NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
576022 | 2mkb | 19765 | cing | 4-filtered-FRED | STAR | entry | full | 173 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mkb # This FRED archive file contains, for PDB entry <2mkb>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2mkb _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mkb _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 3110.56 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 $Protease_NS2_3 A . 1 1 stop_ save_ save_Protease_NS2_3 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Protease NS2 3" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code HAWYSHYVLKFFLLVFGENGVFFYK _Entity.Number_of_monomers 25 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 HIS . 1 1 2 ALA . 1 1 3 TRP . 1 1 4 TYR . 1 1 5 SER . 1 1 6 HIS . 1 1 7 TYR . 1 1 8 VAL . 1 1 9 LEU . 1 1 10 LYS . 1 1 11 PHE . 1 1 12 PHE . 1 1 13 LEU . 1 1 14 LEU . 1 1 15 VAL . 1 1 16 PHE . 1 1 17 GLY . 1 1 18 GLU . 1 1 19 ASN . 1 1 20 GLY . 1 1 21 VAL . 1 1 22 PHE . 1 1 23 PHE . 1 1 24 TYR . 1 1 25 LYS . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID HIS 1 1 1 1 ALA 2 2 1 1 TRP 3 3 1 1 TYR 4 4 1 1 SER 5 5 1 1 HIS 6 6 1 1 TYR 7 7 1 1 VAL 8 8 1 1 LEU 9 9 1 1 LYS 10 10 1 1 PHE 11 11 1 1 PHE 12 12 1 1 LEU 13 13 1 1 LEU 14 14 1 1 VAL 15 15 1 1 PHE 16 16 1 1 GLY 17 17 1 1 GLU 18 18 1 1 ASN 19 19 1 1 GLY 20 20 1 1 VAL 21 21 1 1 PHE 22 22 1 1 PHE 23 23 1 1 TYR 24 24 1 1 LYS 25 25 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 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 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 HIS HA . 1 . HA 1 1 1 1 2 1 1 2 ALA H . 2 . HN 1 1 2 1 1 1 1 1 HIS QB . 1 . HB# 1 1 2 1 2 1 1 2 ALA H . 2 . HN 1 1 3 1 1 1 1 2 ALA HA . 2 . HA 1 1 3 1 2 1 1 3 TRP H . 3 . HN 1 1 4 1 1 1 1 2 ALA MB . 2 . HB# 1 1 4 1 2 1 1 3 TRP H . 3 . HN 1 1 5 1 1 1 1 2 ALA MB . 2 . HB# 1 1 5 1 2 1 1 4 TYR QD . 4 . HD* 1 1 6 1 1 1 1 2 ALA MB . 2 . HB# 1 1 6 1 2 1 1 4 TYR QE . 4 . HE* 1 1 7 1 1 1 1 3 TRP H . 3 . HN 1 1 7 1 2 1 1 4 TYR H . 4 . HN 1 1 8 1 1 1 1 3 TRP HA . 3 . HA 1 1 8 1 2 1 1 4 TYR H . 4 . HN 1 1 9 1 1 1 1 3 TRP HA . 3 . HA 1 1 9 1 2 1 1 5 SER H . 5 . HN 1 1 10 1 1 1 1 3 TRP HA . 3 . HA 1 1 10 1 2 1 1 6 HIS H . 6 . HN 1 1 11 1 1 1 1 3 TRP HB2 . 3 . HB2 1 1 11 1 2 1 1 4 TYR H . 4 . HN 1 1 12 1 1 1 1 4 TYR H . 4 . HN 1 1 12 1 2 1 1 5 SER H . 5 . HN 1 1 13 1 1 1 1 4 TYR HA . 4 . HA 1 1 13 1 2 1 1 5 SER H . 5 . HN 1 1 14 1 1 1 1 4 TYR HA . 4 . HA 1 1 14 1 2 1 1 7 TYR H . 7 . HN 1 1 15 1 1 1 1 4 TYR HB2 . 4 . HB2 1 1 15 1 2 1 1 5 SER H . 5 . HN 1 1 16 1 1 1 1 4 TYR HB3 . 4 . HB1 1 1 16 1 2 1 1 5 SER H . 5 . HN 1 1 17 1 1 1 1 4 TYR QD . 4 . HD* 1 1 17 1 2 1 1 8 VAL MG1 . 8 . HG1# 1 1 18 1 1 1 1 4 TYR QE . 4 . HE* 1 1 18 1 2 1 1 8 VAL MG1 . 8 . HG1# 1 1 19 1 1 1 1 5 SER H . 5 . HN 1 1 19 1 2 1 1 6 HIS H . 6 . HN 1 1 20 1 1 1 1 5 SER HA . 5 . HA 1 1 20 1 2 1 1 6 HIS H . 6 . HN 1 1 21 1 1 1 1 5 SER HA . 5 . HA 1 1 21 1 2 1 1 7 TYR H . 7 . HN 1 1 22 1 1 1 1 5 SER HA . 5 . HA 1 1 22 1 2 1 1 8 VAL H . 8 . HN 1 1 23 1 1 1 1 5 SER HA . 5 . HA 1 1 23 1 2 1 1 8 VAL HB . 8 . HB 1 1 24 1 1 1 1 5 SER HA . 5 . HA 1 1 24 1 2 1 1 8 VAL MG1 . 8 . HG1# 1 1 25 1 1 1 1 5 SER HA . 5 . HA 1 1 25 1 2 1 1 8 VAL MG2 . 8 . HG2# 1 1 26 1 1 1 1 6 HIS H . 6 . HN 1 1 26 1 2 1 1 7 TYR H . 7 . HN 1 1 27 1 1 1 1 6 HIS HA . 6 . HA 1 1 27 1 2 1 1 7 TYR H . 7 . HN 1 1 28 1 1 1 1 6 HIS HA . 6 . HA 1 1 28 1 2 1 1 9 LEU H . 9 . HN 1 1 29 1 1 1 1 6 HIS HA . 6 . HA 1 1 29 1 2 1 1 9 LEU HB2 . 9 . HB2 1 1 30 1 1 1 1 6 HIS HA . 6 . HA 1 1 30 1 2 1 1 9 LEU HB3 . 9 . HB1 1 1 31 1 1 1 1 6 HIS HA . 6 . HA 1 1 31 1 2 1 1 9 LEU MD2 . 9 . HD2# 1 1 32 1 1 1 1 6 HIS HA . 6 . HA 1 1 32 1 2 1 1 10 LYS H . 10 . HN 1 1 33 1 1 1 1 6 HIS QB . 6 . HB# 1 1 33 1 2 1 1 7 TYR H . 7 . HN 1 1 34 1 1 1 1 7 TYR H . 7 . HN 1 1 34 1 2 1 1 8 VAL H . 8 . HN 1 1 35 1 1 1 1 7 TYR HA . 7 . HA 1 1 35 1 2 1 1 8 VAL H . 8 . HN 1 1 36 1 1 1 1 7 TYR HA . 7 . HA 1 1 36 1 2 1 1 9 LEU H . 9 . HN 1 1 37 1 1 1 1 7 TYR HA . 7 . HA 1 1 37 1 2 1 1 10 LYS H . 10 . HN 1 1 38 1 1 1 1 7 TYR HA . 7 . HA 1 1 38 1 2 1 1 10 LYS QB . 10 . HB# 1 1 39 1 1 1 1 7 TYR HB2 . 7 . HB2 1 1 39 1 2 1 1 8 VAL H . 8 . HN 1 1 40 1 1 1 1 7 TYR HB3 . 7 . HB1 1 1 40 1 2 1 1 8 VAL H . 8 . HN 1 1 41 1 1 1 1 8 VAL H . 8 . HN 1 1 41 1 2 1 1 9 LEU H . 9 . HN 1 1 42 1 1 1 1 8 VAL HA . 8 . HA 1 1 42 1 2 1 1 9 LEU H . 9 . HN 1 1 43 1 1 1 1 8 VAL HA . 8 . HA 1 1 43 1 2 1 1 10 LYS H . 10 . HN 1 1 44 1 1 1 1 8 VAL HA . 8 . HA 1 1 44 1 2 1 1 11 PHE H . 11 . HN 1 1 45 1 1 1 1 8 VAL HA . 8 . HA 1 1 45 1 2 1 1 11 PHE HB2 . 11 . HB2 1 1 46 1 1 1 1 8 VAL HA . 8 . HA 1 1 46 1 2 1 1 11 PHE HB3 . 11 . HB1 1 1 47 1 1 1 1 8 VAL HB . 8 . HB 1 1 47 1 2 1 1 9 LEU H . 9 . HN 1 1 48 1 1 1 1 8 VAL MG1 . 8 . HG1# 1 1 48 1 2 1 1 9 LEU H . 9 . HN 1 1 49 1 1 1 1 8 VAL MG1 . 8 . HG1# 1 1 49 1 2 1 1 12 PHE QD . 12 . HD* 1 1 50 1 1 1 1 8 VAL MG2 . 8 . HG2# 1 1 50 1 2 1 1 9 LEU H . 9 . HN 1 1 51 1 1 1 1 8 VAL MG2 . 8 . HG2# 1 1 51 1 2 1 1 11 PHE QD . 11 . HD* 1 1 52 1 1 1 1 8 VAL MG2 . 8 . HG2# 1 1 52 1 2 1 1 12 PHE QD . 12 . HD* 1 1 53 1 1 1 1 9 LEU H . 9 . HN 1 1 53 1 2 1 1 10 LYS H . 10 . HN 1 1 54 1 1 1 1 9 LEU HA . 9 . HA 1 1 54 1 2 1 1 10 LYS H . 10 . HN 1 1 55 1 1 1 1 9 LEU HA . 9 . HA 1 1 55 1 2 1 1 11 PHE H . 11 . HN 1 1 56 1 1 1 1 9 LEU HA . 9 . HA 1 1 56 1 2 1 1 12 PHE H . 12 . HN 1 1 57 1 1 1 1 9 LEU HA . 9 . HA 1 1 57 1 2 1 1 12 PHE QB . 12 . HB# 1 1 58 1 1 1 1 9 LEU HA . 9 . HA 1 1 58 1 2 1 1 13 LEU H . 13 . HN 1 1 59 1 1 1 1 9 LEU HB2 . 9 . HB2 1 1 59 1 2 1 1 10 LYS H . 10 . HN 1 1 60 1 1 1 1 9 LEU HB3 . 9 . HB1 1 1 60 1 2 1 1 10 LYS H . 10 . HN 1 1 61 1 1 1 1 10 LYS H . 10 . HN 1 1 61 1 2 1 1 11 PHE H . 11 . HN 1 1 62 1 1 1 1 10 LYS HA . 10 . HA 1 1 62 1 2 1 1 11 PHE H . 11 . HN 1 1 63 1 1 1 1 10 LYS HA . 10 . HA 1 1 63 1 2 1 1 12 PHE H . 12 . HN 1 1 64 1 1 1 1 10 LYS HA . 10 . HA 1 1 64 1 2 1 1 13 LEU H . 13 . HN 1 1 65 1 1 1 1 10 LYS HA . 10 . HA 1 1 65 1 2 1 1 13 LEU HB2 . 13 . HB2 1 1 66 1 1 1 1 10 LYS HA . 10 . HA 1 1 66 1 2 1 1 13 LEU HB3 . 13 . HB1 1 1 67 1 1 1 1 10 LYS HA . 10 . HA 1 1 67 1 2 1 1 14 LEU H . 14 . HN 1 1 68 1 1 1 1 10 LYS QB . 10 . HB# 1 1 68 1 2 1 1 11 PHE H . 11 . HN 1 1 69 1 1 1 1 11 PHE H . 11 . HN 1 1 69 1 2 1 1 12 PHE H . 12 . HN 1 1 70 1 1 1 1 11 PHE HA . 11 . HA 1 1 70 1 2 1 1 12 PHE H . 12 . HN 1 1 71 1 1 1 1 11 PHE HA . 11 . HA 1 1 71 1 2 1 1 13 LEU H . 13 . HN 1 1 72 1 1 1 1 11 PHE HA . 11 . HA 1 1 72 1 2 1 1 14 LEU H . 14 . HN 1 1 73 1 1 1 1 11 PHE HA . 11 . HA 1 1 73 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1 74 1 1 1 1 11 PHE HA . 11 . HA 1 1 74 1 2 1 1 14 LEU HB3 . 14 . HB1 1 1 75 1 1 1 1 11 PHE HA . 11 . HA 1 1 75 1 2 1 1 15 VAL H . 15 . HN 1 1 76 1 1 1 1 11 PHE HB2 . 11 . HB2 1 1 76 1 2 1 1 12 PHE H . 12 . HN 1 1 77 1 1 1 1 11 PHE HB3 . 11 . HB1 1 1 77 1 2 1 1 12 PHE H . 12 . HN 1 1 78 1 1 1 1 11 PHE QD . 11 . HD* 1 1 78 1 2 1 1 14 LEU MD1 . 14 . HD1# 1 1 79 1 1 1 1 11 PHE QD . 11 . HD* 1 1 79 1 2 1 1 14 LEU MD2 . 14 . HD2# 1 1 80 1 1 1 1 11 PHE QD . 11 . HD* 1 1 80 1 2 1 1 15 VAL MG1 . 15 . HG1# 1 1 81 1 1 1 1 11 PHE QD . 11 . HD* 1 1 81 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1 82 1 1 1 1 12 PHE H . 12 . HN 1 1 82 1 2 1 1 13 LEU H . 13 . HN 1 1 83 1 1 1 1 12 PHE HA . 12 . HA 1 1 83 1 2 1 1 13 LEU H . 13 . HN 1 1 84 1 1 1 1 12 PHE HA . 12 . HA 1 1 84 1 2 1 1 14 LEU H . 14 . HN 1 1 85 1 1 1 1 12 PHE HA . 12 . HA 1 1 85 1 2 1 1 15 VAL H . 15 . HN 1 1 86 1 1 1 1 12 PHE HA . 12 . HA 1 1 86 1 2 1 1 15 VAL HB . 15 . HB 1 1 87 1 1 1 1 12 PHE HA . 12 . HA 1 1 87 1 2 1 1 15 VAL MG1 . 15 . HG1# 1 1 88 1 1 1 1 12 PHE HA . 12 . HA 1 1 88 1 2 1 1 15 VAL MG2 . 15 . HG2# 1 1 89 1 1 1 1 12 PHE HA . 12 . HA 1 1 89 1 2 1 1 16 PHE H . 16 . HN 1 1 90 1 1 1 1 12 PHE QB . 12 . HB# 1 1 90 1 2 1 1 13 LEU H . 13 . HN 1 1 91 1 1 1 1 13 LEU H . 13 . HN 1 1 91 1 2 1 1 14 LEU H . 14 . HN 1 1 92 1 1 1 1 13 LEU H . 13 . HN 1 1 92 1 2 1 1 15 VAL H . 15 . HN 1 1 93 1 1 1 1 13 LEU HA . 13 . HA 1 1 93 1 2 1 1 14 LEU H . 14 . HN 1 1 94 1 1 1 1 13 LEU HA . 13 . HA 1 1 94 1 2 1 1 15 VAL H . 15 . HN 1 1 95 1 1 1 1 13 LEU HA . 13 . HA 1 1 95 1 2 1 1 16 PHE H . 16 . HN 1 1 96 1 1 1 1 13 LEU HA . 13 . HA 1 1 96 1 2 1 1 16 PHE HB2 . 16 . HB2 1 1 97 1 1 1 1 13 LEU HA . 13 . HA 1 1 97 1 2 1 1 16 PHE HB3 . 16 . HB1 1 1 98 1 1 1 1 13 LEU HA . 13 . HA 1 1 98 1 2 1 1 17 GLY H . 17 . HN 1 1 99 1 1 1 1 13 LEU HB2 . 13 . HB2 1 1 99 1 2 1 1 14 LEU H . 14 . HN 1 1 100 1 1 1 1 13 LEU HB3 . 13 . HB1 1 1 100 1 2 1 1 14 LEU H . 14 . HN 1 1 101 1 1 1 1 13 LEU QD . 13 . HD* 1 1 101 1 2 1 1 16 PHE QD . 16 . HD* 1 1 102 1 1 1 1 13 LEU HG . 13 . HG 1 1 102 1 2 1 1 14 LEU H . 14 . HN 1 1 103 1 1 1 1 14 LEU H . 14 . HN 1 1 103 1 2 1 1 15 VAL H . 15 . HN 1 1 104 1 1 1 1 14 LEU H . 14 . HN 1 1 104 1 2 1 1 16 PHE H . 16 . HN 1 1 105 1 1 1 1 14 LEU HA . 14 . HA 1 1 105 1 2 1 1 15 VAL H . 15 . HN 1 1 106 1 1 1 1 14 LEU HA . 14 . HA 1 1 106 1 2 1 1 17 GLY H . 17 . HN 1 1 107 1 1 1 1 14 LEU HA . 14 . HA 1 1 107 1 2 1 1 18 GLU H . 18 . HN 1 1 108 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 108 1 2 1 1 15 VAL H . 15 . HN 1 1 109 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 109 1 2 1 1 15 VAL H . 15 . HN 1 1 110 1 1 1 1 14 LEU MD1 . 14 . HD1# 1 1 110 1 2 1 1 15 VAL H . 15 . HN 1 1 111 1 1 1 1 14 LEU MD2 . 14 . HD2# 1 1 111 1 2 1 1 15 VAL H . 15 . HN 1 1 112 1 1 1 1 14 LEU HG . 14 . HG 1 1 112 1 2 1 1 15 VAL H . 15 . HN 1 1 113 1 1 1 1 15 VAL H . 15 . HN 1 1 113 1 2 1 1 16 PHE H . 16 . HN 1 1 114 1 1 1 1 15 VAL HA . 15 . HA 1 1 114 1 2 1 1 16 PHE H . 16 . HN 1 1 115 1 1 1 1 15 VAL HA . 15 . HA 1 1 115 1 2 1 1 17 GLY H . 17 . HN 1 1 116 1 1 1 1 15 VAL HA . 15 . HA 1 1 116 1 2 1 1 18 GLU H . 18 . HN 1 1 117 1 1 1 1 15 VAL HA . 15 . HA 1 1 117 1 2 1 1 18 GLU HB2 . 18 . HB2 1 1 118 1 1 1 1 15 VAL HA . 15 . HA 1 1 118 1 2 1 1 18 GLU HB3 . 18 . HB1 1 1 119 1 1 1 1 15 VAL HB . 15 . HB 1 1 119 1 2 1 1 16 PHE H . 16 . HN 1 1 120 1 1 1 1 15 VAL MG1 . 15 . HG1# 1 1 120 1 2 1 1 16 PHE H . 16 . HN 1 1 121 1 1 1 1 15 VAL MG2 . 15 . HG2# 1 1 121 1 2 1 1 16 PHE H . 16 . HN 1 1 122 1 1 1 1 15 VAL MG2 . 15 . HG2# 1 1 122 1 2 1 1 19 ASN HD21 . 19 . HD21 1 1 123 1 1 1 1 15 VAL MG2 . 15 . HG2# 1 1 123 1 2 1 1 19 ASN HD22 . 19 . HD22 1 1 124 1 1 1 1 16 PHE H . 16 . HN 1 1 124 1 2 1 1 17 GLY H . 17 . HN 1 1 125 1 1 1 1 16 PHE H . 16 . HN 1 1 125 1 2 1 1 18 GLU H . 18 . HN 1 1 126 1 1 1 1 16 PHE HA . 16 . HA 1 1 126 1 2 1 1 17 GLY H . 17 . HN 1 1 127 1 1 1 1 16 PHE HA . 16 . HA 1 1 127 1 2 1 1 18 GLU H . 18 . HN 1 1 128 1 1 1 1 16 PHE HA . 16 . HA 1 1 128 1 2 1 1 19 ASN HB2 . 19 . HB2 1 1 129 1 1 1 1 16 PHE HA . 16 . HA 1 1 129 1 2 1 1 19 ASN HB3 . 19 . HB1 1 1 130 1 1 1 1 16 PHE HA . 16 . HA 1 1 130 1 2 1 1 20 GLY H . 20 . HN 1 1 131 1 1 1 1 16 PHE HB2 . 16 . HB2 1 1 131 1 2 1 1 17 GLY H . 17 . HN 1 1 132 1 1 1 1 16 PHE HB3 . 16 . HB1 1 1 132 1 2 1 1 17 GLY H . 17 . HN 1 1 133 1 1 1 1 17 GLY H . 17 . HN 1 1 133 1 2 1 1 18 GLU H . 18 . HN 1 1 134 1 1 1 1 17 GLY QA . 17 . HA# 1 1 134 1 2 1 1 18 GLU H . 18 . HN 1 1 135 1 1 1 1 17 GLY QA . 17 . HA# 1 1 135 1 2 1 1 20 GLY H . 20 . HN 1 1 136 1 1 1 1 17 GLY QA . 17 . HA# 1 1 136 1 2 1 1 21 VAL H . 21 . HN 1 1 137 1 1 1 1 18 GLU H . 18 . HN 1 1 137 1 2 1 1 19 ASN H . 19 . HN 1 1 138 1 1 1 1 18 GLU HA . 18 . HA 1 1 138 1 2 1 1 19 ASN H . 19 . HN 1 1 139 1 1 1 1 18 GLU HA . 18 . HA 1 1 139 1 2 1 1 20 GLY H . 20 . HN 1 1 140 1 1 1 1 18 GLU HA . 18 . HA 1 1 140 1 2 1 1 21 VAL H . 21 . HN 1 1 141 1 1 1 1 18 GLU HB2 . 18 . HB2 1 1 141 1 2 1 1 19 ASN H . 19 . HN 1 1 142 1 1 1 1 18 GLU HB3 . 18 . HB1 1 1 142 1 2 1 1 19 ASN H . 19 . HN 1 1 143 1 1 1 1 18 GLU HG2 . 18 . HG2 1 1 143 1 2 1 1 19 ASN H . 19 . HN 1 1 144 1 1 1 1 18 GLU HG3 . 18 . HG1 1 1 144 1 2 1 1 19 ASN H . 19 . HN 1 1 145 1 1 1 1 19 ASN H . 19 . HN 1 1 145 1 2 1 1 20 GLY H . 20 . HN 1 1 146 1 1 1 1 19 ASN H . 19 . HN 1 1 146 1 2 1 1 21 VAL H . 21 . HN 1 1 147 1 1 1 1 19 ASN HA . 19 . HA 1 1 147 1 2 1 1 20 GLY H . 20 . HN 1 1 148 1 1 1 1 19 ASN HA . 19 . HA 1 1 148 1 2 1 1 22 PHE H . 22 . HN 1 1 149 1 1 1 1 19 ASN HB2 . 19 . HB2 1 1 149 1 2 1 1 20 GLY H . 20 . HN 1 1 150 1 1 1 1 19 ASN HB3 . 19 . HB1 1 1 150 1 2 1 1 20 GLY H . 20 . HN 1 1 151 1 1 1 1 20 GLY H . 20 . HN 1 1 151 1 2 1 1 21 VAL H . 21 . HN 1 1 152 1 1 1 1 20 GLY QA . 20 . HA# 1 1 152 1 2 1 1 21 VAL H . 21 . HN 1 1 153 1 1 1 1 20 GLY QA . 20 . HA# 1 1 153 1 2 1 1 22 PHE H . 22 . HN 1 1 154 1 1 1 1 20 GLY QA . 20 . HA# 1 1 154 1 2 1 1 23 PHE H . 23 . HN 1 1 155 1 1 1 1 21 VAL H . 21 . HN 1 1 155 1 2 1 1 22 PHE H . 22 . HN 1 1 156 1 1 1 1 21 VAL HA . 21 . HA 1 1 156 1 2 1 1 22 PHE H . 22 . HN 1 1 157 1 1 1 1 21 VAL HA . 21 . HA 1 1 157 1 2 1 1 23 PHE H . 23 . HN 1 1 158 1 1 1 1 21 VAL HA . 21 . HA 1 1 158 1 2 1 1 24 TYR HB2 . 24 . HB2 1 1 159 1 1 1 1 21 VAL HA . 21 . HA 1 1 159 1 2 1 1 24 TYR HB3 . 24 . HB1 1 1 160 1 1 1 1 21 VAL HB . 21 . HB 1 1 160 1 2 1 1 22 PHE H . 22 . HN 1 1 161 1 1 1 1 21 VAL MG1 . 21 . HG1# 1 1 161 1 2 1 1 22 PHE H . 22 . HN 1 1 162 1 1 1 1 21 VAL MG2 . 21 . HG2# 1 1 162 1 2 1 1 22 PHE H . 22 . HN 1 1 163 1 1 1 1 22 PHE H . 22 . HN 1 1 163 1 2 1 1 23 PHE H . 23 . HN 1 1 164 1 1 1 1 22 PHE HA . 22 . HA 1 1 164 1 2 1 1 23 PHE H . 23 . HN 1 1 165 1 1 1 1 22 PHE QB . 22 . HB# 1 1 165 1 2 1 1 23 PHE H . 23 . HN 1 1 166 1 1 1 1 23 PHE H . 23 . HN 1 1 166 1 2 1 1 24 TYR H . 24 . HN 1 1 167 1 1 1 1 23 PHE HA . 23 . HA 1 1 167 1 2 1 1 24 TYR H . 24 . HN 1 1 168 1 1 1 1 23 PHE HB2 . 23 . HB2 1 1 168 1 2 1 1 24 TYR H . 24 . HN 1 1 169 1 1 1 1 23 PHE HB3 . 23 . HB1 1 1 169 1 2 1 1 24 TYR H . 24 . HN 1 1 170 1 1 1 1 24 TYR H . 24 . HN 1 1 170 1 2 1 1 25 LYS H . 25 . HN 1 1 171 1 1 1 1 24 TYR HA . 24 . HA 1 1 171 1 2 1 1 25 LYS H . 25 . HN 1 1 172 1 1 1 1 24 TYR HB2 . 24 . HB2 1 1 172 1 2 1 1 25 LYS H . 25 . HN 1 1 173 1 1 1 1 24 TYR HB3 . 24 . HB1 1 1 173 1 2 1 1 25 LYS H . 25 . HN 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.9 1.8 4.3 1 1 2 1 . . . . . 5.0 1.8 6.5 1 1 3 1 . . . . . 2.8 1.8 3.1 1 1 4 1 . . . . . 2.8 1.8 4.1 1 1 5 1 . . . . . 5.0 1.8 8.5 1 1 6 1 . . . . . 5.0 1.8 8.5 1 1 7 1 . . . . . 3.9 1.8 4.3 1 1 8 1 . . . . . 3.9 1.8 4.3 1 1 9 1 . . . . . 5.0 1.8 5.5 1 1 10 1 . . . . . 5.0 1.8 5.5 1 1 11 1 . . . . . 5.0 1.8 5.5 1 1 12 1 . . . . . 2.8 1.8 3.1 1 1 13 1 . . . . . 2.8 1.8 3.1 1 1 14 1 . . . . . 3.9 1.8 4.3 1 1 15 1 . . . . . 5.0 1.8 5.5 1 1 16 1 . . . . . 5.0 1.8 5.5 1 1 17 1 . . . . . 3.9 1.8 7.3 1 1 18 1 . . . . . 5.0 1.8 8.5 1 1 19 1 . . . . . 3.9 1.8 4.3 1 1 20 1 . . . . . 2.8 1.8 3.1 1 1 21 1 . . . . . 5.0 1.8 5.5 1 1 22 1 . . . . . 3.9 1.8 4.3 1 1 23 1 . . . . . 3.9 1.8 4.3 1 1 24 1 . . . . . 5.0 1.8 6.5 1 1 25 1 . . . . . 5.0 1.8 6.5 1 1 26 1 . . . . . 3.9 1.8 4.3 1 1 27 1 . . . . . 2.8 1.8 3.1 1 1 28 1 . . . . . 2.8 1.8 3.1 1 1 29 1 . . . . . 5.0 1.8 5.5 1 1 30 1 . . . . . 2.8 1.8 3.1 1 1 31 1 . . . . . 5.0 1.8 6.5 1 1 32 1 . . . . . 5.0 1.8 5.5 1 1 33 1 . . . . . 3.9 1.8 5.3 1 1 34 1 . . . . . 3.9 1.8 4.3 1 1 35 1 . . . . . 2.8 1.8 3.1 1 1 36 1 . . . . . 5.0 1.8 5.5 1 1 37 1 . . . . . 2.8 1.8 3.1 1 1 38 1 . . . . . 2.8 1.8 4.1 1 1 39 1 . . . . . 2.8 1.8 3.1 1 1 40 1 . . . . . 3.9 1.8 4.3 1 1 41 1 . . . . . 3.9 1.8 4.3 1 1 42 1 . . . . . 2.8 1.8 3.1 1 1 43 1 . . . . . 5.0 1.8 5.5 1 1 44 1 . . . . . 3.9 1.8 4.3 1 1 45 1 . . . . . 5.0 1.8 5.5 1 1 46 1 . . . . . 2.8 1.8 3.1 1 1 47 1 . . . . . 3.9 1.8 4.3 1 1 48 1 . . . . . 5.0 1.8 6.5 1 1 49 1 . . . . . 5.0 1.8 8.5 1 1 50 1 . . . . . 5.0 1.8 6.5 1 1 51 1 . . . . . 5.0 1.8 8.5 1 1 52 1 . . . . . 2.8 1.8 6.1 1 1 53 1 . . . . . 2.8 1.8 3.1 1 1 54 1 . . . . . 3.9 1.8 4.3 1 1 55 1 . . . . . 5.0 1.8 5.5 1 1 56 1 . . . . . 5.0 1.8 5.5 1 1 57 1 . . . . . 2.8 1.8 4.1 1 1 58 1 . . . . . 5.0 1.8 5.5 1 1 59 1 . . . . . 3.9 1.8 4.3 1 1 60 1 . . . . . 2.8 1.8 3.1 1 1 61 1 . . . . . 2.8 1.8 3.1 1 1 62 1 . . . . . 3.9 1.8 4.3 1 1 63 1 . . . . . 5.0 1.8 5.5 1 1 64 1 . . . . . 5.0 1.8 5.5 1 1 65 1 . . . . . 3.9 1.8 4.3 1 1 66 1 . . . . . 2.8 1.8 3.1 1 1 67 1 . . . . . 3.9 1.8 4.3 1 1 68 1 . . . . . 2.8 1.8 4.1 1 1 69 1 . . . . . 2.8 1.8 3.1 1 1 70 1 . . . . . 5.0 1.8 5.5 1 1 71 1 . . . . . 5.0 1.8 5.5 1 1 72 1 . . . . . 3.9 1.8 4.3 1 1 73 1 . . . . . 2.8 1.8 3.1 1 1 74 1 . . . . . 2.8 1.8 3.1 1 1 75 1 . . . . . 5.0 1.8 5.5 1 1 76 1 . . . . . 5.0 1.8 5.5 1 1 77 1 . . . . . 3.9 1.8 4.3 1 1 78 1 . . . . . 5.0 1.8 8.5 1 1 79 1 . . . . . 5.0 1.8 8.5 1 1 80 1 . . . . . 3.9 1.8 7.3 1 1 81 1 . . . . . 5.0 1.8 8.5 1 1 82 1 . . . . . 2.8 1.8 3.1 1 1 83 1 . . . . . 3.9 1.8 4.3 1 1 84 1 . . . . . 5.0 1.8 5.5 1 1 85 1 . . . . . 3.9 1.8 4.3 1 1 86 1 . . . . . 2.8 1.8 3.1 1 1 87 1 . . . . . 5.0 1.8 6.5 1 1 88 1 . . . . . 5.0 1.8 6.5 1 1 89 1 . . . . . 3.9 1.8 4.3 1 1 90 1 . . . . . 2.8 1.8 4.1 1 1 91 1 . . . . . 2.8 1.8 3.1 1 1 92 1 . . . . . 5.0 1.8 5.5 1 1 93 1 . . . . . 5.0 1.8 5.5 1 1 94 1 . . . . . 5.0 1.8 5.5 1 1 95 1 . . . . . 3.9 1.8 4.3 1 1 96 1 . . . . . 5.0 1.8 5.5 1 1 97 1 . . . . . 5.0 1.8 5.5 1 1 98 1 . . . . . 3.9 1.8 4.3 1 1 99 1 . . . . . 5.0 1.8 5.5 1 1 100 1 . . . . . 2.8 1.8 3.1 1 1 101 1 . . . . . 5.0 1.8 9.9 1 1 102 1 . . . . . 5.0 1.8 5.5 1 1 103 1 . . . . . 3.9 1.8 4.3 1 1 104 1 . . . . . 5.0 1.8 5.5 1 1 105 1 . . . . . 2.8 1.8 3.1 1 1 106 1 . . . . . 3.9 1.8 4.3 1 1 107 1 . . . . . 5.0 1.8 5.5 1 1 108 1 . . . . . 3.9 1.8 4.3 1 1 109 1 . . . . . 3.9 1.8 4.3 1 1 110 1 . . . . . 5.0 1.8 6.5 1 1 111 1 . . . . . 5.0 1.8 6.5 1 1 112 1 . . . . . 5.0 1.8 5.5 1 1 113 1 . . . . . 2.8 1.8 3.1 1 1 114 1 . . . . . 3.9 1.8 4.3 1 1 115 1 . . . . . 5.0 1.8 5.5 1 1 116 1 . . . . . 5.0 1.8 5.5 1 1 117 1 . . . . . 5.0 1.8 5.5 1 1 118 1 . . . . . 5.0 1.8 5.5 1 1 119 1 . . . . . 2.8 1.8 3.1 1 1 120 1 . . . . . 5.0 1.8 6.5 1 1 121 1 . . . . . 5.0 1.8 6.5 1 1 122 1 . . . . . 5.0 1.8 6.5 1 1 123 1 . . . . . 5.0 1.8 6.5 1 1 124 1 . . . . . 2.8 1.8 3.1 1 1 125 1 . . . . . 5.0 1.8 5.5 1 1 126 1 . . . . . 3.9 1.8 4.3 1 1 127 1 . . . . . 5.0 1.8 5.5 1 1 128 1 . . . . . 5.0 1.8 5.5 1 1 129 1 . . . . . 5.0 1.8 5.5 1 1 130 1 . . . . . 5.0 1.8 5.5 1 1 131 1 . . . . . 3.9 1.8 4.3 1 1 132 1 . . . . . 2.8 1.8 3.1 1 1 133 1 . . . . . 3.9 1.8 4.3 1 1 134 1 . . . . . 2.8 1.8 4.1 1 1 135 1 . . . . . 2.8 1.8 4.1 1 1 136 1 . . . . . 2.8 1.8 4.1 1 1 137 1 . . . . . 3.9 1.8 4.3 1 1 138 1 . . . . . 2.8 1.8 3.1 1 1 139 1 . . . . . 5.0 1.8 5.5 1 1 140 1 . . . . . 2.8 1.8 3.1 1 1 141 1 . . . . . 3.9 1.8 4.3 1 1 142 1 . . . . . 3.9 1.8 4.3 1 1 143 1 . . . . . 5.0 1.8 5.5 1 1 144 1 . . . . . 5.0 1.8 5.5 1 1 145 1 . . . . . 2.8 1.8 3.1 1 1 146 1 . . . . . 5.0 1.8 5.5 1 1 147 1 . . . . . 2.8 1.8 3.1 1 1 148 1 . . . . . 5.0 1.8 5.5 1 1 149 1 . . . . . 3.9 1.8 4.3 1 1 150 1 . . . . . 5.0 1.8 5.5 1 1 151 1 . . . . . 2.8 1.8 3.1 1 1 152 1 . . . . . 2.8 1.8 4.1 1 1 153 1 . . . . . 3.9 1.8 5.3 1 1 154 1 . . . . . 5.0 1.8 6.5 1 1 155 1 . . . . . 5.0 1.8 5.5 1 1 156 1 . . . . . 2.8 1.8 3.1 1 1 157 1 . . . . . 3.9 1.8 4.3 1 1 158 1 . . . . . 5.0 1.8 5.5 1 1 159 1 . . . . . 3.9 1.8 4.3 1 1 160 1 . . . . . 2.8 1.8 3.1 1 1 161 1 . . . . . 5.0 1.8 6.5 1 1 162 1 . . . . . 5.0 1.8 6.5 1 1 163 1 . . . . . 2.8 1.8 3.1 1 1 164 1 . . . . . 2.8 1.8 3.1 1 1 165 1 . . . . . 3.9 1.8 5.3 1 1 166 1 . . . . . 2.8 1.8 3.1 1 1 167 1 . . . . . 2.8 1.8 3.1 1 1 168 1 . . . . . 3.9 1.8 4.3 1 1 169 1 . . . . . 3.9 1.8 4.3 1 1 170 1 . . . . . 2.8 1.8 3.1 1 1 171 1 . . . . . 2.8 1.8 3.1 1 1 172 1 . . . . . 3.9 1.8 4.3 1 1 173 1 . . . . . 3.9 1.8 4.3 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 HIS C C -19.403 1.199 4.648 1.00 . A A . 1 HIS C 1 1 1 2 1 1 1 HIS CA C -20.553 0.917 5.622 1.00 . A A . 1 HIS CA 1 1 1 3 1 1 1 HIS CB C -21.902 0.986 4.896 1.00 . A A . 1 HIS CB 1 1 1 4 1 1 1 HIS CD2 C -22.603 -1.545 4.788 1.00 . A A . 1 HIS CD2 1 1 1 5 1 1 1 HIS CE1 C -24.287 -1.466 6.149 1.00 . A A . 1 HIS CE1 1 1 1 6 1 1 1 HIS CG C -22.709 -0.244 5.214 1.00 . A A . 1 HIS CG 1 1 1 7 1 1 1 HIS HA H -20.430 -0.053 6.078 1.00 . A A . 1 HIS HA 1 1 1 8 1 1 1 HIS HB2 H -22.443 1.863 5.218 1.00 . A A . 1 HIS HB2 1 1 1 9 1 1 1 HIS HB3 H -21.735 1.039 3.830 1.00 . A A . 1 HIS HB3 1 1 1 10 1 1 1 HIS HD1 H -24.132 0.568 6.557 1.00 . A A . 1 HIS HD1 1 1 1 11 1 1 1 HIS HD2 H -21.859 -1.915 4.097 1.00 . A A . 1 HIS HD2 1 1 1 12 1 1 1 HIS HE1 H -25.138 -1.747 6.751 1.00 . A A . 1 HIS HE1 1 1 1 13 1 1 1 HIS N N -20.616 1.979 6.671 1.00 . A A . 1 HIS N 1 1 1 14 1 1 1 HIS ND1 N -23.791 -0.217 6.081 1.00 . A A . 1 HIS ND1 1 1 1 15 1 1 1 HIS NE2 N -23.600 -2.315 5.380 1.00 . A A . 1 HIS NE2 1 1 1 16 1 1 1 HIS O O -19.334 2.255 4.047 1.00 . A A . 1 HIS O 1 1 1 17 1 1 2 ALA C C -16.761 -0.880 3.128 1.00 . A A . 2 ALA C 1 1 1 18 1 1 2 ALA CA C -17.350 0.471 3.555 1.00 . A A . 2 ALA CA 1 1 1 19 1 1 2 ALA CB C -16.326 1.277 4.357 1.00 . A A . 2 ALA CB 1 1 1 20 1 1 2 ALA H H -18.577 -0.580 4.985 1.00 . A A . 2 ALA H 1 1 1 21 1 1 2 ALA HA H -17.666 1.033 2.691 1.00 . A A . 2 ALA HA 1 1 1 22 1 1 2 ALA HB1 H -15.408 1.350 3.796 1.00 . A A . 2 ALA HB1 1 1 1 23 1 1 2 ALA HB2 H -16.136 0.784 5.298 1.00 . A A . 2 ALA HB2 1 1 1 24 1 1 2 ALA HB3 H -16.714 2.268 4.542 1.00 . A A . 2 ALA HB3 1 1 1 25 1 1 2 ALA N N -18.500 0.262 4.488 1.00 . A A . 2 ALA N 1 1 1 26 1 1 2 ALA O O -16.124 -1.564 3.907 1.00 . A A . 2 ALA O 1 1 1 27 1 1 3 TRP C C -15.170 -2.362 0.558 1.00 . A A . 3 TRP C 1 1 1 28 1 1 3 TRP CA C -16.433 -2.574 1.408 1.00 . A A . 3 TRP CA 1 1 1 29 1 1 3 TRP CB C -17.556 -3.180 0.561 1.00 . A A . 3 TRP CB 1 1 1 30 1 1 3 TRP CD1 C -17.356 -5.690 0.768 1.00 . A A . 3 TRP CD1 1 1 1 31 1 1 3 TRP CD2 C -18.954 -4.839 2.104 1.00 . A A . 3 TRP CD2 1 1 1 32 1 1 3 TRP CE2 C -18.948 -6.237 2.318 1.00 . A A . 3 TRP CE2 1 1 1 33 1 1 3 TRP CE3 C -19.875 -4.060 2.829 1.00 . A A . 3 TRP CE3 1 1 1 34 1 1 3 TRP CG C -17.932 -4.516 1.115 1.00 . A A . 3 TRP CG 1 1 1 35 1 1 3 TRP CH2 C -20.733 -6.056 3.930 1.00 . A A . 3 TRP CH2 1 1 1 36 1 1 3 TRP CZ2 C -19.825 -6.843 3.219 1.00 . A A . 3 TRP CZ2 1 1 1 37 1 1 3 TRP CZ3 C -20.758 -4.667 3.737 1.00 . A A . 3 TRP CZ3 1 1 1 38 1 1 3 TRP H H -17.492 -0.696 1.288 1.00 . A A . 3 TRP H 1 1 1 39 1 1 3 TRP HA H -16.214 -3.222 2.242 1.00 . A A . 3 TRP HA 1 1 1 40 1 1 3 TRP HB2 H -18.416 -2.526 0.581 1.00 . A A . 3 TRP HB2 1 1 1 41 1 1 3 TRP HB3 H -17.217 -3.295 -0.458 1.00 . A A . 3 TRP HB3 1 1 1 42 1 1 3 TRP HD1 H -16.556 -5.810 0.051 1.00 . A A . 3 TRP HD1 1 1 1 43 1 1 3 TRP HE1 H -17.723 -7.660 1.414 1.00 . A A . 3 TRP HE1 1 1 1 44 1 1 3 TRP HE3 H -19.902 -2.990 2.688 1.00 . A A . 3 TRP HE3 1 1 1 45 1 1 3 TRP HH2 H -21.415 -6.516 4.630 1.00 . A A . 3 TRP HH2 1 1 1 46 1 1 3 TRP HZ2 H -19.801 -7.913 3.364 1.00 . A A . 3 TRP HZ2 1 1 1 47 1 1 3 TRP HZ3 H -21.461 -4.061 4.288 1.00 . A A . 3 TRP HZ3 1 1 1 48 1 1 3 TRP N N -16.974 -1.266 1.894 1.00 . A A . 3 TRP N 1 1 1 49 1 1 3 TRP NE1 N -17.957 -6.711 1.482 1.00 . A A . 3 TRP NE1 1 1 1 50 1 1 3 TRP O O -14.332 -3.240 0.457 1.00 . A A . 3 TRP O 1 1 1 51 1 1 4 TYR C C -12.791 -0.071 -0.150 1.00 . A A . 4 TYR C 1 1 1 52 1 1 4 TYR CA C -13.812 -0.952 -0.894 1.00 . A A . 4 TYR CA 1 1 1 53 1 1 4 TYR CB C -14.331 -0.256 -2.165 1.00 . A A . 4 TYR CB 1 1 1 54 1 1 4 TYR CD1 C -14.013 2.233 -1.842 1.00 . A A . 4 TYR CD1 1 1 1 55 1 1 4 TYR CD2 C -16.233 1.299 -1.563 1.00 . A A . 4 TYR CD2 1 1 1 56 1 1 4 TYR CE1 C -14.515 3.508 -1.556 1.00 . A A . 4 TYR CE1 1 1 1 57 1 1 4 TYR CE2 C -16.733 2.574 -1.276 1.00 . A A . 4 TYR CE2 1 1 1 58 1 1 4 TYR CG C -14.872 1.126 -1.845 1.00 . A A . 4 TYR CG 1 1 1 59 1 1 4 TYR CZ C -15.874 3.679 -1.273 1.00 . A A . 4 TYR CZ 1 1 1 60 1 1 4 TYR H H -15.708 -0.517 0.043 1.00 . A A . 4 TYR H 1 1 1 61 1 1 4 TYR HA H -13.353 -1.890 -1.161 1.00 . A A . 4 TYR HA 1 1 1 62 1 1 4 TYR HB2 H -13.522 -0.163 -2.874 1.00 . A A . 4 TYR HB2 1 1 1 63 1 1 4 TYR HB3 H -15.117 -0.854 -2.601 1.00 . A A . 4 TYR HB3 1 1 1 64 1 1 4 TYR HD1 H -12.963 2.103 -2.059 1.00 . A A . 4 TYR HD1 1 1 1 65 1 1 4 TYR HD2 H -16.898 0.447 -1.566 1.00 . A A . 4 TYR HD2 1 1 1 66 1 1 4 TYR HE1 H -13.851 4.361 -1.554 1.00 . A A . 4 TYR HE1 1 1 1 67 1 1 4 TYR HE2 H -17.783 2.706 -1.057 1.00 . A A . 4 TYR HE2 1 1 1 68 1 1 4 TYR HH H -16.535 5.384 -1.826 1.00 . A A . 4 TYR HH 1 1 1 69 1 1 4 TYR N N -15.024 -1.209 -0.052 1.00 . A A . 4 TYR N 1 1 1 70 1 1 4 TYR O O -11.857 0.436 -0.743 1.00 . A A . 4 TYR O 1 1 1 71 1 1 4 TYR OH O -16.369 4.937 -0.992 1.00 . A A . 4 TYR OH 1 1 1 72 1 1 5 SER C C -10.703 0.161 2.230 1.00 . A A . 5 SER C 1 1 1 73 1 1 5 SER CA C -11.984 0.947 1.915 1.00 . A A . 5 SER CA 1 1 1 74 1 1 5 SER CB C -12.716 1.315 3.206 1.00 . A A . 5 SER CB 1 1 1 75 1 1 5 SER H H -13.703 -0.321 1.601 1.00 . A A . 5 SER H 1 1 1 76 1 1 5 SER HA H -11.745 1.838 1.363 1.00 . A A . 5 SER HA 1 1 1 77 1 1 5 SER HB2 H -13.779 1.220 3.060 1.00 . A A . 5 SER HB2 1 1 1 78 1 1 5 SER HB3 H -12.404 0.650 3.999 1.00 . A A . 5 SER HB3 1 1 1 79 1 1 5 SER HG H -13.238 3.146 3.614 1.00 . A A . 5 SER HG 1 1 1 80 1 1 5 SER N N -12.951 0.104 1.141 1.00 . A A . 5 SER N 1 1 1 81 1 1 5 SER O O -9.663 0.738 2.490 1.00 . A A . 5 SER O 1 1 1 82 1 1 5 SER OG O -12.411 2.661 3.550 1.00 . A A . 5 SER OG 1 1 1 83 1 1 6 HIS C C -8.670 -2.085 1.256 1.00 . A A . 6 HIS C 1 1 1 84 1 1 6 HIS CA C -9.552 -1.966 2.502 1.00 . A A . 6 HIS CA 1 1 1 85 1 1 6 HIS CB C -10.076 -3.342 2.927 1.00 . A A . 6 HIS CB 1 1 1 86 1 1 6 HIS CD2 C -7.932 -4.042 4.281 1.00 . A A . 6 HIS CD2 1 1 1 87 1 1 6 HIS CE1 C -7.573 -5.959 3.337 1.00 . A A . 6 HIS CE1 1 1 1 88 1 1 6 HIS CG C -8.920 -4.215 3.342 1.00 . A A . 6 HIS CG 1 1 1 89 1 1 6 HIS H H -11.615 -1.588 1.995 1.00 . A A . 6 HIS H 1 1 1 90 1 1 6 HIS HA H -8.994 -1.522 3.306 1.00 . A A . 6 HIS HA 1 1 1 91 1 1 6 HIS HB2 H -10.758 -3.227 3.757 1.00 . A A . 6 HIS HB2 1 1 1 92 1 1 6 HIS HB3 H -10.593 -3.801 2.097 1.00 . A A . 6 HIS HB3 1 1 1 93 1 1 6 HIS HD1 H -9.200 -5.868 2.045 1.00 . A A . 6 HIS HD1 1 1 1 94 1 1 6 HIS HD2 H -7.831 -3.181 4.926 1.00 . A A . 6 HIS HD2 1 1 1 95 1 1 6 HIS HE1 H -7.140 -6.914 3.079 1.00 . A A . 6 HIS HE1 1 1 1 96 1 1 6 HIS N N -10.768 -1.147 2.207 1.00 . A A . 6 HIS N 1 1 1 97 1 1 6 HIS ND1 N -8.670 -5.445 2.754 1.00 . A A . 6 HIS ND1 1 1 1 98 1 1 6 HIS NE2 N -7.083 -5.144 4.276 1.00 . A A . 6 HIS NE2 1 1 1 99 1 1 6 HIS O O -7.471 -2.246 1.358 1.00 . A A . 6 HIS O 1 1 1 100 1 1 7 TYR C C -7.475 -0.924 -1.261 1.00 . A A . 7 TYR C 1 1 1 101 1 1 7 TYR CA C -8.430 -2.113 -1.163 1.00 . A A . 7 TYR CA 1 1 1 102 1 1 7 TYR CB C -9.431 -2.101 -2.326 1.00 . A A . 7 TYR CB 1 1 1 103 1 1 7 TYR CD1 C -9.754 -4.598 -2.104 1.00 . A A . 7 TYR CD1 1 1 1 104 1 1 7 TYR CD2 C -11.707 -3.183 -2.351 1.00 . A A . 7 TYR CD2 1 1 1 105 1 1 7 TYR CE1 C -10.579 -5.726 -2.040 1.00 . A A . 7 TYR CE1 1 1 1 106 1 1 7 TYR CE2 C -12.532 -4.312 -2.287 1.00 . A A . 7 TYR CE2 1 1 1 107 1 1 7 TYR CG C -10.318 -3.325 -2.258 1.00 . A A . 7 TYR CG 1 1 1 108 1 1 7 TYR CZ C -11.968 -5.583 -2.132 1.00 . A A . 7 TYR CZ 1 1 1 109 1 1 7 TYR H H -10.217 -1.871 0.029 1.00 . A A . 7 TYR H 1 1 1 110 1 1 7 TYR HA H -7.873 -3.031 -1.163 1.00 . A A . 7 TYR HA 1 1 1 111 1 1 7 TYR HB2 H -10.041 -1.212 -2.264 1.00 . A A . 7 TYR HB2 1 1 1 112 1 1 7 TYR HB3 H -8.892 -2.101 -3.262 1.00 . A A . 7 TYR HB3 1 1 1 113 1 1 7 TYR HD1 H -8.682 -4.709 -2.032 1.00 . A A . 7 TYR HD1 1 1 1 114 1 1 7 TYR HD2 H -12.141 -2.203 -2.470 1.00 . A A . 7 TYR HD2 1 1 1 115 1 1 7 TYR HE1 H -10.144 -6.708 -1.921 1.00 . A A . 7 TYR HE1 1 1 1 116 1 1 7 TYR HE2 H -13.604 -4.201 -2.357 1.00 . A A . 7 TYR HE2 1 1 1 117 1 1 7 TYR HH H -13.056 -6.813 -1.158 1.00 . A A . 7 TYR HH 1 1 1 118 1 1 7 TYR N N -9.249 -2.005 0.086 1.00 . A A . 7 TYR N 1 1 1 119 1 1 7 TYR O O -6.297 -1.085 -1.515 1.00 . A A . 7 TYR O 1 1 1 120 1 1 7 TYR OH O -12.780 -6.697 -2.070 1.00 . A A . 7 TYR OH 1 1 1 121 1 1 8 VAL C C -6.055 1.401 0.040 1.00 . A A . 8 VAL C 1 1 1 122 1 1 8 VAL CA C -7.089 1.469 -1.095 1.00 . A A . 8 VAL CA 1 1 1 123 1 1 8 VAL CB C -8.022 2.683 -0.938 1.00 . A A . 8 VAL CB 1 1 1 124 1 1 8 VAL CG1 C -8.655 2.694 0.457 1.00 . A A . 8 VAL CG1 1 1 1 125 1 1 8 VAL CG2 C -7.220 3.971 -1.139 1.00 . A A . 8 VAL CG2 1 1 1 126 1 1 8 VAL H H -8.923 0.360 -0.822 1.00 . A A . 8 VAL H 1 1 1 127 1 1 8 VAL HA H -6.587 1.512 -2.045 1.00 . A A . 8 VAL HA 1 1 1 128 1 1 8 VAL HB H -8.803 2.628 -1.683 1.00 . A A . 8 VAL HB 1 1 1 129 1 1 8 VAL HG11 H -9.266 3.580 0.566 1.00 . A A . 8 VAL HG11 1 1 1 130 1 1 8 VAL HG12 H -7.879 2.700 1.207 1.00 . A A . 8 VAL HG12 1 1 1 131 1 1 8 VAL HG13 H -9.272 1.817 0.580 1.00 . A A . 8 VAL HG13 1 1 1 132 1 1 8 VAL HG21 H -6.944 4.064 -2.180 1.00 . A A . 8 VAL HG21 1 1 1 133 1 1 8 VAL HG22 H -6.328 3.940 -0.532 1.00 . A A . 8 VAL HG22 1 1 1 134 1 1 8 VAL HG23 H -7.823 4.820 -0.851 1.00 . A A . 8 VAL HG23 1 1 1 135 1 1 8 VAL N N -7.973 0.265 -1.039 1.00 . A A . 8 VAL N 1 1 1 136 1 1 8 VAL O O -4.950 1.889 -0.088 1.00 . A A . 8 VAL O 1 1 1 137 1 1 9 LEU C C -4.463 -0.488 2.000 1.00 . A A . 9 LEU C 1 1 1 138 1 1 9 LEU CA C -5.447 0.656 2.278 1.00 . A A . 9 LEU CA 1 1 1 139 1 1 9 LEU CB C -6.313 0.341 3.506 1.00 . A A . 9 LEU CB 1 1 1 140 1 1 9 LEU CD1 C -4.372 0.838 5.018 1.00 . A A . 9 LEU CD1 1 1 1 141 1 1 9 LEU CD2 C -5.976 2.658 4.407 1.00 . A A . 9 LEU CD2 1 1 1 142 1 1 9 LEU CG C -5.837 1.162 4.713 1.00 . A A . 9 LEU CG 1 1 1 143 1 1 9 LEU H H -7.299 0.381 1.209 1.00 . A A . 9 LEU H 1 1 1 144 1 1 9 LEU HA H -4.916 1.582 2.424 1.00 . A A . 9 LEU HA 1 1 1 145 1 1 9 LEU HB2 H -7.343 0.586 3.291 1.00 . A A . 9 LEU HB2 1 1 1 146 1 1 9 LEU HB3 H -6.237 -0.710 3.739 1.00 . A A . 9 LEU HB3 1 1 1 147 1 1 9 LEU HD11 H -4.088 1.303 5.951 1.00 . A A . 9 LEU HD11 1 1 1 148 1 1 9 LEU HD12 H -3.746 1.215 4.223 1.00 . A A . 9 LEU HD12 1 1 1 149 1 1 9 LEU HD13 H -4.250 -0.232 5.097 1.00 . A A . 9 LEU HD13 1 1 1 150 1 1 9 LEU HD21 H -5.198 2.959 3.720 1.00 . A A . 9 LEU HD21 1 1 1 151 1 1 9 LEU HD22 H -5.884 3.222 5.323 1.00 . A A . 9 LEU HD22 1 1 1 152 1 1 9 LEU HD23 H -6.942 2.846 3.963 1.00 . A A . 9 LEU HD23 1 1 1 153 1 1 9 LEU HG H -6.444 0.914 5.573 1.00 . A A . 9 LEU HG 1 1 1 154 1 1 9 LEU N N -6.406 0.780 1.140 1.00 . A A . 9 LEU N 1 1 1 155 1 1 9 LEU O O -3.282 -0.377 2.269 1.00 . A A . 9 LEU O 1 1 1 156 1 1 10 LYS C C -3.085 -2.348 0.008 1.00 . A A . 10 LYS C 1 1 1 157 1 1 10 LYS CA C -4.033 -2.729 1.149 1.00 . A A . 10 LYS CA 1 1 1 158 1 1 10 LYS CB C -4.958 -3.879 0.732 1.00 . A A . 10 LYS CB 1 1 1 159 1 1 10 LYS CD C -3.825 -5.657 2.092 1.00 . A A . 10 LYS CD 1 1 1 160 1 1 10 LYS CE C -2.504 -6.431 2.073 1.00 . A A . 10 LYS CE 1 1 1 161 1 1 10 LYS CG C -4.164 -5.189 0.672 1.00 . A A . 10 LYS CG 1 1 1 162 1 1 10 LYS H H -5.899 -1.646 1.237 1.00 . A A . 10 LYS H 1 1 1 163 1 1 10 LYS HA H -3.470 -3.006 2.026 1.00 . A A . 10 LYS HA 1 1 1 164 1 1 10 LYS HB2 H -5.757 -3.976 1.454 1.00 . A A . 10 LYS HB2 1 1 1 165 1 1 10 LYS HB3 H -5.375 -3.670 -0.241 1.00 . A A . 10 LYS HB3 1 1 1 166 1 1 10 LYS HD2 H -3.733 -4.798 2.741 1.00 . A A . 10 LYS HD2 1 1 1 167 1 1 10 LYS HD3 H -4.613 -6.301 2.455 1.00 . A A . 10 LYS HD3 1 1 1 168 1 1 10 LYS HE2 H -2.562 -7.253 1.373 1.00 . A A . 10 LYS HE2 1 1 1 169 1 1 10 LYS HE3 H -1.688 -5.774 1.814 1.00 . A A . 10 LYS HE3 1 1 1 170 1 1 10 LYS HG2 H -4.756 -5.944 0.176 1.00 . A A . 10 LYS HG2 1 1 1 171 1 1 10 LYS HG3 H -3.249 -5.030 0.121 1.00 . A A . 10 LYS HG3 1 1 1 172 1 1 10 LYS HZ1 H -2.224 -6.139 4.119 1.00 . A A . 10 LYS HZ1 1 1 1 173 1 1 10 LYS HZ2 H -1.473 -7.535 3.508 1.00 . A A . 10 LYS HZ2 1 1 1 174 1 1 10 LYS HZ3 H -3.155 -7.505 3.737 1.00 . A A . 10 LYS HZ3 1 1 1 175 1 1 10 LYS N N -4.941 -1.583 1.454 1.00 . A A . 10 LYS N 1 1 1 176 1 1 10 LYS NZ N -2.326 -6.941 3.463 1.00 . A A . 10 LYS NZ 1 1 1 177 1 1 10 LYS O O -1.900 -2.614 0.065 1.00 . A A . 10 LYS O 1 1 1 178 1 1 11 PHE C C -1.706 -0.259 -1.674 1.00 . A A . 11 PHE C 1 1 1 179 1 1 11 PHE CA C -2.727 -1.295 -2.161 1.00 . A A . 11 PHE CA 1 1 1 180 1 1 11 PHE CB C -3.682 -0.680 -3.192 1.00 . A A . 11 PHE CB 1 1 1 181 1 1 11 PHE CD1 C -2.592 -1.052 -5.438 1.00 . A A . 11 PHE CD1 1 1 1 182 1 1 11 PHE CD2 C -2.479 1.154 -4.436 1.00 . A A . 11 PHE CD2 1 1 1 183 1 1 11 PHE CE1 C -1.867 -0.588 -6.541 1.00 . A A . 11 PHE CE1 1 1 1 184 1 1 11 PHE CE2 C -1.753 1.618 -5.540 1.00 . A A . 11 PHE CE2 1 1 1 185 1 1 11 PHE CG C -2.898 -0.181 -4.384 1.00 . A A . 11 PHE CG 1 1 1 186 1 1 11 PHE CZ C -1.447 0.747 -6.593 1.00 . A A . 11 PHE CZ 1 1 1 187 1 1 11 PHE H H -4.558 -1.502 -1.035 1.00 . A A . 11 PHE H 1 1 1 188 1 1 11 PHE HA H -2.223 -2.151 -2.584 1.00 . A A . 11 PHE HA 1 1 1 189 1 1 11 PHE HB2 H -4.390 -1.428 -3.515 1.00 . A A . 11 PHE HB2 1 1 1 190 1 1 11 PHE HB3 H -4.212 0.146 -2.741 1.00 . A A . 11 PHE HB3 1 1 1 191 1 1 11 PHE HD1 H -2.916 -2.081 -5.398 1.00 . A A . 11 PHE HD1 1 1 1 192 1 1 11 PHE HD2 H -2.714 1.827 -3.625 1.00 . A A . 11 PHE HD2 1 1 1 193 1 1 11 PHE HE1 H -1.631 -1.260 -7.353 1.00 . A A . 11 PHE HE1 1 1 1 194 1 1 11 PHE HE2 H -1.429 2.648 -5.580 1.00 . A A . 11 PHE HE2 1 1 1 195 1 1 11 PHE HZ H -0.888 1.105 -7.445 1.00 . A A . 11 PHE HZ 1 1 1 196 1 1 11 PHE N N -3.599 -1.713 -1.020 1.00 . A A . 11 PHE N 1 1 1 197 1 1 11 PHE O O -0.541 -0.319 -2.018 1.00 . A A . 11 PHE O 1 1 1 198 1 1 12 PHE C C -0.122 1.047 0.536 1.00 . A A . 12 PHE C 1 1 1 199 1 1 12 PHE CA C -1.190 1.716 -0.338 1.00 . A A . 12 PHE CA 1 1 1 200 1 1 12 PHE CB C -2.051 2.669 0.496 1.00 . A A . 12 PHE CB 1 1 1 201 1 1 12 PHE CD1 C -0.309 4.028 1.715 1.00 . A A . 12 PHE CD1 1 1 1 202 1 1 12 PHE CD2 C -1.601 5.092 -0.040 1.00 . A A . 12 PHE CD2 1 1 1 203 1 1 12 PHE CE1 C 0.385 5.225 1.931 1.00 . A A . 12 PHE CE1 1 1 1 204 1 1 12 PHE CE2 C -0.907 6.290 0.176 1.00 . A A . 12 PHE CE2 1 1 1 205 1 1 12 PHE CG C -1.302 3.962 0.729 1.00 . A A . 12 PHE CG 1 1 1 206 1 1 12 PHE CZ C 0.086 6.356 1.161 1.00 . A A . 12 PHE CZ 1 1 1 207 1 1 12 PHE H H -3.078 0.701 -0.595 1.00 . A A . 12 PHE H 1 1 1 208 1 1 12 PHE HA H -0.728 2.251 -1.153 1.00 . A A . 12 PHE HA 1 1 1 209 1 1 12 PHE HB2 H -2.970 2.879 -0.032 1.00 . A A . 12 PHE HB2 1 1 1 210 1 1 12 PHE HB3 H -2.280 2.211 1.447 1.00 . A A . 12 PHE HB3 1 1 1 211 1 1 12 PHE HD1 H -0.079 3.156 2.309 1.00 . A A . 12 PHE HD1 1 1 1 212 1 1 12 PHE HD2 H -2.367 5.042 -0.799 1.00 . A A . 12 PHE HD2 1 1 1 213 1 1 12 PHE HE1 H 1.152 5.276 2.691 1.00 . A A . 12 PHE HE1 1 1 1 214 1 1 12 PHE HE2 H -1.137 7.163 -0.417 1.00 . A A . 12 PHE HE2 1 1 1 215 1 1 12 PHE HZ H 0.621 7.279 1.327 1.00 . A A . 12 PHE HZ 1 1 1 216 1 1 12 PHE N N -2.135 0.682 -0.864 1.00 . A A . 12 PHE N 1 1 1 217 1 1 12 PHE O O 1.046 1.369 0.448 1.00 . A A . 12 PHE O 1 1 1 218 1 1 13 LEU C C 1.515 -1.329 1.381 1.00 . A A . 13 LEU C 1 1 1 219 1 1 13 LEU CA C 0.480 -0.590 2.244 1.00 . A A . 13 LEU CA 1 1 1 220 1 1 13 LEU CB C -0.341 -1.586 3.069 1.00 . A A . 13 LEU CB 1 1 1 221 1 1 13 LEU CD1 C 0.063 -1.298 5.520 1.00 . A A . 13 LEU CD1 1 1 1 222 1 1 13 LEU CD2 C 0.246 -3.563 4.483 1.00 . A A . 13 LEU CD2 1 1 1 223 1 1 13 LEU CG C 0.484 -2.066 4.267 1.00 . A A . 13 LEU CG 1 1 1 224 1 1 13 LEU H H -1.464 -0.135 1.415 1.00 . A A . 13 LEU H 1 1 1 225 1 1 13 LEU HA H 0.969 0.116 2.896 1.00 . A A . 13 LEU HA 1 1 1 226 1 1 13 LEU HB2 H -1.242 -1.104 3.421 1.00 . A A . 13 LEU HB2 1 1 1 227 1 1 13 LEU HB3 H -0.604 -2.433 2.452 1.00 . A A . 13 LEU HB3 1 1 1 228 1 1 13 LEU HD11 H 0.665 -1.618 6.359 1.00 . A A . 13 LEU HD11 1 1 1 229 1 1 13 LEU HD12 H -0.979 -1.494 5.731 1.00 . A A . 13 LEU HD12 1 1 1 230 1 1 13 LEU HD13 H 0.204 -0.240 5.359 1.00 . A A . 13 LEU HD13 1 1 1 231 1 1 13 LEU HD21 H 0.893 -3.919 5.270 1.00 . A A . 13 LEU HD21 1 1 1 232 1 1 13 LEU HD22 H 0.462 -4.097 3.570 1.00 . A A . 13 LEU HD22 1 1 1 233 1 1 13 LEU HD23 H -0.784 -3.726 4.762 1.00 . A A . 13 LEU HD23 1 1 1 234 1 1 13 LEU HG H 1.533 -1.891 4.074 1.00 . A A . 13 LEU HG 1 1 1 235 1 1 13 LEU N N -0.514 0.111 1.370 1.00 . A A . 13 LEU N 1 1 1 236 1 1 13 LEU O O 2.673 -1.423 1.738 1.00 . A A . 13 LEU O 1 1 1 237 1 1 14 LEU C C 3.025 -1.591 -1.307 1.00 . A A . 14 LEU C 1 1 1 238 1 1 14 LEU CA C 2.053 -2.577 -0.645 1.00 . A A . 14 LEU CA 1 1 1 239 1 1 14 LEU CB C 1.172 -3.254 -1.703 1.00 . A A . 14 LEU CB 1 1 1 240 1 1 14 LEU CD1 C 1.030 -5.558 -2.671 1.00 . A A . 14 LEU CD1 1 1 1 241 1 1 14 LEU CD2 C 2.538 -3.860 -3.709 1.00 . A A . 14 LEU CD2 1 1 1 242 1 1 14 LEU CG C 1.960 -4.376 -2.389 1.00 . A A . 14 LEU CG 1 1 1 243 1 1 14 LEU H H 0.160 -1.754 -0.016 1.00 . A A . 14 LEU H 1 1 1 244 1 1 14 LEU HA H 2.596 -3.318 -0.088 1.00 . A A . 14 LEU HA 1 1 1 245 1 1 14 LEU HB2 H 0.293 -3.667 -1.228 1.00 . A A . 14 LEU HB2 1 1 1 246 1 1 14 LEU HB3 H 0.872 -2.525 -2.441 1.00 . A A . 14 LEU HB3 1 1 1 247 1 1 14 LEU HD11 H 0.540 -5.858 -1.756 1.00 . A A . 14 LEU HD11 1 1 1 248 1 1 14 LEU HD12 H 1.608 -6.385 -3.056 1.00 . A A . 14 LEU HD12 1 1 1 249 1 1 14 LEU HD13 H 0.288 -5.267 -3.400 1.00 . A A . 14 LEU HD13 1 1 1 250 1 1 14 LEU HD21 H 1.740 -3.725 -4.425 1.00 . A A . 14 LEU HD21 1 1 1 251 1 1 14 LEU HD22 H 3.249 -4.575 -4.094 1.00 . A A . 14 LEU HD22 1 1 1 252 1 1 14 LEU HD23 H 3.034 -2.915 -3.541 1.00 . A A . 14 LEU HD23 1 1 1 253 1 1 14 LEU HG H 2.765 -4.698 -1.743 1.00 . A A . 14 LEU HG 1 1 1 254 1 1 14 LEU N N 1.101 -1.848 0.248 1.00 . A A . 14 LEU N 1 1 1 255 1 1 14 LEU O O 4.215 -1.832 -1.377 1.00 . A A . 14 LEU O 1 1 1 256 1 1 15 VAL C C 4.212 1.294 -1.399 1.00 . A A . 15 VAL C 1 1 1 257 1 1 15 VAL CA C 3.398 0.529 -2.453 1.00 . A A . 15 VAL CA 1 1 1 258 1 1 15 VAL CB C 2.437 1.470 -3.194 1.00 . A A . 15 VAL CB 1 1 1 259 1 1 15 VAL CG1 C 3.217 2.640 -3.800 1.00 . A A . 15 VAL CG1 1 1 1 260 1 1 15 VAL CG2 C 1.736 0.698 -4.317 1.00 . A A . 15 VAL CG2 1 1 1 261 1 1 15 VAL H H 1.555 -0.325 -1.714 1.00 . A A . 15 VAL H 1 1 1 262 1 1 15 VAL HA H 4.058 0.048 -3.157 1.00 . A A . 15 VAL HA 1 1 1 263 1 1 15 VAL HB H 1.700 1.849 -2.501 1.00 . A A . 15 VAL HB 1 1 1 264 1 1 15 VAL HG11 H 3.374 3.397 -3.045 1.00 . A A . 15 VAL HG11 1 1 1 265 1 1 15 VAL HG12 H 2.654 3.062 -4.620 1.00 . A A . 15 VAL HG12 1 1 1 266 1 1 15 VAL HG13 H 4.172 2.288 -4.162 1.00 . A A . 15 VAL HG13 1 1 1 267 1 1 15 VAL HG21 H 2.464 0.122 -4.868 1.00 . A A . 15 VAL HG21 1 1 1 268 1 1 15 VAL HG22 H 1.251 1.397 -4.984 1.00 . A A . 15 VAL HG22 1 1 1 269 1 1 15 VAL HG23 H 0.998 0.035 -3.892 1.00 . A A . 15 VAL HG23 1 1 1 270 1 1 15 VAL N N 2.518 -0.487 -1.789 1.00 . A A . 15 VAL N 1 1 1 271 1 1 15 VAL O O 5.404 1.494 -1.549 1.00 . A A . 15 VAL O 1 1 1 272 1 1 16 PHE C C 5.310 1.521 1.437 1.00 . A A . 16 PHE C 1 1 1 273 1 1 16 PHE CA C 4.314 2.456 0.738 1.00 . A A . 16 PHE CA 1 1 1 274 1 1 16 PHE CB C 3.231 2.924 1.718 1.00 . A A . 16 PHE CB 1 1 1 275 1 1 16 PHE CD1 C 3.901 5.322 2.123 1.00 . A A . 16 PHE CD1 1 1 1 276 1 1 16 PHE CD2 C 4.173 3.715 3.917 1.00 . A A . 16 PHE CD2 1 1 1 277 1 1 16 PHE CE1 C 4.409 6.332 2.948 1.00 . A A . 16 PHE CE1 1 1 1 278 1 1 16 PHE CE2 C 4.682 4.724 4.744 1.00 . A A . 16 PHE CE2 1 1 1 279 1 1 16 PHE CG C 3.782 4.014 2.607 1.00 . A A . 16 PHE CG 1 1 1 280 1 1 16 PHE CZ C 4.800 6.033 4.260 1.00 . A A . 16 PHE CZ 1 1 1 281 1 1 16 PHE H H 2.619 1.532 -0.231 1.00 . A A . 16 PHE H 1 1 1 282 1 1 16 PHE HA H 4.826 3.308 0.320 1.00 . A A . 16 PHE HA 1 1 1 283 1 1 16 PHE HB2 H 2.387 3.307 1.163 1.00 . A A . 16 PHE HB2 1 1 1 284 1 1 16 PHE HB3 H 2.913 2.091 2.326 1.00 . A A . 16 PHE HB3 1 1 1 285 1 1 16 PHE HD1 H 3.599 5.553 1.111 1.00 . A A . 16 PHE HD1 1 1 1 286 1 1 16 PHE HD2 H 4.084 2.706 4.291 1.00 . A A . 16 PHE HD2 1 1 1 287 1 1 16 PHE HE1 H 4.500 7.341 2.575 1.00 . A A . 16 PHE HE1 1 1 1 288 1 1 16 PHE HE2 H 4.983 4.494 5.755 1.00 . A A . 16 PHE HE2 1 1 1 289 1 1 16 PHE HZ H 5.192 6.812 4.897 1.00 . A A . 16 PHE HZ 1 1 1 290 1 1 16 PHE N N 3.579 1.714 -0.332 1.00 . A A . 16 PHE N 1 1 1 291 1 1 16 PHE O O 6.385 1.932 1.829 1.00 . A A . 16 PHE O 1 1 1 292 1 1 17 GLY C C 7.153 -0.863 1.410 1.00 . A A . 17 GLY C 1 1 1 293 1 1 17 GLY CA C 5.881 -0.708 2.249 1.00 . A A . 17 GLY CA 1 1 1 294 1 1 17 GLY H H 4.088 -0.044 1.256 1.00 . A A . 17 GLY H 1 1 1 295 1 1 17 GLY HA2 H 6.142 -0.343 3.232 1.00 . A A . 17 GLY HA2 1 1 1 296 1 1 17 GLY HA3 H 5.394 -1.666 2.336 1.00 . A A . 17 GLY HA3 1 1 1 297 1 1 17 GLY N N 4.960 0.263 1.586 1.00 . A A . 17 GLY N 1 1 1 298 1 1 17 GLY O O 8.251 -0.783 1.924 1.00 . A A . 17 GLY O 1 1 1 299 1 1 18 GLU C C 9.087 0.035 -0.688 1.00 . A A . 18 GLU C 1 1 1 300 1 1 18 GLU CA C 8.222 -1.230 -0.749 1.00 . A A . 18 GLU CA 1 1 1 301 1 1 18 GLU CB C 7.678 -1.447 -2.165 1.00 . A A . 18 GLU CB 1 1 1 302 1 1 18 GLU CD C 9.378 -1.439 -4.009 1.00 . A A . 18 GLU CD 1 1 1 303 1 1 18 GLU CG C 8.659 -2.307 -2.971 1.00 . A A . 18 GLU CG 1 1 1 304 1 1 18 GLU H H 6.115 -1.133 -0.270 1.00 . A A . 18 GLU H 1 1 1 305 1 1 18 GLU HA H 8.795 -2.084 -0.440 1.00 . A A . 18 GLU HA 1 1 1 306 1 1 18 GLU HB2 H 6.723 -1.950 -2.110 1.00 . A A . 18 GLU HB2 1 1 1 307 1 1 18 GLU HB3 H 7.554 -0.493 -2.654 1.00 . A A . 18 GLU HB3 1 1 1 308 1 1 18 GLU HG2 H 9.387 -2.745 -2.302 1.00 . A A . 18 GLU HG2 1 1 1 309 1 1 18 GLU HG3 H 8.117 -3.093 -3.476 1.00 . A A . 18 GLU HG3 1 1 1 310 1 1 18 GLU N N 7.013 -1.077 0.123 1.00 . A A . 18 GLU N 1 1 1 311 1 1 18 GLU O O 10.296 -0.030 -0.752 1.00 . A A . 18 GLU O 1 1 1 312 1 1 18 GLU OE1 O 8.700 -0.864 -4.845 1.00 . A A . 18 GLU OE1 1 1 1 313 1 1 18 GLU OE2 O 10.593 -1.366 -3.950 1.00 . A A . 18 GLU OE2 1 1 1 314 1 1 19 ASN C C 10.169 2.427 0.769 1.00 . A A . 19 ASN C 1 1 1 315 1 1 19 ASN CA C 9.251 2.456 -0.458 1.00 . A A . 19 ASN CA 1 1 1 316 1 1 19 ASN CB C 8.207 3.568 -0.315 1.00 . A A . 19 ASN CB 1 1 1 317 1 1 19 ASN CG C 7.965 4.223 -1.675 1.00 . A A . 19 ASN CG 1 1 1 318 1 1 19 ASN H H 7.493 1.201 -0.482 1.00 . A A . 19 ASN H 1 1 1 319 1 1 19 ASN HA H 9.828 2.603 -1.353 1.00 . A A . 19 ASN HA 1 1 1 320 1 1 19 ASN HB2 H 7.281 3.149 0.052 1.00 . A A . 19 ASN HB2 1 1 1 321 1 1 19 ASN HB3 H 8.566 4.312 0.381 1.00 . A A . 19 ASN HB3 1 1 1 322 1 1 19 ASN HD21 H 6.317 3.177 -2.047 1.00 . A A . 19 ASN HD21 1 1 1 323 1 1 19 ASN HD22 H 6.768 4.278 -3.258 1.00 . A A . 19 ASN HD22 1 1 1 324 1 1 19 ASN N N 8.469 1.181 -0.544 1.00 . A A . 19 ASN N 1 1 1 325 1 1 19 ASN ND2 N 6.931 3.863 -2.386 1.00 . A A . 19 ASN ND2 1 1 1 326 1 1 19 ASN O O 11.266 2.951 0.747 1.00 . A A . 19 ASN O 1 1 1 327 1 1 19 ASN OD1 O 8.725 5.072 -2.097 1.00 . A A . 19 ASN OD1 1 1 1 328 1 1 20 GLY C C 11.448 0.484 3.012 1.00 . A A . 20 GLY C 1 1 1 329 1 1 20 GLY CA C 10.559 1.732 3.068 1.00 . A A . 20 GLY CA 1 1 1 330 1 1 20 GLY H H 8.838 1.396 1.819 1.00 . A A . 20 GLY H 1 1 1 331 1 1 20 GLY HA2 H 11.180 2.614 3.138 1.00 . A A . 20 GLY HA2 1 1 1 332 1 1 20 GLY HA3 H 9.917 1.673 3.934 1.00 . A A . 20 GLY HA3 1 1 1 333 1 1 20 GLY N N 9.725 1.811 1.834 1.00 . A A . 20 GLY N 1 1 1 334 1 1 20 GLY O O 12.601 0.524 3.396 1.00 . A A . 20 GLY O 1 1 1 335 1 1 21 VAL C C 12.864 -1.730 1.419 1.00 . A A . 21 VAL C 1 1 1 336 1 1 21 VAL CA C 11.742 -1.875 2.459 1.00 . A A . 21 VAL CA 1 1 1 337 1 1 21 VAL CB C 10.758 -2.982 2.052 1.00 . A A . 21 VAL CB 1 1 1 338 1 1 21 VAL CG1 C 11.523 -4.276 1.756 1.00 . A A . 21 VAL CG1 1 1 1 339 1 1 21 VAL CG2 C 9.770 -3.232 3.196 1.00 . A A . 21 VAL CG2 1 1 1 340 1 1 21 VAL H H 9.986 -0.629 2.231 1.00 . A A . 21 VAL H 1 1 1 341 1 1 21 VAL HA H 12.163 -2.099 3.423 1.00 . A A . 21 VAL HA 1 1 1 342 1 1 21 VAL HB H 10.217 -2.675 1.169 1.00 . A A . 21 VAL HB 1 1 1 343 1 1 21 VAL HG11 H 10.821 -5.089 1.636 1.00 . A A . 21 VAL HG11 1 1 1 344 1 1 21 VAL HG12 H 12.191 -4.495 2.577 1.00 . A A . 21 VAL HG12 1 1 1 345 1 1 21 VAL HG13 H 12.094 -4.158 0.848 1.00 . A A . 21 VAL HG13 1 1 1 346 1 1 21 VAL HG21 H 10.255 -3.809 3.971 1.00 . A A . 21 VAL HG21 1 1 1 347 1 1 21 VAL HG22 H 8.917 -3.778 2.821 1.00 . A A . 21 VAL HG22 1 1 1 348 1 1 21 VAL HG23 H 9.442 -2.287 3.603 1.00 . A A . 21 VAL HG23 1 1 1 349 1 1 21 VAL N N 10.921 -0.622 2.537 1.00 . A A . 21 VAL N 1 1 1 350 1 1 21 VAL O O 13.898 -2.359 1.526 1.00 . A A . 21 VAL O 1 1 1 351 1 1 22 PHE C C 14.545 0.562 -0.341 1.00 . A A . 22 PHE C 1 1 1 352 1 1 22 PHE CA C 13.734 -0.716 -0.615 1.00 . A A . 22 PHE CA 1 1 1 353 1 1 22 PHE CB C 12.975 -0.602 -1.941 1.00 . A A . 22 PHE CB 1 1 1 354 1 1 22 PHE CD1 C 13.877 -2.585 -3.210 1.00 . A A . 22 PHE CD1 1 1 1 355 1 1 22 PHE CD2 C 14.507 -0.357 -3.929 1.00 . A A . 22 PHE CD2 1 1 1 356 1 1 22 PHE CE1 C 14.647 -3.137 -4.240 1.00 . A A . 22 PHE CE1 1 1 1 357 1 1 22 PHE CE2 C 15.278 -0.909 -4.959 1.00 . A A . 22 PHE CE2 1 1 1 358 1 1 22 PHE CG C 13.807 -1.196 -3.054 1.00 . A A . 22 PHE CG 1 1 1 359 1 1 22 PHE CZ C 15.348 -2.298 -5.115 1.00 . A A . 22 PHE CZ 1 1 1 360 1 1 22 PHE H H 11.833 -0.402 0.361 1.00 . A A . 22 PHE H 1 1 1 361 1 1 22 PHE HA H 14.386 -1.574 -0.640 1.00 . A A . 22 PHE HA 1 1 1 362 1 1 22 PHE HB2 H 12.040 -1.137 -1.868 1.00 . A A . 22 PHE HB2 1 1 1 363 1 1 22 PHE HB3 H 12.778 0.438 -2.155 1.00 . A A . 22 PHE HB3 1 1 1 364 1 1 22 PHE HD1 H 13.337 -3.233 -2.534 1.00 . A A . 22 PHE HD1 1 1 1 365 1 1 22 PHE HD2 H 14.453 0.714 -3.808 1.00 . A A . 22 PHE HD2 1 1 1 366 1 1 22 PHE HE1 H 14.702 -4.208 -4.359 1.00 . A A . 22 PHE HE1 1 1 1 367 1 1 22 PHE HE2 H 15.818 -0.261 -5.635 1.00 . A A . 22 PHE HE2 1 1 1 368 1 1 22 PHE HZ H 15.943 -2.722 -5.910 1.00 . A A . 22 PHE HZ 1 1 1 369 1 1 22 PHE N N 12.672 -0.903 0.423 1.00 . A A . 22 PHE N 1 1 1 370 1 1 22 PHE O O 15.125 1.139 -1.242 1.00 . A A . 22 PHE O 1 1 1 371 1 1 23 PHE C C 15.714 2.269 2.727 1.00 . A A . 23 PHE C 1 1 1 372 1 1 23 PHE CA C 15.373 2.241 1.229 1.00 . A A . 23 PHE CA 1 1 1 373 1 1 23 PHE CB C 14.441 3.401 0.863 1.00 . A A . 23 PHE CB 1 1 1 374 1 1 23 PHE CD1 C 15.970 5.354 0.411 1.00 . A A . 23 PHE CD1 1 1 1 375 1 1 23 PHE CD2 C 14.979 4.190 -1.471 1.00 . A A . 23 PHE CD2 1 1 1 376 1 1 23 PHE CE1 C 16.626 6.222 -0.471 1.00 . A A . 23 PHE CE1 1 1 1 377 1 1 23 PHE CE2 C 15.634 5.058 -2.352 1.00 . A A . 23 PHE CE2 1 1 1 378 1 1 23 PHE CG C 15.148 4.338 -0.089 1.00 . A A . 23 PHE CG 1 1 1 379 1 1 23 PHE CZ C 16.457 6.074 -1.852 1.00 . A A . 23 PHE CZ 1 1 1 380 1 1 23 PHE H H 14.125 0.523 1.607 1.00 . A A . 23 PHE H 1 1 1 381 1 1 23 PHE HA H 16.273 2.289 0.637 1.00 . A A . 23 PHE HA 1 1 1 382 1 1 23 PHE HB2 H 13.553 3.011 0.389 1.00 . A A . 23 PHE HB2 1 1 1 383 1 1 23 PHE HB3 H 14.163 3.939 1.757 1.00 . A A . 23 PHE HB3 1 1 1 384 1 1 23 PHE HD1 H 16.100 5.468 1.478 1.00 . A A . 23 PHE HD1 1 1 1 385 1 1 23 PHE HD2 H 14.344 3.407 -1.857 1.00 . A A . 23 PHE HD2 1 1 1 386 1 1 23 PHE HE1 H 17.261 7.005 -0.085 1.00 . A A . 23 PHE HE1 1 1 1 387 1 1 23 PHE HE2 H 15.504 4.944 -3.419 1.00 . A A . 23 PHE HE2 1 1 1 388 1 1 23 PHE HZ H 16.963 6.743 -2.533 1.00 . A A . 23 PHE HZ 1 1 1 389 1 1 23 PHE N N 14.595 1.005 0.896 1.00 . A A . 23 PHE N 1 1 1 390 1 1 23 PHE O O 15.571 3.282 3.389 1.00 . A A . 23 PHE O 1 1 1 391 1 1 24 TYR C C 17.894 0.464 4.927 1.00 . A A . 24 TYR C 1 1 1 392 1 1 24 TYR CA C 16.513 1.112 4.720 1.00 . A A . 24 TYR CA 1 1 1 393 1 1 24 TYR CB C 15.409 0.258 5.352 1.00 . A A . 24 TYR CB 1 1 1 394 1 1 24 TYR CD1 C 14.353 2.108 6.704 1.00 . A A . 24 TYR CD1 1 1 1 395 1 1 24 TYR CD2 C 15.247 0.176 7.866 1.00 . A A . 24 TYR CD2 1 1 1 396 1 1 24 TYR CE1 C 13.966 2.666 7.929 1.00 . A A . 24 TYR CE1 1 1 1 397 1 1 24 TYR CE2 C 14.860 0.734 9.091 1.00 . A A . 24 TYR CE2 1 1 1 398 1 1 24 TYR CG C 14.993 0.862 6.673 1.00 . A A . 24 TYR CG 1 1 1 399 1 1 24 TYR CZ C 14.221 1.979 9.121 1.00 . A A . 24 TYR CZ 1 1 1 400 1 1 24 TYR H H 16.269 0.358 2.711 1.00 . A A . 24 TYR H 1 1 1 401 1 1 24 TYR HA H 16.498 2.104 5.142 1.00 . A A . 24 TYR HA 1 1 1 402 1 1 24 TYR HB2 H 14.558 0.224 4.690 1.00 . A A . 24 TYR HB2 1 1 1 403 1 1 24 TYR HB3 H 15.776 -0.744 5.515 1.00 . A A . 24 TYR HB3 1 1 1 404 1 1 24 TYR HD1 H 14.156 2.638 5.784 1.00 . A A . 24 TYR HD1 1 1 1 405 1 1 24 TYR HD2 H 15.740 -0.784 7.843 1.00 . A A . 24 TYR HD2 1 1 1 406 1 1 24 TYR HE1 H 13.473 3.626 7.953 1.00 . A A . 24 TYR HE1 1 1 1 407 1 1 24 TYR HE2 H 15.057 0.205 10.011 1.00 . A A . 24 TYR HE2 1 1 1 408 1 1 24 TYR HH H 12.958 2.212 10.534 1.00 . A A . 24 TYR HH 1 1 1 409 1 1 24 TYR N N 16.164 1.161 3.265 1.00 . A A . 24 TYR N 1 1 1 410 1 1 24 TYR O O 18.127 -0.213 5.913 1.00 . A A . 24 TYR O 1 1 1 411 1 1 24 TYR OH O 13.840 2.529 10.328 1.00 . A A . 24 TYR OH 1 1 1 412 1 1 25 LYS C C 20.104 -1.446 4.315 1.00 . A A . 25 LYS C 1 1 1 413 1 1 25 LYS CA C 20.183 0.083 4.122 1.00 . A A . 25 LYS CA 1 1 1 414 1 1 25 LYS CB C 20.816 0.774 5.341 1.00 . A A . 25 LYS CB 1 1 1 415 1 1 25 LYS CD C 22.364 2.606 6.052 1.00 . A A . 25 LYS CD 1 1 1 416 1 1 25 LYS CE C 23.540 3.421 5.501 1.00 . A A . 25 LYS CE 1 1 1 417 1 1 25 LYS CG C 21.540 2.046 4.890 1.00 . A A . 25 LYS CG 1 1 1 418 1 1 25 LYS H H 18.587 1.226 3.223 1.00 . A A . 25 LYS H 1 1 1 419 1 1 25 LYS HA H 20.758 0.310 3.237 1.00 . A A . 25 LYS HA 1 1 1 420 1 1 25 LYS HB2 H 20.044 1.031 6.053 1.00 . A A . 25 LYS HB2 1 1 1 421 1 1 25 LYS HB3 H 21.525 0.107 5.806 1.00 . A A . 25 LYS HB3 1 1 1 422 1 1 25 LYS HD2 H 21.739 3.241 6.663 1.00 . A A . 25 LYS HD2 1 1 1 423 1 1 25 LYS HD3 H 22.744 1.790 6.650 1.00 . A A . 25 LYS HD3 1 1 1 424 1 1 25 LYS HE2 H 24.261 2.765 5.031 1.00 . A A . 25 LYS HE2 1 1 1 425 1 1 25 LYS HE3 H 23.188 4.160 4.798 1.00 . A A . 25 LYS HE3 1 1 1 426 1 1 25 LYS HG2 H 22.193 1.813 4.062 1.00 . A A . 25 LYS HG2 1 1 1 427 1 1 25 LYS HG3 H 20.813 2.782 4.580 1.00 . A A . 25 LYS HG3 1 1 1 428 1 1 25 LYS HZ1 H 23.436 4.713 7.135 1.00 . A A . 25 LYS HZ1 1 1 1 429 1 1 25 LYS HZ2 H 24.961 4.658 6.389 1.00 . A A . 25 LYS HZ2 1 1 1 430 1 1 25 LYS HZ3 H 24.449 3.374 7.377 1.00 . A A . 25 LYS HZ3 1 1 1 431 1 1 25 LYS N N 18.808 0.674 4.002 1.00 . A A . 25 LYS N 1 1 1 432 1 1 25 LYS NZ N 24.141 4.092 6.689 1.00 . A A . 25 LYS NZ 1 1 1 433 1 1 25 LYS O O 20.844 -1.969 5.136 1.00 . A A . 25 LYS O 1 1 1 434 1 1 25 LYS OXT O 19.307 -2.068 3.629 1.00 . A A . 25 LYS OXT 1 1 2 435 1 1 1 HIS C C -17.416 3.232 4.200 1.00 . A A . 1 HIS C 1 1 2 436 1 1 1 HIS CA C -16.898 4.673 4.337 1.00 . A A . 1 HIS CA 1 1 2 437 1 1 1 HIS CB C -16.847 5.096 5.811 1.00 . A A . 1 HIS CB 1 1 2 438 1 1 1 HIS CD2 C -14.582 3.794 6.132 1.00 . A A . 1 HIS CD2 1 1 2 439 1 1 1 HIS CE1 C -13.690 5.082 7.630 1.00 . A A . 1 HIS CE1 1 1 2 440 1 1 1 HIS CG C -15.482 4.802 6.377 1.00 . A A . 1 HIS CG 1 1 2 441 1 1 1 HIS HA H -15.919 4.762 3.894 1.00 . A A . 1 HIS HA 1 1 2 442 1 1 1 HIS HB2 H -17.047 6.153 5.889 1.00 . A A . 1 HIS HB2 1 1 2 443 1 1 1 HIS HB3 H -17.592 4.547 6.369 1.00 . A A . 1 HIS HB3 1 1 2 444 1 1 1 HIS HD1 H -15.279 6.422 7.728 1.00 . A A . 1 HIS HD1 1 1 2 445 1 1 1 HIS HD2 H -14.728 2.985 5.432 1.00 . A A . 1 HIS HD2 1 1 2 446 1 1 1 HIS HE1 H -13.003 5.502 8.349 1.00 . A A . 1 HIS HE1 1 1 2 447 1 1 1 HIS N N -17.849 5.630 3.692 1.00 . A A . 1 HIS N 1 1 2 448 1 1 1 HIS ND1 N -14.892 5.612 7.336 1.00 . A A . 1 HIS ND1 1 1 2 449 1 1 1 HIS NE2 N -13.452 3.973 6.924 1.00 . A A . 1 HIS NE2 1 1 2 450 1 1 1 HIS O O -17.580 2.524 5.177 1.00 . A A . 1 HIS O 1 1 2 451 1 1 2 ALA C C -17.756 0.896 1.395 1.00 . A A . 2 ALA C 1 1 2 452 1 1 2 ALA CA C -18.176 1.401 2.780 1.00 . A A . 2 ALA CA 1 1 2 453 1 1 2 ALA CB C -19.700 1.510 2.872 1.00 . A A . 2 ALA CB 1 1 2 454 1 1 2 ALA H H -17.530 3.381 2.219 1.00 . A A . 2 ALA H 1 1 2 455 1 1 2 ALA HA H -17.805 0.744 3.551 1.00 . A A . 2 ALA HA 1 1 2 456 1 1 2 ALA HB1 H -19.972 1.970 3.810 1.00 . A A . 2 ALA HB1 1 1 2 457 1 1 2 ALA HB2 H -20.134 0.522 2.818 1.00 . A A . 2 ALA HB2 1 1 2 458 1 1 2 ALA HB3 H -20.069 2.111 2.055 1.00 . A A . 2 ALA HB3 1 1 2 459 1 1 2 ALA N N -17.672 2.794 2.991 1.00 . A A . 2 ALA N 1 1 2 460 1 1 2 ALA O O -17.800 1.630 0.425 1.00 . A A . 2 ALA O 1 1 2 461 1 1 3 TRP C C -15.621 -0.242 -0.500 1.00 . A A . 3 TRP C 1 1 2 462 1 1 3 TRP CA C -16.903 -0.933 -0.008 1.00 . A A . 3 TRP CA 1 1 2 463 1 1 3 TRP CB C -18.064 -0.698 -0.983 1.00 . A A . 3 TRP CB 1 1 2 464 1 1 3 TRP CD1 C -19.160 -2.937 -1.402 1.00 . A A . 3 TRP CD1 1 1 2 465 1 1 3 TRP CD2 C -17.726 -2.358 -3.036 1.00 . A A . 3 TRP CD2 1 1 2 466 1 1 3 TRP CE2 C -18.260 -3.618 -3.393 1.00 . A A . 3 TRP CE2 1 1 2 467 1 1 3 TRP CE3 C -16.790 -1.767 -3.904 1.00 . A A . 3 TRP CE3 1 1 2 468 1 1 3 TRP CG C -18.313 -1.947 -1.768 1.00 . A A . 3 TRP CG 1 1 2 469 1 1 3 TRP CH2 C -16.951 -3.666 -5.419 1.00 . A A . 3 TRP CH2 1 1 2 470 1 1 3 TRP CZ2 C -17.881 -4.268 -4.568 1.00 . A A . 3 TRP CZ2 1 1 2 471 1 1 3 TRP CZ3 C -16.406 -2.417 -5.087 1.00 . A A . 3 TRP CZ3 1 1 2 472 1 1 3 TRP H H -17.316 -0.910 2.109 1.00 . A A . 3 TRP H 1 1 2 473 1 1 3 TRP HA H -16.729 -1.992 0.101 1.00 . A A . 3 TRP HA 1 1 2 474 1 1 3 TRP HB2 H -18.954 -0.438 -0.431 1.00 . A A . 3 TRP HB2 1 1 2 475 1 1 3 TRP HB3 H -17.812 0.106 -1.658 1.00 . A A . 3 TRP HB3 1 1 2 476 1 1 3 TRP HD1 H -19.761 -2.951 -0.504 1.00 . A A . 3 TRP HD1 1 1 2 477 1 1 3 TRP HE1 H -19.653 -4.758 -2.341 1.00 . A A . 3 TRP HE1 1 1 2 478 1 1 3 TRP HE3 H -16.364 -0.806 -3.659 1.00 . A A . 3 TRP HE3 1 1 2 479 1 1 3 TRP HH2 H -16.652 -4.161 -6.330 1.00 . A A . 3 TRP HH2 1 1 2 480 1 1 3 TRP HZ2 H -18.304 -5.230 -4.819 1.00 . A A . 3 TRP HZ2 1 1 2 481 1 1 3 TRP HZ3 H -15.687 -1.953 -5.747 1.00 . A A . 3 TRP HZ3 1 1 2 482 1 1 3 TRP N N -17.343 -0.351 1.304 1.00 . A A . 3 TRP N 1 1 2 483 1 1 3 TRP NE1 N -19.130 -3.929 -2.365 1.00 . A A . 3 TRP NE1 1 1 2 484 1 1 3 TRP O O -15.323 0.872 -0.117 1.00 . A A . 3 TRP O 1 1 2 485 1 1 4 TYR C C -12.793 0.453 -0.819 1.00 . A A . 4 TYR C 1 1 2 486 1 1 4 TYR CA C -13.570 -0.356 -1.883 1.00 . A A . 4 TYR CA 1 1 2 487 1 1 4 TYR CB C -13.961 0.513 -3.105 1.00 . A A . 4 TYR CB 1 1 2 488 1 1 4 TYR CD1 C -14.060 2.926 -2.337 1.00 . A A . 4 TYR CD1 1 1 2 489 1 1 4 TYR CD2 C -16.141 1.735 -2.701 1.00 . A A . 4 TYR CD2 1 1 2 490 1 1 4 TYR CE1 C -14.779 4.071 -1.974 1.00 . A A . 4 TYR CE1 1 1 2 491 1 1 4 TYR CE2 C -16.858 2.880 -2.338 1.00 . A A . 4 TYR CE2 1 1 2 492 1 1 4 TYR CG C -14.739 1.754 -2.699 1.00 . A A . 4 TYR CG 1 1 2 493 1 1 4 TYR CZ C -16.178 4.048 -1.974 1.00 . A A . 4 TYR CZ 1 1 2 494 1 1 4 TYR H H -15.139 -1.818 -1.610 1.00 . A A . 4 TYR H 1 1 2 495 1 1 4 TYR HA H -12.950 -1.171 -2.223 1.00 . A A . 4 TYR HA 1 1 2 496 1 1 4 TYR HB2 H -13.061 0.819 -3.618 1.00 . A A . 4 TYR HB2 1 1 2 497 1 1 4 TYR HB3 H -14.563 -0.078 -3.778 1.00 . A A . 4 TYR HB3 1 1 2 498 1 1 4 TYR HD1 H -12.981 2.947 -2.338 1.00 . A A . 4 TYR HD1 1 1 2 499 1 1 4 TYR HD2 H -16.667 0.835 -2.979 1.00 . A A . 4 TYR HD2 1 1 2 500 1 1 4 TYR HE1 H -14.253 4.972 -1.692 1.00 . A A . 4 TYR HE1 1 1 2 501 1 1 4 TYR HE2 H -17.938 2.864 -2.340 1.00 . A A . 4 TYR HE2 1 1 2 502 1 1 4 TYR HH H -16.951 5.746 -2.388 1.00 . A A . 4 TYR HH 1 1 2 503 1 1 4 TYR N N -14.862 -0.919 -1.339 1.00 . A A . 4 TYR N 1 1 2 504 1 1 4 TYR O O -12.102 1.403 -1.132 1.00 . A A . 4 TYR O 1 1 2 505 1 1 4 TYR OH O -16.887 5.178 -1.616 1.00 . A A . 4 TYR OH 1 1 2 506 1 1 5 SER C C -10.918 0.029 1.958 1.00 . A A . 5 SER C 1 1 2 507 1 1 5 SER CA C -12.157 0.810 1.508 1.00 . A A . 5 SER CA 1 1 2 508 1 1 5 SER CB C -13.157 0.946 2.658 1.00 . A A . 5 SER CB 1 1 2 509 1 1 5 SER H H -13.441 -0.706 0.667 1.00 . A A . 5 SER H 1 1 2 510 1 1 5 SER HA H -11.870 1.786 1.158 1.00 . A A . 5 SER HA 1 1 2 511 1 1 5 SER HB2 H -13.629 -0.005 2.843 1.00 . A A . 5 SER HB2 1 1 2 512 1 1 5 SER HB3 H -12.635 1.265 3.552 1.00 . A A . 5 SER HB3 1 1 2 513 1 1 5 SER HG H -13.806 2.776 2.507 1.00 . A A . 5 SER HG 1 1 2 514 1 1 5 SER N N -12.889 0.070 0.434 1.00 . A A . 5 SER N 1 1 2 515 1 1 5 SER O O -9.885 0.603 2.242 1.00 . A A . 5 SER O 1 1 2 516 1 1 5 SER OG O -14.151 1.901 2.309 1.00 . A A . 5 SER OG 1 1 2 517 1 1 6 HIS C C -8.890 -2.326 1.255 1.00 . A A . 6 HIS C 1 1 2 518 1 1 6 HIS CA C -9.830 -2.088 2.445 1.00 . A A . 6 HIS CA 1 1 2 519 1 1 6 HIS CB C -10.404 -3.408 2.991 1.00 . A A . 6 HIS CB 1 1 2 520 1 1 6 HIS CD2 C -10.232 -5.177 1.050 1.00 . A A . 6 HIS CD2 1 1 2 521 1 1 6 HIS CE1 C -12.315 -5.202 0.460 1.00 . A A . 6 HIS CE1 1 1 2 522 1 1 6 HIS CG C -10.886 -4.286 1.864 1.00 . A A . 6 HIS CG 1 1 2 523 1 1 6 HIS H H -11.852 -1.713 1.782 1.00 . A A . 6 HIS H 1 1 2 524 1 1 6 HIS HA H -9.298 -1.574 3.225 1.00 . A A . 6 HIS HA 1 1 2 525 1 1 6 HIS HB2 H -9.633 -3.928 3.540 1.00 . A A . 6 HIS HB2 1 1 2 526 1 1 6 HIS HB3 H -11.228 -3.191 3.653 1.00 . A A . 6 HIS HB3 1 1 2 527 1 1 6 HIS HD1 H -12.948 -3.796 1.857 1.00 . A A . 6 HIS HD1 1 1 2 528 1 1 6 HIS HD2 H -9.174 -5.393 1.089 1.00 . A A . 6 HIS HD2 1 1 2 529 1 1 6 HIS HE1 H -13.238 -5.439 -0.049 1.00 . A A . 6 HIS HE1 1 1 2 530 1 1 6 HIS N N -11.011 -1.274 2.019 1.00 . A A . 6 HIS N 1 1 2 531 1 1 6 HIS ND1 N -12.215 -4.319 1.469 1.00 . A A . 6 HIS ND1 1 1 2 532 1 1 6 HIS NE2 N -11.135 -5.754 0.165 1.00 . A A . 6 HIS NE2 1 1 2 533 1 1 6 HIS O O -7.699 -2.498 1.426 1.00 . A A . 6 HIS O 1 1 2 534 1 1 7 TYR C C -7.584 -1.349 -1.287 1.00 . A A . 7 TYR C 1 1 2 535 1 1 7 TYR CA C -8.547 -2.527 -1.148 1.00 . A A . 7 TYR CA 1 1 2 536 1 1 7 TYR CB C -9.502 -2.585 -2.347 1.00 . A A . 7 TYR CB 1 1 2 537 1 1 7 TYR CD1 C -8.776 -4.896 -3.062 1.00 . A A . 7 TYR CD1 1 1 2 538 1 1 7 TYR CD2 C -11.131 -4.483 -2.654 1.00 . A A . 7 TYR CD2 1 1 2 539 1 1 7 TYR CE1 C -9.065 -6.226 -3.387 1.00 . A A . 7 TYR CE1 1 1 2 540 1 1 7 TYR CE2 C -11.420 -5.813 -2.980 1.00 . A A . 7 TYR CE2 1 1 2 541 1 1 7 TYR CG C -9.809 -4.024 -2.695 1.00 . A A . 7 TYR CG 1 1 2 542 1 1 7 TYR CZ C -10.388 -6.684 -3.346 1.00 . A A . 7 TYR CZ 1 1 2 543 1 1 7 TYR H H -10.376 -2.167 -0.057 1.00 . A A . 7 TYR H 1 1 2 544 1 1 7 TYR HA H -7.998 -3.445 -1.060 1.00 . A A . 7 TYR HA 1 1 2 545 1 1 7 TYR HB2 H -10.419 -2.070 -2.102 1.00 . A A . 7 TYR HB2 1 1 2 546 1 1 7 TYR HB3 H -9.039 -2.104 -3.196 1.00 . A A . 7 TYR HB3 1 1 2 547 1 1 7 TYR HD1 H -7.756 -4.542 -3.094 1.00 . A A . 7 TYR HD1 1 1 2 548 1 1 7 TYR HD2 H -11.928 -3.811 -2.371 1.00 . A A . 7 TYR HD2 1 1 2 549 1 1 7 TYR HE1 H -8.270 -6.899 -3.670 1.00 . A A . 7 TYR HE1 1 1 2 550 1 1 7 TYR HE2 H -12.440 -6.167 -2.949 1.00 . A A . 7 TYR HE2 1 1 2 551 1 1 7 TYR HH H -10.923 -8.026 -4.594 1.00 . A A . 7 TYR HH 1 1 2 552 1 1 7 TYR N N -9.416 -2.320 0.053 1.00 . A A . 7 TYR N 1 1 2 553 1 1 7 TYR O O -6.389 -1.526 -1.433 1.00 . A A . 7 TYR O 1 1 2 554 1 1 7 TYR OH O -10.673 -7.995 -3.668 1.00 . A A . 7 TYR OH 1 1 2 555 1 1 8 VAL C C -6.256 1.099 -0.135 1.00 . A A . 8 VAL C 1 1 2 556 1 1 8 VAL CA C -7.224 1.059 -1.327 1.00 . A A . 8 VAL CA 1 1 2 557 1 1 8 VAL CB C -8.180 2.265 -1.316 1.00 . A A . 8 VAL CB 1 1 2 558 1 1 8 VAL CG1 C -8.854 2.402 0.054 1.00 . A A . 8 VAL CG1 1 1 2 559 1 1 8 VAL CG2 C -7.392 3.543 -1.622 1.00 . A A . 8 VAL CG2 1 1 2 560 1 1 8 VAL H H -9.066 -0.044 -1.090 1.00 . A A . 8 VAL H 1 1 2 561 1 1 8 VAL HA H -6.673 1.036 -2.249 1.00 . A A . 8 VAL HA 1 1 2 562 1 1 8 VAL HB H -8.940 2.125 -2.072 1.00 . A A . 8 VAL HB 1 1 2 563 1 1 8 VAL HG11 H -9.567 3.213 0.024 1.00 . A A . 8 VAL HG11 1 1 2 564 1 1 8 VAL HG12 H -8.106 2.609 0.805 1.00 . A A . 8 VAL HG12 1 1 2 565 1 1 8 VAL HG13 H -9.364 1.483 0.296 1.00 . A A . 8 VAL HG13 1 1 2 566 1 1 8 VAL HG21 H -8.069 4.383 -1.661 1.00 . A A . 8 VAL HG21 1 1 2 567 1 1 8 VAL HG22 H -6.892 3.438 -2.573 1.00 . A A . 8 VAL HG22 1 1 2 568 1 1 8 VAL HG23 H -6.658 3.708 -0.846 1.00 . A A . 8 VAL HG23 1 1 2 569 1 1 8 VAL N N -8.101 -0.148 -1.223 1.00 . A A . 8 VAL N 1 1 2 570 1 1 8 VAL O O -5.166 1.629 -0.230 1.00 . A A . 8 VAL O 1 1 2 571 1 1 9 LEU C C -4.611 -0.499 1.957 1.00 . A A . 9 LEU C 1 1 2 572 1 1 9 LEU CA C -5.753 0.503 2.174 1.00 . A A . 9 LEU CA 1 1 2 573 1 1 9 LEU CB C -6.650 0.056 3.332 1.00 . A A . 9 LEU CB 1 1 2 574 1 1 9 LEU CD1 C -6.150 1.942 4.897 1.00 . A A . 9 LEU CD1 1 1 2 575 1 1 9 LEU CD2 C -6.687 -0.325 5.800 1.00 . A A . 9 LEU CD2 1 1 2 576 1 1 9 LEU CG C -6.000 0.437 4.665 1.00 . A A . 9 LEU CG 1 1 2 577 1 1 9 LEU H H -7.524 0.093 1.018 1.00 . A A . 9 LEU H 1 1 2 578 1 1 9 LEU HA H -5.359 1.489 2.368 1.00 . A A . 9 LEU HA 1 1 2 579 1 1 9 LEU HB2 H -7.612 0.541 3.250 1.00 . A A . 9 LEU HB2 1 1 2 580 1 1 9 LEU HB3 H -6.782 -1.014 3.292 1.00 . A A . 9 LEU HB3 1 1 2 581 1 1 9 LEU HD11 H -5.531 2.479 4.194 1.00 . A A . 9 LEU HD11 1 1 2 582 1 1 9 LEU HD12 H -5.843 2.184 5.904 1.00 . A A . 9 LEU HD12 1 1 2 583 1 1 9 LEU HD13 H -7.183 2.227 4.759 1.00 . A A . 9 LEU HD13 1 1 2 584 1 1 9 LEU HD21 H -6.432 0.130 6.745 1.00 . A A . 9 LEU HD21 1 1 2 585 1 1 9 LEU HD22 H -6.355 -1.353 5.795 1.00 . A A . 9 LEU HD22 1 1 2 586 1 1 9 LEU HD23 H -7.757 -0.292 5.661 1.00 . A A . 9 LEU HD23 1 1 2 587 1 1 9 LEU HG H -4.950 0.181 4.638 1.00 . A A . 9 LEU HG 1 1 2 588 1 1 9 LEU N N -6.645 0.524 0.976 1.00 . A A . 9 LEU N 1 1 2 589 1 1 9 LEU O O -3.492 -0.275 2.378 1.00 . A A . 9 LEU O 1 1 2 590 1 1 10 LYS C C -2.832 -2.092 -0.001 1.00 . A A . 10 LYS C 1 1 2 591 1 1 10 LYS CA C -3.819 -2.616 1.049 1.00 . A A . 10 LYS CA 1 1 2 592 1 1 10 LYS CB C -4.550 -3.861 0.531 1.00 . A A . 10 LYS CB 1 1 2 593 1 1 10 LYS CD C -2.876 -5.462 1.486 1.00 . A A . 10 LYS CD 1 1 2 594 1 1 10 LYS CE C -2.558 -6.261 2.755 1.00 . A A . 10 LYS CE 1 1 2 595 1 1 10 LYS CG C -4.344 -5.021 1.510 1.00 . A A . 10 LYS CG 1 1 2 596 1 1 10 LYS H H -5.799 -1.759 0.964 1.00 . A A . 10 LYS H 1 1 2 597 1 1 10 LYS HA H -3.302 -2.847 1.966 1.00 . A A . 10 LYS HA 1 1 2 598 1 1 10 LYS HB2 H -5.606 -3.649 0.441 1.00 . A A . 10 LYS HB2 1 1 2 599 1 1 10 LYS HB3 H -4.154 -4.135 -0.435 1.00 . A A . 10 LYS HB3 1 1 2 600 1 1 10 LYS HD2 H -2.701 -6.080 0.617 1.00 . A A . 10 LYS HD2 1 1 2 601 1 1 10 LYS HD3 H -2.239 -4.591 1.442 1.00 . A A . 10 LYS HD3 1 1 2 602 1 1 10 LYS HE2 H -3.433 -6.806 3.083 1.00 . A A . 10 LYS HE2 1 1 2 603 1 1 10 LYS HE3 H -1.738 -6.939 2.574 1.00 . A A . 10 LYS HE3 1 1 2 604 1 1 10 LYS HG2 H -4.610 -4.701 2.507 1.00 . A A . 10 LYS HG2 1 1 2 605 1 1 10 LYS HG3 H -4.971 -5.851 1.220 1.00 . A A . 10 LYS HG3 1 1 2 606 1 1 10 LYS HZ1 H -2.951 -4.580 3.926 1.00 . A A . 10 LYS HZ1 1 1 2 607 1 1 10 LYS HZ2 H -1.328 -4.723 3.440 1.00 . A A . 10 LYS HZ2 1 1 2 608 1 1 10 LYS HZ3 H -1.940 -5.720 4.670 1.00 . A A . 10 LYS HZ3 1 1 2 609 1 1 10 LYS N N -4.888 -1.602 1.298 1.00 . A A . 10 LYS N 1 1 2 610 1 1 10 LYS NZ N -2.166 -5.244 3.774 1.00 . A A . 10 LYS NZ 1 1 2 611 1 1 10 LYS O O -1.634 -2.202 0.162 1.00 . A A . 10 LYS O 1 1 2 612 1 1 11 PHE C C -1.515 0.114 -1.551 1.00 . A A . 11 PHE C 1 1 2 613 1 1 11 PHE CA C -2.426 -0.973 -2.133 1.00 . A A . 11 PHE CA 1 1 2 614 1 1 11 PHE CB C -3.365 -0.386 -3.193 1.00 . A A . 11 PHE CB 1 1 2 615 1 1 11 PHE CD1 C -2.060 -0.841 -5.304 1.00 . A A . 11 PHE CD1 1 1 2 616 1 1 11 PHE CD2 C -2.321 1.454 -4.564 1.00 . A A . 11 PHE CD2 1 1 2 617 1 1 11 PHE CE1 C -1.318 -0.401 -6.406 1.00 . A A . 11 PHE CE1 1 1 2 618 1 1 11 PHE CE2 C -1.579 1.894 -5.667 1.00 . A A . 11 PHE CE2 1 1 2 619 1 1 11 PHE CG C -2.562 0.087 -4.383 1.00 . A A . 11 PHE CG 1 1 2 620 1 1 11 PHE CZ C -1.077 0.966 -6.588 1.00 . A A . 11 PHE CZ 1 1 2 621 1 1 11 PHE H H -4.303 -1.435 -1.171 1.00 . A A . 11 PHE H 1 1 2 622 1 1 11 PHE HA H -1.833 -1.767 -2.564 1.00 . A A . 11 PHE HA 1 1 2 623 1 1 11 PHE HB2 H -4.067 -1.143 -3.511 1.00 . A A . 11 PHE HB2 1 1 2 624 1 1 11 PHE HB3 H -3.905 0.448 -2.769 1.00 . A A . 11 PHE HB3 1 1 2 625 1 1 11 PHE HD1 H -2.246 -1.895 -5.164 1.00 . A A . 11 PHE HD1 1 1 2 626 1 1 11 PHE HD2 H -2.707 2.170 -3.854 1.00 . A A . 11 PHE HD2 1 1 2 627 1 1 11 PHE HE1 H -0.931 -1.116 -7.117 1.00 . A A . 11 PHE HE1 1 1 2 628 1 1 11 PHE HE2 H -1.394 2.948 -5.807 1.00 . A A . 11 PHE HE2 1 1 2 629 1 1 11 PHE HZ H -0.506 1.306 -7.439 1.00 . A A . 11 PHE HZ 1 1 2 630 1 1 11 PHE N N -3.331 -1.515 -1.070 1.00 . A A . 11 PHE N 1 1 2 631 1 1 11 PHE O O -0.333 0.154 -1.832 1.00 . A A . 11 PHE O 1 1 2 632 1 1 12 PHE C C -0.119 1.437 0.747 1.00 . A A . 12 PHE C 1 1 2 633 1 1 12 PHE CA C -1.214 2.067 -0.123 1.00 . A A . 12 PHE CA 1 1 2 634 1 1 12 PHE CB C -2.175 2.898 0.734 1.00 . A A . 12 PHE CB 1 1 2 635 1 1 12 PHE CD1 C -0.797 4.784 1.681 1.00 . A A . 12 PHE CD1 1 1 2 636 1 1 12 PHE CD2 C -2.250 5.234 -0.207 1.00 . A A . 12 PHE CD2 1 1 2 637 1 1 12 PHE CE1 C -0.384 6.121 1.683 1.00 . A A . 12 PHE CE1 1 1 2 638 1 1 12 PHE CE2 C -1.836 6.571 -0.207 1.00 . A A . 12 PHE CE2 1 1 2 639 1 1 12 PHE CG C -1.729 4.340 0.737 1.00 . A A . 12 PHE CG 1 1 2 640 1 1 12 PHE CZ C -0.904 7.015 0.739 1.00 . A A . 12 PHE CZ 1 1 2 641 1 1 12 PHE H H -3.010 0.931 -0.516 1.00 . A A . 12 PHE H 1 1 2 642 1 1 12 PHE HA H -0.775 2.683 -0.892 1.00 . A A . 12 PHE HA 1 1 2 643 1 1 12 PHE HB2 H -3.173 2.830 0.326 1.00 . A A . 12 PHE HB2 1 1 2 644 1 1 12 PHE HB3 H -2.174 2.519 1.746 1.00 . A A . 12 PHE HB3 1 1 2 645 1 1 12 PHE HD1 H -0.396 4.095 2.410 1.00 . A A . 12 PHE HD1 1 1 2 646 1 1 12 PHE HD2 H -2.969 4.891 -0.937 1.00 . A A . 12 PHE HD2 1 1 2 647 1 1 12 PHE HE1 H 0.335 6.463 2.411 1.00 . A A . 12 PHE HE1 1 1 2 648 1 1 12 PHE HE2 H -2.238 7.260 -0.934 1.00 . A A . 12 PHE HE2 1 1 2 649 1 1 12 PHE HZ H -0.586 8.047 0.739 1.00 . A A . 12 PHE HZ 1 1 2 650 1 1 12 PHE N N -2.054 0.990 -0.733 1.00 . A A . 12 PHE N 1 1 2 651 1 1 12 PHE O O 1.042 1.783 0.644 1.00 . A A . 12 PHE O 1 1 2 652 1 1 13 LEU C C 1.507 -0.979 1.589 1.00 . A A . 13 LEU C 1 1 2 653 1 1 13 LEU CA C 0.528 -0.177 2.457 1.00 . A A . 13 LEU CA 1 1 2 654 1 1 13 LEU CB C -0.284 -1.114 3.359 1.00 . A A . 13 LEU CB 1 1 2 655 1 1 13 LEU CD1 C 0.160 -0.493 5.741 1.00 . A A . 13 LEU CD1 1 1 2 656 1 1 13 LEU CD2 C 0.211 -2.891 5.043 1.00 . A A . 13 LEU CD2 1 1 2 657 1 1 13 LEU CG C 0.527 -1.457 4.611 1.00 . A A . 13 LEU CG 1 1 2 658 1 1 13 LEU H H -1.428 0.232 1.639 1.00 . A A . 13 LEU H 1 1 2 659 1 1 13 LEU HA H 1.056 0.548 3.056 1.00 . A A . 13 LEU HA 1 1 2 660 1 1 13 LEU HB2 H -1.205 -0.627 3.647 1.00 . A A . 13 LEU HB2 1 1 2 661 1 1 13 LEU HB3 H -0.512 -2.022 2.819 1.00 . A A . 13 LEU HB3 1 1 2 662 1 1 13 LEU HD11 H 0.553 -0.867 6.676 1.00 . A A . 13 LEU HD11 1 1 2 663 1 1 13 LEU HD12 H -0.915 -0.409 5.810 1.00 . A A . 13 LEU HD12 1 1 2 664 1 1 13 LEU HD13 H 0.584 0.479 5.538 1.00 . A A . 13 LEU HD13 1 1 2 665 1 1 13 LEU HD21 H 0.719 -3.106 5.971 1.00 . A A . 13 LEU HD21 1 1 2 666 1 1 13 LEU HD22 H 0.548 -3.579 4.282 1.00 . A A . 13 LEU HD22 1 1 2 667 1 1 13 LEU HD23 H -0.854 -2.999 5.181 1.00 . A A . 13 LEU HD23 1 1 2 668 1 1 13 LEU HG H 1.582 -1.369 4.392 1.00 . A A . 13 LEU HG 1 1 2 669 1 1 13 LEU N N -0.485 0.500 1.589 1.00 . A A . 13 LEU N 1 1 2 670 1 1 13 LEU O O 2.680 -1.080 1.894 1.00 . A A . 13 LEU O 1 1 2 671 1 1 14 LEU C C 2.883 -1.399 -1.143 1.00 . A A . 14 LEU C 1 1 2 672 1 1 14 LEU CA C 1.920 -2.331 -0.400 1.00 . A A . 14 LEU CA 1 1 2 673 1 1 14 LEU CB C 0.971 -3.030 -1.387 1.00 . A A . 14 LEU CB 1 1 2 674 1 1 14 LEU CD1 C 2.327 -5.139 -1.374 1.00 . A A . 14 LEU CD1 1 1 2 675 1 1 14 LEU CD2 C 0.545 -4.793 0.345 1.00 . A A . 14 LEU CD2 1 1 2 676 1 1 14 LEU CG C 0.943 -4.539 -1.113 1.00 . A A . 14 LEU CG 1 1 2 677 1 1 14 LEU H H 0.079 -1.436 0.281 1.00 . A A . 14 LEU H 1 1 2 678 1 1 14 LEU HA H 2.469 -3.061 0.163 1.00 . A A . 14 LEU HA 1 1 2 679 1 1 14 LEU HB2 H -0.024 -2.628 -1.274 1.00 . A A . 14 LEU HB2 1 1 2 680 1 1 14 LEU HB3 H 1.311 -2.857 -2.397 1.00 . A A . 14 LEU HB3 1 1 2 681 1 1 14 LEU HD11 H 2.242 -6.212 -1.474 1.00 . A A . 14 LEU HD11 1 1 2 682 1 1 14 LEU HD12 H 2.984 -4.906 -0.549 1.00 . A A . 14 LEU HD12 1 1 2 683 1 1 14 LEU HD13 H 2.734 -4.725 -2.286 1.00 . A A . 14 LEU HD13 1 1 2 684 1 1 14 LEU HD21 H 1.386 -4.584 0.990 1.00 . A A . 14 LEU HD21 1 1 2 685 1 1 14 LEU HD22 H 0.250 -5.825 0.463 1.00 . A A . 14 LEU HD22 1 1 2 686 1 1 14 LEU HD23 H -0.280 -4.150 0.610 1.00 . A A . 14 LEU HD23 1 1 2 687 1 1 14 LEU HG H 0.223 -5.007 -1.769 1.00 . A A . 14 LEU HG 1 1 2 688 1 1 14 LEU N N 1.029 -1.541 0.505 1.00 . A A . 14 LEU N 1 1 2 689 1 1 14 LEU O O 4.037 -1.722 -1.348 1.00 . A A . 14 LEU O 1 1 2 690 1 1 15 VAL C C 4.251 1.406 -1.278 1.00 . A A . 15 VAL C 1 1 2 691 1 1 15 VAL CA C 3.294 0.724 -2.266 1.00 . A A . 15 VAL CA 1 1 2 692 1 1 15 VAL CB C 2.336 1.742 -2.904 1.00 . A A . 15 VAL CB 1 1 2 693 1 1 15 VAL CG1 C 3.115 2.974 -3.374 1.00 . A A . 15 VAL CG1 1 1 2 694 1 1 15 VAL CG2 C 1.638 1.099 -4.107 1.00 . A A . 15 VAL CG2 1 1 2 695 1 1 15 VAL H H 1.479 -0.013 -1.354 1.00 . A A . 15 VAL H 1 1 2 696 1 1 15 VAL HA H 3.852 0.214 -3.035 1.00 . A A . 15 VAL HA 1 1 2 697 1 1 15 VAL HB H 1.595 2.043 -2.176 1.00 . A A . 15 VAL HB 1 1 2 698 1 1 15 VAL HG11 H 2.545 3.494 -4.131 1.00 . A A . 15 VAL HG11 1 1 2 699 1 1 15 VAL HG12 H 4.063 2.664 -3.789 1.00 . A A . 15 VAL HG12 1 1 2 700 1 1 15 VAL HG13 H 3.287 3.634 -2.536 1.00 . A A . 15 VAL HG13 1 1 2 701 1 1 15 VAL HG21 H 0.625 1.466 -4.175 1.00 . A A . 15 VAL HG21 1 1 2 702 1 1 15 VAL HG22 H 1.623 0.026 -3.985 1.00 . A A . 15 VAL HG22 1 1 2 703 1 1 15 VAL HG23 H 2.174 1.350 -5.010 1.00 . A A . 15 VAL HG23 1 1 2 704 1 1 15 VAL N N 2.413 -0.244 -1.539 1.00 . A A . 15 VAL N 1 1 2 705 1 1 15 VAL O O 5.453 1.391 -1.463 1.00 . A A . 15 VAL O 1 1 2 706 1 1 16 PHE C C 5.530 1.643 1.450 1.00 . A A . 16 PHE C 1 1 2 707 1 1 16 PHE CA C 4.617 2.671 0.772 1.00 . A A . 16 PHE CA 1 1 2 708 1 1 16 PHE CB C 3.674 3.314 1.794 1.00 . A A . 16 PHE CB 1 1 2 709 1 1 16 PHE CD1 C 4.632 5.603 2.244 1.00 . A A . 16 PHE CD1 1 1 2 710 1 1 16 PHE CD2 C 2.716 5.410 0.768 1.00 . A A . 16 PHE CD2 1 1 2 711 1 1 16 PHE CE1 C 4.634 6.990 2.060 1.00 . A A . 16 PHE CE1 1 1 2 712 1 1 16 PHE CE2 C 2.719 6.799 0.585 1.00 . A A . 16 PHE CE2 1 1 2 713 1 1 16 PHE CG C 3.673 4.813 1.599 1.00 . A A . 16 PHE CG 1 1 2 714 1 1 16 PHE CZ C 3.678 7.588 1.230 1.00 . A A . 16 PHE CZ 1 1 2 715 1 1 16 PHE H H 2.757 1.990 -0.098 1.00 . A A . 16 PHE H 1 1 2 716 1 1 16 PHE HA H 5.208 3.433 0.290 1.00 . A A . 16 PHE HA 1 1 2 717 1 1 16 PHE HB2 H 2.673 2.931 1.657 1.00 . A A . 16 PHE HB2 1 1 2 718 1 1 16 PHE HB3 H 4.013 3.083 2.792 1.00 . A A . 16 PHE HB3 1 1 2 719 1 1 16 PHE HD1 H 5.368 5.141 2.885 1.00 . A A . 16 PHE HD1 1 1 2 720 1 1 16 PHE HD2 H 1.976 4.801 0.271 1.00 . A A . 16 PHE HD2 1 1 2 721 1 1 16 PHE HE1 H 5.373 7.600 2.559 1.00 . A A . 16 PHE HE1 1 1 2 722 1 1 16 PHE HE2 H 1.982 7.260 -0.056 1.00 . A A . 16 PHE HE2 1 1 2 723 1 1 16 PHE HZ H 3.680 8.659 1.088 1.00 . A A . 16 PHE HZ 1 1 2 724 1 1 16 PHE N N 3.729 1.996 -0.229 1.00 . A A . 16 PHE N 1 1 2 725 1 1 16 PHE O O 6.676 1.925 1.744 1.00 . A A . 16 PHE O 1 1 2 726 1 1 17 GLY C C 7.080 -0.916 1.453 1.00 . A A . 17 GLY C 1 1 2 727 1 1 17 GLY CA C 5.872 -0.600 2.341 1.00 . A A . 17 GLY CA 1 1 2 728 1 1 17 GLY H H 4.108 0.247 1.440 1.00 . A A . 17 GLY H 1 1 2 729 1 1 17 GLY HA2 H 6.214 -0.244 3.302 1.00 . A A . 17 GLY HA2 1 1 2 730 1 1 17 GLY HA3 H 5.286 -1.497 2.475 1.00 . A A . 17 GLY HA3 1 1 2 731 1 1 17 GLY N N 5.033 0.452 1.692 1.00 . A A . 17 GLY N 1 1 2 732 1 1 17 GLY O O 8.194 -1.010 1.927 1.00 . A A . 17 GLY O 1 1 2 733 1 1 18 GLU C C 9.003 -0.213 -0.782 1.00 . A A . 18 GLU C 1 1 2 734 1 1 18 GLU CA C 8.012 -1.382 -0.752 1.00 . A A . 18 GLU CA 1 1 2 735 1 1 18 GLU CB C 7.377 -1.588 -2.131 1.00 . A A . 18 GLU CB 1 1 2 736 1 1 18 GLU CD C 7.729 -2.522 -4.429 1.00 . A A . 18 GLU CD 1 1 2 737 1 1 18 GLU CG C 8.384 -2.265 -3.069 1.00 . A A . 18 GLU CG 1 1 2 738 1 1 18 GLU H H 5.960 -0.993 -0.193 1.00 . A A . 18 GLU H 1 1 2 739 1 1 18 GLU HA H 8.511 -2.280 -0.438 1.00 . A A . 18 GLU HA 1 1 2 740 1 1 18 GLU HB2 H 6.501 -2.211 -2.034 1.00 . A A . 18 GLU HB2 1 1 2 741 1 1 18 GLU HB3 H 7.093 -0.631 -2.542 1.00 . A A . 18 GLU HB3 1 1 2 742 1 1 18 GLU HG2 H 9.243 -1.621 -3.199 1.00 . A A . 18 GLU HG2 1 1 2 743 1 1 18 GLU HG3 H 8.700 -3.204 -2.640 1.00 . A A . 18 GLU HG3 1 1 2 744 1 1 18 GLU N N 6.869 -1.077 0.167 1.00 . A A . 18 GLU N 1 1 2 745 1 1 18 GLU O O 10.197 -0.405 -0.884 1.00 . A A . 18 GLU O 1 1 2 746 1 1 18 GLU OE1 O 7.447 -1.558 -5.122 1.00 . A A . 18 GLU OE1 1 1 2 747 1 1 18 GLU OE2 O 7.520 -3.680 -4.753 1.00 . A A . 18 GLU OE2 1 1 2 748 1 1 19 ASN C C 10.376 2.151 0.512 1.00 . A A . 19 ASN C 1 1 2 749 1 1 19 ASN CA C 9.430 2.180 -0.698 1.00 . A A . 19 ASN CA 1 1 2 750 1 1 19 ASN CB C 8.511 3.405 -0.638 1.00 . A A . 19 ASN CB 1 1 2 751 1 1 19 ASN CG C 7.825 3.600 -1.995 1.00 . A A . 19 ASN CG 1 1 2 752 1 1 19 ASN H H 7.547 1.122 -0.596 1.00 . A A . 19 ASN H 1 1 2 753 1 1 19 ASN HA H 9.998 2.197 -1.611 1.00 . A A . 19 ASN HA 1 1 2 754 1 1 19 ASN HB2 H 7.762 3.256 0.127 1.00 . A A . 19 ASN HB2 1 1 2 755 1 1 19 ASN HB3 H 9.095 4.282 -0.403 1.00 . A A . 19 ASN HB3 1 1 2 756 1 1 19 ASN HD21 H 6.130 4.272 -1.209 1.00 . A A . 19 ASN HD21 1 1 2 757 1 1 19 ASN HD22 H 6.159 4.182 -2.903 1.00 . A A . 19 ASN HD22 1 1 2 758 1 1 19 ASN N N 8.514 0.996 -0.684 1.00 . A A . 19 ASN N 1 1 2 759 1 1 19 ASN ND2 N 6.604 4.057 -2.038 1.00 . A A . 19 ASN ND2 1 1 2 760 1 1 19 ASN O O 11.421 2.773 0.502 1.00 . A A . 19 ASN O 1 1 2 761 1 1 19 ASN OD1 O 8.406 3.332 -3.028 1.00 . A A . 19 ASN OD1 1 1 2 762 1 1 20 GLY C C 11.555 -0.031 2.846 1.00 . A A . 20 GLY C 1 1 2 763 1 1 20 GLY CA C 10.899 1.355 2.755 1.00 . A A . 20 GLY CA 1 1 2 764 1 1 20 GLY H H 9.176 0.939 1.530 1.00 . A A . 20 GLY H 1 1 2 765 1 1 20 GLY HA2 H 11.667 2.112 2.688 1.00 . A A . 20 GLY HA2 1 1 2 766 1 1 20 GLY HA3 H 10.305 1.524 3.640 1.00 . A A . 20 GLY HA3 1 1 2 767 1 1 20 GLY N N 10.021 1.430 1.547 1.00 . A A . 20 GLY N 1 1 2 768 1 1 20 GLY O O 12.704 -0.152 3.225 1.00 . A A . 20 GLY O 1 1 2 769 1 1 21 VAL C C 12.276 -2.773 1.355 1.00 . A A . 21 VAL C 1 1 2 770 1 1 21 VAL CA C 11.421 -2.455 2.593 1.00 . A A . 21 VAL CA 1 1 2 771 1 1 21 VAL CB C 10.215 -3.400 2.679 1.00 . A A . 21 VAL CB 1 1 2 772 1 1 21 VAL CG1 C 10.680 -4.855 2.561 1.00 . A A . 21 VAL CG1 1 1 2 773 1 1 21 VAL CG2 C 9.509 -3.207 4.025 1.00 . A A . 21 VAL CG2 1 1 2 774 1 1 21 VAL H H 9.905 -0.959 2.213 1.00 . A A . 21 VAL H 1 1 2 775 1 1 21 VAL HA H 12.019 -2.548 3.482 1.00 . A A . 21 VAL HA 1 1 2 776 1 1 21 VAL HB H 9.526 -3.179 1.876 1.00 . A A . 21 VAL HB 1 1 2 777 1 1 21 VAL HG11 H 11.621 -4.976 3.079 1.00 . A A . 21 VAL HG11 1 1 2 778 1 1 21 VAL HG12 H 10.808 -5.109 1.519 1.00 . A A . 21 VAL HG12 1 1 2 779 1 1 21 VAL HG13 H 9.941 -5.507 3.001 1.00 . A A . 21 VAL HG13 1 1 2 780 1 1 21 VAL HG21 H 8.928 -2.298 3.999 1.00 . A A . 21 VAL HG21 1 1 2 781 1 1 21 VAL HG22 H 10.248 -3.141 4.812 1.00 . A A . 21 VAL HG22 1 1 2 782 1 1 21 VAL HG23 H 8.857 -4.046 4.214 1.00 . A A . 21 VAL HG23 1 1 2 783 1 1 21 VAL N N 10.835 -1.077 2.511 1.00 . A A . 21 VAL N 1 1 2 784 1 1 21 VAL O O 13.143 -3.625 1.399 1.00 . A A . 21 VAL O 1 1 2 785 1 1 22 PHE C C 13.900 -1.287 -1.209 1.00 . A A . 22 PHE C 1 1 2 786 1 1 22 PHE CA C 12.844 -2.381 -0.977 1.00 . A A . 22 PHE CA 1 1 2 787 1 1 22 PHE CB C 11.824 -2.394 -2.120 1.00 . A A . 22 PHE CB 1 1 2 788 1 1 22 PHE CD1 C 11.585 -4.823 -2.757 1.00 . A A . 22 PHE CD1 1 1 2 789 1 1 22 PHE CD2 C 12.891 -3.365 -4.189 1.00 . A A . 22 PHE CD2 1 1 2 790 1 1 22 PHE CE1 C 11.848 -5.899 -3.614 1.00 . A A . 22 PHE CE1 1 1 2 791 1 1 22 PHE CE2 C 13.153 -4.440 -5.045 1.00 . A A . 22 PHE CE2 1 1 2 792 1 1 22 PHE CG C 12.108 -3.556 -3.044 1.00 . A A . 22 PHE CG 1 1 2 793 1 1 22 PHE CZ C 12.631 -5.708 -4.757 1.00 . A A . 22 PHE CZ 1 1 2 794 1 1 22 PHE H H 11.337 -1.424 0.240 1.00 . A A . 22 PHE H 1 1 2 795 1 1 22 PHE HA H 13.320 -3.345 -0.902 1.00 . A A . 22 PHE HA 1 1 2 796 1 1 22 PHE HB2 H 10.828 -2.495 -1.714 1.00 . A A . 22 PHE HB2 1 1 2 797 1 1 22 PHE HB3 H 11.893 -1.470 -2.675 1.00 . A A . 22 PHE HB3 1 1 2 798 1 1 22 PHE HD1 H 10.980 -4.971 -1.874 1.00 . A A . 22 PHE HD1 1 1 2 799 1 1 22 PHE HD2 H 13.293 -2.388 -4.410 1.00 . A A . 22 PHE HD2 1 1 2 800 1 1 22 PHE HE1 H 11.445 -6.877 -3.392 1.00 . A A . 22 PHE HE1 1 1 2 801 1 1 22 PHE HE2 H 13.758 -4.293 -5.928 1.00 . A A . 22 PHE HE2 1 1 2 802 1 1 22 PHE HZ H 12.833 -6.537 -5.419 1.00 . A A . 22 PHE HZ 1 1 2 803 1 1 22 PHE N N 12.040 -2.105 0.255 1.00 . A A . 22 PHE N 1 1 2 804 1 1 22 PHE O O 14.539 -1.251 -2.244 1.00 . A A . 22 PHE O 1 1 2 805 1 1 23 PHE C C 15.899 0.914 0.855 1.00 . A A . 23 PHE C 1 1 2 806 1 1 23 PHE CA C 15.111 0.683 -0.444 1.00 . A A . 23 PHE CA 1 1 2 807 1 1 23 PHE CB C 14.303 1.931 -0.812 1.00 . A A . 23 PHE CB 1 1 2 808 1 1 23 PHE CD1 C 14.664 2.044 -3.307 1.00 . A A . 23 PHE CD1 1 1 2 809 1 1 23 PHE CD2 C 12.465 1.458 -2.472 1.00 . A A . 23 PHE CD2 1 1 2 810 1 1 23 PHE CE1 C 14.196 1.928 -4.622 1.00 . A A . 23 PHE CE1 1 1 2 811 1 1 23 PHE CE2 C 11.997 1.342 -3.786 1.00 . A A . 23 PHE CE2 1 1 2 812 1 1 23 PHE CG C 13.798 1.809 -2.231 1.00 . A A . 23 PHE CG 1 1 2 813 1 1 23 PHE CZ C 12.863 1.576 -4.860 1.00 . A A . 23 PHE CZ 1 1 2 814 1 1 23 PHE H H 13.574 -0.444 0.566 1.00 . A A . 23 PHE H 1 1 2 815 1 1 23 PHE HA H 15.784 0.433 -1.249 1.00 . A A . 23 PHE HA 1 1 2 816 1 1 23 PHE HB2 H 13.464 2.027 -0.138 1.00 . A A . 23 PHE HB2 1 1 2 817 1 1 23 PHE HB3 H 14.933 2.803 -0.728 1.00 . A A . 23 PHE HB3 1 1 2 818 1 1 23 PHE HD1 H 15.694 2.315 -3.122 1.00 . A A . 23 PHE HD1 1 1 2 819 1 1 23 PHE HD2 H 11.797 1.276 -1.643 1.00 . A A . 23 PHE HD2 1 1 2 820 1 1 23 PHE HE1 H 14.864 2.108 -5.451 1.00 . A A . 23 PHE HE1 1 1 2 821 1 1 23 PHE HE2 H 10.968 1.071 -3.970 1.00 . A A . 23 PHE HE2 1 1 2 822 1 1 23 PHE HZ H 12.501 1.487 -5.874 1.00 . A A . 23 PHE HZ 1 1 2 823 1 1 23 PHE N N 14.093 -0.399 -0.262 1.00 . A A . 23 PHE N 1 1 2 824 1 1 23 PHE O O 16.356 2.010 1.123 1.00 . A A . 23 PHE O 1 1 2 825 1 1 24 TYR C C 18.199 -0.646 2.846 1.00 . A A . 24 TYR C 1 1 2 826 1 1 24 TYR CA C 16.832 0.055 2.934 1.00 . A A . 24 TYR CA 1 1 2 827 1 1 24 TYR CB C 15.947 -0.573 4.026 1.00 . A A . 24 TYR CB 1 1 2 828 1 1 24 TYR CD1 C 15.450 -2.903 3.187 1.00 . A A . 24 TYR CD1 1 1 2 829 1 1 24 TYR CD2 C 17.010 -2.634 5.022 1.00 . A A . 24 TYR CD2 1 1 2 830 1 1 24 TYR CE1 C 15.629 -4.290 3.238 1.00 . A A . 24 TYR CE1 1 1 2 831 1 1 24 TYR CE2 C 17.189 -4.021 5.073 1.00 . A A . 24 TYR CE2 1 1 2 832 1 1 24 TYR CG C 16.141 -2.074 4.078 1.00 . A A . 24 TYR CG 1 1 2 833 1 1 24 TYR CZ C 16.498 -4.850 4.181 1.00 . A A . 24 TYR CZ 1 1 2 834 1 1 24 TYR H H 15.695 -0.981 1.419 1.00 . A A . 24 TYR H 1 1 2 835 1 1 24 TYR HA H 16.974 1.101 3.143 1.00 . A A . 24 TYR HA 1 1 2 836 1 1 24 TYR HB2 H 16.207 -0.148 4.983 1.00 . A A . 24 TYR HB2 1 1 2 837 1 1 24 TYR HB3 H 14.911 -0.355 3.812 1.00 . A A . 24 TYR HB3 1 1 2 838 1 1 24 TYR HD1 H 14.778 -2.473 2.459 1.00 . A A . 24 TYR HD1 1 1 2 839 1 1 24 TYR HD2 H 17.544 -1.995 5.710 1.00 . A A . 24 TYR HD2 1 1 2 840 1 1 24 TYR HE1 H 15.094 -4.929 2.551 1.00 . A A . 24 TYR HE1 1 1 2 841 1 1 24 TYR HE2 H 17.860 -4.453 5.802 1.00 . A A . 24 TYR HE2 1 1 2 842 1 1 24 TYR HH H 16.053 -6.573 4.873 1.00 . A A . 24 TYR HH 1 1 2 843 1 1 24 TYR N N 16.066 -0.108 1.658 1.00 . A A . 24 TYR N 1 1 2 844 1 1 24 TYR O O 19.074 -0.415 3.660 1.00 . A A . 24 TYR O 1 1 2 845 1 1 24 TYR OH O 16.674 -6.218 4.232 1.00 . A A . 24 TYR OH 1 1 2 846 1 1 25 LYS C C 20.084 -2.299 0.237 1.00 . A A . 25 LYS C 1 1 2 847 1 1 25 LYS CA C 19.694 -2.206 1.718 1.00 . A A . 25 LYS CA 1 1 2 848 1 1 25 LYS CB C 19.456 -3.601 2.303 1.00 . A A . 25 LYS CB 1 1 2 849 1 1 25 LYS CD C 20.457 -5.334 3.805 1.00 . A A . 25 LYS CD 1 1 2 850 1 1 25 LYS CE C 21.472 -6.042 2.900 1.00 . A A . 25 LYS CE 1 1 2 851 1 1 25 LYS CG C 20.423 -3.841 3.466 1.00 . A A . 25 LYS CG 1 1 2 852 1 1 25 LYS H H 17.672 -1.660 1.219 1.00 . A A . 25 LYS H 1 1 2 853 1 1 25 LYS HA H 20.464 -1.698 2.277 1.00 . A A . 25 LYS HA 1 1 2 854 1 1 25 LYS HB2 H 18.439 -3.673 2.660 1.00 . A A . 25 LYS HB2 1 1 2 855 1 1 25 LYS HB3 H 19.624 -4.346 1.539 1.00 . A A . 25 LYS HB3 1 1 2 856 1 1 25 LYS HD2 H 20.746 -5.461 4.839 1.00 . A A . 25 LYS HD2 1 1 2 857 1 1 25 LYS HD3 H 19.479 -5.762 3.650 1.00 . A A . 25 LYS HD3 1 1 2 858 1 1 25 LYS HE2 H 21.145 -6.003 1.870 1.00 . A A . 25 LYS HE2 1 1 2 859 1 1 25 LYS HE3 H 22.447 -5.591 3.004 1.00 . A A . 25 LYS HE3 1 1 2 860 1 1 25 LYS HG2 H 21.413 -3.511 3.185 1.00 . A A . 25 LYS HG2 1 1 2 861 1 1 25 LYS HG3 H 20.090 -3.286 4.331 1.00 . A A . 25 LYS HG3 1 1 2 862 1 1 25 LYS HZ1 H 21.829 -7.476 4.372 1.00 . A A . 25 LYS HZ1 1 1 2 863 1 1 25 LYS HZ2 H 22.168 -8.003 2.793 1.00 . A A . 25 LYS HZ2 1 1 2 864 1 1 25 LYS HZ3 H 20.558 -7.870 3.319 1.00 . A A . 25 LYS HZ3 1 1 2 865 1 1 25 LYS N N 18.389 -1.494 1.864 1.00 . A A . 25 LYS N 1 1 2 866 1 1 25 LYS NZ N 21.509 -7.454 3.382 1.00 . A A . 25 LYS NZ 1 1 2 867 1 1 25 LYS O O 19.241 -2.685 -0.558 1.00 . A A . 25 LYS O 1 1 2 868 1 1 25 LYS OXT O 21.219 -1.982 -0.075 1.00 . A A . 25 LYS OXT 1 1 3 869 1 1 1 HIS C C -20.034 1.980 1.095 1.00 . A A . 1 HIS C 1 1 3 870 1 1 1 HIS CA C -19.676 3.461 1.284 1.00 . A A . 1 HIS CA 1 1 3 871 1 1 1 HIS CB C -20.852 4.232 1.897 1.00 . A A . 1 HIS CB 1 1 3 872 1 1 1 HIS CD2 C -20.418 6.820 2.064 1.00 . A A . 1 HIS CD2 1 1 3 873 1 1 1 HIS CE1 C -19.377 6.845 3.964 1.00 . A A . 1 HIS CE1 1 1 3 874 1 1 1 HIS CG C -20.353 5.519 2.499 1.00 . A A . 1 HIS CG 1 1 3 875 1 1 1 HIS HA H -18.804 3.559 1.912 1.00 . A A . 1 HIS HA 1 1 3 876 1 1 1 HIS HB2 H -21.579 4.452 1.129 1.00 . A A . 1 HIS HB2 1 1 3 877 1 1 1 HIS HB3 H -21.313 3.632 2.667 1.00 . A A . 1 HIS HB3 1 1 3 878 1 1 1 HIS HD1 H -19.478 4.792 4.287 1.00 . A A . 1 HIS HD1 1 1 3 879 1 1 1 HIS HD2 H -20.879 7.146 1.143 1.00 . A A . 1 HIS HD2 1 1 3 880 1 1 1 HIS HE1 H -18.850 7.182 4.845 1.00 . A A . 1 HIS HE1 1 1 3 881 1 1 1 HIS N N -19.433 4.101 -0.045 1.00 . A A . 1 HIS N 1 1 3 882 1 1 1 HIS ND1 N -19.685 5.559 3.714 1.00 . A A . 1 HIS ND1 1 1 3 883 1 1 1 HIS NE2 N -19.800 7.655 2.990 1.00 . A A . 1 HIS NE2 1 1 3 884 1 1 1 HIS O O -21.192 1.604 1.099 1.00 . A A . 1 HIS O 1 1 3 885 1 1 2 ALA C C -18.236 -1.163 1.430 1.00 . A A . 2 ALA C 1 1 3 886 1 1 2 ALA CA C -19.313 -0.320 0.733 1.00 . A A . 2 ALA CA 1 1 3 887 1 1 2 ALA CB C -19.264 -0.528 -0.782 1.00 . A A . 2 ALA CB 1 1 3 888 1 1 2 ALA H H -18.120 1.469 0.924 1.00 . A A . 2 ALA H 1 1 3 889 1 1 2 ALA HA H -20.291 -0.575 1.107 1.00 . A A . 2 ALA HA 1 1 3 890 1 1 2 ALA HB1 H -20.051 0.046 -1.249 1.00 . A A . 2 ALA HB1 1 1 3 891 1 1 2 ALA HB2 H -19.400 -1.576 -1.005 1.00 . A A . 2 ALA HB2 1 1 3 892 1 1 2 ALA HB3 H -18.306 -0.201 -1.160 1.00 . A A . 2 ALA HB3 1 1 3 893 1 1 2 ALA N N -19.043 1.139 0.927 1.00 . A A . 2 ALA N 1 1 3 894 1 1 2 ALA O O -17.847 -2.210 0.945 1.00 . A A . 2 ALA O 1 1 3 895 1 1 3 TRP C C -15.526 -1.831 2.406 1.00 . A A . 3 TRP C 1 1 3 896 1 1 3 TRP CA C -16.705 -1.467 3.326 1.00 . A A . 3 TRP CA 1 1 3 897 1 1 3 TRP CB C -17.409 -2.727 3.848 1.00 . A A . 3 TRP CB 1 1 3 898 1 1 3 TRP CD1 C -18.953 -2.032 5.729 1.00 . A A . 3 TRP CD1 1 1 3 899 1 1 3 TRP CD2 C -16.990 -2.839 6.477 1.00 . A A . 3 TRP CD2 1 1 3 900 1 1 3 TRP CE2 C -17.749 -2.492 7.620 1.00 . A A . 3 TRP CE2 1 1 3 901 1 1 3 TRP CE3 C -15.703 -3.376 6.672 1.00 . A A . 3 TRP CE3 1 1 3 902 1 1 3 TRP CG C -17.777 -2.537 5.287 1.00 . A A . 3 TRP CG 1 1 3 903 1 1 3 TRP CH2 C -15.970 -3.204 9.086 1.00 . A A . 3 TRP CH2 1 1 3 904 1 1 3 TRP CZ2 C -17.249 -2.669 8.911 1.00 . A A . 3 TRP CZ2 1 1 3 905 1 1 3 TRP CZ3 C -15.198 -3.557 7.970 1.00 . A A . 3 TRP CZ3 1 1 3 906 1 1 3 TRP H H -18.095 0.134 2.932 1.00 . A A . 3 TRP H 1 1 3 907 1 1 3 TRP HA H -16.353 -0.876 4.158 1.00 . A A . 3 TRP HA 1 1 3 908 1 1 3 TRP HB2 H -18.302 -2.909 3.270 1.00 . A A . 3 TRP HB2 1 1 3 909 1 1 3 TRP HB3 H -16.745 -3.575 3.758 1.00 . A A . 3 TRP HB3 1 1 3 910 1 1 3 TRP HD1 H -19.770 -1.703 5.104 1.00 . A A . 3 TRP HD1 1 1 3 911 1 1 3 TRP HE1 H -19.667 -1.682 7.681 1.00 . A A . 3 TRP HE1 1 1 3 912 1 1 3 TRP HE3 H -15.102 -3.651 5.819 1.00 . A A . 3 TRP HE3 1 1 3 913 1 1 3 TRP HH2 H -15.575 -3.346 10.082 1.00 . A A . 3 TRP HH2 1 1 3 914 1 1 3 TRP HZ2 H -17.847 -2.397 9.768 1.00 . A A . 3 TRP HZ2 1 1 3 915 1 1 3 TRP HZ3 H -14.210 -3.970 8.109 1.00 . A A . 3 TRP HZ3 1 1 3 916 1 1 3 TRP N N -17.758 -0.710 2.570 1.00 . A A . 3 TRP N 1 1 3 917 1 1 3 TRP NE1 N -18.936 -2.005 7.113 1.00 . A A . 3 TRP NE1 1 1 3 918 1 1 3 TRP O O -15.157 -2.984 2.276 1.00 . A A . 3 TRP O 1 1 3 919 1 1 4 TYR C C -12.541 -0.293 1.264 1.00 . A A . 4 TYR C 1 1 3 920 1 1 4 TYR CA C -13.770 -1.136 0.866 1.00 . A A . 4 TYR CA 1 1 3 921 1 1 4 TYR CB C -14.267 -0.788 -0.551 1.00 . A A . 4 TYR CB 1 1 3 922 1 1 4 TYR CD1 C -15.373 1.472 -0.290 1.00 . A A . 4 TYR CD1 1 1 3 923 1 1 4 TYR CD2 C -13.249 1.342 -1.455 1.00 . A A . 4 TYR CD2 1 1 3 924 1 1 4 TYR CE1 C -15.402 2.856 -0.503 1.00 . A A . 4 TYR CE1 1 1 3 925 1 1 4 TYR CE2 C -13.278 2.724 -1.663 1.00 . A A . 4 TYR CE2 1 1 3 926 1 1 4 TYR CG C -14.297 0.713 -0.766 1.00 . A A . 4 TYR CG 1 1 3 927 1 1 4 TYR CZ C -14.355 3.482 -1.188 1.00 . A A . 4 TYR CZ 1 1 3 928 1 1 4 TYR H H -15.238 0.072 1.894 1.00 . A A . 4 TYR H 1 1 3 929 1 1 4 TYR HA H -13.521 -2.184 0.911 1.00 . A A . 4 TYR HA 1 1 3 930 1 1 4 TYR HB2 H -13.607 -1.235 -1.278 1.00 . A A . 4 TYR HB2 1 1 3 931 1 1 4 TYR HB3 H -15.262 -1.186 -0.685 1.00 . A A . 4 TYR HB3 1 1 3 932 1 1 4 TYR HD1 H -16.181 0.990 0.238 1.00 . A A . 4 TYR HD1 1 1 3 933 1 1 4 TYR HD2 H -12.419 0.757 -1.821 1.00 . A A . 4 TYR HD2 1 1 3 934 1 1 4 TYR HE1 H -16.233 3.441 -0.135 1.00 . A A . 4 TYR HE1 1 1 3 935 1 1 4 TYR HE2 H -12.470 3.206 -2.192 1.00 . A A . 4 TYR HE2 1 1 3 936 1 1 4 TYR HH H -14.222 5.009 -2.330 1.00 . A A . 4 TYR HH 1 1 3 937 1 1 4 TYR N N -14.928 -0.850 1.771 1.00 . A A . 4 TYR N 1 1 3 938 1 1 4 TYR O O -11.664 -0.042 0.458 1.00 . A A . 4 TYR O 1 1 3 939 1 1 4 TYR OH O -14.385 4.846 -1.397 1.00 . A A . 4 TYR OH 1 1 3 940 1 1 5 SER C C -10.014 0.091 3.003 1.00 . A A . 5 SER C 1 1 3 941 1 1 5 SER CA C -11.290 0.943 2.959 1.00 . A A . 5 SER CA 1 1 3 942 1 1 5 SER CB C -11.652 1.431 4.362 1.00 . A A . 5 SER CB 1 1 3 943 1 1 5 SER H H -13.174 -0.096 3.143 1.00 . A A . 5 SER H 1 1 3 944 1 1 5 SER HA H -11.149 1.784 2.305 1.00 . A A . 5 SER HA 1 1 3 945 1 1 5 SER HB2 H -12.136 0.639 4.910 1.00 . A A . 5 SER HB2 1 1 3 946 1 1 5 SER HB3 H -10.750 1.726 4.883 1.00 . A A . 5 SER HB3 1 1 3 947 1 1 5 SER HG H -12.287 3.182 4.927 1.00 . A A . 5 SER HG 1 1 3 948 1 1 5 SER N N -12.464 0.129 2.507 1.00 . A A . 5 SER N 1 1 3 949 1 1 5 SER O O -8.914 0.611 2.979 1.00 . A A . 5 SER O 1 1 3 950 1 1 5 SER OG O -12.537 2.538 4.261 1.00 . A A . 5 SER OG 1 1 3 951 1 1 6 HIS C C -8.281 -2.155 1.722 1.00 . A A . 6 HIS C 1 1 3 952 1 1 6 HIS CA C -8.937 -2.088 3.104 1.00 . A A . 6 HIS CA 1 1 3 953 1 1 6 HIS CB C -9.448 -3.468 3.528 1.00 . A A . 6 HIS CB 1 1 3 954 1 1 6 HIS CD2 C -7.711 -5.411 3.171 1.00 . A A . 6 HIS CD2 1 1 3 955 1 1 6 HIS CE1 C -6.565 -5.148 4.990 1.00 . A A . 6 HIS CE1 1 1 3 956 1 1 6 HIS CG C -8.278 -4.359 3.849 1.00 . A A . 6 HIS CG 1 1 3 957 1 1 6 HIS H H -11.042 -1.608 3.081 1.00 . A A . 6 HIS H 1 1 3 958 1 1 6 HIS HA H -8.234 -1.717 3.828 1.00 . A A . 6 HIS HA 1 1 3 959 1 1 6 HIS HB2 H -10.075 -3.369 4.402 1.00 . A A . 6 HIS HB2 1 1 3 960 1 1 6 HIS HB3 H -10.020 -3.904 2.722 1.00 . A A . 6 HIS HB3 1 1 3 961 1 1 6 HIS HD1 H -7.674 -3.540 5.707 1.00 . A A . 6 HIS HD1 1 1 3 962 1 1 6 HIS HD2 H -8.053 -5.795 2.221 1.00 . A A . 6 HIS HD2 1 1 3 963 1 1 6 HIS HE1 H -5.828 -5.273 5.770 1.00 . A A . 6 HIS HE1 1 1 3 964 1 1 6 HIS N N -10.148 -1.210 3.065 1.00 . A A . 6 HIS N 1 1 3 965 1 1 6 HIS ND1 N -7.529 -4.209 5.006 1.00 . A A . 6 HIS ND1 1 1 3 966 1 1 6 HIS NE2 N -6.631 -5.907 3.894 1.00 . A A . 6 HIS NE2 1 1 3 967 1 1 6 HIS O O -7.094 -2.392 1.606 1.00 . A A . 6 HIS O 1 1 3 968 1 1 7 TYR C C -7.447 -0.849 -0.868 1.00 . A A . 7 TYR C 1 1 3 969 1 1 7 TYR CA C -8.456 -1.984 -0.701 1.00 . A A . 7 TYR CA 1 1 3 970 1 1 7 TYR CB C -9.639 -1.811 -1.661 1.00 . A A . 7 TYR CB 1 1 3 971 1 1 7 TYR CD1 C -9.841 -4.165 -2.547 1.00 . A A . 7 TYR CD1 1 1 3 972 1 1 7 TYR CD2 C -11.619 -3.288 -1.150 1.00 . A A . 7 TYR CD2 1 1 3 973 1 1 7 TYR CE1 C -10.532 -5.378 -2.664 1.00 . A A . 7 TYR CE1 1 1 3 974 1 1 7 TYR CE2 C -12.310 -4.500 -1.268 1.00 . A A . 7 TYR CE2 1 1 3 975 1 1 7 TYR CG C -10.384 -3.121 -1.789 1.00 . A A . 7 TYR CG 1 1 3 976 1 1 7 TYR CZ C -11.765 -5.545 -2.026 1.00 . A A . 7 TYR CZ 1 1 3 977 1 1 7 TYR H H -9.992 -1.746 0.797 1.00 . A A . 7 TYR H 1 1 3 978 1 1 7 TYR HA H -7.976 -2.930 -0.869 1.00 . A A . 7 TYR HA 1 1 3 979 1 1 7 TYR HB2 H -10.306 -1.052 -1.278 1.00 . A A . 7 TYR HB2 1 1 3 980 1 1 7 TYR HB3 H -9.273 -1.511 -2.631 1.00 . A A . 7 TYR HB3 1 1 3 981 1 1 7 TYR HD1 H -8.888 -4.036 -3.039 1.00 . A A . 7 TYR HD1 1 1 3 982 1 1 7 TYR HD2 H -12.038 -2.483 -0.567 1.00 . A A . 7 TYR HD2 1 1 3 983 1 1 7 TYR HE1 H -10.113 -6.183 -3.249 1.00 . A A . 7 TYR HE1 1 1 3 984 1 1 7 TYR HE2 H -13.262 -4.629 -0.775 1.00 . A A . 7 TYR HE2 1 1 3 985 1 1 7 TYR HH H -12.462 -7.158 -1.277 1.00 . A A . 7 TYR HH 1 1 3 986 1 1 7 TYR N N -9.041 -1.940 0.675 1.00 . A A . 7 TYR N 1 1 3 987 1 1 7 TYR O O -6.328 -1.064 -1.295 1.00 . A A . 7 TYR O 1 1 3 988 1 1 7 TYR OH O -12.445 -6.740 -2.142 1.00 . A A . 7 TYR OH 1 1 3 989 1 1 8 VAL C C -5.719 1.295 0.377 1.00 . A A . 8 VAL C 1 1 3 990 1 1 8 VAL CA C -6.870 1.497 -0.621 1.00 . A A . 8 VAL CA 1 1 3 991 1 1 8 VAL CB C -7.684 2.764 -0.305 1.00 . A A . 8 VAL CB 1 1 3 992 1 1 8 VAL CG1 C -8.141 2.761 1.157 1.00 . A A . 8 VAL CG1 1 1 3 993 1 1 8 VAL CG2 C -6.817 4.001 -0.561 1.00 . A A . 8 VAL CG2 1 1 3 994 1 1 8 VAL H H -8.725 0.491 -0.150 1.00 . A A . 8 VAL H 1 1 3 995 1 1 8 VAL HA H -6.479 1.551 -1.622 1.00 . A A . 8 VAL HA 1 1 3 996 1 1 8 VAL HB H -8.552 2.799 -0.948 1.00 . A A . 8 VAL HB 1 1 3 997 1 1 8 VAL HG11 H -8.491 3.747 1.426 1.00 . A A . 8 VAL HG11 1 1 3 998 1 1 8 VAL HG12 H -7.314 2.488 1.795 1.00 . A A . 8 VAL HG12 1 1 3 999 1 1 8 VAL HG13 H -8.943 2.050 1.282 1.00 . A A . 8 VAL HG13 1 1 3 1000 1 1 8 VAL HG21 H -5.989 4.010 0.132 1.00 . A A . 8 VAL HG21 1 1 3 1001 1 1 8 VAL HG22 H -7.411 4.891 -0.424 1.00 . A A . 8 VAL HG22 1 1 3 1002 1 1 8 VAL HG23 H -6.439 3.973 -1.573 1.00 . A A . 8 VAL HG23 1 1 3 1003 1 1 8 VAL N N -7.825 0.352 -0.510 1.00 . A A . 8 VAL N 1 1 3 1004 1 1 8 VAL O O -4.612 1.746 0.158 1.00 . A A . 8 VAL O 1 1 3 1005 1 1 9 LEU C C -3.963 -0.762 1.910 1.00 . A A . 9 LEU C 1 1 3 1006 1 1 9 LEU CA C -4.901 0.322 2.457 1.00 . A A . 9 LEU CA 1 1 3 1007 1 1 9 LEU CB C -5.635 -0.175 3.711 1.00 . A A . 9 LEU CB 1 1 3 1008 1 1 9 LEU CD1 C -3.482 -0.238 5.001 1.00 . A A . 9 LEU CD1 1 1 3 1009 1 1 9 LEU CD2 C -4.878 1.836 5.007 1.00 . A A . 9 LEU CD2 1 1 3 1010 1 1 9 LEU CG C -4.913 0.305 4.978 1.00 . A A . 9 LEU CG 1 1 3 1011 1 1 9 LEU H H -6.870 0.220 1.591 1.00 . A A . 9 LEU H 1 1 3 1012 1 1 9 LEU HA H -4.352 1.223 2.675 1.00 . A A . 9 LEU HA 1 1 3 1013 1 1 9 LEU HB2 H -6.645 0.209 3.710 1.00 . A A . 9 LEU HB2 1 1 3 1014 1 1 9 LEU HB3 H -5.664 -1.255 3.704 1.00 . A A . 9 LEU HB3 1 1 3 1015 1 1 9 LEU HD11 H -3.478 -1.259 4.649 1.00 . A A . 9 LEU HD11 1 1 3 1016 1 1 9 LEU HD12 H -3.101 -0.205 6.011 1.00 . A A . 9 LEU HD12 1 1 3 1017 1 1 9 LEU HD13 H -2.857 0.366 4.361 1.00 . A A . 9 LEU HD13 1 1 3 1018 1 1 9 LEU HD21 H -4.662 2.172 6.011 1.00 . A A . 9 LEU HD21 1 1 3 1019 1 1 9 LEU HD22 H -5.836 2.224 4.696 1.00 . A A . 9 LEU HD22 1 1 3 1020 1 1 9 LEU HD23 H -4.110 2.191 4.336 1.00 . A A . 9 LEU HD23 1 1 3 1021 1 1 9 LEU HG H -5.444 -0.058 5.847 1.00 . A A . 9 LEU HG 1 1 3 1022 1 1 9 LEU N N -5.974 0.591 1.454 1.00 . A A . 9 LEU N 1 1 3 1023 1 1 9 LEU O O -2.756 -0.671 2.036 1.00 . A A . 9 LEU O 1 1 3 1024 1 1 10 LYS C C -2.869 -2.325 -0.482 1.00 . A A . 10 LYS C 1 1 3 1025 1 1 10 LYS CA C -3.660 -2.865 0.715 1.00 . A A . 10 LYS CA 1 1 3 1026 1 1 10 LYS CB C -4.636 -3.959 0.270 1.00 . A A . 10 LYS CB 1 1 3 1027 1 1 10 LYS CD C -4.833 -6.335 -0.491 1.00 . A A . 10 LYS CD 1 1 3 1028 1 1 10 LYS CE C -4.351 -7.685 0.052 1.00 . A A . 10 LYS CE 1 1 3 1029 1 1 10 LYS CG C -3.857 -5.233 -0.069 1.00 . A A . 10 LYS CG 1 1 3 1030 1 1 10 LYS H H -5.492 -1.825 1.187 1.00 . A A . 10 LYS H 1 1 3 1031 1 1 10 LYS HA H -2.988 -3.251 1.466 1.00 . A A . 10 LYS HA 1 1 3 1032 1 1 10 LYS HB2 H -5.334 -4.164 1.070 1.00 . A A . 10 LYS HB2 1 1 3 1033 1 1 10 LYS HB3 H -5.176 -3.626 -0.604 1.00 . A A . 10 LYS HB3 1 1 3 1034 1 1 10 LYS HD2 H -5.815 -6.118 -0.094 1.00 . A A . 10 LYS HD2 1 1 3 1035 1 1 10 LYS HD3 H -4.883 -6.379 -1.568 1.00 . A A . 10 LYS HD3 1 1 3 1036 1 1 10 LYS HE2 H -3.853 -7.549 1.002 1.00 . A A . 10 LYS HE2 1 1 3 1037 1 1 10 LYS HE3 H -5.183 -8.365 0.156 1.00 . A A . 10 LYS HE3 1 1 3 1038 1 1 10 LYS HG2 H -3.171 -5.030 -0.878 1.00 . A A . 10 LYS HG2 1 1 3 1039 1 1 10 LYS HG3 H -3.304 -5.557 0.800 1.00 . A A . 10 LYS HG3 1 1 3 1040 1 1 10 LYS HZ1 H -3.904 -8.403 -1.855 1.00 . A A . 10 LYS HZ1 1 1 3 1041 1 1 10 LYS HZ2 H -2.951 -9.074 -0.619 1.00 . A A . 10 LYS HZ2 1 1 3 1042 1 1 10 LYS HZ3 H -2.659 -7.489 -1.152 1.00 . A A . 10 LYS HZ3 1 1 3 1043 1 1 10 LYS N N -4.513 -1.781 1.287 1.00 . A A . 10 LYS N 1 1 3 1044 1 1 10 LYS NZ N -3.395 -8.201 -0.971 1.00 . A A . 10 LYS NZ 1 1 3 1045 1 1 10 LYS O O -1.702 -2.624 -0.648 1.00 . A A . 10 LYS O 1 1 3 1046 1 1 11 PHE C C -1.695 0.032 -2.010 1.00 . A A . 11 PHE C 1 1 3 1047 1 1 11 PHE CA C -2.775 -0.946 -2.488 1.00 . A A . 11 PHE CA 1 1 3 1048 1 1 11 PHE CB C -3.851 -0.213 -3.298 1.00 . A A . 11 PHE CB 1 1 3 1049 1 1 11 PHE CD1 C -3.038 -0.502 -5.670 1.00 . A A . 11 PHE CD1 1 1 3 1050 1 1 11 PHE CD2 C -2.891 1.691 -4.644 1.00 . A A . 11 PHE CD2 1 1 3 1051 1 1 11 PHE CE1 C -2.477 0.011 -6.846 1.00 . A A . 11 PHE CE1 1 1 3 1052 1 1 11 PHE CE2 C -2.329 2.203 -5.820 1.00 . A A . 11 PHE CE2 1 1 3 1053 1 1 11 PHE CG C -3.245 0.339 -4.569 1.00 . A A . 11 PHE CG 1 1 3 1054 1 1 11 PHE CZ C -2.123 1.363 -6.921 1.00 . A A . 11 PHE CZ 1 1 3 1055 1 1 11 PHE H H -4.434 -1.287 -1.147 1.00 . A A . 11 PHE H 1 1 3 1056 1 1 11 PHE HA H -2.336 -1.734 -3.080 1.00 . A A . 11 PHE HA 1 1 3 1057 1 1 11 PHE HB2 H -4.645 -0.903 -3.548 1.00 . A A . 11 PHE HB2 1 1 3 1058 1 1 11 PHE HB3 H -4.253 0.598 -2.710 1.00 . A A . 11 PHE HB3 1 1 3 1059 1 1 11 PHE HD1 H -3.311 -1.545 -5.613 1.00 . A A . 11 PHE HD1 1 1 3 1060 1 1 11 PHE HD2 H -3.050 2.340 -3.796 1.00 . A A . 11 PHE HD2 1 1 3 1061 1 1 11 PHE HE1 H -2.318 -0.637 -7.695 1.00 . A A . 11 PHE HE1 1 1 3 1062 1 1 11 PHE HE2 H -2.056 3.246 -5.879 1.00 . A A . 11 PHE HE2 1 1 3 1063 1 1 11 PHE HZ H -1.690 1.758 -7.829 1.00 . A A . 11 PHE HZ 1 1 3 1064 1 1 11 PHE N N -3.494 -1.521 -1.309 1.00 . A A . 11 PHE N 1 1 3 1065 1 1 11 PHE O O -0.597 0.055 -2.532 1.00 . A A . 11 PHE O 1 1 3 1066 1 1 12 PHE C C 0.164 1.047 0.189 1.00 . A A . 12 PHE C 1 1 3 1067 1 1 12 PHE CA C -0.989 1.801 -0.486 1.00 . A A . 12 PHE CA 1 1 3 1068 1 1 12 PHE CB C -1.747 2.658 0.535 1.00 . A A . 12 PHE CB 1 1 3 1069 1 1 12 PHE CD1 C -0.536 4.856 0.265 1.00 . A A . 12 PHE CD1 1 1 3 1070 1 1 12 PHE CD2 C -0.303 3.643 2.352 1.00 . A A . 12 PHE CD2 1 1 3 1071 1 1 12 PHE CE1 C 0.303 5.862 0.756 1.00 . A A . 12 PHE CE1 1 1 3 1072 1 1 12 PHE CE2 C 0.536 4.650 2.843 1.00 . A A . 12 PHE CE2 1 1 3 1073 1 1 12 PHE CG C -0.840 3.745 1.062 1.00 . A A . 12 PHE CG 1 1 3 1074 1 1 12 PHE CZ C 0.839 5.759 2.045 1.00 . A A . 12 PHE CZ 1 1 3 1075 1 1 12 PHE H H -2.890 0.784 -0.605 1.00 . A A . 12 PHE H 1 1 3 1076 1 1 12 PHE HA H -0.615 2.423 -1.284 1.00 . A A . 12 PHE HA 1 1 3 1077 1 1 12 PHE HB2 H -2.606 3.107 0.058 1.00 . A A . 12 PHE HB2 1 1 3 1078 1 1 12 PHE HB3 H -2.076 2.035 1.353 1.00 . A A . 12 PHE HB3 1 1 3 1079 1 1 12 PHE HD1 H -0.951 4.936 -0.730 1.00 . A A . 12 PHE HD1 1 1 3 1080 1 1 12 PHE HD2 H -0.537 2.787 2.967 1.00 . A A . 12 PHE HD2 1 1 3 1081 1 1 12 PHE HE1 H 0.537 6.719 0.141 1.00 . A A . 12 PHE HE1 1 1 3 1082 1 1 12 PHE HE2 H 0.950 4.571 3.837 1.00 . A A . 12 PHE HE2 1 1 3 1083 1 1 12 PHE HZ H 1.488 6.536 2.424 1.00 . A A . 12 PHE HZ 1 1 3 1084 1 1 12 PHE N N -1.998 0.830 -1.012 1.00 . A A . 12 PHE N 1 1 3 1085 1 1 12 PHE O O 1.318 1.383 0.013 1.00 . A A . 12 PHE O 1 1 3 1086 1 1 13 LEU C C 1.801 -1.494 0.588 1.00 . A A . 13 LEU C 1 1 3 1087 1 1 13 LEU CA C 0.943 -0.758 1.629 1.00 . A A . 13 LEU CA 1 1 3 1088 1 1 13 LEU CB C 0.220 -1.762 2.533 1.00 . A A . 13 LEU CB 1 1 3 1089 1 1 13 LEU CD1 C 1.312 -1.266 4.730 1.00 . A A . 13 LEU CD1 1 1 3 1090 1 1 13 LEU CD2 C 0.662 -3.608 4.159 1.00 . A A . 13 LEU CD2 1 1 3 1091 1 1 13 LEU CG C 1.190 -2.287 3.596 1.00 . A A . 13 LEU CG 1 1 3 1092 1 1 13 LEU H H -1.080 -0.234 1.076 1.00 . A A . 13 LEU H 1 1 3 1093 1 1 13 LEU HA H 1.559 -0.105 2.225 1.00 . A A . 13 LEU HA 1 1 3 1094 1 1 13 LEU HB2 H -0.615 -1.274 3.016 1.00 . A A . 13 LEU HB2 1 1 3 1095 1 1 13 LEU HB3 H -0.142 -2.588 1.939 1.00 . A A . 13 LEU HB3 1 1 3 1096 1 1 13 LEU HD11 H 1.810 -1.722 5.573 1.00 . A A . 13 LEU HD11 1 1 3 1097 1 1 13 LEU HD12 H 0.326 -0.937 5.027 1.00 . A A . 13 LEU HD12 1 1 3 1098 1 1 13 LEU HD13 H 1.886 -0.416 4.390 1.00 . A A . 13 LEU HD13 1 1 3 1099 1 1 13 LEU HD21 H -0.322 -3.456 4.576 1.00 . A A . 13 LEU HD21 1 1 3 1100 1 1 13 LEU HD22 H 1.329 -3.963 4.932 1.00 . A A . 13 LEU HD22 1 1 3 1101 1 1 13 LEU HD23 H 0.607 -4.341 3.368 1.00 . A A . 13 LEU HD23 1 1 3 1102 1 1 13 LEU HG H 2.161 -2.446 3.150 1.00 . A A . 13 LEU HG 1 1 3 1103 1 1 13 LEU N N -0.140 0.024 0.953 1.00 . A A . 13 LEU N 1 1 3 1104 1 1 13 LEU O O 2.964 -1.762 0.816 1.00 . A A . 13 LEU O 1 1 3 1105 1 1 14 LEU C C 3.023 -1.558 -2.268 1.00 . A A . 14 LEU C 1 1 3 1106 1 1 14 LEU CA C 2.028 -2.522 -1.609 1.00 . A A . 14 LEU CA 1 1 3 1107 1 1 14 LEU CB C 0.993 -3.012 -2.627 1.00 . A A . 14 LEU CB 1 1 3 1108 1 1 14 LEU CD1 C 0.693 -5.207 -3.794 1.00 . A A . 14 LEU CD1 1 1 3 1109 1 1 14 LEU CD2 C 1.930 -3.352 -4.922 1.00 . A A . 14 LEU CD2 1 1 3 1110 1 1 14 LEU CG C 1.641 -4.025 -3.577 1.00 . A A . 14 LEU CG 1 1 3 1111 1 1 14 LEU H H 0.300 -1.584 -0.720 1.00 . A A . 14 LEU H 1 1 3 1112 1 1 14 LEU HA H 2.550 -3.358 -1.182 1.00 . A A . 14 LEU HA 1 1 3 1113 1 1 14 LEU HB2 H 0.169 -3.479 -2.108 1.00 . A A . 14 LEU HB2 1 1 3 1114 1 1 14 LEU HB3 H 0.626 -2.171 -3.198 1.00 . A A . 14 LEU HB3 1 1 3 1115 1 1 14 LEU HD11 H -0.176 -4.874 -4.345 1.00 . A A . 14 LEU HD11 1 1 3 1116 1 1 14 LEU HD12 H 0.384 -5.600 -2.838 1.00 . A A . 14 LEU HD12 1 1 3 1117 1 1 14 LEU HD13 H 1.201 -5.977 -4.354 1.00 . A A . 14 LEU HD13 1 1 3 1118 1 1 14 LEU HD21 H 1.002 -3.193 -5.453 1.00 . A A . 14 LEU HD21 1 1 3 1119 1 1 14 LEU HD22 H 2.577 -3.985 -5.511 1.00 . A A . 14 LEU HD22 1 1 3 1120 1 1 14 LEU HD23 H 2.416 -2.402 -4.753 1.00 . A A . 14 LEU HD23 1 1 3 1121 1 1 14 LEU HG H 2.566 -4.383 -3.146 1.00 . A A . 14 LEU HG 1 1 3 1122 1 1 14 LEU N N 1.238 -1.814 -0.554 1.00 . A A . 14 LEU N 1 1 3 1123 1 1 14 LEU O O 4.094 -1.953 -2.691 1.00 . A A . 14 LEU O 1 1 3 1124 1 1 15 VAL C C 4.378 1.443 -1.903 1.00 . A A . 15 VAL C 1 1 3 1125 1 1 15 VAL CA C 3.592 0.694 -2.989 1.00 . A A . 15 VAL CA 1 1 3 1126 1 1 15 VAL CB C 2.673 1.649 -3.765 1.00 . A A . 15 VAL CB 1 1 3 1127 1 1 15 VAL CG1 C 3.468 2.863 -4.251 1.00 . A A . 15 VAL CG1 1 1 3 1128 1 1 15 VAL CG2 C 2.085 0.916 -4.975 1.00 . A A . 15 VAL CG2 1 1 3 1129 1 1 15 VAL H H 1.805 -0.014 -2.011 1.00 . A A . 15 VAL H 1 1 3 1130 1 1 15 VAL HA H 4.270 0.203 -3.670 1.00 . A A . 15 VAL HA 1 1 3 1131 1 1 15 VAL HB H 1.871 1.978 -3.120 1.00 . A A . 15 VAL HB 1 1 3 1132 1 1 15 VAL HG11 H 3.451 3.631 -3.491 1.00 . A A . 15 VAL HG11 1 1 3 1133 1 1 15 VAL HG12 H 3.025 3.245 -5.158 1.00 . A A . 15 VAL HG12 1 1 3 1134 1 1 15 VAL HG13 H 4.490 2.571 -4.444 1.00 . A A . 15 VAL HG13 1 1 3 1135 1 1 15 VAL HG21 H 1.427 0.129 -4.637 1.00 . A A . 15 VAL HG21 1 1 3 1136 1 1 15 VAL HG22 H 2.886 0.487 -5.561 1.00 . A A . 15 VAL HG22 1 1 3 1137 1 1 15 VAL HG23 H 1.529 1.614 -5.584 1.00 . A A . 15 VAL HG23 1 1 3 1138 1 1 15 VAL N N 2.673 -0.302 -2.359 1.00 . A A . 15 VAL N 1 1 3 1139 1 1 15 VAL O O 5.594 1.413 -1.876 1.00 . A A . 15 VAL O 1 1 3 1140 1 1 16 PHE C C 5.016 1.890 1.099 1.00 . A A . 16 PHE C 1 1 3 1141 1 1 16 PHE CA C 4.394 2.859 0.081 1.00 . A A . 16 PHE CA 1 1 3 1142 1 1 16 PHE CB C 3.310 3.713 0.745 1.00 . A A . 16 PHE CB 1 1 3 1143 1 1 16 PHE CD1 C 4.351 6.008 0.867 1.00 . A A . 16 PHE CD1 1 1 3 1144 1 1 16 PHE CD2 C 4.152 4.707 2.904 1.00 . A A . 16 PHE CD2 1 1 3 1145 1 1 16 PHE CE1 C 4.946 7.048 1.590 1.00 . A A . 16 PHE CE1 1 1 3 1146 1 1 16 PHE CE2 C 4.747 5.748 3.627 1.00 . A A . 16 PHE CE2 1 1 3 1147 1 1 16 PHE CG C 3.954 4.837 1.525 1.00 . A A . 16 PHE CG 1 1 3 1148 1 1 16 PHE CZ C 5.144 6.918 2.971 1.00 . A A . 16 PHE CZ 1 1 3 1149 1 1 16 PHE H H 2.711 2.113 -1.048 1.00 . A A . 16 PHE H 1 1 3 1150 1 1 16 PHE HA H 5.156 3.497 -0.338 1.00 . A A . 16 PHE HA 1 1 3 1151 1 1 16 PHE HB2 H 2.662 4.128 -0.015 1.00 . A A . 16 PHE HB2 1 1 3 1152 1 1 16 PHE HB3 H 2.728 3.098 1.416 1.00 . A A . 16 PHE HB3 1 1 3 1153 1 1 16 PHE HD1 H 4.198 6.109 -0.197 1.00 . A A . 16 PHE HD1 1 1 3 1154 1 1 16 PHE HD2 H 3.845 3.804 3.411 1.00 . A A . 16 PHE HD2 1 1 3 1155 1 1 16 PHE HE1 H 5.252 7.952 1.085 1.00 . A A . 16 PHE HE1 1 1 3 1156 1 1 16 PHE HE2 H 4.900 5.647 4.691 1.00 . A A . 16 PHE HE2 1 1 3 1157 1 1 16 PHE HZ H 5.603 7.721 3.528 1.00 . A A . 16 PHE HZ 1 1 3 1158 1 1 16 PHE N N 3.692 2.109 -1.006 1.00 . A A . 16 PHE N 1 1 3 1159 1 1 16 PHE O O 6.042 2.178 1.683 1.00 . A A . 16 PHE O 1 1 3 1160 1 1 17 GLY C C 6.321 -0.746 1.793 1.00 . A A . 17 GLY C 1 1 3 1161 1 1 17 GLY CA C 4.968 -0.236 2.295 1.00 . A A . 17 GLY CA 1 1 3 1162 1 1 17 GLY H H 3.579 0.530 0.833 1.00 . A A . 17 GLY H 1 1 3 1163 1 1 17 GLY HA2 H 5.100 0.249 3.254 1.00 . A A . 17 GLY HA2 1 1 3 1164 1 1 17 GLY HA3 H 4.292 -1.068 2.404 1.00 . A A . 17 GLY HA3 1 1 3 1165 1 1 17 GLY N N 4.406 0.746 1.316 1.00 . A A . 17 GLY N 1 1 3 1166 1 1 17 GLY O O 7.291 -0.766 2.528 1.00 . A A . 17 GLY O 1 1 3 1167 1 1 18 GLU C C 8.757 -0.546 0.109 1.00 . A A . 18 GLU C 1 1 3 1168 1 1 18 GLU CA C 7.696 -1.643 -0.009 1.00 . A A . 18 GLU CA 1 1 3 1169 1 1 18 GLU CB C 7.408 -1.978 -1.479 1.00 . A A . 18 GLU CB 1 1 3 1170 1 1 18 GLU CD C 9.405 -1.317 -2.849 1.00 . A A . 18 GLU CD 1 1 3 1171 1 1 18 GLU CG C 8.687 -2.485 -2.163 1.00 . A A . 18 GLU CG 1 1 3 1172 1 1 18 GLU H H 5.601 -1.111 -0.028 1.00 . A A . 18 GLU H 1 1 3 1173 1 1 18 GLU HA H 8.014 -2.524 0.519 1.00 . A A . 18 GLU HA 1 1 3 1174 1 1 18 GLU HB2 H 6.648 -2.744 -1.530 1.00 . A A . 18 GLU HB2 1 1 3 1175 1 1 18 GLU HB3 H 7.059 -1.092 -1.988 1.00 . A A . 18 GLU HB3 1 1 3 1176 1 1 18 GLU HG2 H 9.341 -2.925 -1.424 1.00 . A A . 18 GLU HG2 1 1 3 1177 1 1 18 GLU HG3 H 8.428 -3.229 -2.901 1.00 . A A . 18 GLU HG3 1 1 3 1178 1 1 18 GLU N N 6.397 -1.146 0.546 1.00 . A A . 18 GLU N 1 1 3 1179 1 1 18 GLU O O 9.870 -0.794 0.532 1.00 . A A . 18 GLU O 1 1 3 1180 1 1 18 GLU OE1 O 8.823 -0.734 -3.749 1.00 . A A . 18 GLU OE1 1 1 3 1181 1 1 18 GLU OE2 O 10.523 -1.026 -2.463 1.00 . A A . 18 GLU OE2 1 1 3 1182 1 1 19 ASN C C 9.844 1.935 1.320 1.00 . A A . 19 ASN C 1 1 3 1183 1 1 19 ASN CA C 9.384 1.794 -0.134 1.00 . A A . 19 ASN CA 1 1 3 1184 1 1 19 ASN CB C 8.616 3.040 -0.585 1.00 . A A . 19 ASN CB 1 1 3 1185 1 1 19 ASN CG C 8.741 3.197 -2.102 1.00 . A A . 19 ASN CG 1 1 3 1186 1 1 19 ASN H H 7.499 0.830 -0.563 1.00 . A A . 19 ASN H 1 1 3 1187 1 1 19 ASN HA H 10.227 1.623 -0.778 1.00 . A A . 19 ASN HA 1 1 3 1188 1 1 19 ASN HB2 H 7.574 2.938 -0.316 1.00 . A A . 19 ASN HB2 1 1 3 1189 1 1 19 ASN HB3 H 9.030 3.912 -0.101 1.00 . A A . 19 ASN HB3 1 1 3 1190 1 1 19 ASN HD21 H 7.273 1.918 -2.504 1.00 . A A . 19 ASN HD21 1 1 3 1191 1 1 19 ASN HD22 H 8.022 2.614 -3.859 1.00 . A A . 19 ASN HD22 1 1 3 1192 1 1 19 ASN N N 8.409 0.664 -0.243 1.00 . A A . 19 ASN N 1 1 3 1193 1 1 19 ASN ND2 N 7.946 2.520 -2.887 1.00 . A A . 19 ASN ND2 1 1 3 1194 1 1 19 ASN O O 11.006 2.160 1.595 1.00 . A A . 19 ASN O 1 1 3 1195 1 1 19 ASN OD1 O 9.571 3.945 -2.579 1.00 . A A . 19 ASN OD1 1 1 3 1196 1 1 20 GLY C C 10.156 0.678 4.079 1.00 . A A . 20 GLY C 1 1 3 1197 1 1 20 GLY CA C 9.295 1.884 3.693 1.00 . A A . 20 GLY CA 1 1 3 1198 1 1 20 GLY H H 8.009 1.589 1.991 1.00 . A A . 20 GLY H 1 1 3 1199 1 1 20 GLY HA2 H 9.849 2.797 3.864 1.00 . A A . 20 GLY HA2 1 1 3 1200 1 1 20 GLY HA3 H 8.397 1.888 4.292 1.00 . A A . 20 GLY HA3 1 1 3 1201 1 1 20 GLY N N 8.934 1.784 2.248 1.00 . A A . 20 GLY N 1 1 3 1202 1 1 20 GLY O O 11.184 0.820 4.715 1.00 . A A . 20 GLY O 1 1 3 1203 1 1 21 VAL C C 11.951 -1.633 3.368 1.00 . A A . 21 VAL C 1 1 3 1204 1 1 21 VAL CA C 10.562 -1.726 4.017 1.00 . A A . 21 VAL CA 1 1 3 1205 1 1 21 VAL CB C 9.767 -2.910 3.442 1.00 . A A . 21 VAL CB 1 1 3 1206 1 1 21 VAL CG1 C 10.618 -4.183 3.487 1.00 . A A . 21 VAL CG1 1 1 3 1207 1 1 21 VAL CG2 C 8.499 -3.126 4.274 1.00 . A A . 21 VAL CG2 1 1 3 1208 1 1 21 VAL H H 8.926 -0.598 3.160 1.00 . A A . 21 VAL H 1 1 3 1209 1 1 21 VAL HA H 10.658 -1.829 5.083 1.00 . A A . 21 VAL HA 1 1 3 1210 1 1 21 VAL HB H 9.496 -2.696 2.418 1.00 . A A . 21 VAL HB 1 1 3 1211 1 1 21 VAL HG11 H 11.490 -4.055 2.861 1.00 . A A . 21 VAL HG11 1 1 3 1212 1 1 21 VAL HG12 H 10.036 -5.018 3.126 1.00 . A A . 21 VAL HG12 1 1 3 1213 1 1 21 VAL HG13 H 10.930 -4.373 4.503 1.00 . A A . 21 VAL HG13 1 1 3 1214 1 1 21 VAL HG21 H 8.754 -3.624 5.198 1.00 . A A . 21 VAL HG21 1 1 3 1215 1 1 21 VAL HG22 H 7.804 -3.738 3.716 1.00 . A A . 21 VAL HG22 1 1 3 1216 1 1 21 VAL HG23 H 8.043 -2.172 4.492 1.00 . A A . 21 VAL HG23 1 1 3 1217 1 1 21 VAL N N 9.754 -0.509 3.685 1.00 . A A . 21 VAL N 1 1 3 1218 1 1 21 VAL O O 12.928 -2.125 3.899 1.00 . A A . 21 VAL O 1 1 3 1219 1 1 22 PHE C C 14.173 0.310 2.125 1.00 . A A . 22 PHE C 1 1 3 1220 1 1 22 PHE CA C 13.364 -0.860 1.540 1.00 . A A . 22 PHE CA 1 1 3 1221 1 1 22 PHE CB C 13.030 -0.599 0.069 1.00 . A A . 22 PHE CB 1 1 3 1222 1 1 22 PHE CD1 C 11.968 -2.861 -0.292 1.00 . A A . 22 PHE CD1 1 1 3 1223 1 1 22 PHE CD2 C 13.795 -2.187 -1.736 1.00 . A A . 22 PHE CD2 1 1 3 1224 1 1 22 PHE CE1 C 11.874 -4.077 -0.978 1.00 . A A . 22 PHE CE1 1 1 3 1225 1 1 22 PHE CE2 C 13.700 -3.402 -2.422 1.00 . A A . 22 PHE CE2 1 1 3 1226 1 1 22 PHE CG C 12.930 -1.915 -0.670 1.00 . A A . 22 PHE CG 1 1 3 1227 1 1 22 PHE CZ C 12.739 -4.347 -2.043 1.00 . A A . 22 PHE CZ 1 1 3 1228 1 1 22 PHE H H 11.239 -0.604 1.826 1.00 . A A . 22 PHE H 1 1 3 1229 1 1 22 PHE HA H 13.923 -1.775 1.631 1.00 . A A . 22 PHE HA 1 1 3 1230 1 1 22 PHE HB2 H 12.088 -0.074 0.000 1.00 . A A . 22 PHE HB2 1 1 3 1231 1 1 22 PHE HB3 H 13.810 0.002 -0.376 1.00 . A A . 22 PHE HB3 1 1 3 1232 1 1 22 PHE HD1 H 11.300 -2.654 0.531 1.00 . A A . 22 PHE HD1 1 1 3 1233 1 1 22 PHE HD2 H 14.537 -1.458 -2.029 1.00 . A A . 22 PHE HD2 1 1 3 1234 1 1 22 PHE HE1 H 11.132 -4.806 -0.685 1.00 . A A . 22 PHE HE1 1 1 3 1235 1 1 22 PHE HE2 H 14.367 -3.612 -3.245 1.00 . A A . 22 PHE HE2 1 1 3 1236 1 1 22 PHE HZ H 12.666 -5.284 -2.574 1.00 . A A . 22 PHE HZ 1 1 3 1237 1 1 22 PHE N N 12.042 -0.996 2.228 1.00 . A A . 22 PHE N 1 1 3 1238 1 1 22 PHE O O 15.345 0.461 1.834 1.00 . A A . 22 PHE O 1 1 3 1239 1 1 23 PHE C C 14.370 2.143 5.080 1.00 . A A . 23 PHE C 1 1 3 1240 1 1 23 PHE CA C 14.308 2.282 3.550 1.00 . A A . 23 PHE CA 1 1 3 1241 1 1 23 PHE CB C 13.505 3.525 3.153 1.00 . A A . 23 PHE CB 1 1 3 1242 1 1 23 PHE CD1 C 13.597 3.492 0.631 1.00 . A A . 23 PHE CD1 1 1 3 1243 1 1 23 PHE CD2 C 14.924 5.132 1.825 1.00 . A A . 23 PHE CD2 1 1 3 1244 1 1 23 PHE CE1 C 14.075 3.990 -0.586 1.00 . A A . 23 PHE CE1 1 1 3 1245 1 1 23 PHE CE2 C 15.401 5.631 0.607 1.00 . A A . 23 PHE CE2 1 1 3 1246 1 1 23 PHE CG C 14.021 4.063 1.838 1.00 . A A . 23 PHE CG 1 1 3 1247 1 1 23 PHE CZ C 14.976 5.060 -0.598 1.00 . A A . 23 PHE CZ 1 1 3 1248 1 1 23 PHE H H 12.625 0.990 3.171 1.00 . A A . 23 PHE H 1 1 3 1249 1 1 23 PHE HA H 15.304 2.343 3.141 1.00 . A A . 23 PHE HA 1 1 3 1250 1 1 23 PHE HB2 H 12.462 3.264 3.050 1.00 . A A . 23 PHE HB2 1 1 3 1251 1 1 23 PHE HB3 H 13.611 4.283 3.915 1.00 . A A . 23 PHE HB3 1 1 3 1252 1 1 23 PHE HD1 H 12.903 2.667 0.640 1.00 . A A . 23 PHE HD1 1 1 3 1253 1 1 23 PHE HD2 H 15.252 5.573 2.755 1.00 . A A . 23 PHE HD2 1 1 3 1254 1 1 23 PHE HE1 H 13.746 3.550 -1.516 1.00 . A A . 23 PHE HE1 1 1 3 1255 1 1 23 PHE HE2 H 16.097 6.456 0.597 1.00 . A A . 23 PHE HE2 1 1 3 1256 1 1 23 PHE HZ H 15.344 5.445 -1.537 1.00 . A A . 23 PHE HZ 1 1 3 1257 1 1 23 PHE N N 13.567 1.131 2.947 1.00 . A A . 23 PHE N 1 1 3 1258 1 1 23 PHE O O 14.547 3.118 5.789 1.00 . A A . 23 PHE O 1 1 3 1259 1 1 24 TYR C C 14.929 -0.614 7.404 1.00 . A A . 24 TYR C 1 1 3 1260 1 1 24 TYR CA C 14.285 0.740 7.076 1.00 . A A . 24 TYR CA 1 1 3 1261 1 1 24 TYR CB C 12.824 0.774 7.537 1.00 . A A . 24 TYR CB 1 1 3 1262 1 1 24 TYR CD1 C 12.849 2.724 9.136 1.00 . A A . 24 TYR CD1 1 1 3 1263 1 1 24 TYR CD2 C 11.693 2.969 7.017 1.00 . A A . 24 TYR CD2 1 1 3 1264 1 1 24 TYR CE1 C 12.501 4.036 9.476 1.00 . A A . 24 TYR CE1 1 1 3 1265 1 1 24 TYR CE2 C 11.346 4.280 7.359 1.00 . A A . 24 TYR CE2 1 1 3 1266 1 1 24 TYR CG C 12.444 2.189 7.906 1.00 . A A . 24 TYR CG 1 1 3 1267 1 1 24 TYR CZ C 11.750 4.814 8.588 1.00 . A A . 24 TYR CZ 1 1 3 1268 1 1 24 TYR H H 14.092 0.170 5.005 1.00 . A A . 24 TYR H 1 1 3 1269 1 1 24 TYR HA H 14.837 1.541 7.544 1.00 . A A . 24 TYR HA 1 1 3 1270 1 1 24 TYR HB2 H 12.189 0.426 6.737 1.00 . A A . 24 TYR HB2 1 1 3 1271 1 1 24 TYR HB3 H 12.703 0.133 8.397 1.00 . A A . 24 TYR HB3 1 1 3 1272 1 1 24 TYR HD1 H 13.428 2.123 9.821 1.00 . A A . 24 TYR HD1 1 1 3 1273 1 1 24 TYR HD2 H 11.382 2.558 6.069 1.00 . A A . 24 TYR HD2 1 1 3 1274 1 1 24 TYR HE1 H 12.813 4.448 10.425 1.00 . A A . 24 TYR HE1 1 1 3 1275 1 1 24 TYR HE2 H 10.767 4.881 6.674 1.00 . A A . 24 TYR HE2 1 1 3 1276 1 1 24 TYR HH H 10.571 6.082 9.387 1.00 . A A . 24 TYR HH 1 1 3 1277 1 1 24 TYR N N 14.230 0.941 5.594 1.00 . A A . 24 TYR N 1 1 3 1278 1 1 24 TYR O O 14.294 -1.507 7.935 1.00 . A A . 24 TYR O 1 1 3 1279 1 1 24 TYR OH O 11.409 6.107 8.922 1.00 . A A . 24 TYR OH 1 1 3 1280 1 1 25 LYS C C 17.999 -1.842 8.421 1.00 . A A . 25 LYS C 1 1 3 1281 1 1 25 LYS CA C 16.895 -2.057 7.377 1.00 . A A . 25 LYS CA 1 1 3 1282 1 1 25 LYS CB C 17.496 -2.491 6.037 1.00 . A A . 25 LYS CB 1 1 3 1283 1 1 25 LYS CD C 16.980 -3.391 3.759 1.00 . A A . 25 LYS CD 1 1 3 1284 1 1 25 LYS CE C 16.188 -2.723 2.628 1.00 . A A . 25 LYS CE 1 1 3 1285 1 1 25 LYS CG C 16.383 -2.990 5.111 1.00 . A A . 25 LYS CG 1 1 3 1286 1 1 25 LYS H H 16.677 -0.031 6.665 1.00 . A A . 25 LYS H 1 1 3 1287 1 1 25 LYS HA H 16.192 -2.799 7.723 1.00 . A A . 25 LYS HA 1 1 3 1288 1 1 25 LYS HB2 H 17.998 -1.650 5.579 1.00 . A A . 25 LYS HB2 1 1 3 1289 1 1 25 LYS HB3 H 18.207 -3.287 6.204 1.00 . A A . 25 LYS HB3 1 1 3 1290 1 1 25 LYS HD2 H 18.014 -3.077 3.714 1.00 . A A . 25 LYS HD2 1 1 3 1291 1 1 25 LYS HD3 H 16.925 -4.463 3.647 1.00 . A A . 25 LYS HD3 1 1 3 1292 1 1 25 LYS HE2 H 15.999 -3.433 1.834 1.00 . A A . 25 LYS HE2 1 1 3 1293 1 1 25 LYS HE3 H 15.260 -2.322 3.005 1.00 . A A . 25 LYS HE3 1 1 3 1294 1 1 25 LYS HG2 H 15.900 -3.846 5.560 1.00 . A A . 25 LYS HG2 1 1 3 1295 1 1 25 LYS HG3 H 15.658 -2.204 4.965 1.00 . A A . 25 LYS HG3 1 1 3 1296 1 1 25 LYS HZ1 H 17.780 -1.996 1.491 1.00 . A A . 25 LYS HZ1 1 1 3 1297 1 1 25 LYS HZ2 H 17.527 -1.152 2.945 1.00 . A A . 25 LYS HZ2 1 1 3 1298 1 1 25 LYS HZ3 H 16.477 -0.915 1.630 1.00 . A A . 25 LYS HZ3 1 1 3 1299 1 1 25 LYS N N 16.190 -0.766 7.090 1.00 . A A . 25 LYS N 1 1 3 1300 1 1 25 LYS NZ N 17.060 -1.614 2.137 1.00 . A A . 25 LYS NZ 1 1 3 1301 1 1 25 LYS O O 18.074 -2.637 9.343 1.00 . A A . 25 LYS O 1 1 3 1302 1 1 25 LYS OXT O 18.750 -0.888 8.280 1.00 . A A . 25 LYS OXT 1 1 4 1303 1 1 1 HIS C C -18.334 0.891 -0.048 1.00 . A A . 1 HIS C 1 1 4 1304 1 1 1 HIS CA C -18.462 1.815 1.175 1.00 . A A . 1 HIS CA 1 1 4 1305 1 1 1 HIS CB C -17.085 2.105 1.788 1.00 . A A . 1 HIS CB 1 1 4 1306 1 1 1 HIS CD2 C -16.806 4.006 -0.013 1.00 . A A . 1 HIS CD2 1 1 4 1307 1 1 1 HIS CE1 C -14.696 4.402 0.277 1.00 . A A . 1 HIS CE1 1 1 4 1308 1 1 1 HIS CG C -16.373 3.154 0.975 1.00 . A A . 1 HIS CG 1 1 4 1309 1 1 1 HIS HA H -18.941 2.740 0.896 1.00 . A A . 1 HIS HA 1 1 4 1310 1 1 1 HIS HB2 H -17.210 2.460 2.800 1.00 . A A . 1 HIS HB2 1 1 4 1311 1 1 1 HIS HB3 H -16.497 1.198 1.796 1.00 . A A . 1 HIS HB3 1 1 4 1312 1 1 1 HIS HD1 H -14.419 2.984 1.778 1.00 . A A . 