NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
433464 | 2juv | 15455 | cing | 4-filtered-FRED | STAR | entry | full | 292 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2juv # This FRED archive file contains, for PDB entry <2juv>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2juv _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2juv _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5768.47 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 $Insulin_A_chain A . 1 1 2 . 2 $Insulin_B_chain B . 1 1 stop_ save_ save_Insulin_A_chain _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Insulin A chain" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIXEQCCTSICSLYQLENYCN _Entity.Number_of_monomers 21 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 ILE . 1 1 3 ABA $ABA 1 1 4 GLU . 1 1 5 GLN . 1 1 6 CYS . 1 1 7 CYS . 1 1 8 THR . 1 1 9 SER . 1 1 10 ILE . 1 1 11 CYS . 1 1 12 SER . 1 1 13 LEU . 1 1 14 TYR . 1 1 15 GLN . 1 1 16 LEU . 1 1 17 GLU . 1 1 18 ASN . 1 1 19 TYR . 1 1 20 CYS . 1 1 21 ASN . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 ILE 2 2 1 1 ABA 3 3 1 1 GLU 4 4 1 1 GLN 5 5 1 1 CYS 6 6 1 1 CYS 7 7 1 1 THR 8 8 1 1 SER 9 9 1 1 ILE 10 10 1 1 CYS 11 11 1 1 SER 12 12 1 1 LEU 13 13 1 1 TYR 14 14 1 1 GLN 15 15 1 1 LEU 16 16 1 1 GLU 17 17 1 1 ASN 18 18 1 1 TYR 19 19 1 1 CYS 20 20 1 1 ASN 21 21 1 1 stop_ save_ save_Insulin_B_chain _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "Insulin B chain" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FVNQHLCGSDLVEALYLVCGERGFFYTKPT _Entity.Number_of_monomers 30 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 PHE . 1 2 2 VAL . 1 2 3 ASN . 1 2 4 GLN . 1 2 5 HIS . 1 2 6 LEU . 1 2 7 CYS . 1 2 8 GLY . 1 2 9 SER . 1 2 10 ASP . 1 2 11 LEU . 1 2 12 VAL . 1 2 13 GLU . 1 2 14 ALA . 1 2 15 LEU . 1 2 16 TYR . 1 2 17 LEU . 1 2 18 VAL . 1 2 19 CYS . 1 2 20 GLY . 1 2 21 GLU . 1 2 22 ARG . 1 2 23 GLY . 1 2 24 PHE . 1 2 25 PHE . 1 2 26 TYR . 1 2 27 THR . 1 2 28 LYS . 1 2 29 PRO . 1 2 30 THR . 1 2 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 PHE 1 1 1 2 VAL 2 2 1 2 ASN 3 3 1 2 GLN 4 4 1 2 HIS 5 5 1 2 LEU 6 6 1 2 CYS 7 7 1 2 GLY 8 8 1 2 SER 9 9 1 2 ASP 10 10 1 2 LEU 11 11 1 2 VAL 12 12 1 2 GLU 13 13 1 2 ALA 14 14 1 2 LEU 15 15 1 2 TYR 16 16 1 2 LEU 17 17 1 2 VAL 18 18 1 2 CYS 19 19 1 2 GLY 20 20 1 2 GLU 21 21 1 2 ARG 22 22 1 2 GLY 23 23 1 2 PHE 24 24 1 2 PHE 25 25 1 2 TYR 26 26 1 2 THR 27 27 1 2 LYS 28 28 1 2 PRO 29 29 1 2 THR 30 30 1 2 stop_ save_ save_ABA _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ABA _Chem_comp.Type non-polymer save_ save_Discover_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "general distance" _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 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 2 2 1 PHE CA 1 22 PHEN CA 1 1 1 1 2 2 2 3 ASN CA 1 24 ASN CA 1 1 2 1 1 2 2 2 VAL CA 1 23 VAL CA 1 1 2 1 2 2 2 4 GLN CA 1 25 GLN CA 1 1 3 1 1 2 2 3 ASN CA 1 24 ASN CA 1 1 3 1 2 2 2 5 HIS CA 1 26 HIS CA 1 1 4 1 1 2 2 4 GLN CA 1 25 GLN CA 1 1 4 1 2 2 2 6 LEU CA 1 27 LEU CA 1 1 5 1 1 2 2 5 HIS CA 1 26 HIS CA 1 1 5 1 2 2 2 7 CYS CA 1 28 CYS CA 1 1 6 1 1 2 2 6 LEU CA 1 27 LEU CA 1 1 6 1 2 2 2 8 GLY CA 1 29 GLY CA 1 1 7 1 1 2 2 7 CYS CA 1 28 CYS CA 1 1 7 1 2 2 2 9 SER CA 1 30 SER CA 1 1 8 1 1 2 2 8 GLY CA 1 29 GLY CA 1 1 8 1 2 2 2 10 ASP CA 1 31 ASP- CA 1 1 9 1 1 2 2 9 SER CA 1 30 SER CA 1 1 9 1 2 2 2 11 LEU CA 1 32 LEU CA 1 1 10 1 1 2 2 10 ASP CA 1 31 ASP- CA 1 1 10 1 2 2 2 12 VAL CA 1 33 VAL CA 1 1 11 1 1 2 2 11 LEU CA 1 32 LEU CA 1 1 11 1 2 2 2 13 GLU CA 1 34 GLU- CA 1 1 12 1 1 2 2 12 VAL CA 1 33 VAL CA 1 1 12 1 2 2 2 14 ALA CA 1 35 ALA CA 1 1 13 1 1 2 2 13 GLU CA 1 34 GLU- CA 1 1 13 1 2 2 2 15 LEU CA 1 36 LEU CA 1 1 14 1 1 2 2 14 ALA CA 1 35 ALA CA 1 1 14 1 2 2 2 16 TYR CA 1 37 TYR CA 1 1 15 1 1 2 2 15 LEU CA 1 36 LEU CA 1 1 15 1 2 2 2 17 LEU CA 1 38 LEU CA 1 1 16 1 1 2 2 16 TYR CA 1 37 TYR CA 1 1 16 1 2 2 2 18 VAL CA 1 39 VAL CA 1 1 17 1 1 2 2 17 LEU CA 1 38 LEU CA 1 1 17 1 2 2 2 19 CYS CA 1 40 CYS CA 1 1 18 1 1 2 2 18 VAL CA 1 39 VAL CA 1 1 18 1 2 2 2 20 GLY CA 1 41 GLY CA 1 1 19 1 1 2 2 19 CYS CA 1 40 CYS CA 1 1 19 1 2 2 2 21 GLU CA 1 42 GLU- CA 1 1 20 1 1 2 2 20 GLY CA 1 41 GLY CA 1 1 20 1 2 2 2 22 ARG CA 1 43 ARG+ CA 1 1 21 1 1 1 1 1 GLY CA 1 44 GLY CA 1 1 21 1 2 2 2 21 GLU CA 1 42 GLU- CA 1 1 22 1 1 1 1 2 ILE CA 1 45 PHE CA 1 1 22 1 2 2 2 22 ARG CA 1 43 ARG+ CA 1 1 23 1 1 1 1 1 GLY CA 1 44 GLY CA 1 1 23 1 2 1 1 3 ABA CA 1 46 PHE CA 1 1 24 1 1 1 1 2 ILE CA 1 45 PHE CA 1 1 24 1 2 1 1 4 GLU CA 1 47 TYR CA 1 1 25 1 1 1 1 3 ABA CA 1 46 PHE CA 1 1 25 1 2 1 1 5 GLN CA 1 48 THR CA 1 1 26 1 1 1 1 4 GLU CA 1 47 TYR CA 1 1 26 1 2 1 1 6 CYS CA 1 49 LYS+ CA 1 1 27 1 1 1 1 5 GLN CA 1 48 THR CA 1 1 27 1 2 1 1 7 CYS CA 1 50 PRO CA 1 1 28 1 1 1 1 6 CYS CA 1 49 LYS+ CA 1 1 28 1 2 1 1 8 THR CA 1 51 THRC CA 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 . . . . . . 4.7 7.2 1 1 2 1 . . . . . . 4.7 7.2 1 1 3 1 . . . . . . 4.7 7.2 1 1 4 1 . . . . . . 4.7 7.2 1 1 5 1 . . . . . . 4.7 7.2 1 1 6 1 . . . . . . 4.7 7.2 1 1 7 1 . . . . . . 4.7 7.2 1 1 8 1 . . . . . . 4.7 7.2 1 1 9 1 . . . . . . 4.7 7.2 1 1 10 1 . . . . . . 4.7 7.2 1 1 11 1 . . . . . . 4.7 7.2 1 1 12 1 . . . . . . 4.7 7.2 1 1 13 1 . . . . . . 4.7 7.2 1 1 14 1 . . . . . . 4.7 7.2 1 1 15 1 . . . . . . 4.7 7.2 1 1 16 1 . . . . . . 4.7 7.2 1 1 17 1 . . . . . . 4.7 7.2 1 1 18 1 . . . . . . 4.7 7.2 1 1 19 1 . . . . . . 4.7 7.2 1 1 20 1 . . . . . . 4.7 7.2 1 1 21 1 . . . . . . 4.7 7.2 1 1 22 1 . . . . . . 4.7 7.2 1 1 23 1 . . . . . . 4.7 7.2 1 1 24 1 . . . . . . 4.7 7.2 1 1 25 1 . . . . . . 4.7 7.2 1 1 26 1 . . . . . . 4.7 7.2 1 1 27 1 . . . . . . 4.7 7.2 1 1 28 1 . . . . . . 4.7 7.2 1 1 stop_ save_ save_Discover_distance_constraints_6_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 135 1 . . . 1 2 136 1 . . . 1 2 137 1 . . . 1 2 138 1 . . . 1 2 139 1 . . . 1 2 140 1 . . . 1 2 141 1 . . . 1 2 142 1 . . . 1 2 143 1 . . . 1 2 144 1 . . . 1 2 145 1 . . . 1 2 146 1 . . . 1 2 147 1 . . . 1 2 148 1 . . . 1 2 149 1 . . . 1 2 150 1 . . . 1 2 151 1 . . . 1 2 152 1 . . . 1 2 153 1 . . . 1 2 154 1 . . . 1 2 155 1 . . . 1 2 156 1 . . . 1 2 157 1 . . . 1 2 158 1 . . . 1 2 159 1 . . . 1 2 160 1 . . . 1 2 161 1 . . . 1 2 162 1 . . . 1 2 163 1 . . . 1 2 164 1 . . . 1 2 165 1 . . . 1 2 166 1 . . . 1 2 167 1 . . . 1 2 168 1 . . . 1 2 169 1 . . . 1 2 170 1 . . . 1 2 171 1 . . . 1 2 172 1 . . . 1 2 173 1 . . . 1 2 174 1 . . . 1 2 175 1 . . . 1 2 176 1 . . . 1 2 177 1 . . . 1 2 178 1 . . . 1 2 179 1 . . . 1 2 180 1 . . . 1 2 181 1 . . . 1 2 182 1 . . . 1 2 183 1 . . . 1 2 184 1 . . . 1 2 185 1 . . . 1 2 186 1 . . . 1 2 187 1 . . . 1 2 188 1 . . . 1 2 189 1 . . . 1 2 190 1 . . . 1 2 191 1 . . . 1 2 192 1 . . . 1 2 193 1 . . . 1 2 194 1 . . . 1 2 195 1 . . . 1 2 196 1 . . . 1 2 197 1 . . . 1 2 198 1 . . . 1 2 199 1 . . . 1 2 200 1 . . . 1 2 201 1 . . . 1 2 202 1 . . . 1 2 203 1 . . . 1 2 204 1 . . . 1 2 205 1 . . . 1 2 206 1 . . . 1 2 207 1 . . . 1 2 208 1 . . . 1 2 209 1 . . . 1 2 210 1 . . . 1 2 211 1 . . . 1 2 212 1 . . . 1 2 213 1 . . . 1 2 214 1 . . . 1 2 215 1 . . . 