7799 1 1 20 LEU CD2 C 0.531 1.432 2.488 1.00 . A A . 20 LEU CD2 1 1 20 7800 1 1 20 LEU CG C 1.980 1.888 2.309 1.00 . A A . 20 LEU CG 1 1 20 7801 1 1 20 LEU H H 3.575 0.657 -0.288 1.00 . A A . 20 LEU H 1 1 20 7802 1 1 20 LEU HA H 3.753 3.550 -0.062 1.00 . A A . 20 LEU HA 1 1 20 7803 1 1 20 LEU HB3 H 1.672 1.853 0.192 1.00 . A A . 20 LEU HB3 1 1 20 7804 1 1 20 LEU HD11 H 1.623 2.954 4.147 1.00 . A A . 20 LEU HD11 1 1 20 7805 1 1 20 LEU HD12 H 3.329 2.532 3.861 1.00 . A A . 20 LEU HD12 1 1 20 7806 1 1 20 LEU HD13 H 2.574 3.859 2.945 1.00 . A A . 20 LEU HD13 1 1 20 7807 1 1 20 LEU HD21 H 0.479 0.347 2.402 1.00 . A A . 20 LEU HD21 1 1 20 7808 1 1 20 LEU HD22 H 0.173 1.736 3.472 1.00 . A A . 20 LEU HD22 1 1 20 7809 1 1 20 LEU HD23 H -0.092 1.888 1.718 1.00 . A A . 20 LEU HD23 1 1 20 7810 1 1 20 LEU HG H 2.611 1.005 2.414 1.00 . A A . 20 LEU HG 1 1 20 7811 1 1 20 LEU N N 3.993 1.546 -0.481 1.00 . A A . 20 LEU N 1 1 20 7812 1 1 20 LEU O O 4.753 3.540 2.381 1.00 . A A . 20 LEU O 1 1 20 7813 1 1 21 PHE C C 7.673 2.078 2.406 1.00 . A A . 21 PHE C 1 1 20 7814 1 1 21 PHE CA C 6.388 1.323 2.754 1.00 . A A . 21 PHE CA 1 1 20 7815 1 1 21 PHE CB C 6.700 -0.171 2.856 1.00 . A A . 21 PHE CB 1 1 20 7816 1 1 21 PHE CD1 C 4.790 -1.355 3.962 1.00 . A A . 21 PHE CD1 1 1 20 7817 1 1 21 PHE CD2 C 6.741 -0.980 5.226 1.00 . A A . 21 PHE CD2 1 1 20 7818 1 1 21 PHE CE1 C 4.189 -1.994 5.078 1.00 . A A . 21 PHE CE1 1 1 20 7819 1 1 21 PHE CE2 C 6.141 -1.620 6.342 1.00 . A A . 21 PHE CE2 1 1 20 7820 1 1 21 PHE CG C 6.053 -0.861 4.059 1.00 . A A . 21 PHE CG 1 1 20 7821 1 1 21 PHE CZ C 4.877 -2.114 6.245 1.00 . A A . 21 PHE CZ 1 1 20 7822 1 1 21 PHE H H 5.314 0.704 1.080 1.00 . A A . 21 PHE H 1 1 20 7823 1 1 21 PHE HA H 5.963 1.737 3.668 1.00 . A A . 21 PHE HA 1 1 20 7824 1 1 21 PHE HB3 H 7.781 -0.303 2.913 1.00 . A A . 21 PHE HB3 1 1 20 7825 1 1 21 PHE HD1 H 4.238 -1.259 3.026 1.00 . A A . 21 PHE HD1 1 1 20 7826 1 1 21 PHE HD2 H 7.754 -0.584 5.304 1.00 . A A . 21 PHE HD2 1 1 20 7827 1 1 21 PHE HE1 H 3.177 -2.390 4.999 1.00 . A A . 21 PHE HE1 1 1 20 7828 1 1 21 PHE HE2 H 6.692 -1.715 7.277 1.00 . A A . 21 PHE HE2 1 1 20 7829 1 1 21 PHE HZ H 4.417 -2.606 7.101 1.00 . A A . 