1 HIS HD1 1 1 4 1313 1 1 1 HIS HD2 H -17.816 4.057 -0.392 1.00 . A A . 1 HIS HD2 1 1 4 1314 1 1 1 HIS HE1 H -13.704 4.820 0.183 1.00 . A A . 1 HIS HE1 1 1 4 1315 1 1 1 HIS N N -19.236 1.137 2.261 1.00 . A A . 1 HIS N 1 1 4 1316 1 1 1 HIS ND1 N -15.025 3.426 1.142 1.00 . A A . 1 HIS ND1 1 1 4 1317 1 1 1 HIS NE2 N -15.745 4.793 -0.451 1.00 . A A . 1 HIS NE2 1 1 4 1318 1 1 1 HIS O O -17.245 0.611 -0.514 1.00 . A A . 1 HIS O 1 1 4 1319 1 1 2 ALA C C -18.462 -1.666 -1.560 1.00 . A A . 2 ALA C 1 1 4 1320 1 1 2 ALA CA C -19.429 -0.485 -1.766 1.00 . A A . 2 ALA CA 1 1 4 1321 1 1 2 ALA CB C -18.958 0.398 -2.924 1.00 . A A . 2 ALA CB 1 1 4 1322 1 1 2 ALA H H -20.309 0.670 -0.171 1.00 . A A . 2 ALA H 1 1 4 1323 1 1 2 ALA HA H -20.421 -0.851 -1.971 1.00 . A A . 2 ALA HA 1 1 4 1324 1 1 2 ALA HB1 H -19.278 -0.038 -3.860 1.00 . A A . 2 ALA HB1 1 1 4 1325 1 1 2 ALA HB2 H -17.881 0.468 -2.910 1.00 . A A . 2 ALA HB2 1 1 4 1326 1 1 2 ALA HB3 H -19.385 1.384 -2.822 1.00 . A A . 2 ALA HB3 1 1 4 1327 1 1 2 ALA N N -19.448 0.422 -0.568 1.00 . A A . 2 ALA N 1 1 4 1328 1 1 2 ALA O O -17.907 -2.190 -2.508 1.00 . A A . 2 ALA O 1 1 4 1329 1 1 3 TRP C C -15.962 -3.004 -0.702 1.00 . A A . 3 TRP C 1 1 4 1330 1 1 3 TRP CA C -17.335 -3.229 -0.043 1.00 . A A . 3 TRP CA 1 1 4 1331 1 1 3 TRP CB C -18.030 -4.463 -0.632 1.00 . A A . 3 TRP CB 1 1 4 1332 1 1 3 TRP CD1 C -17.923 -6.063 1.324 1.00 . A A . 3 TRP CD1 1 1 4 1333 1 1 3 TRP CD2 C -16.638 -6.720 -0.403 1.00 . A A . 3 TRP CD2 1 1 4 1334 1 1 3 TRP CE2 C -16.483 -7.693 0.611 1.00 . A A . 3 TRP CE2 1 1 4 1335 1 1 3 TRP CE3 C -15.930 -6.896 -1.606 1.00 . A A . 3 TRP CE3 1 1 4 1336 1 1 3 TRP CG C -17.556 -5.693 0.074 1.00 . A A . 3 TRP CG 1 1 4 1337 1 1 3 TRP CH2 C -14.961 -8.964 -0.763 1.00 . A A . 3 TRP CH2 1 1 4 1338 1 1 3 TRP CZ2 C -15.657 -8.804 0.438 1.00 . A A . 3 TRP CZ2 1 1 4 1339 1 1 3 TRP CZ3 C -15.097 -8.012 -1.783 1.00 . A A . 3 TRP CZ3 1 1 4 1340 1 1 3 TRP H H -18.724 -1.645 0.412 1.00 . A A . 3 TRP H 1 1 4 1341 1 1 3 TRP HA H -17.215 -3.352 1.022 1.00 . A A . 3 TRP HA 1 1 4 1342 1 1 3 TRP HB2 H -19.099 -4.368 -0.508 1.00 . A A . 3 TRP HB2 1 1 4 1343 1 1 3 TRP HB3 H -17.796 -4.541 -1.684 1.00 . A A . 3 TRP HB3 1 1 4 1344 1 1 3 TRP HD1 H -18.600 -5.521 1.967 1.00 . A A . 3 TRP HD1 1 1 4 1345 1 1 3 TRP HE1 H -17.380 -7.730 2.492 1.00 . A A . 3 TRP HE1 1 1 4 1346 1 1 3 TRP HE3 H -16.029 -6.169 -2.398 1.00 . A A . 3 TRP HE3 1 1 4 1347 1 1 3 TRP HH2 H -14.319 -9.821 -0.906 1.00 . A A . 3 TRP HH2 1 1 4 1348 1 1 3 TRP HZ2 H -15.555 -9.534 1.227 1.00 . A A . 3 TRP HZ2 1 1 4 1349 1 1 3 TRP HZ3 H -14.558 -8.138 -2.711 1.00 . A A . 3 TRP HZ3 1 1 4 1350 1 1 3 TRP N N -18.262 -2.085 -0.329 1.00 . A A . 3 TRP N 1 1 4 1351 1 1 3 TRP NE1 N -17.286 -7.250 1.643 1.00 . A A . 3 TRP NE1 1 1 4 1352 1 1 3 TRP O O -15.309 -3.938 -1.129 1.00 . A A . 3 TRP O 1 1 4 1353 1 1 4 TYR C C -13.417 -0.445 -0.599 1.00 . A A . 4 TYR C 1 1 4 1354 1 1 4 TYR CA C -14.187 -1.497 -1.410 1.00 . A A . 4 TYR CA 1 1 4 1355 1 1 4 TYR CB C -14.506 -0.982 -2.818 1.00 . A A . 4 TYR CB 1 1 4 1356 1 1 4 TYR CD1 C -12.285 -0.605 -3.951 1.00 . A A . 4 TYR CD1 1 1 4 1357 1 1 4 TYR CD2 C -13.519 -2.631 -4.452 1.00 . A A . 4 TYR CD2 1 1 4 1358 1 1 4 TYR CE1 C -11.269 -1.008 -4.823 1.00 . A A . 4 TYR CE1 1 1 4 1359 1 1 4 TYR CE2 C -12.502 -3.034 -5.324 1.00 . A A . 4 TYR CE2 1 1 4 1360 1 1 4 TYR CG C -13.411 -1.415 -3.765 1.00 . A A . 4 TYR CG 1 1 4 1361 1 1 4 TYR CZ C -11.377 -2.222 -5.509 1.00 . A A . 4 TYR CZ 1 1 4 1362 1 1 4 TYR H H -16.053 -1.030 -0.431 1.00 . A A . 4 TYR H 1 1 4 1363 1 1 4 TYR HA H -13.614 -2.408 -1.476 1.00 . A A . 4 TYR HA 1 1 4 1364 1 1 4 TYR HB2 H -15.450 -1.390 -3.147 1.00 . A A . 4 TYR HB2 1 1 4 1365 1 1 4 TYR HB3 H -14.564 0.096 -2.804 1.00 . A A . 4 TYR HB3 1 1 4 1366 1 1 4 TYR HD1 H -12.202 0.334 -3.421 1.00 . A A . 4 TYR HD1 1 1 4 1367 1 1 4 TYR HD2 H -14.388 -3.256 -4.308 1.00 . A A . 4 TYR HD2 1 1 4 1368 1 1 4 TYR HE1 H -10.400 -0.381 -4.966 1.00 . A A . 4 TYR HE1 1 1 4 1369 1 1 4 TYR HE2 H -12.585 -3.972 -5.853 1.00 . A A . 4 TYR HE2 1 1 4 1370 1 1 4 TYR HH H -9.793 -3.218 -5.888 1.00 . A A . 4 TYR HH 1 1 4 1371 1 1 4 TYR N N -15.516 -1.772 -0.784 1.00 . A A . 4 TYR N 1 1 4 1372 1 1 4 TYR O O -12.959 0.551 -1.128 1.00 . A A . 4 TYR O 1 1 4 1373 1 1 4 TYR OH O -10.372 -2.621 -6.366 1.00 . A A . 4 TYR OH 1 1 4 1374 1 1 5 SER C C -11.171 -0.277 1.985 1.00 . A A . 5 SER C 1 1 4 1375 1 1 5 SER CA C -12.515 0.312 1.534 1.00 . A A . 5 SER CA 1 1 4 1376 1 1 5 SER CB C -13.419 0.574 2.738 1.00 . A A . 5 SER CB 1 1 4 1377 1 1 5 SER H H -13.636 -1.478 1.086 1.00 . A A . 5 SER H 1 1 4 1378 1 1 5 SER HA H -12.354 1.227 0.992 1.00 . A A . 5 SER HA 1 1 4 1379 1 1 5 SER HB2 H -14.387 0.130 2.570 1.00 . A A . 5 SER HB2 1 1 4 1380 1 1 5 SER HB3 H -12.974 0.139 3.624 1.00 . A A . 5 SER HB3 1 1 4 1381 1 1 5 SER HG H -12.950 2.264 3.583 1.00 . A A . 5 SER HG 1 1 4 1382 1 1 5 SER N N -13.263 -0.666 0.682 1.00 . A A . 5 SER N 1 1 4 1383 1 1 5 SER O O -10.279 0.443 2.390 1.00 . A A . 5 SER O 1 1 4 1384 1 1 5 SER OG O -13.572 1.977 2.909 1.00 . A A . 5 SER OG 1 1 4 1385 1 1 6 HIS C C -8.746 -2.258 1.162 1.00 . A A . 6 HIS C 1 1 4 1386 1 1 6 HIS CA C -9.729 -2.206 2.338 1.00 . A A . 6 HIS CA 1 1 4 1387 1 1 6 HIS CB C -10.099 -3.621 2.796 1.00 . A A . 6 HIS CB 1 1 4 1388 1 1 6 HIS CD2 C -8.127 -4.100 4.468 1.00 . A A . 6 HIS CD2 1 1 4 1389 1 1 6 HIS CE1 C -7.213 -5.756 3.412 1.00 . A A . 6 HIS CE1 1 1 4 1390 1 1 6 HIS CG C -8.875 -4.312 3.337 1.00 . A A . 6 HIS CG 1 1 4 1391 1 1 6 HIS H H -11.749 -2.136 1.584 1.00 . A A . 6 HIS H 1 1 4 1392 1 1 6 HIS HA H -9.297 -1.657 3.153 1.00 . A A . 6 HIS HA 1 1 4 1393 1 1 6 HIS HB2 H -10.851 -3.563 3.569 1.00 . A A . 6 HIS HB2 1 1 4 1394 1 1 6 HIS HB3 H -10.487 -4.181 1.959 1.00 . A A . 6 HIS HB3 1 1 4 1395 1 1 6 HIS HD1 H -8.566 -5.773 1.833 1.00 . A A . 6 HIS HD1 1 1 4 1396 1 1 6 HIS HD2 H -8.322 -3.339 5.210 1.00 . A A . 6 HIS HD2 1 1 4 1397 1 1 6 HIS HE1 H -6.552 -6.567 3.145 1.00 . A A . 6 HIS HE1 1 1 4 1398 1 1 6 HIS N N -11.018 -1.576 1.916 1.00 . A A . 6 HIS N 1 1 4 1399 1 1 6 HIS ND1 N -8.273 -5.374 2.679 1.00 . A A . 6 HIS ND1 1 1 4 1400 1 1 6 HIS NE2 N -7.077 -5.013 4.513 1.00 . A A . 6 HIS NE2 1 1 4 1401 1 1 6 HIS O O -7.549 -2.258 1.354 1.00 . A A . 6 HIS O 1 1 4 1402 1 1 7 TYR C C -7.493 -1.071 -1.298 1.00 . A A . 7 TYR C 1 1 4 1403 1 1 7 TYR CA C -8.335 -2.344 -1.238 1.00 . A A . 7 TYR CA 1 1 4 1404 1 1 7 TYR CB C -9.253 -2.445 -2.462 1.00 . A A . 7 TYR CB 1 1 4 1405 1 1 7 TYR CD1 C -9.331 -4.955 -2.714 1.00 . A A . 7 TYR CD1 1 1 4 1406 1 1 7 TYR CD2 C -11.368 -3.776 -2.129 1.00 . A A . 7 TYR CD2 1 1 4 1407 1 1 7 TYR CE1 C -10.028 -6.169 -2.686 1.00 . A A . 7 TYR CE1 1 1 4 1408 1 1 7 TYR CE2 C -12.064 -4.989 -2.101 1.00 . A A . 7 TYR CE2 1 1 4 1409 1 1 7 TYR CG C -10.002 -3.758 -2.435 1.00 . A A . 7 TYR CG 1 1 4 1410 1 1 7 TYR CZ C -11.394 -6.186 -2.380 1.00 . A A . 7 TYR CZ 1 1 4 1411 1 1 7 TYR H H -10.215 -2.291 -0.174 1.00 . A A . 7 TYR H 1 1 4 1412 1 1 7 TYR HA H -7.696 -3.205 -1.183 1.00 . A A . 7 TYR HA 1 1 4 1413 1 1 7 TYR HB2 H -9.960 -1.627 -2.450 1.00 . A A . 7 TYR HB2 1 1 4 1414 1 1 7 TYR HB3 H -8.659 -2.391 -3.362 1.00 . A A . 7 TYR HB3 1 1 4 1415 1 1 7 TYR HD1 H -8.278 -4.942 -2.951 1.00 . A A . 7 TYR HD1 1 1 4 1416 1 1 7 TYR HD2 H -11.884 -2.852 -1.914 1.00 . A A . 7 TYR HD2 1 1 4 1417 1 1 7 TYR HE1 H -9.512 -7.093 -2.902 1.00 . A A . 7 TYR HE1 1 1 4 1418 1 1 7 TYR HE2 H -13.118 -5.003 -1.864 1.00 . A A . 7 TYR HE2 1 1 4 1419 1 1 7 TYR HH H -12.084 -7.700 -1.444 1.00 . A A . 7 TYR HH 1 1 4 1420 1 1 7 TYR N N -9.245 -2.297 -0.048 1.00 . A A . 7 TYR N 1 1 4 1421 1 1 7 TYR O O -6.293 -1.121 -1.487 1.00 . A A . 7 TYR O 1 1 4 1422 1 1 7 TYR OH O -12.080 -7.382 -2.351 1.00 . A A . 7 TYR OH 1 1 4 1423 1 1 8 VAL C C -6.369 1.391 0.052 1.00 . A A . 8 VAL C 1 1 4 1424 1 1 8 VAL CA C -7.345 1.351 -1.135 1.00 . A A . 8 VAL CA 1 1 4 1425 1 1 8 VAL CB C -8.400 2.465 -1.025 1.00 . A A . 8 VAL CB 1 1 4 1426 1 1 8 VAL CG1 C -9.027 2.464 0.374 1.00 . A A . 8 VAL CG1 1 1 4 1427 1 1 8 VAL CG2 C -7.738 3.821 -1.282 1.00 . A A . 8 VAL CG2 1 1 4 1428 1 1 8 VAL H H -9.076 0.072 -0.951 1.00 . A A . 8 VAL H 1 1 4 1429 1 1 8 VAL HA H -6.805 1.446 -2.060 1.00 . A A . 8 VAL HA 1 1 4 1430 1 1 8 VAL HB H -9.174 2.297 -1.762 1.00 . A A . 8 VAL HB 1 1 4 1431 1 1 8 VAL HG11 H -9.291 1.455 0.650 1.00 . A A . 8 VAL HG11 1 1 4 1432 1 1 8 VAL HG12 H -9.914 3.080 0.369 1.00 . A A . 8 VAL HG12 1 1 4 1433 1 1 8 VAL HG13 H -8.317 2.859 1.086 1.00 . A A . 8 VAL HG13 1 1 4 1434 1 1 8 VAL HG21 H -6.883 3.933 -0.631 1.00 . A A . 8 VAL HG21 1 1 4 1435 1 1 8 VAL HG22 H -8.447 4.612 -1.083 1.00 . A A . 8 VAL HG22 1 1 4 1436 1 1 8 VAL HG23 H -7.418 3.876 -2.312 1.00 . A A . 8 VAL HG23 1 1 4 1437 1 1 8 VAL N N -8.111 0.067 -1.116 1.00 . A A . 8 VAL N 1 1 4 1438 1 1 8 VAL O O -5.345 2.043 0.003 1.00 . A A . 8 VAL O 1 1 4 1439 1 1 9 LEU C C -4.678 -0.395 2.098 1.00 . A A . 9 LEU C 1 1 4 1440 1 1 9 LEU CA C -5.781 0.652 2.299 1.00 . A A . 9 LEU CA 1 1 4 1441 1 1 9 LEU CB C -6.687 0.262 3.472 1.00 . A A . 9 LEU CB 1 1 4 1442 1 1 9 LEU CD1 C -6.940 2.263 4.950 1.00 . A A . 9 LEU CD1 1 1 4 1443 1 1 9 LEU CD2 C -6.455 0.025 5.950 1.00 . A A . 9 LEU CD2 1 1 4 1444 1 1 9 LEU CG C -6.194 0.943 4.752 1.00 . A A . 9 LEU CG 1 1 4 1445 1 1 9 LEU H H -7.508 0.158 1.112 1.00 . A A . 9 LEU H 1 1 4 1446 1 1 9 LEU HA H -5.352 1.626 2.471 1.00 . A A . 9 LEU HA 1 1 4 1447 1 1 9 LEU HB2 H -7.700 0.576 3.265 1.00 . A A . 9 LEU HB2 1 1 4 1448 1 1 9 LEU HB3 H -6.663 -0.809 3.604 1.00 . A A . 9 LEU HB3 1 1 4 1449 1 1 9 LEU HD11 H -6.639 2.965 4.187 1.00 . A A . 9 LEU HD11 1 1 4 1450 1 1 9 LEU HD12 H -6.705 2.668 5.924 1.00 . A A . 9 LEU HD12 1 1 4 1451 1 1 9 LEU HD13 H -8.005 2.090 4.881 1.00 . A A . 9 LEU HD13 1 1 4 1452 1 1 9 LEU HD21 H -7.490 -0.283 5.949 1.00 . A A . 9 LEU HD21 1 1 4 1453 1 1 9 LEU HD22 H -6.239 0.557 6.865 1.00 . A A . 9 LEU HD22 1 1 4 1454 1 1 9 LEU HD23 H -5.820 -0.846 5.883 1.00 . A A . 9 LEU HD23 1 1 4 1455 1 1 9 LEU HG H -5.134 1.138 4.670 1.00 . A A . 9 LEU HG 1 1 4 1456 1 1 9 LEU N N -6.681 0.681 1.108 1.00 . A A . 9 LEU N 1 1 4 1457 1 1 9 LEU O O -3.541 -0.184 2.476 1.00 . A A . 9 LEU O 1 1 4 1458 1 1 10 LYS C C -3.024 -2.164 0.143 1.00 . A A . 10 LYS C 1 1 4 1459 1 1 10 LYS CA C -3.971 -2.578 1.275 1.00 . A A . 10 LYS CA 1 1 4 1460 1 1 10 LYS CB C -4.755 -3.838 0.889 1.00 . A A . 10 LYS CB 1 1 4 1461 1 1 10 LYS CD C -3.046 -5.618 0.438 1.00 . A A . 10 LYS CD 1 1 4 1462 1 1 10 LYS CE C -2.012 -6.495 1.152 1.00 . A A . 10 LYS CE 1 1 4 1463 1 1 10 LYS CG C -4.053 -5.077 1.458 1.00 . A A . 10 LYS CG 1 1 4 1464 1 1 10 LYS H H -5.929 -1.665 1.201 1.00 . A A . 10 LYS H 1 1 4 1465 1 1 10 LYS HA H -3.414 -2.756 2.182 1.00 . A A . 10 LYS HA 1 1 4 1466 1 1 10 LYS HB2 H -5.756 -3.777 1.290 1.00 . A A . 10 LYS HB2 1 1 4 1467 1 1 10 LYS HB3 H -4.803 -3.917 -0.187 1.00 . A A . 10 LYS HB3 1 1 4 1468 1 1 10 LYS HD2 H -3.569 -6.205 -0.305 1.00 . A A . 10 LYS HD2 1 1 4 1469 1 1 10 LYS HD3 H -2.543 -4.793 -0.045 1.00 . A A . 10 LYS HD3 1 1 4 1470 1 1 10 LYS HE2 H -1.189 -5.889 1.506 1.00 . A A . 10 LYS HE2 1 1 4 1471 1 1 10 LYS HE3 H -2.471 -7.022 1.976 1.00 . A A . 10 LYS HE3 1 1 4 1472 1 1 10 LYS HG2 H -3.535 -4.810 2.369 1.00 . A A . 10 LYS HG2 1 1 4 1473 1 1 10 LYS HG3 H -4.788 -5.839 1.674 1.00 . A A . 10 LYS HG3 1 1 4 1474 1 1 10 LYS HZ1 H -1.053 -6.957 -0.641 1.00 . A A . 10 LYS HZ1 1 1 4 1475 1 1 10 LYS HZ2 H -2.355 -7.984 -0.268 1.00 . A A . 10 LYS HZ2 1 1 4 1476 1 1 10 LYS HZ3 H -0.879 -8.142 0.560 1.00 . A A . 10 LYS HZ3 1 1 4 1477 1 1 10 LYS N N -5.004 -1.519 1.502 1.00 . A A . 10 LYS N 1 1 4 1478 1 1 10 LYS NZ N -1.540 -7.468 0.124 1.00 . A A . 10 LYS NZ 1 1 4 1479 1 1 10 LYS O O -1.826 -2.366 0.226 1.00 . A A . 10 LYS O 1 1 4 1480 1 1 11 PHE C C -1.671 -0.096 -1.586 1.00 . A A . 11 PHE C 1 1 4 1481 1 1 11 PHE CA C -2.672 -1.161 -2.053 1.00 . A A . 11 PHE CA 1 1 4 1482 1 1 11 PHE CB C -3.630 -0.583 -3.101 1.00 . A A . 11 PHE CB 1 1 4 1483 1 1 11 PHE CD1 C -2.113 -0.842 -5.101 1.00 . A A . 11 PHE CD1 1 1 4 1484 1 1 11 PHE CD2 C -2.833 1.384 -4.466 1.00 . A A . 11 PHE CD2 1 1 4 1485 1 1 11 PHE CE1 C -1.380 -0.302 -6.164 1.00 . A A . 11 PHE CE1 1 1 4 1486 1 1 11 PHE CE2 C -2.101 1.924 -5.530 1.00 . A A . 11 PHE CE2 1 1 4 1487 1 1 11 PHE CG C -2.840 0.000 -4.251 1.00 . A A . 11 PHE CG 1 1 4 1488 1 1 11 PHE CZ C -1.374 1.081 -6.379 1.00 . A A . 11 PHE CZ 1 1 4 1489 1 1 11 PHE H H -4.516 -1.435 -0.958 1.00 . A A . 11 PHE H 1 1 4 1490 1 1 11 PHE HA H -2.150 -2.012 -2.461 1.00 . A A . 11 PHE HA 1 1 4 1491 1 1 11 PHE HB2 H -4.275 -1.367 -3.470 1.00 . A A . 11 PHE HB2 1 1 4 1492 1 1 11 PHE HB3 H -4.231 0.193 -2.649 1.00 . A A . 11 PHE HB3 1 1 4 1493 1 1 11 PHE HD1 H -2.116 -1.910 -4.936 1.00 . A A . 11 PHE HD1 1 1 4 1494 1 1 11 PHE HD2 H -3.393 2.034 -3.810 1.00 . A A . 11 PHE HD2 1 1 4 1495 1 1 11 PHE HE1 H -0.819 -0.953 -6.819 1.00 . A A . 11 PHE HE1 1 1 4 1496 1 1 11 PHE HE2 H -2.096 2.992 -5.696 1.00 . A A . 11 PHE HE2 1 1 4 1497 1 1 11 PHE HZ H -0.809 1.497 -7.200 1.00 . A A . 11 PHE HZ 1 1 4 1498 1 1 11 PHE N N -3.547 -1.587 -0.914 1.00 . A A . 11 PHE N 1 1 4 1499 1 1 11 PHE O O -0.503 -0.148 -1.920 1.00 . A A . 11 PHE O 1 1 4 1500 1 1 12 PHE C C -0.120 1.319 0.590 1.00 . A A . 12 PHE C 1 1 4 1501 1 1 12 PHE CA C -1.191 1.931 -0.320 1.00 . A A . 12 PHE CA 1 1 4 1502 1 1 12 PHE CB C -2.075 2.908 0.463 1.00 . A A . 12 PHE CB 1 1 4 1503 1 1 12 PHE CD1 C -3.401 3.692 -1.537 1.00 . A A . 12 PHE CD1 1 1 4 1504 1 1 12 PHE CD2 C -2.173 5.329 -0.236 1.00 . A A . 12 PHE CD2 1 1 4 1505 1 1 12 PHE CE1 C -3.850 4.706 -2.391 1.00 . A A . 12 PHE CE1 1 1 4 1506 1 1 12 PHE CE2 C -2.623 6.344 -1.090 1.00 . A A . 12 PHE CE2 1 1 4 1507 1 1 12 PHE CG C -2.562 4.003 -0.459 1.00 . A A . 12 PHE CG 1 1 4 1508 1 1 12 PHE CZ C -3.461 6.032 -2.167 1.00 . A A . 12 PHE CZ 1 1 4 1509 1 1 12 PHE H H -3.065 0.881 -0.555 1.00 . A A . 12 PHE H 1 1 4 1510 1 1 12 PHE HA H -0.730 2.440 -1.153 1.00 . A A . 12 PHE HA 1 1 4 1511 1 1 12 PHE HB2 H -2.923 2.378 0.873 1.00 . A A . 12 PHE HB2 1 1 4 1512 1 1 12 PHE HB3 H -1.502 3.344 1.267 1.00 . A A . 12 PHE HB3 1 1 4 1513 1 1 12 PHE HD1 H -3.702 2.669 -1.710 1.00 . A A . 12 PHE HD1 1 1 4 1514 1 1 12 PHE HD2 H -1.527 5.570 0.595 1.00 . A A . 12 PHE HD2 1 1 4 1515 1 1 12 PHE HE1 H -4.497 4.465 -3.221 1.00 . A A . 12 PHE HE1 1 1 4 1516 1 1 12 PHE HE2 H -2.324 7.367 -0.917 1.00 . A A . 12 PHE HE2 1 1 4 1517 1 1 12 PHE HZ H -3.808 6.815 -2.826 1.00 . A A . 12 PHE HZ 1 1 4 1518 1 1 12 PHE N N -2.119 0.864 -0.813 1.00 . A A . 12 PHE N 1 1 4 1519 1 1 12 PHE O O 1.043 1.661 0.503 1.00 . A A . 12 PHE O 1 1 4 1520 1 1 13 LEU C C 1.522 -1.033 1.547 1.00 . A A . 13 LEU C 1 1 4 1521 1 1 13 LEU CA C 0.493 -0.236 2.363 1.00 . A A . 13 LEU CA 1 1 4 1522 1 1 13 LEU CB C -0.325 -1.172 3.258 1.00 . A A . 13 LEU CB 1 1 4 1523 1 1 13 LEU CD1 C 0.076 -0.367 5.592 1.00 . A A . 13 LEU CD1 1 1 4 1524 1 1 13 LEU CD2 C 0.059 -2.816 5.101 1.00 . A A . 13 LEU CD2 1 1 4 1525 1 1 13 LEU CG C 0.438 -1.436 4.558 1.00 . A A . 13 LEU CG 1 1 4 1526 1 1 13 LEU H H -1.448 0.146 1.497 1.00 . A A . 13 LEU H 1 1 4 1527 1 1 13 LEU HA H 0.988 0.508 2.966 1.00 . A A . 13 LEU HA 1 1 4 1528 1 1 13 LEU HB2 H -1.277 -0.714 3.484 1.00 . A A . 13 LEU HB2 1 1 4 1529 1 1 13 LEU HB3 H -0.490 -2.108 2.743 1.00 . A A . 13 LEU HB3 1 1 4 1530 1 1 13 LEU HD11 H 0.286 0.612 5.185 1.00 . A A . 13 LEU HD11 1 1 4 1531 1 1 13 LEU HD12 H 0.660 -0.519 6.486 1.00 . A A . 13 LEU HD12 1 1 4 1532 1 1 13 LEU HD13 H -0.976 -0.439 5.830 1.00 . A A . 13 LEU HD13 1 1 4 1533 1 1 13 LEU HD21 H 0.404 -3.579 4.419 1.00 . A A . 13 LEU HD21 1 1 4 1534 1 1 13 LEU HD22 H -1.015 -2.882 5.201 1.00 . A A . 13 LEU HD22 1 1 4 1535 1 1 13 LEU HD23 H 0.519 -2.962 6.067 1.00 . A A . 13 LEU HD23 1 1 4 1536 1 1 13 LEU HG H 1.501 -1.404 4.366 1.00 . A A . 13 LEU HG 1 1 4 1537 1 1 13 LEU N N -0.504 0.410 1.453 1.00 . A A . 13 LEU N 1 1 4 1538 1 1 13 LEU O O 2.682 -1.108 1.904 1.00 . A A . 13 LEU O 1 1 4 1539 1 1 14 LEU C C 3.032 -1.471 -1.105 1.00 . A A . 14 LEU C 1 1 4 1540 1 1 14 LEU CA C 2.053 -2.410 -0.394 1.00 . A A . 14 LEU CA 1 1 4 1541 1 1 14 LEU CB C 1.172 -3.144 -1.413 1.00 . A A . 14 LEU CB 1 1 4 1542 1 1 14 LEU CD1 C 1.995 -5.449 -0.890 1.00 . A A . 14 LEU CD1 1 1 4 1543 1 1 14 LEU CD2 C 1.194 -4.898 -3.191 1.00 . A A . 14 LEU CD2 1 1 4 1544 1 1 14 LEU CG C 1.926 -4.358 -1.961 1.00 . A A . 14 LEU CG 1 1 4 1545 1 1 14 LEU H H 0.163 -1.545 0.183 1.00 . A A . 14 LEU H 1 1 4 1546 1 1 14 LEU HA H 2.589 -3.120 0.208 1.00 . A A . 14 LEU HA 1 1 4 1547 1 1 14 LEU HB2 H 0.261 -3.470 -0.933 1.00 . A A . 14 LEU HB2 1 1 4 1548 1 1 14 LEU HB3 H 0.931 -2.476 -2.227 1.00 . A A . 14 LEU HB3 1 1 4 1549 1 1 14 LEU HD11 H 2.454 -6.334 -1.307 1.00 . A A . 14 LEU HD11 1 1 4 1550 1 1 14 LEU HD12 H 0.997 -5.686 -0.552 1.00 . A A . 14 LEU HD12 1 1 4 1551 1 1 14 LEU HD13 H 2.584 -5.098 -0.056 1.00 . A A . 14 LEU HD13 1 1 4 1552 1 1 14 LEU HD21 H 0.142 -5.008 -2.967 1.00 . A A . 14 LEU HD21 1 1 4 1553 1 1 14 LEU HD22 H 1.605 -5.859 -3.462 1.00 . A A . 14 LEU HD22 1 1 4 1554 1 1 14 LEU HD23 H 1.316 -4.209 -4.015 1.00 . A A . 14 LEU HD23 1 1 4 1555 1 1 14 LEU HG H 2.929 -4.064 -2.239 1.00 . A A . 14 LEU HG 1 1 4 1556 1 1 14 LEU N N 1.103 -1.623 0.451 1.00 . A A . 14 LEU N 1 1 4 1557 1 1 14 LEU O O 4.228 -1.696 -1.112 1.00 . A A . 14 LEU O 1 1 4 1558 1 1 15 VAL C C 4.295 1.298 -1.385 1.00 . A A . 15 VAL C 1 1 4 1559 1 1 15 VAL CA C 3.421 0.554 -2.405 1.00 . A A . 15 VAL CA 1 1 4 1560 1 1 15 VAL CB C 2.475 1.524 -3.128 1.00 . A A . 15 VAL CB 1 1 4 1561 1 1 15 VAL CG1 C 3.286 2.638 -3.796 1.00 . A A . 15 VAL CG1 1 1 4 1562 1 1 15 VAL CG2 C 1.682 0.766 -4.199 1.00 . A A . 15 VAL CG2 1 1 4 1563 1 1 15 VAL H H 1.562 -0.263 -1.664 1.00 . A A . 15 VAL H 1 1 4 1564 1 1 15 VAL HA H 4.040 0.038 -3.122 1.00 . A A . 15 VAL HA 1 1 4 1565 1 1 15 VAL HB H 1.791 1.959 -2.412 1.00 . A A . 15 VAL HB 1 1 4 1566 1 1 15 VAL HG11 H 2.709 3.072 -4.600 1.00 . A A . 15 VAL HG11 1 1 4 1567 1 1 15 VAL HG12 H 4.202 2.227 -4.195 1.00 . A A . 15 VAL HG12 1 1 4 1568 1 1 15 VAL HG13 H 3.521 3.400 -3.068 1.00 . A A . 15 VAL HG13 1 1 4 1569 1 1 15 VAL HG21 H 2.204 0.826 -5.143 1.00 . A A . 15 VAL HG21 1 1 4 1570 1 1 15 VAL HG22 H 0.702 1.208 -4.301 1.00 . A A . 15 VAL HG22 1 1 4 1571 1 1 15 VAL HG23 H 1.581 -0.270 -3.908 1.00 . A A . 15 VAL HG23 1 1 4 1572 1 1 15 VAL N N 2.529 -0.417 -1.694 1.00 . A A . 15 VAL N 1 1 4 1573 1 1 15 VAL O O 5.493 1.422 -1.556 1.00 . A A . 15 VAL O 1 1 4 1574 1 1 16 PHE C C 5.487 1.540 1.384 1.00 . A A . 16 PHE C 1 1 4 1575 1 1 16 PHE CA C 4.495 2.505 0.722 1.00 . A A . 16 PHE CA 1 1 4 1576 1 1 16 PHE CB C 3.466 3.008 1.740 1.00 . A A . 16 PHE CB 1 1 4 1577 1 1 16 PHE CD1 C 3.981 5.463 1.995 1.00 . A A . 16 PHE CD1 1 1 4 1578 1 1 16 PHE CD2 C 4.648 3.942 3.762 1.00 . A A . 16 PHE CD2 1 1 4 1579 1 1 16 PHE CE1 C 4.517 6.537 2.717 1.00 . A A . 16 PHE CE1 1 1 4 1580 1 1 16 PHE CE2 C 5.185 5.015 4.483 1.00 . A A . 16 PHE CE2 1 1 4 1581 1 1 16 PHE CG C 4.046 4.166 2.518 1.00 . A A . 16 PHE CG 1 1 4 1582 1 1 16 PHE CZ C 5.120 6.313 3.960 1.00 . A A . 16 PHE CZ 1 1 4 1583 1 1 16 PHE H H 2.734 1.660 -0.200 1.00 . A A . 16 PHE H 1 1 4 1584 1 1 16 PHE HA H 5.019 3.340 0.283 1.00 . A A . 16 PHE HA 1 1 4 1585 1 1 16 PHE HB2 H 2.577 3.334 1.221 1.00 . A A . 16 PHE HB2 1 1 4 1586 1 1 16 PHE HB3 H 3.213 2.209 2.420 1.00 . A A . 16 PHE HB3 1 1 4 1587 1 1 16 PHE HD1 H 3.515 5.637 1.036 1.00 . A A . 16 PHE HD1 1 1 4 1588 1 1 16 PHE HD2 H 4.700 2.941 4.165 1.00 . A A . 16 PHE HD2 1 1 4 1589 1 1 16 PHE HE1 H 4.467 7.538 2.313 1.00 . A A . 16 PHE HE1 1 1 4 1590 1 1 16 PHE HE2 H 5.651 4.842 5.442 1.00 . A A . 16 PHE HE2 1 1 4 1591 1 1 16 PHE HZ H 5.534 7.141 4.517 1.00 . A A . 16 PHE HZ 1 1 4 1592 1 1 16 PHE N N 3.702 1.782 -0.319 1.00 . A A . 16 PHE N 1 1 4 1593 1 1 16 PHE O O 6.607 1.904 1.689 1.00 . A A . 16 PHE O 1 1 4 1594 1 1 17 GLY C C 7.206 -0.928 1.313 1.00 . A A . 17 GLY C 1 1 4 1595 1 1 17 GLY CA C 5.998 -0.691 2.226 1.00 . A A . 17 GLY CA 1 1 4 1596 1 1 17 GLY H H 4.178 0.037 1.334 1.00 . A A . 17 GLY H 1 1 4 1597 1 1 17 GLY HA2 H 6.335 -0.317 3.182 1.00 . A A . 17 GLY HA2 1 1 4 1598 1 1 17 GLY HA3 H 5.471 -1.623 2.368 1.00 . A A . 17 GLY HA3 1 1 4 1599 1 1 17 GLY N N 5.084 0.308 1.597 1.00 . A A . 17 GLY N 1 1 4 1600 1 1 17 GLY O O 8.328 -1.001 1.770 1.00 . A A . 17 GLY O 1 1 4 1601 1 1 18 GLU C C 9.107 -0.087 -0.866 1.00 . A A . 18 GLU C 1 1 4 1602 1 1 18 GLU CA C 8.127 -1.265 -0.918 1.00 . A A . 18 GLU CA 1 1 4 1603 1 1 18 GLU CB C 7.481 -1.370 -2.306 1.00 . A A . 18 GLU CB 1 1 4 1604 1 1 18 GLU CD C 8.008 -3.651 -3.199 1.00 . A A . 18 GLU CD 1 1 4 1605 1 1 18 GLU CG C 8.391 -2.168 -3.246 1.00 . A A . 18 GLU CG 1 1 4 1606 1 1 18 GLU H H 6.070 -0.974 -0.321 1.00 . A A . 18 GLU H 1 1 4 1607 1 1 18 GLU HA H 8.635 -2.180 -0.675 1.00 . A A . 18 GLU HA 1 1 4 1608 1 1 18 GLU HB2 H 6.527 -1.870 -2.220 1.00 . A A . 18 GLU HB2 1 1 4 1609 1 1 18 GLU HB3 H 7.332 -0.380 -2.708 1.00 . A A . 18 GLU HB3 1 1 4 1610 1 1 18 GLU HG2 H 8.275 -1.798 -4.254 1.00 . A A . 18 GLU HG2 1 1 4 1611 1 1 18 GLU HG3 H 9.418 -2.053 -2.938 1.00 . A A . 18 GLU HG3 1 1 4 1612 1 1 18 GLU N N 6.985 -1.041 0.026 1.00 . A A . 18 GLU N 1 1 4 1613 1 1 18 GLU O O 10.303 -0.257 -0.995 1.00 . A A . 18 GLU O 1 1 4 1614 1 1 18 GLU OE1 O 8.296 -4.286 -2.198 1.00 . A A . 18 GLU OE1 1 1 4 1615 1 1 18 GLU OE2 O 7.434 -4.124 -4.165 1.00 . A A . 18 GLU OE2 1 1 4 1616 1 1 19 ASN C C 10.343 2.300 0.678 1.00 . A A . 19 ASN C 1 1 4 1617 1 1 19 ASN CA C 9.501 2.301 -0.608 1.00 . A A . 19 ASN CA 1 1 4 1618 1 1 19 ASN CB C 8.559 3.509 -0.624 1.00 . A A . 19 ASN CB 1 1 4 1619 1 1 19 ASN CG C 8.029 3.736 -2.043 1.00 . A A . 19 ASN CG 1 1 4 1620 1 1 19 ASN H H 7.638 1.210 -0.568 1.00 . A A . 19 ASN H 1 1 4 1621 1 1 19 ASN HA H 10.144 2.330 -1.469 1.00 . A A . 19 ASN HA 1 1 4 1622 1 1 19 ASN HB2 H 7.731 3.327 0.045 1.00 . A A . 19 ASN HB2 1 1 4 1623 1 1 19 ASN HB3 H 9.097 4.387 -0.299 1.00 . A A . 19 ASN HB3 1 1 4 1624 1 1 19 ASN HD21 H 6.158 4.037 -1.450 1.00 . A A . 19 ASN HD21 1 1 4 1625 1 1 19 ASN HD22 H 6.415 4.135 -3.125 1.00 . A A . 19 ASN HD22 1 1 4 1626 1 1 19 ASN N N 8.606 1.103 -0.673 1.00 . A A . 19 ASN N 1 1 4 1627 1 1 19 ASN ND2 N 6.763 3.992 -2.221 1.00 . A A . 19 ASN ND2 1 1 4 1628 1 1 19 ASN O O 11.328 3.004 0.774 1.00 . A A . 19 ASN O 1 1 4 1629 1 1 19 ASN OD1 O 8.776 3.683 -3.001 1.00 . A A . 19 ASN OD1 1 1 4 1630 1 1 20 GLY C C 11.386 0.135 3.179 1.00 . A A . 20 GLY C 1 1 4 1631 1 1 20 GLY CA C 10.733 1.507 2.946 1.00 . A A . 20 GLY CA 1 1 4 1632 1 1 20 GLY H H 9.154 0.980 1.574 1.00 . A A . 20 GLY H 1 1 4 1633 1 1 20 GLY HA2 H 11.503 2.263 2.910 1.00 . A A . 20 GLY HA2 1 1 4 1634 1 1 20 GLY HA3 H 10.065 1.722 3.767 1.00 . A A . 20 GLY HA3 1 1 4 1635 1 1 20 GLY N N 9.958 1.530 1.667 1.00 . A A . 20 GLY N 1 1 4 1636 1 1 20 GLY O O 12.407 0.043 3.831 1.00 . A A . 20 GLY O 1 1 4 1637 1 1 21 VAL C C 12.193 -2.749 1.673 1.00 . A A . 21 VAL C 1 1 4 1638 1 1 21 VAL CA C 11.412 -2.284 2.906 1.00 . A A . 21 VAL CA 1 1 4 1639 1 1 21 VAL CB C 10.226 -3.218 3.185 1.00 . A A . 21 VAL CB 1 1 4 1640 1 1 21 VAL CG1 C 10.744 -4.604 3.583 1.00 . A A . 21 VAL CG1 1 1 4 1641 1 1 21 VAL CG2 C 9.379 -2.651 4.331 1.00 . A A . 21 VAL CG2 1 1 4 1642 1 1 21 VAL H H 9.974 -0.847 2.162 1.00 . A A . 21 VAL H 1 1 4 1643 1 1 21 VAL HA H 12.063 -2.257 3.761 1.00 . A A . 21 VAL HA 1 1 4 1644 1 1 21 VAL HB H 9.620 -3.304 2.295 1.00 . A A . 21 VAL HB 1 1 4 1645 1 1 21 VAL HG11 H 9.921 -5.304 3.598 1.00 . A A . 21 VAL HG11 1 1 4 1646 1 1 21 VAL HG12 H 11.191 -4.553 4.566 1.00 . A A . 21 VAL HG12 1 1 4 1647 1 1 21 VAL HG13 H 11.483 -4.933 2.868 1.00 . A A . 21 VAL HG13 1 1 4 1648 1 1 21 VAL HG21 H 8.683 -3.404 4.672 1.00 . A A . 21 VAL HG21 1 1 4 1649 1 1 21 VAL HG22 H 8.832 -1.788 3.981 1.00 . A A . 21 VAL HG22 1 1 4 1650 1 1 21 VAL HG23 H 10.025 -2.361 5.147 1.00 . A A . 21 VAL HG23 1 1 4 1651 1 1 21 VAL N N 10.808 -0.931 2.677 1.00 . A A . 21 VAL N 1 1 4 1652 1 1 21 VAL O O 13.288 -3.265 1.787 1.00 . A A . 21 VAL O 1 1 4 1653 1 1 22 PHE C C 13.645 -2.199 -0.943 1.00 . A A . 22 PHE C 1 1 4 1654 1 1 22 PHE CA C 12.354 -3.008 -0.741 1.00 . A A . 22 PHE CA 1 1 4 1655 1 1 22 PHE CB C 11.372 -2.748 -1.885 1.00 . A A . 22 PHE CB 1 1 4 1656 1 1 22 PHE CD1 C 11.254 -5.032 -2.947 1.00 . A A . 22 PHE CD1 1 1 4 1657 1 1 22 PHE CD2 C 12.323 -3.231 -4.169 1.00 . A A . 22 PHE CD2 1 1 4 1658 1 1 22 PHE CE1 C 11.516 -5.908 -4.007 1.00 . A A . 22 PHE CE1 1 1 4 1659 1 1 22 PHE CE2 C 12.586 -4.106 -5.229 1.00 . A A . 22 PHE CE2 1 1 4 1660 1 1 22 PHE CG C 11.657 -3.693 -3.028 1.00 . A A . 22 PHE CG 1 1 4 1661 1 1 22 PHE CZ C 12.183 -5.445 -5.148 1.00 . A A . 22 PHE CZ 1 1 4 1662 1 1 22 PHE H H 10.759 -2.151 0.441 1.00 . A A . 22 PHE H 1 1 4 1663 1 1 22 PHE HA H 12.581 -4.056 -0.687 1.00 . A A . 22 PHE HA 1 1 4 1664 1 1 22 PHE HB2 H 10.362 -2.903 -1.534 1.00 . A A . 22 PHE HB2 1 1 4 1665 1 1 22 PHE HB3 H 11.480 -1.729 -2.228 1.00 . A A . 22 PHE HB3 1 1 4 1666 1 1 22 PHE HD1 H 10.740 -5.389 -2.067 1.00 . A A . 22 PHE HD1 1 1 4 1667 1 1 22 PHE HD2 H 12.634 -2.199 -4.232 1.00 . A A . 22 PHE HD2 1 1 4 1668 1 1 22 PHE HE1 H 11.205 -6.940 -3.945 1.00 . A A . 22 PHE HE1 1 1 4 1669 1 1 22 PHE HE2 H 13.100 -3.750 -6.109 1.00 . A A . 22 PHE HE2 1 1 4 1670 1 1 22 PHE HZ H 12.385 -6.120 -5.966 1.00 . A A . 22 PHE HZ 1 1 4 1671 1 1 22 PHE N N 11.641 -2.571 0.502 1.00 . A A . 22 PHE N 1 1 4 1672 1 1 22 PHE O O 14.576 -2.660 -1.572 1.00 . A A . 22 PHE O 1 1 4 1673 1 1 23 PHE C C 15.705 -0.098 0.751 1.00 . A A . 23 PHE C 1 1 4 1674 1 1 23 PHE CA C 14.937 -0.171 -0.575 1.00 . A A . 23 PHE CA 1 1 4 1675 1 1 23 PHE CB C 14.438 1.212 -1.012 1.00 . A A . 23 PHE CB 1 1 4 1676 1 1 23 PHE CD1 C 14.551 0.849 -3.508 1.00 . A A . 23 PHE CD1 1 1 4 1677 1 1 23 PHE CD2 C 12.391 1.249 -2.484 1.00 . A A . 23 PHE CD2 1 1 4 1678 1 1 23 PHE CE1 C 13.936 0.741 -4.760 1.00 . A A . 23 PHE CE1 1 1 4 1679 1 1 23 PHE CE2 C 11.776 1.141 -3.736 1.00 . A A . 23 PHE CE2 1 1 4 1680 1 1 23 PHE CG C 13.777 1.103 -2.368 1.00 . A A . 23 PHE CG 1 1 4 1681 1 1 23 PHE CZ C 12.548 0.887 -4.875 1.00 . A A . 23 PHE CZ 1 1 4 1682 1 1 23 PHE H H 12.943 -0.655 0.090 1.00 . A A . 23 PHE H 1 1 4 1683 1 1 23 PHE HA H 15.569 -0.588 -1.340 1.00 . A A . 23 PHE HA 1 1 4 1684 1 1 23 PHE HB2 H 13.723 1.581 -0.292 1.00 . A A . 23 PHE HB2 1 1 4 1685 1 1 23 PHE HB3 H 15.273 1.894 -1.073 1.00 . A A . 23 PHE HB3 1 1 4 1686 1 1 23 PHE HD1 H 15.622 0.736 -3.419 1.00 . A A . 23 PHE HD1 1 1 4 1687 1 1 23 PHE HD2 H 11.795 1.445 -1.605 1.00 . A A . 23 PHE HD2 1 1 4 1688 1 1 23 PHE HE1 H 14.532 0.544 -5.639 1.00 . A A . 23 PHE HE1 1 1 4 1689 1 1 23 PHE HE2 H 10.705 1.254 -3.823 1.00 . A A . 23 PHE HE2 1 1 4 1690 1 1 23 PHE HZ H 12.075 0.803 -5.842 1.00 . A A . 23 PHE HZ 1 1 4 1691 1 1 23 PHE N N 13.706 -1.004 -0.414 1.00 . A A . 23 PHE N 1 1 4 1692 1 1 23 PHE O O 16.661 -0.823 0.955 1.00 . A A . 23 PHE O 1 1 4 1693 1 1 24 TYR C C 17.509 1.045 2.781 1.00 . A A . 24 TYR C 1 1 4 1694 1 1 24 TYR CA C 15.990 0.897 2.975 1.00 . A A . 24 TYR CA 1 1 4 1695 1 1 24 TYR CB C 15.650 -0.394 3.728 1.00 . A A . 24 TYR CB 1 1 4 1696 1 1 24 TYR CD1 C 14.705 0.642 5.826 1.00 . A A . 24 TYR CD1 1 1 4 1697 1 1 24 TYR CD2 C 16.715 -0.703 5.994 1.00 . A A . 24 TYR CD2 1 1 4 1698 1 1 24 TYR CE1 C 14.742 0.871 7.207 1.00 . A A . 24 TYR CE1 1 1 4 1699 1 1 24 TYR CE2 C 16.752 -0.474 7.376 1.00 . A A . 24 TYR CE2 1 1 4 1700 1 1 24 TYR CG C 15.691 -0.145 5.220 1.00 . A A . 24 TYR CG 1 1 4 1701 1 1 24 TYR CZ C 15.766 0.312 7.982 1.00 . A A . 24 TYR CZ 1 1 4 1702 1 1 24 TYR H H 14.519 1.331 1.456 1.00 . A A . 24 TYR H 1 1 4 1703 1 1 24 TYR HA H 15.601 1.747 3.516 1.00 . A A . 24 TYR HA 1 1 4 1704 1 1 24 TYR HB2 H 14.661 -0.720 3.447 1.00 . A A . 24 TYR HB2 1 1 4 1705 1 1 24 TYR HB3 H 16.365 -1.161 3.472 1.00 . A A . 24 TYR HB3 1 1 4 1706 1 1 24 TYR HD1 H 13.915 1.073 5.229 1.00 . A A . 24 TYR HD1 1 1 4 1707 1 1 24 TYR HD2 H 17.477 -1.310 5.527 1.00 . A A . 24 TYR HD2 1 1 4 1708 1 1 24 TYR HE1 H 13.981 1.478 7.674 1.00 . A A . 24 TYR HE1 1 1 4 1709 1 1 24 TYR HE2 H 17.542 -0.905 7.973 1.00 . A A . 24 TYR HE2 1 1 4 1710 1 1 24 TYR HH H 15.282 -0.147 9.771 1.00 . A A . 24 TYR HH 1 1 4 1711 1 1 24 TYR N N 15.293 0.766 1.651 1.00 . A A . 24 TYR N 1 1 4 1712 1 1 24 TYR O O 18.299 0.387 3.436 1.00 . A A . 24 TYR O 1 1 4 1713 1 1 24 TYR OH O 15.803 0.538 9.343 1.00 . A A . 24 TYR OH 1 1 4 1714 1 1 25 LYS C C 19.678 3.576 1.308 1.00 . A A . 25 LYS C 1 1 4 1715 1 1 25 LYS CA C 19.382 2.105 1.634 1.00 . A A . 25 LYS CA 1 1 4 1716 1 1 25 LYS CB C 19.707 1.214 0.430 1.00 . A A . 25 LYS CB 1 1 4 1717 1 1 25 LYS CD C 21.185 -0.684 -0.258 1.00 . A A . 25 LYS CD 1 1 4 1718 1 1 25 LYS CE C 22.539 -1.207 0.238 1.00 . A A . 25 LYS CE 1 1 4 1719 1 1 25 LYS CG C 20.415 -0.057 0.908 1.00 . A A . 25 LYS CG 1 1 4 1720 1 1 25 LYS H H 17.262 2.422 1.370 1.00 . A A . 25 LYS H 1 1 4 1721 1 1 25 LYS HA H 19.955 1.789 2.490 1.00 . A A . 25 LYS HA 1 1 4 1722 1 1 25 LYS HB2 H 18.792 0.949 -0.079 1.00 . A A . 25 LYS HB2 1 1 4 1723 1 1 25 LYS HB3 H 20.353 1.750 -0.249 1.00 . A A . 25 LYS HB3 1 1 4 1724 1 1 25 LYS HD2 H 20.611 -1.503 -0.668 1.00 . A A . 25 LYS HD2 1 1 4 1725 1 1 25 LYS HD3 H 21.347 0.059 -1.025 1.00 . A A . 25 LYS HD3 1 1 4 1726 1 1 25 LYS HE2 H 22.554 -1.240 1.319 1.00 . A A . 25 LYS HE2 1 1 4 1727 1 1 25 LYS HE3 H 22.734 -2.187 -0.169 1.00 . A A . 25 LYS HE3 1 1 4 1728 1 1 25 LYS HG2 H 21.101 0.192 1.704 1.00 . A A . 25 LYS HG2 1 1 4 1729 1 1 25 LYS HG3 H 19.681 -0.761 1.271 1.00 . A A . 25 LYS HG3 1 1 4 1730 1 1 25 LYS HZ1 H 23.287 0.729 0.028 1.00 . A A . 25 LYS HZ1 1 1 4 1731 1 1 25 LYS HZ2 H 23.583 -0.278 -1.309 1.00 . A A . 25 LYS HZ2 1 1 4 1732 1 1 25 LYS HZ3 H 24.483 -0.469 0.119 1.00 . A A . 25 LYS HZ3 1 1 4 1733 1 1 25 LYS N N 17.919 1.905 1.882 1.00 . A A . 25 LYS N 1 1 4 1734 1 1 25 LYS NZ N 23.549 -0.233 -0.270 1.00 . A A . 25 LYS NZ 1 1 4 1735 1 1 25 LYS O O 18.868 4.192 0.630 1.00 . A A . 25 LYS O 1 1 4 1736 1 1 25 LYS OXT O 20.714 4.058 1.736 1.00 . A A . 25 LYS OXT 1 1 5 1737 1 1 1 HIS C C -19.983 3.496 6.976 1.00 . A A . 1 HIS C 1 1 5 1738 1 1 1 HIS CA C -19.822 4.909 7.552 1.00 . A A . 1 HIS CA 1 1 5 1739 1 1 1 HIS CB C -18.583 4.984 8.451 1.00 . A A . 1 HIS CB 1 1 5 1740 1 1 1 HIS CD2 C -17.084 6.639 7.063 1.00 . A A . 1 HIS CD2 1 1 5 1741 1 1 1 HIS CE1 C -17.010 8.269 8.488 1.00 . A A . 1 HIS CE1 1 1 5 1742 1 1 1 HIS CG C -17.821 6.246 8.154 1.00 . A A . 1 HIS CG 1 1 5 1743 1 1 1 HIS HA H -19.744 5.631 6.755 1.00 . A A . 1 HIS HA 1 1 5 1744 1 1 1 HIS HB2 H -18.887 4.983 9.487 1.00 . A A . 1 HIS HB2 1 1 5 1745 1 1 1 HIS HB3 H -17.949 4.130 8.262 1.00 . A A . 1 HIS HB3 1 1 5 1746 1 1 1 HIS HD1 H -18.183 7.338 9.933 1.00 . A A . 1 HIS HD1 1 1 5 1747 1 1 1 HIS HD2 H -16.925 6.045 6.174 1.00 . A A . 1 HIS HD2 1 1 5 1748 1 1 1 HIS HE1 H -16.789 9.215 8.960 1.00 . A A . 1 HIS HE1 1 1 5 1749 1 1 1 HIS N N -20.976 5.243 8.443 1.00 . A A . 1 HIS N 1 1 5 1750 1 1 1 HIS ND1 N -17.760 7.303 9.050 1.00 . A A . 1 HIS ND1 1 1 5 1751 1 1 1 HIS NE2 N -16.574 7.915 7.277 1.00 . A A . 1 HIS NE2 1 1 5 1752 1 1 1 HIS O O -20.849 2.744 7.386 1.00 . A A . 1 HIS O 1 1 5 1753 1 1 2 ALA C C -17.875 1.079 5.432 1.00 . A A . 2 ALA C 1 1 5 1754 1 1 2 ALA CA C -19.248 1.766 5.422 1.00 . A A . 2 ALA CA 1 1 5 1755 1 1 2 ALA CB C -19.725 2.003 3.987 1.00 . A A . 2 ALA CB 1 1 5 1756 1 1 2 ALA H H -18.462 3.753 5.718 1.00 . A A . 2 ALA H 1 1 5 1757 1 1 2 ALA HA H -19.971 1.167 5.954 1.00 . A A . 2 ALA HA 1 1 5 1758 1 1 2 ALA HB1 H -19.483 1.143 3.380 1.00 . A A . 2 ALA HB1 1 1 5 1759 1 1 2 ALA HB2 H -19.234 2.877 3.584 1.00 . A A . 2 ALA HB2 1 1 5 1760 1 1 2 ALA HB3 H -20.793 2.157 3.984 1.00 . A A . 2 ALA HB3 1 1 5 1761 1 1 2 ALA N N -19.152 3.130 6.029 1.00 . A A . 2 ALA N 1 1 5 1762 1 1 2 ALA O O -16.877 1.674 5.793 1.00 . A A . 2 ALA O 1 1 5 1763 1 1 3 TRP C C -15.933 -0.928 3.606 1.00 . A A . 3 TRP C 1 1 5 1764 1 1 3 TRP CA C -16.515 -0.902 5.028 1.00 . A A . 3 TRP CA 1 1 5 1765 1 1 3 TRP CB C -16.851 -2.320 5.511 1.00 . A A . 3 TRP CB 1 1 5 1766 1 1 3 TRP CD1 C -15.970 -2.143 7.877 1.00 . A A . 3 TRP CD1 1 1 5 1767 1 1 3 TRP CD2 C -14.894 -3.706 6.668 1.00 . A A . 3 TRP CD2 1 1 5 1768 1 1 3 TRP CE2 C -14.308 -3.714 7.956 1.00 . A A . 3 TRP CE2 1 1 5 1769 1 1 3 TRP CE3 C -14.394 -4.603 5.706 1.00 . A A . 3 TRP CE3 1 1 5 1770 1 1 3 TRP CG C -15.947 -2.698 6.643 1.00 . A A . 3 TRP CG 1 1 5 1771 1 1 3 TRP CH2 C -12.781 -5.468 7.313 1.00 . A A . 3 TRP CH2 1 1 5 1772 1 1 3 TRP CZ2 C -13.265 -4.583 8.280 1.00 . A A . 3 TRP CZ2 1 1 5 1773 1 1 3 TRP CZ3 C -13.344 -5.479 6.029 1.00 . A A . 3 TRP CZ3 1 1 5 1774 1 1 3 TRP H H -18.639 -0.629 4.754 1.00 . A A . 3 TRP H 1 1 5 1775 1 1 3 TRP HA H -15.819 -0.437 5.708 1.00 . A A . 3 TRP HA 1 1 5 1776 1 1 3 TRP HB2 H -17.877 -2.352 5.847 1.00 . A A . 3 TRP HB2 1 1 5 1777 1 1 3 TRP HB3 H -16.720 -3.019 4.698 1.00 . A A . 3 TRP HB3 1 1 5 1778 1 1 3 TRP HD1 H -16.638 -1.358 8.201 1.00 . A A . 3 TRP HD1 1 1 5 1779 1 1 3 TRP HE1 H -14.807 -2.525 9.594 1.00 . A A . 3 TRP HE1 1 1 5 1780 1 1 3 TRP HE3 H -14.820 -4.619 4.714 1.00 . A A . 3 TRP HE3 1 1 5 1781 1 1 3 TRP HH2 H -11.973 -6.144 7.555 1.00 . A A . 3 TRP HH2 1 1 5 1782 1 1 3 TRP HZ2 H -12.834 -4.571 9.270 1.00 . A A . 3 TRP HZ2 1 1 5 1783 1 1 3 TRP HZ3 H -12.967 -6.164 5.284 1.00 . A A . 3 TRP HZ3 1 1 5 1784 1 1 3 TRP N N -17.820 -0.170 5.040 1.00 . A A . 3 TRP N 1 1 5 1785 1 1 3 TRP NE1 N -14.998 -2.745 8.657 1.00 . A A . 3 TRP NE1 1 1 5 1786 1 1 3 TRP O O -16.025 -1.916 2.901 1.00 . A A . 3 TRP O 1 1 5 1787 1 1 4 TYR C C -13.368 0.909 1.824 1.00 . A A . 4 TYR C 1 1 5 1788 1 1 4 TYR CA C -14.734 0.202 1.809 1.00 . A A . 4 TYR CA 1 1 5 1789 1 1 4 TYR CB C -15.748 0.983 0.956 1.00 . A A . 4 TYR CB 1 1 5 1790 1 1 4 TYR CD1 C -16.801 2.691 2.488 1.00 . A A . 4 TYR CD1 1 1 5 1791 1 1 4 TYR CD2 C -15.111 3.428 0.914 1.00 . A A . 4 TYR CD2 1 1 5 1792 1 1 4 TYR CE1 C -16.935 4.002 2.957 1.00 . A A . 4 TYR CE1 1 1 5 1793 1 1 4 TYR CE2 C -15.245 4.740 1.384 1.00 . A A . 4 TYR CE2 1 1 5 1794 1 1 4 TYR CG C -15.889 2.403 1.466 1.00 . A A . 4 TYR CG 1 1 5 1795 1 1 4 TYR CZ C -16.158 5.026 2.407 1.00 . A A . 4 TYR CZ 1 1 5 1796 1 1 4 TYR H H -15.265 0.938 3.770 1.00 . A A . 4 TYR H 1 1 5 1797 1 1 4 TYR HA H -14.626 -0.798 1.417 1.00 . A A . 4 TYR HA 1 1 5 1798 1 1 4 TYR HB2 H -15.409 1.005 -0.069 1.00 . A A . 4 TYR HB2 1 1 5 1799 1 1 4 TYR HB3 H -16.708 0.490 1.002 1.00 . A A . 4 TYR HB3 1 1 5 1800 1 1 4 TYR HD1 H -17.400 1.901 2.914 1.00 . A A . 4 TYR HD1 1 1 5 1801 1 1 4 TYR HD2 H -14.406 3.207 0.126 1.00 . A A . 4 TYR HD2 1 1 5 1802 1 1 4 TYR HE1 H -17.639 4.224 3.745 1.00 . A A . 4 TYR HE1 1 1 5 1803 1 1 4 TYR HE2 H -14.645 5.531 0.959 1.00 . A A . 4 TYR HE2 1 1 5 1804 1 1 4 TYR HH H -15.527 6.523 3.410 1.00 . A A . 4 TYR HH 1 1 5 1805 1 1 4 TYR N N -15.329 0.155 3.184 1.00 . A A . 4 TYR N 1 1 5 1806 1 1 4 TYR O O -12.892 1.372 0.804 1.00 . A A . 4 TYR O 1 1 5 1807 1 1 4 TYR OH O -16.294 6.318 2.870 1.00 . A A . 4 TYR OH 1 1 5 1808 1 1 5 SER C C -10.275 0.616 3.226 1.00 . A A . 5 SER C 1 1 5 1809 1 1 5 SER CA C -11.392 1.655 3.041 1.00 . A A . 5 SER CA 1 1 5 1810 1 1 5 SER CB C -11.477 2.575 4.259 1.00 . A A . 5 SER CB 1 1 5 1811 1 1 5 SER H H -13.123 0.597 3.778 1.00 . A A . 5 SER H 1 1 5 1812 1 1 5 SER HA H -11.217 2.238 2.152 1.00 . A A . 5 SER HA 1 1 5 1813 1 1 5 SER HB2 H -11.679 1.992 5.141 1.00 . A A . 5 SER HB2 1 1 5 1814 1 1 5 SER HB3 H -10.534 3.093 4.381 1.00 . A A . 5 SER HB3 1 1 5 1815 1 1 5 SER HG H -12.202 4.382 4.322 1.00 . A A . 5 SER HG 1 1 5 1816 1 1 5 SER N N -12.729 0.985 2.969 1.00 . A A . 5 SER N 1 1 5 1817 1 1 5 SER O O -9.200 0.933 3.701 1.00 . A A . 5 SER O 1 1 5 1818 1 1 5 SER OG O -12.528 3.515 4.067 1.00 . A A . 5 SER OG 1 1 5 1819 1 1 6 HIS C C -8.720 -1.871 1.683 1.00 . A A . 6 HIS C 1 1 5 1820 1 1 6 HIS CA C -9.462 -1.668 3.004 1.00 . A A . 6 HIS CA 1 1 5 1821 1 1 6 HIS CB C -10.210 -2.940 3.415 1.00 . A A . 6 HIS CB 1 1 5 1822 1 1 6 HIS CD2 C -11.289 -2.568 5.781 1.00 . A A . 6 HIS CD2 1 1 5 1823 1 1 6 HIS CE1 C -9.704 -3.422 6.988 1.00 . A A . 6 HIS CE1 1 1 5 1824 1 1 6 HIS CG C -10.314 -2.994 4.914 1.00 . A A . 6 HIS CG 1 1 5 1825 1 1 6 HIS H H -11.385 -0.854 2.467 1.00 . A A . 6 HIS H 1 1 5 1826 1 1 6 HIS HA H -8.767 -1.385 3.773 1.00 . A A . 6 HIS HA 1 1 5 1827 1 1 6 HIS HB2 H -11.201 -2.932 2.984 1.00 . A A . 6 HIS HB2 1 1 5 1828 1 1 6 HIS HB3 H -9.671 -3.806 3.061 1.00 . A A . 6 HIS HB3 1 1 5 1829 1 1 6 HIS HD1 H -8.473 -3.929 5.390 1.00 . A A . 6 HIS HD1 1 1 5 1830 1 1 6 HIS HD2 H -12.217 -2.096 5.491 1.00 . A A . 6 HIS HD2 1 1 5 1831 1 1 6 HIS HE1 H -9.121 -3.759 7.832 1.00 . A A . 6 HIS HE1 1 1 5 1832 1 1 6 HIS N N -10.514 -0.619 2.851 1.00 . A A . 6 HIS N 1 1 5 1833 1 1 6 HIS ND1 N -9.312 -3.535 5.706 1.00 . A A . 6 HIS ND1 1 1 5 1834 1 1 6 HIS NE2 N -10.902 -2.839 7.090 1.00 . A A . 6 HIS NE2 1 1 5 1835 1 1 6 HIS O O -7.516 -2.049 1.664 1.00 . A A . 6 HIS O 1 1 5 1836 1 1 7 TYR C C -7.772 -0.853 -0.978 1.00 . A A . 7 TYR C 1 1 5 1837 1 1 7 TYR CA C -8.750 -2.005 -0.746 1.00 . A A . 7 TYR CA 1 1 5 1838 1 1 7 TYR CB C -9.872 -1.983 -1.790 1.00 . A A . 7 TYR CB 1 1 5 1839 1 1 7 TYR CD1 C -9.572 -4.307 -2.725 1.00 . A A . 7 TYR CD1 1 1 5 1840 1 1 7 TYR CD2 C -11.634 -3.774 -1.566 1.00 . A A . 7 TYR CD2 1 1 5 1841 1 1 7 TYR CE1 C -10.035 -5.609 -2.950 1.00 . A A . 7 TYR CE1 1 1 5 1842 1 1 7 TYR CE2 C -12.097 -5.075 -1.790 1.00 . A A . 7 TYR CE2 1 1 5 1843 1 1 7 TYR CG C -10.371 -3.388 -2.032 1.00 . A A . 7 TYR CG 1 1 5 1844 1 1 7 TYR CZ C -11.297 -5.992 -2.482 1.00 . A A . 7 TYR CZ 1 1 5 1845 1 1 7 TYR H H -10.390 -1.676 0.625 1.00 . A A . 7 TYR H 1 1 5 1846 1 1 7 TYR HA H -8.229 -2.944 -0.779 1.00 . A A . 7 TYR HA 1 1 5 1847 1 1 7 TYR HB2 H -10.686 -1.369 -1.432 1.00 . A A . 7 TYR HB2 1 1 5 1848 1 1 7 TYR HB3 H -9.493 -1.573 -2.715 1.00 . A A . 7 TYR HB3 1 1 5 1849 1 1 7 TYR HD1 H -8.598 -4.011 -3.084 1.00 . A A . 7 TYR HD1 1 1 5 1850 1 1 7 TYR HD2 H -12.251 -3.066 -1.032 1.00 . A A . 7 TYR HD2 1 1 5 1851 1 1 7 TYR HE1 H -9.418 -6.317 -3.483 1.00 . A A . 7 TYR HE1 1 1 5 1852 1 1 7 TYR HE2 H -13.072 -5.371 -1.431 1.00 . A A . 7 TYR HE2 1 1 5 1853 1 1 7 TYR HH H -12.226 -7.283 -3.541 1.00 . A A . 7 TYR HH 1 1 5 1854 1 1 7 TYR N N -9.424 -1.831 0.579 1.00 . A A . 7 TYR N 1 1 5 1855 1 1 7 TYR O O -6.656 -1.055 -1.417 1.00 . A A . 7 TYR O 1 1 5 1856 1 1 7 TYR OH O -11.755 -7.275 -2.704 1.00 . A A . 7 TYR OH 1 1 5 1857 1 1 8 VAL C C -6.078 1.405 0.123 1.00 . A A . 8 VAL C 1 1 5 1858 1 1 8 VAL CA C -7.270 1.526 -0.837 1.00 . A A . 8 VAL CA 1 1 5 1859 1 1 8 VAL CB C -8.125 2.764 -0.516 1.00 . A A . 8 VAL CB 1 1 5 1860 1 1 8 VAL CG1 C -8.486 2.794 0.974 1.00 . A A . 8 VAL CG1 1 1 5 1861 1 1 8 VAL CG2 C -7.340 4.030 -0.871 1.00 . A A . 8 VAL CG2 1 1 5 1862 1 1 8 VAL H H -9.079 0.476 -0.295 1.00 . A A . 8 VAL H 1 1 5 1863 1 1 8 VAL HA H -6.921 1.573 -1.853 1.00 . A A . 8 VAL HA 1 1 5 1864 1 1 8 VAL HB H -9.034 2.730 -1.101 1.00 . A A . 8 VAL HB 1 1 5 1865 1 1 8 VAL HG11 H -7.620 3.085 1.549 1.00 . A A . 8 VAL HG11 1 1 5 1866 1 1 8 VAL HG12 H -8.811 1.812 1.286 1.00 . A A . 8 VAL HG12 1 1 5 1867 1 1 8 VAL HG13 H -9.283 3.505 1.137 1.00 . A A . 8 VAL HG13 1 1 5 1868 1 1 8 VAL HG21 H -7.052 3.995 -1.911 1.00 . A A . 8 VAL HG21 1 1 5 1869 1 1 8 VAL HG22 H -6.455 4.090 -0.254 1.00 . A A . 8 VAL HG22 1 1 5 1870 1 1 8 VAL HG23 H -7.960 4.898 -0.698 1.00 . A A . 8 VAL HG23 1 1 5 1871 1 1 8 VAL N N -8.180 0.351 -0.661 1.00 . A A . 8 VAL N 1 1 5 1872 1 1 8 VAL O O -4.983 1.839 -0.177 1.00 . A A . 8 VAL O 1 1 5 1873 1 1 9 LEU C C -4.277 -0.541 1.797 1.00 . A A . 9 LEU C 1 1 5 1874 1 1 9 LEU CA C -5.170 0.624 2.240 1.00 . A A . 9 LEU CA 1 1 5 1875 1 1 9 LEU CB C -5.846 0.311 3.578 1.00 . A A . 9 LEU CB 1 1 5 1876 1 1 9 LEU CD1 C -4.959 2.203 4.953 1.00 . A A . 9 LEU CD1 1 1 5 1877 1 1 9 LEU CD2 C -5.353 -0.028 6.005 1.00 . A A . 9 LEU CD2 1 1 5 1878 1 1 9 LEU CG C -4.909 0.690 4.728 1.00 . A A . 9 LEU CG 1 1 5 1879 1 1 9 LEU H H -7.175 0.444 1.474 1.00 . A A . 9 LEU H 1 1 5 1880 1 1 9 LEU HA H -4.594 1.532 2.320 1.00 . A A . 9 LEU HA 1 1 5 1881 1 1 9 LEU HB2 H -6.765 0.875 3.660 1.00 . A A . 9 LEU HB2 1 1 5 1882 1 1 9 LEU HB3 H -6.067 -0.745 3.631 1.00 . A A . 9 LEU HB3 1 1 5 1883 1 1 9 LEU HD11 H -4.460 2.446 5.879 1.00 . A A . 9 LEU HD11 1 1 5 1884 1 1 9 LEU HD12 H -5.987 2.527 5.001 1.00 . A A . 9 LEU HD12 1 1 5 1885 1 1 9 LEU HD13 H -4.462 2.705 4.134 1.00 . A A . 9 LEU HD13 1 1 5 1886 1 1 9 LEU HD21 H -5.429 -1.088 5.815 1.00 . A A . 9 LEU HD21 1 1 5 1887 1 1 9 LEU HD22 H -6.316 0.351 6.315 1.00 . A A . 9 LEU HD22 1 1 5 1888 1 1 9 LEU HD23 H -4.629 0.147 6.787 1.00 . A A . 9 LEU HD23 1 1 5 1889 1 1 9 LEU HG H -3.900 0.396 4.480 1.00 . A A . 9 LEU HG 1 1 5 1890 1 1 9 LEU N N -6.286 0.799 1.265 1.00 . A A . 9 LEU N 1 1 5 1891 1 1 9 LEU O O -3.073 -0.506 1.968 1.00 . A A . 9 LEU O 1 1 5 1892 1 1 10 LYS C C -3.075 -2.283 -0.350 1.00 . A A . 10 LYS C 1 1 5 1893 1 1 10 LYS CA C -4.046 -2.732 0.748 1.00 . A A . 10 LYS CA 1 1 5 1894 1 1 10 LYS CB C -5.062 -3.737 0.194 1.00 . A A . 10 LYS CB 1 1 5 1895 1 1 10 LYS CD C -5.019 -5.805 1.598 1.00 . A A . 10 LYS CD 1 1 5 1896 1 1 10 LYS CE C -4.382 -7.188 1.769 1.00 . A A . 10 LYS CE 1 1 5 1897 1 1 10 LYS CG C -4.499 -5.156 0.313 1.00 . A A . 10 LYS CG 1 1 5 1898 1 1 10 LYS H H -5.834 -1.567 1.083 1.00 . A A . 10 LYS H 1 1 5 1899 1 1 10 LYS HA H -3.505 -3.170 1.572 1.00 . A A . 10 LYS HA 1 1 5 1900 1 1 10 LYS HB2 H -5.982 -3.665 0.754 1.00 . A A . 10 LYS HB2 1 1 5 1901 1 1 10 LYS HB3 H -5.256 -3.516 -0.846 1.00 . A A . 10 LYS HB3 1 1 5 1902 1 1 10 LYS HD2 H -4.763 -5.182 2.443 1.00 . A A . 10 LYS HD2 1 1 5 1903 1 1 10 LYS HD3 H -6.092 -5.910 1.539 1.00 . A A . 10 LYS HD3 1 1 5 1904 1 1 10 LYS HE2 H -4.688 -7.843 0.964 1.00 . A A . 10 LYS HE2 1 1 5 1905 1 1 10 LYS HE3 H -3.307 -7.107 1.801 1.00 . A A . 10 LYS HE3 1 1 5 1906 1 1 10 LYS HG2 H -4.814 -5.740 -0.540 1.00 . A A . 10 LYS HG2 1 1 5 1907 1 1 10 LYS HG3 H -3.420 -5.115 0.342 1.00 . A A . 10 LYS HG3 1 1 5 1908 1 1 10 LYS HZ1 H -4.602 -7.049 3.838 1.00 . A A . 10 LYS HZ1 1 1 5 1909 1 1 10 LYS HZ2 H -4.510 -8.643 3.256 1.00 . A A . 10 LYS HZ2 1 1 5 1910 1 1 10 LYS HZ3 H -5.934 -7.741 3.048 1.00 . A A . 10 LYS HZ3 1 1 5 1911 1 1 10 LYS N N -4.859 -1.567 1.216 1.00 . A A . 10 LYS N 1 1 5 1912 1 1 10 LYS NZ N -4.896 -7.693 3.076 1.00 . A A . 10 LYS NZ 1 1 5 1913 1 1 10 LYS O O -1.913 -2.639 -0.342 1.00 . A A . 10 LYS O 1 1 5 1914 1 1 11 PHE C C -1.532 -0.132 -1.790 1.00 . A A . 11 PHE C 1 1 5 1915 1 1 11 PHE CA C -2.652 -1.000 -2.382 1.00 . A A . 11 PHE CA 1 1 5 1916 1 1 11 PHE CB C -3.563 -0.172 -3.296 1.00 . A A . 11 PHE CB 1 1 5 1917 1 1 11 PHE CD1 C -2.254 -0.256 -5.451 1.00 . A A . 11 PHE CD1 1 1 5 1918 1 1 11 PHE CD2 C -2.471 1.867 -4.300 1.00 . A A . 11 PHE CD2 1 1 5 1919 1 1 11 PHE CE1 C -1.494 0.365 -6.451 1.00 . A A . 11 PHE CE1 1 1 5 1920 1 1 11 PHE CE2 C -1.712 2.487 -5.298 1.00 . A A . 11 PHE CE2 1 1 5 1921 1 1 11 PHE CG C -2.743 0.496 -4.376 1.00 . A A . 11 PHE CG 1 1 5 1922 1 1 11 PHE CZ C -1.223 1.737 -6.373 1.00 . A A . 11 PHE CZ 1 1 5 1923 1 1 11 PHE H H -4.486 -1.213 -1.261 1.00 . A A . 11 PHE H 1 1 5 1924 1 1 11 PHE HA H -2.234 -1.832 -2.928 1.00 . A A . 11 PHE HA 1 1 5 1925 1 1 11 PHE HB2 H -4.298 -0.820 -3.752 1.00 . A A . 11 PHE HB2 1 1 5 1926 1 1 11 PHE HB3 H -4.069 0.583 -2.710 1.00 . A A . 11 PHE HB3 1 1 5 1927 1 1 11 PHE HD1 H -2.462 -1.313 -5.511 1.00 . A A . 11 PHE HD1 1 1 5 1928 1 1 11 PHE HD2 H -2.848 2.447 -3.470 1.00 . A A . 11 PHE HD2 1 1 5 1929 1 1 11 PHE HE1 H -1.116 -0.215 -7.280 1.00 . A A . 11 PHE HE1 1 1 5 1930 1 1 11 PHE HE2 H -1.503 3.546 -5.239 1.00 . A A . 11 PHE HE2 1 1 5 1931 1 1 11 PHE HZ H -0.637 2.215 -7.145 1.00 . A A . 11 PHE HZ 1 1 5 1932 1 1 11 PHE N N -3.545 -1.491 -1.286 1.00 . A A . 11 PHE N 1 1 5 1933 1 1 11 PHE O O -0.388 -0.225 -2.194 1.00 . A A . 11 PHE O 1 1 5 1934 1 1 12 PHE C C 0.231 0.699 0.516 1.00 . A A . 12 PHE C 1 1 5 1935 1 1 12 PHE CA C -0.812 1.568 -0.196 1.00 . A A . 12 PHE CA 1 1 5 1936 1 1 12 PHE CB C -1.566 2.440 0.812 1.00 . A A . 12 PHE CB 1 1 5 1937 1 1 12 PHE CD1 C -2.789 3.959 -0.789 1.00 . A A . 12 PHE CD1 1 1 5 1938 1 1 12 PHE CD2 C -1.090 4.910 0.656 1.00 . A A . 12 PHE CD2 1 1 5 1939 1 1 12 PHE CE1 C -3.025 5.222 -1.344 1.00 . A A . 12 PHE CE1 1 1 5 1940 1 1 12 PHE CE2 C -1.326 6.173 0.101 1.00 . A A . 12 PHE CE2 1 1 5 1941 1 1 12 PHE CG C -1.822 3.803 0.212 1.00 . A A . 12 PHE CG 1 1 5 1942 1 1 12 PHE CZ C -2.293 6.329 -0.900 1.00 . A A . 12 PHE CZ 1 1 5 1943 1 1 12 PHE H H -2.784 0.748 -0.517 1.00 . A A . 12 PHE H 1 1 5 1944 1 1 12 PHE HA H -0.339 2.189 -0.941 1.00 . A A . 12 PHE HA 1 1 5 1945 1 1 12 PHE HB2 H -2.508 1.973 1.061 1.00 . A A . 12 PHE HB2 1 1 5 1946 1 1 12 PHE HB3 H -0.972 2.549 1.708 1.00 . A A . 12 PHE HB3 1 1 5 1947 1 1 12 PHE HD1 H -3.352 3.105 -1.133 1.00 . A A . 12 PHE HD1 1 1 5 1948 1 1 12 PHE HD2 H -0.345 4.790 1.428 1.00 . A A . 12 PHE HD2 1 1 5 1949 1 1 12 PHE HE1 H -3.770 5.341 -2.115 1.00 . A A . 12 PHE HE1 1 1 5 1950 1 1 12 PHE HE2 H -0.762 7.029 0.444 1.00 . A A . 12 PHE HE2 1 1 5 1951 1 1 12 PHE HZ H -2.475 7.303 -1.328 1.00 . A A . 12 PHE HZ 1 1 5 1952 1 1 12 PHE N N -1.856 0.700 -0.829 1.00 . A A . 12 PHE N 1 1 5 1953 1 1 12 PHE O O 1.413 0.966 0.458 1.00 . A A . 12 PHE O 1 1 5 1954 1 1 13 LEU C C 1.668 -1.958 0.870 1.00 . A A . 13 LEU C 1 1 5 1955 1 1 13 LEU CA C 0.761 -1.248 1.887 1.00 . A A . 13 LEU CA 1 1 5 1956 1 1 13 LEU CB C -0.118 -2.263 2.630 1.00 . A A . 13 LEU CB 1 1 5 1957 1 1 13 LEU CD1 C 0.077 -3.305 4.895 1.00 . A A . 13 LEU CD1 1 1 5 1958 1 1 13 LEU CD2 C 0.920 -4.526 2.886 1.00 . A A . 13 LEU CD2 1 1 5 1959 1 1 13 LEU CG C 0.751 -3.146 3.531 1.00 . A A . 13 LEU CG 1 1 5 1960 1 1 13 LEU H H -1.164 -0.545 1.204 1.00 . A A . 13 LEU H 1 1 5 1961 1 1 13 LEU HA H 1.353 -0.686 2.593 1.00 . A A . 13 LEU HA 1 1 5 1962 1 1 13 LEU HB2 H -0.842 -1.735 3.233 1.00 . A A . 13 LEU HB2 1 1 5 1963 1 1 13 LEU HB3 H -0.633 -2.882 1.910 1.00 . A A . 13 LEU HB3 1 1 5 1964 1 1 13 LEU HD11 H -0.856 -3.835 4.777 1.00 . A A . 13 LEU HD11 1 1 5 1965 1 1 13 LEU HD12 H -0.115 -2.330 5.318 1.00 . A A . 13 LEU HD12 1 1 5 1966 1 1 13 LEU HD13 H 0.726 -3.861 5.556 1.00 . A A . 13 LEU HD13 1 1 5 1967 1 1 13 LEU HD21 H -0.042 -5.014 2.824 1.00 . A A . 13 LEU HD21 1 1 5 1968 1 1 13 LEU HD22 H 1.589 -5.125 3.487 1.00 . A A . 13 LEU HD22 1 1 5 1969 1 1 13 LEU HD23 H 1.332 -4.412 1.894 1.00 . A A . 13 LEU HD23 1 1 5 1970 1 1 13 LEU HG H 1.721 -2.687 3.662 1.00 . A A . 13 LEU HG 1 1 5 1971 1 1 13 LEU N N -0.202 -0.348 1.179 1.00 . A A . 13 LEU N 1 1 5 1972 1 1 13 LEU O O 2.835 -2.190 1.125 1.00 . A A . 13 LEU O 1 1 5 1973 1 1 14 LEU C C 2.887 -2.012 -2.039 1.00 . A A . 14 LEU C 1 1 5 1974 1 1 14 LEU CA C 1.952 -2.998 -1.321 1.00 . A A . 14 LEU CA 1 1 5 1975 1 1 14 LEU CB C 0.930 -3.579 -2.304 1.00 . A A . 14 LEU CB 1 1 5 1976 1 1 14 LEU CD1 C 1.212 -6.043 -1.958 1.00 . A A . 14 LEU CD1 1 1 5 1977 1 1 14 LEU CD2 C 0.776 -5.144 -4.247 1.00 . A A . 14 LEU CD2 1 1 5 1978 1 1 14 LEU CG C 1.475 -4.875 -2.912 1.00 . A A . 14 LEU CG 1 1 5 1979 1 1 14 LEU H H 0.190 -2.102 -0.456 1.00 . A A . 14 LEU H 1 1 5 1980 1 1 14 LEU HA H 2.523 -3.792 -0.875 1.00 . A A . 14 LEU HA 1 1 5 1981 1 1 14 LEU HB2 H 0.006 -3.787 -1.781 1.00 . A A . 14 LEU HB2 1 1 5 1982 1 1 14 LEU HB3 H 0.743 -2.865 -3.092 1.00 . A A . 14 LEU HB3 1 1 5 1983 1 1 14 LEU HD11 H 1.627 -5.815 -0.987 1.00 . A A . 14 LEU HD11 1 1 5 1984 1 1 14 LEU HD12 H 1.677 -6.937 -2.347 1.00 . A A . 14 LEU HD12 1 1 5 1985 1 1 14 LEU HD13 H 0.147 -6.201 -1.866 1.00 . A A . 14 LEU HD13 1 1 5 1986 1 1 14 LEU HD21 H 1.046 -4.375 -4.956 1.00 . A A . 14 LEU HD21 1 1 5 1987 1 1 14 LEU HD22 H -0.294 -5.139 -4.101 1.00 . A A . 14 LEU HD22 1 1 5 1988 1 1 14 LEU HD23 H 1.083 -6.107 -4.626 1.00 . A A . 14 LEU HD23 1 1 5 1989 1 1 14 LEU HG H 2.539 -4.777 -3.074 1.00 . A A . 14 LEU HG 1 1 5 1990 1 1 14 LEU N N 1.134 -2.302 -0.279 1.00 . A A . 14 LEU N 1 1 5 1991 1 1 14 LEU O O 3.942 -2.384 -2.514 1.00 . A A . 14 LEU O 1 1 5 1992 1 1 15 VAL C C 4.225 1.005 -1.800 1.00 . A A . 15 VAL C 1 1 5 1993 1 1 15 VAL CA C 3.364 0.247 -2.820 1.00 . A A . 15 VAL CA 1 1 5 1994 1 1 15 VAL CB C 2.384 1.198 -3.521 1.00 . A A . 15 VAL CB 1 1 5 1995 1 1 15 VAL CG1 C 3.142 2.406 -4.084 1.00 . A A . 15 VAL CG1 1 1 5 1996 1 1 15 VAL CG2 C 1.689 0.462 -4.670 1.00 . A A . 15 VAL CG2 1 1 5 1997 1 1 15 VAL H H 1.646 -0.491 -1.739 1.00 . A A . 15 VAL H 1 1 5 1998 1 1 15 VAL HA H 3.991 -0.237 -3.552 1.00 . A A . 15 VAL HA 1 1 5 1999 1 1 15 VAL HB H 1.644 1.539 -2.811 1.00 . A A . 15 VAL HB 1 1 5 2000 1 1 15 VAL HG11 H 4.178 2.141 -4.240 1.00 . A A . 15 VAL HG11 1 1 5 2001 1 1 15 VAL HG12 H 3.081 3.227 -3.385 1.00 . A A . 15 VAL HG12 1 1 5 2002 1 1 15 VAL HG13 H 2.701 2.701 -5.025 1.00 . A A . 15 VAL HG13 1 1 5 2003 1 1 15 VAL HG21 H 1.638 -0.593 -4.443 1.00 . A A . 15 VAL HG21 1 1 5 2004 1 1 15 VAL HG22 H 2.249 0.606 -5.582 1.00 . A A . 15 VAL HG22 1 1 5 2005 1 1 15 VAL HG23 H 0.690 0.851 -4.795 1.00 . A A . 15 VAL HG23 1 1 5 2006 1 1 15 VAL N N 2.502 -0.763 -2.126 1.00 . A A . 15 VAL N 1 1 5 2007 1 1 15 VAL O O 5.441 0.996 -1.876 1.00 . A A . 15 VAL O 1 1 5 2008 1 1 16 PHE C C 5.225 1.475 1.045 1.00 . A A . 16 PHE C 1 1 5 2009 1 1 16 PHE CA C 4.383 2.425 0.177 1.00 . A A . 16 PHE CA 1 1 5 2010 1 1 16 PHE CB C 3.333 3.144 1.031 1.00 . A A . 16 PHE CB 1 1 5 2011 1 1 16 PHE CD1 C 4.327 5.462 1.058 1.00 . A A . 16 PHE CD1 1 1 5 2012 1 1 16 PHE CD2 C 4.233 4.208 3.132 1.00 . A A . 16 PHE CD2 1 1 5 2013 1 1 16 PHE CE1 C 4.928 6.532 1.731 1.00 . A A . 16 PHE CE1 1 1 5 2014 1 1 16 PHE CE2 C 4.833 5.278 3.805 1.00 . A A . 16 PHE CE2 1 1 5 2015 1 1 16 PHE CG C 3.980 4.300 1.758 1.00 . A A . 16 PHE CG 1 1 5 2016 1 1 16 PHE CZ C 5.180 6.440 3.105 1.00 . A A . 16 PHE CZ 1 1 5 2017 1 1 16 PHE H H 2.625 1.651 -0.810 1.00 . A A . 16 PHE H 1 1 5 2018 1 1 16 PHE HA H 5.019 3.150 -0.303 1.00 . A A . 16 PHE HA 1 1 5 2019 1 1 16 PHE HB2 H 2.544 3.516 0.394 1.00 . A A . 16 PHE HB2 1 1 5 2020 1 1 16 PHE HB3 H 2.919 2.453 1.750 1.00 . A A . 16 PHE HB3 1 1 5 2021 1 1 16 PHE HD1 H 4.133 5.532 -0.002 1.00 . A A . 16 PHE HD1 1 1 5 2022 1 1 16 PHE HD2 H 3.965 3.312 3.672 1.00 . A A . 16 PHE HD2 1 1 5 2023 1 1 16 PHE HE1 H 5.195 7.428 1.192 1.00 . A A . 16 PHE HE1 1 1 5 2024 1 1 16 PHE HE2 H 5.028 5.209 4.865 1.00 . A A . 16 PHE HE2 1 1 5 2025 1 1 16 PHE HZ H 5.643 7.267 3.625 1.00 . A A . 16 PHE HZ 1 1 5 2026 1 1 16 PHE N N 3.605 1.661 -0.849 1.00 . A A . 16 PHE N 1 1 5 2027 1 1 16 PHE O O 6.228 1.876 1.604 1.00 . A A . 16 PHE O 1 1 5 2028 1 1 17 GLY C C 7.061 -0.802 1.475 1.00 . A A . 17 GLY C 1 1 5 2029 1 1 17 GLY CA C 5.619 -0.740 1.987 1.00 . A A . 17 GLY CA 1 1 5 2030 1 1 17 GLY H H 4.020 -0.076 0.702 1.00 . A A . 17 GLY H 1 1 5 2031 1 1 17 GLY HA2 H 5.617 -0.416 3.019 1.00 . A A . 17 GLY HA2 1 1 5 2032 1 1 17 GLY HA3 H 5.175 -1.721 1.919 1.00 . A A . 17 GLY HA3 1 1 5 2033 1 1 17 GLY N N 4.832 0.227 1.161 1.00 . A A . 17 GLY N 1 1 5 2034 1 1 17 GLY O O 7.999 -0.631 2.228 1.00 . A A . 17 GLY O 1 1 5 2035 1 1 18 GLU C C 9.340 0.254 -0.201 1.00 . A A . 18 GLU C 1 1 5 2036 1 1 18 GLU CA C 8.627 -1.093 -0.371 1.00 . A A . 18 GLU CA 1 1 5 2037 1 1 18 GLU CB C 8.443 -1.416 -1.857 1.00 . A A . 18 GLU CB 1 1 5 2038 1 1 18 GLU CD C 9.605 -3.624 -2.055 1.00 . A A . 18 GLU CD 1 1 5 2039 1 1 18 GLU CG C 8.245 -2.924 -2.038 1.00 . A A . 18 GLU CG 1 1 5 2040 1 1 18 GLU H H 6.467 -1.156 -0.392 1.00 . A A . 18 GLU H 1 1 5 2041 1 1 18 GLU HA H 9.192 -1.872 0.109 1.00 . A A . 18 GLU HA 1 1 5 2042 1 1 18 GLU HB2 H 7.577 -0.891 -2.234 1.00 . A A . 18 GLU HB2 1 1 5 2043 1 1 18 GLU HB3 H 9.320 -1.102 -2.404 1.00 . A A . 18 GLU HB3 1 1 5 2044 1 1 18 GLU HG2 H 7.651 -3.309 -1.221 1.00 . A A . 18 GLU HG2 1 1 5 2045 1 1 18 GLU HG3 H 7.735 -3.110 -2.972 1.00 . A A . 18 GLU HG3 1 1 5 2046 1 1 18 GLU N N 7.243 -1.032 0.197 1.00 . A A . 18 GLU N 1 1 5 2047 1 1 18 GLU O O 10.542 0.309 -0.029 1.00 . A A . 18 GLU O 1 1 5 2048 1 1 18 GLU OE1 O 10.328 -3.450 -3.022 1.00 . A A . 18 GLU OE1 1 1 5 2049 1 1 18 GLU OE2 O 9.902 -4.323 -1.100 1.00 . A A . 18 GLU OE2 1 1 5 2050 1 1 19 ASN C C 9.810 2.850 1.339 1.00 . A A . 19 ASN C 1 1 5 2051 1 1 19 ASN CA C 9.225 2.688 -0.072 1.00 . A A . 19 ASN CA 1 1 5 2052 1 1 19 ASN CB C 8.088 3.692 -0.296 1.00 . A A . 19 ASN CB 1 1 5 2053 1 1 19 ASN CG C 7.989 4.035 -1.785 1.00 . A A . 19 ASN CG 1 1 5 2054 1 1 19 ASN H H 7.634 1.255 -0.372 1.00 . A A . 19 ASN H 1 1 5 2055 1 1 19 ASN HA H 9.992 2.835 -0.810 1.00 . A A . 19 ASN HA 1 1 5 2056 1 1 19 ASN HB2 H 7.155 3.261 0.036 1.00 . A A . 19 ASN HB2 1 1 5 2057 1 1 19 ASN HB3 H 8.288 4.592 0.265 1.00 . A A . 19 ASN HB3 1 1 5 2058 1 1 19 ASN HD21 H 6.510 2.754 -2.132 1.00 . A A . 19 ASN HD21 1 1 5 2059 1 1 19 ASN HD22 H 7.033 3.640 -3.481 1.00 . A A . 19 ASN HD22 1 1 5 2060 1 1 19 ASN N N 8.601 1.335 -0.239 1.00 . A A . 19 ASN N 1 1 5 2061 1 1 19 ASN ND2 N 7.104 3.426 -2.528 1.00 . A A . 19 ASN ND2 1 1 5 2062 1 1 19 ASN O O 10.654 3.694 1.569 1.00 . A A . 19 ASN O 1 1 5 2063 1 1 19 ASN OD1 O 8.725 4.868 -2.278 1.00 . A A . 19 ASN OD1 1 1 5 2064 1 1 20 GLY C C 10.733 0.918 4.020 1.00 . A A . 20 GLY C 1 1 5 2065 1 1 20 GLY CA C 9.895 2.157 3.675 1.00 . A A . 20 GLY CA 1 1 5 2066 1 1 20 GLY H H 8.686 1.384 2.069 1.00 . A A . 20 GLY H 1 1 5 2067 1 1 20 GLY HA2 H 10.511 3.041 3.761 1.00 . A A . 20 GLY HA2 1 1 5 2068 1 1 20 GLY HA3 H 9.069 2.229 4.365 1.00 . A A . 20 GLY HA3 1 1 5 2069 1 1 20 GLY N N 9.368 2.051 2.280 1.00 . A A . 20 GLY N 1 1 5 2070 1 1 20 GLY O O 11.727 1.013 4.716 1.00 . A A . 20 GLY O 1 1 5 2071 1 1 21 VAL C C 12.528 -1.432 3.268 1.00 . A A . 21 VAL C 1 1 5 2072 1 1 21 VAL CA C 11.110 -1.493 3.860 1.00 . A A . 21 VAL CA 1 1 5 2073 1 1 21 VAL CB C 10.304 -2.638 3.231 1.00 . A A . 21 VAL CB 1 1 5 2074 1 1 21 VAL CG1 C 11.098 -3.946 3.318 1.00 . A A . 21 VAL CG1 1 1 5 2075 1 1 21 VAL CG2 C 8.980 -2.806 3.982 1.00 . A A . 21 VAL CG2 1 1 5 2076 1 1 21 VAL H H 9.528 -0.297 2.993 1.00 . A A . 21 VAL H 1 1 5 2077 1 1 21 VAL HA H 11.167 -1.632 4.926 1.00 . A A . 21 VAL HA 1 1 5 2078 1 1 21 VAL HB H 10.104 -2.409 2.193 1.00 . A A . 21 VAL HB 1 1 5 2079 1 1 21 VAL HG11 H 11.550 -4.029 4.296 1.00 . A A . 21 VAL HG11 1 1 5 2080 1 1 21 VAL HG12 H 11.871 -3.950 2.563 1.00 . A A . 21 VAL HG12 1 1 5 2081 1 1 21 VAL HG13 H 10.434 -4.782 3.155 1.00 . A A . 21 VAL HG13 1 1 5 2082 1 1 21 VAL HG21 H 8.491 -1.849 4.072 1.00 . A A . 21 VAL HG21 1 1 5 2083 1 1 21 VAL HG22 H 9.173 -3.205 4.967 1.00 . A A . 21 VAL HG22 1 1 5 2084 1 1 21 VAL HG23 H 8.341 -3.487 3.438 1.00 . A A . 21 VAL HG23 1 1 5 2085 1 1 21 VAL N N 10.338 -0.243 3.549 1.00 . A A . 21 VAL N 1 1 5 2086 1 1 21 VAL O O 13.427 -2.096 3.746 1.00 . A A . 21 VAL O 1 1 5 2087 1 1 22 PHE C C 15.160 -0.174 2.676 1.00 . A A . 22 PHE C 1 1 5 2088 1 1 22 PHE CA C 14.101 -0.549 1.620 1.00 . A A . 22 PHE CA 1 1 5 2089 1 1 22 PHE CB C 13.981 0.531 0.527 1.00 . A A . 22 PHE CB 1 1 5 2090 1 1 22 PHE CD1 C 13.334 2.520 1.946 1.00 . A A . 22 PHE CD1 1 1 5 2091 1 1 22 PHE CD2 C 15.453 2.569 0.770 1.00 . A A . 22 PHE CD2 1 1 5 2092 1 1 22 PHE CE1 C 13.596 3.792 2.470 1.00 . A A . 22 PHE CE1 1 1 5 2093 1 1 22 PHE CE2 C 15.714 3.841 1.293 1.00 . A A . 22 PHE CE2 1 1 5 2094 1 1 22 PHE CG C 14.262 1.908 1.096 1.00 . A A . 22 PHE CG 1 1 5 2095 1 1 22 PHE CZ C 14.786 4.452 2.144 1.00 . A A . 22 PHE CZ 1 1 5 2096 1 1 22 PHE H H 11.993 -0.123 1.870 1.00 . A A . 22 PHE H 1 1 5 2097 1 1 22 PHE HA H 14.361 -1.489 1.168 1.00 . A A . 22 PHE HA 1 1 5 2098 1 1 22 PHE HB2 H 14.691 0.321 -0.259 1.00 . A A . 22 PHE HB2 1 1 5 2099 1 1 22 PHE HB3 H 12.982 0.513 0.115 1.00 . A A . 22 PHE HB3 1 1 5 2100 1 1 22 PHE HD1 H 12.415 2.013 2.198 1.00 . A A . 22 PHE HD1 1 1 5 2101 1 1 22 PHE HD2 H 16.170 2.097 0.114 1.00 . A A . 22 PHE HD2 1 1 5 2102 1 1 22 PHE HE1 H 12.878 4.264 3.125 1.00 . A A . 22 PHE HE1 1 1 5 2103 1 1 22 PHE HE2 H 16.633 4.350 1.041 1.00 . A A . 22 PHE HE2 1 1 5 2104 1 1 22 PHE HZ H 14.988 5.433 2.548 1.00 . A A . 22 PHE HZ 1 1 5 2105 1 1 22 PHE N N 12.734 -0.647 2.237 1.00 . A A . 22 PHE N 1 1 5 2106 1 1 22 PHE O O 16.327 -0.488 2.532 1.00 . A A . 22 PHE O 1 1 5 2107 1 1 23 PHE C C 15.014 0.927 6.170 1.00 . A A . 23 PHE C 1 1 5 2108 1 1 23 PHE CA C 15.722 0.872 4.806 1.00 . A A . 23 PHE CA 1 1 5 2109 1 1 23 PHE CB C 16.228 2.259 4.401 1.00 . A A . 23 PHE CB 1 1 5 2110 1 1 23 PHE CD1 C 18.376 2.520 5.694 1.00 . A A . 23 PHE CD1 1 1 5 2111 1 1 23 PHE CD2 C 18.492 2.074 3.313 1.00 . A A . 23 PHE CD2 1 1 5 2112 1 1 23 PHE CE1 C 19.774 2.542 5.758 1.00 . A A . 23 PHE CE1 1 1 5 2113 1 1 23 PHE CE2 C 19.890 2.096 3.377 1.00 . A A . 23 PHE CE2 1 1 5 2114 1 1 23 PHE CG C 17.735 2.286 4.471 1.00 . A A . 23 PHE CG 1 1 5 2115 1 1 23 PHE CZ C 20.531 2.330 4.600 1.00 . A A . 23 PHE CZ 1 1 5 2116 1 1 23 PHE H H 13.809 0.718 3.826 1.00 . A A . 23 PHE H 1 1 5 2117 1 1 23 PHE HA H 16.545 0.175 4.839 1.00 . A A . 23 PHE HA 1 1 5 2118 1 1 23 PHE HB2 H 15.910 2.477 3.392 1.00 . A A . 23 PHE HB2 1 1 5 2119 1 1 23 PHE HB3 H 15.824 3.002 5.073 1.00 . A A . 23 PHE HB3 1 1 5 2120 1 1 23 PHE HD1 H 17.791 2.683 6.588 1.00 . A A . 23 PHE HD1 1 1 5 2121 1 1 23 PHE HD2 H 17.998 1.893 2.370 1.00 . A A . 23 PHE HD2 1 1 5 2122 1 1 23 PHE HE1 H 20.268 2.722 6.701 1.00 . A A . 23 PHE HE1 1 1 5 2123 1 1 23 PHE HE2 H 20.474 1.934 2.484 1.00 . A A . 23 PHE HE2 1 1 5 2124 1 1 23 PHE HZ H 21.609 2.347 4.649 1.00 . A A . 23 PHE HZ 1 1 5 2125 1 1 23 PHE N N 14.755 0.483 3.733 1.00 . A A . 23 PHE N 1 1 5 2126 1 1 23 PHE O O 15.383 1.707 7.028 1.00 . A A . 23 PHE O 1 1 5 2127 1 1 24 TYR C C 13.005 1.454 8.263 1.00 . A A . 24 TYR C 1 1 5 2128 1 1 24 TYR CA C 13.219 0.055 7.651 1.00 . A A . 24 TYR CA 1 1 5 2129 1 1 24 TYR CB C 14.016 -0.863 8.598 1.00 . A A . 24 TYR CB 1 1 5 2130 1 1 24 TYR CD1 C 15.563 0.662 9.900 1.00 . A A . 24 TYR CD1 1 1 5 2131 1 1 24 TYR CD2 C 16.507 -0.760 8.177 1.00 . A A . 24 TYR CD2 1 1 5 2132 1 1 24 TYR CE1 C 16.837 1.171 10.179 1.00 . A A . 24 TYR CE1 1 1 5 2133 1 1 24 TYR CE2 C 17.782 -0.250 8.456 1.00 . A A . 24 TYR CE2 1 1 5 2134 1 1 24 TYR CG C 15.395 -0.304 8.898 1.00 . A A . 24 TYR CG 1 1 5 2135 1 1 24 TYR CZ C 17.946 0.715 9.457 1.00 . A A . 24 TYR CZ 1 1 5 2136 1 1 24 TYR H H 13.745 -0.509 5.636 1.00 . A A . 24 TYR H 1 1 5 2137 1 1 24 TYR HA H 12.257 -0.394 7.462 1.00 . A A . 24 TYR HA 1 1 5 2138 1 1 24 TYR HB2 H 13.471 -0.969 9.523 1.00 . A A . 24 TYR HB2 1 1 5 2139 1 1 24 TYR HB3 H 14.119 -1.832 8.136 1.00 . A A . 24 TYR HB3 1 1 5 2140 1 1 24 TYR HD1 H 14.709 1.016 10.458 1.00 . A A . 24 TYR HD1 1 1 5 2141 1 1 24 TYR HD2 H 16.381 -1.504 7.404 1.00 . A A . 24 TYR HD2 1 1 5 2142 1 1 24 TYR HE1 H 16.965 1.914 10.952 1.00 . A A . 24 TYR HE1 1 1 5 2143 1 1 24 TYR HE2 H 18.637 -0.601 7.899 1.00 . A A . 24 TYR HE2 1 1 5 2144 1 1 24 TYR HH H 19.538 0.768 10.513 1.00 . A A . 24 TYR HH 1 1 5 2145 1 1 24 TYR N N 14.000 0.099 6.360 1.00 . A A . 24 TYR N 1 1 5 2146 1 1 24 TYR O O 12.892 1.598 9.467 1.00 . A A . 24 TYR O 1 1 5 2147 1 1 24 TYR OH O 19.203 1.217 9.732 1.00 . A A . 24 TYR OH 1 1 5 2148 1 1 25 LYS C C 13.705 4.198 9.077 1.00 . A A . 25 LYS C 1 1 5 2149 1 1 25 LYS CA C 12.709 3.869 7.945 1.00 . A A . 25 LYS CA 1 1 5 2150 1 1 25 LYS CB C 11.256 3.894 8.444 1.00 . A A . 25 LYS CB 1 1 5 2151 1 1 25 LYS CD C 9.340 2.877 7.196 1.00 . A A . 25 LYS CD 1 1 5 2152 1 1 25 LYS CE C 8.274 3.030 8.286 1.00 . A A . 25 LYS CE 1 1 5 2153 1 1 25 LYS CG C 10.307 4.062 7.254 1.00 . A A . 25 LYS CG 1 1 5 2154 1 1 25 LYS H H 13.004 2.318 6.476 1.00 . A A . 25 LYS H 1 1 5 2155 1 1 25 LYS HA H 12.827 4.575 7.138 1.00 . A A . 25 LYS HA 1 1 5 2156 1 1 25 LYS HB2 H 11.036 2.969 8.957 1.00 . A A . 25 LYS HB2 1 1 5 2157 1 1 25 LYS HB3 H 11.125 4.722 9.125 1.00 . A A . 25 LYS HB3 1 1 5 2158 1 1 25 LYS HD2 H 8.862 2.852 6.227 1.00 . A A . 25 LYS HD2 1 1 5 2159 1 1 25 LYS HD3 H 9.886 1.959 7.353 1.00 . A A . 25 LYS HD3 1 1 5 2160 1 1 25 LYS HE2 H 8.732 3.332 9.218 1.00 . A A . 25 LYS HE2 1 1 5 2161 1 1 25 LYS HE3 H 7.527 3.747 7.983 1.00 . A A . 25 LYS HE3 1 1 5 2162 1 1 25 LYS HG2 H 9.747 4.980 7.368 1.00 . A A . 25 LYS HG2 1 1 5 2163 1 1 25 LYS HG3 H 10.879 4.102 6.339 1.00 . A A . 25 LYS HG3 1 1 5 2164 1 1 25 LYS HZ1 H 7.233 1.395 7.517 1.00 . A A . 25 LYS HZ1 1 1 5 2165 1 1 25 LYS HZ2 H 6.923 1.706 9.158 1.00 . A A . 25 LYS HZ2 1 1 5 2166 1 1 25 LYS HZ3 H 8.391 0.988 8.690 1.00 . A A . 25 LYS HZ3 1 1 5 2167 1 1 25 LYS N N 12.926 2.474 7.439 1.00 . A A . 25 LYS N 1 1 5 2168 1 1 25 LYS NZ N 7.659 1.678 8.423 1.00 . A A . 25 LYS NZ 1 1 5 2169 1 1 25 LYS O O 14.894 4.194 8.806 1.00 . A A . 25 LYS O 1 1 5 2170 1 1 25 LYS OXT O 13.264 4.449 10.190 1.00 . A A . 25 LYS OXT 1 1 6 2171 1 1 1 HIS C C -20.534 0.374 -1.294 1.00 . A A . 1 HIS C 1 1 6 2172 1 1 1 HIS CA C -21.107 0.866 -2.630 1.00 . A A . 1 HIS CA 1 1 6 2173 1 1 1 HIS CB C -22.434 0.163 -2.940 1.00 . A A . 1 HIS CB 1 1 6 2174 1 1 1 HIS CD2 C -23.937 2.180 -3.707 1.00 . A A . 1 HIS CD2 1 1 6 2175 1 1 1 HIS CE1 C -24.182 1.618 -5.785 1.00 . A A . 1 HIS CE1 1 1 6 2176 1 1 1 HIS CG C -23.245 1.008 -3.886 1.00 . A A . 1 HIS CG 1 1 6 2177 1 1 1 HIS HA H -21.255 1.934 -2.603 1.00 . A A . 1 HIS HA 1 1 6 2178 1 1 1 HIS HB2 H -22.237 -0.797 -3.394 1.00 . A A . 1 HIS HB2 1 1 6 2179 1 1 1 HIS HB3 H -22.988 0.020 -2.023 1.00 . A A . 1 HIS HB3 1 1 6 2180 1 1 1 HIS HD1 H -23.046 -0.122 -5.668 1.00 . A A . 1 HIS HD1 1 1 6 2181 1 1 1 HIS HD2 H -24.012 2.722 -2.775 1.00 . A A . 1 HIS HD2 1 1 6 2182 1 1 1 HIS HE1 H -24.482 1.617 -6.822 1.00 . A A . 1 HIS HE1 1 1 6 2183 1 1 1 HIS N N -20.191 0.498 -3.754 1.00 . A A . 1 HIS N 1 1 6 2184 1 1 1 HIS ND1 N -23.416 0.668 -5.218 1.00 . A A . 1 HIS ND1 1 1 6 2185 1 1 1 HIS NE2 N -24.528 2.563 -4.906 1.00 . A A . 1 HIS NE2 1 1 6 2186 1 1 1 HIS O O -20.196 1.162 -0.433 1.00 . A A . 1 HIS O 1 1 6 2187 1 1 2 ALA C C -18.612 -2.302 -0.119 1.00 . A A . 2 ALA C 1 1 6 2188 1 1 2 ALA CA C -19.867 -1.466 0.160 1.00 . A A . 2 ALA CA 1 1 6 2189 1 1 2 ALA CB C -20.984 -2.344 0.731 1.00 . A A . 2 ALA CB 1 1 6 2190 1 1 2 ALA H H -20.699 -1.537 -1.829 1.00 . A A . 2 ALA H 1 1 6 2191 1 1 2 ALA HA H -19.643 -0.665 0.847 1.00 . A A . 2 ALA HA 1 1 6 2192 1 1 2 ALA HB1 H -20.694 -2.705 1.707 1.00 . A A . 2 ALA HB1 1 1 6 2193 1 1 2 ALA HB2 H -21.154 -3.184 0.073 1.00 . A A . 2 ALA HB2 1 1 6 2194 1 1 2 ALA HB3 H -21.891 -1.764 0.817 1.00 . A A . 2 ALA HB3 1 1 6 2195 1 1 2 ALA N N -20.421 -0.920 -1.118 1.00 . A A . 2 ALA N 1 1 6 2196 1 1 2 ALA O O -18.260 -2.541 -1.259 1.00 . A A . 2 ALA O 1 1 6 2197 1 1 3 TRP C C -15.740 -2.919 -0.264 1.00 . A A . 3 TRP C 1 1 6 2198 1 1 3 TRP CA C -16.699 -3.575 0.744 1.00 . A A . 3 TRP CA 1 1 6 2199 1 1 3 TRP CB C -17.191 -4.935 0.231 1.00 . A A . 3 TRP CB 1 1 6 2200 1 1 3 TRP CD1 C -15.029 -6.241 0.093 1.00 . A A . 3 TRP CD1 1 1 6 2201 1 1 3 TRP CD2 C -16.385 -6.984 1.729 1.00 . A A . 3 TRP CD2 1 1 6 2202 1 1 3 TRP CE2 C -15.224 -7.793 1.763 1.00 . A A . 3 TRP CE2 1 1 6 2203 1 1 3 TRP CE3 C -17.404 -7.246 2.662 1.00 . A A . 3 TRP CE3 1 1 6 2204 1 1 3 TRP CG C -16.236 -6.005 0.659 1.00 . A A . 3 TRP CG 1 1 6 2205 1 1 3 TRP CH2 C -16.101 -9.072 3.611 1.00 . A A . 3 TRP CH2 1 1 6 2206 1 1 3 TRP CZ2 C -15.080 -8.825 2.691 1.00 . A A . 3 TRP CZ2 1 1 6 2207 1 1 3 TRP CZ3 C -17.261 -8.285 3.597 1.00 . A A . 3 TRP CZ3 1 1 6 2208 1 1 3 TRP H H -18.252 -2.539 1.826 1.00 . A A . 3 TRP H 1 1 6 2209 1 1 3 TRP HA H -16.203 -3.704 1.694 1.00 . A A . 3 TRP HA 1 1 6 2210 1 1 3 TRP HB2 H -18.169 -5.142 0.639 1.00 . A A . 3 TRP HB2 1 1 6 2211 1 1 3 TRP HB3 H -17.249 -4.915 -0.847 1.00 . A A . 3 TRP HB3 1 1 6 2212 1 1 3 TRP HD1 H -14.605 -5.691 -0.733 1.00 . A A . 3 TRP HD1 1 1 6 2213 1 1 3 TRP HE1 H -13.548 -7.671 0.532 1.00 . A A . 3 TRP HE1 1 1 6 2214 1 1 3 TRP HE3 H -18.300 -6.646 2.660 1.00 . A A . 3 TRP HE3 1 1 6 2215 1 1 3 TRP HH2 H -15.998 -9.869 4.333 1.00 . A A . 3 TRP HH2 1 1 6 2216 1 1 3 TRP HZ2 H -14.184 -9.429 2.698 1.00 . A A . 3 TRP HZ2 1 1 6 2217 1 1 3 TRP HZ3 H -18.050 -8.477 4.310 1.00 . A A . 3 TRP HZ3 1 1 6 2218 1 1 3 TRP N N -17.938 -2.748 0.921 1.00 . A A . 3 TRP N 1 1 6 2219 1 1 3 TRP NE1 N -14.428 -7.300 0.748 1.00 . A A . 3 TRP NE1 1 1 6 2220 1 1 3 TRP O O -15.404 -3.492 -1.285 1.00 . A A . 3 TRP O 1 1 6 2221 1 1 4 TYR C C -13.447 -0.042 -0.149 1.00 . A A . 4 TYR C 1 1 6 2222 1 1 4 TYR CA C -14.365 -1.013 -0.916 1.00 . A A . 4 TYR CA 1 1 6 2223 1 1 4 TYR CB C -15.278 -0.254 -1.895 1.00 . A A . 4 TYR CB 1 1 6 2224 1 1 4 TYR CD1 C -16.822 0.889 -0.251 1.00 . A A . 4 TYR CD1 1 1 6 2225 1 1 4 TYR CD2 C -15.368 2.257 -1.627 1.00 . A A . 4 TYR CD2 1 1 6 2226 1 1 4 TYR CE1 C -17.336 2.043 0.352 1.00 . A A . 4 TYR CE1 1 1 6 2227 1 1 4 TYR CE2 C -15.882 3.411 -1.025 1.00 . A A . 4 TYR CE2 1 1 6 2228 1 1 4 TYR CG C -15.836 0.994 -1.240 1.00 . A A . 4 TYR CG 1 1 6 2229 1 1 4 TYR CZ C -16.866 3.304 -0.036 1.00 . A A . 4 TYR CZ 1 1 6 2230 1 1 4 TYR H H -15.589 -1.277 0.845 1.00 . A A . 4 TYR H 1 1 6 2231 1 1 4 TYR HA H -13.771 -1.732 -1.458 1.00 . A A . 4 TYR HA 1 1 6 2232 1 1 4 TYR HB2 H -14.708 0.027 -2.769 1.00 . A A . 4 TYR HB2 1 1 6 2233 1 1 4 TYR HB3 H -16.094 -0.896 -2.193 1.00 . A A . 4 TYR HB3 1 1 6 2234 1 1 4 TYR HD1 H -17.184 -0.082 0.050 1.00 . A A . 4 TYR HD1 1 1 6 2235 1 1 4 TYR HD2 H -14.606 2.339 -2.389 1.00 . A A . 4 TYR HD2 1 1 6 2236 1 1 4 TYR HE1 H -18.096 1.962 1.115 1.00 . A A . 4 TYR HE1 1 1 6 2237 1 1 4 TYR HE2 H -15.519 4.383 -1.324 1.00 . A A . 4 TYR HE2 1 1 6 2238 1 1 4 TYR HH H -18.252 4.597 0.199 1.00 . A A . 4 TYR HH 1 1 6 2239 1 1 4 TYR N N -15.301 -1.718 0.017 1.00 . A A . 4 TYR N 1 1 6 2240 1 1 4 TYR O O -12.900 0.884 -0.719 1.00 . A A . 4 TYR O 1 1 6 2241 1 1 4 TYR OH O -17.374 4.442 0.557 1.00 . A A . 4 TYR OH 1 1 6 2242 1 1 5 SER C C -11.141 -0.069 2.437 1.00 . A A . 5 SER C 1 1 6 2243 1 1 5 SER CA C -12.392 0.668 1.931 1.00 . A A . 5 SER CA 1 1 6 2244 1 1 5 SER CB C -13.261 1.125 3.105 1.00 . A A . 5 SER CB 1 1 6 2245 1 1 5 SER H H -13.713 -1.000 1.577 1.00 . A A . 5 SER H 1 1 6 2246 1 1 5 SER HA H -12.105 1.519 1.336 1.00 . A A . 5 SER HA 1 1 6 2247 1 1 5 SER HB2 H -13.423 0.299 3.779 1.00 . A A . 5 SER HB2 1 1 6 2248 1 1 5 SER HB3 H -12.757 1.923 3.636 1.00 . A A . 5 SER HB3 1 1 6 2249 1 1 5 SER HG H -15.164 0.887 2.753 1.00 . A A . 5 SER HG 1 1 6 2250 1 1 5 SER N N -13.270 -0.247 1.135 1.00 . A A . 5 SER N 1 1 6 2251 1 1 5 SER O O -10.340 0.490 3.162 1.00 . A A . 5 SER O 1 1 6 2252 1 1 5 SER OG O -14.518 1.584 2.617 1.00 . A A . 5 SER OG 1 1 6 2253 1 1 6 HIS C C -8.757 -2.227 1.374 1.00 . A A . 6 HIS C 1 1 6 2254 1 1 6 HIS CA C -9.765 -2.079 2.518 1.00 . A A . 6 HIS CA 1 1 6 2255 1 1 6 HIS CB C -10.300 -3.448 2.950 1.00 . A A . 6 HIS CB 1 1 6 2256 1 1 6 HIS CD2 C -9.455 -3.966 5.385 1.00 . A A . 6 HIS CD2 1 1 6 2257 1 1 6 HIS CE1 C -7.703 -5.130 4.871 1.00 . A A . 6 HIS CE1 1 1 6 2258 1 1 6 HIS CG C -9.405 -4.023 4.015 1.00 . A A . 6 HIS CG 1 1 6 2259 1 1 6 HIS H H -11.622 -1.744 1.475 1.00 . A A . 6 HIS H 1 1 6 2260 1 1 6 HIS HA H -9.304 -1.584 3.353 1.00 . A A . 6 HIS HA 1 1 6 2261 1 1 6 HIS HB2 H -11.301 -3.337 3.342 1.00 . A A . 6 HIS HB2 1 1 6 2262 1 1 6 HIS HB3 H -10.319 -4.112 2.098 1.00 . A A . 6 HIS HB3 1 1 6 2263 1 1 6 HIS HD1 H -7.959 -4.997 2.810 1.00 . A A . 6 HIS HD1 1 1 6 2264 1 1 6 HIS HD2 H -10.215 -3.455 5.958 1.00 . A A . 6 HIS HD2 1 1 6 2265 1 1 6 HIS HE1 H -6.803 -5.723 4.943 1.00 . A A . 6 HIS HE1 1 1 6 2266 1 1 6 HIS N N -10.966 -1.314 2.060 1.00 . A A . 6 HIS N 1 1 6 2267 1 1 6 HIS ND1 N -8.278 -4.772 3.708 1.00 . A A . 6 HIS ND1 1 1 6 2268 1 1 6 HIS NE2 N -8.380 -4.665 5.924 1.00 . A A . 6 HIS NE2 1 1 6 2269 1 1 6 HIS O O -7.564 -2.302 1.601 1.00 . A A . 6 HIS O 1 1 6 2270 1 1 7 TYR C C -7.358 -1.178 -1.060 1.00 . A A . 7 TYR C 1 1 6 2271 1 1 7 TYR CA C -8.288 -2.389 -1.013 1.00 . A A . 7 TYR CA 1 1 6 2272 1 1 7 TYR CB C -9.177 -2.433 -2.262 1.00 . A A . 7 TYR CB 1 1 6 2273 1 1 7 TYR CD1 C -9.313 -4.926 -2.637 1.00 . A A . 7 TYR CD1 1 1 6 2274 1 1 7 TYR CD2 C -11.324 -3.731 -1.993 1.00 . A A . 7 TYR CD2 1 1 6 2275 1 1 7 TYR CE1 C -10.036 -6.124 -2.673 1.00 . A A . 7 TYR CE1 1 1 6 2276 1 1 7 TYR CE2 C -12.047 -4.930 -2.028 1.00 . A A . 7 TYR CE2 1 1 6 2277 1 1 7 TYR CG C -9.956 -3.729 -2.297 1.00 . A A . 7 TYR CG 1 1 6 2278 1 1 7 TYR CZ C -11.404 -6.126 -2.368 1.00 . A A . 7 TYR CZ 1 1 6 2279 1 1 7 TYR H H -10.188 -2.187 -0.002 1.00 . A A . 7 TYR H 1 1 6 2280 1 1 7 TYR HA H -7.715 -3.294 -0.931 1.00 . A A . 7 TYR HA 1 1 6 2281 1 1 7 TYR HB2 H -9.865 -1.600 -2.242 1.00 . A A . 7 TYR HB2 1 1 6 2282 1 1 7 TYR HB3 H -8.558 -2.364 -3.144 1.00 . A A . 7 TYR HB3 1 1 6 2283 1 1 7 TYR HD1 H -8.258 -4.924 -2.871 1.00 . A A . 7 TYR HD1 1 1 6 2284 1 1 7 TYR HD2 H -11.821 -2.809 -1.731 1.00 . A A . 7 TYR HD2 1 1 6 2285 1 1 7 TYR HE1 H -9.541 -7.046 -2.936 1.00 . A A . 7 TYR HE1 1 1 6 2286 1 1 7 TYR HE2 H -13.100 -4.931 -1.795 1.00 . A A . 7 TYR HE2 1 1 6 2287 1 1 7 TYR HH H -11.812 -7.862 -1.684 1.00 . A A . 7 TYR HH 1 1 6 2288 1 1 7 TYR N N -9.224 -2.258 0.150 1.00 . A A . 7 TYR N 1 1 6 2289 1 1 7 TYR O O -6.164 -1.308 -1.255 1.00 . A A . 7 TYR O 1 1 6 2290 1 1 7 TYR OH O -12.118 -7.306 -2.405 1.00 . A A . 7 TYR OH 1 1 6 2291 1 1 8 VAL C C -6.022 1.149 0.272 1.00 . A A . 8 VAL C 1 1 6 2292 1 1 8 VAL CA C -7.053 1.229 -0.863 1.00 . A A . 8 VAL CA 1 1 6 2293 1 1 8 VAL CB C -8.029 2.402 -0.658 1.00 . A A . 8 VAL CB 1 1 6 2294 1 1 8 VAL CG1 C -8.697 2.309 0.720 1.00 . A A . 8 VAL CG1 1 1 6 2295 1 1 8 VAL CG2 C -7.266 3.726 -0.761 1.00 . A A . 8 VAL CG2 1 1 6 2296 1 1 8 VAL H H -8.861 0.061 -0.690 1.00 . A A . 8 VAL H 1 1 6 2297 1 1 8 VAL HA H -6.553 1.330 -1.809 1.00 . A A . 8 VAL HA 1 1 6 2298 1 1 8 VAL HB H -8.793 2.368 -1.423 1.00 . A A . 8 VAL HB 1 1 6 2299 1 1 8 VAL HG11 H -9.073 1.308 0.872 1.00 . A A . 8 VAL HG11 1 1 6 2300 1 1 8 VAL HG12 H -9.517 3.011 0.770 1.00 . A A . 8 VAL HG12 1 1 6 2301 1 1 8 VAL HG13 H -7.975 2.543 1.487 1.00 . A A . 8 VAL HG13 1 1 6 2302 1 1 8 VAL HG21 H -7.947 4.548 -0.596 1.00 . A A . 8 VAL HG21 1 1 6 2303 1 1 8 VAL HG22 H -6.828 3.813 -1.744 1.00 . A A . 8 VAL HG22 1 1 6 2304 1 1 8 VAL HG23 H -6.484 3.751 -0.016 1.00 . A A . 8 VAL HG23 1 1 6 2305 1 1 8 VAL N N -7.899 -0.004 -0.860 1.00 . A A . 8 VAL N 1 1 6 2306 1 1 8 VAL O O -4.924 1.660 0.163 1.00 . A A . 8 VAL O 1 1 6 2307 1 1 9 LEU C C -4.297 -0.640 2.099 1.00 . A A . 9 LEU C 1 1 6 2308 1 1 9 LEU CA C -5.412 0.339 2.489 1.00 . A A . 9 LEU CA 1 1 6 2309 1 1 9 LEU CB C -6.250 -0.221 3.649 1.00 . A A . 9 LEU CB 1 1 6 2310 1 1 9 LEU CD1 C -4.285 -0.091 5.206 1.00 . A A . 9 LEU CD1 1 1 6 2311 1 1 9 LEU CD2 C -5.836 1.858 4.986 1.00 . A A . 9 LEU CD2 1 1 6 2312 1 1 9 LEU CG C -5.741 0.330 4.987 1.00 . A A . 9 LEU CG 1 1 6 2313 1 1 9 LEU H H -7.252 0.069 1.401 1.00 . A A . 9 LEU H 1 1 6 2314 1 1 9 LEU HA H -4.996 1.297 2.759 1.00 . A A . 9 LEU HA 1 1 6 2315 1 1 9 LEU HB2 H -7.284 0.066 3.514 1.00 . A A . 9 LEU HB2 1 1 6 2316 1 1 9 LEU HB3 H -6.179 -1.299 3.655 1.00 . A A . 9 LEU HB3 1 1 6 2317 1 1 9 LEU HD11 H -4.045 -0.029 6.257 1.00 . A A . 9 LEU HD11 1 1 6 2318 1 1 9 LEU HD12 H -3.633 0.565 4.649 1.00 . A A . 9 LEU HD12 1 1 6 2319 1 1 9 LEU HD13 H -4.148 -1.107 4.866 1.00 . A A . 9 LEU HD13 1 1 6 2320 1 1 9 LEU HD21 H -5.000 2.271 4.440 1.00 . A A . 9 LEU HD21 1 1 6 2321 1 1 9 LEU HD22 H -5.813 2.221 6.004 1.00 . A A . 9 LEU HD22 1 1 6 2322 1 1 9 LEU HD23 H -6.759 2.162 4.517 1.00 . A A . 9 LEU HD23 1 1 6 2323 1 1 9 LEU HG H -6.349 -0.067 5.789 1.00 . A A . 9 LEU HG 1 1 6 2324 1 1 9 LEU N N -6.368 0.485 1.350 1.00 . A A . 9 LEU N 1 1 6 2325 1 1 9 LEU O O -3.133 -0.397 2.354 1.00 . A A . 9 LEU O 1 1 6 2326 1 1 10 LYS C C -2.766 -2.142 -0.097 1.00 . A A . 10 LYS C 1 1 6 2327 1 1 10 LYS CA C -3.608 -2.726 1.043 1.00 . A A . 10 LYS CA 1 1 6 2328 1 1 10 LYS CB C -4.391 -3.953 0.560 1.00 . A A . 10 LYS CB 1 1 6 2329 1 1 10 LYS CD C -4.800 -4.928 2.831 1.00 . A A . 10 LYS CD 1 1 6 2330 1 1 10 LYS CE C -3.784 -5.094 3.966 1.00 . A A . 10 LYS CE 1 1 6 2331 1 1 10 LYS CG C -4.105 -5.142 1.482 1.00 . A A . 10 LYS CG 1 1 6 2332 1 1 10 LYS H H -5.593 -1.902 1.261 1.00 . A A . 10 LYS H 1 1 6 2333 1 1 10 LYS HA H -2.979 -2.992 1.877 1.00 . A A . 10 LYS HA 1 1 6 2334 1 1 10 LYS HB2 H -5.449 -3.735 0.571 1.00 . A A . 10 LYS HB2 1 1 6 2335 1 1 10 LYS HB3 H -4.086 -4.201 -0.446 1.00 . A A . 10 LYS HB3 1 1 6 2336 1 1 10 LYS HD2 H -5.220 -3.932 2.866 1.00 . A A . 10 LYS HD2 1 1 6 2337 1 1 10 LYS HD3 H -5.589 -5.654 2.948 1.00 . A A . 10 LYS HD3 1 1 6 2338 1 1 10 LYS HE2 H -2.849 -4.613 3.705 1.00 . A A . 10 LYS HE2 1 1 6 2339 1 1 10 LYS HE3 H -4.174 -4.682 4.883 1.00 . A A . 10 LYS HE3 1 1 6 2340 1 1 10 LYS HG2 H -4.477 -6.047 1.025 1.00 . A A . 10 LYS HG2 1 1 6 2341 1 1 10 LYS HG3 H -3.039 -5.228 1.637 1.00 . A A . 10 LYS HG3 1 1 6 2342 1 1 10 LYS HZ1 H -3.100 -6.936 3.270 1.00 . A A . 10 LYS HZ1 1 1 6 2343 1 1 10 LYS HZ2 H -4.518 -7.031 4.204 1.00 . A A . 10 LYS HZ2 1 1 6 2344 1 1 10 LYS HZ3 H -3.018 -6.759 4.955 1.00 . A A . 10 LYS HZ3 1 1 6 2345 1 1 10 LYS N N -4.646 -1.736 1.467 1.00 . A A . 10 LYS N 1 1 6 2346 1 1 10 LYS NZ N -3.591 -6.566 4.109 1.00 . A A . 10 LYS NZ 1 1 6 2347 1 1 10 LYS O O -1.556 -2.271 -0.112 1.00 . A A . 10 LYS O 1 1 6 2348 1 1 11 PHE C C -1.629 0.135 -1.683 1.00 . A A . 11 PHE C 1 1 6 2349 1 1 11 PHE CA C -2.650 -0.893 -2.193 1.00 . A A . 11 PHE CA 1 1 6 2350 1 1 11 PHE CB C -3.714 -0.212 -3.058 1.00 . A A . 11 PHE CB 1 1 6 2351 1 1 11 PHE CD1 C -2.881 -0.667 -5.394 1.00 . A A . 11 PHE CD1 1 1 6 2352 1 1 11 PHE CD2 C -2.732 1.591 -4.522 1.00 . A A . 11 PHE CD2 1 1 6 2353 1 1 11 PHE CE1 C -2.304 -0.240 -6.596 1.00 . A A . 11 PHE CE1 1 1 6 2354 1 1 11 PHE CE2 C -2.157 2.018 -5.724 1.00 . A A . 11 PHE CE2 1 1 6 2355 1 1 11 PHE CG C -3.094 0.249 -4.356 1.00 . A A . 11 PHE CG 1 1 6 2356 1 1 11 PHE CZ C -1.943 1.102 -6.762 1.00 . A A . 11 PHE CZ 1 1 6 2357 1 1 11 PHE H H -4.377 -1.406 -1.005 1.00 . A A . 11 PHE H 1 1 6 2358 1 1 11 PHE HA H -2.152 -1.663 -2.761 1.00 . A A . 11 PHE HA 1 1 6 2359 1 1 11 PHE HB2 H -4.510 -0.912 -3.267 1.00 . A A . 11 PHE HB2 1 1 6 2360 1 1 11 PHE HB3 H -4.116 0.641 -2.529 1.00 . A A . 11 PHE HB3 1 1 6 2361 1 1 11 PHE HD1 H -3.160 -1.702 -5.266 1.00 . A A . 11 PHE HD1 1 1 6 2362 1 1 11 PHE HD2 H -2.898 2.298 -3.722 1.00 . A A . 11 PHE HD2 1 1 6 2363 1 1 11 PHE HE1 H -2.139 -0.946 -7.396 1.00 . A A . 11 PHE HE1 1 1 6 2364 1 1 11 PHE HE2 H -1.878 3.053 -5.852 1.00 . A A . 11 PHE HE2 1 1 6 2365 1 1 11 PHE HZ H -1.498 1.431 -7.689 1.00 . A A . 11 PHE HZ 1 1 6 2366 1 1 11 PHE N N -3.401 -1.496 -1.047 1.00 . A A . 11 PHE N 1 1 6 2367 1 1 11 PHE O O -0.506 0.179 -2.149 1.00 . A A . 11 PHE O 1 1 6 2368 1 1 12 PHE C C 0.122 1.274 0.508 1.00 . A A . 12 PHE C 1 1 6 2369 1 1 12 PHE CA C -1.053 1.973 -0.189 1.00 . A A . 12 PHE CA 1 1 6 2370 1 1 12 PHE CB C -1.865 2.797 0.817 1.00 . A A . 12 PHE CB 1 1 6 2371 1 1 12 PHE CD1 C -0.102 4.360 1.723 1.00 . A A . 12 PHE CD1 1 1 6 2372 1 1 12 PHE CD2 C -1.852 5.268 0.311 1.00 . A A . 12 PHE CD2 1 1 6 2373 1 1 12 PHE CE1 C 0.459 5.636 1.850 1.00 . A A . 12 PHE CE1 1 1 6 2374 1 1 12 PHE CE2 C -1.292 6.544 0.438 1.00 . A A . 12 PHE CE2 1 1 6 2375 1 1 12 PHE CG C -1.258 4.175 0.953 1.00 . A A . 12 PHE CG 1 1 6 2376 1 1 12 PHE CZ C -0.136 6.728 1.206 1.00 . A A . 12 PHE CZ 1 1 6 2377 1 1 12 PHE H H -2.917 0.897 -0.368 1.00 . A A . 12 PHE H 1 1 6 2378 1 1 12 PHE HA H -0.694 2.610 -0.982 1.00 . A A . 12 PHE HA 1 1 6 2379 1 1 12 PHE HB2 H -2.883 2.886 0.471 1.00 . A A . 12 PHE HB2 1 1 6 2380 1 1 12 PHE HB3 H -1.853 2.304 1.777 1.00 . A A . 12 PHE HB3 1 1 6 2381 1 1 12 PHE HD1 H 0.357 3.517 2.219 1.00 . A A . 12 PHE HD1 1 1 6 2382 1 1 12 PHE HD2 H -2.744 5.126 -0.283 1.00 . A A . 12 PHE HD2 1 1 6 2383 1 1 12 PHE HE1 H 1.350 5.778 2.442 1.00 . A A . 12 PHE HE1 1 1 6 2384 1 1 12 PHE HE2 H -1.750 7.387 -0.058 1.00 . A A . 12 PHE HE2 1 1 6 2385 1 1 12 PHE HZ H 0.297 7.713 1.305 1.00 . A A . 12 PHE HZ 1 1 6 2386 1 1 12 PHE N N -2.008 0.954 -0.730 1.00 . A A . 12 PHE N 1 1 6 2387 1 1 12 PHE O O 1.269 1.619 0.300 1.00 . A A . 12 PHE O 1 1 6 2388 1 1 13 LEU C C 1.782 -1.239 1.021 1.00 . A A . 13 LEU C 1 1 6 2389 1 1 13 LEU CA C 0.936 -0.448 2.030 1.00 . A A . 13 LEU CA 1 1 6 2390 1 1 13 LEU CB C 0.226 -1.399 3.000 1.00 . A A . 13 LEU CB 1 1 6 2391 1 1 13 LEU CD1 C 0.389 -1.760 5.472 1.00 . A A . 13 LEU CD1 1 1 6 2392 1 1 13 LEU CD2 C 1.773 -3.138 3.913 1.00 . A A . 13 LEU CD2 1 1 6 2393 1 1 13 LEU CG C 1.169 -1.752 4.155 1.00 . A A . 13 LEU CG 1 1 6 2394 1 1 13 LEU H H -1.095 0.023 1.468 1.00 . A A . 13 LEU H 1 1 6 2395 1 1 13 LEU HA H 1.556 0.242 2.580 1.00 . A A . 13 LEU HA 1 1 6 2396 1 1 13 LEU HB2 H -0.660 -0.918 3.391 1.00 . A A . 13 LEU HB2 1 1 6 2397 1 1 13 LEU HB3 H -0.056 -2.302 2.478 1.00 . A A . 13 LEU HB3 1 1 6 2398 1 1 13 LEU HD11 H 1.082 -1.759 6.300 1.00 . A A . 13 LEU HD11 1 1 6 2399 1 1 13 LEU HD12 H -0.229 -2.643 5.520 1.00 . A A . 13 LEU HD12 1 1 6 2400 1 1 13 LEU HD13 H -0.236 -0.880 5.526 1.00 . A A . 13 LEU HD13 1 1 6 2401 1 1 13 LEU HD21 H 2.132 -3.203 2.896 1.00 . A A . 13 LEU HD21 1 1 6 2402 1 1 13 LEU HD22 H 1.020 -3.894 4.078 1.00 . A A . 13 LEU HD22 1 1 6 2403 1 1 13 LEU HD23 H 2.596 -3.294 4.595 1.00 . A A . 13 LEU HD23 1 1 6 2404 1 1 13 LEU HG H 1.959 -1.017 4.210 1.00 . A A . 13 LEU HG 1 1 6 2405 1 1 13 LEU N N -0.161 0.286 1.325 1.00 . A A . 13 LEU N 1 1 6 2406 1 1 13 LEU O O 2.965 -1.446 1.223 1.00 . A A . 13 LEU O 1 1 6 2407 1 1 14 LEU C C 2.879 -1.517 -1.891 1.00 . A A . 14 LEU C 1 1 6 2408 1 1 14 LEU CA C 1.955 -2.447 -1.093 1.00 . A A . 14 LEU CA 1 1 6 2409 1 1 14 LEU CB C 0.894 -3.065 -2.012 1.00 . A A . 14 LEU CB 1 1 6 2410 1 1 14 LEU CD1 C 0.197 -5.447 -1.704 1.00 . A A . 14 LEU CD1 1 1 6 2411 1 1 14 LEU CD2 C 1.302 -4.733 -3.829 1.00 . A A . 14 LEU CD2 1 1 6 2412 1 1 14 LEU CG C 1.254 -4.522 -2.314 1.00 . A A . 14 LEU CG 1 1 6 2413 1 1 14 LEU H H 0.234 -1.492 -0.206 1.00 . A A . 14 LEU H 1 1 6 2414 1 1 14 LEU HA H 2.530 -3.221 -0.621 1.00 . A A . 14 LEU HA 1 1 6 2415 1 1 14 LEU HB2 H -0.070 -3.026 -1.527 1.00 . A A . 14 LEU HB2 1 1 6 2416 1 1 14 LEU HB3 H 0.852 -2.508 -2.937 1.00 . A A . 14 LEU HB3 1 1 6 2417 1 1 14 LEU HD11 H -0.772 -4.974 -1.762 1.00 . A A . 14 LEU HD11 1 1 6 2418 1 1 14 LEU HD12 H 0.441 -5.642 -0.670 1.00 . A A . 14 LEU HD12 1 1 6 2419 1 1 14 LEU HD13 H 0.175 -6.379 -2.251 1.00 . A A . 14 LEU HD13 1 1 6 2420 1 1 14 LEU HD21 H 2.078 -4.116 -4.254 1.00 . A A . 14 LEU HD21 1 1 6 2421 1 1 14 LEU HD22 H 0.349 -4.462 -4.261 1.00 . A A . 14 LEU HD22 1 1 6 2422 1 1 14 LEU HD23 H 1.510 -5.771 -4.042 1.00 . A A . 14 LEU HD23 1 1 6 2423 1 1 14 LEU HG H 2.221 -4.750 -1.885 1.00 . A A . 14 LEU HG 1 1 6 2424 1 1 14 LEU N N 1.187 -1.676 -0.065 1.00 . A A . 14 LEU N 1 1 6 2425 1 1 14 LEU O O 3.844 -1.955 -2.484 1.00 . A A . 14 LEU O 1 1 6 2426 1 1 15 VAL C C 4.341 1.496 -1.681 1.00 . A A . 15 VAL C 1 1 6 2427 1 1 15 VAL CA C 3.456 0.719 -2.663 1.00 . A A . 15 VAL CA 1 1 6 2428 1 1 15 VAL CB C 2.482 1.658 -3.392 1.00 . A A . 15 VAL CB 1 1 6 2429 1 1 15 VAL CG1 C 3.258 2.811 -4.039 1.00 . A A . 15 VAL CG1 1 1 6 2430 1 1 15 VAL CG2 C 1.738 0.879 -4.481 1.00 . A A . 15 VAL CG2 1 1 6 2431 1 1 15 VAL H H 1.809 0.089 -1.423 1.00 . A A . 15 VAL H 1 1 6 2432 1 1 15 VAL HA H 4.066 0.191 -3.380 1.00 . A A . 15 VAL HA 1 1 6 2433 1 1 15 VAL HB H 1.771 2.058 -2.683 1.00 . A A . 15 VAL HB 1 1 6 2434 1 1 15 VAL HG11 H 4.245 2.470 -4.318 1.00 . A A . 15 VAL HG11 1 1 6 2435 1 1 15 VAL HG12 H 3.346 3.626 -3.335 1.00 . A A . 15 VAL HG12 1 1 6 2436 1 1 15 VAL HG13 H 2.733 3.150 -4.919 1.00 . A A . 15 VAL HG13 1 1 6 2437 1 1 15 VAL HG21 H 2.284 0.947 -5.412 1.00 . A A . 15 VAL HG21 1 1 6 2438 1 1 15 VAL HG22 H 0.751 1.298 -4.613 1.00 . A A . 15 VAL HG22 1 1 6 2439 1 1 15 VAL HG23 H 1.652 -0.158 -4.190 1.00 . A A . 15 VAL HG23 1 1 6 2440 1 1 15 VAL N N 2.592 -0.240 -1.909 1.00 . A A . 15 VAL N 1 1 6 2441 1 1 15 VAL O O 5.554 1.453 -1.759 1.00 . A A . 15 VAL O 1 1 6 2442 1 1 16 PHE C C 5.276 2.011 1.195 1.00 . A A . 16 PHE C 1 1 6 2443 1 1 16 PHE CA C 4.540 2.970 0.252 1.00 . A A . 16 PHE CA 1 1 6 2444 1 1 16 PHE CB C 3.524 3.814 1.027 1.00 . A A . 16 PHE CB 1 1 6 2445 1 1 16 PHE CD1 C 4.649 6.051 1.315 1.00 . A A . 16 PHE CD1 1 1 6 2446 1 1 16 PHE CD2 C 2.888 5.837 -0.338 1.00 . A A . 16 PHE CD2 1 1 6 2447 1 1 16 PHE CE1 C 4.804 7.401 0.974 1.00 . A A . 16 PHE CE1 1 1 6 2448 1 1 16 PHE CE2 C 3.042 7.186 -0.677 1.00 . A A . 16 PHE CE2 1 1 6 2449 1 1 16 PHE CG C 3.691 5.270 0.659 1.00 . A A . 16 PHE CG 1 1 6 2450 1 1 16 PHE CZ C 4.000 7.968 -0.021 1.00 . A A . 16 PHE CZ 1 1 6 2451 1 1 16 PHE H H 2.759 2.204 -0.701 1.00 . A A . 16 PHE H 1 1 6 2452 1 1 16 PHE HA H 5.245 3.613 -0.253 1.00 . A A . 16 PHE HA 1 1 6 2453 1 1 16 PHE HB2 H 2.523 3.493 0.779 1.00 . A A . 16 PHE HB2 1 1 6 2454 1 1 16 PHE HB3 H 3.688 3.690 2.087 1.00 . A A . 16 PHE HB3 1 1 6 2455 1 1 16 PHE HD1 H 5.270 5.615 2.084 1.00 . A A . 16 PHE HD1 1 1 6 2456 1 1 16 PHE HD2 H 2.148 5.235 -0.843 1.00 . A A . 16 PHE HD2 1 1 6 2457 1 1 16 PHE HE1 H 5.543 8.004 1.480 1.00 . A A . 16 PHE HE1 1 1 6 2458 1 1 16 PHE HE2 H 2.422 7.623 -1.446 1.00 . A A . 16 PHE HE2 1 1 6 2459 1 1 16 PHE HZ H 4.120 9.009 -0.284 1.00 . A A . 16 PHE HZ 1 1 6 2460 1 1 16 PHE N N 3.739 2.195 -0.748 1.00 . A A . 16 PHE N 1 1 6 2461 1 1 16 PHE O O 6.390 2.274 1.606 1.00 . A A . 16 PHE O 1 1 6 2462 1 1 17 GLY C C 6.579 -0.642 1.725 1.00 . A A . 17 GLY C 1 1 6 2463 1 1 17 GLY CA C 5.343 -0.086 2.431 1.00 . A A . 17 GLY CA 1 1 6 2464 1 1 17 GLY H H 3.775 0.696 1.176 1.00 . A A . 17 GLY H 1 1 6 2465 1 1 17 GLY HA2 H 5.640 0.409 3.346 1.00 . A A . 17 GLY HA2 1 1 6 2466 1 1 17 GLY HA3 H 4.669 -0.896 2.659 1.00 . A A . 17 GLY HA3 1 1 6 2467 1 1 17 GLY N N 4.669 0.894 1.529 1.00 . A A . 17 GLY N 1 1 6 2468 1 1 17 GLY O O 7.645 -0.726 2.304 1.00 . A A . 17 GLY O 1 1 6 2469 1 1 18 GLU C C 8.733 -0.481 -0.336 1.00 . A A . 18 GLU C 1 1 6 2470 1 1 18 GLU CA C 7.625 -1.539 -0.286 1.00 . A A . 18 GLU CA 1 1 6 2471 1 1 18 GLU CB C 7.103 -1.853 -1.694 1.00 . A A . 18 GLU CB 1 1 6 2472 1 1 18 GLU CD C 6.106 -3.920 -2.710 1.00 . A A . 18 GLU CD 1 1 6 2473 1 1 18 GLU CG C 7.340 -3.334 -2.014 1.00 . A A . 18 GLU CG 1 1 6 2474 1 1 18 GLU H H 5.579 -0.915 0.023 1.00 . A A . 18 GLU H 1 1 6 2475 1 1 18 GLU HA H 7.990 -2.435 0.182 1.00 . A A . 18 GLU HA 1 1 6 2476 1 1 18 GLU HB2 H 6.046 -1.637 -1.745 1.00 . A A . 18 GLU HB2 1 1 6 2477 1 1 18 GLU HB3 H 7.628 -1.244 -2.416 1.00 . A A . 18 GLU HB3 1 1 6 2478 1 1 18 GLU HG2 H 8.198 -3.428 -2.663 1.00 . A A . 18 GLU HG2 1 1 6 2479 1 1 18 GLU HG3 H 7.523 -3.875 -1.097 1.00 . A A . 18 GLU HG3 1 1 6 2480 1 1 18 GLU N N 6.448 -1.005 0.470 1.00 . A A . 18 GLU N 1 1 6 2481 1 1 18 GLU O O 9.903 -0.793 -0.235 1.00 . A A . 18 GLU O 1 1 6 2482 1 1 18 GLU OE1 O 6.028 -3.816 -3.924 1.00 . A A . 18 GLU OE1 1 1 6 2483 1 1 18 GLU OE2 O 5.261 -4.467 -2.017 1.00 . A A . 18 GLU OE2 1 1 6 2484 1 1 19 ASN C C 10.215 1.861 0.792 1.00 . A A . 19 ASN C 1 1 6 2485 1 1 19 ASN CA C 9.397 1.861 -0.503 1.00 . A A . 19 ASN CA 1 1 6 2486 1 1 19 ASN CB C 8.606 3.165 -0.638 1.00 . A A . 19 ASN CB 1 1 6 2487 1 1 19 ASN CG C 8.509 3.555 -2.113 1.00 . A A . 19 ASN CG 1 1 6 2488 1 1 19 ASN H H 7.417 0.993 -0.530 1.00 . A A . 19 ASN H 1 1 6 2489 1 1 19 ASN HA H 10.044 1.734 -1.352 1.00 . A A . 19 ASN HA 1 1 6 2490 1 1 19 ASN HB2 H 7.614 3.030 -0.233 1.00 . A A . 19 ASN HB2 1 1 6 2491 1 1 19 ASN HB3 H 9.111 3.950 -0.094 1.00 . A A . 19 ASN HB3 1 1 6 2492 1 1 19 ASN HD21 H 6.738 2.691 -2.372 1.00 . A A . 19 ASN HD21 1 1 6 2493 1 1 19 ASN HD22 H 7.387 3.445 -3.746 1.00 . A A . 19 ASN HD22 1 1 6 2494 1 1 19 ASN N N 8.369 0.771 -0.468 1.00 . A A . 19 ASN N 1 1 6 2495 1 1 19 ASN ND2 N 7.458 3.202 -2.801 1.00 . A A . 19 ASN ND2 1 1 6 2496 1 1 19 ASN O O 11.373 2.227 0.803 1.00 . A A . 19 ASN O 1 1 6 2497 1 1 19 ASN OD1 O 9.399 4.185 -2.647 1.00 . A A . 19 ASN OD1 1 1 6 2498 1 1 20 GLY C C 10.987 0.024 3.362 1.00 . A A . 20 GLY C 1 1 6 2499 1 1 20 GLY CA C 10.353 1.407 3.178 1.00 . A A . 20 GLY CA 1 1 6 2500 1 1 20 GLY H H 8.687 1.153 1.841 1.00 . A A . 20 GLY H 1 1 6 2501 1 1 20 GLY HA2 H 11.127 2.162 3.179 1.00 . A A . 20 GLY HA2 1 1 6 2502 1 1 20 GLY HA3 H 9.665 1.594 3.988 1.00 . A A . 20 GLY HA3 1 1 6 2503 1 1 20 GLY N N 9.619 1.447 1.881 1.00 . A A . 20 GLY N 1 1 6 2504 1 1 20 GLY O O 12.104 -0.096 3.825 1.00 . A A . 20 GLY O 1 1 6 2505 1 1 21 VAL C C 12.041 -2.610 2.219 1.00 . A A . 21 VAL C 1 1 6 2506 1 1 21 VAL CA C 10.837 -2.406 3.151 1.00 . A A . 21 VAL CA 1 1 6 2507 1 1 21 VAL CB C 9.688 -3.352 2.772 1.00 . A A . 21 VAL CB 1 1 6 2508 1 1 21 VAL CG1 C 10.209 -4.788 2.664 1.00 . A A . 21 VAL CG1 1 1 6 2509 1 1 21 VAL CG2 C 8.601 -3.291 3.850 1.00 . A A . 21 VAL CG2 1 1 6 2510 1 1 21 VAL H H 9.377 -0.898 2.627 1.00 . A A . 21 VAL H 1 1 6 2511 1 1 21 VAL HA H 11.130 -2.577 4.171 1.00 . A A . 21 VAL HA 1 1 6 2512 1 1 21 VAL HB H 9.272 -3.048 1.822 1.00 . A A . 21 VAL HB 1 1 6 2513 1 1 21 VAL HG11 H 10.832 -5.011 3.518 1.00 . A A . 21 VAL HG11 1 1 6 2514 1 1 21 VAL HG12 H 10.788 -4.893 1.759 1.00 . A A . 21 VAL HG12 1 1 6 2515 1 1 21 VAL HG13 H 9.374 -5.472 2.639 1.00 . A A . 21 VAL HG13 1 1 6 2516 1 1 21 VAL HG21 H 8.977 -3.722 4.766 1.00 . A A . 21 VAL HG21 1 1 6 2517 1 1 21 VAL HG22 H 7.736 -3.847 3.519 1.00 . A A . 21 VAL HG22 1 1 6 2518 1 1 21 VAL HG23 H 8.322 -2.262 4.024 1.00 . A A . 21 VAL HG23 1 1 6 2519 1 1 21 VAL N N 10.279 -1.022 3.000 1.00 . A A . 21 VAL N 1 1 6 2520 1 1 21 VAL O O 13.019 -3.229 2.590 1.00 . A A . 21 VAL O 1 1 6 2521 1 1 22 PHE C C 14.246 -1.263 0.367 1.00 . A A . 22 PHE C 1 1 6 2522 1 1 22 PHE CA C 13.117 -2.258 0.062 1.00 . A A . 22 PHE CA 1 1 6 2523 1 1 22 PHE CB C 12.527 -1.993 -1.327 1.00 . A A . 22 PHE CB 1 1 6 2524 1 1 22 PHE CD1 C 10.711 -3.747 -1.360 1.00 . A A . 22 PHE CD1 1 1 6 2525 1 1 22 PHE CD2 C 12.576 -3.968 -2.893 1.00 . A A . 22 PHE CD2 1 1 6 2526 1 1 22 PHE CE1 C 10.155 -4.926 -1.866 1.00 . A A . 22 PHE CE1 1 1 6 2527 1 1 22 PHE CE2 C 12.019 -5.149 -3.398 1.00 . A A . 22 PHE CE2 1 1 6 2528 1 1 22 PHE CG C 11.922 -3.266 -1.873 1.00 . A A . 22 PHE CG 1 1 6 2529 1 1 22 PHE CZ C 10.809 -5.627 -2.885 1.00 . A A . 22 PHE CZ 1 1 6 2530 1 1 22 PHE H H 11.174 -1.598 0.749 1.00 . A A . 22 PHE H 1 1 6 2531 1 1 22 PHE HA H 13.493 -3.266 0.110 1.00 . A A . 22 PHE HA 1 1 6 2532 1 1 22 PHE HB2 H 11.764 -1.232 -1.257 1.00 . A A . 22 PHE HB2 1 1 6 2533 1 1 22 PHE HB3 H 13.309 -1.654 -1.990 1.00 . A A . 22 PHE HB3 1 1 6 2534 1 1 22 PHE HD1 H 10.206 -3.205 -0.573 1.00 . A A . 22 PHE HD1 1 1 6 2535 1 1 22 PHE HD2 H 13.511 -3.600 -3.290 1.00 . A A . 22 PHE HD2 1 1 6 2536 1 1 22 PHE HE1 H 9.221 -5.296 -1.469 1.00 . A A . 22 PHE HE1 1 1 6 2537 1 1 22 PHE HE2 H 12.524 -5.690 -4.185 1.00 . A A . 22 PHE HE2 1 1 6 2538 1 1 22 PHE HZ H 10.379 -6.538 -3.275 1.00 . A A . 22 PHE HZ 1 1 6 2539 1 1 22 PHE N N 11.974 -2.094 1.019 1.00 . A A . 22 PHE N 1 1 6 2540 1 1 22 PHE O O 15.292 -1.301 -0.252 1.00 . A A . 22 PHE O 1 1 6 2541 1 1 23 PHE C C 15.582 0.398 3.112 1.00 . A A . 23 PHE C 1 1 6 2542 1 1 23 PHE CA C 15.121 0.606 1.661 1.00 . A A . 23 PHE CA 1 1 6 2543 1 1 23 PHE CB C 14.466 1.979 1.488 1.00 . A A . 23 PHE CB 1 1 6 2544 1 1 23 PHE CD1 C 13.713 1.922 -0.921 1.00 . A A . 23 PHE CD1 1 1 6 2545 1 1 23 PHE CD2 C 15.593 3.330 -0.319 1.00 . A A . 23 PHE CD2 1 1 6 2546 1 1 23 PHE CE1 C 13.832 2.333 -2.254 1.00 . A A . 23 PHE CE1 1 1 6 2547 1 1 23 PHE CE2 C 15.712 3.741 -1.652 1.00 . A A . 23 PHE CE2 1 1 6 2548 1 1 23 PHE CG C 14.593 2.421 0.048 1.00 . A A . 23 PHE CG 1 1 6 2549 1 1 23 PHE CZ C 14.831 3.241 -2.619 1.00 . A A . 23 PHE CZ 1 1 6 2550 1 1 23 PHE H H 13.206 -0.368 1.808 1.00 . A A . 23 PHE H 1 1 6 2551 1 1 23 PHE HA H 15.956 0.508 0.986 1.00 . A A . 23 PHE HA 1 1 6 2552 1 1 23 PHE HB2 H 13.421 1.917 1.754 1.00 . A A . 23 PHE HB2 1 1 6 2553 1 1 23 PHE HB3 H 14.958 2.696 2.129 1.00 . A A . 23 PHE HB3 1 1 6 2554 1 1 23 PHE HD1 H 12.941 1.221 -0.639 1.00 . A A . 23 PHE HD1 1 1 6 2555 1 1 23 PHE HD2 H 16.273 3.716 0.427 1.00 . A A . 23 PHE HD2 1 1 6 2556 1 1 23 PHE HE1 H 13.153 1.947 -3.000 1.00 . A A . 23 PHE HE1 1 1 6 2557 1 1 23 PHE HE2 H 16.483 4.441 -1.934 1.00 . A A . 23 PHE HE2 1 1 6 2558 1 1 23 PHE HZ H 14.923 3.557 -3.648 1.00 . A A . 23 PHE HZ 1 1 6 2559 1 1 23 PHE N N 14.052 -0.379 1.316 1.00 . A A . 23 PHE N 1 1 6 2560 1 1 23 PHE O O 15.975 1.332 3.787 1.00 . A A . 23 PHE O 1 1 6 2561 1 1 24 TYR C C 16.647 -2.482 5.071 1.00 . A A . 24 TYR C 1 1 6 2562 1 1 24 TYR CA C 15.971 -1.106 4.996 1.00 . A A . 24 TYR CA 1 1 6 2563 1 1 24 TYR CB C 14.679 -1.086 5.819 1.00 . A A . 24 TYR CB 1 1 6 2564 1 1 24 TYR CD1 C 15.550 -0.082 7.960 1.00 . A A . 24 TYR CD1 1 1 6 2565 1 1 24 TYR CD2 C 13.972 1.194 6.632 1.00 . A A . 24 TYR CD2 1 1 6 2566 1 1 24 TYR CE1 C 15.601 0.958 8.897 1.00 . A A . 24 TYR CE1 1 1 6 2567 1 1 24 TYR CE2 C 14.024 2.233 7.568 1.00 . A A . 24 TYR CE2 1 1 6 2568 1 1 24 TYR CG C 14.735 0.037 6.828 1.00 . A A . 24 TYR CG 1 1 6 2569 1 1 24 TYR CZ C 14.839 2.115 8.701 1.00 . A A . 24 TYR CZ 1 1 6 2570 1 1 24 TYR H H 15.218 -1.558 3.027 1.00 . A A . 24 TYR H 1 1 6 2571 1 1 24 TYR HA H 16.643 -0.338 5.344 1.00 . A A . 24 TYR HA 1 1 6 2572 1 1 24 TYR HB2 H 13.839 -0.935 5.159 1.00 . A A . 24 TYR HB2 1 1 6 2573 1 1 24 TYR HB3 H 14.565 -2.026 6.335 1.00 . A A . 24 TYR HB3 1 1 6 2574 1 1 24 TYR HD1 H 16.139 -0.974 8.112 1.00 . A A . 24 TYR HD1 1 1 6 2575 1 1 24 TYR HD2 H 13.344 1.285 5.758 1.00 . A A . 24 TYR HD2 1 1 6 2576 1 1 24 TYR HE1 H 16.231 0.867 9.771 1.00 . A A . 24 TYR HE1 1 1 6 2577 1 1 24 TYR HE2 H 13.436 3.126 7.417 1.00 . A A . 24 TYR HE2 1 1 6 2578 1 1 24 TYR HH H 15.536 3.781 9.320 1.00 . A A . 24 TYR HH 1 1 6 2579 1 1 24 TYR N N 15.537 -0.823 3.593 1.00 . A A . 24 TYR N 1 1 6 2580 1 1 24 TYR O O 16.183 -3.382 5.748 1.00 . A A . 24 TYR O 1 1 6 2581 1 1 24 TYR OH O 14.889 3.139 9.625 1.00 . A A . 24 TYR OH 1 1 6 2582 1 1 25 LYS C C 19.932 -3.765 4.787 1.00 . A A . 25 LYS C 1 1 6 2583 1 1 25 LYS CA C 18.460 -3.962 4.398 1.00 . A A . 25 LYS CA 1 1 6 2584 1 1 25 LYS CB C 18.343 -4.503 2.968 1.00 . A A . 25 LYS CB 1 1 6 2585 1 1 25 LYS CD C 18.186 -6.902 3.682 1.00 . A A . 25 LYS CD 1 1 6 2586 1 1 25 LYS CE C 19.135 -7.848 4.428 1.00 . A A . 25 LYS CE 1 1 6 2587 1 1 25 LYS CG C 19.002 -5.884 2.878 1.00 . A A . 25 LYS CG 1 1 6 2588 1 1 25 LYS H H 18.095 -1.910 3.840 1.00 . A A . 25 LYS H 1 1 6 2589 1 1 25 LYS HA H 17.979 -4.639 5.085 1.00 . A A . 25 LYS HA 1 1 6 2590 1 1 25 LYS HB2 H 17.299 -4.583 2.700 1.00 . A A . 25 LYS HB2 1 1 6 2591 1 1 25 LYS HB3 H 18.837 -3.826 2.287 1.00 . A A . 25 LYS HB3 1 1 6 2592 1 1 25 LYS HD2 H 17.559 -6.383 4.393 1.00 . A A . 25 LYS HD2 1 1 6 2593 1 1 25 LYS HD3 H 17.566 -7.476 3.010 1.00 . A A . 25 LYS HD3 1 1 6 2594 1 1 25 LYS HE2 H 18.660 -8.807 4.582 1.00 . A A . 25 LYS HE2 1 1 6 2595 1 1 25 LYS HE3 H 20.055 -7.968 3.878 1.00 . A A . 25 LYS HE3 1 1 6 2596 1 1 25 LYS HG2 H 19.044 -6.194 1.843 1.00 . A A . 25 LYS HG2 1 1 6 2597 1 1 25 LYS HG3 H 20.003 -5.831 3.278 1.00 . A A . 25 LYS HG3 1 1 6 2598 1 1 25 LYS HZ1 H 19.842 -6.252 5.575 1.00 . A A . 25 LYS HZ1 1 1 6 2599 1 1 25 LYS HZ2 H 20.052 -7.777 6.298 1.00 . A A . 25 LYS HZ2 1 1 6 2600 1 1 25 LYS HZ3 H 18.513 -7.060 6.256 1.00 . A A . 25 LYS HZ3 1 1 6 2601 1 1 25 LYS N N 17.744 -2.649 4.376 1.00 . A A . 25 LYS N 1 1 6 2602 1 1 25 LYS NZ N 19.405 -7.185 5.738 1.00 . A A . 25 LYS NZ 1 1 6 2603 1 1 25 LYS O O 20.400 -4.504 5.637 1.00 . A A . 25 LYS O 1 1 6 2604 1 1 25 LYS OXT O 20.564 -2.883 4.227 1.00 . A A . 25 LYS OXT 1 1 7 2605 1 1 1 HIS C C -22.491 -2.853 1.337 1.00 . A A . 1 HIS C 1 1 7 2606 1 1 1 HIS CA C -23.411 -2.635 2.549 1.00 . A A . 1 HIS CA 1 1 7 2607 1 1 1 HIS CB C -23.640 -1.139 2.800 1.00 . A A . 1 HIS CB 1 1 7 2608 1 1 1 HIS CD2 C -24.198 0.089 0.545 1.00 . A A . 1 HIS CD2 1 1 7 2609 1 1 1 HIS CE1 C -26.358 -0.057 0.631 1.00 . A A . 1 HIS CE1 1 1 7 2610 1 1 1 HIS CG C -24.506 -0.570 1.708 1.00 . A A . 1 HIS CG 1 1 7 2611 1 1 1 HIS HA H -24.357 -3.128 2.392 1.00 . A A . 1 HIS HA 1 1 7 2612 1 1 1 HIS HB2 H -24.130 -1.006 3.753 1.00 . A A . 1 HIS HB2 1 1 7 2613 1 1 1 HIS HB3 H -22.690 -0.625 2.810 1.00 . A A . 1 HIS HB3 1 1 7 2614 1 1 1 HIS HD1 H -26.428 -1.066 2.450 1.00 . A A . 1 HIS HD1 1 1 7 2615 1 1 1 HIS HD2 H -23.199 0.322 0.206 1.00 . A A . 1 HIS HD2 1 1 7 2616 1 1 1 HIS HE1 H -27.407 0.031 0.388 1.00 . A A . 1 HIS HE1 1 1 7 2617 1 1 1 HIS N N -22.760 -3.146 3.793 1.00 . A A . 1 HIS N 1 1 7 2618 1 1 1 HIS ND1 N -25.889 -0.652 1.744 1.00 . A A . 1 HIS ND1 1 1 7 2619 1 1 1 HIS NE2 N -25.370 0.413 -0.134 1.00 . A A . 1 HIS NE2 1 1 7 2620 1 1 1 HIS O O -22.835 -3.565 0.413 1.00 . A A . 1 HIS O 1 1 7 2621 1 1 2 ALA C C -18.951 -2.589 0.683 1.00 . A A . 2 ALA C 1 1 7 2622 1 1 2 ALA CA C -20.390 -2.418 0.181 1.00 . A A . 2 ALA CA 1 1 7 2623 1 1 2 ALA CB C -20.524 -1.131 -0.636 1.00 . A A . 2 ALA CB 1 1 7 2624 1 1 2 ALA H H -21.071 -1.675 2.089 1.00 . A A . 2 ALA H 1 1 7 2625 1 1 2 ALA HA H -20.682 -3.266 -0.419 1.00 . A A . 2 ALA HA 1 1 7 2626 1 1 2 ALA HB1 H -21.549 -1.011 -0.953 1.00 . A A . 2 ALA HB1 1 1 7 2627 1 1 2 ALA HB2 H -19.882 -1.187 -1.503 1.00 . A A . 2 ALA HB2 1 1 7 2628 1 1 2 ALA HB3 H -20.234 -0.287 -0.027 1.00 . A A . 2 ALA HB3 1 1 7 2629 1 1 2 ALA N N -21.328 -2.245 1.333 1.00 . A A . 2 ALA N 1 1 7 2630 1 1 2 ALA O O -18.603 -2.142 1.762 1.00 . A A . 2 ALA O 1 1 7 2631 1 1 3 TRP C C -15.739 -2.810 -0.693 1.00 . A A . 3 TRP C 1 1 7 2632 1 1 3 TRP CA C -16.694 -3.431 0.334 1.00 . A A . 3 TRP CA 1 1 7 2633 1 1 3 TRP CB C -16.508 -4.953 0.401 1.00 . A A . 3 TRP CB 1 1 7 2634 1 1 3 TRP CD1 C -14.878 -4.762 2.327 1.00 . A A . 3 TRP CD1 1 1 7 2635 1 1 3 TRP CD2 C -16.430 -6.356 2.663 1.00 . A A . 3 TRP CD2 1 1 7 2636 1 1 3 TRP CE2 C -15.594 -6.355 3.804 1.00 . A A . 3 TRP CE2 1 1 7 2637 1 1 3 TRP CE3 C -17.494 -7.276 2.622 1.00 . A A . 3 TRP CE3 1 1 7 2638 1 1 3 TRP CG C -15.955 -5.333 1.739 1.00 . A A . 3 TRP CG 1 1 7 2639 1 1 3 TRP CH2 C -16.866 -8.141 4.810 1.00 . A A . 3 TRP CH2 1 1 7 2640 1 1 3 TRP CZ2 C -15.805 -7.234 4.867 1.00 . A A . 3 TRP CZ2 1 1 7 2641 1 1 3 TRP CZ3 C -17.708 -8.163 3.689 1.00 . A A . 3 TRP CZ3 1 1 7 2642 1 1 3 TRP H H -18.414 -3.580 -0.958 1.00 . A A . 3 TRP H 1 1 7 2643 1 1 3 TRP HA H -16.531 -2.997 1.308 1.00 . A A . 3 TRP HA 1 1 7 2644 1 1 3 TRP HB2 H -17.461 -5.439 0.255 1.00 . A A . 3 TRP HB2 1 1 7 2645 1 1 3 TRP HB3 H -15.823 -5.267 -0.372 1.00 . A A . 3 TRP HB3 1 1 7 2646 1 1 3 TRP HD1 H -14.285 -3.962 1.909 1.00 . A A . 3 TRP HD1 1 1 7 2647 1 1 3 TRP HE1 H -13.950 -5.133 4.178 1.00 . A A . 3 TRP HE1 1 1 7 2648 1 1 3 TRP HE3 H -18.149 -7.302 1.763 1.00 . A A . 3 TRP HE3 1 1 7 2649 1 1 3 TRP HH2 H -17.037 -8.826 5.628 1.00 . A A . 3 TRP HH2 1 1 7 2650 1 1 3 TRP HZ2 H -15.153 -7.213 5.728 1.00 . A A . 3 TRP HZ2 1 1 7 2651 1 1 3 TRP HZ3 H -18.528 -8.866 3.647 1.00 . A A . 3 TRP HZ3 1 1 7 2652 1 1 3 TRP N N -18.112 -3.230 -0.093 1.00 . A A . 3 TRP N 1 1 7 2653 1 1 3 TRP NE1 N -14.665 -5.365 3.553 1.00 . A A . 3 TRP NE1 1 1 7 2654 1 1 3 TRP O O -15.371 -3.435 -1.671 1.00 . A A . 3 TRP O 1 1 7 2655 1 1 4 TYR C C -13.451 0.054 -0.709 1.00 . A A . 4 TYR C 1 1 7 2656 1 1 4 TYR CA C -14.405 -0.910 -1.440 1.00 . A A . 4 TYR CA 1 1 7 2657 1 1 4 TYR CB C -15.312 -0.147 -2.419 1.00 . A A . 4 TYR CB 1 1 7 2658 1 1 4 TYR CD1 C -17.306 0.648 -1.088 1.00 . A A . 4 TYR CD1 1 1 7 2659 1 1 4 TYR CD2 C -15.567 2.246 -1.643 1.00 . A A . 4 TYR CD2 1 1 7 2660 1 1 4 TYR CE1 C -18.019 1.655 -0.426 1.00 . A A . 4 TYR CE1 1 1 7 2661 1 1 4 TYR CE2 C -16.280 3.252 -0.981 1.00 . A A . 4 TYR CE2 1 1 7 2662 1 1 4 TYR CG C -16.079 0.942 -1.695 1.00 . A A . 4 TYR CG 1 1 7 2663 1 1 4 TYR CZ C -17.506 2.957 -0.373 1.00 . A A . 4 TYR CZ 1 1 7 2664 1 1 4 TYR H H -15.653 -1.096 0.315 1.00 . A A . 4 TYR H 1 1 7 2665 1 1 4 TYR HA H -13.836 -1.651 -1.979 1.00 . A A . 4 TYR HA 1 1 7 2666 1 1 4 TYR HB2 H -14.704 0.301 -3.192 1.00 . A A . 4 TYR HB2 1 1 7 2667 1 1 4 TYR HB3 H -16.010 -0.836 -2.870 1.00 . A A . 4 TYR HB3 1 1 7 2668 1 1 4 TYR HD1 H -17.701 -0.356 -1.127 1.00 . A A . 4 TYR HD1 1 1 7 2669 1 1 4 TYR HD2 H -14.620 2.473 -2.111 1.00 . A A . 4 TYR HD2 1 1 7 2670 1 1 4 TYR HE1 H -18.965 1.428 0.042 1.00 . A A . 4 TYR HE1 1 1 7 2671 1 1 4 TYR HE2 H -15.884 4.256 -0.939 1.00 . A A . 4 TYR HE2 1 1 7 2672 1 1 4 TYR HH H -17.989 3.907 1.211 1.00 . A A . 4 TYR HH 1 1 7 2673 1 1 4 TYR N N -15.339 -1.581 -0.478 1.00 . A A . 4 TYR N 1 1 7 2674 1 1 4 TYR O O -12.879 0.942 -1.314 1.00 . A A . 4 TYR O 1 1 7 2675 1 1 4 TYR OH O -18.210 3.951 0.277 1.00 . A A . 4 TYR OH 1 1 7 2676 1 1 5 SER C C -11.140 0.008 1.893 1.00 . A A . 5 SER C 1 1 7 2677 1 1 5 SER CA C -12.346 0.786 1.337 1.00 . A A . 5 SER CA 1 1 7 2678 1 1 5 SER CB C -13.193 1.347 2.479 1.00 . A A . 5 SER CB 1 1 7 2679 1 1 5 SER H H -13.729 -0.844 1.046 1.00 . A A . 5 SER H 1 1 7 2680 1 1 5 SER HA H -12.008 1.589 0.705 1.00 . A A . 5 SER HA 1 1 7 2681 1 1 5 SER HB2 H -14.167 1.622 2.106 1.00 . A A . 5 SER HB2 1 1 7 2682 1 1 5 SER HB3 H -13.305 0.593 3.248 1.00 . A A . 5 SER HB3 1 1 7 2683 1 1 5 SER HG H -12.329 2.315 3.930 1.00 . A A . 5 SER HG 1 1 7 2684 1 1 5 SER N N -13.267 -0.119 0.579 1.00 . A A . 5 SER N 1 1 7 2685 1 1 5 SER O O -10.251 0.583 2.494 1.00 . A A . 5 SER O 1 1 7 2686 1 1 5 SER OG O -12.554 2.498 3.015 1.00 . A A . 5 SER OG 1 1 7 2687 1 1 6 HIS C C -8.886 -2.265 1.116 1.00 . A A . 6 HIS C 1 1 7 2688 1 1 6 HIS CA C -9.944 -2.088 2.209 1.00 . A A . 6 HIS CA 1 1 7 2689 1 1 6 HIS CB C -10.538 -3.442 2.615 1.00 . A A . 6 HIS CB 1 1 7 2690 1 1 6 HIS CD2 C -10.990 -3.626 5.199 1.00 . A A . 6 HIS CD2 1 1 7 2691 1 1 6 HIS CE1 C -12.969 -2.748 5.237 1.00 . A A . 6 HIS CE1 1 1 7 2692 1 1 6 HIS CG C -11.301 -3.294 3.905 1.00 . A A . 6 HIS CG 1 1 7 2693 1 1 6 HIS H H -11.817 -1.730 1.203 1.00 . A A . 6 HIS H 1 1 7 2694 1 1 6 HIS HA H -9.510 -1.604 3.065 1.00 . A A . 6 HIS HA 1 1 7 2695 1 1 6 HIS HB2 H -11.204 -3.790 1.839 1.00 . A A . 6 HIS HB2 1 1 7 2696 1 1 6 HIS HB3 H -9.741 -4.157 2.751 1.00 . A A . 6 HIS HB3 1 1 7 2697 1 1 6 HIS HD1 H -13.082 -2.395 3.191 1.00 . A A . 6 HIS HD1 1 1 7 2698 1 1 6 HIS HD2 H -10.065 -4.084 5.519 1.00 . A A . 6 HIS HD2 1 1 7 2699 1 1 6 HIS HE1 H -13.923 -2.374 5.578 1.00 . A A . 6 HIS HE1 1 1 7 2700 1 1 6 HIS N N -11.097 -1.286 1.694 1.00 . A A . 6 HIS N 1 1 7 2701 1 1 6 HIS ND1 N -12.569 -2.736 3.954 1.00 . A A . 6 HIS ND1 1 1 7 2702 1 1 6 HIS NE2 N -12.044 -3.280 6.039 1.00 . A A . 6 HIS NE2 1 1 7 2703 1 1 6 HIS O O -7.716 -2.436 1.401 1.00 . A A . 6 HIS O 1 1 7 2704 1 1 7 TYR C C -7.390 -1.139 -1.283 1.00 . A A . 7 TYR C 1 1 7 2705 1 1 7 TYR CA C -8.301 -2.364 -1.245 1.00 . A A . 7 TYR CA 1 1 7 2706 1 1 7 TYR CB C -9.131 -2.458 -2.531 1.00 . A A . 7 TYR CB 1 1 7 2707 1 1 7 TYR CD1 C -9.396 -4.963 -2.687 1.00 . A A . 7 TYR CD1 1 1 7 2708 1 1 7 TYR CD2 C -11.366 -3.604 -2.291 1.00 . A A . 7 TYR CD2 1 1 7 2709 1 1 7 TYR CE1 C -10.188 -6.117 -2.661 1.00 . A A . 7 TYR CE1 1 1 7 2710 1 1 7 TYR CE2 C -12.157 -4.758 -2.265 1.00 . A A . 7 TYR CE2 1 1 7 2711 1 1 7 TYR CG C -9.985 -3.706 -2.502 1.00 . A A . 7 TYR CG 1 1 7 2712 1 1 7 TYR CZ C -11.568 -6.015 -2.450 1.00 . A A . 7 TYR CZ 1 1 7 2713 1 1 7 TYR H H -10.232 -2.065 -0.331 1.00 . A A . 7 TYR H 1 1 7 2714 1 1 7 TYR HA H -7.717 -3.256 -1.111 1.00 . A A . 7 TYR HA 1 1 7 2715 1 1 7 TYR HB2 H -9.767 -1.589 -2.612 1.00 . A A . 7 TYR HB2 1 1 7 2716 1 1 7 TYR HB3 H -8.469 -2.498 -3.383 1.00 . A A . 7 TYR HB3 1 1 7 2717 1 1 7 TYR HD1 H -8.331 -5.042 -2.850 1.00 . A A . 7 TYR HD1 1 1 7 2718 1 1 7 TYR HD2 H -11.820 -2.635 -2.149 1.00 . A A . 7 TYR HD2 1 1 7 2719 1 1 7 TYR HE1 H -9.733 -7.087 -2.804 1.00 . A A . 7 TYR HE1 1 1 7 2720 1 1 7 TYR HE2 H -13.221 -4.679 -2.102 1.00 . A A . 7 TYR HE2 1 1 7 2721 1 1 7 TYR HH H -12.290 -7.532 -1.545 1.00 . A A . 7 TYR HH 1 1 7 2722 1 1 7 TYR N N -9.286 -2.214 -0.130 1.00 . A A . 7 TYR N 1 1 7 2723 1 1 7 TYR O O -6.185 -1.254 -1.383 1.00 . A A . 7 TYR O 1 1 7 2724 1 1 7 TYR OH O -12.347 -7.152 -2.424 1.00 . A A . 7 TYR OH 1 1 7 2725 1 1 8 VAL C C -6.194 1.278 0.026 1.00 . A A . 8 VAL C 1 1 7 2726 1 1 8 VAL CA C -7.145 1.281 -1.180 1.00 . A A . 8 VAL CA 1 1 7 2727 1 1 8 VAL CB C -8.155 2.440 -1.098 1.00 . A A . 8 VAL CB 1 1 7 2728 1 1 8 VAL CG1 C -8.962 2.359 0.204 1.00 . A A . 8 VAL CG1 1 1 7 2729 1 1 8 VAL CG2 C -7.407 3.776 -1.146 1.00 . A A . 8 VAL CG2 1 1 7 2730 1 1 8 VAL H H -8.938 0.083 -1.083 1.00 . A A . 8 VAL H 1 1 7 2731 1 1 8 VAL HA H -6.581 1.350 -2.092 1.00 . A A . 8 VAL HA 1 1 7 2732 1 1 8 VAL HB H -8.832 2.380 -1.938 1.00 . A A . 8 VAL HB 1 1 7 2733 1 1 8 VAL HG11 H -9.378 1.367 0.311 1.00 . A A . 8 VAL HG11 1 1 7 2734 1 1 8 VAL HG12 H -9.765 3.081 0.174 1.00 . A A . 8 VAL HG12 1 1 7 2735 1 1 8 VAL HG13 H -8.318 2.572 1.043 1.00 . A A . 8 VAL HG13 1 1 7 2736 1 1 8 VAL HG21 H -7.027 3.941 -2.144 1.00 . A A . 8 VAL HG21 1 1 7 2737 1 1 8 VAL HG22 H -6.583 3.754 -0.447 1.00 . A A . 8 VAL HG22 1 1 7 2738 1 1 8 VAL HG23 H -8.081 4.577 -0.881 1.00 . A A . 8 VAL HG23 1 1 7 2739 1 1 8 VAL N N -7.966 0.030 -1.178 1.00 . A A . 8 VAL N 1 1 7 2740 1 1 8 VAL O O -5.092 1.790 -0.043 1.00 . A A . 8 VAL O 1 1 7 2741 1 1 9 LEU C C -4.649 -0.447 2.126 1.00 . A A . 9 LEU C 1 1 7 2742 1 1 9 LEU CA C -5.728 0.623 2.328 1.00 . A A . 9 LEU CA 1 1 7 2743 1 1 9 LEU CB C -6.657 0.242 3.487 1.00 . A A . 9 LEU CB 1 1 7 2744 1 1 9 LEU CD1 C -6.943 1.048 5.838 1.00 . A A . 9 LEU CD1 1 1 7 2745 1 1 9 LEU CD2 C -5.367 -0.825 5.348 1.00 . A A . 9 LEU CD2 1 1 7 2746 1 1 9 LEU CG C -5.945 0.492 4.821 1.00 . A A . 9 LEU CG 1 1 7 2747 1 1 9 LEU H H -7.493 0.266 1.142 1.00 . A A . 9 LEU H 1 1 7 2748 1 1 9 LEU HA H -5.276 1.585 2.516 1.00 . A A . 9 LEU HA 1 1 7 2749 1 1 9 LEU HB2 H -7.555 0.841 3.439 1.00 . A A . 9 LEU HB2 1 1 7 2750 1 1 9 LEU HB3 H -6.917 -0.804 3.410 1.00 . A A . 9 LEU HB3 1 1 7 2751 1 1 9 LEU HD11 H -7.754 0.346 5.971 1.00 . A A . 9 LEU HD11 1 1 7 2752 1 1 9 LEU HD12 H -7.337 1.989 5.480 1.00 . A A . 9 LEU HD12 1 1 7 2753 1 1 9 LEU HD13 H -6.445 1.204 6.784 1.00 . A A . 9 LEU HD13 1 1 7 2754 1 1 9 LEU HD21 H -4.965 -1.397 4.525 1.00 . A A . 9 LEU HD21 1 1 7 2755 1 1 9 LEU HD22 H -6.147 -1.393 5.834 1.00 . A A . 9 LEU HD22 1 1 7 2756 1 1 9 LEU HD23 H -4.581 -0.614 6.057 1.00 . A A . 9 LEU HD23 1 1 7 2757 1 1 9 LEU HG H -5.147 1.204 4.676 1.00 . A A . 9 LEU HG 1 1 7 2758 1 1 9 LEU N N -6.608 0.685 1.121 1.00 . A A . 9 LEU N 1 1 7 2759 1 1 9 LEU O O -3.506 -0.262 2.497 1.00 . A A . 9 LEU O 1 1 7 2760 1 1 10 LYS C C -3.046 -2.240 0.167 1.00 . A A . 10 LYS C 1 1 7 2761 1 1 10 LYS CA C -4.003 -2.646 1.295 1.00 . A A . 10 LYS CA 1 1 7 2762 1 1 10 LYS CB C -4.830 -3.871 0.890 1.00 . A A . 10 LYS CB 1 1 7 2763 1 1 10 LYS CD C -4.577 -6.296 1.469 1.00 . A A . 10 LYS CD 1 1 7 2764 1 1 10 LYS CE C -5.662 -6.888 0.560 1.00 . A A . 10 LYS CE 1 1 7 2765 1 1 10 LYS CG C -3.918 -5.099 0.776 1.00 . A A . 10 LYS CG 1 1 7 2766 1 1 10 LYS H H -5.936 -1.684 1.236 1.00 . A A . 10 LYS H 1 1 7 2767 1 1 10 LYS HA H -3.453 -2.855 2.199 1.00 . A A . 10 LYS HA 1 1 7 2768 1 1 10 LYS HB2 H -5.588 -4.053 1.639 1.00 . A A . 10 LYS HB2 1 1 7 2769 1 1 10 LYS HB3 H -5.302 -3.687 -0.063 1.00 . A A . 10 LYS HB3 1 1 7 2770 1 1 10 LYS HD2 H -3.827 -7.049 1.672 1.00 . A A . 10 LYS HD2 1 1 7 2771 1 1 10 LYS HD3 H -5.022 -5.974 2.398 1.00 . A A . 10 LYS HD3 1 1 7 2772 1 1 10 LYS HE2 H -5.589 -6.465 -0.433 1.00 . A A . 10 LYS HE2 1 1 7 2773 1 1 10 LYS HE3 H -5.573 -7.963 0.520 1.00 . A A . 10 LYS HE3 1 1 7 2774 1 1 10 LYS HG2 H -3.757 -5.329 -0.268 1.00 . A A . 10 LYS HG2 1 1 7 2775 1 1 10 LYS HG3 H -2.970 -4.889 1.248 1.00 . A A . 10 LYS HG3 1 1 7 2776 1 1 10 LYS HZ1 H -7.040 -6.973 2.123 1.00 . A A . 10 LYS HZ1 1 1 7 2777 1 1 10 LYS HZ2 H -7.743 -6.804 0.586 1.00 . A A . 10 LYS HZ2 1 1 7 2778 1 1 10 LYS HZ3 H -6.989 -5.473 1.328 1.00 . A A . 10 LYS HZ3 1 1 7 2779 1 1 10 LYS N N -5.006 -1.562 1.532 1.00 . A A . 10 LYS N 1 1 7 2780 1 1 10 LYS NZ N -6.956 -6.506 1.198 1.00 . A A . 10 LYS NZ 1 1 7 2781 1 1 10 LYS O O -1.861 -2.503 0.225 1.00 . A A . 10 LYS O 1 1 7 2782 1 1 11 PHE C C -1.671 -0.115 -1.516 1.00 . A A . 11 PHE C 1 1 7 2783 1 1 11 PHE CA C -2.683 -1.167 -1.992 1.00 . A A . 11 PHE CA 1 1 7 2784 1 1 11 PHE CB C -3.642 -0.569 -3.028 1.00 . A A . 11 PHE CB 1 1 7 2785 1 1 11 PHE CD1 C -2.611 -1.126 -5.261 1.00 . A A . 11 PHE CD1 1 1 7 2786 1 1 11 PHE CD2 C -2.428 1.143 -4.426 1.00 . A A . 11 PHE CD2 1 1 7 2787 1 1 11 PHE CE1 C -1.900 -0.760 -6.410 1.00 . A A . 11 PHE CE1 1 1 7 2788 1 1 11 PHE CE2 C -1.718 1.508 -5.575 1.00 . A A . 11 PHE CE2 1 1 7 2789 1 1 11 PHE CG C -2.875 -0.175 -4.269 1.00 . A A . 11 PHE CG 1 1 7 2790 1 1 11 PHE CZ C -1.454 0.557 -6.567 1.00 . A A . 11 PHE CZ 1 1 7 2791 1 1 11 PHE H H -4.517 -1.396 -0.878 1.00 . A A . 11 PHE H 1 1 7 2792 1 1 11 PHE HA H -2.168 -2.017 -2.414 1.00 . A A . 11 PHE HA 1 1 7 2793 1 1 11 PHE HB2 H -4.393 -1.301 -3.287 1.00 . A A . 11 PHE HB2 1 1 7 2794 1 1 11 PHE HB3 H -4.121 0.305 -2.611 1.00 . A A . 11 PHE HB3 1 1 7 2795 1 1 11 PHE HD1 H -2.956 -2.143 -5.141 1.00 . A A . 11 PHE HD1 1 1 7 2796 1 1 11 PHE HD2 H -2.632 1.877 -3.661 1.00 . A A . 11 PHE HD2 1 1 7 2797 1 1 11 PHE HE1 H -1.696 -1.494 -7.176 1.00 . A A . 11 PHE HE1 1 1 7 2798 1 1 11 PHE HE2 H -1.373 2.525 -5.696 1.00 . A A . 11 PHE HE2 1 1 7 2799 1 1 11 PHE HZ H -0.905 0.840 -7.453 1.00 . A A . 11 PHE HZ 1 1 7 2800 1 1 11 PHE N N -3.555 -1.598 -0.857 1.00 . A A . 11 PHE N 1 1 7 2801 1 1 11 PHE O O -0.501 -0.189 -1.834 1.00 . A A . 11 PHE O 1 1 7 2802 1 1 12 PHE C C -0.103 1.295 0.644 1.00 . A A . 12 PHE C 1 1 7 2803 1 1 12 PHE CA C -1.177 1.916 -0.258 1.00 . A A . 12 PHE CA 1 1 7 2804 1 1 12 PHE CB C -2.049 2.892 0.539 1.00 . A A . 12 PHE CB 1 1 7 2805 1 1 12 PHE CD1 C -0.309 4.549 1.311 1.00 . A A . 12 PHE CD1 1 1 7 2806 1 1 12 PHE CD2 C -1.960 5.261 -0.318 1.00 . A A . 12 PHE CD2 1 1 7 2807 1 1 12 PHE CE1 C 0.269 5.823 1.282 1.00 . A A . 12 PHE CE1 1 1 7 2808 1 1 12 PHE CE2 C -1.381 6.536 -0.346 1.00 . A A . 12 PHE CE2 1 1 7 2809 1 1 12 PHE CG C -1.425 4.268 0.511 1.00 . A A . 12 PHE CG 1 1 7 2810 1 1 12 PHE CZ C -0.267 6.816 0.453 1.00 . A A . 12 PHE CZ 1 1 7 2811 1 1 12 PHE H H -3.065 0.894 -0.512 1.00 . A A . 12 PHE H 1 1 7 2812 1 1 12 PHE HA H -0.717 2.428 -1.087 1.00 . A A . 12 PHE HA 1 1 7 2813 1 1 12 PHE HB2 H -3.035 2.936 0.100 1.00 . A A . 12 PHE HB2 1 1 7 2814 1 1 12 PHE HB3 H -2.126 2.554 1.563 1.00 . A A . 12 PHE HB3 1 1 7 2815 1 1 12 PHE HD1 H 0.104 3.783 1.950 1.00 . A A . 12 PHE HD1 1 1 7 2816 1 1 12 PHE HD2 H -2.820 5.044 -0.934 1.00 . A A . 12 PHE HD2 1 1 7 2817 1 1 12 PHE HE1 H 1.127 6.040 1.899 1.00 . A A . 12 PHE HE1 1 1 7 2818 1 1 12 PHE HE2 H -1.794 7.302 -0.985 1.00 . A A . 12 PHE HE2 1 1 7 2819 1 1 12 PHE HZ H 0.179 7.800 0.431 1.00 . A A . 12 PHE HZ 1 1 7 2820 1 1 12 PHE N N -2.115 0.859 -0.756 1.00 . A A . 12 PHE N 1 1 7 2821 1 1 12 PHE O O 1.067 1.604 0.526 1.00 . A A . 12 PHE O 1 1 7 2822 1 1 13 LEU C C 1.517 -1.052 1.624 1.00 . A A . 13 LEU C 1 1 7 2823 1 1 13 LEU CA C 0.505 -0.235 2.444 1.00 . A A . 13 LEU CA 1 1 7 2824 1 1 13 LEU CB C -0.319 -1.153 3.353 1.00 . A A . 13 LEU CB 1 1 7 2825 1 1 13 LEU CD1 C 0.132 -0.491 5.725 1.00 . A A . 13 LEU CD1 1 1 7 2826 1 1 13 LEU CD2 C 0.141 -2.903 5.075 1.00 . A A . 13 LEU CD2 1 1 7 2827 1 1 13 LEU CG C 0.484 -1.485 4.614 1.00 . A A . 13 LEU CG 1 1 7 2828 1 1 13 LEU H H -1.442 0.180 1.606 1.00 . A A . 13 LEU H 1 1 7 2829 1 1 13 LEU HA H 1.015 0.508 3.036 1.00 . A A . 13 LEU HA 1 1 7 2830 1 1 13 LEU HB2 H -1.238 -0.655 3.630 1.00 . A A . 13 LEU HB2 1 1 7 2831 1 1 13 LEU HB3 H -0.551 -2.066 2.825 1.00 . A A . 13 LEU HB3 1 1 7 2832 1 1 13 LEU HD11 H 0.558 0.473 5.493 1.00 . A A . 13 LEU HD11 1 1 7 2833 1 1 13 LEU HD12 H 0.531 -0.846 6.664 1.00 . A A . 13 LEU HD12 1 1 7 2834 1 1 13 LEU HD13 H -0.941 -0.401 5.801 1.00 . A A . 13 LEU HD13 1 1 7 2835 1 1 13 LEU HD21 H -0.891 -2.940 5.391 1.00 . A A . 13 LEU HD21 1 1 7 2836 1 1 13 LEU HD22 H 0.780 -3.178 5.901 1.00 . A A . 13 LEU HD22 1 1 7 2837 1 1 13 LEU HD23 H 0.291 -3.594 4.260 1.00 . A A . 13 LEU HD23 1 1 7 2838 1 1 13 LEU HG H 1.541 -1.421 4.396 1.00 . A A . 13 LEU HG 1 1 7 2839 1 1 13 LEU N N -0.492 0.416 1.537 1.00 . A A . 13 LEU N 1 1 7 2840 1 1 13 LEU O O 2.675 -1.152 1.983 1.00 . A A . 13 LEU O 1 1 7 2841 1 1 14 LEU C C 3.007 -1.501 -1.044 1.00 . A A . 14 LEU C 1 1 7 2842 1 1 14 LEU CA C 2.027 -2.430 -0.321 1.00 . A A . 14 LEU CA 1 1 7 2843 1 1 14 LEU CB C 1.136 -3.169 -1.327 1.00 . A A . 14 LEU CB 1 1 7 2844 1 1 14 LEU CD1 C 1.722 -5.534 -0.760 1.00 . A A . 14 LEU CD1 1 1 7 2845 1 1 14 LEU CD2 C 1.223 -4.902 -3.126 1.00 . A A . 14 LEU CD2 1 1 7 2846 1 1 14 LEU CG C 1.853 -4.430 -1.814 1.00 . A A . 14 LEU CG 1 1 7 2847 1 1 14 LEU H H 0.151 -1.530 0.255 1.00 . A A . 14 LEU H 1 1 7 2848 1 1 14 LEU HA H 2.563 -3.137 0.285 1.00 . A A . 14 LEU HA 1 1 7 2849 1 1 14 LEU HB2 H 0.204 -3.442 -0.852 1.00 . A A . 14 LEU HB2 1 1 7 2850 1 1 14 LEU HB3 H 0.933 -2.524 -2.169 1.00 . A A . 14 LEU HB3 1 1 7 2851 1 1 14 LEU HD11 H 0.682 -5.806 -0.651 1.00 . A A . 14 LEU HD11 1 1 7 2852 1 1 14 LEU HD12 H 2.103 -5.177 0.185 1.00 . A A . 14 LEU HD12 1 1 7 2853 1 1 14 LEU HD13 H 2.290 -6.399 -1.073 1.00 . A A . 14 LEU HD13 1 1 7 2854 1 1 14 LEU HD21 H 1.749 -5.775 -3.485 1.00 . A A . 14 LEU HD21 1 1 7 2855 1 1 14 LEU HD22 H 1.290 -4.115 -3.862 1.00 . A A . 14 LEU HD22 1 1 7 2856 1 1 14 LEU HD23 H 0.185 -5.152 -2.959 1.00 . A A . 14 LEU HD23 1 1 7 2857 1 1 14 LEU HG H 2.900 -4.211 -1.974 1.00 . A A . 14 LEU HG 1 1 7 2858 1 1 14 LEU N N 1.089 -1.629 0.525 1.00 . A A . 14 LEU N 1 1 7 2859 1 1 14 LEU O O 4.201 -1.726 -1.044 1.00 . A A . 14 LEU O 1 1 7 2860 1 1 15 VAL C C 4.264 1.264 -1.357 1.00 . A A . 15 VAL C 1 1 7 2861 1 1 15 VAL CA C 3.396 0.507 -2.371 1.00 . A A . 15 VAL CA 1 1 7 2862 1 1 15 VAL CB C 2.446 1.465 -3.108 1.00 . A A . 15 VAL CB 1 1 7 2863 1 1 15 VAL CG1 C 3.252 2.576 -3.786 1.00 . A A . 15 VAL CG1 1 1 7 2864 1 1 15 VAL CG2 C 1.665 0.691 -4.175 1.00 . A A . 15 VAL CG2 1 1 7 2865 1 1 15 VAL H H 1.537 -0.303 -1.621 1.00 . A A . 15 VAL H 1 1 7 2866 1 1 15 VAL HA H 4.016 -0.017 -3.080 1.00 . A A . 15 VAL HA 1 1 7 2867 1 1 15 VAL HB H 1.756 1.901 -2.400 1.00 . A A . 15 VAL HB 1 1 7 2868 1 1 15 VAL HG11 H 2.639 3.063 -4.530 1.00 . A A . 15 VAL HG11 1 1 7 2869 1 1 15 VAL HG12 H 4.124 2.151 -4.261 1.00 . A A . 15 VAL HG12 1 1 7 2870 1 1 15 VAL HG13 H 3.562 3.299 -3.046 1.00 . A A . 15 VAL HG13 1 1 7 2871 1 1 15 VAL HG21 H 0.935 1.344 -4.630 1.00 . A A . 15 VAL HG21 1 1 7 2872 1 1 15 VAL HG22 H 1.163 -0.148 -3.718 1.00 . A A . 15 VAL HG22 1 1 7 2873 1 1 15 VAL HG23 H 2.349 0.333 -4.931 1.00 . A A . 15 VAL HG23 1 1 7 2874 1 1 15 VAL N N 2.504 -0.456 -1.649 1.00 . A A . 15 VAL N 1 1 7 2875 1 1 15 VAL O O 5.463 1.390 -1.529 1.00 . A A . 15 VAL O 1 1 7 2876 1 1 16 PHE C C 5.462 1.532 1.399 1.00 . A A . 16 PHE C 1 1 7 2877 1 1 16 PHE CA C 4.458 2.488 0.743 1.00 . A A . 16 PHE CA 1 1 7 2878 1 1 16 PHE CB C 3.425 2.977 1.764 1.00 . A A . 16 PHE CB 1 1 7 2879 1 1 16 PHE CD1 C 4.121 5.368 2.163 1.00 . A A . 16 PHE CD1 1 1 7 2880 1 1 16 PHE CD2 C 4.516 3.730 3.907 1.00 . A A . 16 PHE CD2 1 1 7 2881 1 1 16 PHE CE1 C 4.685 6.363 2.970 1.00 . A A . 16 PHE CE1 1 1 7 2882 1 1 16 PHE CE2 C 5.080 4.726 4.714 1.00 . A A . 16 PHE CE2 1 1 7 2883 1 1 16 PHE CG C 4.036 4.051 2.632 1.00 . A A . 