1 2 216 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 2 2 1 PHE HA 1 22 PHEN HA 1 2 1 1 2 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 2 1 1 2 2 1 PHE HA 1 22 PHEN HA 1 2 2 1 2 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 3 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 3 1 2 2 2 3 ASN HA 1 24 ASN HA 1 2 4 1 1 2 2 2 VAL HA 1 23 VAL HA 1 2 4 1 2 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 5 1 1 2 2 2 VAL HA 1 23 VAL HA 1 2 5 1 2 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 6 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 6 1 2 2 2 2 VAL HB 1 23 VAL HB 1 2 7 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 7 1 2 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 8 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 8 1 2 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 9 1 1 2 2 3 ASN H 1 24 ASN HN 1 2 9 1 2 2 2 3 ASN HB3 1 24 ASN HB1 1 2 10 1 1 2 2 3 ASN H 1 24 ASN HN 1 2 10 1 2 2 2 3 ASN HB2 1 24 ASN HB2 1 2 11 1 1 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 11 1 2 2 2 3 ASN H 1 24 ASN HN 1 2 12 1 1 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 12 1 2 2 2 3 ASN H 1 24 ASN HN 1 2 13 1 1 2 2 3 ASN H 1 24 ASN HN 1 2 13 1 2 2 2 4 GLN QB 1 25 GLN HB* 1 2 14 1 1 2 2 3 ASN HB3 1 24 ASN HB1 1 2 14 1 2 2 2 4 GLN HA 1 25 GLN HA 1 2 15 1 1 2 2 3 ASN HB2 1 24 ASN HB2 1 2 15 1 2 2 2 4 GLN HA 1 25 GLN HA 1 2 16 1 1 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 16 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 17 1 1 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 17 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 18 1 1 2 2 3 ASN HA 1 24 ASN HA 1 2 18 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 19 1 1 2 2 3 ASN HB3 1 24 ASN HB1 1 2 19 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 20 1 1 2 2 3 ASN HB2 1 24 ASN HB2 1 2 20 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 21 1 1 2 2 4 GLN HA 1 25 GLN HA 1 2 21 1 2 2 2 4 GLN QG 1 25 GLN HG* 1 2 22 1 1 2 2 4 GLN H 1 25 GLN HN 1 2 22 1 2 2 2 4 GLN QB 1 25 GLN HB* 1 2 23 1 1 2 2 4 GLN H 1 25 GLN HN 1 2 23 1 2 2 2 4 GLN QG 1 25 GLN HG* 1 2 24 1 1 2 2 5 HIS H 1 26 HIS HN 1 2 24 1 2 2 2 5 HIS HB3 1 26 HIS HB1 1 2 25 1 1 2 2 5 HIS H 1 26 HIS HN 1 2 25 1 2 2 2 5 HIS HB2 1 26 HIS HB2 1 2 26 1 1 2 2 5 HIS HB3 1 26 HIS HB1 1 2 26 1 2 2 2 5 HIS HD2 1 26 HIS HD2 1 2 27 1 1 2 2 5 HIS HB2 1 26 HIS HB2 1 2 27 1 2 2 2 5 HIS HD2 1 26 HIS HD2 1 2 28 1 1 2 2 4 GLN QB 1 25 GLN HB* 1 2 28 1 2 2 2 5 HIS H 1 26 HIS HN 1 2 29 1 1 2 2 4 GLN H 1 25 GLN HN 1 2 29 1 2 2 2 5 HIS H 1 26 HIS HN 1 2 30 1 1 2 2 5 HIS H 1 26 HIS HN 1 2 30 1 2 2 2 5 HIS HD2 1 26 HIS HD2 1 2 31 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 31 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 32 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 32 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 33 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 33 1 2 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 34 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 34 1 2 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 35 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 35 1 2 2 2 11 LEU QD 1 32 LEU HD1* 1 2 36 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 36 1 2 2 2 6 LEU HG 1 27 LEU HG 1 2 37 1 1 2 2 7 CYS H 1 28 CYS HN 1 2 37 1 2 2 2 7 CYS HB3 1 28 CYS HB1 1 2 38 1 1 2 2 7 CYS H 1 28 CYS HN 1 2 38 1 2 2 2 7 CYS HB2 1 28 CYS HB2 1 2 39 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 39 1 2 2 2 11 LEU HB3 1 32 LEU HB1 1 2 40 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 40 1 2 2 2 11 LEU HB2 1 32 LEU HB2 1 2 41 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 41 1 2 2 2 11 LEU QD 1 32 LEU HD1* 1 2 42 1 1 2 2 6 LEU HB3 1 27 LEU HB1 1 2 42 1 2 2 2 7 CYS HB3 1 28 CYS HB1 1 2 43 1 1 2 2 6 LEU HB2 1 27 LEU HB2 1 2 43 1 2 2 2 7 CYS HB3 1 28 CYS HB1 1 2 44 1 1 2 2 6 LEU HB3 1 27 LEU HB1 1 2 44 1 2 2 2 7 CYS HB2 1 28 CYS HB2 1 2 45 1 1 2 2 6 LEU HB2 1 27 LEU HB2 1 2 45 1 2 2 2 7 CYS HB2 1 28 CYS HB2 1 2 46 1 1 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 46 1 2 2 2 7 CYS HA 1 28 CYS HA 1 2 47 1 1 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 47 1 2 2 2 7 CYS HA 1 28 CYS HA 1 2 48 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 48 1 2 2 2 8 GLY H 1 29 GLY HN 1 2 49 1 1 2 2 7 CYS HB3 1 28 CYS HB1 1 2 49 1 2 2 2 8 GLY H 1 29 GLY HN 1 2 50 1 1 2 2 7 CYS HB2 1 28 CYS HB2 1 2 50 1 2 2 2 8 GLY H 1 29 GLY HN 1 2 51 1 1 2 2 8 GLY H 1 29 GLY HN 1 2 51 1 2 2 2 8 GLY QA 1 29 GLY HA* 1 2 52 1 1 2 2 9 SER H 1 30 SER HN 1 2 52 1 2 2 2 9 SER QB 1 30 SER HB* 1 2 53 1 1 2 2 8 GLY QA 1 29 GLY HA* 1 2 53 1 2 2 2 9 SER H 1 30 SER HN 1 2 54 1 1 2 2 9 SER H 1 30 SER HN 1 2 54 1 2 2 2 10 ASP H 1 31 ASP- HN 1 2 55 1 1 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 55 1 2 2 2 10 ASP HA 1 31 ASP- HA 1 2 56 1 1 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 56 1 2 2 2 10 ASP HA 1 31 ASP- HA 1 2 57 1 1 2 2 10 ASP HA 1 31 ASP- HA 1 2 57 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 58 1 1 2 2 6 LEU HB3 1 27 LEU HB1 1 2 58 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 59 1 1 2 2 6 LEU HB3 1 27 LEU HB1 1 2 59 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 60 1 1 2 2 6 LEU HB2 1 27 LEU HB2 1 2 60 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 61 1 1 2 2 6 LEU HB2 1 27 LEU HB2 1 2 61 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 62 1 1 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 62 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 63 1 1 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 63 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 64 1 1 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 64 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 65 1 1 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 65 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 66 1 1 2 2 8 GLY QA 1 29 GLY HA* 1 2 66 1 2 2 2 10 ASP H 1 31 ASP- HN 1 2 67 1 1 2 2 9 SER HA 1 30 SER HA 1 2 67 1 2 2 2 10 ASP H 1 31 ASP- HN 1 2 68 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 68 1 2 2 2 11 LEU H 1 32 LEU HN 1 2 69 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 69 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 70 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 70 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 71 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 71 1 2 2 2 11 LEU QD 1 32 LEU HD1* 1 2 72 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 72 1 2 2 2 11 LEU HG 1 32 LEU HG 1 2 73 1 1 2 2 6 LEU HG 1 27 LEU HG 1 2 73 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 74 1 1 2 2 11 LEU HB3 1 32 LEU HB1 1 2 74 1 2 2 2 11 LEU QD 1 32 LEU HD1* 1 2 75 1 1 2 2 11 LEU HB2 1 32 LEU HB2 1 2 75 1 2 2 2 11 LEU QD 1 32 LEU HD1* 1 2 76 1 1 2 2 11 LEU H 1 32 LEU HN 1 2 76 1 2 2 2 11 LEU HB3 1 32 LEU HB1 1 2 77 1 1 2 2 11 LEU H 1 32 LEU HN 1 2 77 1 2 2 2 11 LEU HB2 1 32 LEU HB2 1 2 78 1 1 2 2 11 LEU H 1 32 LEU HN 1 2 78 1 2 2 2 11 LEU HG 1 32 LEU HG 1 2 79 1 1 2 2 11 LEU QD 1 32 LEU HD2* 1 2 79 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 80 1 1 2 2 6 LEU HB3 1 27 LEU HB1 1 2 80 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 81 1 1 2 2 6 LEU HB2 1 27 LEU HB2 1 2 81 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 82 1 1 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 82 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 83 1 1 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 83 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 84 1 1 2 2 11 LEU HG 1 32 LEU HG 1 2 84 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 85 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 85 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 86 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 86 1 2 2 2 13 GLU QG 1 34 GLU- HG* 1 2 87 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 87 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 88 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 88 1 2 2 2 15 LEU HG 1 36 LEU HG 1 2 89 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 89 1 2 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 90 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 90 1 2 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 91 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 91 1 2 2 2 15 LEU HB3 1 36 LEU HB1 1 2 92 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 92 1 2 2 2 15 LEU HB2 1 36 LEU HB2 1 2 93 1 1 2 2 12 VAL H 1 33 VAL HN 1 2 93 1 2 2 2 12 VAL HB 1 33 VAL HB 1 2 94 1 1 2 2 12 VAL H 1 33 VAL HN 1 2 94 