21 PHE HZ 1 1 20 7830 1 1 21 PHE N N 5.394 1.480 1.706 1.00 . A A . 21 PHE N 1 1 20 7831 1 1 21 PHE O O 8.487 2.362 3.284 1.00 . A A . 21 PHE O 1 1 20 7832 1 1 22 LYS C C 9.167 4.374 1.471 1.00 . A A . 22 LYS C 1 1 20 7833 1 1 22 LYS CA C 8.989 3.096 0.650 1.00 . A A . 22 LYS CA 1 1 20 7834 1 1 22 LYS CB C 8.892 3.342 -0.857 1.00 . A A . 22 LYS CB 1 1 20 7835 1 1 22 LYS CD C 6.922 4.909 -1.003 1.00 . A A . 22 LYS CD 1 1 20 7836 1 1 22 LYS CE C 6.539 6.324 -0.565 1.00 . A A . 22 LYS CE 1 1 20 7837 1 1 22 LYS CG C 8.439 4.774 -1.151 1.00 . A A . 22 LYS CG 1 1 20 7838 1 1 22 LYS H H 7.150 2.145 0.417 1.00 . A A . 22 LYS H 1 1 20 7839 1 1 22 LYS HA H 9.853 2.453 0.817 1.00 . A A . 22 LYS HA 1 1 20 7840 1 1 22 LYS HB3 H 8.190 2.636 -1.301 1.00 . A A . 22 LYS HB3 1 1 20 7841 1 1 22 LYS HD3 H 6.559 4.188 -0.272 1.00 . A A . 22 LYS HD3 1 1 20 7842 1 1 22 LYS HE3 H 7.414 6.838 -0.168 1.00 . A A . 22 LYS HE3 1 1 20 7843 1 1 22 LYS HG3 H 8.736 5.052 -2.162 1.00 . A A . 22 LYS HG3 1 1 20 7844 1 1 22 LYS HZ1 H 5.943 8.058 -1.469 1.00 . A A . 22 LYS HZ1 1 1 20 7845 1 1 22 LYS HZ2 H 6.573 6.964 -2.506 1.00 . A A . 22 LYS HZ2 1 1 20 7846 1 1 22 LYS HZ3 H 5.066 6.755 -1.914 1.00 . A A . 22 LYS HZ3 1 1 20 7847 1 1 22 LYS N N 7.816 2.380 1.124 1.00 . A A . 22 LYS N 1 1 20 7848 1 1 22 LYS NZ N 5.986 7.087 -1.706 1.00 . A A . 22 LYS NZ 1 1 20 7849 1 1 22 LYS O O 10.260 4.937 1.521 1.00 . A A . 22 LYS O 1 1 20 7850 1 1 23 LYS C C 8.342 5.608 4.376 1.00 . A A . 23 LYS C 1 1 20 7851 1 1 23 LYS CA C 8.101 5.995 2.915 1.00 . A A . 23 LYS CA 1 1 20 7852 1 1 23 LYS CB C 6.828 6.815 2.698 1.00 . A A . 23 LYS CB 1 1 20 7853 1 1 23 LYS CD C 4.553 6.744 3.786 1.00 . A A . 23 LYS CD 1 1 20 7854 1 1 23 LYS CE C 3.502 7.397 2.886 1.00 . A A . 23 LYS CE 1 1 20 7855 1 1 23 LYS CG C 5.580 5.969 2.957 1.00 . A A . 23 LYS CG 1 1 20 7856 1 1 23 LYS H H 7.194 4.330 2.053 1.00 . A A . 23 LYS H 1 1 20 7857 1 1 23 LYS HA H 8.939 6.604 2.576 1.00 . A A . 23 LYS HA 1 1 20 7858 1 1 23 LYS HB3 H 6.807 7.198 1.679 1.00 . A A . 23 LYS HB3 1 1 20 7859 1 1 23 LYS HD3 H 5.059 7.508 4.375 1.00 . A A . 23 LYS HD3 1 1 20 7860 1 1 23 LYS HE3 H 2.511 7.032 3.150 1.00 . A A . 