16 PHE CG 1 1 7 2884 1 1 16 PHE CZ C 5.164 6.042 4.247 1.00 . A A . 16 PHE CZ 1 1 7 2885 1 1 16 PHE H H 2.702 1.626 -0.175 1.00 . A A . 16 PHE H 1 1 7 2886 1 1 16 PHE HA H 4.969 3.328 0.302 1.00 . A A . 16 PHE HA 1 1 7 2887 1 1 16 PHE HB2 H 2.568 3.379 1.244 1.00 . A A . 16 PHE HB2 1 1 7 2888 1 1 16 PHE HB3 H 3.113 2.149 2.383 1.00 . A A . 16 PHE HB3 1 1 7 2889 1 1 16 PHE HD1 H 3.751 5.616 1.179 1.00 . A A . 16 PHE HD1 1 1 7 2890 1 1 16 PHE HD2 H 4.452 2.714 4.269 1.00 . A A . 16 PHE HD2 1 1 7 2891 1 1 16 PHE HE1 H 4.749 7.380 2.609 1.00 . A A . 16 PHE HE1 1 1 7 2892 1 1 16 PHE HE2 H 5.450 4.477 5.698 1.00 . A A . 16 PHE HE2 1 1 7 2893 1 1 16 PHE HZ H 5.599 6.810 4.869 1.00 . A A . 16 PHE HZ 1 1 7 2894 1 1 16 PHE N N 3.668 1.754 -0.296 1.00 . A A . 16 PHE N 1 1 7 2895 1 1 16 PHE O O 6.576 1.910 1.708 1.00 . A A . 16 PHE O 1 1 7 2896 1 1 17 GLY C C 7.207 -0.906 1.293 1.00 . A A . 17 GLY C 1 1 7 2897 1 1 17 GLY CA C 6.007 -0.699 2.218 1.00 . A A . 17 GLY CA 1 1 7 2898 1 1 17 GLY H H 4.176 0.010 1.332 1.00 . A A . 17 GLY H 1 1 7 2899 1 1 17 GLY HA2 H 6.347 -0.327 3.174 1.00 . A A . 17 GLY HA2 1 1 7 2900 1 1 17 GLY HA3 H 5.496 -1.639 2.355 1.00 . A A . 17 GLY HA3 1 1 7 2901 1 1 17 GLY N N 5.077 0.292 1.600 1.00 . A A . 17 GLY N 1 1 7 2902 1 1 17 GLY O O 8.336 -0.964 1.737 1.00 . A A . 17 GLY O 1 1 7 2903 1 1 18 GLU C C 9.027 0.032 -0.933 1.00 . A A . 18 GLU C 1 1 7 2904 1 1 18 GLU CA C 8.102 -1.189 -0.956 1.00 . A A . 18 GLU CA 1 1 7 2905 1 1 18 GLU CB C 7.450 -1.346 -2.330 1.00 . A A . 18 GLU CB 1 1 7 2906 1 1 18 GLU CD C 7.647 -3.380 -3.778 1.00 . A A . 18 GLU CD 1 1 7 2907 1 1 18 GLU CG C 7.000 -2.798 -2.519 1.00 . A A . 18 GLU CG 1 1 7 2908 1 1 18 GLU H H 6.050 -0.942 -0.330 1.00 . A A . 18 GLU H 1 1 7 2909 1 1 18 GLU HA H 8.655 -2.075 -0.707 1.00 . A A . 18 GLU HA 1 1 7 2910 1 1 18 GLU HB2 H 6.593 -0.691 -2.400 1.00 . A A . 18 GLU HB2 1 1 7 2911 1 1 18 GLU HB3 H 8.164 -1.090 -3.099 1.00 . A A . 18 GLU HB3 1 1 7 2912 1 1 18 GLU HG2 H 7.297 -3.381 -1.659 1.00 . A A . 18 GLU HG2 1 1 7 2913 1 1 18 GLU HG3 H 5.927 -2.831 -2.622 1.00 . A A . 18 GLU HG3 1 1 7 2914 1 1 18 GLU N N 6.971 -1.002 0.005 1.00 . A A . 18 GLU N 1 1 7 2915 1 1 18 GLU O O 10.206 -0.073 -1.196 1.00 . A A . 18 GLU O 1 1 7 2916 1 1 18 GLU OE1 O 7.256 -2.977 -4.861 1.00 . A A . 18 GLU OE1 1 1 7 2917 1 1 18 GLU OE2 O 8.520 -4.221 -3.637 1.00 . A A . 18 GLU OE2 1 1 7 2918 1 1 19 ASN C C 10.318 2.334 0.647 1.00 . A A . 19 ASN C 1 1 7 2919 1 1 19 ASN CA C 9.362 2.410 -0.551 1.00 . A A . 19 ASN CA 1 1 7 2920 1 1 19 ASN CB C 8.393 3.585 -0.392 1.00 . A A . 19 ASN CB 1 1 7 2921 1 1 19 ASN CG C 8.078 4.173 -1.768 1.00 . A A . 19 ASN CG 1 1 7 2922 1 1 19 ASN H H 7.551 1.245 -0.391 1.00 . A A . 19 ASN H 1 1 7 2923 1 1 19 ASN HA H 9.920 2.515 -1.464 1.00 . A A . 19 ASN HA 1 1 7 2924 1 1 19 ASN HB2 H 7.480 3.239 0.070 1.00 . A A . 19 ASN HB2 1 1 7 2925 1 1 19 ASN HB3 H 8.844 4.345 0.227 1.00 . A A . 19 ASN HB3 1 1 7 2926 1 1 19 ASN HD21 H 6.398 3.136 -1.987 1.00 . A A . 19 ASN HD21 1 1 7 2927 1 1 19 ASN HD22 H 6.791 4.163 -3.279 1.00 . A A . 19 ASN HD22 1 1 7 2928 1 1 19 ASN N N 8.504 1.187 -0.608 1.00 . A A . 19 ASN N 1 1 7 2929 1 1 19 ASN ND2 N 7.000 3.793 -2.398 1.00 . A A . 19 ASN ND2 1 1 7 2930 1 1 19 ASN O O 11.363 2.952 0.654 1.00 . A A . 19 ASN O 1 1 7 2931 1 1 19 ASN OD1 O 8.824 4.985 -2.278 1.00 . A A . 19 ASN OD1 1 1 7 2932 1 1 20 GLY C C 11.577 0.100 2.828 1.00 . A A . 20 GLY C 1 1 7 2933 1 1 20 GLY CA C 10.843 1.449 2.853 1.00 . A A . 20 GLY CA 1 1 7 2934 1 1 20 GLY H H 9.116 1.089 1.620 1.00 . A A . 20 GLY H 1 1 7 2935 1 1 20 GLY HA2 H 11.568 2.251 2.854 1.00 . A A . 20 GLY HA2 1 1 7 2936 1 1 20 GLY HA3 H 10.241 1.508 3.747 1.00 . A A . 20 GLY HA3 1 1 7 2937 1 1 20 GLY N N 9.964 1.576 1.654 1.00 . A A . 20 GLY N 1 1 7 2938 1 1 20 GLY O O 12.677 -0.017 3.331 1.00 . A A . 20 GLY O 1 1 7 2939 1 1 21 VAL C C 12.318 -2.496 0.861 1.00 . A A . 21 VAL C 1 1 7 2940 1 1 21 VAL CA C 11.647 -2.260 2.220 1.00 . A A . 21 VAL CA 1 1 7 2941 1 1 21 VAL CB C 10.522 -3.278 2.454 1.00 . A A . 21 VAL CB 1 1 7 2942 1 1 21 VAL CG1 C 11.074 -4.700 2.311 1.00 . A A . 21 VAL CG1 1 1 7 2943 1 1 21 VAL CG2 C 9.953 -3.098 3.864 1.00 . A A . 21 VAL CG2 1 1 7 2944 1 1 21 VAL H H 10.083 -0.809 1.867 1.00 . A A . 21 VAL H 1 1 7 2945 1 1 21 VAL HA H 12.374 -2.333 3.007 1.00 . A A . 21 VAL HA 1 1 7 2946 1 1 21 VAL HB H 9.739 -3.123 1.725 1.00 . A A . 21 VAL HB 1 1 7 2947 1 1 21 VAL HG11 H 11.909 -4.832 2.984 1.00 . A A . 21 VAL HG11 1 1 7 2948 1 1 21 VAL HG12 H 11.403 -4.859 1.295 1.00 . A A . 21 VAL HG12 1 1 7 2949 1 1 21 VAL HG13 H 10.300 -5.412 2.555 1.00 . A A . 21 VAL HG13 1 1 7 2950 1 1 21 VAL HG21 H 10.072 -2.069 4.173 1.00 . A A . 21 VAL HG21 1 1 7 2951 1 1 21 VAL HG22 H 10.481 -3.743 4.551 1.00 . A A . 21 VAL HG22 1 1 7 2952 1 1 21 VAL HG23 H 8.904 -3.354 3.864 1.00 . A A . 21 VAL HG23 1 1 7 2953 1 1 21 VAL N N 10.977 -0.921 2.259 1.00 . A A . 21 VAL N 1 1 7 2954 1 1 21 VAL O O 13.399 -3.050 0.787 1.00 . A A . 21 VAL O 1 1 7 2955 1 1 22 PHE C C 12.858 -0.983 -2.131 1.00 . A A . 22 PHE C 1 1 7 2956 1 1 22 PHE CA C 12.289 -2.296 -1.564 1.00 . A A . 22 PHE CA 1 1 7 2957 1 1 22 PHE CB C 11.134 -2.799 -2.436 1.00 . A A . 22 PHE CB 1 1 7 2958 1 1 22 PHE CD1 C 11.605 -5.247 -2.808 1.00 . A A . 22 PHE CD1 1 1 7 2959 1 1 22 PHE CD2 C 12.077 -3.683 -4.600 1.00 . A A . 22 PHE CD2 1 1 7 2960 1 1 22 PHE CE1 C 12.052 -6.303 -3.611 1.00 . A A . 22 PHE CE1 1 1 7 2961 1 1 22 PHE CE2 C 12.524 -4.739 -5.403 1.00 . A A . 22 PHE CE2 1 1 7 2962 1 1 22 PHE CG C 11.617 -3.937 -3.303 1.00 . A A . 22 PHE CG 1 1 7 2963 1 1 22 PHE CZ C 12.512 -6.049 -4.907 1.00 . A A . 22 PHE CZ 1 1 7 2964 1 1 22 PHE H H 10.818 -1.649 -0.121 1.00 . A A . 22 PHE H 1 1 7 2965 1 1 22 PHE HA H 13.062 -3.045 -1.516 1.00 . A A . 22 PHE HA 1 1 7 2966 1 1 22 PHE HB2 H 10.328 -3.144 -1.803 1.00 . A A . 22 PHE HB2 1 1 7 2967 1 1 22 PHE HB3 H 10.780 -1.995 -3.063 1.00 . A A . 22 PHE HB3 1 1 7 2968 1 1 22 PHE HD1 H 11.249 -5.442 -1.806 1.00 . A A . 22 PHE HD1 1 1 7 2969 1 1 22 PHE HD2 H 12.086 -2.673 -4.983 1.00 . A A . 22 PHE HD2 1 1 7 2970 1 1 22 PHE HE1 H 12.043 -7.313 -3.229 1.00 . A A . 22 PHE HE1 1 1 7 2971 1 1 22 PHE HE2 H 12.878 -4.544 -6.404 1.00 . A A . 22 PHE HE2 1 1 7 2972 1 1 22 PHE HZ H 12.858 -6.863 -5.528 1.00 . A A . 22 PHE HZ 1 1 7 2973 1 1 22 PHE N N 11.687 -2.088 -0.208 1.00 . A A . 22 PHE N 1 1 7 2974 1 1 22 PHE O O 13.194 -0.908 -3.298 1.00 . A A . 22 PHE O 1 1 7 2975 1 1 23 PHE C C 14.117 2.159 -0.669 1.00 . A A . 23 PHE C 1 1 7 2976 1 1 23 PHE CA C 13.522 1.347 -1.829 1.00 . A A . 23 PHE CA 1 1 7 2977 1 1 23 PHE CB C 12.320 2.075 -2.442 1.00 . A A . 23 PHE CB 1 1 7 2978 1 1 23 PHE CD1 C 13.454 2.913 -4.533 1.00 . A A . 23 PHE CD1 1 1 7 2979 1 1 23 PHE CD2 C 11.602 1.362 -4.753 1.00 . A A . 23 PHE CD2 1 1 7 2980 1 1 23 PHE CE1 C 13.586 2.952 -5.926 1.00 . A A . 23 PHE CE1 1 1 7 2981 1 1 23 PHE CE2 C 11.735 1.403 -6.146 1.00 . A A . 23 PHE CE2 1 1 7 2982 1 1 23 PHE CG C 12.462 2.117 -3.946 1.00 . A A . 23 PHE CG 1 1 7 2983 1 1 23 PHE CZ C 12.726 2.197 -6.732 1.00 . A A . 23 PHE CZ 1 1 7 2984 1 1 23 PHE H H 12.700 -0.033 -0.387 1.00 . A A . 23 PHE H 1 1 7 2985 1 1 23 PHE HA H 14.270 1.169 -2.585 1.00 . A A . 23 PHE HA 1 1 7 2986 1 1 23 PHE HB2 H 11.413 1.550 -2.181 1.00 . A A . 23 PHE HB2 1 1 7 2987 1 1 23 PHE HB3 H 12.274 3.083 -2.058 1.00 . A A . 23 PHE HB3 1 1 7 2988 1 1 23 PHE HD1 H 14.117 3.495 -3.911 1.00 . A A . 23 PHE HD1 1 1 7 2989 1 1 23 PHE HD2 H 10.836 0.748 -4.301 1.00 . A A . 23 PHE HD2 1 1 7 2990 1 1 23 PHE HE1 H 14.351 3.566 -6.379 1.00 . A A . 23 PHE HE1 1 1 7 2991 1 1 23 PHE HE2 H 11.072 0.819 -6.769 1.00 . A A . 23 PHE HE2 1 1 7 2992 1 1 23 PHE HZ H 12.828 2.228 -7.807 1.00 . A A . 23 PHE HZ 1 1 7 2993 1 1 23 PHE N N 12.973 0.047 -1.324 1.00 . A A . 23 PHE N 1 1 7 2994 1 1 23 PHE O O 13.835 3.333 -0.511 1.00 . A A . 23 PHE O 1 1 7 2995 1 1 24 TYR C C 16.953 1.710 1.598 1.00 . A A . 24 TYR C 1 1 7 2996 1 1 24 TYR CA C 15.555 2.270 1.293 1.00 . A A . 24 TYR CA 1 1 7 2997 1 1 24 TYR CB C 14.597 2.018 2.461 1.00 . A A . 24 TYR CB 1 1 7 2998 1 1 24 TYR CD1 C 13.589 4.298 2.838 1.00 . A A . 24 TYR CD1 1 1 7 2999 1 1 24 TYR CD2 C 15.159 3.431 4.470 1.00 . A A . 24 TYR CD2 1 1 7 3000 1 1 24 TYR CE1 C 13.448 5.466 3.594 1.00 . A A . 24 TYR CE1 1 1 7 3001 1 1 24 TYR CE2 C 15.018 4.600 5.226 1.00 . A A . 24 TYR CE2 1 1 7 3002 1 1 24 TYR CG C 14.445 3.280 3.276 1.00 . A A . 24 TYR CG 1 1 7 3003 1 1 24 TYR CZ C 14.163 5.618 4.788 1.00 . A A . 24 TYR CZ 1 1 7 3004 1 1 24 TYR H H 15.150 0.596 -0.007 1.00 . A A . 24 TYR H 1 1 7 3005 1 1 24 TYR HA H 15.610 3.327 1.084 1.00 . A A . 24 TYR HA 1 1 7 3006 1 1 24 TYR HB2 H 13.633 1.724 2.074 1.00 . A A . 24 TYR HB2 1 1 7 3007 1 1 24 TYR HB3 H 14.987 1.229 3.087 1.00 . A A . 24 TYR HB3 1 1 7 3008 1 1 24 TYR HD1 H 13.038 4.181 1.916 1.00 . A A . 24 TYR HD1 1 1 7 3009 1 1 24 TYR HD2 H 15.819 2.646 4.807 1.00 . A A . 24 TYR HD2 1 1 7 3010 1 1 24 TYR HE1 H 12.788 6.252 3.256 1.00 . A A . 24 TYR HE1 1 1 7 3011 1 1 24 TYR HE2 H 15.568 4.717 6.147 1.00 . A A . 24 TYR HE2 1 1 7 3012 1 1 24 TYR HH H 14.683 7.401 5.233 1.00 . A A . 24 TYR HH 1 1 7 3013 1 1 24 TYR N N 14.939 1.541 0.141 1.00 . A A . 24 TYR N 1 1 7 3014 1 1 24 TYR O O 17.333 1.546 2.744 1.00 . A A . 24 TYR O 1 1 7 3015 1 1 24 TYR OH O 14.023 6.771 5.533 1.00 . A A . 24 TYR OH 1 1 7 3016 1 1 25 LYS C C 20.141 1.762 0.132 1.00 . A A . 25 LYS C 1 1 7 3017 1 1 25 LYS CA C 19.091 0.859 0.791 1.00 . A A . 25 LYS CA 1 1 7 3018 1 1 25 LYS CB C 19.072 -0.523 0.126 1.00 . A A . 25 LYS CB 1 1 7 3019 1 1 25 LYS CD C 17.828 -2.693 0.101 1.00 . A A . 25 LYS CD 1 1 7 3020 1 1 25 LYS CE C 16.828 -3.569 0.866 1.00 . A A . 25 LYS CE 1 1 7 3021 1 1 25 LYS CG C 18.224 -1.489 0.960 1.00 . A A . 25 LYS CG 1 1 7 3022 1 1 25 LYS H H 17.385 1.552 -0.335 1.00 . A A . 25 LYS H 1 1 7 3023 1 1 25 LYS HA H 19.294 0.755 1.846 1.00 . A A . 25 LYS HA 1 1 7 3024 1 1 25 LYS HB2 H 18.654 -0.437 -0.866 1.00 . A A . 25 LYS HB2 1 1 7 3025 1 1 25 LYS HB3 H 20.082 -0.901 0.059 1.00 . A A . 25 LYS HB3 1 1 7 3026 1 1 25 LYS HD2 H 17.373 -2.345 -0.817 1.00 . A A . 25 LYS HD2 1 1 7 3027 1 1 25 LYS HD3 H 18.708 -3.273 -0.133 1.00 . A A . 25 LYS HD3 1 1 7 3028 1 1 25 LYS HE2 H 16.438 -3.032 1.721 1.00 . A A . 25 LYS HE2 1 1 7 3029 1 1 25 LYS HE3 H 16.023 -3.874 0.216 1.00 . A A . 25 LYS HE3 1 1 7 3030 1 1 25 LYS HG2 H 18.796 -1.826 1.812 1.00 . A A . 25 LYS HG2 1 1 7 3031 1 1 25 LYS HG3 H 17.332 -0.984 1.301 1.00 . A A . 25 LYS HG3 1 1 7 3032 1 1 25 LYS HZ1 H 17.997 -5.253 0.481 1.00 . A A . 25 LYS HZ1 1 1 7 3033 1 1 25 LYS HZ2 H 16.982 -5.406 1.835 1.00 . A A . 25 LYS HZ2 1 1 7 3034 1 1 25 LYS HZ3 H 18.388 -4.458 1.928 1.00 . A A . 25 LYS HZ3 1 1 7 3035 1 1 25 LYS N N 17.718 1.413 0.576 1.00 . A A . 25 LYS N 1 1 7 3036 1 1 25 LYS NZ N 17.608 -4.761 1.311 1.00 . A A . 25 LYS NZ 1 1 7 3037 1 1 25 LYS O O 21.053 2.178 0.827 1.00 . A A . 25 LYS O 1 1 7 3038 1 1 25 LYS OXT O 20.017 2.022 -1.055 1.00 . A A . 25 LYS OXT 1 1 8 3039 1 1 1 HIS C C -20.981 2.232 3.910 1.00 . A A . 1 HIS C 1 1 8 3040 1 1 1 HIS CA C -22.451 1.985 4.283 1.00 . A A . 1 HIS CA 1 1 8 3041 1 1 1 HIS CB C -23.376 2.965 3.550 1.00 . A A . 1 HIS CB 1 1 8 3042 1 1 1 HIS CD2 C -24.544 1.866 1.467 1.00 . A A . 1 HIS CD2 1 1 8 3043 1 1 1 HIS CE1 C -23.017 2.288 -0.010 1.00 . A A . 1 HIS CE1 1 1 8 3044 1 1 1 HIS CG C -23.537 2.535 2.116 1.00 . A A . 1 HIS CG 1 1 8 3045 1 1 1 HIS HA H -22.732 0.970 4.049 1.00 . A A . 1 HIS HA 1 1 8 3046 1 1 1 HIS HB2 H -24.343 2.976 4.032 1.00 . A A . 1 HIS HB2 1 1 8 3047 1 1 1 HIS HB3 H -22.948 3.957 3.581 1.00 . A A . 1 HIS HB3 1 1 8 3048 1 1 1 HIS HD1 H -21.721 3.258 1.297 1.00 . A A . 1 HIS HD1 1 1 8 3049 1 1 1 HIS HD2 H -25.456 1.515 1.927 1.00 . A A . 1 HIS HD2 1 1 8 3050 1 1 1 HIS HE1 H -22.471 2.341 -0.941 1.00 . A A . 1 HIS HE1 1 1 8 3051 1 1 1 HIS N N -22.668 2.261 5.736 1.00 . A A . 1 HIS N 1 1 8 3052 1 1 1 HIS ND1 N -22.573 2.793 1.155 1.00 . A A . 1 HIS ND1 1 1 8 3053 1 1 1 HIS NE2 N -24.215 1.713 0.123 1.00 . A A . 1 HIS NE2 1 1 8 3054 1 1 1 HIS O O -20.655 3.180 3.218 1.00 . A A . 1 HIS O 1 1 8 3055 1 1 2 ALA C C -17.885 0.246 4.231 1.00 . A A . 2 ALA C 1 1 8 3056 1 1 2 ALA CA C -18.642 1.567 4.046 1.00 . A A . 2 ALA CA 1 1 8 3057 1 1 2 ALA CB C -18.141 2.616 5.041 1.00 . A A . 2 ALA CB 1 1 8 3058 1 1 2 ALA H H -20.377 0.630 4.925 1.00 . A A . 2 ALA H 1 1 8 3059 1 1 2 ALA HA H -18.524 1.930 3.037 1.00 . A A . 2 ALA HA 1 1 8 3060 1 1 2 ALA HB1 H -18.583 2.433 6.009 1.00 . A A . 2 ALA HB1 1 1 8 3061 1 1 2 ALA HB2 H -18.422 3.601 4.698 1.00 . A A . 2 ALA HB2 1 1 8 3062 1 1 2 ALA HB3 H -17.066 2.554 5.118 1.00 . A A . 2 ALA HB3 1 1 8 3063 1 1 2 ALA N N -20.091 1.386 4.368 1.00 . A A . 2 ALA N 1 1 8 3064 1 1 2 ALA O O -17.831 -0.298 5.319 1.00 . A A . 2 ALA O 1 1 8 3065 1 1 3 TRP C C -15.456 -1.658 2.196 1.00 . A A . 3 TRP C 1 1 8 3066 1 1 3 TRP CA C -16.541 -1.559 3.284 1.00 . A A . 3 TRP CA 1 1 8 3067 1 1 3 TRP CB C -17.593 -2.667 3.108 1.00 . A A . 3 TRP CB 1 1 8 3068 1 1 3 TRP CD1 C -17.831 -3.037 0.612 1.00 . A A . 3 TRP CD1 1 1 8 3069 1 1 3 TRP CD2 C -19.540 -1.858 1.479 1.00 . A A . 3 TRP CD2 1 1 8 3070 1 1 3 TRP CE2 C -19.797 -1.990 0.093 1.00 . A A . 3 TRP CE2 1 1 8 3071 1 1 3 TRP CE3 C -20.471 -1.153 2.262 1.00 . A A . 3 TRP CE3 1 1 8 3072 1 1 3 TRP CG C -18.283 -2.531 1.783 1.00 . A A . 3 TRP CG 1 1 8 3073 1 1 3 TRP CH2 C -21.853 -0.745 0.300 1.00 . A A . 3 TRP CH2 1 1 8 3074 1 1 3 TRP CZ2 C -20.938 -1.442 -0.493 1.00 . A A . 3 TRP CZ2 1 1 8 3075 1 1 3 TRP CZ3 C -21.621 -0.601 1.675 1.00 . A A . 3 TRP CZ3 1 1 8 3076 1 1 3 TRP H H -17.363 0.189 2.310 1.00 . A A . 3 TRP H 1 1 8 3077 1 1 3 TRP HA H -16.091 -1.640 4.261 1.00 . A A . 3 TRP HA 1 1 8 3078 1 1 3 TRP HB2 H -17.106 -3.631 3.157 1.00 . A A . 3 TRP HB2 1 1 8 3079 1 1 3 TRP HB3 H -18.322 -2.596 3.901 1.00 . A A . 3 TRP HB3 1 1 8 3080 1 1 3 TRP HD1 H -16.917 -3.599 0.481 1.00 . A A . 3 TRP HD1 1 1 8 3081 1 1 3 TRP HE1 H -18.634 -2.963 -1.335 1.00 . A A . 3 TRP HE1 1 1 8 3082 1 1 3 TRP HE3 H -20.300 -1.037 3.321 1.00 . A A . 3 TRP HE3 1 1 8 3083 1 1 3 TRP HH2 H -22.739 -0.319 -0.146 1.00 . A A . 3 TRP HH2 1 1 8 3084 1 1 3 TRP HZ2 H -21.113 -1.556 -1.553 1.00 . A A . 3 TRP HZ2 1 1 8 3085 1 1 3 TRP HZ3 H -22.329 -0.061 2.285 1.00 . A A . 3 TRP HZ3 1 1 8 3086 1 1 3 TRP N N -17.301 -0.271 3.175 1.00 . A A . 3 TRP N 1 1 8 3087 1 1 3 TRP NE1 N -18.728 -2.716 -0.392 1.00 . A A . 3 TRP NE1 1 1 8 3088 1 1 3 TRP O O -15.076 -2.742 1.791 1.00 . A A . 3 TRP O 1 1 8 3089 1 1 4 TYR C C -12.624 0.181 1.111 1.00 . A A . 4 TYR C 1 1 8 3090 1 1 4 TYR CA C -13.882 -0.592 0.670 1.00 . A A . 4 TYR CA 1 1 8 3091 1 1 4 TYR CB C -14.519 0.042 -0.581 1.00 . A A . 4 TYR CB 1 1 8 3092 1 1 4 TYR CD1 C -15.992 1.951 0.186 1.00 . A A . 4 TYR CD1 1 1 8 3093 1 1 4 TYR CD2 C -13.807 2.462 -0.733 1.00 . A A . 4 TYR CD2 1 1 8 3094 1 1 4 TYR CE1 C -16.232 3.319 0.373 1.00 . A A . 4 TYR CE1 1 1 8 3095 1 1 4 TYR CE2 C -14.047 3.828 -0.545 1.00 . A A . 4 TYR CE2 1 1 8 3096 1 1 4 TYR CG C -14.778 1.522 -0.366 1.00 . A A . 4 TYR CG 1 1 8 3097 1 1 4 TYR CZ C -15.260 4.257 0.008 1.00 . A A . 4 TYR CZ 1 1 8 3098 1 1 4 TYR H H -15.254 0.320 2.069 1.00 . A A . 4 TYR H 1 1 8 3099 1 1 4 TYR HA H -13.623 -1.617 0.459 1.00 . A A . 4 TYR HA 1 1 8 3100 1 1 4 TYR HB2 H -13.853 -0.084 -1.421 1.00 . A A . 4 TYR HB2 1 1 8 3101 1 1 4 TYR HB3 H -15.455 -0.456 -0.793 1.00 . A A . 4 TYR HB3 1 1 8 3102 1 1 4 TYR HD1 H -16.743 1.228 0.469 1.00 . A A . 4 TYR HD1 1 1 8 3103 1 1 4 TYR HD2 H -12.872 2.133 -1.160 1.00 . A A . 4 TYR HD2 1 1 8 3104 1 1 4 TYR HE1 H -17.168 3.648 0.800 1.00 . A A . 4 TYR HE1 1 1 8 3105 1 1 4 TYR HE2 H -13.297 4.552 -0.827 1.00 . A A . 4 TYR HE2 1 1 8 3106 1 1 4 TYR HH H -15.735 5.983 -0.660 1.00 . A A . 4 TYR HH 1 1 8 3107 1 1 4 TYR N N -14.945 -0.544 1.726 1.00 . A A . 4 TYR N 1 1 8 3108 1 1 4 TYR O O -11.785 0.528 0.298 1.00 . A A . 4 TYR O 1 1 8 3109 1 1 4 TYR OH O -15.496 5.604 0.190 1.00 . A A . 4 TYR OH 1 1 8 3110 1 1 5 SER C C -10.056 0.244 2.981 1.00 . A A . 5 SER C 1 1 8 3111 1 1 5 SER CA C -11.272 1.178 2.882 1.00 . A A . 5 SER CA 1 1 8 3112 1 1 5 SER CB C -11.658 1.702 4.266 1.00 . A A . 5 SER CB 1 1 8 3113 1 1 5 SER H H -13.158 0.138 3.029 1.00 . A A . 5 SER H 1 1 8 3114 1 1 5 SER HA H -11.052 2.003 2.228 1.00 . A A . 5 SER HA 1 1 8 3115 1 1 5 SER HB2 H -10.832 2.252 4.688 1.00 . A A . 5 SER HB2 1 1 8 3116 1 1 5 SER HB3 H -12.515 2.357 4.176 1.00 . A A . 5 SER HB3 1 1 8 3117 1 1 5 SER HG H -12.429 0.949 5.890 1.00 . A A . 5 SER HG 1 1 8 3118 1 1 5 SER N N -12.478 0.438 2.390 1.00 . A A . 5 SER N 1 1 8 3119 1 1 5 SER O O -8.929 0.693 3.062 1.00 . A A . 5 SER O 1 1 8 3120 1 1 5 SER OG O -11.972 0.606 5.118 1.00 . A A . 5 SER OG 1 1 8 3121 1 1 6 HIS C C -8.432 -2.126 1.706 1.00 . A A . 6 HIS C 1 1 8 3122 1 1 6 HIS CA C -9.130 -2.006 3.063 1.00 . A A . 6 HIS CA 1 1 8 3123 1 1 6 HIS CB C -9.755 -3.344 3.474 1.00 . A A . 6 HIS CB 1 1 8 3124 1 1 6 HIS CD2 C -7.545 -4.137 4.660 1.00 . A A . 6 HIS CD2 1 1 8 3125 1 1 6 HIS CE1 C -7.589 -6.216 4.052 1.00 . A A . 6 HIS CE1 1 1 8 3126 1 1 6 HIS CG C -8.673 -4.304 3.895 1.00 . A A . 6 HIS CG 1 1 8 3127 1 1 6 HIS H H -11.190 -1.387 2.906 1.00 . A A . 6 HIS H 1 1 8 3128 1 1 6 HIS HA H -8.430 -1.680 3.810 1.00 . A A . 6 HIS HA 1 1 8 3129 1 1 6 HIS HB2 H -10.435 -3.185 4.299 1.00 . A A . 6 HIS HB2 1 1 8 3130 1 1 6 HIS HB3 H -10.296 -3.760 2.638 1.00 . A A . 6 HIS HB3 1 1 8 3131 1 1 6 HIS HD1 H -9.358 -6.081 2.964 1.00 . A A . 6 HIS HD1 1 1 8 3132 1 1 6 HIS HD2 H -7.235 -3.210 5.119 1.00 . A A . 6 HIS HD2 1 1 8 3133 1 1 6 HIS HE1 H -7.331 -7.258 3.926 1.00 . A A . 6 HIS HE1 1 1 8 3134 1 1 6 HIS N N -10.275 -1.048 2.974 1.00 . A A . 6 HIS N 1 1 8 3135 1 1 6 HIS ND1 N -8.680 -5.639 3.518 1.00 . A A . 6 HIS ND1 1 1 8 3136 1 1 6 HIS NE2 N -6.862 -5.346 4.758 1.00 . A A . 6 HIS NE2 1 1 8 3137 1 1 6 HIS O O -7.236 -2.338 1.634 1.00 . A A . 6 HIS O 1 1 8 3138 1 1 7 TYR C C -7.545 -0.946 -0.917 1.00 . A A . 7 TYR C 1 1 8 3139 1 1 7 TYR CA C -8.545 -2.085 -0.726 1.00 . A A . 7 TYR CA 1 1 8 3140 1 1 7 TYR CB C -9.701 -1.961 -1.727 1.00 . A A . 7 TYR CB 1 1 8 3141 1 1 7 TYR CD1 C -10.241 -4.429 -1.641 1.00 . A A . 7 TYR CD1 1 1 8 3142 1 1 7 TYR CD2 C -12.024 -2.829 -1.266 1.00 . A A . 7 TYR CD2 1 1 8 3143 1 1 7 TYR CE1 C -11.149 -5.480 -1.469 1.00 . A A . 7 TYR CE1 1 1 8 3144 1 1 7 TYR CE2 C -12.932 -3.879 -1.094 1.00 . A A . 7 TYR CE2 1 1 8 3145 1 1 7 TYR CG C -10.678 -3.102 -1.540 1.00 . A A . 7 TYR CG 1 1 8 3146 1 1 7 TYR CZ C -12.495 -5.205 -1.196 1.00 . A A . 7 TYR CZ 1 1 8 3147 1 1 7 TYR H H -10.126 -1.812 0.721 1.00 . A A . 7 TYR H 1 1 8 3148 1 1 7 TYR HA H -8.052 -3.032 -0.842 1.00 . A A . 7 TYR HA 1 1 8 3149 1 1 7 TYR HB2 H -10.212 -1.023 -1.569 1.00 . A A . 7 TYR HB2 1 1 8 3150 1 1 7 TYR HB3 H -9.307 -1.989 -2.732 1.00 . A A . 7 TYR HB3 1 1 8 3151 1 1 7 TYR HD1 H -9.203 -4.641 -1.852 1.00 . A A . 7 TYR HD1 1 1 8 3152 1 1 7 TYR HD2 H -12.361 -1.805 -1.188 1.00 . A A . 7 TYR HD2 1 1 8 3153 1 1 7 TYR HE1 H -10.813 -6.503 -1.547 1.00 . A A . 7 TYR HE1 1 1 8 3154 1 1 7 TYR HE2 H -13.970 -3.668 -0.883 1.00 . A A . 7 TYR HE2 1 1 8 3155 1 1 7 TYR HH H -13.544 -6.645 -1.886 1.00 . A A . 7 TYR HH 1 1 8 3156 1 1 7 TYR N N -9.168 -1.987 0.632 1.00 . A A . 7 TYR N 1 1 8 3157 1 1 7 TYR O O -6.416 -1.161 -1.318 1.00 . A A . 7 TYR O 1 1 8 3158 1 1 7 TYR OH O -13.392 -6.241 -1.027 1.00 . A A . 7 TYR OH 1 1 8 3159 1 1 8 VAL C C -5.845 1.265 0.231 1.00 . A A . 8 VAL C 1 1 8 3160 1 1 8 VAL CA C -7.012 1.420 -0.755 1.00 . A A . 8 VAL CA 1 1 8 3161 1 1 8 VAL CB C -7.850 2.675 -0.452 1.00 . A A . 8 VAL CB 1 1 8 3162 1 1 8 VAL CG1 C -8.293 2.685 1.014 1.00 . A A . 8 VAL CG1 1 1 8 3163 1 1 8 VAL CG2 C -7.013 3.927 -0.737 1.00 . A A . 8 VAL CG2 1 1 8 3164 1 1 8 VAL H H -8.858 0.399 -0.279 1.00 . A A . 8 VAL H 1 1 8 3165 1 1 8 VAL HA H -6.636 1.466 -1.762 1.00 . A A . 8 VAL HA 1 1 8 3166 1 1 8 VAL HB H -8.724 2.680 -1.087 1.00 . A A . 8 VAL HB 1 1 8 3167 1 1 8 VAL HG11 H -9.007 1.893 1.178 1.00 . A A . 8 VAL HG11 1 1 8 3168 1 1 8 VAL HG12 H -8.752 3.635 1.244 1.00 . A A . 8 VAL HG12 1 1 8 3169 1 1 8 VAL HG13 H -7.435 2.537 1.652 1.00 . A A . 8 VAL HG13 1 1 8 3170 1 1 8 VAL HG21 H -7.633 4.805 -0.629 1.00 . A A . 8 VAL HG21 1 1 8 3171 1 1 8 VAL HG22 H -6.627 3.881 -1.744 1.00 . A A . 8 VAL HG22 1 1 8 3172 1 1 8 VAL HG23 H -6.192 3.978 -0.037 1.00 . A A . 8 VAL HG23 1 1 8 3173 1 1 8 VAL N N -7.947 0.262 -0.613 1.00 . A A . 8 VAL N 1 1 8 3174 1 1 8 VAL O O -4.747 1.725 -0.017 1.00 . A A . 8 VAL O 1 1 8 3175 1 1 9 LEU C C -4.008 -0.688 1.803 1.00 . A A . 9 LEU C 1 1 8 3176 1 1 9 LEU CA C -4.976 0.380 2.327 1.00 . A A . 9 LEU CA 1 1 8 3177 1 1 9 LEU CB C -5.674 -0.104 3.602 1.00 . A A . 9 LEU CB 1 1 8 3178 1 1 9 LEU CD1 C -4.978 1.717 5.168 1.00 . A A . 9 LEU CD1 1 1 8 3179 1 1 9 LEU CD2 C -5.252 -0.621 6.009 1.00 . A A . 9 LEU CD2 1 1 8 3180 1 1 9 LEU CG C -4.811 0.236 4.819 1.00 . A A . 9 LEU CG 1 1 8 3181 1 1 9 LEU H H -6.961 0.216 1.503 1.00 . A A . 9 LEU H 1 1 8 3182 1 1 9 LEU HA H -4.454 1.304 2.518 1.00 . A A . 9 LEU HA 1 1 8 3183 1 1 9 LEU HB2 H -6.635 0.381 3.694 1.00 . A A . 9 LEU HB2 1 1 8 3184 1 1 9 LEU HB3 H -5.814 -1.173 3.551 1.00 . A A . 9 LEU HB3 1 1 8 3185 1 1 9 LEU HD11 H -4.504 2.321 4.410 1.00 . A A . 9 LEU HD11 1 1 8 3186 1 1 9 LEU HD12 H -4.520 1.915 6.125 1.00 . A A . 9 LEU HD12 1 1 8 3187 1 1 9 LEU HD13 H -6.030 1.960 5.215 1.00 . A A . 9 LEU HD13 1 1 8 3188 1 1 9 LEU HD21 H -6.330 -0.663 6.044 1.00 . A A . 9 LEU HD21 1 1 8 3189 1 1 9 LEU HD22 H -4.879 -0.185 6.924 1.00 . A A . 9 LEU HD22 1 1 8 3190 1 1 9 LEU HD23 H -4.856 -1.620 5.899 1.00 . A A . 9 LEU HD23 1 1 8 3191 1 1 9 LEU HG H -3.775 0.035 4.592 1.00 . A A . 9 LEU HG 1 1 8 3192 1 1 9 LEU N N -6.072 0.594 1.335 1.00 . A A . 9 LEU N 1 1 8 3193 1 1 9 LEU O O -2.810 -0.599 2.000 1.00 . A A . 9 LEU O 1 1 8 3194 1 1 10 LYS C C -2.711 -2.169 -0.499 1.00 . A A . 10 LYS C 1 1 8 3195 1 1 10 LYS CA C -3.634 -2.762 0.571 1.00 . A A . 10 LYS CA 1 1 8 3196 1 1 10 LYS CB C -4.582 -3.797 -0.045 1.00 . A A . 10 LYS CB 1 1 8 3197 1 1 10 LYS CD C -4.551 -6.284 -0.323 1.00 . A A . 10 LYS CD 1 1 8 3198 1 1 10 LYS CE C -3.713 -7.483 -0.784 1.00 . A A . 10 LYS CE 1 1 8 3199 1 1 10 LYS CG C -3.775 -4.988 -0.573 1.00 . A A . 10 LYS CG 1 1 8 3200 1 1 10 LYS H H -5.492 -1.734 0.970 1.00 . A A . 10 LYS H 1 1 8 3201 1 1 10 LYS HA H -3.054 -3.215 1.360 1.00 . A A . 10 LYS HA 1 1 8 3202 1 1 10 LYS HB2 H -5.279 -4.137 0.707 1.00 . A A . 10 LYS HB2 1 1 8 3203 1 1 10 LYS HB3 H -5.127 -3.344 -0.861 1.00 . A A . 10 LYS HB3 1 1 8 3204 1 1 10 LYS HD2 H -4.766 -6.377 0.731 1.00 . A A . 10 LYS HD2 1 1 8 3205 1 1 10 LYS HD3 H -5.476 -6.261 -0.878 1.00 . A A . 10 LYS HD3 1 1 8 3206 1 1 10 LYS HE2 H -4.349 -8.345 -0.941 1.00 . A A . 10 LYS HE2 1 1 8 3207 1 1 10 LYS HE3 H -3.179 -7.242 -1.691 1.00 . A A . 10 LYS HE3 1 1 8 3208 1 1 10 LYS HG2 H -3.607 -4.865 -1.633 1.00 . A A . 10 LYS HG2 1 1 8 3209 1 1 10 LYS HG3 H -2.826 -5.034 -0.061 1.00 . A A . 10 LYS HG3 1 1 8 3210 1 1 10 LYS HZ1 H -2.015 -7.004 0.326 1.00 . A A . 10 LYS HZ1 1 1 8 3211 1 1 10 LYS HZ2 H -2.302 -8.671 0.184 1.00 . A A . 10 LYS HZ2 1 1 8 3212 1 1 10 LYS HZ3 H -3.248 -7.731 1.235 1.00 . A A . 10 LYS HZ3 1 1 8 3213 1 1 10 LYS N N -4.521 -1.692 1.124 1.00 . A A . 10 LYS N 1 1 8 3214 1 1 10 LYS NZ N -2.747 -7.742 0.323 1.00 . A A . 10 LYS NZ 1 1 8 3215 1 1 10 LYS O O -1.536 -2.474 -0.550 1.00 . A A . 10 LYS O 1 1 8 3216 1 1 11 PHE C C -1.314 0.193 -1.757 1.00 . A A . 11 PHE C 1 1 8 3217 1 1 11 PHE CA C -2.393 -0.682 -2.406 1.00 . A A . 11 PHE CA 1 1 8 3218 1 1 11 PHE CB C -3.363 0.173 -3.231 1.00 . A A . 11 PHE CB 1 1 8 3219 1 1 11 PHE CD1 C -1.978 1.860 -4.495 1.00 . A A . 11 PHE CD1 1 1 8 3220 1 1 11 PHE CD2 C -2.741 -0.126 -5.659 1.00 . A A . 11 PHE CD2 1 1 8 3221 1 1 11 PHE CE1 C -1.343 2.301 -5.663 1.00 . A A . 11 PHE CE1 1 1 8 3222 1 1 11 PHE CE2 C -2.106 0.315 -6.826 1.00 . A A . 11 PHE CE2 1 1 8 3223 1 1 11 PHE CG C -2.676 0.647 -4.492 1.00 . A A . 11 PHE CG 1 1 8 3224 1 1 11 PHE CZ C -1.408 1.528 -6.828 1.00 . A A . 11 PHE CZ 1 1 8 3225 1 1 11 PHE H H -4.187 -1.079 -1.273 1.00 . A A . 11 PHE H 1 1 8 3226 1 1 11 PHE HA H -1.943 -1.438 -3.030 1.00 . A A . 11 PHE HA 1 1 8 3227 1 1 11 PHE HB2 H -4.229 -0.417 -3.492 1.00 . A A . 11 PHE HB2 1 1 8 3228 1 1 11 PHE HB3 H -3.673 1.028 -2.648 1.00 . A A . 11 PHE HB3 1 1 8 3229 1 1 11 PHE HD1 H -1.928 2.457 -3.596 1.00 . A A . 11 PHE HD1 1 1 8 3230 1 1 11 PHE HD2 H -3.280 -1.062 -5.657 1.00 . A A . 11 PHE HD2 1 1 8 3231 1 1 11 PHE HE1 H -0.804 3.237 -5.664 1.00 . A A . 11 PHE HE1 1 1 8 3232 1 1 11 PHE HE2 H -2.156 -0.282 -7.725 1.00 . A A . 11 PHE HE2 1 1 8 3233 1 1 11 PHE HZ H -0.919 1.867 -7.730 1.00 . A A . 11 PHE HZ 1 1 8 3234 1 1 11 PHE N N -3.237 -1.313 -1.344 1.00 . A A . 11 PHE N 1 1 8 3235 1 1 11 PHE O O -0.159 0.148 -2.138 1.00 . A A . 11 PHE O 1 1 8 3236 1 1 12 PHE C C 0.402 0.980 0.571 1.00 . A A . 12 PHE C 1 1 8 3237 1 1 12 PHE CA C -0.675 1.850 -0.089 1.00 . A A . 12 PHE CA 1 1 8 3238 1 1 12 PHE CB C -1.460 2.637 0.968 1.00 . A A . 12 PHE CB 1 1 8 3239 1 1 12 PHE CD1 C -0.294 4.873 0.933 1.00 . A A . 12 PHE CD1 1 1 8 3240 1 1 12 PHE CD2 C -2.527 4.708 0.002 1.00 . A A . 12 PHE CD2 1 1 8 3241 1 1 12 PHE CE1 C -0.262 6.237 0.615 1.00 . A A . 12 PHE CE1 1 1 8 3242 1 1 12 PHE CE2 C -2.496 6.071 -0.316 1.00 . A A . 12 PHE CE2 1 1 8 3243 1 1 12 PHE CG C -1.426 4.108 0.627 1.00 . A A . 12 PHE CG 1 1 8 3244 1 1 12 PHE CZ C -1.363 6.836 -0.009 1.00 . A A . 12 PHE CZ 1 1 8 3245 1 1 12 PHE H H -2.618 0.991 -0.481 1.00 . A A . 12 PHE H 1 1 8 3246 1 1 12 PHE HA H -0.226 2.529 -0.797 1.00 . A A . 12 PHE HA 1 1 8 3247 1 1 12 PHE HB2 H -2.483 2.294 0.989 1.00 . A A . 12 PHE HB2 1 1 8 3248 1 1 12 PHE HB3 H -1.009 2.484 1.938 1.00 . A A . 12 PHE HB3 1 1 8 3249 1 1 12 PHE HD1 H 0.556 4.412 1.415 1.00 . A A . 12 PHE HD1 1 1 8 3250 1 1 12 PHE HD2 H -3.401 4.118 -0.234 1.00 . A A . 12 PHE HD2 1 1 8 3251 1 1 12 PHE HE1 H 0.611 6.826 0.851 1.00 . A A . 12 PHE HE1 1 1 8 3252 1 1 12 PHE HE2 H -3.345 6.533 -0.797 1.00 . A A . 12 PHE HE2 1 1 8 3253 1 1 12 PHE HZ H -1.339 7.887 -0.254 1.00 . A A . 12 PHE HZ 1 1 8 3254 1 1 12 PHE N N -1.682 0.980 -0.773 1.00 . A A . 12 PHE N 1 1 8 3255 1 1 12 PHE O O 1.575 1.277 0.499 1.00 . A A . 12 PHE O 1 1 8 3256 1 1 13 LEU C C 1.838 -1.733 0.776 1.00 . A A . 13 LEU C 1 1 8 3257 1 1 13 LEU CA C 1.022 -0.995 1.847 1.00 . A A . 13 LEU CA 1 1 8 3258 1 1 13 LEU CB C 0.211 -1.986 2.686 1.00 . A A . 13 LEU CB 1 1 8 3259 1 1 13 LEU CD1 C 1.237 -1.624 4.939 1.00 . A A . 13 LEU CD1 1 1 8 3260 1 1 13 LEU CD2 C 0.493 -3.910 4.257 1.00 . A A . 13 LEU CD2 1 1 8 3261 1 1 13 LEU CG C 1.109 -2.598 3.765 1.00 . A A . 13 LEU CG 1 1 8 3262 1 1 13 LEU H H -0.943 -0.331 1.238 1.00 . A A . 13 LEU H 1 1 8 3263 1 1 13 LEU HA H 1.675 -0.420 2.484 1.00 . A A . 13 LEU HA 1 1 8 3264 1 1 13 LEU HB2 H -0.616 -1.471 3.154 1.00 . A A . 13 LEU HB2 1 1 8 3265 1 1 13 LEU HB3 H -0.168 -2.772 2.048 1.00 . A A . 13 LEU HB3 1 1 8 3266 1 1 13 LEU HD11 H 1.903 -0.819 4.667 1.00 . A A . 13 LEU HD11 1 1 8 3267 1 1 13 LEU HD12 H 1.633 -2.145 5.797 1.00 . A A . 13 LEU HD12 1 1 8 3268 1 1 13 LEU HD13 H 0.264 -1.221 5.180 1.00 . A A . 13 LEU HD13 1 1 8 3269 1 1 13 LEU HD21 H 0.625 -4.673 3.504 1.00 . A A . 13 LEU HD21 1 1 8 3270 1 1 13 LEU HD22 H -0.560 -3.766 4.446 1.00 . A A . 13 LEU HD22 1 1 8 3271 1 1 13 LEU HD23 H 0.983 -4.217 5.170 1.00 . A A . 13 LEU HD23 1 1 8 3272 1 1 13 LEU HG H 2.088 -2.791 3.351 1.00 . A A . 13 LEU HG 1 1 8 3273 1 1 13 LEU N N 0.012 -0.102 1.201 1.00 . A A . 13 LEU N 1 1 8 3274 1 1 13 LEU O O 2.988 -2.071 0.987 1.00 . A A . 13 LEU O 1 1 8 3275 1 1 14 LEU C C 2.971 -1.723 -2.152 1.00 . A A . 14 LEU C 1 1 8 3276 1 1 14 LEU CA C 1.999 -2.685 -1.461 1.00 . A A . 14 LEU CA 1 1 8 3277 1 1 14 LEU CB C 0.912 -3.163 -2.439 1.00 . A A . 14 LEU CB 1 1 8 3278 1 1 14 LEU CD1 C 2.494 -3.985 -4.207 1.00 . A A . 14 LEU CD1 1 1 8 3279 1 1 14 LEU CD2 C 1.927 -5.457 -2.264 1.00 . A A . 14 LEU CD2 1 1 8 3280 1 1 14 LEU CG C 1.390 -4.392 -3.228 1.00 . A A . 14 LEU CG 1 1 8 3281 1 1 14 LEU H H 0.330 -1.692 -0.522 1.00 . A A . 14 LEU H 1 1 8 3282 1 1 14 LEU HA H 2.531 -3.525 -1.059 1.00 . A A . 14 LEU HA 1 1 8 3283 1 1 14 LEU HB2 H 0.023 -3.423 -1.884 1.00 . A A . 14 LEU HB2 1 1 8 3284 1 1 14 LEU HB3 H 0.680 -2.366 -3.130 1.00 . A A . 14 LEU HB3 1 1 8 3285 1 1 14 LEU HD11 H 2.356 -2.954 -4.497 1.00 . A A . 14 LEU HD11 1 1 8 3286 1 1 14 LEU HD12 H 2.446 -4.614 -5.082 1.00 . A A . 14 LEU HD12 1 1 8 3287 1 1 14 LEU HD13 H 3.457 -4.100 -3.732 1.00 . A A . 14 LEU HD13 1 1 8 3288 1 1 14 LEU HD21 H 1.289 -5.511 -1.394 1.00 . A A . 14 LEU HD21 1 1 8 3289 1 1 14 LEU HD22 H 2.930 -5.196 -1.959 1.00 . A A . 14 LEU HD22 1 1 8 3290 1 1 14 LEU HD23 H 1.941 -6.416 -2.760 1.00 . A A . 14 LEU HD23 1 1 8 3291 1 1 14 LEU HG H 0.558 -4.799 -3.783 1.00 . A A . 14 LEU HG 1 1 8 3292 1 1 14 LEU N N 1.255 -1.978 -0.373 1.00 . A A . 14 LEU N 1 1 8 3293 1 1 14 LEU O O 4.058 -2.103 -2.544 1.00 . A A . 14 LEU O 1 1 8 3294 1 1 15 VAL C C 4.276 1.293 -1.915 1.00 . A A . 15 VAL C 1 1 8 3295 1 1 15 VAL CA C 3.483 0.510 -2.969 1.00 . A A . 15 VAL CA 1 1 8 3296 1 1 15 VAL CB C 2.543 1.438 -3.751 1.00 . A A . 15 VAL CB 1 1 8 3297 1 1 15 VAL CG1 C 3.348 2.582 -4.379 1.00 . A A . 15 VAL CG1 1 1 8 3298 1 1 15 VAL CG2 C 1.844 0.646 -4.861 1.00 . A A . 15 VAL CG2 1 1 8 3299 1 1 15 VAL H H 1.705 -0.206 -1.977 1.00 . A A . 15 VAL H 1 1 8 3300 1 1 15 VAL HA H 4.156 0.010 -3.650 1.00 . A A . 15 VAL HA 1 1 8 3301 1 1 15 VAL HB H 1.802 1.848 -3.079 1.00 . A A . 15 VAL HB 1 1 8 3302 1 1 15 VAL HG11 H 4.252 2.187 -4.817 1.00 . A A . 15 VAL HG11 1 1 8 3303 1 1 15 VAL HG12 H 3.601 3.303 -3.617 1.00 . A A . 15 VAL HG12 1 1 8 3304 1 1 15 VAL HG13 H 2.754 3.061 -5.144 1.00 . A A . 15 VAL HG13 1 1 8 3305 1 1 15 VAL HG21 H 0.812 0.956 -4.930 1.00 . A A . 15 VAL HG21 1 1 8 3306 1 1 15 VAL HG22 H 1.887 -0.410 -4.633 1.00 . A A . 15 VAL HG22 1 1 8 3307 1 1 15 VAL HG23 H 2.339 0.830 -5.802 1.00 . A A . 15 VAL HG23 1 1 8 3308 1 1 15 VAL N N 2.586 -0.483 -2.303 1.00 . A A . 15 VAL N 1 1 8 3309 1 1 15 VAL O O 5.492 1.255 -1.889 1.00 . A A . 15 VAL O 1 1 8 3310 1 1 16 PHE C C 4.979 1.853 1.024 1.00 . A A . 16 PHE C 1 1 8 3311 1 1 16 PHE CA C 4.301 2.787 0.012 1.00 . A A . 16 PHE CA 1 1 8 3312 1 1 16 PHE CB C 3.209 3.617 0.694 1.00 . A A . 16 PHE CB 1 1 8 3313 1 1 16 PHE CD1 C 4.442 4.892 2.487 1.00 . A A . 16 PHE CD1 1 1 8 3314 1 1 16 PHE CD2 C 3.725 6.078 0.498 1.00 . A A . 16 PHE CD2 1 1 8 3315 1 1 16 PHE CE1 C 4.996 6.073 2.992 1.00 . A A . 16 PHE CE1 1 1 8 3316 1 1 16 PHE CE2 C 4.279 7.260 1.003 1.00 . A A . 16 PHE CE2 1 1 8 3317 1 1 16 PHE CG C 3.806 4.893 1.240 1.00 . A A . 16 PHE CG 1 1 8 3318 1 1 16 PHE CZ C 4.914 7.258 2.251 1.00 . A A . 16 PHE CZ 1 1 8 3319 1 1 16 PHE H H 2.613 2.006 -1.085 1.00 . A A . 16 PHE H 1 1 8 3320 1 1 16 PHE HA H 5.030 3.442 -0.438 1.00 . A A . 16 PHE HA 1 1 8 3321 1 1 16 PHE HB2 H 2.439 3.860 -0.024 1.00 . A A . 16 PHE HB2 1 1 8 3322 1 1 16 PHE HB3 H 2.778 3.049 1.504 1.00 . A A . 16 PHE HB3 1 1 8 3323 1 1 16 PHE HD1 H 4.505 3.978 3.060 1.00 . A A . 16 PHE HD1 1 1 8 3324 1 1 16 PHE HD2 H 3.235 6.080 -0.465 1.00 . A A . 16 PHE HD2 1 1 8 3325 1 1 16 PHE HE1 H 5.486 6.072 3.955 1.00 . A A . 16 PHE HE1 1 1 8 3326 1 1 16 PHE HE2 H 4.215 8.174 0.431 1.00 . A A . 16 PHE HE2 1 1 8 3327 1 1 16 PHE HZ H 5.341 8.169 2.641 1.00 . A A . 16 PHE HZ 1 1 8 3328 1 1 16 PHE N N 3.594 1.998 -1.045 1.00 . A A . 16 PHE N 1 1 8 3329 1 1 16 PHE O O 6.034 2.164 1.544 1.00 . A A . 16 PHE O 1 1 8 3330 1 1 17 GLY C C 6.351 -0.727 1.732 1.00 . A A . 17 GLY C 1 1 8 3331 1 1 17 GLY CA C 5.010 -0.238 2.280 1.00 . A A . 17 GLY CA 1 1 8 3332 1 1 17 GLY H H 3.540 0.477 0.871 1.00 . A A . 17 GLY H 1 1 8 3333 1 1 17 GLY HA2 H 5.171 0.267 3.222 1.00 . A A . 17 GLY HA2 1 1 8 3334 1 1 17 GLY HA3 H 4.357 -1.082 2.431 1.00 . A A . 17 GLY HA3 1 1 8 3335 1 1 17 GLY N N 4.389 0.711 1.305 1.00 . A A . 17 GLY N 1 1 8 3336 1 1 17 GLY O O 7.344 -0.742 2.434 1.00 . A A . 17 GLY O 1 1 8 3337 1 1 18 GLU C C 8.722 -0.470 -0.062 1.00 . A A . 18 GLU C 1 1 8 3338 1 1 18 GLU CA C 7.677 -1.589 -0.123 1.00 . A A . 18 GLU CA 1 1 8 3339 1 1 18 GLU CB C 7.338 -1.949 -1.576 1.00 . A A . 18 GLU CB 1 1 8 3340 1 1 18 GLU CD C 8.954 -3.866 -1.661 1.00 . A A . 18 GLU CD 1 1 8 3341 1 1 18 GLU CG C 8.576 -2.518 -2.283 1.00 . A A . 18 GLU CG 1 1 8 3342 1 1 18 GLU H H 5.576 -1.083 -0.070 1.00 . A A . 18 GLU H 1 1 8 3343 1 1 18 GLU HA H 8.034 -2.456 0.402 1.00 . A A . 18 GLU HA 1 1 8 3344 1 1 18 GLU HB2 H 6.549 -2.688 -1.586 1.00 . A A . 18 GLU HB2 1 1 8 3345 1 1 18 GLU HB3 H 7.005 -1.064 -2.096 1.00 . A A . 18 GLU HB3 1 1 8 3346 1 1 18 GLU HG2 H 8.358 -2.655 -3.332 1.00 . A A . 18 GLU HG2 1 1 8 3347 1 1 18 GLU HG3 H 9.400 -1.829 -2.174 1.00 . A A . 18 GLU HG3 1 1 8 3348 1 1 18 GLU N N 6.391 -1.115 0.478 1.00 . A A . 18 GLU N 1 1 8 3349 1 1 18 GLU O O 9.882 -0.705 0.222 1.00 . A A . 18 GLU O 1 1 8 3350 1 1 18 GLU OE1 O 8.420 -4.871 -2.102 1.00 . A A . 18 GLU OE1 1 1 8 3351 1 1 18 GLU OE2 O 9.771 -3.870 -0.753 1.00 . A A . 18 GLU OE2 1 1 8 3352 1 1 19 ASN C C 9.755 2.088 1.200 1.00 . A A . 19 ASN C 1 1 8 3353 1 1 19 ASN CA C 9.265 1.898 -0.240 1.00 . A A . 19 ASN CA 1 1 8 3354 1 1 19 ASN CB C 8.463 3.121 -0.699 1.00 . A A . 19 ASN CB 1 1 8 3355 1 1 19 ASN CG C 8.522 3.233 -2.224 1.00 . A A . 19 ASN CG 1 1 8 3356 1 1 19 ASN H H 7.367 0.906 -0.513 1.00 . A A . 19 ASN H 1 1 8 3357 1 1 19 ASN HA H 10.097 1.731 -0.899 1.00 . A A . 19 ASN HA 1 1 8 3358 1 1 19 ASN HB2 H 7.435 3.015 -0.385 1.00 . A A . 19 ASN HB2 1 1 8 3359 1 1 19 ASN HB3 H 8.883 4.012 -0.259 1.00 . A A . 19 ASN HB3 1 1 8 3360 1 1 19 ASN HD21 H 6.861 2.180 -2.512 1.00 . A A . 19 ASN HD21 1 1 8 3361 1 1 19 ASN HD22 H 7.623 2.735 -3.923 1.00 . A A . 19 ASN HD22 1 1 8 3362 1 1 19 ASN N N 8.310 0.748 -0.303 1.00 . A A . 19 ASN N 1 1 8 3363 1 1 19 ASN ND2 N 7.591 2.670 -2.947 1.00 . A A . 19 ASN ND2 1 1 8 3364 1 1 19 ASN O O 10.892 2.449 1.436 1.00 . A A . 19 ASN O 1 1 8 3365 1 1 19 ASN OD1 O 9.424 3.839 -2.765 1.00 . A A . 19 ASN OD1 1 1 8 3366 1 1 20 GLY C C 10.146 0.788 4.028 1.00 . A A . 20 GLY C 1 1 8 3367 1 1 20 GLY CA C 9.296 1.988 3.592 1.00 . A A . 20 GLY CA 1 1 8 3368 1 1 20 GLY H H 7.995 1.541 1.935 1.00 . A A . 20 GLY H 1 1 8 3369 1 1 20 GLY HA2 H 9.869 2.896 3.712 1.00 . A A . 20 GLY HA2 1 1 8 3370 1 1 20 GLY HA3 H 8.411 2.036 4.207 1.00 . A A . 20 GLY HA3 1 1 8 3371 1 1 20 GLY N N 8.901 1.836 2.160 1.00 . A A . 20 GLY N 1 1 8 3372 1 1 20 GLY O O 11.070 0.928 4.806 1.00 . A A . 20 GLY O 1 1 8 3373 1 1 21 VAL C C 12.085 -1.495 3.405 1.00 . A A . 21 VAL C 1 1 8 3374 1 1 21 VAL CA C 10.637 -1.602 3.917 1.00 . A A . 21 VAL CA 1 1 8 3375 1 1 21 VAL CB C 9.900 -2.782 3.265 1.00 . A A . 21 VAL CB 1 1 8 3376 1 1 21 VAL CG1 C 10.789 -4.030 3.263 1.00 . A A . 21 VAL CG1 1 1 8 3377 1 1 21 VAL CG2 C 8.623 -3.079 4.056 1.00 . A A . 21 VAL CG2 1 1 8 3378 1 1 21 VAL H H 9.087 -0.479 2.904 1.00 . A A . 21 VAL H 1 1 8 3379 1 1 21 VAL HA H 10.636 -1.719 4.984 1.00 . A A . 21 VAL HA 1 1 8 3380 1 1 21 VAL HB H 9.641 -2.525 2.247 1.00 . A A . 21 VAL HB 1 1 8 3381 1 1 21 VAL HG11 H 10.169 -4.914 3.241 1.00 . A A . 21 VAL HG11 1 1 8 3382 1 1 21 VAL HG12 H 11.398 -4.041 4.156 1.00 . A A . 21 VAL HG12 1 1 8 3383 1 1 21 VAL HG13 H 11.425 -4.017 2.392 1.00 . A A . 21 VAL HG13 1 1 8 3384 1 1 21 VAL HG21 H 8.885 -3.509 5.012 1.00 . A A . 21 VAL HG21 1 1 8 3385 1 1 21 VAL HG22 H 8.011 -3.776 3.504 1.00 . A A . 21 VAL HG22 1 1 8 3386 1 1 21 VAL HG23 H 8.074 -2.162 4.212 1.00 . A A . 21 VAL HG23 1 1 8 3387 1 1 21 VAL N N 9.841 -0.389 3.532 1.00 . A A . 21 VAL N 1 1 8 3388 1 1 21 VAL O O 12.964 -2.179 3.892 1.00 . A A . 21 VAL O 1 1 8 3389 1 1 22 PHE C C 14.264 -1.855 1.413 1.00 . A A . 22 PHE C 1 1 8 3390 1 1 22 PHE CA C 13.722 -0.495 1.880 1.00 . A A . 22 PHE CA 1 1 8 3391 1 1 22 PHE CB C 14.562 0.064 3.038 1.00 . A A . 22 PHE CB 1 1 8 3392 1 1 22 PHE CD1 C 15.359 2.291 2.161 1.00 . A A . 22 PHE CD1 1 1 8 3393 1 1 22 PHE CD2 C 16.947 0.465 2.317 1.00 . A A . 22 PHE CD2 1 1 8 3394 1 1 22 PHE CE1 C 16.365 3.122 1.655 1.00 . A A . 22 PHE CE1 1 1 8 3395 1 1 22 PHE CE2 C 17.952 1.296 1.811 1.00 . A A . 22 PHE CE2 1 1 8 3396 1 1 22 PHE CG C 15.648 0.962 2.492 1.00 . A A . 22 PHE CG 1 1 8 3397 1 1 22 PHE CZ C 17.662 2.626 1.481 1.00 . A A . 22 PHE CZ 1 1 8 3398 1 1 22 PHE H H 11.606 -0.112 2.059 1.00 . A A . 22 PHE H 1 1 8 3399 1 1 22 PHE HA H 13.720 0.205 1.059 1.00 . A A . 22 PHE HA 1 1 8 3400 1 1 22 PHE HB2 H 13.927 0.631 3.702 1.00 . A A . 22 PHE HB2 1 1 8 3401 1 1 22 PHE HB3 H 15.011 -0.754 3.582 1.00 . A A . 22 PHE HB3 1 1 8 3402 1 1 22 PHE HD1 H 14.358 2.676 2.296 1.00 . A A . 22 PHE HD1 1 1 8 3403 1 1 22 PHE HD2 H 17.171 -0.561 2.572 1.00 . A A . 22 PHE HD2 1 1 8 3404 1 1 22 PHE HE1 H 16.142 4.148 1.401 1.00 . A A . 22 PHE HE1 1 1 8 3405 1 1 22 PHE HE2 H 18.953 0.913 1.676 1.00 . A A . 22 PHE HE2 1 1 8 3406 1 1 22 PHE HZ H 18.439 3.267 1.091 1.00 . A A . 22 PHE HZ 1 1 8 3407 1 1 22 PHE N N 12.334 -0.648 2.431 1.00 . A A . 22 PHE N 1 1 8 3408 1 1 22 PHE O O 15.452 -2.120 1.483 1.00 . A A . 22 PHE O 1 1 8 3409 1 1 23 PHE C C 14.543 -4.839 1.581 1.00 . A A . 23 PHE C 1 1 8 3410 1 1 23 PHE CA C 13.811 -4.076 0.466 1.00 . A A . 23 PHE CA 1 1 8 3411 1 1 23 PHE CB C 14.733 -3.822 -0.733 1.00 . A A . 23 PHE CB 1 1 8 3412 1 1 23 PHE CD1 C 13.694 -5.076 -2.658 1.00 . A A . 23 PHE CD1 1 1 8 3413 1 1 23 PHE CD2 C 13.379 -2.674 -2.523 1.00 . A A . 23 PHE CD2 1 1 8 3414 1 1 23 PHE CE1 C 12.933 -5.110 -3.832 1.00 . A A . 23 PHE CE1 1 1 8 3415 1 1 23 PHE CE2 C 12.617 -2.709 -3.698 1.00 . A A . 23 PHE CE2 1 1 8 3416 1 1 23 PHE CG C 13.917 -3.858 -2.003 1.00 . A A . 23 PHE CG 1 1 8 3417 1 1 23 PHE CZ C 12.395 -3.927 -4.352 1.00 . A A . 23 PHE CZ 1 1 8 3418 1 1 23 PHE H H 12.439 -2.469 0.907 1.00 . A A . 23 PHE H 1 1 8 3419 1 1 23 PHE HA H 12.946 -4.636 0.145 1.00 . A A . 23 PHE HA 1 1 8 3420 1 1 23 PHE HB2 H 15.204 -2.856 -0.634 1.00 . A A . 23 PHE HB2 1 1 8 3421 1 1 23 PHE HB3 H 15.493 -4.590 -0.773 1.00 . A A . 23 PHE HB3 1 1 8 3422 1 1 23 PHE HD1 H 14.110 -5.989 -2.257 1.00 . A A . 23 PHE HD1 1 1 8 3423 1 1 23 PHE HD2 H 13.550 -1.736 -2.019 1.00 . A A . 23 PHE HD2 1 1 8 3424 1 1 23 PHE HE1 H 12.763 -6.049 -4.338 1.00 . A A . 23 PHE HE1 1 1 8 3425 1 1 23 PHE HE2 H 12.202 -1.796 -4.099 1.00 . A A . 23 PHE HE2 1 1 8 3426 1 1 23 PHE HZ H 11.807 -3.954 -5.257 1.00 . A A . 23 PHE HZ 1 1 8 3427 1 1 23 PHE N N 13.388 -2.717 0.942 1.00 . A A . 23 PHE N 1 1 8 3428 1 1 23 PHE O O 15.485 -5.572 1.334 1.00 . A A . 23 PHE O 1 1 8 3429 1 1 24 TYR C C 13.874 -6.567 4.396 1.00 . A A . 24 TYR C 1 1 8 3430 1 1 24 TYR CA C 14.754 -5.391 3.946 1.00 . A A . 24 TYR CA 1 1 8 3431 1 1 24 TYR CB C 14.868 -4.335 5.050 1.00 . A A . 24 TYR CB 1 1 8 3432 1 1 24 TYR CD1 C 17.351 -4.012 5.343 1.00 . A A . 24 TYR CD1 1 1 8 3433 1 1 24 TYR CD2 C 16.133 -5.273 7.019 1.00 . A A . 24 TYR CD2 1 1 8 3434 1 1 24 TYR CE1 C 18.537 -4.207 6.059 1.00 . A A . 24 TYR CE1 1 1 8 3435 1 1 24 TYR CE2 C 17.319 -5.468 7.734 1.00 . A A . 24 TYR CE2 1 1 8 3436 1 1 24 TYR CG C 16.148 -4.545 5.823 1.00 . A A . 24 TYR CG 1 1 8 3437 1 1 24 TYR CZ C 18.521 -4.935 7.255 1.00 . A A . 24 TYR CZ 1 1 8 3438 1 1 24 TYR H H 13.342 -4.089 2.974 1.00 . A A . 24 TYR H 1 1 8 3439 1 1 24 TYR HA H 15.735 -5.739 3.666 1.00 . A A . 24 TYR HA 1 1 8 3440 1 1 24 TYR HB2 H 14.875 -3.353 4.603 1.00 . A A . 24 TYR HB2 1 1 8 3441 1 1 24 TYR HB3 H 14.024 -4.418 5.719 1.00 . A A . 24 TYR HB3 1 1 8 3442 1 1 24 TYR HD1 H 17.362 -3.451 4.421 1.00 . A A . 24 TYR HD1 1 1 8 3443 1 1 24 TYR HD2 H 15.205 -5.685 7.389 1.00 . A A . 24 TYR HD2 1 1 8 3444 1 1 24 TYR HE1 H 19.464 -3.796 5.689 1.00 . A A . 24 TYR HE1 1 1 8 3445 1 1 24 TYR HE2 H 17.308 -6.030 8.657 1.00 . A A . 24 TYR HE2 1 1 8 3446 1 1 24 TYR HH H 19.789 -4.399 8.578 1.00 . A A . 24 TYR HH 1 1 8 3447 1 1 24 TYR N N 14.106 -4.677 2.805 1.00 . A A . 24 TYR N 1 1 8 3448 1 1 24 TYR O O 13.630 -6.764 5.572 1.00 . A A . 24 TYR O 1 1 8 3449 1 1 24 TYR OH O 19.692 -5.127 7.960 1.00 . A A . 24 TYR OH 1 1 8 3450 1 1 25 LYS C C 13.392 -9.718 4.237 1.00 . A A . 25 LYS C 1 1 8 3451 1 1 25 LYS CA C 12.533 -8.520 3.812 1.00 . A A . 25 LYS CA 1 1 8 3452 1 1 25 LYS CB C 11.756 -8.849 2.532 1.00 . A A . 25 LYS CB 1 1 8 3453 1 1 25 LYS CD C 10.847 -6.856 1.312 1.00 . A A . 25 LYS CD 1 1 8 3454 1 1 25 LYS CE C 10.785 -7.512 -0.073 1.00 . A A . 25 LYS CE 1 1 8 3455 1 1 25 LYS CG C 10.558 -7.903 2.394 1.00 . A A . 25 LYS CG 1 1 8 3456 1 1 25 LYS H H 13.613 -7.167 2.521 1.00 . A A . 25 LYS H 1 1 8 3457 1 1 25 LYS HA H 11.845 -8.254 4.600 1.00 . A A . 25 LYS HA 1 1 8 3458 1 1 25 LYS HB2 H 12.407 -8.735 1.678 1.00 . A A . 25 LYS HB2 1 1 8 3459 1 1 25 LYS HB3 H 11.402 -9.868 2.581 1.00 . A A . 25 LYS HB3 1 1 8 3460 1 1 25 LYS HD2 H 10.113 -6.065 1.372 1.00 . A A . 25 LYS HD2 1 1 8 3461 1 1 25 LYS HD3 H 11.832 -6.442 1.467 1.00 . A A . 25 LYS HD3 1 1 8 3462 1 1 25 LYS HE2 H 11.509 -7.057 -0.734 1.00 . A A . 25 LYS HE2 1 1 8 3463 1 1 25 LYS HE3 H 10.962 -8.573 0.005 1.00 . A A . 25 LYS HE3 1 1 8 3464 1 1 25 LYS HG2 H 9.681 -8.471 2.119 1.00 . A A . 25 LYS HG2 1 1 8 3465 1 1 25 LYS HG3 H 10.382 -7.404 3.335 1.00 . A A . 25 LYS HG3 1 1 8 3466 1 1 25 LYS HZ1 H 9.245 -6.235 -0.662 1.00 . A A . 25 LYS HZ1 1 1 8 3467 1 1 25 LYS HZ2 H 8.712 -7.654 0.108 1.00 . A A . 25 LYS HZ2 1 1 8 3468 1 1 25 LYS HZ3 H 9.274 -7.712 -1.494 1.00 . A A . 25 LYS HZ3 1 1 8 3469 1 1 25 LYS N N 13.398 -7.350 3.459 1.00 . A A . 25 LYS N 1 1 8 3470 1 1 25 LYS NZ N 9.399 -7.260 -0.566 1.00 . A A . 25 LYS NZ 1 1 8 3471 1 1 25 LYS O O 14.438 -9.919 3.638 1.00 . A A . 25 LYS O 1 1 8 3472 1 1 25 LYS OXT O 12.986 -10.417 5.151 1.00 . A A . 25 LYS OXT 1 1 9 3473 1 1 1 HIS C C -20.980 0.717 -1.330 1.00 . A A . 1 HIS C 1 1 9 3474 1 1 1 HIS CA C -21.035 2.144 -1.891 1.00 . A A . 1 HIS CA 1 1 9 3475 1 1 1 HIS CB C -21.307 2.122 -3.400 1.00 . A A . 1 HIS CB 1 1 9 3476 1 1 1 HIS CD2 C -23.198 3.929 -3.660 1.00 . A A . 1 HIS CD2 1 1 9 3477 1 1 1 HIS CE1 C -22.053 5.432 -4.720 1.00 . A A . 1 HIS CE1 1 1 9 3478 1 1 1 HIS CG C -21.930 3.425 -3.819 1.00 . A A . 1 HIS CG 1 1 9 3479 1 1 1 HIS HA H -21.801 2.713 -1.389 1.00 . A A . 1 HIS HA 1 1 9 3480 1 1 1 HIS HB2 H -20.378 1.979 -3.933 1.00 . A A . 1 HIS HB2 1 1 9 3481 1 1 1 HIS HB3 H -21.982 1.311 -3.632 1.00 . A A . 1 HIS HB3 1 1 9 3482 1 1 1 HIS HD1 H -20.277 4.349 -4.768 1.00 . A A . 1 HIS HD1 1 1 9 3483 1 1 1 HIS HD2 H -24.012 3.419 -3.168 1.00 . A A . 1 HIS HD2 1 1 9 3484 1 1 1 HIS HE1 H -21.772 6.340 -5.235 1.00 . A A . 1 HIS HE1 1 1 9 3485 1 1 1 HIS N N -19.706 2.815 -1.736 1.00 . A A . 1 HIS N 1 1 9 3486 1 1 1 HIS ND1 N -21.217 4.401 -4.497 1.00 . A A . 1 HIS ND1 1 1 9 3487 1 1 1 HIS NE2 N -23.273 5.196 -4.230 1.00 . A A . 1 HIS NE2 1 1 9 3488 1 1 1 HIS O O -21.704 0.378 -0.414 1.00 . A A . 1 HIS O 1 1 9 3489 1 1 2 ALA C C -18.890 -1.647 -0.340 1.00 . A A . 2 ALA C 1 1 9 3490 1 1 2 ALA CA C -20.024 -1.527 -1.369 1.00 . A A . 2 ALA CA 1 1 9 3491 1 1 2 ALA CB C -19.716 -2.371 -2.608 1.00 . A A . 2 ALA CB 1 1 9 3492 1 1 2 ALA H H -19.551 0.177 -2.609 1.00 . A A . 2 ALA H 1 1 9 3493 1 1 2 ALA HA H -20.961 -1.840 -0.935 1.00 . A A . 2 ALA HA 1 1 9 3494 1 1 2 ALA HB1 H -20.375 -2.081 -3.414 1.00 . A A . 2 ALA HB1 1 1 9 3495 1 1 2 ALA HB2 H -19.866 -3.415 -2.379 1.00 . A A . 2 ALA HB2 1 1 9 3496 1 1 2 ALA HB3 H -18.691 -2.211 -2.907 1.00 . A A . 2 ALA HB3 1 1 9 3497 1 1 2 ALA N N -20.127 -0.121 -1.872 1.00 . A A . 2 ALA N 1 1 9 3498 1 1 2 ALA O O -18.230 -0.677 -0.015 1.00 . A A . 2 ALA O 1 1 9 3499 1 1 3 TRP C C -16.216 -3.182 0.473 1.00 . A A . 3 TRP C 1 1 9 3500 1 1 3 TRP CA C -17.569 -3.019 1.180 1.00 . A A . 3 TRP CA 1 1 9 3501 1 1 3 TRP CB C -17.942 -4.292 1.950 1.00 . A A . 3 TRP CB 1 1 9 3502 1 1 3 TRP CD1 C -18.812 -3.315 4.117 1.00 . A A . 3 TRP CD1 1 1 9 3503 1 1 3 TRP CD2 C -20.427 -4.306 2.904 1.00 . A A . 3 TRP CD2 1 1 9 3504 1 1 3 TRP CE2 C -21.046 -3.809 4.076 1.00 . A A . 3 TRP CE2 1 1 9 3505 1 1 3 TRP CE3 C -21.230 -4.979 1.965 1.00 . A A . 3 TRP CE3 1 1 9 3506 1 1 3 TRP CG C -19.008 -3.980 2.954 1.00 . A A . 3 TRP CG 1 1 9 3507 1 1 3 TRP CH2 C -23.195 -4.644 3.364 1.00 . A A . 3 TRP CH2 1 1 9 3508 1 1 3 TRP CZ2 C -22.412 -3.973 4.306 1.00 . A A . 3 TRP CZ2 1 1 9 3509 1 1 3 TRP CZ3 C -22.606 -5.146 2.195 1.00 . A A . 3 TRP CZ3 1 1 9 3510 1 1 3 TRP H H -19.205 -3.600 -0.106 1.00 . A A . 3 TRP H 1 1 9 3511 1 1 3 TRP HA H -17.535 -2.178 1.855 1.00 . A A . 3 TRP HA 1 1 9 3512 1 1 3 TRP HB2 H -18.306 -5.037 1.259 1.00 . A A . 3 TRP HB2 1 1 9 3513 1 1 3 TRP HB3 H -17.069 -4.672 2.461 1.00 . A A . 3 TRP HB3 1 1 9 3514 1 1 3 TRP HD1 H -17.866 -2.928 4.467 1.00 . A A . 3 TRP HD1 1 1 9 3515 1 1 3 TRP HE1 H -20.153 -2.776 5.650 1.00 . A A . 3 TRP HE1 1 1 9 3516 1 1 3 TRP HE3 H -20.786 -5.370 1.061 1.00 . A A . 3 TRP HE3 1 1 9 3517 1 1 3 TRP HH2 H -24.253 -4.776 3.535 1.00 . A A . 3 TRP HH2 1 1 9 3518 1 1 3 TRP HZ2 H -22.862 -3.585 5.209 1.00 . A A . 3 TRP HZ2 1 1 9 3519 1 1 3 TRP HZ3 H -23.212 -5.665 1.467 1.00 . A A . 3 TRP HZ3 1 1 9 3520 1 1 3 TRP N N -18.660 -2.832 0.173 1.00 . A A . 3 TRP N 1 1 9 3521 1 1 3 TRP NE1 N -20.021 -3.214 4.783 1.00 . A A . 3 TRP NE1 1 1 9 3522 1 1 3 TRP O O -15.614 -4.241 0.491 1.00 . A A . 3 TRP O 1 1 9 3523 1 1 4 TYR C C -13.514 -1.054 -0.410 1.00 . A A . 4 TYR C 1 1 9 3524 1 1 4 TYR CA C -14.421 -2.212 -0.854 1.00 . A A . 4 TYR CA 1 1 9 3525 1 1 4 TYR CB C -14.763 -2.101 -2.344 1.00 . A A . 4 TYR CB 1 1 9 3526 1 1 4 TYR CD1 C -13.857 -4.226 -3.353 1.00 . A A . 4 TYR CD1 1 1 9 3527 1 1 4 TYR CD2 C -12.635 -2.160 -3.697 1.00 . A A . 4 TYR CD2 1 1 9 3528 1 1 4 TYR CE1 C -12.895 -4.918 -4.098 1.00 . A A . 4 TYR CE1 1 1 9 3529 1 1 4 TYR CE2 C -11.674 -2.852 -4.442 1.00 . A A . 4 TYR CE2 1 1 9 3530 1 1 4 TYR CG C -13.727 -2.847 -3.153 1.00 . A A . 4 TYR CG 1 1 9 3531 1 1 4 TYR CZ C -11.805 -4.232 -4.643 1.00 . A A . 4 TYR CZ 1 1 9 3532 1 1 4 TYR H H -16.237 -1.292 -0.145 1.00 . A A . 4 TYR H 1 1 9 3533 1 1 4 TYR HA H -13.943 -3.159 -0.656 1.00 . A A . 4 TYR HA 1 1 9 3534 1 1 4 TYR HB2 H -15.738 -2.532 -2.524 1.00 . A A . 4 TYR HB2 1 1 9 3535 1 1 4 TYR HB3 H -14.768 -1.062 -2.638 1.00 . A A . 4 TYR HB3 1 1 9 3536 1 1 4 TYR HD1 H -14.700 -4.756 -2.933 1.00 . A A . 4 TYR HD1 1 1 9 3537 1 1 4 TYR HD2 H -12.535 -1.094 -3.543 1.00 . A A . 4 TYR HD2 1 1 9 3538 1 1 4 TYR HE1 H -12.996 -5.983 -4.253 1.00 . A A . 4 TYR HE1 1 1 9 3539 1 1 4 TYR HE2 H -10.833 -2.322 -4.862 1.00 . A A . 4 TYR HE2 1 1 9 3540 1 1 4 TYR HH H -11.212 -5.076 -6.249 1.00 . A A . 4 TYR HH 1 1 9 3541 1 1 4 TYR N N -15.734 -2.135 -0.148 1.00 . A A . 4 TYR N 1 1 9 3542 1 1 4 TYR O O -12.946 -0.349 -1.222 1.00 . A A . 4 TYR O 1 1 9 3543 1 1 4 TYR OH O -10.854 -4.914 -5.373 1.00 . A A . 4 TYR OH 1 1 9 3544 1 1 5 SER C C -11.171 -0.301 1.897 1.00 . A A . 5 SER C 1 1 9 3545 1 1 5 SER CA C -12.512 0.247 1.389 1.00 . A A . 5 SER CA 1 1 9 3546 1 1 5 SER CB C -13.304 0.876 2.537 1.00 . A A . 5 SER CB 1 1 9 3547 1 1 5 SER H H -13.847 -1.443 1.511 1.00 . A A . 5 SER H 1 1 9 3548 1 1 5 SER HA H -12.346 0.976 0.617 1.00 . A A . 5 SER HA 1 1 9 3549 1 1 5 SER HB2 H -14.351 0.902 2.283 1.00 . A A . 5 SER HB2 1 1 9 3550 1 1 5 SER HB3 H -13.169 0.286 3.434 1.00 . A A . 5 SER HB3 1 1 9 3551 1 1 5 SER HG H -12.572 2.280 3.671 1.00 . A A . 5 SER HG 1 1 9 3552 1 1 5 SER N N -13.379 -0.860 0.878 1.00 . A A . 5 SER N 1 1 9 3553 1 1 5 SER O O -10.204 0.426 2.018 1.00 . A A . 5 SER O 1 1 9 3554 1 1 5 SER OG O -12.841 2.203 2.752 1.00 . A A . 5 SER OG 1 1 9 3555 1 1 6 HIS C C -8.872 -2.449 1.514 1.00 . A A . 6 HIS C 1 1 9 3556 1 1 6 HIS CA C -9.820 -2.166 2.686 1.00 . A A . 6 HIS CA 1 1 9 3557 1 1 6 HIS CB C -10.219 -3.470 3.389 1.00 . A A . 6 HIS CB 1 1 9 3558 1 1 6 HIS CD2 C -7.957 -3.287 4.731 1.00 . A A . 6 HIS CD2 1 1 9 3559 1 1 6 HIS CE1 C -8.109 -5.134 5.852 1.00 . A A . 6 HIS CE1 1 1 9 3560 1 1 6 HIS CG C -9.139 -3.883 4.359 1.00 . A A . 6 HIS CG 1 1 9 3561 1 1 6 HIS H H -11.894 -2.143 2.083 1.00 . A A . 6 HIS H 1 1 9 3562 1 1 6 HIS HA H -9.350 -1.497 3.384 1.00 . A A . 6 HIS HA 1 1 9 3563 1 1 6 HIS HB2 H -11.144 -3.318 3.927 1.00 . A A . 6 HIS HB2 1 1 9 3564 1 1 6 HIS HB3 H -10.355 -4.247 2.653 1.00 . A A . 6 HIS HB3 1 1 9 3565 1 1 6 HIS HD1 H -9.942 -5.717 5.058 1.00 . A A . 6 HIS HD1 1 1 9 3566 1 1 6 HIS HD2 H -7.588 -2.347 4.349 1.00 . A A . 6 HIS HD2 1 1 9 3567 1 1 6 HIS HE1 H -7.895 -5.948 6.531 1.00 . A A . 6 HIS HE1 1 1 9 3568 1 1 6 HIS N N -11.103 -1.575 2.190 1.00 . A A . 6 HIS N 1 1 9 3569 1 1 6 HIS ND1 N -9.214 -5.060 5.089 1.00 . A A . 6 HIS ND1 1 1 9 3570 1 1 6 HIS NE2 N -7.309 -4.080 5.672 1.00 . A A . 6 HIS NE2 1 1 9 3571 1 1 6 HIS O O -7.666 -2.398 1.661 1.00 . A A . 6 HIS O 1 1 9 3572 1 1 7 TYR C C -7.695 -1.800 -1.175 1.00 . A A . 7 TYR C 1 1 9 3573 1 1 7 TYR CA C -8.542 -3.025 -0.831 1.00 . A A . 7 TYR CA 1 1 9 3574 1 1 7 TYR CB C -9.508 -3.350 -1.973 1.00 . A A . 7 TYR CB 1 1 9 3575 1 1 7 TYR CD1 C -9.208 -5.835 -2.277 1.00 . A A . 7 TYR CD1 1 1 9 3576 1 1 7 TYR CD2 C -11.257 -5.023 -1.266 1.00 . A A . 7 TYR CD2 1 1 9 3577 1 1 7 TYR CE1 C -9.667 -7.150 -2.150 1.00 . A A . 7 TYR CE1 1 1 9 3578 1 1 7 TYR CE2 C -11.715 -6.338 -1.139 1.00 . A A . 7 TYR CE2 1 1 9 3579 1 1 7 TYR CG C -10.003 -4.771 -1.835 1.00 . A A . 7 TYR CG 1 1 9 3580 1 1 7 TYR CZ C -10.920 -7.402 -1.580 1.00 . A A . 7 TYR CZ 1 1 9 3581 1 1 7 TYR H H -10.383 -2.773 0.270 1.00 . A A . 7 TYR H 1 1 9 3582 1 1 7 TYR HA H -7.906 -3.868 -0.634 1.00 . A A . 7 TYR HA 1 1 9 3583 1 1 7 TYR HB2 H -10.348 -2.672 -1.938 1.00 . A A . 7 TYR HB2 1 1 9 3584 1 1 7 TYR HB3 H -8.998 -3.238 -2.919 1.00 . A A . 7 TYR HB3 1 1 9 3585 1 1 7 TYR HD1 H -8.240 -5.640 -2.716 1.00 . A A . 7 TYR HD1 1 1 9 3586 1 1 7 TYR HD2 H -11.872 -4.202 -0.926 1.00 . A A . 7 TYR HD2 1 1 9 3587 1 1 7 TYR HE1 H -9.053 -7.972 -2.492 1.00 . A A . 7 TYR HE1 1 1 9 3588 1 1 7 TYR HE2 H -12.684 -6.534 -0.700 1.00 . A A . 7 TYR HE2 1 1 9 3589 1 1 7 TYR HH H -10.760 -9.175 -0.890 1.00 . A A . 7 TYR HH 1 1 9 3590 1 1 7 TYR N N -9.409 -2.741 0.357 1.00 . A A . 7 TYR N 1 1 9 3591 1 1 7 TYR O O -6.488 -1.889 -1.307 1.00 . A A . 7 TYR O 1 1 9 3592 1 1 7 TYR OH O -11.373 -8.699 -1.455 1.00 . A A . 7 TYR OH 1 1 9 3593 1 1 8 VAL C C -6.525 0.867 -0.507 1.00 . A A . 8 VAL C 1 1 9 3594 1 1 8 VAL CA C -7.541 0.585 -1.625 1.00 . A A . 8 VAL CA 1 1 9 3595 1 1 8 VAL CB C -8.583 1.710 -1.744 1.00 . A A . 8 VAL CB 1 1 9 3596 1 1 8 VAL CG1 C -9.191 2.024 -0.374 1.00 . A A . 8 VAL CG1 1 1 9 3597 1 1 8 VAL CG2 C -7.913 2.971 -2.300 1.00 . A A . 8 VAL CG2 1 1 9 3598 1 1 8 VAL H H -9.286 -0.614 -1.184 1.00 . A A . 8 VAL H 1 1 9 3599 1 1 8 VAL HA H -7.028 0.463 -2.562 1.00 . A A . 8 VAL HA 1 1 9 3600 1 1 8 VAL HB H -9.369 1.398 -2.417 1.00 . A A . 8 VAL HB 1 1 9 3601 1 1 8 VAL HG11 H -10.062 2.649 -0.500 1.00 . A A . 8 VAL HG11 1 1 9 3602 1 1 8 VAL HG12 H -8.462 2.540 0.234 1.00 . A A . 8 VAL HG12 1 1 9 3603 1 1 8 VAL HG13 H -9.477 1.104 0.111 1.00 . A A . 8 VAL HG13 1 1 9 3604 1 1 8 VAL HG21 H -7.380 2.725 -3.207 1.00 . A A . 8 VAL HG21 1 1 9 3605 1 1 8 VAL HG22 H -7.219 3.363 -1.570 1.00 . A A . 8 VAL HG22 1 1 9 3606 1 1 8 VAL HG23 H -8.667 3.714 -2.516 1.00 . A A . 8 VAL HG23 1 1 9 3607 1 1 8 VAL N N -8.316 -0.656 -1.306 1.00 . A A . 8 VAL N 1 1 9 3608 1 1 8 VAL O O -5.450 1.384 -0.752 1.00 . A A . 8 VAL O 1 1 9 3609 1 1 9 LEU C C -4.714 -0.245 1.714 1.00 . A A . 9 LEU C 1 1 9 3610 1 1 9 LEU CA C -5.898 0.721 1.845 1.00 . A A . 9 LEU CA 1 1 9 3611 1 1 9 LEU CB C -6.703 0.423 3.116 1.00 . A A . 9 LEU CB 1 1 9 3612 1 1 9 LEU CD1 C -6.950 1.597 5.315 1.00 . A A . 9 LEU CD1 1 1 9 3613 1 1 9 LEU CD2 C -5.222 -0.186 5.041 1.00 . A A . 9 LEU CD2 1 1 9 3614 1 1 9 LEU CG C -5.953 0.963 4.342 1.00 . A A . 9 LEU CG 1 1 9 3615 1 1 9 LEU H H -7.713 0.069 0.877 1.00 . A A . 9 LEU H 1 1 9 3616 1 1 9 LEU HA H -5.553 1.742 1.855 1.00 . A A . 9 LEU HA 1 1 9 3617 1 1 9 LEU HB2 H -7.671 0.897 3.047 1.00 . A A . 9 LEU HB2 1 1 9 3618 1 1 9 LEU HB3 H -6.831 -0.645 3.218 1.00 . A A . 9 LEU HB3 1 1 9 3619 1 1 9 LEU HD11 H -6.430 1.909 6.209 1.00 . A A . 9 LEU HD11 1 1 9 3620 1 1 9 LEU HD12 H -7.709 0.874 5.575 1.00 . A A . 9 LEU HD12 1 1 9 3621 1 1 9 LEU HD13 H -7.413 2.454 4.850 1.00 . A A . 9 LEU HD13 1 1 9 3622 1 1 9 LEU HD21 H -4.815 -0.858 4.302 1.00 . A A . 9 LEU HD21 1 1 9 3623 1 1 9 LEU HD22 H -5.913 -0.721 5.675 1.00 . A A . 9 LEU HD22 1 1 9 3624 1 1 9 LEU HD23 H -4.419 0.214 5.644 1.00 . A A . 9 LEU HD23 1 1 9 3625 1 1 9 LEU HG H -5.238 1.708 4.025 1.00 . A A . 9 LEU HG 1 1 9 3626 1 1 9 LEU N N -6.849 0.502 0.713 1.00 . A A . 9 LEU N 1 1 9 3627 1 1 9 LEU O O -3.579 0.119 1.955 1.00 . A A . 9 LEU O 1 1 9 3628 1 1 10 LYS C C -2.890 -1.986 0.068 1.00 . A A . 10 LYS C 1 1 9 3629 1 1 10 LYS CA C -3.863 -2.466 1.155 1.00 . A A . 10 LYS CA 1 1 9 3630 1 1 10 LYS CB C -4.545 -3.773 0.733 1.00 . A A . 10 LYS CB 1 1 9 3631 1 1 10 LYS CD C -5.565 -4.867 2.744 1.00 . A A . 10 LYS CD 1 1 9 3632 1 1 10 LYS CE C -5.605 -6.200 3.502 1.00 . A A . 10 LYS CE 1 1 9 3633 1 1 10 LYS CG C -4.344 -4.835 1.819 1.00 . A A . 10 LYS CG 1 1 9 3634 1 1 10 LYS H H -5.900 -1.740 1.121 1.00 . A A . 10 LYS H 1 1 9 3635 1 1 10 LYS HA H -3.343 -2.604 2.090 1.00 . A A . 10 LYS HA 1 1 9 3636 1 1 10 LYS HB2 H -5.603 -3.599 0.589 1.00 . A A . 10 LYS HB2 1 1 9 3637 1 1 10 LYS HB3 H -4.110 -4.122 -0.191 1.00 . A A . 10 LYS HB3 1 1 9 3638 1 1 10 LYS HD2 H -5.499 -4.052 3.453 1.00 . A A . 10 LYS HD2 1 1 9 3639 1 1 10 LYS HD3 H -6.465 -4.760 2.157 1.00 . A A . 10 LYS HD3 1 1 9 3640 1 1 10 LYS HE2 H -4.715 -6.779 3.288 1.00 . A A . 10 LYS HE2 1 1 9 3641 1 1 10 LYS HE3 H -5.695 -6.027 4.563 1.00 . A A . 10 LYS HE3 1 1 9 3642 1 1 10 LYS HG2 H -4.220 -5.803 1.354 1.00 . A A . 10 LYS HG2 1 1 9 3643 1 1 10 LYS HG3 H -3.463 -4.599 2.397 1.00 . A A . 10 LYS HG3 1 1 9 3644 1 1 10 LYS HZ1 H -6.788 -6.951 1.956 1.00 . A A . 10 LYS HZ1 1 1 9 3645 1 1 10 LYS HZ2 H -7.671 -6.390 3.295 1.00 . A A . 10 LYS HZ2 1 1 9 3646 1 1 10 LYS HZ3 H -6.843 -7.871 3.380 1.00 . A A . 10 LYS HZ3 1 1 9 3647 1 1 10 LYS N N -4.974 -1.474 1.318 1.00 . A A . 10 LYS N 1 1 9 3648 1 1 10 LYS NZ N -6.819 -6.906 2.995 1.00 . A A . 10 LYS NZ 1 1 9 3649 1 1 10 LYS O O -1.687 -2.094 0.213 1.00 . A A . 10 LYS O 1 1 9 3650 1 1 11 PHE C C -1.649 0.210 -1.576 1.00 . A A . 11 PHE C 1 1 9 3651 1 1 11 PHE CA C -2.517 -0.940 -2.104 1.00 . A A . 11 PHE CA 1 1 9 3652 1 1 11 PHE CB C -3.473 -0.448 -3.202 1.00 . A A . 11 PHE CB 1 1 9 3653 1 1 11 PHE CD1 C -1.780 -0.160 -5.054 1.00 . A A . 11 PHE CD1 1 1 9 3654 1 1 11 PHE CD2 C -2.972 1.793 -4.248 1.00 . A A . 11 PHE CD2 1 1 9 3655 1 1 11 PHE CE1 C -1.087 0.642 -5.968 1.00 . A A . 11 PHE CE1 1 1 9 3656 1 1 11 PHE CE2 C -2.279 2.593 -5.162 1.00 . A A . 11 PHE CE2 1 1 9 3657 1 1 11 PHE CG C -2.724 0.416 -4.193 1.00 . A A . 11 PHE CG 1 1 9 3658 1 1 11 PHE CZ C -1.335 2.019 -6.022 1.00 . A A . 11 PHE CZ 1 1 9 3659 1 1 11 PHE H H -4.380 -1.361 -1.097 1.00 . A A . 11 PHE H 1 1 9 3660 1 1 11 PHE HA H -1.896 -1.737 -2.484 1.00 . A A . 11 PHE HA 1 1 9 3661 1 1 11 PHE HB2 H -3.896 -1.298 -3.715 1.00 . A A . 11 PHE HB2 1 1 9 3662 1 1 11 PHE HB3 H -4.267 0.130 -2.752 1.00 . A A . 11 PHE HB3 1 1 9 3663 1 1 11 PHE HD1 H -1.588 -1.222 -5.011 1.00 . A A . 11 PHE HD1 1 1 9 3664 1 1 11 PHE HD2 H -3.699 2.237 -3.584 1.00 . A A . 11 PHE HD2 1 1 9 3665 1 1 11 PHE HE1 H -0.359 0.198 -6.631 1.00 . A A . 11 PHE HE1 1 1 9 3666 1 1 11 PHE HE2 H -2.471 3.656 -5.204 1.00 . A A . 11 PHE HE2 1 1 9 3667 1 1 11 PHE HZ H -0.800 2.638 -6.727 1.00 . A A . 11 PHE HZ 1 1 9 3668 1 1 11 PHE N N -3.406 -1.445 -1.011 1.00 . A A . 11 PHE N 1 1 9 3669 1 1 11 PHE O O -0.464 0.273 -1.842 1.00 . A A . 11 PHE O 1 1 9 3670 1 1 12 PHE C C -0.304 1.723 0.613 1.00 . A A . 12 PHE C 1 1 9 3671 1 1 12 PHE CA C -1.446 2.255 -0.260 1.00 . A A . 12 PHE CA 1 1 9 3672 1 1 12 PHE CB C -2.443 3.057 0.585 1.00 . A A . 12 PHE CB 1 1 9 3673 1 1 12 PHE CD1 C -3.731 3.920 -1.408 1.00 . A A . 12 PHE CD1 1 1 9 3674 1 1 12 PHE CD2 C -2.818 5.516 0.172 1.00 . A A . 12 PHE CD2 1 1 9 3675 1 1 12 PHE CE1 C -4.256 4.971 -2.168 1.00 . A A . 12 PHE CE1 1 1 9 3676 1 1 12 PHE CE2 C -3.343 6.568 -0.588 1.00 . A A . 12 PHE CE2 1 1 9 3677 1 1 12 PHE CG C -3.011 4.192 -0.238 1.00 . A A . 12 PHE CG 1 1 9 3678 1 1 12 PHE CZ C -4.063 6.295 -1.758 1.00 . A A . 12 PHE CZ 1 1 9 3679 1 1 12 PHE H H -3.190 1.030 -0.618 1.00 . A A . 12 PHE H 1 1 9 3680 1 1 12 PHE HA H -1.055 2.870 -1.056 1.00 . A A . 12 PHE HA 1 1 9 3681 1 1 12 PHE HB2 H -3.245 2.409 0.906 1.00 . A A . 12 PHE HB2 1 1 9 3682 1 1 12 PHE HB3 H -1.937 3.459 1.449 1.00 . A A . 12 PHE HB3 1 1 9 3683 1 1 12 PHE HD1 H -3.881 2.898 -1.725 1.00 . A A . 12 PHE HD1 1 1 9 3684 1 1 12 PHE HD2 H -2.263 5.728 1.074 1.00 . A A . 12 PHE HD2 1 1 9 3685 1 1 12 PHE HE1 H -4.811 4.760 -3.070 1.00 . A A . 12 PHE HE1 1 1 9 3686 1 1 12 PHE HE2 H -3.195 7.590 -0.272 1.00 . A A . 12 PHE HE2 1 1 9 3687 1 1 12 PHE HZ H -4.468 7.106 -2.343 1.00 . A A . 12 PHE HZ 1 1 9 3688 1 1 12 PHE N N -2.233 1.111 -0.822 1.00 . A A . 12 PHE N 1 1 9 3689 1 1 12 PHE O O 0.808 2.213 0.562 1.00 . A A . 12 PHE O 1 1 9 3690 1 1 13 LEU C C 1.560 -0.559 1.407 1.00 . A A . 13 LEU C 1 1 9 3691 1 1 13 LEU CA C 0.494 0.125 2.274 1.00 . A A . 13 LEU CA 1 1 9 3692 1 1 13 LEU CB C -0.227 -0.901 3.156 1.00 . A A . 13 LEU CB 1 1 9 3693 1 1 13 LEU CD1 C -0.349 -1.633 5.543 1.00 . A A . 13 LEU CD1 1 1 9 3694 1 1 13 LEU CD2 C 1.660 -2.199 4.168 1.00 . A A . 13 LEU CD2 1 1 9 3695 1 1 13 LEU CG C 0.583 -1.141 4.434 1.00 . A A . 13 LEU CG 1 1 9 3696 1 1 13 LEU H H -1.476 0.328 1.416 1.00 . A A . 13 LEU H 1 1 9 3697 1 1 13 LEU HA H 0.941 0.892 2.887 1.00 . A A . 13 LEU HA 1 1 9 3698 1 1 13 LEU HB2 H -1.206 -0.525 3.416 1.00 . A A . 13 LEU HB2 1 1 9 3699 1 1 13 LEU HB3 H -0.330 -1.830 2.616 1.00 . A A . 13 LEU HB3 1 1 9 3700 1 1 13 LEU HD11 H 0.148 -1.539 6.498 1.00 . A A . 13 LEU HD11 1 1 9 3701 1 1 13 LEU HD12 H -0.600 -2.669 5.369 1.00 . A A . 13 LEU HD12 1 1 9 3702 1 1 13 LEU HD13 H -1.250 -1.039 5.545 1.00 . A A . 13 LEU HD13 1 1 9 3703 1 1 13 LEU HD21 H 1.290 -2.918 3.452 1.00 . A A . 13 LEU HD21 1 1 9 3704 1 1 13 LEU HD22 H 1.904 -2.704 5.092 1.00 . A A . 13 LEU HD22 1 1 9 3705 1 1 13 LEU HD23 H 2.545 -1.721 3.775 1.00 . A A . 13 LEU HD23 1 1 9 3706 1 1 13 LEU HG H 1.051 -0.218 4.743 1.00 . A A . 13 LEU HG 1 1 9 3707 1 1 13 LEU N N -0.573 0.711 1.404 1.00 . A A . 13 LEU N 1 1 9 3708 1 1 13 LEU O O 2.738 -0.500 1.700 1.00 . A A . 13 LEU O 1 1 9 3709 1 1 14 LEU C C 3.061 -0.846 -1.221 1.00 . A A . 14 LEU C 1 1 9 3710 1 1 14 LEU CA C 2.137 -1.880 -0.562 1.00 . A A . 14 LEU CA 1 1 9 3711 1 1 14 LEU CB C 1.286 -2.600 -1.620 1.00 . A A . 14 LEU CB 1 1 9 3712 1 1 14 LEU CD1 C 3.292 -3.943 -2.316 1.00 . A A . 14 LEU CD1 1 1 9 3713 1 1 14 LEU CD2 C 1.729 -4.841 -0.583 1.00 . A A . 14 LEU CD2 1 1 9 3714 1 1 14 LEU CG C 1.830 -4.014 -1.870 1.00 . A A . 14 LEU CG 1 1 9 3715 1 1 14 LEU H H 0.195 -1.225 0.120 1.00 . A A . 14 LEU H 1 1 9 3716 1 1 14 LEU HA H 2.714 -2.594 -0.005 1.00 . A A . 14 LEU HA 1 1 9 3717 1 1 14 LEU HB2 H 0.264 -2.667 -1.273 1.00 . A A . 14 LEU HB2 1 1 9 3718 1 1 14 LEU HB3 H 1.310 -2.041 -2.543 1.00 . A A . 14 LEU HB3 1 1 9 3719 1 1 14 LEU HD11 H 3.377 -3.284 -3.167 1.00 . A A . 14 LEU HD11 1 1 9 3720 1 1 14 LEU HD12 H 3.633 -4.931 -2.591 1.00 . A A . 14 LEU HD12 1 1 9 3721 1 1 14 LEU HD13 H 3.899 -3.566 -1.506 1.00 . A A . 14 LEU HD13 1 1 9 3722 1 1 14 LEU HD21 H 2.461 -4.491 0.129 1.00 . A A . 14 LEU HD21 1 1 9 3723 1 1 14 LEU HD22 H 1.914 -5.881 -0.808 1.00 . A A . 14 LEU HD22 1 1 9 3724 1 1 14 LEU HD23 H 0.739 -4.735 -0.163 1.00 . A A . 14 LEU HD23 1 1 9 3725 1 1 14 LEU HG H 1.244 -4.488 -2.646 1.00 . A A . 14 LEU HG 1 1 9 3726 1 1 14 LEU N N 1.151 -1.198 0.337 1.00 . A A . 14 LEU N 1 1 9 3727 1 1 14 LEU O O 4.224 -1.107 -1.462 1.00 . A A . 14 LEU O 1 1 9 3728 1 1 15 VAL C C 4.424 1.917 -1.137 1.00 . A A . 15 VAL C 1 1 9 3729 1 1 15 VAL CA C 3.392 1.384 -2.142 1.00 . A A . 15 VAL CA 1 1 9 3730 1 1 15 VAL CB C 2.409 2.490 -2.554 1.00 . A A . 15 VAL CB 1 1 9 3731 1 1 15 VAL CG1 C 3.182 3.680 -3.133 1.00 . A A . 15 VAL CG1 1 1 9 3732 1 1 15 VAL CG2 C 1.445 1.954 -3.618 1.00 . A A . 15 VAL CG2 1 1 9 3733 1 1 15 VAL H H 1.610 0.506 -1.291 1.00 . A A . 15 VAL H 1 1 9 3734 1 1 15 VAL HA H 3.888 0.990 -3.015 1.00 . A A . 15 VAL HA 1 1 9 3735 1 1 15 VAL HB H 1.848 2.813 -1.689 1.00 . A A . 15 VAL HB 1 1 9 3736 1 1 15 VAL HG11 H 3.793 4.122 -2.360 1.00 . A A . 15 VAL HG11 1 1 9 3737 1 1 15 VAL HG12 H 2.483 4.416 -3.504 1.00 . A A . 15 VAL HG12 1 1 9 3738 1 1 15 VAL HG13 H 3.813 3.342 -3.941 1.00 . A A . 15 VAL HG13 1 1 9 3739 1 1 15 VAL HG21 H 1.747 2.311 -4.592 1.00 . A A . 15 VAL HG21 1 1 9 3740 1 1 15 VAL HG22 H 0.444 2.300 -3.403 1.00 . A A . 15 VAL HG22 1 1 9 3741 1 1 15 VAL HG23 H 1.461 0.874 -3.609 1.00 . A A . 15 VAL HG23 1 1 9 3742 1 1 15 VAL N N 2.549 0.324 -1.504 1.00 . A A . 15 VAL N 1 1 9 3743 1 1 15 VAL O O 5.603 1.978 -1.423 1.00 . A A . 15 VAL O 1 1 9 3744 1 1 16 PHE C C 5.797 1.690 1.643 1.00 . A A . 16 PHE C 1 1 9 3745 1 1 16 PHE CA C 4.946 2.829 1.061 1.00 . A A . 16 PHE CA 1 1 9 3746 1 1 16 PHE CB C 4.068 3.455 2.148 1.00 . A A . 16 PHE CB 1 1 9 3747 1 1 16 PHE CD1 C 5.627 4.206 3.983 1.00 . A A . 16 PHE CD1 1 1 9 3748 1 1 16 PHE CD2 C 4.779 5.860 2.424 1.00 . A A . 16 PHE CD2 1 1 9 3749 1 1 16 PHE CE1 C 6.345 5.204 4.651 1.00 . A A . 16 PHE CE1 1 1 9 3750 1 1 16 PHE CE2 C 5.498 6.858 3.093 1.00 . A A . 16 PHE CE2 1 1 9 3751 1 1 16 PHE CG C 4.843 4.533 2.869 1.00 . A A . 16 PHE CG 1 1 9 3752 1 1 16 PHE CZ C 6.280 6.530 4.207 1.00 . A A . 16 PHE CZ 1 1 9 3753 1 1 16 PHE H H 3.031 2.240 0.248 1.00 . A A . 16 PHE H 1 1 9 3754 1 1 16 PHE HA H 5.582 3.582 0.623 1.00 . A A . 16 PHE HA 1 1 9 3755 1 1 16 PHE HB2 H 3.188 3.888 1.693 1.00 . A A . 16 PHE HB2 1 1 9 3756 1 1 16 PHE HB3 H 3.770 2.694 2.852 1.00 . A A . 16 PHE HB3 1 1 9 3757 1 1 16 PHE HD1 H 5.677 3.184 4.325 1.00 . A A . 16 PHE HD1 1 1 9 3758 1 1 16 PHE HD2 H 4.176 6.113 1.566 1.00 . A A . 16 PHE HD2 1 1 9 3759 1 1 16 PHE HE1 H 6.949 4.951 5.509 1.00 . A A . 16 PHE HE1 1 1 9 3760 1 1 16 PHE HE2 H 5.448 7.881 2.751 1.00 . A A . 16 PHE HE2 1 1 9 3761 1 1 16 PHE HZ H 6.834 7.300 4.724 1.00 . A A . 16 PHE HZ 1 1 9 3762 1 1 16 PHE N N 3.988 2.300 0.038 1.00 . A A . 16 PHE N 1 1 9 3763 1 1 16 PHE O O 6.974 1.858 1.903 1.00 . A A . 16 PHE O 1 1 9 3764 1 1 17 GLY C C 7.084 -1.037 1.448 1.00 . A A . 17 GLY C 1 1 9 3765 1 1 17 GLY CA C 5.973 -0.620 2.414 1.00 . A A . 17 GLY CA 1 1 9 3766 1 1 17 GLY H H 4.257 0.425 1.631 1.00 . A A . 17 GLY H 1 1 9 3767 1 1 17 GLY HA2 H 6.408 -0.333 3.361 1.00 . A A . 17 GLY HA2 1 1 9 3768 1 1 17 GLY HA3 H 5.304 -1.453 2.566 1.00 . A A . 17 GLY HA3 1 1 9 3769 1 1 17 GLY N N 5.208 0.534 1.849 1.00 . A A . 17 GLY N 1 1 9 3770 1 1 17 GLY O O 8.213 -1.244 1.851 1.00 . A A . 17 GLY O 1 1 9 3771 1 1 18 GLU C C 8.965 -0.529 -0.825 1.00 . A A . 18 GLU C 1 1 9 3772 1 1 18 GLU CA C 7.831 -1.559 -0.813 1.00 . A A . 18 GLU CA 1 1 9 3773 1 1 18 GLU CB C 7.122 -1.603 -2.171 1.00 . A A . 18 GLU CB 1 1 9 3774 1 1 18 GLU CD C 7.342 -2.278 -4.574 1.00 . A A . 18 GLU CD 1 1 9 3775 1 1 18 GLU CG C 8.023 -2.293 -3.202 1.00 . A A . 18 GLU CG 1 1 9 3776 1 1 18 GLU H H 5.863 -0.982 -0.126 1.00 . A A . 18 GLU H 1 1 9 3777 1 1 18 GLU HA H 8.219 -2.530 -0.567 1.00 . A A . 18 GLU HA 1 1 9 3778 1 1 18 GLU HB2 H 6.198 -2.154 -2.076 1.00 . A A . 18 GLU HB2 1 1 9 3779 1 1 18 GLU HB3 H 6.909 -0.596 -2.499 1.00 . A A . 18 GLU HB3 1 1 9 3780 1 1 18 GLU HG2 H 8.966 -1.768 -3.263 1.00 . A A . 18 GLU HG2 1 1 9 3781 1 1 18 GLU HG3 H 8.197 -3.315 -2.901 1.00 . A A . 18 GLU HG3 1 1 9 3782 1 1 18 GLU N N 6.781 -1.157 0.177 1.00 . A A . 18 GLU N 1 1 9 3783 1 1 18 GLU O O 10.123 -0.876 -0.943 1.00 . A A . 18 GLU O 1 1 9 3784 1 1 18 GLU OE1 O 7.456 -1.274 -5.259 1.00 . A A . 18 GLU OE1 1 1 9 3785 1 1 18 GLU OE2 O 6.722 -3.273 -4.916 1.00 . A A . 18 GLU OE2 1 1 9 3786 1 1 19 ASN C C 10.621 1.600 0.529 1.00 . A A . 19 ASN C 1 1 9 3787 1 1 19 ASN CA C 9.696 1.788 -0.679 1.00 . A A . 19 ASN CA 1 1 9 3788 1 1 19 ASN CB C 8.944 3.118 -0.581 1.00 . A A . 19 ASN CB 1 1 9 3789 1 1 19 ASN CG C 8.680 3.658 -1.988 1.00 . A A . 19 ASN CG 1 1 9 3790 1 1 19 ASN H H 7.696 0.976 -0.588 1.00 . A A . 19 ASN H 1 1 9 3791 1 1 19 ASN HA H 10.266 1.754 -1.590 1.00 . A A . 19 ASN HA 1 1 9 3792 1 1 19 ASN HB2 H 8.004 2.963 -0.070 1.00 . A A . 19 ASN HB2 1 1 9 3793 1 1 19 ASN HB3 H 9.540 3.829 -0.030 1.00 . A A . 19 ASN HB3 1 1 9 3794 1 1 19 ASN HD21 H 6.934 2.729 -2.176 1.00 . A A . 19 ASN HD21 1 1 9 3795 1 1 19 ASN HD22 H 7.409 3.663 -3.511 1.00 . A A . 19 ASN HD22 1 1 9 3796 1 1 19 ASN N N 8.639 0.730 -0.690 1.00 . A A . 19 ASN N 1 1 9 3797 1 1 19 ASN ND2 N 7.584 3.323 -2.610 1.00 . A A . 19 ASN ND2 1 1 9 3798 1 1 19 ASN O O 11.799 1.885 0.466 1.00 . A A . 19 ASN O 1 1 9 3799 1 1 19 ASN OD1 O 9.483 4.393 -2.527 1.00 . A A . 19 ASN OD1 1 1 9 3800 1 1 20 GLY C C 11.631 -0.473 2.730 1.00 . A A . 20 GLY C 1 1 9 3801 1 1 20 GLY CA C 10.931 0.887 2.835 1.00 . A A . 20 GLY CA 1 1 9 3802 1 1 20 GLY H H 9.141 0.882 1.638 1.00 . A A . 20 GLY H 1 1 9 3803 1 1 20 GLY HA2 H 11.671 1.670 2.911 1.00 . A A . 20 GLY HA2 1 1 9 3804 1 1 20 GLY HA3 H 10.304 0.896 3.714 1.00 . A A . 20 GLY HA3 1 1 9 3805 1 1 20 GLY N N 10.093 1.111 1.621 1.00 . A A . 20 GLY N 1 1 9 3806 1 1 20 GLY O O 12.791 -0.608 3.075 1.00 . A A . 20 GLY O 1 1 9 3807 1 1 21 VAL C C 12.687 -2.813 1.077 1.00 . A A . 21 VAL C 1 1 9 3808 1 1 21 VAL CA C 11.564 -2.837 2.123 1.00 . A A . 21 VAL CA 1 1 9 3809 1 1 21 VAL CB C 10.427 -3.769 1.682 1.00 . A A . 21 VAL CB 1 1 9 3810 1 1 21 VAL CG1 C 10.996 -5.137 1.297 1.00 . A A . 21 VAL CG1 1 1 9 3811 1 1 21 VAL CG2 C 9.433 -3.944 2.835 1.00 . A A . 21 VAL CG2 1 1 9 3812 1 1 21 VAL H H 10.001 -1.346 1.980 1.00 . A A . 21 VAL H 1 1 9 3813 1 1 21 VAL HA H 11.951 -3.157 3.073 1.00 . A A . 21 VAL HA 1 1 9 3814 1 1 21 VAL HB H 9.919 -3.338 0.830 1.00 . A A . 21 VAL HB 1 1 9 3815 1 1 21 VAL HG11 H 10.189 -5.847 1.191 1.00 . A A . 21 VAL HG11 1 1 9 3816 1 1 21 VAL HG12 H 11.674 -5.476 2.068 1.00 . A A . 21 VAL HG12 1 1 9 3817 1 1 21 VAL HG13 H 11.529 -5.056 0.361 1.00 . A A . 21 VAL HG13 1 1 9 3818 1 1 21 VAL HG21 H 9.804 -4.693 3.519 1.00 . A A . 21 VAL HG21 1 1 9 3819 1 1 21 VAL HG22 H 8.477 -4.257 2.442 1.00 . A A . 21 VAL HG22 1 1 9 3820 1 1 21 VAL HG23 H 9.318 -3.006 3.357 1.00 . A A . 21 VAL HG23 1 1 9 3821 1 1 21 VAL N N 10.937 -1.481 2.253 1.00 . A A . 21 VAL N 1 1 9 3822 1 1 21 VAL O O 13.652 -3.546 1.180 1.00 . A A . 21 VAL O 1 1 9 3823 1 1 22 PHE C C 14.826 -1.040 -0.499 1.00 . A A . 22 PHE C 1 1 9 3824 1 1 22 PHE CA C 13.640 -1.897 -0.971 1.00 . A A . 22 PHE CA 1 1 9 3825 1 1 22 PHE CB C 12.963 -1.253 -2.186 1.00 . A A . 22 PHE CB 1 1 9 3826 1 1 22 PHE CD1 C 11.327 -3.139 -2.567 1.00 . A A . 22 PHE CD1 1 1 9 3827 1 1 22 PHE CD2 C 12.821 -2.507 -4.369 1.00 . A A . 22 PHE CD2 1 1 9 3828 1 1 22 PHE CE1 C 10.765 -4.130 -3.379 1.00 . A A . 22 PHE CE1 1 1 9 3829 1 1 22 PHE CE2 C 12.259 -3.499 -5.182 1.00 . A A . 22 PHE CE2 1 1 9 3830 1 1 22 PHE CG C 12.356 -2.327 -3.061 1.00 . A A . 22 PHE CG 1 1 9 3831 1 1 22 PHE CZ C 11.231 -4.310 -4.686 1.00 . A A . 22 PHE CZ 1 1 9 3832 1 1 22 PHE H H 11.789 -1.390 0.025 1.00 . A A . 22 PHE H 1 1 9 3833 1 1 22 PHE HA H 13.978 -2.886 -1.225 1.00 . A A . 22 PHE HA 1 1 9 3834 1 1 22 PHE HB2 H 12.188 -0.579 -1.852 1.00 . A A . 22 PHE HB2 1 1 9 3835 1 1 22 PHE HB3 H 13.697 -0.701 -2.754 1.00 . A A . 22 PHE HB3 1 1 9 3836 1 1 22 PHE HD1 H 10.967 -3.001 -1.558 1.00 . A A . 22 PHE HD1 1 1 9 3837 1 1 22 PHE HD2 H 13.614 -1.882 -4.752 1.00 . A A . 22 PHE HD2 1 1 9 3838 1 1 22 PHE HE1 H 9.972 -4.757 -2.998 1.00 . A A . 22 PHE HE1 1 1 9 3839 1 1 22 PHE HE2 H 12.617 -3.638 -6.190 1.00 . A A . 22 PHE HE2 1 1 9 3840 1 1 22 PHE HZ H 10.797 -5.075 -5.314 1.00 . A A . 22 PHE HZ 1 1 9 3841 1 1 22 PHE N N 12.574 -1.973 0.080 1.00 . A A . 22 PHE N 1 1 9 3842 1 1 22 PHE O O 15.773 -0.830 -1.234 1.00 . A A . 22 PHE O 1 1 9 3843 1 1 23 PHE C C 16.629 -0.445 2.385 1.00 . A A . 23 PHE C 1 1 9 3844 1 1 23 PHE CA C 15.920 0.284 1.233 1.00 . A A . 23 PHE CA 1 1 9 3845 1 1 23 PHE CB C 15.262 1.578 1.727 1.00 . A A . 23 PHE CB 1 1 9 3846 1 1 23 PHE CD1 C 14.540 2.416 -0.542 1.00 . A A . 23 PHE CD1 1 1 9 3847 1 1 23 PHE CD2 C 16.056 3.774 0.776 1.00 . A A . 23 PHE CD2 1 1 9 3848 1 1 23 PHE CE1 C 14.564 3.376 -1.560 1.00 . A A . 23 PHE CE1 1 1 9 3849 1 1 23 PHE CE2 C 16.079 4.734 -0.242 1.00 . A A . 23 PHE CE2 1 1 9 3850 1 1 23 PHE CG C 15.287 2.614 0.626 1.00 . A A . 23 PHE CG 1 1 9 3851 1 1 23 PHE CZ C 15.334 4.535 -1.410 1.00 . A A . 23 PHE CZ 1 1 9 3852 1 1 23 PHE H H 14.024 -0.734 1.297 1.00 . A A . 23 PHE H 1 1 9 3853 1 1 23 PHE HA H 16.619 0.503 0.441 1.00 . A A . 23 PHE HA 1 1 9 3854 1 1 23 PHE HB2 H 14.238 1.376 2.008 1.00 . A A . 23 PHE HB2 1 1 9 3855 1 1 23 PHE HB3 H 15.802 1.951 2.584 1.00 . A A . 23 PHE HB3 1 1 9 3856 1 1 23 PHE HD1 H 13.947 1.522 -0.659 1.00 . A A . 23 PHE HD1 1 1 9 3857 1 1 23 PHE HD2 H 16.631 3.928 1.677 1.00 . A A . 23 PHE HD2 1 1 9 3858 1 1 23 PHE HE1 H 13.988 3.223 -2.461 1.00 . A A . 23 PHE HE1 1 1 9 3859 1 1 23 PHE HE2 H 16.672 5.629 -0.127 1.00 . A A . 23 PHE HE2 1 1 9 3860 1 1 23 PHE HZ H 15.352 5.277 -2.195 1.00 . A A . 23 PHE HZ 1 1 9 3861 1 1 23 PHE N N 14.791 -0.549 0.718 1.00 . A A . 23 PHE N 1 1 9 3862 1 1 23 PHE O O 17.113 0.171 3.319 1.00 . A A . 23 PHE O 1 1 9 3863 1 1 24 TYR C C 17.900 -3.860 2.855 1.00 . A A . 24 TYR C 1 1 9 3864 1 1 24 TYR CA C 17.365 -2.532 3.409 1.00 . A A . 24 TYR CA 1 1 9 3865 1 1 24 TYR CB C 16.272 -2.777 4.453 1.00 . A A . 24 TYR CB 1 1 9 3866 1 1 24 TYR CD1 C 17.749 -3.570 6.335 1.00 . A A . 24 TYR CD1 1 1 9 3867 1 1 24 TYR CD2 C 16.492 -1.516 6.626 1.00 . A A . 24 TYR CD2 1 1 9 3868 1 1 24 TYR CE1 C 18.287 -3.422 7.619 1.00 . A A . 24 TYR CE1 1 1 9 3869 1 1 24 TYR CE2 C 17.031 -1.368 7.908 1.00 . A A . 24 TYR CE2 1 1 9 3870 1 1 24 TYR CG C 16.852 -2.617 5.839 1.00 . A A . 24 TYR CG 1 1 9 3871 1 1 24 TYR CZ C 17.929 -2.321 8.405 1.00 . A A . 24 TYR CZ 1 1 9 3872 1 1 24 TYR H H 16.297 -2.228 1.563 1.00 . A A . 24 TYR H 1 1 9 3873 1 1 24 TYR HA H 18.168 -1.956 3.844 1.00 . A A . 24 TYR HA 1 1 9 3874 1 1 24 TYR HB2 H 15.477 -2.062 4.310 1.00 . A A . 24 TYR HB2 1 1 9 3875 1 1 24 TYR HB3 H 15.881 -3.777 4.340 1.00 . A A . 24 TYR HB3 1 1 9 3876 1 1 24 TYR HD1 H 18.027 -4.419 5.729 1.00 . A A . 24 TYR HD1 1 1 9 3877 1 1 24 TYR HD2 H 15.800 -0.781 6.241 1.00 . A A . 24 TYR HD2 1 1 9 3878 1 1 24 TYR HE1 H 18.980 -4.155 8.002 1.00 . A A . 24 TYR HE1 1 1 9 3879 1 1 24 TYR HE2 H 16.754 -0.519 8.515 1.00 . A A . 24 TYR HE2 1 1 9 3880 1 1 24 TYR HH H 17.888 -2.635 10.288 1.00 . A A . 24 TYR HH 1 1 9 3881 1 1 24 TYR N N 16.693 -1.755 2.325 1.00 . A A . 24 TYR N 1 1 9 3882 1 1 24 TYR O O 17.556 -4.929 3.325 1.00 . A A . 24 TYR O 1 1 9 3883 1 1 24 TYR OH O 18.460 -2.173 9.670 1.00 . A A . 24 TYR OH 1 1 9 3884 1 1 25 LYS C C 20.825 -4.891 1.046 1.00 . A A . 25 LYS C 1 1 9 3885 1 1 25 LYS CA C 19.313 -5.041 1.259 1.00 . A A . 25 LYS CA 1 1 9 3886 1 1 25 LYS CB C 18.591 -5.206 -0.083 1.00 . A A . 25 LYS CB 1 1 9 3887 1 1 25 LYS CD C 18.130 -6.804 -1.952 1.00 . A A . 25 LYS CD 1 1 9 3888 1 1 25 LYS CE C 19.301 -6.894 -2.936 1.00 . A A . 25 LYS CE 1 1 9 3889 1 1 25 LYS CG C 18.666 -6.671 -0.525 1.00 . A A . 25 LYS CG 1 1 9 3890 1 1 25 LYS H H 19.004 -2.919 1.499 1.00 . A A . 25 LYS H 1 1 9 3891 1 1 25 LYS HA H 19.106 -5.889 1.893 1.00 . A A . 25 LYS HA 1 1 9 3892 1 1 25 LYS HB2 H 17.557 -4.914 0.027 1.00 . A A . 25 LYS HB2 1 1 9 3893 1 1 25 LYS HB3 H 19.066 -4.583 -0.825 1.00 . A A . 25 LYS HB3 1 1 9 3894 1 1 25 LYS HD2 H 17.527 -7.699 -2.026 1.00 . A A . 25 LYS HD2 1 1 9 3895 1 1 25 LYS HD3 H 17.525 -5.942 -2.193 1.00 . A A . 25 LYS HD3 1 1 9 3896 1 1 25 LYS HE2 H 19.770 -5.925 -3.049 1.00 . A A . 25 LYS HE2 1 1 9 3897 1 1 25 LYS HE3 H 20.021 -7.623 -2.599 1.00 . A A . 25 LYS HE3 1 1 9 3898 1 1 25 LYS HG2 H 19.694 -7.003 -0.492 1.00 . A A . 25 LYS HG2 1 1 9 3899 1 1 25 LYS HG3 H 18.071 -7.278 0.140 1.00 . A A . 25 LYS HG3 1 1 9 3900 1 1 25 LYS HZ1 H 17.998 -6.630 -4.542 1.00 . A A . 25 LYS HZ1 1 1 9 3901 1 1 25 LYS HZ2 H 18.224 -8.254 -4.093 1.00 . A A . 25 LYS HZ2 1 1 9 3902 1 1 25 LYS HZ3 H 19.440 -7.427 -4.945 1.00 . A A . 25 LYS HZ3 1 1 9 3903 1 1 25 LYS N N 18.743 -3.793 1.857 1.00 . A A . 25 LYS N 1 1 9 3904 1 1 25 LYS NZ N 18.695 -7.334 -4.226 1.00 . A A . 25 LYS NZ 1 1 9 3905 1 1 25 LYS O O 21.543 -5.816 1.385 1.00 . A A . 25 LYS O 1 1 9 3906 1 1 25 LYS OXT O 21.238 -3.855 0.547 1.00 . A A . 25 LYS OXT 1 1 10 3907 1 1 1 HIS C C -19.638 -3.859 -1.060 1.00 . A A . 1 HIS C 1 1 10 3908 1 1 1 HIS CA C -19.754 -4.867 -2.211 1.00 . A A . 1 HIS CA 1 1 10 3909 1 1 1 HIS CB C -21.216 -5.280 -2.421 1.00 . A A . 1 HIS CB 1 1 10 3910 1 1 1 HIS CD2 C -21.531 -5.045 -5.020 1.00 . A A . 1 HIS CD2 1 1 10 3911 1 1 1 HIS CE1 C -21.683 -7.150 -5.511 1.00 . A A . 1 HIS CE1 1 1 10 3912 1 1 1 HIS CG C -21.414 -5.737 -3.841 1.00 . A A . 1 HIS CG 1 1 10 3913 1 1 1 HIS HA H -19.360 -4.441 -3.121 1.00 . A A . 1 HIS HA 1 1 10 3914 1 1 1 HIS HB2 H -21.465 -6.085 -1.745 1.00 . A A . 1 HIS HB2 1 1 10 3915 1 1 1 HIS HB3 H -21.860 -4.435 -2.224 1.00 . A A . 1 HIS HB3 1 1 10 3916 1 1 1 HIS HD1 H -21.472 -7.836 -3.559 1.00 . A A . 1 HIS HD1 1 1 10 3917 1 1 1 HIS HD2 H -21.497 -3.969 -5.117 1.00 . A A . 1 HIS HD2 1 1 10 3918 1 1 1 HIS HE1 H -21.792 -8.073 -6.059 1.00 . A A . 1 HIS HE1 1 1 10 3919 1 1 1 HIS N N -19.029 -6.131 -1.874 1.00 . A A . 1 HIS N 1 1 10 3920 1 1 1 HIS ND1 N -21.515 -7.078 -4.178 1.00 . A A . 1 HIS ND1 1 1 10 3921 1 1 1 HIS NE2 N -21.701 -5.938 -6.074 1.00 . A A . 1 HIS NE2 1 1 10 3922 1 1 1 HIS O O -19.081 -2.790 -1.220 1.00 . A A . 1 HIS O 1 1 10 3923 1 1 2 ALA C C -18.675 -3.302 1.889 1.00 . A A . 2 ALA C 1 1 10 3924 1 1 2 ALA CA C -20.074 -3.253 1.262 1.00 . A A . 2 ALA CA 1 1 10 3925 1 1 2 ALA CB C -21.127 -3.750 2.255 1.00 . A A . 2 ALA CB 1 1 10 3926 1 1 2 ALA H H -20.599 -5.061 0.204 1.00 . A A . 2 ALA H 1 1 10 3927 1 1 2 ALA HA H -20.310 -2.247 0.948 1.00 . A A . 2 ALA HA 1 1 10 3928 1 1 2 ALA HB1 H -21.137 -3.103 3.121 1.00 . A A . 2 ALA HB1 1 1 10 3929 1 1 2 ALA HB2 H -20.886 -4.757 2.561 1.00 . A A . 2 ALA HB2 1 1 10 3930 1 1 2 ALA HB3 H -22.099 -3.738 1.785 1.00 . A A . 2 ALA HB3 1 1 10 3931 1 1 2 ALA N N -20.157 -4.193 0.099 1.00 . A A . 2 ALA N 1 1 10 3932 1 1 2 ALA O O -17.936 -4.252 1.702 1.00 . A A . 2 ALA O 1 1 10 3933 1 1 3 TRP C C -15.850 -2.467 2.240 1.00 . A A . 3 TRP C 1 1 10 3934 1 1 3 TRP CA C -16.959 -2.238 3.281 1.00 . A A . 3 TRP CA 1 1 10 3935 1 1 3 TRP CB C -16.973 -3.363 4.325 1.00 . A A . 3 TRP CB 1 1 10 3936 1 1 3 TRP CD1 C -14.929 -2.556 5.574 1.00 . A A . 3 TRP CD1 1 1 10 3937 1 1 3 TRP CD2 C -16.722 -2.790 6.912 1.00 . A A . 3 TRP CD2 1 1 10 3938 1 1 3 TRP CE2 C -15.661 -2.336 7.731 1.00 . A A . 3 TRP CE2 1 1 10 3939 1 1 3 TRP CE3 C -17.973 -3.017 7.515 1.00 . A A . 3 TRP CE3 1 1 10 3940 1 1 3 TRP CG C -16.231 -2.920 5.546 1.00 . A A . 3 TRP CG 1 1 10 3941 1 1 3 TRP CH2 C -17.083 -2.347 9.680 1.00 . A A . 3 TRP CH2 1 1 10 3942 1 1 3 TRP CZ2 C -15.834 -2.116 9.098 1.00 . A A . 3 TRP CZ2 1 1 10 3943 1 1 3 TRP CZ3 C -18.149 -2.797 8.891 1.00 . A A . 3 TRP CZ3 1 1 10 3944 1 1 3 TRP H H -18.930 -1.530 2.761 1.00 . A A . 3 TRP H 1 1 10 3945 1 1 3 TRP HA H -16.813 -1.288 3.772 1.00 . A A . 3 TRP HA 1 1 10 3946 1 1 3 TRP HB2 H -17.994 -3.597 4.589 1.00 . A A . 3 TRP HB2 1 1 10 3947 1 1 3 TRP HB3 H -16.499 -4.242 3.914 1.00 . A A . 3 TRP HB3 1 1 10 3948 1 1 3 TRP HD1 H -14.263 -2.538 4.725 1.00 . A A . 3 TRP HD1 1 1 10 3949 1 1 3 TRP HE1 H -13.704 -1.905 7.159 1.00 . A A . 3 TRP HE1 1 1 10 3950 1 1 3 TRP HE3 H -18.802 -3.364 6.917 1.00 . A A . 3 TRP HE3 1 1 10 3951 1 1 3 TRP HH2 H -17.225 -2.180 10.738 1.00 . A A . 3 TRP HH2 1 1 10 3952 1 1 3 TRP HZ2 H -15.008 -1.770 9.701 1.00 . A A . 3 TRP HZ2 1 1 10 3953 1 1 3 TRP HZ3 H -19.115 -2.976 9.344 1.00 . A A . 3 TRP HZ3 1 1 10 3954 1 1 3 TRP N N -18.310 -2.279 2.631 1.00 . A A . 3 TRP N 1 1 10 3955 1 1 3 TRP NE1 N -14.590 -2.207 6.869 1.00 . A A . 3 TRP NE1 1 1 10 3956 1 1 3 TRP O O -14.906 -3.200 2.471 1.00 . A A . 3 TRP O 1 1 10 3957 1 1 4 TYR C C -13.775 -0.990 0.216 1.00 . A A . 4 TYR C 1 1 10 3958 1 1 4 TYR CA C -14.915 -2.007 0.035 1.00 . A A . 4 TYR CA 1 1 10 3959 1 1 4 TYR CB C -15.646 -1.786 -1.301 1.00 . A A . 4 TYR CB 1 1 10 3960 1 1 4 TYR CD1 C -15.202 0.631 -1.904 1.00 . A A . 4 TYR CD1 1 1 10 3961 1 1 4 TYR CD2 C -17.404 0.018 -1.094 1.00 . A A . 4 TYR CD2 1 1 10 3962 1 1 4 TYR CE1 C -15.620 1.961 -2.030 1.00 . A A . 4 TYR CE1 1 1 10 3963 1 1 4 TYR CE2 C -17.821 1.348 -1.221 1.00 . A A . 4 TYR CE2 1 1 10 3964 1 1 4 TYR CG C -16.095 -0.343 -1.434 1.00 . A A . 4 TYR CG 1 1 10 3965 1 1 4 TYR CZ C -16.929 2.319 -1.689 1.00 . A A . 4 TYR CZ 1 1 10 3966 1 1 4 TYR H H -16.726 -1.247 0.938 1.00 . A A . 4 TYR H 1 1 10 3967 1 1 4 TYR HA H -14.519 -3.010 0.068 1.00 . A A . 4 TYR HA 1 1 10 3968 1 1 4 TYR HB2 H -14.979 -2.027 -2.115 1.00 . A A . 4 TYR HB2 1 1 10 3969 1 1 4 TYR HB3 H -16.510 -2.433 -1.346 1.00 . A A . 4 TYR HB3 1 1 10 3970 1 1 4 TYR HD1 H -14.192 0.355 -2.167 1.00 . A A . 4 TYR HD1 1 1 10 3971 1 1 4 TYR HD2 H -18.094 -0.731 -0.732 1.00 . A A . 4 TYR HD2 1 1 10 3972 1 1 4 TYR HE1 H -14.932 2.710 -2.392 1.00 . A A . 4 TYR HE1 1 1 10 3973 1 1 4 TYR HE2 H -18.831 1.623 -0.956 1.00 . A A . 4 TYR HE2 1 1 10 3974 1 1 4 TYR HH H -17.294 4.041 -0.948 1.00 . A A . 4 TYR HH 1 1 10 3975 1 1 4 TYR N N -15.960 -1.837 1.096 1.00 . A A . 4 TYR N 1 1 10 3976 1 1 4 TYR O O -12.919 -0.851 -0.640 1.00 . A A . 4 TYR O 1 1 10 3977 1 1 4 TYR OH O -17.340 3.630 -1.814 1.00 . A A . 4 TYR OH 1 1 10 3978 1 1 5 SER C C -11.426 0.059 2.197 1.00 . A A . 5 SER C 1 1 10 3979 1 1 5 SER CA C -12.662 0.718 1.559 1.00 . A A . 5 SER CA 1 1 10 3980 1 1 5 SER CB C -13.280 1.739 2.516 1.00 . A A . 5 SER CB 1 1 10 3981 1 1 5 SER H H -14.439 -0.417 2.003 1.00 . A A . 5 SER H 1 1 10 3982 1 1 5 SER HA H -12.393 1.202 0.634 1.00 . A A . 5 SER HA 1 1 10 3983 1 1 5 SER HB2 H -14.297 1.941 2.224 1.00 . A A . 5 SER HB2 1 1 10 3984 1 1 5 SER HB3 H -13.269 1.341 3.522 1.00 . A A . 5 SER HB3 1 1 10 3985 1 1 5 SER HG H -12.047 3.033 3.287 1.00 . A A . 5 SER HG 1 1 10 3986 1 1 5 SER N N -13.748 -0.285 1.324 1.00 . A A . 5 SER N 1 1 10 3987 1 1 5 SER O O -10.634 0.718 2.845 1.00 . A A . 5 SER O 1 1 10 3988 1 1 5 SER OG O -12.532 2.945 2.461 1.00 . A A . 5 SER OG 1 1 10 3989 1 1 6 HIS C C -9.038 -2.256 1.524 1.00 . A A . 6 HIS C 1 1 10 3990 1 1 6 HIS CA C -10.061 -1.916 2.613 1.00 . A A . 6 HIS CA 1 1 10 3991 1 1 6 HIS CB C -10.615 -3.189 3.259 1.00 . A A . 6 HIS CB 1 1 10 3992 1 1 6 HIS CD2 C -11.308 -1.748 5.351 1.00 . A A . 6 HIS CD2 1 1 10 3993 1 1 6 HIS CE1 C -11.422 -3.346 6.809 1.00 . A A . 6 HIS CE1 1 1 10 3994 1 1 6 HIS CG C -10.989 -2.911 4.692 1.00 . A A . 6 HIS CG 1 1 10 3995 1 1 6 HIS H H -11.893 -1.744 1.492 1.00 . A A . 6 HIS H 1 1 10 3996 1 1 6 HIS HA H -9.605 -1.291 3.360 1.00 . A A . 6 HIS HA 1 1 10 3997 1 1 6 HIS HB2 H -11.489 -3.518 2.717 1.00 . A A . 6 HIS HB2 1 1 10 3998 1 1 6 HIS HB3 H -9.862 -3.963 3.230 1.00 . A A . 6 HIS HB3 1 1 10 3999 1 1 6 HIS HD1 H -10.898 -4.870 5.493 1.00 . A A . 6 HIS HD1 1 1 10 4000 1 1 6 HIS HD2 H -11.342 -0.767 4.901 1.00 . A A . 6 HIS HD2 1 1 10 4001 1 1 6 HIS HE1 H -11.563 -3.890 7.731 1.00 . A A . 6 HIS HE1 1 1 10 4002 1 1 6 HIS N N -11.248 -1.229 2.018 1.00 . A A . 6 HIS N 1 1 10 4003 1 1 6 HIS ND1 N -11.069 -3.917 5.643 1.00 . A A . 6 HIS ND1 1 1 10 4004 1 1 6 HIS NE2 N -11.581 -2.025 6.686 1.00 . A A . 6 HIS NE2 1 1 10 4005 1 1 6 HIS O O -7.843 -2.228 1.757 1.00 . A A . 6 HIS O 1 1 10 4006 1 1 7 TYR C C -7.679 -1.680 -1.091 1.00 . A A . 7 TYR C 1 1 10 4007 1 1 7 TYR CA C -8.545 -2.899 -0.773 1.00 . A A . 7 TYR CA 1 1 10 4008 1 1 7 TYR CB C -9.422 -3.270 -1.977 1.00 . A A . 7 TYR CB 1 1 10 4009 1 1 7 TYR CD1 C -9.545 -5.779 -1.725 1.00 . A A . 7 TYR CD1 1 1 10 4010 1 1 7 TYR CD2 C -11.553 -4.469 -1.360 1.00 . A A . 7 TYR CD2 1 1 10 4011 1 1 7 TYR CE1 C -10.258 -6.950 -1.450 1.00 . A A . 7 TYR CE1 1 1 10 4012 1 1 7 TYR CE2 C -12.267 -5.641 -1.084 1.00 . A A . 7 TYR CE2 1 1 10 4013 1 1 7 TYR CG C -10.192 -4.538 -1.680 1.00 . A A . 7 TYR CG 1 1 10 4014 1 1 7 TYR CZ C -11.620 -6.881 -1.130 1.00 . A A . 7 TYR CZ 1 1 10 4015 1 1 7 TYR H H -10.459 -2.574 0.176 1.00 . A A . 7 TYR H 1 1 10 4016 1 1 7 TYR HA H -7.924 -3.731 -0.495 1.00 . A A . 7 TYR HA 1 1 10 4017 1 1 7 TYR HB2 H -10.116 -2.465 -2.176 1.00 . A A . 7 TYR HB2 1 1 10 4018 1 1 7 TYR HB3 H -8.795 -3.426 -2.842 1.00 . A A . 7 TYR HB3 1 1 10 4019 1 1 7 TYR HD1 H -8.495 -5.832 -1.973 1.00 . A A . 7 TYR HD1 1 1 10 4020 1 1 7 TYR HD2 H -12.054 -3.512 -1.325 1.00 . A A . 7 TYR HD2 1 1 10 4021 1 1 7 TYR HE1 H -9.760 -7.908 -1.485 1.00 . A A . 7 TYR HE1 1 1 10 4022 1 1 7 TYR HE2 H -13.317 -5.589 -0.837 1.00 . A A . 7 TYR HE2 1 1 10 4023 1 1 7 TYR HH H -12.352 -8.148 0.098 1.00 . A A . 7 TYR HH 1 1 10 4024 1 1 7 TYR N N -9.495 -2.566 0.337 1.00 . A A . 7 TYR N 1 1 10 4025 1 1 7 TYR O O -6.478 -1.789 -1.259 1.00 . A A . 7 TYR O 1 1 10 4026 1 1 7 TYR OH O -12.323 -8.036 -0.856 1.00 . A A . 7 TYR OH 1 1 10 4027 1 1 8 VAL C C -6.452 0.941 -0.333 1.00 . A A . 8 VAL C 1 1 10 4028 1 1 8 VAL CA C -7.500 0.723 -1.437 1.00 . A A . 8 VAL CA 1 1 10 4029 1 1 8 VAL CB C -8.536 1.862 -1.469 1.00 . A A . 8 VAL CB 1 1 10 4030 1 1 8 VAL CG1 C -9.180 2.041 -0.089 1.00 . A A . 8 VAL CG1 1 1 10 4031 1 1 8 VAL CG2 C -7.849 3.167 -1.881 1.00 . A A . 8 VAL CG2 1 1 10 4032 1 1 8 VAL H H -9.247 -0.469 -1.000 1.00 . A A . 8 VAL H 1 1 10 4033 1 1 8 VAL HA H -7.015 0.642 -2.393 1.00 . A A . 8 VAL HA 1 1 10 4034 1 1 8 VAL HB H -9.305 1.621 -2.190 1.00 . A A . 8 VAL HB 1 1 10 4035 1 1 8 VAL HG11 H -8.465 2.487 0.587 1.00 . A A . 8 VAL HG11 1 1 10 4036 1 1 8 VAL HG12 H -9.487 1.079 0.294 1.00 . A A . 8 VAL HG12 1 1 10 4037 1 1 8 VAL HG13 H -10.042 2.685 -0.176 1.00 . A A . 8 VAL HG13 1 1 10 4038 1 1 8 VAL HG21 H -8.589 3.948 -1.978 1.00 . A A . 8 VAL HG21 1 1 10 4039 1 1 8 VAL HG22 H -7.348 3.028 -2.827 1.00 . A A . 8 VAL HG22 1 1 10 4040 1 1 8 VAL HG23 H -7.126 3.448 -1.130 1.00 . A A . 8 VAL HG23 1 1 10 4041 1 1 8 VAL N N -8.282 -0.520 -1.154 1.00 . A A . 8 VAL N 1 1 10 4042 1 1 8 VAL O O -5.371 1.443 -0.583 1.00 . A A . 8 VAL O 1 1 10 4043 1 1 9 LEU C C -4.615 -0.282 1.805 1.00 . A A . 9 LEU C 1 1 10 4044 1 1 9 LEU CA C -5.784 0.693 2.000 1.00 . A A . 9 LEU CA 1 1 10 4045 1 1 9 LEU CB C -6.569 0.353 3.274 1.00 . A A . 9 LEU CB 1 1 10 4046 1 1 9 LEU CD1 C -6.883 1.255 5.588 1.00 . A A . 9 LEU CD1 1 1 10 4047 1 1 9 LEU CD2 C -4.832 -0.058 5.031 1.00 . A A . 9 LEU CD2 1 1 10 4048 1 1 9 LEU CG C -5.857 0.947 4.495 1.00 . A A . 9 LEU CG 1 1 10 4049 1 1 9 LEU H H -7.632 0.122 1.045 1.00 . A A . 9 LEU H 1 1 10 4050 1 1 9 LEU HA H -5.423 1.709 2.048 1.00 . A A . 9 LEU HA 1 1 10 4051 1 1 9 LEU HB2 H -7.566 0.766 3.202 1.00 . A A . 9 LEU HB2 1 1 10 4052 1 1 9 LEU HB3 H -6.632 -0.719 3.382 1.00 . A A . 9 LEU HB3 1 1 10 4053 1 1 9 LEU HD11 H -7.725 1.776 5.155 1.00 . A A . 9 LEU HD11 1 1 10 4054 1 1 9 LEU HD12 H -6.428 1.875 6.345 1.00 . A A . 9 LEU HD12 1 1 10 4055 1 1 9 LEU HD13 H -7.223 0.332 6.034 1.00 . A A . 9 LEU HD13 1 1 10 4056 1 1 9 LEU HD21 H -5.181 -1.062 4.843 1.00 . A A . 9 LEU HD21 1 1 10 4057 1 1 9 LEU HD22 H -4.709 0.087 6.095 1.00 . A A . 9 LEU HD22 1 1 10 4058 1 1 9 LEU HD23 H -3.886 0.095 4.535 1.00 . A A . 9 LEU HD23 1 1 10 4059 1 1 9 LEU HG H -5.354 1.860 4.210 1.00 . A A . 9 LEU HG 1 1 10 4060 1 1 9 LEU N N -6.761 0.539 0.879 1.00 . A A . 9 LEU N 1 1 10 4061 1 1 9 LEU O O -3.470 0.061 2.030 1.00 . A A . 9 LEU O 1 1 10 4062 1 1 10 LYS C C -2.890 -2.010 0.005 1.00 . A A . 10 LYS C 1 1 10 4063 1 1 10 LYS CA C -3.799 -2.487 1.145 1.00 . A A . 10 LYS CA 1 1 10 4064 1 1 10 LYS CB C -4.501 -3.794 0.763 1.00 . A A . 10 LYS CB 1 1 10 4065 1 1 10 LYS CD C -3.985 -6.134 0.028 1.00 . A A . 10 LYS CD 1 1 10 4066 1 1 10 LYS CE C -4.803 -7.110 0.885 1.00 . A A . 10 LYS CE 1 1 10 4067 1 1 10 LYS CG C -3.515 -4.960 0.893 1.00 . A A . 10 LYS CG 1 1 10 4068 1 1 10 LYS H H -5.828 -1.744 1.185 1.00 . A A . 10 LYS H 1 1 10 4069 1 1 10 LYS HA H -3.226 -2.626 2.049 1.00 . A A . 10 LYS HA 1 1 10 4070 1 1 10 LYS HB2 H -5.342 -3.957 1.423 1.00 . A A . 10 LYS HB2 1 1 10 4071 1 1 10 LYS HB3 H -4.850 -3.731 -0.257 1.00 . A A . 10 LYS HB3 1 1 10 4072 1 1 10 LYS HD2 H -4.596 -5.763 -0.782 1.00 . A A . 10 LYS HD2 1 1 10 4073 1 1 10 LYS HD3 H -3.126 -6.648 -0.375 1.00 . A A . 10 LYS HD3 1 1 10 4074 1 1 10 LYS HE2 H -4.395 -8.108 0.803 1.00 . A A . 10 LYS HE2 1 1 10 4075 1 1 10 LYS HE3 H -4.811 -6.789 1.914 1.00 . A A . 10 LYS HE3 1 1 10 4076 1 1 10 LYS HG2 H -2.536 -4.641 0.563 1.00 . A A . 10 LYS HG2 1 1 10 4077 1 1 10 LYS HG3 H -3.461 -5.274 1.924 1.00 . A A . 10 LYS HG3 1 1 10 4078 1 1 10 LYS HZ1 H -6.432 -6.086 0.077 1.00 . A A . 10 LYS HZ1 1 1 10 4079 1 1 10 LYS HZ2 H -6.857 -7.421 1.035 1.00 . A A . 10 LYS HZ2 1 1 10 4080 1 1 10 LYS HZ3 H -6.236 -7.658 -0.527 1.00 . A A . 10 LYS HZ3 1 1 10 4081 1 1 10 LYS N N -4.897 -1.494 1.372 1.00 . A A . 10 LYS N 1 1 10 4082 1 1 10 LYS NZ N -6.185 -7.065 0.325 1.00 . A A . 10 LYS NZ 1 1 10 4083 1 1 10 LYS O O -1.688 -2.185 0.049 1.00 . A A . 10 LYS O 1 1 10 4084 1 1 11 PHE C C -1.689 0.214 -1.646 1.00 . A A . 11 PHE C 1 1 10 4085 1 1 11 PHE CA C -2.629 -0.893 -2.144 1.00 . A A . 11 PHE CA 1 1 10 4086 1 1 11 PHE CB C -3.636 -0.336 -3.159 1.00 . A A . 11 PHE CB 1 1 10 4087 1 1 11 PHE CD1 C -2.173 -0.333 -5.215 1.00 . A A . 11 PHE CD1 1 1 10 4088 1 1 11 PHE CD2 C -2.945 1.788 -4.329 1.00 . A A . 11 PHE CD2 1 1 10 4089 1 1 11 PHE CE1 C -1.490 0.341 -6.233 1.00 . A A . 11 PHE CE1 1 1 10 4090 1 1 11 PHE CE2 C -2.262 2.461 -5.348 1.00 . A A . 11 PHE CE2 1 1 10 4091 1 1 11 PHE CG C -2.901 0.390 -4.262 1.00 . A A . 11 PHE CG 1 1 10 4092 1 1 11 PHE CZ C -1.535 1.738 -6.301 1.00 . A A . 11 PHE CZ 1 1 10 4093 1 1 11 PHE H H -4.430 -1.262 -1.013 1.00 . A A . 11 PHE H 1 1 10 4094 1 1 11 PHE HA H -2.063 -1.698 -2.586 1.00 . A A . 11 PHE HA 1 1 10 4095 1 1 11 PHE HB2 H -4.206 -1.150 -3.583 1.00 . A A . 11 PHE HB2 1 1 10 4096 1 1 11 PHE HB3 H -4.305 0.350 -2.662 1.00 . A A . 11 PHE HB3 1 1 10 4097 1 1 11 PHE HD1 H -2.139 -1.412 -5.163 1.00 . A A . 11 PHE HD1 1 1 10 4098 1 1 11 PHE HD2 H -3.506 2.347 -3.594 1.00 . A A . 11 PHE HD2 1 1 10 4099 1 1 11 PHE HE1 H -0.929 -0.218 -6.968 1.00 . A A . 11 PHE HE1 1 1 10 4100 1 1 11 PHE HE2 H -2.295 3.540 -5.400 1.00 . A A . 11 PHE HE2 1 1 10 4101 1 1 11 PHE HZ H -1.007 2.258 -7.087 1.00 . A A . 11 PHE HZ 1 1 10 4102 1 1 11 PHE N N -3.457 -1.398 -1.007 1.00 . A A . 11 PHE N 1 1 10 4103 1 1 11 PHE O O -0.517 0.235 -1.970 1.00 . A A . 11 PHE O 1 1 10 4104 1 1 12 PHE C C -0.220 1.638 0.553 1.00 . A A . 12 PHE C 1 1 10 4105 1 1 12 PHE CA C -1.338 2.229 -0.316 1.00 . A A . 12 PHE CA 1 1 10 4106 1 1 12 PHE CB C -2.274 3.103 0.527 1.00 . A A . 12 PHE CB 1 1 10 4107 1 1 12 PHE CD1 C -1.677 5.505 0.040 1.00 . A A . 12 PHE CD1 1 1 10 4108 1 1 12 PHE CD2 C -3.596 4.531 -1.077 1.00 . A A . 12 PHE CD2 1 1 10 4109 1 1 12 PHE CE1 C -1.907 6.717 -0.621 1.00 . A A . 12 PHE CE1 1 1 10 4110 1 1 12 PHE CE2 C -3.826 5.743 -1.739 1.00 . A A . 12 PHE CE2 1 1 10 4111 1 1 12 PHE CG C -2.521 4.412 -0.188 1.00 . A A . 12 PHE CG 1 1 10 4112 1 1 12 PHE CZ C -2.981 6.836 -1.511 1.00 . A A . 12 PHE CZ 1 1 10 4113 1 1 12 PHE H H -3.146 1.081 -0.600 1.00 . A A . 12 PHE H 1 1 10 4114 1 1 12 PHE HA H -0.920 2.806 -1.126 1.00 . A A . 12 PHE HA 1 1 10 4115 1 1 12 PHE HB2 H -3.213 2.591 0.676 1.00 . A A . 12 PHE HB2 1 1 10 4116 1 1 12 PHE HB3 H -1.816 3.301 1.485 1.00 . A A . 12 PHE HB3 1 1 10 4117 1 1 12 PHE HD1 H -0.849 5.413 0.727 1.00 . A A . 12 PHE HD1 1 1 10 4118 1 1 12 PHE HD2 H -4.249 3.688 -1.254 1.00 . A A . 12 PHE HD2 1 1 10 4119 1 1 12 PHE HE1 H -1.255 7.561 -0.445 1.00 . A A . 12 PHE HE1 1 1 10 4120 1 1 12 PHE HE2 H -4.654 5.836 -2.426 1.00 . A A . 12 PHE HE2 1 1 10 4121 1 1 12 PHE HZ H -3.158 7.772 -2.021 1.00 . A A . 12 PHE HZ 1 1 10 4122 1 1 12 PHE N N -2.199 1.127 -0.852 1.00 . A A . 12 PHE N 1 1 10 4123 1 1 12 PHE O O 0.931 2.014 0.438 1.00 . A A . 12 PHE O 1 1 10 4124 1 1 13 LEU C C 1.471 -0.730 1.413 1.00 . A A . 13 LEU C 1 1 10 4125 1 1 13 LEU CA C 0.484 0.064 2.280 1.00 . A A . 13 LEU CA 1 1 10 4126 1 1 13 LEU CB C -0.289 -0.871 3.214 1.00 . A A . 13 LEU CB 1 1 10 4127 1 1 13 LEU CD1 C 0.193 0.022 5.503 1.00 . A A . 13 LEU CD1 1 1 10 4128 1 1 13 LEU CD2 C 0.141 -2.444 5.108 1.00 . A A . 13 LEU CD2 1 1 10 4129 1 1 13 LEU CG C 0.514 -1.090 4.500 1.00 . A A . 13 LEU CG 1 1 10 4130 1 1 13 LEU H H -1.490 0.408 1.472 1.00 . A A . 13 LEU H 1 1 10 4131 1 1 13 LEU HA H 1.005 0.815 2.853 1.00 . A A . 13 LEU HA 1 1 10 4132 1 1 13 LEU HB2 H -1.245 -0.429 3.456 1.00 . A A . 13 LEU HB2 1 1 10 4133 1 1 13 LEU HB3 H -0.445 -1.820 2.724 1.00 . A A . 13 LEU HB3 1 1 10 4134 1 1 13 LEU HD11 H 0.589 -0.241 6.472 1.00 . A A . 13 LEU HD11 1 1 10 4135 1 1 13 LEU HD12 H -0.878 0.146 5.574 1.00 . A A . 13 LEU HD12 1 1 10 4136 1 1 13 LEU HD13 H 0.641 0.946 5.170 1.00 . A A . 13 LEU HD13 1 1 10 4137 1 1 13 LEU HD21 H 0.382 -3.232 4.410 1.00 . A A . 13 LEU HD21 1 1 10 4138 1 1 13 LEU HD22 H -0.918 -2.465 5.320 1.00 . A A . 13 LEU HD22 1 1 10 4139 1 1 13 LEU HD23 H 0.693 -2.593 6.023 1.00 . A A . 13 LEU HD23 1 1 10 4140 1 1 13 LEU HG H 1.570 -1.074 4.272 1.00 . A A . 13 LEU HG 1 1 10 4141 1 1 13 LEU N N -0.554 0.701 1.410 1.00 . A A . 13 LEU N 1 1 10 4142 1 1 13 LEU O O 2.657 -0.759 1.682 1.00 . A A . 13 LEU O 1 1 10 4143 1 1 14 LEU C C 2.948 -1.219 -1.138 1.00 . A A . 14 LEU C 1 1 10 4144 1 1 14 LEU CA C 1.889 -2.147 -0.533 1.00 . A A . 14 LEU CA 1 1 10 4145 1 1 14 LEU CB C 0.972 -2.713 -1.625 1.00 . A A . 14 LEU CB 1 1 10 4146 1 1 14 LEU CD1 C 2.140 -4.900 -1.967 1.00 . A A . 14 LEU CD1 1 1 10 4147 1 1 14 LEU CD2 C 0.968 -3.797 -3.877 1.00 . A A . 14 LEU CD2 1 1 10 4148 1 1 14 LEU CG C 1.790 -3.556 -2.609 1.00 . A A . 14 LEU CG 1 1 10 4149 1 1 14 LEU H H 0.025 -1.316 0.172 1.00 . A A . 14 LEU H 1 1 10 4150 1 1 14 LEU HA H 2.358 -2.947 0.008 1.00 . A A . 14 LEU HA 1 1 10 4151 1 1 14 LEU HB2 H 0.211 -3.328 -1.171 1.00 . A A . 14 LEU HB2 1 1 10 4152 1 1 14 LEU HB3 H 0.505 -1.897 -2.157 1.00 . A A . 14 LEU HB3 1 1 10 4153 1 1 14 LEU HD11 H 2.652 -5.520 -2.688 1.00 . A A . 14 LEU HD11 1 1 10 4154 1 1 14 LEU HD12 H 1.235 -5.393 -1.646 1.00 . A A . 14 LEU HD12 1 1 10 4155 1 1 14 LEU HD13 H 2.782 -4.736 -1.114 1.00 . A A . 14 LEU HD13 1 1 10 4156 1 1 14 LEU HD21 H 0.859 -2.869 -4.417 1.00 . A A . 14 LEU HD21 1 1 10 4157 1 1 14 LEU HD22 H -0.009 -4.174 -3.607 1.00 . A A . 14 LEU HD22 1 1 10 4158 1 1 14 LEU HD23 H 1.472 -4.520 -4.501 1.00 . A A . 14 LEU HD23 1 1 10 4159 1 1 14 LEU HG H 2.700 -3.032 -2.863 1.00 . A A . 14 LEU HG 1 1 10 4160 1 1 14 LEU N N 0.985 -1.364 0.369 1.00 . A A . 14 LEU N 1 1 10 4161 1 1 14 LEU O O 4.118 -1.549 -1.193 1.00 . A A . 14 LEU O 1 1 10 4162 1 1 15 VAL C C 4.431 1.456 -1.063 1.00 . A A . 15 VAL C 1 1 10 4163 1 1 15 VAL CA C 3.509 0.919 -2.166 1.00 . A A . 15 VAL CA 1 1 10 4164 1 1 15 VAL CB C 2.641 2.044 -2.750 1.00 . A A . 15 VAL CB 1 1 10 4165 1 1 15 VAL CG1 C 3.521 3.236 -3.143 1.00 . A A . 15 VAL CG1 1 1 10 4166 1 1 15 VAL CG2 C 1.906 1.532 -3.992 1.00 . A A . 15 VAL CG2 1 1 10 4167 1 1 15 VAL H H 1.592 0.179 -1.504 1.00 . A A . 15 VAL H 1 1 10 4168 1 1 15 VAL HA H 4.087 0.452 -2.948 1.00 . A A . 15 VAL HA 1 1 10 4169 1 1 15 VAL HB H 1.920 2.362 -2.010 1.00 . A A . 15 VAL HB 1 1 10 4170 1 1 15 VAL HG11 H 4.424 2.876 -3.614 1.00 . A A . 15 VAL HG11 1 1 10 4171 1 1 15 VAL HG12 H 3.776 3.802 -2.261 1.00 . A A . 15 VAL HG12 1 1 10 4172 1 1 15 VAL HG13 H 2.983 3.868 -3.834 1.00 . A A . 15 VAL HG13 1 1 10 4173 1 1 15 VAL HG21 H 1.064 2.175 -4.202 1.00 . A A . 15 VAL HG21 1 1 10 4174 1 1 15 VAL HG22 H 1.557 0.527 -3.814 1.00 . A A . 15 VAL HG22 1 1 10 4175 1 1 15 VAL HG23 H 2.580 1.535 -4.835 1.00 . A A . 15 VAL HG23 1 1 10 4176 1 1 15 VAL N N 2.540 -0.056 -1.576 1.00 . A A . 15 VAL N 1 1 10 4177 1 1 15 VAL O O 5.632 1.539 -1.232 1.00 . A A . 15 VAL O 1 1 10 4178 1 1 16 PHE C C 5.685 1.262 1.681 1.00 . A A . 16 PHE C 1 1 10 4179 1 1 16 PHE CA C 4.694 2.333 1.203 1.00 . A A . 16 PHE CA 1 1 10 4180 1 1 16 PHE CB C 3.688 2.666 2.310 1.00 . A A . 16 PHE CB 1 1 10 4181 1 1 16 PHE CD1 C 4.150 5.036 3.037 1.00 . A A . 16 PHE CD1 1 1 10 4182 1 1 16 PHE CD2 C 5.016 3.214 4.382 1.00 . A A . 16 PHE CD2 1 1 10 4183 1 1 16 PHE CE1 C 4.715 5.960 3.923 1.00 . A A . 16 PHE CE1 1 1 10 4184 1 1 16 PHE CE2 C 5.582 4.139 5.268 1.00 . A A . 16 PHE CE2 1 1 10 4185 1 1 16 PHE CG C 4.299 3.663 3.267 1.00 . A A . 16 PHE CG 1 1 10 4186 1 1 16 PHE CZ C 5.433 5.511 5.039 1.00 . A A . 16 PHE CZ 1 1 10 4187 1 1 16 PHE H H 2.897 1.723 0.177 1.00 . A A . 16 PHE H 1 1 10 4188 1 1 16 PHE HA H 5.219 3.225 0.904 1.00 . A A . 16 PHE HA 1 1 10 4189 1 1 16 PHE HB2 H 2.797 3.090 1.871 1.00 . A A . 16 PHE HB2 1 1 10 4190 1 1 16 PHE HB3 H 3.432 1.764 2.846 1.00 . A A . 16 PHE HB3 1 1 10 4191 1 1 16 PHE HD1 H 3.596 5.382 2.177 1.00 . A A . 16 PHE HD1 1 1 10 4192 1 1 16 PHE HD2 H 5.132 2.155 4.560 1.00 . A A . 16 PHE HD2 1 1 10 4193 1 1 16 PHE HE1 H 4.600 7.019 3.747 1.00 . A A . 16 PHE HE1 1 1 10 4194 1 1 16 PHE HE2 H 6.135 3.792 6.129 1.00 . A A . 16 PHE HE2 1 1 10 4195 1 1 16 PHE HZ H 5.869 6.224 5.723 1.00 . A A . 16 PHE HZ 1 1 10 4196 1 1 16 PHE N N 3.868 1.809 0.070 1.00 . A A . 16 PHE N 1 1 10 4197 1 1 16 PHE O O 6.797 1.566 2.070 1.00 . A A . 16 PHE O 1 1 10 4198 1 1 17 GLY C C 7.355 -1.244 1.117 1.00 . A A . 17 GLY C 1 1 10 4199 1 1 17 GLY CA C 6.190 -1.083 2.102 1.00 . A A . 17 GLY CA 1 1 10 4200 1 1 17 GLY H H 4.382 -0.203 1.336 1.00 . A A . 17 GLY H 1 1 10 4201 1 1 17 GLY HA2 H 6.581 -0.846 3.082 1.00 . A A . 17 GLY HA2 1 1 10 4202 1 1 17 GLY HA3 H 5.636 -2.008 2.150 1.00 . A A . 17 GLY HA3 1 1 10 4203 1 1 17 GLY N N 5.284 0.014 1.654 1.00 . A A . 17 GLY N 1 1 10 4204 1 1 17 GLY O O 8.453 -1.583 1.507 1.00 . A A . 17 GLY O 1 1 10 4205 1 1 18 GLU C C 9.369 -0.178 -0.849 1.00 . A A . 18 GLU C 1 1 10 4206 1 1 18 GLU CA C 8.235 -1.160 -1.154 1.00 . A A . 18 GLU CA 1 1 10 4207 1 1 18 GLU CB C 7.602 -0.867 -2.520 1.00 . A A . 18 GLU CB 1 1 10 4208 1 1 18 GLU CD C 6.308 -1.851 -4.423 1.00 . A A . 18 GLU CD 1 1 10 4209 1 1 18 GLU CG C 6.997 -2.154 -3.089 1.00 . A A . 18 GLU CG 1 1 10 4210 1 1 18 GLU H H 6.232 -0.741 -0.454 1.00 . A A . 18 GLU H 1 1 10 4211 1 1 18 GLU HA H 8.612 -2.164 -1.132 1.00 . A A . 18 GLU HA 1 1 10 4212 1 1 18 GLU HB2 H 6.827 -0.123 -2.406 1.00 . A A . 18 GLU HB2 1 1 10 4213 1 1 18 GLU HB3 H 8.360 -0.499 -3.194 1.00 . A A . 18 GLU HB3 1 1 10 4214 1 1 18 GLU HG2 H 7.780 -2.882 -3.244 1.00 . A A . 18 GLU HG2 1 1 10 4215 1 1 18 GLU HG3 H 6.271 -2.549 -2.394 1.00 . A A . 18 GLU HG3 1 1 10 4216 1 1 18 GLU N N 7.128 -1.010 -0.156 1.00 . A A . 18 GLU N 1 1 10 4217 1 1 18 GLU O O 10.451 -0.581 -0.467 1.00 . A A . 18 GLU O 1 1 10 4218 1 1 18 GLU OE1 O 5.177 -1.397 -4.394 1.00 . A A . 18 GLU OE1 1 1 10 4219 1 1 18 GLU OE2 O 6.925 -2.080 -5.450 1.00 . A A . 18 GLU OE2 1 1 10 4220 1 1 19 ASN C C 10.622 1.982 0.783 1.00 . A A . 19 ASN C 1 1 10 4221 1 1 19 ASN CA C 10.212 2.094 -0.692 1.00 . A A . 19 ASN CA 1 1 10 4222 1 1 19 ASN CB C 9.635 3.483 -1.010 1.00 . A A . 19 ASN CB 1 1 10 4223 1 1 19 ASN CG C 8.360 3.742 -0.201 1.00 . A A . 19 ASN CG 1 1 10 4224 1 1 19 ASN H H 8.249 1.402 -1.295 1.00 . A A . 19 ASN H 1 1 10 4225 1 1 19 ASN HA H 11.066 1.904 -1.319 1.00 . A A . 19 ASN HA 1 1 10 4226 1 1 19 ASN HB2 H 10.370 4.237 -0.765 1.00 . A A . 19 ASN HB2 1 1 10 4227 1 1 19 ASN HB3 H 9.407 3.541 -2.064 1.00 . A A . 19 ASN HB3 1 1 10 4228 1 1 19 ASN HD21 H 7.172 3.666 -1.790 1.00 . A A . 19 ASN HD21 1 1 10 4229 1 1 19 ASN HD22 H 6.391 3.957 -0.313 1.00 . A A . 19 ASN HD22 1 1 10 4230 1 1 19 ASN N N 9.131 1.101 -0.997 1.00 . A A . 19 ASN N 1 1 10 4231 1 1 19 ASN ND2 N 7.213 3.793 -0.820 1.00 . A A . 19 ASN ND2 1 1 10 4232 1 1 19 ASN O O 11.736 2.302 1.149 1.00 . A A . 19 ASN O 1 1 10 4233 1 1 19 ASN OD1 O 8.409 3.906 1.002 1.00 . A A . 19 ASN OD1 1 1 10 4234 1 1 20 GLY C C 11.110 0.221 3.203 1.00 . A A . 20 GLY C 1 1 10 4235 1 1 20 GLY CA C 10.069 1.335 3.065 1.00 . A A . 20 GLY CA 1 1 10 4236 1 1 20 GLY H H 8.851 1.237 1.295 1.00 . A A . 20 GLY H 1 1 10 4237 1 1 20 GLY HA2 H 10.471 2.261 3.454 1.00 . A A . 20 GLY HA2 1 1 10 4238 1 1 20 GLY HA3 H 9.181 1.066 3.615 1.00 . A A . 20 GLY HA3 1 1 10 4239 1 1 20 GLY N N 9.734 1.503 1.622 1.00 . A A . 20 GLY N 1 1 10 4240 1 1 20 GLY O O 12.066 0.345 3.945 1.00 . A A . 20 GLY O 1 1 10 4241 1 1 21 VAL C C 13.250 -1.551 1.873 1.00 . A A . 21 VAL C 1 1 10 4242 1 1 21 VAL CA C 11.938 -1.978 2.551 1.00 . A A . 21 VAL CA 1 1 10 4243 1 1 21 VAL CB C 11.290 -3.155 1.809 1.00 . A A . 21 VAL CB 1 1 10 4244 1 1 21 VAL CG1 C 12.343 -4.223 1.494 1.00 . A A . 21 VAL CG1 1 1 10 4245 1 1 21 VAL CG2 C 10.198 -3.772 2.689 1.00 . A A . 21 VAL CG2 1 1 10 4246 1 1 21 VAL H H 10.167 -0.935 1.868 1.00 . A A . 21 VAL H 1 1 10 4247 1 1 21 VAL HA H 12.120 -2.243 3.576 1.00 . A A . 21 VAL HA 1 1 10 4248 1 1 21 VAL HB H 10.852 -2.801 0.886 1.00 . A A . 21 VAL HB 1 1 10 4249 1 1 21 VAL HG11 H 11.853 -5.163 1.286 1.00 . A A . 21 VAL HG11 1 1 10 4250 1 1 21 VAL HG12 H 13.002 -4.341 2.342 1.00 . A A . 21 VAL HG12 1 1 10 4251 1 1 21 VAL HG13 H 12.919 -3.919 0.632 1.00 . A A . 21 VAL HG13 1 1 10 4252 1 1 21 VAL HG21 H 10.625 -4.559 3.293 1.00 . A A . 21 VAL HG21 1 1 10 4253 1 1 21 VAL HG22 H 9.419 -4.180 2.062 1.00 . A A . 21 VAL HG22 1 1 10 4254 1 1 21 VAL HG23 H 9.780 -3.011 3.330 1.00 . A A . 21 VAL HG23 1 1 10 4255 1 1 21 VAL N N 10.942 -0.862 2.476 1.00 . A A . 21 VAL N 1 1 10 4256 1 1 21 VAL O O 14.313 -2.034 2.210 1.00 . A A . 21 VAL O 1 1 10 4257 1 1 22 PHE C C 15.339 0.557 1.205 1.00 . A A . 22 PHE C 1 1 10 4258 1 1 22 PHE CA C 14.408 -0.171 0.227 1.00 . A A . 22 PHE CA 1 1 10 4259 1 1 22 PHE CB C 13.906 0.789 -0.856 1.00 . A A . 22 PHE CB 1 1 10 4260 1 1 22 PHE CD1 C 15.939 1.951 -1.794 1.00 . A A . 22 PHE CD1 1 1 10 4261 1 1 22 PHE CD2 C 14.974 0.106 -3.037 1.00 . A A . 22 PHE CD2 1 1 10 4262 1 1 22 PHE CE1 C 16.920 2.103 -2.781 1.00 . A A . 22 PHE CE1 1 1 10 4263 1 1 22 PHE CE2 C 15.955 0.258 -4.024 1.00 . A A . 22 PHE CE2 1 1 10 4264 1 1 22 PHE CG C 14.966 0.952 -1.921 1.00 . A A . 22 PHE CG 1 1 10 4265 1 1 22 PHE CZ C 16.928 1.257 -3.896 1.00 . A A . 22 PHE CZ 1 1 10 4266 1 1 22 PHE H H 12.302 -0.274 0.686 1.00 . A A . 22 PHE H 1 1 10 4267 1 1 22 PHE HA H 14.919 -1.001 -0.226 1.00 . A A . 22 PHE HA 1 1 10 4268 1 1 22 PHE HB2 H 13.007 0.391 -1.302 1.00 . A A . 22 PHE HB2 1 1 10 4269 1 1 22 PHE HB3 H 13.692 1.750 -0.413 1.00 . A A . 22 PHE HB3 1 1 10 4270 1 1 22 PHE HD1 H 15.933 2.604 -0.933 1.00 . A A . 22 PHE HD1 1 1 10 4271 1 1 22 PHE HD2 H 14.223 -0.664 -3.135 1.00 . A A . 22 PHE HD2 1 1 10 4272 1 1 22 PHE HE1 H 17.671 2.873 -2.683 1.00 . A A . 22 PHE HE1 1 1 10 4273 1 1 22 PHE HE2 H 15.961 -0.395 -4.885 1.00 . A A . 22 PHE HE2 1 1 10 4274 1 1 22 PHE HZ H 17.685 1.374 -4.659 1.00 . A A . 22 PHE HZ 1 1 10 4275 1 1 22 PHE N N 13.174 -0.646 0.930 1.00 . A A . 22 PHE N 1 1 10 4276 1 1 22 PHE O O 16.547 0.519 1.068 1.00 . A A . 22 PHE O 1 1 10 4277 1 1 23 PHE C C 15.556 1.273 4.566 1.00 . A A . 23 PHE C 1 1 10 4278 1 1 23 PHE CA C 15.631 1.948 3.185 1.00 . A A . 23 PHE CA 1 1 10 4279 1 1 23 PHE CB C 15.041 3.361 3.241 1.00 . A A . 23 PHE CB 1 1 10 4280 1 1 23 PHE CD1 C 16.840 4.787 2.194 1.00 . A A . 23 PHE CD1 1 1 10 4281 1 1 23 PHE CD2 C 16.513 4.897 4.595 1.00 . A A . 23 PHE CD2 1 1 10 4282 1 1 23 PHE CE1 C 17.875 5.725 2.293 1.00 . A A . 23 PHE CE1 1 1 10 4283 1 1 23 PHE CE2 C 17.549 5.834 4.693 1.00 . A A . 23 PHE CE2 1 1 10 4284 1 1 23 PHE CG C 16.159 4.373 3.346 1.00 . A A . 23 PHE CG 1 1 10 4285 1 1 23 PHE CZ C 18.230 6.247 3.542 1.00 . A A . 23 PHE CZ 1 1 10 4286 1 1 23 PHE H H 13.807 1.229 2.277 1.00 . A A . 23 PHE H 1 1 10 4287 1 1 23 PHE HA H 16.652 1.990 2.845 1.00 . A A . 23 PHE HA 1 1 10 4288 1 1 23 PHE HB2 H 14.468 3.549 2.344 1.00 . A A . 23 PHE HB2 1 1 10 4289 1 1 23 PHE HB3 H 14.396 3.448 4.104 1.00 . A A . 23 PHE HB3 1 1 10 4290 1 1 23 PHE HD1 H 16.566 4.384 1.231 1.00 . A A . 23 PHE HD1 1 1 10 4291 1 1 23 PHE HD2 H 15.989 4.577 5.484 1.00 . A A . 23 PHE HD2 1 1 10 4292 1 1 23 PHE HE1 H 18.400 6.044 1.405 1.00 . A A . 23 PHE HE1 1 1 10 4293 1 1 23 PHE HE2 H 17.823 6.238 5.656 1.00 . A A . 23 PHE HE2 1 1 10 4294 1 1 23 PHE HZ H 19.028 6.971 3.617 1.00 . A A . 23 PHE HZ 1 1 10 4295 1 1 23 PHE N N 14.783 1.217 2.190 1.00 . A A . 23 PHE N 1 1 10 4296 1 1 23 PHE O O 15.937 1.854 5.566 1.00 . A A . 23 PHE O 1 1 10 4297 1 1 24 TYR C C 15.061 -2.171 5.725 1.00 . A A . 24 TYR C 1 1 10 4298 1 1 24 TYR CA C 14.978 -0.655 5.941 1.00 . A A . 24 TYR CA 1 1 10 4299 1 1 24 TYR CB C 13.615 -0.256 6.509 1.00 . A A . 24 TYR CB 1 1 10 4300 1 1 24 TYR CD1 C 13.659 -1.315 8.796 1.00 . A A . 24 TYR CD1 1 1 10 4301 1 1 24 TYR CD2 C 13.824 1.098 8.624 1.00 . A A . 24 TYR CD2 1 1 10 4302 1 1 24 TYR CE1 C 13.741 -1.221 10.190 1.00 . A A . 24 TYR CE1 1 1 10 4303 1 1 24 TYR CE2 C 13.905 1.192 10.019 1.00 . A A . 24 TYR CE2 1 1 10 4304 1 1 24 TYR CG C 13.702 -0.155 8.014 1.00 . A A . 24 TYR CG 1 1 10 4305 1 1 24 TYR CZ C 13.863 0.032 10.801 1.00 . A A . 24 TYR CZ 1 1 10 4306 1 1 24 TYR H H 14.775 -0.397 3.812 1.00 . A A . 24 TYR H 1 1 10 4307 1 1 24 TYR HA H 15.764 -0.328 6.604 1.00 . A A . 24 TYR HA 1 1 10 4308 1 1 24 TYR HB2 H 13.326 0.699 6.101 1.00 . A A . 24 TYR HB2 1 1 10 4309 1 1 24 TYR HB3 H 12.879 -0.999 6.239 1.00 . A A . 24 TYR HB3 1 1 10 4310 1 1 24 TYR HD1 H 13.565 -2.282 8.325 1.00 . A A . 24 TYR HD1 1 1 10 4311 1 1 24 TYR HD2 H 13.857 1.992 8.020 1.00 . A A . 24 TYR HD2 1 1 10 4312 1 1 24 TYR HE1 H 13.708 -2.116 10.795 1.00 . A A . 24 TYR HE1 1 1 10 4313 1 1 24 TYR HE2 H 14.000 2.159 10.491 1.00 . A A . 24 TYR HE2 1 1 10 4314 1 1 24 TYR HH H 14.868 0.054 12.424 1.00 . A A . 24 TYR HH 1 1 10 4315 1 1 24 TYR N N 15.074 0.054 4.629 1.00 . A A . 24 TYR N 1 1 10 4316 1 1 24 TYR O O 14.106 -2.897 5.937 1.00 . A A . 24 TYR O 1 1 10 4317 1 1 24 TYR OH O 13.943 0.124 12.176 1.00 . A A . 24 TYR OH 1 1 10 4318 1 1 25 LYS C C 17.642 -4.628 5.744 1.00 . A A . 25 LYS C 1 1 10 4319 1 1 25 LYS CA C 16.369 -4.114 5.058 1.00 . A A . 25 LYS CA 1 1 10 4320 1 1 25 LYS CB C 16.480 -4.257 3.538 1.00 . A A . 25 LYS CB 1 1 10 4321 1 1 25 LYS CD C 14.818 -6.113 3.282 1.00 . A A . 25 LYS CD 1 1 10 4322 1 1 25 LYS CE C 14.709 -7.505 3.915 1.00 . A A . 25 LYS CE 1 1 10 4323 1 1 25 LYS CG C 16.294 -5.726 3.142 1.00 . A A . 25 LYS CG 1 1 10 4324 1 1 25 LYS H H 16.949 -2.038 5.134 1.00 . A A . 25 LYS H 1 1 10 4325 1 1 25 LYS HA H 15.507 -4.655 5.416 1.00 . A A . 25 LYS HA 1 1 10 4326 1 1 25 LYS HB2 H 15.716 -3.657 3.064 1.00 . A A . 25 LYS HB2 1 1 10 4327 1 1 25 LYS HB3 H 17.453 -3.920 3.214 1.00 . A A . 25 LYS HB3 1 1 10 4328 1 1 25 LYS HD2 H 14.314 -5.392 3.909 1.00 . A A . 25 LYS HD2 1 1 10 4329 1 1 25 LYS HD3 H 14.355 -6.126 2.307 1.00 . A A . 25 LYS HD3 1 1 10 4330 1 1 25 LYS HE2 H 15.458 -7.626 4.687 1.00 . A A . 25 LYS HE2 1 1 10 4331 1 1 25 LYS HE3 H 13.721 -7.654 4.324 1.00 . A A . 25 LYS HE3 1 1 10 4332 1 1 25 LYS HG2 H 16.608 -5.862 2.118 1.00 . A A . 25 LYS HG2 1 1 10 4333 1 1 25 LYS HG3 H 16.892 -6.350 3.789 1.00 . A A . 25 LYS HG3 1 1 10 4334 1 1 25 LYS HZ1 H 14.781 -9.435 3.131 1.00 . A A . 25 LYS HZ1 1 1 10 4335 1 1 25 LYS HZ2 H 15.934 -8.375 2.472 1.00 . A A . 25 LYS HZ2 1 1 10 4336 1 1 25 LYS HZ3 H 14.302 -8.254 2.012 1.00 . A A . 25 LYS HZ3 1 1 10 4337 1 1 25 LYS N N 16.201 -2.648 5.299 1.00 . A A . 25 LYS N 1 1 10 4338 1 1 25 LYS NZ N 14.949 -8.464 2.798 1.00 . A A . 25 LYS NZ 1 1 10 4339 1 1 25 LYS O O 17.573 -5.677 6.363 1.00 . A A . 25 LYS O 1 1 10 4340 1 1 25 LYS OXT O 18.663 -3.967 5.635 1.00 . A A . 25 LYS OXT 1 1 11 4341 1 1 1 HIS C C -15.980 0.803 4.660 1.00 . A A . 1 HIS C 1 1 11 4342 1 1 1 HIS CA C -15.463 1.373 5.987 1.00 . A A . 1 HIS CA 1 1 11 4343 1 1 1 HIS CB C -14.753 2.711 5.757 1.00 . A A . 1 HIS CB 1 1 11 4344 1 1 1 HIS CD2 C -16.606 4.518 6.219 1.00 . A A . 1 HIS CD2 1 1 11 4345 1 1 1 HIS CE1 C -16.978 5.118 4.170 1.00 . A A . 1 HIS CE1 1 1 11 4346 1 1 1 HIS CG C -15.769 3.770 5.426 1.00 . A A . 1 HIS CG 1 1 11 4347 1 1 1 HIS HA H -16.276 1.503 6.683 1.00 . A A . 1 HIS HA 1 1 11 4348 1 1 1 HIS HB2 H -14.217 2.994 6.651 1.00 . A A . 1 HIS HB2 1 1 11 4349 1 1 1 HIS HB3 H -14.057 2.614 4.936 1.00 . A A . 1 HIS HB3 1 1 11 4350 1 1 1 HIS HD1 H -15.590 3.827 3.315 1.00 . A A . 1 HIS HD1 1 1 11 4351 1 1 1 HIS HD2 H -16.663 4.457 7.295 1.00 . A A . 1 HIS HD2 1 1 11 4352 1 1 1 HIS HE1 H -17.380 5.617 3.301 1.00 . A A . 1 HIS HE1 1 1 11 4353 1 1 1 HIS N N -14.422 0.470 6.566 1.00 . A A . 1 HIS N 1 1 11 4354 1 1 1 HIS ND1 N -16.025 4.170 4.124 1.00 . A A . 1 HIS ND1 1 1 11 4355 1 1 1 HIS NE2 N -17.367 5.368 5.424 1.00 . A A . 1 HIS NE2 1 1 11 4356 1 1 1 HIS O O -15.208 0.394 3.813 1.00 . A A . 1 HIS O 1 1 11 4357 1 1 2 ALA C C -17.350 -1.169 2.915 1.00 . A A . 2 ALA C 1 1 11 4358 1 1 2 ALA CA C -17.879 0.246 3.212 1.00 . A A . 2 ALA CA 1 1 11 4359 1 1 2 ALA CB C -17.451 1.236 2.121 1.00 . A A . 2 ALA CB 1 1 11 4360 1 1 2 ALA H H -17.873 1.123 5.182 1.00 . A A . 2 ALA H 1 1 11 4361 1 1 2 ALA HA H -18.954 0.231 3.286 1.00 . A A . 2 ALA HA 1 1 11 4362 1 1 2 ALA HB1 H -16.437 1.025 1.818 1.00 . A A . 2 ALA HB1 1 1 11 4363 1 1 2 ALA HB2 H -17.509 2.244 2.506 1.00 . A A . 2 ALA HB2 1 1 11 4364 1 1 2 ALA HB3 H -18.108 1.139 1.269 1.00 . A A . 2 ALA HB3 1 1 11 4365 1 1 2 ALA N N -17.282 0.782 4.480 1.00 . A A . 2 ALA N 1 1 11 4366 1 1 2 ALA O O -16.971 -1.898 3.812 1.00 . A A . 2 ALA O 1 1 11 4367 1 1 3 TRP C C -15.659 -2.820 0.326 1.00 . A A . 3 TRP C 1 1 11 4368 1 1 3 TRP CA C -16.831 -2.928 1.310 1.00 . A A . 3 TRP CA 1 1 11 4369 1 1 3 TRP CB C -18.023 -3.633 0.652 1.00 . A A . 3 TRP CB 1 1 11 4370 1 1 3 TRP CD1 C -18.951 -5.290 2.323 1.00 . A A . 3 TRP CD1 1 1 11 4371 1 1 3 TRP CD2 C -20.121 -3.369 2.270 1.00 . A A . 3 TRP CD2 1 1 11 4372 1 1 3 TRP CE2 C -20.743 -4.198 3.235 1.00 . A A . 3 TRP CE2 1 1 11 4373 1 1 3 TRP CE3 C -20.668 -2.093 2.042 1.00 . A A . 3 TRP CE3 1 1 11 4374 1 1 3 TRP CG C -18.985 -4.086 1.705 1.00 . A A . 3 TRP CG 1 1 11 4375 1 1 3 TRP CH2 C -22.396 -2.505 3.709 1.00 . A A . 3 TRP CH2 1 1 11 4376 1 1 3 TRP CZ2 C -21.866 -3.775 3.948 1.00 . A A . 3 TRP CZ2 1 1 11 4377 1 1 3 TRP CZ3 C -21.798 -1.665 2.758 1.00 . A A . 3 TRP CZ3 1 1 11 4378 1 1 3 TRP H H -17.645 -0.962 0.959 1.00 . A A . 3 TRP H 1 1 11 4379 1 1 3 TRP HA H -16.529 -3.464 2.196 1.00 . A A . 3 TRP HA 1 1 11 4380 1 1 3 TRP HB2 H -18.521 -2.947 -0.018 1.00 . A A . 3 TRP HB2 1 1 11 4381 1 1 3 TRP HB3 H -17.671 -4.488 0.094 1.00 . A A . 3 TRP HB3 1 1 11 4382 1 1 3 TRP HD1 H -18.228 -6.070 2.137 1.00 . A A . 3 TRP HD1 1 1 11 4383 1 1 3 TRP HE1 H -20.192 -6.124 3.808 1.00 . A A . 3 TRP HE1 1 1 11 4384 1 1 3 TRP HE3 H -20.216 -1.439 1.311 1.00 . A A . 3 TRP HE3 1 1 11 4385 1 1 3 TRP HH2 H -23.264 -2.170 4.256 1.00 . A A . 3 TRP HH2 1 1 11 4386 1 1 3 TRP HZ2 H -22.322 -4.426 4.680 1.00 . A A . 3 TRP HZ2 1 1 11 4387 1 1 3 TRP HZ3 H -22.210 -0.683 2.575 1.00 . A A . 3 TRP HZ3 1 1 11 4388 1 1 3 TRP N N -17.330 -1.563 1.665 1.00 . A A . 3 TRP N 1 1 11 4389 1 1 3 TRP NE1 N -19.993 -5.357 3.231 1.00 . A A . 3 TRP NE1 1 1 11 4390 1 1 3 TRP O O -14.616 -3.419 0.520 1.00 . A A . 3 TRP O 1 1 11 4391 1 1 4 TYR C C -13.650 -0.910 -1.240 1.00 . A A . 4 TYR C 1 1 11 4392 1 1 4 TYR CA C -14.725 -1.896 -1.732 1.00 . A A . 4 TYR CA 1 1 11 4393 1 1 4 TYR CB C -15.412 -1.361 -2.999 1.00 . A A . 4 TYR CB 1 1 11 4394 1 1 4 TYR CD1 C -14.887 1.112 -3.061 1.00 . A A . 4 TYR CD1 1 1 11 4395 1 1 4 TYR CD2 C -17.105 0.408 -2.378 1.00 . A A . 4 TYR CD2 1 1 11 4396 1 1 4 TYR CE1 C -15.257 2.449 -2.883 1.00 . A A . 4 TYR CE1 1 1 11 4397 1 1 4 TYR CE2 C -17.475 1.747 -2.200 1.00 . A A . 4 TYR CE2 1 1 11 4398 1 1 4 TYR CG C -15.812 0.089 -2.809 1.00 . A A . 4 TYR CG 1 1 11 4399 1 1 4 TYR CZ C -16.550 2.767 -2.454 1.00 . A A . 4 TYR CZ 1 1 11 4400 1 1 4 TYR H H -16.674 -1.586 -0.853 1.00 . A A . 4 TYR H 1 1 11 4401 1 1 4 TYR HA H -14.277 -2.852 -1.940 1.00 . A A . 4 TYR HA 1 1 11 4402 1 1 4 TYR HB2 H -14.729 -1.436 -3.834 1.00 . A A . 4 TYR HB2 1 1 11 4403 1 1 4 TYR HB3 H -16.293 -1.951 -3.206 1.00 . A A . 4 TYR HB3 1 1 11 4404 1 1 4 TYR HD1 H -13.888 0.867 -3.393 1.00 . A A . 4 TYR HD1 1 1 11 4405 1 1 4 TYR HD2 H -17.819 -0.379 -2.184 1.00 . A A . 4 TYR HD2 1 1 11 4406 1 1 4 TYR HE1 H -14.545 3.237 -3.079 1.00 . A A . 4 TYR HE1 1 1 11 4407 1 1 4 TYR HE2 H -18.472 1.991 -1.869 1.00 . A A . 4 TYR HE2 1 1 11 4408 1 1 4 TYR HH H -17.326 4.391 -3.089 1.00 . A A . 4 TYR HH 1 1 11 4409 1 1 4 TYR N N -15.825 -2.055 -0.726 1.00 . A A . 4 TYR N 1 1 11 4410 1 1 4 TYR O O -12.630 -0.735 -1.881 1.00 . A A . 4 TYR O 1 1 11 4411 1 1 4 TYR OH O -16.915 4.086 -2.278 1.00 . A A . 4 TYR OH 1 1 11 4412 1 1 5 SER C C -11.768 -0.002 1.239 1.00 . A A . 5 SER C 1 1 11 4413 1 1 5 SER CA C -12.845 0.707 0.398 1.00 . A A . 5 SER CA 1 1 11 4414 1 1 5 SER CB C -13.638 1.695 1.257 1.00 . A A . 5 SER CB 1 1 11 4415 1 1 5 SER H H -14.688 -0.418 0.387 1.00 . A A . 5 SER H 1 1 11 4416 1 1 5 SER HA H -12.385 1.232 -0.425 1.00 . A A . 5 SER HA 1 1 11 4417 1 1 5 SER HB2 H -14.419 1.174 1.783 1.00 . A A . 5 SER HB2 1 1 11 4418 1 1 5 SER HB3 H -12.974 2.161 1.974 1.00 . A A . 5 SER HB3 1 1 11 4419 1 1 5 SER HG H -14.914 2.271 -0.098 1.00 . A A . 5 SER HG 1 1 11 4420 1 1 5 SER N N -13.863 -0.265 -0.115 1.00 . A A . 5 SER N 1 1 11 4421 1 1 5 SER O O -11.136 0.606 2.084 1.00 . A A . 5 SER O 1 1 11 4422 1 1 5 SER OG O -14.219 2.687 0.418 1.00 . A A . 5 SER OG 1 1 11 4423 1 1 6 HIS C C -9.272 -2.273 0.912 1.00 . A A . 6 HIS C 1 1 11 4424 1 1 6 HIS CA C -10.497 -2.006 1.791 1.00 . A A . 6 HIS CA 1 1 11 4425 1 1 6 HIS CB C -11.153 -3.322 2.220 1.00 . A A . 6 HIS CB 1 1 11 4426 1 1 6 HIS CD2 C -11.827 -2.882 4.722 1.00 . A A . 6 HIS CD2 1 1 11 4427 1 1 6 HIS CE1 C -13.971 -2.735 4.451 1.00 . A A . 6 HIS CE1 1 1 11 4428 1 1 6 HIS CG C -12.071 -3.068 3.385 1.00 . A A . 6 HIS CG 1 1 11 4429 1 1 6 HIS H H -12.053 -1.746 0.322 1.00 . A A . 6 HIS H 1 1 11 4430 1 1 6 HIS HA H -10.210 -1.437 2.656 1.00 . A A . 6 HIS HA 1 1 11 4431 1 1 6 HIS HB2 H -11.720 -3.728 1.396 1.00 . A A . 6 HIS HB2 1 1 11 4432 1 1 6 HIS HB3 H -10.389 -4.026 2.513 1.00 . A A . 6 HIS HB3 1 1 11 4433 1 1 6 HIS HD1 H -13.943 -3.057 2.393 1.00 . A A . 6 HIS HD1 1 1 11 4434 1 1 6 HIS HD2 H -10.850 -2.898 5.185 1.00 . A A . 6 HIS HD2 1 1 11 4435 1 1 6 HIS HE1 H -15.026 -2.615 4.641 1.00 . A A . 6 HIS HE1 1 1 11 4436 1 1 6 HIS N N -11.543 -1.275 1.010 1.00 . A A . 6 HIS N 1 1 11 4437 1 1 6 HIS ND1 N -13.445 -2.970 3.234 1.00 . A A . 6 HIS ND1 1 1 11 4438 1 1 6 HIS NE2 N -13.027 -2.673 5.394 1.00 . A A . 6 HIS NE2 1 1 11 4439 1 1 6 HIS O O -8.148 -2.231 1.374 1.00 . A A . 6 HIS O 1 1 11 4440 1 1 7 TYR C C -7.443 -1.550 -1.351 1.00 . A A . 7 TYR C 1 1 11 4441 1 1 7 TYR CA C -8.332 -2.792 -1.275 1.00 . A A . 7 TYR CA 1 1 11 4442 1 1 7 TYR CB C -8.955 -3.093 -2.644 1.00 . A A . 7 TYR CB 1 1 11 4443 1 1 7 TYR CD1 C -8.840 -5.610 -2.794 1.00 . A A . 7 TYR CD1 1 1 11 4444 1 1 7 TYR CD2 C -10.997 -4.560 -2.432 1.00 . A A . 