1 2 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 95 1 1 2 2 12 VAL H 1 33 VAL HN 1 2 95 1 2 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 96 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 96 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 97 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 97 1 2 2 2 13 GLU QG 1 34 GLU- HG* 1 2 98 1 1 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 98 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 99 1 1 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 99 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 100 1 1 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 100 1 2 2 2 13 GLU HA 1 34 GLU- HA 1 2 101 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 101 1 2 2 2 16 TYR HB3 1 37 TYR HB1 1 2 102 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 102 1 2 2 2 16 TYR HB2 1 37 TYR HB2 1 2 103 1 1 2 2 10 ASP HA 1 31 ASP- HA 1 2 103 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 104 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 104 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 105 1 1 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 105 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 106 1 1 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 106 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 107 1 1 2 2 12 VAL H 1 33 VAL HN 1 2 107 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 108 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 108 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 109 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 109 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 110 1 1 2 2 14 ALA HA 1 35 ALA HA 1 2 110 1 2 2 2 18 VAL HB 1 39 VAL HB 1 2 111 1 1 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 111 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 112 1 1 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 112 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 113 1 1 2 2 13 GLU QB 1 34 GLU- HB* 1 2 113 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 114 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 114 1 2 2 2 15 LEU HA 1 36 LEU HA 1 2 115 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 115 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 116 1 1 2 2 11 LEU QD 1 32 LEU HD1* 1 2 116 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 117 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 117 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 118 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 118 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 119 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 119 1 2 2 2 15 LEU HG 1 36 LEU HG 1 2 120 1 1 2 2 15 LEU HB3 1 36 LEU HB1 1 2 120 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 121 1 1 2 2 15 LEU HB2 1 36 LEU HB2 1 2 121 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 122 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 122 1 2 2 2 15 LEU HB3 1 36 LEU HB1 1 2 123 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 123 1 2 2 2 15 LEU HB2 1 36 LEU HB2 1 2 124 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 124 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 125 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 125 1 2 2 2 15 LEU HG 1 36 LEU HG 1 2 126 1 1 2 2 14 ALA MB 1 35 ALA HB* 1 2 126 1 2 2 2 15 LEU HA 1 36 LEU HA 1 2 127 1 1 2 2 12 VAL HA 1 33 VAL HA 1 2 127 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 128 1 1 2 2 14 ALA HA 1 35 ALA HA 1 2 128 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 129 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 129 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 130 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 130 1 2 2 2 16 TYR HB3 1 37 TYR HB1 1 2 131 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 131 1 2 2 2 16 TYR HB2 1 37 TYR HB2 1 2 132 1 1 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 132 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 133 1 1 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 133 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 134 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 134 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 135 1 1 2 2 12 VAL MG1 1 33 VAL HG1* 1 2 135 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 136 1 1 2 2 12 VAL MG2 1 33 VAL HG2* 1 2 136 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 137 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 137 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 138 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 138 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 139 1 1 2 2 15 LEU HB3 1 36 LEU HB1 1 2 139 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 140 1 1 2 2 15 LEU HB2 1 36 LEU HB2 1 2 140 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 141 1 1 2 2 15 LEU QD 1 36 LEU HD1* 1 2 141 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 142 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 142 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 143 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 143 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 144 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 144 1 2 2 2 16 TYR HB3 1 37 TYR HB1 1 2 145 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 145 1 2 2 2 16 TYR HB2 1 37 TYR HB2 1 2 146 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 146 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 147 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 147 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 148 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 148 1 2 2 2 17 LEU HG 1 38 LEU HG 1 2 149 1 1 2 2 17 LEU QB 1 38 LEU HB* 1 2 149 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 150 1 1 2 2 17 LEU QB 1 38 LEU HB* 1 2 150 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 151 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 151 1 2 2 2 17 LEU QB 1 38 LEU HB* 1 2 152 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 152 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 153 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 153 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 154 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 154 1 2 2 2 17 LEU HG 1 38 LEU HG 1 2 155 1 1 2 2 16 TYR HA 1 37 TYR HA 1 2 155 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 156 1 1 2 2 16 TYR HB3 1 37 TYR HB1 1 2 156 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 157 1 1 2 2 16 TYR HB2 1 37 TYR HB2 1 2 157 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 158 1 1 2 2 15 LEU QD 1 36 LEU HD2* 1 2 158 1 2 2 2 18 VAL HB 1 39 VAL HB 1 2 159 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 159 1 2 2 2 18 VAL H 1 39 VAL HN 1 2 160 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 160 1 2 2 2 18 VAL H 1 39 VAL HN 1 2 161 1 1 2 2 17 LEU QB 1 38 LEU HB* 1 2 161 1 2 2 2 18 VAL H 1 39 VAL HN 1 2 162 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 162 1 2 2 2 18 VAL H 1 39 VAL HN 1 2 163 1 1 2 2 18 VAL HA 1 39 VAL HA 1 2 163 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 164 1 1 2 2 18 VAL HA 1 39 VAL HA 1 2 164 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 165 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 165 1 2 2 2 18 VAL HB 1 39 VAL HB 1 2 166 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 166 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 167 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 167 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 168 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 168 1 2 2 2 19 CYS HB3 1 40 CYS HB1 1 2 169 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 169 1 2 2 2 19 CYS HB2 1 40 CYS HB2 1 2 170 1 1 