23 LYS HE3 1 1 20 7861 1 1 23 LYS HG3 H 5.858 5.054 3.480 1.00 . A A . 23 LYS HG3 1 1 20 7862 1 1 23 LYS HZ1 H 3.475 9.118 3.988 1.00 . A A . 23 LYS HZ1 1 1 20 7863 1 1 23 LYS HZ2 H 4.412 9.213 2.654 1.00 . A A . 23 LYS HZ2 1 1 20 7864 1 1 23 LYS HZ3 H 2.786 9.276 2.517 1.00 . A A . 23 LYS HZ3 1 1 20 7865 1 1 23 LYS N N 8.078 4.794 2.098 1.00 . A A . 23 LYS N 1 1 20 7866 1 1 23 LYS NZ N 3.548 8.871 3.023 1.00 . A A . 23 LYS NZ 1 1 20 7867 1 1 23 LYS O O 9.004 6.337 5.113 1.00 . A A . 23 LYS O 1 1 20 7868 1 1 24 TRP C C 9.405 3.585 6.316 1.00 . A A . 24 TRP C 1 1 20 7869 1 1 24 TRP CA C 7.939 3.970 6.108 1.00 . A A . 24 TRP CA 1 1 20 7870 1 1 24 TRP CB C 6.974 2.815 6.381 1.00 . A A . 24 TRP CB 1 1 20 7871 1 1 24 TRP CD1 C 4.975 4.400 5.987 1.00 . A A . 24 TRP CD1 1 1 20 7872 1 1 24 TRP CD2 C 4.365 2.352 6.575 1.00 . A A . 24 TRP CD2 1 1 20 7873 1 1 24 TRP CE2 C 3.213 3.091 6.397 1.00 . A A . 24 TRP CE2 1 1 20 7874 1 1 24 TRP CE3 C 4.317 0.999 6.954 1.00 . A A . 24 TRP CE3 1 1 20 7875 1 1 24 TRP CG C 5.497 3.207 6.308 1.00 . A A . 24 TRP CG 1 1 20 7876 1 1 24 TRP CH2 C 1.857 1.217 6.953 1.00 . A A . 24 TRP CH2 1 1 20 7877 1 1 24 TRP CZ2 C 1.929 2.563 6.576 1.00 . A A . 24 TRP CZ2 1 1 20 7878 1 1 24 TRP CZ3 C 3.026 0.486 7.129 1.00 . A A . 24 TRP CZ3 1 1 20 7879 1 1 24 TRP H H 7.255 3.876 4.143 1.00 . A A . 24 TRP H 1 1 20 7880 1 1 24 TRP HA H 7.666 4.779 6.788 1.00 . A A . 24 TRP HA 1 1 20 7881 1 1 24 TRP HB3 H 7.182 2.406 7.370 1.00 . A A . 24 TRP HB3 1 1 20 7882 1 1 24 TRP HD1 H 5.565 5.278 5.728 1.00 . A A . 24 TRP HD1 1 1 20 7883 1 1 24 TRP HE1 H 2.929 5.210 5.812 1.00 . A A . 24 TRP HE1 1 1 20 7884 1 1 24 TRP HE3 H 5.212 0.394 7.100 1.00 . A A . 24 TRP HE3 1 1 20 7885 1 1 24 TRP HH2 H 0.887 0.744 7.110 1.00 . A A . 24 TRP HH2 1 1 20 7886 1 1 24 TRP HZ2 H 1.034 3.167 6.429 1.00 . A A . 24 TRP HZ2 1 1 20 7887 1 1 24 TRP HZ3 H 2.931 -0.558 7.423 1.00 . A A . 24 TRP HZ3 1 1 20 7888 1 1 24 TRP N N 7.792 4.463 4.750 1.00 . A A . 24 TRP N 1 1 20 7889 1 1 24 TRP NE1 N 3.596 4.376 6.028 1.00 . A A . 24 TRP NE1 1 1 20 7890 1 1 24 TRP O O 10.085 4.154 7.169 1.00 . A A . 24 TRP O 1 1 20 7891 1 1 25 GLY C C 11.378 1.113 6.718 1.00 . A A . 