7 TYR CD2 1 1 11 4445 1 1 7 TYR CE1 C -9.452 -6.869 -2.774 1.00 . A A . 7 TYR CE1 1 1 11 4446 1 1 7 TYR CE2 C -11.607 -5.818 -2.412 1.00 . A A . 7 TYR CE2 1 1 11 4447 1 1 7 TYR CG C -9.613 -4.454 -2.621 1.00 . A A . 7 TYR CG 1 1 11 4448 1 1 7 TYR CZ C -10.835 -6.974 -2.583 1.00 . A A . 7 TYR CZ 1 1 11 4449 1 1 7 TYR H H -10.399 -2.553 -0.698 1.00 . A A . 7 TYR H 1 1 11 4450 1 1 7 TYR HA H -7.761 -3.636 -0.933 1.00 . A A . 7 TYR HA 1 1 11 4451 1 1 7 TYR HB2 H -9.694 -2.340 -2.876 1.00 . A A . 7 TYR HB2 1 1 11 4452 1 1 7 TYR HB3 H -8.183 -3.081 -3.400 1.00 . A A . 7 TYR HB3 1 1 11 4453 1 1 7 TYR HD1 H -7.773 -5.530 -2.940 1.00 . A A . 7 TYR HD1 1 1 11 4454 1 1 7 TYR HD2 H -11.594 -3.669 -2.299 1.00 . A A . 7 TYR HD2 1 1 11 4455 1 1 7 TYR HE1 H -8.857 -7.760 -2.906 1.00 . A A . 7 TYR HE1 1 1 11 4456 1 1 7 TYR HE2 H -12.674 -5.899 -2.264 1.00 . A A . 7 TYR HE2 1 1 11 4457 1 1 7 TYR HH H -11.613 -8.474 -3.472 1.00 . A A . 7 TYR HH 1 1 11 4458 1 1 7 TYR N N -9.484 -2.534 -0.354 1.00 . A A . 7 TYR N 1 1 11 4459 1 1 7 TYR O O -6.231 -1.644 -1.372 1.00 . A A . 7 TYR O 1 1 11 4460 1 1 7 TYR OH O -11.437 -8.215 -2.564 1.00 . A A . 7 TYR OH 1 1 11 4461 1 1 8 VAL C C -6.408 1.014 -0.138 1.00 . A A . 8 VAL C 1 1 11 4462 1 1 8 VAL CA C -7.241 0.875 -1.422 1.00 . A A . 8 VAL CA 1 1 11 4463 1 1 8 VAL CB C -8.270 2.013 -1.555 1.00 . A A . 8 VAL CB 1 1 11 4464 1 1 8 VAL CG1 C -9.130 2.109 -0.289 1.00 . A A . 8 VAL CG1 1 1 11 4465 1 1 8 VAL CG2 C -7.539 3.341 -1.772 1.00 . A A . 8 VAL CG2 1 1 11 4466 1 1 8 VAL H H -9.021 -0.346 -1.340 1.00 . A A . 8 VAL H 1 1 11 4467 1 1 8 VAL HA H -6.593 0.865 -2.280 1.00 . A A . 8 VAL HA 1 1 11 4468 1 1 8 VAL HB H -8.909 1.815 -2.403 1.00 . A A . 8 VAL HB 1 1 11 4469 1 1 8 VAL HG11 H -9.970 2.762 -0.474 1.00 . A A . 8 VAL HG11 1 1 11 4470 1 1 8 VAL HG12 H -8.536 2.507 0.521 1.00 . A A . 8 VAL HG12 1 1 11 4471 1 1 8 VAL HG13 H -9.490 1.127 -0.021 1.00 . A A . 8 VAL HG13 1 1 11 4472 1 1 8 VAL HG21 H -6.926 3.560 -0.911 1.00 . A A . 8 VAL HG21 1 1 11 4473 1 1 8 VAL HG22 H -8.262 4.132 -1.909 1.00 . A A . 8 VAL HG22 1 1 11 4474 1 1 8 VAL HG23 H -6.913 3.270 -2.650 1.00 . A A . 8 VAL HG23 1 1 11 4475 1 1 8 VAL N N -8.042 -0.386 -1.371 1.00 . A A . 8 VAL N 1 1 11 4476 1 1 8 VAL O O -5.314 1.547 -0.153 1.00 . A A . 8 VAL O 1 1 11 4477 1 1 9 LEU C C -4.966 -0.377 2.212 1.00 . A A . 9 LEU C 1 1 11 4478 1 1 9 LEU CA C -6.156 0.591 2.252 1.00 . A A . 9 LEU CA 1 1 11 4479 1 1 9 LEU CB C -7.158 0.172 3.335 1.00 . A A . 9 LEU CB 1 1 11 4480 1 1 9 LEU CD1 C -7.718 0.879 5.669 1.00 . A A . 9 LEU CD1 1 1 11 4481 1 1 9 LEU CD2 C -5.876 -0.763 5.272 1.00 . A A . 9 LEU CD2 1 1 11 4482 1 1 9 LEU CG C -6.583 0.480 4.722 1.00 . A A . 9 LEU CG 1 1 11 4483 1 1 9 LEU H H -7.792 0.077 0.942 1.00 . A A . 9 LEU H 1 1 11 4484 1 1 9 LEU HA H -5.817 1.599 2.431 1.00 . A A . 9 LEU HA 1 1 11 4485 1 1 9 LEU HB2 H -8.082 0.718 3.199 1.00 . A A . 9 LEU HB2 1 1 11 4486 1 1 9 LEU HB3 H -7.353 -0.886 3.255 1.00 . A A . 9 LEU HB3 1 1 11 4487 1 1 9 LEU HD11 H -8.602 0.304 5.436 1.00 . A A . 9 LEU HD11 1 1 11 4488 1 1 9 LEU HD12 H -7.931 1.931 5.552 1.00 . A A . 9 LEU HD12 1 1 11 4489 1 1 9 LEU HD13 H -7.420 0.684 6.689 1.00 . A A . 9 LEU HD13 1 1 11 4490 1 1 9 LEU HD21 H -6.041 -0.830 6.337 1.00 . A A . 9 LEU HD21 1 1 11 4491 1 1 9 LEU HD22 H -4.816 -0.689 5.077 1.00 . A A . 9 LEU HD22 1 1 11 4492 1 1 9 LEU HD23 H -6.270 -1.646 4.791 1.00 . A A . 9 LEU HD23 1 1 11 4493 1 1 9 LEU HG H -5.877 1.294 4.646 1.00 . A A . 9 LEU HG 1 1 11 4494 1 1 9 LEU N N -6.915 0.516 0.965 1.00 . A A . 9 LEU N 1 1 11 4495 1 1 9 LEU O O -3.898 -0.079 2.714 1.00 . A A . 9 LEU O 1 1 11 4496 1 1 10 LYS C C -3.038 -2.107 0.417 1.00 . A A . 10 LYS C 1 1 11 4497 1 1 10 LYS CA C -4.016 -2.516 1.530 1.00 . A A . 10 LYS CA 1 1 11 4498 1 1 10 LYS CB C -4.683 -3.860 1.208 1.00 . A A . 10 LYS CB 1 1 11 4499 1 1 10 LYS CD C -2.970 -5.208 2.461 1.00 . A A . 10 LYS CD 1 1 11 4500 1 1 10 LYS CE C -3.908 -6.047 3.337 1.00 . A A . 10 LYS CE 1 1 11 4501 1 1 10 LYS CG C -3.620 -4.961 1.094 1.00 . A A . 10 LYS CG 1 1 11 4502 1 1 10 LYS H H -6.009 -1.748 1.206 1.00 . A A . 10 LYS H 1 1 11 4503 1 1 10 LYS HA H -3.503 -2.575 2.476 1.00 . A A . 10 LYS HA 1 1 11 4504 1 1 10 LYS HB2 H -5.379 -4.111 1.995 1.00 . A A . 10 LYS HB2 1 1 11 4505 1 1 10 LYS HB3 H -5.216 -3.780 0.272 1.00 . A A . 10 LYS HB3 1 1 11 4506 1 1 10 LYS HD2 H -2.037 -5.737 2.323 1.00 . A A . 10 LYS HD2 1 1 11 4507 1 1 10 LYS HD3 H -2.779 -4.262 2.945 1.00 . A A . 10 LYS HD3 1 1 11 4508 1 1 10 LYS HE2 H -4.705 -5.429 3.727 1.00 . A A . 10 LYS HE2 1 1 11 4509 1 1 10 LYS HE3 H -4.312 -6.872 2.772 1.00 . A A . 10 LYS HE3 1 1 11 4510 1 1 10 LYS HG2 H -4.086 -5.874 0.749 1.00 . A A . 10 LYS HG2 1 1 11 4511 1 1 10 LYS HG3 H -2.862 -4.657 0.387 1.00 . A A . 10 LYS HG3 1 1 11 4512 1 1 10 LYS HZ1 H -2.530 -5.767 4.876 1.00 . A A . 10 LYS HZ1 1 1 11 4513 1 1 10 LYS HZ2 H -2.380 -7.258 4.073 1.00 . A A . 10 LYS HZ2 1 1 11 4514 1 1 10 LYS HZ3 H -3.653 -7.003 5.169 1.00 . A A . 10 LYS HZ3 1 1 11 4515 1 1 10 LYS N N -5.140 -1.531 1.611 1.00 . A A . 10 LYS N 1 1 11 4516 1 1 10 LYS NZ N -3.053 -6.558 4.447 1.00 . A A . 10 LYS NZ 1 1 11 4517 1 1 10 LYS O O -1.841 -2.279 0.543 1.00 . A A . 10 LYS O 1 1 11 4518 1 1 11 PHE C C -1.712 -0.015 -1.334 1.00 . A A . 11 PHE C 1 1 11 4519 1 1 11 PHE CA C -2.651 -1.140 -1.792 1.00 . A A . 11 PHE CA 1 1 11 4520 1 1 11 PHE CB C -3.604 -0.644 -2.888 1.00 . A A . 11 PHE CB 1 1 11 4521 1 1 11 PHE CD1 C -1.955 -0.623 -4.801 1.00 . A A . 11 PHE CD1 1 1 11 4522 1 1 11 PHE CD2 C -2.966 1.470 -4.107 1.00 . A A . 11 PHE CD2 1 1 11 4523 1 1 11 PHE CE1 C -1.232 0.055 -5.790 1.00 . A A . 11 PHE CE1 1 1 11 4524 1 1 11 PHE CE2 C -2.243 2.147 -5.095 1.00 . A A . 11 PHE CE2 1 1 11 4525 1 1 11 PHE CG C -2.823 0.085 -3.959 1.00 . A A . 11 PHE CG 1 1 11 4526 1 1 11 PHE CZ C -1.376 1.440 -5.937 1.00 . A A . 11 PHE CZ 1 1 11 4527 1 1 11 PHE H H -4.514 -1.437 -0.740 1.00 . A A . 11 PHE H 1 1 11 4528 1 1 11 PHE HA H -2.079 -1.980 -2.153 1.00 . A A . 11 PHE HA 1 1 11 4529 1 1 11 PHE HB2 H -4.115 -1.488 -3.328 1.00 . A A . 11 PHE HB2 1 1 11 4530 1 1 11 PHE HB3 H -4.330 0.027 -2.455 1.00 . A A . 11 PHE HB3 1 1 11 4531 1 1 11 PHE HD1 H -1.844 -1.691 -4.688 1.00 . A A . 11 PHE HD1 1 1 11 4532 1 1 11 PHE HD2 H -3.634 2.017 -3.459 1.00 . A A . 11 PHE HD2 1 1 11 4533 1 1 11 PHE HE1 H -0.563 -0.491 -6.438 1.00 . A A . 11 PHE HE1 1 1 11 4534 1 1 11 PHE HE2 H -2.354 3.216 -5.209 1.00 . A A . 11 PHE HE2 1 1 11 4535 1 1 11 PHE HZ H -0.818 1.962 -6.699 1.00 . A A . 11 PHE HZ 1 1 11 4536 1 1 11 PHE N N -3.543 -1.565 -0.666 1.00 . A A . 11 PHE N 1 1 11 4537 1 1 11 PHE O O -0.515 -0.084 -1.536 1.00 . A A . 11 PHE O 1 1 11 4538 1 1 12 PHE C C -0.299 1.636 0.705 1.00 . A A . 12 PHE C 1 1 11 4539 1 1 12 PHE CA C -1.379 2.150 -0.257 1.00 . A A . 12 PHE CA 1 1 11 4540 1 1 12 PHE CB C -2.326 3.117 0.463 1.00 . A A . 12 PHE CB 1 1 11 4541 1 1 12 PHE CD1 C -1.771 5.369 -0.522 1.00 . A A . 12 PHE CD1 1 1 11 4542 1 1 12 PHE CD2 C -3.814 4.265 -1.218 1.00 . A A . 12 PHE CD2 1 1 11 4543 1 1 12 PHE CE1 C -2.065 6.446 -1.366 1.00 . A A . 12 PHE CE1 1 1 11 4544 1 1 12 PHE CE2 C -4.109 5.342 -2.063 1.00 . A A . 12 PHE CE2 1 1 11 4545 1 1 12 PHE CG C -2.645 4.278 -0.447 1.00 . A A . 12 PHE CG 1 1 11 4546 1 1 12 PHE CZ C -3.234 6.432 -2.137 1.00 . A A . 12 PHE CZ 1 1 11 4547 1 1 12 PHE H H -3.215 1.050 -0.576 1.00 . A A . 12 PHE H 1 1 11 4548 1 1 12 PHE HA H -0.923 2.644 -1.100 1.00 . A A . 12 PHE HA 1 1 11 4549 1 1 12 PHE HB2 H -3.239 2.601 0.726 1.00 . A A . 12 PHE HB2 1 1 11 4550 1 1 12 PHE HB3 H -1.850 3.484 1.360 1.00 . A A . 12 PHE HB3 1 1 11 4551 1 1 12 PHE HD1 H -0.869 5.380 0.072 1.00 . A A . 12 PHE HD1 1 1 11 4552 1 1 12 PHE HD2 H -4.489 3.424 -1.161 1.00 . A A . 12 PHE HD2 1 1 11 4553 1 1 12 PHE HE1 H -1.391 7.287 -1.424 1.00 . A A . 12 PHE HE1 1 1 11 4554 1 1 12 PHE HE2 H -5.010 5.331 -2.657 1.00 . A A . 12 PHE HE2 1 1 11 4555 1 1 12 PHE HZ H -3.461 7.263 -2.789 1.00 . A A . 12 PHE HZ 1 1 11 4556 1 1 12 PHE N N -2.245 1.018 -0.724 1.00 . A A . 12 PHE N 1 1 11 4557 1 1 12 PHE O O 0.858 2.001 0.601 1.00 . A A . 12 PHE O 1 1 11 4558 1 1 13 LEU C C 1.391 -0.593 1.846 1.00 . A A . 13 LEU C 1 1 11 4559 1 1 13 LEU CA C 0.334 0.232 2.595 1.00 . A A . 13 LEU CA 1 1 11 4560 1 1 13 LEU CB C -0.471 -0.659 3.547 1.00 . A A . 13 LEU CB 1 1 11 4561 1 1 13 LEU CD1 C 0.066 0.451 5.723 1.00 . A A . 13 LEU CD1 1 1 11 4562 1 1 13 LEU CD2 C -0.250 -2.025 5.629 1.00 . A A . 13 LEU CD2 1 1 11 4563 1 1 13 LEU CG C 0.280 -0.803 4.873 1.00 . A A . 13 LEU CG 1 1 11 4564 1 1 13 LEU H H -1.606 0.500 1.687 1.00 . A A . 13 LEU H 1 1 11 4565 1 1 13 LEU HA H 0.804 1.031 3.147 1.00 . A A . 13 LEU HA 1 1 11 4566 1 1 13 LEU HB2 H -1.439 -0.213 3.726 1.00 . A A . 13 LEU HB2 1 1 11 4567 1 1 13 LEU HB3 H -0.601 -1.635 3.101 1.00 . A A . 13 LEU HB3 1 1 11 4568 1 1 13 LEU HD11 H 0.547 1.294 5.249 1.00 . A A . 13 LEU HD11 1 1 11 4569 1 1 13 LEU HD12 H 0.491 0.298 6.704 1.00 . A A . 13 LEU HD12 1 1 11 4570 1 1 13 LEU HD13 H -0.992 0.647 5.816 1.00 . A A . 13 LEU HD13 1 1 11 4571 1 1 13 LEU HD21 H -0.066 -2.916 5.047 1.00 . A A . 13 LEU HD21 1 1 11 4572 1 1 13 LEU HD22 H -1.312 -1.915 5.793 1.00 . A A . 13 LEU HD22 1 1 11 4573 1 1 13 LEU HD23 H 0.254 -2.106 6.580 1.00 . A A . 13 LEU HD23 1 1 11 4574 1 1 13 LEU HG H 1.335 -0.929 4.677 1.00 . A A . 13 LEU HG 1 1 11 4575 1 1 13 LEU N N -0.668 0.783 1.630 1.00 . A A . 13 LEU N 1 1 11 4576 1 1 13 LEU O O 2.563 -0.554 2.174 1.00 . A A . 13 LEU O 1 1 11 4577 1 1 14 LEU C C 2.956 -1.235 -0.670 1.00 . A A . 14 LEU C 1 1 11 4578 1 1 14 LEU CA C 1.963 -2.151 0.056 1.00 . A A . 14 LEU CA 1 1 11 4579 1 1 14 LEU CB C 1.113 -2.942 -0.950 1.00 . A A . 14 LEU CB 1 1 11 4580 1 1 14 LEU CD1 C 3.120 -4.305 -1.609 1.00 . A A . 14 LEU CD1 1 1 11 4581 1 1 14 LEU CD2 C 1.618 -5.101 0.226 1.00 . A A . 14 LEU CD2 1 1 11 4582 1 1 14 LEU CG C 1.671 -4.364 -1.116 1.00 . A A . 14 LEU CG 1 1 11 4583 1 1 14 LEU H H 0.034 -1.336 0.592 1.00 . A A . 14 LEU H 1 1 11 4584 1 1 14 LEU HA H 2.487 -2.825 0.707 1.00 . A A . 14 LEU HA 1 1 11 4585 1 1 14 LEU HB2 H 0.096 -2.999 -0.591 1.00 . A A . 14 LEU HB2 1 1 11 4586 1 1 14 LEU HB3 H 1.126 -2.439 -1.906 1.00 . A A . 14 LEU HB3 1 1 11 4587 1 1 14 LEU HD11 H 3.427 -5.285 -1.940 1.00 . A A . 14 LEU HD11 1 1 11 4588 1 1 14 LEU HD12 H 3.762 -3.979 -0.803 1.00 . A A . 14 LEU HD12 1 1 11 4589 1 1 14 LEU HD13 H 3.193 -3.608 -2.430 1.00 . A A . 14 LEU HD13 1 1 11 4590 1 1 14 LEU HD21 H 2.391 -4.718 0.877 1.00 . A A . 14 LEU HD21 1 1 11 4591 1 1 14 LEU HD22 H 1.775 -6.156 0.064 1.00 . A A . 14 LEU HD22 1 1 11 4592 1 1 14 LEU HD23 H 0.652 -4.947 0.684 1.00 . A A . 14 LEU HD23 1 1 11 4593 1 1 14 LEU HG H 1.072 -4.897 -1.841 1.00 . A A . 14 LEU HG 1 1 11 4594 1 1 14 LEU N N 0.984 -1.329 0.839 1.00 . A A . 14 LEU N 1 1 11 4595 1 1 14 LEU O O 4.144 -1.497 -0.708 1.00 . A A . 14 LEU O 1 1 11 4596 1 1 15 VAL C C 4.345 1.451 -0.961 1.00 . A A . 15 VAL C 1 1 11 4597 1 1 15 VAL CA C 3.375 0.795 -1.958 1.00 . A A . 15 VAL CA 1 1 11 4598 1 1 15 VAL CB C 2.440 1.841 -2.586 1.00 . A A . 15 VAL CB 1 1 11 4599 1 1 15 VAL CG1 C 3.264 2.964 -3.222 1.00 . A A . 15 VAL CG1 1 1 11 4600 1 1 15 VAL CG2 C 1.581 1.178 -3.668 1.00 . A A . 15 VAL CG2 1 1 11 4601 1 1 15 VAL H H 1.511 0.026 -1.178 1.00 . A A . 15 VAL H 1 1 11 4602 1 1 15 VAL HA H 3.924 0.280 -2.731 1.00 . A A . 15 VAL HA 1 1 11 4603 1 1 15 VAL HB H 1.800 2.255 -1.820 1.00 . A A . 15 VAL HB 1 1 11 4604 1 1 15 VAL HG11 H 3.994 2.539 -3.896 1.00 . A A . 15 VAL HG11 1 1 11 4605 1 1 15 VAL HG12 H 3.771 3.522 -2.447 1.00 . A A . 15 VAL HG12 1 1 11 4606 1 1 15 VAL HG13 H 2.609 3.624 -3.770 1.00 . A A . 15 VAL HG13 1 1 11 4607 1 1 15 VAL HG21 H 2.211 0.871 -4.490 1.00 . A A . 15 VAL HG21 1 1 11 4608 1 1 15 VAL HG22 H 0.844 1.884 -4.025 1.00 . A A . 15 VAL HG22 1 1 11 4609 1 1 15 VAL HG23 H 1.081 0.315 -3.255 1.00 . A A . 15 VAL HG23 1 1 11 4610 1 1 15 VAL N N 2.472 -0.158 -1.236 1.00 . A A . 15 VAL N 1 1 11 4611 1 1 15 VAL O O 5.503 1.675 -1.265 1.00 . A A . 15 VAL O 1 1 11 4612 1 1 16 PHE C C 5.867 1.392 1.675 1.00 . A A . 16 PHE C 1 1 11 4613 1 1 16 PHE CA C 4.768 2.378 1.256 1.00 . A A . 16 PHE CA 1 1 11 4614 1 1 16 PHE CB C 3.847 2.697 2.438 1.00 . A A . 16 PHE CB 1 1 11 4615 1 1 16 PHE CD1 C 5.341 3.577 4.268 1.00 . A A . 16 PHE CD1 1 1 11 4616 1 1 16 PHE CD2 C 4.048 5.156 2.959 1.00 . A A . 16 PHE CD2 1 1 11 4617 1 1 16 PHE CE1 C 5.878 4.633 5.012 1.00 . A A . 16 PHE CE1 1 1 11 4618 1 1 16 PHE CE2 C 4.585 6.213 3.704 1.00 . A A . 16 PHE CE2 1 1 11 4619 1 1 16 PHE CG C 4.426 3.838 3.241 1.00 . A A . 16 PHE CG 1 1 11 4620 1 1 16 PHE CZ C 5.501 5.951 4.730 1.00 . A A . 16 PHE CZ 1 1 11 4621 1 1 16 PHE H H 2.943 1.550 0.450 1.00 . A A . 16 PHE H 1 1 11 4622 1 1 16 PHE HA H 5.202 3.287 0.870 1.00 . A A . 16 PHE HA 1 1 11 4623 1 1 16 PHE HB2 H 2.870 2.977 2.069 1.00 . A A . 16 PHE HB2 1 1 11 4624 1 1 16 PHE HB3 H 3.755 1.825 3.068 1.00 . A A . 16 PHE HB3 1 1 11 4625 1 1 16 PHE HD1 H 5.632 2.560 4.486 1.00 . A A . 16 PHE HD1 1 1 11 4626 1 1 16 PHE HD2 H 3.341 5.358 2.168 1.00 . A A . 16 PHE HD2 1 1 11 4627 1 1 16 PHE HE1 H 6.584 4.432 5.804 1.00 . A A . 16 PHE HE1 1 1 11 4628 1 1 16 PHE HE2 H 4.294 7.229 3.487 1.00 . A A . 16 PHE HE2 1 1 11 4629 1 1 16 PHE HZ H 5.915 6.766 5.305 1.00 . A A . 16 PHE HZ 1 1 11 4630 1 1 16 PHE N N 3.879 1.749 0.229 1.00 . A A . 16 PHE N 1 1 11 4631 1 1 16 PHE O O 7.012 1.766 1.856 1.00 . A A . 16 PHE O 1 1 11 4632 1 1 17 GLY C C 7.591 -1.022 1.118 1.00 . A A . 17 GLY C 1 1 11 4633 1 1 17 GLY CA C 6.540 -0.889 2.222 1.00 . A A . 17 GLY CA 1 1 11 4634 1 1 17 GLY H H 4.596 -0.142 1.667 1.00 . A A . 17 GLY H 1 1 11 4635 1 1 17 GLY HA2 H 7.020 -0.581 3.141 1.00 . A A . 17 GLY HA2 1 1 11 4636 1 1 17 GLY HA3 H 6.056 -1.842 2.369 1.00 . A A . 17 GLY HA3 1 1 11 4637 1 1 17 GLY N N 5.524 0.132 1.824 1.00 . A A . 17 GLY N 1 1 11 4638 1 1 17 GLY O O 8.776 -1.041 1.386 1.00 . A A . 17 GLY O 1 1 11 4639 1 1 18 GLU C C 9.120 -0.036 -1.223 1.00 . A A . 18 GLU C 1 1 11 4640 1 1 18 GLU CA C 8.147 -1.221 -1.248 1.00 . A A . 18 GLU CA 1 1 11 4641 1 1 18 GLU CB C 7.304 -1.210 -2.528 1.00 . A A . 18 GLU CB 1 1 11 4642 1 1 18 GLU CD C 7.732 -3.521 -3.397 1.00 . A A . 18 GLU CD 1 1 11 4643 1 1 18 GLU CG C 8.007 -2.030 -3.616 1.00 . A A . 18 GLU CG 1 1 11 4644 1 1 18 GLU H H 6.202 -1.077 -0.312 1.00 . A A . 18 GLU H 1 1 11 4645 1 1 18 GLU HA H 8.690 -2.145 -1.169 1.00 . A A . 18 GLU HA 1 1 11 4646 1 1 18 GLU HB2 H 6.333 -1.641 -2.323 1.00 . A A . 18 GLU HB2 1 1 11 4647 1 1 18 GLU HB3 H 7.181 -0.193 -2.870 1.00 . A A . 18 GLU HB3 1 1 11 4648 1 1 18 GLU HG2 H 7.635 -1.733 -4.585 1.00 . A A . 18 GLU HG2 1 1 11 4649 1 1 18 GLU HG3 H 9.071 -1.852 -3.569 1.00 . A A . 18 GLU HG3 1 1 11 4650 1 1 18 GLU N N 7.166 -1.102 -0.122 1.00 . A A . 18 GLU N 1 1 11 4651 1 1 18 GLU O O 10.292 -0.178 -1.517 1.00 . A A . 18 GLU O 1 1 11 4652 1 1 18 GLU OE1 O 8.484 -4.140 -2.662 1.00 . A A . 18 GLU OE1 1 1 11 4653 1 1 18 GLU OE2 O 6.774 -4.018 -3.969 1.00 . A A . 18 GLU OE2 1 1 11 4654 1 1 19 ASN C C 10.612 2.100 0.286 1.00 . A A . 19 ASN C 1 1 11 4655 1 1 19 ASN CA C 9.535 2.324 -0.779 1.00 . A A . 19 ASN CA 1 1 11 4656 1 1 19 ASN CB C 8.623 3.490 -0.381 1.00 . A A . 19 ASN CB 1 1 11 4657 1 1 19 ASN CG C 8.194 4.259 -1.632 1.00 . A A . 19 ASN CG 1 1 11 4658 1 1 19 ASN H H 7.698 1.203 -0.606 1.00 . A A . 19 ASN H 1 1 11 4659 1 1 19 ASN HA H 9.986 2.515 -1.735 1.00 . A A . 19 ASN HA 1 1 11 4660 1 1 19 ASN HB2 H 7.748 3.108 0.124 1.00 . A A . 19 ASN HB2 1 1 11 4661 1 1 19 ASN HB3 H 9.158 4.155 0.279 1.00 . A A . 19 ASN HB3 1 1 11 4662 1 1 19 ASN HD21 H 6.385 3.440 -1.692 1.00 . A A . 19 ASN HD21 1 1 11 4663 1 1 19 ASN HD22 H 6.719 4.556 -2.925 1.00 . A A . 19 ASN HD22 1 1 11 4664 1 1 19 ASN N N 8.642 1.125 -0.852 1.00 . A A . 19 ASN N 1 1 11 4665 1 1 19 ASN ND2 N 7.000 4.070 -2.124 1.00 . A A . 19 ASN ND2 1 1 11 4666 1 1 19 ASN O O 11.751 2.494 0.124 1.00 . A A . 19 ASN O 1 1 11 4667 1 1 19 ASN OD1 O 8.953 5.040 -2.168 1.00 . A A . 19 ASN OD1 1 1 11 4668 1 1 20 GLY C C 12.101 -0.024 2.074 1.00 . A A . 20 GLY C 1 1 11 4669 1 1 20 GLY CA C 11.238 1.183 2.456 1.00 . A A . 20 GLY CA 1 1 11 4670 1 1 20 GLY H H 9.329 1.147 1.461 1.00 . A A . 20 GLY H 1 1 11 4671 1 1 20 GLY HA2 H 11.869 2.049 2.596 1.00 . A A . 20 GLY HA2 1 1 11 4672 1 1 20 GLY HA3 H 10.712 0.968 3.374 1.00 . A A . 20 GLY HA3 1 1 11 4673 1 1 20 GLY N N 10.253 1.457 1.369 1.00 . A A . 20 GLY N 1 1 11 4674 1 1 20 GLY O O 13.286 -0.052 2.345 1.00 . A A . 20 GLY O 1 1 11 4675 1 1 21 VAL C C 13.452 -1.830 0.081 1.00 . A A . 21 VAL C 1 1 11 4676 1 1 21 VAL CA C 12.312 -2.226 1.035 1.00 . A A . 21 VAL CA 1 1 11 4677 1 1 21 VAL CB C 11.309 -3.155 0.337 1.00 . A A . 21 VAL CB 1 1 11 4678 1 1 21 VAL CG1 C 12.052 -4.290 -0.375 1.00 . A A . 21 VAL CG1 1 1 11 4679 1 1 21 VAL CG2 C 10.360 -3.757 1.379 1.00 . A A . 21 VAL CG2 1 1 11 4680 1 1 21 VAL H H 10.558 -0.972 1.231 1.00 . A A . 21 VAL H 1 1 11 4681 1 1 21 VAL HA H 12.715 -2.711 1.906 1.00 . A A . 21 VAL HA 1 1 11 4682 1 1 21 VAL HB H 10.738 -2.590 -0.386 1.00 . A A . 21 VAL HB 1 1 11 4683 1 1 21 VAL HG11 H 12.554 -3.899 -1.247 1.00 . A A . 21 VAL HG11 1 1 11 4684 1 1 21 VAL HG12 H 11.346 -5.050 -0.676 1.00 . A A . 21 VAL HG12 1 1 11 4685 1 1 21 VAL HG13 H 12.779 -4.722 0.296 1.00 . A A . 21 VAL HG13 1 1 11 4686 1 1 21 VAL HG21 H 9.968 -2.970 2.008 1.00 . A A . 21 VAL HG21 1 1 11 4687 1 1 21 VAL HG22 H 10.897 -4.468 1.988 1.00 . A A . 21 VAL HG22 1 1 11 4688 1 1 21 VAL HG23 H 9.544 -4.255 0.878 1.00 . A A . 21 VAL HG23 1 1 11 4689 1 1 21 VAL N N 11.520 -1.019 1.442 1.00 . A A . 21 VAL N 1 1 11 4690 1 1 21 VAL O O 14.446 -2.522 -0.026 1.00 . A A . 21 VAL O 1 1 11 4691 1 1 22 PHE C C 15.530 0.438 -0.784 1.00 . A A . 22 PHE C 1 1 11 4692 1 1 22 PHE CA C 14.399 -0.276 -1.542 1.00 . A A . 22 PHE CA 1 1 11 4693 1 1 22 PHE CB C 13.713 0.686 -2.517 1.00 . A A . 22 PHE CB 1 1 11 4694 1 1 22 PHE CD1 C 12.393 -0.858 -4.010 1.00 . A A . 22 PHE CD1 1 1 11 4695 1 1 22 PHE CD2 C 14.393 0.190 -4.893 1.00 . A A . 22 PHE CD2 1 1 11 4696 1 1 22 PHE CE1 C 12.190 -1.505 -5.235 1.00 . A A . 22 PHE CE1 1 1 11 4697 1 1 22 PHE CE2 C 14.190 -0.457 -6.118 1.00 . A A . 22 PHE CE2 1 1 11 4698 1 1 22 PHE CG C 13.494 -0.010 -3.839 1.00 . A A . 22 PHE CG 1 1 11 4699 1 1 22 PHE CZ C 13.089 -1.304 -6.289 1.00 . A A . 22 PHE CZ 1 1 11 4700 1 1 22 PHE H H 12.513 -0.177 -0.493 1.00 . A A . 22 PHE H 1 1 11 4701 1 1 22 PHE HA H 14.791 -1.122 -2.079 1.00 . A A . 22 PHE HA 1 1 11 4702 1 1 22 PHE HB2 H 12.762 0.997 -2.111 1.00 . A A . 22 PHE HB2 1 1 11 4703 1 1 22 PHE HB3 H 14.340 1.553 -2.667 1.00 . A A . 22 PHE HB3 1 1 11 4704 1 1 22 PHE HD1 H 11.699 -1.013 -3.197 1.00 . A A . 22 PHE HD1 1 1 11 4705 1 1 22 PHE HD2 H 15.242 0.844 -4.762 1.00 . A A . 22 PHE HD2 1 1 11 4706 1 1 22 PHE HE1 H 11.341 -2.159 -5.366 1.00 . A A . 22 PHE HE1 1 1 11 4707 1 1 22 PHE HE2 H 14.883 -0.302 -6.932 1.00 . A A . 22 PHE HE2 1 1 11 4708 1 1 22 PHE HZ H 12.933 -1.804 -7.234 1.00 . A A . 22 PHE HZ 1 1 11 4709 1 1 22 PHE N N 13.320 -0.720 -0.603 1.00 . A A . 22 PHE N 1 1 11 4710 1 1 22 PHE O O 16.591 0.674 -1.330 1.00 . A A . 22 PHE O 1 1 11 4711 1 1 23 PHE C C 16.638 0.741 2.580 1.00 . A A . 23 PHE C 1 1 11 4712 1 1 23 PHE CA C 16.381 1.474 1.252 1.00 . A A . 23 PHE CA 1 1 11 4713 1 1 23 PHE CB C 15.825 2.879 1.508 1.00 . A A . 23 PHE CB 1 1 11 4714 1 1 23 PHE CD1 C 17.323 4.276 0.033 1.00 . A A . 23 PHE CD1 1 1 11 4715 1 1 23 PHE CD2 C 17.540 4.477 2.441 1.00 . A A . 23 PHE CD2 1 1 11 4716 1 1 23 PHE CE1 C 18.339 5.224 -0.138 1.00 . A A . 23 PHE CE1 1 1 11 4717 1 1 23 PHE CE2 C 18.555 5.425 2.269 1.00 . A A . 23 PHE CE2 1 1 11 4718 1 1 23 PHE CG C 16.923 3.902 1.322 1.00 . A A . 23 PHE CG 1 1 11 4719 1 1 23 PHE CZ C 18.955 5.799 0.981 1.00 . A A . 23 PHE CZ 1 1 11 4720 1 1 23 PHE H H 14.455 0.578 0.883 1.00 . A A . 23 PHE H 1 1 11 4721 1 1 23 PHE HA H 17.292 1.538 0.678 1.00 . A A . 23 PHE HA 1 1 11 4722 1 1 23 PHE HB2 H 15.025 3.081 0.811 1.00 . A A . 23 PHE HB2 1 1 11 4723 1 1 23 PHE HB3 H 15.447 2.938 2.517 1.00 . A A . 23 PHE HB3 1 1 11 4724 1 1 23 PHE HD1 H 16.847 3.833 -0.829 1.00 . A A . 23 PHE HD1 1 1 11 4725 1 1 23 PHE HD2 H 17.233 4.189 3.435 1.00 . A A . 23 PHE HD2 1 1 11 4726 1 1 23 PHE HE1 H 18.646 5.513 -1.132 1.00 . A A . 23 PHE HE1 1 1 11 4727 1 1 23 PHE HE2 H 19.032 5.869 3.131 1.00 . A A . 23 PHE HE2 1 1 11 4728 1 1 23 PHE HZ H 19.739 6.530 0.848 1.00 . A A . 23 PHE HZ 1 1 11 4729 1 1 23 PHE N N 15.315 0.780 0.464 1.00 . A A . 23 PHE N 1 1 11 4730 1 1 23 PHE O O 17.049 1.341 3.556 1.00 . A A . 23 PHE O 1 1 11 4731 1 1 24 TYR C C 17.023 -2.772 3.554 1.00 . A A . 24 TYR C 1 1 11 4732 1 1 24 TYR CA C 16.634 -1.322 3.883 1.00 . A A . 24 TYR CA 1 1 11 4733 1 1 24 TYR CB C 15.295 -1.273 4.628 1.00 . A A . 24 TYR CB 1 1 11 4734 1 1 24 TYR CD1 C 16.022 -1.431 7.037 1.00 . A A . 24 TYR CD1 1 1 11 4735 1 1 24 TYR CD2 C 15.142 0.677 6.221 1.00 . A A . 24 TYR CD2 1 1 11 4736 1 1 24 TYR CE1 C 16.202 -0.864 8.305 1.00 . A A . 24 TYR CE1 1 1 11 4737 1 1 24 TYR CE2 C 15.324 1.243 7.488 1.00 . A A . 24 TYR CE2 1 1 11 4738 1 1 24 TYR CG C 15.492 -0.660 5.995 1.00 . A A . 24 TYR CG 1 1 11 4739 1 1 24 TYR CZ C 15.854 0.473 8.530 1.00 . A A . 24 TYR CZ 1 1 11 4740 1 1 24 TYR H H 16.074 -1.013 1.822 1.00 . A A . 24 TYR H 1 1 11 4741 1 1 24 TYR HA H 17.403 -0.852 4.475 1.00 . A A . 24 TYR HA 1 1 11 4742 1 1 24 TYR HB2 H 14.594 -0.676 4.066 1.00 . A A . 24 TYR HB2 1 1 11 4743 1 1 24 TYR HB3 H 14.905 -2.274 4.737 1.00 . A A . 24 TYR HB3 1 1 11 4744 1 1 24 TYR HD1 H 16.292 -2.462 6.864 1.00 . A A . 24 TYR HD1 1 1 11 4745 1 1 24 TYR HD2 H 14.735 1.272 5.417 1.00 . A A . 24 TYR HD2 1 1 11 4746 1 1 24 TYR HE1 H 16.612 -1.458 9.109 1.00 . A A . 24 TYR HE1 1 1 11 4747 1 1 24 TYR HE2 H 15.055 2.275 7.662 1.00 . A A . 24 TYR HE2 1 1 11 4748 1 1 24 TYR HH H 15.215 0.919 10.275 1.00 . A A . 24 TYR HH 1 1 11 4749 1 1 24 TYR N N 16.402 -0.550 2.621 1.00 . A A . 24 TYR N 1 1 11 4750 1 1 24 TYR O O 16.523 -3.710 4.149 1.00 . A A . 24 TYR O 1 1 11 4751 1 1 24 TYR OH O 16.030 1.030 9.781 1.00 . A A . 24 TYR OH 1 1 11 4752 1 1 25 LYS C C 19.870 -4.448 2.216 1.00 . A A . 25 LYS C 1 1 11 4753 1 1 25 LYS CA C 18.339 -4.343 2.237 1.00 . A A . 25 LYS CA 1 1 11 4754 1 1 25 LYS CB C 17.762 -4.573 0.837 1.00 . A A . 25 LYS CB 1 1 11 4755 1 1 25 LYS CD C 16.485 -6.207 -0.558 1.00 . A A . 25 LYS CD 1 1 11 4756 1 1 25 LYS CE C 16.497 -7.738 -0.627 1.00 . A A . 25 LYS CE 1 1 11 4757 1 1 25 LYS CG C 16.792 -5.755 0.872 1.00 . A A . 25 LYS CG 1 1 11 4758 1 1 25 LYS H H 18.303 -2.187 2.147 1.00 . A A . 25 LYS H 1 1 11 4759 1 1 25 LYS HA H 17.926 -5.062 2.928 1.00 . A A . 25 LYS HA 1 1 11 4760 1 1 25 LYS HB2 H 17.237 -3.685 0.513 1.00 . A A . 25 LYS HB2 1 1 11 4761 1 1 25 LYS HB3 H 18.565 -4.789 0.148 1.00 . A A . 25 LYS HB3 1 1 11 4762 1 1 25 LYS HD2 H 15.511 -5.841 -0.849 1.00 . A A . 25 LYS HD2 1 1 11 4763 1 1 25 LYS HD3 H 17.234 -5.812 -1.228 1.00 . A A . 25 LYS HD3 1 1 11 4764 1 1 25 LYS HE2 H 17.110 -8.144 0.166 1.00 . A A . 25 LYS HE2 1 1 11 4765 1 1 25 LYS HE3 H 15.492 -8.125 -0.562 1.00 . A A . 25 LYS HE3 1 1 11 4766 1 1 25 LYS HG2 H 17.238 -6.571 1.422 1.00 . A A . 25 LYS HG2 1 1 11 4767 1 1 25 LYS HG3 H 15.875 -5.454 1.357 1.00 . A A . 25 LYS HG3 1 1 11 4768 1 1 25 LYS HZ1 H 17.018 -9.087 -2.126 1.00 . A A . 25 LYS HZ1 1 1 11 4769 1 1 25 LYS HZ2 H 18.085 -7.773 -1.978 1.00 . A A . 25 LYS HZ2 1 1 11 4770 1 1 25 LYS HZ3 H 16.562 -7.559 -2.704 1.00 . A A . 25 LYS HZ3 1 1 11 4771 1 1 25 LYS N N 17.914 -2.959 2.611 1.00 . A A . 25 LYS N 1 1 11 4772 1 1 25 LYS NZ N 17.085 -8.064 -1.960 1.00 . A A . 25 LYS NZ 1 1 11 4773 1 1 25 LYS O O 20.392 -5.312 2.899 1.00 . A A . 25 LYS O 1 1 11 4774 1 1 25 LYS OXT O 20.494 -3.663 1.518 1.00 . A A . 25 LYS OXT 1 1 12 4775 1 1 1 HIS C C -21.059 2.023 -2.312 1.00 . A A . 1 HIS C 1 1 12 4776 1 1 1 HIS CA C -21.990 2.554 -1.214 1.00 . A A . 1 HIS CA 1 1 12 4777 1 1 1 HIS CB C -23.295 1.749 -1.170 1.00 . A A . 1 HIS CB 1 1 12 4778 1 1 1 HIS CD2 C -22.250 -0.028 0.466 1.00 . A A . 1 HIS CD2 1 1 12 4779 1 1 1 HIS CE1 C -23.191 -1.800 -0.352 1.00 . A A . 1 HIS CE1 1 1 12 4780 1 1 1 HIS CG C -23.034 0.387 -0.583 1.00 . A A . 1 HIS CG 1 1 12 4781 1 1 1 HIS HA H -21.501 2.514 -0.254 1.00 . A A . 1 HIS HA 1 1 12 4782 1 1 1 HIS HB2 H -24.018 2.269 -0.560 1.00 . A A . 1 HIS HB2 1 1 12 4783 1 1 1 HIS HB3 H -23.684 1.639 -2.172 1.00 . A A . 1 HIS HB3 1 1 12 4784 1 1 1 HIS HD1 H -24.248 -0.807 -1.845 1.00 . A A . 1 HIS HD1 1 1 12 4785 1 1 1 HIS HD2 H -21.647 0.619 1.085 1.00 . A A . 1 HIS HD2 1 1 12 4786 1 1 1 HIS HE1 H -23.487 -2.825 -0.517 1.00 . A A . 1 HIS HE1 1 1 12 4787 1 1 1 HIS N N -22.408 3.955 -1.525 1.00 . A A . 1 HIS N 1 1 12 4788 1 1 1 HIS ND1 N -23.625 -0.760 -1.089 1.00 . A A . 1 HIS ND1 1 1 12 4789 1 1 1 HIS NE2 N -22.350 -1.409 0.609 1.00 . A A . 1 HIS NE2 1 1 12 4790 1 1 1 HIS O O -21.456 1.869 -3.452 1.00 . A A . 1 HIS O 1 1 12 4791 1 1 2 ALA C C -17.866 0.254 -2.343 1.00 . A A . 2 ALA C 1 1 12 4792 1 1 2 ALA CA C -18.856 1.227 -2.993 1.00 . A A . 2 ALA CA 1 1 12 4793 1 1 2 ALA CB C -18.123 2.465 -3.515 1.00 . A A . 2 ALA CB 1 1 12 4794 1 1 2 ALA H H -19.526 1.881 -1.050 1.00 . A A . 2 ALA H 1 1 12 4795 1 1 2 ALA HA H -19.384 0.744 -3.801 1.00 . A A . 2 ALA HA 1 1 12 4796 1 1 2 ALA HB1 H -17.697 3.008 -2.685 1.00 . A A . 2 ALA HB1 1 1 12 4797 1 1 2 ALA HB2 H -18.820 3.101 -4.042 1.00 . A A . 2 ALA HB2 1 1 12 4798 1 1 2 ALA HB3 H -17.335 2.159 -4.188 1.00 . A A . 2 ALA HB3 1 1 12 4799 1 1 2 ALA N N -19.821 1.746 -1.975 1.00 . A A . 2 ALA N 1 1 12 4800 1 1 2 ALA O O -17.282 0.545 -1.314 1.00 . A A . 2 ALA O 1 1 12 4801 1 1 3 TRP C C -15.274 -1.525 -2.753 1.00 . A A . 3 TRP C 1 1 12 4802 1 1 3 TRP CA C -16.713 -1.889 -2.358 1.00 . A A . 3 TRP CA 1 1 12 4803 1 1 3 TRP CB C -17.122 -3.242 -2.952 1.00 . A A . 3 TRP CB 1 1 12 4804 1 1 3 TRP CD1 C -15.582 -4.779 -1.662 1.00 . A A . 3 TRP CD1 1 1 12 4805 1 1 3 TRP CD2 C -17.751 -5.112 -1.167 1.00 . A A . 3 TRP CD2 1 1 12 4806 1 1 3 TRP CE2 C -17.011 -6.028 -0.383 1.00 . A A . 3 TRP CE2 1 1 12 4807 1 1 3 TRP CE3 C -19.153 -5.117 -1.044 1.00 . A A . 3 TRP CE3 1 1 12 4808 1 1 3 TRP CG C -16.821 -4.331 -1.971 1.00 . A A . 3 TRP CG 1 1 12 4809 1 1 3 TRP CH2 C -19.031 -6.906 0.602 1.00 . A A . 3 TRP CH2 1 1 12 4810 1 1 3 TRP CZ2 C -17.638 -6.915 0.492 1.00 . A A . 3 TRP CZ2 1 1 12 4811 1 1 3 TRP CZ3 C -19.787 -6.008 -0.165 1.00 . A A . 3 TRP CZ3 1 1 12 4812 1 1 3 TRP H H -18.149 -1.107 -3.768 1.00 . A A . 3 TRP H 1 1 12 4813 1 1 3 TRP HA H -16.809 -1.915 -1.283 1.00 . A A . 3 TRP HA 1 1 12 4814 1 1 3 TRP HB2 H -18.181 -3.235 -3.167 1.00 . A A . 3 TRP HB2 1 1 12 4815 1 1 3 TRP HB3 H -16.571 -3.416 -3.865 1.00 . A A . 3 TRP HB3 1 1 12 4816 1 1 3 TRP HD1 H -14.657 -4.410 -2.082 1.00 . A A . 3 TRP HD1 1 1 12 4817 1 1 3 TRP HE1 H -14.943 -6.278 -0.326 1.00 . A A . 3 TRP HE1 1 1 12 4818 1 1 3 TRP HE3 H -19.745 -4.429 -1.630 1.00 . A A . 3 TRP HE3 1 1 12 4819 1 1 3 TRP HH2 H -19.524 -7.589 1.278 1.00 . A A . 3 TRP HH2 1 1 12 4820 1 1 3 TRP HZ2 H -17.051 -7.605 1.081 1.00 . A A . 3 TRP HZ2 1 1 12 4821 1 1 3 TRP HZ3 H -20.864 -6.003 -0.078 1.00 . A A . 3 TRP HZ3 1 1 12 4822 1 1 3 TRP N N -17.670 -0.897 -2.939 1.00 . A A . 3 TRP N 1 1 12 4823 1 1 3 TRP NE1 N -15.694 -5.785 -0.719 1.00 . A A . 3 TRP NE1 1 1 12 4824 1 1 3 TRP O O -14.675 -2.149 -3.609 1.00 . A A . 3 TRP O 1 1 12 4825 1 1 4 TYR C C -12.699 0.642 -1.262 1.00 . A A . 4 TYR C 1 1 12 4826 1 1 4 TYR CA C -13.325 -0.089 -2.460 1.00 . A A . 4 TYR CA 1 1 12 4827 1 1 4 TYR CB C -13.471 0.854 -3.661 1.00 . A A . 4 TYR CB 1 1 12 4828 1 1 4 TYR CD1 C -11.715 -0.319 -5.047 1.00 . A A . 4 TYR CD1 1 1 12 4829 1 1 4 TYR CD2 C -11.479 2.058 -4.633 1.00 . A A . 4 TYR CD2 1 1 12 4830 1 1 4 TYR CE1 C -10.531 -0.307 -5.793 1.00 . A A . 4 TYR CE1 1 1 12 4831 1 1 4 TYR CE2 C -10.296 2.070 -5.379 1.00 . A A . 4 TYR CE2 1 1 12 4832 1 1 4 TYR CG C -12.190 0.864 -4.466 1.00 . A A . 4 TYR CG 1 1 12 4833 1 1 4 TYR CZ C -9.821 0.889 -5.959 1.00 . A A . 4 TYR CZ 1 1 12 4834 1 1 4 TYR H H -15.228 -0.024 -1.451 1.00 . A A . 4 TYR H 1 1 12 4835 1 1 4 TYR HA H -12.728 -0.945 -2.733 1.00 . A A . 4 TYR HA 1 1 12 4836 1 1 4 TYR HB2 H -14.283 0.515 -4.286 1.00 . A A . 4 TYR HB2 1 1 12 4837 1 1 4 TYR HB3 H -13.681 1.853 -3.309 1.00 . A A . 4 TYR HB3 1 1 12 4838 1 1 4 TYR HD1 H -12.262 -1.242 -4.920 1.00 . A A . 4 TYR HD1 1 1 12 4839 1 1 4 TYR HD2 H -11.844 2.971 -4.184 1.00 . A A . 4 TYR HD2 1 1 12 4840 1 1 4 TYR HE1 H -10.165 -1.218 -6.242 1.00 . A A . 4 TYR HE1 1 1 12 4841 1 1 4 TYR HE2 H -9.748 2.992 -5.507 1.00 . A A . 4 TYR HE2 1 1 12 4842 1 1 4 TYR HH H -7.917 0.931 -6.083 1.00 . A A . 4 TYR HH 1 1 12 4843 1 1 4 TYR N N -14.722 -0.511 -2.133 1.00 . A A . 4 TYR N 1 1 12 4844 1 1 4 TYR O O -11.995 1.622 -1.417 1.00 . A A . 4 TYR O 1 1 12 4845 1 1 4 TYR OH O -8.655 0.901 -6.696 1.00 . A A . 4 TYR OH 1 1 12 4846 1 1 5 SER C C -11.111 0.084 1.600 1.00 . A A . 5 SER C 1 1 12 4847 1 1 5 SER CA C -12.371 0.825 1.147 1.00 . A A . 5 SER CA 1 1 12 4848 1 1 5 SER CB C -13.466 0.738 2.213 1.00 . A A . 5 SER CB 1 1 12 4849 1 1 5 SER H H -13.517 -0.627 0.036 1.00 . A A . 5 SER H 1 1 12 4850 1 1 5 SER HA H -12.142 1.854 0.939 1.00 . A A . 5 SER HA 1 1 12 4851 1 1 5 SER HB2 H -13.935 -0.232 2.173 1.00 . A A . 5 SER HB2 1 1 12 4852 1 1 5 SER HB3 H -13.026 0.881 3.191 1.00 . A A . 5 SER HB3 1 1 12 4853 1 1 5 SER HG H -15.005 1.442 1.247 1.00 . A A . 5 SER HG 1 1 12 4854 1 1 5 SER N N -12.950 0.166 -0.065 1.00 . A A . 5 SER N 1 1 12 4855 1 1 5 SER O O -10.093 0.686 1.875 1.00 . A A . 5 SER O 1 1 12 4856 1 1 5 SER OG O -14.444 1.741 1.967 1.00 . A A . 5 SER OG 1 1 12 4857 1 1 6 HIS C C -8.942 -2.074 0.961 1.00 . A A . 6 HIS C 1 1 12 4858 1 1 6 HIS CA C -9.977 -2.014 2.092 1.00 . A A . 6 HIS CA 1 1 12 4859 1 1 6 HIS CB C -10.507 -3.415 2.411 1.00 . A A . 6 HIS CB 1 1 12 4860 1 1 6 HIS CD2 C -9.833 -3.558 4.949 1.00 . A A . 6 HIS CD2 1 1 12 4861 1 1 6 HIS CE1 C -11.814 -3.807 5.790 1.00 . A A . 6 HIS CE1 1 1 12 4862 1 1 6 HIS CG C -10.714 -3.552 3.896 1.00 . A A . 6 HIS CG 1 1 12 4863 1 1 6 HIS H H -12.008 -1.676 1.431 1.00 . A A . 6 HIS H 1 1 12 4864 1 1 6 HIS HA H -9.535 -1.577 2.971 1.00 . A A . 6 HIS HA 1 1 12 4865 1 1 6 HIS HB2 H -11.446 -3.571 1.901 1.00 . A A . 6 HIS HB2 1 1 12 4866 1 1 6 HIS HB3 H -9.792 -4.154 2.080 1.00 . A A . 6 HIS HB3 1 1 12 4867 1 1 6 HIS HD1 H -12.823 -3.751 3.970 1.00 . A A . 6 HIS HD1 1 1 12 4868 1 1 6 HIS HD2 H -8.761 -3.453 4.864 1.00 . A A . 6 HIS HD2 1 1 12 4869 1 1 6 HIS HE1 H -12.627 -3.938 6.489 1.00 . A A . 6 HIS HE1 1 1 12 4870 1 1 6 HIS N N -11.173 -1.220 1.667 1.00 . A A . 6 HIS N 1 1 12 4871 1 1 6 HIS ND1 N -11.973 -3.713 4.456 1.00 . A A . 6 HIS ND1 1 1 12 4872 1 1 6 HIS NE2 N -10.529 -3.718 6.143 1.00 . A A . 6 HIS NE2 1 1 12 4873 1 1 6 HIS O O -7.773 -2.310 1.199 1.00 . A A . 6 HIS O 1 1 12 4874 1 1 7 TYR C C -7.353 -0.793 -1.265 1.00 . A A . 7 TYR C 1 1 12 4875 1 1 7 TYR CA C -8.398 -1.900 -1.410 1.00 . A A . 7 TYR CA 1 1 12 4876 1 1 7 TYR CB C -9.247 -1.680 -2.668 1.00 . A A . 7 TYR CB 1 1 12 4877 1 1 7 TYR CD1 C -8.521 -3.731 -3.942 1.00 . A A . 7 TYR CD1 1 1 12 4878 1 1 7 TYR CD2 C -10.850 -3.523 -3.295 1.00 . A A . 7 TYR CD2 1 1 12 4879 1 1 7 TYR CE1 C -8.799 -4.964 -4.544 1.00 . A A . 7 TYR CE1 1 1 12 4880 1 1 7 TYR CE2 C -11.126 -4.756 -3.897 1.00 . A A . 7 TYR CE2 1 1 12 4881 1 1 7 TYR CG C -9.546 -3.011 -3.317 1.00 . A A . 7 TYR CG 1 1 12 4882 1 1 7 TYR CZ C -10.101 -5.477 -4.522 1.00 . A A . 7 TYR CZ 1 1 12 4883 1 1 7 TYR H H -10.306 -1.669 -0.426 1.00 . A A . 7 TYR H 1 1 12 4884 1 1 7 TYR HA H -7.913 -2.858 -1.454 1.00 . A A . 7 TYR HA 1 1 12 4885 1 1 7 TYR HB2 H -10.173 -1.194 -2.398 1.00 . A A . 7 TYR HB2 1 1 12 4886 1 1 7 TYR HB3 H -8.705 -1.057 -3.363 1.00 . A A . 7 TYR HB3 1 1 12 4887 1 1 7 TYR HD1 H -7.516 -3.337 -3.960 1.00 . A A . 7 TYR HD1 1 1 12 4888 1 1 7 TYR HD2 H -11.641 -2.968 -2.813 1.00 . A A . 7 TYR HD2 1 1 12 4889 1 1 7 TYR HE1 H -8.008 -5.519 -5.026 1.00 . A A . 7 TYR HE1 1 1 12 4890 1 1 7 TYR HE2 H -12.131 -5.152 -3.881 1.00 . A A . 7 TYR HE2 1 1 12 4891 1 1 7 TYR HH H -10.127 -7.386 -4.499 1.00 . A A . 7 TYR HH 1 1 12 4892 1 1 7 TYR N N -9.360 -1.859 -0.263 1.00 . A A . 7 TYR N 1 1 12 4893 1 1 7 TYR O O -6.168 -1.025 -1.415 1.00 . A A . 7 TYR O 1 1 12 4894 1 1 7 TYR OH O -10.373 -6.692 -5.115 1.00 . A A . 7 TYR OH 1 1 12 4895 1 1 8 VAL C C -5.933 1.277 0.449 1.00 . A A . 8 VAL C 1 1 12 4896 1 1 8 VAL CA C -6.809 1.527 -0.788 1.00 . A A . 8 VAL CA 1 1 12 4897 1 1 8 VAL CB C -7.666 2.796 -0.631 1.00 . A A . 8 VAL CB 1 1 12 4898 1 1 8 VAL CG1 C -8.179 2.925 0.806 1.00 . A A . 8 VAL CG1 1 1 12 4899 1 1 8 VAL CG2 C -6.821 4.024 -0.978 1.00 . A A . 8 VAL CG2 1 1 12 4900 1 1 8 VAL H H -8.741 0.558 -0.834 1.00 . A A . 8 VAL H 1 1 12 4901 1 1 8 VAL HA H -6.190 1.611 -1.664 1.00 . A A . 8 VAL HA 1 1 12 4902 1 1 8 VAL HB H -8.510 2.741 -1.304 1.00 . A A . 8 VAL HB 1 1 12 4903 1 1 8 VAL HG11 H -7.390 3.308 1.438 1.00 . A A . 8 VAL HG11 1 1 12 4904 1 1 8 VAL HG12 H -8.490 1.957 1.167 1.00 . A A . 8 VAL HG12 1 1 12 4905 1 1 8 VAL HG13 H -9.019 3.605 0.830 1.00 . A A . 8 VAL HG13 1 1 12 4906 1 1 8 VAL HG21 H -5.916 4.016 -0.390 1.00 . A A . 8 VAL HG21 1 1 12 4907 1 1 8 VAL HG22 H -7.384 4.921 -0.763 1.00 . A A . 8 VAL HG22 1 1 12 4908 1 1 8 VAL HG23 H -6.568 4.002 -2.028 1.00 . A A . 8 VAL HG23 1 1 12 4909 1 1 8 VAL N N -7.781 0.404 -0.960 1.00 . A A . 8 VAL N 1 1 12 4910 1 1 8 VAL O O -4.808 1.731 0.523 1.00 . A A . 8 VAL O 1 1 12 4911 1 1 9 LEU C C -4.674 -0.921 2.362 1.00 . A A . 9 LEU C 1 1 12 4912 1 1 9 LEU CA C -5.643 0.238 2.635 1.00 . A A . 9 LEU CA 1 1 12 4913 1 1 9 LEU CB C -6.676 -0.160 3.699 1.00 . A A . 9 LEU CB 1 1 12 4914 1 1 9 LEU CD1 C -5.106 0.378 5.583 1.00 . A A . 9 LEU CD1 1 1 12 4915 1 1 9 LEU CD2 C -6.571 2.167 4.626 1.00 . A A . 9 LEU CD2 1 1 12 4916 1 1 9 LEU CG C -6.478 0.676 4.971 1.00 . A A . 9 LEU CG 1 1 12 4917 1 1 9 LEU H H -7.343 0.178 1.314 1.00 . A A . 9 LEU H 1 1 12 4918 1 1 9 LEU HA H -5.100 1.113 2.957 1.00 . A A . 9 LEU HA 1 1 12 4919 1 1 9 LEU HB2 H -7.671 0.007 3.313 1.00 . A A . 9 LEU HB2 1 1 12 4920 1 1 9 LEU HB3 H -6.558 -1.207 3.939 1.00 . A A . 9 LEU HB3 1 1 12 4921 1 1 9 LEU HD11 H -5.099 0.687 6.618 1.00 . A A . 9 LEU HD11 1 1 12 4922 1 1 9 LEU HD12 H -4.344 0.918 5.041 1.00 . A A . 9 LEU HD12 1 1 12 4923 1 1 9 LEU HD13 H -4.907 -0.682 5.524 1.00 . A A . 9 LEU HD13 1 1 12 4924 1 1 9 LEU HD21 H -7.338 2.318 3.882 1.00 . A A . 9 LEU HD21 1 1 12 4925 1 1 9 LEU HD22 H -5.621 2.507 4.238 1.00 . A A . 9 LEU HD22 1 1 12 4926 1 1 9 LEU HD23 H -6.817 2.727 5.516 1.00 . A A . 9 LEU HD23 1 1 12 4927 1 1 9 LEU HG H -7.249 0.425 5.685 1.00 . A A . 9 LEU HG 1 1 12 4928 1 1 9 LEU N N -6.439 0.541 1.409 1.00 . A A . 9 LEU N 1 1 12 4929 1 1 9 LEU O O -3.630 -1.019 2.978 1.00 . A A . 9 LEU O 1 1 12 4930 1 1 10 LYS C C -3.128 -2.573 0.008 1.00 . A A . 10 LYS C 1 1 12 4931 1 1 10 LYS CA C -4.105 -2.947 1.132 1.00 . A A . 10 LYS CA 1 1 12 4932 1 1 10 LYS CB C -5.036 -4.077 0.683 1.00 . A A . 10 LYS CB 1 1 12 4933 1 1 10 LYS CD C -4.478 -5.960 2.239 1.00 . A A . 10 LYS CD 1 1 12 4934 1 1 10 LYS CE C -3.153 -6.572 2.713 1.00 . A A . 10 LYS CE 1 1 12 4935 1 1 10 LYS CG C -4.314 -5.423 0.812 1.00 . A A . 10 LYS CG 1 1 12 4936 1 1 10 LYS H H -5.858 -1.700 0.956 1.00 . A A . 10 LYS H 1 1 12 4937 1 1 10 LYS HA H -3.562 -3.247 2.015 1.00 . A A . 10 LYS HA 1 1 12 4938 1 1 10 LYS HB2 H -5.921 -4.082 1.303 1.00 . A A . 10 LYS HB2 1 1 12 4939 1 1 10 LYS HB3 H -5.321 -3.922 -0.347 1.00 . A A . 10 LYS HB3 1 1 12 4940 1 1 10 LYS HD2 H -4.757 -5.150 2.898 1.00 . A A . 10 LYS HD2 1 1 12 4941 1 1 10 LYS HD3 H -5.247 -6.716 2.252 1.00 . A A . 10 LYS HD3 1 1 12 4942 1 1 10 LYS HE2 H -2.321 -6.102 2.208 1.00 . A A . 10 LYS HE2 1 1 12 4943 1 1 10 LYS HE3 H -3.054 -6.466 3.783 1.00 . A A . 10 LYS HE3 1 1 12 4944 1 1 10 LYS HG2 H -4.740 -6.127 0.111 1.00 . A A . 10 LYS HG2 1 1 12 4945 1 1 10 LYS HG3 H -3.264 -5.289 0.597 1.00 . A A . 10 LYS HG3 1 1 12 4946 1 1 10 LYS HZ1 H -3.960 -8.483 2.933 1.00 . A A . 10 LYS HZ1 1 1 12 4947 1 1 10 LYS HZ2 H -2.312 -8.467 2.519 1.00 . A A . 10 LYS HZ2 1 1 12 4948 1 1 10 LYS HZ3 H -3.488 -8.111 1.346 1.00 . A A . 10 LYS HZ3 1 1 12 4949 1 1 10 LYS N N -5.009 -1.797 1.444 1.00 . A A . 10 LYS N 1 1 12 4950 1 1 10 LYS NZ N -3.236 -8.017 2.351 1.00 . A A . 10 LYS NZ 1 1 12 4951 1 1 10 LYS O O -1.981 -2.976 0.020 1.00 . A A . 10 LYS O 1 1 12 4952 1 1 11 PHE C C -1.680 -0.337 -1.632 1.00 . A A . 11 PHE C 1 1 12 4953 1 1 11 PHE CA C -2.670 -1.416 -2.087 1.00 . A A . 11 PHE CA 1 1 12 4954 1 1 11 PHE CB C -3.605 -0.874 -3.176 1.00 . A A . 11 PHE CB 1 1 12 4955 1 1 11 PHE CD1 C -2.411 -1.407 -5.334 1.00 . A A . 11 PHE CD1 1 1 12 4956 1 1 11 PHE CD2 C -2.440 0.888 -4.552 1.00 . A A . 11 PHE CD2 1 1 12 4957 1 1 11 PHE CE1 C -1.664 -1.017 -6.452 1.00 . A A . 11 PHE CE1 1 1 12 4958 1 1 11 PHE CE2 C -1.693 1.278 -5.671 1.00 . A A . 11 PHE CE2 1 1 12 4959 1 1 11 PHE CG C -2.798 -0.455 -4.384 1.00 . A A . 11 PHE CG 1 1 12 4960 1 1 11 PHE CZ C -1.305 0.325 -6.620 1.00 . A A . 11 PHE CZ 1 1 12 4961 1 1 11 PHE H H -4.504 -1.500 -0.950 1.00 . A A . 11 PHE H 1 1 12 4962 1 1 11 PHE HA H -2.137 -2.278 -2.457 1.00 . A A . 11 PHE HA 1 1 12 4963 1 1 11 PHE HB2 H -4.307 -1.644 -3.463 1.00 . A A . 11 PHE HB2 1 1 12 4964 1 1 11 PHE HB3 H -4.146 -0.021 -2.792 1.00 . A A . 11 PHE HB3 1 1 12 4965 1 1 11 PHE HD1 H -2.687 -2.444 -5.204 1.00 . A A . 11 PHE HD1 1 1 12 4966 1 1 11 PHE HD2 H -2.737 1.623 -3.820 1.00 . A A . 11 PHE HD2 1 1 12 4967 1 1 11 PHE HE1 H -1.365 -1.752 -7.185 1.00 . A A . 11 PHE HE1 1 1 12 4968 1 1 11 PHE HE2 H -1.416 2.314 -5.800 1.00 . A A . 11 PHE HE2 1 1 12 4969 1 1 11 PHE HZ H -0.730 0.627 -7.483 1.00 . A A . 11 PHE HZ 1 1 12 4970 1 1 11 PHE N N -3.573 -1.811 -0.961 1.00 . A A . 11 PHE N 1 1 12 4971 1 1 11 PHE O O -0.491 -0.450 -1.859 1.00 . A A . 11 PHE O 1 1 12 4972 1 1 12 PHE C C -0.179 1.228 0.429 1.00 . A A . 12 PHE C 1 1 12 4973 1 1 12 PHE CA C -1.232 1.795 -0.531 1.00 . A A . 12 PHE CA 1 1 12 4974 1 1 12 PHE CB C -2.124 2.812 0.189 1.00 . A A . 12 PHE CB 1 1 12 4975 1 1 12 PHE CD1 C -1.063 4.978 -0.551 1.00 . A A . 12 PHE CD1 1 1 12 4976 1 1 12 PHE CD2 C -0.859 4.314 1.772 1.00 . A A . 12 PHE CD2 1 1 12 4977 1 1 12 PHE CE1 C -0.326 6.138 -0.284 1.00 . A A . 12 PHE CE1 1 1 12 4978 1 1 12 PHE CE2 C -0.122 5.474 2.039 1.00 . A A . 12 PHE CE2 1 1 12 4979 1 1 12 PHE CG C -1.330 4.065 0.477 1.00 . A A . 12 PHE CG 1 1 12 4980 1 1 12 PHE CZ C 0.144 6.385 1.011 1.00 . A A . 12 PHE CZ 1 1 12 4981 1 1 12 PHE H H -3.120 0.781 -0.826 1.00 . A A . 12 PHE H 1 1 12 4982 1 1 12 PHE HA H -0.752 2.262 -1.376 1.00 . A A . 12 PHE HA 1 1 12 4983 1 1 12 PHE HB2 H -2.969 3.057 -0.439 1.00 . A A . 12 PHE HB2 1 1 12 4984 1 1 12 PHE HB3 H -2.475 2.389 1.117 1.00 . A A . 12 PHE HB3 1 1 12 4985 1 1 12 PHE HD1 H -1.425 4.788 -1.551 1.00 . A A . 12 PHE HD1 1 1 12 4986 1 1 12 PHE HD2 H -1.065 3.610 2.565 1.00 . A A . 12 PHE HD2 1 1 12 4987 1 1 12 PHE HE1 H -0.120 6.841 -1.077 1.00 . A A . 12 PHE HE1 1 1 12 4988 1 1 12 PHE HE2 H 0.242 5.665 3.037 1.00 . A A . 12 PHE HE2 1 1 12 4989 1 1 12 PHE HZ H 0.713 7.280 1.217 1.00 . A A . 12 PHE HZ 1 1 12 4990 1 1 12 PHE N N -2.156 0.709 -0.995 1.00 . A A . 12 PHE N 1 1 12 4991 1 1 12 PHE O O 0.998 1.500 0.292 1.00 . A A . 12 PHE O 1 1 12 4992 1 1 13 LEU C C 1.446 -0.972 1.607 1.00 . A A . 13 LEU C 1 1 12 4993 1 1 13 LEU CA C 0.383 -0.159 2.359 1.00 . A A . 13 LEU CA 1 1 12 4994 1 1 13 LEU CB C -0.453 -1.070 3.267 1.00 . A A . 13 LEU CB 1 1 12 4995 1 1 13 LEU CD1 C -0.162 -1.183 5.752 1.00 . A A . 13 LEU CD1 1 1 12 4996 1 1 13 LEU CD2 C 0.464 -3.141 4.332 1.00 . A A . 13 LEU CD2 1 1 12 4997 1 1 13 LEU CG C 0.422 -1.612 4.404 1.00 . A A . 13 LEU CG 1 1 12 4998 1 1 13 LEU H H -1.550 0.230 1.475 1.00 . A A . 13 LEU H 1 1 12 4999 1 1 13 LEU HA H 0.849 0.616 2.946 1.00 . A A . 13 LEU HA 1 1 12 5000 1 1 13 LEU HB2 H -1.275 -0.505 3.682 1.00 . A A . 13 LEU HB2 1 1 12 5001 1 1 13 LEU HB3 H -0.840 -1.896 2.688 1.00 . A A . 13 LEU HB3 1 1 12 5002 1 1 13 LEU HD11 H 0.546 -1.403 6.538 1.00 . A A . 13 LEU HD11 1 1 12 5003 1 1 13 LEU HD12 H -1.080 -1.722 5.935 1.00 . A A . 13 LEU HD12 1 1 12 5004 1 1 13 LEU HD13 H -0.365 -0.122 5.737 1.00 . A A . 13 LEU HD13 1 1 12 5005 1 1 13 LEU HD21 H 1.287 -3.506 4.927 1.00 . A A . 13 LEU HD21 1 1 12 5006 1 1 13 LEU HD22 H 0.597 -3.450 3.306 1.00 . A A . 13 LEU HD22 1 1 12 5007 1 1 13 LEU HD23 H -0.462 -3.544 4.713 1.00 . A A . 13 LEU HD23 1 1 12 5008 1 1 13 LEU HG H 1.424 -1.218 4.307 1.00 . A A . 13 LEU HG 1 1 12 5009 1 1 13 LEU N N -0.594 0.437 1.392 1.00 . A A . 13 LEU N 1 1 12 5010 1 1 13 LEU O O 2.606 -0.971 1.968 1.00 . A A . 13 LEU O 1 1 12 5011 1 1 14 LEU C C 3.014 -1.541 -0.966 1.00 . A A . 14 LEU C 1 1 12 5012 1 1 14 LEU CA C 2.040 -2.468 -0.229 1.00 . A A . 14 LEU CA 1 1 12 5013 1 1 14 LEU CB C 1.198 -3.270 -1.228 1.00 . A A . 14 LEU CB 1 1 12 5014 1 1 14 LEU CD1 C 1.022 -5.684 -1.866 1.00 . A A . 14 LEU CD1 1 1 12 5015 1 1 14 LEU CD2 C 2.670 -4.205 -3.023 1.00 . A A . 14 LEU CD2 1 1 12 5016 1 1 14 LEU CG C 1.981 -4.505 -1.689 1.00 . A A . 14 LEU CG 1 1 12 5017 1 1 14 LEU H H 0.113 -1.640 0.285 1.00 . A A . 14 LEU H 1 1 12 5018 1 1 14 LEU HA H 2.578 -3.135 0.419 1.00 . A A . 14 LEU HA 1 1 12 5019 1 1 14 LEU HB2 H 0.278 -3.582 -0.756 1.00 . A A . 14 LEU HB2 1 1 12 5020 1 1 14 LEU HB3 H 0.969 -2.651 -2.084 1.00 . A A . 14 LEU HB3 1 1 12 5021 1 1 14 LEU HD11 H 0.525 -5.888 -0.930 1.00 . A A . 14 LEU HD11 1 1 12 5022 1 1 14 LEU HD12 H 1.579 -6.556 -2.177 1.00 . A A . 14 LEU HD12 1 1 12 5023 1 1 14 LEU HD13 H 0.287 -5.441 -2.620 1.00 . A A . 14 LEU HD13 1 1 12 5024 1 1 14 LEU HD21 H 3.491 -4.893 -3.166 1.00 . A A . 14 LEU HD21 1 1 12 5025 1 1 14 LEU HD22 H 3.047 -3.193 -3.015 1.00 . A A . 14 LEU HD22 1 1 12 5026 1 1 14 LEU HD23 H 1.961 -4.318 -3.829 1.00 . A A . 14 LEU HD23 1 1 12 5027 1 1 14 LEU HG H 2.725 -4.756 -0.947 1.00 . A A . 14 LEU HG 1 1 12 5028 1 1 14 LEU N N 1.055 -1.661 0.558 1.00 . A A . 14 LEU N 1 1 12 5029 1 1 14 LEU O O 4.215 -1.732 -0.929 1.00 . A A . 14 LEU O 1 1 12 5030 1 1 15 VAL C C 4.241 1.218 -1.386 1.00 . A A . 15 VAL C 1 1 12 5031 1 1 15 VAL CA C 3.377 0.419 -2.375 1.00 . A A . 15 VAL CA 1 1 12 5032 1 1 15 VAL CB C 2.413 1.345 -3.132 1.00 . A A . 15 VAL CB 1 1 12 5033 1 1 15 VAL CG1 C 3.190 2.497 -3.777 1.00 . A A . 15 VAL CG1 1 1 12 5034 1 1 15 VAL CG2 C 1.696 0.548 -4.229 1.00 . A A . 15 VAL CG2 1 1 12 5035 1 1 15 VAL H H 1.527 -0.415 -1.632 1.00 . A A . 15 VAL H 1 1 12 5036 1 1 15 VAL HA H 4.004 -0.113 -3.073 1.00 . A A . 15 VAL HA 1 1 12 5037 1 1 15 VAL HB H 1.684 1.745 -2.443 1.00 . A A . 15 VAL HB 1 1 12 5038 1 1 15 VAL HG11 H 3.463 3.216 -3.018 1.00 . A A . 15 VAL HG11 1 1 12 5039 1 1 15 VAL HG12 H 2.573 2.977 -4.521 1.00 . A A . 15 VAL HG12 1 1 12 5040 1 1 15 VAL HG13 H 4.084 2.111 -4.245 1.00 . A A . 15 VAL HG13 1 1 12 5041 1 1 15 VAL HG21 H 1.513 -0.459 -3.883 1.00 . A A . 15 VAL HG21 1 1 12 5042 1 1 15 VAL HG22 H 2.314 0.517 -5.114 1.00 . A A . 15 VAL HG22 1 1 12 5043 1 1 15 VAL HG23 H 0.756 1.025 -4.463 1.00 . A A . 15 VAL HG23 1 1 12 5044 1 1 15 VAL N N 2.498 -0.539 -1.628 1.00 . A A . 15 VAL N 1 1 12 5045 1 1 15 VAL O O 5.440 1.347 -1.560 1.00 . A A . 15 VAL O 1 1 12 5046 1 1 16 PHE C C 5.413 1.591 1.386 1.00 . A A . 16 PHE C 1 1 12 5047 1 1 16 PHE CA C 4.422 2.518 0.667 1.00 . A A . 16 PHE CA 1 1 12 5048 1 1 16 PHE CB C 3.381 3.064 1.651 1.00 . A A . 16 PHE CB 1 1 12 5049 1 1 16 PHE CD1 C 4.808 4.248 3.362 1.00 . A A . 16 PHE CD1 1 1 12 5050 1 1 16 PHE CD2 C 3.481 5.577 1.828 1.00 . A A . 16 PHE CD2 1 1 12 5051 1 1 16 PHE CE1 C 5.292 5.419 3.959 1.00 . A A . 16 PHE CE1 1 1 12 5052 1 1 16 PHE CE2 C 3.965 6.748 2.425 1.00 . A A . 16 PHE CE2 1 1 12 5053 1 1 16 PHE CG C 3.903 4.328 2.296 1.00 . A A . 16 PHE CG 1 1 12 5054 1 1 16 PHE CZ C 4.870 6.668 3.489 1.00 . A A . 16 PHE CZ 1 1 12 5055 1 1 16 PHE H H 2.674 1.613 -0.222 1.00 . A A . 16 PHE H 1 1 12 5056 1 1 16 PHE HA H 4.945 3.333 0.192 1.00 . A A . 16 PHE HA 1 1 12 5057 1 1 16 PHE HB2 H 2.466 3.284 1.121 1.00 . A A . 16 PHE HB2 1 1 12 5058 1 1 16 PHE HB3 H 3.185 2.326 2.414 1.00 . A A . 16 PHE HB3 1 1 12 5059 1 1 16 PHE HD1 H 5.133 3.284 3.724 1.00 . A A . 16 PHE HD1 1 1 12 5060 1 1 16 PHE HD2 H 2.783 5.640 1.007 1.00 . A A . 16 PHE HD2 1 1 12 5061 1 1 16 PHE HE1 H 5.989 5.357 4.779 1.00 . A A . 16 PHE HE1 1 1 12 5062 1 1 16 PHE HE2 H 3.639 7.712 2.064 1.00 . A A . 16 PHE HE2 1 1 12 5063 1 1 16 PHE HZ H 5.243 7.571 3.951 1.00 . A A . 16 PHE HZ 1 1 12 5064 1 1 16 PHE N N 3.640 1.741 -0.343 1.00 . A A . 16 PHE N 1 1 12 5065 1 1 16 PHE O O 6.504 1.996 1.742 1.00 . A A . 16 PHE O 1 1 12 5066 1 1 17 GLY C C 7.203 -0.829 1.425 1.00 . A A . 17 GLY C 1 1 12 5067 1 1 17 GLY CA C 5.951 -0.616 2.278 1.00 . A A . 17 GLY CA 1 1 12 5068 1 1 17 GLY H H 4.156 0.048 1.290 1.00 . A A . 17 GLY H 1 1 12 5069 1 1 17 GLY HA2 H 6.233 -0.220 3.243 1.00 . A A . 17 GLY HA2 1 1 12 5070 1 1 17 GLY HA3 H 5.445 -1.560 2.408 1.00 . A A . 17 GLY HA3 1 1 12 5071 1 1 17 GLY N N 5.039 0.349 1.593 1.00 . A A . 17 GLY N 1 1 12 5072 1 1 17 GLY O O 8.310 -0.800 1.927 1.00 . A A . 17 GLY O 1 1 12 5073 1 1 18 GLU C C 9.113 0.015 -0.745 1.00 . A A . 18 GLU C 1 1 12 5074 1 1 18 GLU CA C 8.228 -1.238 -0.749 1.00 . A A . 18 GLU CA 1 1 12 5075 1 1 18 GLU CB C 7.653 -1.496 -2.147 1.00 . A A . 18 GLU CB 1 1 12 5076 1 1 18 GLU CD C 6.481 -3.655 -2.663 1.00 . A A . 18 GLU CD 1 1 12 5077 1 1 18 GLU CG C 7.846 -2.971 -2.522 1.00 . A A . 18 GLU CG 1 1 12 5078 1 1 18 GLU H H 6.135 -1.045 -0.242 1.00 . A A . 18 GLU H 1 1 12 5079 1 1 18 GLU HA H 8.793 -2.090 -0.418 1.00 . A A . 18 GLU HA 1 1 12 5080 1 1 18 GLU HB2 H 6.600 -1.256 -2.154 1.00 . A A . 18 GLU HB2 1 1 12 5081 1 1 18 GLU HB3 H 8.166 -0.875 -2.866 1.00 . A A . 18 GLU HB3 1 1 12 5082 1 1 18 GLU HG2 H 8.379 -3.036 -3.459 1.00 . A A . 18 GLU HG2 1 1 12 5083 1 1 18 GLU HG3 H 8.416 -3.467 -1.750 1.00 . A A . 18 GLU HG3 1 1 12 5084 1 1 18 GLU N N 7.039 -1.033 0.140 1.00 . A A . 18 GLU N 1 1 12 5085 1 1 18 GLU O O 10.324 -0.072 -0.791 1.00 . A A . 18 GLU O 1 1 12 5086 1 1 18 GLU OE1 O 5.766 -3.326 -3.597 1.00 . A A . 18 GLU OE1 1 1 12 5087 1 1 18 GLU OE2 O 6.176 -4.502 -1.838 1.00 . A A . 18 GLU OE2 1 1 12 5088 1 1 19 ASN C C 10.274 2.457 0.556 1.00 . A A . 19 ASN C 1 1 12 5089 1 1 19 ASN CA C 9.322 2.440 -0.650 1.00 . A A . 19 ASN CA 1 1 12 5090 1 1 19 ASN CB C 8.299 3.574 -0.540 1.00 . A A . 19 ASN CB 1 1 12 5091 1 1 19 ASN CG C 8.014 4.140 -1.933 1.00 . A A . 19 ASN CG 1 1 12 5092 1 1 19 ASN H H 7.540 1.218 -0.625 1.00 . A A . 19 ASN H 1 1 12 5093 1 1 19 ASN HA H 9.882 2.539 -1.563 1.00 . A A . 19 ASN HA 1 1 12 5094 1 1 19 ASN HB2 H 7.384 3.195 -0.111 1.00 . A A . 19 ASN HB2 1 1 12 5095 1 1 19 ASN HB3 H 8.696 4.357 0.088 1.00 . A A . 19 ASN HB3 1 1 12 5096 1 1 19 ASN HD21 H 6.618 2.790 -2.354 1.00 . A A . 19 ASN HD21 1 1 12 5097 1 1 19 ASN HD22 H 6.922 3.927 -3.577 1.00 . A A . 19 ASN HD22 1 1 12 5098 1 1 19 ASN N N 8.517 1.178 -0.673 1.00 . A A . 19 ASN N 1 1 12 5099 1 1 19 ASN ND2 N 7.110 3.573 -2.683 1.00 . A A . 19 ASN ND2 1 1 12 5100 1 1 19 ASN O O 11.278 3.141 0.549 1.00 . A A . 19 ASN O 1 1 12 5101 1 1 19 ASN OD1 O 8.624 5.107 -2.343 1.00 . A A . 19 ASN OD1 1 1 12 5102 1 1 20 GLY C C 11.593 0.332 2.861 1.00 . A A . 20 GLY C 1 1 12 5103 1 1 20 GLY CA C 10.846 1.672 2.789 1.00 . A A . 20 GLY CA 1 1 12 5104 1 1 20 GLY H H 9.149 1.167 1.564 1.00 . A A . 20 GLY H 1 1 12 5105 1 1 20 GLY HA2 H 11.562 2.480 2.732 1.00 . A A . 20 GLY HA2 1 1 12 5106 1 1 20 GLY HA3 H 10.244 1.790 3.677 1.00 . A A . 20 GLY HA3 1 1 12 5107 1 1 20 GLY N N 9.964 1.707 1.585 1.00 . A A . 20 GLY N 1 1 12 5108 1 1 20 GLY O O 12.742 0.282 3.255 1.00 . A A . 20 GLY O 1 1 12 5109 1 1 21 VAL C C 12.522 -2.317 1.335 1.00 . A A . 21 VAL C 1 1 12 5110 1 1 21 VAL CA C 11.626 -2.092 2.560 1.00 . A A . 21 VAL CA 1 1 12 5111 1 1 21 VAL CB C 10.484 -3.118 2.593 1.00 . A A . 21 VAL CB 1 1 12 5112 1 1 21 VAL CG1 C 11.049 -4.533 2.434 1.00 . A A . 21 VAL CG1 1 1 12 5113 1 1 21 VAL CG2 C 9.744 -3.019 3.931 1.00 . A A . 21 VAL CG2 1 1 12 5114 1 1 21 VAL H H 10.017 -0.692 2.190 1.00 . A A . 21 VAL H 1 1 12 5115 1 1 21 VAL HA H 12.207 -2.169 3.459 1.00 . A A . 21 VAL HA 1 1 12 5116 1 1 21 VAL HB H 9.796 -2.914 1.784 1.00 . A A . 21 VAL HB 1 1 12 5117 1 1 21 VAL HG11 H 11.365 -4.682 1.412 1.00 . A A . 21 VAL HG11 1 1 12 5118 1 1 21 VAL HG12 H 10.286 -5.255 2.683 1.00 . A A . 21 VAL HG12 1 1 12 5119 1 1 21 VAL HG13 H 11.894 -4.660 3.095 1.00 . A A . 21 VAL HG13 1 1 12 5120 1 1 21 VAL HG21 H 10.195 -3.695 4.643 1.00 . A A . 21 VAL HG21 1 1 12 5121 1 1 21 VAL HG22 H 8.707 -3.286 3.789 1.00 . A A . 21 VAL HG22 1 1 12 5122 1 1 21 VAL HG23 H 9.807 -2.009 4.305 1.00 . A A . 21 VAL HG23 1 1 12 5123 1 1 21 VAL N N 10.950 -0.754 2.497 1.00 . A A . 21 VAL N 1 1 12 5124 1 1 21 VAL O O 13.633 -2.798 1.451 1.00 . A A . 21 VAL O 1 1 12 5125 1 1 22 PHE C C 14.061 -1.215 -1.110 1.00 . A A . 22 PHE C 1 1 12 5126 1 1 22 PHE CA C 12.865 -2.180 -1.074 1.00 . A A . 22 PHE CA 1 1 12 5127 1 1 22 PHE CB C 11.911 -1.895 -2.238 1.00 . A A . 22 PHE CB 1 1 12 5128 1 1 22 PHE CD1 C 12.291 -3.854 -3.781 1.00 . A A . 22 PHE CD1 1 1 12 5129 1 1 22 PHE CD2 C 13.154 -1.679 -4.420 1.00 . A A . 22 PHE CD2 1 1 12 5130 1 1 22 PHE CE1 C 12.805 -4.404 -4.961 1.00 . A A . 22 PHE CE1 1 1 12 5131 1 1 22 PHE CE2 C 13.668 -2.230 -5.599 1.00 . A A . 22 PHE CE2 1 1 12 5132 1 1 22 PHE CG C 12.466 -2.491 -3.510 1.00 . A A . 22 PHE CG 1 1 12 5133 1 1 22 PHE CZ C 13.494 -3.592 -5.870 1.00 . A A . 22 PHE CZ 1 1 12 5134 1 1 22 PHE H H 11.146 -1.597 0.102 1.00 . A A . 22 PHE H 1 1 12 5135 1 1 22 PHE HA H 13.210 -3.196 -1.127 1.00 . A A . 22 PHE HA 1 1 12 5136 1 1 22 PHE HB2 H 10.946 -2.331 -2.027 1.00 . A A . 22 PHE HB2 1 1 12 5137 1 1 22 PHE HB3 H 11.803 -0.828 -2.361 1.00 . A A . 22 PHE HB3 1 1 12 5138 1 1 22 PHE HD1 H 11.761 -4.481 -3.080 1.00 . A A . 22 PHE HD1 1 1 12 5139 1 1 22 PHE HD2 H 13.289 -0.628 -4.211 1.00 . A A . 22 PHE HD2 1 1 12 5140 1 1 22 PHE HE1 H 12.671 -5.455 -5.170 1.00 . A A . 22 PHE HE1 1 1 12 5141 1 1 22 PHE HE2 H 14.200 -1.604 -6.301 1.00 . A A . 22 PHE HE2 1 1 12 5142 1 1 22 PHE HZ H 13.890 -4.018 -6.781 1.00 . A A . 22 PHE HZ 1 1 12 5143 1 1 22 PHE N N 12.045 -1.980 0.166 1.00 . A A . 22 PHE N 1 1 12 5144 1 1 22 PHE O O 15.000 -1.418 -1.855 1.00 . A A . 22 PHE O 1 1 12 5145 1 1 23 PHE C C 15.891 0.761 1.044 1.00 . A A . 23 PHE C 1 1 12 5146 1 1 23 PHE CA C 15.171 0.798 -0.312 1.00 . A A . 23 PHE CA 1 1 12 5147 1 1 23 PHE CB C 14.526 2.166 -0.552 1.00 . A A . 23 PHE CB 1 1 12 5148 1 1 23 PHE CD1 C 14.702 2.542 -3.041 1.00 . A A . 23 PHE CD1 1 1 12 5149 1 1 23 PHE CD2 C 12.558 1.902 -2.109 1.00 . A A . 23 PHE CD2 1 1 12 5150 1 1 23 PHE CE1 C 14.136 2.575 -4.321 1.00 . A A . 23 PHE CE1 1 1 12 5151 1 1 23 PHE CE2 C 11.991 1.935 -3.388 1.00 . A A . 23 PHE CE2 1 1 12 5152 1 1 23 PHE CG C 13.914 2.205 -1.934 1.00 . A A . 23 PHE CG 1 1 12 5153 1 1 23 PHE CZ C 12.779 2.273 -4.494 1.00 . A A . 23 PHE CZ 1 1 12 5154 1 1 23 PHE H H 13.269 -0.030 0.273 1.00 . A A . 23 PHE H 1 1 12 5155 1 1 23 PHE HA H 15.863 0.573 -1.109 1.00 . A A . 23 PHE HA 1 1 12 5156 1 1 23 PHE HB2 H 13.756 2.336 0.188 1.00 . A A . 23 PHE HB2 1 1 12 5157 1 1 23 PHE HB3 H 15.278 2.935 -0.470 1.00 . A A . 23 PHE HB3 1 1 12 5158 1 1 23 PHE HD1 H 15.749 2.776 -2.909 1.00 . A A . 23 PHE HD1 1 1 12 5159 1 1 23 PHE HD2 H 11.949 1.641 -1.256 1.00 . A A . 23 PHE HD2 1 1 12 5160 1 1 23 PHE HE1 H 14.743 2.835 -5.175 1.00 . A A . 23 PHE HE1 1 1 12 5161 1 1 23 PHE HE2 H 10.945 1.701 -3.521 1.00 . A A . 23 PHE HE2 1 1 12 5162 1 1 23 PHE HZ H 12.342 2.299 -5.481 1.00 . A A . 23 PHE HZ 1 1 12 5163 1 1 23 PHE N N 14.035 -0.174 -0.318 1.00 . A A . 23 PHE N 1 1 12 5164 1 1 23 PHE O O 16.144 1.783 1.655 1.00 . A A . 23 PHE O 1 1 12 5165 1 1 24 TYR C C 17.629 -1.902 2.923 1.00 . A A . 24 TYR C 1 1 12 5166 1 1 24 TYR CA C 16.923 -0.542 2.829 1.00 . A A . 24 TYR CA 1 1 12 5167 1 1 24 TYR CB C 15.813 -0.429 3.877 1.00 . A A . 24 TYR CB 1 1 12 5168 1 1 24 TYR CD1 C 16.052 1.851 4.926 1.00 . A A . 24 TYR CD1 1 1 12 5169 1 1 24 TYR CD2 C 16.897 -0.079 6.126 1.00 . A A . 24 TYR CD2 1 1 12 5170 1 1 24 TYR CE1 C 16.470 2.684 5.970 1.00 . A A . 24 TYR CE1 1 1 12 5171 1 1 24 TYR CE2 C 17.316 0.754 7.169 1.00 . A A . 24 TYR CE2 1 1 12 5172 1 1 24 TYR CG C 16.265 0.470 5.003 1.00 . A A . 24 TYR CG 1 1 12 5173 1 1 24 TYR CZ C 17.102 2.135 7.092 1.00 . A A . 24 TYR CZ 1 1 12 5174 1 1 24 TYR H H 16.006 -1.223 1.000 1.00 . A A . 24 TYR H 1 1 12 5175 1 1 24 TYR HA H 17.634 0.260 2.955 1.00 . A A . 24 TYR HA 1 1 12 5176 1 1 24 TYR HB2 H 14.932 -0.012 3.417 1.00 . A A . 24 TYR HB2 1 1 12 5177 1 1 24 TYR HB3 H 15.584 -1.409 4.269 1.00 . A A . 24 TYR HB3 1 1 12 5178 1 1 24 TYR HD1 H 15.564 2.275 4.061 1.00 . A A . 24 TYR HD1 1 1 12 5179 1 1 24 TYR HD2 H 17.062 -1.145 6.185 1.00 . A A . 24 TYR HD2 1 1 12 5180 1 1 24 TYR HE1 H 16.305 3.749 5.910 1.00 . A A . 24 TYR HE1 1 1 12 5181 1 1 24 TYR HE2 H 17.803 0.331 8.035 1.00 . A A . 24 TYR HE2 1 1 12 5182 1 1 24 TYR HH H 18.414 3.235 7.936 1.00 . A A . 24 TYR HH 1 1 12 5183 1 1 24 TYR N N 16.222 -0.418 1.515 1.00 . A A . 24 TYR N 1 1 12 5184 1 1 24 TYR O O 17.373 -2.690 3.816 1.00 . A A . 24 TYR O 1 1 12 5185 1 1 24 TYR OH O 17.514 2.955 8.121 1.00 . A A . 24 TYR OH 1 1 12 5186 1 1 25 LYS C C 20.648 -3.339 1.426 1.00 . A A . 25 LYS C 1 1 12 5187 1 1 25 LYS CA C 19.240 -3.490 2.019 1.00 . A A . 25 LYS CA 1 1 12 5188 1 1 25 LYS CB C 18.391 -4.425 1.153 1.00 . A A . 25 LYS CB 1 1 12 5189 1 1 25 LYS CD C 18.502 -6.811 0.403 1.00 . A A . 25 LYS CD 1 1 12 5190 1 1 25 LYS CE C 17.038 -6.947 -0.031 1.00 . A A . 25 LYS CE 1 1 12 5191 1 1 25 LYS CG C 18.595 -5.873 1.610 1.00 . A A . 25 LYS CG 1 1 12 5192 1 1 25 LYS H H 18.698 -1.531 1.291 1.00 . A A . 25 LYS H 1 1 12 5193 1 1 25 LYS HA H 19.297 -3.873 3.025 1.00 . A A . 25 LYS HA 1 1 12 5194 1 1 25 LYS HB2 H 17.348 -4.160 1.253 1.00 . A A . 25 LYS HB2 1 1 12 5195 1 1 25 LYS HB3 H 18.690 -4.330 0.121 1.00 . A A . 25 LYS HB3 1 1 12 5196 1 1 25 LYS HD2 H 19.086 -6.409 -0.411 1.00 . A A . 25 LYS HD2 1 1 12 5197 1 1 25 LYS HD3 H 18.886 -7.784 0.675 1.00 . A A . 25 LYS HD3 1 1 12 5198 1 1 25 LYS HE2 H 16.530 -7.673 0.589 1.00 . A A . 25 LYS HE2 1 1 12 5199 1 1 25 LYS HE3 H 16.540 -5.991 0.023 1.00 . A A . 25 LYS HE3 1 1 12 5200 1 1 25 LYS HG2 H 19.570 -5.972 2.067 1.00 . A A . 25 LYS HG2 1 1 12 5201 1 1 25 LYS HG3 H 17.833 -6.135 2.328 1.00 . A A . 25 LYS HG3 1 1 12 5202 1 1 25 LYS HZ1 H 17.455 -8.389 -1.478 1.00 . A A . 25 LYS HZ1 1 1 12 5203 1 1 25 LYS HZ2 H 17.718 -6.791 -1.996 1.00 . A A . 25 LYS HZ2 1 1 12 5204 1 1 25 LYS HZ3 H 16.135 -7.392 -1.854 1.00 . A A . 25 LYS HZ3 1 1 12 5205 1 1 25 LYS N N 18.513 -2.182 1.999 1.00 . A A . 25 LYS N 1 1 12 5206 1 1 25 LYS NZ N 17.091 -7.416 -1.446 1.00 . A A . 25 LYS NZ 1 1 12 5207 1 1 25 LYS O O 21.533 -4.048 1.874 1.00 . A A . 25 LYS O 1 1 12 5208 1 1 25 LYS OXT O 20.818 -2.522 0.534 1.00 . A A . 25 LYS OXT 1 1 13 5209 1 1 1 HIS C C -18.042 1.473 2.370 1.00 . A A . 1 HIS C 1 1 13 5210 1 1 1 HIS CA C -19.411 2.131 2.137 1.00 . A A . 1 HIS CA 1 1 13 5211 1 1 1 HIS CB C -20.319 1.225 1.285 1.00 . A A . 1 HIS CB 1 1 13 5212 1 1 1 HIS CD2 C -18.720 0.748 -0.754 1.00 . A A . 1 HIS CD2 1 1 13 5213 1 1 1 HIS CE1 C -19.966 1.556 -2.328 1.00 . A A . 1 HIS CE1 1 1 13 5214 1 1 1 HIS CG C -19.864 1.210 -0.154 1.00 . A A . 1 HIS CG 1 1 13 5215 1 1 1 HIS HA H -19.887 2.331 3.084 1.00 . A A . 1 HIS HA 1 1 13 5216 1 1 1 HIS HB2 H -20.288 0.220 1.676 1.00 . A A . 1 HIS HB2 1 1 13 5217 1 1 1 HIS HB3 H -21.334 1.592 1.334 1.00 . A A . 1 HIS HB3 1 1 13 5218 1 1 1 HIS HD1 H -21.532 2.128 -1.083 1.00 . A A . 1 HIS HD1 1 1 13 5219 1 1 1 HIS HD2 H -17.893 0.287 -0.239 1.00 . A A . 1 HIS HD2 1 1 13 5220 1 1 1 HIS HE1 H -20.334 1.859 -3.298 1.00 . A A . 1 HIS HE1 1 1 13 5221 1 1 1 HIS N N -19.255 3.406 1.367 1.00 . A A . 1 HIS N 1 1 13 5222 1 1 1 HIS ND1 N -20.646 1.722 -1.179 1.00 . A A . 1 HIS ND1 1 1 13 5223 1 1 1 HIS NE2 N -18.786 0.968 -2.125 1.00 . A A . 1 HIS NE2 1 1 13 5224 1 1 1 HIS O O -17.014 2.023 2.022 1.00 . A A . 1 HIS O 1 1 13 5225 1 1 2 ALA C C -16.314 -1.248 2.023 1.00 . A A . 2 ALA C 1 1 13 5226 1 1 2 ALA CA C -16.728 -0.393 3.233 1.00 . A A . 2 ALA CA 1 1 13 5227 1 1 2 ALA CB C -17.005 -1.274 4.455 1.00 . A A . 2 ALA CB 1 1 13 5228 1 1 2 ALA H H -18.869 -0.115 3.239 1.00 . A A . 2 ALA H 1 1 13 5229 1 1 2 ALA HA H -15.957 0.325 3.465 1.00 . A A . 2 ALA HA 1 1 13 5230 1 1 2 ALA HB1 H -17.616 -0.730 5.160 1.00 . A A . 2 ALA HB1 1 1 13 5231 1 1 2 ALA HB2 H -16.071 -1.545 4.924 1.00 . A A . 2 ALA HB2 1 1 13 5232 1 1 2 ALA HB3 H -17.524 -2.169 4.145 1.00 . A A . 2 ALA HB3 1 1 13 5233 1 1 2 ALA N N -18.025 0.303 2.964 1.00 . A A . 2 ALA N 1 1 13 5234 1 1 2 ALA O O -16.713 -0.982 0.907 1.00 . A A . 2 ALA O 1 1 13 5235 1 1 3 TRP C C -14.095 -2.432 0.192 1.00 . A A . 3 TRP C 1 1 13 5236 1 1 3 TRP CA C -15.053 -3.178 1.134 1.00 . A A . 3 TRP CA 1 1 13 5237 1 1 3 TRP CB C -16.318 -3.643 0.385 1.00 . A A . 3 TRP CB 1 1 13 5238 1 1 3 TRP CD1 C -17.228 -5.041 2.292 1.00 . A A . 3 TRP CD1 1 1 13 5239 1 1 3 TRP CD2 C -18.719 -3.536 1.535 1.00 . A A . 3 TRP CD2 1 1 13 5240 1 1 3 TRP CE2 C -19.350 -4.237 2.590 1.00 . A A . 3 TRP CE2 1 1 13 5241 1 1 3 TRP CE3 C -19.448 -2.525 0.883 1.00 . A A . 3 TRP CE3 1 1 13 5242 1 1 3 TRP CG C -17.372 -4.065 1.366 1.00 . A A . 3 TRP CG 1 1 13 5243 1 1 3 TRP CH2 C -21.365 -2.939 2.324 1.00 . A A . 3 TRP CH2 1 1 13 5244 1 1 3 TRP CZ2 C -20.655 -3.946 2.983 1.00 . A A . 3 TRP CZ2 1 1 13 5245 1 1 3 TRP CZ3 C -20.764 -2.229 1.276 1.00 . A A . 3 TRP CZ3 1 1 13 5246 1 1 3 TRP H H -15.215 -2.457 3.162 1.00 . A A . 3 TRP H 1 1 13 5247 1 1 3 TRP HA H -14.550 -4.038 1.552 1.00 . A A . 3 TRP HA 1 1 13 5248 1 1 3 TRP HB2 H -16.697 -2.834 -0.220 1.00 . A A . 3 TRP HB2 1 1 13 5249 1 1 3 TRP HB3 H -16.069 -4.478 -0.252 1.00 . A A . 3 TRP HB3 1 1 13 5250 1 1 3 TRP HD1 H -16.343 -5.641 2.440 1.00 . A A . 3 TRP HD1 1 1 13 5251 1 1 3 TRP HE1 H -18.559 -5.774 3.752 1.00 . A A . 3 TRP HE1 1 1 13 5252 1 1 3 TRP HE3 H -18.993 -1.972 0.073 1.00 . A A . 3 TRP HE3 1 1 13 5253 1 1 3 TRP HH2 H -22.378 -2.707 2.623 1.00 . A A . 3 TRP HH2 1 1 13 5254 1 1 3 TRP HZ2 H -21.115 -4.494 3.791 1.00 . A A . 3 TRP HZ2 1 1 13 5255 1 1 3 TRP HZ3 H -21.315 -1.452 0.768 1.00 . A A . 3 TRP HZ3 1 1 13 5256 1 1 3 TRP N N -15.516 -2.275 2.248 1.00 . A A . 3 TRP N 1 1 13 5257 1 1 3 TRP NE1 N -18.400 -5.143 3.019 1.00 . A A . 3 TRP NE1 1 1 13 5258 1 1 3 TRP O O -12.915 -2.728 0.144 1.00 . A A . 3 TRP O 1 1 13 5259 1 1 4 TYR C C -12.750 0.216 -0.678 1.00 . A A . 4 TYR C 1 1 13 5260 1 1 4 TYR CA C -13.684 -0.709 -1.479 1.00 . A A . 4 TYR CA 1 1 13 5261 1 1 4 TYR CB C -14.630 0.078 -2.412 1.00 . A A . 4 TYR CB 1 1 13 5262 1 1 4 TYR CD1 C -15.562 1.900 -0.925 1.00 . A A . 4 TYR CD1 1 1 13 5263 1 1 4 TYR CD2 C -14.012 2.511 -2.687 1.00 . A A . 4 TYR CD2 1 1 13 5264 1 1 4 TYR CE1 C -15.661 3.244 -0.548 1.00 . A A . 4 TYR CE1 1 1 13 5265 1 1 4 TYR CE2 C -14.111 3.855 -2.310 1.00 . A A . 4 TYR CE2 1 1 13 5266 1 1 4 TYR CG C -14.736 1.531 -1.995 1.00 . A A . 4 TYR CG 1 1 13 5267 1 1 4 TYR CZ C -14.936 4.221 -1.240 1.00 . A A . 4 TYR CZ 1 1 13 5268 1 1 4 TYR H H -15.535 -1.238 -0.494 1.00 . A A . 4 TYR H 1 1 13 5269 1 1 4 TYR HA H -13.097 -1.399 -2.058 1.00 . A A . 4 TYR HA 1 1 13 5270 1 1 4 TYR HB2 H -14.249 0.029 -3.421 1.00 . A A . 4 TYR HB2 1 1 13 5271 1 1 4 TYR HB3 H -15.612 -0.372 -2.384 1.00 . A A . 4 TYR HB3 1 1 13 5272 1 1 4 TYR HD1 H -16.121 1.146 -0.391 1.00 . A A . 4 TYR HD1 1 1 13 5273 1 1 4 TYR HD2 H -13.375 2.228 -3.513 1.00 . A A . 4 TYR HD2 1 1 13 5274 1 1 4 TYR HE1 H -16.297 3.528 0.278 1.00 . A A . 4 TYR HE1 1 1 13 5275 1 1 4 TYR HE2 H -13.552 4.609 -2.844 1.00 . A A . 4 TYR HE2 1 1 13 5276 1 1 4 TYR HH H -14.237 5.778 -0.383 1.00 . A A . 4 TYR HH 1 1 13 5277 1 1 4 TYR N N -14.582 -1.466 -0.552 1.00 . A A . 4 TYR N 1 1 13 5278 1 1 4 TYR O O -11.672 0.559 -1.126 1.00 . A A . 4 TYR O 1 1 13 5279 1 1 4 TYR OH O -15.034 5.546 -0.868 1.00 . A A . 4 TYR OH 1 1 13 5280 1 1 5 SER C C -11.108 0.701 1.931 1.00 . A A . 5 SER C 1 1 13 5281 1 1 5 SER CA C -12.292 1.490 1.353 1.00 . A A . 5 SER CA 1 1 13 5282 1 1 5 SER CB C -13.207 1.987 2.475 1.00 . A A . 5 SER CB 1 1 13 5283 1 1 5 SER H H -14.019 0.300 0.847 1.00 . A A . 5 SER H 1 1 13 5284 1 1 5 SER HA H -11.935 2.323 0.773 1.00 . A A . 5 SER HA 1 1 13 5285 1 1 5 SER HB2 H -12.653 2.635 3.134 1.00 . A A . 5 SER HB2 1 1 13 5286 1 1 5 SER HB3 H -14.034 2.537 2.045 1.00 . A A . 5 SER HB3 1 1 13 5287 1 1 5 SER HG H -13.126 0.748 3.979 1.00 . A A . 5 SER HG 1 1 13 5288 1 1 5 SER N N -13.152 0.602 0.508 1.00 . A A . 5 SER N 1 1 13 5289 1 1 5 SER O O -10.085 1.266 2.274 1.00 . A A . 5 SER O 1 1 13 5290 1 1 5 SER OG O -13.698 0.874 3.218 1.00 . A A . 5 SER OG 1 1 13 5291 1 1 6 HIS C C -9.218 -1.919 1.467 1.00 . A A . 6 HIS C 1 1 13 5292 1 1 6 HIS CA C -10.126 -1.424 2.594 1.00 . A A . 6 HIS CA 1 1 13 5293 1 1 6 HIS CB C -10.805 -2.602 3.298 1.00 . A A . 6 HIS CB 1 1 13 5294 1 1 6 HIS CD2 C -12.389 -1.907 5.277 1.00 . A A . 6 HIS CD2 1 1 13 5295 1 1 6 HIS CE1 C -10.888 -1.692 6.824 1.00 . A A . 6 HIS CE1 1 1 13 5296 1 1 6 HIS CG C -11.179 -2.201 4.700 1.00 . A A . 6 HIS CG 1 1 13 5297 1 1 6 HIS H H -12.073 -1.025 1.757 1.00 . A A . 6 HIS H 1 1 13 5298 1 1 6 HIS HA H -9.554 -0.852 3.302 1.00 . A A . 6 HIS HA 1 1 13 5299 1 1 6 HIS HB2 H -11.695 -2.882 2.754 1.00 . A A . 6 HIS HB2 1 1 13 5300 1 1 6 HIS HB3 H -10.126 -3.440 3.334 1.00 . A A . 6 HIS HB3 1 1 13 5301 1 1 6 HIS HD1 H -9.269 -2.196 5.617 1.00 . A A . 6 HIS HD1 1 1 13 5302 1 1 6 HIS HD2 H -13.341 -1.925 4.767 1.00 . A A . 6 HIS HD2 1 1 13 5303 1 1 6 HIS HE1 H -10.407 -1.508 7.773 1.00 . A A . 6 HIS HE1 1 1 13 5304 1 1 6 HIS N N -11.240 -0.597 2.041 1.00 . A A . 6 HIS N 1 1 13 5305 1 1 6 HIS ND1 N -10.235 -2.058 5.705 1.00 . A A . 6 HIS ND1 1 1 13 5306 1 1 6 HIS NE2 N -12.204 -1.587 6.618 1.00 . A A . 6 HIS NE2 1 1 13 5307 1 1 6 HIS O O -8.019 -2.034 1.637 1.00 . A A . 6 HIS O 1 1 13 5308 1 1 7 TYR C C -7.960 -1.577 -1.246 1.00 . A A . 7 TYR C 1 1 13 5309 1 1 7 TYR CA C -8.933 -2.680 -0.825 1.00 . A A . 7 TYR CA 1 1 13 5310 1 1 7 TYR CB C -9.915 -3.007 -1.955 1.00 . A A . 7 TYR CB 1 1 13 5311 1 1 7 TYR CD1 C -9.055 -5.248 -2.730 1.00 . A A . 7 TYR CD1 1 1 13 5312 1 1 7 TYR CD2 C -11.177 -5.156 -1.560 1.00 . A A . 7 TYR CD2 1 1 13 5313 1 1 7 TYR CE1 C -9.181 -6.636 -2.850 1.00 . A A . 7 TYR CE1 1 1 13 5314 1 1 7 TYR CE2 C -11.303 -6.545 -1.680 1.00 . A A . 7 TYR CE2 1 1 13 5315 1 1 7 TYR CG C -10.052 -4.507 -2.085 1.00 . A A . 7 TYR CG 1 1 13 5316 1 1 7 TYR CZ C -10.305 -7.285 -2.325 1.00 . A A . 7 TYR CZ 1 1 13 5317 1 1 7 TYR H H -10.742 -2.095 0.206 1.00 . A A . 7 TYR H 1 1 13 5318 1 1 7 TYR HA H -8.388 -3.561 -0.540 1.00 . A A . 7 TYR HA 1 1 13 5319 1 1 7 TYR HB2 H -10.880 -2.575 -1.733 1.00 . A A . 7 TYR HB2 1 1 13 5320 1 1 7 TYR HB3 H -9.544 -2.599 -2.883 1.00 . A A . 7 TYR HB3 1 1 13 5321 1 1 7 TYR HD1 H -8.188 -4.747 -3.134 1.00 . A A . 7 TYR HD1 1 1 13 5322 1 1 7 TYR HD2 H -11.947 -4.585 -1.063 1.00 . A A . 7 TYR HD2 1 1 13 5323 1 1 7 TYR HE1 H -8.412 -7.207 -3.348 1.00 . A A . 7 TYR HE1 1 1 13 5324 1 1 7 TYR HE2 H -12.170 -7.045 -1.274 1.00 . A A . 7 TYR HE2 1 1 13 5325 1 1 7 TYR HH H -10.155 -9.051 -1.615 1.00 . A A . 7 TYR HH 1 1 13 5326 1 1 7 TYR N N -9.775 -2.203 0.317 1.00 . A A . 7 TYR N 1 1 13 5327 1 1 7 TYR O O -6.790 -1.824 -1.471 1.00 . A A . 7 TYR O 1 1 13 5328 1 1 7 TYR OH O -10.430 -8.654 -2.446 1.00 . A A . 7 TYR OH 1 1 13 5329 1 1 8 VAL C C -6.455 0.956 -0.624 1.00 . A A . 8 VAL C 1 1 13 5330 1 1 8 VAL CA C -7.528 0.771 -1.709 1.00 . A A . 8 VAL CA 1 1 13 5331 1 1 8 VAL CB C -8.437 2.007 -1.825 1.00 . A A . 8 VAL CB 1 1 13 5332 1 1 8 VAL CG1 C -8.932 2.441 -0.441 1.00 . A A . 8 VAL CG1 1 1 13 5333 1 1 8 VAL CG2 C -7.655 3.157 -2.466 1.00 . A A . 8 VAL CG2 1 1 13 5334 1 1 8 VAL H H -9.374 -0.190 -1.125 1.00 . A A . 8 VAL H 1 1 13 5335 1 1 8 VAL HA H -7.062 0.567 -2.657 1.00 . A A . 8 VAL HA 1 1 13 5336 1 1 8 VAL HB H -9.289 1.765 -2.446 1.00 . A A . 8 VAL HB 1 1 13 5337 1 1 8 VAL HG11 H -9.327 1.585 0.085 1.00 . A A . 8 VAL HG11 1 1 13 5338 1 1 8 VAL HG12 H -9.707 3.185 -0.553 1.00 . A A . 8 VAL HG12 1 1 13 5339 1 1 8 VAL HG13 H -8.110 2.861 0.120 1.00 . A A . 8 VAL HG13 1 1 13 5340 1 1 8 VAL HG21 H -7.218 2.821 -3.395 1.00 . A A . 8 VAL HG21 1 1 13 5341 1 1 8 VAL HG22 H -6.872 3.478 -1.795 1.00 . A A . 8 VAL HG22 1 1 13 5342 1 1 8 VAL HG23 H -8.323 3.983 -2.662 1.00 . A A . 8 VAL HG23 1 1 13 5343 1 1 8 VAL N N -8.432 -0.360 -1.330 1.00 . A A . 8 VAL N 1 1 13 5344 1 1 8 VAL O O -5.344 1.368 -0.901 1.00 . A A . 8 VAL O 1 1 13 5345 1 1 9 LEU C C -4.727 -0.354 1.573 1.00 . A A . 9 LEU C 1 1 13 5346 1 1 9 LEU CA C -5.787 0.747 1.709 1.00 . A A . 9 LEU CA 1 1 13 5347 1 1 9 LEU CB C -6.594 0.562 2.998 1.00 . A A . 9 LEU CB 1 1 13 5348 1 1 9 LEU CD1 C -6.172 2.736 4.158 1.00 . A A . 9 LEU CD1 1 1 13 5349 1 1 9 LEU CD2 C -6.336 0.624 5.483 1.00 . A A . 9 LEU CD2 1 1 13 5350 1 1 9 LEU CG C -5.865 1.237 4.161 1.00 . A A . 9 LEU CG 1 1 13 5351 1 1 9 LEU H H -7.677 0.275 0.789 1.00 . A A . 9 LEU H 1 1 13 5352 1 1 9 LEU HA H -5.324 1.721 1.696 1.00 . A A . 9 LEU HA 1 1 13 5353 1 1 9 LEU HB2 H -7.572 1.007 2.878 1.00 . A A . 9 LEU HB2 1 1 13 5354 1 1 9 LEU HB3 H -6.702 -0.492 3.207 1.00 . A A . 9 LEU HB3 1 1 13 5355 1 1 9 LEU HD11 H -5.728 3.196 5.028 1.00 . A A . 9 LEU HD11 1 1 13 5356 1 1 9 LEU HD12 H -7.241 2.885 4.178 1.00 . A A . 9 LEU HD12 1 1 13 5357 1 1 9 LEU HD13 H -5.763 3.185 3.264 1.00 . A A . 9 LEU HD13 1 1 13 5358 1 1 9 LEU HD21 H -5.841 1.118 6.305 1.00 . A A . 9 LEU HD21 1 1 13 5359 1 1 9 LEU HD22 H -6.092 -0.429 5.498 1.00 . A A . 9 LEU HD22 1 1 13 5360 1 1 9 LEU HD23 H -7.405 0.748 5.577 1.00 . A A . 9 LEU HD23 1 1 13 5361 1 1 9 LEU HG H -4.800 1.088 4.053 1.00 . A A . 9 LEU HG 1 1 13 5362 1 1 9 LEU N N -6.781 0.623 0.603 1.00 . A A . 9 LEU N 1 1 13 5363 1 1 9 LEU O O -3.560 -0.135 1.836 1.00 . A A . 9 LEU O 1 1 13 5364 1 1 10 LYS C C -3.088 -2.264 -0.058 1.00 . A A . 10 LYS C 1 1 13 5365 1 1 10 LYS CA C -4.148 -2.652 0.983 1.00 . A A . 10 LYS CA 1 1 13 5366 1 1 10 LYS CB C -4.978 -3.845 0.495 1.00 . A A . 10 LYS CB 1 1 13 5367 1 1 10 LYS CD C -5.178 -6.311 0.875 1.00 . A A . 10 LYS CD 1 1 13 5368 1 1 10 LYS CE C -4.576 -7.364 1.813 1.00 . A A . 10 LYS CE 1 1 13 5369 1 1 10 LYS CG C -4.197 -5.143 0.722 1.00 . A A . 10 LYS CG 1 1 13 5370 1 1 10 LYS H H -6.078 -1.681 0.940 1.00 . A A . 10 LYS H 1 1 13 5371 1 1 10 LYS HA H -3.680 -2.888 1.926 1.00 . A A . 10 LYS HA 1 1 13 5372 1 1 10 LYS HB2 H -5.908 -3.882 1.043 1.00 . A A . 10 LYS HB2 1 1 13 5373 1 1 10 LYS HB3 H -5.185 -3.732 -0.559 1.00 . A A . 10 LYS HB3 1 1 13 5374 1 1 10 LYS HD2 H -6.108 -5.948 1.289 1.00 . A A . 10 LYS HD2 1 1 13 5375 1 1 10 LYS HD3 H -5.361 -6.755 -0.092 1.00 . A A . 10 LYS HD3 1 1 13 5376 1 1 10 LYS HE2 H -3.563 -7.598 1.511 1.00 . A A . 10 LYS HE2 1 1 13 5377 1 1 10 LYS HE3 H -4.594 -7.012 2.833 1.00 . A A . 10 LYS HE3 1 1 13 5378 1 1 10 LYS HG2 H -3.549 -5.324 -0.122 1.00 . A A . 10 LYS HG2 1 1 13 5379 1 1 10 LYS HG3 H -3.604 -5.055 1.621 1.00 . A A . 10 LYS HG3 1 1 13 5380 1 1 10 LYS HZ1 H -5.152 -9.292 2.346 1.00 . A A . 10 LYS HZ1 1 1 13 5381 1 1 10 LYS HZ2 H -5.377 -8.935 0.701 1.00 . A A . 10 LYS HZ2 1 1 13 5382 1 1 10 LYS HZ3 H -6.440 -8.299 1.866 1.00 . A A . 10 LYS HZ3 1 1 13 5383 1 1 10 LYS N N -5.129 -1.535 1.153 1.00 . A A . 10 LYS N 1 1 13 5384 1 1 10 LYS NZ N -5.452 -8.563 1.670 1.00 . A A . 10 LYS NZ 1 1 13 5385 1 1 10 LYS O O -1.906 -2.458 0.151 1.00 . A A . 10 LYS O 1 1 13 5386 1 1 11 PHE C C -1.597 -0.197 -1.658 1.00 . A A . 11 PHE C 1 1 13 5387 1 1 11 PHE CA C -2.522 -1.286 -2.217 1.00 . A A . 11 PHE CA 1 1 13 5388 1 1 11 PHE CB C -3.368 -0.738 -3.374 1.00 . A A . 11 PHE CB 1 1 13 5389 1 1 11 PHE CD1 C -2.040 -1.166 -5.475 1.00 . A A . 11 PHE CD1 1 1 13 5390 1 1 11 PHE CD2 C -2.036 1.068 -4.530 1.00 . A A . 11 PHE CD2 1 1 13 5391 1 1 11 PHE CE1 C -1.196 -0.731 -6.505 1.00 . A A . 11 PHE CE1 1 1 13 5392 1 1 11 PHE CE2 C -1.193 1.502 -5.559 1.00 . A A . 11 PHE CE2 1 1 13 5393 1 1 11 PHE CG C -2.460 -0.268 -4.488 1.00 . A A . 11 PHE CG 1 1 13 5394 1 1 11 PHE CZ C -0.773 0.603 -6.547 1.00 . A A . 11 PHE CZ 1 1 13 5395 1 1 11 PHE H H -4.465 -1.547 -1.309 1.00 . A A . 11 PHE H 1 1 13 5396 1 1 11 PHE HA H -1.944 -2.135 -2.551 1.00 . A A . 11 PHE HA 1 1 13 5397 1 1 11 PHE HB2 H -4.019 -1.517 -3.744 1.00 . A A . 11 PHE HB2 1 1 13 5398 1 1 11 PHE HB3 H -3.964 0.093 -3.022 1.00 . A A . 11 PHE HB3 1 1 13 5399 1 1 11 PHE HD1 H -2.365 -2.195 -5.444 1.00 . A A . 11 PHE HD1 1 1 13 5400 1 1 11 PHE HD2 H -2.361 1.761 -3.769 1.00 . A A . 11 PHE HD2 1 1 13 5401 1 1 11 PHE HE1 H -0.871 -1.425 -7.266 1.00 . A A . 11 PHE HE1 1 1 13 5402 1 1 11 PHE HE2 H -0.867 2.531 -5.592 1.00 . A A . 11 PHE HE2 1 1 13 5403 1 1 11 PHE HZ H -0.122 0.938 -7.340 1.00 . A A . 11 PHE HZ 1 1 13 5404 1 1 11 PHE N N -3.506 -1.703 -1.169 1.00 . A A . 11 PHE N 1 1 13 5405 1 1 11 PHE O O -0.396 -0.241 -1.842 1.00 . A A . 11 PHE O 1 1 13 5406 1 1 12 PHE C C -0.275 1.274 0.573 1.00 . A A . 12 PHE C 1 1 13 5407 1 1 12 PHE CA C -1.309 1.868 -0.389 1.00 . A A . 12 PHE CA 1 1 13 5408 1 1 12 PHE CB C -2.283 2.782 0.365 1.00 . A A . 12 PHE CB 1 1 13 5409 1 1 12 PHE CD1 C -1.543 5.133 -0.169 1.00 . A A . 12 PHE CD1 1 1 13 5410 1 1 12 PHE CD2 C -3.484 4.234 -1.312 1.00 . A A . 12 PHE CD2 1 1 13 5411 1 1 12 PHE CE1 C -1.688 6.336 -0.869 1.00 . A A . 12 PHE CE1 1 1 13 5412 1 1 12 PHE CE2 C -3.629 5.437 -2.013 1.00 . A A . 12 PHE CE2 1 1 13 5413 1 1 12 PHE CG C -2.441 4.081 -0.391 1.00 . A A . 12 PHE CG 1 1 13 5414 1 1 12 PHE CZ C -2.731 6.489 -1.791 1.00 . A A . 12 PHE CZ 1 1 13 5415 1 1 12 PHE H H -3.125 0.783 -0.835 1.00 . A A . 12 PHE H 1 1 13 5416 1 1 12 PHE HA H -0.816 2.420 -1.173 1.00 . A A . 12 PHE HA 1 1 13 5417 1 1 12 PHE HB2 H -3.244 2.297 0.451 1.00 . A A . 12 PHE HB2 1 1 13 5418 1 1 12 PHE HB3 H -1.894 2.988 1.351 1.00 . A A . 12 PHE HB3 1 1 13 5419 1 1 12 PHE HD1 H -0.739 5.016 0.542 1.00 . A A . 12 PHE HD1 1 1 13 5420 1 1 12 PHE HD2 H -4.177 3.423 -1.484 1.00 . A A . 12 PHE HD2 1 1 13 5421 1 1 12 PHE HE1 H -0.996 7.147 -0.698 1.00 . A A . 12 PHE HE1 1 1 13 5422 1 1 12 PHE HE2 H -4.433 5.556 -2.723 1.00 . A A . 12 PHE HE2 1 1 13 5423 1 1 12 PHE HZ H -2.842 7.417 -2.331 1.00 . A A . 12 PHE HZ 1 1 13 5424 1 1 12 PHE N N -2.153 0.776 -0.971 1.00 . A A . 12 PHE N 1 1 13 5425 1 1 12 PHE O O 0.897 1.592 0.506 1.00 . A A . 12 PHE O 1 1 13 5426 1 1 13 LEU C C 1.368 -0.959 1.643 1.00 . A A . 13 LEU C 1 1 13 5427 1 1 13 LEU CA C 0.257 -0.234 2.416 1.00 . A A . 13 LEU CA 1 1 13 5428 1 1 13 LEU CB C -0.584 -1.231 3.220 1.00 . A A . 13 LEU CB 1 1 13 5429 1 1 13 LEU CD1 C -0.058 -0.465 5.544 1.00 . A A . 13 LEU CD1 1 1 13 5430 1 1 13 LEU CD2 C -0.428 -2.891 5.080 1.00 . A A . 13 LEU CD2 1 1 13 5431 1 1 13 LEU CG C 0.142 -1.586 4.521 1.00 . A A . 13 LEU CG 1 1 13 5432 1 1 13 LEU H H -1.652 0.154 1.478 1.00 . A A . 13 LEU H 1 1 13 5433 1 1 13 LEU HA H 0.678 0.510 3.074 1.00 . A A . 13 LEU HA 1 1 13 5434 1 1 13 LEU HB2 H -1.542 -0.789 3.450 1.00 . A A . 13 LEU HB2 1 1 13 5435 1 1 13 LEU HB3 H -0.732 -2.128 2.637 1.00 . A A . 13 LEU HB3 1 1 13 5436 1 1 13 LEU HD11 H -1.112 -0.250 5.642 1.00 . A A . 13 LEU HD11 1 1 13 5437 1 1 13 LEU HD12 H 0.461 0.422 5.212 1.00 . A A . 13 LEU HD12 1 1 13 5438 1 1 13 LEU HD13 H 0.337 -0.776 6.500 1.00 . A A . 13 LEU HD13 1 1 13 5439 1 1 13 LEU HD21 H 0.058 -3.125 6.014 1.00 . A A . 13 LEU HD21 1 1 13 5440 1 1 13 LEU HD22 H -0.257 -3.691 4.375 1.00 . A A . 13 LEU HD22 1 1 13 5441 1 1 13 LEU HD23 H -1.491 -2.779 5.246 1.00 . A A . 13 LEU HD23 1 1 13 5442 1 1 13 LEU HG H 1.196 -1.708 4.322 1.00 . A A . 13 LEU HG 1 1 13 5443 1 1 13 LEU N N -0.701 0.401 1.456 1.00 . A A . 13 LEU N 1 1 13 5444 1 1 13 LEU O O 2.523 -0.928 2.025 1.00 . A A . 13 LEU O 1 1 13 5445 1 1 14 LEU C C 3.086 -1.314 -0.798 1.00 . A A . 14 LEU C 1 1 13 5446 1 1 14 LEU CA C 2.049 -2.314 -0.271 1.00 . A A . 14 LEU CA 1 1 13 5447 1 1 14 LEU CB C 1.260 -2.949 -1.427 1.00 . A A . 14 LEU CB 1 1 13 5448 1 1 14 LEU CD1 C 3.334 -3.997 -2.377 1.00 . A A . 14 LEU CD1 1 1 13 5449 1 1 14 LEU CD2 C 1.976 -5.234 -0.679 1.00 . A A . 14 LEU CD2 1 1 13 5450 1 1 14 LEU CG C 1.918 -4.266 -1.865 1.00 . A A . 14 LEU CG 1 1 13 5451 1 1 14 LEU H H 0.084 -1.596 0.260 1.00 . A A . 14 LEU H 1 1 13 5452 1 1 14 LEU HA H 2.528 -3.076 0.313 1.00 . A A . 14 LEU HA 1 1 13 5453 1 1 14 LEU HB2 H 0.249 -3.147 -1.103 1.00 . A A . 14 LEU HB2 1 1 13 5454 1 1 14 LEU HB3 H 1.238 -2.266 -2.265 1.00 . A A . 14 LEU HB3 1 1 13 5455 1 1 14 LEU HD11 H 3.352 -3.059 -2.912 1.00 . A A . 14 LEU HD11 1 1 13 5456 1 1 14 LEU HD12 H 3.635 -4.795 -3.040 1.00 . A A . 14 LEU HD12 1 1 13 5457 1 1 14 LEU HD13 H 4.017 -3.948 -1.541 1.00 . A A . 14 LEU HD13 1 1 13 5458 1 1 14 LEU HD21 H 2.170 -6.234 -1.041 1.00 . A A . 14 LEU HD21 1 1 13 5459 1 1 14 LEU HD22 H 1.033 -5.218 -0.154 1.00 . A A . 14 LEU HD22 1 1 13 5460 1 1 14 LEU HD23 H 2.768 -4.935 -0.008 1.00 . A A . 14 LEU HD23 1 1 13 5461 1 1 14 LEU HG H 1.331 -4.706 -2.659 1.00 . A A . 14 LEU HG 1 1 13 5462 1 1 14 LEU N N 1.022 -1.598 0.549 1.00 . A A . 14 LEU N 1 1 13 5463 1 1 14 LEU O O 4.271 -1.590 -0.824 1.00 . A A . 14 LEU O 1 1 13 5464 1 1 15 VAL C C 4.459 1.414 -0.567 1.00 . A A . 15 VAL C 1 1 13 5465 1 1 15 VAL CA C 3.590 0.888 -1.718 1.00 . A A . 15 VAL CA 1 1 13 5466 1 1 15 VAL CB C 2.703 2.005 -2.288 1.00 . A A . 15 VAL CB 1 1 13 5467 1 1 15 VAL CG1 C 3.581 3.125 -2.854 1.00 . A A . 15 VAL CG1 1 1 13 5468 1 1 15 VAL CG2 C 1.821 1.443 -3.409 1.00 . A A . 15 VAL CG2 1 1 13 5469 1 1 15 VAL H H 1.684 0.043 -1.156 1.00 . A A . 15 VAL H 1 1 13 5470 1 1 15 VAL HA H 4.212 0.474 -2.497 1.00 . A A . 15 VAL HA 1 1 13 5471 1 1 15 VAL HB H 2.079 2.403 -1.502 1.00 . A A . 15 VAL HB 1 1 13 5472 1 1 15 VAL HG11 H 3.030 3.668 -3.608 1.00 . A A . 15 VAL HG11 1 1 13 5473 1 1 15 VAL HG12 H 4.470 2.700 -3.295 1.00 . A A . 15 VAL HG12 1 1 13 5474 1 1 15 VAL HG13 H 3.861 3.799 -2.059 1.00 . A A . 15 VAL HG13 1 1 13 5475 1 1 15 VAL HG21 H 1.944 0.371 -3.463 1.00 . A A . 15 VAL HG21 1 1 13 5476 1 1 15 VAL HG22 H 2.108 1.885 -4.351 1.00 . A A . 15 VAL HG22 1 1 13 5477 1 1 15 VAL HG23 H 0.787 1.675 -3.203 1.00 . A A . 15 VAL HG23 1 1 13 5478 1 1 15 VAL N N 2.642 -0.151 -1.203 1.00 . A A . 15 VAL N 1 1 13 5479 1 1 15 VAL O O 5.633 1.676 -0.738 1.00 . A A . 15 VAL O 1 1 13 5480 1 1 16 PHE C C 5.840 1.092 2.066 1.00 . A A . 16 PHE C 1 1 13 5481 1 1 16 PHE CA C 4.680 2.052 1.779 1.00 . A A . 16 PHE CA 1 1 13 5482 1 1 16 PHE CB C 3.698 2.067 2.955 1.00 . A A . 16 PHE CB 1 1 13 5483 1 1 16 PHE CD1 C 3.780 4.547 3.418 1.00 . A A . 16 PHE CD1 1 1 13 5484 1 1 16 PHE CD2 C 1.667 3.549 2.769 1.00 . A A . 16 PHE CD2 1 1 13 5485 1 1 16 PHE CE1 C 3.161 5.799 3.506 1.00 . A A . 16 PHE CE1 1 1 13 5486 1 1 16 PHE CE2 C 1.049 4.802 2.857 1.00 . A A . 16 PHE CE2 1 1 13 5487 1 1 16 PHE CG C 3.033 3.421 3.049 1.00 . A A . 16 PHE CG 1 1 13 5488 1 1 16 PHE CZ C 1.796 5.926 3.225 1.00 . A A . 16 PHE CZ 1 1 13 5489 1 1 16 PHE H H 2.939 1.330 0.720 1.00 . A A . 16 PHE H 1 1 13 5490 1 1 16 PHE HA H 5.050 3.047 1.590 1.00 . A A . 16 PHE HA 1 1 13 5491 1 1 16 PHE HB2 H 2.946 1.306 2.807 1.00 . A A . 16 PHE HB2 1 1 13 5492 1 1 16 PHE HB3 H 4.233 1.867 3.871 1.00 . A A . 16 PHE HB3 1 1 13 5493 1 1 16 PHE HD1 H 4.834 4.449 3.635 1.00 . A A . 16 PHE HD1 1 1 13 5494 1 1 16 PHE HD2 H 1.090 2.682 2.485 1.00 . A A . 16 PHE HD2 1 1 13 5495 1 1 16 PHE HE1 H 3.737 6.667 3.791 1.00 . A A . 16 PHE HE1 1 1 13 5496 1 1 16 PHE HE2 H -0.004 4.900 2.641 1.00 . A A . 16 PHE HE2 1 1 13 5497 1 1 16 PHE HZ H 1.319 6.894 3.293 1.00 . A A . 16 PHE HZ 1 1 13 5498 1 1 16 PHE N N 3.887 1.557 0.607 1.00 . A A . 16 PHE N 1 1 13 5499 1 1 16 PHE O O 6.955 1.511 2.317 1.00 . A A . 16 PHE O 1 1 13 5500 1 1 17 GLY C C 7.735 -1.083 1.196 1.00 . A A . 17 GLY C 1 1 13 5501 1 1 17 GLY CA C 6.661 -1.195 2.281 1.00 . A A . 17 GLY CA 1 1 13 5502 1 1 17 GLY H H 4.676 -0.503 1.810 1.00 . A A . 17 GLY H 1 1 13 5503 1 1 17 GLY HA2 H 7.105 -1.003 3.249 1.00 . A A . 17 GLY HA2 1 1 13 5504 1 1 17 GLY HA3 H 6.243 -2.189 2.267 1.00 . A A . 17 GLY HA3 1 1 13 5505 1 1 17 GLY N N 5.582 -0.194 2.022 1.00 . A A . 17 GLY N 1 1 13 5506 1 1 17 GLY O O 8.908 -0.957 1.489 1.00 . A A . 17 GLY O 1 1 13 5507 1 1 18 GLU C C 9.082 0.338 -1.081 1.00 . A A . 18 GLU C 1 1 13 5508 1 1 18 GLU CA C 8.347 -1.009 -1.162 1.00 . A A . 18 GLU CA 1 1 13 5509 1 1 18 GLU CB C 7.539 -1.119 -2.461 1.00 . A A . 18 GLU CB 1 1 13 5510 1 1 18 GLU CD C 7.361 -2.892 -4.227 1.00 . A A . 18 GLU CD 1 1 13 5511 1 1 18 GLU CG C 8.319 -1.957 -3.482 1.00 . A A . 18 GLU CG 1 1 13 5512 1 1 18 GLU H H 6.388 -1.218 -0.267 1.00 . A A . 18 GLU H 1 1 13 5513 1 1 18 GLU HA H 9.054 -1.816 -1.098 1.00 . A A . 18 GLU HA 1 1 13 5514 1 1 18 GLU HB2 H 6.590 -1.593 -2.256 1.00 . A A . 18 GLU HB2 1 1 13 5515 1 1 18 GLU HB3 H 7.369 -0.132 -2.865 1.00 . A A . 18 GLU HB3 1 1 13 5516 1 1 18 GLU HG2 H 8.802 -1.300 -4.191 1.00 . A A . 18 GLU HG2 1 1 13 5517 1 1 18 GLU HG3 H 9.066 -2.545 -2.970 1.00 . A A . 18 GLU HG3 1 1 13 5518 1 1 18 GLU N N 7.343 -1.120 -0.056 1.00 . A A . 18 GLU N 1 1 13 5519 1 1 18 GLU O O 10.244 0.439 -1.422 1.00 . A A . 18 GLU O 1 1 13 5520 1 1 18 GLU OE1 O 7.068 -3.954 -3.700 1.00 . A A . 18 GLU OE1 1 1 13 5521 1 1 18 GLU OE2 O 6.940 -2.534 -5.315 1.00 . A A . 18 GLU OE2 1 1 13 5522 1 1 19 ASN C C 10.250 2.638 0.498 1.00 . A A . 19 ASN C 1 1 13 5523 1 1 19 ASN CA C 9.081 2.704 -0.495 1.00 . A A . 19 ASN CA 1 1 13 5524 1 1 19 ASN CB C 7.996 3.656 0.017 1.00 . A A . 19 ASN CB 1 1 13 5525 1 1 19 ASN CG C 7.489 4.521 -1.138 1.00 . A A . 19 ASN CG 1 1 13 5526 1 1 19 ASN H H 7.484 1.253 -0.337 1.00 . A A . 19 ASN H 1 1 13 5527 1 1 19 ASN HA H 9.431 3.031 -1.458 1.00 . A A . 19 ASN HA 1 1 13 5528 1 1 19 ASN HB2 H 7.176 3.084 0.427 1.00 . A A . 19 ASN HB2 1 1 13 5529 1 1 19 ASN HB3 H 8.409 4.292 0.785 1.00 . A A . 19 ASN HB3 1 1 13 5530 1 1 19 ASN HD21 H 6.239 3.135 -1.818 1.00 . A A . 19 ASN HD21 1 1 13 5531 1 1 19 ASN HD22 H 6.258 4.590 -2.694 1.00 . A A . 19 ASN HD22 1 1 13 5532 1 1 19 ASN N N 8.416 1.365 -0.617 1.00 . A A . 19 ASN N 1 1 13 5533 1 1 19 ASN ND2 N 6.586 4.043 -1.951 1.00 . A A . 19 ASN ND2 1 1 13 5534 1 1 19 ASN O O 11.145 3.462 0.464 1.00 . A A . 19 ASN O 1 1 13 5535 1 1 19 ASN OD1 O 7.918 5.645 -1.303 1.00 . A A . 19 ASN OD1 1 1 13 5536 1 1 20 GLY C C 12.225 0.324 2.035 1.00 . A A . 20 GLY C 1 1 13 5537 1 1 20 GLY CA C 11.354 1.541 2.372 1.00 . A A . 20 GLY CA 1 1 13 5538 1 1 20 GLY H H 9.514 1.019 1.383 1.00 . A A . 20 GLY H 1 1 13 5539 1 1 20 GLY HA2 H 11.960 2.435 2.350 1.00 . A A . 20 GLY HA2 1 1 13 5540 1 1 20 GLY HA3 H 10.936 1.416 3.359 1.00 . A A . 20 GLY HA3 1 1 13 5541 1 1 20 GLY N N 10.247 1.668 1.377 1.00 . A A . 20 GLY N 1 1 13 5542 1 1 20 GLY O O 13.436 0.384 2.124 1.00 . A A . 20 GLY O 1 1 13 5543 1 1 21 VAL C C 13.053 -1.884 -0.067 1.00 . A A . 21 VAL C 1 1 13 5544 1 1 21 VAL CA C 12.426 -2.003 1.328 1.00 . A A . 21 VAL CA 1 1 13 5545 1 1 21 VAL CB C 11.427 -3.168 1.382 1.00 . A A . 21 VAL CB 1 1 13 5546 1 1 21 VAL CG1 C 12.084 -4.443 0.843 1.00 . A A . 21 VAL CG1 1 1 13 5547 1 1 21 VAL CG2 C 10.993 -3.402 2.832 1.00 . A A . 21 VAL CG2 1 1 13 5548 1 1 21 VAL H H 10.641 -0.809 1.598 1.00 . A A . 21 VAL H 1 1 13 5549 1 1 21 VAL HA H 13.194 -2.149 2.064 1.00 . A A . 21 VAL HA 1 1 13 5550 1 1 21 VAL HB H 10.563 -2.928 0.779 1.00 . A A . 21 VAL HB 1 1 13 5551 1 1 21 VAL HG11 H 12.191 -4.367 -0.230 1.00 . A A . 21 VAL HG11 1 1 13 5552 1 1 21 VAL HG12 H 11.466 -5.296 1.083 1.00 . A A . 21 VAL HG12 1 1 13 5553 1 1 21 VAL HG13 H 13.059 -4.564 1.293 1.00 . A A . 21 VAL HG13 1 1 13 5554 1 1 21 VAL HG21 H 11.675 -4.092 3.305 1.00 . A A . 21 VAL HG21 1 1 13 5555 1 1 21 VAL HG22 H 9.995 -3.817 2.846 1.00 . A A . 21 VAL HG22 1 1 13 5556 1 1 21 VAL HG23 H 10.999 -2.464 3.367 1.00 . A A . 21 VAL HG23 1 1 13 5557 1 1 21 VAL N N 11.624 -0.780 1.658 1.00 . A A . 21 VAL N 1 1 13 5558 1 1 21 VAL O O 14.234 -2.119 -0.245 1.00 . A A . 21 VAL O 1 1 13 5559 1 1 22 PHE C C 13.809 -0.225 -2.542 1.00 . A A . 22 PHE C 1 1 13 5560 1 1 22 PHE CA C 12.819 -1.395 -2.444 1.00 . A A . 22 PHE CA 1 1 13 5561 1 1 22 PHE CB C 11.602 -1.147 -3.340 1.00 . A A . 22 PHE CB 1 1 13 5562 1 1 22 PHE CD1 C 11.129 -3.376 -4.422 1.00 . A A . 22 PHE CD1 1 1 13 5563 1 1 22 PHE CD2 C 12.208 -1.647 -5.737 1.00 . A A . 22 PHE CD2 1 1 13 5564 1 1 22 PHE CE1 C 11.170 -4.238 -5.523 1.00 . A A . 22 PHE CE1 1 1 13 5565 1 1 22 PHE CE2 C 12.249 -2.511 -6.838 1.00 . A A . 22 PHE CE2 1 1 13 5566 1 1 22 PHE CG C 11.648 -2.079 -4.529 1.00 . A A . 22 PHE CG 1 1 13 5567 1 1 22 PHE CZ C 11.729 -3.806 -6.731 1.00 . A A . 22 PHE CZ 1 1 13 5568 1 1 22 PHE H H 11.326 -1.344 -0.879 1.00 . A A . 22 PHE H 1 1 13 5569 1 1 22 PHE HA H 13.304 -2.310 -2.733 1.00 . A A . 22 PHE HA 1 1 13 5570 1 1 22 PHE HB2 H 10.697 -1.327 -2.779 1.00 . A A . 22 PHE HB2 1 1 13 5571 1 1 22 PHE HB3 H 11.612 -0.125 -3.687 1.00 . A A . 22 PHE HB3 1 1 13 5572 1 1 22 PHE HD1 H 10.698 -3.710 -3.490 1.00 . A A . 22 PHE HD1 1 1 13 5573 1 1 22 PHE HD2 H 12.609 -0.648 -5.820 1.00 . A A . 22 PHE HD2 1 1 13 5574 1 1 22 PHE HE1 H 10.770 -5.239 -5.441 1.00 . A A . 22 PHE HE1 1 1 13 5575 1 1 22 PHE HE2 H 12.680 -2.177 -7.771 1.00 . A A . 22 PHE HE2 1 1 13 5576 1 1 22 PHE HZ H 11.759 -4.472 -7.581 1.00 . A A . 22 PHE HZ 1 1 13 5577 1 1 22 PHE N N 12.273 -1.525 -1.053 1.00 . A A . 22 PHE N 1 1 13 5578 1 1 22 PHE O O 14.594 -0.152 -3.468 1.00 . A A . 22 PHE O 1 1 13 5579 1 1 23 PHE C C 15.920 1.610 -0.688 1.00 . A A . 23 PHE C 1 1 13 5580 1 1 23 PHE CA C 14.735 1.840 -1.640 1.00 . A A . 23 PHE CA 1 1 13 5581 1 1 23 PHE CB C 13.912 3.050 -1.190 1.00 . A A . 23 PHE CB 1 1 13 5582 1 1 23 PHE CD1 C 13.724 4.551 -3.210 1.00 . A A . 23 PHE CD1 1 1 13 5583 1 1 23 PHE CD2 C 11.831 3.159 -2.611 1.00 . A A . 23 PHE CD2 1 1 13 5584 1 1 23 PHE CE1 C 13.006 5.059 -4.298 1.00 . A A . 23 PHE CE1 1 1 13 5585 1 1 23 PHE CE2 C 11.113 3.667 -3.698 1.00 . A A . 23 PHE CE2 1 1 13 5586 1 1 23 PHE CG C 13.137 3.600 -2.365 1.00 . A A . 23 PHE CG 1 1 13 5587 1 1 23 PHE CZ C 11.700 4.617 -4.542 1.00 . A A . 23 PHE CZ 1 1 13 5588 1 1 23 PHE H H 13.149 0.603 -0.859 1.00 . A A . 23 PHE H 1 1 13 5589 1 1 23 PHE HA H 15.091 1.993 -2.646 1.00 . A A . 23 PHE HA 1 1 13 5590 1 1 23 PHE HB2 H 13.225 2.749 -0.413 1.00 . A A . 23 PHE HB2 1 1 13 5591 1 1 23 PHE HB3 H 14.574 3.813 -0.809 1.00 . A A . 23 PHE HB3 1 1 13 5592 1 1 23 PHE HD1 H 14.732 4.892 -3.022 1.00 . A A . 23 PHE HD1 1 1 13 5593 1 1 23 PHE HD2 H 11.378 2.427 -1.960 1.00 . A A . 23 PHE HD2 1 1 13 5594 1 1 23 PHE HE1 H 13.459 5.791 -4.949 1.00 . A A . 23 PHE HE1 1 1 13 5595 1 1 23 PHE HE2 H 10.105 3.327 -3.888 1.00 . A A . 23 PHE HE2 1 1 13 5596 1 1 23 PHE HZ H 11.146 5.009 -5.382 1.00 . A A . 23 PHE HZ 1 1 13 5597 1 1 23 PHE N N 13.786 0.684 -1.597 1.00 . A A . 23 PHE N 1 1 13 5598 1 1 23 PHE O O 16.629 2.535 -0.339 1.00 . A A . 23 PHE O 1 1 13 5599 1 1 24 TYR C C 18.378 -0.699 -0.077 1.00 . A A . 24 TYR C 1 1 13 5600 1 1 24 TYR CA C 17.289 0.101 0.653 1.00 . A A . 24 TYR CA 1 1 13 5601 1 1 24 TYR CB C 16.679 -0.721 1.793 1.00 . A A . 24 TYR CB 1 1 13 5602 1 1 24 TYR CD1 C 18.420 -0.491 3.604 1.00 . A A . 24 TYR CD1 1 1 13 5603 1 1 24 TYR CD2 C 16.301 0.660 3.868 1.00 . A A . 24 TYR CD2 1 1 13 5604 1 1 24 TYR CE1 C 18.850 0.020 4.835 1.00 . A A . 24 TYR CE1 1 1 13 5605 1 1 24 TYR CE2 C 16.732 1.171 5.099 1.00 . A A . 24 TYR CE2 1 1 13 5606 1 1 24 TYR CG C 17.145 -0.171 3.121 1.00 . A A . 24 TYR CG 1 1 13 5607 1 1 24 TYR CZ C 18.007 0.851 5.582 1.00 . A A . 24 TYR CZ 1 1 13 5608 1 1 24 TYR H H 15.570 -0.349 -0.567 1.00 . A A . 24 TYR H 1 1 13 5609 1 1 24 TYR HA H 17.696 1.022 1.041 1.00 . A A . 24 TYR HA 1 1 13 5610 1 1 24 TYR HB2 H 15.602 -0.667 1.738 1.00 . A A . 24 TYR HB2 1 1 13 5611 1 1 24 TYR HB3 H 16.991 -1.752 1.703 1.00 . A A . 24 TYR HB3 1 1 13 5612 1 1 24 TYR HD1 H 19.071 -1.131 3.027 1.00 . A A . 24 TYR HD1 1 1 13 5613 1 1 24 TYR HD2 H 15.319 0.907 3.498 1.00 . A A . 24 TYR HD2 1 1 13 5614 1 1 24 TYR HE1 H 19.833 -0.227 5.207 1.00 . A A . 24 TYR HE1 1 1 13 5615 1 1 24 TYR HE2 H 16.082 1.811 5.675 1.00 . A A . 24 TYR HE2 1 1 13 5616 1 1 24 TYR HH H 18.189 0.726 7.479 1.00 . A A . 24 TYR HH 1 1 13 5617 1 1 24 TYR N N 16.147 0.385 -0.270 1.00 . A A . 24 TYR N 1 1 13 5618 1 1 24 TYR O O 19.011 -1.569 0.495 1.00 . A A . 24 TYR O 1 1 13 5619 1 1 24 TYR OH O 18.432 1.355 6.794 1.00 . A A . 24 TYR OH 1 1 13 5620 1 1 25 LYS C C 20.949 -0.317 -2.193 1.00 . A A . 25 LYS C 1 1 13 5621 1 1 25 LYS CA C 19.653 -1.146 -2.107 1.00 . A A . 25 LYS CA 1 1 13 5622 1 1 25 LYS CB C 19.029 -1.393 -3.497 1.00 . A A . 25 LYS CB 1 1 13 5623 1 1 25 LYS CD C 18.697 0.941 -4.372 1.00 . A A . 25 LYS CD 1 1 13 5624 1 1 25 LYS CE C 19.407 2.082 -5.112 1.00 . A A . 25 LYS CE 1 1 13 5625 1 1 25 LYS CG C 19.509 -0.350 -4.523 1.00 . A A . 25 LYS CG 1 1 13 5626 1 1 25 LYS H H 18.083 0.298 -1.771 1.00 . A A . 25 LYS H 1 1 13 5627 1 1 25 LYS HA H 19.857 -2.093 -1.632 1.00 . A A . 25 LYS HA 1 1 13 5628 1 1 25 LYS HB2 H 19.310 -2.377 -3.840 1.00 . A A . 25 LYS HB2 1 1 13 5629 1 1 25 LYS HB3 H 17.952 -1.341 -3.417 1.00 . A A . 25 LYS HB3 1 1 13 5630 1 1 25 LYS HD2 H 17.712 0.797 -4.791 1.00 . A A . 25 LYS HD2 1 1 13 5631 1 1 25 LYS HD3 H 18.610 1.192 -3.327 1.00 . A A . 25 LYS HD3 1 1 13 5632 1 1 25 LYS HE2 H 20.042 1.685 -5.892 1.00 . A A . 25 LYS HE2 1 1 13 5633 1 1 25 LYS HE3 H 18.684 2.767 -5.526 1.00 . A A . 25 LYS HE3 1 1 13 5634 1 1 25 LYS HG2 H 20.556 -0.140 -4.363 1.00 . A A . 25 LYS HG2 1 1 13 5635 1 1 25 LYS HG3 H 19.372 -0.742 -5.519 1.00 . A A . 25 LYS HG3 1 1 13 5636 1 1 25 LYS HZ1 H 20.819 2.075 -3.574 1.00 . A A . 25 LYS HZ1 1 1 13 5637 1 1 25 LYS HZ2 H 19.594 3.240 -3.389 1.00 . A A . 25 LYS HZ2 1 1 13 5638 1 1 25 LYS HZ3 H 20.835 3.483 -4.525 1.00 . A A . 25 LYS HZ3 1 1 13 5639 1 1 25 LYS N N 18.604 -0.408 -1.335 1.00 . A A . 25 LYS N 1 1 13 5640 1 1 25 LYS NZ N 20.225 2.772 -4.072 1.00 . A A . 25 LYS NZ 1 1 13 5641 1 1 25 LYS O O 20.879 0.893 -2.043 1.00 . A A . 25 LYS O 1 1 13 5642 1 1 25 LYS OXT O 21.992 -0.914 -2.409 1.00 . A A . 25 LYS OXT 1 1 14 5643 1 1 1 HIS C C -20.191 1.173 3.241 1.00 . A A . 1 HIS C 1 1 14 5644 1 1 1 HIS CA C -20.491 1.637 4.673 1.00 . A A . 1 HIS CA 1 1 14 5645 1 1 1 HIS CB C -21.271 2.957 4.664 1.00 . A A . 1 HIS CB 1 1 14 5646 1 1 1 HIS CD2 C -23.785 2.669 5.376 1.00 . A A . 1 HIS CD2 1 1 14 5647 1 1 1 HIS CE1 C -24.604 2.143 3.441 1.00 . A A . 1 HIS CE1 1 1 14 5648 1 1 1 HIS CG C -22.738 2.672 4.488 1.00 . A A . 1 HIS CG 1 1 14 5649 1 1 1 HIS HA H -21.054 0.883 5.200 1.00 . A A . 1 HIS HA 1 1 14 5650 1 1 1 HIS HB2 H -21.116 3.474 5.600 1.00 . A A . 1 HIS HB2 1 1 14 5651 1 1 1 HIS HB3 H -20.925 3.575 3.849 1.00 . A A . 1 HIS HB3 1 1 14 5652 1 1 1 HIS HD1 H -22.799 2.250 2.411 1.00 . A A . 1 HIS HD1 1 1 14 5653 1 1 1 HIS HD2 H -23.707 2.894 6.430 1.00 . A A . 1 HIS HD2 1 1 14 5654 1 1 1 HIS HE1 H -25.291 1.867 2.654 1.00 . A A . 1 HIS HE1 1 1 14 5655 1 1 1 HIS N N -19.219 1.935 5.400 1.00 . A A . 1 HIS N 1 1 14 5656 1 1 1 HIS ND1 N -23.285 2.334 3.258 1.00 . A A . 1 HIS ND1 1 1 14 5657 1 1 1 HIS NE2 N -24.962 2.334 4.713 1.00 . A A . 1 HIS NE2 1 1 14 5658 1 1 1 HIS O O -20.599 0.102 2.834 1.00 . A A . 1 HIS O 1 1 14 5659 1 1 2 ALA C C -18.022 0.534 1.070 1.00 . A A . 2 ALA C 1 1 14 5660 1 1 2 ALA CA C -19.149 1.572 1.075 1.00 . A A . 2 ALA CA 1 1 14 5661 1 1 2 ALA CB C -18.690 2.861 0.388 1.00 . A A . 2 ALA CB 1 1 14 5662 1 1 2 ALA H H -19.160 2.827 2.830 1.00 . A A . 2 ALA H 1 1 14 5663 1 1 2 ALA HA H -20.024 1.181 0.578 1.00 . A A . 2 ALA HA 1 1 14 5664 1 1 2 ALA HB1 H -19.485 3.592 0.424 1.00 . A A . 2 ALA HB1 1 1 14 5665 1 1 2 ALA HB2 H -18.440 2.651 -0.642 1.00 . A A . 2 ALA HB2 1 1 14 5666 1 1 2 ALA HB3 H -17.820 3.251 0.897 1.00 . A A . 2 ALA HB3 1 1 14 5667 1 1 2 ALA N N -19.480 1.969 2.478 1.00 . A A . 2 ALA N 1 1 14 5668 1 1 2 ALA O O -17.230 0.461 1.992 1.00 . A A . 2 ALA O 1 1 14 5669 1 1 3 TRP C C -15.572 -0.666 -0.594 1.00 . A A . 3 TRP C 1 1 14 5670 1 1 3 TRP CA C -16.859 -1.295 -0.036 1.00 . A A . 3 TRP CA 1 1 14 5671 1 1 3 TRP CB C -17.408 -2.392 -0.971 1.00 . A A . 3 TRP CB 1 1 14 5672 1 1 3 TRP CD1 C -17.668 -1.152 -3.167 1.00 . A A . 3 TRP CD1 1 1 14 5673 1 1 3 TRP CD2 C -16.049 -2.713 -3.242 1.00 . A A . 3 TRP CD2 1 1 14 5674 1 1 3 TRP CE2 C -16.084 -2.101 -4.516 1.00 . A A . 3 TRP CE2 1 1 14 5675 1 1 3 TRP CE3 C -15.109 -3.737 -3.023 1.00 . A A . 3 TRP CE3 1 1 14 5676 1 1 3 TRP CG C -17.065 -2.090 -2.401 1.00 . A A . 3 TRP CG 1 1 14 5677 1 1 3 TRP CH2 C -14.291 -3.511 -5.304 1.00 . A A . 3 TRP CH2 1 1 14 5678 1 1 3 TRP CZ2 C -15.217 -2.492 -5.538 1.00 . A A . 3 TRP CZ2 1 1 14 5679 1 1 3 TRP CZ3 C -14.237 -4.133 -4.050 1.00 . A A . 3 TRP CZ3 1 1 14 5680 1 1 3 TRP H H -18.584 -0.185 -0.698 1.00 . A A . 3 TRP H 1 1 14 5681 1 1 3 TRP HA H -16.675 -1.708 0.944 1.00 . A A . 3 TRP HA 1 1 14 5682 1 1 3 TRP HB2 H -16.977 -3.343 -0.696 1.00 . A A . 3 TRP HB2 1 1 14 5683 1 1 3 TRP HB3 H -18.482 -2.446 -0.865 1.00 . A A . 3 TRP HB3 1 1 14 5684 1 1 3 TRP HD1 H -18.472 -0.504 -2.850 1.00 . A A . 3 TRP HD1 1 1 14 5685 1 1 3 TRP HE1 H -17.338 -0.570 -5.165 1.00 . A A . 3 TRP HE1 1 1 14 5686 1 1 3 TRP HE3 H -15.059 -4.223 -2.060 1.00 . A A . 3 TRP HE3 1 1 14 5687 1 1 3 TRP HH2 H -13.617 -3.819 -6.090 1.00 . A A . 3 TRP HH2 1 1 14 5688 1 1 3 TRP HZ2 H -15.263 -2.010 -6.503 1.00 . A A . 3 TRP HZ2 1 1 14 5689 1 1 3 TRP HZ3 H -13.519 -4.921 -3.871 1.00 . A A . 3 TRP HZ3 1 1 14 5690 1 1 3 TRP N N -17.939 -0.265 0.035 1.00 . A A . 3 TRP N 1 1 14 5691 1 1 3 TRP NE1 N -17.085 -1.156 -4.421 1.00 . A A . 3 TRP NE1 1 1 14 5692 1 1 3 TRP O O -15.498 0.533 -0.794 1.00 . A A . 3 TRP O 1 1 14 5693 1 1 4 TYR C C -12.542 -0.012 -0.402 1.00 . A A . 4 TYR C 1 1 14 5694 1 1 4 TYR CA C -13.262 -0.957 -1.398 1.00 . A A . 4 TYR CA 1 1 14 5695 1 1 4 TYR CB C -13.648 -0.248 -2.716 1.00 . A A . 4 TYR CB 1 1 14 5696 1 1 4 TYR CD1 C -11.479 0.468 -3.788 1.00 . A A . 4 TYR CD1 1 1 14 5697 1 1 4 TYR CD2 C -12.866 2.148 -2.723 1.00 . A A . 4 TYR CD2 1 1 14 5698 1 1 4 TYR CE1 C -10.548 1.455 -4.130 1.00 . A A . 4 TYR CE1 1 1 14 5699 1 1 4 TYR CE2 C -11.936 3.134 -3.066 1.00 . A A . 4 TYR CE2 1 1 14 5700 1 1 4 TYR CG C -12.637 0.815 -3.083 1.00 . A A . 4 TYR CG 1 1 14 5701 1 1 4 TYR CZ C -10.777 2.788 -3.769 1.00 . A A . 4 TYR CZ 1 1 14 5702 1 1 4 TYR H H -14.663 -2.431 -0.669 1.00 . A A . 4 TYR H 1 1 14 5703 1 1 4 TYR HA H -12.619 -1.790 -1.622 1.00 . A A . 4 TYR HA 1 1 14 5704 1 1 4 TYR HB2 H -13.692 -0.979 -3.509 1.00 . A A . 4 TYR HB2 1 1 14 5705 1 1 4 TYR HB3 H -14.619 0.210 -2.607 1.00 . A A . 4 TYR HB3 1 1 14 5706 1 1 4 TYR HD1 H -11.302 -0.561 -4.067 1.00 . A A . 4 TYR HD1 1 1 14 5707 1 1 4 TYR HD2 H -13.760 2.415 -2.180 1.00 . A A . 4 TYR HD2 1 1 14 5708 1 1 4 TYR HE1 H -9.653 1.189 -4.671 1.00 . A A . 4 TYR HE1 1 1 14 5709 1 1 4 TYR HE2 H -12.114 4.163 -2.787 1.00 . A A . 4 TYR HE2 1 1 14 5710 1 1 4 TYR HH H -10.143 4.161 -4.935 1.00 . A A . 4 TYR HH 1 1 14 5711 1 1 4 TYR N N -14.563 -1.473 -0.843 1.00 . A A . 4 TYR N 1 1 14 5712 1 1 4 TYR O O -11.461 0.477 -0.680 1.00 . A A . 4 TYR O 1 1 14 5713 1 1 4 TYR OH O -9.861 3.761 -4.108 1.00 . A A . 4 TYR OH 1 1 14 5714 1 1 5 SER C C -11.103 0.486 2.212 1.00 . A A . 5 SER C 1 1 14 5715 1 1 5 SER CA C -12.425 1.116 1.762 1.00 . A A . 5 SER CA 1 1 14 5716 1 1 5 SER CB C -13.399 1.230 2.939 1.00 . A A . 5 SER CB 1 1 14 5717 1 1 5 SER H H -13.957 -0.193 0.990 1.00 . A A . 5 SER H 1 1 14 5718 1 1 5 SER HA H -12.247 2.085 1.333 1.00 . A A . 5 SER HA 1 1 14 5719 1 1 5 SER HB2 H -13.801 0.259 3.172 1.00 . A A . 5 SER HB2 1 1 14 5720 1 1 5 SER HB3 H -12.872 1.615 3.804 1.00 . A A . 5 SER HB3 1 1 14 5721 1 1 5 SER HG H -14.125 3.005 2.598 1.00 . A A . 5 SER HG 1 1 14 5722 1 1 5 SER N N -13.104 0.225 0.764 1.00 . A A . 5 SER N 1 1 14 5723 1 1 5 SER O O -10.123 1.171 2.443 1.00 . A A . 5 SER O 1 1 14 5724 1 1 5 SER OG O -14.463 2.106 2.589 1.00 . A A . 5 SER OG 1 1 14 5725 1 1 6 HIS C C -8.976 -1.841 1.485 1.00 . A A . 6 HIS C 1 1 14 5726 1 1 6 HIS CA C -9.813 -1.513 2.727 1.00 . A A . 6 HIS CA 1 1 14 5727 1 1 6 HIS CB C -10.265 -2.796 3.431 1.00 . A A . 6 HIS CB 1 1 14 5728 1 1 6 HIS CD2 C -8.002 -3.182 4.716 1.00 . A A . 6 HIS CD2 1 1 14 5729 1 1 6 HIS CE1 C -7.683 -5.257 4.178 1.00 . A A . 6 HIS CE1 1 1 14 5730 1 1 6 HIS CG C -9.060 -3.554 3.923 1.00 . A A . 6 HIS CG 1 1 14 5731 1 1 6 HIS H H -11.872 -1.340 2.110 1.00 . A A . 6 HIS H 1 1 14 5732 1 1 6 HIS HA H -9.247 -0.897 3.402 1.00 . A A . 6 HIS HA 1 1 14 5733 1 1 6 HIS HB2 H -10.897 -2.542 4.270 1.00 . A A . 6 HIS HB2 1 1 14 5734 1 1 6 HIS HB3 H -10.817 -3.413 2.738 1.00 . A A . 6 HIS HB3 1 1 14 5735 1 1 6 HIS HD1 H -9.413 -5.449 3.038 1.00 . A A . 6 HIS HD1 1 1 14 5736 1 1 6 HIS HD2 H -7.865 -2.202 5.150 1.00 . A A . 6 HIS HD2 1 1 14 5737 1 1 6 HIS HE1 H -7.255 -6.244 4.097 1.00 . A A . 6 HIS HE1 1 1 14 5738 1 1 6 HIS N N -11.070 -0.817 2.318 1.00 . A A . 6 HIS N 1 1 14 5739 1 1 6 HIS ND1 N -8.835 -4.883 3.593 1.00 . A A . 6 HIS ND1 1 1 14 5740 1 1 6 HIS NE2 N -7.134 -4.257 4.875 1.00 . A A . 6 HIS NE2 1 1 14 5741 1 1 6 HIS O O -7.768 -1.950 1.554 1.00 . A A . 6 HIS O 1 1 14 5742 1 1 7 TYR C C -7.876 -1.173 -1.211 1.00 . A A . 7 TYR C 1 1 14 5743 1 1 7 TYR CA C -8.862 -2.302 -0.907 1.00 . A A . 7 TYR CA 1 1 14 5744 1 1 7 TYR CB C -9.923 -2.407 -2.010 1.00 . A A . 7 TYR CB 1 1 14 5745 1 1 7 TYR CD1 C -11.674 -3.944 -1.036 1.00 . A A . 7 TYR CD1 1 1 14 5746 1 1 7 TYR CD2 C -10.190 -4.803 -2.752 1.00 . A A . 7 TYR CD2 1 1 14 5747 1 1 7 TYR CE1 C -12.312 -5.187 -0.966 1.00 . A A . 7 TYR CE1 1 1 14 5748 1 1 7 TYR CE2 C -10.829 -6.046 -2.680 1.00 . A A . 7 TYR CE2 1 1 14 5749 1 1 7 TYR CG C -10.613 -3.751 -1.930 1.00 . A A . 7 TYR CG 1 1 14 5750 1 1 7 TYR CZ C -11.889 -6.238 -1.787 1.00 . A A . 7 TYR CZ 1 1 14 5751 1 1 7 TYR H H -10.587 -1.891 0.322 1.00 . A A . 7 TYR H 1 1 14 5752 1 1 7 TYR HA H -8.338 -3.233 -0.805 1.00 . A A . 7 TYR HA 1 1 14 5753 1 1 7 TYR HB2 H -10.652 -1.619 -1.883 1.00 . A A . 7 TYR HB2 1 1 14 5754 1 1 7 TYR HB3 H -9.449 -2.304 -2.974 1.00 . A A . 7 TYR HB3 1 1 14 5755 1 1 7 TYR HD1 H -12.002 -3.135 -0.403 1.00 . A A . 7 TYR HD1 1 1 14 5756 1 1 7 TYR HD2 H -9.372 -4.654 -3.442 1.00 . A A . 7 TYR HD2 1 1 14 5757 1 1 7 TYR HE1 H -13.130 -5.335 -0.277 1.00 . A A . 7 TYR HE1 1 1 14 5758 1 1 7 TYR HE2 H -10.503 -6.858 -3.314 1.00 . A A . 7 TYR HE2 1 1 14 5759 1 1 7 TYR HH H -13.296 -7.429 -2.279 1.00 . A A . 7 TYR HH 1 1 14 5760 1 1 7 TYR N N -9.615 -1.991 0.348 1.00 . A A . 7 TYR N 1 1 14 5761 1 1 7 TYR O O -6.718 -1.412 -1.494 1.00 . A A . 7 TYR O 1 1 14 5762 1 1 7 TYR OH O -12.519 -7.463 -1.717 1.00 . A A . 7 TYR OH 1 1 14 5763 1 1 8 VAL C C -6.294 1.230 -0.332 1.00 . A A . 8 VAL C 1 1 14 5764 1 1 8 VAL CA C -7.408 1.206 -1.390 1.00 . A A . 8 VAL CA 1 1 14 5765 1 1 8 VAL CB C -8.293 2.461 -1.305 1.00 . A A . 8 VAL CB 1 1 14 5766 1 1 8 VAL CG1 C -8.665 2.756 0.152 1.00 . A A . 8 VAL CG1 1 1 14 5767 1 1 8 VAL CG2 C -7.534 3.657 -1.885 1.00 . A A . 8 VAL CG2 1 1 14 5768 1 1 8 VAL H H -9.259 0.211 -0.885 1.00 . A A . 8 VAL H 1 1 14 5769 1 1 8 VAL HA H -6.979 1.123 -2.374 1.00 . A A . 8 VAL HA 1 1 14 5770 1 1 8 VAL HB H -9.196 2.300 -1.875 1.00 . A A . 8 VAL HB 1 1 14 5771 1 1 8 VAL HG11 H -7.790 3.101 0.684 1.00 . A A . 8 VAL HG11 1 1 14 5772 1 1 8 VAL HG12 H -9.036 1.855 0.616 1.00 . A A . 8 VAL HG12 1 1 14 5773 1 1 8 VAL HG13 H -9.429 3.519 0.181 1.00 . A A . 8 VAL HG13 1 1 14 5774 1 1 8 VAL HG21 H -7.209 3.426 -2.888 1.00 . A A . 8 VAL HG21 1 1 14 5775 1 1 8 VAL HG22 H -6.672 3.870 -1.268 1.00 . A A . 8 VAL HG22 1 1 14 5776 1 1 8 VAL HG23 H -8.183 4.520 -1.906 1.00 . A A . 8 VAL HG23 1 1 14 5777 1 1 8 VAL N N -8.324 0.053 -1.131 1.00 . A A . 8 VAL N 1 1 14 5778 1 1 8 VAL O O -5.182 1.648 -0.593 1.00 . A A . 8 VAL O 1 1 14 5779 1 1 9 LEU C C -4.577 -0.412 1.694 1.00 . A A . 9 LEU C 1 1 14 5780 1 1 9 LEU CA C -5.560 0.738 1.939 1.00 . A A . 9 LEU CA 1 1 14 5781 1 1 9 LEU CB C -6.346 0.510 3.233 1.00 . A A . 9 LEU CB 1 1 14 5782 1 1 9 LEU CD1 C -5.959 2.691 4.392 1.00 . A A . 9 LEU CD1 1 1 14 5783 1 1 9 LEU CD2 C -6.090 0.576 5.716 1.00 . A A . 9 LEU CD2 1 1 14 5784 1 1 9 LEU CG C -5.627 1.197 4.396 1.00 . A A . 9 LEU CG 1 1 14 5785 1 1 9 LEU H H -7.490 0.424 1.034 1.00 . A A . 9 LEU H 1 1 14 5786 1 1 9 LEU HA H -5.036 1.680 1.984 1.00 . A A . 9 LEU HA 1 1 14 5787 1 1 9 LEU HB2 H -7.339 0.921 3.130 1.00 . A A . 9 LEU HB2 1 1 14 5788 1 1 9 LEU HB3 H -6.413 -0.549 3.431 1.00 . A A . 9 LEU HB3 1 1 14 5789 1 1 9 LEU HD11 H -5.625 3.137 5.318 1.00 . A A . 9 LEU HD11 1 1 14 5790 1 1 9 LEU HD12 H -7.026 2.823 4.295 1.00 . A A . 9 LEU HD12 1 1 14 5791 1 1 9 LEU HD13 H -5.459 3.169 3.562 1.00 . A A . 9 LEU HD13 1 1 14 5792 1 1 9 LEU HD21 H -5.658 1.123 6.542 1.00 . A A . 9 LEU HD21 1 1 14 5793 1 1 9 LEU HD22 H -5.769 -0.455 5.761 1.00 . A A . 9 LEU HD22 1 1 14 5794 1 1 9 LEU HD23 H -7.167 0.622 5.779 1.00 . A A . 9 LEU HD23 1 1 14 5795 1 1 9 LEU HG H -4.560 1.065 4.288 1.00 . A A . 9 LEU HG 1 1 14 5796 1 1 9 LEU N N -6.590 0.766 0.858 1.00 . A A . 9 LEU N 1 1 14 5797 1 1 9 LEU O O -3.385 -0.269 1.898 1.00 . A A . 9 LEU O 1 1 14 5798 1 1 10 LYS C C -3.141 -2.335 -0.109 1.00 . A A . 10 LYS C 1 1 14 5799 1 1 10 LYS CA C -4.157 -2.706 0.978 1.00 . A A . 10 LYS CA 1 1 14 5800 1 1 10 LYS CB C -5.074 -3.837 0.499 1.00 . A A . 10 LYS CB 1 1 14 5801 1 1 10 LYS CD C -5.615 -6.186 1.169 1.00 . A A . 10 LYS CD 1 1 14 5802 1 1 10 LYS CE C -5.133 -7.270 2.139 1.00 . A A . 10 LYS CE 1 1 14 5803 1 1 10 LYS CG C -4.482 -5.188 0.912 1.00 . A A . 10 LYS CG 1 1 14 5804 1 1 10 LYS H H -6.032 -1.634 1.082 1.00 . A A . 10 LYS H 1 1 14 5805 1 1 10 LYS HA H -3.648 -3.001 1.882 1.00 . A A . 10 LYS HA 1 1 14 5806 1 1 10 LYS HB2 H -6.052 -3.720 0.944 1.00 . A A . 10 LYS HB2 1 1 14 5807 1 1 10 LYS HB3 H -5.162 -3.799 -0.576 1.00 . A A . 10 LYS HB3 1 1 14 5808 1 1 10 LYS HD2 H -6.460 -5.668 1.599 1.00 . A A . 10 LYS HD2 1 1 14 5809 1 1 10 LYS HD3 H -5.909 -6.644 0.237 1.00 . A A . 10 LYS HD3 1 1 14 5810 1 1 10 LYS HE2 H -4.179 -7.664 1.816 1.00 . A A . 10 LYS HE2 1 1 14 5811 1 1 10 LYS HE3 H -5.056 -6.872 3.139 1.00 . A A . 10 LYS HE3 1 1 14 5812 1 1 10 LYS HG2 H -3.846 -5.559 0.122 1.00 . A A . 10 LYS HG2 1 1 14 5813 1 1 10 LYS HG3 H -3.901 -5.066 1.814 1.00 . A A . 10 LYS HG3 1 1 14 5814 1 1 10 LYS HZ1 H -7.110 -7.917 2.296 1.00 . A A . 10 LYS HZ1 1 1 14 5815 1 1 10 LYS HZ2 H -5.961 -9.065 2.798 1.00 . A A . 10 LYS HZ2 1 1 14 5816 1 1 10 LYS HZ3 H -6.197 -8.762 1.143 1.00 . A A . 10 LYS HZ3 1 1 14 5817 1 1 10 LYS N N -5.066 -1.547 1.246 1.00 . A A . 10 LYS N 1 1 14 5818 1 1 10 LYS NZ N -6.180 -8.333 2.090 1.00 . A A . 10 LYS NZ 1 1 14 5819 1 1 10 LYS O O -1.975 -2.667 -0.017 1.00 . A A . 10 LYS O 1 1 14 5820 1 1 11 PHE C C -1.637 -0.197 -1.691 1.00 . A A . 11 PHE C 1 1 14 5821 1 1 11 PHE CA C -2.636 -1.231 -2.223 1.00 . A A . 11 PHE CA 1 1 14 5822 1 1 11 PHE CB C -3.525 -0.617 -3.310 1.00 . A A . 11 PHE CB 1 1 14 5823 1 1 11 PHE CD1 C -2.050 0.971 -4.602 1.00 . A A . 11 PHE CD1 1 1 14 5824 1 1 11 PHE CD2 C -2.545 -1.201 -5.560 1.00 . A A . 11 PHE CD2 1 1 14 5825 1 1 11 PHE CE1 C -1.272 1.287 -5.722 1.00 . A A . 11 PHE CE1 1 1 14 5826 1 1 11 PHE CE2 C -1.769 -0.883 -6.680 1.00 . A A . 11 PHE CE2 1 1 14 5827 1 1 11 PHE CG C -2.686 -0.274 -4.521 1.00 . A A . 11 PHE CG 1 1 14 5828 1 1 11 PHE CZ C -1.132 0.361 -6.762 1.00 . A A . 11 PHE CZ 1 1 14 5829 1 1 11 PHE H H -4.519 -1.376 -1.179 1.00 . A A . 11 PHE H 1 1 14 5830 1 1 11 PHE HA H -2.116 -2.093 -2.613 1.00 . A A . 11 PHE HA 1 1 14 5831 1 1 11 PHE HB2 H -4.291 -1.326 -3.591 1.00 . A A . 11 PHE HB2 1 1 14 5832 1 1 11 PHE HB3 H -3.990 0.281 -2.930 1.00 . A A . 11 PHE HB3 1 1 14 5833 1 1 11 PHE HD1 H -2.157 1.686 -3.800 1.00 . A A . 11 PHE HD1 1 1 14 5834 1 1 11 PHE HD2 H -3.036 -2.161 -5.498 1.00 . A A . 11 PHE HD2 1 1 14 5835 1 1 11 PHE HE1 H -0.782 2.248 -5.784 1.00 . A A . 11 PHE HE1 1 1 14 5836 1 1 11 PHE HE2 H -1.660 -1.598 -7.483 1.00 . A A . 11 PHE HE2 1 1 14 5837 1 1 11 PHE HZ H -0.532 0.606 -7.626 1.00 . A A . 11 PHE HZ 1 1 14 5838 1 1 11 PHE N N -3.576 -1.638 -1.133 1.00 . A A . 11 PHE N 1 1 14 5839 1 1 11 PHE O O -0.453 -0.269 -1.965 1.00 . A A . 11 PHE O 1 1 14 5840 1 1 12 PHE C C -0.142 1.145 0.543 1.00 . A A . 12 PHE C 1 1 14 5841 1 1 12 PHE CA C -1.189 1.803 -0.364 1.00 . A A . 12 PHE CA 1 1 14 5842 1 1 12 PHE CB C -2.091 2.744 0.445 1.00 . A A . 12 PHE CB 1 1 14 5843 1 1 12 PHE CD1 C -3.178 3.643 -1.651 1.00 . A A . 12 PHE CD1 1 1 14 5844 1 1 12 PHE CD2 C -2.337 5.215 -0.006 1.00 . A A . 12 PHE CD2 1 1 14 5845 1 1 12 PHE CE1 C -3.600 4.709 -2.454 1.00 . A A . 12 PHE CE1 1 1 14 5846 1 1 12 PHE CE2 C -2.760 6.280 -0.810 1.00 . A A . 12 PHE CE2 1 1 14 5847 1 1 12 PHE CG C -2.545 3.895 -0.425 1.00 . A A . 12 PHE CG 1 1 14 5848 1 1 12 PHE CZ C -3.392 6.028 -2.033 1.00 . A A . 12 PHE CZ 1 1 14 5849 1 1 12 PHE H H -3.065 0.792 -0.718 1.00 . A A . 12 PHE H 1 1 14 5850 1 1 12 PHE HA H -0.707 2.349 -1.161 1.00 . A A . 12 PHE HA 1 1 14 5851 1 1 12 PHE HB2 H -2.954 2.199 0.800 1.00 . A A . 12 PHE HB2 1 1 14 5852 1 1 12 PHE HB3 H -1.539 3.131 1.290 1.00 . A A . 12 PHE HB3 1 1 14 5853 1 1 12 PHE HD1 H -3.340 2.627 -1.976 1.00 . A A . 12 PHE HD1 1 1 14 5854 1 1 12 PHE HD2 H -1.850 5.412 0.938 1.00 . A A . 12 PHE HD2 1 1 14 5855 1 1 12 PHE HE1 H -4.088 4.513 -3.398 1.00 . A A . 12 PHE HE1 1 1 14 5856 1 1 12 PHE HE2 H -2.600 7.297 -0.486 1.00 . A A . 12 PHE HE2 1 1 14 5857 1 1 12 PHE HZ H -3.718 6.850 -2.652 1.00 . A A . 12 PHE HZ 1 1 14 5858 1 1 12 PHE N N -2.106 0.761 -0.926 1.00 . A A . 12 PHE N 1 1 14 5859 1 1 12 PHE O O 1.034 1.445 0.462 1.00 . A A . 12 PHE O 1 1 14 5860 1 1 13 LEU C C 1.437 -1.232 1.481 1.00 . A A . 13 LEU C 1 1 14 5861 1 1 13 LEU CA C 0.404 -0.450 2.305 1.00 . A A . 13 LEU CA 1 1 14 5862 1 1 13 LEU CB C -0.449 -1.404 3.149 1.00 . A A . 13 LEU CB 1 1 14 5863 1 1 13 LEU CD1 C 0.209 -0.645 5.442 1.00 . A A . 13 LEU CD1 1 1 14 5864 1 1 13 LEU CD2 C -0.295 -3.055 5.020 1.00 . A A . 13 LEU CD2 1 1 14 5865 1 1 13 LEU CG C 0.313 -1.783 4.423 1.00 . A A . 13 LEU CG 1 1 14 5866 1 1 13 LEU H H -1.518 0.014 1.435 1.00 . A A . 13 LEU H 1 1 14 5867 1 1 13 LEU HA H 0.897 0.266 2.943 1.00 . A A . 13 LEU HA 1 1 14 5868 1 1 13 LEU HB2 H -1.376 -0.917 3.415 1.00 . A A . 13 LEU HB2 1 1 14 5869 1 1 13 LEU HB3 H -0.660 -2.296 2.580 1.00 . A A . 13 LEU HB3 1 1 14 5870 1 1 13 LEU HD11 H -0.810 -0.290 5.484 1.00 . A A . 13 LEU HD11 1 1 14 5871 1 1 13 LEU HD12 H 0.861 0.164 5.146 1.00 . A A . 13 LEU HD12 1 1 14 5872 1 1 13 LEU HD13 H 0.504 -1.007 6.416 1.00 . A A . 13 LEU HD13 1 1 14 5873 1 1 13 LEU HD21 H -1.340 -2.889 5.235 1.00 . A A . 13 LEU HD21 1 1 14 5874 1 1 13 LEU HD22 H 0.224 -3.308 5.932 1.00 . A A . 13 LEU HD22 1 1 14 5875 1 1 13 LEU HD23 H -0.197 -3.866 4.313 1.00 . A A . 13 LEU HD23 1 1 14 5876 1 1 13 LEU HG H 1.352 -1.957 4.184 1.00 . A A . 13 LEU HG 1 1 14 5877 1 1 13 LEU N N -0.563 0.242 1.397 1.00 . A A . 13 LEU N 1 1 14 5878 1 1 13 LEU O O 2.605 -1.271 1.818 1.00 . A A . 13 LEU O 1 1 14 5879 1 1 14 LEU C C 3.022 -1.668 -1.050 1.00 . A A . 14 LEU C 1 1 14 5880 1 1 14 LEU CA C 1.968 -2.614 -0.461 1.00 . A A . 14 LEU CA 1 1 14 5881 1 1 14 LEU CB C 1.106 -3.223 -1.574 1.00 . A A . 14 LEU CB 1 1 14 5882 1 1 14 LEU CD1 C 1.070 -5.543 -2.516 1.00 . A A . 14 LEU CD1 1 1 14 5883 1 1 14 LEU CD2 C 2.308 -3.730 -3.708 1.00 . A A . 14 LEU CD2 1 1 14 5884 1 1 14 LEU CG C 1.915 -4.280 -2.334 1.00 . A A . 14 LEU CG 1 1 14 5885 1 1 14 LEU H H 0.066 -1.788 0.145 1.00 . A A . 14 LEU H 1 1 14 5886 1 1 14 LEU HA H 2.440 -3.392 0.108 1.00 . A A . 14 LEU HA 1 1 14 5887 1 1 14 LEU HB2 H 0.229 -3.682 -1.140 1.00 . A A . 14 LEU HB2 1 1 14 5888 1 1 14 LEU HB3 H 0.801 -2.445 -2.259 1.00 . A A . 14 LEU HB3 1 1 14 5889 1 1 14 LEU HD11 H 0.182 -5.303 -3.084 1.00 . A A . 14 LEU HD11 1 1 14 5890 1 1 14 LEU HD12 H 0.785 -5.928 -1.549 1.00 . A A . 14 LEU HD12 1 1 14 5891 1 1 14 LEU HD13 H 1.645 -6.287 -3.045 1.00 . A A . 14 LEU HD13 1 1 14 5892 1 1 14 LEU HD21 H 2.779 -2.765 -3.589 1.00 . A A . 14 LEU HD21 1 1 14 5893 1 1 14 LEU HD22 H 1.425 -3.625 -4.321 1.00 . A A . 14 LEU HD22 1 1 14 5894 1 1 14 LEU HD23 H 2.997 -4.411 -4.184 1.00 . A A . 14 LEU HD23 1 1 14 5895 1 1 14 LEU HG H 2.807 -4.523 -1.773 1.00 . A A . 14 LEU HG 1 1 14 5896 1 1 14 LEU N N 1.013 -1.843 0.397 1.00 . A A . 14 LEU N 1 1 14 5897 1 1 14 LEU O O 4.207 -1.949 -1.026 1.00 . A A . 14 LEU O 1 1 14 5898 1 1 15 VAL C C 4.403 1.067 -1.028 1.00 . A A . 15 VAL C 1 1 14 5899 1 1 15 VAL CA C 3.555 0.442 -2.146 1.00 . A A . 15 VAL CA 1 1 14 5900 1 1 15 VAL CB C 2.681 1.504 -2.830 1.00 . A A . 15 VAL CB 1 1 14 5901 1 1 15 VAL CG1 C 3.553 2.676 -3.295 1.00 . A A . 15 VAL CG1 1 1 14 5902 1 1 15 VAL CG2 C 1.982 0.887 -4.046 1.00 . A A . 15 VAL CG2 1 1 14 5903 1 1 15 VAL H H 1.633 -0.347 -1.556 1.00 . A A . 15 VAL H 1 1 14 5904 1 1 15 VAL HA H 4.191 -0.038 -2.875 1.00 . A A . 15 VAL HA 1 1 14 5905 1 1 15 VAL HB H 1.939 1.863 -2.131 1.00 . A A . 15 VAL HB 1 1 14 5906 1 1 15 VAL HG11 H 4.490 2.299 -3.677 1.00 . A A . 15 VAL HG11 1 1 14 5907 1 1 15 VAL HG12 H 3.744 3.334 -2.459 1.00 . A A . 15 VAL HG12 1 1 14 5908 1 1 15 VAL HG13 H 3.039 3.221 -4.072 1.00 . A A . 15 VAL HG13 1 1 14 5909 1 1 15 VAL HG21 H 1.202 0.219 -3.713 1.00 . A A . 15 VAL HG21 1 1 14 5910 1 1 15 VAL HG22 H 2.701 0.336 -4.634 1.00 . A A . 15 VAL HG22 1 1 14 5911 1 1 15 VAL HG23 H 1.549 1.672 -4.649 1.00 . A A . 15 VAL HG23 1 1 14 5912 1 1 15 VAL N N 2.593 -0.545 -1.563 1.00 . A A . 15 VAL N 1 1 14 5913 1 1 15 VAL O O 5.571 1.354 -1.212 1.00 . A A . 15 VAL O 1 1 14 5914 1 1 16 PHE C C 5.743 0.949 1.680 1.00 . A A . 16 PHE C 1 1 14 5915 1 1 16 PHE CA C 4.584 1.869 1.272 1.00 . A A . 16 PHE CA 1 1 14 5916 1 1 16 PHE CB C 3.569 1.997 2.411 1.00 . A A . 16 PHE CB 1 1 14 5917 1 1 16 PHE CD1 C 3.765 4.374 3.234 1.00 . A A . 16 PHE CD1 1 1 14 5918 1 1 16 PHE CD2 C 4.796 2.603 4.530 1.00 . A A . 16 PHE CD2 1 1 14 5919 1 1 16 PHE CE1 C 4.215 5.318 4.165 1.00 . A A . 16 PHE CE1 1 1 14 5920 1 1 16 PHE CE2 C 5.245 3.547 5.461 1.00 . A A . 16 PHE CE2 1 1 14 5921 1 1 16 PHE CG C 4.056 3.016 3.415 1.00 . A A . 16 PHE CG 1 1 14 5922 1 1 16 PHE CZ C 4.956 4.904 5.279 1.00 . A A . 16 PHE CZ 1 1 14 5923 1 1 16 PHE H H 2.877 1.025 0.253 1.00 . A A . 16 PHE H 1 1 14 5924 1 1 16 PHE HA H 4.958 2.844 1.000 1.00 . A A . 16 PHE HA 1 1 14 5925 1 1 16 PHE HB2 H 2.617 2.314 2.011 1.00 . A A . 16 PHE HB2 1 1 14 5926 1 1 16 PHE HB3 H 3.453 1.040 2.898 1.00 . A A . 16 PHE HB3 1 1 14 5927 1 1 16 PHE HD1 H 3.193 4.694 2.375 1.00 . A A . 16 PHE HD1 1 1 14 5928 1 1 16 PHE HD2 H 5.021 1.557 4.671 1.00 . A A . 16 PHE HD2 1 1 14 5929 1 1 16 PHE HE1 H 3.990 6.365 4.024 1.00 . A A . 16 PHE HE1 1 1 14 5930 1 1 16 PHE HE2 H 5.817 3.228 6.321 1.00 . A A . 16 PHE HE2 1 1 14 5931 1 1 16 PHE HZ H 5.303 5.632 5.997 1.00 . A A . 16 PHE HZ 1 1 14 5932 1 1 16 PHE N N 3.821 1.271 0.132 1.00 . A A . 16 PHE N 1 1 14 5933 1 1 16 PHE O O 6.815 1.411 2.016 1.00 . A A . 16 PHE O 1 1 14 5934 1 1 17 GLY C C 7.797 -1.133 1.048 1.00 . A A . 17 GLY C 1 1 14 5935 1 1 17 GLY CA C 6.629 -1.299 2.019 1.00 . A A . 17 GLY CA 1 1 14 5936 1 1 17 GLY H H 4.664 -0.697 1.362 1.00 . A A . 17 GLY H 1 1 14 5937 1 1 17 GLY HA2 H 6.962 -1.085 3.024 1.00 . A A . 17 GLY HA2 1 1 14 5938 1 1 17 GLY HA3 H 6.262 -2.312 1.966 1.00 . A A . 17 GLY HA3 1 1 14 5939 1 1 17 GLY N N 5.537 -0.348 1.643 1.00 . A A . 17 GLY N 1 1 14 5940 1 1 17 GLY O O 8.940 -1.034 1.455 1.00 . A A . 17 GLY O 1 1 14 5941 1 1 18 GLU C C 9.310 0.442 -0.999 1.00 . A A . 18 GLU C 1 1 14 5942 1 1 18 GLU CA C 8.619 -0.904 -1.233 1.00 . A A . 18 GLU CA 1 1 14 5943 1 1 18 GLU CB C 7.930 -0.939 -2.602 1.00 . A A . 18 GLU CB 1 1 14 5944 1 1 18 GLU CD C 9.227 -2.679 -3.855 1.00 . A A . 18 GLU CD 1 1 14 5945 1 1 18 GLU CG C 8.970 -1.176 -3.703 1.00 . A A . 18 GLU CG 1 1 14 5946 1 1 18 GLU H H 6.588 -1.154 -0.535 1.00 . A A . 18 GLU H 1 1 14 5947 1 1 18 GLU HA H 9.332 -1.704 -1.151 1.00 . A A . 18 GLU HA 1 1 14 5948 1 1 18 GLU HB2 H 7.203 -1.738 -2.618 1.00 . A A . 18 GLU HB2 1 1 14 5949 1 1 18 GLU HB3 H 7.433 0.003 -2.778 1.00 . A A . 18 GLU HB3 1 1 14 5950 1 1 18 GLU HG2 H 8.602 -0.777 -4.636 1.00 . A A . 18 GLU HG2 1 1 14 5951 1 1 18 GLU HG3 H 9.893 -0.680 -3.438 1.00 . A A . 18 GLU HG3 1 1 14 5952 1 1 18 GLU N N 7.520 -1.084 -0.233 1.00 . A A . 18 GLU N 1 1 14 5953 1 1 18 GLU O O 10.516 0.555 -1.102 1.00 . A A . 18 GLU O 1 1 14 5954 1 1 18 GLU OE1 O 8.479 -3.318 -4.575 1.00 . A A . 18 GLU OE1 1 1 14 5955 1 1 18 GLU OE2 O 10.171 -3.163 -3.252 1.00 . A A . 18 GLU OE2 1 1 14 5956 1 1 19 ASN C C 9.989 2.725 0.896 1.00 . A A . 19 ASN C 1 1 14 5957 1 1 19 ASN CA C 9.158 2.794 -0.387 1.00 . A A . 19 ASN CA 1 1 14 5958 1 1 19 ASN CB C 7.976 3.751 -0.213 1.00 . A A . 19 ASN CB 1 1 14 5959 1 1 19 ASN CG C 7.601 4.348 -1.569 1.00 . A A . 19 ASN CG 1 1 14 5960 1 1 19 ASN H H 7.586 1.324 -0.567 1.00 . A A . 19 ASN H 1 1 14 5961 1 1 19 ASN HA H 9.771 3.105 -1.214 1.00 . A A . 19 ASN HA 1 1 14 5962 1 1 19 ASN HB2 H 7.131 3.213 0.191 1.00 . A A . 19 ASN HB2 1 1 14 5963 1 1 19 ASN HB3 H 8.253 4.547 0.463 1.00 . A A . 19 ASN HB3 1 1 14 5964 1 1 19 ASN HD21 H 6.338 2.884 -2.026 1.00 . A A . 19 ASN HD21 1 1 14 5965 1 1 19 ASN HD22 H 6.494 4.101 -3.198 1.00 . A A . 19 ASN HD22 1 1 14 5966 1 1 19 ASN N N 8.553 1.454 -0.659 1.00 . A A . 19 ASN N 1 1 14 5967 1 1 19 ASN ND2 N 6.740 3.727 -2.327 1.00 . A A . 19 ASN ND2 1 1 14 5968 1 1 19 ASN O O 11.051 3.310 0.995 1.00 . A A . 19 ASN O 1 1 14 5969 1 1 19 ASN OD1 O 8.098 5.391 -1.945 1.00 . A A . 19 ASN OD1 1 1 14 5970 1 1 20 GLY C C 11.569 1.103 2.893 1.00 . A A . 20 GLY C 1 1 14 5971 1 1 20 GLY CA C 10.259 1.848 3.156 1.00 . A A . 20 GLY CA 1 1 14 5972 1 1 20 GLY H H 8.658 1.526 1.753 1.00 . A A . 20 GLY H 1 1 14 5973 1 1 20 GLY HA2 H 10.473 2.828 3.559 1.00 . A A . 20 GLY HA2 1 1 14 5974 1 1 20 GLY HA3 H 9.664 1.288 3.860 1.00 . A A . 20 GLY HA3 1 1 14 5975 1 1 20 GLY N N 9.511 1.993 1.872 1.00 . A A . 20 GLY N 1 1 14 5976 1 1 20 GLY O O 12.613 1.478 3.394 1.00 . A A . 20 GLY O 1 1 14 5977 1 1 21 VAL C C 13.779 0.192 1.045 1.00 . A A . 21 VAL C 1 1 14 5978 1 1 21 VAL CA C 12.782 -0.707 1.793 1.00 . A A . 21 VAL CA 1 1 14 5979 1 1 21 VAL CB C 12.341 -1.885 0.910 1.00 . A A . 21 VAL CB 1 1 14 5980 1 1 21 VAL CG1 C 13.572 -2.616 0.367 1.00 . A A . 21 VAL CG1 1 1 14 5981 1 1 21 VAL CG2 C 11.501 -2.863 1.738 1.00 . A A . 21 VAL CG2 1 1 14 5982 1 1 21 VAL H H 10.670 -0.226 1.698 1.00 . A A . 21 VAL H 1 1 14 5983 1 1 21 VAL HA H 13.224 -1.075 2.702 1.00 . A A . 21 VAL HA 1 1 14 5984 1 1 21 VAL HB H 11.752 -1.512 0.084 1.00 . A A . 21 VAL HB 1 1 14 5985 1 1 21 VAL HG11 H 13.280 -3.585 -0.007 1.00 . A A . 21 VAL HG11 1 1 14 5986 1 1 21 VAL HG12 H 14.297 -2.739 1.159 1.00 . A A . 21 VAL HG12 1 1 14 5987 1 1 21 VAL HG13 H 14.010 -2.038 -0.433 1.00 . A A . 21 VAL HG13 1 1 14 5988 1 1 21 VAL HG21 H 11.104 -2.355 2.605 1.00 . A A . 21 VAL HG21 1 1 14 5989 1 1 21 VAL HG22 H 12.118 -3.689 2.058 1.00 . A A . 21 VAL HG22 1 1 14 5990 1 1 21 VAL HG23 H 10.685 -3.235 1.135 1.00 . A A . 