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 170 1 2 2 2 19 CYS HA 1 40 CYS HA 1 2 171 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 171 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 172 1 1 2 2 18 VAL HA 1 39 VAL HA 1 2 172 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 173 1 1 2 2 18 VAL HB 1 39 VAL HB 1 2 173 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 174 1 1 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 174 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 175 1 1 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 175 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 176 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 176 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 177 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 177 1 2 2 2 20 GLY H 1 41 GLY HN 1 2 178 1 1 2 2 16 TYR HA 1 37 TYR HA 1 2 178 1 2 2 2 20 GLY H 1 41 GLY HN 1 2 179 1 1 2 2 19 CYS HA 1 40 CYS HA 1 2 179 1 2 2 2 20 GLY H 1 41 GLY HN 1 2 180 1 1 2 2 20 GLY H 1 41 GLY HN 1 2 180 1 2 2 2 20 GLY QA 1 41 GLY HA* 1 2 181 1 1 2 2 21 GLU H 1 42 GLU- HN 1 2 181 1 2 2 2 21 GLU HB3 1 42 GLU- HB1 1 2 182 1 1 2 2 21 GLU H 1 42 GLU- HN 1 2 182 1 2 2 2 21 GLU HB2 1 42 GLU- HB2 1 2 183 1 1 2 2 21 GLU H 1 42 GLU- HN 1 2 183 1 2 2 2 21 GLU QG 1 42 GLU- HG* 1 2 184 1 1 2 2 20 GLY QA 1 41 GLY HA* 1 2 184 1 2 2 2 21 GLU H 1 42 GLU- HN 1 2 185 1 1 2 2 20 GLY H 1 41 GLY HN 1 2 185 1 2 2 2 21 GLU H 1 42 GLU- HN 1 2 186 1 1 2 2 21 GLU H 1 42 GLU- HN 1 2 186 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 187 1 1 2 2 20 GLY QA 1 41 GLY HA* 1 2 187 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 188 1 1 2 2 21 GLU HB3 1 42 GLU- HB1 1 2 188 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 189 1 1 2 2 21 GLU HB2 1 42 GLU- HB2 1 2 189 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 190 1 1 2 2 21 GLU QG 1 42 GLU- HG* 1 2 190 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 191 1 1 2 2 22 ARG HA 1 43 ARG+ HA 1 2 191 1 2 2 2 22 ARG QG 1 43 ARG+ HG* 1 2 192 1 1 2 2 22 ARG HB3 1 43 ARG+ HB1 1 2 192 1 2 2 2 22 ARG QD 1 43 ARG+ HD* 1 2 193 1 1 2 2 22 ARG HB2 1 43 ARG+ HB2 1 2 193 1 2 2 2 22 ARG QD 1 43 ARG+ HD* 1 2 194 1 1 2 2 22 ARG H 1 43 ARG+ HN 1 2 194 1 2 2 2 22 ARG HB3 1 43 ARG+ HB1 1 2 195 1 1 2 2 22 ARG H 1 43 ARG+ HN 1 2 195 1 2 2 2 22 ARG HB2 1 43 ARG+ HB2 1 2 196 1 1 2 2 22 ARG H 1 43 ARG+ HN 1 2 196 1 2 2 2 22 ARG QG 1 43 ARG+ HG* 1 2 197 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 197 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 198 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 198 1 2 2 2 16 TYR HA 1 37 TYR HA 1 2 199 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 199 1 2 1 1 4 GLU QB 1 47 TYR HB1 1 2 200 1 1 1 1 1 GLY QA 1 44 GLY HA* 1 2 200 1 2 1 1 2 ILE H 1 45 PHE HN 1 2 201 1 1 1 1 4 GLU QB 1 47 TYR HB1 1 2 201 1 2 2 2 11 LEU QD 1 32 LEU HD2* 1 2 202 1 1 1 1 4 GLU QB 1 47 TYR HB1 1 2 202 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 203 1 1 1 1 3 ABA HA 1 46 PHE HA 1 2 203 1 2 1 1 4 GLU H 1 47 TYR HN 1 2 204 1 1 1 1 4 GLU H 1 47 TYR HN 1 2 204 1 2 1 1 4 GLU QB 1 47 TYR HB1 1 2 205 1 1 1 1 5 GLN HA 1 48 THR HA 1 2 205 1 2 1 1 5 GLN QG 1 48 THR HG* 1 2 206 1 1 1 1 5 GLN H 1 48 THR HN 1 2 206 1 2 1 1 5 GLN QG 1 48 THR HG* 1 2 207 1 1 1 1 4 GLU HA 1 47 TYR HA 1 2 207 1 2 1 1 5 GLN H 1 48 THR HN 1 2 208 1 1 1 1 4 GLU QB 1 47 TYR HB1 1 2 208 1 2 1 1 5 GLN H 1 48 THR HN 1 2 209 1 1 1 1 5 GLN H 1 48 THR HN 1 2 209 1 2 1 1 6 CYS HA 1 49 LYS+ HA 1 2 210 1 1 1 1 5 GLN HA 1 48 THR HA 1 2 210 1 2 1 1 6 CYS H 1 49 LYS+ HN 1 2 211 1 1 1 1 5 GLN QG 1 48 THR HG* 1 2 211 1 2 1 1 6 CYS H 1 49 LYS+ HN 1 2 212 1 1 1 1 5 GLN H 1 48 THR HN 1 2 212 1 2 1 1 6 CYS H 1 49 LYS+ HN 1 2 213 1 1 1 1 6 CYS H 1 49 LYS+ HN 1 2 213 1 2 1 1 6 CYS QB 1 49 LYS+ HB1 1 2 214 1 1 1 1 6 CYS QB 1 49 LYS+ HB1 1 2 214 1 2 1 1 7 CYS HB2 1 50 PRO HB1 1 2 215 1 1 1 1 6 CYS QB 1 49 LYS+ HB1 1 2 215 1 2 1 1 7 CYS HB3 1 50 PRO HB2 1 2 216 1 1 1 1 6 CYS HA 1 49 LYS+ HA 1 2 216 1 2 1 1 8 THR H 1 51 THRC HN 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.0 -1.0 6.0 1 2 2 1 . . . . . 3.0 -1.0 6.0 1 2 3 1 . . . . . 3.0 -1.0 5.0 1 2 4 1 . . . . . 2.7 -1.0 4.4 1 2 5 1 . . . . . 2.7 -1.0 4.4 1 2 6 1 . . . . . 2.7 -1.0 4.4 1 2 7 1 . . . . . 2.7 -1.0 6.0 1 2 8 1 . . . . . 2.7 -1.0 3.7 1 2 9 1 . . . . . 2.7 -1.0 3.7 1 2 10 1 . . . . . 2.7 -1.0 3.7 1 2 11 1 . . . . . 3.0 -1.0 4.4 1 2 12 1 . . . . . 3.0 -1.0 4.4 1 2 13 1 . . . . . 3.0 -1.0 4.4 1 2 14 1 . . . . . 3.0 -1.0 6.0 1 2 15 1 . . . . . 3.0 -1.0 6.0 1 2 16 1 . . . . . 3.0 -1.0 6.0 1 2 17 1 . . . . . 3.0 -1.0 6.0 1 2 18 1 . . . . . 2.7 -1.0 2.7 1 2 19 1 . . . . . 3.0 -1.0 4.4 1 2 20 1 . . . . . 3.0 -1.0 4.4 1 2 21 1 . . . . . 2.7 -1.0 4.4 1 2 22 1 . . . . . 2.7 -1.0 4.4 1 2 23 1 . . . . . 2.7 -1.0 4.4 1 2 24 1 . . . . . 2.7 -1.0 3.7 1 2 25 1 . . . . . 2.7 -1.0 5.0 1 2 26 1 . . . . . 3.0 -1.0 4.4 1 2 27 1 . . . . . 3.0 -1.0 4.4 1 2 28 1 . . . . . 3.0 -1.0 4.4 1 2 29 1 . . . . . 3.0 -1.0 5.0 1 2 30 1 . . . . . 3.0 -1.0 5.0 1 2 31 1 . . . . . 3.0 -1.0 6.0 1 2 32 1 . . . . . 3.0 -1.0 6.0 1 2 33 1 . . . . . 2.7 -1.0 3.7 1 2 34 1 . . . . . 2.7 -1.0 6.0 1 2 35 1 . . . . . 3.0 -1.0 6.0 1 2 36 1 . . . . . 2.7 -1.0 6.0 1 2 37 1 . . . . . 2.7 -1.0 5.0 1 2 38 1 . . . . . 2.7 -1.0 3.4 1 2 39 1 . . . . . 3.0 -1.0 5.2 1 2 40 1 . . . . . 3.0 -1.0 5.0 1 2 41 1 . . . . . 3.0 -1.0 6.0 1 2 42 1 . . . . . 3.0 -1.0 7.0 1 2 43 1 . . . . . 3.0 -1.0 7.0 1 2 44 1 . . . . . 3.0 -1.0 7.0 1 2 45 1 . . . . . 3.0 -1.0 7.0 1 2 46 1 . . . . . 3.0 -1.0 6.5 1 2 47 1 . . . . . 3.0 -1.0 6.8 1 2 48 1 . . . . . 3.0 -1.0 5.0 1 2 49 1 . . . . . 3.0 -1.0 6.0 1 2 50 1 . . . . . 3.0 -1.0 6.0 1 2 51 1 . . . . . 2.7 -1.0 2.7 1 2 52 1 . . . . . 2.7 -1.0 4.4 1 2 53 1 . . . . . 3.0 -1.0 4.4 1 2 54 1 . . . . . 3.0 -1.0 3.4 1 2 55 1 . . . . . 3.0 -1.0 6.0 1 2 56 1 . . . . . 3.0 -1.0 6.0 1 2 57 1 . . . . . 3.0 -1.0 4.4 1 2 58 1 . . . . . 3.0 -1.0 5.4 1 2 59 1 . . . . . 3.0 -1.0 5.4 1 2 60 1 . . . . . 3.0 -1.0 5.4 1 2 61 1 . . . . . 3.0 -1.0 5.4 1 2 62 1 . . . . . 3.0 -1.0 5.4 1 2 63 1 . . . . . 3.0 -1.0 5.4 1 2 64 1 . . . . . 3.0 -1.0 5.4 1 2 65 1 . . . . . 3.0 -1.0 5.4 1 2 66 1 . . . . . 3.0 -1.0 4.4 1 2 67 1 . . . . . 3.0 -1.0 3.4 1 2 68 1 . . . . . 3.0 -1.0 3.4 1 2 69 1 . . . . . 2.7 -1.0 3.7 1 2 70 1 . . . . . 2.7 -1.0 3.4 1 2 71 1 . . . . . 2.7 -1.0 4.4 1 2 72 1 . . . . . 2.7 -1.0 3.7 1 2 73 1 . . . . . 3.0 -1.0 5.0 1 2 74 1 . . . . . 2.7 -1.0 5.4 1 2 75 1 . . . . . 2.7 -1.0 5.4 1 2 76 1 . . . . . 2.7 -1.0 4.4 1 2 77 1 . . . . . 2.7 -1.0 4.4 1 2 78 1 . . . . . 2.7 -1.0 5.0 1 2 79 1 . . . . . 3.0 -1.0 5.4 1 2 80 1 . . . . . 3.0 -1.0 4.4 1 2 81 1 . . . . . 3.0 -1.0 4.4 1 2 82 1 . . . . . 3.0 -1.0 4.7 1 2 83 1 . . . . . 3.0 -1.0 4.4 1 2 84 1 . . . . . 3.0 -1.0 4.4 1 2 85 1 . . . . . 3.0 -1.0 4.4 1 2 86 1 . . . . . 3.0 -1.0 6.4 1 2 87 1 . . . . . 3.0 -1.0 4.4 1 2 88 1 . . . . . 3.0 -1.0 5.0 1 2 89 1 . . . . . 2.7 -1.0 4.4 1 2 90 1 . . . . . 2.7 -1.0 4.4 1 2 91 1 . . . . . 2.7 -1.0 4.4 1 2 92 1 . . . . . 2.7 -1.0 4.4 1 2 93 1 . . . . . 2.7 -1.0 3.7 1 2 94 1 . . . . . 2.7 -1.0 4.4 1 2 95 1 . . . . . 2.7 -1.0 4.4 1 2 96 1 . . . . . 2.7 -1.0 3.4 1 2 97 1 . . . . . 2.7 -1.0 4.4 1 2 98 1 . . . . . 3.0 -1.0 6.7 1 2 99 1 . . . . . 3.0 -1.0 5.4 1 2 100 1 . . . . . 3.0 -1.0 6.0 1 2 101 1 . . . . . 3.0 -1.0 4.4 1 2 102 1 . . . . . 3.0 -1.0 4.4 1 2 103 1 . . . . . 3.0 -1.0 5.0 1 2 104 1 . . . . . 3.0 -1.0 5.0 1 2 105 1 . . . . . 3.0 -1.0 5.0 1 2 106 1 . . . . . 3.0 -1.0 4.0 1 2 107 1 . . . . . 3.0 -1.0 5.0 1 2 108 1 . . . . . 3.0 -1.0 6.0 1 2 109 1 . . . . . 3.0 -1.0 3.4 1 2 110 1 . . . . . 3.0 -1.0 6.4 1 2 111 1 . . . . . 3.0 -1.0 6.0 1 2 112 1 . . . . . 3.0 -1.0 6.0 1 2 113 1 . . . . . 3.0 -1.0 4.4 1 2 114 1 . . . . . 3.0 -1.0 5.0 1 2 115 1 . . . . . 3.0 -1.0 5.0 1 2 116 1 . . . . . 3.0 -1.0 8.0 1 2 117 1 . . . . . 2.7 -1.0 4.4 1 2 118 1 . . . . . 