25 GLY C 1 1 20 7892 1 1 25 GLY CA C 11.222 2.155 5.609 1.00 . A A . 25 GLY CA 1 1 20 7893 1 1 25 GLY H H 9.290 2.164 4.831 1.00 . A A . 25 GLY H 1 1 20 7894 1 1 25 GLY HA2 H 11.523 1.723 4.655 1.00 . A A . 25 GLY HA2 1 1 20 7895 1 1 25 GLY HA3 H 11.885 2.997 5.800 1.00 . A A . 25 GLY HA3 1 1 20 7896 1 1 25 GLY N N 9.849 2.621 5.522 1.00 . A A . 25 GLY N 1 1 20 7897 1 1 25 GLY O O 10.394 0.703 7.332 1.00 . A A . 25 GLY O 1 1 20 7898 1 1 26 TRP C C 11.984 -1.464 7.761 1.00 . A A . 26 TRP C 1 1 20 7899 1 1 26 TRP CA C 12.919 -0.271 7.967 1.00 . A A . 26 TRP CA 1 1 20 7900 1 1 26 TRP CB C 12.809 0.341 9.365 1.00 . A A . 26 TRP CB 1 1 20 7901 1 1 26 TRP CD1 C 14.283 -1.499 10.415 1.00 . A A . 26 TRP CD1 1 1 20 7902 1 1 26 TRP CD2 C 12.864 -0.589 11.852 1.00 . A A . 26 TRP CD2 1 1 20 7903 1 1 26 TRP CE2 C 13.584 -1.549 12.534 1.00 . A A . 26 TRP CE2 1 1 20 7904 1 1 26 TRP CE3 C 11.872 0.175 12.492 1.00 . A A . 26 TRP CE3 1 1 20 7905 1 1 26 TRP CG C 13.323 -0.565 10.485 1.00 . A A . 26 TRP CG 1 1 20 7906 1 1 26 TRP CH2 C 12.406 -1.083 14.549 1.00 . A A . 26 TRP CH2 1 1 20 7907 1 1 26 TRP CZ2 C 13.389 -1.832 13.892 1.00 . A A . 26 TRP CZ2 1 1 20 7908 1 1 26 TRP CZ3 C 11.689 -0.121 13.848 1.00 . A A . 26 TRP CZ3 1 1 20 7909 1 1 26 TRP H H 13.417 1.055 6.438 1.00 . A A . 26 TRP H 1 1 20 7910 1 1 26 TRP HA H 13.956 -0.582 7.839 1.00 . A A . 26 TRP HA 1 1 20 7911 1 1 26 TRP HB3 H 11.765 0.588 9.562 1.00 . A A . 26 TRP HB3 1 1 20 7912 1 1 26 TRP HD1 H 14.842 -1.738 9.510 1.00 . A A . 26 TRP HD1 1 1 20 7913 1 1 26 TRP HE1 H 15.193 -2.911 11.848 1.00 . A A . 26 TRP HE1 1 1 20 7914 1 1 26 TRP HE3 H 11.289 0.938 11.975 1.00 . A A . 26 TRP HE3 1 1 20 7915 1 1 26 TRP HH2 H 12.204 -1.254 15.606 1.00 . A A . 26 TRP HH2 1 1 20 7916 1 1 26 TRP HZ2 H 13.971 -2.595 14.408 1.00 . A A . 26 TRP HZ2 1 1 20 7917 1 1 26 TRP HZ3 H 10.932 0.443 14.392 1.00 . A A . 26 TRP HZ3 1 1 20 7918 1 1 26 TRP N N 12.622 0.716 6.942 1.00 . A A . 26 TRP N 1 1 20 7919 1 1 26 TRP NE1 N 14.474 -2.119 11.632 1.00 . A A . 26 TRP NE1 1 1 20 7920 1 1 26 TRP O O 11.100 -1.712 8.580 1.00 . A A . 26 TRP O 1 1 stop_ save_
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