21 VAL HG23 1 1 14 5991 1 1 21 VAL N N 11.527 0.055 2.099 1.00 . A A . 21 VAL N 1 1 14 5992 1 1 21 VAL O O 14.979 0.056 1.190 1.00 . A A . 21 VAL O 1 1 14 5993 1 1 22 PHE C C 14.828 3.057 0.438 1.00 . A A . 22 PHE C 1 1 14 5994 1 1 22 PHE CA C 14.190 2.029 -0.505 1.00 . A A . 22 PHE CA 1 1 14 5995 1 1 22 PHE CB C 13.290 2.725 -1.530 1.00 . A A . 22 PHE CB 1 1 14 5996 1 1 22 PHE CD1 C 14.600 2.527 -3.676 1.00 . A A . 22 PHE CD1 1 1 14 5997 1 1 22 PHE CD2 C 14.474 4.686 -2.581 1.00 . A A . 22 PHE CD2 1 1 14 5998 1 1 22 PHE CE1 C 15.390 3.085 -4.688 1.00 . A A . 22 PHE CE1 1 1 14 5999 1 1 22 PHE CE2 C 15.265 5.245 -3.592 1.00 . A A . 22 PHE CE2 1 1 14 6000 1 1 22 PHE CG C 14.142 3.327 -2.623 1.00 . A A . 22 PHE CG 1 1 14 6001 1 1 22 PHE CZ C 15.724 4.444 -4.645 1.00 . A A . 22 PHE CZ 1 1 14 6002 1 1 22 PHE H H 12.314 1.199 0.163 1.00 . A A . 22 PHE H 1 1 14 6003 1 1 22 PHE HA H 14.952 1.465 -1.009 1.00 . A A . 22 PHE HA 1 1 14 6004 1 1 22 PHE HB2 H 12.610 2.003 -1.960 1.00 . A A . 22 PHE HB2 1 1 14 6005 1 1 22 PHE HB3 H 12.724 3.506 -1.044 1.00 . A A . 22 PHE HB3 1 1 14 6006 1 1 22 PHE HD1 H 14.343 1.477 -3.710 1.00 . A A . 22 PHE HD1 1 1 14 6007 1 1 22 PHE HD2 H 14.121 5.305 -1.770 1.00 . A A . 22 PHE HD2 1 1 14 6008 1 1 22 PHE HE1 H 15.744 2.467 -5.500 1.00 . A A . 22 PHE HE1 1 1 14 6009 1 1 22 PHE HE2 H 15.523 6.293 -3.560 1.00 . A A . 22 PHE HE2 1 1 14 6010 1 1 22 PHE HZ H 16.334 4.875 -5.425 1.00 . A A . 22 PHE HZ 1 1 14 6011 1 1 22 PHE N N 13.285 1.111 0.254 1.00 . A A . 22 PHE N 1 1 14 6012 1 1 22 PHE O O 15.902 3.567 0.176 1.00 . A A . 22 PHE O 1 1 14 6013 1 1 23 PHE C C 15.668 3.623 3.514 1.00 . A A . 23 PHE C 1 1 14 6014 1 1 23 PHE CA C 14.751 4.338 2.508 1.00 . A A . 23 PHE CA 1 1 14 6015 1 1 23 PHE CB C 13.532 4.944 3.214 1.00 . A A . 23 PHE CB 1 1 14 6016 1 1 23 PHE CD1 C 12.572 6.033 1.146 1.00 . A A . 23 PHE CD1 1 1 14 6017 1 1 23 PHE CD2 C 13.094 7.424 3.063 1.00 . A A . 23 PHE CD2 1 1 14 6018 1 1 23 PHE CE1 C 12.129 7.161 0.448 1.00 . A A . 23 PHE CE1 1 1 14 6019 1 1 23 PHE CE2 C 12.651 8.553 2.363 1.00 . A A . 23 PHE CE2 1 1 14 6020 1 1 23 PHE CG C 13.055 6.164 2.455 1.00 . A A . 23 PHE CG 1 1 14 6021 1 1 23 PHE CZ C 12.169 8.421 1.055 1.00 . A A . 23 PHE CZ 1 1 14 6022 1 1 23 PHE H H 13.326 2.921 1.727 1.00 . A A . 23 PHE H 1 1 14 6023 1 1 23 PHE HA H 15.295 5.110 1.986 1.00 . A A . 23 PHE HA 1 1 14 6024 1 1 23 PHE HB2 H 12.738 4.213 3.254 1.00 . A A . 23 PHE HB2 1 1 14 6025 1 1 23 PHE HB3 H 13.806 5.231 4.218 1.00 . A A . 23 PHE HB3 1 1 14 6026 1 1 23 PHE HD1 H 12.542 5.061 0.677 1.00 . A A . 23 PHE HD1 1 1 14 6027 1 1 23 PHE HD2 H 13.466 7.526 4.072 1.00 . A A . 23 PHE HD2 1 1 14 6028 1 1 23 PHE HE1 H 11.757 7.058 -0.561 1.00 . A A . 23 PHE HE1 1 1 14 6029 1 1 23 PHE HE2 H 12.681 9.525 2.831 1.00 . A A . 23 PHE HE2 1 1 14 6030 1 1 23 PHE HZ H 11.827 9.291 0.516 1.00 . A A . 23 PHE HZ 1 1 14 6031 1 1 23 PHE N N 14.182 3.353 1.537 1.00 . A A . 23 PHE N 1 1 14 6032 1 1 23 PHE O O 15.692 3.947 4.686 1.00 . A A . 23 PHE O 1 1 14 6033 1 1 24 TYR C C 18.648 1.567 3.222 1.00 . A A . 24 TYR C 1 1 14 6034 1 1 24 TYR CA C 17.346 1.909 3.965 1.00 . A A . 24 TYR CA 1 1 14 6035 1 1 24 TYR CB C 16.580 0.633 4.338 1.00 . A A . 24 TYR CB 1 1 14 6036 1 1 24 TYR CD1 C 17.170 0.414 6.780 1.00 . A A . 24 TYR CD1 1 1 14 6037 1 1 24 TYR CD2 C 14.887 0.968 6.177 1.00 . A A . 24 TYR CD2 1 1 14 6038 1 1 24 TYR CE1 C 16.820 0.447 8.135 1.00 . A A . 24 TYR CE1 1 1 14 6039 1 1 24 TYR CE2 C 14.537 1.002 7.533 1.00 . A A . 24 TYR CE2 1 1 14 6040 1 1 24 TYR CG C 16.203 0.673 5.801 1.00 . A A . 24 TYR CG 1 1 14 6041 1 1 24 TYR CZ C 15.504 0.741 8.512 1.00 . A A . 24 TYR CZ 1 1 14 6042 1 1 24 TYR H H 16.389 2.415 2.109 1.00 . A A . 24 TYR H 1 1 14 6043 1 1 24 TYR HA H 17.557 2.488 4.850 1.00 . A A . 24 TYR HA 1 1 14 6044 1 1 24 TYR HB2 H 15.685 0.564 3.738 1.00 . A A . 24 TYR HB2 1 1 14 6045 1 1 24 TYR HB3 H 17.202 -0.229 4.153 1.00 . A A . 24 TYR HB3 1 1 14 6046 1 1 24 TYR HD1 H 18.185 0.187 6.489 1.00 . A A . 24 TYR HD1 1 1 14 6047 1 1 24 TYR HD2 H 14.141 1.169 5.422 1.00 . A A . 24 TYR HD2 1 1 14 6048 1 1 24 TYR HE1 H 17.566 0.246 8.890 1.00 . A A . 24 TYR HE1 1 1 14 6049 1 1 24 TYR HE2 H 13.522 1.228 7.823 1.00 . A A . 24 TYR HE2 1 1 14 6050 1 1 24 TYR HH H 14.862 -0.104 10.100 1.00 . A A . 24 TYR HH 1 1 14 6051 1 1 24 TYR N N 16.425 2.654 3.057 1.00 . A A . 24 TYR N 1 1 14 6052 1 1 24 TYR O O 19.157 0.465 3.313 1.00 . A A . 24 TYR O 1 1 14 6053 1 1 24 TYR OH O 15.160 0.774 9.848 1.00 . A A . 24 TYR OH 1 1 14 6054 1 1 25 LYS C C 21.673 2.532 2.613 1.00 . A A . 25 LYS C 1 1 14 6055 1 1 25 LYS CA C 20.453 2.251 1.727 1.00 . A A . 25 LYS CA 1 1 14 6056 1 1 25 LYS CB C 20.419 3.218 0.538 1.00 . A A . 25 LYS CB 1 1 14 6057 1 1 25 LYS CD C 20.161 2.267 -1.765 1.00 . A A . 25 LYS CD 1 1 14 6058 1 1 25 LYS CE C 20.454 3.479 -2.657 1.00 . A A . 25 LYS CE 1 1 14 6059 1 1 25 LYS CG C 19.413 2.720 -0.508 1.00 . A A . 25 LYS CG 1 1 14 6060 1 1 25 LYS H H 18.756 3.389 2.426 1.00 . A A . 25 LYS H 1 1 14 6061 1 1 25 LYS HA H 20.475 1.232 1.372 1.00 . A A . 25 LYS HA 1 1 14 6062 1 1 25 LYS HB2 H 20.125 4.199 0.882 1.00 . A A . 25 LYS HB2 1 1 14 6063 1 1 25 LYS HB3 H 21.401 3.273 0.092 1.00 . A A . 25 LYS HB3 1 1 14 6064 1 1 25 LYS HD2 H 21.090 1.794 -1.480 1.00 . A A . 25 LYS HD2 1 1 14 6065 1 1 25 LYS HD3 H 19.551 1.561 -2.309 1.00 . A A . 25 LYS HD3 1 1 14 6066 1 1 25 LYS HE2 H 19.609 3.683 -3.301 1.00 . A A . 25 LYS HE2 1 1 14 6067 1 1 25 LYS HE3 H 20.684 4.344 -2.053 1.00 . A A . 25 LYS HE3 1 1 14 6068 1 1 25 LYS HG2 H 18.854 1.890 -0.101 1.00 . A A . 25 LYS HG2 1 1 14 6069 1 1 25 LYS HG3 H 18.734 3.520 -0.763 1.00 . A A . 25 LYS HG3 1 1 14 6070 1 1 25 LYS HZ1 H 22.439 2.870 -2.833 1.00 . A A . 25 LYS HZ1 1 1 14 6071 1 1 25 LYS HZ2 H 21.908 3.877 -4.094 1.00 . A A . 25 LYS HZ2 1 1 14 6072 1 1 25 LYS HZ3 H 21.418 2.252 -4.039 1.00 . A A . 25 LYS HZ3 1 1 14 6073 1 1 25 LYS N N 19.186 2.510 2.484 1.00 . A A . 25 LYS N 1 1 14 6074 1 1 25 LYS NZ N 21.644 3.090 -3.466 1.00 . A A . 25 LYS NZ 1 1 14 6075 1 1 25 LYS O O 22.482 1.634 2.773 1.00 . A A . 25 LYS O 1 1 14 6076 1 1 25 LYS OXT O 21.777 3.641 3.115 1.00 . A A . 25 LYS OXT 1 1 15 6077 1 1 1 HIS C C -19.734 -6.488 2.883 1.00 . A A . 1 HIS C 1 1 15 6078 1 1 1 HIS CA C -20.967 -6.263 3.767 1.00 . A A . 1 HIS CA 1 1 15 6079 1 1 1 HIS CB C -20.950 -4.850 4.360 1.00 . A A . 1 HIS CB 1 1 15 6080 1 1 1 HIS CD2 C -23.459 -4.170 3.965 1.00 . A A . 1 HIS CD2 1 1 15 6081 1 1 1 HIS CE1 C -24.044 -3.904 6.034 1.00 . A A . 1 HIS CE1 1 1 15 6082 1 1 1 HIS CG C -22.350 -4.440 4.729 1.00 . A A . 1 HIS CG 1 1 15 6083 1 1 1 HIS HA H -21.870 -6.412 3.197 1.00 . A A . 1 HIS HA 1 1 15 6084 1 1 1 HIS HB2 H -20.327 -4.837 5.242 1.00 . A A . 1 HIS HB2 1 1 15 6085 1 1 1 HIS HB3 H -20.554 -4.159 3.631 1.00 . A A . 1 HIS HB3 1 1 15 6086 1 1 1 HIS HD1 H -22.185 -4.378 6.841 1.00 . A A . 1 HIS HD1 1 1 15 6087 1 1 1 HIS HD2 H -23.497 -4.212 2.886 1.00 . A A . 1 HIS HD2 1 1 15 6088 1 1 1 HIS HE1 H -24.624 -3.699 6.923 1.00 . A A . 1 HIS HE1 1 1 15 6089 1 1 1 HIS N N -20.939 -7.187 4.944 1.00 . A A . 1 HIS N 1 1 15 6090 1 1 1 HIS ND1 N -22.747 -4.264 6.047 1.00 . A A . 1 HIS ND1 1 1 15 6091 1 1 1 HIS NE2 N -24.527 -3.832 4.791 1.00 . A A . 1 HIS NE2 1 1 15 6092 1 1 1 HIS O O -18.791 -7.152 3.275 1.00 . A A . 1 HIS O 1 1 15 6093 1 1 2 ALA C C -17.389 -5.245 1.243 1.00 . A A . 2 ALA C 1 1 15 6094 1 1 2 ALA CA C -18.563 -6.115 0.779 1.00 . A A . 2 ALA CA 1 1 15 6095 1 1 2 ALA CB C -19.056 -5.660 -0.597 1.00 . A A . 2 ALA CB 1 1 15 6096 1 1 2 ALA H H -20.506 -5.406 1.403 1.00 . A A . 2 ALA H 1 1 15 6097 1 1 2 ALA HA H -18.271 -7.152 0.740 1.00 . A A . 2 ALA HA 1 1 15 6098 1 1 2 ALA HB1 H -19.352 -4.622 -0.548 1.00 . A A . 2 ALA HB1 1 1 15 6099 1 1 2 ALA HB2 H -19.903 -6.262 -0.893 1.00 . A A . 2 ALA HB2 1 1 15 6100 1 1 2 ALA HB3 H -18.262 -5.775 -1.319 1.00 . A A . 2 ALA HB3 1 1 15 6101 1 1 2 ALA N N -19.735 -5.938 1.694 1.00 . A A . 2 ALA N 1 1 15 6102 1 1 2 ALA O O -17.573 -4.137 1.712 1.00 . A A . 2 ALA O 1 1 15 6103 1 1 3 TRP C C -14.436 -4.141 0.364 1.00 . A A . 3 TRP C 1 1 15 6104 1 1 3 TRP CA C -14.993 -4.943 1.548 1.00 . A A . 3 TRP CA 1 1 15 6105 1 1 3 TRP CB C -13.971 -5.973 2.042 1.00 . A A . 3 TRP CB 1 1 15 6106 1 1 3 TRP CD1 C -13.970 -5.852 4.570 1.00 . A A . 3 TRP CD1 1 1 15 6107 1 1 3 TRP CD2 C -15.185 -7.577 3.789 1.00 . A A . 3 TRP CD2 1 1 15 6108 1 1 3 TRP CE2 C -15.269 -7.627 5.201 1.00 . A A . 3 TRP CE2 1 1 15 6109 1 1 3 TRP CE3 C -15.868 -8.560 3.050 1.00 . A A . 3 TRP CE3 1 1 15 6110 1 1 3 TRP CG C -14.354 -6.440 3.413 1.00 . A A . 3 TRP CG 1 1 15 6111 1 1 3 TRP CH2 C -16.675 -9.585 5.106 1.00 . A A . 3 TRP CH2 1 1 15 6112 1 1 3 TRP CZ2 C -16.004 -8.616 5.855 1.00 . A A . 3 TRP CZ2 1 1 15 6113 1 1 3 TRP CZ3 C -16.608 -9.557 3.706 1.00 . A A . 3 TRP CZ3 1 1 15 6114 1 1 3 TRP H H -16.060 -6.635 0.733 1.00 . A A . 3 TRP H 1 1 15 6115 1 1 3 TRP HA H -15.263 -4.278 2.354 1.00 . A A . 3 TRP HA 1 1 15 6116 1 1 3 TRP HB2 H -13.952 -6.816 1.367 1.00 . A A . 3 TRP HB2 1 1 15 6117 1 1 3 TRP HB3 H -12.992 -5.519 2.078 1.00 . A A . 3 TRP HB3 1 1 15 6118 1 1 3 TRP HD1 H -13.343 -4.976 4.651 1.00 . A A . 3 TRP HD1 1 1 15 6119 1 1 3 TRP HE1 H -14.386 -6.335 6.578 1.00 . A A . 3 TRP HE1 1 1 15 6120 1 1 3 TRP HE3 H -15.823 -8.547 1.971 1.00 . A A . 3 TRP HE3 1 1 15 6121 1 1 3 TRP HH2 H -17.246 -10.354 5.604 1.00 . A A . 3 TRP HH2 1 1 15 6122 1 1 3 TRP HZ2 H -16.052 -8.633 6.935 1.00 . A A . 3 TRP HZ2 1 1 15 6123 1 1 3 TRP HZ3 H -17.129 -10.306 3.127 1.00 . A A . 3 TRP HZ3 1 1 15 6124 1 1 3 TRP N N -16.183 -5.740 1.115 1.00 . A A . 3 TRP N 1 1 15 6125 1 1 3 TRP NE1 N -14.512 -6.554 5.630 1.00 . A A . 3 TRP NE1 1 1 15 6126 1 1 3 TRP O O -13.453 -4.514 -0.248 1.00 . A A . 3 TRP O 1 1 15 6127 1 1 4 TYR C C -13.669 -1.069 -0.591 1.00 . A A . 4 TYR C 1 1 15 6128 1 1 4 TYR CA C -14.583 -2.198 -1.097 1.00 . A A . 4 TYR CA 1 1 15 6129 1 1 4 TYR CB C -15.854 -1.639 -1.761 1.00 . A A . 4 TYR CB 1 1 15 6130 1 1 4 TYR CD1 C -17.382 -0.812 0.074 1.00 . A A . 4 TYR CD1 1 1 15 6131 1 1 4 TYR CD2 C -16.071 0.807 -1.169 1.00 . A A . 4 TYR CD2 1 1 15 6132 1 1 4 TYR CE1 C -17.933 0.223 0.837 1.00 . A A . 4 TYR CE1 1 1 15 6133 1 1 4 TYR CE2 C -16.624 1.840 -0.407 1.00 . A A . 4 TYR CE2 1 1 15 6134 1 1 4 TYR CG C -16.449 -0.521 -0.929 1.00 . A A . 4 TYR CG 1 1 15 6135 1 1 4 TYR CZ C -17.555 1.548 0.597 1.00 . A A . 4 TYR CZ 1 1 15 6136 1 1 4 TYR H H -15.853 -2.763 0.557 1.00 . A A . 4 TYR H 1 1 15 6137 1 1 4 TYR HA H -14.047 -2.811 -1.801 1.00 . A A . 4 TYR HA 1 1 15 6138 1 1 4 TYR HB2 H -15.604 -1.259 -2.741 1.00 . A A . 4 TYR HB2 1 1 15 6139 1 1 4 TYR HB3 H -16.579 -2.432 -1.864 1.00 . A A . 4 TYR HB3 1 1 15 6140 1 1 4 TYR HD1 H -17.674 -1.834 0.260 1.00 . A A . 4 TYR HD1 1 1 15 6141 1 1 4 TYR HD2 H -15.351 1.031 -1.943 1.00 . A A . 4 TYR HD2 1 1 15 6142 1 1 4 TYR HE1 H -18.652 -0.002 1.611 1.00 . A A . 4 TYR HE1 1 1 15 6143 1 1 4 TYR HE2 H -16.332 2.864 -0.591 1.00 . A A . 4 TYR HE2 1 1 15 6144 1 1 4 TYR HH H -18.856 2.919 0.872 1.00 . A A . 4 TYR HH 1 1 15 6145 1 1 4 TYR N N -15.066 -3.039 0.044 1.00 . A A . 4 TYR N 1 1 15 6146 1 1 4 TYR O O -13.037 -0.382 -1.373 1.00 . A A . 4 TYR O 1 1 15 6147 1 1 4 TYR OH O -18.101 2.569 1.349 1.00 . A A . 4 TYR OH 1 1 15 6148 1 1 5 SER C C -11.481 -0.433 1.966 1.00 . A A . 5 SER C 1 1 15 6149 1 1 5 SER CA C -12.698 0.185 1.262 1.00 . A A . 5 SER CA 1 1 15 6150 1 1 5 SER CB C -13.571 0.937 2.267 1.00 . A A . 5 SER CB 1 1 15 6151 1 1 5 SER H H -14.090 -1.459 1.313 1.00 . A A . 5 SER H 1 1 15 6152 1 1 5 SER HA H -12.379 0.854 0.479 1.00 . A A . 5 SER HA 1 1 15 6153 1 1 5 SER HB2 H -14.159 0.235 2.834 1.00 . A A . 5 SER HB2 1 1 15 6154 1 1 5 SER HB3 H -12.938 1.501 2.941 1.00 . A A . 5 SER HB3 1 1 15 6155 1 1 5 SER HG H -15.051 2.196 2.201 1.00 . A A . 5 SER HG 1 1 15 6156 1 1 5 SER N N -13.582 -0.885 0.705 1.00 . A A . 5 SER N 1 1 15 6157 1 1 5 SER O O -10.813 0.220 2.743 1.00 . A A . 5 SER O 1 1 15 6158 1 1 5 SER OG O -14.439 1.816 1.567 1.00 . A A . 5 SER OG 1 1 15 6159 1 1 6 HIS C C -8.886 -2.532 1.338 1.00 . A A . 6 HIS C 1 1 15 6160 1 1 6 HIS CA C -10.012 -2.340 2.353 1.00 . A A . 6 HIS CA 1 1 15 6161 1 1 6 HIS CB C -10.530 -3.693 2.853 1.00 . A A . 6 HIS CB 1 1 15 6162 1 1 6 HIS CD2 C -10.754 -4.220 5.420 1.00 . A A . 6 HIS CD2 1 1 15 6163 1 1 6 HIS CE1 C -12.269 -2.752 5.915 1.00 . A A . 6 HIS CE1 1 1 15 6164 1 1 6 HIS CG C -11.053 -3.551 4.259 1.00 . A A . 6 HIS CG 1 1 15 6165 1 1 6 HIS H H -11.738 -2.193 1.069 1.00 . A A . 6 HIS H 1 1 15 6166 1 1 6 HIS HA H -9.666 -1.747 3.179 1.00 . A A . 6 HIS HA 1 1 15 6167 1 1 6 HIS HB2 H -11.326 -4.035 2.208 1.00 . A A . 6 HIS HB2 1 1 15 6168 1 1 6 HIS HB3 H -9.725 -4.412 2.842 1.00 . A A . 6 HIS HB3 1 1 15 6169 1 1 6 HIS HD1 H -12.450 -1.978 3.994 1.00 . A A . 6 HIS HD1 1 1 15 6170 1 1 6 HIS HD2 H -10.032 -5.018 5.509 1.00 . A A . 6 HIS HD2 1 1 15 6171 1 1 6 HIS HE1 H -12.983 -2.154 6.462 1.00 . A A . 6 HIS HE1 1 1 15 6172 1 1 6 HIS N N -11.188 -1.684 1.700 1.00 . A A . 6 HIS N 1 1 15 6173 1 1 6 HIS ND1 N -12.023 -2.619 4.600 1.00 . A A . 6 HIS ND1 1 1 15 6174 1 1 6 HIS NE2 N -11.522 -3.714 6.465 1.00 . A A . 6 HIS NE2 1 1 15 6175 1 1 6 HIS O O -7.727 -2.307 1.636 1.00 . A A . 6 HIS O 1 1 15 6176 1 1 7 TYR C C -7.457 -1.804 -1.181 1.00 . A A . 7 TYR C 1 1 15 6177 1 1 7 TYR CA C -8.172 -3.130 -0.913 1.00 . A A . 7 TYR CA 1 1 15 6178 1 1 7 TYR CB C -8.923 -3.602 -2.163 1.00 . A A . 7 TYR CB 1 1 15 6179 1 1 7 TYR CD1 C -8.601 -6.084 -1.841 1.00 . A A . 7 TYR CD1 1 1 15 6180 1 1 7 TYR CD2 C -10.854 -5.188 -1.830 1.00 . A A . 7 TYR CD2 1 1 15 6181 1 1 7 TYR CE1 C -9.112 -7.371 -1.634 1.00 . A A . 7 TYR CE1 1 1 15 6182 1 1 7 TYR CE2 C -11.365 -6.475 -1.623 1.00 . A A . 7 TYR CE2 1 1 15 6183 1 1 7 TYR CG C -9.473 -4.993 -1.939 1.00 . A A . 7 TYR CG 1 1 15 6184 1 1 7 TYR CZ C -10.494 -7.566 -1.525 1.00 . A A . 7 TYR CZ 1 1 15 6185 1 1 7 TYR H H -10.161 -3.097 -0.071 1.00 . A A . 7 TYR H 1 1 15 6186 1 1 7 TYR HA H -7.465 -3.876 -0.600 1.00 . A A . 7 TYR HA 1 1 15 6187 1 1 7 TYR HB2 H -9.737 -2.922 -2.370 1.00 . A A . 7 TYR HB2 1 1 15 6188 1 1 7 TYR HB3 H -8.246 -3.615 -3.005 1.00 . A A . 7 TYR HB3 1 1 15 6189 1 1 7 TYR HD1 H -7.534 -5.934 -1.925 1.00 . A A . 7 TYR HD1 1 1 15 6190 1 1 7 TYR HD2 H -11.527 -4.347 -1.906 1.00 . A A . 7 TYR HD2 1 1 15 6191 1 1 7 TYR HE1 H -8.441 -8.214 -1.558 1.00 . A A . 7 TYR HE1 1 1 15 6192 1 1 7 TYR HE2 H -12.431 -6.625 -1.539 1.00 . A A . 7 TYR HE2 1 1 15 6193 1 1 7 TYR HH H -11.031 -9.282 -2.170 1.00 . A A . 7 TYR HH 1 1 15 6194 1 1 7 TYR N N -9.221 -2.933 0.138 1.00 . A A . 7 TYR N 1 1 15 6195 1 1 7 TYR O O -6.252 -1.759 -1.335 1.00 . A A . 7 TYR O 1 1 15 6196 1 1 7 TYR OH O -10.999 -8.834 -1.321 1.00 . A A . 7 TYR OH 1 1 15 6197 1 1 8 VAL C C -6.583 0.935 -0.320 1.00 . A A . 8 VAL C 1 1 15 6198 1 1 8 VAL CA C -7.571 0.615 -1.452 1.00 . A A . 8 VAL CA 1 1 15 6199 1 1 8 VAL CB C -8.739 1.617 -1.478 1.00 . A A . 8 VAL CB 1 1 15 6200 1 1 8 VAL CG1 C -9.416 1.688 -0.103 1.00 . A A . 8 VAL CG1 1 1 15 6201 1 1 8 VAL CG2 C -8.213 3.005 -1.856 1.00 . A A . 8 VAL CG2 1 1 15 6202 1 1 8 VAL H H -9.163 -0.795 -1.075 1.00 . A A . 8 VAL H 1 1 15 6203 1 1 8 VAL HA H -7.061 0.621 -2.398 1.00 . A A . 8 VAL HA 1 1 15 6204 1 1 8 VAL HB H -9.465 1.298 -2.213 1.00 . A A . 8 VAL HB 1 1 15 6205 1 1 8 VAL HG11 H -10.356 2.214 -0.192 1.00 . A A . 8 VAL HG11 1 1 15 6206 1 1 8 VAL HG12 H -8.774 2.216 0.588 1.00 . A A . 8 VAL HG12 1 1 15 6207 1 1 8 VAL HG13 H -9.596 0.690 0.264 1.00 . A A . 8 VAL HG13 1 1 15 6208 1 1 8 VAL HG21 H -7.753 2.961 -2.831 1.00 . A A . 8 VAL HG21 1 1 15 6209 1 1 8 VAL HG22 H -7.483 3.324 -1.127 1.00 . A A . 8 VAL HG22 1 1 15 6210 1 1 8 VAL HG23 H -9.033 3.708 -1.876 1.00 . A A . 8 VAL HG23 1 1 15 6211 1 1 8 VAL N N -8.196 -0.724 -1.217 1.00 . A A . 8 VAL N 1 1 15 6212 1 1 8 VAL O O -5.566 1.570 -0.533 1.00 . A A . 8 VAL O 1 1 15 6213 1 1 9 LEU C C -4.710 -0.167 1.905 1.00 . A A . 9 LEU C 1 1 15 6214 1 1 9 LEU CA C -5.948 0.732 2.024 1.00 . A A . 9 LEU CA 1 1 15 6215 1 1 9 LEU CB C -6.758 0.382 3.279 1.00 . A A . 9 LEU CB 1 1 15 6216 1 1 9 LEU CD1 C -7.286 1.501 5.454 1.00 . A A . 9 LEU CD1 1 1 15 6217 1 1 9 LEU CD2 C -5.187 0.166 5.217 1.00 . A A . 9 LEU CD2 1 1 15 6218 1 1 9 LEU CG C -6.163 1.101 4.495 1.00 . A A . 9 LEU CG 1 1 15 6219 1 1 9 LEU H H -7.688 -0.044 1.014 1.00 . A A . 9 LEU H 1 1 15 6220 1 1 9 LEU HA H -5.657 1.771 2.051 1.00 . A A . 9 LEU HA 1 1 15 6221 1 1 9 LEU HB2 H -7.784 0.693 3.143 1.00 . A A . 9 LEU HB2 1 1 15 6222 1 1 9 LEU HB3 H -6.725 -0.685 3.442 1.00 . A A . 9 LEU HB3 1 1 15 6223 1 1 9 LEU HD11 H -7.888 2.275 5.001 1.00 . A A . 9 LEU HD11 1 1 15 6224 1 1 9 LEU HD12 H -6.857 1.872 6.374 1.00 . A A . 9 LEU HD12 1 1 15 6225 1 1 9 LEU HD13 H -7.904 0.641 5.666 1.00 . A A . 9 LEU HD13 1 1 15 6226 1 1 9 LEU HD21 H -4.621 -0.396 4.489 1.00 . A A . 9 LEU HD21 1 1 15 6227 1 1 9 LEU HD22 H -5.741 -0.515 5.846 1.00 . A A . 9 LEU HD22 1 1 15 6228 1 1 9 LEU HD23 H -4.513 0.750 5.826 1.00 . A A . 9 LEU HD23 1 1 15 6229 1 1 9 LEU HG H -5.638 1.987 4.168 1.00 . A A . 9 LEU HG 1 1 15 6230 1 1 9 LEU N N -6.870 0.479 0.876 1.00 . A A . 9 LEU N 1 1 15 6231 1 1 9 LEU O O -3.602 0.253 2.180 1.00 . A A . 9 LEU O 1 1 15 6232 1 1 10 LYS C C -2.807 -1.834 0.205 1.00 . A A . 10 LYS C 1 1 15 6233 1 1 10 LYS CA C -3.721 -2.323 1.336 1.00 . A A . 10 LYS CA 1 1 15 6234 1 1 10 LYS CB C -4.321 -3.689 0.991 1.00 . A A . 10 LYS CB 1 1 15 6235 1 1 10 LYS CD C -3.444 -5.328 2.666 1.00 . A A . 10 LYS CD 1 1 15 6236 1 1 10 LYS CE C -2.630 -6.619 2.820 1.00 . A A . 10 LYS CE 1 1 15 6237 1 1 10 LYS CG C -3.282 -4.786 1.243 1.00 . A A . 10 LYS CG 1 1 15 6238 1 1 10 LYS H H -5.794 -1.715 1.260 1.00 . A A . 10 LYS H 1 1 15 6239 1 1 10 LYS HA H -3.171 -2.384 2.263 1.00 . A A . 10 LYS HA 1 1 15 6240 1 1 10 LYS HB2 H -5.191 -3.866 1.607 1.00 . A A . 10 LYS HB2 1 1 15 6241 1 1 10 LYS HB3 H -4.609 -3.702 -0.050 1.00 . A A . 10 LYS HB3 1 1 15 6242 1 1 10 LYS HD2 H -3.094 -4.592 3.374 1.00 . A A . 10 LYS HD2 1 1 15 6243 1 1 10 LYS HD3 H -4.487 -5.539 2.853 1.00 . A A . 10 LYS HD3 1 1 15 6244 1 1 10 LYS HE2 H -3.140 -7.305 3.484 1.00 . A A . 10 LYS HE2 1 1 15 6245 1 1 10 LYS HE3 H -2.468 -7.079 1.857 1.00 . A A . 10 LYS HE3 1 1 15 6246 1 1 10 LYS HG2 H -3.426 -5.586 0.532 1.00 . A A . 10 LYS HG2 1 1 15 6247 1 1 10 LYS HG3 H -2.290 -4.376 1.128 1.00 . A A . 10 LYS HG3 1 1 15 6248 1 1 10 LYS HZ1 H -0.704 -7.021 3.505 1.00 . A A . 10 LYS HZ1 1 1 15 6249 1 1 10 LYS HZ2 H -1.490 -5.772 4.346 1.00 . A A . 10 LYS HZ2 1 1 15 6250 1 1 10 LYS HZ3 H -0.874 -5.494 2.787 1.00 . A A . 10 LYS HZ3 1 1 15 6251 1 1 10 LYS N N -4.890 -1.400 1.485 1.00 . A A . 10 LYS N 1 1 15 6252 1 1 10 LYS NZ N -1.327 -6.194 3.409 1.00 . A A . 10 LYS NZ 1 1 15 6253 1 1 10 LYS O O -1.598 -1.881 0.317 1.00 . A A . 10 LYS O 1 1 15 6254 1 1 11 PHE C C -1.682 0.321 -1.552 1.00 . A A . 11 PHE C 1 1 15 6255 1 1 11 PHE CA C -2.552 -0.853 -2.017 1.00 . A A . 11 PHE CA 1 1 15 6256 1 1 11 PHE CB C -3.564 -0.395 -3.074 1.00 . A A . 11 PHE CB 1 1 15 6257 1 1 11 PHE CD1 C -2.186 -0.745 -5.161 1.00 . A A . 11 PHE CD1 1 1 15 6258 1 1 11 PHE CD2 C -2.800 1.515 -4.533 1.00 . A A . 11 PHE CD2 1 1 15 6259 1 1 11 PHE CE1 C -1.510 -0.250 -6.282 1.00 . A A . 11 PHE CE1 1 1 15 6260 1 1 11 PHE CE2 C -2.123 2.010 -5.653 1.00 . A A . 11 PHE CE2 1 1 15 6261 1 1 11 PHE CG C -2.833 0.137 -4.285 1.00 . A A . 11 PHE CG 1 1 15 6262 1 1 11 PHE CZ C -1.478 1.128 -6.527 1.00 . A A . 11 PHE CZ 1 1 15 6263 1 1 11 PHE H H -4.360 -1.327 -0.935 1.00 . A A . 11 PHE H 1 1 15 6264 1 1 11 PHE HA H -1.935 -1.645 -2.413 1.00 . A A . 11 PHE HA 1 1 15 6265 1 1 11 PHE HB2 H -4.181 -1.233 -3.366 1.00 . A A . 11 PHE HB2 1 1 15 6266 1 1 11 PHE HB3 H -4.187 0.383 -2.660 1.00 . A A . 11 PHE HB3 1 1 15 6267 1 1 11 PHE HD1 H -2.211 -1.809 -4.971 1.00 . A A . 11 PHE HD1 1 1 15 6268 1 1 11 PHE HD2 H -3.298 2.196 -3.859 1.00 . A A . 11 PHE HD2 1 1 15 6269 1 1 11 PHE HE1 H -1.011 -0.930 -6.957 1.00 . A A . 11 PHE HE1 1 1 15 6270 1 1 11 PHE HE2 H -2.099 3.073 -5.843 1.00 . A A . 11 PHE HE2 1 1 15 6271 1 1 11 PHE HZ H -0.956 1.510 -7.392 1.00 . A A . 11 PHE HZ 1 1 15 6272 1 1 11 PHE N N -3.381 -1.358 -0.876 1.00 . A A . 11 PHE N 1 1 15 6273 1 1 11 PHE O O -0.499 0.371 -1.828 1.00 . A A . 11 PHE O 1 1 15 6274 1 1 12 PHE C C -0.357 1.921 0.607 1.00 . A A . 12 PHE C 1 1 15 6275 1 1 12 PHE CA C -1.459 2.423 -0.335 1.00 . A A . 12 PHE CA 1 1 15 6276 1 1 12 PHE CB C -2.455 3.310 0.421 1.00 . A A . 12 PHE CB 1 1 15 6277 1 1 12 PHE CD1 C -1.748 5.629 -0.273 1.00 . A A . 12 PHE CD1 1 1 15 6278 1 1 12 PHE CD2 C -3.823 4.731 -1.152 1.00 . A A . 12 PHE CD2 1 1 15 6279 1 1 12 PHE CE1 C -1.957 6.813 -0.990 1.00 . A A . 12 PHE CE1 1 1 15 6280 1 1 12 PHE CE2 C -4.031 5.916 -1.869 1.00 . A A . 12 PHE CE2 1 1 15 6281 1 1 12 PHE CG C -2.681 4.588 -0.353 1.00 . A A . 12 PHE CG 1 1 15 6282 1 1 12 PHE CZ C -3.098 6.957 -1.789 1.00 . A A . 12 PHE CZ 1 1 15 6283 1 1 12 PHE H H -3.213 1.190 -0.617 1.00 . A A . 12 PHE H 1 1 15 6284 1 1 12 PHE HA H -1.029 2.966 -1.163 1.00 . A A . 12 PHE HA 1 1 15 6285 1 1 12 PHE HB2 H -3.393 2.787 0.534 1.00 . A A . 12 PHE HB2 1 1 15 6286 1 1 12 PHE HB3 H -2.056 3.548 1.395 1.00 . A A . 12 PHE HB3 1 1 15 6287 1 1 12 PHE HD1 H -0.868 5.518 0.342 1.00 . A A . 12 PHE HD1 1 1 15 6288 1 1 12 PHE HD2 H -4.544 3.930 -1.215 1.00 . A A . 12 PHE HD2 1 1 15 6289 1 1 12 PHE HE1 H -1.237 7.616 -0.929 1.00 . A A . 12 PHE HE1 1 1 15 6290 1 1 12 PHE HE2 H -4.912 6.027 -2.485 1.00 . A A . 12 PHE HE2 1 1 15 6291 1 1 12 PHE HZ H -3.259 7.870 -2.342 1.00 . A A . 12 PHE HZ 1 1 15 6292 1 1 12 PHE N N -2.258 1.259 -0.836 1.00 . A A . 12 PHE N 1 1 15 6293 1 1 12 PHE O O 0.769 2.378 0.557 1.00 . A A . 12 PHE O 1 1 15 6294 1 1 13 LEU C C 1.384 -0.406 1.609 1.00 . A A . 13 LEU C 1 1 15 6295 1 1 13 LEU CA C 0.345 0.412 2.392 1.00 . A A . 13 LEU CA 1 1 15 6296 1 1 13 LEU CB C -0.443 -0.491 3.353 1.00 . A A . 13 LEU CB 1 1 15 6297 1 1 13 LEU CD1 C 1.472 -0.441 4.974 1.00 . A A . 13 LEU CD1 1 1 15 6298 1 1 13 LEU CD2 C -0.366 1.244 5.163 1.00 . A A . 13 LEU CD2 1 1 15 6299 1 1 13 LEU CG C -0.031 -0.208 4.804 1.00 . A A . 13 LEU CG 1 1 15 6300 1 1 13 LEU H H -1.591 0.613 1.458 1.00 . A A . 13 LEU H 1 1 15 6301 1 1 13 LEU HA H 0.826 1.207 2.939 1.00 . A A . 13 LEU HA 1 1 15 6302 1 1 13 LEU HB2 H -1.500 -0.299 3.239 1.00 . A A . 13 LEU HB2 1 1 15 6303 1 1 13 LEU HB3 H -0.241 -1.526 3.120 1.00 . A A . 13 LEU HB3 1 1 15 6304 1 1 13 LEU HD11 H 1.710 -0.504 6.026 1.00 . A A . 13 LEU HD11 1 1 15 6305 1 1 13 LEU HD12 H 2.017 0.379 4.530 1.00 . A A . 13 LEU HD12 1 1 15 6306 1 1 13 LEU HD13 H 1.751 -1.363 4.486 1.00 . A A . 13 LEU HD13 1 1 15 6307 1 1 13 LEU HD21 H -0.302 1.373 6.233 1.00 . A A . 13 LEU HD21 1 1 15 6308 1 1 13 LEU HD22 H -1.367 1.475 4.832 1.00 . A A . 13 LEU HD22 1 1 15 6309 1 1 13 LEU HD23 H 0.335 1.906 4.678 1.00 . A A . 13 LEU HD23 1 1 15 6310 1 1 13 LEU HG H -0.570 -0.873 5.463 1.00 . A A . 13 LEU HG 1 1 15 6311 1 1 13 LEU N N -0.677 0.970 1.452 1.00 . A A . 13 LEU N 1 1 15 6312 1 1 13 LEU O O 2.548 -0.440 1.959 1.00 . A A . 13 LEU O 1 1 15 6313 1 1 14 LEU C C 2.925 -0.957 -0.975 1.00 . A A . 14 LEU C 1 1 15 6314 1 1 14 LEU CA C 1.921 -1.872 -0.268 1.00 . A A . 14 LEU CA 1 1 15 6315 1 1 14 LEU CB C 1.052 -2.615 -1.295 1.00 . A A . 14 LEU CB 1 1 15 6316 1 1 14 LEU CD1 C 2.924 -4.256 -1.624 1.00 . A A . 14 LEU CD1 1 1 15 6317 1 1 14 LEU CD2 C 1.106 -4.744 0.026 1.00 . A A . 14 LEU CD2 1 1 15 6318 1 1 14 LEU CG C 1.428 -4.102 -1.328 1.00 . A A . 14 LEU CG 1 1 15 6319 1 1 14 LEU H H 0.021 -1.012 0.289 1.00 . A A . 14 LEU H 1 1 15 6320 1 1 14 LEU HA H 2.438 -2.577 0.357 1.00 . A A . 14 LEU HA 1 1 15 6321 1 1 14 LEU HB2 H 0.012 -2.516 -1.025 1.00 . A A . 14 LEU HB2 1 1 15 6322 1 1 14 LEU HB3 H 1.209 -2.186 -2.274 1.00 . A A . 14 LEU HB3 1 1 15 6323 1 1 14 LEU HD11 H 3.206 -3.583 -2.420 1.00 . A A . 14 LEU HD11 1 1 15 6324 1 1 14 LEU HD12 H 3.129 -5.272 -1.925 1.00 . A A . 14 LEU HD12 1 1 15 6325 1 1 14 LEU HD13 H 3.493 -4.022 -0.736 1.00 . A A . 14 LEU HD13 1 1 15 6326 1 1 14 LEU HD21 H 1.048 -5.816 -0.089 1.00 . A A . 14 LEU HD21 1 1 15 6327 1 1 14 LEU HD22 H 0.159 -4.368 0.386 1.00 . A A . 14 LEU HD22 1 1 15 6328 1 1 14 LEU HD23 H 1.883 -4.499 0.735 1.00 . A A . 14 LEU HD23 1 1 15 6329 1 1 14 LEU HG H 0.860 -4.595 -2.104 1.00 . A A . 14 LEU HG 1 1 15 6330 1 1 14 LEU N N 0.966 -1.059 0.549 1.00 . A A . 14 LEU N 1 1 15 6331 1 1 14 LEU O O 4.102 -1.251 -1.041 1.00 . A A . 14 LEU O 1 1 15 6332 1 1 15 VAL C C 4.414 1.662 -1.202 1.00 . A A . 15 VAL C 1 1 15 6333 1 1 15 VAL CA C 3.387 1.103 -2.197 1.00 . A A . 15 VAL CA 1 1 15 6334 1 1 15 VAL CB C 2.482 2.219 -2.740 1.00 . A A . 15 VAL CB 1 1 15 6335 1 1 15 VAL CG1 C 3.338 3.387 -3.241 1.00 . A A . 15 VAL CG1 1 1 15 6336 1 1 15 VAL CG2 C 1.644 1.678 -3.904 1.00 . A A . 15 VAL CG2 1 1 15 6337 1 1 15 VAL H H 1.509 0.361 -1.419 1.00 . A A . 15 VAL H 1 1 15 6338 1 1 15 VAL HA H 3.887 0.604 -3.012 1.00 . A A . 15 VAL HA 1 1 15 6339 1 1 15 VAL HB H 1.826 2.566 -1.954 1.00 . A A . 15 VAL HB 1 1 15 6340 1 1 15 VAL HG11 H 2.763 3.984 -3.934 1.00 . A A . 15 VAL HG11 1 1 15 6341 1 1 15 VAL HG12 H 4.216 3.003 -3.739 1.00 . A A . 15 VAL HG12 1 1 15 6342 1 1 15 VAL HG13 H 3.638 3.998 -2.404 1.00 . A A . 15 VAL HG13 1 1 15 6343 1 1 15 VAL HG21 H 2.284 1.496 -4.754 1.00 . A A . 15 VAL HG21 1 1 15 6344 1 1 15 VAL HG22 H 0.889 2.402 -4.170 1.00 . A A . 15 VAL HG22 1 1 15 6345 1 1 15 VAL HG23 H 1.170 0.755 -3.607 1.00 . A A . 15 VAL HG23 1 1 15 6346 1 1 15 VAL N N 2.464 0.153 -1.495 1.00 . A A . 15 VAL N 1 1 15 6347 1 1 15 VAL O O 5.604 1.670 -1.463 1.00 . A A . 15 VAL O 1 1 15 6348 1 1 16 PHE C C 5.799 1.543 1.510 1.00 . A A . 16 PHE C 1 1 15 6349 1 1 16 PHE CA C 4.910 2.667 0.960 1.00 . A A . 16 PHE CA 1 1 15 6350 1 1 16 PHE CB C 4.019 3.243 2.066 1.00 . A A . 16 PHE CB 1 1 15 6351 1 1 16 PHE CD1 C 5.056 5.521 2.380 1.00 . A A . 16 PHE CD1 1 1 15 6352 1 1 16 PHE CD2 C 5.287 3.880 4.150 1.00 . A A . 16 PHE CD2 1 1 15 6353 1 1 16 PHE CE1 C 5.785 6.444 3.140 1.00 . A A . 16 PHE CE1 1 1 15 6354 1 1 16 PHE CE2 C 6.016 4.803 4.910 1.00 . A A . 16 PHE CE2 1 1 15 6355 1 1 16 PHE CG C 4.807 4.239 2.885 1.00 . A A . 16 PHE CG 1 1 15 6356 1 1 16 PHE CZ C 6.265 6.085 4.404 1.00 . A A . 16 PHE CZ 1 1 15 6357 1 1 16 PHE H H 3.000 2.093 0.131 1.00 . A A . 16 PHE H 1 1 15 6358 1 1 16 PHE HA H 5.514 3.450 0.529 1.00 . A A . 16 PHE HA 1 1 15 6359 1 1 16 PHE HB2 H 3.167 3.737 1.621 1.00 . A A . 16 PHE HB2 1 1 15 6360 1 1 16 PHE HB3 H 3.677 2.442 2.706 1.00 . A A . 16 PHE HB3 1 1 15 6361 1 1 16 PHE HD1 H 4.686 5.798 1.404 1.00 . A A . 16 PHE HD1 1 1 15 6362 1 1 16 PHE HD2 H 5.096 2.892 4.540 1.00 . A A . 16 PHE HD2 1 1 15 6363 1 1 16 PHE HE1 H 5.977 7.433 2.749 1.00 . A A . 16 PHE HE1 1 1 15 6364 1 1 16 PHE HE2 H 6.386 4.527 5.886 1.00 . A A . 16 PHE HE2 1 1 15 6365 1 1 16 PHE HZ H 6.827 6.797 4.991 1.00 . A A . 16 PHE HZ 1 1 15 6366 1 1 16 PHE N N 3.962 2.119 -0.060 1.00 . A A . 16 PHE N 1 1 15 6367 1 1 16 PHE O O 6.975 1.739 1.758 1.00 . A A . 16 PHE O 1 1 15 6368 1 1 17 GLY C C 7.175 -1.107 1.231 1.00 . A A . 17 GLY C 1 1 15 6369 1 1 17 GLY CA C 6.049 -0.780 2.215 1.00 . A A . 17 GLY CA 1 1 15 6370 1 1 17 GLY H H 4.296 0.235 1.479 1.00 . A A . 17 GLY H 1 1 15 6371 1 1 17 GLY HA2 H 6.474 -0.514 3.173 1.00 . A A . 17 GLY HA2 1 1 15 6372 1 1 17 GLY HA3 H 5.414 -1.645 2.330 1.00 . A A . 17 GLY HA3 1 1 15 6373 1 1 17 GLY N N 5.245 0.366 1.692 1.00 . A A . 17 GLY N 1 1 15 6374 1 1 17 GLY O O 8.307 -1.312 1.625 1.00 . A A . 17 GLY O 1 1 15 6375 1 1 18 GLU C C 9.063 -0.418 -0.964 1.00 . A A . 18 GLU C 1 1 15 6376 1 1 18 GLU CA C 7.938 -1.453 -1.059 1.00 . A A . 18 GLU CA 1 1 15 6377 1 1 18 GLU CB C 7.236 -1.369 -2.419 1.00 . A A . 18 GLU CB 1 1 15 6378 1 1 18 GLU CD C 6.874 -3.067 -4.218 1.00 . A A . 18 GLU CD 1 1 15 6379 1 1 18 GLU CG C 7.931 -2.300 -3.418 1.00 . A A . 18 GLU CG 1 1 15 6380 1 1 18 GLU H H 5.955 -0.974 -0.339 1.00 . A A . 18 GLU H 1 1 15 6381 1 1 18 GLU HA H 8.329 -2.442 -0.903 1.00 . A A . 18 GLU HA 1 1 15 6382 1 1 18 GLU HB2 H 6.203 -1.665 -2.309 1.00 . A A . 18 GLU HB2 1 1 15 6383 1 1 18 GLU HB3 H 7.283 -0.354 -2.785 1.00 . A A . 18 GLU HB3 1 1 15 6384 1 1 18 GLU HG2 H 8.539 -1.715 -4.092 1.00 . A A . 18 GLU HG2 1 1 15 6385 1 1 18 GLU HG3 H 8.555 -3.002 -2.885 1.00 . A A . 18 GLU HG3 1 1 15 6386 1 1 18 GLU N N 6.876 -1.150 -0.046 1.00 . A A . 18 GLU N 1 1 15 6387 1 1 18 GLU O O 10.230 -0.745 -1.076 1.00 . A A . 18 GLU O 1 1 15 6388 1 1 18 GLU OE1 O 6.314 -2.487 -5.133 1.00 . A A . 18 GLU OE1 1 1 15 6389 1 1 18 GLU OE2 O 6.643 -4.223 -3.901 1.00 . A A . 18 GLU OE2 1 1 15 6390 1 1 19 ASN C C 10.636 1.619 0.612 1.00 . A A . 19 ASN C 1 1 15 6391 1 1 19 ASN CA C 9.755 1.891 -0.612 1.00 . A A . 19 ASN CA 1 1 15 6392 1 1 19 ASN CB C 8.977 3.198 -0.432 1.00 . A A . 19 ASN CB 1 1 15 6393 1 1 19 ASN CG C 8.715 3.832 -1.800 1.00 . A A . 19 ASN CG 1 1 15 6394 1 1 19 ASN H H 7.768 1.048 -0.639 1.00 . A A . 19 ASN H 1 1 15 6395 1 1 19 ASN HA H 10.356 1.937 -1.501 1.00 . A A . 19 ASN HA 1 1 15 6396 1 1 19 ASN HB2 H 8.035 2.994 0.056 1.00 . A A . 19 ASN HB2 1 1 15 6397 1 1 19 ASN HB3 H 9.555 3.882 0.173 1.00 . A A . 19 ASN HB3 1 1 15 6398 1 1 19 ASN HD21 H 7.002 2.866 -2.083 1.00 . A A . 19 ASN HD21 1 1 15 6399 1 1 19 ASN HD22 H 7.465 3.909 -3.339 1.00 . A A . 19 ASN HD22 1 1 15 6400 1 1 19 ASN N N 8.715 0.823 -0.738 1.00 . A A . 19 ASN N 1 1 15 6401 1 1 19 ASN ND2 N 7.638 3.510 -2.462 1.00 . A A . 19 ASN ND2 1 1 15 6402 1 1 19 ASN O O 11.825 1.869 0.601 1.00 . A A . 19 ASN O 1 1 15 6403 1 1 19 ASN OD1 O 9.500 4.630 -2.271 1.00 . A A . 19 ASN OD1 1 1 15 6404 1 1 20 GLY C C 11.590 -0.536 2.712 1.00 . A A . 20 GLY C 1 1 15 6405 1 1 20 GLY CA C 10.839 0.788 2.894 1.00 . A A . 20 GLY CA 1 1 15 6406 1 1 20 GLY H H 9.095 0.899 1.635 1.00 . A A . 20 GLY H 1 1 15 6407 1 1 20 GLY HA2 H 11.548 1.583 3.077 1.00 . A A . 20 GLY HA2 1 1 15 6408 1 1 20 GLY HA3 H 10.169 0.703 3.736 1.00 . A A . 20 GLY HA3 1 1 15 6409 1 1 20 GLY N N 10.054 1.096 1.662 1.00 . A A . 20 GLY N 1 1 15 6410 1 1 20 GLY O O 12.708 -0.685 3.169 1.00 . A A . 20 GLY O 1 1 15 6411 1 1 21 VAL C C 12.993 -2.636 1.073 1.00 . A A . 21 VAL C 1 1 15 6412 1 1 21 VAL CA C 11.669 -2.818 1.835 1.00 . A A . 21 VAL CA 1 1 15 6413 1 1 21 VAL CB C 10.675 -3.658 1.019 1.00 . A A . 21 VAL CB 1 1 15 6414 1 1 21 VAL CG1 C 11.382 -4.883 0.429 1.00 . A A . 21 VAL CG1 1 1 15 6415 1 1 21 VAL CG2 C 9.538 -4.127 1.931 1.00 . A A . 21 VAL CG2 1 1 15 6416 1 1 21 VAL H H 10.082 -1.352 1.690 1.00 . A A . 21 VAL H 1 1 15 6417 1 1 21 VAL HA H 11.853 -3.291 2.782 1.00 . A A . 21 VAL HA 1 1 15 6418 1 1 21 VAL HB H 10.271 -3.057 0.217 1.00 . A A . 21 VAL HB 1 1 15 6419 1 1 21 VAL HG11 H 10.651 -5.643 0.194 1.00 . A A . 21 VAL HG11 1 1 15 6420 1 1 21 VAL HG12 H 12.088 -5.275 1.147 1.00 . A A . 21 VAL HG12 1 1 15 6421 1 1 21 VAL HG13 H 11.906 -4.599 -0.473 1.00 . A A . 21 VAL HG13 1 1 15 6422 1 1 21 VAL HG21 H 9.833 -5.034 2.437 1.00 . A A . 21 VAL HG21 1 1 15 6423 1 1 21 VAL HG22 H 8.656 -4.317 1.337 1.00 . A A . 21 VAL HG22 1 1 15 6424 1 1 21 VAL HG23 H 9.322 -3.362 2.661 1.00 . A A . 21 VAL HG23 1 1 15 6425 1 1 21 VAL N N 10.988 -1.498 2.048 1.00 . A A . 21 VAL N 1 1 15 6426 1 1 21 VAL O O 13.888 -3.454 1.176 1.00 . A A . 21 VAL O 1 1 15 6427 1 1 22 PHE C C 15.244 -0.254 0.235 1.00 . A A . 22 PHE C 1 1 15 6428 1 1 22 PHE CA C 14.401 -1.352 -0.437 1.00 . A A . 22 PHE CA 1 1 15 6429 1 1 22 PHE CB C 13.963 -0.917 -1.841 1.00 . A A . 22 PHE CB 1 1 15 6430 1 1 22 PHE CD1 C 13.959 -3.343 -2.559 1.00 . A A . 22 PHE CD1 1 1 15 6431 1 1 22 PHE CD2 C 12.134 -1.911 -3.267 1.00 . A A . 22 PHE CD2 1 1 15 6432 1 1 22 PHE CE1 C 13.376 -4.420 -3.238 1.00 . A A . 22 PHE CE1 1 1 15 6433 1 1 22 PHE CE2 C 11.552 -2.988 -3.946 1.00 . A A . 22 PHE CE2 1 1 15 6434 1 1 22 PHE CG C 13.337 -2.087 -2.573 1.00 . A A . 22 PHE CG 1 1 15 6435 1 1 22 PHE CZ C 12.173 -4.242 -3.930 1.00 . A A . 22 PHE CZ 1 1 15 6436 1 1 22 PHE H H 12.400 -0.928 0.254 1.00 . A A . 22 PHE H 1 1 15 6437 1 1 22 PHE HA H 14.967 -2.267 -0.498 1.00 . A A . 22 PHE HA 1 1 15 6438 1 1 22 PHE HB2 H 13.242 -0.116 -1.760 1.00 . A A . 22 PHE HB2 1 1 15 6439 1 1 22 PHE HB3 H 14.823 -0.569 -2.393 1.00 . A A . 22 PHE HB3 1 1 15 6440 1 1 22 PHE HD1 H 14.887 -3.481 -2.025 1.00 . A A . 22 PHE HD1 1 1 15 6441 1 1 22 PHE HD2 H 11.655 -0.943 -3.279 1.00 . A A . 22 PHE HD2 1 1 15 6442 1 1 22 PHE HE1 H 13.855 -5.388 -3.227 1.00 . A A . 22 PHE HE1 1 1 15 6443 1 1 22 PHE HE2 H 10.624 -2.852 -4.480 1.00 . A A . 22 PHE HE2 1 1 15 6444 1 1 22 PHE HZ H 11.724 -5.074 -4.454 1.00 . A A . 22 PHE HZ 1 1 15 6445 1 1 22 PHE N N 13.129 -1.576 0.320 1.00 . A A . 22 PHE N 1 1 15 6446 1 1 22 PHE O O 16.008 0.436 -0.416 1.00 . A A . 22 PHE O 1 1 15 6447 1 1 23 PHE C C 15.934 0.698 3.764 1.00 . A A . 23 PHE C 1 1 15 6448 1 1 23 PHE CA C 15.906 0.962 2.247 1.00 . A A . 23 PHE CA 1 1 15 6449 1 1 23 PHE CB C 15.178 2.276 1.944 1.00 . A A . 23 PHE CB 1 1 15 6450 1 1 23 PHE CD1 C 16.842 4.109 2.426 1.00 . A A . 23 PHE CD1 1 1 15 6451 1 1 23 PHE CD2 C 16.435 3.482 0.120 1.00 . A A . 23 PHE CD2 1 1 15 6452 1 1 23 PHE CE1 C 17.768 5.071 2.000 1.00 . A A . 23 PHE CE1 1 1 15 6453 1 1 23 PHE CE2 C 17.360 4.443 -0.306 1.00 . A A . 23 PHE CE2 1 1 15 6454 1 1 23 PHE CG C 16.175 3.314 1.486 1.00 . A A . 23 PHE CG 1 1 15 6455 1 1 23 PHE CZ C 18.025 5.237 0.634 1.00 . A A . 23 PHE CZ 1 1 15 6456 1 1 23 PHE H H 14.492 -0.656 2.038 1.00 . A A . 23 PHE H 1 1 15 6457 1 1 23 PHE HA H 16.911 1.002 1.856 1.00 . A A . 23 PHE HA 1 1 15 6458 1 1 23 PHE HB2 H 14.446 2.112 1.167 1.00 . A A . 23 PHE HB2 1 1 15 6459 1 1 23 PHE HB3 H 14.680 2.627 2.837 1.00 . A A . 23 PHE HB3 1 1 15 6460 1 1 23 PHE HD1 H 16.643 3.981 3.480 1.00 . A A . 23 PHE HD1 1 1 15 6461 1 1 23 PHE HD2 H 15.920 2.870 -0.606 1.00 . A A . 23 PHE HD2 1 1 15 6462 1 1 23 PHE HE1 H 18.282 5.683 2.726 1.00 . A A . 23 PHE HE1 1 1 15 6463 1 1 23 PHE HE2 H 17.559 4.571 -1.360 1.00 . A A . 23 PHE HE2 1 1 15 6464 1 1 23 PHE HZ H 18.739 5.978 0.307 1.00 . A A . 23 PHE HZ 1 1 15 6465 1 1 23 PHE N N 15.113 -0.088 1.534 1.00 . A A . 23 PHE N 1 1 15 6466 1 1 23 PHE O O 15.956 1.621 4.557 1.00 . A A . 23 PHE O 1 1 15 6467 1 1 24 TYR C C 17.010 -1.923 5.999 1.00 . A A . 24 TYR C 1 1 15 6468 1 1 24 TYR CA C 15.956 -0.854 5.645 1.00 . A A . 24 TYR CA 1 1 15 6469 1 1 24 TYR CB C 14.534 -1.344 5.974 1.00 . A A . 24 TYR CB 1 1 15 6470 1 1 24 TYR CD1 C 14.233 -3.224 4.310 1.00 . A A . 24 TYR CD1 1 1 15 6471 1 1 24 TYR CD2 C 14.384 -3.768 6.668 1.00 . A A . 24 TYR CD2 1 1 15 6472 1 1 24 TYR CE1 C 14.089 -4.583 4.006 1.00 . A A . 24 TYR CE1 1 1 15 6473 1 1 24 TYR CE2 C 14.239 -5.127 6.363 1.00 . A A . 24 TYR CE2 1 1 15 6474 1 1 24 TYR CG C 14.383 -2.815 5.641 1.00 . A A . 24 TYR CG 1 1 15 6475 1 1 24 TYR CZ C 14.092 -5.534 5.032 1.00 . A A . 24 TYR CZ 1 1 15 6476 1 1 24 TYR H H 15.911 -1.279 3.524 1.00 . A A . 24 TYR H 1 1 15 6477 1 1 24 TYR HA H 16.158 0.046 6.199 1.00 . A A . 24 TYR HA 1 1 15 6478 1 1 24 TYR HB2 H 14.344 -1.198 7.026 1.00 . A A . 24 TYR HB2 1 1 15 6479 1 1 24 TYR HB3 H 13.820 -0.773 5.401 1.00 . A A . 24 TYR HB3 1 1 15 6480 1 1 24 TYR HD1 H 14.231 -2.491 3.517 1.00 . A A . 24 TYR HD1 1 1 15 6481 1 1 24 TYR HD2 H 14.500 -3.454 7.694 1.00 . A A . 24 TYR HD2 1 1 15 6482 1 1 24 TYR HE1 H 13.975 -4.897 2.979 1.00 . A A . 24 TYR HE1 1 1 15 6483 1 1 24 TYR HE2 H 14.241 -5.860 7.155 1.00 . A A . 24 TYR HE2 1 1 15 6484 1 1 24 TYR HH H 14.456 -7.063 3.941 1.00 . A A . 24 TYR HH 1 1 15 6485 1 1 24 TYR N N 15.932 -0.549 4.176 1.00 . A A . 24 TYR N 1 1 15 6486 1 1 24 TYR O O 17.274 -2.173 7.162 1.00 . A A . 24 TYR O 1 1 15 6487 1 1 24 TYR OH O 13.948 -6.875 4.735 1.00 . A A . 24 TYR OH 1 1 15 6488 1 1 25 LYS C C 19.738 -3.593 4.246 1.00 . A A . 25 LYS C 1 1 15 6489 1 1 25 LYS CA C 18.637 -3.599 5.314 1.00 . A A . 25 LYS CA 1 1 15 6490 1 1 25 LYS CB C 17.871 -4.925 5.286 1.00 . A A . 25 LYS CB 1 1 15 6491 1 1 25 LYS CD C 17.723 -5.692 7.661 1.00 . A A . 25 LYS CD 1 1 15 6492 1 1 25 LYS CE C 16.733 -6.844 7.862 1.00 . A A . 25 LYS CE 1 1 15 6493 1 1 25 LYS CG C 18.459 -5.874 6.331 1.00 . A A . 25 LYS CG 1 1 15 6494 1 1 25 LYS H H 17.390 -2.341 4.092 1.00 . A A . 25 LYS H 1 1 15 6495 1 1 25 LYS HA H 19.062 -3.442 6.292 1.00 . A A . 25 LYS HA 1 1 15 6496 1 1 25 LYS HB2 H 16.829 -4.743 5.508 1.00 . A A . 25 LYS HB2 1 1 15 6497 1 1 25 LYS HB3 H 17.958 -5.371 4.307 1.00 . A A . 25 LYS HB3 1 1 15 6498 1 1 25 LYS HD2 H 18.440 -5.687 8.471 1.00 . A A . 25 LYS HD2 1 1 15 6499 1 1 25 LYS HD3 H 17.185 -4.756 7.650 1.00 . A A . 25 LYS HD3 1 1 15 6500 1 1 25 LYS HE2 H 15.966 -6.559 8.569 1.00 . A A . 25 LYS HE2 1 1 15 6501 1 1 25 LYS HE3 H 16.291 -7.128 6.919 1.00 . A A . 25 LYS HE3 1 1 15 6502 1 1 25 LYS HG2 H 18.347 -6.894 5.992 1.00 . A A . 25 LYS HG2 1 1 15 6503 1 1 25 LYS HG3 H 19.507 -5.655 6.469 1.00 . A A . 25 LYS HG3 1 1 15 6504 1 1 25 LYS HZ1 H 18.393 -8.106 7.813 1.00 . A A . 25 LYS HZ1 1 1 15 6505 1 1 25 LYS HZ2 H 16.978 -8.843 8.397 1.00 . A A . 25 LYS HZ2 1 1 15 6506 1 1 25 LYS HZ3 H 17.837 -7.754 9.377 1.00 . A A . 25 LYS HZ3 1 1 15 6507 1 1 25 LYS N N 17.611 -2.554 5.019 1.00 . A A . 25 LYS N 1 1 15 6508 1 1 25 LYS NZ N 17.547 -7.971 8.402 1.00 . A A . 25 LYS NZ 1 1 15 6509 1 1 25 LYS O O 19.404 -3.613 3.072 1.00 . A A . 25 LYS O 1 1 15 6510 1 1 25 LYS OXT O 20.897 -3.573 4.625 1.00 . A A . 25 LYS OXT 1 1 16 6511 1 1 1 HIS C C -19.940 0.007 4.746 1.00 . A A . 1 HIS C 1 1 16 6512 1 1 1 HIS CA C -20.784 0.102 6.024 1.00 . A A . 1 HIS CA 1 1 16 6513 1 1 1 HIS CB C -21.452 -1.244 6.324 1.00 . A A . 1 HIS CB 1 1 16 6514 1 1 1 HIS CD2 C -21.312 -1.261 8.950 1.00 . A A . 1 HIS CD2 1 1 16 6515 1 1 1 HIS CE1 C -23.435 -1.261 9.379 1.00 . A A . 1 HIS CE1 1 1 16 6516 1 1 1 HIS CG C -21.962 -1.253 7.741 1.00 . A A . 1 HIS CG 1 1 16 6517 1 1 1 HIS HA H -20.171 0.403 6.858 1.00 . A A . 1 HIS HA 1 1 16 6518 1 1 1 HIS HB2 H -22.277 -1.398 5.644 1.00 . A A . 1 HIS HB2 1 1 16 6519 1 1 1 HIS HB3 H -20.731 -2.039 6.199 1.00 . A A . 1 HIS HB3 1 1 16 6520 1 1 1 HIS HD1 H -24.052 -1.251 7.392 1.00 . A A . 1 HIS HD1 1 1 16 6521 1 1 1 HIS HD2 H -20.240 -1.263 9.081 1.00 . A A . 1 HIS HD2 1 1 16 6522 1 1 1 HIS HE1 H -24.381 -1.262 9.903 1.00 . A A . 1 HIS HE1 1 1 16 6523 1 1 1 HIS N N -21.909 1.069 5.829 1.00 . A A . 1 HIS N 1 1 16 6524 1 1 1 HIS ND1 N -23.316 -1.254 8.039 1.00 . A A . 1 HIS ND1 1 1 16 6525 1 1 1 HIS NE2 N -22.244 -1.265 9.983 1.00 . A A . 1 HIS NE2 1 1 16 6526 1 1 1 HIS O O -20.458 0.063 3.646 1.00 . A A . 1 HIS O 1 1 16 6527 1 1 2 ALA C C -17.041 -1.587 3.657 1.00 . A A . 2 ALA C 1 1 16 6528 1 1 2 ALA CA C -17.761 -0.232 3.683 1.00 . A A . 2 ALA CA 1 1 16 6529 1 1 2 ALA CB C -16.757 0.911 3.836 1.00 . A A . 2 ALA CB 1 1 16 6530 1 1 2 ALA H H -18.253 -0.177 5.784 1.00 . A A . 2 ALA H 1 1 16 6531 1 1 2 ALA HA H -18.337 -0.096 2.781 1.00 . A A . 2 ALA HA 1 1 16 6532 1 1 2 ALA HB1 H -15.970 0.612 4.512 1.00 . A A . 2 ALA HB1 1 1 16 6533 1 1 2 ALA HB2 H -17.259 1.782 4.230 1.00 . A A . 2 ALA HB2 1 1 16 6534 1 1 2 ALA HB3 H -16.332 1.148 2.872 1.00 . A A . 2 ALA HB3 1 1 16 6535 1 1 2 ALA N N -18.645 -0.134 4.886 1.00 . A A . 2 ALA N 1 1 16 6536 1 1 2 ALA O O -16.441 -1.999 4.633 1.00 . A A . 2 ALA O 1 1 16 6537 1 1 3 TRP C C -15.189 -3.515 1.533 1.00 . A A . 3 TRP C 1 1 16 6538 1 1 3 TRP CA C -16.421 -3.611 2.444 1.00 . A A . 3 TRP CA 1 1 16 6539 1 1 3 TRP CB C -17.474 -4.543 1.837 1.00 . A A . 3 TRP CB 1 1 16 6540 1 1 3 TRP CD1 C -17.119 -6.854 2.803 1.00 . A A . 3 TRP CD1 1 1 16 6541 1 1 3 TRP CD2 C -16.191 -6.614 0.767 1.00 . A A . 3 TRP CD2 1 1 16 6542 1 1 3 TRP CE2 C -15.920 -7.939 1.183 1.00 . A A . 3 TRP CE2 1 1 16 6543 1 1 3 TRP CE3 C -15.715 -6.204 -0.491 1.00 . A A . 3 TRP CE3 1 1 16 6544 1 1 3 TRP CG C -16.955 -5.946 1.813 1.00 . A A . 3 TRP CG 1 1 16 6545 1 1 3 TRP CH2 C -14.733 -8.399 -0.865 1.00 . A A . 3 TRP CH2 1 1 16 6546 1 1 3 TRP CZ2 C -15.200 -8.824 0.381 1.00 . A A . 3 TRP CZ2 1 1 16 6547 1 1 3 TRP CZ3 C -14.989 -7.091 -1.301 1.00 . A A . 3 TRP CZ3 1 1 16 6548 1 1 3 TRP H H -17.587 -1.922 1.775 1.00 . A A . 3 TRP H 1 1 16 6549 1 1 3 TRP HA H -16.137 -3.965 3.423 1.00 . A A . 3 TRP HA 1 1 16 6550 1 1 3 TRP HB2 H -18.375 -4.504 2.433 1.00 . A A . 3 TRP HB2 1 1 16 6551 1 1 3 TRP HB3 H -17.697 -4.226 0.829 1.00 . A A . 3 TRP HB3 1 1 16 6552 1 1 3 TRP HD1 H -17.644 -6.683 3.731 1.00 . A A . 3 TRP HD1 1 1 16 6553 1 1 3 TRP HE1 H -16.479 -8.854 2.971 1.00 . A A . 3 TRP HE1 1 1 16 6554 1 1 3 TRP HE3 H -15.908 -5.198 -0.834 1.00 . A A . 3 TRP HE3 1 1 16 6555 1 1 3 TRP HH2 H -14.174 -9.078 -1.494 1.00 . A A . 3 TRP HH2 1 1 16 6556 1 1 3 TRP HZ2 H -15.003 -9.831 0.720 1.00 . A A . 3 TRP HZ2 1 1 16 6557 1 1 3 TRP HZ3 H -14.627 -6.765 -2.265 1.00 . A A . 3 TRP HZ3 1 1 16 6558 1 1 3 TRP N N -17.098 -2.279 2.546 1.00 . A A . 3 TRP N 1 1 16 6559 1 1 3 TRP NE1 N -16.506 -8.036 2.430 1.00 . A A . 3 TRP NE1 1 1 16 6560 1 1 3 TRP O O -14.113 -3.961 1.882 1.00 . A A . 3 TRP O 1 1 16 6561 1 1 4 TYR C C -13.282 -1.613 -0.186 1.00 . A A . 4 TYR C 1 1 16 6562 1 1 4 TYR CA C -14.185 -2.800 -0.574 1.00 . A A . 4 TYR CA 1 1 16 6563 1 1 4 TYR CB C -14.814 -2.581 -1.962 1.00 . A A . 4 TYR CB 1 1 16 6564 1 1 4 TYR CD1 C -14.572 -0.134 -2.543 1.00 . A A . 4 TYR CD1 1 1 16 6565 1 1 4 TYR CD2 C -16.707 -0.924 -1.706 1.00 . A A . 4 TYR CD2 1 1 16 6566 1 1 4 TYR CE1 C -15.092 1.161 -2.646 1.00 . A A . 4 TYR CE1 1 1 16 6567 1 1 4 TYR CE2 C -17.226 0.372 -1.809 1.00 . A A . 4 TYR CE2 1 1 16 6568 1 1 4 TYR CG C -15.379 -1.178 -2.072 1.00 . A A . 4 TYR CG 1 1 16 6569 1 1 4 TYR CZ C -16.420 1.414 -2.279 1.00 . A A . 4 TYR CZ 1 1 16 6570 1 1 4 TYR H H -16.222 -2.582 0.114 1.00 . A A . 4 TYR H 1 1 16 6571 1 1 4 TYR HA H -13.612 -3.711 -0.577 1.00 . A A . 4 TYR HA 1 1 16 6572 1 1 4 TYR HB2 H -14.058 -2.721 -2.721 1.00 . A A . 4 TYR HB2 1 1 16 6573 1 1 4 TYR HB3 H -15.607 -3.299 -2.111 1.00 . A A . 4 TYR HB3 1 1 16 6574 1 1 4 TYR HD1 H -13.549 -0.328 -2.826 1.00 . A A . 4 TYR HD1 1 1 16 6575 1 1 4 TYR HD2 H -17.331 -1.727 -1.343 1.00 . A A . 4 TYR HD2 1 1 16 6576 1 1 4 TYR HE1 H -14.470 1.965 -3.009 1.00 . A A . 4 TYR HE1 1 1 16 6577 1 1 4 TYR HE2 H -18.250 0.567 -1.527 1.00 . A A . 4 TYR HE2 1 1 16 6578 1 1 4 TYR HH H -16.451 3.254 -1.769 1.00 . A A . 4 TYR HH 1 1 16 6579 1 1 4 TYR N N -15.344 -2.931 0.368 1.00 . A A . 4 TYR N 1 1 16 6580 1 1 4 TYR O O -12.276 -1.360 -0.822 1.00 . A A . 4 TYR O 1 1 16 6581 1 1 4 TYR OH O -16.933 2.692 -2.380 1.00 . A A . 4 TYR OH 1 1 16 6582 1 1 5 SER C C -11.437 -0.172 1.840 1.00 . A A . 5 SER C 1 1 16 6583 1 1 5 SER CA C -12.797 0.279 1.282 1.00 . A A . 5 SER CA 1 1 16 6584 1 1 5 SER CB C -13.621 0.969 2.371 1.00 . A A . 5 SER CB 1 1 16 6585 1 1 5 SER H H -14.442 -1.112 1.350 1.00 . A A . 5 SER H 1 1 16 6586 1 1 5 SER HA H -12.651 0.953 0.456 1.00 . A A . 5 SER HA 1 1 16 6587 1 1 5 SER HB2 H -14.612 1.174 2.000 1.00 . A A . 5 SER HB2 1 1 16 6588 1 1 5 SER HB3 H -13.691 0.320 3.234 1.00 . A A . 5 SER HB3 1 1 16 6589 1 1 5 SER HG H -13.065 2.292 3.684 1.00 . A A . 5 SER HG 1 1 16 6590 1 1 5 SER N N -13.631 -0.889 0.852 1.00 . A A . 5 SER N 1 1 16 6591 1 1 5 SER O O -10.544 0.633 2.023 1.00 . A A . 5 SER O 1 1 16 6592 1 1 5 SER OG O -12.998 2.194 2.732 1.00 . A A . 5 SER OG 1 1 16 6593 1 1 6 HIS C C -8.981 -2.229 1.515 1.00 . A A . 6 HIS C 1 1 16 6594 1 1 6 HIS CA C -9.960 -1.923 2.654 1.00 . A A . 6 HIS CA 1 1 16 6595 1 1 6 HIS CB C -10.286 -3.194 3.441 1.00 . A A . 6 HIS CB 1 1 16 6596 1 1 6 HIS CD2 C -8.217 -4.506 4.396 1.00 . A A . 6 HIS CD2 1 1 16 6597 1 1 6 HIS CE1 C -7.806 -3.239 6.105 1.00 . A A . 6 HIS CE1 1 1 16 6598 1 1 6 HIS CG C -9.153 -3.501 4.381 1.00 . A A . 6 HIS CG 1 1 16 6599 1 1 6 HIS H H -11.997 -2.077 1.957 1.00 . A A . 6 HIS H 1 1 16 6600 1 1 6 HIS HA H -9.538 -1.184 3.310 1.00 . A A . 6 HIS HA 1 1 16 6601 1 1 6 HIS HB2 H -11.195 -3.047 4.006 1.00 . A A . 6 HIS HB2 1 1 16 6602 1 1 6 HIS HB3 H -10.417 -4.020 2.755 1.00 . A A . 6 HIS HB3 1 1 16 6603 1 1 6 HIS HD1 H -9.360 -1.899 5.753 1.00 . A A . 6 HIS HD1 1 1 16 6604 1 1 6 HIS HD2 H -8.151 -5.305 3.672 1.00 . A A . 6 HIS HD2 1 1 16 6605 1 1 6 HIS HE1 H -7.360 -2.828 6.998 1.00 . A A . 6 HIS HE1 1 1 16 6606 1 1 6 HIS N N -11.268 -1.442 2.112 1.00 . A A . 6 HIS N 1 1 16 6607 1 1 6 HIS ND1 N -8.871 -2.705 5.480 1.00 . A A . 6 HIS ND1 1 1 16 6608 1 1 6 HIS NE2 N -7.367 -4.338 5.485 1.00 . A A . 6 HIS NE2 1 1 16 6609 1 1 6 HIS O O -7.780 -2.143 1.687 1.00 . A A . 6 HIS O 1 1 16 6610 1 1 7 TYR C C -7.695 -1.678 -1.108 1.00 . A A . 7 TYR C 1 1 16 6611 1 1 7 TYR CA C -8.574 -2.889 -0.795 1.00 . A A . 7 TYR CA 1 1 16 6612 1 1 7 TYR CB C -9.498 -3.206 -1.975 1.00 . A A . 7 TYR CB 1 1 16 6613 1 1 7 TYR CD1 C -9.234 -5.680 -2.390 1.00 . A A . 7 TYR CD1 1 1 16 6614 1 1 7 TYR CD2 C -11.219 -4.896 -1.240 1.00 . A A . 7 TYR CD2 1 1 16 6615 1 1 7 TYR CE1 C -9.696 -6.998 -2.290 1.00 . A A . 7 TYR CE1 1 1 16 6616 1 1 7 TYR CE2 C -11.681 -6.213 -1.140 1.00 . A A . 7 TYR CE2 1 1 16 6617 1 1 7 TYR CG C -9.995 -4.629 -1.866 1.00 . A A . 7 TYR CG 1 1 16 6618 1 1 7 TYR CZ C -10.920 -7.264 -1.665 1.00 . A A . 7 TYR CZ 1 1 16 6619 1 1 7 TYR H H -10.452 -2.640 0.245 1.00 . A A . 7 TYR H 1 1 16 6620 1 1 7 TYR HA H -7.958 -3.739 -0.566 1.00 . A A . 7 TYR HA 1 1 16 6621 1 1 7 TYR HB2 H -10.340 -2.529 -1.966 1.00 . A A . 7 TYR HB2 1 1 16 6622 1 1 7 TYR HB3 H -8.952 -3.089 -2.899 1.00 . A A . 7 TYR HB3 1 1 16 6623 1 1 7 TYR HD1 H -8.290 -5.475 -2.873 1.00 . A A . 7 TYR HD1 1 1 16 6624 1 1 7 TYR HD2 H -11.806 -4.086 -0.834 1.00 . A A . 7 TYR HD2 1 1 16 6625 1 1 7 TYR HE1 H -9.109 -7.809 -2.695 1.00 . A A . 7 TYR HE1 1 1 16 6626 1 1 7 TYR HE2 H -12.625 -6.418 -0.657 1.00 . A A . 7 TYR HE2 1 1 16 6627 1 1 7 TYR HH H -11.354 -8.817 -0.642 1.00 . A A . 7 TYR HH 1 1 16 6628 1 1 7 TYR N N -9.481 -2.581 0.357 1.00 . A A . 7 TYR N 1 1 16 6629 1 1 7 TYR O O -6.491 -1.793 -1.236 1.00 . A A . 7 TYR O 1 1 16 6630 1 1 7 TYR OH O -11.376 -8.562 -1.567 1.00 . A A . 7 TYR OH 1 1 16 6631 1 1 8 VAL C C -6.475 0.951 -0.369 1.00 . A A . 8 VAL C 1 1 16 6632 1 1 8 VAL CA C -7.488 0.715 -1.501 1.00 . A A . 8 VAL CA 1 1 16 6633 1 1 8 VAL CB C -8.511 1.861 -1.593 1.00 . A A . 8 VAL CB 1 1 16 6634 1 1 8 VAL CG1 C -9.114 2.151 -0.215 1.00 . A A . 8 VAL CG1 1 1 16 6635 1 1 8 VAL CG2 C -7.818 3.123 -2.118 1.00 . A A . 8 VAL CG2 1 1 16 6636 1 1 8 VAL H H -9.258 -0.456 -1.094 1.00 . A A . 8 VAL H 1 1 16 6637 1 1 8 VAL HA H -6.971 0.608 -2.438 1.00 . A A . 8 VAL HA 1 1 16 6638 1 1 8 VAL HB H -9.301 1.578 -2.273 1.00 . A A . 8 VAL HB 1 1 16 6639 1 1 8 VAL HG11 H -9.972 2.798 -0.328 1.00 . A A . 8 VAL HG11 1 1 16 6640 1 1 8 VAL HG12 H -8.376 2.637 0.407 1.00 . A A . 8 VAL HG12 1 1 16 6641 1 1 8 VAL HG13 H -9.419 1.224 0.245 1.00 . A A . 8 VAL HG13 1 1 16 6642 1 1 8 VAL HG21 H -7.099 3.468 -1.390 1.00 . A A . 8 VAL HG21 1 1 16 6643 1 1 8 VAL HG22 H -8.556 3.893 -2.288 1.00 . A A . 8 VAL HG22 1 1 16 6644 1 1 8 VAL HG23 H -7.312 2.898 -3.044 1.00 . A A . 8 VAL HG23 1 1 16 6645 1 1 8 VAL N N -8.289 -0.517 -1.215 1.00 . A A . 8 VAL N 1 1 16 6646 1 1 8 VAL O O -5.392 1.462 -0.588 1.00 . A A . 8 VAL O 1 1 16 6647 1 1 9 LEU C C -4.690 -0.225 1.836 1.00 . A A . 9 LEU C 1 1 16 6648 1 1 9 LEU CA C -5.883 0.729 1.989 1.00 . A A . 9 LEU CA 1 1 16 6649 1 1 9 LEU CB C -6.708 0.372 3.231 1.00 . A A . 9 LEU CB 1 1 16 6650 1 1 9 LEU CD1 C -7.207 1.525 5.395 1.00 . A A . 9 LEU CD1 1 1 16 6651 1 1 9 LEU CD2 C -5.224 0.016 5.215 1.00 . A A . 9 LEU CD2 1 1 16 6652 1 1 9 LEU CG C -6.092 1.034 4.469 1.00 . A A . 9 LEU CG 1 1 16 6653 1 1 9 LEU H H -7.690 0.134 0.975 1.00 . A A . 9 LEU H 1 1 16 6654 1 1 9 LEU HA H -5.543 1.751 2.050 1.00 . A A . 9 LEU HA 1 1 16 6655 1 1 9 LEU HB2 H -7.722 0.723 3.102 1.00 . A A . 9 LEU HB2 1 1 16 6656 1 1 9 LEU HB3 H -6.713 -0.700 3.364 1.00 . A A . 9 LEU HB3 1 1 16 6657 1 1 9 LEU HD11 H -7.847 0.696 5.660 1.00 . A A . 9 LEU HD11 1 1 16 6658 1 1 9 LEU HD12 H -7.789 2.281 4.889 1.00 . A A . 9 LEU HD12 1 1 16 6659 1 1 9 LEU HD13 H -6.772 1.945 6.290 1.00 . A A . 9 LEU HD13 1 1 16 6660 1 1 9 LEU HD21 H -4.526 0.537 5.852 1.00 . A A . 9 LEU HD21 1 1 16 6661 1 1 9 LEU HD22 H -4.681 -0.586 4.502 1.00 . A A . 9 LEU HD22 1 1 16 6662 1 1 9 LEU HD23 H -5.855 -0.622 5.817 1.00 . A A . 9 LEU HD23 1 1 16 6663 1 1 9 LEU HG H -5.484 1.873 4.164 1.00 . A A . 9 LEU HG 1 1 16 6664 1 1 9 LEU N N -6.819 0.557 0.835 1.00 . A A . 9 LEU N 1 1 16 6665 1 1 9 LEU O O -3.556 0.147 2.075 1.00 . A A . 9 LEU O 1 1 16 6666 1 1 10 LYS C C -2.904 -1.953 0.097 1.00 . A A . 10 LYS C 1 1 16 6667 1 1 10 LYS CA C -3.815 -2.422 1.240 1.00 . A A . 10 LYS CA 1 1 16 6668 1 1 10 LYS CB C -4.483 -3.755 0.887 1.00 . A A . 10 LYS CB 1 1 16 6669 1 1 10 LYS CD C -4.372 -6.119 1.704 1.00 . A A . 10 LYS CD 1 1 16 6670 1 1 10 LYS CE C -3.526 -7.005 2.626 1.00 . A A . 10 LYS CE 1 1 16 6671 1 1 10 LYS CG C -3.547 -4.911 1.253 1.00 . A A . 10 LYS CG 1 1 16 6672 1 1 10 LYS H H -5.861 -1.724 1.225 1.00 . A A . 10 LYS H 1 1 16 6673 1 1 10 LYS HA H -3.250 -2.521 2.155 1.00 . A A . 10 LYS HA 1 1 16 6674 1 1 10 LYS HB2 H -5.409 -3.851 1.437 1.00 . A A . 10 LYS HB2 1 1 16 6675 1 1 10 LYS HB3 H -4.690 -3.784 -0.173 1.00 . A A . 10 LYS HB3 1 1 16 6676 1 1 10 LYS HD2 H -5.250 -5.778 2.235 1.00 . A A . 10 LYS HD2 1 1 16 6677 1 1 10 LYS HD3 H -4.675 -6.690 0.839 1.00 . A A . 10 LYS HD3 1 1 16 6678 1 1 10 LYS HE2 H -3.772 -8.047 2.471 1.00 . A A . 10 LYS HE2 1 1 16 6679 1 1 10 LYS HE3 H -2.475 -6.837 2.449 1.00 . A A . 10 LYS HE3 1 1 16 6680 1 1 10 LYS HG2 H -2.954 -5.180 0.391 1.00 . A A . 10 LYS HG2 1 1 16 6681 1 1 10 LYS HG3 H -2.893 -4.604 2.057 1.00 . A A . 10 LYS HG3 1 1 16 6682 1 1 10 LYS HZ1 H -4.886 -6.804 4.194 1.00 . A A . 10 LYS HZ1 1 1 16 6683 1 1 10 LYS HZ2 H -3.727 -5.562 4.119 1.00 . A A . 10 LYS HZ2 1 1 16 6684 1 1 10 LYS HZ3 H -3.292 -7.101 4.694 1.00 . A A . 10 LYS HZ3 1 1 16 6685 1 1 10 LYS N N -4.937 -1.450 1.424 1.00 . A A . 10 LYS N 1 1 16 6686 1 1 10 LYS NZ N -3.885 -6.586 4.012 1.00 . A A . 10 LYS NZ 1 1 16 6687 1 1 10 LYS O O -1.695 -2.051 0.178 1.00 . A A . 10 LYS O 1 1 16 6688 1 1 11 PHE C C -1.702 0.166 -1.633 1.00 . A A . 11 PHE C 1 1 16 6689 1 1 11 PHE CA C -2.663 -0.934 -2.108 1.00 . A A . 11 PHE CA 1 1 16 6690 1 1 11 PHE CB C -3.683 -0.373 -3.108 1.00 . A A . 11 PHE CB 1 1 16 6691 1 1 11 PHE CD1 C -2.341 -0.475 -5.243 1.00 . A A . 11 PHE CD1 1 1 16 6692 1 1 11 PHE CD2 C -2.923 1.696 -4.333 1.00 . A A . 11 PHE CD2 1 1 16 6693 1 1 11 PHE CE1 C -1.676 0.148 -6.306 1.00 . A A . 11 PHE CE1 1 1 16 6694 1 1 11 PHE CE2 C -2.259 2.320 -5.396 1.00 . A A . 11 PHE CE2 1 1 16 6695 1 1 11 PHE CG C -2.964 0.299 -4.257 1.00 . A A . 11 PHE CG 1 1 16 6696 1 1 11 PHE CZ C -1.635 1.546 -6.382 1.00 . A A . 11 PHE CZ 1 1 16 6697 1 1 11 PHE H H -4.461 -1.353 -0.990 1.00 . A A . 11 PHE H 1 1 16 6698 1 1 11 PHE HA H -2.113 -1.746 -2.557 1.00 . A A . 11 PHE HA 1 1 16 6699 1 1 11 PHE HB2 H -4.293 -1.180 -3.489 1.00 . A A . 11 PHE HB2 1 1 16 6700 1 1 11 PHE HB3 H -4.314 0.348 -2.609 1.00 . A A . 11 PHE HB3 1 1 16 6701 1 1 11 PHE HD1 H -2.372 -1.553 -5.184 1.00 . A A . 11 PHE HD1 1 1 16 6702 1 1 11 PHE HD2 H -3.403 2.294 -3.573 1.00 . A A . 11 PHE HD2 1 1 16 6703 1 1 11 PHE HE1 H -1.196 -0.448 -7.067 1.00 . A A . 11 PHE HE1 1 1 16 6704 1 1 11 PHE HE2 H -2.227 3.398 -5.455 1.00 . A A . 11 PHE HE2 1 1 16 6705 1 1 11 PHE HZ H -1.122 2.027 -7.202 1.00 . A A . 11 PHE HZ 1 1 16 6706 1 1 11 PHE N N -3.483 -1.429 -0.958 1.00 . A A . 11 PHE N 1 1 16 6707 1 1 11 PHE O O -0.540 0.182 -1.992 1.00 . A A . 11 PHE O 1 1 16 6708 1 1 12 PHE C C -0.168 1.587 0.538 1.00 . A A . 12 PHE C 1 1 16 6709 1 1 12 PHE CA C -1.304 2.177 -0.309 1.00 . A A . 12 PHE CA 1 1 16 6710 1 1 12 PHE CB C -2.216 3.060 0.551 1.00 . A A . 12 PHE CB 1 1 16 6711 1 1 12 PHE CD1 C -3.647 4.321 -1.099 1.00 . A A . 12 PHE CD1 1 1 16 6712 1 1 12 PHE CD2 C -1.806 5.479 -0.024 1.00 . A A . 12 PHE CD2 1 1 16 6713 1 1 12 PHE CE1 C -3.970 5.487 -1.803 1.00 . A A . 12 PHE CE1 1 1 16 6714 1 1 12 PHE CE2 C -2.130 6.645 -0.728 1.00 . A A . 12 PHE CE2 1 1 16 6715 1 1 12 PHE CG C -2.565 4.318 -0.209 1.00 . A A . 12 PHE CG 1 1 16 6716 1 1 12 PHE CZ C -3.210 6.649 -1.618 1.00 . A A . 12 PHE CZ 1 1 16 6717 1 1 12 PHE H H -3.124 1.037 -0.544 1.00 . A A . 12 PHE H 1 1 16 6718 1 1 12 PHE HA H -0.901 2.750 -1.130 1.00 . A A . 12 PHE HA 1 1 16 6719 1 1 12 PHE HB2 H -3.120 2.519 0.791 1.00 . A A . 12 PHE HB2 1 1 16 6720 1 1 12 PHE HB3 H -1.703 3.323 1.465 1.00 . A A . 12 PHE HB3 1 1 16 6721 1 1 12 PHE HD1 H -4.232 3.425 -1.241 1.00 . A A . 12 PHE HD1 1 1 16 6722 1 1 12 PHE HD2 H -0.972 5.477 0.662 1.00 . A A . 12 PHE HD2 1 1 16 6723 1 1 12 PHE HE1 H -4.803 5.491 -2.489 1.00 . A A . 12 PHE HE1 1 1 16 6724 1 1 12 PHE HE2 H -1.544 7.543 -0.586 1.00 . A A . 12 PHE HE2 1 1 16 6725 1 1 12 PHE HZ H -3.460 7.548 -2.162 1.00 . A A . 12 PHE HZ 1 1 16 6726 1 1 12 PHE N N -2.183 1.079 -0.821 1.00 . A A . 12 PHE N 1 1 16 6727 1 1 12 PHE O O 0.981 1.959 0.395 1.00 . A A . 12 PHE O 1 1 16 6728 1 1 13 LEU C C 1.547 -0.769 1.386 1.00 . A A . 13 LEU C 1 1 16 6729 1 1 13 LEU CA C 0.569 0.026 2.262 1.00 . A A . 13 LEU CA 1 1 16 6730 1 1 13 LEU CB C -0.190 -0.907 3.212 1.00 . A A . 13 LEU CB 1 1 16 6731 1 1 13 LEU CD1 C 1.201 -0.397 5.234 1.00 . A A . 13 LEU CD1 1 1 16 6732 1 1 13 LEU CD2 C 0.079 -2.620 5.011 1.00 . A A . 13 LEU CD2 1 1 16 6733 1 1 13 LEU CG C 0.776 -1.490 4.248 1.00 . A A . 13 LEU CG 1 1 16 6734 1 1 13 LEU H H -1.421 0.371 1.496 1.00 . A A . 13 LEU H 1 1 16 6735 1 1 13 LEU HA H 1.096 0.778 2.827 1.00 . A A . 13 LEU HA 1 1 16 6736 1 1 13 LEU HB2 H -0.968 -0.352 3.716 1.00 . A A . 13 LEU HB2 1 1 16 6737 1 1 13 LEU HB3 H -0.633 -1.712 2.644 1.00 . A A . 13 LEU HB3 1 1 16 6738 1 1 13 LEU HD11 H 1.718 -0.846 6.068 1.00 . A A . 13 LEU HD11 1 1 16 6739 1 1 13 LEU HD12 H 0.325 0.124 5.592 1.00 . A A . 13 LEU HD12 1 1 16 6740 1 1 13 LEU HD13 H 1.857 0.301 4.736 1.00 . A A . 13 LEU HD13 1 1 16 6741 1 1 13 LEU HD21 H -0.688 -2.204 5.648 1.00 . A A . 13 LEU HD21 1 1 16 6742 1 1 13 LEU HD22 H 0.803 -3.145 5.616 1.00 . A A . 13 LEU HD22 1 1 16 6743 1 1 13 LEU HD23 H -0.370 -3.306 4.308 1.00 . A A . 13 LEU HD23 1 1 16 6744 1 1 13 LEU HG H 1.650 -1.880 3.747 1.00 . A A . 13 LEU HG 1 1 16 6745 1 1 13 LEU N N -0.486 0.659 1.409 1.00 . A A . 13 LEU N 1 1 16 6746 1 1 13 LEU O O 2.729 -0.824 1.661 1.00 . A A . 13 LEU O 1 1 16 6747 1 1 14 LEU C C 2.964 -1.225 -1.254 1.00 . A A . 14 LEU C 1 1 16 6748 1 1 14 LEU CA C 1.952 -2.159 -0.581 1.00 . A A . 14 LEU CA 1 1 16 6749 1 1 14 LEU CB C 1.015 -2.784 -1.622 1.00 . A A . 14 LEU CB 1 1 16 6750 1 1 14 LEU CD1 C 1.155 -5.152 -2.423 1.00 . A A . 14 LEU CD1 1 1 16 6751 1 1 14 LEU CD2 C 1.771 -3.277 -3.954 1.00 . A A . 14 LEU CD2 1 1 16 6752 1 1 14 LEU CG C 1.796 -3.765 -2.503 1.00 . A A . 14 LEU CG 1 1 16 6753 1 1 14 LEU H H 0.099 -1.309 0.127 1.00 . A A . 14 LEU H 1 1 16 6754 1 1 14 LEU HA H 2.462 -2.930 -0.033 1.00 . A A . 14 LEU HA 1 1 16 6755 1 1 14 LEU HB2 H 0.217 -3.309 -1.117 1.00 . A A . 14 LEU HB2 1 1 16 6756 1 1 14 LEU HB3 H 0.596 -2.004 -2.239 1.00 . A A . 14 LEU HB3 1 1 16 6757 1 1 14 LEU HD11 H 1.768 -5.863 -2.956 1.00 . A A . 14 LEU HD11 1 1 16 6758 1 1 14 LEU HD12 H 0.171 -5.120 -2.868 1.00 . A A . 14 LEU HD12 1 1 16 6759 1 1 14 LEU HD13 H 1.073 -5.452 -1.389 1.00 . A A . 14 LEU HD13 1 1 16 6760 1 1 14 LEU HD21 H 0.784 -3.423 -4.367 1.00 . A A . 14 LEU HD21 1 1 16 6761 1 1 14 LEU HD22 H 2.490 -3.836 -4.535 1.00 . A A . 14 LEU HD22 1 1 16 6762 1 1 14 LEU HD23 H 2.022 -2.227 -3.986 1.00 . A A . 14 LEU HD23 1 1 16 6763 1 1 14 LEU HG H 2.819 -3.823 -2.159 1.00 . A A . 14 LEU HG 1 1 16 6764 1 1 14 LEU N N 1.058 -1.376 0.328 1.00 . A A . 14 LEU N 1 1 16 6765 1 1 14 LEU O O 4.132 -1.543 -1.380 1.00 . A A . 14 LEU O 1 1 16 6766 1 1 15 VAL C C 4.398 1.503 -1.295 1.00 . A A . 15 VAL C 1 1 16 6767 1 1 15 VAL CA C 3.438 0.909 -2.335 1.00 . A A . 15 VAL CA 1 1 16 6768 1 1 15 VAL CB C 2.520 1.994 -2.920 1.00 . A A . 15 VAL CB 1 1 16 6769 1 1 15 VAL CG1 C 3.355 3.188 -3.390 1.00 . A A . 15 VAL CG1 1 1 16 6770 1 1 15 VAL CG2 C 1.747 1.421 -4.112 1.00 . A A . 15 VAL CG2 1 1 16 6771 1 1 15 VAL H H 1.573 0.156 -1.551 1.00 . A A . 15 VAL H 1 1 16 6772 1 1 15 VAL HA H 3.992 0.428 -3.127 1.00 . A A . 15 VAL HA 1 1 16 6773 1 1 15 VAL HB H 1.823 2.321 -2.161 1.00 . A A . 15 VAL HB 1 1 16 6774 1 1 15 VAL HG11 H 2.804 3.741 -4.138 1.00 . A A . 15 VAL HG11 1 1 16 6775 1 1 15 VAL HG12 H 4.284 2.835 -3.815 1.00 . A A . 15 VAL HG12 1 1 16 6776 1 1 15 VAL HG13 H 3.566 3.833 -2.550 1.00 . A A . 15 VAL HG13 1 1 16 6777 1 1 15 VAL HG21 H 0.970 2.114 -4.403 1.00 . A A . 15 VAL HG21 1 1 16 6778 1 1 15 VAL HG22 H 1.302 0.477 -3.833 1.00 . A A . 15 VAL HG22 1 1 16 6779 1 1 15 VAL HG23 H 2.422 1.271 -4.940 1.00 . A A . 15 VAL HG23 1 1 16 6780 1 1 15 VAL N N 2.518 -0.069 -1.676 1.00 . A A . 15 VAL N 1 1 16 6781 1 1 15 VAL O O 5.596 1.563 -1.507 1.00 . A A . 15 VAL O 1 1 16 6782 1 1 16 PHE C C 5.683 1.430 1.465 1.00 . A A . 16 PHE C 1 1 16 6783 1 1 16 PHE CA C 4.760 2.513 0.892 1.00 . A A . 16 PHE CA 1 1 16 6784 1 1 16 PHE CB C 3.808 3.037 1.973 1.00 . A A . 16 PHE CB 1 1 16 6785 1 1 16 PHE CD1 C 5.486 4.149 3.492 1.00 . A A . 16 PHE CD1 1 1 16 6786 1 1 16 PHE CD2 C 3.871 5.533 2.326 1.00 . A A . 16 PHE CD2 1 1 16 6787 1 1 16 PHE CE1 C 6.037 5.291 4.083 1.00 . A A . 16 PHE CE1 1 1 16 6788 1 1 16 PHE CE2 C 4.423 6.675 2.918 1.00 . A A . 16 PHE CE2 1 1 16 6789 1 1 16 PHE CG C 4.402 4.270 2.613 1.00 . A A . 16 PHE CG 1 1 16 6790 1 1 16 PHE CZ C 5.506 6.555 3.797 1.00 . A A . 16 PHE CZ 1 1 16 6791 1 1 16 PHE H H 2.911 1.865 -0.020 1.00 . A A . 16 PHE H 1 1 16 6792 1 1 16 PHE HA H 5.343 3.327 0.490 1.00 . A A . 16 PHE HA 1 1 16 6793 1 1 16 PHE HB2 H 2.856 3.286 1.525 1.00 . A A . 16 PHE HB2 1 1 16 6794 1 1 16 PHE HB3 H 3.663 2.275 2.724 1.00 . A A . 16 PHE HB3 1 1 16 6795 1 1 16 PHE HD1 H 5.896 3.175 3.714 1.00 . A A . 16 PHE HD1 1 1 16 6796 1 1 16 PHE HD2 H 3.036 5.626 1.648 1.00 . A A . 16 PHE HD2 1 1 16 6797 1 1 16 PHE HE1 H 6.872 5.198 4.762 1.00 . A A . 16 PHE HE1 1 1 16 6798 1 1 16 PHE HE2 H 4.014 7.650 2.696 1.00 . A A . 16 PHE HE2 1 1 16 6799 1 1 16 PHE HZ H 5.932 7.435 4.253 1.00 . A A . 16 PHE HZ 1 1 16 6800 1 1 16 PHE N N 3.879 1.932 -0.169 1.00 . A A . 16 PHE N 1 1 16 6801 1 1 16 PHE O O 6.818 1.695 1.811 1.00 . A A . 16 PHE O 1 1 16 6802 1 1 17 GLY C C 7.278 -1.086 1.202 1.00 . A A . 17 GLY C 1 1 16 6803 1 1 17 GLY CA C 6.050 -0.900 2.097 1.00 . A A . 17 GLY CA 1 1 16 6804 1 1 17 GLY H H 4.287 0.020 1.267 1.00 . A A . 17 GLY H 1 1 16 6805 1 1 17 GLY HA2 H 6.370 -0.654 3.099 1.00 . A A . 17 GLY HA2 1 1 16 6806 1 1 17 GLY HA3 H 5.480 -1.814 2.113 1.00 . A A . 17 GLY HA3 1 1 16 6807 1 1 17 GLY N N 5.204 0.209 1.558 1.00 . A A . 17 GLY N 1 1 16 6808 1 1 17 GLY O O 8.385 -1.225 1.685 1.00 . A A . 17 GLY O 1 1 16 6809 1 1 18 GLU C C 9.257 -0.099 -0.809 1.00 . A A . 18 GLU C 1 1 16 6810 1 1 18 GLU CA C 8.261 -1.241 -1.022 1.00 . A A . 18 GLU CA 1 1 16 6811 1 1 18 GLU CB C 7.677 -1.201 -2.439 1.00 . A A . 18 GLU CB 1 1 16 6812 1 1 18 GLU CD C 9.413 -2.416 -3.775 1.00 . A A . 18 GLU CD 1 1 16 6813 1 1 18 GLU CG C 8.010 -2.507 -3.169 1.00 . A A . 18 GLU CG 1 1 16 6814 1 1 18 GLU H H 6.192 -0.955 -0.465 1.00 . A A . 18 GLU H 1 1 16 6815 1 1 18 GLU HA H 8.743 -2.186 -0.846 1.00 . A A . 18 GLU HA 1 1 16 6816 1 1 18 GLU HB2 H 6.605 -1.081 -2.386 1.00 . A A . 18 GLU HB2 1 1 16 6817 1 1 18 GLU HB3 H 8.104 -0.371 -2.981 1.00 . A A . 18 GLU HB3 1 1 16 6818 1 1 18 GLU HG2 H 7.971 -3.330 -2.470 1.00 . A A . 18 GLU HG2 1 1 16 6819 1 1 18 GLU HG3 H 7.290 -2.672 -3.957 1.00 . A A . 18 GLU HG3 1 1 16 6820 1 1 18 GLU N N 7.094 -1.078 -0.098 1.00 . A A . 18 GLU N 1 1 16 6821 1 1 18 GLU O O 10.456 -0.298 -0.833 1.00 . A A . 18 GLU O 1 1 16 6822 1 1 18 GLU OE1 O 10.369 -2.573 -3.033 1.00 . A A . 18 GLU OE1 1 1 16 6823 1 1 18 GLU OE2 O 9.506 -2.194 -4.971 1.00 . A A . 18 GLU OE2 1 1 16 6824 1 1 19 ASN C C 10.514 1.990 0.925 1.00 . A A . 19 ASN C 1 1 16 6825 1 1 19 ASN CA C 9.678 2.253 -0.331 1.00 . A A . 19 ASN CA 1 1 16 6826 1 1 19 ASN CB C 8.760 3.462 -0.118 1.00 . A A . 19 ASN CB 1 1 16 6827 1 1 19 ASN CG C 8.480 4.139 -1.461 1.00 . A A . 19 ASN CG 1 1 16 6828 1 1 19 ASN H H 7.794 1.217 -0.544 1.00 . A A . 19 ASN H 1 1 16 6829 1 1 19 ASN HA H 10.316 2.415 -1.180 1.00 . A A . 19 ASN HA 1 1 16 6830 1 1 19 ASN HB2 H 7.828 3.135 0.321 1.00 . A A . 19 ASN HB2 1 1 16 6831 1 1 19 ASN HB3 H 9.241 4.167 0.543 1.00 . A A . 19 ASN HB3 1 1 16 6832 1 1 19 ASN HD21 H 6.744 3.213 -1.729 1.00 . A A . 19 ASN HD21 1 1 16 6833 1 1 19 ASN HD22 H 7.196 4.282 -2.967 1.00 . A A . 19 ASN HD22 1 1 16 6834 1 1 19 ASN N N 8.763 1.093 -0.576 1.00 . A A . 19 ASN N 1 1 16 6835 1 1 19 ASN ND2 N 7.382 3.855 -2.107 1.00 . A A . 19 ASN ND2 1 1 16 6836 1 1 19 ASN O O 11.677 2.338 0.992 1.00 . A A . 19 ASN O 1 1 16 6837 1 1 19 ASN OD1 O 9.270 4.936 -1.929 1.00 . A A . 19 ASN OD1 1 1 16 6838 1 1 20 GLY C C 11.602 -0.137 2.912 1.00 . A A . 20 GLY C 1 1 16 6839 1 1 20 GLY CA C 10.666 1.047 3.165 1.00 . A A . 20 GLY CA 1 1 16 6840 1 1 20 GLY H H 8.989 1.087 1.815 1.00 . A A . 20 GLY H 1 1 16 6841 1 1 20 GLY HA2 H 11.244 1.909 3.469 1.00 . A A . 20 GLY HA2 1 1 16 6842 1 1 20 GLY HA3 H 9.965 0.788 3.945 1.00 . A A . 20 GLY HA3 1 1 16 6843 1 1 20 GLY N N 9.924 1.363 1.910 1.00 . A A . 20 GLY N 1 1 16 6844 1 1 20 GLY O O 12.744 -0.130 3.330 1.00 . A A . 20 GLY O 1 1 16 6845 1 1 21 VAL C C 13.234 -1.904 1.133 1.00 . A A . 21 VAL C 1 1 16 6846 1 1 21 VAL CA C 11.997 -2.339 1.929 1.00 . A A . 21 VAL CA 1 1 16 6847 1 1 21 VAL CB C 11.120 -3.286 1.097 1.00 . A A . 21 VAL CB 1 1 16 6848 1 1 21 VAL CG1 C 11.971 -4.432 0.540 1.00 . A A . 21 VAL CG1 1 1 16 6849 1 1 21 VAL CG2 C 10.012 -3.868 1.981 1.00 . A A . 21 VAL CG2 1 1 16 6850 1 1 21 VAL H H 10.201 -1.127 1.890 1.00 . A A . 21 VAL H 1 1 16 6851 1 1 21 VAL HA H 12.292 -2.818 2.844 1.00 . A A . 21 VAL HA 1 1 16 6852 1 1 21 VAL HB H 10.677 -2.738 0.278 1.00 . A A . 21 VAL HB 1 1 16 6853 1 1 21 VAL HG11 H 12.520 -4.897 1.345 1.00 . A A . 21 VAL HG11 1 1 16 6854 1 1 21 VAL HG12 H 12.664 -4.043 -0.192 1.00 . A A . 21 VAL HG12 1 1 16 6855 1 1 21 VAL HG13 H 11.328 -5.163 0.072 1.00 . A A . 21 VAL HG13 1 1 16 6856 1 1 21 VAL HG21 H 9.703 -3.129 2.705 1.00 . A A . 21 VAL HG21 1 1 16 6857 1 1 21 VAL HG22 H 10.383 -4.742 2.495 1.00 . A A . 21 VAL HG22 1 1 16 6858 1 1 21 VAL HG23 H 9.168 -4.143 1.366 1.00 . A A . 21 VAL HG23 1 1 16 6859 1 1 21 VAL N N 11.128 -1.151 2.221 1.00 . A A . 21 VAL N 1 1 16 6860 1 1 21 VAL O O 14.315 -2.438 1.307 1.00 . A A . 21 VAL O 1 1 16 6861 1 1 22 PHE C C 15.340 0.115 0.356 1.00 . A A . 22 PHE C 1 1 16 6862 1 1 22 PHE CA C 14.233 -0.443 -0.550 1.00 . A A . 22 PHE CA 1 1 16 6863 1 1 22 PHE CB C 13.652 0.666 -1.433 1.00 . A A . 22 PHE CB 1 1 16 6864 1 1 22 PHE CD1 C 15.618 1.855 -2.472 1.00 . A A . 22 PHE CD1 1 1 16 6865 1 1 22 PHE CD2 C 14.391 0.243 -3.807 1.00 . A A . 22 PHE CD2 1 1 16 6866 1 1 22 PHE CE1 C 16.474 2.097 -3.553 1.00 . A A . 22 PHE CE1 1 1 16 6867 1 1 22 PHE CE2 C 15.247 0.488 -4.887 1.00 . A A . 22 PHE CE2 1 1 16 6868 1 1 22 PHE CG C 14.577 0.927 -2.598 1.00 . A A . 22 PHE CG 1 1 16 6869 1 1 22 PHE CZ C 16.289 1.414 -4.761 1.00 . A A . 22 PHE CZ 1 1 16 6870 1 1 22 PHE H H 12.194 -0.527 0.156 1.00 . A A . 22 PHE H 1 1 16 6871 1 1 22 PHE HA H 14.619 -1.236 -1.164 1.00 . A A . 22 PHE HA 1 1 16 6872 1 1 22 PHE HB2 H 12.685 0.361 -1.803 1.00 . A A . 22 PHE HB2 1 1 16 6873 1 1 22 PHE HB3 H 13.545 1.569 -0.851 1.00 . A A . 22 PHE HB3 1 1 16 6874 1 1 22 PHE HD1 H 15.762 2.381 -1.540 1.00 . A A . 22 PHE HD1 1 1 16 6875 1 1 22 PHE HD2 H 13.588 -0.471 -3.904 1.00 . A A . 22 PHE HD2 1 1 16 6876 1 1 22 PHE HE1 H 17.279 2.813 -3.455 1.00 . A A . 22 PHE HE1 1 1 16 6877 1 1 22 PHE HE2 H 15.104 -0.040 -5.819 1.00 . A A . 22 PHE HE2 1 1 16 6878 1 1 22 PHE HZ H 16.949 1.603 -5.595 1.00 . A A . 22 PHE HZ 1 1 16 6879 1 1 22 PHE N N 13.078 -0.934 0.267 1.00 . A A . 22 PHE N 1 1 16 6880 1 1 22 PHE O O 16.513 0.012 0.050 1.00 . A A . 22 PHE O 1 1 16 6881 1 1 23 PHE C C 16.321 0.261 3.521 1.00 . A A . 23 PHE C 1 1 16 6882 1 1 23 PHE CA C 16.000 1.262 2.397 1.00 . A A . 23 PHE CA 1 1 16 6883 1 1 23 PHE CB C 15.364 2.534 2.969 1.00 . A A . 23 PHE CB 1 1 16 6884 1 1 23 PHE CD1 C 16.569 4.408 1.787 1.00 . A A . 23 PHE CD1 1 1 16 6885 1 1 23 PHE CD2 C 17.121 3.945 4.102 1.00 . A A . 23 PHE CD2 1 1 16 6886 1 1 23 PHE CE1 C 17.506 5.448 1.771 1.00 . A A . 23 PHE CE1 1 1 16 6887 1 1 23 PHE CE2 C 18.058 4.985 4.087 1.00 . A A . 23 PHE CE2 1 1 16 6888 1 1 23 PHE CG C 16.376 3.656 2.953 1.00 . A A . 23 PHE CG 1 1 16 6889 1 1 23 PHE CZ C 18.250 5.737 2.921 1.00 . A A . 23 PHE CZ 1 1 16 6890 1 1 23 PHE H H 14.021 0.764 1.690 1.00 . A A . 23 PHE H 1 1 16 6891 1 1 23 PHE HA H 16.898 1.514 1.855 1.00 . A A . 23 PHE HA 1 1 16 6892 1 1 23 PHE HB2 H 14.509 2.810 2.370 1.00 . A A . 23 PHE HB2 1 1 16 6893 1 1 23 PHE HB3 H 15.047 2.352 3.986 1.00 . A A . 23 PHE HB3 1 1 16 6894 1 1 23 PHE HD1 H 15.995 4.186 0.899 1.00 . A A . 23 PHE HD1 1 1 16 6895 1 1 23 PHE HD2 H 16.973 3.366 5.001 1.00 . A A . 23 PHE HD2 1 1 16 6896 1 1 23 PHE HE1 H 17.655 6.028 0.872 1.00 . A A . 23 PHE HE1 1 1 16 6897 1 1 23 PHE HE2 H 18.632 5.208 4.974 1.00 . A A . 23 PHE HE2 1 1 16 6898 1 1 23 PHE HZ H 18.973 6.539 2.909 1.00 . A A . 23 PHE HZ 1 1 16 6899 1 1 23 PHE N N 14.973 0.699 1.466 1.00 . A A . 23 PHE N 1 1 16 6900 1 1 23 PHE O O 16.792 0.638 4.578 1.00 . A A . 23 PHE O 1 1 16 6901 1 1 24 TYR C C 17.240 -3.159 3.765 1.00 . A A . 24 TYR C 1 1 16 6902 1 1 24 TYR CA C 16.372 -2.032 4.350 1.00 . A A . 24 TYR CA 1 1 16 6903 1 1 24 TYR CB C 14.999 -2.564 4.777 1.00 . A A . 24 TYR CB 1 1 16 6904 1 1 24 TYR CD1 C 14.070 -0.718 6.226 1.00 . A A . 24 TYR CD1 1 1 16 6905 1 1 24 TYR CD2 C 14.856 -2.752 7.287 1.00 . A A . 24 TYR CD2 1 1 16 6906 1 1 24 TYR CE1 C 13.730 -0.196 7.479 1.00 . A A . 24 TYR CE1 1 1 16 6907 1 1 24 TYR CE2 C 14.517 -2.229 8.541 1.00 . A A . 24 TYR CE2 1 1 16 6908 1 1 24 TYR CG C 14.634 -1.997 6.130 1.00 . A A . 24 TYR CG 1 1 16 6909 1 1 24 TYR CZ C 13.953 -0.951 8.637 1.00 . A A . 24 TYR CZ 1 1 16 6910 1 1 24 TYR H H 15.703 -1.295 2.439 1.00 . A A . 24 TYR H 1 1 16 6911 1 1 24 TYR HA H 16.868 -1.574 5.191 1.00 . A A . 24 TYR HA 1 1 16 6912 1 1 24 TYR HB2 H 14.256 -2.267 4.051 1.00 . A A . 24 TYR HB2 1 1 16 6913 1 1 24 TYR HB3 H 15.031 -3.641 4.837 1.00 . A A . 24 TYR HB3 1 1 16 6914 1 1 24 TYR HD1 H 13.898 -0.136 5.334 1.00 . A A . 24 TYR HD1 1 1 16 6915 1 1 24 TYR HD2 H 15.290 -3.738 7.213 1.00 . A A . 24 TYR HD2 1 1 16 6916 1 1 24 TYR HE1 H 13.296 0.790 7.553 1.00 . A A . 24 TYR HE1 1 1 16 6917 1 1 24 TYR HE2 H 14.689 -2.812 9.433 1.00 . A A . 24 TYR HE2 1 1 16 6918 1 1 24 TYR HH H 14.316 0.166 10.142 1.00 . A A . 24 TYR HH 1 1 16 6919 1 1 24 TYR N N 16.076 -1.010 3.299 1.00 . A A . 24 TYR N 1 1 16 6920 1 1 24 TYR O O 17.068 -4.320 4.090 1.00 . A A . 24 TYR O 1 1 16 6921 1 1 24 TYR OH O 13.619 -0.437 9.873 1.00 . A A . 24 TYR OH 1 1 16 6922 1 1 25 LYS C C 20.507 -3.363 2.238 1.00 . A A . 25 LYS C 1 1 16 6923 1 1 25 LYS CA C 19.059 -3.865 2.302 1.00 . A A . 25 LYS CA 1 1 16 6924 1 1 25 LYS CB C 18.505 -4.090 0.890 1.00 . A A . 25 LYS CB 1 1 16 6925 1 1 25 LYS CD C 18.176 -6.569 0.777 1.00 . A A . 25 LYS CD 1 1 16 6926 1 1 25 LYS CE C 17.159 -7.651 0.393 1.00 . A A . 25 LYS CE 1 1 16 6927 1 1 25 LYS CG C 17.468 -5.218 0.914 1.00 . A A . 25 LYS CG 1 1 16 6928 1 1 25 LYS H H 18.298 -1.880 2.665 1.00 . A A . 25 LYS H 1 1 16 6929 1 1 25 LYS HA H 19.004 -4.781 2.868 1.00 . A A . 25 LYS HA 1 1 16 6930 1 1 25 LYS HB2 H 18.038 -3.180 0.538 1.00 . A A . 25 LYS HB2 1 1 16 6931 1 1 25 LYS HB3 H 19.311 -4.360 0.225 1.00 . A A . 25 LYS HB3 1 1 16 6932 1 1 25 LYS HD2 H 18.934 -6.500 0.011 1.00 . A A . 25 LYS HD2 1 1 16 6933 1 1 25 LYS HD3 H 18.639 -6.829 1.717 1.00 . A A . 25 LYS HD3 1 1 16 6934 1 1 25 LYS HE2 H 16.255 -7.196 0.010 1.00 . A A . 25 LYS HE2 1 1 16 6935 1 1 25 LYS HE3 H 17.582 -8.321 -0.340 1.00 . A A . 25 LYS HE3 1 1 16 6936 1 1 25 LYS HG2 H 16.925 -5.187 1.848 1.00 . A A . 25 LYS HG2 1 1 16 6937 1 1 25 LYS HG3 H 16.778 -5.091 0.094 1.00 . A A . 25 LYS HG3 1 1 16 6938 1 1 25 LYS HZ1 H 16.530 -7.728 2.380 1.00 . A A . 25 LYS HZ1 1 1 16 6939 1 1 25 LYS HZ2 H 17.747 -8.850 1.994 1.00 . A A . 25 LYS HZ2 1 1 16 6940 1 1 25 LYS HZ3 H 16.150 -9.115 1.480 1.00 . A A . 25 LYS HZ3 1 1 16 6941 1 1 25 LYS N N 18.175 -2.822 2.908 1.00 . A A . 25 LYS N 1 1 16 6942 1 1 25 LYS NZ N 16.875 -8.391 1.657 1.00 . A A . 25 LYS NZ 1 1 16 6943 1 1 25 LYS O O 21.384 -4.088 2.680 1.00 . A A . 25 LYS O 1 1 16 6944 1 1 25 LYS OXT O 20.717 -2.263 1.749 1.00 . A A . 25 LYS OXT 1 1 17 6945 1 1 1 HIS C C -17.481 -1.470 5.167 1.00 . A A . 1 HIS C 1 1 17 6946 1 1 1 HIS CA C -18.805 -1.959 5.768 1.00 . A A . 1 HIS CA 1 1 17 6947 1 1 1 HIS CB C -19.260 -1.023 6.894 1.00 . A A . 1 HIS CB 1 1 17 6948 1 1 1 HIS CD2 C -21.548 -1.690 8.003 1.00 . A A . 1 HIS CD2 1 1 17 6949 1 1 1 HIS CE1 C -22.879 -0.790 6.550 1.00 . A A . 1 HIS CE1 1 1 17 6950 1 1 1 HIS CG C -20.755 -1.107 7.046 1.00 . A A . 1 HIS CG 1 1 17 6951 1 1 1 HIS HA H -19.566 -2.013 5.005 1.00 . A A . 1 HIS HA 1 1 17 6952 1 1 1 HIS HB2 H -18.788 -1.316 7.820 1.00 . A A . 1 HIS HB2 1 1 17 6953 1 1 1 HIS HB3 H -18.980 -0.008 6.653 1.00 . A A . 1 HIS HB3 1 1 17 6954 1 1 1 HIS HD1 H -21.376 -0.042 5.321 1.00 . A A . 1 HIS HD1 1 1 17 6955 1 1 1 HIS HD2 H -21.187 -2.224 8.869 1.00 . A A . 1 HIS HD2 1 1 17 6956 1 1 1 HIS HE1 H -23.769 -0.467 6.030 1.00 . A A . 1 HIS HE1 1 1 17 6957 1 1 1 HIS N N -18.619 -3.295 6.414 1.00 . A A . 1 HIS N 1 1 17 6958 1 1 1 HIS ND1 N -21.626 -0.538 6.129 1.00 . A A . 1 HIS ND1 1 1 17 6959 1 1 1 HIS NE2 N -22.889 -1.490 7.687 1.00 . A A . 1 HIS NE2 1 1 17 6960 1 1 1 HIS O O -16.429 -2.010 5.451 1.00 . A A . 1 HIS O 1 1 17 6961 1 1 2 ALA C C -15.612 -0.958 2.821 1.00 . A A . 2 ALA C 1 1 17 6962 1 1 2 ALA CA C -16.293 0.104 3.697 1.00 . A A . 2 ALA CA 1 1 17 6963 1 1 2 ALA CB C -15.381 0.526 4.853 1.00 . A A . 2 ALA CB 1 1 17 6964 1 1 2 ALA H H -18.403 -0.039 4.134 1.00 . A A . 2 ALA H 1 1 17 6965 1 1 2 ALA HA H -16.542 0.968 3.100 1.00 . A A . 2 ALA HA 1 1 17 6966 1 1 2 ALA HB1 H -14.707 1.299 4.517 1.00 . A A . 2 ALA HB1 1 1 17 6967 1 1 2 ALA HB2 H -14.810 -0.327 5.191 1.00 . A A . 2 ALA HB2 1 1 17 6968 1 1 2 ALA HB3 H -15.982 0.901 5.668 1.00 . A A . 2 ALA HB3 1 1 17 6969 1 1 2 ALA N N -17.535 -0.448 4.338 1.00 . A A . 2 ALA N 1 1 17 6970 1 1 2 ALA O O -14.901 -1.820 3.307 1.00 . A A . 2 ALA O 1 1 17 6971 1 1 3 TRP C C -13.935 -1.300 -0.030 1.00 . A A . 3 TRP C 1 1 17 6972 1 1 3 TRP CA C -15.192 -1.897 0.614 1.00 . A A . 3 TRP CA 1 1 17 6973 1 1 3 TRP CB C -16.255 -2.198 -0.448 1.00 . A A . 3 TRP CB 1 1 17 6974 1 1 3 TRP CD1 C -18.431 -2.725 0.731 1.00 . A A . 3 TRP CD1 1 1 17 6975 1 1 3 TRP CD2 C -17.291 -4.577 0.148 1.00 . A A . 3 TRP CD2 1 1 17 6976 1 1 3 TRP CE2 C -18.474 -5.013 0.791 1.00 . A A . 3 TRP CE2 1 1 17 6977 1 1 3 TRP CE3 C -16.391 -5.552 -0.320 1.00 . A A . 3 TRP CE3 1 1 17 6978 1 1 3 TRP CG C -17.288 -3.119 0.122 1.00 . A A . 3 TRP CG 1 1 17 6979 1 1 3 TRP CH2 C -17.850 -7.324 0.493 1.00 . A A . 3 TRP CH2 1 1 17 6980 1 1 3 TRP CZ2 C -18.754 -6.368 0.964 1.00 . A A . 3 TRP CZ2 1 1 17 6981 1 1 3 TRP CZ3 C -16.671 -6.917 -0.147 1.00 . A A . 3 TRP CZ3 1 1 17 6982 1 1 3 TRP H H -16.396 -0.191 1.165 1.00 . A A . 3 TRP H 1 1 17 6983 1 1 3 TRP HA H -14.945 -2.798 1.153 1.00 . A A . 3 TRP HA 1 1 17 6984 1 1 3 TRP HB2 H -16.728 -1.276 -0.755 1.00 . A A . 3 TRP HB2 1 1 17 6985 1 1 3 TRP HB3 H -15.789 -2.665 -1.302 1.00 . A A . 3 TRP HB3 1 1 17 6986 1 1 3 TRP HD1 H -18.742 -1.702 0.881 1.00 . A A . 3 TRP HD1 1 1 17 6987 1 1 3 TRP HE1 H -19.998 -3.839 1.591 1.00 . A A . 3 TRP HE1 1 1 17 6988 1 1 3 TRP HE3 H -15.481 -5.248 -0.814 1.00 . A A . 3 TRP HE3 1 1 17 6989 1 1 3 TRP HH2 H -18.059 -8.376 0.623 1.00 . A A . 3 TRP HH2 1 1 17 6990 1 1 3 TRP HZ2 H -19.663 -6.678 1.458 1.00 . A A . 3 TRP HZ2 1 1 17 6991 1 1 3 TRP HZ3 H -15.974 -7.658 -0.511 1.00 . A A . 3 TRP HZ3 1 1 17 6992 1 1 3 TRP N N -15.824 -0.897 1.532 1.00 . A A . 3 TRP N 1 1 17 6993 1 1 3 TRP NE1 N -19.135 -3.848 1.128 1.00 . A A . 3 TRP NE1 1 1 17 6994 1 1 3 TRP O O -12.841 -1.805 0.144 1.00 . A A . 3 TRP O 1 1 17 6995 1 1 4 TYR C C -11.898 0.922 -0.368 1.00 . A A . 4 TYR C 1 1 17 6996 1 1 4 TYR CA C -12.902 0.422 -1.420 1.00 . A A . 4 TYR CA 1 1 17 6997 1 1 4 TYR CB C -13.474 1.595 -2.239 1.00 . A A . 4 TYR CB 1 1 17 6998 1 1 4 TYR CD1 C -13.010 3.712 -0.942 1.00 . A A . 4 TYR CD1 1 1 17 6999 1 1 4 TYR CD2 C -15.239 2.761 -0.853 1.00 . A A . 4 TYR CD2 1 1 17 7000 1 1 4 TYR CE1 C -13.420 4.749 -0.096 1.00 . A A . 4 TYR CE1 1 1 17 7001 1 1 4 TYR CE2 C -15.648 3.797 -0.008 1.00 . A A . 4 TYR CE2 1 1 17 7002 1 1 4 TYR CG C -13.919 2.717 -1.321 1.00 . A A . 4 TYR CG 1 1 17 7003 1 1 4 TYR CZ C -14.739 4.791 0.372 1.00 . A A . 4 TYR CZ 1 1 17 7004 1 1 4 TYR H H -14.979 0.163 -0.882 1.00 . A A . 4 TYR H 1 1 17 7005 1 1 4 TYR HA H -12.421 -0.277 -2.079 1.00 . A A . 4 TYR HA 1 1 17 7006 1 1 4 TYR HB2 H -12.714 1.965 -2.911 1.00 . A A . 4 TYR HB2 1 1 17 7007 1 1 4 TYR HB3 H -14.319 1.249 -2.816 1.00 . A A . 4 TYR HB3 1 1 17 7008 1 1 4 TYR HD1 H -11.992 3.680 -1.301 1.00 . A A . 4 TYR HD1 1 1 17 7009 1 1 4 TYR HD2 H -15.941 1.994 -1.147 1.00 . A A . 4 TYR HD2 1 1 17 7010 1 1 4 TYR HE1 H -12.719 5.516 0.198 1.00 . A A . 4 TYR HE1 1 1 17 7011 1 1 4 TYR HE2 H -16.666 3.830 0.353 1.00 . A A . 4 TYR HE2 1 1 17 7012 1 1 4 TYR HH H -15.289 6.595 0.669 1.00 . A A . 4 TYR HH 1 1 17 7013 1 1 4 TYR N N -14.086 -0.223 -0.765 1.00 . A A . 4 TYR N 1 1 17 7014 1 1 4 TYR O O -10.723 1.068 -0.647 1.00 . A A . 4 TYR O 1 1 17 7015 1 1 4 TYR OH O -15.142 5.812 1.205 1.00 . A A . 4 TYR OH 1 1 17 7016 1 1 5 SER C C -10.359 0.622 2.231 1.00 . A A . 5 SER C 1 1 17 7017 1 1 5 SER CA C -11.432 1.670 1.911 1.00 . A A . 5 SER CA 1 1 17 7018 1 1 5 SER CB C -12.329 1.909 3.127 1.00 . A A . 5 SER CB 1 1 17 7019 1 1 5 SER H H -13.303 1.051 1.028 1.00 . A A . 5 SER H 1 1 17 7020 1 1 5 SER HA H -10.971 2.593 1.612 1.00 . A A . 5 SER HA 1 1 17 7021 1 1 5 SER HB2 H -12.892 1.016 3.344 1.00 . A A . 5 SER HB2 1 1 17 7022 1 1 5 SER HB3 H -11.714 2.161 3.981 1.00 . A A . 5 SER HB3 1 1 17 7023 1 1 5 SER HG H -14.074 2.592 2.597 1.00 . A A . 5 SER HG 1 1 17 7024 1 1 5 SER N N -12.352 1.180 0.834 1.00 . A A . 5 SER N 1 1 17 7025 1 1 5 SER O O -9.247 0.955 2.595 1.00 . A A . 5 SER O 1 1 17 7026 1 1 5 SER OG O -13.228 2.974 2.844 1.00 . A A . 5 SER OG 1 1 17 7027 1 1 6 HIS C C -8.746 -1.896 1.178 1.00 . A A . 6 HIS C 1 1 17 7028 1 1 6 HIS CA C -9.672 -1.705 2.382 1.00 . A A . 6 HIS CA 1 1 17 7029 1 1 6 HIS CB C -10.484 -2.976 2.651 1.00 . A A . 6 HIS CB 1 1 17 7030 1 1 6 HIS CD2 C -9.907 -4.055 4.977 1.00 . A A . 6 HIS CD2 1 1 17 7031 1 1 6 HIS CE1 C -8.232 -5.279 4.352 1.00 . A A . 6 HIS CE1 1 1 17 7032 1 1 6 HIS CG C -9.742 -3.844 3.630 1.00 . A A . 6 HIS CG 1 1 17 7033 1 1 6 HIS H H -11.579 -0.881 1.793 1.00 . A A . 6 HIS H 1 1 17 7034 1 1 6 HIS HA H -9.096 -1.444 3.250 1.00 . A A . 6 HIS HA 1 1 17 7035 1 1 6 HIS HB2 H -11.446 -2.708 3.063 1.00 . A A . 6 HIS HB2 1 1 17 7036 1 1 6 HIS HB3 H -10.625 -3.516 1.727 1.00 . A A . 6 HIS HB3 1 1 17 7037 1 1 6 HIS HD1 H -8.293 -4.713 2.351 1.00 . A A . 6 HIS HD1 1 1 17 7038 1 1 6 HIS HD2 H -10.663 -3.588 5.592 1.00 . A A . 6 HIS HD2 1 1 17 7039 1 1 6 HIS HE1 H -7.401 -5.969 4.360 1.00 . A A . 6 HIS HE1 1 1 17 7040 1 1 6 HIS N N -10.680 -0.638 2.093 1.00 . A A . 6 HIS N 1 1 17 7041 1 1 6 HIS ND1 N -8.668 -4.636 3.253 1.00 . A A . 6 HIS ND1 1 1 17 7042 1 1 6 HIS NE2 N -8.953 -4.961 5.430 1.00 . A A . 6 HIS NE2 1 1 17 7043 1 1 6 HIS O O -7.576 -2.193 1.331 1.00 . A A . 6 HIS O 1 1 17 7044 1 1 7 TYR C C -7.303 -0.817 -1.239 1.00 . A A . 7 TYR C 1 1 17 7045 1 1 7 TYR CA C -8.401 -1.882 -1.231 1.00 . A A . 7 TYR CA 1 1 17 7046 1 1 7 TYR CB C -9.341 -1.703 -2.430 1.00 . A A . 7 TYR CB 1 1 17 7047 1 1 7 TYR CD1 C -9.597 -4.133 -3.064 1.00 . A A . 7 TYR CD1 1 1 17 7048 1 1 7 TYR CD2 C -11.551 -2.910 -2.315 1.00 . A A . 7 TYR CD2 1 1 17 7049 1 1 7 TYR CE1 C -10.380 -5.282 -3.228 1.00 . A A . 7 TYR CE1 1 1 17 7050 1 1 7 TYR CE2 C -12.333 -4.057 -2.478 1.00 . A A . 7 TYR CE2 1 1 17 7051 1 1 7 TYR CG C -10.182 -2.946 -2.607 1.00 . A A . 7 TYR CG 1 1 17 7052 1 1 7 TYR CZ C -11.749 -5.244 -2.934 1.00 . A A . 7 TYR CZ 1 1 17 7053 1 1 7 TYR H H -10.200 -1.475 -0.107 1.00 . A A . 7 TYR H 1 1 17 7054 1 1 7 TYR HA H -7.962 -2.862 -1.248 1.00 . A A . 7 TYR HA 1 1 17 7055 1 1 7 TYR HB2 H -9.985 -0.852 -2.258 1.00 . A A . 7 TYR HB2 1 1 17 7056 1 1 7 TYR HB3 H -8.756 -1.536 -3.321 1.00 . A A . 7 TYR HB3 1 1 17 7057 1 1 7 TYR HD1 H -8.541 -4.162 -3.290 1.00 . A A . 7 TYR HD1 1 1 17 7058 1 1 7 TYR HD2 H -12.002 -1.996 -1.964 1.00 . A A . 7 TYR HD2 1 1 17 7059 1 1 7 TYR HE1 H -9.929 -6.198 -3.580 1.00 . A A . 7 TYR HE1 1 1 17 7060 1 1 7 TYR HE2 H -13.389 -4.028 -2.251 1.00 . A A . 7 TYR HE2 1 1 17 7061 1 1 7 TYR HH H -12.991 -6.299 -3.928 1.00 . A A . 7 TYR HH 1 1 17 7062 1 1 7 TYR N N -9.257 -1.720 -0.015 1.00 . A A . 7 TYR N 1 1 17 7063 1 1 7 TYR O O -6.149 -1.111 -1.486 1.00 . A A . 7 TYR O 1 1 17 7064 1 1 7 TYR OH O -12.520 -6.375 -3.094 1.00 . A A . 7 TYR OH 1 1 17 7065 1 1 8 VAL C C -5.640 1.238 0.237 1.00 . A A . 8 VAL C 1 1 17 7066 1 1 8 VAL CA C -6.619 1.496 -0.918 1.00 . A A . 8 VAL CA 1 1 17 7067 1 1 8 VAL CB C -7.393 2.812 -0.723 1.00 . A A . 8 VAL CB 1 1 17 7068 1 1 8 VAL CG1 C -8.076 2.837 0.648 1.00 . A A . 8 VAL CG1 1 1 17 7069 1 1 8 VAL CG2 C -6.423 3.993 -0.827 1.00 . A A . 8 VAL CG2 1 1 17 7070 1 1 8 VAL H H -8.587 0.615 -0.741 1.00 . A A . 8 VAL H 1 1 17 7071 1 1 8 VAL HA H -6.085 1.519 -1.851 1.00 . A A . 8 VAL HA 1 1 17 7072 1 1 8 VAL HB H -8.145 2.899 -1.495 1.00 . A A . 8 VAL HB 1 1 17 7073 1 1 8 VAL HG11 H -8.846 2.082 0.680 1.00 . A A . 8 VAL HG11 1 1 17 7074 1 1 8 VAL HG12 H -8.517 3.808 0.811 1.00 . A A . 8 VAL HG12 1 1 17 7075 1 1 8 VAL HG13 H -7.345 2.640 1.419 1.00 . A A . 8 VAL HG13 1 1 17 7076 1 1 8 VAL HG21 H -6.981 4.917 -0.844 1.00 . A A . 8 VAL HG21 1 1 17 7077 1 1 8 VAL HG22 H -5.844 3.906 -1.734 1.00 . A A . 8 VAL HG22 1 1 17 7078 1 1 8 VAL HG23 H -5.759 3.989 0.026 1.00 . A A . 8 VAL HG23 1 1 17 7079 1 1 8 VAL N N -7.652 0.411 -0.950 1.00 . A A . 8 VAL N 1 1 17 7080 1 1 8 VAL O O -4.485 1.614 0.176 1.00 . A A . 8 VAL O 1 1 17 7081 1 1 9 LEU C C -4.200 -0.829 2.004 1.00 . A A . 9 LEU C 1 1 17 7082 1 1 9 LEU CA C -5.192 0.262 2.424 1.00 . A A . 9 LEU CA 1 1 17 7083 1 1 9 LEU CB C -6.117 -0.243 3.537 1.00 . A A . 9 LEU CB 1 1 17 7084 1 1 9 LEU CD1 C -5.423 1.349 5.337 1.00 . A A . 9 LEU CD1 1 1 17 7085 1 1 9 LEU CD2 C -6.139 -0.970 5.928 1.00 . A A . 9 LEU CD2 1 1 17 7086 1 1 9 LEU CG C -5.411 -0.114 4.889 1.00 . A A . 9 LEU CG 1 1 17 7087 1 1 9 LEU H H -7.024 0.267 1.288 1.00 . A A . 9 LEU H 1 1 17 7088 1 1 9 LEU HA H -4.668 1.147 2.745 1.00 . A A . 9 LEU HA 1 1 17 7089 1 1 9 LEU HB2 H -7.023 0.345 3.546 1.00 . A A . 9 LEU HB2 1 1 17 7090 1 1 9 LEU HB3 H -6.361 -1.279 3.359 1.00 . A A . 9 LEU HB3 1 1 17 7091 1 1 9 LEU HD11 H -4.764 1.926 4.704 1.00 . A A . 9 LEU HD11 1 1 17 7092 1 1 9 LEU HD12 H -5.086 1.415 6.362 1.00 . A A . 9 LEU HD12 1 1 17 7093 1 1 9 LEU HD13 H -6.426 1.741 5.262 1.00 . A A . 9 LEU HD13 1 1 17 7094 1 1 9 LEU HD21 H -5.592 -0.948 6.859 1.00 . A A . 9 LEU HD21 1 1 17 7095 1 1 9 LEU HD22 H -6.206 -1.988 5.574 1.00 . A A . 9 LEU HD22 1 1 17 7096 1 1 9 LEU HD23 H -7.133 -0.577 6.086 1.00 . A A . 9 LEU HD23 1 1 17 7097 1 1 9 LEU HG H -4.388 -0.451 4.795 1.00 . A A . 9 LEU HG 1 1 17 7098 1 1 9 LEU N N -6.093 0.575 1.275 1.00 . A A . 9 LEU N 1 1 17 7099 1 1 9 LEU O O -3.033 -0.781 2.346 1.00 . A A . 9 LEU O 1 1 17 7100 1 1 10 LYS C C -2.742 -2.314 -0.229 1.00 . A A . 10 LYS C 1 1 17 7101 1 1 10 LYS CA C -3.738 -2.888 0.784 1.00 . A A . 10 LYS CA 1 1 17 7102 1 1 10 LYS CB C -4.644 -3.932 0.121 1.00 . A A . 10 LYS CB 1 1 17 7103 1 1 10 LYS CD C -5.742 -6.158 0.422 1.00 . A A . 10 LYS CD 1 1 17 7104 1 1 10 LYS CE C -5.074 -6.996 -0.674 1.00 . A A . 10 LYS CE 1 1 17 7105 1 1 10 LYS CG C -4.727 -5.175 1.011 1.00 . A A . 10 LYS CG 1 1 17 7106 1 1 10 LYS H H -5.601 -1.809 0.972 1.00 . A A . 10 LYS H 1 1 17 7107 1 1 10 LYS HA H -3.217 -3.324 1.622 1.00 . A A . 10 LYS HA 1 1 17 7108 1 1 10 LYS HB2 H -5.633 -3.518 -0.016 1.00 . A A . 10 LYS HB2 1 1 17 7109 1 1 10 LYS HB3 H -4.233 -4.207 -0.839 1.00 . A A . 10 LYS HB3 1 1 17 7110 1 1 10 LYS HD2 H -6.105 -6.810 1.205 1.00 . A A . 10 LYS HD2 1 1 17 7111 1 1 10 LYS HD3 H -6.570 -5.610 -0.001 1.00 . A A . 10 LYS HD3 1 1 17 7112 1 1 10 LYS HE2 H -5.811 -7.325 -1.394 1.00 . A A . 10 LYS HE2 1 1 17 7113 1 1 10 LYS HE3 H -4.299 -6.426 -1.164 1.00 . A A . 10 LYS HE3 1 1 17 7114 1 1 10 LYS HG2 H -3.755 -5.645 1.063 1.00 . A A . 10 LYS HG2 1 1 17 7115 1 1 10 LYS HG3 H -5.041 -4.887 2.003 1.00 . A A . 10 LYS HG3 1 1 17 7116 1 1 10 LYS HZ1 H -5.235 -8.773 0.405 1.00 . A A . 10 LYS HZ1 1 1 17 7117 1 1 10 LYS HZ2 H -3.881 -7.832 0.820 1.00 . A A . 10 LYS HZ2 1 1 17 7118 1 1 10 LYS HZ3 H -3.894 -8.713 -0.633 1.00 . A A . 10 LYS HZ3 1 1 17 7119 1 1 10 LYS N N -4.656 -1.802 1.247 1.00 . A A . 10 LYS N 1 1 17 7120 1 1 10 LYS NZ N -4.476 -8.167 0.033 1.00 . A A . 10 LYS NZ 1 1 17 7121 1 1 10 LYS O O -1.552 -2.557 -0.147 1.00 . A A . 10 LYS O 1 1 17 7122 1 1 11 PHE C C -1.299 -0.007 -1.485 1.00 . A A . 11 PHE C 1 1 17 7123 1 1 11 PHE CA C -2.310 -0.921 -2.187 1.00 . A A . 11 PHE CA 1 1 17 7124 1 1 11 PHE CB C -3.228 -0.109 -3.108 1.00 . A A . 11 PHE CB 1 1 17 7125 1 1 11 PHE CD1 C -2.510 -0.739 -5.444 1.00 . A A . 11 PHE CD1 1 1 17 7126 1 1 11 PHE CD2 C -1.854 1.425 -4.565 1.00 . A A . 11 PHE CD2 1 1 17 7127 1 1 11 PHE CE1 C -1.849 -0.451 -6.644 1.00 . A A . 11 PHE CE1 1 1 17 7128 1 1 11 PHE CE2 C -1.194 1.712 -5.766 1.00 . A A . 11 PHE CE2 1 1 17 7129 1 1 11 PHE CG C -2.512 0.199 -4.404 1.00 . A A . 11 PHE CG 1 1 17 7130 1 1 11 PHE CZ C -1.191 0.774 -6.805 1.00 . A A . 11 PHE CZ 1 1 17 7131 1 1 11 PHE H H -4.184 -1.346 -1.204 1.00 . A A . 11 PHE H 1 1 17 7132 1 1 11 PHE HA H -1.799 -1.687 -2.749 1.00 . A A . 11 PHE HA 1 1 17 7133 1 1 11 PHE HB2 H -4.120 -0.680 -3.319 1.00 . A A . 11 PHE HB2 1 1 17 7134 1 1 11 PHE HB3 H -3.500 0.815 -2.620 1.00 . A A . 11 PHE HB3 1 1 17 7135 1 1 11 PHE HD1 H -3.017 -1.684 -5.319 1.00 . A A . 11 PHE HD1 1 1 17 7136 1 1 11 PHE HD2 H -1.855 2.148 -3.763 1.00 . A A . 11 PHE HD2 1 1 17 7137 1 1 11 PHE HE1 H -1.847 -1.175 -7.446 1.00 . A A . 11 PHE HE1 1 1 17 7138 1 1 11 PHE HE2 H -0.686 2.657 -5.890 1.00 . A A . 11 PHE HE2 1 1 17 7139 1 1 11 PHE HZ H -0.682 0.996 -7.732 1.00 . A A . 11 PHE HZ 1 1 17 7140 1 1 11 PHE N N -3.221 -1.536 -1.172 1.00 . A A . 11 PHE N 1 1 17 7141 1 1 11 PHE O O -0.117 -0.043 -1.770 1.00 . A A . 11 PHE O 1 1 17 7142 1 1 12 PHE C C 0.173 0.852 0.991 1.00 . A A . 12 PHE C 1 1 17 7143 1 1 12 PHE CA C -0.818 1.699 0.185 1.00 . A A . 12 PHE CA 1 1 17 7144 1 1 12 PHE CB C -1.706 2.533 1.116 1.00 . A A . 12 PHE CB 1 1 17 7145 1 1 12 PHE CD1 C -0.417 4.698 1.244 1.00 . A A . 12 PHE CD1 1 1 17 7146 1 1 12 PHE CD2 C -0.510 3.279 3.208 1.00 . A A . 12 PHE CD2 1 1 17 7147 1 1 12 PHE CE1 C 0.369 5.618 1.947 1.00 . A A . 12 PHE CE1 1 1 17 7148 1 1 12 PHE CE2 C 0.276 4.200 3.910 1.00 . A A . 12 PHE CE2 1 1 17 7149 1 1 12 PHE CG C -0.857 3.528 1.874 1.00 . A A . 12 PHE CG 1 1 17 7150 1 1 12 PHE CZ C 0.716 5.369 3.280 1.00 . A A . 12 PHE CZ 1 1 17 7151 1 1 12 PHE H H -2.711 0.801 -0.331 1.00 . A A . 12 PHE H 1 1 17 7152 1 1 12 PHE HA H -0.294 2.344 -0.503 1.00 . A A . 12 PHE HA 1 1 17 7153 1 1 12 PHE HB2 H -2.443 3.063 0.531 1.00 . A A . 12 PHE HB2 1 1 17 7154 1 1 12 PHE HB3 H -2.205 1.879 1.817 1.00 . A A . 12 PHE HB3 1 1 17 7155 1 1 12 PHE HD1 H -0.684 4.893 0.216 1.00 . A A . 12 PHE HD1 1 1 17 7156 1 1 12 PHE HD2 H -0.849 2.376 3.694 1.00 . A A . 12 PHE HD2 1 1 17 7157 1 1 12 PHE HE1 H 0.708 6.522 1.461 1.00 . A A . 12 PHE HE1 1 1 17 7158 1 1 12 PHE HE2 H 0.543 4.007 4.940 1.00 . A A . 12 PHE HE2 1 1 17 7159 1 1 12 PHE HZ H 1.323 6.080 3.823 1.00 . A A . 12 PHE HZ 1 1 17 7160 1 1 12 PHE N N -1.755 0.799 -0.553 1.00 . A A . 12 PHE N 1 1 17 7161 1 1 12 PHE O O 1.359 1.105 0.989 1.00 . A A . 12 PHE O 1 1 17 7162 1 1 13 LEU C C 1.622 -1.730 1.534 1.00 . A A . 13 LEU C 1 1 17 7163 1 1 13 LEU CA C 0.602 -1.048 2.459 1.00 . A A . 13 LEU CA 1 1 17 7164 1 1 13 LEU CB C -0.320 -2.087 3.112 1.00 . A A . 13 LEU CB 1 1 17 7165 1 1 13 LEU CD1 C -0.182 -3.244 5.325 1.00 . A A . 13 LEU CD1 1 1 17 7166 1 1 13 LEU CD2 C 0.603 -4.408 3.259 1.00 . A A . 13 LEU CD2 1 1 17 7167 1 1 13 LEU CG C 0.502 -3.055 3.969 1.00 . A A . 13 LEU CG 1 1 17 7168 1 1 13 LEU H H -1.271 -0.356 1.637 1.00 . A A . 13 LEU H 1 1 17 7169 1 1 13 LEU HA H 1.109 -0.475 3.217 1.00 . A A . 13 LEU HA 1 1 17 7170 1 1 13 LEU HB2 H -1.044 -1.580 3.734 1.00 . A A . 13 LEU HB2 1 1 17 7171 1 1 13 LEU HB3 H -0.836 -2.641 2.341 1.00 . A A . 13 LEU HB3 1 1 17 7172 1 1 13 LEU HD11 H 0.482 -3.776 5.991 1.00 . A A . 13 LEU HD11 1 1 17 7173 1 1 13 LEU HD12 H -1.091 -3.812 5.193 1.00 . A A . 13 LEU HD12 1 1 17 7174 1 1 13 LEU HD13 H -0.417 -2.278 5.748 1.00 . A A . 13 LEU HD13 1 1 17 7175 1 1 13 LEU HD21 H 1.172 -5.093 3.871 1.00 . A A . 13 LEU HD21 1 1 17 7176 1 1 13 LEU HD22 H 1.097 -4.280 2.307 1.00 . A A . 13 LEU HD22 1 1 17 7177 1 1 13 LEU HD23 H -0.389 -4.807 3.100 1.00 . A A . 13 LEU HD23 1 1 17 7178 1 1 13 LEU HG H 1.493 -2.650 4.121 1.00 . A A . 13 LEU HG 1 1 17 7179 1 1 13 LEU N N -0.308 -0.166 1.664 1.00 . A A . 13 LEU N 1 1 17 7180 1 1 13 LEU O O 2.734 -2.014 1.934 1.00 . A A . 13 LEU O 1 1 17 7181 1 1 14 LEU C C 3.106 -1.586 -1.302 1.00 . A A . 14 LEU C 1 1 17 7182 1 1 14 LEU CA C 2.204 -2.638 -0.652 1.00 . A A . 14 LEU CA 1 1 17 7183 1 1 14 LEU CB C 1.319 -3.321 -1.703 1.00 . A A . 14 LEU CB 1 1 17 7184 1 1 14 LEU CD1 C 1.615 -5.742 -1.145 1.00 . A A . 14 LEU CD1 1 1 17 7185 1 1 14 LEU CD2 C 1.455 -5.022 -3.532 1.00 . A A . 14 LEU CD2 1 1 17 7186 1 1 14 LEU CG C 1.969 -4.637 -2.142 1.00 . A A . 14 LEU CG 1 1 17 7187 1 1 14 LEU H H 0.353 -1.743 -0.002 1.00 . A A . 14 LEU H 1 1 17 7188 1 1 14 LEU HA H 2.799 -3.372 -0.140 1.00 . A A . 14 LEU HA 1 1 17 7189 1 1 14 LEU HB2 H 0.346 -3.522 -1.280 1.00 . A A . 14 LEU HB2 1 1 17 7190 1 1 14 LEU HB3 H 1.212 -2.673 -2.559 1.00 . A A . 14 LEU HB3 1 1 17 7191 1 1 14 LEU HD11 H 0.544 -5.885 -1.129 1.00 . A A . 14 LEU HD11 1 1 17 7192 1 1 14 LEU HD12 H 1.955 -5.461 -0.159 1.00 . A A . 14 LEU HD12 1 1 17 7193 1 1 14 LEU HD13 H 2.097 -6.663 -1.441 1.00 . A A . 14 LEU HD13 1 1 17 7194 1 1 14 LEU HD21 H 0.395 -4.822 -3.594 1.00 . A A . 14 LEU HD21 1 1 17 7195 1 1 14 LEU HD22 H 1.632 -6.074 -3.703 1.00 . A A . 14 LEU HD22 1 1 17 7196 1 1 14 LEU HD23 H 1.975 -4.444 -4.282 1.00 . A A . 14 LEU HD23 1 1 17 7197 1 1 14 LEU HG H 3.042 -4.515 -2.176 1.00 . A A . 14 LEU HG 1 1 17 7198 1 1 14 LEU N N 1.254 -1.986 0.300 1.00 . A A . 14 LEU N 1 1 17 7199 1 1 14 LEU O O 4.317 -1.662 -1.231 1.00 . A A . 14 LEU O 1 1 17 7200 1 1 15 VAL C C 4.147 1.237 -1.538 1.00 . A A . 15 VAL C 1 1 17 7201 1 1 15 VAL CA C 3.336 0.470 -2.590 1.00 . A A . 15 VAL CA 1 1 17 7202 1 1 15 VAL CB C 2.320 1.393 -3.282 1.00 . A A . 15 VAL CB 1 1 17 7203 1 1 15 VAL CG1 C 3.022 2.663 -3.773 1.00 . A A . 15 VAL CG1 1 1 17 7204 1 1 15 VAL CG2 C 1.702 0.664 -4.479 1.00 . A A . 15 VAL CG2 1 1 17 7205 1 1 15 VAL H H 1.542 -0.563 -1.967 1.00 . A A . 15 VAL H 1 1 17 7206 1 1 15 VAL HA H 3.995 0.035 -3.325 1.00 . A A . 15 VAL HA 1 1 17 7207 1 1 15 VAL HB H 1.542 1.660 -2.581 1.00 . A A . 15 VAL HB 1 1 17 7208 1 1 15 VAL HG11 H 2.493 3.059 -4.628 1.00 . A A . 15 VAL HG11 1 1 17 7209 1 1 15 VAL HG12 H 4.038 2.426 -4.057 1.00 . A A . 15 VAL HG12 1 1 17 7210 1 1 15 VAL HG13 H 3.031 3.398 -2.983 1.00 . A A . 15 VAL HG13 1 1 17 7211 1 1 15 VAL HG21 H 0.760 0.224 -4.186 1.00 . A A . 15 VAL HG21 1 1 17 7212 1 1 15 VAL HG22 H 2.372 -0.114 -4.815 1.00 . A A . 15 VAL HG22 1 1 17 7213 1 1 15 VAL HG23 H 1.537 1.367 -5.283 1.00 . A A . 15 VAL HG23 1 1 17 7214 1 1 15 VAL N N 2.520 -0.600 -1.932 1.00 . A A . 15 VAL N 1 1 17 7215 1 1 15 VAL O O 5.357 1.312 -1.621 1.00 . A A . 15 VAL O 1 1 17 7216 1 1 16 PHE C C 5.113 1.575 1.323 1.00 . A A . 16 PHE C 1 1 17 7217 1 1 16 PHE CA C 4.241 2.543 0.513 1.00 . A A . 16 PHE CA 1 1 17 7218 1 1 16 PHE CB C 3.171 3.183 1.402 1.00 . A A . 16 PHE CB 1 1 17 7219 1 1 16 PHE CD1 C 3.774 5.633 1.423 1.00 . A A . 16 PHE CD1 1 1 17 7220 1 1 16 PHE CD2 C 4.254 4.296 3.388 1.00 . A A . 16 PHE CD2 1 1 17 7221 1 1 16 PHE CE1 C 4.308 6.759 2.059 1.00 . A A . 16 PHE CE1 1 1 17 7222 1 1 16 PHE CE2 C 4.789 5.422 4.023 1.00 . A A . 16 PHE CE2 1 1 17 7223 1 1 16 PHE CG C 3.747 4.401 2.088 1.00 . A A . 16 PHE CG 1 1 17 7224 1 1 16 PHE CZ C 4.816 6.654 3.359 1.00 . A A . 16 PHE CZ 1 1 17 7225 1 1 16 PHE H H 2.518 1.708 -0.490 1.00 . A A . 16 PHE H 1 1 17 7226 1 1 16 PHE HA H 4.853 3.310 0.064 1.00 . A A . 16 PHE HA 1 1 17 7227 1 1 16 PHE HB2 H 2.326 3.478 0.796 1.00 . A A . 16 PHE HB2 1 1 17 7228 1 1 16 PHE HB3 H 2.848 2.471 2.148 1.00 . A A . 16 PHE HB3 1 1 17 7229 1 1 16 PHE HD1 H 3.381 5.714 0.420 1.00 . A A . 16 PHE HD1 1 1 17 7230 1 1 16 PHE HD2 H 4.235 3.346 3.901 1.00 . A A . 16 PHE HD2 1 1 17 7231 1 1 16 PHE HE1 H 4.329 7.710 1.547 1.00 . A A . 16 PHE HE1 1 1 17 7232 1 1 16 PHE HE2 H 5.180 5.341 5.027 1.00 . A A . 16 PHE HE2 1 1 17 7233 1 1 16 PHE HZ H 5.229 7.524 3.850 1.00 . A A . 16 PHE HZ 1 1 17 7234 1 1 16 PHE N N 3.494 1.793 -0.545 1.00 . A A . 16 PHE N 1 1 17 7235 1 1 16 PHE O O 6.190 1.929 1.763 1.00 . A A . 16 PHE O 1 1 17 7236 1 1 17 GLY C C 6.782 -0.902 1.550 1.00 . A A . 17 GLY C 1 1 17 7237 1 1 17 GLY CA C 5.466 -0.638 2.283 1.00 . A A . 17 GLY CA 1 1 17 7238 1 1 17 GLY H H 3.791 0.093 1.142 1.00 . A A . 17 GLY H 1 1 17 7239 1 1 17 GLY HA2 H 5.675 -0.246 3.269 1.00 . A A . 17 GLY HA2 1 1 17 7240 1 1 17 GLY HA3 H 4.916 -1.562 2.370 1.00 . A A . 17 GLY HA3 1 1 17 7241 1 1 17 GLY N N 4.660 0.357 1.513 1.00 . A A . 17 GLY N 1 1 17 7242 1 1 17 GLY O O 7.849 -0.750 2.111 1.00 . A A . 17 GLY O 1 1 17 7243 1 1 18 GLU C C 8.791 -0.253 -0.589 1.00 . A A . 18 GLU C 1 1 17 7244 1 1 18 GLU CA C 7.973 -1.543 -0.474 1.00 . A A . 18 GLU CA 1 1 17 7245 1 1 18 GLU CB C 7.520 -2.028 -1.855 1.00 . A A . 18 GLU CB 1 1 17 7246 1 1 18 GLU CD C 6.141 -4.080 -2.269 1.00 . A A . 18 GLU CD 1 1 17 7247 1 1 18 GLU CG C 7.532 -3.560 -1.892 1.00 . A A . 18 GLU CG 1 1 17 7248 1 1 18 GLU H H 5.842 -1.392 -0.139 1.00 . A A . 18 GLU H 1 1 17 7249 1 1 18 GLU HA H 8.555 -2.304 0.013 1.00 . A A . 18 GLU HA 1 1 17 7250 1 1 18 GLU HB2 H 6.520 -1.669 -2.054 1.00 . A A . 18 GLU HB2 1 1 17 7251 1 1 18 GLU HB3 H 8.194 -1.647 -2.609 1.00 . A A . 18 GLU HB3 1 1 17 7252 1 1 18 GLU HG2 H 8.252 -3.896 -2.625 1.00 . A A . 18 GLU HG2 1 1 17 7253 1 1 18 GLU HG3 H 7.805 -3.943 -0.920 1.00 . A A . 18 GLU HG3 1 1 17 7254 1 1 18 GLU N N 6.716 -1.284 0.296 1.00 . A A . 18 GLU N 1 1 17 7255 1 1 18 GLU O O 10.007 -0.272 -0.518 1.00 . A A . 18 GLU O 1 1 17 7256 1 1 18 GLU OE1 O 5.858 -4.155 -3.455 1.00 . A A . 18 GLU OE1 1 1 17 7257 1 1 18 GLU OE2 O 5.382 -4.397 -1.366 1.00 . A A . 18 GLU OE2 1 1 17 7258 1 1 19 ASN C C 9.606 2.433 0.478 1.00 . A A . 19 ASN C 1 1 17 7259 1 1 19 ASN CA C 8.868 2.168 -0.838 1.00 . A A . 19 ASN CA 1 1 17 7260 1 1 19 ASN CB C 7.794 3.233 -1.081 1.00 . A A . 19 ASN CB 1 1 17 7261 1 1 19 ASN CG C 7.654 3.483 -2.585 1.00 . A A . 19 ASN CG 1 1 17 7262 1 1 19 ASN H H 7.153 0.855 -0.779 1.00 . A A . 19 ASN H 1 1 17 7263 1 1 19 ASN HA H 9.562 2.146 -1.657 1.00 . A A . 19 ASN HA 1 1 17 7264 1 1 19 ASN HB2 H 6.850 2.894 -0.682 1.00 . A A . 19 ASN HB2 1 1 17 7265 1 1 19 ASN HB3 H 8.082 4.153 -0.592 1.00 . A A . 19 ASN HB3 1 1 17 7266 1 1 19 ASN HD21 H 6.513 1.887 -2.895 1.00 . A A . 19 ASN HD21 1 1 17 7267 1 1 19 ASN HD22 H 6.858 2.814 -4.274 1.00 . A A . 19 ASN HD22 1 1 17 7268 1 1 19 ASN N N 8.132 0.869 -0.743 1.00 . A A . 19 ASN N 1 1 17 7269 1 1 19 ASN ND2 N 6.949 2.660 -3.312 1.00 . A A . 19 ASN ND2 1 1 17 7270 1 1 19 ASN O O 10.724 2.911 0.489 1.00 . A A . 19 ASN O 1 1 17 7271 1 1 19 ASN OD1 O 8.192 4.439 -3.104 1.00 . A A . 19 ASN OD1 1 1 17 7272 1 1 20 GLY C C 10.688 1.217 3.122 1.00 . A A . 20 GLY C 1 1 17 7273 1 1 20 GLY CA C 9.637 2.305 2.908 1.00 . A A . 20 GLY CA 1 1 17 7274 1 1 20 GLY H H 8.092 1.707 1.536 1.00 . A A . 20 GLY H 1 1 17 7275 1 1 20 GLY HA2 H 10.112 3.274 2.934 1.00 . A A . 20 GLY HA2 1 1 17 7276 1 1 20 GLY HA3 H 8.897 2.242 3.690 1.00 . A A . 20 GLY HA3 1 1 17 7277 1 1 20 GLY N N 8.986 2.102 1.582 1.00 . A A . 20 GLY N 1 1 17 7278 1 1 20 GLY O O 11.771 1.485 3.607 1.00 . A A . 20 GLY O 1 1 17 7279 1 1 21 VAL C C 12.671 -0.762 2.194 1.00 . A A . 21 VAL C 1 1 17 7280 1 1 21 VAL CA C 11.374 -1.116 2.928 1.00 . A A . 21 VAL CA 1 1 17 7281 1 1 21 VAL CB C 10.710 -2.360 2.312 1.00 . A A . 21 VAL CB 1 1 17 7282 1 1 21 VAL CG1 C 11.759 -3.449 2.063 1.00 . A A . 21 VAL CG1 1 1 17 7283 1 1 21 VAL CG2 C 9.648 -2.898 3.276 1.00 . A A . 21 VAL CG2 1 1 17 7284 1 1 21 VAL H H 9.500 -0.198 2.361 1.00 . A A . 21 VAL H 1 1 17 7285 1 1 21 VAL HA H 11.571 -1.284 3.971 1.00 . A A . 21 VAL HA 1 1 17 7286 1 1 21 VAL HB H 10.243 -2.091 1.376 1.00 . A A . 21 VAL HB 1 1 17 7287 1 1 21 VAL HG11 H 11.351 -4.412 2.331 1.00 . A A . 21 VAL HG11 1 1 17 7288 1 1 21 VAL HG12 H 12.635 -3.251 2.663 1.00 . A A . 21 VAL HG12 1 1 17 7289 1 1 21 VAL HG13 H 12.033 -3.453 1.019 1.00 . A A . 21 VAL HG13 1 1 17 7290 1 1 21 VAL HG21 H 10.124 -3.503 4.034 1.00 . A A . 21 VAL HG21 1 1 17 7291 1 1 21 VAL HG22 H 8.936 -3.498 2.730 1.00 . A A . 21 VAL HG22 1 1 17 7292 1 1 21 VAL HG23 H 9.136 -2.071 3.746 1.00 . A A . 21 VAL HG23 1 1 17 7293 1 1 21 VAL N N 10.382 -0.009 2.756 1.00 . A A . 21 VAL N 1 1 17 7294 1 1 21 VAL O O 13.702 -0.582 2.814 1.00 . A A . 21 VAL O 1 1 17 7295 1 1 22 PHE C C 14.850 -1.462 0.108 1.00 . A A . 22 PHE C 1 1 17 7296 1 1 22 PHE CA C 13.825 -0.322 0.058 1.00 . A A . 22 PHE CA 1 1 17 7297 1 1 22 PHE CB C 14.403 0.965 0.664 1.00 . A A . 22 PHE CB 1 1 17 7298 1 1 22 PHE CD1 C 16.562 1.248 -0.614 1.00 . A A . 22 PHE CD1 1 1 17 7299 1 1 22 PHE CD2 C 14.725 2.763 -1.075 1.00 . A A . 22 PHE CD2 1 1 17 7300 1 1 22 PHE CE1 C 17.346 1.907 -1.568 1.00 . A A . 22 PHE CE1 1 1 17 7301 1 1 22 PHE CE2 C 15.509 3.421 -2.030 1.00 . A A . 22 PHE CE2 1 1 17 7302 1 1 22 PHE CG C 15.251 1.676 -0.367 1.00 . A A . 22 PHE CG 1 1 17 7303 1 1 22 PHE CZ C 16.819 2.994 -2.276 1.00 . A A . 22 PHE CZ 1 1 17 7304 1 1 22 PHE H H 11.762 -0.816 0.436 1.00 . A A . 22 PHE H 1 1 17 7305 1 1 22 PHE HA H 13.533 -0.142 -0.961 1.00 . A A . 22 PHE HA 1 1 17 7306 1 1 22 PHE HB2 H 13.595 1.611 0.974 1.00 . A A . 22 PHE HB2 1 1 17 7307 1 1 22 PHE HB3 H 15.014 0.718 1.520 1.00 . A A . 22 PHE HB3 1 1 17 7308 1 1 22 PHE HD1 H 16.968 0.410 -0.066 1.00 . A A . 22 PHE HD1 1 1 17 7309 1 1 22 PHE HD2 H 13.714 3.093 -0.886 1.00 . A A . 22 PHE HD2 1 1 17 7310 1 1 22 PHE HE1 H 18.357 1.578 -1.758 1.00 . A A . 22 PHE HE1 1 1 17 7311 1 1 22 PHE HE2 H 15.103 4.260 -2.577 1.00 . A A . 22 PHE HE2 1 1 17 7312 1 1 22 PHE HZ H 17.423 3.503 -3.013 1.00 . A A . 22 PHE HZ 1 1 17 7313 1 1 22 PHE N N 12.614 -0.663 0.884 1.00 . A A . 22 PHE N 1 1 17 7314 1 1 22 PHE O O 15.265 -1.983 -0.910 1.00 . A A . 22 PHE O 1 1 17 7315 1 1 23 PHE C C 15.804 -3.878 2.589 1.00 . A A . 23 PHE C 1 1 17 7316 1 1 23 PHE CA C 16.233 -2.959 1.441 1.00 . A A . 23 PHE CA 1 1 17 7317 1 1 23 PHE CB C 17.565 -2.268 1.757 1.00 . A A . 23 PHE CB 1 1 17 7318 1 1 23 PHE CD1 C 19.015 -2.939 -0.194 1.00 . A A . 23 PHE CD1 1 1 17 7319 1 1 23 PHE CD2 C 19.449 -3.933 1.976 1.00 . A A . 23 PHE CD2 1 1 17 7320 1 1 23 PHE CE1 C 20.071 -3.677 -0.743 1.00 . A A . 23 PHE CE1 1 1 17 7321 1 1 23 PHE CE2 C 20.504 -4.670 1.427 1.00 . A A . 23 PHE CE2 1 1 17 7322 1 1 23 PHE CG C 18.703 -3.067 1.165 1.00 . A A . 23 PHE CG 1 1 17 7323 1 1 23 PHE CZ C 20.816 -4.542 0.068 1.00 . A A . 23 PHE CZ 1 1 17 7324 1 1 23 PHE H H 14.880 -1.407 2.081 1.00 . A A . 23 PHE H 1 1 17 7325 1 1 23 PHE HA H 16.315 -3.517 0.527 1.00 . A A . 23 PHE HA 1 1 17 7326 1 1 23 PHE HB2 H 17.565 -1.275 1.333 1.00 . A A . 23 PHE HB2 1 1 17 7327 1 1 23 PHE HB3 H 17.692 -2.203 2.828 1.00 . A A . 23 PHE HB3 1 1 17 7328 1 1 23 PHE HD1 H 18.439 -2.272 -0.820 1.00 . A A . 23 PHE HD1 1 1 17 7329 1 1 23 PHE HD2 H 19.210 -4.031 3.024 1.00 . A A . 23 PHE HD2 1 1 17 7330 1 1 23 PHE HE1 H 20.310 -3.578 -1.791 1.00 . A A . 23 PHE HE1 1 1 17 7331 1 1 23 PHE HE2 H 21.080 -5.337 2.051 1.00 . A A . 23 PHE HE2 1 1 17 7332 1 1 23 PHE HZ H 21.630 -5.111 -0.356 1.00 . A A . 23 PHE HZ 1 1 17 7333 1 1 23 PHE N N 15.245 -1.850 1.286 1.00 . A A . 23 PHE N 1 1 17 7334 1 1 23 PHE O O 15.502 -5.037 2.382 1.00 . A A . 23 PHE O 1 1 17 7335 1 1 24 TYR C C 16.071 -5.529 4.993 1.00 . A A . 24 TYR C 1 1 17 7336 1 1 24 TYR CA C 15.356 -4.169 4.987 1.00 . A A . 24 TYR CA 1 1 17 7337 1 1 24 TYR CB C 13.839 -4.337 4.839 1.00 . A A . 24 TYR CB 1 1 17 7338 1 1 24 TYR CD1 C 13.227 -5.473 7.007 1.00 . A A . 24 TYR CD1 1 1 17 7339 1 1 24 TYR CD2 C 12.550 -3.169 6.664 1.00 . A A . 24 TYR CD2 1 1 17 7340 1 1 24 TYR CE1 C 12.627 -5.461 8.271 1.00 . A A . 24 TYR CE1 1 1 17 7341 1 1 24 TYR CE2 C 11.949 -3.159 7.928 1.00 . A A . 24 TYR CE2 1 1 17 7342 1 1 24 TYR CG C 13.190 -4.327 6.203 1.00 . A A . 24 TYR CG 1 1 17 7343 1 1 24 TYR CZ C 11.987 -4.305 8.731 1.00 . A A . 24 TYR CZ 1 1 17 7344 1 1 24 TYR H H 16.012 -2.415 3.915 1.00 . A A . 24 TYR H 1 1 17 7345 1 1 24 TYR HA H 15.575 -3.631 5.896 1.00 . A A . 24 TYR HA 1 1 17 7346 1 1 24 TYR HB2 H 13.449 -3.523 4.249 1.00 . A A . 24 TYR HB2 1 1 17 7347 1 1 24 TYR HB3 H 13.624 -5.272 4.345 1.00 . A A . 24 TYR HB3 1 1 17 7348 1 1 24 TYR HD1 H 13.721 -6.366 6.653 1.00 . A A . 24 TYR HD1 1 1 17 7349 1 1 24 TYR HD2 H 12.520 -2.286 6.044 1.00 . A A . 24 TYR HD2 1 1 17 7350 1 1 24 TYR HE1 H 12.656 -6.345 8.890 1.00 . A A . 24 TYR HE1 1 1 17 7351 1 1 24 TYR HE2 H 11.455 -2.267 8.283 1.00 . A A . 24 TYR HE2 1 1 17 7352 1 1 24 TYR HH H 10.478 -4.566 9.873 1.00 . A A . 24 TYR HH 1 1 17 7353 1 1 24 TYR N N 15.769 -3.355 3.795 1.00 . A A . 24 TYR N 1 1 17 7354 1 1 24 TYR O O 15.453 -6.572 5.122 1.00 . A A . 24 TYR O 1 1 17 7355 1 1 24 TYR OH O 11.394 -4.293 9.976 1.00 . A A . 24 TYR OH 1 1 17 7356 1 1 25 LYS C C 19.457 -6.633 5.631 1.00 . A A . 25 LYS C 1 1 17 7357 1 1 25 LYS CA C 18.147 -6.799 4.848 1.00 . A A . 25 LYS CA 1 1 17 7358 1 1 25 LYS CB C 18.435 -7.084 3.369 1.00 . A A . 25 LYS CB 1 1 17 7359 1 1 25 LYS CD C 18.117 -9.560 3.169 1.00 . A A . 25 LYS CD 1 1 17 7360 1 1 25 LYS CE C 19.108 -9.940 2.061 1.00 . A A . 25 LYS CE 1 1 17 7361 1 1 25 LYS CG C 17.503 -8.190 2.865 1.00 . A A . 25 LYS CG 1 1 17 7362 1 1 25 LYS H H 17.842 -4.665 4.752 1.00 . A A . 25 LYS H 1 1 17 7363 1 1 25 LYS HA H 17.556 -7.598 5.269 1.00 . A A . 25 LYS HA 1 1 17 7364 1 1 25 LYS HB2 H 18.272 -6.185 2.792 1.00 . A A . 25 LYS HB2 1 1 17 7365 1 1 25 LYS HB3 H 19.460 -7.401 3.257 1.00 . A A . 25 LYS HB3 1 1 17 7366 1 1 25 LYS HD2 H 18.635 -9.519 4.117 1.00 . A A . 25 LYS HD2 1 1 17 7367 1 1 25 LYS HD3 H 17.334 -10.301 3.219 1.00 . A A . 25 LYS HD3 1 1 17 7368 1 1 25 LYS HE2 H 19.528 -9.049 1.612 1.00 . A A . 25 LYS HE2 1 1 17 7369 1 1 25 LYS HE3 H 19.892 -10.566 2.458 1.00 . A A . 25 LYS HE3 1 1 17 7370 1 1 25 LYS HG2 H 16.545 -8.107 3.360 1.00 . A A . 25 LYS HG2 1 1 17 7371 1 1 25 LYS HG3 H 17.366 -8.087 1.799 1.00 . A A . 25 LYS HG3 1 1 17 7372 1 1 25 LYS HZ1 H 17.537 -10.099 0.698 1.00 . A A . 25 LYS HZ1 1 1 17 7373 1 1 25 LYS HZ2 H 17.903 -11.549 1.507 1.00 . A A . 25 LYS HZ2 1 1 17 7374 1 1 25 LYS HZ3 H 18.918 -10.985 0.268 1.00 . A A . 25 LYS HZ3 1 1 17 7375 1 1 25 LYS N N 17.372 -5.519 4.854 1.00 . A A . 25 LYS N 1 1 17 7376 1 1 25 LYS NZ N 18.306 -10.701 1.059 1.00 . A A . 25 LYS NZ 1 1 17 7377 1 1 25 LYS O O 20.168 -5.674 5.370 1.00 . A A . 25 LYS O 1 1 17 7378 1 1 25 LYS OXT O 19.727 -7.471 6.477 1.00 . A A . 25 LYS OXT 1 1 18 7379 1 1 1 HIS C C -20.087 1.236 2.504 1.00 . A A . 1 HIS C 1 1 18 7380 1 1 1 HIS CA C -20.490 2.671 2.888 1.00 . A A . 1 HIS CA 1 1 18 7381 1 1 1 HIS CB C -21.424 2.677 4.115 1.00 . A A . 1 HIS CB 1 1 18 7382 1 1 1 HIS CD2 C -23.941 2.693 3.339 1.00 . A A . 1 HIS CD2 1 1 18 7383 1 1 1 HIS CE1 C -24.326 0.566 3.468 1.00 . A A . 1 HIS CE1 1 1 18 7384 1 1 1 HIS CG C -22.775 2.103 3.763 1.00 . A A . 1 HIS CG 1 1 18 7385 1 1 1 HIS HA H -19.607 3.254 3.103 1.00 . A A . 1 HIS HA 1 1 18 7386 1 1 1 HIS HB2 H -20.981 2.086 4.902 1.00 . A A . 1 HIS HB2 1 1 18 7387 1 1 1 HIS HB3 H -21.548 3.693 4.462 1.00 . A A . 1 HIS HB3 1 1 18 7388 1 1 1 HIS HD1 H -22.417 0.044 4.109 1.00 . A A . 1 HIS HD1 1 1 18 7389 1 1 1 HIS HD2 H -24.078 3.752 3.176 1.00 . A A . 1 HIS HD2 1 1 18 7390 1 1 1 HIS HE1 H -24.817 -0.396 3.431 1.00 . A A . 1 HIS HE1 1 1 18 7391 1 1 1 HIS N N -21.265 3.313 1.778 1.00 . A A . 1 HIS N 1 1 18 7392 1 1 1 HIS ND1 N -23.046 0.745 3.838 1.00 . A A . 1 HIS ND1 1 1 18 7393 1 1 1 HIS NE2 N -24.918 1.720 3.154 1.00 . A A . 1 HIS NE2 1 1 18 7394 1 1 1 HIS O O -20.367 0.289 3.215 1.00 . A A . 1 HIS O 1 1 18 7395 1 1 2 ALA C C -17.668 -0.676 1.624 1.00 . A A . 2 ALA C 1 1 18 7396 1 1 2 ALA CA C -18.994 -0.292 0.950 1.00 . A A . 2 ALA CA 1 1 18 7397 1 1 2 ALA CB C -18.820 -0.196 -0.568 1.00 . A A . 2 ALA CB 1 1 18 7398 1 1 2 ALA H H -19.203 1.853 0.831 1.00 . A A . 2 ALA H 1 1 18 7399 1 1 2 ALA HA H -19.757 -1.017 1.187 1.00 . A A . 2 ALA HA 1 1 18 7400 1 1 2 ALA HB1 H -18.221 -1.024 -0.916 1.00 . A A . 2 ALA HB1 1 1 18 7401 1 1 2 ALA HB2 H -18.329 0.733 -0.818 1.00 . A A . 2 ALA HB2 1 1 18 7402 1 1 2 ALA HB3 H -19.790 -0.228 -1.044 1.00 . A A . 2 ALA HB3 1 1 18 7403 1 1 2 ALA N N -19.423 1.075 1.384 1.00 . A A . 2 ALA N 1 1 18 7404 1 1 2 ALA O O -17.042 0.131 2.289 1.00 . A A . 2 ALA O 1 1 18 7405 1 1 3 TRP C C -14.769 -2.061 1.148 1.00 . A A . 3 TRP C 1 1 18 7406 1 1 3 TRP CA C -15.954 -2.349 2.082 1.00 . A A . 3 TRP CA 1 1 18 7407 1 1 3 TRP CB C -16.123 -3.857 2.308 1.00 . A A . 3 TRP CB 1 1 18 7408 1 1 3 TRP CD1 C -16.243 -4.056 4.825 1.00 . A A . 3 TRP CD1 1 1 18 7409 1 1 3 TRP CD2 C -14.300 -4.822 3.989 1.00 . A A . 3 TRP CD2 1 1 18 7410 1 1 3 TRP CE2 C -14.235 -4.993 5.392 1.00 . A A . 3 TRP CE2 1 1 18 7411 1 1 3 TRP CE3 C -13.195 -5.228 3.220 1.00 . A A . 3 TRP CE3 1 1 18 7412 1 1 3 TRP CG C -15.587 -4.225 3.655 1.00 . A A . 3 TRP CG 1 1 18 7413 1 1 3 TRP CH2 C -12.024 -5.945 5.230 1.00 . A A . 3 TRP CH2 1 1 18 7414 1 1 3 TRP CZ2 C -13.113 -5.547 6.009 1.00 . A A . 3 TRP CZ2 1 1 18 7415 1 1 3 TRP CZ3 C -12.065 -5.786 3.838 1.00 . A A . 3 TRP CZ3 1 1 18 7416 1 1 3 TRP H H -17.760 -2.533 0.913 1.00 . A A . 3 TRP H 1 1 18 7417 1 1 3 TRP HA H -15.811 -1.852 3.028 1.00 . A A . 3 TRP HA 1 1 18 7418 1 1 3 TRP HB2 H -17.171 -4.114 2.257 1.00 . A A . 3 TRP HB2 1 1 18 7419 1 1 3 TRP HB3 H -15.584 -4.399 1.545 1.00 . A A . 3 TRP HB3 1 1 18 7420 1 1 3 TRP HD1 H -17.232 -3.634 4.936 1.00 . A A . 3 TRP HD1 1 1 18 7421 1 1 3 TRP HE1 H -15.684 -4.500 6.807 1.00 . A A . 3 TRP HE1 1 1 18 7422 1 1 3 TRP HE3 H -13.217 -5.109 2.147 1.00 . A A . 3 TRP HE3 1 1 18 7423 1 1 3 TRP HH2 H -11.152 -6.376 5.700 1.00 . A A . 3 TRP HH2 1 1 18 7424 1 1 3 TRP HZ2 H -13.087 -5.667 7.083 1.00 . A A . 3 TRP HZ2 1 1 18 7425 1 1 3 TRP HZ3 H -11.222 -6.095 3.238 1.00 . A A . 3 TRP HZ3 1 1 18 7426 1 1 3 TRP N N -17.237 -1.903 1.453 1.00 . A A . 3 TRP N 1 1 18 7427 1 1 3 TRP NE1 N -15.442 -4.510 5.857 1.00 . A A . 3 TRP NE1 1 1 18 7428 1 1 3 TRP O O -14.140 -2.962 0.625 1.00 . A A . 3 TRP O 1 1 18 7429 1 1 4 TYR C C -12.185 0.241 0.852 1.00 . A A . 4 TYR C 1 1 18 7430 1 1 4 TYR CA C -13.311 -0.438 0.051 1.00 . A A . 4 TYR CA 1 1 18 7431 1 1 4 TYR CB C -13.895 0.527 -0.994 1.00 . A A . 4 TYR CB 1 1 18 7432 1 1 4 TYR CD1 C -13.554 2.813 0.033 1.00 . A A . 4 TYR CD1 1 1 18 7433 1 1 4 TYR CD2 C -15.796 1.894 -0.045 1.00 . A A . 4 TYR CD2 1 1 18 7434 1 1 4 TYR CE1 C -14.048 3.965 0.656 1.00 . A A . 4 TYR CE1 1 1 18 7435 1 1 4 TYR CE2 C -16.289 3.045 0.579 1.00 . A A . 4 TYR CE2 1 1 18 7436 1 1 4 TYR CG C -14.428 1.776 -0.318 1.00 . A A . 4 TYR CG 1 1 18 7437 1 1 4 TYR CZ C -15.415 4.080 0.930 1.00 . A A . 4 TYR CZ 1 1 18 7438 1 1 4 TYR H H -14.980 -0.102 1.382 1.00 . A A . 4 TYR H 1 1 18 7439 1 1 4 TYR HA H -12.931 -1.317 -0.440 1.00 . A A . 4 TYR HA 1 1 18 7440 1 1 4 TYR HB2 H -13.123 0.804 -1.696 1.00 . A A . 4 TYR HB2 1 1 18 7441 1 1 4 TYR HB3 H -14.699 0.037 -1.523 1.00 . A A . 4 TYR HB3 1 1 18 7442 1 1 4 TYR HD1 H -12.499 2.726 -0.179 1.00 . A A . 4 TYR HD1 1 1 18 7443 1 1 4 TYR HD2 H -16.471 1.096 -0.315 1.00 . A A . 4 TYR HD2 1 1 18 7444 1 1 4 TYR HE1 H -13.374 4.763 0.927 1.00 . A A . 4 TYR HE1 1 1 18 7445 1 1 4 TYR HE2 H -17.345 3.135 0.789 1.00 . A A . 4 TYR HE2 1 1 18 7446 1 1 4 TYR HH H -15.912 5.924 0.899 1.00 . A A . 4 TYR HH 1 1 18 7447 1 1 4 TYR N N -14.460 -0.806 0.943 1.00 . A A . 4 TYR N 1 1 18 7448 1 1 4 TYR O O -11.108 0.476 0.335 1.00 . A A . 4 TYR O 1 1 18 7449 1 1 4 TYR OH O -15.904 5.214 1.546 1.00 . A A . 4 TYR OH 1 1 18 7450 1 1 5 SER C C -10.163 0.290 3.123 1.00 . A A . 5 SER C 1 1 18 7451 1 1 5 SER CA C -11.370 1.216 2.939 1.00 . A A . 5 SER CA 1 1 18 7452 1 1 5 SER CB C -12.040 1.497 4.285 1.00 . A A . 5 SER CB 1 1 18 7453 1 1 5 SER H H -13.298 0.351 2.499 1.00 . A A . 5 SER H 1 1 18 7454 1 1 5 SER HA H -11.063 2.140 2.482 1.00 . A A . 5 SER HA 1 1 18 7455 1 1 5 SER HB2 H -13.005 1.949 4.123 1.00 . A A . 5 SER HB2 1 1 18 7456 1 1 5 SER HB3 H -12.166 0.568 4.825 1.00 . A A . 5 SER HB3 1 1 18 7457 1 1 5 SER HG H -11.424 2.261 5.967 1.00 . A A . 5 SER HG 1 1 18 7458 1 1 5 SER N N -12.425 0.553 2.105 1.00 . A A . 5 SER N 1 1 18 7459 1 1 5 SER O O -9.040 0.740 3.249 1.00 . A A . 5 SER O 1 1 18 7460 1 1 5 SER OG O -11.227 2.390 5.036 1.00 . A A . 5 SER OG 1 1 18 7461 1 1 6 HIS C C -8.560 -2.197 1.959 1.00 . A A . 6 HIS C 1 1 18 7462 1 1 6 HIS CA C -9.253 -1.956 3.302 1.00 . A A . 6 HIS CA 1 1 18 7463 1 1 6 HIS CB C -9.885 -3.250 3.823 1.00 . A A . 6 HIS CB 1 1 18 7464 1 1 6 HIS CD2 C -9.759 -3.209 6.449 1.00 . A A . 6 HIS CD2 1 1 18 7465 1 1 6 HIS CE1 C -11.773 -2.519 6.851 1.00 . A A . 6 HIS CE1 1 1 18 7466 1 1 6 HIS CG C -10.372 -3.043 5.233 1.00 . A A . 6 HIS CG 1 1 18 7467 1 1 6 HIS H H -11.301 -1.330 3.025 1.00 . A A . 6 HIS H 1 1 18 7468 1 1 6 HIS HA H -8.546 -1.576 4.017 1.00 . A A . 6 HIS HA 1 1 18 7469 1 1 6 HIS HB2 H -10.717 -3.524 3.191 1.00 . A A . 6 HIS HB2 1 1 18 7470 1 1 6 HIS HB3 H -9.149 -4.040 3.811 1.00 . A A . 6 HIS HB3 1 1 18 7471 1 1 6 HIS HD1 H -12.355 -2.397 4.858 1.00 . A A . 6 HIS HD1 1 1 18 7472 1 1 6 HIS HD2 H -8.743 -3.547 6.593 1.00 . A A . 6 HIS HD2 1 1 18 7473 1 1 6 HIS HE1 H -12.668 -2.199 7.362 1.00 . A A . 6 HIS HE1 1 1 18 7474 1 1 6 HIS N N -10.387 -0.996 3.134 1.00 . A A . 6 HIS N 1 1 18 7475 1 1 6 HIS ND1 N -11.656 -2.603 5.513 1.00 . A A . 6 HIS ND1 1 1 18 7476 1 1 6 HIS NE2 N -10.645 -2.876 7.470 1.00 . A A . 6 HIS NE2 1 1 18 7477 1 1 6 HIS O O -7.378 -2.484 1.906 1.00 . A A . 6 HIS O 1 1 18 7478 1 1 7 TYR C C -7.666 -1.165 -0.756 1.00 . A A . 7 TYR C 1 1 18 7479 1 1 7 TYR CA C -8.666 -2.284 -0.469 1.00 . A A . 7 TYR CA 1 1 18 7480 1 1 7 TYR CB C -9.827 -2.247 -1.469 1.00 . A A . 7 TYR CB 1 1 18 7481 1 1 7 TYR CD1 C -11.501 -3.822 -0.432 1.00 . A A . 7 TYR CD1 1 1 18 7482 1 1 7 TYR CD2 C -10.316 -4.529 -2.425 1.00 . A A . 7 TYR CD2 1 1 18 7483 1 1 7 TYR CE1 C -12.186 -5.042 -0.407 1.00 . A A . 7 TYR CE1 1 1 18 7484 1 1 7 TYR CE2 C -11.002 -5.749 -2.399 1.00 . A A . 7 TYR CE2 1 1 18 7485 1 1 7 TYR CG C -10.566 -3.565 -1.441 1.00 . A A . 7 TYR CG 1 1 18 7486 1 1 7 TYR CZ C -11.937 -6.004 -1.389 1.00 . A A . 7 TYR CZ 1 1 18 7487 1 1 7 TYR H H -10.229 -1.835 0.948 1.00 . A A . 7 TYR H 1 1 18 7488 1 1 7 TYR HA H -8.171 -3.238 -0.508 1.00 . A A . 7 TYR HA 1 1 18 7489 1 1 7 TYR HB2 H -10.506 -1.448 -1.202 1.00 . A A . 7 TYR HB2 1 1 18 7490 1 1 7 TYR HB3 H -9.441 -2.072 -2.462 1.00 . A A . 7 TYR HB3 1 1 18 7491 1 1 7 TYR HD1 H -11.696 -3.080 0.327 1.00 . A A . 7 TYR HD1 1 1 18 7492 1 1 7 TYR HD2 H -9.595 -4.331 -3.204 1.00 . A A . 7 TYR HD2 1 1 18 7493 1 1 7 TYR HE1 H -12.907 -5.239 0.371 1.00 . A A . 7 TYR HE1 1 1 18 7494 1 1 7 TYR HE2 H -10.810 -6.493 -3.158 1.00 . A A . 7 TYR HE2 1 1 18 7495 1 1 7 TYR HH H -12.278 -7.722 -0.627 1.00 . A A . 7 TYR HH 1 1 18 7496 1 1 7 TYR N N -9.283 -2.074 0.876 1.00 . A A . 7 TYR N 1 1 18 7497 1 1 7 TYR O O -6.541 -1.413 -1.143 1.00 . A A . 7 TYR O 1 1 18 7498 1 1 7 TYR OH O -12.614 -7.207 -1.364 1.00 . A A . 7 TYR OH 1 1 18 7499 1 1 8 VAL C C -5.934 1.108 0.178 1.00 . A A . 8 VAL C 1 1 18 7500 1 1 8 VAL CA C -7.132 1.208 -0.780 1.00 . A A . 8 VAL CA 1 1 18 7501 1 1 8 VAL CB C -7.957 2.481 -0.521 1.00 . A A . 8 VAL CB 1 1 18 7502 1 1 8 VAL CG1 C -8.313 2.593 0.964 1.00 . A A . 8 VAL CG1 1 1 18 7503 1 1 8 VAL CG2 C -7.145 3.710 -0.941 1.00 . A A . 8 VAL CG2 1 1 18 7504 1 1 8 VAL H H -8.975 0.229 -0.216 1.00 . A A . 8 VAL H 1 1 18 7505 1 1 8 VAL HA H -6.787 1.196 -1.799 1.00 . A A . 8 VAL HA 1 1 18 7506 1 1 8 VAL HB H -8.867 2.438 -1.102 1.00 . A A . 8 VAL HB 1 1 18 7507 1 1 8 VAL HG11 H -8.859 3.509 1.135 1.00 . A A . 8 VAL HG11 1 1 18 7508 1 1 8 VAL HG12 H -7.407 2.599 1.554 1.00 . A A . 8 VAL HG12 1 1 18 7509 1 1 8 VAL HG13 H -8.925 1.752 1.252 1.00 . A A . 8 VAL HG13 1 1 18 7510 1 1 8 VAL HG21 H -7.749 4.598 -0.819 1.00 . A A . 8 VAL HG21 1 1 18 7511 1 1 8 VAL HG22 H -6.854 3.613 -1.976 1.00 . A A . 8 VAL HG22 1 1 18 7512 1 1 8 VAL HG23 H -6.263 3.787 -0.324 1.00 . A A . 8 VAL HG23 1 1 18 7513 1 1 8 VAL N N -8.066 0.064 -0.544 1.00 . A A . 8 VAL N 1 1 18 7514 1 1 8 VAL O O -4.849 1.565 -0.126 1.00 . A A . 8 VAL O 1 1 18 7515 1 1 9 LEU C C -3.997 -0.700 1.762 1.00 . A A . 9 LEU C 1 1 18 7516 1 1 9 LEU CA C -4.994 0.342 2.288 1.00 . A A . 9 LEU CA 1 1 18 7517 1 1 9 LEU CB C -5.638 -0.137 3.593 1.00 . A A . 9 LEU CB 1 1 18 7518 1 1 9 LEU CD1 C -4.674 1.476 5.243 1.00 . A A . 9 LEU CD1 1 1 18 7519 1 1 9 LEU CD2 C -5.028 -0.911 5.890 1.00 . A A . 9 LEU CD2 1 1 18 7520 1 1 9 LEU CG C -4.644 0.030 4.746 1.00 . A A . 9 LEU CG 1 1 18 7521 1 1 9 LEU H H -7.002 0.118 1.535 1.00 . A A . 9 LEU H 1 1 18 7522 1 1 9 LEU HA H -4.502 1.289 2.444 1.00 . A A . 9 LEU HA 1 1 18 7523 1 1 9 LEU HB2 H -6.524 0.447 3.793 1.00 . A A . 9 LEU HB2 1 1 18 7524 1 1 9 LEU HB3 H -5.906 -1.179 3.500 1.00 . A A . 9 LEU HB3 1 1 18 7525 1 1 9 LEU HD11 H -4.417 2.142 4.433 1.00 . A A . 9 LEU HD11 1 1 18 7526 1 1 9 LEU HD12 H -3.962 1.596 6.047 1.00 . A A . 9 LEU HD12 1 1 18 7527 1 1 9 LEU HD13 H -5.665 1.713 5.603 1.00 . A A . 9 LEU HD13 1 1 18 7528 1 1 9 LEU HD21 H -4.332 -0.787 6.706 1.00 . A A . 9 LEU HD21 1 1 18 7529 1 1 9 LEU HD22 H -4.997 -1.933 5.543 1.00 . A A . 9 LEU HD22 1 1 18 7530 1 1 9 LEU HD23 H -6.027 -0.676 6.230 1.00 . A A . 9 LEU HD23 1 1 18 7531 1 1 9 LEU HG H -3.648 -0.210 4.400 1.00 . A A . 9 LEU HG 1 1 18 7532 1 1 9 LEU N N -6.122 0.493 1.321 1.00 . A A . 9 LEU N 1 1 18 7533 1 1 9 LEU O O -2.798 -0.543 1.895 1.00 . A A . 9 LEU O 1 1 18 7534 1 1 10 LYS C C -2.743 -2.220 -0.549 1.00 . A A . 10 LYS C 1 1 18 7535 1 1 10 LYS CA C -3.571 -2.804 0.604 1.00 . A A . 10 LYS CA 1 1 18 7536 1 1 10 LYS CB C -4.486 -3.925 0.099 1.00 . A A . 10 LYS CB 1 1 18 7537 1 1 10 LYS CD C -4.880 -6.396 0.108 1.00 . A A . 10 LYS CD 1 1 18 7538 1 1 10 LYS CE C -5.797 -6.990 1.184 1.00 . A A . 10 LYS CE 1 1 18 7539 1 1 10 LYS CG C -4.047 -5.259 0.707 1.00 . A A . 