2.7 -1.0 3.7 1 2 119 1 . . . . . 2.7 -1.0 3.4 1 2 120 1 . . . . . 2.5 -1.0 4.7 1 2 121 1 . . . . . 2.5 -1.0 4.7 1 2 122 1 . . . . . 2.7 -1.0 3.7 1 2 123 1 . . . . . 2.7 -1.0 3.7 1 2 124 1 . . . . . 2.7 -1.0 4.4 1 2 125 1 . . . . . 2.7 -1.0 3.4 1 2 126 1 . . . . . 3.0 -1.0 6.0 1 2 127 1 . . . . . 3.0 -1.0 3.4 1 2 128 1 . . . . . 3.0 -1.0 5.0 1 2 129 1 . . . . . 3.0 -1.0 3.4 1 2 130 1 . . . . . 3.0 -1.0 6.0 1 2 131 1 . . . . . 3.0 -1.0 6.0 1 2 132 1 . . . . . 3.0 -1.0 8.0 1 2 133 1 . . . . . 3.0 -1.0 6.4 1 2 134 1 . . . . . 3.0 -1.0 5.4 1 2 135 1 . . . . . 3.0 -1.0 6.0 1 2 136 1 . . . . . 3.0 -1.0 6.0 1 2 137 1 . . . . . 3.0 -1.0 4.0 1 2 138 1 . . . . . 3.0 -1.0 5.0 1 2 139 1 . . . . . 3.0 -1.0 4.4 1 2 140 1 . . . . . 3.0 -1.0 4.4 1 2 141 1 . . . . . 3.0 -1.0 6.0 1 2 142 1 . . . . . 3.0 -1.0 5.4 1 2 143 1 . . . . . 3.0 -1.0 3.4 1 2 144 1 . . . . . 2.7 -1.0 3.7 1 2 145 1 . . . . . 2.7 -1.0 3.7 1 2 146 1 . . . . . 2.7 -1.0 4.4 1 2 147 1 . . . . . 2.7 -1.0 6.0 1 2 148 1 . . . . . 2.7 -1.0 6.0 1 2 149 1 . . . . . 2.7 -1.0 5.4 1 2 150 1 . . . . . 2.7 -1.0 5.4 1 2 151 1 . . . . . 2.7 -1.0 4.4 1 2 152 1 . . . . . 2.7 -1.0 6.0 1 2 153 1 . . . . . 2.7 -1.0 6.0 1 2 154 1 . . . . . 2.7 -1.0 6.0 1 2 155 1 . . . . . 3.0 -1.0 5.0 1 2 156 1 . . . . . 3.0 -1.0 4.4 1 2 157 1 . . . . . 3.0 -1.0 4.4 1 2 158 1 . . . . . 3.0 -1.0 6.0 1 2 159 1 . . . . . 3.0 -1.0 5.0 1 2 160 1 . . . . . 3.0 -1.0 3.4 1 2 161 1 . . . . . 3.0 -1.0 4.4 1 2 162 1 . . . . . 3.0 -1.0 5.0 1 2 163 1 . . . . . 2.7 -1.0 4.4 1 2 164 1 . . . . . 2.7 -1.0 3.7 1 2 165 1 . . . . . 2.7 -1.0 3.7 1 2 166 1 . . . . . 2.7 -1.0 4.4 1 2 167 1 . . . . . 2.7 -1.0 3.7 1 2 168 1 . . . . . 2.7 -1.0 3.7 1 2 169 1 . . . . . 2.7 -1.0 3.4 1 2 170 1 . . . . . 3.0 -1.0 6.4 1 2 171 1 . . . . . 3.0 -1.0 5.0 1 2 172 1 . . . . . 3.0 -1.0 5.0 1 2 173 1 . . . . . 3.0 -1.0 4.4 1 2 174 1 . . . . . 3.0 -1.0 4.4 1 2 175 1 . . . . . 3.0 -1.0 4.4 1 2 176 1 . . . . . 2.7 -1.0 2.7 1 2 177 1 . . . . . 2.7 -1.0 2.7 1 2 178 1 . . . . . 3.0 -1.0 5.0 1 2 179 1 . . . . . 3.0 -1.0 5.0 1 2 180 1 . . . . . 2.7 -1.0 2.7 1 2 181 1 . . . . . 2.7 -1.0 3.4 1 2 182 1 . . . . . 2.7 -1.0 3.4 1 2 183 1 . . . . . 2.7 -1.0 6.0 1 2 184 1 . . . . . 2.7 -1.0 3.7 1 2 185 1 . . . . . 3.0 -1.0 5.0 1 2 186 1 . . . . . 3.0 -1.0 3.4 1 2 187 1 . . . . . 3.0 -1.0 6.0 1 2 188 1 . . . . . 3.0 -1.0 6.0 1 2 189 1 . . . . . 3.0 -1.0 6.0 1 2 190 1 . . . . . 3.0 -1.0 6.0 1 2 191 1 . . . . . 2.7 -1.0 4.4 1 2 192 1 . . . . . 2.7 -1.0 5.4 1 2 193 1 . . . . . 2.7 -1.0 5.4 1 2 194 1 . . . . . 2.7 -1.0 3.4 1 2 195 1 . . . . . 2.7 -1.0 3.4 1 2 196 1 . . . . . 2.7 -1.0 4.4 1 2 197 1 . . . . . 3.0 -1.0 6.4 1 2 198 1 . . . . . 3.0 -1.0 7.0 1 2 199 1 . . . . . 3.0 -1.0 7.0 1 2 200 1 . . . . . 2.7 -1.0 3.7 1 2 201 1 . . . . . 3.0 -1.0 6.4 1 2 202 1 . . . . . 3.0 -1.0 6.5 1 2 203 1 . . . . . 3.0 -1.0 3.4 1 2 204 1 . . . . . 2.7 -1.0 3.4 1 2 205 1 . . . . . 2.7 -1.0 4.4 1 2 206 1 . . . . . 2.7 -1.0 4.4 1 2 207 1 . . . . . 2.7 -1.0 3.4 1 2 208 1 . . . . . 3.0 -1.0 6.0 1 2 209 1 . . . . . 3.0 -1.0 5.0 1 2 210 1 . . . . . 3.0 -1.0 3.4 1 2 211 1 . . . . . 3.0 -1.0 6.0 1 2 212 1 . . . . . 3.0 -1.0 5.0 1 2 213 1 . . . . . 2.7 -1.0 3.4 1 2 214 1 . . . . . 3.0 -1.0 5.0 1 2 215 1 . . . . . 3.0 -1.0 5.0 1 2 216 1 . . . . . 3.0 -1.0 7.0 1 2 stop_ save_ save_Discover_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 21 1 . . . 1 3 22 1 . . . 1 3 23 1 . . . 1 3 24 1 . . . 1 3 25 1 . . . 1 3 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 2 2 7 CYS O 1 28 CYS O 1 3 1 1 2 2 2 10 ASP H 1 31 ASP- HN 1 3 2 1 1 2 2 7 CYS O 1 28 CYS O 1 3 2 1 2 2 2 10 ASP N 1 31 ASP- N 1 3 3 1 1 2 2 8 GLY O 1 29 GLY O 1 3 3 1 2 2 2 11 LEU H 1 32 LEU HN 1 3 4 1 1 2 2 8 GLY O 1 29 GLY O 1 3 4 1 2 2 2 11 LEU N 1 32 LEU N 1 3 5 1 1 2 2 9 SER O 1 30 SER O 1 3 5 1 2 2 2 12 VAL H 1 33 VAL HN 1 3 6 1 1 2 2 9 SER O 1 30 SER O 1 3 6 1 2 2 2 12 VAL N 1 33 VAL N 1 3 7 1 1 2 2 8 GLY O 1 29 GLY O 1 3 7 1 2 2 2 12 VAL H 1 33 VAL HN 1 3 8 1 1 2 2 8 GLY O 1 29 GLY O 1 3 8 1 2 2 2 12 VAL N 1 33 VAL N 1 3 9 1 1 2 2 9 SER O 1 30 SER O 1 3 9 1 2 2 2 13 GLU H 1 34 GLU- HN 1 3 10 1 1 2 2 9 SER O 1 30 SER O 1 3 10 1 2 2 2 13 GLU N 1 34 GLU- N 1 3 11 1 1 2 2 10 ASP O 1 31 ASP- O 1 3 11 1 2 2 2 14 ALA H 1 35 ALA HN 1 3 12 1 1 2 2 10 ASP O 1 31 ASP- O 1 3 12 1 2 2 2 14 ALA N 1 35 ALA N 1 3 13 1 1 2 2 11 LEU O 1 32 LEU O 1 3 13 1 2 2 2 15 LEU H 1 36 LEU HN 1 3 14 1 1 2 2 11 LEU O 1 32 LEU O 1 3 14 1 2 2 2 15 LEU N 1 36 LEU N 1 3 15 1 1 2 2 12 VAL O 1 33 VAL O 1 3 15 1 2 2 2 16 TYR H 1 37 TYR HN 1 3 16 1 1 2 2 12 VAL O 1 33 VAL O 1 3 16 1 2 2 2 16 TYR N 1 37 TYR N 1 3 17 1 1 2 2 13 GLU O 1 34 GLU- O 1 3 17 1 2 2 2 17 LEU H 1 38 LEU HN 1 3 18 1 1 2 2 13 GLU O 1 34 GLU- O 1 3 18 1 2 2 2 17 LEU N 1 38 LEU N 1 3 19 1 1 2 2 14 ALA O 1 35 ALA O 1 3 19 1 2 2 2 18 VAL H 1 39 VAL HN 1 3 20 1 1 2 2 14 ALA O 1 35 ALA O 1 3 20 1 2 2 2 18 VAL N 1 39 VAL N 1 3 21 1 1 2 2 15 LEU O 1 36 LEU O 1 3 21 1 2 2 2 19 CYS H 1 40 CYS HN 1 3 22 1 1 2 2 15 LEU O 1 36 LEU O 1 3 22 1 2 2 2 19 CYS N 1 40 CYS N 1 3 23 1 1 1 1 1 GLY N 1 44 GLY N 1 3 23 1 2 2 2 20 GLY O 1 41 GLY O 1 3 24 1 1 2 2 16 TYR O 1 37 TYR O 1 3 24 1 2 2 2 20 GLY H 1 41 GLY HN 1 3 25 1 1 2 2 16 TYR O 1 37 TYR O 1 3 25 1 2 2 2 20 GLY N 1 41 GLY N 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 2.3 2.6 1 3 2 1 . . . . . . 2.7 3.3 1 3 3 1 . . . . . . 2.3 2.6 1 3 4 1 . . . . . . 2.7 3.3 1 3 5 1 . . . . . . 2.3 2.6 1 3 6 1 . . . . . . 2.7 3.3 1 3 7 1 . . . . . . 2.3 2.6 1 3 8 1 . . . . . . 2.7 3.3 1 3 9 1 . . . . . . 2.3 2.6 1 3 10 1 . . . . . . 2.7 3.3 1 3 11 1 . . . . . . 2.3 2.6 1 3 12 1 . . . . . . 2.7 3.3 1 3 13 1 . . . . . . 2.3 2.6 1 3 14 1 . . . . . . 2.7 3.3 1 3 15 1 . . . . . . 2.3 2.6 1 3 16 1 . . . . . . 2.7 3.3 1 3 17 1 . . . . . . 2.3 2.6 1 3 18 1 . . . . . . 2.7 3.3 1 3 19 1 . . . . . . 2.3 2.6 1 3 20 1 . . . . . . 2.7 3.3 1 3 21 1 . . . . . . 2.3 2.6 1 3 22 1 . . . . . . 2.7 3.3 1 3 23 1 . . . . . . 2.7 3.3 1 3 24 1 . . . . . . 2.3 2.6 1 3 25 1 . . . . . . 2.7 3.3 1 3 stop_ save_ save_Discover_dihedral_8 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 2 2 4 GLN C 2 2 5 HIS N 2 2 5 HIS CA 2 2 5 HIS C -89.99999 -40.0 1 25 GLN C 1 26 HIS N 1 26 HIS CA 1 26 HIS C 1 1 2 . 2 2 9 SER C 2 2 10 ASP N 2 2 10 ASP CA 2 2 10 ASP C -89.99999 -40.0 1 30 SER C 1 31 ASP- N 1 31 ASP- CA 1 31 ASP- C 1 1 3 . 2 2 10 ASP C 2 2 11 LEU N 2 2 11 LEU CA 2 2 11 LEU C -89.99999 -40.0 1 31 ASP- C 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 1 4 . 2 2 11 LEU C 2 2 12 VAL N 2 2 12 VAL CA 2 2 12 VAL C -89.99999 -40.0 1 32 LEU C 1 33 VAL N 1 33 VAL CA 1 33 VAL C 1 1 5 . 2 2 12 VAL C 2 2 13 GLU N 2 2 13 GLU CA 2 2 13 GLU C -89.99999 -40.0 1 33 VAL C 1 34 GLU- N 1 34 GLU- CA 1 34 GLU- C 1 1 6 . 2 2 13 GLU C 2 2 14 ALA N 2 2 14 ALA CA 2 2 14 ALA C -89.99999 -40.0 1 34 GLU- C 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 1 7 . 2 2 14 ALA C 2 2 15 LEU N 2 2 15 LEU CA 2 2 15 LEU C -89.99999 -40.0 1 35 ALA C 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 1 8 . 2 2 15 LEU C 2 2 16 TYR N 2 2 16 TYR CA 2 2 16 TYR C -89.99999 -40.0 1 36 LEU C 1 37 TYR N 1 37 TYR CA 1 37 TYR C 1 1 9 . 2 2 16 TYR C 2 2 17 LEU N 2 2 17 LEU CA 2 2 17 LEU C -89.99999 -40.0 1 37 TYR C 1 38 LEU N 1 38 LEU CA 1 38 LEU C 1 1 10 . 2 2 17 LEU C 2 2 18 VAL N 2 2 18 VAL CA 2 2 18 VAL C -89.99999 -40.0 1 38 LEU C 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 1 11 . 2 2 1 PHE C 2 2 2 VAL N 2 2 2 VAL CA 2 2 2 VAL C -160.0 -80.0 1 22 PHEN C 1 23 VAL N 1 23 VAL CA 1 23 VAL C 1 1 12 . 2 2 3 ASN C 2 2 4 GLN N 2 2 4 GLN CA 2 2 4 GLN C -160.0 -80.0 1 24 ASN C 1 25 GLN N 1 25 GLN CA 1 25 GLN C 1 1 13 . 2 2 5 HIS C 2 2 6 LEU N 2 2 6 LEU CA 2 2 6 LEU C -160.0 -80.0 1 26 HIS C 1 27 LEU N 1 27 LEU CA 1 27 LEU C 1 1 14 . 1 1 2 ILE C 1 1 3 ABA N 1 1 3 ABA CA 1 1 3 ABA C -160.0 -80.0 1 45 PHE C 1 46 PHE N 1 46 PHE CA 1 46 PHE C 1 1 15 . 