10 LYS CG 1 1 18 7540 1 1 10 LYS H H -5.462 -1.855 1.048 1.00 . A A . 10 LYS H 1 1 18 7541 1 1 10 LYS HA H -2.921 -3.177 1.380 1.00 . A A . 10 LYS HA 1 1 18 7542 1 1 10 LYS HB2 H -5.506 -3.715 0.389 1.00 . A A . 10 LYS HB2 1 1 18 7543 1 1 10 LYS HB3 H -4.423 -3.984 -0.977 1.00 . A A . 10 LYS HB3 1 1 18 7544 1 1 10 LYS HD2 H -5.479 -6.014 -0.707 1.00 . A A . 10 LYS HD2 1 1 18 7545 1 1 10 LYS HD3 H -4.221 -7.166 -0.263 1.00 . A A . 10 LYS HD3 1 1 18 7546 1 1 10 LYS HE2 H -6.196 -7.938 0.851 1.00 . A A . 10 LYS HE2 1 1 18 7547 1 1 10 LYS HE3 H -5.259 -7.113 2.111 1.00 . A A . 10 LYS HE3 1 1 18 7548 1 1 10 LYS HG2 H -3.001 -5.425 0.489 1.00 . A A . 10 LYS HG2 1 1 18 7549 1 1 10 LYS HG3 H -4.192 -5.233 1.777 1.00 . A A . 10 LYS HG3 1 1 18 7550 1 1 10 LYS HZ1 H -7.322 -5.780 0.434 1.00 . A A . 10 LYS HZ1 1 1 18 7551 1 1 10 LYS HZ2 H -6.509 -5.121 1.773 1.00 . A A . 10 LYS HZ2 1 1 18 7552 1 1 10 LYS HZ3 H -7.622 -6.386 1.989 1.00 . A A . 10 LYS HZ3 1 1 18 7553 1 1 10 LYS N N -4.488 -1.757 1.152 1.00 . A A . 10 LYS N 1 1 18 7554 1 1 10 LYS NZ N -6.895 -5.994 1.358 1.00 . A A . 10 LYS NZ 1 1 18 7555 1 1 10 LYS O O -1.553 -2.453 -0.645 1.00 . A A . 10 LYS O 1 1 18 7556 1 1 11 PHE C C -1.562 0.142 -2.026 1.00 . A A . 11 PHE C 1 1 18 7557 1 1 11 PHE CA C -2.619 -0.839 -2.556 1.00 . A A . 11 PHE CA 1 1 18 7558 1 1 11 PHE CB C -3.684 -0.102 -3.378 1.00 . A A . 11 PHE CB 1 1 18 7559 1 1 11 PHE CD1 C -2.631 -0.073 -5.672 1.00 . A A . 11 PHE CD1 1 1 18 7560 1 1 11 PHE CD2 C -2.818 2.011 -4.446 1.00 . A A . 11 PHE CD2 1 1 18 7561 1 1 11 PHE CE1 C -2.023 0.606 -6.733 1.00 . A A . 11 PHE CE1 1 1 18 7562 1 1 11 PHE CE2 C -2.210 2.690 -5.509 1.00 . A A . 11 PHE CE2 1 1 18 7563 1 1 11 PHE CG C -3.029 0.629 -4.527 1.00 . A A . 11 PHE CG 1 1 18 7564 1 1 11 PHE CZ C -1.812 1.988 -6.652 1.00 . A A . 11 PHE CZ 1 1 18 7565 1 1 11 PHE H H -4.324 -1.275 -1.305 1.00 . A A . 11 PHE H 1 1 18 7566 1 1 11 PHE HA H -2.152 -1.605 -3.155 1.00 . A A . 11 PHE HA 1 1 18 7567 1 1 11 PHE HB2 H -4.395 -0.817 -3.765 1.00 . A A . 11 PHE HB2 1 1 18 7568 1 1 11 PHE HB3 H -4.197 0.608 -2.747 1.00 . A A . 11 PHE HB3 1 1 18 7569 1 1 11 PHE HD1 H -2.794 -1.139 -5.735 1.00 . A A . 11 PHE HD1 1 1 18 7570 1 1 11 PHE HD2 H -3.125 2.553 -3.565 1.00 . A A . 11 PHE HD2 1 1 18 7571 1 1 11 PHE HE1 H -1.716 0.064 -7.616 1.00 . A A . 11 PHE HE1 1 1 18 7572 1 1 11 PHE HE2 H -2.048 3.756 -5.445 1.00 . A A . 11 PHE HE2 1 1 18 7573 1 1 11 PHE HZ H -1.343 2.511 -7.472 1.00 . A A . 11 PHE HZ 1 1 18 7574 1 1 11 PHE N N -3.366 -1.454 -1.413 1.00 . A A . 11 PHE N 1 1 18 7575 1 1 11 PHE O O -0.472 0.234 -2.556 1.00 . A A . 11 PHE O 1 1 18 7576 1 1 12 PHE C C 0.278 1.080 0.237 1.00 . A A . 12 PHE C 1 1 18 7577 1 1 12 PHE CA C -0.894 1.836 -0.401 1.00 . A A . 12 PHE CA 1 1 18 7578 1 1 12 PHE CB C -1.672 2.618 0.665 1.00 . A A . 12 PHE CB 1 1 18 7579 1 1 12 PHE CD1 C -3.110 3.818 -1.029 1.00 . A A . 12 PHE CD1 1 1 18 7580 1 1 12 PHE CD2 C -1.879 5.131 0.596 1.00 . A A . 12 PHE CD2 1 1 18 7581 1 1 12 PHE CE1 C -3.630 4.993 -1.585 1.00 . A A . 12 PHE CE1 1 1 18 7582 1 1 12 PHE CE2 C -2.399 6.306 0.040 1.00 . A A . 12 PHE CE2 1 1 18 7583 1 1 12 PHE CG C -2.233 3.886 0.061 1.00 . A A . 12 PHE CG 1 1 18 7584 1 1 12 PHE CZ C -3.275 6.237 -1.050 1.00 . A A . 12 PHE CZ 1 1 18 7585 1 1 12 PHE H H -2.764 0.768 -0.565 1.00 . A A . 12 PHE H 1 1 18 7586 1 1 12 PHE HA H -0.537 2.509 -1.165 1.00 . A A . 12 PHE HA 1 1 18 7587 1 1 12 PHE HB2 H -2.481 2.009 1.039 1.00 . A A . 12 PHE HB2 1 1 18 7588 1 1 12 PHE HB3 H -1.009 2.872 1.478 1.00 . A A . 12 PHE HB3 1 1 18 7589 1 1 12 PHE HD1 H -3.383 2.860 -1.443 1.00 . A A . 12 PHE HD1 1 1 18 7590 1 1 12 PHE HD2 H -1.202 5.186 1.436 1.00 . A A . 12 PHE HD2 1 1 18 7591 1 1 12 PHE HE1 H -4.306 4.939 -2.425 1.00 . A A . 12 PHE HE1 1 1 18 7592 1 1 12 PHE HE2 H -2.126 7.265 0.452 1.00 . A A . 12 PHE HE2 1 1 18 7593 1 1 12 PHE HZ H -3.677 7.143 -1.478 1.00 . A A . 12 PHE HZ 1 1 18 7594 1 1 12 PHE N N -1.878 0.867 -0.978 1.00 . A A . 12 PHE N 1 1 18 7595 1 1 12 PHE O O 1.421 1.475 0.115 1.00 . A A . 12 PHE O 1 1 18 7596 1 1 13 LEU C C 1.988 -1.448 0.476 1.00 . A A . 13 LEU C 1 1 18 7597 1 1 13 LEU CA C 1.097 -0.803 1.550 1.00 . A A . 13 LEU CA 1 1 18 7598 1 1 13 LEU CB C 0.387 -1.879 2.376 1.00 . A A . 13 LEU CB 1 1 18 7599 1 1 13 LEU CD1 C 1.320 -1.351 4.637 1.00 . A A . 13 LEU CD1 1 1 18 7600 1 1 13 LEU CD2 C 0.816 -3.718 4.013 1.00 . A A . 13 LEU CD2 1 1 18 7601 1 1 13 LEU CG C 1.315 -2.367 3.492 1.00 . A A . 13 LEU CG 1 1 18 7602 1 1 13 LEU H H -0.929 -0.313 0.989 1.00 . A A . 13 LEU H 1 1 18 7603 1 1 13 LEU HA H 1.687 -0.172 2.196 1.00 . A A . 13 LEU HA 1 1 18 7604 1 1 13 LEU HB2 H -0.513 -1.464 2.809 1.00 . A A . 13 LEU HB2 1 1 18 7605 1 1 13 LEU HB3 H 0.127 -2.710 1.738 1.00 . A A . 13 LEU HB3 1 1 18 7606 1 1 13 LEU HD11 H 0.307 -1.177 4.969 1.00 . A A . 13 LEU HD11 1 1 18 7607 1 1 13 LEU HD12 H 1.751 -0.423 4.293 1.00 . A A . 13 LEU HD12 1 1 18 7608 1 1 13 LEU HD13 H 1.906 -1.737 5.458 1.00 . A A . 13 LEU HD13 1 1 18 7609 1 1 13 LEU HD21 H 0.818 -4.437 3.208 1.00 . A A . 13 LEU HD21 1 1 18 7610 1 1 13 LEU HD22 H -0.187 -3.608 4.396 1.00 . A A . 13 LEU HD22 1 1 18 7611 1 1 13 LEU HD23 H 1.468 -4.060 4.803 1.00 . A A . 13 LEU HD23 1 1 18 7612 1 1 13 LEU HG H 2.318 -2.477 3.104 1.00 . A A . 13 LEU HG 1 1 18 7613 1 1 13 LEU N N 0.001 -0.012 0.910 1.00 . A A . 13 LEU N 1 1 18 7614 1 1 13 LEU O O 3.171 -1.641 0.678 1.00 . A A . 13 LEU O 1 1 18 7615 1 1 14 LEU C C 3.171 -1.381 -2.406 1.00 . A A . 14 LEU C 1 1 18 7616 1 1 14 LEU CA C 2.242 -2.411 -1.748 1.00 . A A . 14 LEU CA 1 1 18 7617 1 1 14 LEU CB C 1.218 -2.943 -2.759 1.00 . A A . 14 LEU CB 1 1 18 7618 1 1 14 LEU CD1 C 1.758 -5.385 -2.692 1.00 . A A . 14 LEU CD1 1 1 18 7619 1 1 14 LEU CD2 C 1.033 -4.324 -4.834 1.00 . A A . 14 LEU CD2 1 1 18 7620 1 1 14 LEU CG C 1.823 -4.112 -3.541 1.00 . A A . 14 LEU CG 1 1 18 7621 1 1 14 LEU H H 0.470 -1.615 -0.804 1.00 . A A . 14 LEU H 1 1 18 7622 1 1 14 LEU HA H 2.819 -3.223 -1.348 1.00 . A A . 14 LEU HA 1 1 18 7623 1 1 14 LEU HB2 H 0.335 -3.278 -2.234 1.00 . A A . 14 LEU HB2 1 1 18 7624 1 1 14 LEU HB3 H 0.949 -2.154 -3.446 1.00 . A A . 14 LEU HB3 1 1 18 7625 1 1 14 LEU HD11 H 0.726 -5.657 -2.528 1.00 . A A . 14 LEU HD11 1 1 18 7626 1 1 14 LEU HD12 H 2.239 -5.208 -1.741 1.00 . A A . 14 LEU HD12 1 1 18 7627 1 1 14 LEU HD13 H 2.265 -6.187 -3.207 1.00 . A A . 14 LEU HD13 1 1 18 7628 1 1 14 LEU HD21 H 1.041 -3.413 -5.414 1.00 . A A . 14 LEU HD21 1 1 18 7629 1 1 14 LEU HD22 H 0.014 -4.590 -4.595 1.00 . A A . 14 LEU HD22 1 1 18 7630 1 1 14 LEU HD23 H 1.486 -5.118 -5.407 1.00 . A A . 14 LEU HD23 1 1 18 7631 1 1 14 LEU HG H 2.855 -3.892 -3.778 1.00 . A A . 14 LEU HG 1 1 18 7632 1 1 14 LEU N N 1.427 -1.781 -0.663 1.00 . A A . 14 LEU N 1 1 18 7633 1 1 14 LEU O O 4.200 -1.725 -2.952 1.00 . A A . 14 LEU O 1 1 18 7634 1 1 15 VAL C C 4.442 1.681 -1.882 1.00 . A A . 15 VAL C 1 1 18 7635 1 1 15 VAL CA C 3.677 0.927 -2.977 1.00 . A A . 15 VAL CA 1 1 18 7636 1 1 15 VAL CB C 2.709 1.860 -3.719 1.00 . A A . 15 VAL CB 1 1 18 7637 1 1 15 VAL CG1 C 3.459 3.100 -4.214 1.00 . A A . 15 VAL CG1 1 1 18 7638 1 1 15 VAL CG2 C 2.108 1.122 -4.921 1.00 . A A . 15 VAL CG2 1 1 18 7639 1 1 15 VAL H H 1.980 0.129 -1.913 1.00 . A A . 15 VAL H 1 1 18 7640 1 1 15 VAL HA H 4.368 0.481 -3.676 1.00 . A A . 15 VAL HA 1 1 18 7641 1 1 15 VAL HB H 1.917 2.162 -3.048 1.00 . A A . 15 VAL HB 1 1 18 7642 1 1 15 VAL HG11 H 2.921 3.542 -5.040 1.00 . A A . 15 VAL HG11 1 1 18 7643 1 1 15 VAL HG12 H 4.449 2.817 -4.540 1.00 . A A . 15 VAL HG12 1 1 18 7644 1 1 15 VAL HG13 H 3.537 3.818 -3.411 1.00 . A A . 15 VAL HG13 1 1 18 7645 1 1 15 VAL HG21 H 2.890 0.894 -5.631 1.00 . A A . 15 VAL HG21 1 1 18 7646 1 1 15 VAL HG22 H 1.365 1.748 -5.393 1.00 . A A . 15 VAL HG22 1 1 18 7647 1 1 15 VAL HG23 H 1.647 0.205 -4.588 1.00 . A A . 15 VAL HG23 1 1 18 7648 1 1 15 VAL N N 2.815 -0.124 -2.357 1.00 . A A . 15 VAL N 1 1 18 7649 1 1 15 VAL O O 5.656 1.723 -1.881 1.00 . A A . 15 VAL O 1 1 18 7650 1 1 16 PHE C C 5.022 2.047 1.178 1.00 . A A . 16 PHE C 1 1 18 7651 1 1 16 PHE CA C 4.419 3.019 0.153 1.00 . A A . 16 PHE CA 1 1 18 7652 1 1 16 PHE CB C 3.321 3.872 0.798 1.00 . A A . 16 PHE CB 1 1 18 7653 1 1 16 PHE CD1 C 4.346 6.174 0.929 1.00 . A A . 16 PHE CD1 1 1 18 7654 1 1 16 PHE CD2 C 4.132 4.873 2.965 1.00 . A A . 16 PHE CD2 1 1 18 7655 1 1 16 PHE CE1 C 4.925 7.219 1.658 1.00 . A A . 16 PHE CE1 1 1 18 7656 1 1 16 PHE CE2 C 4.712 5.919 3.694 1.00 . A A . 16 PHE CE2 1 1 18 7657 1 1 16 PHE CG C 3.949 5.001 1.583 1.00 . A A . 16 PHE CG 1 1 18 7658 1 1 16 PHE CZ C 5.109 7.092 3.040 1.00 . A A . 16 PHE CZ 1 1 18 7659 1 1 16 PHE H H 2.758 2.215 -0.966 1.00 . A A . 16 PHE H 1 1 18 7660 1 1 16 PHE HA H 5.188 3.659 -0.252 1.00 . A A . 16 PHE HA 1 1 18 7661 1 1 16 PHE HB2 H 2.684 4.281 0.027 1.00 . A A . 16 PHE HB2 1 1 18 7662 1 1 16 PHE HB3 H 2.732 3.256 1.462 1.00 . A A . 16 PHE HB3 1 1 18 7663 1 1 16 PHE HD1 H 4.205 6.272 -0.137 1.00 . A A . 16 PHE HD1 1 1 18 7664 1 1 16 PHE HD2 H 3.827 3.968 3.469 1.00 . A A . 16 PHE HD2 1 1 18 7665 1 1 16 PHE HE1 H 5.231 8.124 1.153 1.00 . A A . 16 PHE HE1 1 1 18 7666 1 1 16 PHE HE2 H 4.853 5.821 4.760 1.00 . A A . 16 PHE HE2 1 1 18 7667 1 1 16 PHE HZ H 5.555 7.899 3.602 1.00 . A A . 16 PHE HZ 1 1 18 7668 1 1 16 PHE N N 3.738 2.270 -0.947 1.00 . A A . 16 PHE N 1 1 18 7669 1 1 16 PHE O O 6.049 2.325 1.765 1.00 . A A . 16 PHE O 1 1 18 7670 1 1 17 GLY C C 6.255 -0.651 1.849 1.00 . A A . 17 GLY C 1 1 18 7671 1 1 17 GLY CA C 4.945 -0.070 2.383 1.00 . A A . 17 GLY CA 1 1 18 7672 1 1 17 GLY H H 3.572 0.701 0.908 1.00 . A A . 17 GLY H 1 1 18 7673 1 1 17 GLY HA2 H 5.131 0.431 3.323 1.00 . A A . 17 GLY HA2 1 1 18 7674 1 1 17 GLY HA3 H 4.237 -0.869 2.532 1.00 . A A . 17 GLY HA3 1 1 18 7675 1 1 17 GLY N N 4.397 0.911 1.395 1.00 . A A . 17 GLY N 1 1 18 7676 1 1 17 GLY O O 7.259 -0.662 2.535 1.00 . A A . 17 GLY O 1 1 18 7677 1 1 18 GLU C C 8.610 -0.631 -0.011 1.00 . A A . 18 GLU C 1 1 18 7678 1 1 18 GLU CA C 7.509 -1.697 0.043 1.00 . A A . 18 GLU CA 1 1 18 7679 1 1 18 GLU CB C 7.134 -2.159 -1.368 1.00 . A A . 18 GLU CB 1 1 18 7680 1 1 18 GLU CD C 5.507 -4.051 -1.116 1.00 . A A . 18 GLU CD 1 1 18 7681 1 1 18 GLU CG C 6.971 -3.683 -1.380 1.00 . A A . 18 GLU CG 1 1 18 7682 1 1 18 GLU H H 5.433 -1.098 0.091 1.00 . A A . 18 GLU H 1 1 18 7683 1 1 18 GLU HA H 7.839 -2.535 0.630 1.00 . A A . 18 GLU HA 1 1 18 7684 1 1 18 GLU HB2 H 6.205 -1.695 -1.666 1.00 . A A . 18 GLU HB2 1 1 18 7685 1 1 18 GLU HB3 H 7.914 -1.878 -2.059 1.00 . A A . 18 GLU HB3 1 1 18 7686 1 1 18 GLU HG2 H 7.269 -4.067 -2.345 1.00 . A A . 18 GLU HG2 1 1 18 7687 1 1 18 GLU HG3 H 7.594 -4.118 -0.613 1.00 . A A . 18 GLU HG3 1 1 18 7688 1 1 18 GLU N N 6.256 -1.124 0.626 1.00 . A A . 18 GLU N 1 1 18 7689 1 1 18 GLU O O 9.783 -0.942 0.027 1.00 . A A . 18 GLU O 1 1 18 7690 1 1 18 GLU OE1 O 5.074 -3.905 0.017 1.00 . A A . 18 GLU OE1 1 1 18 7691 1 1 18 GLU OE2 O 4.844 -4.476 -2.048 1.00 . A A . 18 GLU OE2 1 1 18 7692 1 1 19 ASN C C 9.917 1.887 1.256 1.00 . A A . 19 ASN C 1 1 18 7693 1 1 19 ASN CA C 9.273 1.706 -0.126 1.00 . A A . 19 ASN CA 1 1 18 7694 1 1 19 ASN CB C 8.517 2.972 -0.537 1.00 . A A . 19 ASN CB 1 1 18 7695 1 1 19 ASN CG C 8.736 3.229 -2.030 1.00 . A A . 19 ASN CG 1 1 18 7696 1 1 19 ASN H H 7.289 0.850 -0.108 1.00 . A A . 19 ASN H 1 1 18 7697 1 1 19 ASN HA H 10.025 1.475 -0.858 1.00 . A A . 19 ASN HA 1 1 18 7698 1 1 19 ASN HB2 H 7.463 2.844 -0.343 1.00 . A A . 19 ASN HB2 1 1 18 7699 1 1 19 ASN HB3 H 8.889 3.814 0.028 1.00 . A A . 19 ASN HB3 1 1 18 7700 1 1 19 ASN HD21 H 7.165 2.150 -2.593 1.00 . A A . 19 ASN HD21 1 1 18 7701 1 1 19 ASN HD22 H 8.050 2.863 -3.856 1.00 . A A . 19 ASN HD22 1 1 18 7702 1 1 19 ASN N N 8.242 0.623 -0.087 1.00 . A A . 19 ASN N 1 1 18 7703 1 1 19 ASN ND2 N 7.916 2.704 -2.898 1.00 . A A . 19 ASN ND2 1 1 18 7704 1 1 19 ASN O O 11.025 2.371 1.370 1.00 . A A . 19 ASN O 1 1 18 7705 1 1 19 ASN OD1 O 9.665 3.914 -2.408 1.00 . A A . 19 ASN OD1 1 1 18 7706 1 1 20 GLY C C 10.256 0.289 4.212 1.00 . A A . 20 GLY C 1 1 18 7707 1 1 20 GLY CA C 9.787 1.651 3.678 1.00 . A A . 20 GLY CA 1 1 18 7708 1 1 20 GLY H H 8.334 1.118 2.178 1.00 . A A . 20 GLY H 1 1 18 7709 1 1 20 GLY HA2 H 10.624 2.334 3.653 1.00 . A A . 20 GLY HA2 1 1 18 7710 1 1 20 GLY HA3 H 9.025 2.044 4.333 1.00 . A A . 20 GLY HA3 1 1 18 7711 1 1 20 GLY N N 9.227 1.503 2.301 1.00 . A A . 20 GLY N 1 1 18 7712 1 1 20 GLY O O 11.140 0.219 5.044 1.00 . A A . 20 GLY O 1 1 18 7713 1 1 21 VAL C C 11.029 -2.824 3.261 1.00 . A A . 21 VAL C 1 1 18 7714 1 1 21 VAL CA C 10.085 -2.139 4.257 1.00 . A A . 21 VAL CA 1 1 18 7715 1 1 21 VAL CB C 8.782 -2.935 4.407 1.00 . A A . 21 VAL CB 1 1 18 7716 1 1 21 VAL CG1 C 9.099 -4.374 4.826 1.00 . A A . 21 VAL CG1 1 1 18 7717 1 1 21 VAL CG2 C 7.902 -2.281 5.475 1.00 . A A . 21 VAL CG2 1 1 18 7718 1 1 21 VAL H H 8.947 -0.719 3.091 1.00 . A A . 21 VAL H 1 1 18 7719 1 1 21 VAL HA H 10.566 -2.045 5.213 1.00 . A A . 21 VAL HA 1 1 18 7720 1 1 21 VAL HB H 8.257 -2.945 3.463 1.00 . A A . 21 VAL HB 1 1 18 7721 1 1 21 VAL HG11 H 9.774 -4.363 5.670 1.00 . A A . 21 VAL HG11 1 1 18 7722 1 1 21 VAL HG12 H 9.561 -4.896 4.002 1.00 . A A . 21 VAL HG12 1 1 18 7723 1 1 21 VAL HG13 H 8.185 -4.877 5.104 1.00 . A A . 21 VAL HG13 1 1 18 7724 1 1 21 VAL HG21 H 7.459 -1.380 5.075 1.00 . A A . 21 VAL HG21 1 1 18 7725 1 1 21 VAL HG22 H 8.504 -2.033 6.337 1.00 . A A . 21 VAL HG22 1 1 18 7726 1 1 21 VAL HG23 H 7.120 -2.967 5.768 1.00 . A A . 21 VAL HG23 1 1 18 7727 1 1 21 VAL N N 9.669 -0.792 3.755 1.00 . A A . 21 VAL N 1 1 18 7728 1 1 21 VAL O O 11.969 -3.491 3.649 1.00 . A A . 21 VAL O 1 1 18 7729 1 1 22 PHE C C 12.633 -2.317 0.334 1.00 . A A . 22 PHE C 1 1 18 7730 1 1 22 PHE CA C 11.661 -3.326 0.967 1.00 . A A . 22 PHE CA 1 1 18 7731 1 1 22 PHE CB C 10.700 -3.880 -0.090 1.00 . A A . 22 PHE CB 1 1 18 7732 1 1 22 PHE CD1 C 11.981 -5.647 -1.354 1.00 . A A . 22 PHE CD1 1 1 18 7733 1 1 22 PHE CD2 C 10.400 -6.346 0.347 1.00 . A A . 22 PHE CD2 1 1 18 7734 1 1 22 PHE CE1 C 12.292 -6.987 -1.615 1.00 . A A . 22 PHE CE1 1 1 18 7735 1 1 22 PHE CE2 C 10.710 -7.685 0.085 1.00 . A A . 22 PHE CE2 1 1 18 7736 1 1 22 PHE CG C 11.036 -5.326 -0.372 1.00 . A A . 22 PHE CG 1 1 18 7737 1 1 22 PHE CZ C 11.656 -8.006 -0.895 1.00 . A A . 22 PHE CZ 1 1 18 7738 1 1 22 PHE H H 10.014 -2.138 1.703 1.00 . A A . 22 PHE H 1 1 18 7739 1 1 22 PHE HA H 12.212 -4.134 1.415 1.00 . A A . 22 PHE HA 1 1 18 7740 1 1 22 PHE HB2 H 9.685 -3.811 0.275 1.00 . A A . 22 PHE HB2 1 1 18 7741 1 1 22 PHE HB3 H 10.794 -3.306 -0.999 1.00 . A A . 22 PHE HB3 1 1 18 7742 1 1 22 PHE HD1 H 12.472 -4.861 -1.909 1.00 . A A . 22 PHE HD1 1 1 18 7743 1 1 22 PHE HD2 H 9.670 -6.098 1.105 1.00 . A A . 22 PHE HD2 1 1 18 7744 1 1 22 PHE HE1 H 13.021 -7.235 -2.372 1.00 . A A . 22 PHE HE1 1 1 18 7745 1 1 22 PHE HE2 H 10.220 -8.472 0.641 1.00 . A A . 22 PHE HE2 1 1 18 7746 1 1 22 PHE HZ H 11.895 -9.040 -1.097 1.00 . A A . 22 PHE HZ 1 1 18 7747 1 1 22 PHE N N 10.782 -2.674 1.988 1.00 . A A . 22 PHE N 1 1 18 7748 1 1 22 PHE O O 13.527 -2.694 -0.399 1.00 . A A . 22 PHE O 1 1 18 7749 1 1 23 PHE C C 13.845 0.982 1.067 1.00 . A A . 23 PHE C 1 1 18 7750 1 1 23 PHE CA C 13.389 -0.028 0.004 1.00 . A A . 23 PHE CA 1 1 18 7751 1 1 23 PHE CB C 12.558 0.663 -1.084 1.00 . A A . 23 PHE CB 1 1 18 7752 1 1 23 PHE CD1 C 14.173 0.616 -3.020 1.00 . A A . 23 PHE CD1 1 1 18 7753 1 1 23 PHE CD2 C 12.191 -0.778 -3.123 1.00 . A A . 23 PHE CD2 1 1 18 7754 1 1 23 PHE CE1 C 14.569 0.146 -4.278 1.00 . A A . 23 PHE CE1 1 1 18 7755 1 1 23 PHE CE2 C 12.588 -1.248 -4.380 1.00 . A A . 23 PHE CE2 1 1 18 7756 1 1 23 PHE CG C 12.984 0.155 -2.442 1.00 . A A . 23 PHE CG 1 1 18 7757 1 1 23 PHE CZ C 13.776 -0.787 -4.958 1.00 . A A . 23 PHE CZ 1 1 18 7758 1 1 23 PHE H H 11.743 -0.758 1.193 1.00 . A A . 23 PHE H 1 1 18 7759 1 1 23 PHE HA H 14.244 -0.511 -0.440 1.00 . A A . 23 PHE HA 1 1 18 7760 1 1 23 PHE HB2 H 11.512 0.444 -0.930 1.00 . A A . 23 PHE HB2 1 1 18 7761 1 1 23 PHE HB3 H 12.714 1.730 -1.036 1.00 . A A . 23 PHE HB3 1 1 18 7762 1 1 23 PHE HD1 H 14.786 1.334 -2.496 1.00 . A A . 23 PHE HD1 1 1 18 7763 1 1 23 PHE HD2 H 11.274 -1.133 -2.678 1.00 . A A . 23 PHE HD2 1 1 18 7764 1 1 23 PHE HE1 H 15.487 0.501 -4.723 1.00 . A A . 23 PHE HE1 1 1 18 7765 1 1 23 PHE HE2 H 11.975 -1.967 -4.906 1.00 . A A . 23 PHE HE2 1 1 18 7766 1 1 23 PHE HZ H 14.082 -1.149 -5.928 1.00 . A A . 23 PHE HZ 1 1 18 7767 1 1 23 PHE N N 12.470 -1.044 0.603 1.00 . A A . 23 PHE N 1 1 18 7768 1 1 23 PHE O O 13.930 2.169 0.815 1.00 . A A . 23 PHE O 1 1 18 7769 1 1 24 TYR C C 15.633 0.752 4.240 1.00 . A A . 24 TYR C 1 1 18 7770 1 1 24 TYR CA C 14.601 1.444 3.337 1.00 . A A . 24 TYR CA 1 1 18 7771 1 1 24 TYR CB C 13.331 1.781 4.123 1.00 . A A . 24 TYR CB 1 1 18 7772 1 1 24 TYR CD1 C 12.955 4.137 3.308 1.00 . A A . 24 TYR CD1 1 1 18 7773 1 1 24 TYR CD2 C 13.480 3.781 5.648 1.00 . A A . 24 TYR CD2 1 1 18 7774 1 1 24 TYR CE1 C 12.880 5.517 3.534 1.00 . A A . 24 TYR CE1 1 1 18 7775 1 1 24 TYR CE2 C 13.405 5.159 5.874 1.00 . A A . 24 TYR CE2 1 1 18 7776 1 1 24 TYR CG C 13.255 3.269 4.364 1.00 . A A . 24 TYR CG 1 1 18 7777 1 1 24 TYR CZ C 13.106 6.028 4.817 1.00 . A A . 24 TYR CZ 1 1 18 7778 1 1 24 TYR H H 14.071 -0.445 2.436 1.00 . A A . 24 TYR H 1 1 18 7779 1 1 24 TYR HA H 15.018 2.342 2.909 1.00 . A A . 24 TYR HA 1 1 18 7780 1 1 24 TYR HB2 H 12.467 1.466 3.557 1.00 . A A . 24 TYR HB2 1 1 18 7781 1 1 24 TYR HB3 H 13.345 1.263 5.071 1.00 . A A . 24 TYR HB3 1 1 18 7782 1 1 24 TYR HD1 H 12.782 3.743 2.317 1.00 . A A . 24 TYR HD1 1 1 18 7783 1 1 24 TYR HD2 H 13.710 3.112 6.463 1.00 . A A . 24 TYR HD2 1 1 18 7784 1 1 24 TYR HE1 H 12.648 6.186 2.718 1.00 . A A . 24 TYR HE1 1 1 18 7785 1 1 24 TYR HE2 H 13.580 5.555 6.864 1.00 . A A . 24 TYR HE2 1 1 18 7786 1 1 24 TYR HH H 12.126 7.601 5.277 1.00 . A A . 24 TYR HH 1 1 18 7787 1 1 24 TYR N N 14.144 0.517 2.255 1.00 . A A . 24 TYR N 1 1 18 7788 1 1 24 TYR O O 15.731 1.047 5.418 1.00 . A A . 24 TYR O 1 1 18 7789 1 1 24 TYR OH O 13.031 7.388 5.041 1.00 . A A . 24 TYR OH 1 1 18 7790 1 1 25 LYS C C 16.805 -1.558 5.732 1.00 . A A . 25 LYS C 1 1 18 7791 1 1 25 LYS CA C 17.444 -0.888 4.499 1.00 . A A . 25 LYS CA 1 1 18 7792 1 1 25 LYS CB C 18.463 0.186 4.912 1.00 . A A . 25 LYS CB 1 1 18 7793 1 1 25 LYS CD C 18.978 1.635 2.934 1.00 . A A . 25 LYS CD 1 1 18 7794 1 1 25 LYS CE C 19.249 2.931 3.705 1.00 . A A . 25 LYS CE 1 1 18 7795 1 1 25 LYS CG C 19.446 0.434 3.763 1.00 . A A . 25 LYS CG 1 1 18 7796 1 1 25 LYS H H 16.307 -0.373 2.740 1.00 . A A . 25 LYS H 1 1 18 7797 1 1 25 LYS HA H 17.930 -1.634 3.889 1.00 . A A . 25 LYS HA 1 1 18 7798 1 1 25 LYS HB2 H 17.944 1.103 5.149 1.00 . A A . 25 LYS HB2 1 1 18 7799 1 1 25 LYS HB3 H 19.009 -0.152 5.780 1.00 . A A . 25 LYS HB3 1 1 18 7800 1 1 25 LYS HD2 H 19.516 1.654 1.997 1.00 . A A . 25 LYS HD2 1 1 18 7801 1 1 25 LYS HD3 H 17.920 1.547 2.739 1.00 . A A . 25 LYS HD3 1 1 18 7802 1 1 25 LYS HE2 H 19.237 2.743 4.771 1.00 . A A . 25 LYS HE2 1 1 18 7803 1 1 25 LYS HE3 H 20.197 3.354 3.410 1.00 . A A . 25 LYS HE3 1 1 18 7804 1 1 25 LYS HG2 H 20.427 0.637 4.168 1.00 . A A . 25 LYS HG2 1 1 18 7805 1 1 25 LYS HG3 H 19.492 -0.440 3.132 1.00 . A A . 25 LYS HG3 1 1 18 7806 1 1 25 LYS HZ1 H 18.256 4.758 3.821 1.00 . A A . 25 LYS HZ1 1 1 18 7807 1 1 25 LYS HZ2 H 17.227 3.426 3.595 1.00 . A A . 25 LYS HZ2 1 1 18 7808 1 1 25 LYS HZ3 H 18.157 4.017 2.300 1.00 . A A . 25 LYS HZ3 1 1 18 7809 1 1 25 LYS N N 16.407 -0.163 3.691 1.00 . A A . 25 LYS N 1 1 18 7810 1 1 25 LYS NZ N 18.138 3.852 3.326 1.00 . A A . 25 LYS NZ 1 1 18 7811 1 1 25 LYS O O 15.685 -2.031 5.612 1.00 . A A . 25 LYS O 1 1 18 7812 1 1 25 LYS OXT O 17.447 -1.596 6.771 1.00 . A A . 25 LYS OXT 1 1 19 7813 1 1 1 HIS C C -15.856 2.268 7.825 1.00 . A A . 1 HIS C 1 1 19 7814 1 1 1 HIS CA C -15.698 2.710 9.291 1.00 . A A . 1 HIS CA 1 1 19 7815 1 1 1 HIS CB C -14.336 2.258 9.851 1.00 . A A . 1 HIS CB 1 1 19 7816 1 1 1 HIS CD2 C -14.303 -0.140 10.937 1.00 . A A . 1 HIS CD2 1 1 19 7817 1 1 1 HIS CE1 C -14.079 -1.308 9.126 1.00 . A A . 1 HIS CE1 1 1 19 7818 1 1 1 HIS CG C -14.257 0.750 9.893 1.00 . A A . 1 HIS CG 1 1 19 7819 1 1 1 HIS HA H -15.781 3.784 9.364 1.00 . A A . 1 HIS HA 1 1 19 7820 1 1 1 HIS HB2 H -13.546 2.639 9.220 1.00 . A A . 1 HIS HB2 1 1 19 7821 1 1 1 HIS HB3 H -14.212 2.651 10.850 1.00 . A A . 1 HIS HB3 1 1 19 7822 1 1 1 HIS HD1 H -14.050 0.316 7.828 1.00 . A A . 1 HIS HD1 1 1 19 7823 1 1 1 HIS HD2 H -14.409 0.126 11.978 1.00 . A A . 1 HIS HD2 1 1 19 7824 1 1 1 HIS HE1 H -13.974 -2.138 8.442 1.00 . A A . 1 HIS HE1 1 1 19 7825 1 1 1 HIS N N -16.727 2.056 10.163 1.00 . A A . 1 HIS N 1 1 19 7826 1 1 1 HIS ND1 N -14.114 -0.019 8.748 1.00 . A A . 1 HIS ND1 1 1 19 7827 1 1 1 HIS NE2 N -14.190 -1.439 10.450 1.00 . A A . 1 HIS NE2 1 1 19 7828 1 1 1 HIS O O -14.886 2.177 7.096 1.00 . A A . 1 HIS O 1 1 19 7829 1 1 2 ALA C C -16.704 0.163 5.730 1.00 . A A . 2 ALA C 1 1 19 7830 1 1 2 ALA CA C -17.318 1.551 5.979 1.00 . A A . 2 ALA CA 1 1 19 7831 1 1 2 ALA CB C -16.655 2.610 5.088 1.00 . A A . 2 ALA CB 1 1 19 7832 1 1 2 ALA H H -17.833 2.077 8.006 1.00 . A A . 2 ALA H 1 1 19 7833 1 1 2 ALA HA H -18.378 1.524 5.780 1.00 . A A . 2 ALA HA 1 1 19 7834 1 1 2 ALA HB1 H -17.200 2.691 4.161 1.00 . A A . 2 ALA HB1 1 1 19 7835 1 1 2 ALA HB2 H -15.634 2.319 4.882 1.00 . A A . 2 ALA HB2 1 1 19 7836 1 1 2 ALA HB3 H -16.663 3.563 5.595 1.00 . A A . 2 ALA HB3 1 1 19 7837 1 1 2 ALA N N -17.073 1.994 7.395 1.00 . A A . 2 ALA N 1 1 19 7838 1 1 2 ALA O O -15.725 -0.215 6.347 1.00 . A A . 2 ALA O 1 1 19 7839 1 1 3 TRP C C -15.982 -1.991 3.205 1.00 . A A . 3 TRP C 1 1 19 7840 1 1 3 TRP CA C -16.728 -1.965 4.548 1.00 . A A . 3 TRP CA 1 1 19 7841 1 1 3 TRP CB C -17.951 -2.886 4.504 1.00 . A A . 3 TRP CB 1 1 19 7842 1 1 3 TRP CD1 C -17.603 -4.349 6.535 1.00 . A A . 3 TRP CD1 1 1 19 7843 1 1 3 TRP CD2 C -17.276 -5.457 4.606 1.00 . A A . 3 TRP CD2 1 1 19 7844 1 1 3 TRP CE2 C -17.047 -6.383 5.650 1.00 . A A . 3 TRP CE2 1 1 19 7845 1 1 3 TRP CE3 C -17.133 -5.906 3.279 1.00 . A A . 3 TRP CE3 1 1 19 7846 1 1 3 TRP CG C -17.626 -4.172 5.194 1.00 . A A . 3 TRP CG 1 1 19 7847 1 1 3 TRP CH2 C -16.555 -8.135 4.066 1.00 . A A . 3 TRP CH2 1 1 19 7848 1 1 3 TRP CZ2 C -16.691 -7.707 5.389 1.00 . A A . 3 TRP CZ2 1 1 19 7849 1 1 3 TRP CZ3 C -16.776 -7.238 3.013 1.00 . A A . 3 TRP CZ3 1 1 19 7850 1 1 3 TRP H H -18.067 -0.281 4.348 1.00 . A A . 3 TRP H 1 1 19 7851 1 1 3 TRP HA H -16.068 -2.274 5.343 1.00 . A A . 3 TRP HA 1 1 19 7852 1 1 3 TRP HB2 H -18.782 -2.410 5.003 1.00 . A A . 3 TRP HB2 1 1 19 7853 1 1 3 TRP HB3 H -18.216 -3.087 3.476 1.00 . A A . 3 TRP HB3 1 1 19 7854 1 1 3 TRP HD1 H -17.817 -3.590 7.273 1.00 . A A . 3 TRP HD1 1 1 19 7855 1 1 3 TRP HE1 H -17.171 -6.046 7.703 1.00 . A A . 3 TRP HE1 1 1 19 7856 1 1 3 TRP HE3 H -17.301 -5.222 2.461 1.00 . A A . 3 TRP HE3 1 1 19 7857 1 1 3 TRP HH2 H -16.280 -9.159 3.855 1.00 . A A . 3 TRP HH2 1 1 19 7858 1 1 3 TRP HZ2 H -16.523 -8.395 6.204 1.00 . A A . 3 TRP HZ2 1 1 19 7859 1 1 3 TRP HZ3 H -16.670 -7.571 1.992 1.00 . A A . 3 TRP HZ3 1 1 19 7860 1 1 3 TRP N N -17.276 -0.601 4.832 1.00 . A A . 3 TRP N 1 1 19 7861 1 1 3 TRP NE1 N -17.259 -5.659 6.807 1.00 . A A . 3 TRP NE1 1 1 19 7862 1 1 3 TRP O O -15.719 -3.046 2.658 1.00 . A A . 3 TRP O 1 1 19 7863 1 1 4 TYR C C -13.634 0.081 1.502 1.00 . A A . 4 TYR C 1 1 19 7864 1 1 4 TYR CA C -14.880 -0.809 1.381 1.00 . A A . 4 TYR CA 1 1 19 7865 1 1 4 TYR CB C -15.871 -0.242 0.348 1.00 . A A . 4 TYR CB 1 1 19 7866 1 1 4 TYR CD1 C -15.633 2.275 0.449 1.00 . A A . 4 TYR CD1 1 1 19 7867 1 1 4 TYR CD2 C -17.576 1.244 1.472 1.00 . A A . 4 TYR CD2 1 1 19 7868 1 1 4 TYR CE1 C -16.102 3.538 0.832 1.00 . A A . 4 TYR CE1 1 1 19 7869 1 1 4 TYR CE2 C -18.045 2.507 1.851 1.00 . A A . 4 TYR CE2 1 1 19 7870 1 1 4 TYR CG C -16.369 1.126 0.770 1.00 . A A . 4 TYR CG 1 1 19 7871 1 1 4 TYR CZ C -17.309 3.654 1.532 1.00 . A A . 4 TYR CZ 1 1 19 7872 1 1 4 TYR H H -15.833 -0.007 3.140 1.00 . A A . 4 TYR H 1 1 19 7873 1 1 4 TYR HA H -14.590 -1.808 1.094 1.00 . A A . 4 TYR HA 1 1 19 7874 1 1 4 TYR HB2 H -15.377 -0.160 -0.609 1.00 . A A . 4 TYR HB2 1 1 19 7875 1 1 4 TYR HB3 H -16.710 -0.915 0.257 1.00 . A A . 4 TYR HB3 1 1 19 7876 1 1 4 TYR HD1 H -14.701 2.187 -0.091 1.00 . A A . 4 TYR HD1 1 1 19 7877 1 1 4 TYR HD2 H -18.143 0.360 1.720 1.00 . A A . 4 TYR HD2 1 1 19 7878 1 1 4 TYR HE1 H -15.533 4.422 0.585 1.00 . A A . 4 TYR HE1 1 1 19 7879 1 1 4 TYR HE2 H -18.976 2.597 2.392 1.00 . A A . 4 TYR HE2 1 1 19 7880 1 1 4 TYR HH H -18.319 5.240 1.191 1.00 . A A . 4 TYR HH 1 1 19 7881 1 1 4 TYR N N -15.624 -0.845 2.678 1.00 . A A . 4 TYR N 1 1 19 7882 1 1 4 TYR O O -13.141 0.609 0.523 1.00 . A A . 4 TYR O 1 1 19 7883 1 1 4 TYR OH O -17.773 4.899 1.905 1.00 . A A . 4 TYR OH 1 1 19 7884 1 1 5 SER C C -10.677 0.215 3.223 1.00 . A A . 5 SER C 1 1 19 7885 1 1 5 SER CA C -11.897 1.088 2.887 1.00 . A A . 5 SER CA 1 1 19 7886 1 1 5 SER CB C -12.238 2.010 4.062 1.00 . A A . 5 SER CB 1 1 19 7887 1 1 5 SER H H -13.522 -0.201 3.472 1.00 . A A . 5 SER H 1 1 19 7888 1 1 5 SER HA H -11.707 1.676 2.004 1.00 . A A . 5 SER HA 1 1 19 7889 1 1 5 SER HB2 H -13.300 1.985 4.245 1.00 . A A . 5 SER HB2 1 1 19 7890 1 1 5 SER HB3 H -11.715 1.671 4.947 1.00 . A A . 5 SER HB3 1 1 19 7891 1 1 5 SER HG H -12.639 3.885 3.734 1.00 . A A . 5 SER HG 1 1 19 7892 1 1 5 SER N N -13.115 0.241 2.699 1.00 . A A . 5 SER N 1 1 19 7893 1 1 5 SER O O -9.743 0.664 3.862 1.00 . A A . 5 SER O 1 1 19 7894 1 1 5 SER OG O -11.849 3.339 3.744 1.00 . A A . 5 SER OG 1 1 19 7895 1 1 6 HIS C C -8.685 -2.176 1.837 1.00 . A A . 6 HIS C 1 1 19 7896 1 1 6 HIS CA C -9.511 -1.923 3.101 1.00 . A A . 6 HIS CA 1 1 19 7897 1 1 6 HIS CB C -10.122 -3.229 3.620 1.00 . A A . 6 HIS CB 1 1 19 7898 1 1 6 HIS CD2 C -12.167 -3.294 5.269 1.00 . A A . 6 HIS CD2 1 1 19 7899 1 1 6 HIS CE1 C -11.278 -2.213 6.923 1.00 . A A . 6 HIS CE1 1 1 19 7900 1 1 6 HIS CG C -10.891 -2.967 4.888 1.00 . A A . 6 HIS CG 1 1 19 7901 1 1 6 HIS H H -11.436 -1.374 2.289 1.00 . A A . 6 HIS H 1 1 19 7902 1 1 6 HIS HA H -8.889 -1.481 3.859 1.00 . A A . 6 HIS HA 1 1 19 7903 1 1 6 HIS HB2 H -10.788 -3.635 2.874 1.00 . A A . 6 HIS HB2 1 1 19 7904 1 1 6 HIS HB3 H -9.331 -3.939 3.820 1.00 . A A . 6 HIS HB3 1 1 19 7905 1 1 6 HIS HD1 H -9.439 -1.898 6.004 1.00 . A A . 6 HIS HD1 1 1 19 7906 1 1 6 HIS HD2 H -12.876 -3.839 4.664 1.00 . A A . 6 HIS HD2 1 1 19 7907 1 1 6 HIS HE1 H -11.131 -1.734 7.880 1.00 . A A . 6 HIS HE1 1 1 19 7908 1 1 6 HIS N N -10.675 -1.028 2.801 1.00 . A A . 6 HIS N 1 1 19 7909 1 1 6 HIS ND1 N -10.342 -2.276 5.959 1.00 . A A . 6 HIS ND1 1 1 19 7910 1 1 6 HIS NE2 N -12.410 -2.819 6.555 1.00 . A A . 6 HIS NE2 1 1 19 7911 1 1 6 HIS O O -7.469 -2.164 1.872 1.00 . A A . 6 HIS O 1 1 19 7912 1 1 7 TYR C C -7.739 -1.420 -0.897 1.00 . A A . 7 TYR C 1 1 19 7913 1 1 7 TYR CA C -8.585 -2.645 -0.549 1.00 . A A . 7 TYR CA 1 1 19 7914 1 1 7 TYR CB C -9.654 -2.888 -1.620 1.00 . A A . 7 TYR CB 1 1 19 7915 1 1 7 TYR CD1 C -9.008 -5.240 -2.269 1.00 . A A . 7 TYR CD1 1 1 19 7916 1 1 7 TYR CD2 C -11.172 -4.866 -1.238 1.00 . A A . 7 TYR CD2 1 1 19 7917 1 1 7 TYR CE1 C -9.285 -6.609 -2.352 1.00 . A A . 7 TYR CE1 1 1 19 7918 1 1 7 TYR CE2 C -11.447 -6.236 -1.322 1.00 . A A . 7 TYR CE2 1 1 19 7919 1 1 7 TYR CG C -9.952 -4.367 -1.711 1.00 . A A . 7 TYR CG 1 1 19 7920 1 1 7 TYR CZ C -10.504 -7.108 -1.879 1.00 . A A . 7 TYR CZ 1 1 19 7921 1 1 7 TYR H H -10.314 -2.398 0.725 1.00 . A A . 7 TYR H 1 1 19 7922 1 1 7 TYR HA H -7.958 -3.511 -0.448 1.00 . A A . 7 TYR HA 1 1 19 7923 1 1 7 TYR HB2 H -10.556 -2.354 -1.359 1.00 . A A . 7 TYR HB2 1 1 19 7924 1 1 7 TYR HB3 H -9.293 -2.537 -2.575 1.00 . A A . 7 TYR HB3 1 1 19 7925 1 1 7 TYR HD1 H -8.067 -4.855 -2.634 1.00 . A A . 7 TYR HD1 1 1 19 7926 1 1 7 TYR HD2 H -11.900 -4.195 -0.810 1.00 . A A . 7 TYR HD2 1 1 19 7927 1 1 7 TYR HE1 H -8.557 -7.282 -2.781 1.00 . A A . 7 TYR HE1 1 1 19 7928 1 1 7 TYR HE2 H -12.388 -6.621 -0.958 1.00 . A A . 7 TYR HE2 1 1 19 7929 1 1 7 TYR HH H -11.206 -8.624 -2.803 1.00 . A A . 7 TYR HH 1 1 19 7930 1 1 7 TYR N N -9.336 -2.398 0.723 1.00 . A A . 7 TYR N 1 1 19 7931 1 1 7 TYR O O -6.588 -1.539 -1.274 1.00 . A A . 7 TYR O 1 1 19 7932 1 1 7 TYR OH O -10.776 -8.458 -1.961 1.00 . A A . 7 TYR OH 1 1 19 7933 1 1 8 VAL C C -6.317 1.091 -0.100 1.00 . A A . 8 VAL C 1 1 19 7934 1 1 8 VAL CA C -7.521 0.999 -1.048 1.00 . A A . 8 VAL CA 1 1 19 7935 1 1 8 VAL CB C -8.504 2.164 -0.832 1.00 . A A . 8 VAL CB 1 1 19 7936 1 1 8 VAL CG1 C -8.932 2.241 0.639 1.00 . A A . 8 VAL CG1 1 1 19 7937 1 1 8 VAL CG2 C -7.833 3.480 -1.235 1.00 . A A . 8 VAL CG2 1 1 19 7938 1 1 8 VAL H H -9.220 -0.185 -0.432 1.00 . A A . 8 VAL H 1 1 19 7939 1 1 8 VAL HA H -7.185 0.987 -2.069 1.00 . A A . 8 VAL HA 1 1 19 7940 1 1 8 VAL HB H -9.379 2.007 -1.448 1.00 . A A . 8 VAL HB 1 1 19 7941 1 1 8 VAL HG11 H -8.129 2.659 1.227 1.00 . A A . 8 VAL HG11 1 1 19 7942 1 1 8 VAL HG12 H -9.165 1.251 1.001 1.00 . A A . 8 VAL HG12 1 1 19 7943 1 1 8 VAL HG13 H -9.807 2.870 0.726 1.00 . A A . 8 VAL HG13 1 1 19 7944 1 1 8 VAL HG21 H -7.482 3.409 -2.254 1.00 . A A . 8 VAL HG21 1 1 19 7945 1 1 8 VAL HG22 H -6.996 3.674 -0.580 1.00 . A A . 8 VAL HG22 1 1 19 7946 1 1 8 VAL HG23 H -8.546 4.288 -1.155 1.00 . A A . 8 VAL HG23 1 1 19 7947 1 1 8 VAL N N -8.297 -0.245 -0.751 1.00 . A A . 8 VAL N 1 1 19 7948 1 1 8 VAL O O -5.264 1.581 -0.466 1.00 . A A . 8 VAL O 1 1 19 7949 1 1 9 LEU C C -4.259 -0.392 1.645 1.00 . A A . 9 LEU C 1 1 19 7950 1 1 9 LEU CA C -5.325 0.625 2.074 1.00 . A A . 9 LEU CA 1 1 19 7951 1 1 9 LEU CB C -5.931 0.237 3.426 1.00 . A A . 9 LEU CB 1 1 19 7952 1 1 9 LEU CD1 C -5.514 2.325 4.738 1.00 . A A . 9 LEU CD1 1 1 19 7953 1 1 9 LEU CD2 C -5.359 0.095 5.854 1.00 . A A . 9 LEU CD2 1 1 19 7954 1 1 9 LEU CG C -5.106 0.862 4.554 1.00 . A A . 9 LEU CG 1 1 19 7955 1 1 9 LEU H H -7.313 0.189 1.367 1.00 . A A . 9 LEU H 1 1 19 7956 1 1 9 LEU HA H -4.900 1.615 2.127 1.00 . A A . 9 LEU HA 1 1 19 7957 1 1 9 LEU HB2 H -6.949 0.597 3.480 1.00 . A A . 9 LEU HB2 1 1 19 7958 1 1 9 LEU HB3 H -5.922 -0.838 3.529 1.00 . A A . 9 LEU HB3 1 1 19 7959 1 1 9 LEU HD11 H -5.114 2.696 5.670 1.00 . A A . 9 LEU HD11 1 1 19 7960 1 1 9 LEU HD12 H -6.592 2.399 4.754 1.00 . A A . 9 LEU HD12 1 1 19 7961 1 1 9 LEU HD13 H -5.125 2.913 3.920 1.00 . A A . 9 LEU HD13 1 1 19 7962 1 1 9 LEU HD21 H -5.046 -0.932 5.733 1.00 . A A . 9 LEU HD21 1 1 19 7963 1 1 9 LEU HD22 H -6.412 0.126 6.091 1.00 . A A . 9 LEU HD22 1 1 19 7964 1 1 9 LEU HD23 H -4.796 0.551 6.656 1.00 . A A . 9 LEU HD23 1 1 19 7965 1 1 9 LEU HG H -4.056 0.811 4.302 1.00 . A A . 9 LEU HG 1 1 19 7966 1 1 9 LEU N N -6.461 0.596 1.106 1.00 . A A . 9 LEU N 1 1 19 7967 1 1 9 LEU O O -3.075 -0.155 1.785 1.00 . A A . 9 LEU O 1 1 19 7968 1 1 10 LYS C C -2.815 -1.975 -0.457 1.00 . A A . 10 LYS C 1 1 19 7969 1 1 10 LYS CA C -3.694 -2.552 0.656 1.00 . A A . 10 LYS CA 1 1 19 7970 1 1 10 LYS CB C -4.542 -3.712 0.123 1.00 . A A . 10 LYS CB 1 1 19 7971 1 1 10 LYS CD C -3.717 -5.659 1.463 1.00 . A A . 10 LYS CD 1 1 19 7972 1 1 10 LYS CE C -3.812 -6.780 0.423 1.00 . A A . 10 LYS CE 1 1 19 7973 1 1 10 LYS CG C -4.875 -4.675 1.265 1.00 . A A . 10 LYS CG 1 1 19 7974 1 1 10 LYS H H -5.640 -1.682 1.002 1.00 . A A . 10 LYS H 1 1 19 7975 1 1 10 LYS HA H -3.087 -2.884 1.482 1.00 . A A . 10 LYS HA 1 1 19 7976 1 1 10 LYS HB2 H -5.457 -3.324 -0.300 1.00 . A A . 10 LYS HB2 1 1 19 7977 1 1 10 LYS HB3 H -3.989 -4.239 -0.640 1.00 . A A . 10 LYS HB3 1 1 19 7978 1 1 10 LYS HD2 H -2.779 -5.137 1.347 1.00 . A A . 10 LYS HD2 1 1 19 7979 1 1 10 LYS HD3 H -3.773 -6.084 2.454 1.00 . A A . 10 LYS HD3 1 1 19 7980 1 1 10 LYS HE2 H -4.620 -7.455 0.672 1.00 . A A . 10 LYS HE2 1 1 19 7981 1 1 10 LYS HE3 H -3.958 -6.368 -0.564 1.00 . A A . 10 LYS HE3 1 1 19 7982 1 1 10 LYS HG2 H -5.030 -4.114 2.176 1.00 . A A . 10 LYS HG2 1 1 19 7983 1 1 10 LYS HG3 H -5.773 -5.224 1.024 1.00 . A A . 10 LYS HG3 1 1 19 7984 1 1 10 LYS HZ1 H -1.728 -6.808 0.344 1.00 . A A . 10 LYS HZ1 1 1 19 7985 1 1 10 LYS HZ2 H -2.464 -8.220 -0.251 1.00 . A A . 10 LYS HZ2 1 1 19 7986 1 1 10 LYS HZ3 H -2.393 -7.937 1.422 1.00 . A A . 10 LYS HZ3 1 1 19 7987 1 1 10 LYS N N -4.677 -1.520 1.111 1.00 . A A . 10 LYS N 1 1 19 7988 1 1 10 LYS NZ N -2.500 -7.490 0.490 1.00 . A A . 10 LYS NZ 1 1 19 7989 1 1 10 LYS O O -1.613 -2.162 -0.465 1.00 . A A . 10 LYS O 1 1 19 7990 1 1 11 PHE C C -1.612 0.356 -1.927 1.00 . A A . 11 PHE C 1 1 19 7991 1 1 11 PHE CA C -2.609 -0.658 -2.501 1.00 . A A . 11 PHE CA 1 1 19 7992 1 1 11 PHE CB C -3.638 0.039 -3.401 1.00 . A A . 11 PHE CB 1 1 19 7993 1 1 11 PHE CD1 C -2.491 -0.078 -5.645 1.00 . A A . 11 PHE CD1 1 1 19 7994 1 1 11 PHE CD2 C -2.723 2.081 -4.566 1.00 . A A . 11 PHE CD2 1 1 19 7995 1 1 11 PHE CE1 C -1.838 0.532 -6.723 1.00 . A A . 11 PHE CE1 1 1 19 7996 1 1 11 PHE CE2 C -2.071 2.691 -5.644 1.00 . A A . 11 PHE CE2 1 1 19 7997 1 1 11 PHE CG C -2.934 0.696 -4.566 1.00 . A A . 11 PHE CG 1 1 19 7998 1 1 11 PHE CZ C -1.628 1.916 -6.722 1.00 . A A . 11 PHE CZ 1 1 19 7999 1 1 11 PHE H H -4.378 -1.124 -1.354 1.00 . A A . 11 PHE H 1 1 19 8000 1 1 11 PHE HA H -2.092 -1.424 -3.055 1.00 . A A . 11 PHE HA 1 1 19 8001 1 1 11 PHE HB2 H -4.343 -0.690 -3.772 1.00 . A A . 11 PHE HB2 1 1 19 8002 1 1 11 PHE HB3 H -4.164 0.790 -2.829 1.00 . A A . 11 PHE HB3 1 1 19 8003 1 1 11 PHE HD1 H -2.652 -1.146 -5.646 1.00 . A A . 11 PHE HD1 1 1 19 8004 1 1 11 PHE HD2 H -3.066 2.680 -3.734 1.00 . A A . 11 PHE HD2 1 1 19 8005 1 1 11 PHE HE1 H -1.496 -0.067 -7.554 1.00 . A A . 11 PHE HE1 1 1 19 8006 1 1 11 PHE HE2 H -1.910 3.758 -5.643 1.00 . A A . 11 PHE HE2 1 1 19 8007 1 1 11 PHE HZ H -1.124 2.386 -7.554 1.00 . A A . 11 PHE HZ 1 1 19 8008 1 1 11 PHE N N -3.407 -1.265 -1.390 1.00 . A A . 11 PHE N 1 1 19 8009 1 1 11 PHE O O -0.465 0.406 -2.329 1.00 . A A . 11 PHE O 1 1 19 8010 1 1 12 PHE C C -0.026 1.438 0.434 1.00 . A A . 12 PHE C 1 1 19 8011 1 1 12 PHE CA C -1.123 2.160 -0.359 1.00 . A A . 12 PHE CA 1 1 19 8012 1 1 12 PHE CB C -2.008 2.992 0.579 1.00 . A A . 12 PHE CB 1 1 19 8013 1 1 12 PHE CD1 C -3.442 3.956 -1.264 1.00 . A A . 12 PHE CD1 1 1 19 8014 1 1 12 PHE CD2 C -2.269 5.474 0.219 1.00 . A A . 12 PHE CD2 1 1 19 8015 1 1 12 PHE CE1 C -3.978 5.047 -1.956 1.00 . A A . 12 PHE CE1 1 1 19 8016 1 1 12 PHE CE2 C -2.805 6.566 -0.475 1.00 . A A . 12 PHE CE2 1 1 19 8017 1 1 12 PHE CG C -2.587 4.169 -0.175 1.00 . A A . 12 PHE CG 1 1 19 8018 1 1 12 PHE CZ C -3.659 6.351 -1.563 1.00 . A A . 12 PHE CZ 1 1 19 8019 1 1 12 PHE H H -2.970 1.084 -0.666 1.00 . A A . 12 PHE H 1 1 19 8020 1 1 12 PHE HA H -0.688 2.791 -1.117 1.00 . A A . 12 PHE HA 1 1 19 8021 1 1 12 PHE HB2 H -2.812 2.376 0.955 1.00 . A A . 12 PHE HB2 1 1 19 8022 1 1 12 PHE HB3 H -1.415 3.351 1.405 1.00 . A A . 12 PHE HB3 1 1 19 8023 1 1 12 PHE HD1 H -3.689 2.950 -1.568 1.00 . A A . 12 PHE HD1 1 1 19 8024 1 1 12 PHE HD2 H -1.609 5.640 1.059 1.00 . A A . 12 PHE HD2 1 1 19 8025 1 1 12 PHE HE1 H -4.638 4.882 -2.795 1.00 . A A . 12 PHE HE1 1 1 19 8026 1 1 12 PHE HE2 H -2.559 7.572 -0.171 1.00 . A A . 12 PHE HE2 1 1 19 8027 1 1 12 PHE HZ H -4.074 7.193 -2.097 1.00 . A A . 12 PHE HZ 1 1 19 8028 1 1 12 PHE N N -2.042 1.155 -0.978 1.00 . A A . 12 PHE N 1 1 19 8029 1 1 12 PHE O O 1.140 1.778 0.349 1.00 . A A . 12 PHE O 1 1 19 8030 1 1 13 LEU C C 1.554 -1.104 1.050 1.00 . A A . 13 LEU C 1 1 19 8031 1 1 13 LEU CA C 0.619 -0.329 1.988 1.00 . A A . 13 LEU CA 1 1 19 8032 1 1 13 LEU CB C -0.189 -1.294 2.860 1.00 . A A . 13 LEU CB 1 1 19 8033 1 1 13 LEU CD1 C -0.312 -1.991 5.259 1.00 . A A . 13 LEU CD1 1 1 19 8034 1 1 13 LEU CD2 C 1.470 -2.927 3.779 1.00 . A A . 13 LEU CD2 1 1 19 8035 1 1 13 LEU CG C 0.631 -1.685 4.093 1.00 . A A . 13 LEU CG 1 1 19 8036 1 1 13 LEU H H -1.341 0.174 1.237 1.00 . A A . 13 LEU H 1 1 19 8037 1 1 13 LEU HA H 1.187 0.343 2.613 1.00 . A A . 13 LEU HA 1 1 19 8038 1 1 13 LEU HB2 H -1.106 -0.814 3.174 1.00 . A A . 13 LEU HB2 1 1 19 8039 1 1 13 LEU HB3 H -0.425 -2.182 2.291 1.00 . A A . 13 LEU HB3 1 1 19 8040 1 1 13 LEU HD11 H -0.929 -1.128 5.458 1.00 . A A . 13 LEU HD11 1 1 19 8041 1 1 13 LEU HD12 H 0.268 -2.229 6.138 1.00 . A A . 13 LEU HD12 1 1 19 8042 1 1 13 LEU HD13 H -0.940 -2.832 5.003 1.00 . A A . 13 LEU HD13 1 1 19 8043 1 1 13 LEU HD21 H 0.925 -3.570 3.104 1.00 . A A . 13 LEU HD21 1 1 19 8044 1 1 13 LEU HD22 H 1.681 -3.460 4.694 1.00 . A A . 13 LEU HD22 1 1 19 8045 1 1 13 LEU HD23 H 2.399 -2.626 3.317 1.00 . A A . 13 LEU HD23 1 1 19 8046 1 1 13 LEU HG H 1.283 -0.866 4.365 1.00 . A A . 13 LEU HG 1 1 19 8047 1 1 13 LEU N N -0.396 0.433 1.195 1.00 . A A . 13 LEU N 1 1 19 8048 1 1 13 LEU O O 2.707 -1.322 1.362 1.00 . A A . 13 LEU O 1 1 19 8049 1 1 14 LEU C C 3.011 -1.337 -1.630 1.00 . A A . 14 LEU C 1 1 19 8050 1 1 14 LEU CA C 1.939 -2.269 -1.055 1.00 . A A . 14 LEU CA 1 1 19 8051 1 1 14 LEU CB C 0.997 -2.758 -2.161 1.00 . A A . 14 LEU CB 1 1 19 8052 1 1 14 LEU CD1 C 1.772 -5.136 -2.222 1.00 . A A . 14 LEU CD1 1 1 19 8053 1 1 14 LEU CD2 C 0.920 -4.044 -4.302 1.00 . A A . 14 LEU CD2 1 1 19 8054 1 1 14 LEU CG C 1.702 -3.822 -3.006 1.00 . A A . 14 LEU CG 1 1 19 8055 1 1 14 LEU H H 0.135 -1.327 -0.331 1.00 . A A . 14 LEU H 1 1 19 8056 1 1 14 LEU HA H 2.397 -3.107 -0.564 1.00 . A A . 14 LEU HA 1 1 19 8057 1 1 14 LEU HB2 H 0.109 -3.181 -1.716 1.00 . A A . 14 LEU HB2 1 1 19 8058 1 1 14 LEU HB3 H 0.722 -1.926 -2.793 1.00 . A A . 14 LEU HB3 1 1 19 8059 1 1 14 LEU HD11 H 2.571 -5.080 -1.497 1.00 . A A . 14 LEU HD11 1 1 19 8060 1 1 14 LEU HD12 H 1.962 -5.952 -2.905 1.00 . A A . 14 LEU HD12 1 1 19 8061 1 1 14 LEU HD13 H 0.834 -5.303 -1.714 1.00 . A A . 14 LEU HD13 1 1 19 8062 1 1 14 LEU HD21 H 0.721 -3.091 -4.770 1.00 . A A . 14 LEU HD21 1 1 19 8063 1 1 14 LEU HD22 H -0.015 -4.537 -4.080 1.00 . A A . 14 LEU HD22 1 1 19 8064 1 1 14 LEU HD23 H 1.501 -4.658 -4.973 1.00 . A A . 14 LEU HD23 1 1 19 8065 1 1 14 LEU HG H 2.704 -3.491 -3.240 1.00 . A A . 14 LEU HG 1 1 19 8066 1 1 14 LEU N N 1.070 -1.516 -0.098 1.00 . A A . 14 LEU N 1 1 19 8067 1 1 14 LEU O O 4.173 -1.685 -1.704 1.00 . A A . 14 LEU O 1 1 19 8068 1 1 15 VAL C C 4.516 1.344 -1.471 1.00 . A A . 15 VAL C 1 1 19 8069 1 1 15 VAL CA C 3.610 0.816 -2.593 1.00 . A A . 15 VAL CA 1 1 19 8070 1 1 15 VAL CB C 2.768 1.950 -3.195 1.00 . A A . 15 VAL CB 1 1 19 8071 1 1 15 VAL CG1 C 3.685 3.081 -3.671 1.00 . A A . 15 VAL CG1 1 1 19 8072 1 1 15 VAL CG2 C 1.963 1.416 -4.387 1.00 . A A . 15 VAL CG2 1 1 19 8073 1 1 15 VAL H H 1.679 0.096 -1.946 1.00 . A A . 15 VAL H 1 1 19 8074 1 1 15 VAL HA H 4.201 0.345 -3.362 1.00 . A A . 15 VAL HA 1 1 19 8075 1 1 15 VAL HB H 2.090 2.331 -2.444 1.00 . A A . 15 VAL HB 1 1 19 8076 1 1 15 VAL HG11 H 3.202 3.628 -4.467 1.00 . A A . 15 VAL HG11 1 1 19 8077 1 1 15 VAL HG12 H 4.613 2.662 -4.033 1.00 . A A . 15 VAL HG12 1 1 19 8078 1 1 15 VAL HG13 H 3.889 3.749 -2.847 1.00 . A A . 15 VAL HG13 1 1 19 8079 1 1 15 VAL HG21 H 2.475 1.662 -5.306 1.00 . A A . 15 VAL HG21 1 1 19 8080 1 1 15 VAL HG22 H 0.982 1.869 -4.391 1.00 . A A . 15 VAL HG22 1 1 19 8081 1 1 15 VAL HG23 H 1.863 0.344 -4.305 1.00 . A A . 15 VAL HG23 1 1 19 8082 1 1 15 VAL N N 2.622 -0.155 -2.027 1.00 . A A . 15 VAL N 1 1 19 8083 1 1 15 VAL O O 5.725 1.381 -1.605 1.00 . A A . 15 VAL O 1 1 19 8084 1 1 16 PHE C C 5.503 1.112 1.476 1.00 . A A . 16 PHE C 1 1 19 8085 1 1 16 PHE CA C 4.763 2.260 0.771 1.00 . A A . 16 PHE CA 1 1 19 8086 1 1 16 PHE CB C 3.765 2.926 1.725 1.00 . A A . 16 PHE CB 1 1 19 8087 1 1 16 PHE CD1 C 5.125 4.966 2.321 1.00 . A A . 16 PHE CD1 1 1 19 8088 1 1 16 PHE CD2 C 4.607 3.357 4.061 1.00 . A A . 16 PHE CD2 1 1 19 8089 1 1 16 PHE CE1 C 5.822 5.746 3.251 1.00 . A A . 16 PHE CE1 1 1 19 8090 1 1 16 PHE CE2 C 5.306 4.138 4.990 1.00 . A A . 16 PHE CE2 1 1 19 8091 1 1 16 PHE CG C 4.517 3.770 2.728 1.00 . A A . 16 PHE CG 1 1 19 8092 1 1 16 PHE CZ C 5.913 5.332 4.585 1.00 . A A . 16 PHE CZ 1 1 19 8093 1 1 16 PHE H H 2.961 1.694 -0.276 1.00 . A A . 16 PHE H 1 1 19 8094 1 1 16 PHE HA H 5.468 2.993 0.412 1.00 . A A . 16 PHE HA 1 1 19 8095 1 1 16 PHE HB2 H 3.089 3.551 1.160 1.00 . A A . 16 PHE HB2 1 1 19 8096 1 1 16 PHE HB3 H 3.202 2.165 2.245 1.00 . A A . 16 PHE HB3 1 1 19 8097 1 1 16 PHE HD1 H 5.055 5.285 1.292 1.00 . A A . 16 PHE HD1 1 1 19 8098 1 1 16 PHE HD2 H 4.139 2.436 4.375 1.00 . A A . 16 PHE HD2 1 1 19 8099 1 1 16 PHE HE1 H 6.291 6.667 2.937 1.00 . A A . 16 PHE HE1 1 1 19 8100 1 1 16 PHE HE2 H 5.377 3.819 6.020 1.00 . A A . 16 PHE HE2 1 1 19 8101 1 1 16 PHE HZ H 6.453 5.934 5.301 1.00 . A A . 16 PHE HZ 1 1 19 8102 1 1 16 PHE N N 3.938 1.742 -0.363 1.00 . A A . 16 PHE N 1 1 19 8103 1 1 16 PHE O O 6.502 1.331 2.130 1.00 . A A . 16 PHE O 1 1 19 8104 1 1 17 GLY C C 7.116 -1.412 1.434 1.00 . A A . 17 GLY C 1 1 19 8105 1 1 17 GLY CA C 5.708 -1.257 2.009 1.00 . A A . 17 GLY CA 1 1 19 8106 1 1 17 GLY H H 4.217 -0.261 0.816 1.00 . A A . 17 GLY H 1 1 19 8107 1 1 17 GLY HA2 H 5.771 -1.076 3.072 1.00 . A A . 17 GLY HA2 1 1 19 8108 1 1 17 GLY HA3 H 5.148 -2.161 1.829 1.00 . A A . 17 GLY HA3 1 1 19 8109 1 1 17 GLY N N 5.026 -0.104 1.347 1.00 . A A . 17 GLY N 1 1 19 8110 1 1 17 GLY O O 8.087 -1.468 2.163 1.00 . A A . 17 GLY O 1 1 19 8111 1 1 18 GLU C C 9.361 -0.291 -0.375 1.00 . A A . 18 GLU C 1 1 19 8112 1 1 18 GLU CA C 8.592 -1.608 -0.487 1.00 . A A . 18 GLU CA 1 1 19 8113 1 1 18 GLU CB C 8.343 -1.962 -1.956 1.00 . A A . 18 GLU CB 1 1 19 8114 1 1 18 GLU CD C 9.294 -4.270 -2.177 1.00 . A A . 18 GLU CD 1 1 19 8115 1 1 18 GLU CG C 8.003 -3.449 -2.078 1.00 . A A . 18 GLU CG 1 1 19 8116 1 1 18 GLU H H 6.441 -1.413 -0.439 1.00 . A A . 18 GLU H 1 1 19 8117 1 1 18 GLU HA H 9.141 -2.396 -0.004 1.00 . A A . 18 GLU HA 1 1 19 8118 1 1 18 GLU HB2 H 7.520 -1.371 -2.333 1.00 . A A . 18 GLU HB2 1 1 19 8119 1 1 18 GLU HB3 H 9.232 -1.749 -2.532 1.00 . A A . 18 GLU HB3 1 1 19 8120 1 1 18 GLU HG2 H 7.442 -3.763 -1.210 1.00 . A A . 18 GLU HG2 1 1 19 8121 1 1 18 GLU HG3 H 7.410 -3.611 -2.966 1.00 . A A . 18 GLU HG3 1 1 19 8122 1 1 18 GLU N N 7.238 -1.469 0.131 1.00 . A A . 18 GLU N 1 1 19 8123 1 1 18 GLU O O 10.543 -0.280 -0.113 1.00 . A A . 18 GLU O 1 1 19 8124 1 1 18 GLU OE1 O 9.964 -4.168 -3.192 1.00 . A A . 18 GLU OE1 1 1 19 8125 1 1 18 GLU OE2 O 9.589 -4.987 -1.234 1.00 . A A . 18 GLU OE2 1 1 19 8126 1 1 19 ASN C C 9.715 2.464 1.019 1.00 . A A . 19 ASN C 1 1 19 8127 1 1 19 ASN CA C 9.391 2.139 -0.447 1.00 . A A . 19 ASN CA 1 1 19 8128 1 1 19 ASN CB C 8.413 3.164 -1.024 1.00 . A A . 19 ASN CB 1 1 19 8129 1 1 19 ASN CG C 8.517 3.160 -2.551 1.00 . A A . 19 ASN CG 1 1 19 8130 1 1 19 ASN H H 7.736 0.781 -0.757 1.00 . A A . 19 ASN H 1 1 19 8131 1 1 19 ASN HA H 10.294 2.128 -1.031 1.00 . A A . 19 ASN HA 1 1 19 8132 1 1 19 ASN HB2 H 7.406 2.910 -0.729 1.00 . A A . 19 ASN HB2 1 1 19 8133 1 1 19 ASN HB3 H 8.661 4.147 -0.651 1.00 . A A . 19 ASN HB3 1 1 19 8134 1 1 19 ASN HD21 H 7.089 1.799 -2.788 1.00 . A A . 19 ASN HD21 1 1 19 8135 1 1 19 ASN HD22 H 7.798 2.366 -4.223 1.00 . A A . 19 ASN HD22 1 1 19 8136 1 1 19 ASN N N 8.694 0.817 -0.557 1.00 . A A . 19 ASN N 1 1 19 8137 1 1 19 ASN ND2 N 7.736 2.377 -3.245 1.00 . A A . 19 ASN ND2 1 1 19 8138 1 1 19 ASN O O 10.456 3.385 1.304 1.00 . A A . 19 ASN O 1 1 19 8139 1 1 19 ASN OD1 O 9.318 3.875 -3.119 1.00 . A A . 19 ASN OD1 1 1 19 8140 1 1 20 GLY C C 10.342 0.882 3.959 1.00 . A A . 20 GLY C 1 1 19 8141 1 1 20 GLY CA C 9.431 1.977 3.390 1.00 . A A . 20 GLY CA 1 1 19 8142 1 1 20 GLY H H 8.567 0.986 1.689 1.00 . A A . 20 GLY H 1 1 19 8143 1 1 20 GLY HA2 H 9.912 2.939 3.500 1.00 . A A . 20 GLY HA2 1 1 19 8144 1 1 20 GLY HA3 H 8.497 1.979 3.932 1.00 . A A . 20 GLY HA3 1 1 19 8145 1 1 20 GLY N N 9.163 1.718 1.945 1.00 . A A . 20 GLY N 1 1 19 8146 1 1 20 GLY O O 11.164 1.143 4.816 1.00 . A A . 20 GLY O 1 1 19 8147 1 1 21 VAL C C 12.159 -1.797 3.022 1.00 . A A . 21 VAL C 1 1 19 8148 1 1 21 VAL CA C 11.063 -1.445 4.032 1.00 . A A . 21 VAL CA 1 1 19 8149 1 1 21 VAL CB C 10.120 -2.636 4.252 1.00 . A A . 21 VAL CB 1 1 19 8150 1 1 21 VAL CG1 C 10.882 -3.773 4.939 1.00 . A A . 21 VAL CG1 1 1 19 8151 1 1 21 VAL CG2 C 8.945 -2.209 5.139 1.00 . A A . 21 VAL CG2 1 1 19 8152 1 1 21 VAL H H 9.527 -0.536 2.811 1.00 . A A . 21 VAL H 1 1 19 8153 1 1 21 VAL HA H 11.504 -1.152 4.966 1.00 . A A . 21 VAL HA 1 1 19 8154 1 1 21 VAL HB H 9.747 -2.979 3.298 1.00 . A A . 21 VAL HB 1 1 19 8155 1 1 21 VAL HG11 H 10.254 -4.652 4.981 1.00 . A A . 21 VAL HG11 1 1 19 8156 1 1 21 VAL HG12 H 11.149 -3.473 5.941 1.00 . A A . 21 VAL HG12 1 1 19 8157 1 1 21 VAL HG13 H 11.777 -3.997 4.378 1.00 . A A . 21 VAL HG13 1 1 19 8158 1 1 21 VAL HG21 H 8.404 -3.085 5.466 1.00 . A A . 21 VAL HG21 1 1 19 8159 1 1 21 VAL HG22 H 8.283 -1.568 4.576 1.00 . A A . 21 VAL HG22 1 1 19 8160 1 1 21 VAL HG23 H 9.319 -1.674 5.999 1.00 . A A . 21 VAL HG23 1 1 19 8161 1 1 21 VAL N N 10.201 -0.341 3.500 1.00 . A A . 21 VAL N 1 1 19 8162 1 1 21 VAL O O 13.334 -1.777 3.337 1.00 . A A . 21 VAL O 1 1 19 8163 1 1 22 PHE C C 13.640 -1.240 0.407 1.00 . A A . 22 PHE C 1 1 19 8164 1 1 22 PHE CA C 12.795 -2.467 0.767 1.00 . A A . 22 PHE CA 1 1 19 8165 1 1 22 PHE CB C 11.980 -2.935 -0.442 1.00 . A A . 22 PHE CB 1 1 19 8166 1 1 22 PHE CD1 C 12.873 -5.213 -1.046 1.00 . A A . 22 PHE CD1 1 1 19 8167 1 1 22 PHE CD2 C 13.568 -3.302 -2.365 1.00 . A A . 22 PHE CD2 1 1 19 8168 1 1 22 PHE CE1 C 13.659 -6.052 -1.846 1.00 . A A . 22 PHE CE1 1 1 19 8169 1 1 22 PHE CE2 C 14.354 -4.140 -3.165 1.00 . A A . 22 PHE CE2 1 1 19 8170 1 1 22 PHE CG C 12.828 -3.838 -1.305 1.00 . A A . 22 PHE CG 1 1 19 8171 1 1 22 PHE CZ C 14.399 -5.514 -2.905 1.00 . A A . 22 PHE CZ 1 1 19 8172 1 1 22 PHE H H 10.827 -2.118 1.590 1.00 . A A . 22 PHE H 1 1 19 8173 1 1 22 PHE HA H 13.425 -3.264 1.116 1.00 . A A . 22 PHE HA 1 1 19 8174 1 1 22 PHE HB2 H 11.109 -3.476 -0.103 1.00 . A A . 22 PHE HB2 1 1 19 8175 1 1 22 PHE HB3 H 11.668 -2.078 -1.019 1.00 . A A . 22 PHE HB3 1 1 19 8176 1 1 22 PHE HD1 H 12.302 -5.628 -0.229 1.00 . A A . 22 PHE HD1 1 1 19 8177 1 1 22 PHE HD2 H 13.533 -2.241 -2.566 1.00 . A A . 22 PHE HD2 1 1 19 8178 1 1 22 PHE HE1 H 13.694 -7.112 -1.645 1.00 . A A . 22 PHE HE1 1 1 19 8179 1 1 22 PHE HE2 H 14.925 -3.726 -3.983 1.00 . A A . 22 PHE HE2 1 1 19 8180 1 1 22 PHE HZ H 15.006 -6.161 -3.523 1.00 . A A . 22 PHE HZ 1 1 19 8181 1 1 22 PHE N N 11.780 -2.115 1.812 1.00 . A A . 22 PHE N 1 1 19 8182 1 1 22 PHE O O 14.801 -1.354 0.065 1.00 . A A . 22 PHE O 1 1 19 8183 1 1 23 PHE C C 14.324 1.840 1.450 1.00 . A A . 23 PHE C 1 1 19 8184 1 1 23 PHE CA C 13.818 1.176 0.162 1.00 . A A . 23 PHE CA 1 1 19 8185 1 1 23 PHE CB C 12.799 2.070 -0.550 1.00 . A A . 23 PHE CB 1 1 19 8186 1 1 23 PHE CD1 C 13.784 2.206 -2.867 1.00 . A A . 23 PHE CD1 1 1 19 8187 1 1 23 PHE CD2 C 13.795 4.192 -1.475 1.00 . A A . 23 PHE CD2 1 1 19 8188 1 1 23 PHE CE1 C 14.409 2.924 -3.894 1.00 . A A . 23 PHE CE1 1 1 19 8189 1 1 23 PHE CE2 C 14.421 4.908 -2.501 1.00 . A A . 23 PHE CE2 1 1 19 8190 1 1 23 PHE CG C 13.477 2.841 -1.657 1.00 . A A . 23 PHE CG 1 1 19 8191 1 1 23 PHE CZ C 14.728 4.274 -3.711 1.00 . A A . 23 PHE CZ 1 1 19 8192 1 1 23 PHE H H 12.127 -0.012 0.772 1.00 . A A . 23 PHE H 1 1 19 8193 1 1 23 PHE HA H 14.642 0.956 -0.498 1.00 . A A . 23 PHE HA 1 1 19 8194 1 1 23 PHE HB2 H 12.016 1.457 -0.967 1.00 . A A . 23 PHE HB2 1 1 19 8195 1 1 23 PHE HB3 H 12.372 2.763 0.160 1.00 . A A . 23 PHE HB3 1 1 19 8196 1 1 23 PHE HD1 H 13.539 1.164 -3.008 1.00 . A A . 23 PHE HD1 1 1 19 8197 1 1 23 PHE HD2 H 13.559 4.681 -0.541 1.00 . A A . 23 PHE HD2 1 1 19 8198 1 1 23 PHE HE1 H 14.646 2.434 -4.827 1.00 . A A . 23 PHE HE1 1 1 19 8199 1 1 23 PHE HE2 H 14.667 5.951 -2.360 1.00 . A A . 23 PHE HE2 1 1 19 8200 1 1 23 PHE HZ H 15.211 4.827 -4.503 1.00 . A A . 23 PHE HZ 1 1 19 8201 1 1 23 PHE N N 13.064 -0.070 0.489 1.00 . A A . 23 PHE N 1 1 19 8202 1 1 23 PHE O O 14.373 3.051 1.554 1.00 . A A . 23 PHE O 1 1 19 8203 1 1 24 TYR C C 16.044 0.586 4.475 1.00 . A A . 24 TYR C 1 1 19 8204 1 1 24 TYR CA C 15.205 1.628 3.716 1.00 . A A . 24 TYR CA 1 1 19 8205 1 1 24 TYR CB C 13.943 1.986 4.507 1.00 . A A . 24 TYR CB 1 1 19 8206 1 1 24 TYR CD1 C 13.893 4.506 4.436 1.00 . A A . 24 TYR CD1 1 1 19 8207 1 1 24 TYR CD2 C 14.513 3.408 6.508 1.00 . A A . 24 TYR CD2 1 1 19 8208 1 1 24 TYR CE1 C 14.057 5.752 5.048 1.00 . A A . 24 TYR CE1 1 1 19 8209 1 1 24 TYR CE2 C 14.677 4.656 7.120 1.00 . A A . 24 TYR CE2 1 1 19 8210 1 1 24 TYR CG C 14.122 3.332 5.166 1.00 . A A . 24 TYR CG 1 1 19 8211 1 1 24 TYR CZ C 14.449 5.828 6.389 1.00 . A A . 24 TYR CZ 1 1 19 8212 1 1 24 TYR H H 14.649 0.081 2.319 1.00 . A A . 24 TYR H 1 1 19 8213 1 1 24 TYR HA H 15.787 2.515 3.528 1.00 . A A . 24 TYR HA 1 1 19 8214 1 1 24 TYR HB2 H 13.098 2.023 3.836 1.00 . A A . 24 TYR HB2 1 1 19 8215 1 1 24 TYR HB3 H 13.768 1.236 5.265 1.00 . A A . 24 TYR HB3 1 1 19 8216 1 1 24 TYR HD1 H 13.592 4.448 3.401 1.00 . A A . 24 TYR HD1 1 1 19 8217 1 1 24 TYR HD2 H 14.689 2.504 7.072 1.00 . A A . 24 TYR HD2 1 1 19 8218 1 1 24 TYR HE1 H 13.882 6.658 4.485 1.00 . A A . 24 TYR HE1 1 1 19 8219 1 1 24 TYR HE2 H 14.979 4.714 8.154 1.00 . A A . 24 TYR HE2 1 1 19 8220 1 1 24 TYR HH H 13.769 7.311 7.381 1.00 . A A . 24 TYR HH 1 1 19 8221 1 1 24 TYR N N 14.699 1.052 2.430 1.00 . A A . 24 TYR N 1 1 19 8222 1 1 24 TYR O O 16.011 0.516 5.690 1.00 . A A . 24 TYR O 1 1 19 8223 1 1 24 TYR OH O 14.610 7.058 6.993 1.00 . A A . 24 TYR OH 1 1 19 8224 1 1 25 LYS C C 19.069 -1.234 3.876 1.00 . A A . 25 LYS C 1 1 19 8225 1 1 25 LYS CA C 17.641 -1.257 4.438 1.00 . A A . 25 LYS CA 1 1 19 8226 1 1 25 LYS CB C 16.956 -2.590 4.120 1.00 . A A . 25 LYS CB 1 1 19 8227 1 1 25 LYS CD C 16.675 -4.967 4.853 1.00 . A A . 25 LYS CD 1 1 19 8228 1 1 25 LYS CE C 17.744 -5.822 4.162 1.00 . A A . 25 LYS CE 1 1 19 8229 1 1 25 LYS CG C 17.267 -3.604 5.225 1.00 . A A . 25 LYS CG 1 1 19 8230 1 1 25 LYS H H 16.810 -0.142 2.789 1.00 . A A . 25 LYS H 1 1 19 8231 1 1 25 LYS HA H 17.655 -1.096 5.505 1.00 . A A . 25 LYS HA 1 1 19 8232 1 1 25 LYS HB2 H 15.887 -2.439 4.060 1.00 . A A . 25 LYS HB2 1 1 19 8233 1 1 25 LYS HB3 H 17.321 -2.965 3.175 1.00 . A A . 25 LYS HB3 1 1 19 8234 1 1 25 LYS HD2 H 16.337 -5.466 5.749 1.00 . A A . 25 LYS HD2 1 1 19 8235 1 1 25 LYS HD3 H 15.841 -4.826 4.181 1.00 . A A . 25 LYS HD3 1 1 19 8236 1 1 25 LYS HE2 H 18.247 -5.245 3.398 1.00 . A A . 25 LYS HE2 1 1 19 8237 1 1 25 LYS HE3 H 18.454 -6.192 4.886 1.00 . A A . 25 LYS HE3 1 1 19 8238 1 1 25 LYS HG2 H 18.339 -3.693 5.338 1.00 . A A . 25 LYS HG2 1 1 19 8239 1 1 25 LYS HG3 H 16.833 -3.267 6.154 1.00 . A A . 25 LYS HG3 1 1 19 8240 1 1 25 LYS HZ1 H 16.359 -7.380 4.255 1.00 . A A . 25 LYS HZ1 1 1 19 8241 1 1 25 LYS HZ2 H 17.677 -7.683 3.227 1.00 . A A . 25 LYS HZ2 1 1 19 8242 1 1 25 LYS HZ3 H 16.445 -6.619 2.740 1.00 . A A . 25 LYS HZ3 1 1 19 8243 1 1 25 LYS N N 16.798 -0.219 3.765 1.00 . A A . 25 LYS N 1 1 19 8244 1 1 25 LYS NZ N 16.999 -6.962 3.551 1.00 . A A . 25 LYS NZ 1 1 19 8245 1 1 25 LYS O O 19.213 -1.115 2.668 1.00 . A A . 25 LYS O 1 1 19 8246 1 1 25 LYS OXT O 19.995 -1.340 4.663 1.00 . A A . 25 LYS OXT 1 1 20 8247 1 1 1 HIS C C -20.756 1.834 -1.920 1.00 . A A . 1 HIS C 1 1 20 8248 1 1 1 HIS CA C -22.239 1.649 -1.568 1.00 . A A . 1 HIS CA 1 1 20 8249 1 1 1 HIS CB C -23.055 1.270 -2.810 1.00 . A A . 1 HIS CB 1 1 20 8250 1 1 1 HIS CD2 C -23.014 -1.354 -2.644 1.00 . A A . 1 HIS CD2 1 1 20 8251 1 1 1 HIS CE1 C -21.887 -1.766 -4.449 1.00 . A A . 1 HIS CE1 1 1 20 8252 1 1 1 HIS CG C -22.728 -0.141 -3.220 1.00 . A A . 1 HIS CG 1 1 20 8253 1 1 1 HIS HA H -22.352 0.892 -0.809 1.00 . A A . 1 HIS HA 1 1 20 8254 1 1 1 HIS HB2 H -24.109 1.342 -2.585 1.00 . A A . 1 HIS HB2 1 1 20 8255 1 1 1 HIS HB3 H -22.814 1.944 -3.620 1.00 . A A . 1 HIS HB3 1 1 20 8256 1 1 1 HIS HD1 H -21.653 0.224 -5.010 1.00 . A A . 1 HIS HD1 1 1 20 8257 1 1 1 HIS HD2 H -23.569 -1.493 -1.728 1.00 . A A . 1 HIS HD2 1 1 20 8258 1 1 1 HIS HE1 H -21.372 -2.282 -5.245 1.00 . A A . 1 HIS HE1 1 1 20 8259 1 1 1 HIS N N -22.821 2.944 -1.101 1.00 . A A . 1 HIS N 1 1 20 8260 1 1 1 HIS ND1 N -22.008 -0.429 -4.370 1.00 . A A . 1 HIS ND1 1 1 20 8261 1 1 1 HIS NE2 N -22.483 -2.379 -3.421 1.00 . A A . 1 HIS NE2 1 1 20 8262 1 1 1 HIS O O -20.397 2.025 -3.068 1.00 . A A . 1 HIS O 1 1 20 8263 1 1 2 ALA C C -17.621 1.312 -0.064 1.00 . A A . 2 ALA C 1 1 20 8264 1 1 2 ALA CA C -18.431 1.950 -1.196 1.00 . A A . 2 ALA CA 1 1 20 8265 1 1 2 ALA CB C -18.202 3.462 -1.237 1.00 . A A . 2 ALA CB 1 1 20 8266 1 1 2 ALA H H -20.208 1.625 -0.019 1.00 . A A . 2 ALA H 1 1 20 8267 1 1 2 ALA HA H -18.164 1.510 -2.145 1.00 . A A . 2 ALA HA 1 1 20 8268 1 1 2 ALA HB1 H -17.146 3.668 -1.160 1.00 . A A . 2 ALA HB1 1 1 20 8269 1 1 2 ALA HB2 H -18.722 3.927 -0.413 1.00 . A A . 2 ALA HB2 1 1 20 8270 1 1 2 ALA HB3 H -18.579 3.858 -2.170 1.00 . A A . 2 ALA HB3 1 1 20 8271 1 1 2 ALA N N -19.893 1.779 -0.934 1.00 . A A . 2 ALA N 1 1 20 8272 1 1 2 ALA O O -17.443 1.896 0.990 1.00 . A A . 2 ALA O 1 1 20 8273 1 1 3 TRP C C -14.899 -0.796 0.314 1.00 . A A . 3 TRP C 1 1 20 8274 1 1 3 TRP CA C -16.341 -0.574 0.792 1.00 . A A . 3 TRP CA 1 1 20 8275 1 1 3 TRP CB C -17.051 -1.916 1.026 1.00 . A A . 3 TRP CB 1 1 20 8276 1 1 3 TRP CD1 C -19.532 -2.314 0.714 1.00 . A A . 3 TRP CD1 1 1 20 8277 1 1 3 TRP CD2 C -19.101 -0.787 2.311 1.00 . A A . 3 TRP CD2 1 1 20 8278 1 1 3 TRP CE2 C -20.509 -0.913 2.238 1.00 . A A . 3 TRP CE2 1 1 20 8279 1 1 3 TRP CE3 C -18.565 0.118 3.245 1.00 . A A . 3 TRP CE3 1 1 20 8280 1 1 3 TRP CG C -18.503 -1.688 1.332 1.00 . A A . 3 TRP CG 1 1 20 8281 1 1 3 TRP CH2 C -20.804 0.725 3.984 1.00 . A A . 3 TRP CH2 1 1 20 8282 1 1 3 TRP CZ2 C -21.353 -0.170 3.061 1.00 . A A . 3 TRP CZ2 1 1 20 8283 1 1 3 TRP CZ3 C -19.413 0.869 4.075 1.00 . A A . 3 TRP CZ3 1 1 20 8284 1 1 3 TRP H H -17.299 -0.334 -1.127 1.00 . A A . 3 TRP H 1 1 20 8285 1 1 3 TRP HA H -16.348 0.007 1.702 1.00 . A A . 3 TRP HA 1 1 20 8286 1 1 3 TRP HB2 H -16.966 -2.526 0.138 1.00 . A A . 3 TRP HB2 1 1 20 8287 1 1 3 TRP HB3 H -16.587 -2.427 1.856 1.00 . A A . 3 TRP HB3 1 1 20 8288 1 1 3 TRP HD1 H -19.439 -3.051 -0.069 1.00 . A A . 3 TRP HD1 1 1 20 8289 1 1 3 TRP HE1 H -21.615 -2.151 0.979 1.00 . A A . 3 TRP HE1 1 1 20 8290 1 1 3 TRP HE3 H -17.495 0.237 3.324 1.00 . A A . 3 TRP HE3 1 1 20 8291 1 1 3 TRP HH2 H -21.451 1.304 4.626 1.00 . A A . 3 TRP HH2 1 1 20 8292 1 1 3 TRP HZ2 H -22.424 -0.284 2.987 1.00 . A A . 3 TRP HZ2 1 1 20 8293 1 1 3 TRP HZ3 H -18.991 1.560 4.789 1.00 . A A . 3 TRP HZ3 1 1 20 8294 1 1 3 TRP N N -17.137 0.114 -0.272 1.00 . A A . 3 TRP N 1 1 20 8295 1 1 3 TRP NE1 N -20.721 -1.856 1.251 1.00 . A A . 3 TRP NE1 1 1 20 8296 1 1 3 TRP O O -14.420 -1.913 0.245 1.00 . A A . 3 TRP O 1 1 20 8297 1 1 4 TYR C C -11.793 0.672 0.557 1.00 . A A . 4 TYR C 1 1 20 8298 1 1 4 TYR CA C -12.786 0.122 -0.483 1.00 . A A . 4 TYR CA 1 1 20 8299 1 1 4 TYR CB C -12.708 0.921 -1.796 1.00 . A A . 4 TYR CB 1 1 20 8300 1 1 4 TYR CD1 C -11.743 3.168 -1.153 1.00 . A A . 4 TYR CD1 1 1 20 8301 1 1 4 TYR CD2 C -14.109 3.019 -1.663 1.00 . A A . 4 TYR CD2 1 1 20 8302 1 1 4 TYR CE1 C -11.882 4.539 -0.909 1.00 . A A . 4 TYR CE1 1 1 20 8303 1 1 4 TYR CE2 C -14.247 4.390 -1.420 1.00 . A A . 4 TYR CE2 1 1 20 8304 1 1 4 TYR CG C -12.858 2.406 -1.529 1.00 . A A . 4 TYR CG 1 1 20 8305 1 1 4 TYR CZ C -13.133 5.150 -1.043 1.00 . A A . 4 TYR CZ 1 1 20 8306 1 1 4 TYR H H -14.606 1.156 0.057 1.00 . A A . 4 TYR H 1 1 20 8307 1 1 4 TYR HA H -12.570 -0.915 -0.680 1.00 . A A . 4 TYR HA 1 1 20 8308 1 1 4 TYR HB2 H -11.753 0.739 -2.267 1.00 . A A . 4 TYR HB2 1 1 20 8309 1 1 4 TYR HB3 H -13.497 0.596 -2.458 1.00 . A A . 4 TYR HB3 1 1 20 8310 1 1 4 TYR HD1 H -10.776 2.697 -1.049 1.00 . A A . 4 TYR HD1 1 1 20 8311 1 1 4 TYR HD2 H -14.970 2.434 -1.953 1.00 . A A . 4 TYR HD2 1 1 20 8312 1 1 4 TYR HE1 H -11.022 5.125 -0.618 1.00 . A A . 4 TYR HE1 1 1 20 8313 1 1 4 TYR HE2 H -15.212 4.864 -1.524 1.00 . A A . 4 TYR HE2 1 1 20 8314 1 1 4 TYR HH H -13.786 6.613 -0.001 1.00 . A A . 4 TYR HH 1 1 20 8315 1 1 4 TYR N N -14.201 0.265 -0.011 1.00 . A A . 4 TYR N 1 1 20 8316 1 1 4 TYR O O -10.613 0.791 0.285 1.00 . A A . 4 TYR O 1 1 20 8317 1 1 4 TYR OH O -13.269 6.503 -0.803 1.00 . A A . 4 TYR OH 1 1 20 8318 1 1 5 SER C C -10.179 0.555 3.053 1.00 . A A . 5 SER C 1 1 20 8319 1 1 5 SER CA C -11.332 1.534 2.799 1.00 . A A . 5 SER CA 1 1 20 8320 1 1 5 SER CB C -12.195 1.685 4.054 1.00 . A A . 5 SER CB 1 1 20 8321 1 1 5 SER H H -13.208 0.888 1.945 1.00 . A A . 5 SER H 1 1 20 8322 1 1 5 SER HA H -10.946 2.491 2.503 1.00 . A A . 5 SER HA 1 1 20 8323 1 1 5 SER HB2 H -13.018 2.350 3.849 1.00 . A A . 5 SER HB2 1 1 20 8324 1 1 5 SER HB3 H -12.582 0.716 4.343 1.00 . A A . 5 SER HB3 1 1 20 8325 1 1 5 SER HG H -11.986 2.412 5.847 1.00 . A A . 5 SER HG 1 1 20 8326 1 1 5 SER N N -12.256 0.999 1.745 1.00 . A A . 5 SER N 1 1 20 8327 1 1 5 SER O O -9.061 0.955 3.317 1.00 . A A . 5 SER O 1 1 20 8328 1 1 5 SER OG O -11.406 2.227 5.104 1.00 . A A . 5 SER OG 1 1 20 8329 1 1 6 HIS C C -8.624 -1.996 1.869 1.00 . A A . 6 HIS C 1 1 20 8330 1 1 6 HIS CA C -9.369 -1.732 3.182 1.00 . A A . 6 HIS CA 1 1 20 8331 1 1 6 HIS CB C -10.092 -2.993 3.664 1.00 . A A . 6 HIS CB 1 1 20 8332 1 1 6 HIS CD2 C -8.718 -5.232 3.721 1.00 . A A . 6 HIS CD2 1 1 20 8333 1 1 6 HIS CE1 C -7.514 -4.819 5.474 1.00 . A A . 6 HIS CE1 1 1 20 8334 1 1 6 HIS CG C -9.085 -3.989 4.172 1.00 . A A . 6 HIS CG 1 1 20 8335 1 1 6 HIS H H -11.352 -1.012 2.741 1.00 . A A . 6 HIS H 1 1 20 8336 1 1 6 HIS HA H -8.681 -1.388 3.933 1.00 . A A . 6 HIS HA 1 1 20 8337 1 1 6 HIS HB2 H -10.775 -2.734 4.460 1.00 . A A . 6 HIS HB2 1 1 20 8338 1 1 6 HIS HB3 H -10.644 -3.426 2.843 1.00 . A A . 6 HIS HB3 1 1 20 8339 1 1 6 HIS HD1 H -8.325 -2.939 5.847 1.00 . A A . 6 HIS HD1 1 1 20 8340 1 1 6 HIS HD2 H -9.138 -5.731 2.859 1.00 . A A . 6 HIS HD2 1 1 20 8341 1 1 6 HIS HE1 H -6.796 -4.913 6.276 1.00 . A A . 6 HIS HE1 1 1 20 8342 1 1 6 HIS N N -10.445 -0.720 2.963 1.00 . A A . 6 HIS N 1 1 20 8343 1 1 6 HIS ND1 N -8.304 -3.746 5.291 1.00 . A A . 6 HIS ND1 1 1 20 8344 1 1 6 HIS NE2 N -7.726 -5.755 4.545 1.00 . A A . 6 HIS NE2 1 1 20 8345 1 1 6 HIS O O -7.435 -2.250 1.864 1.00 . A A . 6 HIS O 1 1 20 8346 1 1 7 TYR C C -7.608 -1.074 -0.820 1.00 . A A . 7 TYR C 1 1 20 8347 1 1 7 TYR CA C -8.651 -2.161 -0.560 1.00 . A A . 7 TYR CA 1 1 20 8348 1 1 7 TYR CB C -9.773 -2.099 -1.603 1.00 . A A . 7 TYR CB 1 1 20 8349 1 1 7 TYR CD1 C -9.650 -4.417 -2.586 1.00 . A A . 7 TYR CD1 1 1 20 8350 1 1 7 TYR CD2 C -11.568 -3.829 -1.224 1.00 . A A . 7 TYR CD2 1 1 20 8351 1 1 7 TYR CE1 C -10.178 -5.698 -2.777 1.00 . A A . 7 TYR CE1 1 1 20 8352 1 1 7 TYR CE2 C -12.096 -5.111 -1.414 1.00 . A A . 7 TYR CE2 1 1 20 8353 1 1 7 TYR CG C -10.345 -3.481 -1.810 1.00 . A A . 7 TYR CG 1 1 20 8354 1 1 7 TYR CZ C -11.401 -6.046 -2.191 1.00 . A A . 7 TYR CZ 1 1 20 8355 1 1 7 TYR H H -10.270 -1.711 0.796 1.00 . A A . 7 TYR H 1 1 20 8356 1 1 7 TYR HA H -8.187 -3.129 -0.573 1.00 . A A . 7 TYR HA 1 1 20 8357 1 1 7 TYR HB2 H -10.550 -1.433 -1.259 1.00 . A A . 7 TYR HB2 1 1 20 8358 1 1 7 TYR HB3 H -9.373 -1.733 -2.537 1.00 . A A . 7 TYR HB3 1 1 20 8359 1 1 7 TYR HD1 H -8.706 -4.148 -3.038 1.00 . A A . 7 TYR HD1 1 1 20 8360 1 1 7 TYR HD2 H -12.105 -3.107 -0.624 1.00 . A A . 7 TYR HD2 1 1 20 8361 1 1 7 TYR HE1 H -9.642 -6.420 -3.376 1.00 . A A . 7 TYR HE1 1 1 20 8362 1 1 7 TYR HE2 H -13.039 -5.380 -0.963 1.00 . A A . 7 TYR HE2 1 1 20 8363 1 1 7 TYR HH H -12.476 -7.290 -3.162 1.00 . A A . 7 TYR HH 1 1 20 8364 1 1 7 TYR N N -9.316 -1.926 0.759 1.00 . A A . 7 TYR N 1 1 20 8365 1 1 7 TYR O O -6.503 -1.357 -1.241 1.00 . A A . 7 TYR O 1 1 20 8366 1 1 7 TYR OH O -11.920 -7.310 -2.378 1.00 . A A . 7 TYR OH 1 1 20 8367 1 1 8 VAL C C -5.776 1.096 0.202 1.00 . A A . 8 VAL C 1 1 20 8368 1 1 8 VAL CA C -6.960 1.270 -0.760 1.00 . A A . 8 VAL CA 1 1 20 8369 1 1 8 VAL CB C -7.731 2.572 -0.481 1.00 . A A . 8 VAL CB 1 1 20 8370 1 1 8 VAL CG1 C -8.055 2.693 1.012 1.00 . A A . 8 VAL CG1 1 1 20 8371 1 1 8 VAL CG2 C -6.878 3.770 -0.912 1.00 . A A . 8 VAL CG2 1 1 20 8372 1 1 8 VAL H H -8.837 0.357 -0.197 1.00 . A A . 8 VAL H 1 1 20 8373 1 1 8 VAL HA H -6.610 1.261 -1.777 1.00 . A A . 8 VAL HA 1 1 20 8374 1 1 8 VAL HB H -8.653 2.568 -1.045 1.00 . A A . 8 VAL HB 1 1 20 8375 1 1 8 VAL HG11 H -8.824 3.438 1.154 1.00 . A A . 8 VAL HG11 1 1 20 8376 1 1 8 VAL HG12 H -7.165 2.984 1.552 1.00 . A A . 8 VAL HG12 1 1 20 8377 1 1 8 VAL HG13 H -8.404 1.741 1.381 1.00 . A A . 8 VAL HG13 1 1 20 8378 1 1 8 VAL HG21 H -7.429 4.684 -0.745 1.00 . A A . 8 VAL HG21 1 1 20 8379 1 1 8 VAL HG22 H -6.637 3.682 -1.961 1.00 . A A . 8 VAL HG22 1 1 20 8380 1 1 8 VAL HG23 H -5.966 3.790 -0.334 1.00 . A A . 8 VAL HG23 1 1 20 8381 1 1 8 VAL N N -7.944 0.163 -0.550 1.00 . A A . 8 VAL N 1 1 20 8382 1 1 8 VAL O O -4.661 1.476 -0.098 1.00 . A A . 8 VAL O 1 1 20 8383 1 1 9 LEU C C -3.991 -0.850 1.800 1.00 . A A . 9 LEU C 1 1 20 8384 1 1 9 LEU CA C -4.907 0.265 2.323 1.00 . A A . 9 LEU CA 1 1 20 8385 1 1 9 LEU CB C -5.600 -0.167 3.625 1.00 . A A . 9 LEU CB 1 1 20 8386 1 1 9 LEU CD1 C -3.421 -0.019 4.866 1.00 . A A . 9 LEU CD1 1 1 20 8387 1 1 9 LEU CD2 C -4.936 1.969 4.764 1.00 . A A . 9 LEU CD2 1 1 20 8388 1 1 9 LEU CG C -4.882 0.439 4.840 1.00 . A A . 9 LEU CG 1 1 20 8389 1 1 9 LEU H H -6.918 0.183 1.553 1.00 . A A . 9 LEU H 1 1 20 8390 1 1 9 LEU HA H -4.346 1.172 2.482 1.00 . A A . 9 LEU HA 1 1 20 8391 1 1 9 LEU HB2 H -6.626 0.170 3.612 1.00 . A A . 9 LEU HB2 1 1 20 8392 1 1 9 LEU HB3 H -5.579 -1.244 3.700 1.00 . A A . 9 LEU HB3 1 1 20 8393 1 1 9 LEU HD11 H -3.367 -1.064 4.601 1.00 . A A . 9 LEU HD11 1 1 20 8394 1 1 9 LEU HD12 H -3.018 0.123 5.857 1.00 . A A . 9 LEU HD12 1 1 20 8395 1 1 9 LEU HD13 H -2.850 0.562 4.158 1.00 . A A . 9 LEU HD13 1 1 20 8396 1 1 9 LEU HD21 H -4.233 2.317 4.021 1.00 . A A . 9 LEU HD21 1 1 20 8397 1 1 9 LEU HD22 H -4.678 2.386 5.725 1.00 . A A . 9 LEU HD22 1 1 20 8398 1 1 9 LEU HD23 H -5.932 2.281 4.491 1.00 . A A . 9 LEU HD23 1 1 20 8399 1 1 9 LEU HG H -5.374 0.108 5.744 1.00 . A A . 9 LEU HG 1 1 20 8400 1 1 9 LEU N N -6.012 0.497 1.347 1.00 . A A . 9 LEU N 1 1 20 8401 1 1 9 LEU O O -2.787 -0.797 1.959 1.00 . A A . 9 LEU O 1 1 20 8402 1 1 10 LYS C C -2.860 -2.455 -0.542 1.00 . A A . 10 LYS C 1 1 20 8403 1 1 10 LYS CA C -3.723 -2.967 0.617 1.00 . A A . 10 LYS CA 1 1 20 8404 1 1 10 LYS CB C -4.728 -4.013 0.118 1.00 . A A . 10 LYS CB 1 1 20 8405 1 1 10 LYS CD C -4.462 -6.154 1.383 1.00 . A A . 10 LYS CD 1 1 20 8406 1 1 10 LYS CE C -5.755 -6.937 1.134 1.00 . A A . 10 LYS CE 1 1 20 8407 1 1 10 LYS CG C -4.069 -5.395 0.113 1.00 . A A . 10 LYS CG 1 1 20 8408 1 1 10 LYS H H -5.533 -1.866 1.041 1.00 . A A . 10 LYS H 1 1 20 8409 1 1 10 LYS HA H -3.103 -3.390 1.391 1.00 . A A . 10 LYS HA 1 1 20 8410 1 1 10 LYS HB2 H -5.588 -4.024 0.772 1.00 . A A . 10 LYS HB2 1 1 20 8411 1 1 10 LYS HB3 H -5.040 -3.761 -0.885 1.00 . A A . 10 LYS HB3 1 1 20 8412 1 1 10 LYS HD2 H -3.670 -6.840 1.650 1.00 . A A . 10 LYS HD2 1 1 20 8413 1 1 10 LYS HD3 H -4.617 -5.453 2.189 1.00 . A A . 10 LYS HD3 1 1 20 8414 1 1 10 LYS HE2 H -6.516 -6.284 0.727 1.00 . A A . 10 LYS HE2 1 1 20 8415 1 1 10 LYS HE3 H -5.572 -7.764 0.466 1.00 . A A . 10 LYS HE3 1 1 20 8416 1 1 10 LYS HG2 H -4.401 -5.947 -0.756 1.00 . A A . 10 LYS HG2 1 1 20 8417 1 1 10 LYS HG3 H -2.996 -5.284 0.080 1.00 . A A . 10 LYS HG3 1 1 20 8418 1 1 10 LYS HZ1 H -6.513 -6.656 3.056 1.00 . A A . 10 LYS HZ1 1 1 20 8419 1 1 10 LYS HZ2 H -5.353 -7.893 2.943 1.00 . A A . 10 LYS HZ2 1 1 20 8420 1 1 10 LYS HZ3 H -6.928 -8.146 2.361 1.00 . A A . 10 LYS HZ3 1 1 20 8421 1 1 10 LYS N N -4.557 -1.852 1.165 1.00 . A A . 10 LYS N 1 1 20 8422 1 1 10 LYS NZ N -6.168 -7.446 2.474 1.00 . A A . 10 LYS NZ 1 1 20 8423 1 1 10 LYS O O -1.691 -2.776 -0.642 1.00 . A A . 10 LYS O 1 1 20 8424 1 1 11 PHE C C -1.592 -0.114 -2.050 1.00 . A A . 11 PHE C 1 1 20 8425 1 1 11 PHE CA C -2.640 -1.109 -2.562 1.00 . A A . 11 PHE CA 1 1 20 8426 1 1 11 PHE CB C -3.665 -0.406 -3.456 1.00 . A A . 11 PHE CB 1 1 20 8427 1 1 11 PHE CD1 C -2.871 -0.991 -5.778 1.00 . A A . 11 PHE CD1 1 1 20 8428 1 1 11 PHE CD2 C -2.571 1.279 -4.980 1.00 . A A . 11 PHE CD2 1 1 20 8429 1 1 11 PHE CE1 C -2.274 -0.642 -6.995 1.00 . A A . 11 PHE CE1 1 1 20 8430 1 1 11 PHE CE2 C -1.974 1.629 -6.197 1.00 . A A . 11 PHE CE2 1 1 20 8431 1 1 11 PHE CG C -3.020 -0.030 -4.769 1.00 . A A . 11 PHE CG 1 1 20 8432 1 1 11 PHE CZ C -1.825 0.668 -7.204 1.00 . A A . 11 PHE CZ 1 1 20 8433 1 1 11 PHE H H -4.369 -1.405 -1.305 1.00 . A A . 11 PHE H 1 1 20 8434 1 1 11 PHE HA H -2.162 -1.911 -3.104 1.00 . A A . 11 PHE HA 1 1 20 8435 1 1 11 PHE HB2 H -4.498 -1.069 -3.639 1.00 . A A . 11 PHE HB2 1 1 20 8436 1 1 11 PHE HB3 H -4.020 0.487 -2.962 1.00 . A A . 11 PHE HB3 1 1 20 8437 1 1 11 PHE HD1 H -3.218 -2.001 -5.616 1.00 . A A . 11 PHE HD1 1 1 20 8438 1 1 11 PHE HD2 H -2.686 2.021 -4.204 1.00 . A A . 11 PHE HD2 1 1 20 8439 1 1 11 PHE HE1 H -2.159 -1.383 -7.772 1.00 . A A . 11 PHE HE1 1 1 20 8440 1 1 11 PHE HE2 H -1.628 2.639 -6.359 1.00 . A A . 11 PHE HE2 1 1 20 8441 1 1 11 PHE HZ H -1.364 0.937 -8.143 1.00 . A A . 11 PHE HZ 1 1 20 8442 1 1 11 PHE N N -3.427 -1.653 -1.412 1.00 . A A . 11 PHE N 1 1 20 8443 1 1 11 PHE O O -0.449 -0.140 -2.464 1.00 . A A . 11 PHE O 1 1 20 8444 1 1 12 PHE C C 0.120 1.019 0.162 1.00 . A A . 12 PHE C 1 1 20 8445 1 1 12 PHE CA C -1.001 1.749 -0.590 1.00 . A A . 12 PHE CA 1 1 20 8446 1 1 12 PHE CB C -1.816 2.623 0.368 1.00 . A A . 12 PHE CB 1 1 20 8447 1 1 12 PHE CD1 C -0.541 4.785 0.111 1.00 . A A . 12 PHE CD1 1 1 20 8448 1 1 12 PHE CD2 C -0.529 3.670 2.265 1.00 . A A . 12 PHE CD2 1 1 20 8449 1 1 12 PHE CE1 C 0.272 5.798 0.631 1.00 . A A . 12 PHE CE1 1 1 20 8450 1 1 12 PHE CE2 C 0.283 4.685 2.784 1.00 . A A . 12 PHE CE2 1 1 20 8451 1 1 12 PHE CG C -0.941 3.720 0.928 1.00 . A A . 12 PHE CG 1 1 20 8452 1 1 12 PHE CZ C 0.683 5.749 1.968 1.00 . A A . 12 PHE CZ 1 1 20 8453 1 1 12 PHE H H -2.901 0.750 -0.822 1.00 . A A . 12 PHE H 1 1 20 8454 1 1 12 PHE HA H -0.590 2.355 -1.383 1.00 . A A . 12 PHE HA 1 1 20 8455 1 1 12 PHE HB2 H -2.647 3.063 -0.166 1.00 . A A . 12 PHE HB2 1 1 20 8456 1 1 12 PHE HB3 H -2.192 2.014 1.177 1.00 . A A . 12 PHE HB3 1 1 20 8457 1 1 12 PHE HD1 H -0.860 4.823 -0.920 1.00 . A A . 12 PHE HD1 1 1 20 8458 1 1 12 PHE HD2 H -0.837 2.848 2.894 1.00 . A A . 12 PHE HD2 1 1 20 8459 1 1 12 PHE HE1 H 0.580 6.620 0.002 1.00 . A A . 12 PHE HE1 1 1 20 8460 1 1 12 PHE HE2 H 0.601 4.646 3.817 1.00 . A A . 12 PHE HE2 1 1 20 8461 1 1 12 PHE HZ H 1.310 6.532 2.370 1.00 . A A . 12 PHE HZ 1 1 20 8462 1 1 12 PHE N N -1.974 0.757 -1.144 1.00 . A A . 12 PHE N 1 1 20 8463 1 1 12 PHE O O 1.278 1.367 0.050 1.00 . A A . 12 PHE O 1 1 20 8464 1 1 13 LEU C C 1.776 -1.460 0.677 1.00 . A A . 13 LEU C 1 1 20 8465 1 1 13 LEU CA C 0.821 -0.771 1.663 1.00 . A A . 13 LEU CA 1 1 20 8466 1 1 13 LEU CB C 0.044 -1.810 2.480 1.00 . A A . 13 LEU CB 1 1 20 8467 1 1 13 LEU CD1 C 0.243 -2.639 4.831 1.00 . A A . 13 LEU CD1 1 1 20 8468 1 1 13 LEU CD2 C 1.408 -3.846 2.981 1.00 . A A . 13 LEU CD2 1 1 20 8469 1 1 13 LEU CG C 0.978 -2.472 3.499 1.00 . A A . 13 LEU CG 1 1 20 8470 1 1 13 LEU H H -1.164 -0.267 0.978 1.00 . A A . 13 LEU H 1 1 20 8471 1 1 13 LEU HA H 1.369 -0.117 2.323 1.00 . A A . 13 LEU HA 1 1 20 8472 1 1 13 LEU HB2 H -0.768 -1.322 2.999 1.00 . A A . 13 LEU HB2 1 1 20 8473 1 1 13 LEU HB3 H -0.354 -2.563 1.816 1.00 . A A . 13 LEU HB3 1 1 20 8474 1 1 13 LEU HD11 H 0.930 -3.012 5.575 1.00 . A A . 13 LEU HD11 1 1 20 8475 1 1 13 LEU HD12 H -0.571 -3.338 4.709 1.00 . A A . 13 LEU HD12 1 1 20 8476 1 1 13 LEU HD13 H -0.147 -1.684 5.148 1.00 . A A . 13 LEU HD13 1 1 20 8477 1 1 13 LEU HD21 H 2.222 -4.220 3.584 1.00 . A A . 13 LEU HD21 1 1 20 8478 1 1 13 LEU HD22 H 1.733 -3.760 1.954 1.00 . A A . 13 LEU HD22 1 1 20 8479 1 1 13 LEU HD23 H 0.574 -4.530 3.038 1.00 . A A . 13 LEU HD23 1 1 20 8480 1 1 13 LEU HG H 1.850 -1.850 3.645 1.00 . A A . 13 LEU HG 1 1 20 8481 1 1 13 LEU N N -0.221 -0.001 0.914 1.00 . A A . 13 LEU N 1 1 20 8482 1 1 13 LEU O O 2.945 -1.636 0.959 1.00 . A A . 13 LEU O 1 1 20 8483 1 1 14 LEU C C 3.088 -1.495 -2.171 1.00 . A A . 14 LEU C 1 1 20 8484 1 1 14 LEU CA C 2.163 -2.514 -1.488 1.00 . A A . 14 LEU CA 1 1 20 8485 1 1 14 LEU CB C 1.201 -3.135 -2.507 1.00 . A A . 14 LEU CB 1 1 20 8486 1 1 14 LEU CD1 C 2.010 -5.501 -2.410 1.00 . A A . 14 LEU CD1 1 1 20 8487 1 1 14 LEU CD2 C 1.127 -4.568 -4.552 1.00 . A A . 14 LEU CD2 1 1 20 8488 1 1 14 LEU CG C 1.916 -4.246 -3.280 1.00 . A A . 14 LEU CG 1 1 20 8489 1 1 14 LEU H H 0.338 -1.687 -0.684 1.00 . A A . 14 LEU H 1 1 20 8490 1 1 14 LEU HA H 2.746 -3.283 -1.016 1.00 . A A . 14 LEU HA 1 1 20 8491 1 1 14 LEU HB2 H 0.346 -3.547 -1.990 1.00 . A A . 14 LEU HB2 1 1 20 8492 1 1 14 LEU HB3 H 0.871 -2.374 -3.197 1.00 . A A . 14 LEU HB3 1 1 20 8493 1 1 14 LEU HD11 H 2.546 -6.271 -2.945 1.00 . A A . 14 LEU HD11 1 1 20 8494 1 1 14 LEU HD12 H 1.017 -5.852 -2.173 1.00 . A A . 14 LEU HD12 1 1 20 8495 1 1 14 LEU HD13 H 2.536 -5.266 -1.495 1.00 . A A . 14 LEU HD13 1 1 20 8496 1 1 14 LEU HD21 H 1.024 -3.673 -5.149 1.00 . A A . 14 LEU HD21 1 1 20 8497 1 1 14 LEU HD22 H 0.148 -4.939 -4.285 1.00 . A A . 14 LEU HD22 1 1 20 8498 1 1 14 LEU HD23 H 1.653 -5.320 -5.121 1.00 . A A . 14 LEU HD23 1 1 20 8499 1 1 14 LEU HG H 2.911 -3.918 -3.546 1.00 . A A . 14 LEU HG 1 1 20 8500 1 1 14 LEU N N 1.285 -1.844 -0.478 1.00 . A A . 14 LEU N 1 1 20 8501 1 1 14 LEU O O 4.098 -1.855 -2.742 1.00 . A A . 14 LEU O 1 1 20 8502 1 1 15 VAL C C 4.385 1.568 -1.671 1.00 . A A . 15 VAL C 1 1 20 8503 1 1 15 VAL CA C 3.609 0.810 -2.756 1.00 . A A . 15 VAL CA 1 1 20 8504 1 1 15 VAL CB C 2.633 1.743 -3.491 1.00 . A A . 15 VAL CB 1 1 20 8505 1 1 15 VAL CG1 C 3.397 2.936 -4.074 1.00 . A A . 15 VAL CG1 1 1 20 8506 1 1 15 VAL CG2 C 1.950 0.977 -4.628 1.00 . A A . 15 VAL CG2 1 1 20 8507 1 1 15 VAL H H 1.932 0.032 -1.650 1.00 . A A . 15 VAL H 1 1 20 8508 1 1 15 VAL HA H 4.290 0.358 -3.460 1.00 . A A . 15 VAL HA 1 1 20 8509 1 1 15 VAL HB H 1.887 2.100 -2.796 1.00 . A A . 15 VAL HB 1 1 20 8510 1 1 15 VAL HG11 H 2.829 3.367 -4.884 1.00 . A A . 15 VAL HG11 1 1 20 8511 1 1 15 VAL HG12 H 4.356 2.604 -4.443 1.00 . A A . 15 VAL HG12 1 1 20 8512 1 1 15 VAL HG13 H 3.546 3.679 -3.305 1.00 . A A . 15 VAL HG13 1 1 20 8513 1 1 15 VAL HG21 H 2.629 0.892 -5.465 1.00 . A A . 15 VAL HG21 1 1 20 8514 1 1 15 VAL HG22 H 1.063 1.510 -4.939 1.00 . A A . 15 VAL HG22 1 1 20 8515 1 1 15 VAL HG23 H 1.675 -0.009 -4.286 1.00 . A A . 15 VAL HG23 1 1 20 8516 1 1 15 VAL N N 2.750 -0.232 -2.116 1.00 . A A . 15 VAL N 1 1 20 8517 1 1 15 VAL O O 5.600 1.541 -1.635 1.00 . A A . 15 VAL O 1 1 20 8518 1 1 16 PHE C C 5.079 1.995 1.263 1.00 . A A . 16 PHE C 1 1 20 8519 1 1 16 PHE CA C 4.373 2.976 0.317 1.00 . A A . 16 PHE CA 1 1 20 8520 1 1 16 PHE CB C 3.258 3.726 1.051 1.00 . A A . 16 PHE CB 1 1 20 8521 1 1 16 PHE CD1 C 4.301 6.009 1.313 1.00 . A A . 16 PHE CD1 1 1 20 8522 1 1 16 PHE CD2 C 3.964 4.646 3.290 1.00 . A A . 16 PHE CD2 1 1 20 8523 1 1 16 PHE CE1 C 4.853 7.022 2.105 1.00 . A A . 16 PHE CE1 1 1 20 8524 1 1 16 PHE CE2 C 4.516 5.660 4.082 1.00 . A A . 16 PHE CE2 1 1 20 8525 1 1 16 PHE CG C 3.857 4.820 1.905 1.00 . A A . 16 PHE CG 1 1 20 8526 1 1 16 PHE CZ C 4.961 6.848 3.490 1.00 . A A . 16 PHE CZ 1 1 20 8527 1 1 16 PHE H H 2.706 2.221 -0.824 1.00 . A A . 16 PHE H 1 1 20 8528 1 1 16 PHE HA H 5.082 3.678 -0.094 1.00 . A A . 16 PHE HA 1 1 20 8529 1 1 16 PHE HB2 H 2.583 4.163 0.330 1.00 . A A . 16 PHE HB2 1 1 20 8530 1 1 16 PHE HB3 H 2.715 3.037 1.680 1.00 . A A . 16 PHE HB3 1 1 20 8531 1 1 16 PHE HD1 H 4.218 6.143 0.244 1.00 . A A . 16 PHE HD1 1 1 20 8532 1 1 16 PHE HD2 H 3.622 3.729 3.748 1.00 . A A . 16 PHE HD2 1 1 20 8533 1 1 16 PHE HE1 H 5.196 7.939 1.647 1.00 . A A . 16 PHE HE1 1 1 20 8534 1 1 16 PHE HE2 H 4.599 5.526 5.150 1.00 . A A . 16 PHE HE2 1 1 20 8535 1 1 16 PHE HZ H 5.387 7.630 4.101 1.00 . A A . 16 PHE HZ 1 1 20 8536 1 1 16 PHE N N 3.686 2.227 -0.779 1.00 . A A . 16 PHE N 1 1 20 8537 1 1 16 PHE O O 6.156 2.269 1.756 1.00 . A A . 16 PHE O 1 1 20 8538 1 1 17 GLY C C 6.420 -0.651 1.765 1.00 . A A . 17 GLY C 1 1 20 8539 1 1 17 GLY CA C 5.128 -0.154 2.413 1.00 . A A . 17 GLY CA 1 1 20 8540 1 1 17 GLY H H 3.620 0.643 1.094 1.00 . A A . 17 GLY H 1 1 20 8541 1 1 17 GLY HA2 H 5.354 0.309 3.363 1.00 . A A . 17 GLY HA2 1 1 20 8542 1 1 17 GLY HA3 H 4.461 -0.987 2.565 1.00 . A A . 17 GLY HA3 1 1 20 8543 1 1 17 GLY N N 4.485 0.848 1.510 1.00 . A A . 17 GLY N 1 1 20 8544 1 1 17 GLY O O 7.443 -0.755 2.413 1.00 . A A . 17 GLY O 1 1 20 8545 1 1 18 GLU C C 8.706 -0.350 -0.141 1.00 . A A . 18 GLU C 1 1 20 8546 1 1 18 GLU CA C 7.614 -1.420 -0.213 1.00 . A A . 18 GLU CA 1 1 20 8547 1 1 18 GLU CB C 7.190 -1.665 -1.663 1.00 . A A . 18 GLU CB 1 1 20 8548 1 1 18 GLU CD C 7.774 -4.080 -1.946 1.00 . A A . 18 GLU CD 1 1 20 8549 1 1 18 GLU CG C 6.625 -3.081 -1.799 1.00 . A A . 18 GLU CG 1 1 20 8550 1 1 18 GLU H H 5.545 -0.840 -0.013 1.00 . A A . 18 GLU H 1 1 20 8551 1 1 18 GLU HA H 7.963 -2.333 0.231 1.00 . A A . 18 GLU HA 1 1 20 8552 1 1 18 GLU HB2 H 6.435 -0.946 -1.946 1.00 . A A . 18 GLU HB2 1 1 20 8553 1 1 18 GLU HB3 H 8.048 -1.558 -2.312 1.00 . A A . 18 GLU HB3 1 1 20 8554 1 1 18 GLU HG2 H 6.045 -3.324 -0.920 1.00 . A A . 18 GLU HG2 1 1 20 8555 1 1 18 GLU HG3 H 5.992 -3.133 -2.672 1.00 . A A . 18 GLU HG3 1 1 20 8556 1 1 18 GLU N N 6.382 -0.943 0.487 1.00 . A A . 18 GLU N 1 1 20 8557 1 1 18 GLU O O 9.871 -0.656 0.004 1.00 . A A . 18 GLU O 1 1 20 8558 1 1 18 GLU OE1 O 8.322 -4.167 -3.033 1.00 . A A . 18 GLU OE1 1 1 20 8559 1 1 18 GLU OE2 O 8.088 -4.741 -0.970 1.00 . A A . 18 GLU OE2 1 1 20 8560 1 1 19 ASN C C 10.037 1.967 1.227 1.00 . A A . 19 ASN C 1 1 20 8561 1 1 19 ASN CA C 9.343 2.001 -0.139 1.00 . A A . 19 ASN CA 1 1 20 8562 1 1 19 ASN CB C 8.551 3.303 -0.303 1.00 . A A . 19 ASN CB 1 1 20 8563 1 1 19 ASN CG C 8.525 3.707 -1.778 1.00 . A A . 19 ASN CG 1 1 20 8564 1 1 19 ASN H H 7.381 1.117 -0.326 1.00 . A A . 19 ASN H 1 1 20 8565 1 1 19 ASN HA H 10.066 1.906 -0.928 1.00 . A A . 19 ASN HA 1 1 20 8566 1 1 19 ASN HB2 H 7.540 3.156 0.049 1.00 . A A . 19 ASN HB2 1 1 20 8567 1 1 19 ASN HB3 H 9.021 4.085 0.274 1.00 . A A . 19 ASN HB3 1 1 20 8568 1 1 19 ASN HD21 H 6.743 2.898 -2.117 1.00 . A A . 19 ASN HD21 1 1 20 8569 1 1 19 ASN HD22 H 7.470 3.644 -3.457 1.00 . A A . 19 ASN HD22 1 1 20 8570 1 1 19 ASN N N 8.330 0.902 -0.223 1.00 . A A . 19 ASN N 1 1 20 8571 1 1 19 ASN ND2 N 7.495 3.391 -2.512 1.00 . A A . 19 ASN ND2 1 1 20 8572 1 1 19 ASN O O 11.217 2.239 1.343 1.00 . A A . 19 ASN O 1 1 20 8573 1 1 19 ASN OD1 O 9.454 4.319 -2.268 1.00 . A A . 19 ASN OD1 1 1 20 8574 1 1 20 GLY C C 10.626 0.222 3.805 1.00 . A A . 20 GLY C 1 1 20 8575 1 1 20 GLY CA C 9.902 1.560 3.624 1.00 . A A . 20 GLY CA 1 1 20 8576 1 1 20 GLY H H 8.360 1.408 2.128 1.00 . A A . 20 GLY H 1 1 20 8577 1 1 20 GLY HA2 H 10.604 2.371 3.749 1.00 . A A . 20 GLY HA2 1 1 20 8578 1 1 20 GLY HA3 H 9.119 1.643 4.363 1.00 . A A . 20 GLY HA3 1 1 20 8579 1 1 20 GLY N N 9.305 1.627 2.258 1.00 . A A . 20 GLY N 1 1 20 8580 1 1 20 GLY O O 11.711 0.170 4.354 1.00 . A A . 20 GLY O 1 1 20 8581 1 1 21 VAL C C 11.977 -2.270 2.644 1.00 . A A . 21 VAL C 1 1 20 8582 1 1 21 VAL CA C 10.700 -2.198 3.495 1.00 . A A . 21 VAL CA 1 1 20 8583 1 1 21 VAL CB C 9.662 -3.221 3.012 1.00 . A A . 21 VAL CB 1 1 20 8584 1 1 21 VAL CG1 C 10.292 -4.617 2.962 1.00 . A A . 21 VAL CG1 1 1 20 8585 1 1 21 VAL CG2 C 8.474 -3.242 3.979 1.00 . A A . 21 VAL CG2 1 1 20 8586 1 1 21 VAL H H 9.161 -0.792 2.905 1.00 . A A . 21 VAL H 1 1 20 8587 1 1 21 VAL HA H 10.936 -2.379 4.528 1.00 . A A . 21 VAL HA 1 1 20 8588 1 1 21 VAL HB H 9.320 -2.946 2.024 1.00 . A A . 21 VAL HB 1 1 20 8589 1 1 21 VAL HG11 H 9.513 -5.360 2.867 1.00 . A A . 21 VAL HG11 1 1 20 8590 1 1 21 VAL HG12 H 10.851 -4.793 3.869 1.00 . A A . 21 VAL HG12 1 1 20 8591 1 1 21 VAL HG13 H 10.955 -4.682 2.111 1.00 . A A . 21 VAL HG13 1 1 20 8592 1 1 21 VAL HG21 H 8.775 -3.701 4.909 1.00 . A A . 21 VAL HG21 1 1 20 8593 1 1 21 VAL HG22 H 7.666 -3.811 3.542 1.00 . A A . 21 VAL HG22 1 1 20 8594 1 1 21 VAL HG23 H 8.143 -2.232 4.166 1.00 . A A . 21 VAL HG23 1 1 20 8595 1 1 21 VAL N N 10.039 -0.859 3.347 1.00 . A A . 21 VAL N 1 1 20 8596 1 1 21 VAL O O 12.904 -2.987 2.970 1.00 . A A . 21 VAL O 1 1 20 8597 1 1 22 PHE C C 14.504 -1.184 1.475 1.00 . A A . 22 PHE C 1 1 20 8598 1 1 22 PHE CA C 13.243 -1.553 0.680 1.00 . A A . 22 PHE CA 1 1 20 8599 1 1 22 PHE CB C 12.972 -0.505 -0.405 1.00 . A A . 22 PHE CB 1 1 20 8600 1 1 22 PHE CD1 C 15.191 -0.331 -1.593 1.00 . A A . 22 PHE CD1 1 1 20 8601 1 1 22 PHE CD2 C 13.352 -1.446 -2.714 1.00 . A A . 22 PHE CD2 1 1 20 8602 1 1 22 PHE CE1 C 16.012 -0.573 -2.701 1.00 . A A . 22 PHE CE1 1 1 20 8603 1 1 22 PHE CE2 C 14.175 -1.688 -3.821 1.00 . A A . 22 PHE CE2 1 1 20 8604 1 1 22 PHE CG C 13.860 -0.767 -1.599 1.00 . A A . 22 PHE CG 1 1 20 8605 1 1 22 PHE CZ C 15.504 -1.251 -3.814 1.00 . A A . 22 PHE CZ 1 1 20 8606 1 1 22 PHE H H 11.266 -0.969 1.324 1.00 . A A . 22 PHE H 1 1 20 8607 1 1 22 PHE HA H 13.360 -2.522 0.232 1.00 . A A . 22 PHE HA 1 1 20 8608 1 1 22 PHE HB2 H 11.938 -0.562 -0.709 1.00 . A A . 22 PHE HB2 1 1 20 8609 1 1 22 PHE HB3 H 13.179 0.480 -0.015 1.00 . A A . 22 PHE HB3 1 1 20 8610 1 1 22 PHE HD1 H 15.583 0.193 -0.733 1.00 . A A . 22 PHE HD1 1 1 20 8611 1 1 22 PHE HD2 H 12.326 -1.783 -2.719 1.00 . A A . 22 PHE HD2 1 1 20 8612 1 1 22 PHE HE1 H 17.038 -0.235 -2.695 1.00 . A A . 22 PHE HE1 1 1 20 8613 1 1 22 PHE HE2 H 13.782 -2.213 -4.680 1.00 . A A . 22 PHE HE2 1 1 20 8614 1 1 22 PHE HZ H 16.138 -1.438 -4.669 1.00 . A A . 22 PHE HZ 1 1 20 8615 1 1 22 PHE N N 12.028 -1.534 1.561 1.00 . A A . 22 PHE N 1 1 20 8616 1 1 22 PHE O O 15.580 -1.685 1.210 1.00 . A A . 22 PHE O 1 1 20 8617 1 1 23 PHE C C 15.371 -0.321 4.721 1.00 . A A . 23 PHE C 1 1 20 8618 1 1 23 PHE CA C 15.566 0.089 3.258 1.00 . A A . 23 PHE CA 1 1 20 8619 1 1 23 PHE CB C 15.654 1.614 3.119 1.00 . A A . 23 PHE CB 1 1 20 8620 1 1 23 PHE CD1 C 17.478 1.782 1.380 1.00 . A A . 23 PHE CD1 1 1 20 8621 1 1 23 PHE CD2 C 15.237 2.503 0.795 1.00 . A A . 23 PHE CD2 1 1 20 8622 1 1 23 PHE CE1 C 17.921 2.117 0.095 1.00 . A A . 23 PHE CE1 1 1 20 8623 1 1 23 PHE CE2 C 15.681 2.837 -0.490 1.00 . A A . 23 PHE CE2 1 1 20 8624 1 1 23 PHE CG C 16.136 1.975 1.731 1.00 . A A . 23 PHE CG 1 1 20 8625 1 1 23 PHE CZ C 17.023 2.644 -0.840 1.00 . A A . 23 PHE CZ 1 1 20 8626 1 1 23 PHE H H 13.499 0.075 2.636 1.00 . A A . 23 PHE H 1 1 20 8627 1 1 23 PHE HA H 16.457 -0.364 2.864 1.00 . A A . 23 PHE HA 1 1 20 8628 1 1 23 PHE HB2 H 14.679 2.048 3.285 1.00 . A A . 23 PHE HB2 1 1 20 8629 1 1 23 PHE HB3 H 16.348 2.002 3.850 1.00 . A A . 23 PHE HB3 1 1 20 8630 1 1 23 PHE HD1 H 18.171 1.376 2.101 1.00 . A A . 23 PHE HD1 1 1 20 8631 1 1 23 PHE HD2 H 14.202 2.652 1.064 1.00 . A A . 23 PHE HD2 1 1 20 8632 1 1 23 PHE HE1 H 18.956 1.968 -0.175 1.00 . A A . 23 PHE HE1 1 1 20 8633 1 1 23 PHE HE2 H 14.988 3.244 -1.212 1.00 . A A . 23 PHE HE2 1 1 20 8634 1 1 23 PHE HZ H 17.365 2.902 -1.831 1.00 . A A . 23 PHE HZ 1 1 20 8635 1 1 23 PHE N N 14.377 -0.313 2.444 1.00 . A A . 23 PHE N 1 1 20 8636 1 1 23 PHE O O 15.957 -1.283 5.182 1.00 . A A . 23 PHE O 1 1 20 8637 1 1 24 TYR C C 15.618 -0.070 7.664 1.00 . A A . 24 TYR C 1 1 20 8638 1 1 24 TYR CA C 14.295 0.069 6.893 1.00 . A A . 24 TYR CA 1 1 20 8639 1 1 24 TYR CB C 13.529 -1.257 6.868 1.00 . A A . 24 TYR CB 1 1 20 8640 1 1 24 TYR CD1 C 11.230 -0.745 7.772 1.00 . A A . 24 TYR CD1 1 1 20 8641 1 1 24 TYR CD2 C 12.844 -1.820 9.229 1.00 . A A . 24 TYR CD2 1 1 20 8642 1 1 24 TYR CE1 C 10.287 -0.760 8.806 1.00 . A A . 24 TYR CE1 1 1 20 8643 1 1 24 TYR CE2 C 11.900 -1.835 10.263 1.00 . A A . 24 TYR CE2 1 1 20 8644 1 1 24 TYR CG C 12.509 -1.275 7.984 1.00 . A A . 24 TYR CG 1 1 20 8645 1 1 24 TYR CZ C 10.622 -1.306 10.051 1.00 . A A . 24 TYR CZ 1 1 20 8646 1 1 24 TYR H H 14.094 1.163 5.043 1.00 . A A . 24 TYR H 1 1 20 8647 1 1 24 TYR HA H 13.683 0.834 7.344 1.00 . A A . 24 TYR HA 1 1 20 8648 1 1 24 TYR HB2 H 13.027 -1.362 5.919 1.00 . A A . 24 TYR HB2 1 1 20 8649 1 1 24 TYR HB3 H 14.221 -2.077 7.000 1.00 . A A . 24 TYR HB3 1 1 20 8650 1 1 24 TYR HD1 H 10.972 -0.324 6.811 1.00 . A A . 24 TYR HD1 1 1 20 8651 1 1 24 TYR HD2 H 13.830 -2.229 9.393 1.00 . A A . 24 TYR HD2 1 1 20 8652 1 1 24 TYR HE1 H 9.301 -0.352 8.644 1.00 . A A . 24 TYR HE1 1 1 20 8653 1 1 24 TYR HE2 H 12.159 -2.256 11.224 1.00 . A A . 24 TYR HE2 1 1 20 8654 1 1 24 TYR HH H 9.236 -2.166 11.044 1.00 . A A . 24 TYR HH 1 1 20 8655 1 1 24 TYR N N 14.549 0.399 5.449 1.00 . A A . 24 TYR N 1 1 20 8656 1 1 24 TYR O O 15.834 -1.039 8.369 1.00 . A A . 24 TYR O 1 1 20 8657 1 1 24 TYR OH O 9.692 -1.320 11.071 1.00 . A A . 24 TYR OH 1 1 20 8658 1 1 25 LYS C C 18.735 -0.208 7.634 1.00 . A A . 25 LYS C 1 1 20 8659 1 1 25 LYS CA C 17.822 0.878 8.230 1.00 . A A . 25 LYS CA 1 1 20 8660 1 1 25 LYS CB C 17.513 0.596 9.709 1.00 . A A . 25 LYS CB 1 1 20 8661 1 1 25 LYS CD C 18.393 0.764 12.044 1.00 . A A . 25 LYS CD 1 1 20 8662 1 1 25 LYS CE C 19.738 0.516 12.737 1.00 . A A . 25 LYS CE 1 1 20 8663 1 1 25 LYS CG C 18.633 1.162 10.584 1.00 . A A . 25 LYS CG 1 1 20 8664 1 1 25 LYS H H 16.275 1.663 6.949 1.00 . A A . 25 LYS H 1 1 20 8665 1 1 25 LYS HA H 18.299 1.842 8.140 1.00 . A A . 25 LYS HA 1 1 20 8666 1 1 25 LYS HB2 H 16.575 1.063 9.975 1.00 . A A . 25 LYS HB2 1 1 20 8667 1 1 25 LYS HB3 H 17.441 -0.470 9.866 1.00 . A A . 25 LYS HB3 1 1 20 8668 1 1 25 LYS HD2 H 17.865 1.558 12.551 1.00 . A A . 25 LYS HD2 1 1 20 8669 1 1 25 LYS HD3 H 17.803 -0.139 12.077 1.00 . A A . 25 LYS HD3 1 1 20 8670 1 1 25 LYS HE2 H 19.596 -0.094 13.619 1.00 . A A . 25 LYS HE2 1 1 20 8671 1 1 25 LYS HE3 H 20.430 0.041 12.058 1.00 . A A . 25 LYS HE3 1 1 20 8672 1 1 25 LYS HG2 H 19.583 0.768 10.251 1.00 . A A . 25 LYS HG2 1 1 20 8673 1 1 25 LYS HG3 H 18.642 2.239 10.504 1.00 . A A . 25 LYS HG3 1 1 20 8674 1 1 25 LYS HZ1 H 20.337 2.456 12.261 1.00 . A A . 25 LYS HZ1 1 1 20 8675 1 1 25 LYS HZ2 H 21.169 1.777 13.578 1.00 . A A . 25 LYS HZ2 1 1 20 8676 1 1 25 LYS HZ3 H 19.571 2.321 13.770 1.00 . A A . 25 LYS HZ3 1 1 20 8677 1 1 25 LYS N N 16.494 0.903 7.527 1.00 . A A . 25 LYS N 1 1 20 8678 1 1 25 LYS NZ N 20.241 1.870 13.115 1.00 . A A . 25 LYS NZ 1 1 20 8679 1 1 25 LYS O O 19.644 0.155 6.906 1.00 . A A . 25 LYS O 1 1 20 8680 1 1 25 LYS OXT O 18.513 -1.377 7.909 1.00 . A A . 25 LYS OXT 1 1 21 8681 1 1 1 HIS C C -19.849 -2.333 -5.844 1.00 . A A . 1 HIS C 1 1 21 8682 1 1 1 HIS CA C -21.315 -2.788 -5.808 1.00 . A A . 1 HIS CA 1 1 21 8683 1 1 1 HIS CB C -21.904 -2.818 -7.223 1.00 . A A . 1 HIS CB 1 1 21 8684 1 1 1 HIS CD2 C -21.921 -5.322 -8.024 1.00 . A A . 1 HIS CD2 1 1 21 8685 1 1 1 HIS CE1 C -20.106 -5.287 -9.206 1.00 . A A . 1 HIS CE1 1 1 21 8686 1 1 1 HIS CG C -21.418 -4.047 -7.943 1.00 . A A . 1 HIS CG 1 1 21 8687 1 1 1 HIS HA H -21.395 -3.764 -5.356 1.00 . A A . 1 HIS HA 1 1 21 8688 1 1 1 HIS HB2 H -22.982 -2.839 -7.164 1.00 . A A . 1 HIS HB2 1 1 21 8689 1 1 1 HIS HB3 H -21.589 -1.938 -7.763 1.00 . A A . 1 HIS HB3 1 1 21 8690 1 1 1 HIS HD1 H -19.663 -3.284 -8.854 1.00 . A A . 1 HIS HD1 1 1 21 8691 1 1 1 HIS HD2 H -22.824 -5.666 -7.543 1.00 . A A . 1 HIS HD2 1 1 21 8692 1 1 1 HIS HE1 H -19.284 -5.585 -9.841 1.00 . A A . 1 HIS HE1 1 1 21 8693 1 1 1 HIS N N -22.148 -1.797 -5.059 1.00 . A A . 1 HIS N 1 1 21 8694 1 1 1 HIS ND1 N -20.260 -4.048 -8.706 1.00 . A A . 1 HIS ND1 1 1 21 8695 1 1 1 HIS NE2 N -21.090 -6.103 -8.822 1.00 . A A . 1 HIS NE2 1 1 21 8696 1 1 1 HIS O O -19.560 -1.155 -5.748 1.00 . A A . 1 HIS O 1 1 21 8697 1 1 2 ALA C C -16.980 -2.399 -4.679 1.00 . A A . 2 ALA C 1 1 21 8698 1 1 2 ALA CA C -17.467 -2.930 -6.036 1.00 . A A . 2 ALA CA 1 1 21 8699 1 1 2 ALA CB C -17.319 -1.860 -7.124 1.00 . A A . 2 ALA CB 1 1 21 8700 1 1 2 ALA H H -19.209 -4.205 -6.063 1.00 . A A . 2 ALA H 1 1 21 8701 1 1 2 ALA HA H -16.899 -3.805 -6.311 1.00 . A A . 2 ALA HA 1 1 21 8702 1 1 2 ALA HB1 H -18.099 -1.985 -7.862 1.00 . A A . 2 ALA HB1 1 1 21 8703 1 1 2 ALA HB2 H -16.354 -1.962 -7.601 1.00 . A A . 2 ALA HB2 1 1 21 8704 1 1 2 ALA HB3 H -17.398 -0.879 -6.680 1.00 . A A . 2 ALA HB3 1 1 21 8705 1 1 2 ALA N N -18.932 -3.267 -5.986 1.00 . A A . 2 ALA N 1 1 21 8706 1 1 2 ALA O O -17.463 -1.400 -4.178 1.00 . A A . 2 ALA O 1 1 21 8707 1 1 3 TRP C C -14.115 -1.965 -2.929 1.00 . A A . 3 TRP C 1 1 21 8708 1 1 3 TRP CA C -15.496 -2.609 -2.757 1.00 . A A . 3 TRP CA 1 1 21 8709 1 1 3 TRP CB C -15.402 -3.880 -1.907 1.00 . A A . 3 TRP CB 1 1 21 8710 1 1 3 TRP CD1 C -14.148 -4.074 0.282 1.00 . A A . 3 TRP CD1 1 1 21 8711 1 1 3 TRP CD2 C -15.795 -2.542 0.368 1.00 . A A . 3 TRP CD2 1 1 21 8712 1 1 3 TRP CE2 C -15.181 -2.553 1.643 1.00 . A A . 3 TRP CE2 1 1 21 8713 1 1 3 TRP CE3 C -16.870 -1.659 0.156 1.00 . A A . 3 TRP CE3 1 1 21 8714 1 1 3 TRP CG C -15.120 -3.519 -0.479 1.00 . A A . 3 TRP CG 1 1 21 8715 1 1 3 TRP CH2 C -16.686 -0.845 2.444 1.00 . A A . 3 TRP CH2 1 1 21 8716 1 1 3 TRP CZ2 C -15.617 -1.716 2.671 1.00 . A A . 3 TRP CZ2 1 1 21 8717 1 1 3 TRP CZ3 C -17.310 -0.816 1.190 1.00 . A A . 3 TRP CZ3 1 1 21 8718 1 1 3 TRP H H -15.647 -3.866 -4.503 1.00 . A A . 3 TRP H 1 1 21 8719 1 1 3 TRP HA H -16.181 -1.911 -2.302 1.00 . A A . 3 TRP HA 1 1 21 8720 1 1 3 TRP HB2 H -16.336 -4.418 -1.962 1.00 . A A . 3 TRP HB2 1 1 21 8721 1 1 3 TRP HB3 H -14.605 -4.504 -2.283 1.00 . A A . 3 TRP HB3 1 1 21 8722 1 1 3 TRP HD1 H -13.457 -4.839 -0.041 1.00 . A A . 3 TRP HD1 1 1 21 8723 1 1 3 TRP HE1 H -13.585 -3.729 2.283 1.00 . A A . 3 TRP HE1 1 1 21 8724 1 1 3 TRP HE3 H -17.358 -1.628 -0.805 1.00 . A A . 3 TRP HE3 1 1 21 8725 1 1 3 TRP HH2 H -17.030 -0.194 3.234 1.00 . A A . 3 TRP HH2 1 1 21 8726 1 1 3 TRP HZ2 H -15.134 -1.743 3.637 1.00 . A A . 3 TRP HZ2 1 1 21 8727 1 1 3 TRP HZ3 H -18.136 -0.142 1.016 1.00 . A A . 3 TRP HZ3 1 1 21 8728 1 1 3 TRP N N -16.022 -3.065 -4.080 1.00 . A A . 3 TRP N 1 1 21 8729 1 1 3 TRP NE1 N -14.184 -3.502 1.540 1.00 . A A . 3 TRP NE1 1 1 21 8730 1 1 3 TRP O O -13.151 -2.624 -3.268 1.00 . A A . 3 TRP O 1 1 21 8731 1 1 4 TYR C C -12.387 0.856 -1.591 1.00 . A A . 4 TYR C 1 1 21 8732 1 1 4 TYR CA C -12.698 0.013 -2.839 1.00 . A A . 4 TYR CA 1 1 21 8733 1 1 4 TYR CB C -12.851 0.906 -4.074 1.00 . A A . 4 TYR CB 1 1 21 8734 1 1 4 TYR CD1 C -11.332 -0.421 -5.590 1.00 . A A . 4 TYR CD1 1 1 21 8735 1 1 4 TYR CD2 C -10.755 1.880 -5.084 1.00 . A A . 4 TYR CD2 1 1 21 8736 1 1 4 TYR CE1 C -10.188 -0.532 -6.388 1.00 . A A . 4 TYR CE1 1 1 21 8737 1 1 4 TYR CE2 C -9.610 1.768 -5.883 1.00 . A A . 4 TYR CE2 1 1 21 8738 1 1 4 TYR CG C -11.616 0.786 -4.938 1.00 . A A . 4 TYR CG 1 1 21 8739 1 1 4 TYR CZ C -9.327 0.561 -6.534 1.00 . A A . 4 TYR CZ 1 1 21 8740 1 1 4 TYR H H -14.807 -0.170 -2.422 1.00 . A A . 4 TYR H 1 1 21 8741 1 1 4 TYR HA H -11.913 -0.708 -3.005 1.00 . A A . 4 TYR HA 1 1 21 8742 1 1 4 TYR HB2 H -13.717 0.596 -4.640 1.00 . A A . 4 TYR HB2 1 1 21 8743 1 1 4 TYR HB3 H -12.972 1.934 -3.764 1.00 . A A . 4 TYR HB3 1 1 21 8744 1 1 4 TYR HD1 H -11.997 -1.265 -5.477 1.00 . A A . 4 TYR HD1 1 1 21 8745 1 1 4 TYR HD2 H -10.973 2.812 -4.582 1.00 . A A . 4 TYR HD2 1 1 21 8746 1 1 4 TYR HE1 H -9.969 -1.463 -6.891 1.00 . A A . 4 TYR HE1 1 1 21 8747 1 1 4 TYR HE2 H -8.946 2.612 -5.996 1.00 . A A . 4 TYR HE2 1 1 21 8748 1 1 4 TYR HH H -7.525 -0.007 -6.812 1.00 . A A . 4 TYR HH 1 1 21 8749 1 1 4 TYR N N -14.015 -0.680 -2.695 1.00 . A A . 4 TYR N 1 1 21 8750 1 1 4 TYR O O -11.651 1.825 -1.657 1.00 . A A . 4 TYR O 1 1 21 8751 1 1 4 TYR OH O -8.198 0.451 -7.321 1.00 . A A . 4 TYR OH 1 1 21 8752 1 1 5 SER C C -11.492 0.625 1.563 1.00 . A A . 5 SER C 1 1 21 8753 1 1 5 SER CA C -12.656 1.263 0.797 1.00 . A A . 5 SER CA 1 1 21 8754 1 1 5 SER CB C -13.949 1.188 1.612 1.00 . A A . 5 SER CB 1 1 21 8755 1 1 5 SER H H -13.513 -0.298 -0.421 1.00 . A A . 5 SER H 1 1 21 8756 1 1 5 SER HA H -12.428 2.286 0.560 1.00 . A A . 5 SER HA 1 1 21 8757 1 1 5 SER HB2 H -14.259 0.162 1.705 1.00 . A A . 5 SER HB2 1 1 21 8758 1 1 5 SER HB3 H -13.775 1.600 2.598 1.00 . A A . 5 SER HB3 1 1 21 8759 1 1 5 SER HG H -15.493 2.374 1.614 1.00 . A A . 5 SER HG 1 1 21 8760 1 1 5 SER N N -12.931 0.489 -0.454 1.00 . A A . 5 SER N 1 1 21 8761 1 1 5 SER O O -10.722 1.306 2.212 1.00 . A A . 5 SER O 1 1 21 8762 1 1 5 SER OG O -14.967 1.926 0.947 1.00 . A A . 5 SER OG 1 1 21 8763 1 1 6 HIS C C -9.108 -1.676 1.193 1.00 . A A . 6 HIS C 1 1 21 8764 1 1 6 HIS CA C -10.239 -1.372 2.183 1.00 . A A . 6 HIS CA 1 1 21 8765 1 1 6 HIS CB C -10.850 -2.668 2.726 1.00 . A A . 6 HIS CB 1 1 21 8766 1 1 6 HIS CD2 C -9.098 -4.578 3.168 1.00 . A A . 6 HIS CD2 1 1 21 8767 1 1 6 HIS CE1 C -8.438 -3.955 5.134 1.00 . A A . 6 HIS CE1 1 1 21 8768 1 1 6 HIS CG C -9.805 -3.444 3.483 1.00 . A A . 6 HIS CG 1 1 21 8769 1 1 6 HIS H H -11.992 -1.191 0.940 1.00 . A A . 6 HIS H 1 1 21 8770 1 1 6 HIS HA H -9.871 -0.768 2.991 1.00 . A A . 6 HIS HA 1 1 21 8771 1 1 6 HIS HB2 H -11.669 -2.430 3.389 1.00 . A A . 6 HIS HB2 1 1 21 8772 1 1 6 HIS HB3 H -11.215 -3.266 1.904 1.00 . A A . 6 HIS HB3 1 1 21 8773 1 1 6 HIS HD1 H -9.675 -2.287 5.254 1.00 . A A . 6 HIS HD1 1 1 21 8774 1 1 6 HIS HD2 H -9.198 -5.138 2.249 1.00 . A A . 6 HIS HD2 1 1 21 8775 1 1 6 HIS HE1 H -7.920 -3.913 6.081 1.00 . A A . 6 HIS HE1 1 1 21 8776 1 1 6 HIS N N -11.359 -0.674 1.479 1.00 . A A . 6 HIS N 1 1 21 8777 1 1 6 HIS ND1 N -9.365 -3.063 4.742 1.00 . A A . 6 HIS ND1 1 1 21 8778 1 1 6 HIS NE2 N -8.236 -4.899 4.212 1.00 . A A . 6 HIS NE2 1 1 21 8779 1 1 6 HIS O O -7.953 -1.755 1.568 1.00 . A A . 6 HIS O 1 1 21 8780 1 1 7 TYR C C -7.366 -0.975 -1.135 1.00 . A A . 7 TYR C 1 1 21 8781 1 1 7 TYR CA C -8.377 -2.122 -1.091 1.00 . A A . 7 TYR CA 1 1 21 8782 1 1 7 TYR CB C -9.122 -2.237 -2.426 1.00 . A A . 7 TYR CB 1 1 21 8783 1 1 7 TYR CD1 C -10.935 -3.923 -1.946 1.00 . A A . 7 TYR CD1 1 1 21 8784 1 1 7 TYR CD2 C -9.044 -4.599 -3.305 1.00 . A A . 7 TYR CD2 1 1 21 8785 1 1 7 TYR CE1 C -11.486 -5.203 -2.073 1.00 . A A . 7 TYR CE1 1 1 21 8786 1 1 7 TYR CE2 C -9.595 -5.879 -3.431 1.00 . A A . 7 TYR CE2 1 1 21 8787 1 1 7 TYR CG C -9.714 -3.620 -2.561 1.00 . A A . 7 TYR CG 1 1 21 8788 1 1 7 TYR CZ C -10.816 -6.181 -2.815 1.00 . A A . 7 TYR CZ 1 1 21 8789 1 1 7 TYR H H -10.368 -1.759 -0.340 1.00 . A A . 7 TYR H 1 1 21 8790 1 1 7 TYR HA H -7.879 -3.047 -0.863 1.00 . A A . 7 TYR HA 1 1 21 8791 1 1 7 TYR HB2 H -9.912 -1.502 -2.462 1.00 . A A . 7 TYR HB2 1 1 21 8792 1 1 7 TYR HB3 H -8.432 -2.061 -3.238 1.00 . A A . 7 TYR HB3 1 1 21 8793 1 1 7 TYR HD1 H -11.454 -3.168 -1.373 1.00 . A A . 7 TYR HD1 1 1 21 8794 1 1 7 TYR HD2 H -8.102 -4.366 -3.779 1.00 . A A . 7 TYR HD2 1 1 21 8795 1 1 7 TYR HE1 H -12.426 -5.436 -1.598 1.00 . A A . 7 TYR HE1 1 1 21 8796 1 1 7 TYR HE2 H -9.079 -6.635 -4.004 1.00 . A A . 7 TYR HE2 1 1 21 8797 1 1 7 TYR HH H -10.997 -7.992 -2.243 1.00 . A A . 7 TYR HH 1 1 21 8798 1 1 7 TYR N N -9.432 -1.835 -0.067 1.00 . A A . 7 TYR N 1 1 21 8799 1 1 7 TYR O O -6.183 -1.189 -1.317 1.00 . A A . 7 TYR O 1 1 21 8800 1 1 7 TYR OH O -11.360 -7.441 -2.941 1.00 . A A . 7 TYR OH 1 1 21 8801 1 1 8 VAL C C -5.892 1.273 0.202 1.00 . A A . 8 VAL C 1 1 21 8802 1 1 8 VAL CA C -6.895 1.407 -0.953 1.00 . A A . 8 VAL CA 1 1 21 8803 1 1 8 VAL CB C -7.791 2.648 -0.786 1.00 . A A . 8 VAL CB 1 1 21 8804 1 1 8 VAL CG1 C -8.420 2.671 0.612 1.00 . A A . 8 VAL CG1 1 1 21 8805 1 1 8 VAL CG2 C -6.951 3.913 -0.983 1.00 . A A . 8 VAL CG2 1 1 21 8806 1 1 8 VAL H H -8.783 0.373 -0.788 1.00 . A A . 8 VAL H 1 1 21 8807 1 1 8 VAL HA H -6.371 1.456 -1.891 1.00 . A A . 8 VAL HA 1 1 21 8808 1 1 8 VAL HB H -8.577 2.622 -1.528 1.00 . A A . 8 VAL HB 1 1 21 8809 1 1 8 VAL HG11 H -9.175 3.443 0.653 1.00 . A A . 8 VAL HG11 1 1 21 8810 1 1 8 VAL HG12 H -7.657 2.874 1.348 1.00 . A A . 8 VAL HG12 1 1 21 8811 1 1 8 VAL HG13 H -8.874 1.714 0.819 1.00 . A A . 8 VAL HG13 1 1 21 8812 1 1 8 VAL HG21 H -7.595 4.780 -0.960 1.00 . A A . 8 VAL HG21 1 1 21 8813 1 1 8 VAL HG22 H -6.445 3.865 -1.934 1.00 . A A . 8 VAL HG22 1 1 21 8814 1 1 8 VAL HG23 H -6.221 3.986 -0.190 1.00 . A A . 8 VAL HG23 1 1 21 8815 1 1 8 VAL N N -7.826 0.238 -0.947 1.00 . A A . 8 VAL N 1 1 21 8816 1 1 8 VAL O O -4.743 1.659 0.086 1.00 . A A . 8 VAL O 1 1 21 8817 1 1 9 LEU C C -4.391 -0.598 2.141 1.00 . A A . 9 LEU C 1 1 21 8818 1 1 9 LEU CA C -5.401 0.509 2.468 1.00 . A A . 9 LEU CA 1 1 21 8819 1 1 9 LEU CB C -6.311 0.094 3.631 1.00 . A A . 9 LEU CB 1 1 21 8820 1 1 9 LEU CD1 C -5.968 0.562 6.068 1.00 . A A . 9 LEU CD1 1 1 21 8821 1 1 9 LEU CD2 C -5.582 -1.737 5.173 1.00 . A A . 9 LEU CD2 1 1 21 8822 1 1 9 LEU CG C -5.465 -0.241 4.865 1.00 . A A . 9 LEU CG 1 1 21 8823 1 1 9 LEU H H -7.246 0.385 1.358 1.00 . A A . 9 LEU H 1 1 21 8824 1 1 9 LEU HA H -4.892 1.429 2.704 1.00 . A A . 9 LEU HA 1 1 21 8825 1 1 9 LEU HB2 H -6.984 0.906 3.866 1.00 . A A . 9 LEU HB2 1 1 21 8826 1 1 9 LEU HB3 H -6.885 -0.774 3.346 1.00 . A A . 9 LEU HB3 1 1 21 8827 1 1 9 LEU HD11 H -5.971 1.614 5.823 1.00 . A A . 9 LEU HD11 1 1 21 8828 1 1 9 LEU HD12 H -5.319 0.390 6.913 1.00 . A A . 9 LEU HD12 1 1 21 8829 1 1 9 LEU HD13 H -6.972 0.248 6.316 1.00 . A A . 9 LEU HD13 1 1 21 8830 1 1 9 LEU HD21 H -4.985 -1.974 6.041 1.00 . A A . 9 LEU HD21 1 1 21 8831 1 1 9 LEU HD22 H -5.227 -2.306 4.326 1.00 . A A . 9 LEU HD22 1 1 21 8832 1 1 9 LEU HD23 H -6.615 -1.985 5.367 1.00 . A A . 9 LEU HD23 1 1 21 8833 1 1 9 LEU HG H -4.432 0.011 4.674 1.00 . A A . 9 LEU HG 1 1 21 8834 1 1 9 LEU N N -6.319 0.703 1.304 1.00 . A A . 9 LEU N 1 1 21 8835 1 1 9 LEU O O -3.212 -0.474 2.417 1.00 . A A . 9 LEU O 1 1 21 8836 1 1 10 LYS C C -2.956 -2.334 0.072 1.00 . A A . 10 LYS C 1 1 21 8837 1 1 10 LYS CA C -3.912 -2.789 1.181 1.00 . A A . 10 LYS CA 1 1 21 8838 1 1 10 LYS CB C -4.811 -3.926 0.684 1.00 . A A . 10 LYS CB 1 1 21 8839 1 1 10 LYS CD C -4.995 -6.273 1.540 1.00 . A A . 10 LYS CD 1 1 21 8840 1 1 10 LYS CE C -3.720 -6.749 2.246 1.00 . A A . 10 LYS CE 1 1 21 8841 1 1 10 LYS CG C -5.246 -4.797 1.868 1.00 . A A . 10 LYS CG 1 1 21 8842 1 1 10 LYS H H -5.799 -1.747 1.321 1.00 . A A . 10 LYS H 1 1 21 8843 1 1 10 LYS HA H -3.355 -3.110 2.048 1.00 . A A . 10 LYS HA 1 1 21 8844 1 1 10 LYS HB2 H -5.685 -3.510 0.203 1.00 . A A . 10 LYS HB2 1 1 21 8845 1 1 10 LYS HB3 H -4.266 -4.531 -0.024 1.00 . A A . 10 LYS HB3 1 1 21 8846 1 1 10 LYS HD2 H -5.835 -6.863 1.879 1.00 . A A . 10 LYS HD2 1 1 21 8847 1 1 10 LYS HD3 H -4.879 -6.391 0.474 1.00 . A A . 10 LYS HD3 1 1 21 8848 1 1 10 LYS HE2 H -3.003 -5.941 2.309 1.00 . A A . 10 LYS HE2 1 1 21 8849 1 1 10 LYS HE3 H -3.953 -7.124 3.231 1.00 . A A . 10 LYS HE3 1 1 21 8850 1 1 10 LYS HG2 H -4.680 -4.520 2.746 1.00 . A A . 10 LYS HG2 1 1 21 8851 1 1 10 LYS HG3 H -6.298 -4.648 2.057 1.00 . A A . 10 LYS HG3 1 1 21 8852 1 1 10 LYS HZ1 H -2.456 -8.374 1.917 1.00 . A A . 10 LYS HZ1 1 1 21 8853 1 1 10 LYS HZ2 H -2.776 -7.451 0.526 1.00 . A A . 10 LYS HZ2 1 1 21 8854 1 1 10 LYS HZ3 H -3.960 -8.505 1.142 1.00 . A A . 10 LYS HZ3 1 1 21 8855 1 1 10 LYS N N -4.845 -1.676 1.541 1.00 . A A . 10 LYS N 1 1 21 8856 1 1 10 LYS NZ N -3.188 -7.853 1.393 1.00 . A A . 10 LYS NZ 1 1 21 8857 1 1 10 LYS O O -1.788 -2.676 0.073 1.00 . A A . 10 LYS O 1 1 21 8858 1 1 11 PHE C C -1.459 -0.173 -1.412 1.00 . A A . 11 PHE C 1 1 21 8859 1 1 11 PHE CA C -2.569 -1.068 -1.976 1.00 . A A . 11 PHE CA 1 1 21 8860 1 1 11 PHE CB C -3.497 -0.264 -2.895 1.00 . A A . 11 PHE CB 1 1 21 8861 1 1 11 PHE CD1 C -3.016 -1.172 -5.198 1.00 . A A . 11 PHE CD1 1 1 21 8862 1 1 11 PHE CD2 C -2.156 1.016 -4.605 1.00 . A A . 11 PHE CD2 1 1 21 8863 1 1 11 PHE CE1 C -2.440 -1.053 -6.469 1.00 . A A . 11 PHE CE1 1 1 21 8864 1 1 11 PHE CE2 C -1.581 1.135 -5.875 1.00 . A A . 11 PHE CE2 1 1 21 8865 1 1 11 PHE CG C -2.874 -0.138 -4.266 1.00 . A A . 11 PHE CG 1 1 21 8866 1 1 11 PHE CZ C -1.723 0.100 -6.808 1.00 . A A . 11 PHE CZ 1 1 21 8867 1 1 11 PHE H H -4.390 -1.295 -0.840 1.00 . A A . 11 PHE H 1 1 21 8868 1 1 11 PHE HA H -2.143 -1.900 -2.516 1.00 . A A . 11 PHE HA 1 1 21 8869 1 1 11 PHE HB2 H -4.447 -0.772 -2.978 1.00 . A A . 11 PHE HB2 1 1 21 8870 1 1 11 PHE HB3 H -3.650 0.720 -2.477 1.00 . A A . 11 PHE HB3 1 1 21 8871 1 1 11 PHE HD1 H -3.570 -2.062 -4.937 1.00 . A A . 11 PHE HD1 1 1 21 8872 1 1 11 PHE HD2 H -2.046 1.815 -3.884 1.00 . A A . 11 PHE HD2 1 1 21 8873 1 1 11 PHE HE1 H -2.550 -1.852 -7.188 1.00 . A A . 11 PHE HE1 1 1 21 8874 1 1 11 PHE HE2 H -1.028 2.025 -6.136 1.00 . A A . 11 PHE HE2 1 1 21 8875 1 1 11 PHE HZ H -1.278 0.192 -7.787 1.00 . A A . 11 PHE HZ 1 1 21 8876 1 1 11 PHE N N -3.445 -1.560 -0.868 1.00 . A A . 11 PHE N 1 1 21 8877 1 1 11 PHE O O -0.319 -0.253 -1.829 1.00 . A A . 11 PHE O 1 1 21 8878 1 1 12 PHE C C 0.291 0.711 0.901 1.00 . A A . 12 PHE C 1 1 21 8879 1 1 12 PHE CA C -0.741 1.558 0.147 1.00 . A A . 12 PHE CA 1 1 21 8880 1 1 12 PHE CB C -1.492 2.481 1.112 1.00 . A A . 12 PHE CB 1 1 21 8881 1 1 12 PHE CD1 C -0.127 4.591 0.905 1.00 . A A . 12 PHE CD1 1 1 21 8882 1 1 12 PHE CD2 C -2.379 4.567 0.008 1.00 . A A . 12 PHE CD2 1 1 21 8883 1 1 12 PHE CE1 C 0.025 5.919 0.489 1.00 . A A . 12 PHE CE1 1 1 21 8884 1 1 12 PHE CE2 C -2.228 5.895 -0.408 1.00 . A A . 12 PHE CE2 1 1 21 8885 1 1 12 PHE CG C -1.329 3.915 0.665 1.00 . A A . 12 PHE CG 1 1 21 8886 1 1 12 PHE CZ C -1.025 6.571 -0.167 1.00 . A A . 12 PHE CZ 1 1 21 8887 1 1 12 PHE H H -2.706 0.708 -0.130 1.00 . A A . 12 PHE H 1 1 21 8888 1 1 12 PHE HA H -0.256 2.141 -0.622 1.00 . A A . 12 PHE HA 1 1 21 8889 1 1 12 PHE HB2 H -2.540 2.223 1.119 1.00 . A A . 12 PHE HB2 1 1 21 8890 1 1 12 PHE HB3 H -1.087 2.368 2.108 1.00 . A A . 12 PHE HB3 1 1 21 8891 1 1 12 PHE HD1 H 0.684 4.088 1.412 1.00 . A A . 12 PHE HD1 1 1 21 8892 1 1 12 PHE HD2 H -3.308 4.045 -0.177 1.00 . A A . 12 PHE HD2 1 1 21 8893 1 1 12 PHE HE1 H 0.953 6.440 0.675 1.00 . A A . 12 PHE HE1 1 1 21 8894 1 1 12 PHE HE2 H -3.037 6.398 -0.915 1.00 . A A . 12 PHE HE2 1 1 21 8895 1 1 12 PHE HZ H -0.908 7.596 -0.488 1.00 . A A . 12 PHE HZ 1 1 21 8896 1 1 12 PHE N N -1.781 0.669 -0.455 1.00 . A A . 12 PHE N 1 1 21 8897 1 1 12 PHE O O 1.479 0.924 0.785 1.00 . A A . 12 PHE O 1 1 21 8898 1 1 13 LEU C C 1.739 -1.847 1.417 1.00 . A A . 13 LEU C 1 1 21 8899 1 1 13 LEU CA C 0.798 -1.137 2.405 1.00 . A A . 13 LEU CA 1 1 21 8900 1 1 13 LEU CB C -0.083 -2.156 3.138 1.00 . A A . 13 LEU CB 1 1 21 8901 1 1 13 LEU CD1 C -0.272 -2.952 5.502 1.00 . A A . 13 LEU CD1 1 1 21 8902 1 1 13 LEU CD2 C 1.286 -4.098 3.921 1.00 . A A . 13 LEU CD2 1 1 21 8903 1 1 13 LEU CG C 0.684 -2.749 4.323 1.00 . A A . 13 LEU CG 1 1 21 8904 1 1 13 LEU H H -1.124 -0.422 1.725 1.00 . A A . 13 LEU H 1 1 21 8905 1 1 13 LEU HA H 1.365 -0.557 3.114 1.00 . A A . 13 LEU HA 1 1 21 8906 1 1 13 LEU HB2 H -0.977 -1.664 3.496 1.00 . A A . 13 LEU HB2 1 1 21 8907 1 1 13 LEU HB3 H -0.358 -2.949 2.457 1.00 . A A . 13 LEU HB3 1 1 21 8908 1 1 13 LEU HD11 H -0.862 -2.058 5.644 1.00 . A A . 13 LEU HD11 1 1 21 8909 1 1 13 LEU HD12 H 0.297 -3.154 6.396 1.00 . A A . 13 LEU HD12 1 1 21 8910 1 1 13 LEU HD13 H -0.927 -3.785 5.295 1.00 . A A . 13 LEU HD13 1 1 21 8911 1 1 13 LEU HD21 H 0.498 -4.762 3.600 1.00 . A A . 13 LEU HD21 1 1 21 8912 1 1 13 LEU HD22 H 1.799 -4.531 4.767 1.00 . A A . 13 LEU HD22 1 1 21 8913 1 1 13 LEU HD23 H 1.986 -3.952 3.111 1.00 . A A . 13 LEU HD23 1 1 21 8914 1 1 13 LEU HG H 1.474 -2.072 4.617 1.00 . A A . 13 LEU HG 1 1 21 8915 1 1 13 LEU N N -0.158 -0.260 1.658 1.00 . A A . 13 LEU N 1 1 21 8916 1 1 13 LEU O O 2.881 -2.125 1.728 1.00 . A A . 13 LEU O 1 1 21 8917 1 1 14 LEU C C 3.025 -1.806 -1.496 1.00 . A A . 14 LEU C 1 1 21 8918 1 1 14 LEU CA C 2.113 -2.817 -0.790 1.00 . A A . 14 LEU CA 1 1 21 8919 1 1 14 LEU CB C 1.119 -3.428 -1.786 1.00 . A A . 14 LEU CB 1 1 21 8920 1 1 14 LEU CD1 C 0.718 -5.780 -2.536 1.00 . A A . 14 LEU CD1 1 1 21 8921 1 1 14 LEU CD2 C 2.194 -4.273 -3.876 1.00 . A A . 14 LEU CD2 1 1 21 8922 1 1 14 LEU CG C 1.747 -4.649 -2.462 1.00 . A A . 14 LEU CG 1 1 21 8923 1 1 14 LEU H H 0.336 -1.894 0.007 1.00 . A A . 14 LEU H 1 1 21 8924 1 1 14 LEU HA H 2.697 -3.594 -0.332 1.00 . A A . 14 LEU HA 1 1 21 8925 1 1 14 LEU HB2 H 0.221 -3.725 -1.262 1.00 . A A . 14 LEU HB2 1 1 21 8926 1 1 14 LEU HB3 H 0.867 -2.694 -2.537 1.00 . A A . 14 LEU HB3 1 1 21 8927 1 1 14 LEU HD11 H 0.301 -5.953 -1.554 1.00 . A A . 14 LEU HD11 1 1 21 8928 1 1 14 LEU HD12 H 1.199 -6.681 -2.887 1.00 . A A . 14 LEU HD12 1 1 21 8929 1 1 14 LEU HD13 H -0.071 -5.504 -3.219 1.00 . A A . 14 LEU HD13 1 1 21 8930 1 1 14 LEU HD21 H 2.776 -3.363 -3.841 1.00 . A A . 14 LEU HD21 1 1 21 8931 1 1 14 LEU HD22 H 1.324 -4.119 -4.500 1.00 . A A . 14 LEU HD22 1 1 21 8932 1 1 14 LEU HD23 H 2.795 -5.069 -4.289 1.00 . A A . 14 LEU HD23 1 1 21 8933 1 1 14 LEU HG H 2.602 -4.979 -1.888 1.00 . A A . 14 LEU HG 1 1 21 8934 1 1 14 LEU N N 1.261 -2.133 0.229 1.00 . A A . 14 LEU N 1 1 21 8935 1 1 14 LEU O O 4.219 -2.011 -1.617 1.00 . A A . 14 LEU O 1 1 21 8936 1 1 15 VAL C C 4.128 1.111 -1.680 1.00 . A A . 15 VAL C 1 1 21 8937 1 1 15 VAL CA C 3.277 0.314 -2.678 1.00 . A A . 15 VAL CA 1 1 21 8938 1 1 15 VAL CB C 2.254 1.224 -3.370 1.00 . A A . 15 VAL CB 1 1 21 8939 1 1 15 VAL CG1 C 2.967 2.416 -4.014 1.00 . A A . 15 VAL CG1 1 1 21 8940 1 1 15 VAL CG2 C 1.515 0.434 -4.453 1.00 . A A . 15 VAL CG2 1 1 21 8941 1 1 15 VAL H H 1.498 -0.594 -1.854 1.00 . A A . 15 VAL H 1 1 21 8942 1 1 15 VAL HA H 3.911 -0.151 -3.418 1.00 . A A . 15 VAL HA 1 1 21 8943 1 1 15 VAL HB H 1.543 1.585 -2.639 1.00 . A A . 15 VAL HB 1 1 21 8944 1 1 15 VAL HG11 H 3.913 2.091 -4.424 1.00 . A A . 15 VAL HG11 1 1 21 8945 1 1 15 VAL HG12 H 3.140 3.178 -3.269 1.00 . A A . 15 VAL HG12 1 1 21 8946 1 1 15 VAL HG13 H 2.353 2.819 -4.806 1.00 . A A . 15 VAL HG13 1 1 21 8947 1 1 15 VAL HG21 H 1.528 -0.618 -4.205 1.00 . A A . 15 VAL HG21 1 1 21 8948 1 1 15 VAL HG22 H 2.003 0.585 -5.404 1.00 . A A . 15 VAL HG22 1 1 21 8949 1 1 15 VAL HG23 H 0.494 0.776 -4.515 1.00 . A A . 15 VAL HG23 1 1 21 8950 1 1 15 VAL N N 2.463 -0.723 -1.965 1.00 . A A . 15 VAL N 1 1 21 8951 1 1 15 VAL O O 5.333 1.208 -1.823 1.00 . A A . 15 VAL O 1 1 21 8952 1 1 16 PHE C C 5.221 1.530 1.126 1.00 . A A . 16 PHE C 1 1 21 8953 1 1 16 PHE CA C 4.292 2.460 0.338 1.00 . A A . 16 PHE CA 1 1 21 8954 1 1 16 PHE CB C 3.251 3.098 1.262 1.00 . A A . 16 PHE CB 1 1 21 8955 1 1 16 PHE CD1 C 3.731 5.569 1.133 1.00 . A A . 16 PHE CD1 1 1 21 8956 1 1 16 PHE CD2 C 4.426 4.346 3.108 1.00 . A A . 16 PHE CD2 1 1 21 8957 1 1 16 PHE CE1 C 4.258 6.746 1.676 1.00 . A A . 16 PHE CE1 1 1 21 8958 1 1 16 PHE CE2 C 4.952 5.523 3.651 1.00 . A A . 16 PHE CE2 1 1 21 8959 1 1 16 PHE CG C 3.814 4.369 1.850 1.00 . A A . 16 PHE CG 1 1 21 8960 1 1 16 PHE CZ C 4.868 6.724 2.935 1.00 . A A . 16 PHE CZ 1 1 21 8961 1 1 16 PHE H H 2.541 1.579 -0.571 1.00 . A A . 16 PHE H 1 1 21 8962 1 1 16 PHE HA H 4.865 3.231 -0.155 1.00 . A A . 16 PHE HA 1 1 21 8963 1 1 16 PHE HB2 H 2.358 3.325 0.697 1.00 . A A . 16 PHE HB2 1 1 21 8964 1 1 16 PHE HB3 H 3.007 2.410 2.058 1.00 . A A . 16 PHE HB3 1 1 21 8965 1 1 16 PHE HD1 H 3.259 5.586 0.162 1.00 . A A . 16 PHE HD1 1 1 21 8966 1 1 16 PHE HD2 H 4.491 3.421 3.661 1.00 . A A . 16 PHE HD2 1 1 21 8967 1 1 16 PHE HE1 H 4.192 7.672 1.123 1.00 . A A . 16 PHE HE1 1 1 21 8968 1 1 16 PHE HE2 H 5.425 5.507 4.623 1.00 . A A . 16 PHE HE2 1 1 21 8969 1 1 16 PHE HZ H 5.276 7.632 3.354 1.00 . A A . 16 PHE HZ 1 1 21 8970 1 1 16 PHE N N 3.513 1.676 -0.670 1.00 . A A . 16 PHE N 1 1 21 8971 1 1 16 PHE O O 6.288 1.932 1.549 1.00 . A A . 16 PHE O 1 1 21 8972 1 1 17 GLY C C 7.035 -0.818 1.325 1.00 . A A . 17 GLY C 1 1 21 8973 1 1 17 GLY CA C 5.701 -0.670 2.061 1.00 . A A . 17 GLY CA 1 1 21 8974 1 1 17 GLY H H 3.970 -0.014 0.957 1.00 . A A . 17 GLY H 1 1 21 8975 1 1 17 GLY HA2 H 5.877 -0.295 3.060 1.00 . A A . 17 GLY HA2 1 1 21 8976 1 1 17 GLY HA3 H 5.217 -1.632 2.116 1.00 . A A . 17 GLY HA3 1 1 21 8977 1 1 17 GLY N N 4.832 0.289 1.315 1.00 . A A . 17 GLY N 1 1 21 8978 1 1 17 GLY O O 8.090 -0.787 1.929 1.00 . A A . 17 GLY O 1 1 21 8979 1 1 18 GLU C C 9.044 0.231 -0.732 1.00 . A A . 18 GLU C 1 1 21 8980 1 1 18 GLU CA C 8.270 -1.094 -0.750 1.00 . A A . 18 GLU CA 1 1 21 8981 1 1 18 GLU CB C 7.851 -1.465 -2.174 1.00 . A A . 18 GLU CB 1 1 21 8982 1 1 18 GLU CD C 7.562 -3.376 -3.767 1.00 . A A . 18 GLU CD 1 1 21 8983 1 1 18 GLU CG C 7.818 -2.990 -2.308 1.00 . A A . 18 GLU CG 1 1 21 8984 1 1 18 GLU H H 6.136 -0.974 -0.445 1.00 . A A . 18 GLU H 1 1 21 8985 1 1 18 GLU HA H 8.875 -1.877 -0.329 1.00 . A A . 18 GLU HA 1 1 21 8986 1 1 18 GLU HB2 H 6.869 -1.062 -2.378 1.00 . A A . 18 GLU HB2 1 1 21 8987 1 1 18 GLU HB3 H 8.561 -1.058 -2.877 1.00 . A A . 18 GLU HB3 1 1 21 8988 1 1 18 GLU HG2 H 8.765 -3.397 -1.989 1.00 . A A . 18 GLU HG2 1 1 21 8989 1 1 18 GLU HG3 H 7.029 -3.388 -1.689 1.00 . A A . 18 GLU HG3 1 1 21 8990 1 1 18 GLU N N 6.998 -0.962 0.023 1.00 . A A . 18 GLU N 1 1 21 8991 1 1 18 GLU O O 10.247 0.252 -0.889 1.00 . A A . 18 GLU O 1 1 21 8992 1 1 18 GLU OE1 O 6.407 -3.386 -4.162 1.00 . A A . 18 GLU OE1 1 1 21 8993 1 1 18 GLU OE2 O 8.525 -3.660 -4.461 1.00 . A A . 18 GLU OE2 1 1 21 8994 1 1 19 ASN C C 9.865 2.783 0.834 1.00 . A A . 19 ASN C 1 1 21 8995 1 1 19 ASN CA C 9.071 2.649 -0.475 1.00 . A A . 19 ASN CA 1 1 21 8996 1 1 19 ASN CB C 7.967 3.708 -0.545 1.00 . A A . 19 ASN CB 1 1 21 8997 1 1 19 ASN CG C 7.776 4.155 -1.995 1.00 . A A . 19 ASN CG 1 1 21 8998 1 1 19 ASN H H 7.397 1.288 -0.387 1.00 . A A . 19 ASN H 1 1 21 8999 1 1 19 ASN HA H 9.730 2.749 -1.321 1.00 . A A . 19 ASN HA 1 1 21 9000 1 1 19 ASN HB2 H 7.043 3.292 -0.170 1.00 . A A . 19 ASN HB2 1 1 21 9001 1 1 19 ASN HB3 H 8.247 4.560 0.057 1.00 . A A . 19 ASN HB3 1 1 21 9002 1 1 19 ASN HD21 H 6.335 2.836 -2.362 1.00 . A A . 19 ASN HD21 1 1 21 9003 1 1 19 ASN HD22 H 6.749 3.841 -3.666 1.00 . A A . 19 ASN HD22 1 1 21 9004 1 1 19 ASN N N 8.365 1.331 -0.524 1.00 . A A . 19 ASN N 1 1 21 9005 1 1 19 ASN ND2 N 6.879 3.561 -2.736 1.00 . A A . 19 ASN ND2 1 1 21 9006 1 1 19 ASN O O 10.733 3.627 0.955 1.00 . A A . 19 ASN O 1 1 21 9007 1 1 19 ASN OD1 O 8.451 5.052 -2.460 1.00 . A A . 19 ASN OD1 1 1 21 9008 1 1 20 GLY C C 11.118 0.758 3.340 1.00 . A A . 20 GLY C 1 1 21 9009 1 1 20 GLY CA C 10.295 2.034 3.115 1.00 . A A . 20 GLY CA 1 1 21 9010 1 1 20 GLY H H 8.863 1.295 1.690 1.00 . A A . 20 GLY H 1 1 21 9011 1 1 20 GLY HA2 H 10.956 2.889 3.109 1.00 . A A . 20 GLY HA2 1 1 21 9012 1 1 20 GLY HA3 H 9.581 2.142 3.916 1.00 . A A . 20 GLY HA3 1 1 21 9013 1 1 20 GLY N N 9.569 1.961 1.812 1.00 . A A . 20 GLY N 1 1 21 9014 1 1 20 GLY O O 12.195 0.804 3.902 1.00 . A A . 20 GLY O 1 1 21 9015 1 1 21 VAL C C 12.281 -1.952 1.922 1.00 . A A . 21 VAL C 1 1 21 9016 1 1 21 VAL CA C 11.392 -1.650 3.133 1.00 . A A . 21 VAL CA 1 1 21 9017 1 1 21 VAL CB C 10.330 -2.744 3.320 1.00 . A A . 21 VAL CB 1 1 21 9018 1 1 21 VAL CG1 C 10.996 -4.124 3.325 1.00 . A A . 21 VAL CG1 1 1 21 9019 1 1 21 VAL CG2 C 9.605 -2.532 4.652 1.00 . A A . 21 VAL CG2 1 1 21 9020 1 1 21 VAL H H 9.746 -0.410 2.475 1.00 . A A . 21 VAL H 1 1 21 9021 1 1 21 VAL HA H 11.993 -1.570 4.019 1.00 . A A . 21 VAL HA 1 1 21 9022 1 1 21 VAL HB H 9.618 -2.694 2.509 1.00 . A A . 21 VAL HB 1 1 21 9023 1 1 21 VAL HG11 H 11.772 -4.146 4.075 1.00 . A A . 21 VAL HG11 1 1 21 9024 1 1 21 VAL HG12 H 11.427 -4.319 2.353 1.00 . A A . 21 VAL HG12 1 1 21 9025 1 1 21 VAL HG13 H 10.257 -4.879 3.548 1.00 . A A . 21 VAL HG13 1 1 21 9026 1 1 21 VAL HG21 H 10.279 -2.750 5.467 1.00 . A A . 21 VAL HG21 1 1 21 9027 1 1 21 VAL HG22 H 8.751 -3.190 4.706 1.00 . A A . 21 VAL HG22 1 1 21 9028 1 1 21 VAL HG23 H 9.274 -1.507 4.723 1.00 . A A . 21 VAL HG23 1 1 21 9029 1 1 21 VAL N N 10.623 -0.384 2.921 1.00 . A A . 21 VAL N 1 1 21 9030 1 1 21 VAL O O 13.411 -2.376 2.065 1.00 . A A . 21 VAL O 1 1 21 9031 1 1 22 PHE C C 13.268 -0.743 -1.010 1.00 . A A . 22 PHE C 1 1 21 9032 1 1 22 PHE CA C 12.594 -2.020 -0.487 1.00 . A A . 22 PHE CA 1 1 21 9033 1 1 22 PHE CB C 11.597 -2.567 -1.512 1.00 . A A . 22 PHE CB 1 1 21 9034 1 1 22 PHE CD1 C 10.241 -4.290 -0.261 1.00 . A A . 22 PHE CD1 1 1 21 9035 1 1 22 PHE CD2 C 11.984 -5.047 -1.768 1.00 . A A . 22 PHE CD2 1 1 21 9036 1 1 22 PHE CE1 C 9.936 -5.619 0.055 1.00 . A A . 22 PHE CE1 1 1 21 9037 1 1 22 PHE CE2 C 11.679 -6.377 -1.451 1.00 . A A . 22 PHE CE2 1 1 21 9038 1 1 22 PHE CG C 11.265 -4.003 -1.173 1.00 . A A . 22 PHE CG 1 1 21 9039 1 1 22 PHE CZ C 10.655 -6.662 -0.541 1.00 . A A . 22 PHE CZ 1 1 21 9040 1 1 22 PHE H H 10.866 -1.401 0.650 1.00 . A A . 22 PHE H 1 1 21 9041 1 1 22 PHE HA H 13.339 -2.766 -0.271 1.00 . A A . 22 PHE HA 1 1 21 9042 1 1 22 PHE HB2 H 10.695 -1.974 -1.492 1.00 . A A . 22 PHE HB2 1 1 21 9043 1 1 22 PHE HB3 H 12.034 -2.525 -2.499 1.00 . A A . 22 PHE HB3 1 1 21 9044 1 1 22 PHE HD1 H 9.686 -3.485 0.198 1.00 . A A . 22 PHE HD1 1 1 21 9045 1 1 22 PHE HD2 H 12.775 -4.827 -2.470 1.00 . A A . 22 PHE HD2 1 1 21 9046 1 1 22 PHE HE1 H 9.146 -5.839 0.757 1.00 . A A . 22 PHE HE1 1 1 21 9047 1 1 22 PHE HE2 H 12.234 -7.181 -1.910 1.00 . A A . 22 PHE HE2 1 1 21 9048 1 1 22 PHE HZ H 10.419 -7.688 -0.297 1.00 . A A . 22 PHE HZ 1 1 21 9049 1 1 22 PHE N N 11.779 -1.741 0.737 1.00 . A A . 22 PHE N 1 1 21 9050 1 1 22 PHE O O 14.114 -0.797 -1.882 1.00 . A A . 22 PHE O 1 1 21 9051 1 1 23 PHE C C 14.065 2.493 0.240 1.00 . A A . 23 PHE C 1 1 21 9052 1 1 23 PHE CA C 13.531 1.679 -0.952 1.00 . A A . 23 PHE CA 1 1 21 9053 1 1 23 PHE CB C 12.398 2.431 -1.659 1.00 . A A . 23 PHE CB 1 1 21 9054 1 1 23 PHE CD1 C 13.409 2.744 -3.950 1.00 . A A . 23 PHE CD1 1 1 21 9055 1 1 23 PHE CD2 C 13.057 4.695 -2.554 1.00 . A A . 23 PHE CD2 1 1 21 9056 1 1 23 PHE CE1 C 13.936 3.560 -4.958 1.00 . A A . 23 PHE CE1 1 1 21 9057 1 1 23 PHE CE2 C 13.584 5.511 -3.563 1.00 . A A . 23 PHE CE2 1 1 21 9058 1 1 23 PHE CG C 12.969 3.311 -2.748 1.00 . A A . 23 PHE CG 1 1 21 9059 1 1 23 PHE CZ C 14.023 4.944 -4.764 1.00 . A A . 23 PHE CZ 1 1 21 9060 1 1 23 PHE H H 12.225 0.424 0.218 1.00 . A A . 23 PHE H 1 1 21 9061 1 1 23 PHE HA H 14.326 1.473 -1.650 1.00 . A A . 23 PHE HA 1 1 21 9062 1 1 23 PHE HB2 H 11.713 1.720 -2.094 1.00 . A A . 23 PHE HB2 1 1 21 9063 1 1 23 PHE HB3 H 11.872 3.043 -0.942 1.00 . A A . 23 PHE HB3 1 1 21 9064 1 1 23 PHE HD1 H 13.341 1.676 -4.100 1.00 . A A . 23 PHE HD1 1 1 21 9065 1 1 23 PHE HD2 H 12.719 5.134 -1.627 1.00 . A A . 23 PHE HD2 1 1 21 9066 1 1 23 PHE HE1 H 14.274 3.122 -5.886 1.00 . A A . 23 PHE HE1 1 1 21 9067 1 1 23 PHE HE2 H 13.652 6.578 -3.412 1.00 . A A . 23 PHE HE2 1 1 21 9068 1 1 23 PHE HZ H 14.430 5.573 -5.542 1.00 . A A . 23 PHE HZ 1 1 21 9069 1 1 23 PHE N N 12.907 0.403 -0.484 1.00 . A A . 23 PHE N 1 1 21 9070 1 1 23 PHE O O 14.259 3.689 0.141 1.00 . A A . 23 PHE O 1 1 21 9071 1 1 24 TYR C C 15.544 1.643 3.523 1.00 . A A . 24 TYR C 1 1 21 9072 1 1 24 TYR CA C 14.831 2.599 2.552 1.00 . A A . 24 TYR CA 1 1 21 9073 1 1 24 TYR CB C 13.589 3.211 3.210 1.00 . A A . 24 TYR CB 1 1 21 9074 1 1 24 TYR CD1 C 14.486 5.082 4.640 1.00 . A A . 24 TYR CD1 1 1 21 9075 1 1 24 TYR CD2 C 13.378 5.634 2.555 1.00 . A A . 24 TYR CD2 1 1 21 9076 1 1 24 TYR CE1 C 14.704 6.443 4.886 1.00 . A A . 24 TYR CE1 1 1 21 9077 1 1 24 TYR CE2 C 13.597 6.995 2.800 1.00 . A A . 24 TYR CE2 1 1 21 9078 1 1 24 TYR CG C 13.824 4.677 3.476 1.00 . A A . 24 TYR CG 1 1 21 9079 1 1 24 TYR CZ C 14.259 7.399 3.966 1.00 . A A . 24 TYR CZ 1 1 21 9080 1 1 24 TYR H H 14.146 0.892 1.423 1.00 . A A . 24 TYR H 1 1 21 9081 1 1 24 TYR HA H 15.502 3.383 2.238 1.00 . A A . 24 TYR HA 1 1 21 9082 1 1 24 TYR HB2 H 12.742 3.096 2.550 1.00 . A A . 24 TYR HB2 1 1 21 9083 1 1 24 TYR HB3 H 13.389 2.702 4.143 1.00 . A A . 24 TYR HB3 1 1 21 9084 1 1 24 TYR HD1 H 14.830 4.344 5.351 1.00 . A A . 24 TYR HD1 1 1 21 9085 1 1 24 TYR HD2 H 12.868 5.322 1.656 1.00 . A A . 24 TYR HD2 1 1 21 9086 1 1 24 TYR HE1 H 15.216 6.755 5.784 1.00 . A A . 24 TYR HE1 1 1 21 9087 1 1 24 TYR HE2 H 13.253 7.734 2.091 1.00 . A A . 24 TYR HE2 1 1 21 9088 1 1 24 TYR HH H 15.320 8.979 3.822 1.00 . A A . 24 TYR HH 1 1 21 9089 1 1 24 TYR N N 14.307 1.856 1.362 1.00 . A A . 24 TYR N 1 1 21 9090 1 1 24 TYR O O 15.498 1.820 4.727 1.00 . A A . 24 TYR O 1 1 21 9091 1 1 24 TYR OH O 14.473 8.741 4.206 1.00 . A A . 24 TYR OH 1 1 21 9092 1 1 25 LYS C C 18.280 -0.711 3.294 1.00 . A A . 25 LYS C 1 1 21 9093 1 1 25 LYS CA C 16.921 -0.331 3.900 1.00 . A A . 25 LYS CA 1 1 21 9094 1 1 25 LYS CB C 16.005 -1.558 3.978 1.00 . A A . 25 LYS CB 1 1 21 9095 1 1 25 LYS CD C 14.085 -2.595 5.206 1.00 . A A . 25 LYS CD 1 1 21 9096 1 1 25 LYS CE C 14.855 -3.598 6.073 1.00 . A A . 25 LYS CE 1 1 21 9097 1 1 25 LYS CG C 14.917 -1.321 5.030 1.00 . A A . 25 LYS CG 1 1 21 9098 1 1 25 LYS H H 16.233 0.512 2.037 1.00 . A A . 25 LYS H 1 1 21 9099 1 1 25 LYS HA H 17.055 0.091 4.883 1.00 . A A . 25 LYS HA 1 1 21 9100 1 1 25 LYS HB2 H 15.546 -1.724 3.014 1.00 . A A . 25 LYS HB2 1 1 21 9101 1 1 25 LYS HB3 H 16.588 -2.424 4.253 1.00 . A A . 25 LYS HB3 1 1 21 9102 1 1 25 LYS HD2 H 13.150 -2.347 5.686 1.00 . A A . 25 LYS HD2 1 1 21 9103 1 1 25 LYS HD3 H 13.890 -3.033 4.239 1.00 . A A . 25 LYS HD3 1 1 21 9104 1 1 25 LYS HE2 H 15.724 -3.961 5.541 1.00 . A A . 25 LYS HE2 1 1 21 9105 1 1 25 LYS HE3 H 15.147 -3.143 7.006 1.00 . A A . 25 LYS HE3 1 1 21 9106 1 1 25 LYS HG2 H 15.379 -1.057 5.970 1.00 . A A . 25 LYS HG2 1 1 21 9107 1 1 25 LYS HG3 H 14.274 -0.516 4.706 1.00 . A A . 25 LYS HG3 1 1 21 9108 1 1 25 LYS HZ1 H 13.552 -5.088 5.419 1.00 . A A . 25 LYS HZ1 1 1 21 9109 1 1 25 LYS HZ2 H 13.089 -4.356 6.880 1.00 . A A . 25 LYS HZ2 1 1 21 9110 1 1 25 LYS HZ3 H 14.373 -5.469 6.853 1.00 . A A . 25 LYS HZ3 1 1 21 9111 1 1 25 LYS N N 16.205 0.633 3.009 1.00 . A A . 25 LYS N 1 1 21 9112 1 1 25 LYS NZ N 13.895 -4.712 6.325 1.00 . A A . 25 LYS NZ 1 1 21 9113 1 1 25 LYS O O 18.305 -1.108 2.139 1.00 . A A . 25 LYS O 1 1 21 9114 1 1 25 LYS OXT O 19.271 -0.599 3.997 1.00 . A A . 25 LYS OXT 1 1 22 9115 1 1 1 HIS C C -19.047 -2.267 3.301 1.00 . A A . 1 HIS C 1 1 22 9116 1 1 1 HIS CA C -19.400 -2.832 4.682 1.00 . A A . 1 HIS CA 1 1 22 9117 1 1 1 HIS CB C -18.711 -4.184 4.898 1.00 . A A . 1 HIS CB 1 1 22 9118 1 1 1 HIS CD2 C -16.700 -3.593 6.484 1.00 . A A . 1 HIS CD2 1 1 22 9119 1 1 1 HIS CE1 C -17.438 -4.529 8.293 1.00 . A A . 1 HIS CE1 1 1 22 9120 1 1 1 HIS CG C -17.917 -4.148 6.176 1.00 . A A . 1 HIS CG 1 1 22 9121 1 1 1 HIS HA H -19.106 -2.141 5.457 1.00 . A A . 1 HIS HA 1 1 22 9122 1 1 1 HIS HB2 H -19.456 -4.964 4.959 1.00 . A A . 1 HIS HB2 1 1 22 9123 1 1 1 HIS HB3 H -18.048 -4.386 4.071 1.00 . A A . 1 HIS HB3 1 1 22 9124 1 1 1 HIS HD1 H -19.213 -5.226 7.460 1.00 . A A . 1 HIS HD1 1 1 22 9125 1 1 1 HIS HD2 H -16.070 -3.052 5.794 1.00 . A A . 1 HIS HD2 1 1 22 9126 1 1 1 HIS HE1 H -17.520 -4.878 9.311 1.00 . A A . 1 HIS HE1 1 1 22 9127 1 1 1 HIS N N -20.865 -3.115 4.768 1.00 . A A . 1 HIS N 1 1 22 9128 1 1 1 HIS ND1 N -18.370 -4.740 7.345 1.00 . A A . 1 HIS ND1 1 1 22 9129 1 1 1 HIS NE2 N -16.399 -3.834 7.821 1.00 . A A . 1 HIS NE2 1 1 22 9130 1 1 1 HIS O O -19.674 -2.592 2.310 1.00 . A A . 1 HIS O 1 1 22 9131 1 1 2 ALA C C -16.673 -1.781 1.191 1.00 . A A . 2 ALA C 1 1 22 9132 1 1 2 ALA CA C -17.642 -0.838 1.915 1.00 . A A . 2 ALA CA 1 1 22 9133 1 1 2 ALA CB C -16.950 0.483 2.260 1.00 . A A . 2 ALA CB 1 1 22 9134 1 1 2 ALA H H -17.553 -1.184 4.046 1.00 . A A . 2 ALA H 1 1 22 9135 1 1 2 ALA HA H -18.512 -0.650 1.306 1.00 . A A . 2 ALA HA 1 1 22 9136 1 1 2 ALA HB1 H -15.978 0.281 2.684 1.00 . A A . 2 ALA HB1 1 1 22 9137 1 1 2 ALA HB2 H -17.549 1.028 2.977 1.00 . A A . 2 ALA HB2 1 1 22 9138 1 1 2 ALA HB3 H -16.837 1.075 1.364 1.00 . A A . 2 ALA HB3 1 1 22 9139 1 1 2 ALA N N -18.044 -1.426 3.231 1.00 . A A . 2 ALA N 1 1 22 9140 1 1 2 ALA O O -15.714 -2.258 1.767 1.00 . A A . 2 ALA O 1 1 22 9141 1 1 3 TRP C C -14.874 -2.184 -1.523 1.00 . A A . 3 TRP C 1 1 22 9142 1 1 3 TRP CA C -16.013 -2.965 -0.838 1.00 . A A . 3 TRP CA 1 1 22 9143 1 1 3 TRP CB C -16.920 -3.620 -1.885 1.00 . A A . 3 TRP CB 1 1 22 9144 1 1 3 TRP CD1 C -16.667 -6.077 -1.346 1.00 . A A . 3 TRP CD1 1 1 22 9145 1 1 3 TRP CD2 C -15.688 -5.515 -3.292 1.00 . A A . 3 TRP CD2 1 1 22 9146 1 1 3 TRP CE2 C -15.474 -6.902 -3.114 1.00 . A A . 3 TRP CE2 1 1 22 9147 1 1 3 TRP CE3 C -15.169 -4.907 -4.450 1.00 . A A . 3 TRP CE3 1 1 22 9148 1 1 3 TRP CG C -16.449 -5.014 -2.155 1.00 . A A . 3 TRP CG 1 1 22 9149 1 1 3 TRP CH2 C -14.259 -7.038 -5.195 1.00 . A A . 3 TRP CH2 1 1 22 9150 1 1 3 TRP CZ2 C -14.768 -7.659 -4.051 1.00 . A A . 3 TRP CZ2 1 1 22 9151 1 1 3 TRP CZ3 C -14.458 -5.666 -5.394 1.00 . A A . 3 TRP CZ3 1 1 22 9152 1 1 3 TRP H H -17.698 -1.650 -0.510 1.00 . A A . 3 TRP H 1 1 22 9153 1 1 3 TRP HA H -15.606 -3.721 -0.186 1.00 . A A . 3 TRP HA 1 1 22 9154 1 1 3 TRP HB2 H -17.933 -3.649 -1.517 1.00 . A A . 3 TRP HB2 1 1 22 9155 1 1 3 TRP HB3 H -16.885 -3.046 -2.800 1.00 . A A . 3 TRP HB3 1 1 22 9156 1 1 3 TRP HD1 H -17.205 -6.054 -0.410 1.00 . A A . 3 TRP HD1 1 1 22 9157 1 1 3 TRP HE1 H -16.103 -8.098 -1.529 1.00 . A A . 3 TRP HE1 1 1 22 9158 1 1 3 TRP HE3 H -15.316 -3.849 -4.612 1.00 . A A . 3 TRP HE3 1 1 22 9159 1 1 3 TRP HH2 H -13.712 -7.617 -5.925 1.00 . A A . 3 TRP HH2 1 1 22 9160 1 1 3 TRP HZ2 H -14.617 -8.716 -3.893 1.00 . A A . 3 TRP HZ2 1 1 22 9161 1 1 3 TRP HZ3 H -14.064 -5.188 -6.278 1.00 . A A . 3 TRP HZ3 1 1 22 9162 1 1 3 TRP N N -16.918 -2.050 -0.069 1.00 . A A . 3 TRP N 1 1 22 9163 1 1 3 TRP NE1 N -16.088 -7.197 -1.914 1.00 . A A . 3 TRP NE1 1 1 22 9164 1 1 3 TRP O O -14.139 -2.731 -2.324 1.00 . A A . 3 TRP O 1 1 22 9165 1 1 4 TYR C C -12.759 0.582 -0.785 1.00 . A A . 4 TYR C 1 1 22 9166 1 1 4 TYR CA C -13.621 -0.115 -1.851 1.00 . A A . 4 TYR CA 1 1 22 9167 1 1 4 TYR CB C -14.340 0.917 -2.736 1.00 . A A . 4 TYR CB 1 1 22 9168 1 1 4 TYR CD1 C -14.666 2.992 -1.330 1.00 . A A . 4 TYR CD1 1 1 22 9169 1 1 4 TYR CD2 C -16.553 1.507 -1.668 1.00 . A A . 4 TYR CD2 1 1 22 9170 1 1 4 TYR CE1 C -15.467 3.834 -0.550 1.00 . A A . 4 TYR CE1 1 1 22 9171 1 1 4 TYR CE2 C -17.355 2.350 -0.888 1.00 . A A . 4 TYR CE2 1 1 22 9172 1 1 4 TYR CG C -15.207 1.828 -1.890 1.00 . A A . 4 TYR CG 1 1 22 9173 1 1 4 TYR CZ C -16.813 3.512 -0.329 1.00 . A A . 4 TYR CZ 1 1 22 9174 1 1 4 TYR H H -15.310 -0.493 -0.565 1.00 . A A . 4 TYR H 1 1 22 9175 1 1 4 TYR HA H -13.004 -0.752 -2.466 1.00 . A A . 4 TYR HA 1 1 22 9176 1 1 4 TYR HB2 H -13.605 1.512 -3.259 1.00 . A A . 4 TYR HB2 1 1 22 9177 1 1 4 TYR HB3 H -14.959 0.402 -3.455 1.00 . A A . 4 TYR HB3 1 1 22 9178 1 1 4 TYR HD1 H -13.628 3.240 -1.499 1.00 . A A . 4 TYR HD1 1 1 22 9179 1 1 4 TYR HD2 H -16.972 0.610 -2.099 1.00 . A A . 4 TYR HD2 1 1 22 9180 1 1 4 TYR HE1 H -15.049 4.731 -0.120 1.00 . A A . 4 TYR HE1 1 1 22 9181 1 1 4 TYR HE2 H -18.391 2.101 -0.718 1.00 . A A . 4 TYR HE2 1 1 22 9182 1 1 4 TYR HH H -17.168 4.478 1.282 1.00 . A A . 4 TYR HH 1 1 22 9183 1 1 4 TYR N N -14.716 -0.917 -1.215 1.00 . A A . 4 TYR N 1 1 22 9184 1 1 4 TYR O O -12.042 1.522 -1.076 1.00 . A A . 4 TYR O 1 1 22 9185 1 1 4 TYR OH O -17.606 4.342 0.438 1.00 . A A . 4 TYR OH 1 1 22 9186 1 1 5 SER C C -10.823 -0.120 1.923 1.00 . A A . 5 SER C 1 1 22 9187 1 1 5 SER CA C -12.007 0.771 1.524 1.00 . A A . 5 SER CA 1 1 22 9188 1 1 5 SER CB C -12.971 0.940 2.697 1.00 . A A . 5 SER CB 1 1 22 9189 1 1 5 SER H H -13.402 -0.628 0.661 1.00 . A A . 5 SER H 1 1 22 9190 1 1 5 SER HA H -11.653 1.733 1.201 1.00 . A A . 5 SER HA 1 1 22 9191 1 1 5 SER HB2 H -13.940 1.239 2.332 1.00 . A A . 5 SER HB2 1 1 22 9192 1 1 5 SER HB3 H -13.062 -0.001 3.225 1.00 . A A . 5 SER HB3 1 1 22 9193 1 1 5 SER HG H -12.797 2.793 3.267 1.00 . A A . 5 SER HG 1 1 22 9194 1 1 5 SER N N -12.820 0.131 0.446 1.00 . A A . 5 SER N 1 1 22 9195 1 1 5 SER O O -9.852 0.347 2.486 1.00 . A A . 5 SER O 1 1 22 9196 1 1 5 SER OG O -12.472 1.942 3.572 1.00 . A A . 5 SER OG 1 1 22 9197 1 1 6 HIS C C -8.735 -2.358 0.875 1.00 . A A . 6 HIS C 1 1 22 9198 1 1 6 HIS CA C -9.769 -2.309 1.999 1.00 . A A . 6 HIS CA 1 1 22 9199 1 1 6 HIS CB C -10.412 -3.684 2.204 1.00 . A A . 6 HIS CB 1 1 22 9200 1 1 6 HIS CD2 C -8.811 -5.292 3.532 1.00 . A A . 6 HIS CD2 1 1 22 9201 1 1 6 HIS CE1 C -9.476 -4.811 5.536 1.00 . A A . 6 HIS CE1 1 1 22 9202 1 1 6 HIS CG C -9.802 -4.350 3.407 1.00 . A A . 6 HIS CG 1 1 22 9203 1 1 6 HIS H H -11.683 -1.750 1.181 1.00 . A A . 6 HIS H 1 1 22 9204 1 1 6 HIS HA H -9.303 -1.980 2.910 1.00 . A A . 6 HIS HA 1 1 22 9205 1 1 6 HIS HB2 H -11.474 -3.567 2.358 1.00 . A A . 6 HIS HB2 1 1 22 9206 1 1 6 HIS HB3 H -10.240 -4.296 1.330 1.00 . A A . 6 HIS HB3 1 1 22 9207 1 1 6 HIS HD1 H -10.911 -3.421 4.955 1.00 . A A . 6 HIS HD1 1 1 22 9208 1 1 6 HIS HD2 H -8.272 -5.741 2.710 1.00 . A A . 6 HIS HD2 1 1 22 9209 1 1 6 HIS HE1 H -9.577 -4.794 6.612 1.00 . A A . 6 HIS HE1 1 1 22 9210 1 1 6 HIS N N -10.894 -1.395 1.636 1.00 . A A . 6 HIS N 1 1 22 9211 1 1 6 HIS ND1 N -10.211 -4.058 4.699 1.00 . A A . 6 HIS ND1 1 1 22 9212 1 1 6 HIS NE2 N -8.606 -5.582 4.877 1.00 . A A . 6 HIS NE2 1 1 22 9213 1 1 6 HIS O O -7.550 -2.463 1.122 1.00 . A A . 6 HIS O 1 1 22 9214 1 1 7 TYR C C -7.358 -1.042 -1.500 1.00 . A A . 7 TYR C 1 1 22 9215 1 1 7 TYR CA C -8.206 -2.314 -1.498 1.00 . A A . 7 TYR CA 1 1 22 9216 1 1 7 TYR CB C -9.065 -2.397 -2.767 1.00 . A A . 7 TYR CB 1 1 22 9217 1 1 7 TYR CD1 C -9.103 -4.922 -2.787 1.00 . A A . 7 TYR CD1 1 1 22 9218 1 1 7 TYR CD2 C -11.209 -3.721 -2.841 1.00 . A A . 7 TYR CD2 1 1 22 9219 1 1 7 TYR CE1 C -9.797 -6.138 -2.817 1.00 . A A . 7 TYR CE1 1 1 22 9220 1 1 7 TYR CE2 C -11.901 -4.937 -2.871 1.00 . A A . 7 TYR CE2 1 1 22 9221 1 1 7 TYR CG C -9.810 -3.713 -2.798 1.00 . A A . 7 TYR CG 1 1 22 9222 1 1 7 TYR CZ C -11.195 -6.145 -2.858 1.00 . A A . 7 TYR CZ 1 1 22 9223 1 1 7 TYR H H -10.132 -2.190 -0.524 1.00 . A A . 7 TYR H 1 1 22 9224 1 1 7 TYR HA H -7.572 -3.179 -1.422 1.00 . A A . 7 TYR HA 1 1 22 9225 1 1 7 TYR HB2 H -9.772 -1.581 -2.774 1.00 . A A . 7 TYR HB2 1 1 22 9226 1 1 7 TYR HB3 H -8.426 -2.326 -3.636 1.00 . A A . 7 TYR HB3 1 1 22 9227 1 1 7 TYR HD1 H -8.023 -4.917 -2.754 1.00 . A A . 7 TYR HD1 1 1 22 9228 1 1 7 TYR HD2 H -11.755 -2.790 -2.849 1.00 . A A . 7 TYR HD2 1 1 22 9229 1 1 7 TYR HE1 H -9.252 -7.070 -2.808 1.00 . A A . 7 TYR HE1 1 1 22 9230 1 1 7 TYR HE2 H -12.981 -4.943 -2.903 1.00 . A A . 7 TYR HE2 1 1 22 9231 1 1 7 TYR HH H -12.308 -7.461 -2.037 1.00 . A A . 7 TYR HH 1 1 22 9232 1 1 7 TYR N N -9.172 -2.278 -0.355 1.00 . A A . 7 TYR N 1 1 22 9233 1 1 7 TYR O O -6.162 -1.085 -1.716 1.00 . A A . 7 TYR O 1 1 22 9234 1 1 7 TYR OH O -11.878 -7.343 -2.889 1.00 . A A . 7 TYR OH 1 1 22 9235 1 1 8 VAL C C -6.221 1.346 -0.019 1.00 . A A . 8 VAL C 1 1 22 9236 1 1 8 VAL CA C -7.197 1.365 -1.205 1.00 . A A . 8 VAL CA 1 1 22 9237 1 1 8 VAL CB C -8.247 2.480 -1.054 1.00 . A A . 8 VAL CB 1 1 22 9238 1 1 8 VAL CG1 C -8.902 2.414 0.330 1.00 . A A . 8 VAL CG1 1 1 22 9239 1 1 8 VAL CG2 C -7.570 3.842 -1.227 1.00 . A A . 8 VAL CG2 1 1 22 9240 1 1 8 VAL H H -8.929 0.085 -1.058 1.00 . A A . 8 VAL H 1 1 22 9241 1 1 8 VAL HA H -6.655 1.493 -2.123 1.00 . A A . 8 VAL HA 1 1 22 9242 1 1 8 VAL HB H -9.006 2.359 -1.813 1.00 . A A . 8 VAL HB 1 1 22 9243 1 1 8 VAL HG11 H -8.197 2.740 1.079 1.00 . A A . 8 VAL HG11 1 1 22 9244 1 1 8 VAL HG12 H -9.205 1.398 0.537 1.00 . A A . 8 VAL HG12 1 1 22 9245 1 1 8 VAL HG13 H -9.769 3.058 0.348 1.00 . A A . 8 VAL HG13 1 1 22 9246 1 1 8 VAL HG21 H -7.286 3.974 -2.261 1.00 . A A . 8 VAL HG21 1 1 22 9247 1 1 8 VAL HG22 H -6.689 3.890 -0.603 1.00 . A A . 8 VAL HG22 1 1 22 9248 1 1 8 VAL HG23 H -8.256 4.626 -0.941 1.00 . A A . 8 VAL HG23 1 1 22 9249 1 1 8 VAL N N -7.968 0.085 -1.241 1.00 . A A . 8 VAL N 1 1 22 9250 1 1 8 VAL O O -5.151 1.917 -0.080 1.00 . A A . 8 VAL O 1 1 22 9251 1 1 9 LEU C C -4.600 -0.477 1.983 1.00 . A A . 9 LEU C 1 1 22 9252 1 1 9 LEU CA C -5.669 0.592 2.230 1.00 . A A . 9 LEU CA 1 1 22 9253 1 1 9 LEU CB C -6.568 0.196 3.408 1.00 . A A . 9 LEU CB 1 1 22 9254 1 1 9 LEU CD1 C -6.866 2.290 4.742 1.00 . A A . 9 LEU CD1 1 1 22 9255 1 1 9 LEU CD2 C -6.462 0.114 5.904 1.00 . A A . 9 LEU CD2 1 1 22 9256 1 1 9 LEU CG C -6.128 0.950 4.666 1.00 . A A . 9 LEU CG 1 1 22 9257 1 1 9 LEU H H -7.441 0.205 1.063 1.00 . A A . 9 LEU H 1 1 22 9258 1 1 9 LEU HA H -5.210 1.550 2.419 1.00 . A A . 9 LEU HA 1 1 22 9259 1 1 9 LEU HB2 H -7.593 0.445 3.178 1.00 . A A . 9 LEU HB2 1 1 22 9260 1 1 9 LEU HB3 H -6.486 -0.867 3.581 1.00 . A A . 9 LEU HB3 1 1 22 9261 1 1 9 LEU HD11 H -7.925 2.127 4.606 1.00 . A A . 9 LEU HD11 1 1 22 9262 1 1 9 LEU HD12 H -6.499 2.947 3.968 1.00 . A A . 9 LEU HD12 1 1 22 9263 1 1 9 LEU HD13 H -6.693 2.740 5.709 1.00 . A A . 9 LEU HD13 1 1 22 9264 1 1 9 LEU HD21 H -5.930 -0.824 5.859 1.00 . A A . 9 LEU HD21 1 1 22 9265 1 1 9 LEU HD22 H -7.525 -0.075 5.936 1.00 . A A . 9 LEU HD22 1 1 22 9266 1 1 9 LEU HD23 H -6.167 0.653 6.793 1.00 . A A . 9 LEU HD23 1 1 22 9267 1 1 9 LEU HG H -5.064 1.128 4.626 1.00 . A A . 9 LEU HG 1 1 22 9268 1 1 9 LEU N N -6.578 0.673 1.049 1.00 . A A . 9 LEU N 1 1 22 9269 1 1 9 LEU O O -3.446 -0.300 2.322 1.00 . A A . 9 LEU O 1 1 22 9270 1 1 10 LYS C C -2.985 -2.184 0.038 1.00 . A A . 10 LYS C 1 1 22 9271 1 1 10 LYS CA C -3.986 -2.663 1.096 1.00 . A A . 10 LYS CA 1 1 22 9272 1 1 10 LYS CB C -4.813 -3.841 0.568 1.00 . A A . 10 LYS CB 1 1 22 9273 1 1 10 LYS CD C -3.931 -5.968 1.555 1.00 . A A . 10 LYS CD 1 1 22 9274 1 1 10 LYS CE C -3.369 -7.345 1.180 1.00 . A A . 10 LYS CE 1 1 22 9275 1 1 10 LYS CG C -3.903 -5.051 0.329 1.00 . A A . 10 LYS CG 1 1 22 9276 1 1 10 LYS H H -5.916 -1.697 1.107 1.00 . A A . 10 LYS H 1 1 22 9277 1 1 10 LYS HA H -3.471 -2.949 2.000 1.00 . A A . 10 LYS HA 1 1 22 9278 1 1 10 LYS HB2 H -5.573 -4.098 1.292 1.00 . A A . 10 LYS HB2 1 1 22 9279 1 1 10 LYS HB3 H -5.286 -3.560 -0.362 1.00 . A A . 10 LYS HB3 1 1 22 9280 1 1 10 LYS HD2 H -3.331 -5.534 2.342 1.00 . A A . 10 LYS HD2 1 1 22 9281 1 1 10 LYS HD3 H -4.950 -6.079 1.898 1.00 . A A . 10 LYS HD3 1 1 22 9282 1 1 10 LYS HE2 H -3.872 -8.119 1.743 1.00 . A A . 10 LYS HE2 1 1 22 9283 1 1 10 LYS HE3 H -3.478 -7.520 0.121 1.00 . A A . 10 LYS HE3 1 1 22 9284 1 1 10 LYS HG2 H -4.252 -5.596 -0.536 1.00 . A A . 10 LYS HG2 1 1 22 9285 1 1 10 LYS HG3 H -2.892 -4.714 0.157 1.00 . A A . 10 LYS HG3 1 1 22 9286 1 1 10 LYS HZ1 H -1.825 -7.177 2.572 1.00 . A A . 10 LYS HZ1 1 1 22 9287 1 1 10 LYS HZ2 H -1.469 -6.491 1.059 1.00 . A A . 10 LYS HZ2 1 1 22 9288 1 1 10 LYS HZ3 H -1.460 -8.180 1.254 1.00 . A A . 10 LYS HZ3 1 1 22 9289 1 1 10 LYS N N -4.977 -1.582 1.380 1.00 . A A . 10 LYS N 1 1 22 9290 1 1 10 LYS NZ N -1.922 -7.293 1.543 1.00 . A A . 10 LYS NZ 1 1 22 9291 1 1 10 LYS O O -1.793 -2.374 0.176 1.00 . A A . 10 LYS O 1 1 22 9292 1 1 11 PHE C C -1.658 0.069 -1.523 1.00 . A A . 11 PHE C 1 1 22 9293 1 1 11 PHE CA C -2.541 -1.056 -2.076 1.00 . A A . 11 PHE CA 1 1 22 9294 1 1 11 PHE CB C -3.459 -0.532 -3.187 1.00 . A A . 11 PHE CB 1 1 22 9295 1 1 11 PHE CD1 C -1.940 -0.808 -5.183 1.00 . A A . 11 PHE CD1 1 1 22 9296 1 1 11 PHE CD2 C -2.539 1.432 -4.472 1.00 . A A . 11 PHE CD2 1 1 22 9297 1 1 11 PHE CE1 C -1.169 -0.272 -6.221 1.00 . A A . 11 PHE CE1 1 1 22 9298 1 1 11 PHE CE2 C -1.767 1.968 -5.509 1.00 . A A . 11 PHE CE2 1 1 22 9299 1 1 11 PHE CG C -2.626 0.045 -4.308 1.00 . A A . 11 PHE CG 1 1 22 9300 1 1 11 PHE CZ C -1.082 1.116 -6.384 1.00 . A A . 11 PHE CZ 1 1 22 9301 1 1 11 PHE H H -4.431 -1.411 -1.093 1.00 . A A . 11 PHE H 1 1 22 9302 1 1 11 PHE HA H -1.930 -1.862 -2.452 1.00 . A A . 11 PHE HA 1 1 22 9303 1 1 11 PHE HB2 H -4.062 -1.344 -3.567 1.00 . A A . 11 PHE HB2 1 1 22 9304 1 1 11 PHE HB3 H -4.103 0.237 -2.787 1.00 . A A . 11 PHE HB3 1 1 22 9305 1 1 11 PHE HD1 H -2.006 -1.878 -5.057 1.00 . A A . 11 PHE HD1 1 1 22 9306 1 1 11 PHE HD2 H -3.068 2.089 -3.798 1.00 . A A . 11 PHE HD2 1 1 22 9307 1 1 11 PHE HE1 H -0.640 -0.929 -6.895 1.00 . A A . 11 PHE HE1 1 1 22 9308 1 1 11 PHE HE2 H -1.700 3.038 -5.635 1.00 . A A . 11 PHE HE2 1 1 22 9309 1 1 11 PHE HZ H -0.486 1.529 -7.184 1.00 . A A . 11 PHE HZ 1 1 22 9310 1 1 11 PHE N N -3.463 -1.557 -1.010 1.00 . A A . 11 PHE N 1 1 22 9311 1 1 11 PHE O O -0.461 0.084 -1.734 1.00 . A A . 11 PHE O 1 1 22 9312 1 1 12 PHE C C -0.382 1.590 0.738 1.00 . A A . 12 PHE C 1 1 22 9313 1 1 12 PHE CA C -1.433 2.132 -0.240 1.00 . A A . 12 PHE CA 1 1 22 9314 1 1 12 PHE CB C -2.448 3.019 0.490 1.00 . A A . 12 PHE CB 1 1 22 9315 1 1 12 PHE CD1 C -1.564 5.336 0.022 1.00 . A A . 12 PHE CD1 1 1 22 9316 1 1 12 PHE CD2 C -1.381 4.449 2.272 1.00 . A A . 12 PHE CD2 1 1 22 9317 1 1 12 PHE CE1 C -0.948 6.521 0.440 1.00 . A A . 12 PHE CE1 1 1 22 9318 1 1 12 PHE CE2 C -0.764 5.634 2.689 1.00 . A A . 12 PHE CE2 1 1 22 9319 1 1 12 PHE CG C -1.780 4.299 0.939 1.00 . A A . 12 PHE CG 1 1 22 9320 1 1 12 PHE CZ C -0.548 6.671 1.773 1.00 . A A . 12 PHE CZ 1 1 22 9321 1 1 12 PHE H H -3.207 0.970 -0.654 1.00 . A A . 12 PHE H 1 1 22 9322 1 1 12 PHE HA H -0.956 2.692 -1.029 1.00 . A A . 12 PHE HA 1 1 22 9323 1 1 12 PHE HB2 H -3.263 3.256 -0.176 1.00 . A A . 12 PHE HB2 1 1 22 9324 1 1 12 PHE HB3 H -2.830 2.493 1.352 1.00 . A A . 12 PHE HB3 1 1 22 9325 1 1 12 PHE HD1 H -1.872 5.220 -1.006 1.00 . A A . 12 PHE HD1 1 1 22 9326 1 1 12 PHE HD2 H -1.547 3.649 2.979 1.00 . A A . 12 PHE HD2 1 1 22 9327 1 1 12 PHE HE1 H -0.782 7.321 -0.267 1.00 . A A . 12 PHE HE1 1 1 22 9328 1 1 12 PHE HE2 H -0.455 5.750 3.718 1.00 . A A . 12 PHE HE2 1 1 22 9329 1 1 12 PHE HZ H -0.073 7.586 2.095 1.00 . A A . 12 PHE HZ 1 1 22 9330 1 1 12 PHE N N -2.240 1.007 -0.813 1.00 . A A . 12 PHE N 1 1 22 9331 1 1 12 PHE O O 0.770 1.977 0.697 1.00 . A A . 12 PHE O 1 1 22 9332 1 1 13 LEU C C 1.252 -0.739 1.867 1.00 . A A . 13 LEU C 1 1 22 9333 1 1 13 LEU CA C 0.205 0.119 2.591 1.00 . A A . 13 LEU CA 1 1 22 9334 1 1 13 LEU CB C -0.632 -0.743 3.541 1.00 . A A . 13 LEU CB 1 1 22 9335 1 1 13 LEU CD1 C 0.026 0.126 5.792 1.00 . A A . 13 LEU CD1 1 1 22 9336 1 1 13 LEU CD2 C -0.351 -2.321 5.461 1.00 . A A . 13 LEU CD2 1 1 22 9337 1 1 13 LEU CG C 0.173 -1.038 4.811 1.00 . A A . 13 LEU CG 1 1 22 9338 1 1 13 LEU H H -1.707 0.394 1.623 1.00 . A A . 13 LEU H 1 1 22 9339 1 1 13 LEU HA H 0.687 0.910 3.145 1.00 . A A . 13 LEU HA 1 1 22 9340 1 1 13 LEU HB2 H -1.538 -0.216 3.803 1.00 . A A . 13 LEU HB2 1 1 22 9341 1 1 13 LEU HB3 H -0.884 -1.673 3.054 1.00 . A A . 13 LEU HB3 1 1 22 9342 1 1 13 LEU HD11 H 0.613 0.965 5.448 1.00 . A A . 13 LEU HD11 1 1 22 9343 1 1 13 LEU HD12 H 0.374 -0.179 6.769 1.00 . A A . 13 LEU HD12 1 1 22 9344 1 1 13 LEU HD13 H -1.013 0.416 5.855 1.00 . A A . 13 LEU HD13 1 1 22 9345 1 1 13 LEU HD21 H -0.254 -3.142 4.767 1.00 . A A . 13 LEU HD21 1 1 22 9346 1 1 13 LEU HD22 H -1.390 -2.193 5.725 1.00 . A A . 13 LEU HD22 1 1 22 9347 1 1 13 LEU HD23 H 0.223 -2.533 6.351 1.00 . A A . 13 LEU HD23 1 1 22 9348 1 1 13 LEU HG H 1.217 -1.162 4.555 1.00 . A A . 13 LEU HG 1 1 22 9349 1 1 13 LEU N N -0.772 0.693 1.612 1.00 . A A . 13 LEU N 1 1 22 9350 1 1 13 LEU O O 2.417 -0.726 2.217 1.00 . A A . 13 LEU O 1 1 22 9351 1 1 14 LEU C C 2.872 -1.468 -0.583 1.00 . A A . 14 LEU C 1 1 22 9352 1 1 14 LEU CA C 1.824 -2.339 0.118 1.00 . A A . 14 LEU CA 1 1 22 9353 1 1 14 LEU CB C 0.993 -3.118 -0.907 1.00 . A A . 14 LEU CB 1 1 22 9354 1 1 14 LEU CD1 C 1.702 -5.380 -0.095 1.00 . A A . 14 LEU CD1 1 1 22 9355 1 1 14 LEU CD2 C 1.020 -5.062 -2.477 1.00 . A A . 14 LEU CD2 1 1 22 9356 1 1 14 LEU CG C 1.721 -4.412 -1.282 1.00 . A A . 14 LEU CG 1 1 22 9357 1 1 14 LEU H H -0.100 -1.475 0.598 1.00 . A A . 14 LEU H 1 1 22 9358 1 1 14 LEU HA H 2.306 -3.021 0.793 1.00 . A A . 14 LEU HA 1 1 22 9359 1 1 14 LEU HB2 H 0.030 -3.358 -0.481 1.00 . A A . 14 LEU HB2 1 1 22 9360 1 1 14 LEU HB3 H 0.855 -2.515 -1.792 1.00 . A A . 14 LEU HB3 1 1 22 9361 1 1 14 LEU HD11 H 2.366 -5.019 0.676 1.00 . A A . 14 LEU HD11 1 1 22 9362 1 1 14 LEU HD12 H 2.027 -6.357 -0.421 1.00 . A A . 14 LEU HD12 1 1 22 9363 1 1 14 LEU HD13 H 0.698 -5.449 0.298 1.00 . A A . 14 LEU HD13 1 1 22 9364 1 1 14 LEU HD21 H 1.683 -5.783 -2.934 1.00 . A A . 14 LEU HD21 1 1 22 9365 1 1 14 LEU HD22 H 0.761 -4.303 -3.201 1.00 . A A . 14 LEU HD22 1 1 22 9366 1 1 14 LEU HD23 H 0.123 -5.562 -2.142 1.00 . A A . 14 LEU HD23 1 1 22 9367 1 1 14 LEU HG H 2.746 -4.185 -1.543 1.00 . A A . 14 LEU HG 1 1 22 9368 1 1 14 LEU N N 0.846 -1.481 0.862 1.00 . A A . 14 LEU N 1 1 22 9369 1 1 14 LEU O O 4.041 -1.798 -0.611 1.00 . A A . 14 LEU O 1 1 22 9370 1 1 15 VAL C C 4.406 1.144 -0.797 1.00 . A A . 15 VAL C 1 1 22 9371 1 1 15 VAL CA C 3.434 0.551 -1.827 1.00 . A A . 15 VAL CA 1 1 22 9372 1 1 15 VAL CB C 2.583 1.655 -2.472 1.00 . A A . 15 VAL CB 1 1 22 9373 1 1 15 VAL CG1 C 3.484 2.803 -2.943 1.00 . A A . 15 VAL CG1 1 1 22 9374 1 1 15 VAL CG2 C 1.831 1.084 -3.678 1.00 . A A . 15 VAL CG2 1 1 22 9375 1 1 15 VAL H H 1.513 -0.110 -1.088 1.00 . A A . 15 VAL H 1 1 22 9376 1 1 15 VAL HA H 3.977 0.010 -2.586 1.00 . A A . 15 VAL HA 1 1 22 9377 1 1 15 VAL HB H 1.874 2.031 -1.749 1.00 . A A . 15 VAL HB 1 1 22 9378 1 1 15 VAL HG11 H 2.948 3.413 -3.655 1.00 . A A . 15 VAL HG11 1 1 22 9379 1 1 15 VAL HG12 H 4.369 2.397 -3.412 1.00 . A A . 15 VAL HG12 1 1 22 9380 1 1 15 VAL HG13 H 3.771 3.407 -2.095 1.00 . A A . 15 VAL HG13 1 1 22 9381 1 1 15 VAL HG21 H 1.144 1.826 -4.058 1.00 . A A . 15 VAL HG21 1 1 22 9382 1 1 15 VAL HG22 H 1.280 0.206 -3.376 1.00 . A A . 15 VAL HG22 1 1 22 9383 1 1 15 VAL HG23 H 2.537 0.818 -4.450 1.00 . A A . 15 VAL HG23 1 1 22 9384 1 1 15 VAL N N 2.461 -0.354 -1.136 1.00 . A A . 15 VAL N 1 1 22 9385 1 1 15 VAL O O 5.594 1.233 -1.034 1.00 . A A . 15 VAL O 1 1 22 9386 1 1 16 PHE C C 5.839 1.114 1.855 1.00 . A A . 16 PHE C 1 1 22 9387 1 1 16 PHE CA C 4.784 2.134 1.404 1.00 . A A . 16 PHE CA 1 1 22 9388 1 1 16 PHE CB C 3.846 2.487 2.564 1.00 . A A . 16 PHE CB 1 1 22 9389 1 1 16 PHE CD1 C 2.836 4.650 1.748 1.00 . A A . 16 PHE CD1 1 1 22 9390 1 1 16 PHE CD2 C 4.385 4.715 3.612 1.00 . A A . 16 PHE CD2 1 1 22 9391 1 1 16 PHE CE1 C 2.689 6.041 1.821 1.00 . A A . 16 PHE CE1 1 1 22 9392 1 1 16 PHE CE2 C 4.237 6.106 3.686 1.00 . A A . 16 PHE CE2 1 1 22 9393 1 1 16 PHE CG C 3.684 3.987 2.643 1.00 . A A . 16 PHE CG 1 1 22 9394 1 1 16 PHE CZ C 3.389 6.768 2.791 1.00 . A A . 16 PHE CZ 1 1 22 9395 1 1 16 PHE H H 2.937 1.459 0.510 1.00 . A A . 16 PHE H 1 1 22 9396 1 1 16 PHE HA H 5.263 3.027 1.035 1.00 . A A . 16 PHE HA 1 1 22 9397 1 1 16 PHE HB2 H 2.881 2.028 2.402 1.00 . A A . 16 PHE HB2 1 1 22 9398 1 1 16 PHE HB3 H 4.267 2.123 3.490 1.00 . A A . 16 PHE HB3 1 1 22 9399 1 1 16 PHE HD1 H 2.295 4.089 1.000 1.00 . A A . 16 PHE HD1 1 1 22 9400 1 1 16 PHE HD2 H 5.040 4.205 4.303 1.00 . A A . 16 PHE HD2 1 1 22 9401 1 1 16 PHE HE1 H 2.035 6.552 1.131 1.00 . A A . 16 PHE HE1 1 1 22 9402 1 1 16 PHE HE2 H 4.778 6.667 4.433 1.00 . A A . 16 PHE HE2 1 1 22 9403 1 1 16 PHE HZ H 3.275 7.841 2.848 1.00 . A A . 16 PHE HZ 1 1 22 9404 1 1 16 PHE N N 3.901 1.546 0.346 1.00 . A A . 16 PHE N 1 1 22 9405 1 1 16 PHE O O 6.984 1.460 2.077 1.00 . A A . 16 PHE O 1 1 22 9406 1 1 17 GLY C C 7.552 -1.302 1.369 1.00 . A A . 17 GLY C 1 1 22 9407 1 1 17 GLY CA C 6.448 -1.177 2.421 1.00 . A A . 17 GLY CA 1 1 22 9408 1 1 17 GLY H H 4.535 -0.393 1.803 1.00 . A A . 17 GLY H 1 1 22 9409 1 1 17 GLY HA2 H 6.883 -0.889 3.368 1.00 . A A . 17 GLY HA2 1 1 22 9410 1 1 17 GLY HA3 H 5.947 -2.127 2.527 1.00 . A A . 17 GLY HA3 1 1 22 9411 1 1 17 GLY N N 5.465 -0.137 1.989 1.00 . A A . 17 GLY N 1 1 22 9412 1 1 17 GLY O O 8.725 -1.281 1.688 1.00 . A A . 17 GLY O 1 1 22 9413 1 1 18 GLU C C 8.984 -0.215 -1.080 1.00 . A A . 18 GLU C 1 1 22 9414 1 1 18 GLU CA C 8.219 -1.534 -0.956 1.00 . A A . 18 GLU CA 1 1 22 9415 1 1 18 GLU CB C 7.444 -1.846 -2.238 1.00 . A A . 18 GLU CB 1 1 22 9416 1 1 18 GLU CD C 6.157 -3.705 -3.319 1.00 . A A . 18 GLU CD 1 1 22 9417 1 1 18 GLU CG C 7.343 -3.365 -2.414 1.00 . A A . 18 GLU CG 1 1 22 9418 1 1 18 GLU H H 6.232 -1.427 -0.116 1.00 . A A . 18 GLU H 1 1 22 9419 1 1 18 GLU HA H 8.901 -2.334 -0.729 1.00 . A A . 18 GLU HA 1 1 22 9420 1 1 18 GLU HB2 H 6.451 -1.423 -2.173 1.00 . A A . 18 GLU HB2 1 1 22 9421 1 1 18 GLU HB3 H 7.961 -1.422 -3.085 1.00 . A A . 18 GLU HB3 1 1 22 9422 1 1 18 GLU HG2 H 8.254 -3.736 -2.861 1.00 . A A . 18 GLU HG2 1 1 22 9423 1 1 18 GLU HG3 H 7.202 -3.829 -1.449 1.00 . A A . 18 GLU HG3 1 1 22 9424 1 1 18 GLU N N 7.186 -1.420 0.118 1.00 . A A . 18 GLU N 1 1 22 9425 1 1 18 GLU O O 10.197 -0.202 -1.158 1.00 . A A . 18 GLU O 1 1 22 9426 1 1 18 GLU OE1 O 6.206 -3.354 -4.487 1.00 . A A . 18 GLU OE1 1 1 22 9427 1 1 18 GLU OE2 O 5.218 -4.315 -2.830 1.00 . A A . 18 GLU OE2 1 1 22 9428 1 1 19 ASN C C 9.954 2.374 -0.002 1.00 . A A . 19 ASN C 1 1 22 9429 1 1 19 ASN CA C 8.968 2.222 -1.165 1.00 . A A . 19 ASN CA 1 1 22 9430 1 1 19 ASN CB C 7.851 3.271 -1.060 1.00 . A A . 19 ASN CB 1 1 22 9431 1 1 19 ASN CG C 7.255 3.558 -2.446 1.00 . A A . 19 ASN CG 1 1 22 9432 1 1 19 ASN H H 7.308 0.847 -0.991 1.00 . A A . 19 ASN H 1 1 22 9433 1 1 19 ASN HA H 9.480 2.317 -2.106 1.00 . A A . 19 ASN HA 1 1 22 9434 1 1 19 ASN HB2 H 7.074 2.903 -0.405 1.00 . A A . 19 ASN HB2 1 1 22 9435 1 1 19 ASN HB3 H 8.258 4.185 -0.652 1.00 . A A . 19 ASN HB3 1 1 22 9436 1 1 19 ASN HD21 H 6.207 5.129 -1.829 1.00 . A A . 19 ASN HD21 1 1 22 9437 1 1 19 ASN HD22 H 6.054 4.756 -3.477 1.00 . A A . 19 ASN HD22 1 1 22 9438 1 1 19 ASN N N 8.284 0.892 -1.073 1.00 . A A . 19 ASN N 1 1 22 9439 1 1 19 ASN ND2 N 6.437 4.565 -2.596 1.00 . A A . 19 ASN ND2 1 1 22 9440 1 1 19 ASN O O 11.025 2.930 -0.151 1.00 . A A . 19 ASN O 1 1 22 9441 1 1 19 ASN OD1 O 7.535 2.860 -3.401 1.00 . A A . 19 ASN OD1 1 1 22 9442 1 1 20 GLY C C 11.653 0.979 2.177 1.00 . A A . 20 GLY C 1 1 22 9443 1 1 20 GLY CA C 10.490 1.961 2.338 1.00 . A A . 20 GLY CA 1 1 22 9444 1 1 20 GLY H H 8.725 1.423 1.232 1.00 . A A . 20 GLY H 1 1 22 9445 1 1 20 GLY HA2 H 10.874 2.968 2.422 1.00 . A A . 20 GLY HA2 1 1 22 9446 1 1 20 GLY HA3 H 9.933 1.711 3.229 1.00 . A A . 20 GLY HA3 1 1 22 9447 1 1 20 GLY N N 9.592 1.869 1.150 1.00 . A A . 20 GLY N 1 1 22 9448 1 1 20 GLY O O 12.801 1.338 2.361 1.00 . A A . 20 GLY O 1 1 22 9449 1 1 21 VAL C C 13.363 -0.875 0.463 1.00 . A A . 21 VAL C 1 1 22 9450 1 1 21 VAL CA C 12.472 -1.258 1.655 1.00 . A A . 21 VAL CA 1 1 22 9451 1 1 21 VAL CB C 11.765 -2.599 1.409 1.00 . A A . 21 VAL CB 1 1 22 9452 1 1 21 VAL CG1 C 12.771 -3.639 0.904 1.00 . A A . 21 VAL CG1 1 1 22 9453 1 1 21 VAL CG2 C 11.146 -3.095 2.720 1.00 . A A . 21 VAL CG2 1 1 22 9454 1 1 21 VAL H H 10.433 -0.525 1.681 1.00 . A A . 21 VAL H 1 1 22 9455 1 1 21 VAL HA H 13.064 -1.316 2.550 1.00 . A A . 21 VAL HA 1 1 22 9456 1 1 21 VAL HB H 10.988 -2.465 0.672 1.00 . A A . 21 VAL HB 1 1 22 9457 1 1 21 VAL HG11 H 13.682 -3.571 1.483 1.00 . A A . 21 VAL HG11 1 1 22 9458 1 1 21 VAL HG12 H 12.991 -3.452 -0.136 1.00 . A A . 21 VAL HG12 1 1 22 9459 1 1 21 VAL HG13 H 12.351 -4.628 1.011 1.00 . A A . 21 VAL HG13 1 1 22 9460 1 1 21 VAL HG21 H 10.242 -3.645 2.507 1.00 . A A . 21 VAL HG21 1 1 22 9461 1 1 21 VAL HG22 H 10.912 -2.249 3.350 1.00 . A A . 21 VAL HG22 1 1 22 9462 1 1 21 VAL HG23 H 11.848 -3.740 3.229 1.00 . A A . 21 VAL HG23 1 1 22 9463 1 1 21 VAL N N 11.370 -0.257 1.831 1.00 . A A . 21 VAL N 1 1 22 9464 1 1 21 VAL O O 14.543 -1.168 0.444 1.00 . A A . 21 VAL O 1 1 22 9465 1 1 22 PHE C C 14.759 1.124 -1.308 1.00 . A A . 22 PHE C 1 1 22 9466 1 1 22 PHE CA C 13.611 0.192 -1.720 1.00 . A A . 22 PHE CA 1 1 22 9467 1 1 22 PHE CB C 12.625 0.928 -2.635 1.00 . A A . 22 PHE CB 1 1 22 9468 1 1 22 PHE CD1 C 14.063 2.217 -4.257 1.00 . A A . 22 PHE CD1 1 1 22 9469 1 1 22 PHE CD2 C 12.975 0.189 -5.021 1.00 . A A . 22 PHE CD2 1 1 22 9470 1 1 22 PHE CE1 C 14.628 2.392 -5.527 1.00 . A A . 22 PHE CE1 1 1 22 9471 1 1 22 PHE CE2 C 13.539 0.365 -6.291 1.00 . A A . 22 PHE CE2 1 1 22 9472 1 1 22 PHE CG C 13.237 1.116 -4.005 1.00 . A A . 22 PHE CG 1 1 22 9473 1 1 22 PHE CZ C 14.366 1.466 -6.544 1.00 . A A . 22 PHE CZ 1 1 22 9474 1 1 22 PHE H H 11.853 0.005 -0.478 1.00 . A A . 22 PHE H 1 1 22 9475 1 1 22 PHE HA H 13.999 -0.674 -2.223 1.00 . A A . 22 PHE HA 1 1 22 9476 1 1 22 PHE HB2 H 11.718 0.349 -2.724 1.00 . A A . 22 PHE HB2 1 1 22 9477 1 1 22 PHE HB3 H 12.393 1.894 -2.210 1.00 . A A . 22 PHE HB3 1 1 22 9478 1 1 22 PHE HD1 H 14.266 2.932 -3.473 1.00 . A A . 22 PHE HD1 1 1 22 9479 1 1 22 PHE HD2 H 12.337 -0.661 -4.826 1.00 . A A . 22 PHE HD2 1 1 22 9480 1 1 22 PHE HE1 H 15.265 3.241 -5.721 1.00 . A A . 22 PHE HE1 1 1 22 9481 1 1 22 PHE HE2 H 13.338 -0.349 -7.075 1.00 . A A . 22 PHE HE2 1 1 22 9482 1 1 22 PHE HZ H 14.802 1.602 -7.522 1.00 . A A . 22 PHE HZ 1 1 22 9483 1 1 22 PHE N N 12.806 -0.219 -0.525 1.00 . A A . 22 PHE N 1 1 22 9484 1 1 22 PHE O O 15.816 1.118 -1.908 1.00 . A A . 22 PHE O 1 1 22 9485 1 1 23 PHE C C 16.195 2.395 1.518 1.00 . A A . 23 PHE C 1 1 22 9486 1 1 23 PHE CA C 15.640 2.850 0.164 1.00 . A A . 23 PHE CA 1 1 22 9487 1 1 23 PHE CB C 14.971 4.226 0.274 1.00 . A A . 23 PHE CB 1 1 22 9488 1 1 23 PHE CD1 C 15.663 5.190 -1.956 1.00 . A A . 23 PHE CD1 1 1 22 9489 1 1 23 PHE CD2 C 13.310 4.779 -1.543 1.00 . A A . 23 PHE CD2 1 1 22 9490 1 1 23 PHE CE1 C 15.355 5.668 -3.235 1.00 . A A . 23 PHE CE1 1 1 22 9491 1 1 23 PHE CE2 C 13.002 5.256 -2.821 1.00 . A A . 23 PHE CE2 1 1 22 9492 1 1 23 PHE CG C 14.640 4.745 -1.108 1.00 . A A . 23 PHE CG 1 1 22 9493 1 1 23 PHE CZ C 14.024 5.701 -3.668 1.00 . A A . 23 PHE CZ 1 1 22 9494 1 1 23 PHE H H 13.699 1.904 0.179 1.00 . A A . 23 PHE H 1 1 22 9495 1 1 23 PHE HA H 16.430 2.885 -0.564 1.00 . A A . 23 PHE HA 1 1 22 9496 1 1 23 PHE HB2 H 14.064 4.141 0.852 1.00 . A A . 23 PHE HB2 1 1 22 9497 1 1 23 PHE HB3 H 15.645 4.916 0.762 1.00 . A A . 23 PHE HB3 1 1 22 9498 1 1 23 PHE HD1 H 16.690 5.165 -1.623 1.00 . A A . 23 PHE HD1 1 1 22 9499 1 1 23 PHE HD2 H 12.521 4.436 -0.891 1.00 . A A . 23 PHE HD2 1 1 22 9500 1 1 23 PHE HE1 H 16.143 6.011 -3.889 1.00 . A A . 23 PHE HE1 1 1 22 9501 1 1 23 PHE HE2 H 11.975 5.282 -3.155 1.00 . A A . 23 PHE HE2 1 1 22 9502 1 1 23 PHE HZ H 13.785 6.070 -4.655 1.00 . A A . 23 PHE HZ 1 1 22 9503 1 1 23 PHE N N 14.560 1.920 -0.289 1.00 . A A . 23 PHE N 1 1 22 9504 1 1 23 PHE O O 17.276 1.842 1.596 1.00 . A A . 23 PHE O 1 1 22 9505 1 1 24 TYR C C 17.324 2.738 4.253 1.00 . A A . 24 TYR C 1 1 22 9506 1 1 24 TYR CA C 15.913 2.201 3.949 1.00 . A A . 24 TYR CA 1 1 22 9507 1 1 24 TYR CB C 15.905 0.668 3.917 1.00 . A A . 24 TYR CB 1 1 22 9508 1 1 24 TYR CD1 C 15.862 0.003 6.350 1.00 . A A . 24 TYR CD1 1 1 22 9509 1 1 24 TYR CD2 C 13.831 -0.217 5.044 1.00 . A A . 24 TYR CD2 1 1 22 9510 1 1 24 TYR CE1 C 15.191 -0.488 7.476 1.00 . A A . 24 TYR CE1 1 1 22 9511 1 1 24 TYR CE2 C 13.160 -0.707 6.169 1.00 . A A . 24 TYR CE2 1 1 22 9512 1 1 24 TYR CG C 15.181 0.139 5.133 1.00 . A A . 24 TYR CG 1 1 22 9513 1 1 24 TYR CZ C 13.840 -0.842 7.386 1.00 . A A . 24 TYR CZ 1 1 22 9514 1 1 24 TYR H H 14.590 3.060 2.476 1.00 . A A . 24 TYR H 1 1 22 9515 1 1 24 TYR HA H 15.216 2.552 4.694 1.00 . A A . 24 TYR HA 1 1 22 9516 1 1 24 TYR HB2 H 15.400 0.331 3.025 1.00 . A A . 24 TYR HB2 1 1 22 9517 1 1 24 TYR HB3 H 16.920 0.301 3.915 1.00 . A A . 24 TYR HB3 1 1 22 9518 1 1 24 TYR HD1 H 16.905 0.277 6.420 1.00 . A A . 24 TYR HD1 1 1 22 9519 1 1 24 TYR HD2 H 13.306 -0.112 4.106 1.00 . A A . 24 TYR HD2 1 1 22 9520 1 1 24 TYR HE1 H 15.715 -0.591 8.415 1.00 . A A . 24 TYR HE1 1 1 22 9521 1 1 24 TYR HE2 H 12.118 -0.981 6.100 1.00 . A A . 24 TYR HE2 1 1 22 9522 1 1 24 TYR HH H 13.076 -2.275 8.392 1.00 . A A . 24 TYR HH 1 1 22 9523 1 1 24 TYR N N 15.456 2.619 2.581 1.00 . A A . 24 TYR N 1 1 22 9524 1 1 24 TYR O O 18.130 2.066 4.870 1.00 . A A . 24 TYR O 1 1 22 9525 1 1 24 TYR OH O 13.179 -1.326 8.497 1.00 . A A . 24 TYR OH 1 1 22 9526 1 1 25 LYS C C 20.084 3.626 3.579 1.00 . A A . 25 LYS C 1 1 22 9527 1 1 25 LYS CA C 18.964 4.559 4.082 1.00 . A A . 25 LYS CA 1 1 22 9528 1 1 25 LYS CB C 19.037 4.764 5.604 1.00 . A A . 25 LYS CB 1 1 22 9529 1 1 25 LYS CD C 18.806 6.486 7.407 1.00 . A A . 25 LYS CD 1 1 22 9530 1 1 25 LYS CE C 19.032 7.997 7.506 1.00 . A A . 25 LYS CE 1 1 22 9531 1 1 25 LYS CG C 18.421 6.117 5.970 1.00 . A A . 25 LYS CG 1 1 22 9532 1 1 25 LYS H H 16.940 4.464 3.340 1.00 . A A . 25 LYS H 1 1 22 9533 1 1 25 LYS HA H 19.034 5.513 3.584 1.00 . A A . 25 LYS HA 1 1 22 9534 1 1 25 LYS HB2 H 18.493 3.974 6.102 1.00 . A A . 25 LYS HB2 1 1 22 9535 1 1 25 LYS HB3 H 20.069 4.744 5.921 1.00 . A A . 25 LYS HB3 1 1 22 9536 1 1 25 LYS HD2 H 18.010 6.194 8.077 1.00 . A A . 25 LYS HD2 1 1 22 9537 1 1 25 LYS HD3 H 19.714 5.969 7.680 1.00 . A A . 25 LYS HD3 1 1 22 9538 1 1 25 LYS HE2 H 19.893 8.286 6.918 1.00 . A A . 25 LYS HE2 1 1 22 9539 1 1 25 LYS HE3 H 18.154 8.531 7.174 1.00 . A A . 25 LYS HE3 1 1 22 9540 1 1 25 LYS HG2 H 18.789 6.874 5.292 1.00 . A A . 25 LYS HG2 1 1 22 9541 1 1 25 LYS HG3 H 17.346 6.056 5.892 1.00 . A A . 25 LYS HG3 1 1 22 9542 1 1 25 LYS HZ1 H 20.106 7.724 9.272 1.00 . A A . 25 LYS HZ1 1 1 22 9543 1 1 25 LYS HZ2 H 18.440 7.974 9.504 1.00 . A A . 25 LYS HZ2 1 1 22 9544 1 1 25 LYS HZ3 H 19.449 9.278 9.095 1.00 . A A . 25 LYS HZ3 1 1 22 9545 1 1 25 LYS N N 17.615 3.950 3.829 1.00 . A A . 25 LYS N 1 1 22 9546 1 1 25 LYS NZ N 19.275 8.263 8.954 1.00 . A A . 25 LYS NZ 1 1 22 9547 1 1 25 LYS O O 20.127 3.387 2.383 1.00 . A A . 25 LYS O 1 1 22 9548 1 1 25 LYS OXT O 20.878 3.170 4.390 1.00 . A A . 25 LYS OXT 1 1 23 9549 1 1 1 HIS C C -19.422 3.426 -4.605 1.00 . A A . 1 HIS C 1 1 23 9550 1 1 1 HIS CA C -19.541 4.937 -4.844 1.00 . A A . 1 HIS CA 1 1 23 9551 1 1 1 HIS CB C -18.800 5.339 -6.125 1.00 . A A . 1 HIS CB 1 1 23 9552 1 1 1 HIS CD2 C -20.533 6.941 -7.283 1.00 . A A . 1 HIS CD2 1 1 23 9553 1 1 1 HIS CE1 C -19.425 8.794 -7.092 1.00 . A A . 1 HIS CE1 1 1 23 9554 1 1 1 HIS CG C -19.355 6.637 -6.646 1.00 . A A . 1 HIS CG 1 1 23 9555 1 1 1 HIS HA H -20.579 5.223 -4.915 1.00 . A A . 1 HIS HA 1 1 23 9556 1 1 1 HIS HB2 H -17.748 5.457 -5.911 1.00 . A A . 1 HIS HB2 1 1 23 9557 1 1 1 HIS HB3 H -18.930 4.569 -6.871 1.00 . A A . 1 HIS HB3 1 1 23 9558 1 1 1 HIS HD1 H -17.781 7.957 -6.127 1.00 . A A . 1 HIS HD1 1 1 23 9559 1 1 1 HIS HD2 H -21.308 6.232 -7.528 1.00 . A A . 1 HIS HD2 1 1 23 9560 1 1 1 HIS HE1 H -19.139 9.833 -7.151 1.00 . A A . 1 HIS HE1 1 1 23 9561 1 1 1 HIS N N -18.869 5.693 -3.742 1.00 . A A . 1 HIS N 1 1 23 9562 1 1 1 HIS ND1 N -18.664 7.833 -6.534 1.00 . A A . 1 HIS ND1 1 1 23 9563 1 1 1 HIS NE2 N -20.574 8.304 -7.563 1.00 . A A . 1 HIS NE2 1 1 23 9564 1 1 1 HIS O O -20.411 2.745 -4.414 1.00 . A A . 1 HIS O 1 1 23 9565 1 1 2 ALA C C -17.363 1.177 -3.031 1.00 . A A . 2 ALA C 1 1 23 9566 1 1 2 ALA CA C -18.036 1.432 -4.387 1.00 . A A . 2 ALA CA 1 1 23 9567 1 1 2 ALA CB C -17.133 0.967 -5.532 1.00 . A A . 2 ALA CB 1 1 23 9568 1 1 2 ALA H H -17.438 3.470 -4.768 1.00 . A A . 2 ALA H 1 1 23 9569 1 1 2 ALA HA H -18.984 0.921 -4.438 1.00 . A A . 2 ALA HA 1 1 23 9570 1 1 2 ALA HB1 H -16.292 1.639 -5.624 1.00 . A A . 2 ALA HB1 1 1 23 9571 1 1 2 ALA HB2 H -17.694 0.963 -6.455 1.00 . A A . 2 ALA HB2 1 1 23 9572 1 1 2 ALA HB3 H -16.774 -0.031 -5.325 1.00 . A A . 2 ALA HB3 1 1 23 9573 1 1 2 ALA N N -18.220 2.899 -4.613 1.00 . A A . 2 ALA N 1 1 23 9574 1 1 2 ALA O O -16.894 2.094 -2.379 1.00 . A A . 2 ALA O 1 1 23 9575 1 1 3 TRP C C -15.190 -0.741 -1.499 1.00 . A A . 3 TRP C 1 1 23 9576 1 1 3 TRP CA C -16.671 -0.384 -1.294 1.00 . A A . 3 TRP CA 1 1 23 9577 1 1 3 TRP CB C -17.457 -1.584 -0.748 1.00 . A A . 3 TRP CB 1 1 23 9578 1 1 3 TRP CD1 C -19.729 -0.741 -0.026 1.00 . A A . 3 TRP CD1 1 1 23 9579 1 1 3 TRP CD2 C -18.294 -0.938 1.694 1.00 . A A . 3 TRP CD2 1 1 23 9580 1 1 3 TRP CE2 C -19.511 -0.462 2.234 1.00 . A A . 3 TRP CE2 1 1 23 9581 1 1 3 TRP CE3 C -17.216 -1.151 2.573 1.00 . A A . 3 TRP CE3 1 1 23 9582 1 1 3 TRP CG C -18.458 -1.107 0.257 1.00 . A A . 3 TRP CG 1 1 23 9583 1 1 3 TRP CH2 C -18.574 -0.422 4.457 1.00 . A A . 3 TRP CH2 1 1 23 9584 1 1 3 TRP CZ2 C -19.654 -0.205 3.599 1.00 . A A . 3 TRP CZ2 1 1 23 9585 1 1 3 TRP CZ3 C -17.357 -0.894 3.946 1.00 . A A . 3 TRP CZ3 1 1 23 9586 1 1 3 TRP H H -17.695 -0.781 -3.152 1.00 . A A . 3 TRP H 1 1 23 9587 1 1 3 TRP HA H -16.762 0.452 -0.617 1.00 . A A . 3 TRP HA 1 1 23 9588 1 1 3 TRP HB2 H -17.969 -2.079 -1.560 1.00 . A A . 3 TRP HB2 1 1 23 9589 1 1 3 TRP HB3 H -16.777 -2.276 -0.276 1.00 . A A . 3 TRP HB3 1 1 23 9590 1 1 3 TRP HD1 H -20.182 -0.746 -1.006 1.00 . A A . 3 TRP HD1 1 1 23 9591 1 1 3 TRP HE1 H -21.281 -0.046 1.217 1.00 . A A . 3 TRP HE1 1 1 23 9592 1 1 3 TRP HE3 H -16.275 -1.515 2.188 1.00 . A A . 3 TRP HE3 1 1 23 9593 1 1 3 TRP HH2 H -18.676 -0.225 5.514 1.00 . A A . 3 TRP HH2 1 1 23 9594 1 1 3 TRP HZ2 H -20.594 0.159 3.988 1.00 . A A . 3 TRP HZ2 1 1 23 9595 1 1 3 TRP HZ3 H -16.522 -1.060 4.611 1.00 . A A . 3 TRP HZ3 1 1 23 9596 1 1 3 TRP N N -17.312 -0.062 -2.606 1.00 . A A . 3 TRP N 1 1 23 9597 1 1 3 TRP NE1 N -20.355 -0.356 1.147 1.00 . A A . 3 TRP NE1 1 1 23 9598 1 1 3 TRP O O -14.778 -1.874 -1.327 1.00 . A A . 3 TRP O 1 1 23 9599 1 1 4 TYR C C -12.076 0.618 -0.974 1.00 . A A . 4 TYR C 1 1 23 9600 1 1 4 TYR CA C -12.928 -0.037 -2.076 1.00 . A A . 4 TYR CA 1 1 23 9601 1 1 4 TYR CB C -12.601 0.563 -3.455 1.00 . A A . 4 TYR CB 1 1 23 9602 1 1 4 TYR CD1 C -11.685 2.873 -2.982 1.00 . A A . 4 TYR CD1 1 1 23 9603 1 1 4 TYR CD2 C -13.939 2.671 -3.853 1.00 . A A . 4 TYR CD2 1 1 23 9604 1 1 4 TYR CE1 C -11.817 4.265 -2.960 1.00 . A A . 4 TYR CE1 1 1 23 9605 1 1 4 TYR CE2 C -14.071 4.065 -3.830 1.00 . A A . 4 TYR CE2 1 1 23 9606 1 1 4 TYR CG C -12.745 2.073 -3.428 1.00 . A A . 4 TYR CG 1 1 23 9607 1 1 4 TYR CZ C -13.011 4.861 -3.383 1.00 . A A . 4 TYR CZ 1 1 23 9608 1 1 4 TYR H H -14.741 1.134 -1.985 1.00 . A A . 4 TYR H 1 1 23 9609 1 1 4 TYR HA H -12.747 -1.100 -2.094 1.00 . A A . 4 TYR HA 1 1 23 9610 1 1 4 TYR HB2 H -11.587 0.308 -3.723 1.00 . A A . 4 TYR HB2 1 1 23 9611 1 1 4 TYR HB3 H -13.278 0.153 -4.190 1.00 . A A . 4 TYR HB3 1 1 23 9612 1 1 4 TYR HD1 H -10.764 2.413 -2.654 1.00 . A A . 4 TYR HD1 1 1 23 9613 1 1 4 TYR HD2 H -14.758 2.057 -4.198 1.00 . A A . 4 TYR HD2 1 1 23 9614 1 1 4 TYR HE1 H -11.000 4.880 -2.615 1.00 . A A . 4 TYR HE1 1 1 23 9615 1 1 4 TYR HE2 H -14.992 4.525 -4.157 1.00 . A A . 4 TYR HE2 1 1 23 9616 1 1 4 TYR HH H -13.223 6.543 -4.266 1.00 . A A . 4 TYR HH 1 1 23 9617 1 1 4 TYR N N -14.387 0.229 -1.861 1.00 . A A . 4 TYR N 1 1 23 9618 1 1 4 TYR O O -10.865 0.689 -1.083 1.00 . A A . 4 TYR O 1 1 23 9619 1 1 4 TYR OH O -13.141 6.236 -3.360 1.00 . A A . 4 TYR OH 1 1 23 9620 1 1 5 SER C C -10.860 0.767 1.748 1.00 . A A . 5 SER C 1 1 23 9621 1 1 5 SER CA C -11.914 1.734 1.197 1.00 . A A . 5 SER CA 1 1 23 9622 1 1 5 SER CB C -12.945 2.074 2.275 1.00 . A A . 5 SER CB 1 1 23 9623 1 1 5 SER H H -13.668 1.016 0.159 1.00 . A A . 5 SER H 1 1 23 9624 1 1 5 SER HA H -11.444 2.633 0.845 1.00 . A A . 5 SER HA 1 1 23 9625 1 1 5 SER HB2 H -13.760 2.625 1.837 1.00 . A A . 5 SER HB2 1 1 23 9626 1 1 5 SER HB3 H -13.325 1.159 2.710 1.00 . A A . 5 SER HB3 1 1 23 9627 1 1 5 SER HG H -11.716 2.315 3.769 1.00 . A A . 5 SER HG 1 1 23 9628 1 1 5 SER N N -12.694 1.089 0.089 1.00 . A A . 5 SER N 1 1 23 9629 1 1 5 SER O O -9.781 1.168 2.141 1.00 . A A . 5 SER O 1 1 23 9630 1 1 5 SER OG O -12.329 2.871 3.280 1.00 . A A . 5 SER OG 1 1 23 9631 1 1 6 HIS C C -9.208 -1.884 1.154 1.00 . A A . 6 HIS C 1 1 23 9632 1 1 6 HIS CA C -10.174 -1.500 2.276 1.00 . A A . 6 HIS CA 1 1 23 9633 1 1 6 HIS CB C -11.003 -2.708 2.726 1.00 . A A . 6 HIS CB 1 1 23 9634 1 1 6 HIS CD2 C -10.910 -3.357 5.271 1.00 . A A . 6 HIS CD2 1 1 23 9635 1 1 6 HIS CE1 C -12.158 -1.768 6.050 1.00 . A A . 6 HIS CE1 1 1 23 9636 1 1 6 HIS CG C -11.299 -2.595 4.197 1.00 . A A . 6 HIS CG 1 1 23 9637 1 1 6 HIS H H -12.034 -0.800 1.437 1.00 . A A . 6 HIS H 1 1 23 9638 1 1 6 HIS HA H -9.628 -1.092 3.107 1.00 . A A . 6 HIS HA 1 1 23 9639 1 1 6 HIS HB2 H -11.931 -2.735 2.174 1.00 . A A . 6 HIS HB2 1 1 23 9640 1 1 6 HIS HB3 H -10.447 -3.615 2.540 1.00 . A A . 6 HIS HB3 1 1 23 9641 1 1 6 HIS HD1 H -12.533 -0.872 4.210 1.00 . A A . 6 HIS HD1 1 1 23 9642 1 1 6 HIS HD2 H -10.278 -4.231 5.216 1.00 . A A . 6 HIS HD2 1 1 23 9643 1 1 6 HIS HE1 H -12.712 -1.130 6.723 1.00 . A A . 6 HIS HE1 1 1 23 9644 1 1 6 HIS N N -11.163 -0.503 1.768 1.00 . A A . 6 HIS N 1 1 23 9645 1 1 6 HIS ND1 N -12.095 -1.587 4.719 1.00 . A A . 6 HIS ND1 1 1 23 9646 1 1 6 HIS NE2 N -11.453 -2.833 6.440 1.00 . A A . 6 HIS NE2 1 1 23 9647 1 1 6 HIS O O -8.036 -2.111 1.387 1.00 . A A . 6 HIS O 1 1 23 9648 1 1 7 TYR C C -7.731 -1.214 -1.387 1.00 . A A . 7 TYR C 1 1 23 9649 1 1 7 TYR CA C -8.800 -2.294 -1.212 1.00 . A A . 7 TYR CA 1 1 23 9650 1 1 7 TYR CB C -9.715 -2.350 -2.440 1.00 . A A . 7 TYR CB 1 1 23 9651 1 1 7 TYR CD1 C -9.499 -4.792 -3.030 1.00 . A A . 7 TYR CD1 1 1 23 9652 1 1 7 TYR CD2 C -11.644 -3.964 -2.260 1.00 . A A . 7 TYR CD2 1 1 23 9653 1 1 7 TYR CE1 C -10.041 -6.076 -3.161 1.00 . A A . 7 TYR CE1 1 1 23 9654 1 1 7 TYR CE2 C -12.186 -5.248 -2.391 1.00 . A A . 7 TYR CE2 1 1 23 9655 1 1 7 TYR CG C -10.300 -3.736 -2.579 1.00 . A A . 7 TYR CG 1 1 23 9656 1 1 7 TYR CZ C -11.385 -6.304 -2.842 1.00 . A A . 7 TYR CZ 1 1 23 9657 1 1 7 TYR H H -10.635 -1.741 -0.219 1.00 . A A . 7 TYR H 1 1 23 9658 1 1 7 TYR HA H -8.337 -3.248 -1.047 1.00 . A A . 7 TYR HA 1 1 23 9659 1 1 7 TYR HB2 H -10.514 -1.631 -2.327 1.00 . A A . 7 TYR HB2 1 1 23 9660 1 1 7 TYR HB3 H -9.143 -2.112 -3.325 1.00 . A A . 7 TYR HB3 1 1 23 9661 1 1 7 TYR HD1 H -8.462 -4.616 -3.275 1.00 . A A . 7 TYR HD1 1 1 23 9662 1 1 7 TYR HD2 H -12.263 -3.149 -1.911 1.00 . A A . 7 TYR HD2 1 1 23 9663 1 1 7 TYR HE1 H -9.423 -6.891 -3.508 1.00 . A A . 7 TYR HE1 1 1 23 9664 1 1 7 TYR HE2 H -13.223 -5.424 -2.145 1.00 . A A . 7 TYR HE2 1 1 23 9665 1 1 7 TYR HH H -11.927 -7.978 -2.103 1.00 . A A . 7 TYR HH 1 1 23 9666 1 1 7 TYR N N -9.690 -1.941 -0.063 1.00 . A A . 7 TYR N 1 1 23 9667 1 1 7 TYR O O -6.558 -1.509 -1.524 1.00 . A A . 7 TYR O 1 1 23 9668 1 1 7 TYR OH O -11.920 -7.569 -2.971 1.00 . A A . 7 TYR OH 1 1 23 9669 1 1 8 VAL C C -6.167 1.123 -0.308 1.00 . A A . 8 VAL C 1 1 23 9670 1 1 8 VAL CA C -7.133 1.139 -1.503 1.00 . A A . 8 VAL CA 1 1 23 9671 1 1 8 VAL CB C -7.957 2.438 -1.548 1.00 . A A . 8 VAL CB 1 1 23 9672 1 1 8 VAL CG1 C -8.531 2.754 -0.164 1.00 . A A . 8 VAL CG1 1 1 23 9673 1 1 8 VAL CG2 C -7.060 3.596 -1.999 1.00 . A A . 8 VAL CG2 1 1 23 9674 1 1 8 VAL H H -9.078 0.236 -1.233 1.00 . A A . 8 VAL H 1 1 23 9675 1 1 8 VAL HA H -6.583 1.022 -2.420 1.00 . A A . 8 VAL HA 1 1 23 9676 1 1 8 VAL HB H -8.769 2.320 -2.251 1.00 . A A . 8 VAL HB 1 1 23 9677 1 1 8 VAL HG11 H -9.281 3.526 -0.253 1.00 . A A . 8 VAL HG11 1 1 23 9678 1 1 8 VAL HG12 H -7.739 3.096 0.486 1.00 . A A . 8 VAL HG12 1 1 23 9679 1 1 8 VAL HG13 H -8.978 1.864 0.251 1.00 . A A . 8 VAL HG13 1 1 23 9680 1 1 8 VAL HG21 H -6.296 3.769 -1.256 1.00 . A A . 8 VAL HG21 1 1 23 9681 1 1 8 VAL HG22 H -7.657 4.488 -2.118 1.00 . A A . 8 VAL HG22 1 1 23 9682 1 1 8 VAL HG23 H -6.596 3.345 -2.941 1.00 . A A . 8 VAL HG23 1 1 23 9683 1 1 8 VAL N N -8.127 0.033 -1.361 1.00 . A A . 8 VAL N 1 1 23 9684 1 1 8 VAL O O -5.023 1.516 -0.421 1.00 . A A . 8 VAL O 1 1 23 9685 1 1 9 LEU C C -4.683 -0.531 1.825 1.00 . A A . 9 LEU C 1 1 23 9686 1 1 9 LEU CA C -5.729 0.574 2.024 1.00 . A A . 9 LEU CA 1 1 23 9687 1 1 9 LEU CB C -6.656 0.236 3.197 1.00 . A A . 9 LEU CB 1 1 23 9688 1 1 9 LEU CD1 C -6.040 2.131 4.710 1.00 . A A . 9 LEU CD1 1 1 23 9689 1 1 9 LEU CD2 C -6.702 -0.077 5.675 1.00 . A A . 9 LEU CD2 1 1 23 9690 1 1 9 LEU CG C -5.978 0.614 4.516 1.00 . A A . 9 LEU CG 1 1 23 9691 1 1 9 LEU H H -7.541 0.318 0.886 1.00 . A A . 9 LEU H 1 1 23 9692 1 1 9 LEU HA H -5.247 1.524 2.194 1.00 . A A . 9 LEU HA 1 1 23 9693 1 1 9 LEU HB2 H -7.579 0.787 3.095 1.00 . A A . 9 LEU HB2 1 1 23 9694 1 1 9 LEU HB3 H -6.867 -0.823 3.194 1.00 . A A . 9 LEU HB3 1 1 23 9695 1 1 9 LEU HD11 H -7.055 2.472 4.568 1.00 . A A . 9 LEU HD11 1 1 23 9696 1 1 9 LEU HD12 H -5.395 2.613 3.990 1.00 . A A . 9 LEU HD12 1 1 23 9697 1 1 9 LEU HD13 H -5.713 2.380 5.709 1.00 . A A . 9 LEU HD13 1 1 23 9698 1 1 9 LEU HD21 H -6.332 -1.086 5.780 1.00 . A A . 9 LEU HD21 1 1 23 9699 1 1 9 LEU HD22 H -7.763 -0.102 5.475 1.00 . A A . 9 LEU HD22 1 1 23 9700 1 1 9 LEU HD23 H -6.521 0.468 6.590 1.00 . A A . 9 LEU HD23 1 1 23 9701 1 1 9 LEU HG H -4.946 0.296 4.494 1.00 . A A . 9 LEU HG 1 1 23 9702 1 1 9 LEU N N -6.619 0.646 0.827 1.00 . A A . 9 LEU N 1 1 23 9703 1 1 9 LEU O O -3.543 -0.396 2.228 1.00 . A A . 9 LEU O 1 1 23 9704 1 1 10 LYS C C -3.018 -2.286 -0.036 1.00 . A A . 10 LYS C 1 1 23 9705 1 1 10 LYS CA C -4.093 -2.734 0.959 1.00 . A A . 10 LYS CA 1 1 23 9706 1 1 10 LYS CB C -4.925 -3.883 0.376 1.00 . A A . 10 LYS CB 1 1 23 9707 1 1 10 LYS CD C -6.029 -4.705 2.469 1.00 . A A . 10 LYS CD 1 1 23 9708 1 1 10 LYS CE C -5.362 -3.915 3.602 1.00 . A A . 10 LYS CE 1 1 23 9709 1 1 10 LYS CG C -4.995 -5.031 1.388 1.00 . A A . 10 LYS CG 1 1 23 9710 1 1 10 LYS H H -5.991 -1.704 0.875 1.00 . A A . 10 LYS H 1 1 23 9711 1 1 10 LYS HA H -3.639 -3.041 1.888 1.00 . A A . 10 LYS HA 1 1 23 9712 1 1 10 LYS HB2 H -5.924 -3.533 0.157 1.00 . A A . 10 LYS HB2 1 1 23 9713 1 1 10 LYS HB3 H -4.462 -4.237 -0.533 1.00 . A A . 10 LYS HB3 1 1 23 9714 1 1 10 LYS HD2 H -6.826 -4.115 2.039 1.00 . A A . 10 LYS HD2 1 1 23 9715 1 1 10 LYS HD3 H -6.436 -5.624 2.866 1.00 . A A . 10 LYS HD3 1 1 23 9716 1 1 10 LYS HE2 H -4.337 -4.239 3.731 1.00 . A A . 10 LYS HE2 1 1 23 9717 1 1 10 LYS HE3 H -5.399 -2.857 3.394 1.00 . A A . 10 LYS HE3 1 1 23 9718 1 1 10 LYS HG2 H -5.280 -5.940 0.879 1.00 . A A . 10 LYS HG2 1 1 23 9719 1 1 10 LYS HG3 H -4.026 -5.166 1.847 1.00 . A A . 10 LYS HG3 1 1 23 9720 1 1 10 LYS HZ1 H -5.714 -3.786 5.650 1.00 . A A . 10 LYS HZ1 1 1 23 9721 1 1 10 LYS HZ2 H -6.208 -5.255 4.955 1.00 . A A . 10 LYS HZ2 1 1 23 9722 1 1 10 LYS HZ3 H -7.125 -3.844 4.710 1.00 . A A . 10 LYS HZ3 1 1 23 9723 1 1 10 LYS N N -5.065 -1.621 1.197 1.00 . A A . 10 LYS N 1 1 23 9724 1 1 10 LYS NZ N -6.164 -4.224 4.820 1.00 . A A . 10 LYS NZ 1 1 23 9725 1 1 10 LYS O O -1.845 -2.548 0.149 1.00 . A A . 10 LYS O 1 1 23 9726 1 1 11 PHE C C -1.461 -0.105 -1.448 1.00 . A A . 11 PHE C 1 1 23 9727 1 1 11 PHE CA C -2.411 -1.124 -2.092 1.00 . A A . 11 PHE CA 1 1 23 9728 1 1 11 PHE CB C -3.237 -0.466 -3.202 1.00 . A A . 11 PHE CB 1 1 23 9729 1 1 11 PHE CD1 C -2.076 -1.387 -5.243 1.00 . A A . 11 PHE CD1 1 1 23 9730 1 1 11 PHE CD2 C -1.885 0.982 -4.762 1.00 . A A . 11 PHE CD2 1 1 23 9731 1 1 11 PHE CE1 C -1.280 -1.220 -6.383 1.00 . A A . 11 PHE CE1 1 1 23 9732 1 1 11 PHE CE2 C -1.090 1.149 -5.902 1.00 . A A . 11 PHE CE2 1 1 23 9733 1 1 11 PHE CG C -2.379 -0.286 -4.432 1.00 . A A . 11 PHE CG 1 1 23 9734 1 1 11 PHE CZ C -0.787 0.048 -6.712 1.00 . A A . 11 PHE CZ 1 1 23 9735 1 1 11 PHE H H -4.364 -1.397 -1.207 1.00 . A A . 11 PHE H 1 1 23 9736 1 1 11 PHE HA H -1.854 -1.957 -2.491 1.00 . A A . 11 PHE HA 1 1 23 9737 1 1 11 PHE HB2 H -4.084 -1.094 -3.441 1.00 . A A . 11 PHE HB2 1 1 23 9738 1 1 11 PHE HB3 H -3.589 0.498 -2.865 1.00 . A A . 11 PHE HB3 1 1 23 9739 1 1 11 PHE HD1 H -2.456 -2.365 -4.989 1.00 . A A . 11 PHE HD1 1 1 23 9740 1 1 11 PHE HD2 H -2.118 1.832 -4.137 1.00 . A A . 11 PHE HD2 1 1 23 9741 1 1 11 PHE HE1 H -1.047 -2.069 -7.008 1.00 . A A . 11 PHE HE1 1 1 23 9742 1 1 11 PHE HE2 H -0.709 2.128 -6.156 1.00 . A A . 11 PHE HE2 1 1 23 9743 1 1 11 PHE HZ H -0.174 0.177 -7.592 1.00 . A A . 11 PHE HZ 1 1 23 9744 1 1 11 PHE N N -3.411 -1.602 -1.085 1.00 . A A . 11 PHE N 1 1 23 9745 1 1 11 PHE O O -0.273 -0.109 -1.706 1.00 . A A . 11 PHE O 1 1 23 9746 1 1 12 PHE C C -0.072 1.074 0.952 1.00 . A A . 12 PHE C 1 1 23 9747 1 1 12 PHE CA C -1.105 1.776 0.063 1.00 . A A . 12 PHE CA 1 1 23 9748 1 1 12 PHE CB C -2.053 2.631 0.911 1.00 . A A . 12 PHE CB 1 1 23 9749 1 1 12 PHE CD1 C -3.162 3.939 -0.939 1.00 . A A . 12 PHE CD1 1 1 23 9750 1 1 12 PHE CD2 C -1.789 5.125 0.668 1.00 . A A . 12 PHE CD2 1 1 23 9751 1 1 12 PHE CE1 C -3.430 5.142 -1.601 1.00 . A A . 12 PHE CE1 1 1 23 9752 1 1 12 PHE CE2 C -2.056 6.330 0.006 1.00 . A A . 12 PHE CE2 1 1 23 9753 1 1 12 PHE CG C -2.342 3.930 0.195 1.00 . A A . 12 PHE CG 1 1 23 9754 1 1 12 PHE CZ C -2.876 6.338 -1.128 1.00 . A A . 12 PHE CZ 1 1 23 9755 1 1 12 PHE H H -2.939 0.738 -0.412 1.00 . A A . 12 PHE H 1 1 23 9756 1 1 12 PHE HA H -0.612 2.392 -0.673 1.00 . A A . 12 PHE HA 1 1 23 9757 1 1 12 PHE HB2 H -2.977 2.095 1.072 1.00 . A A . 12 PHE HB2 1 1 23 9758 1 1 12 PHE HB3 H -1.591 2.842 1.864 1.00 . A A . 12 PHE HB3 1 1 23 9759 1 1 12 PHE HD1 H -3.589 3.017 -1.305 1.00 . A A . 12 PHE HD1 1 1 23 9760 1 1 12 PHE HD2 H -1.155 5.119 1.543 1.00 . A A . 12 PHE HD2 1 1 23 9761 1 1 12 PHE HE1 H -4.062 5.149 -2.476 1.00 . A A . 12 PHE HE1 1 1 23 9762 1 1 12 PHE HE2 H -1.628 7.252 0.370 1.00 . A A . 12 PHE HE2 1 1 23 9763 1 1 12 PHE HZ H -3.082 7.267 -1.638 1.00 . A A . 12 PHE HZ 1 1 23 9764 1 1 12 PHE N N -1.977 0.761 -0.607 1.00 . A A . 12 PHE N 1 1 23 9765 1 1 12 PHE O O 1.096 1.415 0.942 1.00 . A A . 12 PHE O 1 1 23 9766 1 1 13 LEU C C 1.533 -1.339 1.745 1.00 . A A . 13 LEU C 1 1 23 9767 1 1 13 LEU CA C 0.456 -0.651 2.595 1.00 . A A . 13 LEU CA 1 1 23 9768 1 1 13 LEU CB C -0.402 -1.690 3.325 1.00 . A A . 13 LEU CB 1 1 23 9769 1 1 13 LEU CD1 C -0.342 -1.999 5.809 1.00 . A A . 13 LEU CD1 1 1 23 9770 1 1 13 LEU CD2 C 0.532 -3.794 4.306 1.00 . A A . 13 LEU CD2 1 1 23 9771 1 1 13 LEU CG C 0.392 -2.281 4.495 1.00 . A A . 13 LEU CG 1 1 23 9772 1 1 13 LEU H H -1.444 -0.166 1.689 1.00 . A A . 13 LEU H 1 1 23 9773 1 1 13 LEU HA H 0.909 0.021 3.307 1.00 . A A . 13 LEU HA 1 1 23 9774 1 1 13 LEU HB2 H -1.299 -1.216 3.699 1.00 . A A . 13 LEU HB2 1 1 23 9775 1 1 13 LEU HB3 H -0.672 -2.479 2.639 1.00 . A A . 13 LEU HB3 1 1 23 9776 1 1 13 LEU HD11 H 0.370 -1.980 6.622 1.00 . A A . 13 LEU HD11 1 1 23 9777 1 1 13 LEU HD12 H -1.072 -2.775 5.988 1.00 . A A . 13 LEU HD12 1 1 23 9778 1 1 13 LEU HD13 H -0.840 -1.043 5.745 1.00 . A A . 13 LEU HD13 1 1 23 9779 1 1 13 LEU HD21 H -0.448 -4.244 4.257 1.00 . A A . 13 LEU HD21 1 1 23 9780 1 1 13 LEU HD22 H 1.079 -4.213 5.138 1.00 . A A . 13 LEU HD22 1 1 23 9781 1 1 13 LEU HD23 H 1.066 -3.994 3.388 1.00 . A A . 13 LEU HD23 1 1 23 9782 1 1 13 LEU HG H 1.374 -1.830 4.529 1.00 . A A . 13 LEU HG 1 1 23 9783 1 1 13 LEU N N -0.497 0.090 1.709 1.00 . A A . 13 LEU N 1 1 23 9784 1 1 13 LEU O O 2.699 -1.339 2.091 1.00 . A A . 13 LEU O 1 1 23 9785 1 1 14 LEU C C 3.126 -1.565 -0.825 1.00 . A A . 14 LEU C 1 1 23 9786 1 1 14 LEU CA C 2.142 -2.595 -0.257 1.00 . A A . 14 LEU CA 1 1 23 9787 1 1 14 LEU CB C 1.313 -3.229 -1.380 1.00 . A A . 14 LEU CB 1 1 23 9788 1 1 14 LEU CD1 C 1.131 -5.514 -2.381 1.00 . A A . 14 LEU CD1 1 1 23 9789 1 1 14 LEU CD2 C 2.812 -3.891 -3.271 1.00 . A A . 14 LEU CD2 1 1 23 9790 1 1 14 LEU CG C 2.095 -4.384 -2.009 1.00 . A A . 14 LEU CG 1 1 23 9791 1 1 14 LEU H H 0.199 -1.891 0.372 1.00 . A A . 14 LEU H 1 1 23 9792 1 1 14 LEU HA H 2.670 -3.355 0.288 1.00 . A A . 14 LEU HA 1 1 23 9793 1 1 14 LEU HB2 H 0.382 -3.601 -0.973 1.00 . A A . 14 LEU HB2 1 1 23 9794 1 1 14 LEU HB3 H 1.103 -2.485 -2.134 1.00 . A A . 14 LEU HB3 1 1 23 9795 1 1 14 LEU HD11 H 1.694 -6.404 -2.621 1.00 . A A . 14 LEU HD11 1 1 23 9796 1 1 14 LEU HD12 H 0.542 -5.219 -3.237 1.00 . A A . 14 LEU HD12 1 1 23 9797 1 1 14 LEU HD13 H 0.476 -5.716 -1.545 1.00 . A A . 14 LEU HD13 1 1 23 9798 1 1 14 LEU HD21 H 2.565 -2.854 -3.443 1.00 . A A . 14 LEU HD21 1 1 23 9799 1 1 14 LEU HD22 H 2.497 -4.480 -4.119 1.00 . A A . 14 LEU HD22 1 1 23 9800 1 1 14 LEU HD23 H 3.879 -3.991 -3.140 1.00 . A A . 14 LEU HD23 1 1 23 9801 1 1 14 LEU HG H 2.823 -4.754 -1.301 1.00 . A A . 14 LEU HG 1 1 23 9802 1 1 14 LEU N N 1.146 -1.915 0.630 1.00 . A A . 14 LEU N 1 1 23 9803 1 1 14 LEU O O 4.318 -1.803 -0.899 1.00 . A A . 14 LEU O 1 1 23 9804 1 1 15 VAL C C 4.382 1.241 -0.661 1.00 . A A . 15 VAL C 1 1 23 9805 1 1 15 VAL CA C 3.515 0.644 -1.779 1.00 . A A . 15 VAL CA 1 1 23 9806 1 1 15 VAL CB C 2.559 1.698 -2.357 1.00 . A A . 15 VAL CB 1 1 23 9807 1 1 15 VAL CG1 C 3.326 2.984 -2.682 1.00 . A A . 15 VAL CG1 1 1 23 9808 1 1 15 VAL CG2 C 1.921 1.157 -3.641 1.00 . A A . 15 VAL CG2 1 1 23 9809 1 1 15 VAL H H 1.665 -0.263 -1.138 1.00 . A A . 15 VAL H 1 1 23 9810 1 1 15 VAL HA H 4.138 0.241 -2.561 1.00 . A A . 15 VAL HA 1 1 23 9811 1 1 15 VAL HB H 1.785 1.916 -1.635 1.00 . A A . 15 VAL HB 1 1 23 9812 1 1 15 VAL HG11 H 3.689 3.427 -1.766 1.00 . A A . 15 VAL HG11 1 1 23 9813 1 1 15 VAL HG12 H 2.669 3.679 -3.182 1.00 . A A . 15 VAL HG12 1 1 23 9814 1 1 15 VAL HG13 H 4.162 2.752 -3.325 1.00 . A A . 15 VAL HG13 1 1 23 9815 1 1 15 VAL HG21 H 2.628 1.233 -4.453 1.00 . A A . 15 VAL HG21 1 1 23 9816 1 1 15 VAL HG22 H 1.039 1.735 -3.876 1.00 . A A . 15 VAL HG22 1 1 23 9817 1 1 15 VAL HG23 H 1.645 0.123 -3.499 1.00 . A A . 15 VAL HG23 1 1 23 9818 1 1 15 VAL N N 2.628 -0.422 -1.218 1.00 . A A . 15 VAL N 1 1 23 9819 1 1 15 VAL O O 5.568 1.440 -0.830 1.00 . A A . 15 VAL O 1 1 23 9820 1 1 16 PHE C C 5.712 1.153 2.033 1.00 . A A . 16 PHE C 1 1 23 9821 1 1 16 PHE CA C 4.577 2.100 1.616 1.00 . A A . 16 PHE CA 1 1 23 9822 1 1 16 PHE CB C 3.567 2.264 2.758 1.00 . A A . 16 PHE CB 1 1 23 9823 1 1 16 PHE CD1 C 3.887 4.603 3.647 1.00 . A A . 16 PHE CD1 1 1 23 9824 1 1 16 PHE CD2 C 4.850 2.748 4.875 1.00 . A A . 16 PHE CD2 1 1 23 9825 1 1 16 PHE CE1 C 4.393 5.496 4.598 1.00 . A A . 16 PHE CE1 1 1 23 9826 1 1 16 PHE CE2 C 5.358 3.642 5.827 1.00 . A A . 16 PHE CE2 1 1 23 9827 1 1 16 PHE CG C 4.115 3.228 3.786 1.00 . A A . 16 PHE CG 1 1 23 9828 1 1 16 PHE CZ C 5.129 5.015 5.688 1.00 . A A . 16 PHE CZ 1 1 23 9829 1 1 16 PHE H H 2.834 1.345 0.588 1.00 . A A . 16 PHE H 1 1 23 9830 1 1 16 PHE HA H 4.977 3.064 1.341 1.00 . A A . 16 PHE HA 1 1 23 9831 1 1 16 PHE HB2 H 2.638 2.648 2.363 1.00 . A A . 16 PHE HB2 1 1 23 9832 1 1 16 PHE HB3 H 3.392 1.305 3.222 1.00 . A A . 16 PHE HB3 1 1 23 9833 1 1 16 PHE HD1 H 3.318 4.973 2.805 1.00 . A A . 16 PHE HD1 1 1 23 9834 1 1 16 PHE HD2 H 5.027 1.688 4.983 1.00 . A A . 16 PHE HD2 1 1 23 9835 1 1 16 PHE HE1 H 4.217 6.557 4.491 1.00 . A A . 16 PHE HE1 1 1 23 9836 1 1 16 PHE HE2 H 5.925 3.270 6.667 1.00 . A A . 16 PHE HE2 1 1 23 9837 1 1 16 PHE HZ H 5.520 5.705 6.422 1.00 . A A . 16 PHE HZ 1 1 23 9838 1 1 16 PHE N N 3.794 1.520 0.479 1.00 . A A . 16 PHE N 1 1 23 9839 1 1 16 PHE O O 6.770 1.589 2.447 1.00 . A A . 16 PHE O 1 1 23 9840 1 1 17 GLY C C 7.674 -1.107 1.261 1.00 . A A . 17 GLY C 1 1 23 9841 1 1 17 GLY CA C 6.568 -1.109 2.317 1.00 . A A . 17 GLY CA 1 1 23 9842 1 1 17 GLY H H 4.642 -0.469 1.592 1.00 . A A . 17 GLY H 1 1 23 9843 1 1 17 GLY HA2 H 6.984 -0.824 3.273 1.00 . A A . 17 GLY HA2 1 1 23 9844 1 1 17 GLY HA3 H 6.147 -2.099 2.388 1.00 . A A . 17 GLY HA3 1 1 23 9845 1 1 17 GLY N N 5.502 -0.138 1.928 1.00 . A A . 17 GLY N 1 1 23 9846 1 1 17 GLY O O 8.837 -0.956 1.580 1.00 . A A . 17 GLY O 1 1 23 9847 1 1 18 GLU C C 9.070 0.086 -1.121 1.00 . A A . 18 GLU C 1 1 23 9848 1 1 18 GLU CA C 8.360 -1.269 -1.070 1.00 . A A . 18 GLU CA 1 1 23 9849 1 1 18 GLU CB C 7.598 -1.533 -2.374 1.00 . A A . 18 GLU CB 1 1 23 9850 1 1 18 GLU CD C 9.666 -1.837 -3.754 1.00 . A A . 18 GLU CD 1 1 23 9851 1 1 18 GLU CG C 8.391 -2.514 -3.243 1.00 . A A . 18 GLU CG 1 1 23 9852 1 1 18 GLU H H 6.374 -1.382 -0.222 1.00 . A A . 18 GLU H 1 1 23 9853 1 1 18 GLU HA H 9.074 -2.053 -0.895 1.00 . A A . 18 GLU HA 1 1 23 9854 1 1 18 GLU HB2 H 6.629 -1.955 -2.147 1.00 . A A . 18 GLU HB2 1 1 23 9855 1 1 18 GLU HB3 H 7.469 -0.605 -2.910 1.00 . A A . 18 GLU HB3 1 1 23 9856 1 1 18 GLU HG2 H 8.654 -3.383 -2.657 1.00 . A A . 18 GLU HG2 1 1 23 9857 1 1 18 GLU HG3 H 7.787 -2.818 -4.084 1.00 . A A . 18 GLU HG3 1 1 23 9858 1 1 18 GLU N N 7.322 -1.267 0.008 1.00 . A A . 18 GLU N 1 1 23 9859 1 1 18 GLU O O 10.283 0.154 -1.175 1.00 . A A . 18 GLU O 1 1 23 9860 1 1 18 GLU OE1 O 9.560 -1.017 -4.651 1.00 . A A . 18 GLU OE1 1 1 23 9861 1 1 18 GLU OE2 O 10.727 -2.151 -3.239 1.00 . A A . 18 GLU OE2 1 1 23 9862 1 1 19 ASN C C 9.869 2.693 0.097 1.00 . A A . 19 ASN C 1 1 23 9863 1 1 19 ASN CA C 8.951 2.518 -1.115 1.00 . A A . 19 ASN CA 1 1 23 9864 1 1 19 ASN CB C 7.788 3.516 -1.056 1.00 . A A . 19 ASN CB 1 1 23 9865 1 1 19 ASN CG C 7.286 3.807 -2.473 1.00 . A A . 19 ASN CG 1 1 23 9866 1 1 19 ASN H H 7.349 1.069 -1.029 1.00 . A A . 19 ASN H 1 1 23 9867 1 1 19 ASN HA H 9.505 2.653 -2.024 1.00 . A A . 19 ASN HA 1 1 23 9868 1 1 19 ASN HB2 H 6.984 3.099 -0.466 1.00 . A A . 19 ASN HB2 1 1 23 9869 1 1 19 ASN HB3 H 8.126 4.435 -0.602 1.00 . A A . 19 ASN HB3 1 1 23 9870 1 1 19 ASN HD21 H 6.379 2.051 -2.673 1.00 . A A . 19 ASN HD21 1 1 23 9871 1 1 19 ASN HD22 H 6.264 3.084 -4.014 1.00 . A A . 19 ASN HD22 1 1 23 9872 1 1 19 ASN N N 8.322 1.159 -1.087 1.00 . A A . 19 ASN N 1 1 23 9873 1 1 19 ASN ND2 N 6.583 2.906 -3.106 1.00 . A A . 19 ASN ND2 1 1 23 9874 1 1 19 ASN O O 10.869 3.382 0.037 1.00 . A A . 19 ASN O 1 1 23 9875 1 1 19 ASN OD1 O 7.535 4.868 -3.012 1.00 . A A . 19 ASN OD1 1 1 23 9876 1 1 20 GLY C C 11.587 1.232 2.302 1.00 . A A . 20 GLY C 1 1 23 9877 1 1 20 GLY CA C 10.376 2.167 2.419 1.00 . A A . 20 GLY CA 1 1 23 9878 1 1 20 GLY H H 8.727 1.510 1.207 1.00 . A A . 20 GLY H 1 1 23 9879 1 1 20 GLY HA2 H 10.717 3.186 2.532 1.00 . A A . 20 GLY HA2 1 1 23 9880 1 1 20 GLY HA3 H 9.791 1.885 3.282 1.00 . A A . 20 GLY HA3 1 1 23 9881 1 1 20 GLY N N 9.535 2.061 1.194 1.00 . A A . 20 GLY N 1 1 23 9882 1 1 20 GLY O O 12.666 1.555 2.758 1.00 . A A . 20 GLY O 1 1 23 9883 1 1 21 VAL C C 13.818 -0.175 1.012 1.00 . A A . 21 VAL C 1 1 23 9884 1 1 21 VAL CA C 12.571 -0.882 1.568 1.00 . A A . 21 VAL CA 1 1 23 9885 1 1 21 VAL CB C 12.085 -1.979 0.606 1.00 . A A . 21 VAL CB 1 1 23 9886 1 1 21 VAL CG1 C 13.278 -2.804 0.108 1.00 . A A . 21 VAL CG1 1 1 23 9887 1 1 21 VAL CG2 C 11.107 -2.903 1.338 1.00 . A A . 21 VAL CG2 1 1 23 9888 1 1 21 VAL H H 10.534 -0.172 1.346 1.00 . A A . 21 VAL H 1 1 23 9889 1 1 21 VAL HA H 12.797 -1.313 2.526 1.00 . A A . 21 VAL HA 1 1 23 9890 1 1 21 VAL HB H 11.588 -1.522 -0.237 1.00 . A A . 21 VAL HB 1 1 23 9891 1 1 21 VAL HG11 H 13.855 -2.216 -0.590 1.00 . A A . 21 VAL HG11 1 1 23 9892 1 1 21 VAL HG12 H 12.917 -3.695 -0.385 1.00 . A A . 21 VAL HG12 1 1 23 9893 1 1 21 VAL HG13 H 13.900 -3.083 0.946 1.00 . A A . 21 VAL HG13 1 1 23 9894 1 1 21 VAL HG21 H 10.257 -3.103 0.702 1.00 . A A . 21 VAL HG21 1 1 23 9895 1 1 21 VAL HG22 H 10.772 -2.428 2.248 1.00 . A A . 21 VAL HG22 1 1 23 9896 1 1 21 VAL HG23 H 11.601 -3.833 1.579 1.00 . A A . 21 VAL HG23 1 1 23 9897 1 1 21 VAL N N 11.420 0.074 1.701 1.00 . A A . 21 VAL N 1 1 23 9898 1 1 21 VAL O O 14.916 -0.390 1.486 1.00 . A A . 21 VAL O 1 1 23 9899 1 1 22 PHE C C 14.873 2.861 -0.117 1.00 . A A . 22 PHE C 1 1 23 9900 1 1 22 PHE CA C 14.849 1.381 -0.546 1.00 . A A . 22 PHE CA 1 1 23 9901 1 1 22 PHE CB C 14.741 1.243 -2.077 1.00 . A A . 22 PHE CB 1 1 23 9902 1 1 22 PHE CD1 C 13.430 3.328 -2.661 1.00 . A A . 22 PHE CD1 1 1 23 9903 1 1 22 PHE CD2 C 12.414 1.162 -3.052 1.00 . A A . 22 PHE CD2 1 1 23 9904 1 1 22 PHE CE1 C 12.285 3.956 -3.161 1.00 . A A . 22 PHE CE1 1 1 23 9905 1 1 22 PHE CE2 C 11.267 1.791 -3.551 1.00 . A A . 22 PHE CE2 1 1 23 9906 1 1 22 PHE CG C 13.496 1.929 -2.605 1.00 . A A . 22 PHE CG 1 1 23 9907 1 1 22 PHE CZ C 11.203 3.189 -3.607 1.00 . A A . 22 PHE CZ 1 1 23 9908 1 1 22 PHE H H 12.764 0.828 -0.343 1.00 . A A . 22 PHE H 1 1 23 9909 1 1 22 PHE HA H 15.753 0.898 -0.210 1.00 . A A . 22 PHE HA 1 1 23 9910 1 1 22 PHE HB2 H 15.611 1.688 -2.534 1.00 . A A . 22 PHE HB2 1 1 23 9911 1 1 22 PHE HB3 H 14.704 0.194 -2.334 1.00 . A A . 22 PHE HB3 1 1 23 9912 1 1 22 PHE HD1 H 14.264 3.922 -2.317 1.00 . A A . 22 PHE HD1 1 1 23 9913 1 1 22 PHE HD2 H 12.462 0.084 -3.010 1.00 . A A . 22 PHE HD2 1 1 23 9914 1 1 22 PHE HE1 H 12.235 5.035 -3.204 1.00 . A A . 22 PHE HE1 1 1 23 9915 1 1 22 PHE HE2 H 10.433 1.199 -3.895 1.00 . A A . 22 PHE HE2 1 1 23 9916 1 1 22 PHE HZ H 10.319 3.673 -3.993 1.00 . A A . 22 PHE HZ 1 1 23 9917 1 1 22 PHE N N 13.659 0.666 0.020 1.00 . A A . 22 PHE N 1 1 23 9918 1 1 22 PHE O O 15.697 3.629 -0.578 1.00 . A A . 22 PHE O 1 1 23 9919 1 1 23 PHE C C 13.231 4.801 2.573 1.00 . A A . 23 PHE C 1 1 23 9920 1 1 23 PHE CA C 13.977 4.686 1.236 1.00 . A A . 23 PHE CA 1 1 23 9921 1 1 23 PHE CB C 13.251 5.466 0.139 1.00 . A A . 23 PHE CB 1 1 23 9922 1 1 23 PHE CD1 C 14.840 7.366 -0.345 1.00 . A A . 23 PHE CD1 1 1 23 9923 1 1 23 PHE CD2 C 12.783 7.841 0.848 1.00 . A A . 23 PHE CD2 1 1 23 9924 1 1 23 PHE CE1 C 15.194 8.717 -0.273 1.00 . A A . 23 PHE CE1 1 1 23 9925 1 1 23 PHE CE2 C 13.138 9.194 0.920 1.00 . A A . 23 PHE CE2 1 1 23 9926 1 1 23 PHE CG C 13.634 6.926 0.215 1.00 . A A . 23 PHE CG 1 1 23 9927 1 1 23 PHE CZ C 14.344 9.632 0.360 1.00 . A A . 23 PHE CZ 1 1 23 9928 1 1 23 PHE H H 13.347 2.628 1.140 1.00 . A A . 23 PHE H 1 1 23 9929 1 1 23 PHE HA H 14.986 5.054 1.341 1.00 . A A . 23 PHE HA 1 1 23 9930 1 1 23 PHE HB2 H 13.533 5.069 -0.823 1.00 . A A . 23 PHE HB2 1 1 23 9931 1 1 23 PHE HB3 H 12.185 5.366 0.272 1.00 . A A . 23 PHE HB3 1 1 23 9932 1 1 23 PHE HD1 H 15.497 6.660 -0.833 1.00 . A A . 23 PHE HD1 1 1 23 9933 1 1 23 PHE HD2 H 11.853 7.504 1.281 1.00 . A A . 23 PHE HD2 1 1 23 9934 1 1 23 PHE HE1 H 16.125 9.056 -0.706 1.00 . A A . 23 PHE HE1 1 1 23 9935 1 1 23 PHE HE2 H 12.482 9.899 1.408 1.00 . A A . 23 PHE HE2 1 1 23 9936 1 1 23 PHE HZ H 14.617 10.676 0.415 1.00 . A A . 23 PHE HZ 1 1 23 9937 1 1 23 PHE N N 13.992 3.263 0.771 1.00 . A A . 23 PHE N 1 1 23 9938 1 1 23 PHE O O 12.111 5.276 2.638 1.00 . A A . 23 PHE O 1 1 23 9939 1 1 24 TYR C C 14.281 4.532 6.071 1.00 . A A . 24 TYR C 1 1 23 9940 1 1 24 TYR CA C 13.206 4.441 4.983 1.00 . A A . 24 TYR CA 1 1 23 9941 1 1 24 TYR CB C 12.396 3.150 5.110 1.00 . A A . 24 TYR CB 1 1 23 9942 1 1 24 TYR CD1 C 10.134 3.925 5.906 1.00 . A A . 24 TYR CD1 1 1 23 9943 1 1 24 TYR CD2 C 11.617 2.839 7.490 1.00 . A A . 24 TYR CD2 1 1 23 9944 1 1 24 TYR CE1 C 9.171 4.075 6.910 1.00 . A A . 24 TYR CE1 1 1 23 9945 1 1 24 TYR CE2 C 10.652 2.989 8.493 1.00 . A A . 24 TYR CE2 1 1 23 9946 1 1 24 TYR CG C 11.357 3.308 6.195 1.00 . A A . 24 TYR CG 1 1 23 9947 1 1 24 TYR CZ C 9.430 3.607 8.203 1.00 . A A . 24 TYR CZ 1 1 23 9948 1 1 24 TYR H H 14.753 3.991 3.548 1.00 . A A . 24 TYR H 1 1 23 9949 1 1 24 TYR HA H 12.548 5.294 5.034 1.00 . A A . 24 TYR HA 1 1 23 9950 1 1 24 TYR HB2 H 11.904 2.951 4.173 1.00 . A A . 24 TYR HB2 1 1 23 9951 1 1 24 TYR HB3 H 13.054 2.328 5.353 1.00 . A A . 24 TYR HB3 1 1 23 9952 1 1 24 TYR HD1 H 9.934 4.286 4.908 1.00 . A A . 24 TYR HD1 1 1 23 9953 1 1 24 TYR HD2 H 12.559 2.363 7.713 1.00 . A A . 24 TYR HD2 1 1 23 9954 1 1 24 TYR HE1 H 8.228 4.551 6.687 1.00 . A A . 24 TYR HE1 1 1 23 9955 1 1 24 TYR HE2 H 10.852 2.629 9.491 1.00 . A A . 24 TYR HE2 1 1 23 9956 1 1 24 TYR HH H 7.875 3.010 9.137 1.00 . A A . 24 TYR HH 1 1 23 9957 1 1 24 TYR N N 13.853 4.366 3.636 1.00 . A A . 24 TYR N 1 1 23 9958 1 1 24 TYR O O 14.529 3.593 6.805 1.00 . A A . 24 TYR O 1 1 23 9959 1 1 24 TYR OH O 8.481 3.754 9.193 1.00 . A A . 24 TYR OH 1 1 23 9960 1 1 25 LYS C C 15.617 6.987 8.165 1.00 . A A . 25 LYS C 1 1 23 9961 1 1 25 LYS CA C 15.991 5.857 7.193 1.00 . A A . 25 LYS CA 1 1 23 9962 1 1 25 LYS CB C 17.255 6.214 6.394 1.00 . A A . 25 LYS CB 1 1 23 9963 1 1 25 LYS CD C 17.926 7.735 4.517 1.00 . A A . 25 LYS CD 1 1 23 9964 1 1 25 LYS CE C 17.676 9.103 3.871 1.00 . A A . 25 LYS CE 1 1 23 9965 1 1 25 LYS CG C 17.139 7.636 5.827 1.00 . A A . 25 LYS CG 1 1 23 9966 1 1 25 LYS H H 14.695 6.398 5.554 1.00 . A A . 25 LYS H 1 1 23 9967 1 1 25 LYS HA H 16.154 4.939 7.736 1.00 . A A . 25 LYS HA 1 1 23 9968 1 1 25 LYS HB2 H 18.116 6.158 7.044 1.00 . A A . 25 LYS HB2 1 1 23 9969 1 1 25 LYS HB3 H 17.374 5.515 5.581 1.00 . A A . 25 LYS HB3 1 1 23 9970 1 1 25 LYS HD2 H 18.981 7.621 4.723 1.00 . A A . 25 LYS HD2 1 1 23 9971 1 1 25 LYS HD3 H 17.605 6.956 3.842 1.00 . A A . 25 LYS HD3 1 1 23 9972 1 1 25 LYS HE2 H 17.436 9.836 4.630 1.00 . A A . 25 LYS HE2 1 1 23 9973 1 1 25 LYS HE3 H 18.542 9.417 3.309 1.00 . A A . 25 LYS HE3 1 1 23 9974 1 1 25 LYS HG2 H 16.100 7.865 5.640 1.00 . A A . 25 LYS HG2 1 1 23 9975 1 1 25 LYS HG3 H 17.540 8.340 6.540 1.00 . A A . 25 LYS HG3 1 1 23 9976 1 1 25 LYS HZ1 H 15.823 8.266 3.396 1.00 . A A . 25 LYS HZ1 1 1 23 9977 1 1 25 LYS HZ2 H 16.850 8.488 2.060 1.00 . A A . 25 LYS HZ2 1 1 23 9978 1 1 25 LYS HZ3 H 16.065 9.820 2.760 1.00 . A A . 25 LYS HZ3 1 1 23 9979 1 1 25 LYS N N 14.920 5.667 6.165 1.00 . A A . 25 LYS N 1 1 23 9980 1 1 25 LYS NZ N 16.516 8.904 2.953 1.00 . A A . 25 LYS NZ 1 1 23 9981 1 1 25 LYS O O 16.118 6.971 9.278 1.00 . A A . 25 LYS O 1 1 23 9982 1 1 25 LYS OXT O 14.839 7.850 7.782 1.00 . A A . 25 LYS OXT 1 1 24 9983 1 1 1 HIS C C -18.553 3.792 2.323 1.00 . A A . 1 HIS C 1 1 24 9984 1 1 1 HIS CA C -18.108 5.111 2.970 1.00 . A A . 1 HIS CA 1 1 24 9985 1 1 1 HIS CB C -16.909 4.882 3.898 1.00 . A A . 1 HIS CB 1 1 24 9986 1 1 1 HIS CD2 C -14.893 3.645 2.750 1.00 . A A . 1 HIS CD2 1 1 24 9987 1 1 1 HIS CE1 C -13.957 5.361 1.816 1.00 . A A . 1 HIS CE1 1 1 24 9988 1 1 1 HIS CG C -15.654 4.739 3.076 1.00 . A A . 1 HIS CG 1 1 24 9989 1 1 1 HIS HA H -17.854 5.835 2.212 1.00 . A A . 1 HIS HA 1 1 24 9990 1 1 1 HIS HB2 H -16.805 5.723 4.568 1.00 . A A . 1 HIS HB2 1 1 24 9991 1 1 1 HIS HB3 H -17.064 3.981 4.472 1.00 . A A . 1 HIS HB3 1 1 24 9992 1 1 1 HIS HD1 H -15.335 6.757 2.511 1.00 . A A . 1 HIS HD1 1 1 24 9993 1 1 1 HIS HD2 H -15.094 2.631 3.063 1.00 . A A . 1 HIS HD2 1 1 24 9994 1 1 1 HIS HE1 H -13.280 5.982 1.249 1.00 . A A . 1 HIS HE1 1 1 24 9995 1 1 1 HIS N N -19.189 5.644 3.855 1.00 . A A . 1 HIS N 1 1 24 9996 1 1 1 HIS ND1 N -15.039 5.824 2.470 1.00 . A A . 1 HIS ND1 1 1 24 9997 1 1 1 HIS NE2 N -13.822 4.039 1.955 1.00 . A A . 1 HIS NE2 1 1 24 9998 1 1 1 HIS O O -19.481 3.149 2.780 1.00 . A A . 1 HIS O 1 1 24 9999 1 1 2 ALA C C -17.391 0.956 1.073 1.00 . A A . 2 ALA C 1 1 24 10000 1 1 2 ALA CA C -18.272 2.113 0.579 1.00 . A A . 2 ALA CA 1 1 24 10001 1 1 2 ALA CB C -18.027 2.378 -0.907 1.00 . A A . 2 ALA CB 1 1 24 10002 1 1 2 ALA H H -17.152 3.926 0.917 1.00 . A A . 2 ALA H 1 1 24 10003 1 1 2 ALA HA H -19.315 1.889 0.746 1.00 . A A . 2 ALA HA 1 1 24 10004 1 1 2 ALA HB1 H -16.969 2.510 -1.080 1.00 . A A . 2 ALA HB1 1 1 24 10005 1 1 2 ALA HB2 H -18.556 3.270 -1.206 1.00 . A A . 2 ALA HB2 1 1 24 10006 1 1 2 ALA HB3 H -18.383 1.537 -1.486 1.00 . A A . 2 ALA HB3 1 1 24 10007 1 1 2 ALA N N -17.895 3.388 1.264 1.00 . A A . 2 ALA N 1 1 24 10008 1 1 2 ALA O O -16.583 1.118 1.971 1.00 . A A . 2 ALA O 1 1 24 10009 1 1 3 TRP C C -15.332 -1.322 0.235 1.00 . A A . 3 TRP C 1 1 24 10010 1 1 3 TRP CA C -16.710 -1.379 0.912 1.00 . A A . 3 TRP CA 1 1 24 10011 1 1 3 TRP CB C -17.496 -2.615 0.453 1.00 . A A . 3 TRP CB 1 1 24 10012 1 1 3 TRP CD1 C -18.230 -4.105 2.360 1.00 . A A . 3 TRP CD1 1 1 24 10013 1 1 3 TRP CD2 C -19.710 -2.465 1.926 1.00 . A A . 3 TRP CD2 1 1 24 10014 1 1 3 TRP CE2 C -20.237 -3.216 3.003 1.00 . A A . 3 TRP CE2 1 1 24 10015 1 1 3 TRP CE3 C -20.453 -1.367 1.456 1.00 . A A . 3 TRP CE3 1 1 24 10016 1 1 3 TRP CG C -18.432 -3.050 1.537 1.00 . A A . 3 TRP CG 1 1 24 10017 1 1 3 TRP CH2 C -22.186 -1.795 3.112 1.00 . A A . 3 TRP CH2 1 1 24 10018 1 1 3 TRP CZ2 C -21.460 -2.889 3.593 1.00 . A A . 3 TRP CZ2 1 1 24 10019 1 1 3 TRP CZ3 C -21.683 -1.036 2.047 1.00 . A A . 3 TRP CZ3 1 1 24 10020 1 1 3 TRP H H -18.192 -0.310 -0.237 1.00 . A A . 3 TRP H 1 1 24 10021 1 1 3 TRP HA H -16.600 -1.391 1.985 1.00 . A A . 3 TRP HA 1 1 24 10022 1 1 3 TRP HB2 H -18.061 -2.374 -0.435 1.00 . A A . 3 TRP HB2 1 1 24 10023 1 1 3 TRP HB3 H -16.807 -3.417 0.231 1.00 . A A . 3 TRP HB3 1 1 24 10024 1 1 3 TRP HD1 H -17.373 -4.762 2.340 1.00 . A A . 3 TRP HD1 1 1 24 10025 1 1 3 TRP HE1 H -19.400 -4.883 3.930 1.00 . A A . 3 TRP HE1 1 1 24 10026 1 1 3 TRP HE3 H -20.076 -0.776 0.636 1.00 . A A . 3 TRP HE3 1 1 24 10027 1 1 3 TRP HH2 H -23.132 -1.535 3.563 1.00 . A A . 3 TRP HH2 1 1 24 10028 1 1 3 TRP HZ2 H -21.842 -3.477 4.414 1.00 . A A . 3 TRP HZ2 1 1 24 10029 1 1 3 TRP HZ3 H -22.246 -0.191 1.678 1.00 . A A . 3 TRP HZ3 1 1 24 10030 1 1 3 TRP N N -17.539 -0.208 0.487 1.00 . A A . 3 TRP N 1 1 24 10031 1 1 3 TRP NE1 N -19.300 -4.204 3.231 1.00 . A A . 3 TRP NE1 1 1 24 10032 1 1 3 TRP O O -14.953 -2.212 -0.506 1.00 . A A . 3 TRP O 1 1 24 10033 1 1 4 TYR C C -12.264 0.609 0.798 1.00 . A A . 4 TYR C 1 1 24 10034 1 1 4 TYR CA C -13.231 -0.142 -0.135 1.00 . A A . 4 TYR CA 1 1 24 10035 1 1 4 TYR CB C -13.465 0.651 -1.425 1.00 . A A . 4 TYR CB 1 1 24 10036 1 1 4 TYR CD1 C -13.333 -1.237 -3.093 1.00 . A A . 4 TYR CD1 1 1 24 10037 1 1 4 TYR CD2 C -11.616 0.476 -3.131 1.00 . A A . 4 TYR CD2 1 1 24 10038 1 1 4 TYR CE1 C -12.704 -1.891 -4.158 1.00 . A A . 4 TYR CE1 1 1 24 10039 1 1 4 TYR CE2 C -10.988 -0.178 -4.196 1.00 . A A . 4 TYR CE2 1 1 24 10040 1 1 4 TYR CG C -12.788 -0.054 -2.578 1.00 . A A . 4 TYR CG 1 1 24 10041 1 1 4 TYR CZ C -11.532 -1.361 -4.709 1.00 . A A . 4 TYR CZ 1 1 24 10042 1 1 4 TYR H H -14.915 0.429 1.084 1.00 . A A . 4 TYR H 1 1 24 10043 1 1 4 TYR HA H -12.835 -1.115 -0.374 1.00 . A A . 4 TYR HA 1 1 24 10044 1 1 4 TYR HB2 H -14.525 0.721 -1.620 1.00 . A A . 4 TYR HB2 1 1 24 10045 1 1 4 TYR HB3 H -13.052 1.642 -1.319 1.00 . A A . 4 TYR HB3 1 1 24 10046 1 1 4 TYR HD1 H -14.238 -1.645 -2.667 1.00 . A A . 4 TYR HD1 1 1 24 10047 1 1 4 TYR HD2 H -11.198 1.389 -2.735 1.00 . A A . 4 TYR HD2 1 1 24 10048 1 1 4 TYR HE1 H -13.124 -2.803 -4.555 1.00 . A A . 4 TYR HE1 1 1 24 10049 1 1 4 TYR HE2 H -10.084 0.230 -4.622 1.00 . A A . 4 TYR HE2 1 1 24 10050 1 1 4 TYR HH H -10.323 -2.671 -5.392 1.00 . A A . 4 TYR HH 1 1 24 10051 1 1 4 TYR N N -14.584 -0.274 0.486 1.00 . A A . 4 TYR N 1 1 24 10052 1 1 4 TYR O O -11.271 1.157 0.354 1.00 . A A . 4 TYR O 1 1 24 10053 1 1 4 TYR OH O -10.911 -2.007 -5.759 1.00 . A A . 4 TYR OH 1 1 24 10054 1 1 5 SER C C -10.329 0.530 3.217 1.00 . A A . 5 SER C 1 1 24 10055 1 1 5 SER CA C -11.617 1.339 3.034 1.00 . A A . 5 SER CA 1 1 24 10056 1 1 5 SER CB C -12.389 1.445 4.354 1.00 . A A . 5 SER CB 1 1 24 10057 1 1 5 SER H H -13.330 0.173 2.427 1.00 . A A . 5 SER H 1 1 24 10058 1 1 5 SER HA H -11.386 2.322 2.663 1.00 . A A . 5 SER HA 1 1 24 10059 1 1 5 SER HB2 H -11.788 1.965 5.082 1.00 . A A . 5 SER HB2 1 1 24 10060 1 1 5 SER HB3 H -13.305 1.995 4.189 1.00 . A A . 5 SER HB3 1 1 24 10061 1 1 5 SER HG H -12.385 0.087 5.752 1.00 . A A . 5 SER HG 1 1 24 10062 1 1 5 SER N N -12.535 0.630 2.085 1.00 . A A . 5 SER N 1 1 24 10063 1 1 5 SER O O -9.251 1.082 3.335 1.00 . A A . 5 SER O 1 1 24 10064 1 1 5 SER OG O -12.685 0.140 4.841 1.00 . A A . 5 SER OG 1 1 24 10065 1 1 6 HIS C C -8.582 -1.878 2.005 1.00 . A A . 6 HIS C 1 1 24 10066 1 1 6 HIS CA C -9.223 -1.632 3.375 1.00 . A A . 6 HIS CA 1 1 24 10067 1 1 6 HIS CB C -9.721 -2.945 3.989 1.00 . A A . 6 HIS CB 1 1 24 10068 1 1 6 HIS CD2 C -7.375 -3.146 5.167 1.00 . A A . 6 HIS CD2 1 1 24 10069 1 1 6 HIS CE1 C -7.533 -5.198 5.842 1.00 . A A . 6 HIS CE1 1 1 24 10070 1 1 6 HIS CG C -8.601 -3.605 4.754 1.00 . A A . 6 HIS CG 1 1 24 10071 1 1 6 HIS H H -11.317 -1.187 3.113 1.00 . A A . 6 HIS H 1 1 24 10072 1 1 6 HIS HA H -8.516 -1.160 4.034 1.00 . A A . 6 HIS HA 1 1 24 10073 1 1 6 HIS HB2 H -10.543 -2.741 4.659 1.00 . A A . 6 HIS HB2 1 1 24 10074 1 1 6 HIS HB3 H -10.055 -3.606 3.202 1.00 . A A . 6 HIS HB3 1 1 24 10075 1 1 6 HIS HD1 H -9.433 -5.530 5.063 1.00 . A A . 6 HIS HD1 1 1 24 10076 1 1 6 HIS HD2 H -6.990 -2.153 4.987 1.00 . A A . 6 HIS HD2 1 1 24 10077 1 1 6 HIS HE1 H -7.312 -6.151 6.299 1.00 . A A . 6 HIS HE1 1 1 24 10078 1 1 6 HIS N N -10.437 -0.774 3.223 1.00 . A A . 6 HIS N 1 1 24 10079 1 1 6 HIS ND1 N -8.679 -4.918 5.196 1.00 . A A . 6 HIS ND1 1 1 24 10080 1 1 6 HIS NE2 N -6.702 -4.153 5.853 1.00 . A A . 6 HIS NE2 1 1 24 10081 1 1 6 HIS O O -7.397 -2.132 1.907 1.00 . A A . 6 HIS O 1 1 24 10082 1 1 7 TYR C C -7.705 -0.971 -0.697 1.00 . A A . 7 TYR C 1 1 24 10083 1 1 7 TYR CA C -8.793 -2.008 -0.420 1.00 . A A . 7 TYR CA 1 1 24 10084 1 1 7 TYR CB C -9.969 -1.811 -1.384 1.00 . A A . 7 TYR CB 1 1 24 10085 1 1 7 TYR CD1 C -11.807 -3.316 -0.534 1.00 . A A . 7 TYR CD1 1 1 24 10086 1 1 7 TYR CD2 C -10.550 -4.000 -2.490 1.00 . A A . 7 TYR CD2 1 1 24 10087 1 1 7 TYR CE1 C -12.576 -4.481 -0.620 1.00 . A A . 7 TYR CE1 1 1 24 10088 1 1 7 TYR CE2 C -11.318 -5.166 -2.575 1.00 . A A . 7 TYR CE2 1 1 24 10089 1 1 7 TYR CG C -10.792 -3.074 -1.469 1.00 . A A . 7 TYR CG 1 1 24 10090 1 1 7 TYR CZ C -12.332 -5.406 -1.641 1.00 . A A . 7 TYR CZ 1 1 24 10091 1 1 7 TYR H H -10.303 -1.579 1.059 1.00 . A A . 7 TYR H 1 1 24 10092 1 1 7 TYR HA H -8.394 -3.000 -0.513 1.00 . A A . 7 TYR HA 1 1 24 10093 1 1 7 TYR HB2 H -10.591 -1.002 -1.029 1.00 . A A . 7 TYR HB2 1 1 24 10094 1 1 7 TYR HB3 H -9.589 -1.565 -2.364 1.00 . A A . 7 TYR HB3 1 1 24 10095 1 1 7 TYR HD1 H -11.995 -2.603 0.254 1.00 . A A . 7 TYR HD1 1 1 24 10096 1 1 7 TYR HD2 H -9.769 -3.815 -3.212 1.00 . A A . 7 TYR HD2 1 1 24 10097 1 1 7 TYR HE1 H -13.359 -4.665 0.101 1.00 . A A . 7 TYR HE1 1 1 24 10098 1 1 7 TYR HE2 H -11.131 -5.881 -3.364 1.00 . A A . 7 TYR HE2 1 1 24 10099 1 1 7 TYR HH H -12.594 -7.271 -1.326 1.00 . A A . 7 TYR HH 1 1 24 10100 1 1 7 TYR N N -9.356 -1.794 0.950 1.00 . A A . 7 TYR N 1 1 24 10101 1 1 7 TYR O O -6.621 -1.299 -1.139 1.00 . A A . 7 TYR O 1 1 24 10102 1 1 7 TYR OH O -13.093 -6.554 -1.726 1.00 . A A . 7 TYR OH 1 1 24 10103 1 1 8 VAL C C -5.735 1.099 0.241 1.00 . A A . 8 VAL C 1 1 24 10104 1 1 8 VAL CA C -6.968 1.350 -0.642 1.00 . A A . 8 VAL CA 1 1 24 10105 1 1 8 VAL CB C -7.672 2.667 -0.270 1.00 . A A . 8 VAL CB 1 1 24 10106 1 1 8 VAL CG1 C -7.871 2.759 1.246 1.00 . A A . 8 VAL CG1 1 1 24 10107 1 1 8 VAL CG2 C -6.821 3.849 -0.743 1.00 . A A . 8 VAL CG2 1 1 24 10108 1 1 8 VAL H H -8.865 0.503 -0.049 1.00 . A A . 8 VAL H 1 1 24 10109 1 1 8 VAL HA H -6.678 1.370 -1.678 1.00 . A A . 8 VAL HA 1 1 24 10110 1 1 8 VAL HB H -8.636 2.704 -0.757 1.00 . A A . 8 VAL HB 1 1 24 10111 1 1 8 VAL HG11 H -8.758 3.338 1.457 1.00 . A A . 8 VAL HG11 1 1 24 10112 1 1 8 VAL HG12 H -7.013 3.239 1.694 1.00 . A A . 8 VAL HG12 1 1 24 10113 1 1 8 VAL HG13 H -7.983 1.768 1.655 1.00 . A A . 8 VAL HG13 1 1 24 10114 1 1 8 VAL HG21 H -6.686 3.789 -1.813 1.00 . A A . 8 VAL HG21 1 1 24 10115 1 1 8 VAL HG22 H -5.858 3.816 -0.256 1.00 . A A . 8 VAL HG22 1 1 24 10116 1 1 8 VAL HG23 H -7.319 4.773 -0.494 1.00 . A A . 8 VAL HG23 1 1 24 10117 1 1 8 VAL N N -7.986 0.276 -0.418 1.00 . A A . 8 VAL N 1 1 24 10118 1 1 8 VAL O O -4.629 1.466 -0.106 1.00 . A A . 8 VAL O 1 1 24 10119 1 1 9 LEU C C -3.905 -0.947 1.660 1.00 . A A . 9 LEU C 1 1 24 10120 1 1 9 LEU CA C -4.772 0.158 2.274 1.00 . A A . 9 LEU CA 1 1 24 10121 1 1 9 LEU CB C -5.404 -0.319 3.586 1.00 . A A . 9 LEU CB 1 1 24 10122 1 1 9 LEU CD1 C -4.738 0.494 5.858 1.00 . A A . 9 LEU CD1 1 1 24 10123 1 1 9 LEU CD2 C -4.189 -1.841 5.158 1.00 . A A . 9 LEU CD2 1 1 24 10124 1 1 9 LEU CG C -4.331 -0.393 4.679 1.00 . A A . 9 LEU CG 1 1 24 10125 1 1 9 LEU H H -6.823 0.161 1.615 1.00 . A A . 9 LEU H 1 1 24 10126 1 1 9 LEU HA H -4.186 1.047 2.446 1.00 . A A . 9 LEU HA 1 1 24 10127 1 1 9 LEU HB2 H -6.177 0.374 3.886 1.00 . A A . 9 LEU HB2 1 1 24 10128 1 1 9 LEU HB3 H -5.835 -1.298 3.441 1.00 . A A . 9 LEU HB3 1 1 24 10129 1 1 9 LEU HD11 H -4.558 1.530 5.608 1.00 . A A . 9 LEU HD11 1 1 24 10130 1 1 9 LEU HD12 H -4.154 0.228 6.726 1.00 . A A . 9 LEU HD12 1 1 24 10131 1 1 9 LEU HD13 H -5.787 0.352 6.071 1.00 . A A . 9 LEU HD13 1 1 24 10132 1 1 9 LEU HD21 H -3.230 -1.970 5.635 1.00 . A A . 9 LEU HD21 1 1 24 10133 1 1 9 LEU HD22 H -4.263 -2.509 4.312 1.00 . A A . 9 LEU HD22 1 1 24 10134 1 1 9 LEU HD23 H -4.975 -2.066 5.863 1.00 . A A . 9 LEU HD23 1 1 24 10135 1 1 9 LEU HG H -3.387 -0.050 4.280 1.00 . A A . 9 LEU HG 1 1 24 10136 1 1 9 LEU N N -5.923 0.458 1.370 1.00 . A A . 9 LEU N 1 1 24 10137 1 1 9 LEU O O -2.693 -0.917 1.757 1.00 . A A . 9 LEU O 1 1 24 10138 1 1 10 LYS C C -2.856 -2.467 -0.737 1.00 . A A . 10 LYS C 1 1 24 10139 1 1 10 LYS CA C -3.725 -3.025 0.397 1.00 . A A . 10 LYS CA 1 1 24 10140 1 1 10 LYS CB C -4.763 -4.011 -0.152 1.00 . A A . 10 LYS CB 1 1 24 10141 1 1 10 LYS CD C -5.987 -4.863 1.856 1.00 . A A . 10 LYS CD 1 1 24 10142 1 1 10 LYS CE C -6.100 -6.017 2.859 1.00 . A A . 10 LYS CE 1 1 24 10143 1 1 10 LYS CG C -4.915 -5.189 0.813 1.00 . A A . 10 LYS CG 1 1 24 10144 1 1 10 LYS H H -5.499 -1.922 0.955 1.00 . A A . 10 LYS H 1 1 24 10145 1 1 10 LYS HA H -3.108 -3.511 1.136 1.00 . A A . 10 LYS HA 1 1 24 10146 1 1 10 LYS HB2 H -5.714 -3.509 -0.264 1.00 . A A . 10 LYS HB2 1 1 24 10147 1 1 10 LYS HB3 H -4.437 -4.377 -1.114 1.00 . A A . 10 LYS HB3 1 1 24 10148 1 1 10 LYS HD2 H -5.717 -3.955 2.379 1.00 . A A . 10 LYS HD2 1 1 24 10149 1 1 10 LYS HD3 H -6.938 -4.724 1.363 1.00 . A A . 10 LYS HD3 1 1 24 10150 1 1 10 LYS HE2 H -7.032 -5.948 3.404 1.00 . A A . 10 LYS HE2 1 1 24 10151 1 1 10 LYS HE3 H -6.033 -6.966 2.349 1.00 . A A . 10 LYS HE3 1 1 24 10152 1 1 10 LYS HG2 H -5.206 -6.071 0.261 1.00 . A A . 10 LYS HG2 1 1 24 10153 1 1 10 LYS HG3 H -3.974 -5.370 1.311 1.00 . A A . 10 LYS HG3 1 1 24 10154 1 1 10 LYS HZ1 H -5.105 -6.409 4.649 1.00 . A A . 10 LYS HZ1 1 1 24 10155 1 1 10 LYS HZ2 H -4.831 -4.848 4.035 1.00 . A A . 10 LYS HZ2 1 1 24 10156 1 1 10 LYS HZ3 H -4.074 -6.191 3.320 1.00 . A A . 10 LYS HZ3 1 1 24 10157 1 1 10 LYS N N -4.517 -1.922 1.024 1.00 . A A . 10 LYS N 1 1 24 10158 1 1 10 LYS NZ N -4.940 -5.853 3.786 1.00 . A A . 10 LYS NZ 1 1 24 10159 1 1 10 LYS O O -1.690 -2.792 -0.850 1.00 . A A . 10 LYS O 1 1 24 10160 1 1 11 PHE C C -1.566 -0.062 -2.131 1.00 . A A . 11 PHE C 1 1 24 10161 1 1 11 PHE CA C -2.619 -1.029 -2.689 1.00 . A A . 11 PHE CA 1 1 24 10162 1 1 11 PHE CB C -3.636 -0.281 -3.555 1.00 . A A . 11 PHE CB 1 1 24 10163 1 1 11 PHE CD1 C -2.649 -0.690 -5.842 1.00 . A A . 11 PHE CD1 1 1 24 10164 1 1 11 PHE CD2 C -2.649 1.569 -4.958 1.00 . A A . 11 PHE CD2 1 1 24 10165 1 1 11 PHE CE1 C -2.024 -0.234 -7.008 1.00 . A A . 11 PHE CE1 1 1 24 10166 1 1 11 PHE CE2 C -2.024 2.025 -6.124 1.00 . A A . 11 PHE CE2 1 1 24 10167 1 1 11 PHE CG C -2.962 0.211 -4.816 1.00 . A A . 11 PHE CG 1 1 24 10168 1 1 11 PHE CZ C -1.711 1.124 -7.149 1.00 . A A . 11 PHE CZ 1 1 24 10169 1 1 11 PHE H H -4.355 -1.367 -1.450 1.00 . A A . 11 PHE H 1 1 24 10170 1 1 11 PHE HA H -2.145 -1.808 -3.265 1.00 . A A . 11 PHE HA 1 1 24 10171 1 1 11 PHE HB2 H -4.445 -0.946 -3.817 1.00 . A A . 11 PHE HB2 1 1 24 10172 1 1 11 PHE HB3 H -4.027 0.562 -3.005 1.00 . A A . 11 PHE HB3 1 1 24 10173 1 1 11 PHE HD1 H -2.891 -1.737 -5.733 1.00 . A A . 11 PHE HD1 1 1 24 10174 1 1 11 PHE HD2 H -2.890 2.263 -4.167 1.00 . A A . 11 PHE HD2 1 1 24 10175 1 1 11 PHE HE1 H -1.783 -0.928 -7.798 1.00 . A A . 11 PHE HE1 1 1 24 10176 1 1 11 PHE HE2 H -1.782 3.071 -6.233 1.00 . A A . 11 PHE HE2 1 1 24 10177 1 1 11 PHE HZ H -1.228 1.476 -8.049 1.00 . A A . 11 PHE HZ 1 1 24 10178 1 1 11 PHE N N -3.415 -1.620 -1.569 1.00 . A A . 11 PHE N 1 1 24 10179 1 1 11 PHE O O -0.432 -0.050 -2.571 1.00 . A A . 11 PHE O 1 1 24 10180 1 1 12 PHE C C 0.165 0.943 0.149 1.00 . A A . 12 PHE C 1 1 24 10181 1 1 12 PHE CA C -0.960 1.706 -0.562 1.00 . A A . 12 PHE CA 1 1 24 10182 1 1 12 PHE CB C -1.776 2.527 0.441 1.00 . A A . 12 PHE CB 1 1 24 10183 1 1 12 PHE CD1 C -0.638 4.770 0.224 1.00 . A A . 12 PHE CD1 1 1 24 10184 1 1 12 PHE CD2 C -0.424 3.548 2.309 1.00 . A A . 12 PHE CD2 1 1 24 10185 1 1 12 PHE CE1 C 0.147 5.802 0.749 1.00 . A A . 12 PHE CE1 1 1 24 10186 1 1 12 PHE CE2 C 0.362 4.581 2.833 1.00 . A A . 12 PHE CE2 1 1 24 10187 1 1 12 PHE CG C -0.924 3.642 1.004 1.00 . A A . 12 PHE CG 1 1 24 10188 1 1 12 PHE CZ C 0.647 5.708 2.053 1.00 . A A . 12 PHE CZ 1 1 24 10189 1 1 12 PHE H H -2.855 0.706 -0.823 1.00 . A A . 12 PHE H 1 1 24 10190 1 1 12 PHE HA H -0.553 2.351 -1.325 1.00 . A A . 12 PHE HA 1 1 24 10191 1 1 12 PHE HB2 H -2.636 2.950 -0.058 1.00 . A A . 12 PHE HB2 1 1 24 10192 1 1 12 PHE HB3 H -2.106 1.888 1.245 1.00 . A A . 12 PHE HB3 1 1 24 10193 1 1 12 PHE HD1 H -1.024 4.843 -0.782 1.00 . A A . 12 PHE HD1 1 1 24 10194 1 1 12 PHE HD2 H -0.644 2.678 2.909 1.00 . A A . 12 PHE HD2 1 1 24 10195 1 1 12 PHE HE1 H 0.368 6.671 0.147 1.00 . A A . 12 PHE HE1 1 1 24 10196 1 1 12 PHE HE2 H 0.748 4.508 3.838 1.00 . A A . 12 PHE HE2 1 1 24 10197 1 1 12 PHE HZ H 1.254 6.505 2.458 1.00 . A A . 12 PHE HZ 1 1 24 10198 1 1 12 PHE N N -1.935 0.742 -1.161 1.00 . A A . 12 PHE N 1 1 24 10199 1 1 12 PHE O O 1.327 1.276 0.016 1.00 . A A . 12 PHE O 1 1 24 10200 1 1 13 LEU C C 1.805 -1.565 0.593 1.00 . A A . 13 LEU C 1 1 24 10201 1 1 13 LEU CA C 0.875 -0.880 1.606 1.00 . A A . 13 LEU CA 1 1 24 10202 1 1 13 LEU CB C 0.105 -1.927 2.420 1.00 . A A . 13 LEU CB 1 1 24 10203 1 1 13 LEU CD1 C 0.588 -2.862 4.692 1.00 . A A . 13 LEU CD1 1 1 24 10204 1 1 13 LEU CD2 C 1.196 -4.168 2.649 1.00 . A A . 13 LEU CD2 1 1 24 10205 1 1 13 LEU CG C 1.088 -2.762 3.250 1.00 . A A . 13 LEU CG 1 1 24 10206 1 1 13 LEU H H -1.119 -0.335 0.978 1.00 . A A . 13 LEU H 1 1 24 10207 1 1 13 LEU HA H 1.443 -0.245 2.267 1.00 . A A . 13 LEU HA 1 1 24 10208 1 1 13 LEU HB2 H -0.590 -1.428 3.080 1.00 . A A . 13 LEU HB2 1 1 24 10209 1 1 13 LEU HB3 H -0.439 -2.575 1.749 1.00 . A A . 13 LEU HB3 1 1 24 10210 1 1 13 LEU HD11 H 1.360 -3.295 5.310 1.00 . A A . 13 LEU HD11 1 1 24 10211 1 1 13 LEU HD12 H -0.293 -3.487 4.726 1.00 . A A . 13 LEU HD12 1 1 24 10212 1 1 13 LEU HD13 H 0.345 -1.876 5.058 1.00 . A A . 13 LEU HD13 1 1 24 10213 1 1 13 LEU HD21 H 0.422 -4.797 3.062 1.00 . A A . 13 LEU HD21 1 1 24 10214 1 1 13 LEU HD22 H 2.164 -4.585 2.884 1.00 . A A . 13 LEU HD22 1 1 24 10215 1 1 13 LEU HD23 H 1.080 -4.112 1.577 1.00 . A A . 13 LEU HD23 1 1 24 10216 1 1 13 LEU HG H 2.060 -2.290 3.239 1.00 . A A . 13 LEU HG 1 1 24 10217 1 1 13 LEU N N -0.173 -0.084 0.894 1.00 . A A . 13 LEU N 1 1 24 10218 1 1 13 LEU O O 2.965 -1.796 0.870 1.00 . A A . 13 LEU O 1 1 24 10219 1 1 14 LEU C C 3.165 -1.553 -2.205 1.00 . A A . 14 LEU C 1 1 24 10220 1 1 14 LEU CA C 2.169 -2.553 -1.601 1.00 . A A . 14 LEU CA 1 1 24 10221 1 1 14 LEU CB C 1.202 -3.066 -2.672 1.00 . A A . 14 LEU CB 1 1 24 10222 1 1 14 LEU CD1 C 1.520 -5.543 -2.808 1.00 . A A . 14 LEU CD1 1 1 24 10223 1 1 14 LEU CD2 C 1.349 -4.189 -4.902 1.00 . A A . 14 LEU CD2 1 1 24 10224 1 1 14 LEU CG C 1.863 -4.202 -3.459 1.00 . A A . 14 LEU CG 1 1 24 10225 1 1 14 LEU H H 0.368 -1.691 -0.781 1.00 . A A . 14 LEU H 1 1 24 10226 1 1 14 LEU HA H 2.697 -3.377 -1.159 1.00 . A A . 14 LEU HA 1 1 24 10227 1 1 14 LEU HB2 H 0.301 -3.432 -2.199 1.00 . A A . 14 LEU HB2 1 1 24 10228 1 1 14 LEU HB3 H 0.952 -2.261 -3.347 1.00 . A A . 14 LEU HB3 1 1 24 10229 1 1 14 LEU HD11 H 2.235 -6.288 -3.122 1.00 . A A . 14 LEU HD11 1 1 24 10230 1 1 14 LEU HD12 H 0.528 -5.848 -3.110 1.00 . A A . 14 LEU HD12 1 1 24 10231 1 1 14 LEU HD13 H 1.554 -5.441 -1.733 1.00 . A A . 14 LEU HD13 1 1 24 10232 1 1 14 LEU HD21 H 0.366 -3.740 -4.932 1.00 . A A . 14 LEU HD21 1 1 24 10233 1 1 14 LEU HD22 H 1.293 -5.201 -5.274 1.00 . A A . 14 LEU HD22 1 1 24 10234 1 1 14 LEU HD23 H 2.024 -3.615 -5.520 1.00 . A A . 14 LEU HD23 1 1 24 10235 1 1 14 LEU HG H 2.935 -4.065 -3.456 1.00 . A A . 14 LEU HG 1 1 24 10236 1 1 14 LEU N N 1.307 -1.887 -0.577 1.00 . A A . 14 LEU N 1 1 24 10237 1 1 14 LEU O O 4.265 -1.915 -2.579 1.00 . A A . 14 LEU O 1 1 24 10238 1 1 15 VAL C C 4.426 1.478 -1.751 1.00 . A A . 15 VAL C 1 1 24 10239 1 1 15 VAL CA C 3.712 0.721 -2.880 1.00 . A A . 15 VAL CA 1 1 24 10240 1 1 15 VAL CB C 2.811 1.660 -3.696 1.00 . A A . 15 VAL CB 1 1 24 10241 1 1 15 VAL CG1 C 3.621 2.866 -4.181 1.00 . A A . 15 VAL CG1 1 1 24 10242 1 1 15 VAL CG2 C 2.254 0.907 -4.907 1.00 . A A . 15 VAL CG2 1 1 24 10243 1 1 15 VAL H H 1.898 -0.042 -1.992 1.00 . A A . 15 VAL H 1 1 24 10244 1 1 15 VAL HA H 4.434 0.250 -3.530 1.00 . A A . 15 VAL HA 1 1 24 10245 1 1 15 VAL HB H 1.994 2.002 -3.076 1.00 . A A . 15 VAL HB 1 1 24 10246 1 1 15 VAL HG11 H 3.476 3.693 -3.503 1.00 . A A . 15 VAL HG11 1 1 24 10247 1 1 15 VAL HG12 H 3.290 3.149 -5.170 1.00 . A A . 15 VAL HG12 1 1 24 10248 1 1 15 VAL HG13 H 4.669 2.607 -4.214 1.00 . A A . 15 VAL HG13 1 1 24 10249 1 1 15 VAL HG21 H 3.069 0.472 -5.468 1.00 . A A . 15 VAL HG21 1 1 24 10250 1 1 15 VAL HG22 H 1.707 1.594 -5.538 1.00 . A A . 15 VAL HG22 1 1 24 10251 1 1 15 VAL HG23 H 1.590 0.124 -4.571 1.00 . A A . 15 VAL HG23 1 1 24 10252 1 1 15 VAL N N 2.788 -0.305 -2.301 1.00 . A A . 15 VAL N 1 1 24 10253 1 1 15 VAL O O 5.635 1.415 -1.624 1.00 . A A . 15 VAL O 1 1 24 10254 1 1 16 PHE C C 4.980 1.967 1.188 1.00 . A A . 16 PHE C 1 1 24 10255 1 1 16 PHE CA C 4.322 2.938 0.197 1.00 . A A . 16 PHE CA 1 1 24 10256 1 1 16 PHE CB C 3.178 3.701 0.870 1.00 . A A . 16 PHE CB 1 1 24 10257 1 1 16 PHE CD1 C 4.110 6.039 1.034 1.00 . A A . 16 PHE CD1 1 1 24 10258 1 1 16 PHE CD2 C 3.888 4.727 3.062 1.00 . A A . 16 PHE CD2 1 1 24 10259 1 1 16 PHE CE1 C 4.629 7.104 1.781 1.00 . A A . 16 PHE CE1 1 1 24 10260 1 1 16 PHE CE2 C 4.406 5.791 3.808 1.00 . A A . 16 PHE CE2 1 1 24 10261 1 1 16 PHE CG C 3.739 4.850 1.675 1.00 . A A . 16 PHE CG 1 1 24 10262 1 1 16 PHE CZ C 4.777 6.980 3.167 1.00 . A A . 16 PHE CZ 1 1 24 10263 1 1 16 PHE H H 2.715 2.211 -1.049 1.00 . A A . 16 PHE H 1 1 24 10264 1 1 16 PHE HA H 5.053 3.634 -0.184 1.00 . A A . 16 PHE HA 1 1 24 10265 1 1 16 PHE HB2 H 2.507 4.085 0.114 1.00 . A A . 16 PHE HB2 1 1 24 10266 1 1 16 PHE HB3 H 2.637 3.035 1.525 1.00 . A A . 16 PHE HB3 1 1 24 10267 1 1 16 PHE HD1 H 3.996 6.135 -0.035 1.00 . A A . 16 PHE HD1 1 1 24 10268 1 1 16 PHE HD2 H 3.602 3.810 3.556 1.00 . A A . 16 PHE HD2 1 1 24 10269 1 1 16 PHE HE1 H 4.915 8.021 1.287 1.00 . A A . 16 PHE HE1 1 1 24 10270 1 1 16 PHE HE2 H 4.521 5.697 4.878 1.00 . A A . 16 PHE HE2 1 1 24 10271 1 1 16 PHE HZ H 5.177 7.802 3.743 1.00 . A A . 16 PHE HZ 1 1 24 10272 1 1 16 PHE N N 3.689 2.184 -0.929 1.00 . A A . 16 PHE N 1 1 24 10273 1 1 16 PHE O O 5.992 2.279 1.786 1.00 . A A . 16 PHE O 1 1 24 10274 1 1 17 GLY C C 6.372 -0.658 1.779 1.00 . A A . 17 GLY C 1 1 24 10275 1 1 17 GLY CA C 5.013 -0.196 2.311 1.00 . A A . 17 GLY CA 1 1 24 10276 1 1 17 GLY H H 3.602 0.560 0.868 1.00 . A A . 17 GLY H 1 1 24 10277 1 1 17 GLY HA2 H 5.145 0.268 3.278 1.00 . A A . 17 GLY HA2 1 1 24 10278 1 1 17 GLY HA3 H 4.360 -1.048 2.407 1.00 . A A . 17 GLY HA3 1 1 24 10279 1 1 17 GLY N N 4.416 0.794 1.364 1.00 . A A . 17 GLY N 1 1 24 10280 1 1 17 GLY O O 7.347 -0.681 2.501 1.00 . A A . 17 GLY O 1 1 24 10281 1 1 18 GLU C C 8.793 -0.355 0.049 1.00 . A A . 18 GLU C 1 1 24 10282 1 1 18 GLU CA C 7.750 -1.473 -0.062 1.00 . A A . 18 GLU CA 1 1 24 10283 1 1 18 GLU CB C 7.457 -1.796 -1.532 1.00 . A A . 18 GLU CB 1 1 24 10284 1 1 18 GLU CD C 8.284 -2.991 -3.573 1.00 . A A . 18 GLU CD 1 1 24 10285 1 1 18 GLU CG C 8.571 -2.683 -2.100 1.00 . A A . 18 GLU CG 1 1 24 10286 1 1 18 GLU H H 5.643 -0.987 -0.047 1.00 . A A . 18 GLU H 1 1 24 10287 1 1 18 GLU HA H 8.097 -2.353 0.448 1.00 . A A . 18 GLU HA 1 1 24 10288 1 1 18 GLU HB2 H 6.511 -2.316 -1.604 1.00 . A A . 18 GLU HB2 1 1 24 10289 1 1 18 GLU HB3 H 7.406 -0.878 -2.099 1.00 . A A . 18 GLU HB3 1 1 24 10290 1 1 18 GLU HG2 H 9.518 -2.167 -2.019 1.00 . A A . 18 GLU HG2 1 1 24 10291 1 1 18 GLU HG3 H 8.615 -3.607 -1.543 1.00 . A A . 18 GLU HG3 1 1 24 10292 1 1 18 GLU N N 6.445 -1.019 0.517 1.00 . A A . 18 GLU N 1 1 24 10293 1 1 18 GLU O O 9.947 -0.601 0.339 1.00 . A A . 18 GLU O 1 1 24 10294 1 1 18 GLU OE1 O 8.503 -2.115 -4.396 1.00 . A A . 18 GLU OE1 1 1 24 10295 1 1 18 GLU OE2 O 7.849 -4.096 -3.853 1.00 . A A . 18 GLU OE2 1 1 24 10296 1 1 19 ASN C C 9.922 2.085 1.364 1.00 . A A . 19 ASN C 1 1 24 10297 1 1 19 ASN CA C 9.346 2.014 -0.055 1.00 . A A . 19 ASN CA 1 1 24 10298 1 1 19 ASN CB C 8.523 3.268 -0.372 1.00 . A A . 19 ASN CB 1 1 24 10299 1 1 19 ASN CG C 8.232 3.329 -1.875 1.00 . A A . 19 ASN CG 1 1 24 10300 1 1 19 ASN H H 7.447 1.036 -0.383 1.00 . A A . 19 ASN H 1 1 24 10301 1 1 19 ASN HA H 10.139 1.903 -0.771 1.00 . A A . 19 ASN HA 1 1 24 10302 1 1 19 ASN HB2 H 7.591 3.233 0.175 1.00 . A A . 19 ASN HB2 1 1 24 10303 1 1 19 ASN HB3 H 9.078 4.147 -0.079 1.00 . A A . 19 ASN HB3 1 1 24 10304 1 1 19 ASN HD21 H 6.421 4.108 -1.642 1.00 . A A . 19 ASN HD21 1 1 24 10305 1 1 19 ASN HD22 H 6.894 3.834 -3.248 1.00 . A A . 19 ASN HD22 1 1 24 10306 1 1 19 ASN N N 8.386 0.870 -0.163 1.00 . A A . 19 ASN N 1 1 24 10307 1 1 19 ASN ND2 N 7.088 3.797 -2.289 1.00 . A A . 19 ASN ND2 1 1 24 10308 1 1 19 ASN O O 11.068 2.438 1.562 1.00 . A A . 19 ASN O 1 1 24 10309 1 1 19 ASN OD1 O 9.055 2.944 -2.682 1.00 . A A . 19 ASN OD1 1 1 24 10310 1 1 20 GLY C C 10.360 0.454 4.062 1.00 . A A . 20 GLY C 1 1 24 10311 1 1 20 GLY CA C 9.623 1.763 3.756 1.00 . A A . 20 GLY CA 1 1 24 10312 1 1 20 GLY H H 8.219 1.446 2.156 1.00 . A A . 20 GLY H 1 1 24 10313 1 1 20 GLY HA2 H 10.295 2.598 3.887 1.00 . A A . 20 GLY HA2 1 1 24 10314 1 1 20 GLY HA3 H 8.785 1.864 4.428 1.00 . A A . 20 GLY HA3 1 1 24 10315 1 1 20 GLY N N 9.134 1.736 2.348 1.00 . A A . 20 GLY N 1 1 24 10316 1 1 20 GLY O O 11.414 0.453 4.669 1.00 . A A . 20 GLY O 1 1 24 10317 1 1 21 VAL C C 11.867 -2.023 3.218 1.00 . A A . 21 VAL C 1 1 24 10318 1 1 21 VAL CA C 10.497 -1.972 3.910 1.00 . A A . 21 VAL CA 1 1 24 10319 1 1 21 VAL CB C 9.552 -3.042 3.342 1.00 . A A . 21 VAL CB 1 1 24 10320 1 1 21 VAL CG1 C 10.255 -4.403 3.324 1.00 . A A . 21 VAL CG1 1 1 24 10321 1 1 21 VAL CG2 C 8.301 -3.136 4.222 1.00 . A A . 21 VAL CG2 1 1 24 10322 1 1 21 VAL H H 8.968 -0.643 3.149 1.00 . A A . 21 VAL H 1 1 24 10323 1 1 21 VAL HA H 10.615 -2.113 4.969 1.00 . A A . 21 VAL HA 1 1 24 10324 1 1 21 VAL HB H 9.267 -2.771 2.336 1.00 . A A . 21 VAL HB 1 1 24 10325 1 1 21 VAL HG11 H 11.069 -4.378 2.614 1.00 . A A . 21 VAL HG11 1 1 24 10326 1 1 21 VAL HG12 H 9.550 -5.169 3.036 1.00 . A A . 21 VAL HG12 1 1 24 10327 1 1 21 VAL HG13 H 10.643 -4.623 4.308 1.00 . A A . 21 VAL HG13 1 1 24 10328 1 1 21 VAL HG21 H 7.555 -3.735 3.723 1.00 . A A . 21 VAL HG21 1 1 24 10329 1 1 21 VAL HG22 H 7.910 -2.145 4.397 1.00 . A A . 21 VAL HG22 1 1 24 10330 1 1 21 VAL HG23 H 8.559 -3.592 5.166 1.00 . A A . 21 VAL HG23 1 1 24 10331 1 1 21 VAL N N 9.820 -0.664 3.642 1.00 . A A . 21 VAL N 1 1 24 10332 1 1 21 VAL O O 12.780 -2.672 3.690 1.00 . A A . 21 VAL O 1 1 24 10333 1 1 22 PHE C C 14.160 -0.105 1.721 1.00 . A A . 22 PHE C 1 1 24 10334 1 1 22 PHE CA C 13.328 -1.357 1.391 1.00 . A A . 22 PHE CA 1 1 24 10335 1 1 22 PHE CB C 12.971 -1.385 -0.097 1.00 . A A . 22 PHE CB 1 1 24 10336 1 1 22 PHE CD1 C 13.724 -3.633 -0.952 1.00 . A A . 22 PHE CD1 1 1 24 10337 1 1 22 PHE CD2 C 15.104 -1.692 -1.405 1.00 . A A . 22 PHE CD2 1 1 24 10338 1 1 22 PHE CE1 C 14.639 -4.444 -1.635 1.00 . A A . 22 PHE CE1 1 1 24 10339 1 1 22 PHE CE2 C 16.019 -2.502 -2.089 1.00 . A A . 22 PHE CE2 1 1 24 10340 1 1 22 PHE CG C 13.957 -2.258 -0.837 1.00 . A A . 22 PHE CG 1 1 24 10341 1 1 22 PHE CZ C 15.786 -3.878 -2.204 1.00 . A A . 22 PHE CZ 1 1 24 10342 1 1 22 PHE H H 11.265 -0.828 1.750 1.00 . A A . 22 PHE H 1 1 24 10343 1 1 22 PHE HA H 13.881 -2.243 1.649 1.00 . A A . 22 PHE HA 1 1 24 10344 1 1 22 PHE HB2 H 11.973 -1.783 -0.221 1.00 . A A . 22 PHE HB2 1 1 24 10345 1 1 22 PHE HB3 H 13.009 -0.382 -0.496 1.00 . A A . 22 PHE HB3 1 1 24 10346 1 1 22 PHE HD1 H 12.838 -4.070 -0.513 1.00 . A A . 22 PHE HD1 1 1 24 10347 1 1 22 PHE HD2 H 15.285 -0.631 -1.316 1.00 . A A . 22 PHE HD2 1 1 24 10348 1 1 22 PHE HE1 H 14.459 -5.505 -1.724 1.00 . A A . 22 PHE HE1 1 1 24 10349 1 1 22 PHE HE2 H 16.904 -2.066 -2.527 1.00 . A A . 22 PHE HE2 1 1 24 10350 1 1 22 PHE HZ H 16.492 -4.503 -2.730 1.00 . A A . 22 PHE HZ 1 1 24 10351 1 1 22 PHE N N 12.016 -1.345 2.110 1.00 . A A . 22 PHE N 1 1 24 10352 1 1 22 PHE O O 15.339 -0.052 1.426 1.00 . A A . 22 PHE O 1 1 24 10353 1 1 23 PHE C C 13.735 2.841 3.886 1.00 . A A . 23 PHE C 1 1 24 10354 1 1 23 PHE CA C 14.338 2.137 2.660 1.00 . A A . 23 PHE CA 1 1 24 10355 1 1 23 PHE CB C 14.221 3.024 1.416 1.00 . A A . 23 PHE CB 1 1 24 10356 1 1 23 PHE CD1 C 16.658 3.631 1.173 1.00 . A A . 23 PHE CD1 1 1 24 10357 1 1 23 PHE CD2 C 15.596 2.342 -0.587 1.00 . A A . 23 PHE CD2 1 1 24 10358 1 1 23 PHE CE1 C 17.863 3.608 0.462 1.00 . A A . 23 PHE CE1 1 1 24 10359 1 1 23 PHE CE2 C 16.802 2.319 -1.296 1.00 . A A . 23 PHE CE2 1 1 24 10360 1 1 23 PHE CG C 15.524 2.998 0.649 1.00 . A A . 23 PHE CG 1 1 24 10361 1 1 23 PHE CZ C 17.936 2.952 -0.772 1.00 . A A . 23 PHE CZ 1 1 24 10362 1 1 23 PHE H H 12.617 0.838 2.553 1.00 . A A . 23 PHE H 1 1 24 10363 1 1 23 PHE HA H 15.372 1.895 2.841 1.00 . A A . 23 PHE HA 1 1 24 10364 1 1 23 PHE HB2 H 13.426 2.653 0.789 1.00 . A A . 23 PHE HB2 1 1 24 10365 1 1 23 PHE HB3 H 14.001 4.038 1.714 1.00 . A A . 23 PHE HB3 1 1 24 10366 1 1 23 PHE HD1 H 16.602 4.138 2.125 1.00 . A A . 23 PHE HD1 1 1 24 10367 1 1 23 PHE HD2 H 14.723 1.855 -0.991 1.00 . A A . 23 PHE HD2 1 1 24 10368 1 1 23 PHE HE1 H 18.738 4.096 0.866 1.00 . A A . 23 PHE HE1 1 1 24 10369 1 1 23 PHE HE2 H 16.859 1.813 -2.249 1.00 . A A . 23 PHE HE2 1 1 24 10370 1 1 23 PHE HZ H 18.866 2.934 -1.320 1.00 . A A . 23 PHE HZ 1 1 24 10371 1 1 23 PHE N N 13.566 0.898 2.325 1.00 . A A . 23 PHE N 1 1 24 10372 1 1 23 PHE O O 13.147 3.901 3.781 1.00 . A A . 23 PHE O 1 1 24 10373 1 1 24 TYR C C 13.903 2.193 7.544 1.00 . A A . 24 TYR C 1 1 24 10374 1 1 24 TYR CA C 13.340 2.890 6.296 1.00 . A A . 24 TYR CA 1 1 24 10375 1 1 24 TYR CB C 11.823 2.704 6.207 1.00 . A A . 24 TYR CB 1 1 24 10376 1 1 24 TYR CD1 C 10.931 4.100 8.110 1.00 . A A . 24 TYR CD1 1 1 24 10377 1 1 24 TYR CD2 C 10.675 4.917 5.842 1.00 . A A . 24 TYR CD2 1 1 24 10378 1 1 24 TYR CE1 C 10.285 5.243 8.595 1.00 . A A . 24 TYR CE1 1 1 24 10379 1 1 24 TYR CE2 C 10.029 6.060 6.325 1.00 . A A . 24 TYR CE2 1 1 24 10380 1 1 24 TYR CG C 11.126 3.937 6.733 1.00 . A A . 24 TYR CG 1 1 24 10381 1 1 24 TYR CZ C 9.834 6.223 7.702 1.00 . A A . 24 TYR CZ 1 1 24 10382 1 1 24 TYR H H 14.370 1.408 5.106 1.00 . A A . 24 TYR H 1 1 24 10383 1 1 24 TYR HA H 13.579 3.942 6.317 1.00 . A A . 24 TYR HA 1 1 24 10384 1 1 24 TYR HB2 H 11.545 2.550 5.177 1.00 . A A . 24 TYR HB2 1 1 24 10385 1 1 24 TYR HB3 H 11.528 1.845 6.792 1.00 . A A . 24 TYR HB3 1 1 24 10386 1 1 24 TYR HD1 H 11.278 3.343 8.798 1.00 . A A . 24 TYR HD1 1 1 24 10387 1 1 24 TYR HD2 H 10.825 4.792 4.779 1.00 . A A . 24 TYR HD2 1 1 24 10388 1 1 24 TYR HE1 H 10.134 5.368 9.656 1.00 . A A . 24 TYR HE1 1 1 24 10389 1 1 24 TYR HE2 H 9.681 6.817 5.638 1.00 . A A . 24 TYR HE2 1 1 24 10390 1 1 24 TYR HH H 9.862 8.022 8.342 1.00 . A A . 24 TYR HH 1 1 24 10391 1 1 24 TYR N N 13.889 2.259 5.050 1.00 . A A . 24 TYR N 1 1 24 10392 1 1 24 TYR O O 13.181 1.877 8.472 1.00 . A A . 24 TYR O 1 1 24 10393 1 1 24 TYR OH O 9.196 7.349 8.180 1.00 . A A . 24 TYR OH 1 1 24 10394 1 1 25 LYS C C 16.967 2.142 9.323 1.00 . A A . 25 LYS C 1 1 24 10395 1 1 25 LYS CA C 15.815 1.291 8.758 1.00 . A A . 25 LYS CA 1 1 24 10396 1 1 25 LYS CB C 16.335 -0.057 8.233 1.00 . A A . 25 LYS CB 1 1 24 10397 1 1 25 LYS CD C 18.292 -1.146 7.112 1.00 . A A . 25 LYS CD 1 1 24 10398 1 1 25 LYS CE C 19.273 -1.313 8.278 1.00 . A A . 25 LYS CE 1 1 24 10399 1 1 25 LYS CG C 17.515 0.163 7.277 1.00 . A A . 25 LYS CG 1 1 24 10400 1 1 25 LYS H H 15.752 2.232 6.814 1.00 . A A . 25 LYS H 1 1 24 10401 1 1 25 LYS HA H 15.073 1.120 9.522 1.00 . A A . 25 LYS HA 1 1 24 10402 1 1 25 LYS HB2 H 16.656 -0.663 9.066 1.00 . A A . 25 LYS HB2 1 1 24 10403 1 1 25 LYS HB3 H 15.540 -0.565 7.707 1.00 . A A . 25 LYS HB3 1 1 24 10404 1 1 25 LYS HD2 H 17.599 -1.976 7.100 1.00 . A A . 25 LYS HD2 1 1 24 10405 1 1 25 LYS HD3 H 18.842 -1.123 6.183 1.00 . A A . 25 LYS HD3 1 1 24 10406 1 1 25 LYS HE2 H 20.216 -0.838 8.043 1.00 . A A . 25 LYS HE2 1 1 24 10407 1 1 25 LYS HE3 H 18.857 -0.894 9.182 1.00 . A A . 25 LYS HE3 1 1 24 10408 1 1 25 LYS HG2 H 17.142 0.485 6.315 1.00 . A A . 25 LYS HG2 1 1 24 10409 1 1 25 LYS HG3 H 18.170 0.920 7.680 1.00 . A A . 25 LYS HG3 1 1 24 10410 1 1 25 LYS HZ1 H 20.123 -2.974 9.205 1.00 . A A . 25 LYS HZ1 1 1 24 10411 1 1 25 LYS HZ2 H 19.824 -3.186 7.546 1.00 . A A . 25 LYS HZ2 1 1 24 10412 1 1 25 LYS HZ3 H 18.538 -3.226 8.657 1.00 . A A . 25 LYS HZ3 1 1 24 10413 1 1 25 LYS N N 15.192 1.960 7.572 1.00 . A A . 25 LYS N 1 1 24 10414 1 1 25 LYS NZ N 19.452 -2.786 8.433 1.00 . A A . 25 LYS NZ 1 1 24 10415 1 1 25 LYS O O 17.597 1.694 10.269 1.00 . A A . 25 LYS O 1 1 24 10416 1 1 25 LYS OXT O 17.201 3.224 8.805 1.00 . A A . 25 LYS OXT 1 1 25 10417 1 1 1 HIS C C -20.665 2.346 1.299 1.00 . A A . 1 HIS C 1 1 25 10418 1 1 1 HIS CA C -20.977 3.230 2.522 1.00 . A A . 1 HIS CA 1 1 25 10419 1 1 1 HIS CB C -21.679 4.537 2.104 1.00 . A A . 1 HIS CB 1 1 25 10420 1 1 1 HIS CD2 C -19.950 6.184 0.993 1.00 . A A . 1 HIS CD2 1 1 25 10421 1 1 1 HIS CE1 C -20.334 5.693 -1.082 1.00 . A A . 1 HIS CE1 1 1 25 10422 1 1 1 HIS CG C -20.925 5.216 0.987 1.00 . A A . 1 HIS CG 1 1 25 10423 1 1 1 HIS HA H -21.611 2.688 3.207 1.00 . A A . 1 HIS HA 1 1 25 10424 1 1 1 HIS HB2 H -22.680 4.312 1.770 1.00 . A A . 1 HIS HB2 1 1 25 10425 1 1 1 HIS HB3 H -21.729 5.201 2.955 1.00 . A A . 1 HIS HB3 1 1 25 10426 1 1 1 HIS HD1 H -21.796 4.264 -0.694 1.00 . A A . 1 HIS HD1 1 1 25 10427 1 1 1 HIS HD2 H -19.536 6.644 1.878 1.00 . A A . 1 HIS HD2 1 1 25 10428 1 1 1 HIS HE1 H -20.291 5.676 -2.161 1.00 . A A . 1 HIS HE1 1 1 25 10429 1 1 1 HIS N N -19.720 3.648 3.222 1.00 . A A . 1 HIS N 1 1 25 10430 1 1 1 HIS ND1 N -21.154 4.919 -0.347 1.00 . A A . 1 HIS ND1 1 1 25 10431 1 1 1 HIS NE2 N -19.579 6.482 -0.314 1.00 . A A . 1 HIS NE2 1 1 25 10432 1 1 1 HIS O O -21.452 1.492 0.936 1.00 . A A . 1 HIS O 1 1 25 10433 1 1 2 ALA C C -17.802 1.046 -0.327 1.00 . A A . 2 ALA C 1 1 25 10434 1 1 2 ALA CA C -19.177 1.701 -0.523 1.00 . A A . 2 ALA CA 1 1 25 10435 1 1 2 ALA CB C -19.141 2.679 -1.701 1.00 . A A . 2 ALA CB 1 1 25 10436 1 1 2 ALA H H -18.906 3.226 0.974 1.00 . A A . 2 ALA H 1 1 25 10437 1 1 2 ALA HA H -19.931 0.948 -0.694 1.00 . A A . 2 ALA HA 1 1 25 10438 1 1 2 ALA HB1 H -20.143 3.017 -1.920 1.00 . A A . 2 ALA HB1 1 1 25 10439 1 1 2 ALA HB2 H -18.731 2.184 -2.569 1.00 . A A . 2 ALA HB2 1 1 25 10440 1 1 2 ALA HB3 H -18.522 3.528 -1.446 1.00 . A A . 2 ALA HB3 1 1 25 10441 1 1 2 ALA N N -19.529 2.536 0.667 1.00 . A A . 2 ALA N 1 1 25 10442 1 1 2 ALA O O -17.227 1.101 0.745 1.00 . A A . 2 ALA O 1 1 25 10443 1 1 3 TRP C C -14.816 0.834 -1.387 1.00 . A A . 3 TRP C 1 1 25 10444 1 1 3 TRP CA C -15.932 -0.222 -1.245 1.00 . A A . 3 TRP CA 1 1 25 10445 1 1 3 TRP CB C -15.882 -1.275 -2.376 1.00 . A A . 3 TRP CB 1 1 25 10446 1 1 3 TRP CD1 C -15.293 0.009 -4.485 1.00 . A A . 3 TRP CD1 1 1 25 10447 1 1 3 TRP CD2 C -17.450 -0.627 -4.432 1.00 . A A . 3 TRP CD2 1 1 25 10448 1 1 3 TRP CE2 C -17.264 0.074 -5.646 1.00 . A A . 3 TRP CE2 1 1 25 10449 1 1 3 TRP CE3 C -18.731 -1.138 -4.151 1.00 . A A . 3 TRP CE3 1 1 25 10450 1 1 3 TRP CG C -16.184 -0.650 -3.708 1.00 . A A . 3 TRP CG 1 1 25 10451 1 1 3 TRP CH2 C -19.575 -0.254 -6.255 1.00 . A A . 3 TRP CH2 1 1 25 10452 1 1 3 TRP CZ2 C -18.310 0.261 -6.549 1.00 . A A . 3 TRP CZ2 1 1 25 10453 1 1 3 TRP CZ3 C -19.785 -0.952 -5.058 1.00 . A A . 3 TRP CZ3 1 1 25 10454 1 1 3 TRP H H -17.761 0.411 -2.205 1.00 . A A . 3 TRP H 1 1 25 10455 1 1 3 TRP HA H -15.846 -0.715 -0.288 1.00 . A A . 3 TRP HA 1 1 25 10456 1 1 3 TRP HB2 H -14.899 -1.720 -2.408 1.00 . A A . 3 TRP HB2 1 1 25 10457 1 1 3 TRP HB3 H -16.611 -2.046 -2.172 1.00 . A A . 3 TRP HB3 1 1 25 10458 1 1 3 TRP HD1 H -14.253 0.174 -4.248 1.00 . A A . 3 TRP HD1 1 1 25 10459 1 1 3 TRP HE1 H -15.514 0.946 -6.359 1.00 . A A . 3 TRP HE1 1 1 25 10460 1 1 3 TRP HE3 H -18.902 -1.678 -3.231 1.00 . A A . 3 TRP HE3 1 1 25 10461 1 1 3 TRP HH2 H -20.390 -0.113 -6.949 1.00 . A A . 3 TRP HH2 1 1 25 10462 1 1 3 TRP HZ2 H -18.143 0.800 -7.470 1.00 . A A . 3 TRP HZ2 1 1 25 10463 1 1 3 TRP HZ3 H -20.763 -1.349 -4.833 1.00 . A A . 3 TRP HZ3 1 1 25 10464 1 1 3 TRP N N -17.274 0.434 -1.358 1.00 . A A . 3 TRP N 1 1 25 10465 1 1 3 TRP NE1 N -15.934 0.442 -5.633 1.00 . A A . 3 TRP NE1 1 1 25 10466 1 1 3 TRP O O -14.973 1.960 -0.955 1.00 . A A . 3 TRP O 1 1 25 10467 1 1 4 TYR C C -12.006 1.903 -0.772 1.00 . A A . 4 TYR C 1 1 25 10468 1 1 4 TYR CA C -12.553 1.447 -2.138 1.00 . A A . 4 TYR CA 1 1 25 10469 1 1 4 TYR CB C -13.127 2.644 -2.916 1.00 . A A . 4 TYR CB 1 1 25 10470 1 1 4 TYR CD1 C -11.431 2.255 -4.749 1.00 . A A . 4 TYR CD1 1 1 25 10471 1 1 4 TYR CD2 C -13.722 2.758 -5.361 1.00 . A A . 4 TYR CD2 1 1 25 10472 1 1 4 TYR CE1 C -11.089 2.170 -6.103 1.00 . A A . 4 TYR CE1 1 1 25 10473 1 1 4 TYR CE2 C -13.380 2.674 -6.714 1.00 . A A . 4 TYR CE2 1 1 25 10474 1 1 4 TYR CG C -12.749 2.548 -4.377 1.00 . A A . 4 TYR CG 1 1 25 10475 1 1 4 TYR CZ C -12.063 2.380 -7.086 1.00 . A A . 4 TYR CZ 1 1 25 10476 1 1 4 TYR H H -13.586 -0.440 -2.300 1.00 . A A . 4 TYR H 1 1 25 10477 1 1 4 TYR HA H -11.763 0.989 -2.711 1.00 . A A . 4 TYR HA 1 1 25 10478 1 1 4 TYR HB2 H -14.202 2.650 -2.827 1.00 . A A . 4 TYR HB2 1 1 25 10479 1 1 4 TYR HB3 H -12.731 3.561 -2.504 1.00 . A A . 4 TYR HB3 1 1 25 10480 1 1 4 TYR HD1 H -10.678 2.092 -3.992 1.00 . A A . 4 TYR HD1 1 1 25 10481 1 1 4 TYR HD2 H -14.739 2.986 -5.074 1.00 . A A . 4 TYR HD2 1 1 25 10482 1 1 4 TYR HE1 H -10.073 1.944 -6.390 1.00 . A A . 4 TYR HE1 1 1 25 10483 1 1 4 TYR HE2 H -14.132 2.837 -7.471 1.00 . A A . 4 TYR HE2 1 1 25 10484 1 1 4 TYR HH H -11.545 3.186 -8.739 1.00 . A A . 4 TYR HH 1 1 25 10485 1 1 4 TYR N N -13.690 0.475 -1.973 1.00 . A A . 4 TYR N 1 1 25 10486 1 1 4 TYR O O -11.291 2.884 -0.682 1.00 . A A . 4 TYR O 1 1 25 10487 1 1 4 TYR OH O -11.726 2.297 -8.421 1.00 . A A . 4 TYR OH 1 1 25 10488 1 1 5 SER C C -10.738 0.601 2.089 1.00 . A A . 5 SER C 1 1 25 10489 1 1 5 SER CA C -11.819 1.586 1.639 1.00 . A A . 5 SER CA 1 1 25 10490 1 1 5 SER CB C -13.037 1.521 2.567 1.00 . A A . 5 SER CB 1 1 25 10491 1 1 5 SER H H -12.895 0.405 0.194 1.00 . A A . 5 SER H 1 1 25 10492 1 1 5 SER HA H -11.424 2.586 1.617 1.00 . A A . 5 SER HA 1 1 25 10493 1 1 5 SER HB2 H -12.710 1.524 3.593 1.00 . A A . 5 SER HB2 1 1 25 10494 1 1 5 SER HB3 H -13.666 2.385 2.391 1.00 . A A . 5 SER HB3 1 1 25 10495 1 1 5 SER HG H -14.675 0.570 2.107 1.00 . A A . 5 SER HG 1 1 25 10496 1 1 5 SER N N -12.326 1.197 0.287 1.00 . A A . 5 SER N 1 1 25 10497 1 1 5 SER O O -9.662 0.989 2.503 1.00 . A A . 5 SER O 1 1 25 10498 1 1 5 SER OG O -13.769 0.325 2.313 1.00 . A A . 5 SER OG 1 1 25 10499 1 1 6 HIS C C -9.045 -1.961 1.243 1.00 . A A . 6 HIS C 1 1 25 10500 1 1 6 HIS CA C -10.011 -1.698 2.401 1.00 . A A . 6 HIS CA 1 1 25 10501 1 1 6 HIS CB C -10.827 -2.953 2.728 1.00 . A A . 6 HIS CB 1 1 25 10502 1 1 6 HIS CD2 C -9.103 -4.934 2.854 1.00 . A A . 6 HIS CD2 1 1 25 10503 1 1 6 HIS CE1 C -8.971 -5.101 5.010 1.00 . A A . 6 HIS CE1 1 1 25 10504 1 1 6 HIS CG C -9.939 -3.979 3.379 1.00 . A A . 6 HIS CG 1 1 25 10505 1 1 6 HIS H H -11.890 -0.949 1.651 1.00 . A A . 6 HIS H 1 1 25 10506 1 1 6 HIS HA H -9.468 -1.370 3.269 1.00 . A A . 6 HIS HA 1 1 25 10507 1 1 6 HIS HB2 H -11.631 -2.695 3.401 1.00 . A A . 6 HIS HB2 1 1 25 10508 1 1 6 HIS HB3 H -11.238 -3.361 1.817 1.00 . A A . 6 HIS HB3 1 1 25 10509 1 1 6 HIS HD1 H -10.315 -3.566 5.423 1.00 . A A . 6 HIS HD1 1 1 25 10510 1 1 6 HIS HD2 H -8.944 -5.109 1.801 1.00 . A A . 6 HIS HD2 1 1 25 10511 1 1 6 HIS HE1 H -8.696 -5.425 6.003 1.00 . A A . 6 HIS HE1 1 1 25 10512 1 1 6 HIS N N -11.018 -0.670 1.997 1.00 . A A . 6 HIS N 1 1 25 10513 1 1 6 HIS ND1 N -9.838 -4.104 4.756 1.00 . A A . 6 HIS ND1 1 1 25 10514 1 1 6 HIS NE2 N -8.494 -5.641 3.886 1.00 . A A . 6 HIS NE2 1 1 25 10515 1 1 6 HIS O O -7.868 -2.196 1.447 1.00 . A A . 6 HIS O 1 1 25 10516 1 1 7 TYR C C -7.572 -1.075 -1.226 1.00 . A A . 7 TYR C 1 1 25 10517 1 1 7 TYR CA C -8.652 -2.156 -1.153 1.00 . A A . 7 TYR CA 1 1 25 10518 1 1 7 TYR CB C -9.571 -2.087 -2.380 1.00 . A A . 7 TYR CB 1 1 25 10519 1 1 7 TYR CD1 C -10.059 -4.554 -2.617 1.00 . A A . 7 TYR CD1 1 1 25 10520 1 1 7 TYR CD2 C -11.889 -3.044 -2.111 1.00 . A A . 7 TYR CD2 1 1 25 10521 1 1 7 TYR CE1 C -10.949 -5.634 -2.606 1.00 . A A . 7 TYR CE1 1 1 25 10522 1 1 7 TYR CE2 C -12.778 -4.124 -2.100 1.00 . A A . 7 TYR CE2 1 1 25 10523 1 1 7 TYR CG C -10.529 -3.257 -2.368 1.00 . A A . 7 TYR CG 1 1 25 10524 1 1 7 TYR CZ C -12.307 -5.420 -2.348 1.00 . A A . 7 TYR CZ 1 1 25 10525 1 1 7 TYR H H -10.485 -1.718 -0.100 1.00 . A A . 7 TYR H 1 1 25 10526 1 1 7 TYR HA H -8.195 -3.126 -1.085 1.00 . A A . 7 TYR HA 1 1 25 10527 1 1 7 TYR HB2 H -10.130 -1.164 -2.357 1.00 . A A . 7 TYR HB2 1 1 25 10528 1 1 7 TYR HB3 H -8.973 -2.123 -3.278 1.00 . A A . 7 TYR HB3 1 1 25 10529 1 1 7 TYR HD1 H -9.010 -4.719 -2.816 1.00 . A A . 7 TYR HD1 1 1 25 10530 1 1 7 TYR HD2 H -12.251 -2.045 -1.919 1.00 . A A . 7 TYR HD2 1 1 25 10531 1 1 7 TYR HE1 H -10.586 -6.633 -2.798 1.00 . A A . 7 TYR HE1 1 1 25 10532 1 1 7 TYR HE2 H -13.826 -3.960 -1.902 1.00 . A A . 7 TYR HE2 1 1 25 10533 1 1 7 TYR HH H -13.287 -6.773 -1.425 1.00 . A A . 7 TYR HH 1 1 25 10534 1 1 7 TYR N N -9.536 -1.916 0.030 1.00 . A A . 7 TYR N 1 1 25 10535 1 1 7 TYR O O -6.408 -1.367 -1.427 1.00 . A A . 7 TYR O 1 1 25 10536 1 1 7 TYR OH O -13.184 -6.484 -2.335 1.00 . A A . 7 TYR OH 1 1 25 10537 1 1 8 VAL C C -5.979 1.126 0.120 1.00 . A A . 8 VAL C 1 1 25 10538 1 1 8 VAL CA C -6.931 1.262 -1.079 1.00 . A A . 8 VAL CA 1 1 25 10539 1 1 8 VAL CB C -7.730 2.575 -1.018 1.00 . A A . 8 VAL CB 1 1 25 10540 1 1 8 VAL CG1 C -8.240 2.824 0.405 1.00 . A A . 8 VAL CG1 1 1 25 10541 1 1 8 VAL CG2 C -6.826 3.737 -1.441 1.00 . A A . 8 VAL CG2 1 1 25 10542 1 1 8 VAL H H -8.887 0.368 -0.867 1.00 . A A . 8 VAL H 1 1 25 10543 1 1 8 VAL HA H -6.372 1.216 -1.997 1.00 . A A . 8 VAL HA 1 1 25 10544 1 1 8 VAL HB H -8.571 2.513 -1.692 1.00 . A A . 8 VAL HB 1 1 25 10545 1 1 8 VAL HG11 H -9.067 3.519 0.373 1.00 . A A . 8 VAL HG11 1 1 25 10546 1 1 8 VAL HG12 H -7.445 3.239 1.006 1.00 . A A . 8 VAL HG12 1 1 25 10547 1 1 8 VAL HG13 H -8.570 1.893 0.836 1.00 . A A . 8 VAL HG13 1 1 25 10548 1 1 8 VAL HG21 H -7.377 4.664 -1.376 1.00 . A A . 8 VAL HG21 1 1 25 10549 1 1 8 VAL HG22 H -6.496 3.585 -2.458 1.00 . A A . 8 VAL HG22 1 1 25 10550 1 1 8 VAL HG23 H -5.968 3.783 -0.787 1.00 . A A . 8 VAL HG23 1 1 25 10551 1 1 8 VAL N N -7.946 0.164 -1.043 1.00 . A A . 8 VAL N 1 1 25 10552 1 1 8 VAL O O -4.842 1.552 0.070 1.00 . A A . 8 VAL O 1 1 25 10553 1 1 9 LEU C C -4.486 -0.720 2.085 1.00 . A A . 9 LEU C 1 1 25 10554 1 1 9 LEU CA C -5.565 0.330 2.386 1.00 . A A . 9 LEU CA 1 1 25 10555 1 1 9 LEU CB C -6.507 -0.156 3.498 1.00 . A A . 9 LEU CB 1 1 25 10556 1 1 9 LEU CD1 C -4.653 -0.248 5.187 1.00 . A A . 9 LEU CD1 1 1 25 10557 1 1 9 LEU CD2 C -5.929 1.877 4.853 1.00 . A A . 9 LEU CD2 1 1 25 10558 1 1 9 LEU CG C -6.026 0.347 4.867 1.00 . A A . 9 LEU CG 1 1 25 10559 1 1 9 LEU H H -7.354 0.173 1.196 1.00 . A A . 9 LEU H 1 1 25 10560 1 1 9 LEU HA H -5.110 1.266 2.670 1.00 . A A . 9 LEU HA 1 1 25 10561 1 1 9 LEU HB2 H -7.503 0.216 3.311 1.00 . A A . 9 LEU HB2 1 1 25 10562 1 1 9 LEU HB3 H -6.526 -1.236 3.503 1.00 . A A . 9 LEU HB3 1 1 25 10563 1 1 9 LEU HD11 H -4.484 -0.209 6.253 1.00 . A A . 9 LEU HD11 1 1 25 10564 1 1 9 LEU HD12 H -3.887 0.320 4.680 1.00 . A A . 9 LEU HD12 1 1 25 10565 1 1 9 LEU HD13 H -4.619 -1.275 4.855 1.00 . A A . 9 LEU HD13 1 1 25 10566 1 1 9 LEU HD21 H -6.790 2.288 4.348 1.00 . A A . 9 LEU HD21 1 1 25 10567 1 1 9 LEU HD22 H -5.030 2.177 4.334 1.00 . A A . 9 LEU HD22 1 1 25 10568 1 1 9 LEU HD23 H -5.898 2.243 5.868 1.00 . A A . 9 LEU HD23 1 1 25 10569 1 1 9 LEU HG H -6.732 0.040 5.625 1.00 . A A . 9 LEU HG 1 1 25 10570 1 1 9 LEU N N -6.437 0.518 1.188 1.00 . A A . 9 LEU N 1 1 25 10571 1 1 9 LEU O O -3.341 -0.569 2.469 1.00 . A A . 9 LEU O 1 1 25 10572 1 1 10 LYS C C -2.871 -2.321 -0.022 1.00 . A A . 10 LYS C 1 1 25 10573 1 1 10 LYS CA C -3.829 -2.833 1.062 1.00 . A A . 10 LYS CA 1 1 25 10574 1 1 10 LYS CB C -4.642 -4.029 0.550 1.00 . A A . 10 LYS CB 1 1 25 10575 1 1 10 LYS CD C -3.626 -5.731 2.089 1.00 . A A . 10 LYS CD 1 1 25 10576 1 1 10 LYS CE C -4.470 -6.983 2.361 1.00 . A A . 10 LYS CE 1 1 25 10577 1 1 10 LYS CG C -3.791 -5.301 0.626 1.00 . A A . 10 LYS CG 1 1 25 10578 1 1 10 LYS H H -5.771 -1.879 1.084 1.00 . A A . 10 LYS H 1 1 25 10579 1 1 10 LYS HA H -3.278 -3.112 1.945 1.00 . A A . 10 LYS HA 1 1 25 10580 1 1 10 LYS HB2 H -5.526 -4.149 1.159 1.00 . A A . 10 LYS HB2 1 1 25 10581 1 1 10 LYS HB3 H -4.932 -3.853 -0.475 1.00 . A A . 10 LYS HB3 1 1 25 10582 1 1 10 LYS HD2 H -2.586 -5.951 2.282 1.00 . A A . 10 LYS HD2 1 1 25 10583 1 1 10 LYS HD3 H -3.951 -4.933 2.739 1.00 . A A . 10 LYS HD3 1 1 25 10584 1 1 10 LYS HE2 H -4.856 -7.385 1.433 1.00 . A A . 10 LYS HE2 1 1 25 10585 1 1 10 LYS HE3 H -3.883 -7.728 2.876 1.00 . A A . 10 LYS HE3 1 1 25 10586 1 1 10 LYS HG2 H -4.278 -6.091 0.071 1.00 . A A . 10 LYS HG2 1 1 25 10587 1 1 10 LYS HG3 H -2.818 -5.110 0.198 1.00 . A A . 10 LYS HG3 1 1 25 10588 1 1 10 LYS HZ1 H -5.212 -6.231 4.158 1.00 . A A . 10 LYS HZ1 1 1 25 10589 1 1 10 LYS HZ2 H -6.268 -7.300 3.366 1.00 . A A . 10 LYS HZ2 1 1 25 10590 1 1 10 LYS HZ3 H -6.069 -5.715 2.788 1.00 . A A . 10 LYS HZ3 1 1 25 10591 1 1 10 LYS N N -4.840 -1.780 1.393 1.00 . A A . 10 LYS N 1 1 25 10592 1 1 10 LYS NZ N -5.588 -6.522 3.234 1.00 . A A . 10 LYS NZ 1 1 25 10593 1 1 10 LYS O O -1.683 -2.582 0.017 1.00 . A A . 10 LYS O 1 1 25 10594 1 1 11 PHE C C -1.470 -0.072 -1.478 1.00 . A A . 11 PHE C 1 1 25 10595 1 1 11 PHE CA C -2.500 -1.044 -2.069 1.00 . A A . 11 PHE CA 1 1 25 10596 1 1 11 PHE CB C -3.453 -0.315 -3.023 1.00 . A A . 11 PHE CB 1 1 25 10597 1 1 11 PHE CD1 C -2.247 -0.606 -5.221 1.00 . A A . 11 PHE CD1 1 1 25 10598 1 1 11 PHE CD2 C -2.398 1.615 -4.257 1.00 . A A . 11 PHE CD2 1 1 25 10599 1 1 11 PHE CE1 C -1.534 -0.085 -6.308 1.00 . A A . 11 PHE CE1 1 1 25 10600 1 1 11 PHE CE2 C -1.684 2.134 -5.343 1.00 . A A . 11 PHE CE2 1 1 25 10601 1 1 11 PHE CG C -2.680 0.244 -4.195 1.00 . A A . 11 PHE CG 1 1 25 10602 1 1 11 PHE CZ C -1.252 1.285 -6.368 1.00 . A A . 11 PHE CZ 1 1 25 10603 1 1 11 PHE H H -4.339 -1.385 -0.987 1.00 . A A . 11 PHE H 1 1 25 10604 1 1 11 PHE HA H -2.003 -1.851 -2.586 1.00 . A A . 11 PHE HA 1 1 25 10605 1 1 11 PHE HB2 H -4.200 -1.008 -3.383 1.00 . A A . 11 PHE HB2 1 1 25 10606 1 1 11 PHE HB3 H -3.939 0.493 -2.496 1.00 . A A . 11 PHE HB3 1 1 25 10607 1 1 11 PHE HD1 H -2.464 -1.662 -5.175 1.00 . A A . 11 PHE HD1 1 1 25 10608 1 1 11 PHE HD2 H -2.730 2.270 -3.466 1.00 . A A . 11 PHE HD2 1 1 25 10609 1 1 11 PHE HE1 H -1.201 -0.740 -7.099 1.00 . A A . 11 PHE HE1 1 1 25 10610 1 1 11 PHE HE2 H -1.466 3.191 -5.390 1.00 . A A . 11 PHE HE2 1 1 25 10611 1 1 11 PHE HZ H -0.702 1.686 -7.206 1.00 . A A . 11 PHE HZ 1 1 25 10612 1 1 11 PHE N N -3.378 -1.586 -0.983 1.00 . A A . 11 PHE N 1 1 25 10613 1 1 11 PHE O O -0.304 -0.110 -1.825 1.00 . A A . 11 PHE O 1 1 25 10614 1 1 12 PHE C C 0.120 0.999 0.858 1.00 . A A . 12 PHE C 1 1 25 10615 1 1 12 PHE CA C -0.933 1.759 0.042 1.00 . A A . 12 PHE CA 1 1 25 10616 1 1 12 PHE CB C -1.789 2.644 0.954 1.00 . A A . 12 PHE CB 1 1 25 10617 1 1 12 PHE CD1 C -0.006 4.152 1.909 1.00 . A A . 12 PHE CD1 1 1 25 10618 1 1 12 PHE CD2 C -1.669 5.107 0.424 1.00 . A A . 12 PHE CD2 1 1 25 10619 1 1 12 PHE CE1 C 0.595 5.408 2.043 1.00 . A A . 12 PHE CE1 1 1 25 10620 1 1 12 PHE CE2 C -1.066 6.363 0.558 1.00 . A A . 12 PHE CE2 1 1 25 10621 1 1 12 PHE CG C -1.139 4.000 1.099 1.00 . A A . 12 PHE CG 1 1 25 10622 1 1 12 PHE CZ C 0.066 6.514 1.368 1.00 . A A . 12 PHE CZ 1 1 25 10623 1 1 12 PHE H H -2.835 0.795 -0.314 1.00 . A A . 12 PHE H 1 1 25 10624 1 1 12 PHE HA H -0.460 2.360 -0.718 1.00 . A A . 12 PHE HA 1 1 25 10625 1 1 12 PHE HB2 H -2.772 2.762 0.523 1.00 . A A . 12 PHE HB2 1 1 25 10626 1 1 12 PHE HB3 H -1.876 2.182 1.926 1.00 . A A . 12 PHE HB3 1 1 25 10627 1 1 12 PHE HD1 H 0.403 3.298 2.430 1.00 . A A . 12 PHE HD1 1 1 25 10628 1 1 12 PHE HD2 H -2.543 4.991 -0.201 1.00 . A A . 