1 1 4 GLU C 1 1 5 GLN N 1 1 5 GLN CA 1 1 5 GLN C -160.0 -80.0 1 47 TYR C 1 48 THR N 1 48 THR CA 1 48 THR C 1 1 16 . 2 2 18 VAL N 2 2 18 VAL CA 2 2 18 VAL CB 2 2 18 VAL CG1 -100.0 -20.0 1 39 VAL N 1 39 VAL CA 1 39 VAL CB 1 39 VAL CG1 1 1 17 . 2 2 5 HIS N 2 2 5 HIS CA 2 2 5 HIS CB 2 2 5 HIS CG -100.0 -20.0 1 26 HIS N 1 26 HIS CA 1 26 HIS CB 1 26 HIS CG 1 1 18 . 2 2 10 ASP N 2 2 10 ASP CA 2 2 10 ASP CB 2 2 10 ASP CG -100.0 -20.0 1 31 ASP- N 1 31 ASP- CA 1 31 ASP- CB 1 31 ASP- CG 1 1 19 . 2 2 11 LEU N 2 2 11 LEU CA 2 2 11 LEU CB 2 2 11 LEU CG 140.0 220.0 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 1 20 . 2 2 12 VAL N 2 2 12 VAL CA 2 2 12 VAL CB 2 2 12 VAL CG1 -100.0 -20.0 1 33 VAL N 1 33 VAL CA 1 33 VAL CB 1 33 VAL CG1 1 1 21 . 2 2 19 CYS N 2 2 19 CYS CA 2 2 19 CYS CB 2 2 19 CYS SG -100.0 -20.0 1 40 CYS N 1 40 CYS CA 1 40 CYS CB 1 40 CYS SG 1 1 22 . 2 2 4 GLN N 2 2 4 GLN CA 2 2 4 GLN CB 2 2 4 GLN CG 140.0 220.0 1 25 GLN N 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG 1 1 23 . 2 2 17 LEU N 2 2 17 LEU CA 2 2 17 LEU CB 2 2 17 LEU CG 140.0 220.0 1 38 LEU N 1 38 LEU CA 1 38 LEU CB 1 38 LEU CG 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 0.878 -3.978 8.454 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 0.247 -4.068 9.804 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -0.875 -5.787 9.286 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -1.795 -4.572 10.037 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -0.746 -5.537 10.961 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -0.103 -3.186 9.585 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 0.908 -4.068 10.767 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -0.882 -5.071 10.041 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 2.056 -4.229 8.291 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ILE C C 1.869 -2.546 6.086 1.00 . A A . 2 ILE C 1 1 1 11 1 1 2 ILE CA C 0.692 -3.519 6.080 1.00 . A A . 2 ILE CA 1 1 1 12 1 1 2 ILE CB C -0.376 -3.001 5.111 1.00 . A A . 2 ILE CB 1 1 1 13 1 1 2 ILE CD1 C -0.517 -1.764 2.910 1.00 . A A . 2 ILE CD1 1 1 1 14 1 1 2 ILE CG1 C 0.254 -2.818 3.716 1.00 . A A . 2 ILE CG1 1 1 1 15 1 1 2 ILE CG2 C -0.916 -1.665 5.630 1.00 . A A . 2 ILE CG2 1 1 1 16 1 1 2 ILE H H -0.830 -3.426 7.603 1.00 . A A . 2 ILE H 1 1 1 17 1 1 2 ILE HA H 1.031 -4.486 5.759 1.00 . A A . 2 ILE HA 1 1 1 18 1 1 2 ILE HB H -1.185 -3.716 5.052 1.00 . A A . 2 ILE HB 1 1 1 19 1 1 2 ILE HD11 H -0.274 -0.779 3.281 1.00 . A A . 2 ILE HD11 1 1 1 20 1 1 2 ILE HD12 H -1.578 -1.936 3.014 1.00 . A A . 2 ILE HD12 1 1 1 21 1 1 2 ILE HD13 H -0.241 -1.834 1.869 1.00 . A A . 2 ILE HD13 1 1 1 22 1 1 2 ILE HG12 H 1.280 -2.501 3.825 1.00 . A A . 2 ILE HG12 1 1 1 23 1 1 2 ILE HG13 H 0.226 -3.759 3.187 1.00 . A A . 2 ILE HG13 1 1 1 24 1 1 2 ILE HG21 H -1.080 -1.732 6.696 1.00 . A A . 2 ILE HG21 1 1 1 25 1 1 2 ILE HG22 H -1.848 -1.437 5.136 1.00 . A A . 2 ILE HG22 1 1 1 26 1 1 2 ILE HG23 H -0.199 -0.883 5.425 1.00 . A A . 2 ILE HG23 1 1 1 27 1 1 2 ILE N N 0.118 -3.622 7.452 1.00 . A A . 2 ILE N 1 1 1 28 1 1 2 ILE O O 2.877 -2.768 5.449 1.00 . A A . 2 ILE O 1 1 1 29 1 1 3 ABA C C 4.111 -1.100 7.371 1.00 . A A . 3 ABA C 1 1 1 30 1 1 3 ABA CA C 2.831 -0.460 6.844 1.00 . A A . 3 ABA CA 1 1 1 31 1 1 3 ABA CB C 2.411 0.679 7.768 1.00 . A A . 3 ABA CB 1 1 1 32 1 1 3 ABA CG C 1.658 1.739 6.964 1.00 . A A . 3 ABA CG 1 1 1 33 1 1 3 ABA H H 0.917 -1.313 7.293 1.00 . A A . 3 ABA H 1 1 1 34 1 1 3 ABA HA H 3.007 -0.075 5.858 1.00 . A A . 3 ABA HA 1 1 1 35 1 1 3 ABA HB2 H 1.769 0.291 8.546 1.00 . A A . 3 ABA HB2 1 1 1 36 1 1 3 ABA HB3 H 3.284 1.119 8.212 1.00 . A A . 3 ABA HB3 1 1 1 37 1 1 3 ABA HG1 H 0.640 1.413 6.804 1.00 . A A . 3 ABA HG1 1 1 1 38 1 1 3 ABA HG2 H 2.144 1.880 6.010 1.00 . A A . 3 ABA HG2 1 1 1 39 1 1 3 ABA HG3 H 1.656 2.670 7.509 1.00 . A A . 3 ABA HG3 1 1 1 40 1 1 3 ABA N N 1.740 -1.467 6.795 1.00 . A A . 3 ABA N 1 1 1 41 1 1 3 ABA O O 5.189 -0.863 6.877 1.00 . A A . 3 ABA O 1 1 1 42 1 1 4 GLU C C 5.853 -3.442 7.859 1.00 . A A . 4 GLU C 1 1 1 43 1 1 4 GLU CA C 5.203 -2.562 8.937 1.00 . A A . 4 GLU CA 1 1 1 44 1 1 4 GLU CB C 4.759 -3.378 10.158 1.00 . A A . 4 GLU CB 1 1 1 45 1 1 4 GLU CD C 6.939 -4.495 10.662 1.00 . A A . 4 GLU CD 1 1 1 46 1 1 4 GLU CG C 5.487 -4.724 10.241 1.00 . A A . 4 GLU CG 1 1 1 47 1 1 4 GLU H H 3.118 -2.086 8.754 1.00 . A A . 4 GLU H 1 1 1 48 1 1 4 GLU HA H 5.906 -1.804 9.250 1.00 . A A . 4 GLU HA 1 1 1 49 1 1 4 GLU HB2 H 4.965 -2.810 11.052 1.00 . A A . 4 GLU HB2 1 1 1 50 1 1 4 GLU HB3 H 3.698 -3.550 10.086 1.00 . A A . 4 GLU HB3 1 1 1 51 1 1 4 GLU HG2 H 4.995 -5.348 10.972 1.00 . A A . 4 GLU HG2 1 1 1 52 1 1 4 GLU HG3 H 5.463 -5.211 9.279 1.00 . A A . 4 GLU HG3 1 1 1 53 1 1 4 GLU N N 3.998 -1.908 8.371 1.00 . A A . 4 GLU N 1 1 1 54 1 1 4 GLU O O 7.052 -3.638 7.847 1.00 . A A . 4 GLU O 1 1 1 55 1 1 4 GLU OE1 O 7.533 -3.546 10.179 1.00 . A A . 4 GLU OE1 1 1 1 56 1 1 4 GLU OE2 O 7.431 -5.273 11.462 1.00 . A A . 4 GLU OE2 1 1 1 57 1 1 5 GLN C C 5.831 -3.969 4.607 1.00 . A A . 5 GLN C 1 1 1 58 1 1 5 GLN CA C 5.655 -4.814 5.871 1.00 . A A . 5 GLN CA 1 1 1 59 1 1 5 GLN CB C 4.717 -5.988 5.585 1.00 . A A . 5 GLN CB 1 1 1 60 1 1 5 GLN CD C 4.893 -8.462 5.894 1.00 . A A . 5 GLN CD 1 1 1 61 1 1 5 GLN CG C 5.546 -7.233 5.259 1.00 . A A . 5 GLN CG 1 1 1 62 1 1 5 GLN H H 4.110 -3.788 6.970 1.00 . A A . 5 GLN H 1 1 1 63 1 1 5 GLN HA H 6.617 -5.190 6.189 1.00 . A A . 5 GLN HA 1 1 1 64 1 1 5 GLN HB2 H 4.104 -6.179 6.454 1.00 . A A . 5 GLN HB2 1 1 1 65 1 1 5 GLN HB3 H 4.085 -5.748 4.744 1.00 . A A . 5 GLN HB3 1 1 1 66 1 1 5 GLN HE21 H 4.942 -9.523 4.218 1.00 . A A . 5 GLN HE21 1 1 1 67 1 1 5 GLN HE22 H 4.264 -10.315 5.558 1.00 . A A . 5 GLN HE22 1 1 1 68 1 1 5 GLN HG2 H 5.594 -7.364 4.188 1.00 . A A . 5 GLN HG2 1 1 1 69 1 1 5 GLN HG3 H 6.544 -7.115 5.654 1.00 . A A . 5 GLN HG3 1 1 1 70 1 1 5 GLN N N 5.074 -3.963 6.949 1.00 . A A . 5 GLN N 1 1 1 71 1 1 5 GLN NE2 N 4.682 -9.522 5.163 1.00 . A A . 5 GLN NE2 1 1 1 72 1 1 5 GLN O O 6.632 -4.274 3.746 1.00 . A A . 5 GLN O 1 1 1 73 1 1 5 GLN OE1 O 4.572 -8.458 7.066 1.00 . A A . 5 GLN OE1 1 1 1 74 1 1 6 CYS C C 5.968 -0.736 3.680 1.00 . A A . 6 CYS C 1 1 1 75 1 1 6 CYS CA C 5.209 -2.010 3.315 1.00 . A A . 6 CYS CA 1 1 1 76 1 1 6 CYS CB C 3.810 -1.671 2.803 1.00 . A A . 6 CYS CB 1 1 1 77 1 1 6 CYS H H 4.463 -2.670 5.216 1.00 . A A . 6 CYS H 1 1 1 78 1 1 6 CYS HA H 5.753 -2.531 2.534 1.00 . A A . 6 CYS HA 1 1 1 79 1 1 6 CYS HB2 H 3.077 -1.968 3.530 1.00 . A A . 6 CYS HB2 1 1 1 80 1 1 6 CYS HB3 H 3.726 -0.623 2.628 1.00 . A A . 6 CYS HB3 1 1 1 81 1 1 6 CYS N N 5.094 -2.899 4.502 1.00 . A A . 6 CYS N 1 1 1 82 1 1 6 CYS O O 6.109 0.167 2.879 1.00 . A A . 6 CYS O 1 1 1 83 1 1 6 CYS SG S 3.534 -2.569 1.270 1.00 . A A . 6 CYS SG 1 1 1 84 1 1 7 CYS C C 8.636 0.097 5.759 1.00 . A A . 7 CYS C 1 1 1 85 1 1 7 CYS CA C 7.246 0.536 5.290 1.00 . A A . 7 CYS CA 1 1 1 86 1 1 7 CYS CB C 6.521 1.254 6.428 1.00 . A A . 7 CYS CB 1 1 1 87 1 1 7 CYS H H 6.357 -1.412 5.497 1.00 . A A . 7 CYS H 1 1 1 88 1 1 7 CYS HA H 7.346 1.204 4.450 1.00 . A A . 7 CYS HA 1 1 1 89 1 1 7 CYS HB2 H 5.475 1.369 6.183 1.00 . A A . 7 CYS HB2 1 1 1 90 1 1 7 CYS HB3 H 6.606 0.670 7.320 1.00 . A A . 7 CYS HB3 1 1 1 91 1 1 7 CYS N N 6.475 -0.666 4.875 1.00 . A A . 7 CYS N 1 1 1 92 1 1 7 CYS O O 9.589 0.848 5.692 1.00 . A A . 7 CYS O 1 1 1 93 1 1 7 CYS SG S 7.282 2.879 6.692 1.00 . A A . 7 CYS SG 1 1 1 94 1 1 8 THR C C 10.661 -2.568 5.630 1.00 . A A . 8 THR C 1 1 1 95 1 1 8 THR CA C 10.091 -1.613 6.683 1.00 . A A . 8 THR CA 1 1 1 96 1 1 8 THR CB C 9.933 -2.355 8.015 1.00 . A A . 8 THR CB 1 1 1 97 1 1 8 THR CG2 C 9.001 -1.570 8.942 1.00 . A A . 8 THR CG2 1 1 1 98 1 1 8 THR H H 7.985 -1.716 6.262 1.00 . A A . 8 THR H 1 1 1 99 1 1 8 THR HA H 10.762 -0.776 6.811 1.00 . A A . 8 THR HA 1 1 1 100 1 1 8 THR HB H 10.899 -2.456 8.486 1.00 . A A . 8 THR HB 1 1 1 101 1 1 8 THR HG1 H 8.672 -3.546 7.137 1.00 . A A . 8 THR HG1 1 1 1 102 1 1 8 THR HG21 H 9.039 -0.521 8.690 1.00 . A A . 8 THR HG21 1 1 1 103 1 1 8 THR HG22 H 9.315 -1.706 9.967 1.00 . A A . 8 THR HG22 1 1 1 104 1 1 8 THR HG23 H 7.990 -1.932 8.825 1.00 . A A . 8 THR HG23 1 1 1 105 1 1 8 THR N N 8.762 -1.121 6.223 1.00 . A A . 8 THR N 1 1 1 106 1 1 8 THR O O 11.821 -2.928 5.664 1.00 . A A . 8 THR O 1 1 1 107 1 1 8 THR OG1 O 9.386 -3.643 7.772 1.00 . A A . 8 THR OG1 1 1 1 108 1 1 9 SER C C 10.077 -3.260 2.251 1.00 . A A . 9 SER C 1 1 1 109 1 1 9 SER CA C 10.336 -3.901 3.625 1.00 . A A . 9 SER CA 1 1 1 110 1 1 9 SER CB C 9.608 -5.246 3.738 1.00 . A A . 9 SER CB 1 1 1 111 1 1 9 SER H H 8.918 -2.665 4.682 1.00 . A A . 9 SER H 1 1 1 112 1 1 9 SER HA H 11.398 -4.057 3.749 1.00 . A A . 9 SER HA 1 1 1 113 1 1 9 SER HB2 H 8.573 -5.125 3.467 1.00 . A A . 9 SER HB2 1 1 1 114 1 1 9 SER HB3 H 10.071 -5.962 3.069 1.00 . A A . 9 SER HB3 1 1 1 115 1 1 9 SER HG H 10.608 -5.716 5.341 1.00 . A A . 9 SER HG 1 1 1 116 1 1 9 SER N N 9.849 -2.975 4.690 1.00 . A A . 9 SER N 1 1 1 117 1 1 9 SER O O 10.656 -2.244 1.923 1.00 . A A . 9 SER O 1 1 1 118 1 1 9 SER OG O 9.685 -5.714 5.078 1.00 . A A . 9 SER OG 1 1 1 119 1 1 10 ILE C C 7.560 -3.681 -0.376 1.00 . A A . 10 ILE C 1 1 1 120 1 1 10 ILE CA C 8.945 -3.233 0.105 1.00 . A A . 10 ILE CA 1 1 1 121 1 1 10 ILE CB C 10.029 -3.697 -0.886 1.00 . A A . 10 ILE CB 1 1 1 122 1 1 10 ILE CD1 C 12.332 -3.209 -0.051 1.00 . A A . 10 ILE CD1 1 1 1 123 1 1 10 ILE CG1 C 11.169 -2.684 -0.892 1.00 . A A . 10 ILE CG1 1 1 1 124 1 1 10 ILE CG2 C 9.460 -3.813 -2.303 1.00 . A A . 10 ILE CG2 1 1 1 125 1 1 10 ILE H H 8.754 -4.648 1.706 1.00 . A A . 10 ILE H 1 1 1 126 1 1 10 ILE HA H 8.967 -2.156 0.181 1.00 . A A . 10 ILE HA 1 1 1 127 1 1 10 ILE HB H 10.409 -4.657 -0.576 1.00 . A A . 10 ILE HB 1 1 1 128 1 1 10 ILE HD11 H 13.049 -2.416 0.105 1.00 . A A . 10 ILE HD11 1 1 1 129 1 1 10 ILE HD12 H 12.808 -4.029 -0.568 1.00 . A A . 10 ILE HD12 1 1 1 130 1 1 10 ILE HD13 H 11.961 -3.552 0.903 1.00 . A A . 10 ILE HD13 1 1 1 131 1 1 10 ILE HG12 H 11.499 -2.524 -1.906 1.00 . A A . 10 ILE HG12 1 1 1 132 1 1 10 ILE HG13 H 10.818 -1.754 -0.474 1.00 . A A . 10 ILE HG13 1 1 1 133 1 1 10 ILE HG21 H 10.204 -4.243 -2.954 1.00 . A A . 10 ILE HG21 1 1 1 134 1 1 10 ILE HG22 H 9.190 -2.832 -2.659 1.00 . A A . 10 ILE HG22 1 1 1 135 1 1 10 ILE HG23 H 8.584 -4.446 -2.288 1.00 . A A . 10 ILE HG23 1 1 1 136 1 1 10 ILE N N 9.218 -3.832 1.441 1.00 . A A . 10 ILE N 1 1 1 137 1 1 10 ILE O O 6.950 -4.565 0.192 1.00 . A A . 10 ILE O 1 1 1 138 1 1 11 CYS C C 5.744 -3.552 -3.478 1.00 . A A . 11 CYS C 1 1 1 139 1 1 11 CYS CA C 5.727 -3.495 -1.954 1.00 . A A . 11 CYS CA 1 1 1 140 1 1 11 CYS CB C 4.660 -2.495 -1.528 1.00 . A A . 11 CYS CB 1 1 1 141 1 1 11 CYS H H 7.580 -2.372 -1.880 1.00 . A A . 11 CYS H 1 1 1 142 1 1 11 CYS HA H 5.471 -4.466 -1.565 1.00 . A A . 11 CYS HA 1 1 1 143 1 1 11 CYS HB2 H 4.637 -1.676 -2.228 1.00 . A A . 11 CYS HB2 1 1 1 144 1 1 11 CYS HB3 H 3.698 -2.983 -1.515 1.00 . A A . 11 CYS HB3 1 1 1 145 1 1 11 CYS N N 7.066 -3.084 -1.431 1.00 . A A . 11 CYS N 1 1 1 146 1 1 11 CYS O O 6.626 -3.029 -4.129 1.00 . A A . 11 CYS O 1 1 1 147 1 1 11 CYS SG S 5.039 -1.875 0.119 1.00 . A A . 11 CYS SG 1 1 1 148 1 1 12 SER C C 3.282 -3.672 -5.937 1.00 . A A . 12 SER C 1 1 1 149 1 1 12 SER CA C 4.630 -4.244 -5.523 1.00 . A A . 12 SER CA 1 1 1 150 1 1 12 SER CB C 4.765 -5.692 -5.999 1.00 . A A . 12 SER CB 1 1 1 151 1 1 12 SER H H 4.038 -4.546 -3.482 1.00 . A A . 12 SER H 1 1 1 152 1 1 12 SER HA H 5.411 -3.648 -5.974 1.00 . A A . 12 SER HA 1 1 1 153 1 1 12 SER HB2 H 4.030 -5.890 -6.761 1.00 . A A . 12 SER HB2 1 1 1 154 1 1 12 SER HB3 H 5.752 -5.839 -6.412 1.00 . A A . 12 SER HB3 1 1 1 155 1 1 12 SER HG H 5.267 -7.221 -4.905 1.00 . A A . 12 SER HG 1 1 1 156 1 1 12 SER N N 4.741 -4.162 -4.042 1.00 . A A . 12 SER N 1 1 1 157 1 1 12 SER O O 2.317 -3.711 -5.200 1.00 . A A . 12 SER O 1 1 1 158 1 1 12 SER OG O 4.551 -6.579 -4.910 1.00 . A A . 12 SER OG 1 1 1 159 1 1 13 LEU C C 0.797 -3.475 -7.526 1.00 . A A . 13 LEU C 1 1 1 160 1 1 13 LEU CA C 1.962 -2.488 -7.581 1.00 . A A . 13 LEU CA 1 1 1 161 1 1 13 LEU CB C 2.162 -2.016 -9.018 1.00 . A A . 13 LEU CB 1 1 1 162 1 1 13 LEU CD1 C 1.973 -3.031 -11.287 1.00 . A A . 13 LEU CD1 1 1 1 163 1 1 13 LEU CD2 C 4.053 -3.359 -9.954 1.00 . A A . 13 LEU CD2 1 1 1 164 1 1 13 LEU CG C 2.531 -3.219 -9.879 1.00 . A A . 13 LEU CG 1 1 1 165 1 1 13 LEU H H 4.029 -3.078 -7.658 1.00 . A A . 13 LEU H 1 1 1 166 1 1 13 LEU HA H 1.729 -1.646 -6.959 1.00 . A A . 13 LEU HA 1 1 1 167 1 1 13 LEU HB2 H 1.247 -1.571 -9.383 1.00 . A A . 13 LEU HB2 1 1 1 168 1 1 13 LEU HB3 H 2.959 -1.289 -9.054 1.00 . A A . 13 LEU HB3 1 1 1 169 1 1 13 LEU HD11 H 1.985 -3.977 -11.806 1.00 . A A . 13 LEU HD11 1 1 1 170 1 1 13 LEU HD12 H 2.585 -2.319 -11.821 1.00 . A A . 13 LEU HD12 1 1 1 171 1 1 13 LEU HD13 H 0.960 -2.664 -11.226 1.00 . A A . 13 LEU HD13 1 1 1 172 1 1 13 LEU HD21 H 4.513 -2.406 -9.736 1.00 . A A . 13 LEU HD21 1 1 1 173 1 1 13 LEU HD22 H 4.337 -3.677 -10.946 1.00 . A A . 13 LEU HD22 1 1 1 174 1 1 13 LEU HD23 H 4.384 -4.092 -9.232 1.00 . A A . 13 LEU HD23 1 1 1 175 1 1 13 LEU HG H 2.107 -4.108 -9.438 1.00 . A A . 13 LEU HG 1 1 1 176 1 1 13 LEU N N 3.225 -3.111 -7.101 1.00 . A A . 13 LEU N 1 1 1 177 1 1 13 LEU O O -0.353 -3.085 -7.592 1.00 . A A . 13 LEU O 1 1 1 178 1 1 14 TYR C C -0.253 -6.053 -5.853 1.00 . A A . 14 TYR C 1 1 1 179 1 1 14 TYR CA C -0.083 -5.690 -7.302 1.00 . A A . 14 TYR CA 1 1 1 180 1 1 14 TYR CB C 0.212 -6.936 -8.138 1.00 . A A . 14 TYR CB 1 1 1 181 1 1 14 TYR CD1 C -1.983 -7.456 -9.266 1.00 . A A . 14 TYR CD1 1 1 1 182 1 1 14 TYR CD2 C -1.268 -8.846 -7.409 1.00 . A A . 14 TYR CD2 1 1 1 183 1 1 14 TYR CE1 C -3.146 -8.226 -9.395 1.00 . A A . 14 TYR CE1 1 1 1 184 1 1 14 TYR CE2 C -2.432 -9.616 -7.538 1.00 . A A . 14 TYR CE2 1 1 1 185 1 1 14 TYR CG C -1.043 -7.765 -8.273 1.00 . A A . 14 TYR CG 1 1 1 186 1 1 14 TYR CZ C -3.370 -9.306 -8.531 1.00 . A A . 14 TYR CZ 1 1 1 187 1 1 14 TYR H H 1.980 -5.061 -7.285 1.00 . A A . 14 TYR H 1 1 1 188 1 1 14 TYR HA H -0.977 -5.202 -7.648 1.00 . A A . 14 TYR HA 1 1 1 189 1 1 14 TYR HB2 H 0.554 -6.637 -9.118 1.00 . A A . 14 TYR HB2 1 1 1 190 1 1 14 TYR HB3 H 0.979 -7.520 -7.653 1.00 . A A . 14 TYR HB3 1 1 1 191 1 1 14 TYR HD1 H -1.810 -6.623 -9.931 1.00 . A A . 14 TYR HD1 1 1 1 192 1 1 14 TYR HD2 H -0.545 -9.085 -6.643 1.00 . A A . 14 TYR HD2 1 1 1 193 1 1 14 TYR HE1 H -3.870 -7.987 -10.160 1.00 . A A . 14 TYR HE1 1 1 1 194 1 1 14 TYR HE2 H -2.605 -10.449 -6.873 1.00 . A A . 14 TYR HE2 1 1 1 195 1 1 14 TYR HH H -4.466 -10.786 -8.026 1.00 . A A . 14 TYR HH 1 1 1 196 1 1 14 TYR N N 1.054 -4.740 -7.377 1.00 . A A . 14 TYR N 1 1 1 197 1 1 14 TYR O O -1.345 -6.236 -5.354 1.00 . A A . 14 TYR O 1 1 1 198 1 1 14 TYR OH O -4.515 -10.066 -8.659 1.00 . A A . 14 TYR OH 1 1 1 199 1 1 15 GLN C C 0.055 -5.226 -3.078 1.00 . A A . 15 GLN C 1 1 1 200 1 1 15 GLN CA C 0.786 -6.384 -3.734 1.00 . A A . 15 GLN CA 1 1 1 201 1 1 15 GLN CB C 2.215 -6.436 -3.234 1.00 . A A . 15 GLN CB 1 1 1 202 1 1 15 GLN CD C 3.188 -8.089 -1.633 1.00 . A A . 15 GLN CD 1 1 1 203 1 1 15 GLN CG C 2.645 -7.888 -3.049 1.00 . A A . 15 GLN CG 1 1 1 204 1 1 15 GLN H H 1.691 -5.907 -5.601 1.00 . A A . 15 GLN H 1 1 1 205 1 1 15 GLN HA H 0.278 -7.316 -3.542 1.00 . A A . 15 GLN HA 1 1 1 206 1 1 15 GLN HB2 H 2.848 -5.963 -3.969 1.00 . A A . 15 GLN HB2 1 1 1 207 1 1 15 GLN HB3 H 2.288 -5.909 -2.302 1.00 . A A . 15 GLN HB3 1 1 1 208 1 1 15 GLN HE21 H 5.051 -8.407 -2.244 1.00 . A A . 15 GLN HE21 1 1 1 209 1 1 15 GLN HE22 H 4.816 -8.477 -0.564 1.00 . A A . 15 GLN HE22 1 1 1 210 1 1 15 GLN HG2 H 1.795 -8.534 -3.206 1.00 . A A . 15 GLN HG2 1 1 1 211 1 1 15 GLN HG3 H 3.416 -8.124 -3.766 1.00 . A A . 15 GLN HG3 1 1 1 212 1 1 15 GLN N N 0.833 -6.101 -5.169 1.00 . A A . 15 GLN N 1 1 1 213 1 1 15 GLN NE2 N 4.457 -8.346 -1.466 1.00 . A A . 15 GLN NE2 1 1 1 214 1 1 15 GLN O O -0.671 -5.385 -2.116 1.00 . A A . 