12 PHE HD2 1 1 25 10629 1 1 12 PHE HE1 H 1.470 5.524 2.669 1.00 . A A . 12 PHE HE1 1 1 25 10630 1 1 12 PHE HE2 H -1.474 7.217 0.037 1.00 . A A . 12 PHE HE2 1 1 25 10631 1 1 12 PHE HZ H 0.531 7.483 1.471 1.00 . A A . 12 PHE HZ 1 1 25 10632 1 1 12 PHE N N -1.890 0.790 -0.582 1.00 . A A . 12 PHE N 1 1 25 10633 1 1 12 PHE O O 1.295 1.313 0.811 1.00 . A A . 12 PHE O 1 1 25 10634 1 1 13 LEU C C 1.691 -1.502 1.477 1.00 . A A . 13 LEU C 1 1 25 10635 1 1 13 LEU CA C 0.681 -0.805 2.402 1.00 . A A . 13 LEU CA 1 1 25 10636 1 1 13 LEU CB C -0.169 -1.838 3.147 1.00 . A A . 13 LEU CB 1 1 25 10637 1 1 13 LEU CD1 C 0.387 -1.448 5.555 1.00 . A A . 13 LEU CD1 1 1 25 10638 1 1 13 LEU CD2 C 0.107 -3.778 4.700 1.00 . A A . 13 LEU CD2 1 1 25 10639 1 1 13 LEU CG C 0.606 -2.372 4.355 1.00 . A A . 13 LEU CG 1 1 25 10640 1 1 13 LEU H H -1.244 -0.245 1.602 1.00 . A A . 13 LEU H 1 1 25 10641 1 1 13 LEU HA H 1.192 -0.169 3.107 1.00 . A A . 13 LEU HA 1 1 25 10642 1 1 13 LEU HB2 H -1.086 -1.375 3.484 1.00 . A A . 13 LEU HB2 1 1 25 10643 1 1 13 LEU HB3 H -0.403 -2.657 2.482 1.00 . A A . 13 LEU HB3 1 1 25 10644 1 1 13 LEU HD11 H -0.672 -1.291 5.701 1.00 . A A . 13 LEU HD11 1 1 25 10645 1 1 13 LEU HD12 H 0.870 -0.499 5.372 1.00 . A A . 13 LEU HD12 1 1 25 10646 1 1 13 LEU HD13 H 0.809 -1.901 6.440 1.00 . A A . 13 LEU HD13 1 1 25 10647 1 1 13 LEU HD21 H 0.171 -4.408 3.824 1.00 . A A . 13 LEU HD21 1 1 25 10648 1 1 13 LEU HD22 H -0.920 -3.725 5.032 1.00 . A A . 13 LEU HD22 1 1 25 10649 1 1 13 LEU HD23 H 0.718 -4.193 5.488 1.00 . A A . 13 LEU HD23 1 1 25 10650 1 1 13 LEU HG H 1.660 -2.411 4.119 1.00 . A A . 13 LEU HG 1 1 25 10651 1 1 13 LEU N N -0.293 -0.007 1.592 1.00 . A A . 13 LEU N 1 1 25 10652 1 1 13 LEU O O 2.831 -1.713 1.843 1.00 . A A . 13 LEU O 1 1 25 10653 1 1 14 LEU C C 3.090 -1.494 -1.379 1.00 . A A . 14 LEU C 1 1 25 10654 1 1 14 LEU CA C 2.208 -2.531 -0.673 1.00 . A A . 14 LEU CA 1 1 25 10655 1 1 14 LEU CB C 1.301 -3.245 -1.682 1.00 . A A . 14 LEU CB 1 1 25 10656 1 1 14 LEU CD1 C 1.909 -5.638 -1.277 1.00 . A A . 14 LEU CD1 1 1 25 10657 1 1 14 LEU CD2 C 1.403 -4.853 -3.594 1.00 . A A . 14 LEU CD2 1 1 25 10658 1 1 14 LEU CG C 2.030 -4.464 -2.252 1.00 . A A . 14 LEU CG 1 1 25 10659 1 1 14 LEU H H 0.353 -1.669 0.011 1.00 . A A . 14 LEU H 1 1 25 10660 1 1 14 LEU HA H 2.819 -3.247 -0.155 1.00 . A A . 14 LEU HA 1 1 25 10661 1 1 14 LEU HB2 H 0.392 -3.562 -1.189 1.00 . A A . 14 LEU HB2 1 1 25 10662 1 1 14 LEU HB3 H 1.055 -2.568 -2.486 1.00 . A A . 14 LEU HB3 1 1 25 10663 1 1 14 LEU HD11 H 0.873 -5.928 -1.187 1.00 . A A . 14 LEU HD11 1 1 25 10664 1 1 14 LEU HD12 H 2.285 -5.340 -0.309 1.00 . A A . 14 LEU HD12 1 1 25 10665 1 1 14 LEU HD13 H 2.487 -6.473 -1.644 1.00 . A A . 14 LEU HD13 1 1 25 10666 1 1 14 LEU HD21 H 1.882 -5.746 -3.968 1.00 . A A . 14 LEU HD21 1 1 25 10667 1 1 14 LEU HD22 H 1.541 -4.048 -4.301 1.00 . A A . 14 LEU HD22 1 1 25 10668 1 1 14 LEU HD23 H 0.348 -5.039 -3.459 1.00 . A A . 14 LEU HD23 1 1 25 10669 1 1 14 LEU HG H 3.074 -4.224 -2.396 1.00 . A A . 14 LEU HG 1 1 25 10670 1 1 14 LEU N N 1.278 -1.854 0.282 1.00 . A A . 14 LEU N 1 1 25 10671 1 1 14 LEU O O 4.301 -1.611 -1.406 1.00 . A A . 14 LEU O 1 1 25 10672 1 1 15 VAL C C 4.154 1.334 -1.659 1.00 . A A . 15 VAL C 1 1 25 10673 1 1 15 VAL CA C 3.271 0.573 -2.658 1.00 . A A . 15 VAL CA 1 1 25 10674 1 1 15 VAL CB C 2.223 1.504 -3.284 1.00 . A A . 15 VAL CB 1 1 25 10675 1 1 15 VAL CG1 C 2.910 2.737 -3.880 1.00 . A A . 15 VAL CG1 1 1 25 10676 1 1 15 VAL CG2 C 1.476 0.757 -4.393 1.00 . A A . 15 VAL CG2 1 1 25 10677 1 1 15 VAL H H 1.507 -0.421 -1.903 1.00 . A A . 15 VAL H 1 1 25 10678 1 1 15 VAL HA H 3.878 0.129 -3.432 1.00 . A A . 15 VAL HA 1 1 25 10679 1 1 15 VAL HB H 1.521 1.817 -2.525 1.00 . A A . 15 VAL HB 1 1 25 10680 1 1 15 VAL HG11 H 2.936 3.525 -3.143 1.00 . A A . 15 VAL HG11 1 1 25 10681 1 1 15 VAL HG12 H 2.360 3.072 -4.746 1.00 . A A . 15 VAL HG12 1 1 25 10682 1 1 15 VAL HG13 H 3.919 2.482 -4.171 1.00 . A A . 15 VAL HG13 1 1 25 10683 1 1 15 VAL HG21 H 0.437 1.051 -4.387 1.00 . A A . 15 VAL HG21 1 1 25 10684 1 1 15 VAL HG22 H 1.550 -0.307 -4.226 1.00 . A A . 15 VAL HG22 1 1 25 10685 1 1 15 VAL HG23 H 1.914 1.001 -5.350 1.00 . A A . 15 VAL HG23 1 1 25 10686 1 1 15 VAL N N 2.485 -0.483 -1.946 1.00 . A A . 15 VAL N 1 1 25 10687 1 1 15 VAL O O 5.356 1.420 -1.828 1.00 . A A . 15 VAL O 1 1 25 10688 1 1 16 PHE C C 5.258 1.653 1.198 1.00 . A A . 16 PHE C 1 1 25 10689 1 1 16 PHE CA C 4.384 2.624 0.390 1.00 . A A . 16 PHE CA 1 1 25 10690 1 1 16 PHE CB C 3.367 3.318 1.300 1.00 . A A . 16 PHE CB 1 1 25 10691 1 1 16 PHE CD1 C 3.862 5.788 1.205 1.00 . A A . 16 PHE CD1 1 1 25 10692 1 1 16 PHE CD2 C 4.679 4.507 3.094 1.00 . A A . 16 PHE CD2 1 1 25 10693 1 1 16 PHE CE1 C 4.435 6.946 1.743 1.00 . A A . 16 PHE CE1 1 1 25 10694 1 1 16 PHE CE2 C 5.251 5.665 3.632 1.00 . A A . 16 PHE CE2 1 1 25 10695 1 1 16 PHE CG C 3.983 4.569 1.881 1.00 . A A . 16 PHE CG 1 1 25 10696 1 1 16 PHE CZ C 5.129 6.885 2.956 1.00 . A A . 16 PHE CZ 1 1 25 10697 1 1 16 PHE H H 2.601 1.787 -0.500 1.00 . A A . 16 PHE H 1 1 25 10698 1 1 16 PHE HA H 5.001 3.361 -0.101 1.00 . A A . 16 PHE HA 1 1 25 10699 1 1 16 PHE HB2 H 2.490 3.583 0.725 1.00 . A A . 16 PHE HB2 1 1 25 10700 1 1 16 PHE HB3 H 3.085 2.651 2.100 1.00 . A A . 16 PHE HB3 1 1 25 10701 1 1 16 PHE HD1 H 3.326 5.837 0.269 1.00 . A A . 16 PHE HD1 1 1 25 10702 1 1 16 PHE HD2 H 4.772 3.566 3.616 1.00 . A A . 16 PHE HD2 1 1 25 10703 1 1 16 PHE HE1 H 4.341 7.888 1.222 1.00 . A A . 16 PHE HE1 1 1 25 10704 1 1 16 PHE HE2 H 5.787 5.617 4.568 1.00 . A A . 16 PHE HE2 1 1 25 10705 1 1 16 PHE HZ H 5.572 7.779 3.372 1.00 . A A . 16 PHE HZ 1 1 25 10706 1 1 16 PHE N N 3.572 1.876 -0.620 1.00 . A A . 16 PHE N 1 1 25 10707 1 1 16 PHE O O 6.312 2.020 1.679 1.00 . A A . 16 PHE O 1 1 25 10708 1 1 17 GLY C C 6.966 -0.830 1.401 1.00 . A A . 17 GLY C 1 1 25 10709 1 1 17 GLY CA C 5.638 -0.574 2.117 1.00 . A A . 17 GLY CA 1 1 25 10710 1 1 17 GLY H H 3.976 0.144 0.948 1.00 . A A . 17 GLY H 1 1 25 10711 1 1 17 GLY HA2 H 5.832 -0.187 3.109 1.00 . A A . 17 GLY HA2 1 1 25 10712 1 1 17 GLY HA3 H 5.092 -1.502 2.195 1.00 . A A . 17 GLY HA3 1 1 25 10713 1 1 17 GLY N N 4.829 0.419 1.346 1.00 . A A . 17 GLY N 1 1 25 10714 1 1 17 GLY O O 8.018 -0.801 2.008 1.00 . A A . 17 GLY O 1 1 25 10715 1 1 18 GLU C C 9.069 -0.060 -0.674 1.00 . A A . 18 GLU C 1 1 25 10716 1 1 18 GLU CA C 8.200 -1.326 -0.638 1.00 . A A . 18 GLU CA 1 1 25 10717 1 1 18 GLU CB C 7.770 -1.735 -2.050 1.00 . A A . 18 GLU CB 1 1 25 10718 1 1 18 GLU CD C 7.050 -3.689 -3.447 1.00 . A A . 18 GLU CD 1 1 25 10719 1 1 18 GLU CG C 7.745 -3.265 -2.149 1.00 . A A . 18 GLU CG 1 1 25 10720 1 1 18 GLU H H 6.069 -1.090 -0.358 1.00 . A A . 18 GLU H 1 1 25 10721 1 1 18 GLU HA H 8.746 -2.129 -0.175 1.00 . A A . 18 GLU HA 1 1 25 10722 1 1 18 GLU HB2 H 6.783 -1.343 -2.255 1.00 . A A . 18 GLU HB2 1 1 25 10723 1 1 18 GLU HB3 H 8.471 -1.341 -2.770 1.00 . A A . 18 GLU HB3 1 1 25 10724 1 1 18 GLU HG2 H 8.758 -3.640 -2.145 1.00 . A A . 18 GLU HG2 1 1 25 10725 1 1 18 GLU HG3 H 7.206 -3.671 -1.307 1.00 . A A . 18 GLU HG3 1 1 25 10726 1 1 18 GLU N N 6.930 -1.074 0.114 1.00 . A A . 18 GLU N 1 1 25 10727 1 1 18 GLU O O 10.275 -0.131 -0.813 1.00 . A A . 18 GLU O 1 1 25 10728 1 1 18 GLU OE1 O 5.841 -3.854 -3.423 1.00 . A A . 18 GLU OE1 1 1 25 10729 1 1 18 GLU OE2 O 7.741 -3.848 -4.440 1.00 . A A . 18 GLU OE2 1 1 25 10730 1 1 19 ASN C C 10.098 2.480 0.744 1.00 . A A . 19 ASN C 1 1 25 10731 1 1 19 ASN CA C 9.267 2.360 -0.543 1.00 . A A . 19 ASN CA 1 1 25 10732 1 1 19 ASN CB C 8.239 3.493 -0.625 1.00 . A A . 19 ASN CB 1 1 25 10733 1 1 19 ASN CG C 8.021 3.879 -2.089 1.00 . A A . 19 ASN CG 1 1 25 10734 1 1 19 ASN H H 7.499 1.129 -0.411 1.00 . A A . 19 ASN H 1 1 25 10735 1 1 19 ASN HA H 9.913 2.386 -1.403 1.00 . A A . 19 ASN HA 1 1 25 10736 1 1 19 ASN HB2 H 7.304 3.164 -0.195 1.00 . A A . 19 ASN HB2 1 1 25 10737 1 1 19 ASN HB3 H 8.604 4.350 -0.080 1.00 . A A . 19 ASN HB3 1 1 25 10738 1 1 19 ASN HD21 H 6.485 2.642 -2.338 1.00 . A A . 19 ASN HD21 1 1 25 10739 1 1 19 ASN HD22 H 6.915 3.551 -3.705 1.00 . A A . 19 ASN HD22 1 1 25 10740 1 1 19 ASN N N 8.469 1.096 -0.533 1.00 . A A . 19 ASN N 1 1 25 10741 1 1 19 ASN ND2 N 7.061 3.311 -2.767 1.00 . A A . 19 ASN ND2 1 1 25 10742 1 1 19 ASN O O 11.064 3.216 0.797 1.00 . A A . 19 ASN O 1 1 25 10743 1 1 19 ASN OD1 O 8.731 4.708 -2.623 1.00 . A A . 19 ASN OD1 1 1 25 10744 1 1 20 GLY C C 11.125 0.482 3.392 1.00 . A A . 20 GLY C 1 1 25 10745 1 1 20 GLY CA C 10.484 1.839 3.064 1.00 . A A . 20 GLY CA 1 1 25 10746 1 1 20 GLY H H 8.937 1.188 1.712 1.00 . A A . 20 GLY H 1 1 25 10747 1 1 20 GLY HA2 H 11.257 2.588 2.980 1.00 . A A . 20 GLY HA2 1 1 25 10748 1 1 20 GLY HA3 H 9.808 2.113 3.861 1.00 . A A . 20 GLY HA3 1 1 25 10749 1 1 20 GLY N N 9.723 1.767 1.779 1.00 . A A . 20 GLY N 1 1 25 10750 1 1 20 GLY O O 12.175 0.425 4.002 1.00 . A A . 20 GLY O 1 1 25 10751 1 1 21 VAL C C 11.925 -2.483 2.148 1.00 . A A . 21 VAL C 1 1 25 10752 1 1 21 VAL CA C 11.087 -1.957 3.322 1.00 . A A . 21 VAL CA 1 1 25 10753 1 1 21 VAL CB C 9.879 -2.869 3.583 1.00 . A A . 21 VAL CB 1 1 25 10754 1 1 21 VAL CG1 C 10.351 -4.308 3.806 1.00 . A A . 21 VAL CG1 1 1 25 10755 1 1 21 VAL CG2 C 9.131 -2.387 4.830 1.00 . A A . 21 VAL CG2 1 1 25 10756 1 1 21 VAL H H 9.649 -0.549 2.526 1.00 . A A . 21 VAL H 1 1 25 10757 1 1 21 VAL HA H 11.695 -1.897 4.207 1.00 . A A . 21 VAL HA 1 1 25 10758 1 1 21 VAL HB H 9.215 -2.837 2.729 1.00 . A A . 21 VAL HB 1 1 25 10759 1 1 21 VAL HG11 H 11.117 -4.323 4.567 1.00 . A A . 21 VAL HG11 1 1 25 10760 1 1 21 VAL HG12 H 10.751 -4.704 2.884 1.00 . A A . 21 VAL HG12 1 1 25 10761 1 1 21 VAL HG13 H 9.516 -4.915 4.123 1.00 . A A . 21 VAL HG13 1 1 25 10762 1 1 21 VAL HG21 H 8.968 -1.321 4.764 1.00 . A A . 21 VAL HG21 1 1 25 10763 1 1 21 VAL HG22 H 9.718 -2.607 5.710 1.00 . A A . 21 VAL HG22 1 1 25 10764 1 1 21 VAL HG23 H 8.178 -2.892 4.897 1.00 . A A . 21 VAL HG23 1 1 25 10765 1 1 21 VAL N N 10.503 -0.611 3.009 1.00 . A A . 21 VAL N 1 1 25 10766 1 1 21 VAL O O 12.851 -3.247 2.340 1.00 . A A . 21 VAL O 1 1 25 10767 1 1 22 PHE C C 13.381 -1.497 -0.729 1.00 . A A . 22 PHE C 1 1 25 10768 1 1 22 PHE CA C 12.399 -2.572 -0.235 1.00 . A A . 22 PHE CA 1 1 25 10769 1 1 22 PHE CB C 11.359 -2.889 -1.314 1.00 . A A . 22 PHE CB 1 1 25 10770 1 1 22 PHE CD1 C 10.464 -5.185 -0.776 1.00 . A A . 22 PHE CD1 1 1 25 10771 1 1 22 PHE CD2 C 12.120 -4.960 -2.534 1.00 . A A . 22 PHE CD2 1 1 25 10772 1 1 22 PHE CE1 C 10.424 -6.567 -0.992 1.00 . A A . 22 PHE CE1 1 1 25 10773 1 1 22 PHE CE2 C 12.079 -6.342 -2.748 1.00 . A A . 22 PHE CE2 1 1 25 10774 1 1 22 PHE CG C 11.312 -4.381 -1.548 1.00 . A A . 22 PHE CG 1 1 25 10775 1 1 22 PHE CZ C 11.230 -7.146 -1.978 1.00 . A A . 22 PHE CZ 1 1 25 10776 1 1 22 PHE H H 10.863 -1.471 0.811 1.00 . A A . 22 PHE H 1 1 25 10777 1 1 22 PHE HA H 12.936 -3.468 0.024 1.00 . A A . 22 PHE HA 1 1 25 10778 1 1 22 PHE HB2 H 10.386 -2.545 -0.991 1.00 . A A . 22 PHE HB2 1 1 25 10779 1 1 22 PHE HB3 H 11.628 -2.390 -2.233 1.00 . A A . 22 PHE HB3 1 1 25 10780 1 1 22 PHE HD1 H 9.841 -4.739 -0.016 1.00 . A A . 22 PHE HD1 1 1 25 10781 1 1 22 PHE HD2 H 12.775 -4.341 -3.129 1.00 . A A . 22 PHE HD2 1 1 25 10782 1 1 22 PHE HE1 H 9.769 -7.188 -0.397 1.00 . A A . 22 PHE HE1 1 1 25 10783 1 1 22 PHE HE2 H 12.701 -6.789 -3.509 1.00 . A A . 22 PHE HE2 1 1 25 10784 1 1 22 PHE HZ H 11.199 -8.213 -2.143 1.00 . A A . 22 PHE HZ 1 1 25 10785 1 1 22 PHE N N 11.612 -2.087 0.942 1.00 . A A . 22 PHE N 1 1 25 10786 1 1 22 PHE O O 14.102 -1.707 -1.686 1.00 . A A . 22 PHE O 1 1 25 10787 1 1 23 PHE C C 15.178 1.244 0.679 1.00 . A A . 23 PHE C 1 1 25 10788 1 1 23 PHE CA C 14.369 0.721 -0.519 1.00 . A A . 23 PHE CA 1 1 25 10789 1 1 23 PHE CB C 13.477 1.822 -1.100 1.00 . A A . 23 PHE CB 1 1 25 10790 1 1 23 PHE CD1 C 14.426 2.375 -3.369 1.00 . A A . 23 PHE CD1 1 1 25 10791 1 1 23 PHE CD2 C 12.478 0.936 -3.241 1.00 . A A . 23 PHE CD2 1 1 25 10792 1 1 23 PHE CE1 C 14.411 2.269 -4.765 1.00 . A A . 23 PHE CE1 1 1 25 10793 1 1 23 PHE CE2 C 12.465 0.830 -4.636 1.00 . A A . 23 PHE CE2 1 1 25 10794 1 1 23 PHE CG C 13.459 1.709 -2.607 1.00 . A A . 23 PHE CG 1 1 25 10795 1 1 23 PHE CZ C 13.432 1.496 -5.399 1.00 . A A . 23 PHE CZ 1 1 25 10796 1 1 23 PHE H H 12.843 -0.205 0.689 1.00 . A A . 23 PHE H 1 1 25 10797 1 1 23 PHE HA H 15.035 0.349 -1.282 1.00 . A A . 23 PHE HA 1 1 25 10798 1 1 23 PHE HB2 H 12.472 1.712 -0.718 1.00 . A A . 23 PHE HB2 1 1 25 10799 1 1 23 PHE HB3 H 13.864 2.789 -0.818 1.00 . A A . 23 PHE HB3 1 1 25 10800 1 1 23 PHE HD1 H 15.182 2.972 -2.881 1.00 . A A . 23 PHE HD1 1 1 25 10801 1 1 23 PHE HD2 H 11.732 0.422 -2.652 1.00 . A A . 23 PHE HD2 1 1 25 10802 1 1 23 PHE HE1 H 15.158 2.783 -5.353 1.00 . A A . 23 PHE HE1 1 1 25 10803 1 1 23 PHE HE2 H 11.708 0.234 -5.125 1.00 . A A . 23 PHE HE2 1 1 25 10804 1 1 23 PHE HZ H 13.421 1.414 -6.476 1.00 . A A . 23 PHE HZ 1 1 25 10805 1 1 23 PHE N N 13.425 -0.355 -0.084 1.00 . A A . 23 PHE N 1 1 25 10806 1 1 23 PHE O O 15.541 2.404 0.735 1.00 . A A . 23 PHE O 1 1 25 10807 1 1 24 TYR C C 17.671 0.225 2.767 1.00 . A A . 24 TYR C 1 1 25 10808 1 1 24 TYR CA C 16.258 0.825 2.827 1.00 . A A . 24 TYR CA 1 1 25 10809 1 1 24 TYR CB C 15.478 0.281 4.029 1.00 . A A . 24 TYR CB 1 1 25 10810 1 1 24 TYR CD1 C 14.467 2.284 5.176 1.00 . A A . 24 TYR CD1 1 1 25 10811 1 1 24 TYR CD2 C 16.463 1.284 6.121 1.00 . A A . 24 TYR CD2 1 1 25 10812 1 1 24 TYR CE1 C 14.458 3.236 6.202 1.00 . A A . 24 TYR CE1 1 1 25 10813 1 1 24 TYR CE2 C 16.455 2.236 7.147 1.00 . A A . 24 TYR CE2 1 1 25 10814 1 1 24 TYR CG C 15.470 1.308 5.136 1.00 . A A . 24 TYR CG 1 1 25 10815 1 1 24 TYR CZ C 15.452 3.212 7.188 1.00 . A A . 24 TYR CZ 1 1 25 10816 1 1 24 TYR H H 15.171 -0.540 1.562 1.00 . A A . 24 TYR H 1 1 25 10817 1 1 24 TYR HA H 16.308 1.902 2.875 1.00 . A A . 24 TYR HA 1 1 25 10818 1 1 24 TYR HB2 H 14.464 0.069 3.727 1.00 . A A . 24 TYR HB2 1 1 25 10819 1 1 24 TYR HB3 H 15.944 -0.626 4.382 1.00 . A A . 24 TYR HB3 1 1 25 10820 1 1 24 TYR HD1 H 13.699 2.303 4.416 1.00 . A A . 24 TYR HD1 1 1 25 10821 1 1 24 TYR HD2 H 17.238 0.531 6.089 1.00 . A A . 24 TYR HD2 1 1 25 10822 1 1 24 TYR HE1 H 13.684 3.989 6.234 1.00 . A A . 24 TYR HE1 1 1 25 10823 1 1 24 TYR HE2 H 17.222 2.218 7.906 1.00 . A A . 24 TYR HE2 1 1 25 10824 1 1 24 TYR HH H 15.959 4.907 7.906 1.00 . A A . 24 TYR HH 1 1 25 10825 1 1 24 TYR N N 15.468 0.391 1.634 1.00 . A A . 24 TYR N 1 1 25 10826 1 1 24 TYR O O 18.182 -0.295 3.742 1.00 . A A . 24 TYR O 1 1 25 10827 1 1 24 TYR OH O 15.445 4.151 8.198 1.00 . A A . 24 TYR OH 1 1 25 10828 1 1 25 LYS C C 20.510 0.565 0.486 1.00 . A A . 25 LYS C 1 1 25 10829 1 1 25 LYS CA C 19.679 -0.272 1.473 1.00 . A A . 25 LYS CA 1 1 25 10830 1 1 25 LYS CB C 19.473 -1.696 0.939 1.00 . A A . 25 LYS CB 1 1 25 10831 1 1 25 LYS CD C 18.344 -3.062 -0.834 1.00 . A A . 25 LYS CD 1 1 25 10832 1 1 25 LYS CE C 17.080 -2.984 -1.696 1.00 . A A . 25 LYS CE 1 1 25 10833 1 1 25 LYS CG C 18.769 -1.649 -0.424 1.00 . A A . 25 LYS CG 1 1 25 10834 1 1 25 LYS H H 17.863 0.716 0.851 1.00 . A A . 25 LYS H 1 1 25 10835 1 1 25 LYS HA H 20.170 -0.310 2.433 1.00 . A A . 25 LYS HA 1 1 25 10836 1 1 25 LYS HB2 H 20.434 -2.179 0.829 1.00 . A A . 25 LYS HB2 1 1 25 10837 1 1 25 LYS HB3 H 18.868 -2.257 1.635 1.00 . A A . 25 LYS HB3 1 1 25 10838 1 1 25 LYS HD2 H 19.140 -3.525 -1.400 1.00 . A A . 25 LYS HD2 1 1 25 10839 1 1 25 LYS HD3 H 18.141 -3.649 0.049 1.00 . A A . 25 LYS HD3 1 1 25 10840 1 1 25 LYS HE2 H 16.218 -2.777 -1.076 1.00 . A A . 25 LYS HE2 1 1 25 10841 1 1 25 LYS HE3 H 17.189 -2.225 -2.455 1.00 . A A . 25 LYS HE3 1 1 25 10842 1 1 25 LYS HG2 H 17.895 -1.017 -0.355 1.00 . A A . 25 LYS HG2 1 1 25 10843 1 1 25 LYS HG3 H 19.445 -1.250 -1.165 1.00 . A A . 25 LYS HG3 1 1 25 10844 1 1 25 LYS HZ1 H 17.729 -4.467 -3.011 1.00 . A A . 25 LYS HZ1 1 1 25 10845 1 1 25 LYS HZ2 H 16.041 -4.387 -2.833 1.00 . A A . 25 LYS HZ2 1 1 25 10846 1 1 25 LYS HZ3 H 16.995 -5.067 -1.602 1.00 . A A . 25 LYS HZ3 1 1 25 10847 1 1 25 LYS N N 18.300 0.294 1.620 1.00 . A A . 25 LYS N 1 1 25 10848 1 1 25 LYS NZ N 16.953 -4.328 -2.334 1.00 . A A . 25 LYS NZ 1 1 25 10849 1 1 25 LYS O O 21.725 0.492 0.559 1.00 . A A . 25 LYS O 1 1 25 10850 1 1 25 LYS OXT O 19.918 1.261 -0.327 1.00 . A A . 25 LYS OXT 1 1 26 10851 1 1 1 HIS C C -16.561 5.368 3.067 1.00 . A A . 1 HIS C 1 1 26 10852 1 1 1 HIS CA C -15.270 6.180 2.893 1.00 . A A . 1 HIS CA 1 1 26 10853 1 1 1 HIS CB C -15.197 6.788 1.486 1.00 . A A . 1 HIS CB 1 1 26 10854 1 1 1 HIS CD2 C -14.371 9.234 1.982 1.00 . A A . 1 HIS CD2 1 1 26 10855 1 1 1 HIS CE1 C -12.400 9.087 1.094 1.00 . A A . 1 HIS CE1 1 1 26 10856 1 1 1 HIS CG C -14.251 7.958 1.489 1.00 . A A . 1 HIS CG 1 1 26 10857 1 1 1 HIS HA H -15.221 6.964 3.633 1.00 . A A . 1 HIS HA 1 1 26 10858 1 1 1 HIS HB2 H -14.845 6.043 0.789 1.00 . A A . 1 HIS HB2 1 1 26 10859 1 1 1 HIS HB3 H -16.180 7.123 1.188 1.00 . A A . 1 HIS HB3 1 1 26 10860 1 1 1 HIS HD1 H -12.591 7.106 0.487 1.00 . A A . 1 HIS HD1 1 1 26 10861 1 1 1 HIS HD2 H -15.242 9.628 2.486 1.00 . A A . 1 HIS HD2 1 1 26 10862 1 1 1 HIS HE1 H -11.404 9.327 0.754 1.00 . A A . 1 HIS HE1 1 1 26 10863 1 1 1 HIS N N -14.077 5.287 3.002 1.00 . A A . 1 HIS N 1 1 26 10864 1 1 1 HIS ND1 N -12.986 7.887 0.927 1.00 . A A . 1 HIS ND1 1 1 26 10865 1 1 1 HIS NE2 N -13.201 9.945 1.731 1.00 . A A . 1 HIS NE2 1 1 26 10866 1 1 1 HIS O O -17.270 5.525 4.042 1.00 . A A . 1 HIS O 1 1 26 10867 1 1 2 ALA C C -17.941 2.373 1.450 1.00 . A A . 2 ALA C 1 1 26 10868 1 1 2 ALA CA C -18.113 3.680 2.232 1.00 . A A . 2 ALA CA 1 1 26 10869 1 1 2 ALA CB C -19.212 4.539 1.605 1.00 . A A . 2 ALA CB 1 1 26 10870 1 1 2 ALA H H -16.280 4.397 1.350 1.00 . A A . 2 ALA H 1 1 26 10871 1 1 2 ALA HA H -18.347 3.475 3.265 1.00 . A A . 2 ALA HA 1 1 26 10872 1 1 2 ALA HB1 H -18.981 4.713 0.564 1.00 . A A . 2 ALA HB1 1 1 26 10873 1 1 2 ALA HB2 H -19.272 5.483 2.125 1.00 . A A . 2 ALA HB2 1 1 26 10874 1 1 2 ALA HB3 H -20.158 4.024 1.682 1.00 . A A . 2 ALA HB3 1 1 26 10875 1 1 2 ALA N N -16.869 4.504 2.127 1.00 . A A . 2 ALA N 1 1 26 10876 1 1 2 ALA O O -18.025 2.358 0.236 1.00 . A A . 2 ALA O 1 1 26 10877 1 1 3 TRP C C -16.242 -0.017 0.588 1.00 . A A . 3 TRP C 1 1 26 10878 1 1 3 TRP CA C -17.498 -0.048 1.471 1.00 . A A . 3 TRP CA 1 1 26 10879 1 1 3 TRP CB C -18.759 -0.283 0.624 1.00 . A A . 3 TRP CB 1 1 26 10880 1 1 3 TRP CD1 C -19.488 -2.693 0.863 1.00 . A A . 3 TRP CD1 1 1 26 10881 1 1 3 TRP CD2 C -20.564 -1.320 2.284 1.00 . A A . 3 TRP CD2 1 1 26 10882 1 1 3 TRP CE2 C -21.061 -2.622 2.522 1.00 . A A . 3 TRP CE2 1 1 26 10883 1 1 3 TRP CE3 C -21.082 -0.261 3.053 1.00 . A A . 3 TRP CE3 1 1 26 10884 1 1 3 TRP CG C -19.564 -1.391 1.225 1.00 . A A . 3 TRP CG 1 1 26 10885 1 1 3 TRP CH2 C -22.542 -1.805 4.244 1.00 . A A . 3 TRP CH2 1 1 26 10886 1 1 3 TRP CZ2 C -22.038 -2.867 3.489 1.00 . A A . 3 TRP CZ2 1 1 26 10887 1 1 3 TRP CZ3 C -22.065 -0.504 4.027 1.00 . A A . 3 TRP CZ3 1 1 26 10888 1 1 3 TRP H H -17.630 1.337 3.121 1.00 . A A . 3 TRP H 1 1 26 10889 1 1 3 TRP HA H -17.406 -0.826 2.213 1.00 . A A . 3 TRP HA 1 1 26 10890 1 1 3 TRP HB2 H -19.353 0.618 0.599 1.00 . A A . 3 TRP HB2 1 1 26 10891 1 1 3 TRP HB3 H -18.472 -0.551 -0.381 1.00 . A A . 3 TRP HB3 1 1 26 10892 1 1 3 TRP HD1 H -18.839 -3.095 0.098 1.00 . A A . 3 TRP HD1 1 1 26 10893 1 1 3 TRP HE1 H -20.515 -4.391 1.568 1.00 . A A . 3 TRP HE1 1 1 26 10894 1 1 3 TRP HE3 H -20.721 0.744 2.894 1.00 . A A . 3 TRP HE3 1 1 26 10895 1 1 3 TRP HH2 H -23.298 -1.986 4.993 1.00 . A A . 3 TRP HH2 1 1 26 10896 1 1 3 TRP HZ2 H -22.402 -3.871 3.652 1.00 . A A . 3 TRP HZ2 1 1 26 10897 1 1 3 TRP HZ3 H -22.455 0.316 4.611 1.00 . A A . 3 TRP HZ3 1 1 26 10898 1 1 3 TRP N N -17.694 1.282 2.145 1.00 . A A . 3 TRP N 1 1 26 10899 1 1 3 TRP NE1 N -20.375 -3.423 1.632 1.00 . A A . 3 TRP NE1 1 1 26 10900 1 1 3 TRP O O -15.850 1.019 0.091 1.00 . A A . 3 TRP O 1 1 26 10901 1 1 4 TYR C C -13.296 -0.181 0.067 1.00 . A A . 4 TYR C 1 1 26 10902 1 1 4 TYR CA C -14.354 -1.200 -0.440 1.00 . A A . 4 TYR CA 1 1 26 10903 1 1 4 TYR CB C -14.862 -0.919 -1.884 1.00 . A A . 4 TYR CB 1 1 26 10904 1 1 4 TYR CD1 C -12.973 0.056 -3.255 1.00 . A A . 4 TYR CD1 1 1 26 10905 1 1 4 TYR CD2 C -14.700 1.545 -2.427 1.00 . A A . 4 TYR CD2 1 1 26 10906 1 1 4 TYR CE1 C -12.331 1.141 -3.860 1.00 . A A . 4 TYR CE1 1 1 26 10907 1 1 4 TYR CE2 C -14.056 2.629 -3.034 1.00 . A A . 4 TYR CE2 1 1 26 10908 1 1 4 TYR CG C -14.159 0.258 -2.535 1.00 . A A . 4 TYR CG 1 1 26 10909 1 1 4 TYR CZ C -12.871 2.427 -3.750 1.00 . A A . 4 TYR CZ 1 1 26 10910 1 1 4 TYR H H -15.931 -1.969 0.825 1.00 . A A . 4 TYR H 1 1 26 10911 1 1 4 TYR HA H -13.937 -2.195 -0.398 1.00 . A A . 4 TYR HA 1 1 26 10912 1 1 4 TYR HB2 H -14.695 -1.798 -2.487 1.00 . A A . 4 TYR HB2 1 1 26 10913 1 1 4 TYR HB3 H -15.923 -0.720 -1.848 1.00 . A A . 4 TYR HB3 1 1 26 10914 1 1 4 TYR HD1 H -12.555 -0.935 -3.340 1.00 . A A . 4 TYR HD1 1 1 26 10915 1 1 4 TYR HD2 H -15.615 1.703 -1.878 1.00 . A A . 4 TYR HD2 1 1 26 10916 1 1 4 TYR HE1 H -11.418 0.986 -4.415 1.00 . A A . 4 TYR HE1 1 1 26 10917 1 1 4 TYR HE2 H -14.475 3.622 -2.947 1.00 . A A . 4 TYR HE2 1 1 26 10918 1 1 4 TYR HH H -11.798 4.003 -3.657 1.00 . A A . 4 TYR HH 1 1 26 10919 1 1 4 TYR N N -15.599 -1.149 0.403 1.00 . A A . 4 TYR N 1 1 26 10920 1 1 4 TYR O O -12.360 0.161 -0.626 1.00 . A A . 4 TYR O 1 1 26 10921 1 1 4 TYR OH O -12.236 3.498 -4.346 1.00 . A A . 4 TYR OH 1 1 26 10922 1 1 5 SER C C -11.158 0.531 2.348 1.00 . A A . 5 SER C 1 1 26 10923 1 1 5 SER CA C -12.423 1.251 1.847 1.00 . A A . 5 SER CA 1 1 26 10924 1 1 5 SER CB C -13.143 1.939 3.009 1.00 . A A . 5 SER CB 1 1 26 10925 1 1 5 SER H H -14.164 -0.027 1.856 1.00 . A A . 5 SER H 1 1 26 10926 1 1 5 SER HA H -12.162 1.979 1.098 1.00 . A A . 5 SER HA 1 1 26 10927 1 1 5 SER HB2 H -14.132 2.231 2.699 1.00 . A A . 5 SER HB2 1 1 26 10928 1 1 5 SER HB3 H -13.219 1.251 3.842 1.00 . A A . 5 SER HB3 1 1 26 10929 1 1 5 SER HG H -12.153 2.990 4.316 1.00 . A A . 5 SER HG 1 1 26 10930 1 1 5 SER N N -13.423 0.279 1.294 1.00 . A A . 5 SER N 1 1 26 10931 1 1 5 SER O O -10.211 1.165 2.780 1.00 . A A . 5 SER O 1 1 26 10932 1 1 5 SER OG O -12.414 3.097 3.397 1.00 . A A . 5 SER OG 1 1 26 10933 1 1 6 HIS C C -8.970 -1.809 1.597 1.00 . A A . 6 HIS C 1 1 26 10934 1 1 6 HIS CA C -9.918 -1.521 2.766 1.00 . A A . 6 HIS CA 1 1 26 10935 1 1 6 HIS CB C -10.450 -2.827 3.365 1.00 . A A . 6 HIS CB 1 1 26 10936 1 1 6 HIS CD2 C -12.123 -2.450 5.357 1.00 . A A . 6 HIS CD2 1 1 26 10937 1 1 6 HIS CE1 C -10.672 -2.243 6.953 1.00 . A A . 6 HIS CE1 1 1 26 10938 1 1 6 HIS CG C -10.882 -2.586 4.786 1.00 . A A . 6 HIS CG 1 1 26 10939 1 1 6 HIS H H -11.896 -1.271 1.943 1.00 . A A . 6 HIS H 1 1 26 10940 1 1 6 HIS HA H -9.405 -0.954 3.521 1.00 . A A . 6 HIS HA 1 1 26 10941 1 1 6 HIS HB2 H -11.293 -3.173 2.785 1.00 . A A . 6 HIS HB2 1 1 26 10942 1 1 6 HIS HB3 H -9.671 -3.575 3.348 1.00 . A A . 6 HIS HB3 1 1 26 10943 1 1 6 HIS HD1 H -8.996 -2.500 5.748 1.00 . A A . 6 HIS HD1 1 1 26 10944 1 1 6 HIS HD2 H -13.061 -2.503 4.825 1.00 . A A . 6 HIS HD2 1 1 26 10945 1 1 6 HIS HE1 H -10.225 -2.102 7.927 1.00 . A A . 6 HIS HE1 1 1 26 10946 1 1 6 HIS N N -11.128 -0.778 2.295 1.00 . A A . 6 HIS N 1 1 26 10947 1 1 6 HIS ND1 N -9.972 -2.452 5.824 1.00 . A A . 6 HIS ND1 1 1 26 10948 1 1 6 HIS NE2 N -11.988 -2.234 6.725 1.00 . A A . 6 HIS NE2 1 1 26 10949 1 1 6 HIS O O -7.787 -2.023 1.791 1.00 . A A . 6 HIS O 1 1 26 10950 1 1 7 TYR C C -7.554 -0.956 -0.925 1.00 . A A . 7 TYR C 1 1 26 10951 1 1 7 TYR CA C -8.593 -2.070 -0.797 1.00 . A A . 7 TYR CA 1 1 26 10952 1 1 7 TYR CB C -9.525 -2.082 -2.014 1.00 . A A . 7 TYR CB 1 1 26 10953 1 1 7 TYR CD1 C -9.856 -4.583 -2.099 1.00 . A A . 7 TYR CD1 1 1 26 10954 1 1 7 TYR CD2 C -11.794 -3.158 -1.792 1.00 . A A . 7 TYR CD2 1 1 26 10955 1 1 7 TYR CE1 C -10.681 -5.714 -2.056 1.00 . A A . 7 TYR CE1 1 1 26 10956 1 1 7 TYR CE2 C -12.619 -4.288 -1.748 1.00 . A A . 7 TYR CE2 1 1 26 10957 1 1 7 TYR CG C -10.413 -3.305 -1.967 1.00 . A A . 7 TYR CG 1 1 26 10958 1 1 7 TYR CZ C -12.062 -5.566 -1.880 1.00 . A A . 7 TYR CZ 1 1 26 10959 1 1 7 TYR H H -10.425 -1.625 0.256 1.00 . A A . 7 TYR H 1 1 26 10960 1 1 7 TYR HA H -8.104 -3.020 -0.692 1.00 . A A . 7 TYR HA 1 1 26 10961 1 1 7 TYR HB2 H -10.138 -1.192 -2.006 1.00 . A A . 7 TYR HB2 1 1 26 10962 1 1 7 TYR HB3 H -8.934 -2.103 -2.918 1.00 . A A . 7 TYR HB3 1 1 26 10963 1 1 7 TYR HD1 H -8.791 -4.696 -2.235 1.00 . A A . 7 TYR HD1 1 1 26 10964 1 1 7 TYR HD2 H -12.224 -2.173 -1.690 1.00 . A A . 7 TYR HD2 1 1 26 10965 1 1 7 TYR HE1 H -10.252 -6.701 -2.158 1.00 . A A . 7 TYR HE1 1 1 26 10966 1 1 7 TYR HE2 H -13.684 -4.175 -1.613 1.00 . A A . 7 TYR HE2 1 1 26 10967 1 1 7 TYR HH H -13.278 -6.789 -2.702 1.00 . A A . 7 TYR HH 1 1 26 10968 1 1 7 TYR N N -9.473 -1.806 0.387 1.00 . A A . 7 TYR N 1 1 26 10969 1 1 7 TYR O O -6.384 -1.212 -1.140 1.00 . A A . 7 TYR O 1 1 26 10970 1 1 7 TYR OH O -12.876 -6.680 -1.836 1.00 . A A . 7 TYR OH 1 1 26 10971 1 1 8 VAL C C -5.949 1.282 0.245 1.00 . A A . 8 VAL C 1 1 26 10972 1 1 8 VAL CA C -7.007 1.414 -0.861 1.00 . A A . 8 VAL CA 1 1 26 10973 1 1 8 VAL CB C -7.851 2.689 -0.685 1.00 . A A . 8 VAL CB 1 1 26 10974 1 1 8 VAL CG1 C -8.427 2.759 0.734 1.00 . A A . 8 VAL CG1 1 1 26 10975 1 1 8 VAL CG2 C -6.974 3.919 -0.935 1.00 . A A . 8 VAL CG2 1 1 26 10976 1 1 8 VAL H H -8.917 0.444 -0.586 1.00 . A A . 8 VAL H 1 1 26 10977 1 1 8 VAL HA H -6.531 1.419 -1.825 1.00 . A A . 8 VAL HA 1 1 26 10978 1 1 8 VAL HB H -8.664 2.677 -1.397 1.00 . A A . 8 VAL HB 1 1 26 10979 1 1 8 VAL HG11 H -8.858 1.804 0.995 1.00 . A A . 8 VAL HG11 1 1 26 10980 1 1 8 VAL HG12 H -9.189 3.521 0.776 1.00 . A A . 8 VAL HG12 1 1 26 10981 1 1 8 VAL HG13 H -7.638 2.999 1.432 1.00 . A A . 8 VAL HG13 1 1 26 10982 1 1 8 VAL HG21 H -7.545 4.815 -0.737 1.00 . A A . 8 VAL HG21 1 1 26 10983 1 1 8 VAL HG22 H -6.646 3.924 -1.965 1.00 . A A . 8 VAL HG22 1 1 26 10984 1 1 8 VAL HG23 H -6.113 3.888 -0.284 1.00 . A A . 8 VAL HG23 1 1 26 10985 1 1 8 VAL N N -7.972 0.275 -0.772 1.00 . A A . 8 VAL N 1 1 26 10986 1 1 8 VAL O O -4.802 1.649 0.064 1.00 . A A . 8 VAL O 1 1 26 10987 1 1 9 LEU C C -4.341 -0.542 2.112 1.00 . A A . 9 LEU C 1 1 26 10988 1 1 9 LEU CA C -5.353 0.548 2.494 1.00 . A A . 9 LEU CA 1 1 26 10989 1 1 9 LEU CB C -6.200 0.106 3.694 1.00 . A A . 9 LEU CB 1 1 26 10990 1 1 9 LEU CD1 C -5.951 0.733 6.105 1.00 . A A . 9 LEU CD1 1 1 26 10991 1 1 9 LEU CD2 C -5.173 -1.505 5.313 1.00 . A A . 9 LEU CD2 1 1 26 10992 1 1 9 LEU CG C -5.315 -0.026 4.938 1.00 . A A . 9 LEU CG 1 1 26 10993 1 1 9 LEU H H -7.253 0.434 1.482 1.00 . A A . 9 LEU H 1 1 26 10994 1 1 9 LEU HA H -4.846 1.474 2.716 1.00 . A A . 9 LEU HA 1 1 26 10995 1 1 9 LEU HB2 H -6.971 0.841 3.877 1.00 . A A . 9 LEU HB2 1 1 26 10996 1 1 9 LEU HB3 H -6.658 -0.847 3.479 1.00 . A A . 9 LEU HB3 1 1 26 10997 1 1 9 LEU HD11 H -5.434 0.485 7.021 1.00 . A A . 9 LEU HD11 1 1 26 10998 1 1 9 LEU HD12 H -6.991 0.454 6.192 1.00 . A A . 9 LEU HD12 1 1 26 10999 1 1 9 LEU HD13 H -5.876 1.795 5.927 1.00 . A A . 9 LEU HD13 1 1 26 11000 1 1 9 LEU HD21 H -4.547 -1.597 6.188 1.00 . A A . 9 LEU HD21 1 1 26 11001 1 1 9 LEU HD22 H -4.725 -2.044 4.491 1.00 . A A . 9 LEU HD22 1 1 26 11002 1 1 9 LEU HD23 H -6.149 -1.918 5.524 1.00 . A A . 9 LEU HD23 1 1 26 11003 1 1 9 LEU HG H -4.338 0.389 4.731 1.00 . A A . 9 LEU HG 1 1 26 11004 1 1 9 LEU N N -6.328 0.736 1.377 1.00 . A A . 9 LEU N 1 1 26 11005 1 1 9 LEU O O -3.152 -0.396 2.325 1.00 . A A . 9 LEU O 1 1 26 11006 1 1 10 LYS C C -3.030 -2.266 -0.066 1.00 . A A . 10 LYS C 1 1 26 11007 1 1 10 LYS CA C -3.880 -2.724 1.125 1.00 . A A . 10 LYS CA 1 1 26 11008 1 1 10 LYS CB C -4.791 -3.889 0.726 1.00 . A A . 10 LYS CB 1 1 26 11009 1 1 10 LYS CD C -4.963 -6.379 0.598 1.00 . A A . 10 LYS CD 1 1 26 11010 1 1 10 LYS CE C -4.171 -7.691 0.601 1.00 . A A . 10 LYS CE 1 1 26 11011 1 1 10 LYS CG C -4.003 -5.199 0.778 1.00 . A A . 10 LYS CG 1 1 26 11012 1 1 10 LYS H H -5.773 -1.713 1.366 1.00 . A A . 10 LYS H 1 1 26 11013 1 1 10 LYS HA H -3.247 -3.012 1.951 1.00 . A A . 10 LYS HA 1 1 26 11014 1 1 10 LYS HB2 H -5.626 -3.943 1.410 1.00 . A A . 10 LYS HB2 1 1 26 11015 1 1 10 LYS HB3 H -5.158 -3.731 -0.277 1.00 . A A . 10 LYS HB3 1 1 26 11016 1 1 10 LYS HD2 H -5.677 -6.387 1.410 1.00 . A A . 10 LYS HD2 1 1 26 11017 1 1 10 LYS HD3 H -5.487 -6.276 -0.340 1.00 . A A . 10 LYS HD3 1 1 26 11018 1 1 10 LYS HE2 H -3.134 -7.503 0.845 1.00 . A A . 10 LYS HE2 1 1 26 11019 1 1 10 LYS HE3 H -4.602 -8.388 1.302 1.00 . A A . 10 LYS HE3 1 1 26 11020 1 1 10 LYS HG2 H -3.268 -5.208 -0.014 1.00 . A A . 10 LYS HG2 1 1 26 11021 1 1 10 LYS HG3 H -3.507 -5.284 1.733 1.00 . A A . 10 LYS HG3 1 1 26 11022 1 1 10 LYS HZ1 H -5.292 -8.253 -1.068 1.00 . A A . 10 LYS HZ1 1 1 26 11023 1 1 10 LYS HZ2 H -3.895 -9.188 -0.823 1.00 . A A . 10 LYS HZ2 1 1 26 11024 1 1 10 LYS HZ3 H -3.765 -7.612 -1.444 1.00 . A A . 10 LYS HZ3 1 1 26 11025 1 1 10 LYS N N -4.809 -1.626 1.537 1.00 . A A . 10 LYS N 1 1 26 11026 1 1 10 LYS NZ N -4.290 -8.225 -0.788 1.00 . A A . 10 LYS NZ 1 1 26 11027 1 1 10 LYS O O -1.833 -2.481 -0.101 1.00 . A A . 10 LYS O 1 1 26 11028 1 1 11 PHE C C -1.774 -0.161 -1.774 1.00 . A A . 11 PHE C 1 1 26 11029 1 1 11 PHE CA C -2.870 -1.136 -2.222 1.00 . A A . 11 PHE CA 1 1 26 11030 1 1 11 PHE CB C -3.896 -0.423 -3.108 1.00 . A A . 11 PHE CB 1 1 26 11031 1 1 11 PHE CD1 C -3.320 -1.300 -5.402 1.00 . A A . 11 PHE CD1 1 1 26 11032 1 1 11 PHE CD2 C -2.800 1.008 -4.872 1.00 . A A . 11 PHE CD2 1 1 26 11033 1 1 11 PHE CE1 C -2.791 -1.126 -6.686 1.00 . A A . 11 PHE CE1 1 1 26 11034 1 1 11 PHE CE2 C -2.270 1.183 -6.157 1.00 . A A . 11 PHE CE2 1 1 26 11035 1 1 11 PHE CG C -3.325 -0.233 -4.494 1.00 . A A . 11 PHE CG 1 1 26 11036 1 1 11 PHE CZ C -2.267 0.116 -7.064 1.00 . A A . 11 PHE CZ 1 1 26 11037 1 1 11 PHE H H -4.607 -1.453 -0.976 1.00 . A A . 11 PHE H 1 1 26 11038 1 1 11 PHE HA H -2.437 -1.968 -2.756 1.00 . A A . 11 PHE HA 1 1 26 11039 1 1 11 PHE HB2 H -4.796 -1.017 -3.167 1.00 . A A . 11 PHE HB2 1 1 26 11040 1 1 11 PHE HB3 H -4.130 0.542 -2.682 1.00 . A A . 11 PHE HB3 1 1 26 11041 1 1 11 PHE HD1 H -3.725 -2.259 -5.111 1.00 . A A . 11 PHE HD1 1 1 26 11042 1 1 11 PHE HD2 H -2.802 1.831 -4.173 1.00 . A A . 11 PHE HD2 1 1 26 11043 1 1 11 PHE HE1 H -2.787 -1.949 -7.385 1.00 . A A . 11 PHE HE1 1 1 26 11044 1 1 11 PHE HE2 H -1.866 2.141 -6.448 1.00 . A A . 11 PHE HE2 1 1 26 11045 1 1 11 PHE HZ H -1.859 0.251 -8.055 1.00 . A A . 11 PHE HZ 1 1 26 11046 1 1 11 PHE N N -3.641 -1.624 -1.036 1.00 . A A . 11 PHE N 1 1 26 11047 1 1 11 PHE O O -0.664 -0.196 -2.270 1.00 . A A . 11 PHE O 1 1 26 11048 1 1 12 PHE C C 0.086 0.918 0.368 1.00 . A A . 12 PHE C 1 1 26 11049 1 1 12 PHE CA C -1.051 1.670 -0.335 1.00 . A A . 12 PHE CA 1 1 26 11050 1 1 12 PHE CB C -1.793 2.574 0.654 1.00 . A A . 12 PHE CB 1 1 26 11051 1 1 12 PHE CD1 C 0.037 3.882 1.794 1.00 . A A . 12 PHE CD1 1 1 26 11052 1 1 12 PHE CD2 C -1.330 4.998 0.131 1.00 . A A . 12 PHE CD2 1 1 26 11053 1 1 12 PHE CE1 C 0.762 5.064 1.990 1.00 . A A . 12 PHE CE1 1 1 26 11054 1 1 12 PHE CE2 C -0.606 6.179 0.326 1.00 . A A . 12 PHE CE2 1 1 26 11055 1 1 12 PHE CG C -1.010 3.849 0.865 1.00 . A A . 12 PHE CG 1 1 26 11056 1 1 12 PHE CZ C 0.441 6.212 1.256 1.00 . A A . 12 PHE CZ 1 1 26 11057 1 1 12 PHE H H -2.977 0.701 -0.439 1.00 . A A . 12 PHE H 1 1 26 11058 1 1 12 PHE HA H -0.665 2.258 -1.154 1.00 . A A . 12 PHE HA 1 1 26 11059 1 1 12 PHE HB2 H -2.769 2.814 0.259 1.00 . A A . 12 PHE HB2 1 1 26 11060 1 1 12 PHE HB3 H -1.905 2.061 1.598 1.00 . A A . 12 PHE HB3 1 1 26 11061 1 1 12 PHE HD1 H 0.284 2.997 2.360 1.00 . A A . 12 PHE HD1 1 1 26 11062 1 1 12 PHE HD2 H -2.138 4.972 -0.586 1.00 . A A . 12 PHE HD2 1 1 26 11063 1 1 12 PHE HE1 H 1.568 5.089 2.708 1.00 . A A . 12 PHE HE1 1 1 26 11064 1 1 12 PHE HE2 H -0.852 7.065 -0.240 1.00 . A A . 12 PHE HE2 1 1 26 11065 1 1 12 PHE HZ H 1.001 7.124 1.407 1.00 . A A . 12 PHE HZ 1 1 26 11066 1 1 12 PHE N N -2.077 0.700 -0.829 1.00 . A A . 12 PHE N 1 1 26 11067 1 1 12 PHE O O 1.245 1.229 0.190 1.00 . A A . 12 PHE O 1 1 26 11068 1 1 13 LEU C C 1.662 -1.654 0.854 1.00 . A A . 13 LEU C 1 1 26 11069 1 1 13 LEU CA C 0.818 -0.861 1.867 1.00 . A A . 13 LEU CA 1 1 26 11070 1 1 13 LEU CB C 0.052 -1.809 2.803 1.00 . A A . 13 LEU CB 1 1 26 11071 1 1 13 LEU CD1 C 2.155 -2.633 3.901 1.00 . A A . 13 LEU CD1 1 1 26 11072 1 1 13 LEU CD2 C 1.014 -0.588 4.776 1.00 . A A . 13 LEU CD2 1 1 26 11073 1 1 13 LEU CG C 0.800 -1.964 4.137 1.00 . A A . 13 LEU CG 1 1 26 11074 1 1 13 LEU H H -1.186 -0.313 1.279 1.00 . A A . 13 LEU H 1 1 26 11075 1 1 13 LEU HA H 1.447 -0.203 2.442 1.00 . A A . 13 LEU HA 1 1 26 11076 1 1 13 LEU HB2 H -0.932 -1.405 2.992 1.00 . A A . 13 LEU HB2 1 1 26 11077 1 1 13 LEU HB3 H -0.045 -2.778 2.333 1.00 . A A . 13 LEU HB3 1 1 26 11078 1 1 13 LEU HD11 H 2.555 -2.978 4.844 1.00 . A A . 13 LEU HD11 1 1 26 11079 1 1 13 LEU HD12 H 2.838 -1.922 3.460 1.00 . A A . 13 LEU HD12 1 1 26 11080 1 1 13 LEU HD13 H 2.032 -3.474 3.235 1.00 . A A . 13 LEU HD13 1 1 26 11081 1 1 13 LEU HD21 H 1.336 -0.713 5.799 1.00 . A A . 13 LEU HD21 1 1 26 11082 1 1 13 LEU HD22 H 0.088 -0.032 4.756 1.00 . A A . 13 LEU HD22 1 1 26 11083 1 1 13 LEU HD23 H 1.770 -0.048 4.225 1.00 . A A . 13 LEU HD23 1 1 26 11084 1 1 13 LEU HG H 0.211 -2.580 4.802 1.00 . A A . 13 LEU HG 1 1 26 11085 1 1 13 LEU N N -0.242 -0.078 1.157 1.00 . A A . 13 LEU N 1 1 26 11086 1 1 13 LEU O O 2.850 -1.843 1.041 1.00 . A A . 13 LEU O 1 1 26 11087 1 1 14 LEU C C 2.797 -1.972 -1.999 1.00 . A A . 14 LEU C 1 1 26 11088 1 1 14 LEU CA C 1.820 -2.887 -1.245 1.00 . A A . 14 LEU CA 1 1 26 11089 1 1 14 LEU CB C 0.758 -3.443 -2.199 1.00 . A A . 14 LEU CB 1 1 26 11090 1 1 14 LEU CD1 C 0.974 -5.933 -2.071 1.00 . A A . 14 LEU CD1 1 1 26 11091 1 1 14 LEU CD2 C 0.653 -4.819 -4.283 1.00 . A A . 14 LEU CD2 1 1 26 11092 1 1 14 LEU CG C 1.301 -4.690 -2.903 1.00 . A A . 14 LEU CG 1 1 26 11093 1 1 14 LEU H H 0.098 -1.942 -0.346 1.00 . A A . 14 LEU H 1 1 26 11094 1 1 14 LEU HA H 2.354 -3.695 -0.779 1.00 . A A . 14 LEU HA 1 1 26 11095 1 1 14 LEU HB2 H -0.129 -3.703 -1.638 1.00 . A A . 14 LEU HB2 1 1 26 11096 1 1 14 LEU HB3 H 0.510 -2.695 -2.937 1.00 . A A . 14 LEU HB3 1 1 26 11097 1 1 14 LEU HD11 H 1.240 -5.756 -1.039 1.00 . A A . 14 LEU HD11 1 1 26 11098 1 1 14 LEU HD12 H 1.535 -6.776 -2.448 1.00 . A A . 14 LEU HD12 1 1 26 11099 1 1 14 LEU HD13 H -0.082 -6.145 -2.139 1.00 . A A . 14 LEU HD13 1 1 26 11100 1 1 14 LEU HD21 H 0.738 -3.879 -4.810 1.00 . A A . 14 LEU HD21 1 1 26 11101 1 1 14 LEU HD22 H -0.391 -5.074 -4.170 1.00 . A A . 14 LEU HD22 1 1 26 11102 1 1 14 LEU HD23 H 1.153 -5.593 -4.846 1.00 . A A . 14 LEU HD23 1 1 26 11103 1 1 14 LEU HG H 2.373 -4.604 -3.013 1.00 . A A . 14 LEU HG 1 1 26 11104 1 1 14 LEU N N 1.056 -2.112 -0.216 1.00 . A A . 14 LEU N 1 1 26 11105 1 1 14 LEU O O 3.831 -2.411 -2.465 1.00 . A A . 14 LEU O 1 1 26 11106 1 1 15 VAL C C 4.273 0.988 -1.836 1.00 . A A . 15 VAL C 1 1 26 11107 1 1 15 VAL CA C 3.386 0.238 -2.840 1.00 . A A . 15 VAL CA 1 1 26 11108 1 1 15 VAL CB C 2.452 1.211 -3.577 1.00 . A A . 15 VAL CB 1 1 26 11109 1 1 15 VAL CG1 C 3.241 2.432 -4.058 1.00 . A A . 15 VAL CG1 1 1 26 11110 1 1 15 VAL CG2 C 1.833 0.505 -4.788 1.00 . A A . 15 VAL CG2 1 1 26 11111 1 1 15 VAL H H 1.638 -0.382 -1.733 1.00 . A A . 15 VAL H 1 1 26 11112 1 1 15 VAL HA H 3.995 -0.296 -3.552 1.00 . A A . 15 VAL HA 1 1 26 11113 1 1 15 VAL HB H 1.666 1.532 -2.907 1.00 . A A . 15 VAL HB 1 1 26 11114 1 1 15 VAL HG11 H 3.290 3.165 -3.265 1.00 . A A . 15 VAL HG11 1 1 26 11115 1 1 15 VAL HG12 H 2.750 2.865 -4.917 1.00 . A A . 15 VAL HG12 1 1 26 11116 1 1 15 VAL HG13 H 4.243 2.132 -4.329 1.00 . A A . 15 VAL HG13 1 1 26 11117 1 1 15 VAL HG21 H 1.020 1.102 -5.174 1.00 . A A . 15 VAL HG21 1 1 26 11118 1 1 15 VAL HG22 H 1.460 -0.463 -4.491 1.00 . A A . 15 VAL HG22 1 1 26 11119 1 1 15 VAL HG23 H 2.585 0.382 -5.556 1.00 . A A . 15 VAL HG23 1 1 26 11120 1 1 15 VAL N N 2.477 -0.709 -2.119 1.00 . A A . 15 VAL N 1 1 26 11121 1 1 15 VAL O O 5.476 1.075 -2.004 1.00 . A A . 15 VAL O 1 1 26 11122 1 1 16 PHE C C 5.394 1.321 1.019 1.00 . A A . 16 PHE C 1 1 26 11123 1 1 16 PHE CA C 4.490 2.275 0.224 1.00 . A A . 16 PHE CA 1 1 26 11124 1 1 16 PHE CB C 3.462 2.938 1.147 1.00 . A A . 16 PHE CB 1 1 26 11125 1 1 16 PHE CD1 C 4.076 5.384 1.148 1.00 . A A . 16 PHE CD1 1 1 26 11126 1 1 16 PHE CD2 C 4.670 4.030 3.072 1.00 . A A . 16 PHE CD2 1 1 26 11127 1 1 16 PHE CE1 C 4.654 6.503 1.758 1.00 . A A . 16 PHE CE1 1 1 26 11128 1 1 16 PHE CE2 C 5.248 5.151 3.681 1.00 . A A . 16 PHE CE2 1 1 26 11129 1 1 16 PHE CG C 4.084 4.147 1.806 1.00 . A A . 16 PHE CG 1 1 26 11130 1 1 16 PHE CZ C 5.240 6.386 3.023 1.00 . A A . 16 PHE CZ 1 1 26 11131 1 1 16 PHE H H 2.716 1.442 -0.682 1.00 . A A . 16 PHE H 1 1 26 11132 1 1 16 PHE HA H 5.086 3.034 -0.259 1.00 . A A . 16 PHE HA 1 1 26 11133 1 1 16 PHE HB2 H 2.603 3.244 0.569 1.00 . A A . 16 PHE HB2 1 1 26 11134 1 1 16 PHE HB3 H 3.153 2.234 1.906 1.00 . A A . 16 PHE HB3 1 1 26 11135 1 1 16 PHE HD1 H 3.624 5.473 0.173 1.00 . A A . 16 PHE HD1 1 1 26 11136 1 1 16 PHE HD2 H 4.676 3.077 3.579 1.00 . A A . 16 PHE HD2 1 1 26 11137 1 1 16 PHE HE1 H 4.647 7.457 1.251 1.00 . A A . 16 PHE HE1 1 1 26 11138 1 1 16 PHE HE2 H 5.700 5.060 4.658 1.00 . A A . 16 PHE HE2 1 1 26 11139 1 1 16 PHE HZ H 5.685 7.251 3.494 1.00 . A A . 16 PHE HZ 1 1 26 11140 1 1 16 PHE N N 3.687 1.528 -0.794 1.00 . A A . 16 PHE N 1 1 26 11141 1 1 16 PHE O O 6.393 1.737 1.572 1.00 . A A . 16 PHE O 1 1 26 11142 1 1 17 GLY C C 7.326 -0.927 1.253 1.00 . A A . 17 GLY C 1 1 26 11143 1 1 17 GLY CA C 5.910 -0.921 1.835 1.00 . A A . 17 GLY CA 1 1 26 11144 1 1 17 GLY H H 4.249 -0.265 0.625 1.00 . A A . 17 GLY H 1 1 26 11145 1 1 17 GLY HA2 H 5.951 -0.628 2.876 1.00 . A A . 17 GLY HA2 1 1 26 11146 1 1 17 GLY HA3 H 5.488 -1.910 1.756 1.00 . A A . 17 GLY HA3 1 1 26 11147 1 1 17 GLY N N 5.058 0.051 1.079 1.00 . A A . 17 GLY N 1 1 26 11148 1 1 17 GLY O O 8.301 -0.884 1.980 1.00 . A A . 17 GLY O 1 1 26 11149 1 1 18 GLU C C 9.508 0.375 -0.419 1.00 . A A . 18 GLU C 1 1 26 11150 1 1 18 GLU CA C 8.807 -0.964 -0.681 1.00 . A A . 18 GLU CA 1 1 26 11151 1 1 18 GLU CB C 8.563 -1.166 -2.181 1.00 . A A . 18 GLU CB 1 1 26 11152 1 1 18 GLU CD C 9.573 -3.418 -2.596 1.00 . A A . 18 GLU CD 1 1 26 11153 1 1 18 GLU CG C 8.261 -2.642 -2.461 1.00 . A A . 18 GLU CG 1 1 26 11154 1 1 18 GLU H H 6.646 -0.993 -0.618 1.00 . A A . 18 GLU H 1 1 26 11155 1 1 18 GLU HA H 9.398 -1.771 -0.290 1.00 . A A . 18 GLU HA 1 1 26 11156 1 1 18 GLU HB2 H 7.723 -0.560 -2.494 1.00 . A A . 18 GLU HB2 1 1 26 11157 1 1 18 GLU HB3 H 9.443 -0.870 -2.732 1.00 . A A . 18 GLU HB3 1 1 26 11158 1 1 18 GLU HG2 H 7.681 -3.051 -1.646 1.00 . A A . 18 GLU HG2 1 1 26 11159 1 1 18 GLU HG3 H 7.699 -2.727 -3.379 1.00 . A A . 18 GLU HG3 1 1 26 11160 1 1 18 GLU N N 7.448 -0.968 -0.053 1.00 . A A . 18 GLU N 1 1 26 11161 1 1 18 GLU O O 10.720 0.445 -0.341 1.00 . A A . 18 GLU O 1 1 26 11162 1 1 18 GLU OE1 O 10.134 -3.409 -3.678 1.00 . A A . 18 GLU OE1 1 1 26 11163 1 1 18 GLU OE2 O 9.994 -4.006 -1.613 1.00 . A A . 18 GLU OE2 1 1 26 11164 1 1 19 ASN C C 9.772 2.860 1.501 1.00 . A A . 19 ASN C 1 1 26 11165 1 1 19 ASN CA C 9.364 2.764 0.022 1.00 . A A . 19 ASN CA 1 1 26 11166 1 1 19 ASN CB C 8.272 3.791 -0.299 1.00 . A A . 19 ASN CB 1 1 26 11167 1 1 19 ASN CG C 8.193 4.005 -1.813 1.00 . A A . 19 ASN CG 1 1 26 11168 1 1 19 ASN H H 7.779 1.340 -0.314 1.00 . A A . 19 ASN H 1 1 26 11169 1 1 19 ASN HA H 10.219 2.925 -0.612 1.00 . A A . 19 ASN HA 1 1 26 11170 1 1 19 ASN HB2 H 7.321 3.430 0.065 1.00 . A A . 19 ASN HB2 1 1 26 11171 1 1 19 ASN HB3 H 8.508 4.728 0.182 1.00 . A A . 19 ASN HB3 1 1 26 11172 1 1 19 ASN HD21 H 6.414 3.139 -1.989 1.00 . A A . 19 ASN HD21 1 1 26 11173 1 1 19 ASN HD22 H 7.085 3.719 -3.436 1.00 . A A . 19 ASN HD22 1 1 26 11174 1 1 19 ASN N N 8.752 1.430 -0.262 1.00 . A A . 19 ASN N 1 1 26 11175 1 1 19 ASN ND2 N 7.143 3.586 -2.467 1.00 . A A . 19 ASN ND2 1 1 26 11176 1 1 19 ASN O O 10.457 3.781 1.903 1.00 . A A . 19 ASN O 1 1 26 11177 1 1 19 ASN OD1 O 9.096 4.560 -2.408 1.00 . A A . 19 ASN OD1 1 1 26 11178 1 1 20 GLY C C 10.814 0.917 4.044 1.00 . A A . 20 GLY C 1 1 26 11179 1 1 20 GLY CA C 9.710 1.942 3.759 1.00 . A A . 20 GLY CA 1 1 26 11180 1 1 20 GLY H H 8.804 1.185 1.964 1.00 . A A . 20 GLY H 1 1 26 11181 1 1 20 GLY HA2 H 10.058 2.930 4.025 1.00 . A A . 20 GLY HA2 1 1 26 11182 1 1 20 GLY HA3 H 8.839 1.697 4.348 1.00 . A A . 20 GLY HA3 1 1 26 11183 1 1 20 GLY N N 9.354 1.915 2.311 1.00 . A A . 20 GLY N 1 1 26 11184 1 1 20 GLY O O 11.746 1.199 4.769 1.00 . A A . 20 GLY O 1 1 26 11185 1 1 21 VAL C C 13.169 -0.774 3.426 1.00 . A A . 21 VAL C 1 1 26 11186 1 1 21 VAL CA C 11.767 -1.316 3.738 1.00 . A A . 21 VAL CA 1 1 26 11187 1 1 21 VAL CB C 11.435 -2.503 2.817 1.00 . A A . 21 VAL CB 1 1 26 11188 1 1 21 VAL CG1 C 10.140 -3.172 3.285 1.00 . A A . 21 VAL CG1 1 1 26 11189 1 1 21 VAL CG2 C 11.270 -2.035 1.365 1.00 . A A . 21 VAL CG2 1 1 26 11190 1 1 21 VAL H H 9.945 -0.478 2.905 1.00 . A A . 21 VAL H 1 1 26 11191 1 1 21 VAL HA H 11.724 -1.634 4.763 1.00 . A A . 21 VAL HA 1 1 26 11192 1 1 21 VAL HB H 12.241 -3.218 2.869 1.00 . A A . 21 VAL HB 1 1 26 11193 1 1 21 VAL HG11 H 9.491 -2.432 3.728 1.00 . A A . 21 VAL HG11 1 1 26 11194 1 1 21 VAL HG12 H 10.372 -3.932 4.016 1.00 . A A . 21 VAL HG12 1 1 26 11195 1 1 21 VAL HG13 H 9.644 -3.625 2.439 1.00 . A A . 21 VAL HG13 1 1 26 11196 1 1 21 VAL HG21 H 10.710 -2.775 0.811 1.00 . A A . 21 VAL HG21 1 1 26 11197 1 1 21 VAL HG22 H 12.243 -1.910 0.914 1.00 . A A . 21 VAL HG22 1 1 26 11198 1 1 21 VAL HG23 H 10.742 -1.095 1.345 1.00 . A A . 21 VAL HG23 1 1 26 11199 1 1 21 VAL N N 10.714 -0.271 3.484 1.00 . A A . 21 VAL N 1 1 26 11200 1 1 21 VAL O O 14.109 -1.002 4.165 1.00 . A A . 21 VAL O 1 1 26 11201 1 1 22 PHE C C 15.136 1.501 3.025 1.00 . A A . 22 PHE C 1 1 26 11202 1 1 22 PHE CA C 14.646 0.504 1.966 1.00 . A A . 22 PHE CA 1 1 26 11203 1 1 22 PHE CB C 14.425 1.213 0.625 1.00 . A A . 22 PHE CB 1 1 26 11204 1 1 22 PHE CD1 C 16.212 0.196 -0.834 1.00 . A A . 22 PHE CD1 1 1 26 11205 1 1 22 PHE CD2 C 13.901 -0.425 -1.220 1.00 . A A . 22 PHE CD2 1 1 26 11206 1 1 22 PHE CE1 C 16.613 -0.643 -1.880 1.00 . A A . 22 PHE CE1 1 1 26 11207 1 1 22 PHE CE2 C 14.301 -1.264 -2.267 1.00 . A A . 22 PHE CE2 1 1 26 11208 1 1 22 PHE CG C 14.857 0.305 -0.504 1.00 . A A . 22 PHE CG 1 1 26 11209 1 1 22 PHE CZ C 15.657 -1.373 -2.596 1.00 . A A . 22 PHE CZ 1 1 26 11210 1 1 22 PHE H H 12.531 0.100 1.771 1.00 . A A . 22 PHE H 1 1 26 11211 1 1 22 PHE HA H 15.362 -0.288 1.847 1.00 . A A . 22 PHE HA 1 1 26 11212 1 1 22 PHE HB2 H 13.377 1.453 0.514 1.00 . A A . 22 PHE HB2 1 1 26 11213 1 1 22 PHE HB3 H 15.007 2.121 0.598 1.00 . A A . 22 PHE HB3 1 1 26 11214 1 1 22 PHE HD1 H 16.951 0.759 -0.282 1.00 . A A . 22 PHE HD1 1 1 26 11215 1 1 22 PHE HD2 H 12.855 -0.340 -0.966 1.00 . A A . 22 PHE HD2 1 1 26 11216 1 1 22 PHE HE1 H 17.659 -0.728 -2.135 1.00 . A A . 22 PHE HE1 1 1 26 11217 1 1 22 PHE HE2 H 13.564 -1.827 -2.819 1.00 . A A . 22 PHE HE2 1 1 26 11218 1 1 22 PHE HZ H 15.966 -2.020 -3.404 1.00 . A A . 22 PHE HZ 1 1 26 11219 1 1 22 PHE N N 13.309 -0.061 2.341 1.00 . A A . 22 PHE N 1 1 26 11220 1 1 22 PHE O O 16.326 1.686 3.206 1.00 . A A . 22 PHE O 1 1 26 11221 1 1 23 PHE C C 14.410 2.545 6.182 1.00 . A A . 23 PHE C 1 1 26 11222 1 1 23 PHE CA C 14.642 3.123 4.775 1.00 . A A . 23 PHE CA 1 1 26 11223 1 1 23 PHE CB C 13.749 4.347 4.540 1.00 . A A . 23 PHE CB 1 1 26 11224 1 1 23 PHE CD1 C 15.352 6.120 3.730 1.00 . A A . 23 PHE CD1 1 1 26 11225 1 1 23 PHE CD2 C 14.491 6.270 5.993 1.00 . A A . 23 PHE CD2 1 1 26 11226 1 1 23 PHE CE1 C 16.094 7.290 3.934 1.00 . A A . 23 PHE CE1 1 1 26 11227 1 1 23 PHE CE2 C 15.234 7.440 6.196 1.00 . A A . 23 PHE CE2 1 1 26 11228 1 1 23 PHE CG C 14.550 5.610 4.759 1.00 . A A . 23 PHE CG 1 1 26 11229 1 1 23 PHE CZ C 16.034 7.950 5.167 1.00 . A A . 23 PHE CZ 1 1 26 11230 1 1 23 PHE H H 13.283 1.969 3.560 1.00 . A A . 23 PHE H 1 1 26 11231 1 1 23 PHE HA H 15.678 3.396 4.649 1.00 . A A . 23 PHE HA 1 1 26 11232 1 1 23 PHE HB2 H 13.375 4.330 3.526 1.00 . A A . 23 PHE HB2 1 1 26 11233 1 1 23 PHE HB3 H 12.919 4.324 5.229 1.00 . A A . 23 PHE HB3 1 1 26 11234 1 1 23 PHE HD1 H 15.398 5.611 2.779 1.00 . A A . 23 PHE HD1 1 1 26 11235 1 1 23 PHE HD2 H 13.874 5.878 6.787 1.00 . A A . 23 PHE HD2 1 1 26 11236 1 1 23 PHE HE1 H 16.711 7.683 3.141 1.00 . A A . 23 PHE HE1 1 1 26 11237 1 1 23 PHE HE2 H 15.188 7.949 7.147 1.00 . A A . 23 PHE HE2 1 1 26 11238 1 1 23 PHE HZ H 16.607 8.851 5.325 1.00 . A A . 23 PHE HZ 1 1 26 11239 1 1 23 PHE N N 14.233 2.140 3.724 1.00 . A A . 23 PHE N 1 1 26 11240 1 1 23 PHE O O 14.269 3.278 7.143 1.00 . A A . 23 PHE O 1 1 26 11241 1 1 24 TYR C C 14.936 -0.702 7.769 1.00 . A A . 24 TYR C 1 1 26 11242 1 1 24 TYR CA C 14.151 0.614 7.653 1.00 . A A . 24 TYR CA 1 1 26 11243 1 1 24 TYR CB C 12.642 0.354 7.725 1.00 . A A . 24 TYR CB 1 1 26 11244 1 1 24 TYR CD1 C 11.995 0.660 10.141 1.00 . A A . 24 TYR CD1 1 1 26 11245 1 1 24 TYR CD2 C 11.511 2.443 8.571 1.00 . A A . 24 TYR CD2 1 1 26 11246 1 1 24 TYR CE1 C 11.431 1.417 11.175 1.00 . A A . 24 TYR CE1 1 1 26 11247 1 1 24 TYR CE2 C 10.948 3.200 9.604 1.00 . A A . 24 TYR CE2 1 1 26 11248 1 1 24 TYR CG C 12.036 1.172 8.839 1.00 . A A . 24 TYR CG 1 1 26 11249 1 1 24 TYR CZ C 10.907 2.687 10.905 1.00 . A A . 24 TYR CZ 1 1 26 11250 1 1 24 TYR H H 14.488 0.665 5.523 1.00 . A A . 24 TYR H 1 1 26 11251 1 1 24 TYR HA H 14.444 1.296 8.436 1.00 . A A . 24 TYR HA 1 1 26 11252 1 1 24 TYR HB2 H 12.185 0.630 6.788 1.00 . A A . 24 TYR HB2 1 1 26 11253 1 1 24 TYR HB3 H 12.465 -0.694 7.915 1.00 . A A . 24 TYR HB3 1 1 26 11254 1 1 24 TYR HD1 H 12.399 -0.319 10.349 1.00 . A A . 24 TYR HD1 1 1 26 11255 1 1 24 TYR HD2 H 11.543 2.838 7.566 1.00 . A A . 24 TYR HD2 1 1 26 11256 1 1 24 TYR HE1 H 11.400 1.022 12.178 1.00 . A A . 24 TYR HE1 1 1 26 11257 1 1 24 TYR HE2 H 10.543 4.180 9.396 1.00 . A A . 24 TYR HE2 1 1 26 11258 1 1 24 TYR HH H 11.017 4.050 12.238 1.00 . A A . 24 TYR HH 1 1 26 11259 1 1 24 TYR N N 14.371 1.237 6.310 1.00 . A A . 24 TYR N 1 1 26 11260 1 1 24 TYR O O 14.442 -1.684 8.293 1.00 . A A . 24 TYR O 1 1 26 11261 1 1 24 TYR OH O 10.351 3.433 11.925 1.00 . A A . 24 TYR OH 1 1 26 11262 1 1 25 LYS C C 18.451 -1.641 7.593 1.00 . A A . 25 LYS C 1 1 26 11263 1 1 25 LYS CA C 16.971 -1.980 7.370 1.00 . A A . 25 LYS CA 1 1 26 11264 1 1 25 LYS CB C 16.771 -2.678 6.020 1.00 . A A . 25 LYS CB 1 1 26 11265 1 1 25 LYS CD C 15.981 -5.055 5.904 1.00 . A A . 25 LYS CD 1 1 26 11266 1 1 25 LYS CE C 15.335 -5.403 7.250 1.00 . A A . 25 LYS CE 1 1 26 11267 1 1 25 LYS CG C 17.195 -4.147 6.133 1.00 . A A . 25 LYS CG 1 1 26 11268 1 1 25 LYS H H 16.534 0.073 6.870 1.00 . A A . 25 LYS H 1 1 26 11269 1 1 25 LYS HA H 16.608 -2.612 8.166 1.00 . A A . 25 LYS HA 1 1 26 11270 1 1 25 LYS HB2 H 15.730 -2.622 5.737 1.00 . A A . 25 LYS HB2 1 1 26 11271 1 1 25 LYS HB3 H 17.375 -2.190 5.270 1.00 . A A . 25 LYS HB3 1 1 26 11272 1 1 25 LYS HD2 H 15.263 -4.543 5.281 1.00 . A A . 25 LYS HD2 1 1 26 11273 1 1 25 LYS HD3 H 16.301 -5.963 5.415 1.00 . A A . 25 LYS HD3 1 1 26 11274 1 1 25 LYS HE2 H 16.088 -5.447 8.026 1.00 . A A . 25 LYS HE2 1 1 26 11275 1 1 25 LYS HE3 H 14.578 -4.677 7.502 1.00 . A A . 25 LYS HE3 1 1 26 11276 1 1 25 LYS HG2 H 17.950 -4.361 5.390 1.00 . A A . 25 LYS HG2 1 1 26 11277 1 1 25 LYS HG3 H 17.598 -4.331 7.118 1.00 . A A . 25 LYS HG3 1 1 26 11278 1 1 25 LYS HZ1 H 15.447 -7.436 6.802 1.00 . A A . 25 LYS HZ1 1 1 26 11279 1 1 25 LYS HZ2 H 14.012 -6.691 6.282 1.00 . A A . 25 LYS HZ2 1 1 26 11280 1 1 25 LYS HZ3 H 14.242 -7.043 7.928 1.00 . A A . 25 LYS HZ3 1 1 26 11281 1 1 25 LYS N N 16.155 -0.729 7.286 1.00 . A A . 25 LYS N 1 1 26 11282 1 1 25 LYS NZ N 14.713 -6.744 7.050 1.00 . A A . 25 LYS NZ 1 1 26 11283 1 1 25 LYS O O 18.999 -0.890 6.799 1.00 . A A . 25 LYS O 1 1 26 11284 1 1 25 LYS OXT O 19.012 -2.139 8.554 1.00 . A A . 25 LYS OXT 1 1 27 11285 1 1 1 HIS C C -15.341 5.233 3.133 1.00 . A A . 1 HIS C 1 1 27 11286 1 1 1 HIS CA C -14.009 5.968 3.379 1.00 . A A . 1 HIS CA 1 1 27 11287 1 1 1 HIS CB C -14.228 7.285 4.148 1.00 . A A . 1 HIS CB 1 1 27 11288 1 1 1 HIS CD2 C -15.317 9.100 2.581 1.00 . A A . 1 HIS CD2 1 1 27 11289 1 1 1 HIS CE1 C -17.389 8.791 3.130 1.00 . A A . 1 HIS CE1 1 1 27 11290 1 1 1 HIS CG C -15.334 8.098 3.519 1.00 . A A . 1 HIS CG 1 1 27 11291 1 1 1 HIS HA H -13.343 5.332 3.942 1.00 . A A . 1 HIS HA 1 1 27 11292 1 1 1 HIS HB2 H -14.491 7.059 5.171 1.00 . A A . 1 HIS HB2 1 1 27 11293 1 1 1 HIS HB3 H -13.313 7.859 4.137 1.00 . A A . 1 HIS HB3 1 1 27 11294 1 1 1 HIS HD1 H -17.019 7.271 4.503 1.00 . A A . 1 HIS HD1 1 1 27 11295 1 1 1 HIS HD2 H -14.429 9.493 2.106 1.00 . A A . 1 HIS HD2 1 1 27 11296 1 1 1 HIS HE1 H -18.464 8.879 3.184 1.00 . A A . 1 HIS HE1 1 1 27 11297 1 1 1 HIS N N -13.360 6.356 2.085 1.00 . A A . 1 HIS N 1 1 27 11298 1 1 1 HIS ND1 N -16.667 7.917 3.855 1.00 . A A . 1 HIS ND1 1 1 27 11299 1 1 1 HIS NE2 N -16.615 9.536 2.337 1.00 . A A . 1 HIS NE2 1 1 27 11300 1 1 1 HIS O O -15.730 4.381 3.908 1.00 . A A . 1 HIS O 1 1 27 11301 1 1 2 ALA C C -17.226 4.054 0.481 1.00 . A A . 2 ALA C 1 1 27 11302 1 1 2 ALA CA C -17.335 4.863 1.779 1.00 . A A . 2 ALA CA 1 1 27 11303 1 1 2 ALA CB C -18.361 5.989 1.630 1.00 . A A . 2 ALA CB 1 1 27 11304 1 1 2 ALA H H -15.708 6.238 1.450 1.00 . A A . 2 ALA H 1 1 27 11305 1 1 2 ALA HA H -17.610 4.220 2.600 1.00 . A A . 2 ALA HA 1 1 27 11306 1 1 2 ALA HB1 H -18.611 6.379 2.605 1.00 . A A . 2 ALA HB1 1 1 27 11307 1 1 2 ALA HB2 H -19.251 5.603 1.157 1.00 . A A . 2 ALA HB2 1 1 27 11308 1 1 2 ALA HB3 H -17.944 6.778 1.022 1.00 . A A . 2 ALA HB3 1 1 27 11309 1 1 2 ALA N N -16.037 5.550 2.065 1.00 . A A . 2 ALA N 1 1 27 11310 1 1 2 ALA O O -17.019 4.608 -0.584 1.00 . A A . 2 ALA O 1 1 27 11311 1 1 3 TRP C C -15.844 1.897 -1.226 1.00 . A A . 3 TRP C 1 1 27 11312 1 1 3 TRP CA C -17.264 1.863 -0.639 1.00 . A A . 3 TRP CA 1 1 27 11313 1 1 3 TRP CB C -18.291 2.407 -1.641 1.00 . A A . 3 TRP CB 1 1 27 11314 1 1 3 TRP CD1 C -18.815 0.627 -3.362 1.00 . A A . 3 TRP CD1 1 1 27 11315 1 1 3 TRP CD2 C -20.280 0.641 -1.656 1.00 . A A . 3 TRP CD2 1 1 27 11316 1 1 3 TRP CE2 C -20.689 -0.391 -2.534 1.00 . A A . 3 TRP CE2 1 1 27 11317 1 1 3 TRP CE3 C -21.042 0.861 -0.493 1.00 . A A . 3 TRP CE3 1 1 27 11318 1 1 3 TRP CG C -19.088 1.273 -2.204 1.00 . A A . 3 TRP CG 1 1 27 11319 1 1 3 TRP CH2 C -22.555 -0.945 -1.108 1.00 . A A . 3 TRP CH2 1 1 27 11320 1 1 3 TRP CZ2 C -21.811 -1.177 -2.268 1.00 . A A . 3 TRP CZ2 1 1 27 11321 1 1 3 TRP CZ3 C -22.171 0.072 -0.223 1.00 . A A . 3 TRP CZ3 1 1 27 11322 1 1 3 TRP H H -17.522 2.341 1.449 1.00 . A A . 3 TRP H 1 1 27 11323 1 1 3 TRP HA H -17.520 0.850 -0.370 1.00 . A A . 3 TRP HA 1 1 27 11324 1 1 3 TRP HB2 H -18.953 3.097 -1.139 1.00 . A A . 3 TRP HB2 1 1 27 11325 1 1 3 TRP HB3 H -17.778 2.919 -2.441 1.00 . A A . 3 TRP HB3 1 1 27 11326 1 1 3 TRP HD1 H -17.989 0.847 -4.024 1.00 . A A . 3 TRP HD1 1 1 27 11327 1 1 3 TRP HE1 H -19.793 -0.972 -4.323 1.00 . A A . 3 TRP HE1 1 1 27 11328 1 1 3 TRP HE3 H -20.754 1.642 0.196 1.00 . A A . 3 TRP HE3 1 1 27 11329 1 1 3 TRP HH2 H -23.425 -1.548 -0.895 1.00 . A A . 3 TRP HH2 1 1 27 11330 1 1 3 TRP HZ2 H -22.102 -1.958 -2.953 1.00 . A A . 3 TRP HZ2 1 1 27 11331 1 1 3 TRP HZ3 H -22.748 0.250 0.673 1.00 . A A . 3 TRP HZ3 1 1 27 11332 1 1 3 TRP N N -17.360 2.748 0.572 1.00 . A A . 3 TRP N 1 1 27 11333 1 1 3 TRP NE1 N -19.764 -0.360 -3.559 1.00 . A A . 3 TRP NE1 1 1 27 11334 1 1 3 TRP O O -15.128 2.870 -1.079 1.00 . A A . 3 TRP O 1 1 27 11335 1 1 4 TYR C C -13.017 1.471 -1.640 1.00 . A A . 4 TYR C 1 1 27 11336 1 1 4 TYR CA C -14.066 0.719 -2.482 1.00 . A A . 4 TYR CA 1 1 27 11337 1 1 4 TYR CB C -14.179 1.283 -3.917 1.00 . A A . 4 TYR CB 1 1 27 11338 1 1 4 TYR CD1 C -15.859 3.174 -3.935 1.00 . A A . 4 TYR CD1 1 1 27 11339 1 1 4 TYR CD2 C -13.498 3.720 -3.945 1.00 . A A . 4 TYR CD2 1 1 27 11340 1 1 4 TYR CE1 C -16.173 4.537 -3.958 1.00 . A A . 4 TYR CE1 1 1 27 11341 1 1 4 TYR CE2 C -13.813 5.083 -3.972 1.00 . A A . 4 TYR CE2 1 1 27 11342 1 1 4 TYR CG C -14.520 2.763 -3.925 1.00 . A A . 4 TYR CG 1 1 27 11343 1 1 4 TYR CZ C -15.150 5.491 -3.978 1.00 . A A . 4 TYR CZ 1 1 27 11344 1 1 4 TYR H H -16.054 0.060 -1.956 1.00 . A A . 4 TYR H 1 1 27 11345 1 1 4 TYR HA H -13.785 -0.322 -2.540 1.00 . A A . 4 TYR HA 1 1 27 11346 1 1 4 TYR HB2 H -13.237 1.140 -4.425 1.00 . A A . 4 TYR HB2 1 1 27 11347 1 1 4 TYR HB3 H -14.948 0.741 -4.448 1.00 . A A . 4 TYR HB3 1 1 27 11348 1 1 4 TYR HD1 H -16.649 2.438 -3.920 1.00 . A A . 4 TYR HD1 1 1 27 11349 1 1 4 TYR HD2 H -12.464 3.406 -3.939 1.00 . A A . 4 TYR HD2 1 1 27 11350 1 1 4 TYR HE1 H -17.206 4.854 -3.962 1.00 . A A . 4 TYR HE1 1 1 27 11351 1 1 4 TYR HE2 H -13.023 5.820 -3.989 1.00 . A A . 4 TYR HE2 1 1 27 11352 1 1 4 TYR HH H -15.689 7.106 -3.115 1.00 . A A . 4 TYR HH 1 1 27 11353 1 1 4 TYR N N -15.443 0.822 -1.875 1.00 . A A . 4 TYR N 1 1 27 11354 1 1 4 TYR O O -12.141 2.136 -2.160 1.00 . A A . 4 TYR O 1 1 27 11355 1 1 4 TYR OH O -15.459 6.836 -4.006 1.00 . A A . 4 TYR OH 1 1 27 11356 1 1 5 SER C C -11.274 1.026 1.338 1.00 . A A . 5 SER C 1 1 27 11357 1 1 5 SER CA C -12.114 2.043 0.551 1.00 . A A . 5 SER CA 1 1 27 11358 1 1 5 SER CB C -12.968 2.887 1.500 1.00 . A A . 5 SER CB 1 1 27 11359 1 1 5 SER H H -13.805 0.798 0.060 1.00 . A A . 5 SER H 1 1 27 11360 1 1 5 SER HA H -11.472 2.684 -0.030 1.00 . A A . 5 SER HA 1 1 27 11361 1 1 5 SER HB2 H -13.783 2.294 1.877 1.00 . A A . 5 SER HB2 1 1 27 11362 1 1 5 SER HB3 H -12.356 3.221 2.329 1.00 . A A . 5 SER HB3 1 1 27 11363 1 1 5 SER HG H -14.126 3.686 0.149 1.00 . A A . 5 SER HG 1 1 27 11364 1 1 5 SER N N -13.097 1.350 -0.336 1.00 . A A . 5 SER N 1 1 27 11365 1 1 5 SER O O -10.505 1.394 2.206 1.00 . A A . 5 SER O 1 1 27 11366 1 1 5 SER OG O -13.488 4.009 0.795 1.00 . A A . 5 SER OG 1 1 27 11367 1 1 6 HIS C C -9.433 -1.736 0.911 1.00 . A A . 6 HIS C 1 1 27 11368 1 1 6 HIS CA C -10.607 -1.277 1.774 1.00 . A A . 6 HIS CA 1 1 27 11369 1 1 6 HIS CB C -11.571 -2.438 2.038 1.00 . A A . 6 HIS CB 1 1 27 11370 1 1 6 HIS CD2 C -12.392 -1.608 4.394 1.00 . A A . 6 HIS CD2 1 1 27 11371 1 1 6 HIS CE1 C -14.526 -1.677 4.025 1.00 . A A . 6 HIS CE1 1 1 27 11372 1 1 6 HIS CG C -12.559 -2.046 3.103 1.00 . A A . 6 HIS CG 1 1 27 11373 1 1 6 HIS H H -12.031 -0.522 0.337 1.00 . A A . 6 HIS H 1 1 27 11374 1 1 6 HIS HA H -10.246 -0.877 2.703 1.00 . A A . 6 HIS HA 1 1 27 11375 1 1 6 HIS HB2 H -12.100 -2.681 1.128 1.00 . A A . 6 HIS HB2 1 1 27 11376 1 1 6 HIS HB3 H -11.011 -3.301 2.367 1.00 . A A . 6 HIS HB3 1 1 27 11377 1 1 6 HIS HD1 H -14.379 -2.351 2.063 1.00 . A A . 6 HIS HD1 1 1 27 11378 1 1 6 HIS HD2 H -11.441 -1.467 4.885 1.00 . A A . 6 HIS HD2 1 1 27 11379 1 1 6 HIS HE1 H -15.596 -1.604 4.154 1.00 . A A . 6 HIS HE1 1 1 27 11380 1 1 6 HIS N N -11.408 -0.245 1.043 1.00 . A A . 6 HIS N 1 1 27 11381 1 1 6 HIS ND1 N -13.928 -2.081 2.890 1.00 . A A . 6 HIS ND1 1 1 27 11382 1 1 6 HIS NE2 N -13.636 -1.376 4.974 1.00 . A A . 6 HIS NE2 1 1 27 11383 1 1 6 HIS O O -8.320 -1.867 1.384 1.00 . A A . 6 HIS O 1 1 27 11384 1 1 7 TYR C C -7.500 -1.328 -1.349 1.00 . A A . 7 TYR C 1 1 27 11385 1 1 7 TYR CA C -8.569 -2.417 -1.260 1.00 . A A . 7 TYR CA 1 1 27 11386 1 1 7 TYR CB C -9.226 -2.651 -2.625 1.00 . A A . 7 TYR CB 1 1 27 11387 1 1 7 TYR CD1 C -9.204 -5.157 -2.906 1.00 . A A . 7 TYR CD1 1 1 27 11388 1 1 7 TYR CD2 C -11.294 -4.064 -2.340 1.00 . A A . 7 TYR CD2 1 1 27 11389 1 1 7 TYR CE1 C -9.852 -6.397 -2.904 1.00 . A A . 7 TYR CE1 1 1 27 11390 1 1 7 TYR CE2 C -11.941 -5.305 -2.337 1.00 . A A . 7 TYR CE2 1 1 27 11391 1 1 7 TYR CG C -9.925 -3.990 -2.625 1.00 . A A . 7 TYR CG 1 1 27 11392 1 1 7 TYR CZ C -11.221 -6.471 -2.619 1.00 . A A . 7 TYR CZ 1 1 27 11393 1 1 7 TYR H H -10.578 -1.855 -0.703 1.00 . A A . 7 TYR H 1 1 27 11394 1 1 7 TYR HA H -8.134 -3.331 -0.896 1.00 . A A . 7 TYR HA 1 1 27 11395 1 1 7 TYR HB2 H -9.945 -1.868 -2.817 1.00 . A A . 7 TYR HB2 1 1 27 11396 1 1 7 TYR HB3 H -8.469 -2.641 -3.394 1.00 . A A . 7 TYR HB3 1 1 27 11397 1 1 7 TYR HD1 H -8.148 -5.100 -3.126 1.00 . A A . 7 TYR HD1 1 1 27 11398 1 1 7 TYR HD2 H -11.851 -3.165 -2.124 1.00 . A A . 7 TYR HD2 1 1 27 11399 1 1 7 TYR HE1 H -9.297 -7.298 -3.120 1.00 . A A . 7 TYR HE1 1 1 27 11400 1 1 7 TYR HE2 H -12.997 -5.363 -2.118 1.00 . A A . 7 TYR HE2 1 1 27 11401 1 1 7 TYR HH H -12.196 -7.856 -3.499 1.00 . A A . 7 TYR HH 1 1 27 11402 1 1 7 TYR N N -9.674 -1.974 -0.352 1.00 . A A . 7 TYR N 1 1 27 11403 1 1 7 TYR O O -6.319 -1.612 -1.392 1.00 . A A . 7 TYR O 1 1 27 11404 1 1 7 TYR OH O -11.860 -7.694 -2.614 1.00 . A A . 7 TYR OH 1 1 27 11405 1 1 8 VAL C C -6.063 1.027 -0.126 1.00 . A A . 8 VAL C 1 1 27 11406 1 1 8 VAL CA C -6.910 1.030 -1.407 1.00 . A A . 8 VAL CA 1 1 27 11407 1 1 8 VAL CB C -7.731 2.325 -1.538 1.00 . A A . 8 VAL CB 1 1 27 11408 1 1 8 VAL CG1 C -8.507 2.600 -0.244 1.00 . A A . 8 VAL CG1 1 1 27 11409 1 1 8 VAL CG2 C -6.787 3.498 -1.821 1.00 . A A . 8 VAL CG2 1 1 27 11410 1 1 8 VAL H H -8.864 0.115 -1.296 1.00 . A A . 8 VAL H 1 1 27 11411 1 1 8 VAL HA H -6.275 0.911 -2.267 1.00 . A A . 8 VAL HA 1 1 27 11412 1 1 8 VAL HB H -8.430 2.222 -2.356 1.00 . A A . 8 VAL HB 1 1 27 11413 1 1 8 VAL HG11 H -7.813 2.846 0.546 1.00 . A A . 8 VAL HG11 1 1 27 11414 1 1 8 VAL HG12 H -9.072 1.723 0.031 1.00 . A A . 8 VAL HG12 1 1 27 11415 1 1 8 VAL HG13 H -9.183 3.429 -0.400 1.00 . A A . 8 VAL HG13 1 1 27 11416 1 1 8 VAL HG21 H -7.363 4.404 -1.937 1.00 . A A . 8 VAL HG21 1 1 27 11417 1 1 8 VAL HG22 H -6.234 3.304 -2.728 1.00 . A A . 8 VAL HG22 1 1 27 11418 1 1 8 VAL HG23 H -6.098 3.612 -0.997 1.00 . A A . 8 VAL HG23 1 1 27 11419 1 1 8 VAL N N -7.907 -0.083 -1.349 1.00 . A A . 8 VAL N 1 1 27 11420 1 1 8 VAL O O -4.901 1.384 -0.144 1.00 . A A . 8 VAL O 1 1 27 11421 1 1 9 LEU C C -4.797 -0.548 2.161 1.00 . A A . 9 LEU C 1 1 27 11422 1 1 9 LEU CA C -5.868 0.545 2.258 1.00 . A A . 9 LEU CA 1 1 27 11423 1 1 9 LEU CB C -6.904 0.200 3.335 1.00 . A A . 9 LEU CB 1 1 27 11424 1 1 9 LEU CD1 C -7.046 1.089 5.671 1.00 . A A . 9 LEU CD1 1 1 27 11425 1 1 9 LEU CD2 C -6.190 -1.223 5.264 1.00 . A A . 9 LEU CD2 1 1 27 11426 1 1 9 LEU CG C -6.239 0.206 4.716 1.00 . A A . 9 LEU CG 1 1 27 11427 1 1 9 LEU H H -7.570 0.303 0.956 1.00 . A A . 9 LEU H 1 1 27 11428 1 1 9 LEU HA H -5.415 1.501 2.469 1.00 . A A . 9 LEU HA 1 1 27 11429 1 1 9 LEU HB2 H -7.699 0.931 3.314 1.00 . A A . 9 LEU HB2 1 1 27 11430 1 1 9 LEU HB3 H -7.313 -0.780 3.139 1.00 . A A . 9 LEU HB3 1 1 27 11431 1 1 9 LEU HD11 H -8.101 0.945 5.491 1.00 . A A . 9 LEU HD11 1 1 27 11432 1 1 9 LEU HD12 H -6.790 2.125 5.506 1.00 . A A . 9 LEU HD12 1 1 27 11433 1 1 9 LEU HD13 H -6.815 0.820 6.692 1.00 . A A . 9 LEU HD13 1 1 27 11434 1 1 9 LEU HD21 H -7.191 -1.628 5.304 1.00 . A A . 9 LEU HD21 1 1 27 11435 1 1 9 LEU HD22 H -5.765 -1.214 6.257 1.00 . A A . 9 LEU HD22 1 1 27 11436 1 1 9 LEU HD23 H -5.580 -1.837 4.618 1.00 . A A . 9 LEU HD23 1 1 27 11437 1 1 9 LEU HG H -5.234 0.594 4.630 1.00 . A A . 9 LEU HG 1 1 27 11438 1 1 9 LEU N N -6.636 0.602 0.977 1.00 . A A . 9 LEU N 1 1 27 11439 1 1 9 LEU O O -3.666 -0.357 2.569 1.00 . A A . 9 LEU O 1 1 27 11440 1 1 10 LYS C C -3.125 -2.422 0.379 1.00 . A A . 10 LYS C 1 1 27 11441 1 1 10 LYS CA C -4.146 -2.792 1.462 1.00 . A A . 10 LYS CA 1 1 27 11442 1 1 10 LYS CB C -4.958 -4.022 1.039 1.00 . A A . 10 LYS CB 1 1 27 11443 1 1 10 LYS CD C -6.077 -6.092 1.891 1.00 . A A . 10 LYS CD 1 1 27 11444 1 1 10 LYS CE C -6.658 -6.785 3.128 1.00 . A A . 10 LYS CE 1 1 27 11445 1 1 10 LYS CG C -5.529 -4.715 2.280 1.00 . A A . 10 LYS CG 1 1 27 11446 1 1 10 LYS H H -6.060 -1.811 1.272 1.00 . A A . 10 LYS H 1 1 27 11447 1 1 10 LYS HA H -3.648 -2.979 2.401 1.00 . A A . 10 LYS HA 1 1 27 11448 1 1 10 LYS HB2 H -5.768 -3.714 0.393 1.00 . A A . 10 LYS HB2 1 1 27 11449 1 1 10 LYS HB3 H -4.317 -4.709 0.508 1.00 . A A . 10 LYS HB3 1 1 27 11450 1 1 10 LYS HD2 H -6.851 -5.972 1.146 1.00 . A A . 10 LYS HD2 1 1 27 11451 1 1 10 LYS HD3 H -5.278 -6.695 1.485 1.00 . A A . 10 LYS HD3 1 1 27 11452 1 1 10 LYS HE2 H -5.884 -6.937 3.869 1.00 . A A . 10 LYS HE2 1 1 27 11453 1 1 10 LYS HE3 H -7.465 -6.200 3.542 1.00 . A A . 10 LYS HE3 1 1 27 11454 1 1 10 LYS HG2 H -4.749 -4.833 3.018 1.00 . A A . 10 LYS HG2 1 1 27 11455 1 1 10 LYS HG3 H -6.328 -4.116 2.692 1.00 . A A . 10 LYS HG3 1 1 27 11456 1 1 10 LYS HZ1 H -6.387 -8.662 2.263 1.00 . A A . 10 LYS HZ1 1 1 27 11457 1 1 10 LYS HZ2 H -7.875 -7.932 1.883 1.00 . A A . 10 LYS HZ2 1 1 27 11458 1 1 10 LYS HZ3 H -7.624 -8.607 3.422 1.00 . A A . 10 LYS HZ3 1 1 27 11459 1 1 10 LYS N N -5.144 -1.688 1.607 1.00 . A A . 10 LYS N 1 1 27 11460 1 1 10 LYS NZ N -7.175 -8.095 2.637 1.00 . A A . 10 LYS NZ 1 1 27 11461 1 1 10 LYS O O -1.935 -2.602 0.549 1.00 . A A . 10 LYS O 1 1 27 11462 1 1 11 PHE C C -1.719 -0.384 -1.343 1.00 . A A . 11 PHE C 1 1 27 11463 1 1 11 PHE CA C -2.658 -1.495 -1.830 1.00 . A A . 11 PHE CA 1 1 27 11464 1 1 11 PHE CB C -3.563 -0.985 -2.957 1.00 . A A . 11 PHE CB 1 1 27 11465 1 1 11 PHE CD1 C -2.112 0.395 -4.492 1.00 . A A . 11 PHE CD1 1 1 27 11466 1 1 11 PHE CD2 C -2.648 -1.882 -5.130 1.00 . A A . 11 PHE CD2 1 1 27 11467 1 1 11 PHE CE1 C -1.364 0.548 -5.666 1.00 . A A . 11 PHE CE1 1 1 27 11468 1 1 11 PHE CE2 C -1.900 -1.729 -6.305 1.00 . A A . 11 PHE CE2 1 1 27 11469 1 1 11 PHE CG C -2.754 -0.820 -4.224 1.00 . A A . 11 PHE CG 1 1 27 11470 1 1 11 PHE CZ C -1.259 -0.513 -6.571 1.00 . A A . 11 PHE CZ 1 1 27 11471 1 1 11 PHE H H -4.557 -1.753 -0.835 1.00 . A A . 11 PHE H 1 1 27 11472 1 1 11 PHE HA H -2.090 -2.348 -2.167 1.00 . A A . 11 PHE HA 1 1 27 11473 1 1 11 PHE HB2 H -4.358 -1.696 -3.128 1.00 . A A . 11 PHE HB2 1 1 27 11474 1 1 11 PHE HB3 H -3.987 -0.033 -2.675 1.00 . A A . 11 PHE HB3 1 1 27 11475 1 1 11 PHE HD1 H -2.193 1.215 -3.793 1.00 . A A . 11 PHE HD1 1 1 27 11476 1 1 11 PHE HD2 H -3.142 -2.819 -4.924 1.00 . A A . 11 PHE HD2 1 1 27 11477 1 1 11 PHE HE1 H -0.870 1.485 -5.872 1.00 . A A . 11 PHE HE1 1 1 27 11478 1 1 11 PHE HE2 H -1.818 -2.548 -7.003 1.00 . A A . 11 PHE HE2 1 1 27 11479 1 1 11 PHE HZ H -0.682 -0.395 -7.478 1.00 . A A . 11 PHE HZ 1 1 27 11480 1 1 11 PHE N N -3.591 -1.894 -0.730 1.00 . A A . 11 PHE N 1 1 27 11481 1 1 11 PHE O O -0.528 -0.422 -1.588 1.00 . A A . 11 PHE O 1 1 27 11482 1 1 12 PHE C C -0.294 1.146 0.785 1.00 . A A . 12 PHE C 1 1 27 11483 1 1 12 PHE CA C -1.385 1.711 -0.135 1.00 . A A . 12 PHE CA 1 1 27 11484 1 1 12 PHE CB C -2.335 2.629 0.647 1.00 . A A . 12 PHE CB 1 1 27 11485 1 1 12 PHE CD1 C -0.882 4.689 0.773 1.00 . A A . 12 PHE CD1 1 1 27 11486 1 1 12 PHE CD2 C -1.448 3.532 2.828 1.00 . A A . 12 PHE CD2 1 1 27 11487 1 1 12 PHE CE1 C -0.141 5.625 1.504 1.00 . A A . 12 PHE CE1 1 1 27 11488 1 1 12 PHE CE2 C -0.707 4.468 3.559 1.00 . A A . 12 PHE CE2 1 1 27 11489 1 1 12 PHE CG C -1.536 3.643 1.435 1.00 . A A . 12 PHE CG 1 1 27 11490 1 1 12 PHE CZ C -0.053 5.514 2.897 1.00 . A A . 12 PHE CZ 1 1 27 11491 1 1 12 PHE H H -3.210 0.601 -0.460 1.00 . A A . 12 PHE H 1 1 27 11492 1 1 12 PHE HA H -0.941 2.251 -0.956 1.00 . A A . 12 PHE HA 1 1 27 11493 1 1 12 PHE HB2 H -2.986 3.143 -0.045 1.00 . A A . 12 PHE HB2 1 1 27 11494 1 1 12 PHE HB3 H -2.930 2.035 1.326 1.00 . A A . 12 PHE HB3 1 1 27 11495 1 1 12 PHE HD1 H -0.951 4.775 -0.301 1.00 . A A . 12 PHE HD1 1 1 27 11496 1 1 12 PHE HD2 H -1.952 2.724 3.339 1.00 . A A . 12 PHE HD2 1 1 27 11497 1 1 12 PHE HE1 H 0.363 6.431 0.994 1.00 . A A . 12 PHE HE1 1 1 27 11498 1 1 12 PHE HE2 H -0.639 4.382 4.634 1.00 . A A . 12 PHE HE2 1 1 27 11499 1 1 12 PHE HZ H 0.519 6.236 3.461 1.00 . A A . 12 PHE HZ 1 1 27 11500 1 1 12 PHE N N -2.247 0.599 -0.649 1.00 . A A . 12 PHE N 1 1 27 11501 1 1 12 PHE O O 0.862 1.510 0.682 1.00 . A A . 12 PHE O 1 1 27 11502 1 1 13 LEU C C 1.443 -1.072 1.796 1.00 . A A . 13 LEU C 1 1 27 11503 1 1 13 LEU CA C 0.356 -0.346 2.601 1.00 . A A . 13 LEU CA 1 1 27 11504 1 1 13 LEU CB C -0.430 -1.335 3.468 1.00 . A A . 13 LEU CB 1 1 27 11505 1 1 13 LEU CD1 C 0.197 -0.529 5.750 1.00 . A A . 13 LEU CD1 1 1 27 11506 1 1 13 LEU CD2 C -0.144 -2.968 5.337 1.00 . A A . 13 LEU CD2 1 1 27 11507 1 1 13 LEU CG C 0.368 -1.659 4.733 1.00 . A A . 13 LEU CG 1 1 27 11508 1 1 13 LEU H H -1.594 -0.026 1.733 1.00 . A A . 13 LEU H 1 1 27 11509 1 1 13 LEU HA H 0.798 0.418 3.221 1.00 . A A . 13 LEU HA 1 1 27 11510 1 1 13 LEU HB2 H -1.378 -0.897 3.743 1.00 . A A . 13 LEU HB2 1 1 27 11511 1 1 13 LEU HB3 H -0.603 -2.244 2.911 1.00 . A A . 13 LEU HB3 1 1 27 11512 1 1 13 LEU HD11 H 0.664 0.369 5.372 1.00 . A A . 13 LEU HD11 1 1 27 11513 1 1 13 LEU HD12 H 0.662 -0.810 6.683 1.00 . A A . 13 LEU HD12 1 1 27 11514 1 1 13 LEU HD13 H -0.855 -0.347 5.913 1.00 . A A . 13 LEU HD13 1 1 27 11515 1 1 13 LEU HD21 H -0.063 -3.759 4.605 1.00 . A A . 13 LEU HD21 1 1 27 11516 1 1 13 LEU HD22 H -1.178 -2.851 5.628 1.00 . A A . 13 LEU HD22 1 1 27 11517 1 1 13 LEU HD23 H 0.447 -3.220 6.205 1.00 . A A . 13 LEU HD23 1 1 27 11518 1 1 13 LEU HG H 1.415 -1.761 4.483 1.00 . A A . 13 LEU HG 1 1 27 11519 1 1 13 LEU N N -0.655 0.253 1.676 1.00 . A A . 13 LEU N 1 1 27 11520 1 1 13 LEU O O 2.618 -0.973 2.097 1.00 . A A . 13 LEU O 1 1 27 11521 1 1 14 LEU C C 3.020 -1.515 -0.723 1.00 . A A . 14 LEU C 1 1 27 11522 1 1 14 LEU CA C 2.063 -2.518 -0.071 1.00 . A A . 14 LEU CA 1 1 27 11523 1 1 14 LEU CB C 1.242 -3.253 -1.137 1.00 . A A . 14 LEU CB 1 1 27 11524 1 1 14 LEU CD1 C 1.254 -5.627 -1.930 1.00 . A A . 14 LEU CD1 1 1 27 11525 1 1 14 LEU CD2 C 2.588 -3.898 -3.144 1.00 . A A . 14 LEU CD2 1 1 27 11526 1 1 14 LEU CG C 2.094 -4.359 -1.770 1.00 . A A . 14 LEU CG 1 1 27 11527 1 1 14 LEU H H 0.102 -1.848 0.544 1.00 . A A . 14 LEU H 1 1 27 11528 1 1 14 LEU HA H 2.609 -3.223 0.527 1.00 . A A . 14 LEU HA 1 1 27 11529 1 1 14 LEU HB2 H 0.366 -3.690 -0.679 1.00 . A A . 14 LEU HB2 1 1 27 11530 1 1 14 LEU HB3 H 0.937 -2.554 -1.902 1.00 . A A . 14 LEU HB3 1 1 27 11531 1 1 14 LEU HD11 H 0.843 -5.911 -0.972 1.00 . A A . 14 LEU HD11 1 1 27 11532 1 1 14 LEU HD12 H 1.878 -6.427 -2.304 1.00 . A A . 14 LEU HD12 1 1 27 11533 1 1 14 LEU HD13 H 0.450 -5.442 -2.628 1.00 . A A . 14 LEU HD13 1 1 27 11534 1 1 14 LEU HD21 H 1.773 -3.942 -3.853 1.00 . A A . 14 LEU HD21 1 1 27 11535 1 1 14 LEU HD22 H 3.387 -4.545 -3.475 1.00 . A A . 14 LEU HD22 1 1 27 11536 1 1 14 LEU HD23 H 2.951 -2.884 -3.075 1.00 . A A . 14 LEU HD23 1 1 27 11537 1 1 14 LEU HG H 2.943 -4.568 -1.133 1.00 . A A . 14 LEU HG 1 1 27 11538 1 1 14 LEU N N 1.056 -1.792 0.768 1.00 . A A . 14 LEU N 1 1 27 11539 1 1 14 LEU O O 4.224 -1.699 -0.720 1.00 . A A . 14 LEU O 1 1 27 11540 1 1 15 VAL C C 4.258 1.242 -0.862 1.00 . A A . 15 VAL C 1 1 27 11541 1 1 15 VAL CA C 3.351 0.588 -1.915 1.00 . A A . 15 VAL CA 1 1 27 11542 1 1 15 VAL CB C 2.372 1.613 -2.509 1.00 . A A . 15 VAL CB 1 1 27 11543 1 1 15 VAL CG1 C 3.149 2.770 -3.144 1.00 . A A . 15 VAL CG1 1 1 27 11544 1 1 15 VAL CG2 C 1.509 0.939 -3.583 1.00 . A A . 15 VAL CG2 1 1 27 11545 1 1 15 VAL H H 1.516 -0.332 -1.241 1.00 . A A . 15 VAL H 1 1 27 11546 1 1 15 VAL HA H 3.945 0.146 -2.701 1.00 . A A . 15 VAL HA 1 1 27 11547 1 1 15 VAL HB H 1.736 1.996 -1.724 1.00 . A A . 15 VAL HB 1 1 27 11548 1 1 15 VAL HG11 H 3.707 2.407 -3.994 1.00 . A A . 15 VAL HG11 1 1 27 11549 1 1 15 VAL HG12 H 3.831 3.189 -2.418 1.00 . A A . 15 VAL HG12 1 1 27 11550 1 1 15 VAL HG13 H 2.457 3.534 -3.468 1.00 . A A . 15 VAL HG13 1 1 27 11551 1 1 15 VAL HG21 H 1.531 -0.132 -3.446 1.00 . A A . 15 VAL HG21 1 1 27 11552 1 1 15 VAL HG22 H 1.896 1.183 -4.563 1.00 . A A . 15 VAL HG22 1 1 27 11553 1 1 15 VAL HG23 H 0.491 1.291 -3.501 1.00 . A A . 15 VAL HG23 1 1 27 11554 1 1 15 VAL N N 2.488 -0.452 -1.268 1.00 . A A . 15 VAL N 1 1 27 11555 1 1 15 VAL O O 5.398 1.574 -1.132 1.00 . A A . 15 VAL O 1 1 27 11556 1 1 16 PHE C C 5.789 1.139 1.744 1.00 . A A . 16 PHE C 1 1 27 11557 1 1 16 PHE CA C 4.584 2.036 1.423 1.00 . A A . 16 PHE CA 1 1 27 11558 1 1 16 PHE CB C 3.647 2.136 2.632 1.00 . A A . 16 PHE CB 1 1 27 11559 1 1 16 PHE CD1 C 5.094 2.980 4.518 1.00 . A A . 16 PHE CD1 1 1 27 11560 1 1 16 PHE CD2 C 3.575 4.527 3.432 1.00 . A A . 16 PHE CD2 1 1 27 11561 1 1 16 PHE CE1 C 5.528 4.003 5.368 1.00 . A A . 16 PHE CE1 1 1 27 11562 1 1 16 PHE CE2 C 4.009 5.550 4.283 1.00 . A A . 16 PHE CE2 1 1 27 11563 1 1 16 PHE CG C 4.117 3.241 3.549 1.00 . A A . 16 PHE CG 1 1 27 11564 1 1 16 PHE CZ C 4.986 5.289 5.251 1.00 . A A . 16 PHE CZ 1 1 27 11565 1 1 16 PHE H H 2.838 1.132 0.531 1.00 . A A . 16 PHE H 1 1 27 11566 1 1 16 PHE HA H 4.915 3.020 1.129 1.00 . A A . 16 PHE HA 1 1 27 11567 1 1 16 PHE HB2 H 2.645 2.353 2.293 1.00 . A A . 16 PHE HB2 1 1 27 11568 1 1 16 PHE HB3 H 3.652 1.199 3.169 1.00 . A A . 16 PHE HB3 1 1 27 11569 1 1 16 PHE HD1 H 5.512 1.988 4.608 1.00 . A A . 16 PHE HD1 1 1 27 11570 1 1 16 PHE HD2 H 2.820 4.729 2.686 1.00 . A A . 16 PHE HD2 1 1 27 11571 1 1 16 PHE HE1 H 6.282 3.801 6.114 1.00 . A A . 16 PHE HE1 1 1 27 11572 1 1 16 PHE HE2 H 3.590 6.542 4.192 1.00 . A A . 16 PHE HE2 1 1 27 11573 1 1 16 PHE HZ H 5.321 6.078 5.907 1.00 . A A . 16 PHE HZ 1 1 27 11574 1 1 16 PHE N N 3.758 1.417 0.340 1.00 . A A . 16 PHE N 1 1 27 11575 1 1 16 PHE O O 6.888 1.617 1.958 1.00 . A A . 16 PHE O 1 1 27 11576 1 1 17 GLY C C 7.763 -0.989 0.946 1.00 . A A . 17 GLY C 1 1 27 11577 1 1 17 GLY CA C 6.718 -1.095 2.058 1.00 . A A . 17 GLY CA 1 1 27 11578 1 1 17 GLY H H 4.694 -0.519 1.583 1.00 . A A . 17 GLY H 1 1 27 11579 1 1 17 GLY HA2 H 7.169 -0.832 3.005 1.00 . A A . 17 GLY HA2 1 1 27 11580 1 1 17 GLY HA3 H 6.347 -2.107 2.103 1.00 . A A . 17 GLY HA3 1 1 27 11581 1 1 17 GLY N N 5.589 -0.160 1.767 1.00 . A A . 17 GLY N 1 1 27 11582 1 1 17 GLY O O 8.950 -0.948 1.208 1.00 . A A . 17 GLY O 1 1 27 11583 1 1 18 GLU C C 9.118 0.475 -1.271 1.00 . A A . 18 GLU C 1 1 27 11584 1 1 18 GLU CA C 8.297 -0.808 -1.425 1.00 . A A . 18 GLU CA 1 1 27 11585 1 1 18 GLU CB C 7.434 -0.754 -2.689 1.00 . A A . 18 GLU CB 1 1 27 11586 1 1 18 GLU CD C 7.972 -2.348 -4.551 1.00 . A A . 18 GLU CD 1 1 27 11587 1 1 18 GLU CG C 8.311 -0.990 -3.927 1.00 . A A . 18 GLU CG 1 1 27 11588 1 1 18 GLU H H 6.365 -0.954 -0.472 1.00 . A A . 18 GLU H 1 1 27 11589 1 1 18 GLU HA H 8.947 -1.662 -1.453 1.00 . A A . 18 GLU HA 1 1 27 11590 1 1 18 GLU HB2 H 6.671 -1.518 -2.637 1.00 . A A . 18 GLU HB2 1 1 27 11591 1 1 18 GLU HB3 H 6.966 0.216 -2.764 1.00 . A A . 18 GLU HB3 1 1 27 11592 1 1 18 GLU HG2 H 8.129 -0.207 -4.649 1.00 . A A . 18 GLU HG2 1 1 27 11593 1 1 18 GLU HG3 H 9.351 -0.979 -3.639 1.00 . A A . 18 GLU HG3 1 1 27 11594 1 1 18 GLU N N 7.329 -0.930 -0.291 1.00 . A A . 18 GLU N 1 1 27 11595 1 1 18 GLU O O 10.303 0.496 -1.535 1.00 . A A . 18 GLU O 1 1 27 11596 1 1 18 GLU OE1 O 6.815 -2.555 -4.884 1.00 . A A . 18 GLU OE1 1 1 27 11597 1 1 18 GLU OE2 O 8.875 -3.155 -4.690 1.00 . A A . 18 GLU OE2 1 1 27 11598 1 1 19 ASN C C 10.320 2.635 0.433 1.00 . A A . 19 ASN C 1 1 27 11599 1 1 19 ASN CA C 9.236 2.822 -0.630 1.00 . A A . 19 ASN CA 1 1 27 11600 1 1 19 ASN CB C 8.185 3.832 -0.158 1.00 . A A . 19 ASN CB 1 1 27 11601 1 1 19 ASN CG C 7.613 4.577 -1.364 1.00 . A A . 19 ASN CG 1 1 27 11602 1 1 19 ASN H H 7.541 1.482 -0.609 1.00 . A A . 19 ASN H 1 1 27 11603 1 1 19 ASN HA H 9.672 3.147 -1.557 1.00 . A A . 19 ASN HA 1 1 27 11604 1 1 19 ASN HB2 H 7.390 3.312 0.357 1.00 . A A . 19 ASN HB2 1 1 27 11605 1 1 19 ASN HB3 H 8.646 4.541 0.515 1.00 . A A . 19 ASN HB3 1 1 27 11606 1 1 19 ASN HD21 H 6.185 3.237 -1.698 1.00 . A A . 19 ASN HD21 1 1 27 11607 1 1 19 ASN HD22 H 6.214 4.551 -2.772 1.00 . A A . 19 ASN HD22 1 1 27 11608 1 1 19 ASN N N 8.495 1.536 -0.826 1.00 . A A . 19 ASN N 1 1 27 11609 1 1 19 ASN ND2 N 6.586 4.080 -1.998 1.00 . A A . 19 ASN ND2 1 1 27 11610 1 1 19 ASN O O 11.421 3.134 0.306 1.00 . A A . 19 ASN O 1 1 27 11611 1 1 19 ASN OD1 O 8.108 5.621 -1.737 1.00 . A A . 19 ASN OD1 1 1 27 11612 1 1 20 GLY C C 12.082 0.677 2.029 1.00 . A A . 20 GLY C 1 1 27 11613 1 1 20 GLY CA C 11.021 1.654 2.547 1.00 . A A . 20 GLY CA 1 1 27 11614 1 1 20 GLY H H 9.123 1.504 1.538 1.00 . A A . 20 GLY H 1 1 27 11615 1 1 20 GLY HA2 H 11.490 2.588 2.823 1.00 . A A . 20 GLY HA2 1 1 27 11616 1 1 20 GLY HA3 H 10.531 1.225 3.408 1.00 . A A . 20 GLY HA3 1 1 27 11617 1 1 20 GLY N N 10.015 1.902 1.473 1.00 . A A . 20 GLY N 1 1 27 11618 1 1 20 GLY O O 13.261 0.852 2.267 1.00 . A A . 20 GLY O 1 1 27 11619 1 1 21 VAL C C 13.556 -0.671 -0.279 1.00 . A A . 21 VAL C 1 1 27 11620 1 1 21 VAL CA C 12.656 -1.336 0.774 1.00 . A A . 21 VAL CA 1 1 27 11621 1 1 21 VAL CB C 11.807 -2.451 0.147 1.00 . A A . 21 VAL CB 1 1 27 11622 1 1 21 VAL CG1 C 12.692 -3.367 -0.705 1.00 . A A . 21 VAL CG1 1 1 27 11623 1 1 21 VAL CG2 C 11.152 -3.276 1.259 1.00 . A A . 21 VAL CG2 1 1 27 11624 1 1 21 VAL H H 10.708 -0.464 1.134 1.00 . A A . 21 VAL H 1 1 27 11625 1 1 21 VAL HA H 13.255 -1.736 1.570 1.00 . A A . 21 VAL HA 1 1 27 11626 1 1 21 VAL HB H 11.041 -2.012 -0.477 1.00 . A A . 21 VAL HB 1 1 27 11627 1 1 21 VAL HG11 H 13.615 -3.568 -0.179 1.00 . A A . 21 VAL HG11 1 1 27 11628 1 1 21 VAL HG12 H 12.912 -2.884 -1.645 1.00 . A A . 21 VAL HG12 1 1 27 11629 1 1 21 VAL HG13 H 12.175 -4.297 -0.891 1.00 . A A . 21 VAL HG13 1 1 27 11630 1 1 21 VAL HG21 H 10.721 -2.613 1.994 1.00 . A A . 21 VAL HG21 1 1 27 11631 1 1 21 VAL HG22 H 11.896 -3.901 1.730 1.00 . A A . 21 VAL HG22 1 1 27 11632 1 1 21 VAL HG23 H 10.376 -3.897 0.836 1.00 . A A . 21 VAL HG23 1 1 27 11633 1 1 21 VAL N N 11.669 -0.347 1.316 1.00 . A A . 21 VAL N 1 1 27 11634 1 1 21 VAL O O 14.725 -0.988 -0.394 1.00 . A A . 21 VAL O 1 1 27 11635 1 1 22 PHE C C 14.737 2.016 -1.453 1.00 . A A . 22 PHE C 1 1 27 11636 1 1 22 PHE CA C 13.842 0.940 -2.085 1.00 . A A . 22 PHE CA 1 1 27 11637 1 1 22 PHE CB C 12.830 1.575 -3.044 1.00 . A A . 22 PHE CB 1 1 27 11638 1 1 22 PHE CD1 C 11.913 -0.607 -3.917 1.00 . A A . 22 PHE CD1 1 1 27 11639 1 1 22 PHE CD2 C 12.897 0.956 -5.488 1.00 . A A . 22 PHE CD2 1 1 27 11640 1 1 22 PHE CE1 C 11.645 -1.493 -4.968 1.00 . A A . 22 PHE CE1 1 1 27 11641 1 1 22 PHE CE2 C 12.629 0.071 -6.537 1.00 . A A . 22 PHE CE2 1 1 27 11642 1 1 22 PHE CG C 12.540 0.618 -4.177 1.00 . A A . 22 PHE CG 1 1 27 11643 1 1 22 PHE CZ C 12.002 -1.154 -6.277 1.00 . A A . 22 PHE CZ 1 1 27 11644 1 1 22 PHE H H 12.077 0.484 -0.922 1.00 . A A . 22 PHE H 1 1 27 11645 1 1 22 PHE HA H 14.445 0.224 -2.613 1.00 . A A . 22 PHE HA 1 1 27 11646 1 1 22 PHE HB2 H 11.916 1.794 -2.512 1.00 . A A . 22 PHE HB2 1 1 27 11647 1 1 22 PHE HB3 H 13.240 2.491 -3.443 1.00 . A A . 22 PHE HB3 1 1 27 11648 1 1 22 PHE HD1 H 11.636 -0.869 -2.907 1.00 . A A . 22 PHE HD1 1 1 27 11649 1 1 22 PHE HD2 H 13.380 1.901 -5.689 1.00 . A A . 22 PHE HD2 1 1 27 11650 1 1 22 PHE HE1 H 11.162 -2.438 -4.767 1.00 . A A . 22 PHE HE1 1 1 27 11651 1 1 22 PHE HE2 H 12.905 0.331 -7.548 1.00 . A A . 22 PHE HE2 1 1 27 11652 1 1 22 PHE HZ H 11.795 -1.837 -7.087 1.00 . A A . 22 PHE HZ 1 1 27 11653 1 1 22 PHE N N 13.020 0.247 -1.040 1.00 . A A . 22 PHE N 1 1 27 11654 1 1 22 PHE O O 15.684 2.475 -2.061 1.00 . A A . 22 PHE O 1 1 27 11655 1 1 23 PHE C C 16.043 2.821 1.611 1.00 . A A . 23 PHE C 1 1 27 11656 1 1 23 PHE CA C 15.286 3.451 0.435 1.00 . A A . 23 PHE CA 1 1 27 11657 1 1 23 PHE CB C 14.293 4.510 0.926 1.00 . A A . 23 PHE CB 1 1 27 11658 1 1 23 PHE CD1 C 13.129 5.202 -1.204 1.00 . A A . 23 PHE CD1 1 1 27 11659 1 1 23 PHE CD2 C 14.691 6.744 -0.173 1.00 . A A . 23 PHE CD2 1 1 27 11660 1 1 23 PHE CE1 C 12.889 6.128 -2.226 1.00 . A A . 23 PHE CE1 1 1 27 11661 1 1 23 PHE CE2 C 14.450 7.670 -1.195 1.00 . A A . 23 PHE CE2 1 1 27 11662 1 1 23 PHE CG C 14.031 5.509 -0.177 1.00 . A A . 23 PHE CG 1 1 27 11663 1 1 23 PHE CZ C 13.549 7.362 -2.221 1.00 . A A . 23 PHE CZ 1 1 27 11664 1 1 23 PHE H H 13.684 2.026 0.232 1.00 . A A . 23 PHE H 1 1 27 11665 1 1 23 PHE HA H 15.978 3.891 -0.265 1.00 . A A . 23 PHE HA 1 1 27 11666 1 1 23 PHE HB2 H 13.366 4.032 1.207 1.00 . A A . 23 PHE HB2 1 1 27 11667 1 1 23 PHE HB3 H 14.707 5.020 1.783 1.00 . A A . 23 PHE HB3 1 1 27 11668 1 1 23 PHE HD1 H 12.620 4.251 -1.210 1.00 . A A . 23 PHE HD1 1 1 27 11669 1 1 23 PHE HD2 H 15.387 6.982 0.618 1.00 . A A . 23 PHE HD2 1 1 27 11670 1 1 23 PHE HE1 H 12.193 5.891 -3.017 1.00 . A A . 23 PHE HE1 1 1 27 11671 1 1 23 PHE HE2 H 14.960 8.622 -1.192 1.00 . A A . 23 PHE HE2 1 1 27 11672 1 1 23 PHE HZ H 13.363 8.076 -3.008 1.00 . A A . 23 PHE HZ 1 1 27 11673 1 1 23 PHE N N 14.448 2.414 -0.239 1.00 . A A . 23 PHE N 1 1 27 11674 1 1 23 PHE O O 16.071 3.354 2.706 1.00 . A A . 23 PHE O 1 1 27 11675 1 1 24 TYR C C 18.550 0.153 1.881 1.00 . A A . 24 TYR C 1 1 27 11676 1 1 24 TYR CA C 17.419 1.002 2.477 1.00 . A A . 24 TYR CA 1 1 27 11677 1 1 24 TYR CB C 16.387 0.118 3.182 1.00 . A A . 24 TYR CB 1 1 27 11678 1 1 24 TYR CD1 C 17.474 -0.374 5.402 1.00 . A A . 24 TYR CD1 1 1 27 11679 1 1 24 TYR CD2 C 15.606 1.171 5.335 1.00 . A A . 24 TYR CD2 1 1 27 11680 1 1 24 TYR CE1 C 17.572 -0.196 6.787 1.00 . A A . 24 TYR CE1 1 1 27 11681 1 1 24 TYR CE2 C 15.704 1.349 6.719 1.00 . A A . 24 TYR CE2 1 1 27 11682 1 1 24 TYR CG C 16.491 0.310 4.677 1.00 . A A . 24 TYR CG 1 1 27 11683 1 1 24 TYR CZ C 16.687 0.665 7.446 1.00 . A A . 24 TYR CZ 1 1 27 11684 1 1 24 TYR H H 16.617 1.279 0.496 1.00 . A A . 24 TYR H 1 1 27 11685 1 1 24 TYR HA H 17.817 1.728 3.170 1.00 . A A . 24 TYR HA 1 1 27 11686 1 1 24 TYR HB2 H 15.397 0.392 2.852 1.00 . A A . 24 TYR HB2 1 1 27 11687 1 1 24 TYR HB3 H 16.573 -0.918 2.939 1.00 . A A . 24 TYR HB3 1 1 27 11688 1 1 24 TYR HD1 H 18.157 -1.038 4.893 1.00 . A A . 24 TYR HD1 1 1 27 11689 1 1 24 TYR HD2 H 14.849 1.699 4.775 1.00 . A A . 24 TYR HD2 1 1 27 11690 1 1 24 TYR HE1 H 18.329 -0.724 7.347 1.00 . A A . 24 TYR HE1 1 1 27 11691 1 1 24 TYR HE2 H 15.022 2.014 7.228 1.00 . A A . 24 TYR HE2 1 1 27 11692 1 1 24 TYR HH H 16.227 0.183 9.235 1.00 . A A . 24 TYR HH 1 1 27 11693 1 1 24 TYR N N 16.658 1.685 1.386 1.00 . A A . 24 TYR N 1 1 27 11694 1 1 24 TYR O O 18.703 -1.012 2.201 1.00 . A A . 24 TYR O 1 1 27 11695 1 1 24 TYR OH O 16.783 0.841 8.811 1.00 . A A . 24 TYR OH 1 1 27 11696 1 1 25 LYS C C 21.777 0.763 0.494 1.00 . A A . 25 LYS C 1 1 27 11697 1 1 25 LYS CA C 20.467 -0.031 0.390 1.00 . A A . 25 LYS CA 1 1 27 11698 1 1 25 LYS CB C 20.060 -0.213 -1.075 1.00 . A A . 25 LYS CB 1 1 27 11699 1 1 25 LYS CD C 22.115 -0.910 -2.329 1.00 . A A . 25 LYS CD 1 1 27 11700 1 1 25 LYS CE C 23.270 -1.844 -1.944 1.00 . A A . 25 LYS CE 1 1 27 11701 1 1 25 LYS CG C 20.817 -1.401 -1.678 1.00 . A A . 25 LYS CG 1 1 27 11702 1 1 25 LYS H H 19.198 1.670 0.774 1.00 . A A . 25 LYS H 1 1 27 11703 1 1 25 LYS HA H 20.575 -0.995 0.862 1.00 . A A . 25 LYS HA 1 1 27 11704 1 1 25 LYS HB2 H 18.996 -0.396 -1.133 1.00 . A A . 25 LYS HB2 1 1 27 11705 1 1 25 LYS HB3 H 20.300 0.683 -1.630 1.00 . A A . 25 LYS HB3 1 1 27 11706 1 1 25 LYS HD2 H 21.997 -0.907 -3.403 1.00 . A A . 25 LYS HD2 1 1 27 11707 1 1 25 LYS HD3 H 22.333 0.091 -1.988 1.00 . A A . 25 LYS HD3 1 1 27 11708 1 1 25 LYS HE2 H 22.908 -2.650 -1.321 1.00 . A A . 25 LYS HE2 1 1 27 11709 1 1 25 LYS HE3 H 23.745 -2.236 -2.829 1.00 . A A . 25 LYS HE3 1 1 27 11710 1 1 25 LYS HG2 H 21.049 -2.111 -0.897 1.00 . A A . 25 LYS HG2 1 1 27 11711 1 1 25 LYS HG3 H 20.200 -1.877 -2.425 1.00 . A A . 25 LYS HG3 1 1 27 11712 1 1 25 LYS HZ1 H 23.750 -0.575 -0.358 1.00 . A A . 25 LYS HZ1 1 1 27 11713 1 1 25 LYS HZ2 H 24.579 -0.226 -1.802 1.00 . A A . 25 LYS HZ2 1 1 27 11714 1 1 25 LYS HZ3 H 25.029 -1.567 -0.865 1.00 . A A . 25 LYS HZ3 1 1 27 11715 1 1 25 LYS N N 19.343 0.732 1.014 1.00 . A A . 25 LYS N 1 1 27 11716 1 1 25 LYS NZ N 24.229 -0.989 -1.186 1.00 . A A . 25 LYS NZ 1 1 27 11717 1 1 25 LYS O O 21.778 1.927 0.127 1.00 . A A . 25 LYS O 1 1 27 11718 1 1 25 LYS OXT O 22.758 0.187 0.936 1.00 . A A . 25 LYS OXT 1 1 28 11719 1 1 1 HIS C C -20.037 -0.575 0.999 1.00 . A A . 1 HIS C 1 1 28 11720 1 1 1 HIS CA C -20.132 0.913 1.368 1.00 . A A . 1 HIS CA 1 1 28 11721 1 1 1 HIS CB C -20.815 1.711 0.250 1.00 . A A . 1 HIS CB 1 1 28 11722 1 1 1 HIS CD2 C -22.918 0.336 -0.521 1.00 . A A . 1 HIS CD2 1 1 28 11723 1 1 1 HIS CE1 C -24.430 1.425 0.585 1.00 . A A . 1 HIS CE1 1 1 28 11724 1 1 1 HIS CG C -22.268 1.329 0.171 1.00 . A A . 1 HIS CG 1 1 28 11725 1 1 1 HIS HA H -20.679 1.035 2.290 1.00 . A A . 1 HIS HA 1 1 28 11726 1 1 1 HIS HB2 H -20.732 2.768 0.459 1.00 . A A . 1 HIS HB2 1 1 28 11727 1 1 1 HIS HB3 H -20.334 1.493 -0.693 1.00 . A A . 1 HIS HB3 1 1 28 11728 1 1 1 HIS HD1 H -23.116 2.780 1.462 1.00 . A A . 1 HIS HD1 1 1 28 11729 1 1 1 HIS HD2 H -22.444 -0.383 -1.170 1.00 . A A . 1 HIS HD2 1 1 28 11730 1 1 1 HIS HE1 H -25.379 1.745 0.989 1.00 . A A . 1 HIS HE1 1 1 28 11731 1 1 1 HIS N N -18.766 1.506 1.497 1.00 . A A . 1 HIS N 1 1 28 11732 1 1 1 HIS ND1 N -23.253 2.011 0.870 1.00 . A A . 1 HIS ND1 1 1 28 11733 1 1 1 HIS NE2 N -24.284 0.399 -0.258 1.00 . A A . 1 HIS NE2 1 1 28 11734 1 1 1 HIS O O -20.527 -1.427 1.715 1.00 . A A . 1 HIS O 1 1 28 11735 1 1 2 ALA C C -17.869 -2.841 -0.225 1.00 . A A . 2 ALA C 1 1 28 11736 1 1 2 ALA CA C -19.284 -2.326 -0.520 1.00 . A A . 2 ALA CA 1 1 28 11737 1 1 2 ALA CB C -19.562 -2.331 -2.024 1.00 . A A . 2 ALA CB 1 1 28 11738 1 1 2 ALA H H -19.020 -0.189 -0.670 1.00 . A A . 2 ALA H 1 1 28 11739 1 1 2 ALA HA H -20.018 -2.930 -0.009 1.00 . A A . 2 ALA HA 1 1 28 11740 1 1 2 ALA HB1 H -18.804 -1.753 -2.531 1.00 . A A . 2 ALA HB1 1 1 28 11741 1 1 2 ALA HB2 H -20.533 -1.898 -2.211 1.00 . A A . 2 ALA HB2 1 1 28 11742 1 1 2 ALA HB3 H -19.543 -3.348 -2.389 1.00 . A A . 2 ALA HB3 1 1 28 11743 1 1 2 ALA N N -19.409 -0.893 -0.109 1.00 . A A . 2 ALA N 1 1 28 11744 1 1 2 ALA O O -17.191 -3.356 -1.096 1.00 . A A . 2 ALA O 1 1 28 11745 1 1 3 TRP C C -14.987 -2.545 0.468 1.00 . A A . 3 TRP C 1 1 28 11746 1 1 3 TRP CA C -16.054 -3.166 1.387 1.00 . A A . 3 TRP CA 1 1 28 11747 1 1 3 TRP CB C -16.090 -4.692 1.234 1.00 . A A . 3 TRP CB 1 1 28 11748 1 1 3 TRP CD1 C -15.641 -5.582 3.558 1.00 . A A . 3 TRP CD1 1 1 28 11749 1 1 3 TRP CD2 C -13.857 -5.776 2.200 1.00 . A A . 3 TRP CD2 1 1 28 11750 1 1 3 TRP CE2 C -13.472 -6.304 3.455 1.00 . A A . 3 TRP CE2 1 1 28 11751 1 1 3 TRP CE3 C -12.911 -5.779 1.161 1.00 . A A . 3 TRP CE3 1 1 28 11752 1 1 3 TRP CG C -15.239 -5.323 2.292 1.00 . A A . 3 TRP CG 1 1 28 11753 1 1 3 TRP CH2 C -11.264 -6.812 2.626 1.00 . A A . 3 TRP CH2 1 1 28 11754 1 1 3 TRP CZ2 C -12.193 -6.817 3.670 1.00 . A A . 3 TRP CZ2 1 1 28 11755 1 1 3 TRP CZ3 C -11.622 -6.294 1.374 1.00 . A A . 3 TRP CZ3 1 1 28 11756 1 1 3 TRP H H -18.000 -2.278 1.675 1.00 . A A . 3 TRP H 1 1 28 11757 1 1 3 TRP HA H -15.851 -2.908 2.415 1.00 . A A . 3 TRP HA 1 1 28 11758 1 1 3 TRP HB2 H -17.106 -5.041 1.335 1.00 . A A . 3 TRP HB2 1 1 28 11759 1 1 3 TRP HB3 H -15.712 -4.966 0.259 1.00 . A A . 3 TRP HB3 1 1 28 11760 1 1 3 TRP HD1 H -16.620 -5.370 3.964 1.00 . A A . 3 TRP HD1 1 1 28 11761 1 1 3 TRP HE1 H -14.622 -6.449 5.186 1.00 . A A . 3 TRP HE1 1 1 28 11762 1 1 3 TRP HE3 H -13.177 -5.382 0.193 1.00 . A A . 3 TRP HE3 1 1 28 11763 1 1 3 TRP HH2 H -10.272 -7.207 2.784 1.00 . A A . 3 TRP HH2 1 1 28 11764 1 1 3 TRP HZ2 H -11.921 -7.215 4.637 1.00 . A A . 3 TRP HZ2 1 1 28 11765 1 1 3 TRP HZ3 H -10.903 -6.292 0.569 1.00 . A A . 3 TRP HZ3 1 1 28 11766 1 1 3 TRP N N -17.426 -2.698 1.002 1.00 . A A . 3 TRP N 1 1 28 11767 1 1 3 TRP NE1 N -14.593 -6.164 4.248 1.00 . A A . 3 TRP NE1 1 1 28 11768 1 1 3 TRP O O -14.005 -3.178 0.128 1.00 . A A . 3 TRP O 1 1 28 11769 1 1 4 TYR C C -13.227 0.263 -0.014 1.00 . A A . 4 TYR C 1 1 28 11770 1 1 4 TYR CA C -14.163 -0.651 -0.823 1.00 . A A . 4 TYR CA 1 1 28 11771 1 1 4 TYR CB C -14.987 0.165 -1.824 1.00 . A A . 4 TYR CB 1 1 28 11772 1 1 4 TYR CD1 C -14.591 -1.046 -3.999 1.00 . A A . 4 TYR CD1 1 1 28 11773 1 1 4 TYR CD2 C -13.520 1.101 -3.649 1.00 . A A . 4 TYR CD2 1 1 28 11774 1 1 4 TYR CE1 C -14.002 -1.134 -5.265 1.00 . A A . 4 TYR CE1 1 1 28 11775 1 1 4 TYR CE2 C -12.931 1.013 -4.916 1.00 . A A . 4 TYR CE2 1 1 28 11776 1 1 4 TYR CG C -14.351 0.071 -3.191 1.00 . A A . 4 TYR CG 1 1 28 11777 1 1 4 TYR CZ C -13.171 -0.104 -5.723 1.00 . A A . 4 TYR CZ 1 1 28 11778 1 1 4 TYR H H -15.963 -0.811 0.358 1.00 . A A . 4 TYR H 1 1 28 11779 1 1 4 TYR HA H -13.589 -1.397 -1.348 1.00 . A A . 4 TYR HA 1 1 28 11780 1 1 4 TYR HB2 H -15.993 -0.227 -1.867 1.00 . A A . 4 TYR HB2 1 1 28 11781 1 1 4 TYR HB3 H -15.016 1.198 -1.511 1.00 . A A . 4 TYR HB3 1 1 28 11782 1 1 4 TYR HD1 H -15.232 -1.840 -3.646 1.00 . A A . 4 TYR HD1 1 1 28 11783 1 1 4 TYR HD2 H -13.333 1.963 -3.026 1.00 . A A . 4 TYR HD2 1 1 28 11784 1 1 4 TYR HE1 H -14.187 -1.996 -5.889 1.00 . A A . 4 TYR HE1 1 1 28 11785 1 1 4 TYR HE2 H -12.290 1.807 -5.268 1.00 . A A . 4 TYR HE2 1 1 28 11786 1 1 4 TYR HH H -11.752 -0.647 -6.879 1.00 . A A . 4 TYR HH 1 1 28 11787 1 1 4 TYR N N -15.169 -1.308 0.069 1.00 . A A . 4 TYR N 1 1 28 11788 1 1 4 TYR O O -12.607 1.161 -0.556 1.00 . A A . 4 TYR O 1 1 28 11789 1 1 4 TYR OH O -12.591 -0.190 -6.972 1.00 . A A . 4 TYR OH 1 1 28 11790 1 1 5 SER C C -10.986 0.064 2.585 1.00 . A A . 5 SER C 1 1 28 11791 1 1 5 SER CA C -12.201 0.882 2.110 1.00 . A A . 5 SER CA 1 1 28 11792 1 1 5 SER CB C -13.053 1.328 3.302 1.00 . A A . 5 SER CB 1 1 28 11793 1 1 5 SER H H -13.606 -0.698 1.689 1.00 . A A . 5 SER H 1 1 28 11794 1 1 5 SER HA H -11.872 1.742 1.552 1.00 . A A . 5 SER HA 1 1 28 11795 1 1 5 SER HB2 H -12.418 1.750 4.063 1.00 . A A . 5 SER HB2 1 1 28 11796 1 1 5 SER HB3 H -13.762 2.077 2.975 1.00 . A A . 5 SER HB3 1 1 28 11797 1 1 5 SER HG H -13.147 -0.258 4.433 1.00 . A A . 5 SER HG 1 1 28 11798 1 1 5 SER N N -13.108 0.035 1.273 1.00 . A A . 5 SER N 1 1 28 11799 1 1 5 SER O O -10.173 0.540 3.356 1.00 . A A . 5 SER O 1 1 28 11800 1 1 5 SER OG O -13.745 0.206 3.842 1.00 . A A . 5 SER OG 1 1 28 11801 1 1 6 HIS C C -8.719 -2.164 1.384 1.00 . A A . 6 HIS C 1 1 28 11802 1 1 6 HIS CA C -9.702 -2.012 2.545 1.00 . A A . 6 HIS CA 1 1 28 11803 1 1 6 HIS CB C -10.303 -3.374 2.923 1.00 . A A . 6 HIS CB 1 1 28 11804 1 1 6 HIS CD2 C -11.542 -3.034 5.219 1.00 . A A . 6 HIS CD2 1 1 28 11805 1 1 6 HIS CE1 C -13.574 -2.952 4.473 1.00 . A A . 6 HIS CE1 1 1 28 11806 1 1 6 HIS CG C -11.471 -3.184 3.857 1.00 . A A . 6 HIS CG 1 1 28 11807 1 1 6 HIS H H -11.525 -1.520 1.506 1.00 . A A . 6 HIS H 1 1 28 11808 1 1 6 HIS HA H -9.205 -1.578 3.394 1.00 . A A . 6 HIS HA 1 1 28 11809 1 1 6 HIS HB2 H -10.639 -3.877 2.028 1.00 . A A . 6 HIS HB2 1 1 28 11810 1 1 6 HIS HB3 H -9.549 -3.974 3.409 1.00 . A A . 6 HIS HB3 1 1 28 11811 1 1 6 HIS HD1 H -13.073 -3.209 2.470 1.00 . A A . 6 HIS HD1 1 1 28 11812 1 1 6 HIS HD2 H -10.695 -3.029 5.890 1.00 . A A . 6 HIS HD2 1 1 28 11813 1 1 6 HIS HE1 H -14.650 -2.873 4.423 1.00 . A A . 6 HIS HE1 1 1 28 11814 1 1 6 HIS N N -10.859 -1.160 2.127 1.00 . A A . 6 HIS N 1 1 28 11815 1 1 6 HIS ND1 N -12.780 -3.129 3.402 1.00 . A A . 6 HIS ND1 1 1 28 11816 1 1 6 HIS NE2 N -12.870 -2.887 5.606 1.00 . A A . 6 HIS NE2 1 1 28 11817 1 1 6 HIS O O -7.518 -2.187 1.578 1.00 . A A . 6 HIS O 1 1 28 11818 1 1 7 TYR C C -7.381 -1.202 -1.096 1.00 . A A . 7 TYR C 1 1 28 11819 1 1 7 TYR CA C -8.322 -2.406 -1.011 1.00 . A A . 7 TYR CA 1 1 28 11820 1 1 7 TYR CB C -9.247 -2.446 -2.235 1.00 . A A . 7 TYR CB 1 1 28 11821 1 1 7 TYR CD1 C -9.603 -4.945 -2.117 1.00 . A A . 7 TYR CD1 1 1 28 11822 1 1 7 TYR CD2 C -11.542 -3.491 -2.178 1.00 . A A . 7 TYR CD2 1 1 28 11823 1 1 7 TYR CE1 C -10.443 -6.062 -2.065 1.00 . A A . 7 TYR CE1 1 1 28 11824 1 1 7 TYR CE2 C -12.381 -4.609 -2.125 1.00 . A A . 7 TYR CE2 1 1 28 11825 1 1 7 TYR CG C -10.151 -3.657 -2.173 1.00 . A A . 7 TYR CG 1 1 28 11826 1 1 7 TYR CZ C -11.832 -5.895 -2.069 1.00 . A A . 7 TYR CZ 1 1 28 11827 1 1 7 TYR H H -10.191 -2.236 0.055 1.00 . A A . 7 TYR H 1 1 28 11828 1 1 7 TYR HA H -7.754 -3.315 -0.943 1.00 . A A . 7 TYR HA 1 1 28 11829 1 1 7 TYR HB2 H -9.851 -1.551 -2.255 1.00 . A A . 7 TYR HB2 1 1 28 11830 1 1 7 TYR HB3 H -8.649 -2.492 -3.132 1.00 . A A . 7 TYR HB3 1 1 28 11831 1 1 7 TYR HD1 H -8.529 -5.074 -2.114 1.00 . A A . 7 TYR HD1 1 1 28 11832 1 1 7 TYR HD2 H -11.966 -2.499 -2.221 1.00 . A A . 7 TYR HD2 1 1 28 11833 1 1 7 TYR HE1 H -10.018 -7.055 -2.023 1.00 . A A . 7 TYR HE1 1 1 28 11834 1 1 7 TYR HE2 H -13.454 -4.479 -2.128 1.00 . A A . 7 TYR HE2 1 1 28 11835 1 1 7 TYR HH H -12.768 -7.245 -1.097 1.00 . A A . 7 TYR HH 1 1 28 11836 1 1 7 TYR N N -9.221 -2.263 0.177 1.00 . A A . 7 TYR N 1 1 28 11837 1 1 7 TYR O O -6.192 -1.347 -1.306 1.00 . A A . 7 TYR O 1 1 28 11838 1 1 7 TYR OH O -12.660 -6.997 -2.018 1.00 . A A . 7 TYR OH 1 1 28 11839 1 1 8 VAL C C -5.983 1.146 0.129 1.00 . A A . 8 VAL C 1 1 28 11840 1 1 8 VAL CA C -7.057 1.209 -0.969 1.00 . A A . 8 VAL CA 1 1 28 11841 1 1 8 VAL CB C -8.020 2.388 -0.747 1.00 . A A . 8 VAL CB 1 1 28 11842 1 1 8 VAL CG1 C -8.612 2.335 0.666 1.00 . A A . 8 VAL CG1 1 1 28 11843 1 1 8 VAL CG2 C -7.263 3.708 -0.927 1.00 . A A . 8 VAL CG2 1 1 28 11844 1 1 8 VAL H H -8.871 0.058 -0.741 1.00 . A A . 8 VAL H 1 1 28 11845 1 1 8 VAL HA H -6.590 1.293 -1.934 1.00 . A A . 8 VAL HA 1 1 28 11846 1 1 8 VAL HB H -8.821 2.334 -1.469 1.00 . A A . 8 VAL HB 1 1 28 11847 1 1 8 VAL HG11 H -8.947 1.331 0.880 1.00 . A A . 8 VAL HG11 1 1 28 11848 1 1 8 VAL HG12 H -9.449 3.015 0.731 1.00 . A A . 8 VAL HG12 1 1 28 11849 1 1 8 VAL HG13 H -7.859 2.624 1.385 1.00 . A A . 8 VAL HG13 1 1 28 11850 1 1 8 VAL HG21 H -6.484 3.781 -0.183 1.00 . A A . 8 VAL HG21 1 1 28 11851 1 1 8 VAL HG22 H -7.948 4.535 -0.814 1.00 . A A . 8 VAL HG22 1 1 28 11852 1 1 8 VAL HG23 H -6.822 3.738 -1.913 1.00 . A A . 8 VAL HG23 1 1 28 11853 1 1 8 VAL N N -7.911 -0.020 -0.918 1.00 . A A . 8 VAL N 1 1 28 11854 1 1 8 VAL O O -4.885 1.644 -0.035 1.00 . A A . 8 VAL O 1 1 28 11855 1 1 9 LEU C C -4.212 -0.617 1.962 1.00 . A A . 9 LEU C 1 1 28 11856 1 1 9 LEU CA C -5.294 0.400 2.343 1.00 . A A . 9 LEU CA 1 1 28 11857 1 1 9 LEU CB C -6.091 -0.086 3.557 1.00 . A A . 9 LEU CB 1 1 28 11858 1 1 9 LEU CD1 C -5.751 1.887 5.054 1.00 . A A . 9 LEU CD1 1 1 28 11859 1 1 9 LEU CD2 C -5.931 -0.405 6.031 1.00 . A A . 9 LEU CD2 1 1 28 11860 1 1 9 LEU CG C -5.419 0.409 4.839 1.00 . A A . 9 LEU CG 1 1 28 11861 1 1 9 LEU H H -7.179 0.113 1.336 1.00 . A A . 9 LEU H 1 1 28 11862 1 1 9 LEU HA H -4.850 1.361 2.553 1.00 . A A . 9 LEU HA 1 1 28 11863 1 1 9 LEU HB2 H -7.099 0.301 3.506 1.00 . A A . 9 LEU HB2 1 1 28 11864 1 1 9 LEU HB3 H -6.120 -1.166 3.561 1.00 . A A . 9 LEU HB3 1 1 28 11865 1 1 9 LEU HD11 H -6.822 2.024 5.025 1.00 . A A . 9 LEU HD11 1 1 28 11866 1 1 9 LEU HD12 H -5.292 2.476 4.273 1.00 . A A . 9 LEU HD12 1 1 28 11867 1 1 9 LEU HD13 H -5.373 2.206 6.013 1.00 . A A . 9 LEU HD13 1 1 28 11868 1 1 9 LEU HD21 H -7.010 -0.364 6.058 1.00 . A A . 9 LEU HD21 1 1 28 11869 1 1 9 LEU HD22 H -5.531 0.006 6.946 1.00 . A A . 9 LEU HD22 1 1 28 11870 1 1 9 LEU HD23 H -5.612 -1.432 5.929 1.00 . A A . 9 LEU HD23 1 1 28 11871 1 1 9 LEU HG H -4.348 0.289 4.754 1.00 . A A . 9 LEU HG 1 1 28 11872 1 1 9 LEU N N -6.292 0.518 1.238 1.00 . A A . 9 LEU N 1 1 28 11873 1 1 9 LEU O O -3.042 -0.410 2.223 1.00 . A A . 9 LEU O 1 1 28 11874 1 1 10 LYS C C -2.643 -2.141 -0.128 1.00 . A A . 10 LYS C 1 1 28 11875 1 1 10 LYS CA C -3.583 -2.733 0.929 1.00 . A A . 10 LYS CA 1 1 28 11876 1 1 10 LYS CB C -4.394 -3.893 0.344 1.00 . A A . 10 LYS CB 1 1 28 11877 1 1 10 LYS CD C -4.371 -6.339 -0.178 1.00 . A A . 10 LYS CD 1 1 28 11878 1 1 10 LYS CE C -3.416 -7.435 -0.664 1.00 . A A . 10 LYS CE 1 1 28 11879 1 1 10 LYS CG C -3.561 -5.175 0.400 1.00 . A A . 10 LYS CG 1 1 28 11880 1 1 10 LYS H H -5.545 -1.849 1.129 1.00 . A A . 10 LYS H 1 1 28 11881 1 1 10 LYS HA H -3.021 -3.069 1.787 1.00 . A A . 10 LYS HA 1 1 28 11882 1 1 10 LYS HB2 H -5.300 -4.025 0.918 1.00 . A A . 10 LYS HB2 1 1 28 11883 1 1 10 LYS HB3 H -4.646 -3.674 -0.683 1.00 . A A . 10 LYS HB3 1 1 28 11884 1 1 10 LYS HD2 H -5.022 -6.738 0.586 1.00 . A A . 10 LYS HD2 1 1 28 11885 1 1 10 LYS HD3 H -4.964 -5.988 -1.009 1.00 . A A . 10 LYS HD3 1 1 28 11886 1 1 10 LYS HE2 H -3.111 -7.240 -1.683 1.00 . A A . 10 LYS HE2 1 1 28 11887 1 1 10 LYS HE3 H -2.555 -7.497 -0.017 1.00 . A A . 10 LYS HE3 1 1 28 11888 1 1 10 LYS HG2 H -2.657 -5.043 -0.177 1.00 . A A . 10 LYS HG2 1 1 28 11889 1 1 10 LYS HG3 H -3.304 -5.394 1.426 1.00 . A A . 10 LYS HG3 1 1 28 11890 1 1 10 LYS HZ1 H -4.409 -8.925 0.405 1.00 . A A . 10 LYS HZ1 1 1 28 11891 1 1 10 LYS HZ2 H -3.650 -9.475 -1.011 1.00 . A A . 10 LYS HZ2 1 1 28 11892 1 1 10 LYS HZ3 H -5.096 -8.589 -1.110 1.00 . A A . 10 LYS HZ3 1 1 28 11893 1 1 10 LYS N N -4.594 -1.709 1.338 1.00 . A A . 10 LYS N 1 1 28 11894 1 1 10 LYS NZ N -4.203 -8.700 -0.589 1.00 . A A . 10 LYS NZ 1 1 28 11895 1 1 10 LYS O O -1.445 -2.355 -0.093 1.00 . A A . 10 LYS O 1 1 28 11896 1 1 11 PHE C C -1.312 0.196 -1.466 1.00 . A A . 11 PHE C 1 1 28 11897 1 1 11 PHE CA C -2.324 -0.758 -2.115 1.00 . A A . 11 PHE CA 1 1 28 11898 1 1 11 PHE CB C -3.301 0.012 -3.011 1.00 . A A . 11 PHE CB 1 1 28 11899 1 1 11 PHE CD1 C -2.151 -0.230 -5.244 1.00 . A A . 11 PHE CD1 1 1 28 11900 1 1 11 PHE CD2 C -2.286 1.970 -4.234 1.00 . A A . 11 PHE CD2 1 1 28 11901 1 1 11 PHE CE1 C -1.467 0.314 -6.336 1.00 . A A . 11 PHE CE1 1 1 28 11902 1 1 11 PHE CE2 C -1.604 2.515 -5.327 1.00 . A A . 11 PHE CE2 1 1 28 11903 1 1 11 PHE CG C -2.561 0.597 -4.191 1.00 . A A . 11 PHE CG 1 1 28 11904 1 1 11 PHE CZ C -1.193 1.686 -6.379 1.00 . A A . 11 PHE CZ 1 1 28 11905 1 1 11 PHE H H -4.147 -1.221 -1.054 1.00 . A A . 11 PHE H 1 1 28 11906 1 1 11 PHE HA H -1.815 -1.519 -2.687 1.00 . A A . 11 PHE HA 1 1 28 11907 1 1 11 PHE HB2 H -4.069 -0.660 -3.366 1.00 . A A . 11 PHE HB2 1 1 28 11908 1 1 11 PHE HB3 H -3.757 0.808 -2.442 1.00 . A A . 11 PHE HB3 1 1 28 11909 1 1 11 PHE HD1 H -2.362 -1.289 -5.212 1.00 . A A . 11 PHE HD1 1 1 28 11910 1 1 11 PHE HD2 H -2.602 2.608 -3.422 1.00 . A A . 11 PHE HD2 1 1 28 11911 1 1 11 PHE HE1 H -1.151 -0.325 -7.148 1.00 . A A . 11 PHE HE1 1 1 28 11912 1 1 11 PHE HE2 H -1.392 3.574 -5.360 1.00 . A A . 11 PHE HE2 1 1 28 11913 1 1 11 PHE HZ H -0.666 2.107 -7.223 1.00 . A A . 11 PHE HZ 1 1 28 11914 1 1 11 PHE N N -3.179 -1.384 -1.058 1.00 . A A . 11 PHE N 1 1 28 11915 1 1 11 PHE O O -0.147 0.204 -1.813 1.00 . A A . 11 PHE O 1 1 28 11916 1 1 12 PHE C C 0.326 1.146 0.826 1.00 . A A . 12 PHE C 1 1 28 11917 1 1 12 PHE CA C -0.819 1.931 0.175 1.00 . A A . 12 PHE CA 1 1 28 11918 1 1 12 PHE CB C -1.669 2.628 1.245 1.00 . A A . 12 PHE CB 1 1 28 11919 1 1 12 PHE CD1 C -3.016 4.235 -0.159 1.00 . A A . 12 PHE CD1 1 1 28 11920 1 1 12 PHE CD2 C -1.313 5.122 1.322 1.00 . A A . 12 PHE CD2 1 1 28 11921 1 1 12 PHE CE1 C -3.329 5.534 -0.576 1.00 . A A . 12 PHE CE1 1 1 28 11922 1 1 12 PHE CE2 C -1.626 6.420 0.904 1.00 . A A . 12 PHE CE2 1 1 28 11923 1 1 12 PHE CG C -2.007 4.029 0.791 1.00 . A A . 12 PHE CG 1 1 28 11924 1 1 12 PHE CZ C -2.634 6.626 -0.045 1.00 . A A . 12 PHE CZ 1 1 28 11925 1 1 12 PHE H H -2.696 0.950 -0.249 1.00 . A A . 12 PHE H 1 1 28 11926 1 1 12 PHE HA H -0.431 2.657 -0.523 1.00 . A A . 12 PHE HA 1 1 28 11927 1 1 12 PHE HB2 H -2.581 2.071 1.401 1.00 . A A . 12 PHE HB2 1 1 28 11928 1 1 12 PHE HB3 H -1.114 2.675 2.170 1.00 . A A . 12 PHE HB3 1 1 28 11929 1 1 12 PHE HD1 H -3.553 3.392 -0.569 1.00 . A A . 12 PHE HD1 1 1 28 11930 1 1 12 PHE HD2 H -0.535 4.964 2.054 1.00 . A A . 12 PHE HD2 1 1 28 11931 1 1 12 PHE HE1 H -4.108 5.693 -1.308 1.00 . A A . 12 PHE HE1 1 1 28 11932 1 1 12 PHE HE2 H -1.090 7.264 1.313 1.00 . A A . 12 PHE HE2 1 1 28 11933 1 1 12 PHE HZ H -2.875 7.628 -0.368 1.00 . A A . 12 PHE HZ 1 1 28 11934 1 1 12 PHE N N -1.753 0.987 -0.515 1.00 . A A . 12 PHE N 1 1 28 11935 1 1 12 PHE O O 1.472 1.544 0.771 1.00 . A A . 12 PHE O 1 1 28 11936 1 1 13 LEU C C 1.950 -1.485 1.010 1.00 . A A . 13 LEU C 1 1 28 11937 1 1 13 LEU CA C 1.079 -0.804 2.078 1.00 . A A . 13 LEU CA 1 1 28 11938 1 1 13 LEU CB C 0.318 -1.850 2.899 1.00 . A A . 13 LEU CB 1 1 28 11939 1 1 13 LEU CD1 C 0.385 -2.622 5.277 1.00 . A A . 13 LEU CD1 1 1 28 11940 1 1 13 LEU CD2 C 1.847 -3.712 3.570 1.00 . A A . 13 LEU CD2 1 1 28 11941 1 1 13 LEU CG C 1.219 -2.389 4.015 1.00 . A A . 13 LEU CG 1 1 28 11942 1 1 13 LEU H H -0.918 -0.277 1.452 1.00 . A A . 13 LEU H 1 1 28 11943 1 1 13 LEU HA H 1.687 -0.195 2.727 1.00 . A A . 13 LEU HA 1 1 28 11944 1 1 13 LEU HB2 H -0.561 -1.395 3.335 1.00 . A A . 13 LEU HB2 1 1 28 11945 1 1 13 LEU HB3 H 0.019 -2.665 2.256 1.00 . A A . 13 LEU HB3 1 1 28 11946 1 1 13 LEU HD11 H -0.042 -1.686 5.605 1.00 . A A . 13 LEU HD11 1 1 28 11947 1 1 13 LEU HD12 H 1.017 -3.022 6.057 1.00 . A A . 13 LEU HD12 1 1 28 11948 1 1 13 LEU HD13 H -0.407 -3.323 5.062 1.00 . A A . 13 LEU HD13 1 1 28 11949 1 1 13 LEU HD21 H 2.789 -3.853 4.078 1.00 . A A . 13 LEU HD21 1 1 28 11950 1 1 13 LEU HD22 H 2.014 -3.692 2.502 1.00 . A A . 13 LEU HD22 1 1 28 11951 1 1 13 LEU HD23 H 1.181 -4.527 3.813 1.00 . A A . 13 LEU HD23 1 1 28 11952 1 1 13 LEU HG H 1.998 -1.671 4.228 1.00 . A A . 13 LEU HG 1 1 28 11953 1 1 13 LEU N N 0.016 0.025 1.431 1.00 . A A . 13 LEU N 1 1 28 11954 1 1 13 LEU O O 3.142 -1.645 1.187 1.00 . A A . 13 LEU O 1 1 28 11955 1 1 14 LEU C C 2.960 -1.520 -1.986 1.00 . A A . 14 LEU C 1 1 28 11956 1 1 14 LEU CA C 2.158 -2.549 -1.175 1.00 . A A . 14 LEU CA 1 1 28 11957 1 1 14 LEU CB C 1.126 -3.249 -2.065 1.00 . A A . 14 LEU CB 1 1 28 11958 1 1 14 LEU CD1 C 1.758 -5.653 -1.769 1.00 . A A . 14 LEU CD1 1 1 28 11959 1 1 14 LEU CD2 C 0.979 -4.831 -3.995 1.00 . A A . 14 LEU CD2 1 1 28 11960 1 1 14 LEU CG C 1.769 -4.467 -2.736 1.00 . A A . 14 LEU CG 1 1 28 11961 1 1 14 LEU H H 0.399 -1.739 -0.216 1.00 . A A . 14 LEU H 1 1 28 11962 1 1 14 LEU HA H 2.822 -3.273 -0.743 1.00 . A A . 14 LEU HA 1 1 28 11963 1 1 14 LEU HB2 H 0.287 -3.569 -1.463 1.00 . A A . 14 LEU HB2 1 1 28 11964 1 1 14 LEU HB3 H 0.782 -2.563 -2.825 1.00 . A A . 14 LEU HB3 1 1 28 11965 1 1 14 LEU HD11 H 0.738 -5.945 -1.569 1.00 . A A . 14 LEU HD11 1 1 28 11966 1 1 14 LEU HD12 H 2.239 -5.368 -0.844 1.00 . A A . 14 LEU HD12 1 1 28 11967 1 1 14 LEU HD13 H 2.291 -6.482 -2.210 1.00 . A A . 14 LEU HD13 1 1 28 11968 1 1 14 LEU HD21 H -0.045 -5.047 -3.729 1.00 . A A . 14 LEU HD21 1 1 28 11969 1 1 14 LEU HD22 H 1.422 -5.701 -4.459 1.00 . A A . 14 LEU HD22 1 1 28 11970 1 1 14 LEU HD23 H 1.004 -4.003 -4.688 1.00 . A A . 14 LEU HD23 1 1 28 11971 1 1 14 LEU HG H 2.789 -4.233 -3.004 1.00 . A A . 14 LEU HG 1 1 28 11972 1 1 14 LEU N N 1.363 -1.881 -0.096 1.00 . A A . 14 LEU N 1 1 28 11973 1 1 14 LEU O O 3.900 -1.867 -2.674 1.00 . A A . 14 LEU O 1 1 28 11974 1 1 15 VAL C C 4.208 1.590 -1.694 1.00 . A A . 15 VAL C 1 1 28 11975 1 1 15 VAL CA C 3.352 0.777 -2.670 1.00 . A A . 15 VAL CA 1 1 28 11976 1 1 15 VAL CB C 2.279 1.651 -3.336 1.00 . A A . 15 VAL CB 1 1 28 11977 1 1 15 VAL CG1 C 2.924 2.909 -3.927 1.00 . A A . 15 VAL CG1 1 1 28 11978 1 1 15 VAL CG2 C 1.600 0.859 -4.458 1.00 . A A . 15 VAL CG2 1 1 28 11979 1 1 15 VAL H H 1.843 -0.010 -1.349 1.00 . A A . 15 VAL H 1 1 28 11980 1 1 15 VAL HA H 3.975 0.319 -3.424 1.00 . A A . 15 VAL HA 1 1 28 11981 1 1 15 VAL HB H 1.542 1.938 -2.599 1.00 . A A . 15 VAL HB 1 1 28 11982 1 1 15 VAL HG11 H 3.876 2.653 -4.369 1.00 . A A . 15 VAL HG11 1 1 28 11983 1 1 15 VAL HG12 H 3.075 3.639 -3.145 1.00 . A A . 15 VAL HG12 1 1 28 11984 1 1 15 VAL HG13 H 2.275 3.323 -4.686 1.00 . A A . 15 VAL HG13 1 1 28 11985 1 1 15 VAL HG21 H 2.121 1.033 -5.388 1.00 . A A . 15 VAL HG21 1 1 28 11986 1 1 15 VAL HG22 H 0.575 1.180 -4.555 1.00 . A A . 15 VAL HG22 1 1 28 11987 1 1 15 VAL HG23 H 1.626 -0.195 -4.223 1.00 . A A . 15 VAL HG23 1 1 28 11988 1 1 15 VAL N N 2.602 -0.267 -1.910 1.00 . A A . 15 VAL N 1 1 28 11989 1 1 15 VAL O O 5.421 1.554 -1.748 1.00 . A A . 15 VAL O 1 1 28 11990 1 1 16 PHE C C 5.075 2.170 1.192 1.00 . A A . 16 PHE C 1 1 28 11991 1 1 16 PHE CA C 4.360 3.105 0.206 1.00 . A A . 16 PHE CA 1 1 28 11992 1 1 16 PHE CB C 3.318 3.963 0.931 1.00 . A A . 16 PHE CB 1 1 28 11993 1 1 16 PHE CD1 C 4.188 6.332 0.893 1.00 . A A . 16 PHE CD1 1 1 28 11994 1 1 16 PHE CD2 C 4.437 5.030 2.923 1.00 . A A . 16 PHE CD2 1 1 28 11995 1 1 16 PHE CE1 C 4.815 7.420 1.512 1.00 . A A . 16 PHE CE1 1 1 28 11996 1 1 16 PHE CE2 C 5.064 6.118 3.544 1.00 . A A . 16 PHE CE2 1 1 28 11997 1 1 16 PHE CG C 3.998 5.137 1.598 1.00 . A A . 16 PHE CG 1 1 28 11998 1 1 16 PHE CZ C 5.253 7.312 2.838 1.00 . A A . 16 PHE CZ 1 1 28 11999 1 1 16 PHE H H 2.604 2.299 -0.755 1.00 . A A . 16 PHE H 1 1 28 12000 1 1 16 PHE HA H 5.074 3.737 -0.298 1.00 . A A . 16 PHE HA 1 1 28 12001 1 1 16 PHE HB2 H 2.592 4.327 0.218 1.00 . A A . 16 PHE HB2 1 1 28 12002 1 1 16 PHE HB3 H 2.819 3.367 1.680 1.00 . A A . 16 PHE HB3 1 1 28 12003 1 1 16 PHE HD1 H 3.850 6.416 -0.130 1.00 . A A . 16 PHE HD1 1 1 28 12004 1 1 16 PHE HD2 H 4.292 4.108 3.467 1.00 . A A . 16 PHE HD2 1 1 28 12005 1 1 16 PHE HE1 H 4.962 8.341 0.969 1.00 . A A . 16 PHE HE1 1 1 28 12006 1 1 16 PHE HE2 H 5.401 6.035 4.566 1.00 . A A . 16 PHE HE2 1 1 28 12007 1 1 16 PHE HZ H 5.737 8.151 3.316 1.00 . A A . 16 PHE HZ 1 1 28 12008 1 1 16 PHE N N 3.584 2.303 -0.789 1.00 . A A . 16 PHE N 1 1 28 12009 1 1 16 PHE O O 6.179 2.445 1.620 1.00 . A A . 16 PHE O 1 1 28 12010 1 1 17 GLY C C 6.326 -0.520 1.824 1.00 . A A . 17 GLY C 1 1 28 12011 1 1 17 GLY CA C 5.110 0.115 2.498 1.00 . A A . 17 GLY CA 1 1 28 12012 1 1 17 GLY H H 3.570 0.857 1.184 1.00 . A A . 17 GLY H 1 1 28 12013 1 1 17 GLY HA2 H 5.426 0.650 3.383 1.00 . A A . 17 GLY HA2 1 1 28 12014 1 1 17 GLY HA3 H 4.411 -0.658 2.774 1.00 . A A . 17 GLY HA3 1 1 28 12015 1 1 17 GLY N N 4.459 1.065 1.548 1.00 . A A . 17 GLY N 1 1 28 12016 1 1 17 GLY O O 7.392 -0.592 2.402 1.00 . A A . 17 GLY O 1 1 28 12017 1 1 18 GLU C C 8.447 -0.573 -0.337 1.00 . A A . 18 GLU C 1 1 28 12018 1 1 18 GLU CA C 7.332 -1.599 -0.114 1.00 . A A . 18 GLU CA 1 1 28 12019 1 1 18 GLU CB C 6.771 -2.087 -1.451 1.00 . A A . 18 GLU CB 1 1 28 12020 1 1 18 GLU CD C 6.930 -4.530 -0.922 1.00 . A A . 18 GLU CD 1 1 28 12021 1 1 18 GLU CG C 5.973 -3.377 -1.231 1.00 . A A . 18 GLU CG 1 1 28 12022 1 1 18 GLU H H 5.306 -0.899 0.155 1.00 . A A . 18 GLU H 1 1 28 12023 1 1 18 GLU HA H 7.708 -2.432 0.450 1.00 . A A . 18 GLU HA 1 1 28 12024 1 1 18 GLU HB2 H 6.123 -1.328 -1.869 1.00 . A A . 18 GLU HB2 1 1 28 12025 1 1 18 GLU HB3 H 7.585 -2.282 -2.134 1.00 . A A . 18 GLU HB3 1 1 28 12026 1 1 18 GLU HG2 H 5.293 -3.241 -0.401 1.00 . A A . 18 GLU HG2 1 1 28 12027 1 1 18 GLU HG3 H 5.411 -3.609 -2.123 1.00 . A A . 18 GLU HG3 1 1 28 12028 1 1 18 GLU N N 6.177 -0.974 0.603 1.00 . A A . 18 GLU N 1 1 28 12029 1 1 18 GLU O O 9.611 -0.919 -0.400 1.00 . A A . 18 GLU O 1 1 28 12030 1 1 18 GLU OE1 O 7.243 -4.718 0.243 1.00 . A A . 18 GLU OE1 1 1 28 12031 1 1 18 GLU OE2 O 7.332 -5.206 -1.856 1.00 . A A . 18 GLU OE2 1 1 28 12032 1 1 19 ASN C C 10.069 1.814 0.590 1.00 . A A . 19 ASN C 1 1 28 12033 1 1 19 ASN CA C 9.159 1.731 -0.645 1.00 . A A . 19 ASN CA 1 1 28 12034 1 1 19 ASN CB C 8.399 3.044 -0.848 1.00 . A A . 19 ASN CB 1 1 28 12035 1 1 19 ASN CG C 8.321 3.360 -2.344 1.00 . A A . 19 ASN CG 1 1 28 12036 1 1 19 ASN H H 7.165 0.942 -0.381 1.00 . A A . 19 ASN H 1 1 28 12037 1 1 19 ASN HA H 9.743 1.505 -1.519 1.00 . A A . 19 ASN HA 1 1 28 12038 1 1 19 ASN HB2 H 7.401 2.951 -0.446 1.00 . A A . 19 ASN HB2 1 1 28 12039 1 1 19 ASN HB3 H 8.918 3.844 -0.341 1.00 . A A . 19 ASN HB3 1 1 28 12040 1 1 19 ASN HD21 H 6.776 2.152 -2.667 1.00 . A A . 19 ASN HD21 1 1 28 12041 1 1 19 ASN HD22 H 7.351 2.978 -4.033 1.00 . A A . 19 ASN HD22 1 1 28 12042 1 1 19 ASN N N 8.107 0.686 -0.444 1.00 . A A . 19 ASN N 1 1 28 12043 1 1 19 ASN ND2 N 7.407 2.783 -3.076 1.00 . A A . 19 ASN ND2 1 1 28 12044 1 1 19 ASN O O 11.205 2.238 0.503 1.00 . A A . 19 ASN O 1 1 28 12045 1 1 19 ASN OD1 O 9.100 4.141 -2.852 1.00 . A A . 19 ASN OD1 1 1 28 12046 1 1 20 GLY C C 10.777 0.036 3.422 1.00 . A A . 20 GLY C 1 1 28 12047 1 1 20 GLY CA C 10.403 1.458 2.977 1.00 . A A . 20 GLY CA 1 1 28 12048 1 1 20 GLY H H 8.657 1.072 1.774 1.00 . A A . 20 GLY H 1 1 28 12049 1 1 20 GLY HA2 H 11.304 2.022 2.785 1.00 . A A . 20 GLY HA2 1 1 28 12050 1 1 20 GLY HA3 H 9.841 1.939 3.762 1.00 . A A . 20 GLY HA3 1 1 28 12051 1 1 20 GLY N N 9.575 1.410 1.734 1.00 . A A . 20 GLY N 1 1 28 12052 1 1 20 GLY O O 11.822 -0.178 4.008 1.00 . A A . 20 GLY O 1 1 28 12053 1 1 21 VAL C C 11.003 -3.104 2.501 1.00 . A A . 21 VAL C 1 1 28 12054 1 1 21 VAL CA C 10.239 -2.340 3.595 1.00 . A A . 21 VAL CA 1 1 28 12055 1 1 21 VAL CB C 8.874 -2.993 3.854 1.00 . A A . 21 VAL CB 1 1 28 12056 1 1 21 VAL CG1 C 9.072 -4.444 4.300 1.00 . A A . 21 VAL CG1 1 1 28 12057 1 1 21 VAL CG2 C 8.135 -2.226 4.954 1.00 . A A . 21 VAL CG2 1 1 28 12058 1 1 21 VAL H H 9.084 -0.743 2.702 1.00 . A A . 21 VAL H 1 1 28 12059 1 1 21 VAL HA H 10.813 -2.329 4.504 1.00 . A A . 21 VAL HA 1 1 28 12060 1 1 21 VAL HB H 8.290 -2.975 2.944 1.00 . A A . 21 VAL HB 1 1 28 12061 1 1 21 VAL HG11 H 9.839 -4.486 5.061 1.00 . A A . 21 VAL HG11 1 1 28 12062 1 1 21 VAL HG12 H 9.374 -5.044 3.454 1.00 . A A . 21 VAL HG12 1 1 28 12063 1 1 21 VAL HG13 H 8.146 -4.828 4.701 1.00 . A A . 21 VAL HG13 1 1 28 12064 1 1 21 VAL HG21 H 8.669 -2.330 5.887 1.00 . A A . 21 VAL HG21 1 1 28 12065 1 1 21 VAL HG22 H 7.138 -2.625 5.064 1.00 . A A . 21 VAL HG22 1 1 28 12066 1 1 21 VAL HG23 H 8.076 -1.180 4.689 1.00 . A A . 21 VAL HG23 1 1 28 12067 1 1 21 VAL N N 9.929 -0.936 3.166 1.00 . A A . 21 VAL N 1 1 28 12068 1 1 21 VAL O O 11.735 -4.031 2.788 1.00 . A A . 21 VAL O 1 1 28 12069 1 1 22 PHE C C 12.711 -2.599 -0.400 1.00 . A A . 22 PHE C 1 1 28 12070 1 1 22 PHE CA C 11.557 -3.450 0.159 1.00 . A A . 22 PHE CA 1 1 28 12071 1 1 22 PHE CB C 10.494 -3.692 -0.919 1.00 . A A . 22 PHE CB 1 1 28 12072 1 1 22 PHE CD1 C 10.053 -6.150 -0.563 1.00 . A A . 22 PHE CD1 1 1 28 12073 1 1 22 PHE CD2 C 11.117 -5.442 -2.624 1.00 . A A . 22 PHE CD2 1 1 28 12074 1 1 22 PHE CE1 C 10.110 -7.481 -0.990 1.00 . A A . 22 PHE CE1 1 1 28 12075 1 1 22 PHE CE2 C 11.173 -6.774 -3.051 1.00 . A A . 22 PHE CE2 1 1 28 12076 1 1 22 PHE CG C 10.556 -5.129 -1.379 1.00 . A A . 22 PHE CG 1 1 28 12077 1 1 22 PHE CZ C 10.671 -7.794 -2.235 1.00 . A A . 22 PHE CZ 1 1 28 12078 1 1 22 PHE H H 10.243 -1.984 1.049 1.00 . A A . 22 PHE H 1 1 28 12079 1 1 22 PHE HA H 11.933 -4.395 0.515 1.00 . A A . 22 PHE HA 1 1 28 12080 1 1 22 PHE HB2 H 9.514 -3.487 -0.511 1.00 . A A . 22 PHE HB2 1 1 28 12081 1 1 22 PHE HB3 H 10.677 -3.038 -1.759 1.00 . A A . 22 PHE HB3 1 1 28 12082 1 1 22 PHE HD1 H 9.620 -5.908 0.398 1.00 . A A . 22 PHE HD1 1 1 28 12083 1 1 22 PHE HD2 H 11.506 -4.656 -3.253 1.00 . A A . 22 PHE HD2 1 1 28 12084 1 1 22 PHE HE1 H 9.720 -8.267 -0.360 1.00 . A A . 22 PHE HE1 1 1 28 12085 1 1 22 PHE HE2 H 11.606 -7.015 -4.011 1.00 . A A . 22 PHE HE2 1 1 28 12086 1 1 22 PHE HZ H 10.714 -8.821 -2.564 1.00 . A A . 22 PHE HZ 1 1 28 12087 1 1 22 PHE N N 10.838 -2.731 1.259 1.00 . A A . 22 PHE N 1 1 28 12088 1 1 22 PHE O O 13.165 -2.812 -1.509 1.00 . A A . 22 PHE O 1 1 28 12089 1 1 23 PHE C C 15.234 -0.388 1.036 1.00 . A A . 23 PHE C 1 1 28 12090 1 1 23 PHE CA C 14.323 -0.792 -0.132 1.00 . A A . 23 PHE CA 1 1 28 12091 1 1 23 PHE CB C 13.648 0.438 -0.752 1.00 . A A . 23 PHE CB 1 1 28 12092 1 1 23 PHE CD1 C 13.287 -0.078 -3.195 1.00 . A A . 23 PHE CD1 1 1 28 12093 1 1 23 PHE CD2 C 15.184 1.294 -2.561 1.00 . A A . 23 PHE CD2 1 1 28 12094 1 1 23 PHE CE1 C 13.659 0.029 -4.540 1.00 . A A . 23 PHE CE1 1 1 28 12095 1 1 23 PHE CE2 C 15.555 1.401 -3.906 1.00 . A A . 23 PHE CE2 1 1 28 12096 1 1 23 PHE CG C 14.049 0.554 -2.204 1.00 . A A . 23 PHE CG 1 1 28 12097 1 1 23 PHE CZ C 14.793 0.768 -4.896 1.00 . A A . 23 PHE CZ 1 1 28 12098 1 1 23 PHE H H 12.823 -1.490 1.251 1.00 . A A . 23 PHE H 1 1 28 12099 1 1 23 PHE HA H 14.890 -1.318 -0.884 1.00 . A A . 23 PHE HA 1 1 28 12100 1 1 23 PHE HB2 H 12.576 0.334 -0.682 1.00 . A A . 23 PHE HB2 1 1 28 12101 1 1 23 PHE HB3 H 13.960 1.326 -0.223 1.00 . A A . 23 PHE HB3 1 1 28 12102 1 1 23 PHE HD1 H 12.413 -0.650 -2.920 1.00 . A A . 23 PHE HD1 1 1 28 12103 1 1 23 PHE HD2 H 15.772 1.782 -1.798 1.00 . A A . 23 PHE HD2 1 1 28 12104 1 1 23 PHE HE1 H 13.071 -0.459 -5.303 1.00 . A A . 23 PHE HE1 1 1 28 12105 1 1 23 PHE HE2 H 16.430 1.971 -4.181 1.00 . A A . 23 PHE HE2 1 1 28 12106 1 1 23 PHE HZ H 15.080 0.851 -5.933 1.00 . A A . 23 PHE HZ 1 1 28 12107 1 1 23 PHE N N 13.195 -1.644 0.359 1.00 . A A . 23 PHE N 1 1 28 12108 1 1 23 PHE O O 15.768 0.706 1.072 1.00 . A A . 23 PHE O 1 1 28 12109 1 1 24 TYR C C 16.749 -2.241 3.848 1.00 . A A . 24 TYR C 1 1 28 12110 1 1 24 TYR CA C 16.290 -0.947 3.163 1.00 . A A . 24 TYR CA 1 1 28 12111 1 1 24 TYR CB C 15.404 -0.110 4.097 1.00 . A A . 24 TYR CB 1 1 28 12112 1 1 24 TYR CD1 C 17.302 0.790 5.498 1.00 . A A . 24 TYR CD1 1 1 28 12113 1 1 24 TYR CD2 C 15.522 -0.439 6.594 1.00 . A A . 24 TYR CD2 1 1 28 12114 1 1 24 TYR CE1 C 17.938 0.968 6.731 1.00 . A A . 24 TYR CE1 1 1 28 12115 1 1 24 TYR CE2 C 16.158 -0.262 7.827 1.00 . A A . 24 TYR CE2 1 1 28 12116 1 1 24 TYR CG C 16.093 0.085 5.429 1.00 . A A . 24 TYR CG 1 1 28 12117 1 1 24 TYR CZ C 17.366 0.443 7.896 1.00 . A A . 24 TYR CZ 1 1 28 12118 1 1 24 TYR H H 14.978 -2.142 1.940 1.00 . A A . 24 TYR H 1 1 28 12119 1 1 24 TYR HA H 17.140 -0.370 2.850 1.00 . A A . 24 TYR HA 1 1 28 12120 1 1 24 TYR HB2 H 15.218 0.854 3.646 1.00 . A A . 24 TYR HB2 1 1 28 12121 1 1 24 TYR HB3 H 14.465 -0.620 4.252 1.00 . A A . 24 TYR HB3 1 1 28 12122 1 1 24 TYR HD1 H 17.743 1.195 4.600 1.00 . A A . 24 TYR HD1 1 1 28 12123 1 1 24 TYR HD2 H 14.591 -0.983 6.541 1.00 . A A . 24 TYR HD2 1 1 28 12124 1 1 24 TYR HE1 H 18.870 1.512 6.786 1.00 . A A . 24 TYR HE1 1 1 28 12125 1 1 24 TYR HE2 H 15.717 -0.666 8.725 1.00 . A A . 24 TYR HE2 1 1 28 12126 1 1 24 TYR HH H 18.486 -0.182 9.310 1.00 . A A . 24 TYR HH 1 1 28 12127 1 1 24 TYR N N 15.417 -1.267 1.992 1.00 . A A . 24 TYR N 1 1 28 12128 1 1 24 TYR O O 17.929 -2.522 3.935 1.00 . A A . 24 TYR O 1 1 28 12129 1 1 24 TYR OH O 17.993 0.618 9.112 1.00 . A A . 24 TYR OH 1 1 28 12130 1 1 25 LYS C C 14.995 -5.280 5.004 1.00 . A A . 25 LYS C 1 1 28 12131 1 1 25 LYS CA C 16.184 -4.307 5.013 1.00 . A A . 25 LYS CA 1 1 28 12132 1 1 25 LYS CB C 16.541 -3.910 6.450 1.00 . A A . 25 LYS CB 1 1 28 12133 1 1 25 LYS CD C 17.758 -6.014 7.057 1.00 . A A . 25 LYS CD 1 1 28 12134 1 1 25 LYS CE C 18.747 -6.470 8.134 1.00 . A A . 25 LYS CE 1 1 28 12135 1 1 25 LYS CG C 17.901 -4.506 6.825 1.00 . A A . 25 LYS CG 1 1 28 12136 1 1 25 LYS H H 14.881 -2.770 4.244 1.00 . A A . 25 LYS H 1 1 28 12137 1 1 25 LYS HA H 17.039 -4.757 4.533 1.00 . A A . 25 LYS HA 1 1 28 12138 1 1 25 LYS HB2 H 16.586 -2.834 6.526 1.00 . A A . 25 LYS HB2 1 1 28 12139 1 1 25 LYS HB3 H 15.787 -4.287 7.126 1.00 . A A . 25 LYS HB3 1 1 28 12140 1 1 25 LYS HD2 H 16.748 -6.234 7.376 1.00 . A A . 25 LYS HD2 1 1 28 12141 1 1 25 LYS HD3 H 17.964 -6.539 6.136 1.00 . A A . 25 LYS HD3 1 1 28 12142 1 1 25 LYS HE2 H 18.975 -7.520 8.010 1.00 . A A . 25 LYS HE2 1 1 28 12143 1 1 25 LYS HE3 H 19.650 -5.881 8.090 1.00 . A A . 25 LYS HE3 1 1 28 12144 1 1 25 LYS HG2 H 18.605 -4.330 6.022 1.00 . A A . 25 LYS HG2 1 1 28 12145 1 1 25 LYS HG3 H 18.263 -4.038 7.728 1.00 . A A . 25 LYS HG3 1 1 28 12146 1 1 25 LYS HZ1 H 17.781 -5.234 9.508 1.00 . A A . 25 LYS HZ1 1 1 28 12147 1 1 25 LYS HZ2 H 18.683 -6.488 10.216 1.00 . A A . 25 LYS HZ2 1 1 28 12148 1 1 25 LYS HZ3 H 17.192 -6.825 9.477 1.00 . A A . 25 LYS HZ3 1 1 28 12149 1 1 25 LYS N N 15.821 -3.025 4.331 1.00 . A A . 25 LYS N 1 1 28 12150 1 1 25 LYS NZ N 18.048 -6.237 9.431 1.00 . A A . 25 LYS NZ 1 1 28 12151 1 1 25 LYS O O 15.230 -6.470 5.138 1.00 . A A . 25 LYS O 1 1 28 12152 1 1 25 LYS OXT O 13.871 -4.821 4.867 1.00 . A A . 25 LYS OXT 1 1 stop_ save_
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