15 GLN O 1 1 1 215 1 1 15 GLN OE1 O 2.452 -8.015 -0.670 1.00 . A A . 15 GLN OE1 1 1 1 216 1 1 16 LEU C C -1.867 -2.844 -3.642 1.00 . A A . 16 LEU C 1 1 1 217 1 1 16 LEU CA C -0.464 -2.872 -3.070 1.00 . A A . 16 LEU CA 1 1 1 218 1 1 16 LEU CB C 0.317 -1.631 -3.472 1.00 . A A . 16 LEU CB 1 1 1 219 1 1 16 LEU CD1 C 2.462 -0.412 -3.054 1.00 . A A . 16 LEU CD1 1 1 1 220 1 1 16 LEU CD2 C 1.535 -1.947 -1.319 1.00 . A A . 16 LEU CD2 1 1 1 221 1 1 16 LEU CG C 1.698 -1.709 -2.822 1.00 . A A . 16 LEU CG 1 1 1 222 1 1 16 LEU H H 0.791 -3.951 -4.424 1.00 . A A . 16 LEU H 1 1 1 223 1 1 16 LEU HA H -0.509 -2.945 -1.993 1.00 . A A . 16 LEU HA 1 1 1 224 1 1 16 LEU HB2 H 0.415 -1.593 -4.546 1.00 . A A . 16 LEU HB2 1 1 1 225 1 1 16 LEU HB3 H -0.196 -0.757 -3.133 1.00 . A A . 16 LEU HB3 1 1 1 226 1 1 16 LEU HD11 H 3.225 -0.307 -2.296 1.00 . A A . 16 LEU HD11 1 1 1 227 1 1 16 LEU HD12 H 1.780 0.420 -3.000 1.00 . A A . 16 LEU HD12 1 1 1 228 1 1 16 LEU HD13 H 2.925 -0.441 -4.029 1.00 . A A . 16 LEU HD13 1 1 1 229 1 1 16 LEU HD21 H 1.726 -2.987 -1.098 1.00 . A A . 16 LEU HD21 1 1 1 230 1 1 16 LEU HD22 H 0.528 -1.695 -1.022 1.00 . A A . 16 LEU HD22 1 1 1 231 1 1 16 LEU HD23 H 2.236 -1.330 -0.778 1.00 . A A . 16 LEU HD23 1 1 1 232 1 1 16 LEU HG H 2.251 -2.528 -3.253 1.00 . A A . 16 LEU HG 1 1 1 233 1 1 16 LEU N N 0.224 -4.052 -3.624 1.00 . A A . 16 LEU N 1 1 1 234 1 1 16 LEU O O -2.786 -2.299 -3.063 1.00 . A A . 16 LEU O 1 1 1 235 1 1 17 GLU C C -4.219 -4.516 -4.583 1.00 . A A . 17 GLU C 1 1 1 236 1 1 17 GLU CA C -3.376 -3.521 -5.383 1.00 . A A . 17 GLU CA 1 1 1 237 1 1 17 GLU CB C -3.232 -4.014 -6.823 1.00 . A A . 17 GLU CB 1 1 1 238 1 1 17 GLU CD C -4.445 -4.443 -8.965 1.00 . A A . 17 GLU CD 1 1 1 239 1 1 17 GLU CG C -4.603 -4.028 -7.501 1.00 . A A . 17 GLU CG 1 1 1 240 1 1 17 GLU H H -1.283 -3.913 -5.207 1.00 . A A . 17 GLU H 1 1 1 241 1 1 17 GLU HA H -3.829 -2.544 -5.369 1.00 . A A . 17 GLU HA 1 1 1 242 1 1 17 GLU HB2 H -2.564 -3.359 -7.360 1.00 . A A . 17 GLU HB2 1 1 1 243 1 1 17 GLU HB3 H -2.823 -5.012 -6.820 1.00 . A A . 17 GLU HB3 1 1 1 244 1 1 17 GLU HG2 H -5.247 -4.732 -6.994 1.00 . A A . 17 GLU HG2 1 1 1 245 1 1 17 GLU HG3 H -5.039 -3.041 -7.453 1.00 . A A . 17 GLU HG3 1 1 1 246 1 1 17 GLU N N -2.038 -3.463 -4.770 1.00 . A A . 17 GLU N 1 1 1 247 1 1 17 GLU O O -5.436 -4.479 -4.596 1.00 . A A . 17 GLU O 1 1 1 248 1 1 17 GLU OE1 O -3.603 -3.870 -9.636 1.00 . A A . 17 GLU OE1 1 1 1 249 1 1 17 GLU OE2 O -5.169 -5.328 -9.391 1.00 . A A . 17 GLU OE2 1 1 1 250 1 1 18 ASN C C -4.912 -5.786 -1.837 1.00 . A A . 18 ASN C 1 1 1 251 1 1 18 ASN CA C -4.321 -6.427 -3.091 1.00 . A A . 18 ASN CA 1 1 1 252 1 1 18 ASN CB C -3.376 -7.559 -2.687 1.00 . A A . 18 ASN CB 1 1 1 253 1 1 18 ASN CG C -4.190 -8.823 -2.408 1.00 . A A . 18 ASN CG 1 1 1 254 1 1 18 ASN H H -2.586 -5.420 -3.887 1.00 . A A . 18 ASN H 1 1 1 255 1 1 18 ASN HA H -5.120 -6.830 -3.694 1.00 . A A . 18 ASN HA 1 1 1 256 1 1 18 ASN HB2 H -2.679 -7.749 -3.489 1.00 . A A . 18 ASN HB2 1 1 1 257 1 1 18 ASN HB3 H -2.834 -7.278 -1.796 1.00 . A A . 18 ASN HB3 1 1 1 258 1 1 18 ASN HD21 H -3.374 -9.128 -0.624 1.00 . A A . 18 ASN HD21 1 1 1 259 1 1 18 ASN HD22 H -4.538 -10.271 -1.094 1.00 . A A . 18 ASN HD22 1 1 1 260 1 1 18 ASN N N -3.570 -5.412 -3.884 1.00 . A A . 18 ASN N 1 1 1 261 1 1 18 ASN ND2 N -4.019 -9.460 -1.282 1.00 . A A . 18 ASN ND2 1 1 1 262 1 1 18 ASN O O -5.847 -6.295 -1.253 1.00 . A A . 18 ASN O 1 1 1 263 1 1 18 ASN OD1 O -4.991 -9.235 -3.222 1.00 . A A . 18 ASN OD1 1 1 1 264 1 1 19 TYR C C -6.027 -3.043 -0.586 1.00 . A A . 19 TYR C 1 1 1 265 1 1 19 TYR CA C -4.919 -4.020 -0.194 1.00 . A A . 19 TYR CA 1 1 1 266 1 1 19 TYR CB C -3.801 -3.261 0.518 1.00 . A A . 19 TYR CB 1 1 1 267 1 1 19 TYR CD1 C -3.163 -5.053 2.171 1.00 . A A . 19 TYR CD1 1 1 1 268 1 1 19 TYR CD2 C -1.526 -4.348 0.523 1.00 . A A . 19 TYR CD2 1 1 1 269 1 1 19 TYR CE1 C -2.240 -5.967 2.697 1.00 . A A . 19 TYR CE1 1 1 1 270 1 1 19 TYR CE2 C -0.603 -5.261 1.050 1.00 . A A . 19 TYR CE2 1 1 1 271 1 1 19 TYR CG C -2.805 -4.243 1.085 1.00 . A A . 19 TYR CG 1 1 1 272 1 1 19 TYR CZ C -0.961 -6.071 2.136 1.00 . A A . 19 TYR CZ 1 1 1 273 1 1 19 TYR H H -3.621 -4.280 -1.894 1.00 . A A . 19 TYR H 1 1 1 274 1 1 19 TYR HA H -5.320 -4.772 0.469 1.00 . A A . 19 TYR HA 1 1 1 275 1 1 19 TYR HB2 H -3.303 -2.611 -0.186 1.00 . A A . 19 TYR HB2 1 1 1 276 1 1 19 TYR HB3 H -4.222 -2.672 1.319 1.00 . A A . 19 TYR HB3 1 1 1 277 1 1 19 TYR HD1 H -4.149 -4.972 2.602 1.00 . A A . 19 TYR HD1 1 1 1 278 1 1 19 TYR HD2 H -1.250 -3.723 -0.315 1.00 . A A . 19 TYR HD2 1 1 1 279 1 1 19 TYR HE1 H -2.516 -6.591 3.534 1.00 . A A . 19 TYR HE1 1 1 1 280 1 1 19 TYR HE2 H 0.383 -5.342 0.618 1.00 . A A . 19 TYR HE2 1 1 1 281 1 1 19 TYR HH H 0.788 -6.518 2.755 1.00 . A A . 19 TYR HH 1 1 1 282 1 1 19 TYR N N -4.377 -4.678 -1.414 1.00 . A A . 19 TYR N 1 1 1 283 1 1 19 TYR O O -6.285 -2.079 0.106 1.00 . A A . 19 TYR O 1 1 1 284 1 1 19 TYR OH O -0.052 -6.971 2.654 1.00 . A A . 19 TYR OH 1 1 1 285 1 1 20 CYS C C -9.062 -2.698 -1.346 1.00 . A A . 20 CYS C 1 1 1 286 1 1 20 CYS CA C -7.780 -2.348 -2.097 1.00 . A A . 20 CYS CA 1 1 1 287 1 1 20 CYS CB C -8.016 -2.457 -3.603 1.00 . A A . 20 CYS CB 1 1 1 288 1 1 20 CYS H H -6.475 -4.062 -2.237 1.00 . A A . 20 CYS H 1 1 1 289 1 1 20 CYS HA H -7.494 -1.337 -1.851 1.00 . A A . 20 CYS HA 1 1 1 290 1 1 20 CYS HB2 H -8.177 -3.488 -3.875 1.00 . A A . 20 CYS HB2 1 1 1 291 1 1 20 CYS HB3 H -8.882 -1.873 -3.875 1.00 . A A . 20 CYS HB3 1 1 1 292 1 1 20 CYS N N -6.690 -3.279 -1.687 1.00 . A A . 20 CYS N 1 1 1 293 1 1 20 CYS O O -9.342 -3.849 -1.074 1.00 . A A . 20 CYS O 1 1 1 294 1 1 20 CYS SG S -6.565 -1.817 -4.468 1.00 . A A . 20 CYS SG 1 1 1 295 1 1 21 ASN C C -10.786 -2.801 0.985 1.00 . A A . 21 ASN C 1 1 1 296 1 1 21 ASN CA C -11.101 -1.980 -0.267 1.00 . A A . 21 ASN CA 1 1 1 297 1 1 21 ASN CB C -12.054 -2.764 -1.167 1.00 . A A . 21 ASN CB 1 1 1 298 1 1 21 ASN CG C -13.257 -3.231 -0.348 1.00 . A A . 21 ASN CG 1 1 1 299 1 1 21 ASN H H -9.594 -0.792 -1.232 1.00 . A A . 21 ASN H 1 1 1 300 1 1 21 ASN HA H -11.560 -1.045 0.019 1.00 . A A . 21 ASN HA 1 1 1 301 1 1 21 ASN HB2 H -12.390 -2.129 -1.974 1.00 . A A . 21 ASN HB2 1 1 1 302 1 1 21 ASN HB3 H -11.539 -3.620 -1.572 1.00 . A A . 21 ASN HB3 1 1 1 303 1 1 21 ASN HD21 H -13.461 -1.497 0.597 1.00 . A A . 21 ASN HD21 1 1 1 304 1 1 21 ASN HD22 H -14.586 -2.693 1.025 1.00 . A A . 21 ASN HD22 1 1 1 305 1 1 21 ASN N N -9.841 -1.710 -1.005 1.00 . A A . 21 ASN N 1 1 1 306 1 1 21 ASN ND2 N -13.814 -2.405 0.495 1.00 . A A . 21 ASN ND2 1 1 1 307 1 1 21 ASN O O -9.634 -3.167 1.152 1.00 . A A . 21 ASN O 1 1 1 308 1 1 21 ASN OXT O -11.699 -3.048 1.754 1.00 . A A . 21 ASN OXT 1 1 1 309 1 1 21 ASN OD1 O -13.694 -4.358 -0.475 1.00 . A A . 21 ASN OD1 1 1 1 310 2 2 1 PHE C C 7.641 0.812 -8.872 1.00 . B B . 1 PHE C 1 1 1 311 2 2 1 PHE CA C 6.351 1.592 -8.617 1.00 . B B . 1 PHE CA 1 1 1 312 2 2 1 PHE CB C 5.184 0.618 -8.451 1.00 . B B . 1 PHE CB 1 1 1 313 2 2 1 PHE CD1 C 3.267 2.140 -7.849 1.00 . B B . 1 PHE CD1 1 1 1 314 2 2 1 PHE CD2 C 3.330 1.163 -10.070 1.00 . B B . 1 PHE CD2 1 1 1 315 2 2 1 PHE CE1 C 2.072 2.796 -8.172 1.00 . B B . 1 PHE CE1 1 1 1 316 2 2 1 PHE CE2 C 2.135 1.818 -10.393 1.00 . B B . 1 PHE CE2 1 1 1 317 2 2 1 PHE CG C 3.895 1.323 -8.798 1.00 . B B . 1 PHE CG 1 1 1 318 2 2 1 PHE CZ C 1.506 2.635 -9.443 1.00 . B B . 1 PHE CZ 1 1 1 319 2 2 1 PHE H1 H 6.964 2.964 -10.060 1.00 . B B . 1 PHE H1 1 1 1 320 2 2 1 PHE H2 H 5.378 3.208 -9.501 1.00 . B B . 1 PHE H2 1 1 1 321 2 2 1 PHE H3 H 5.717 1.933 -10.571 1.00 . B B . 1 PHE H3 1 1 1 322 2 2 1 PHE HA H 6.458 2.183 -7.719 1.00 . B B . 1 PHE HA 1 1 1 323 2 2 1 PHE HB2 H 5.323 -0.227 -9.111 1.00 . B B . 1 PHE HB2 1 1 1 324 2 2 1 PHE HB3 H 5.142 0.274 -7.428 1.00 . B B . 1 PHE HB3 1 1 1 325 2 2 1 PHE HD1 H 3.703 2.265 -6.869 1.00 . B B . 1 PHE HD1 1 1 1 326 2 2 1 PHE HD2 H 3.815 0.534 -10.801 1.00 . B B . 1 PHE HD2 1 1 1 327 2 2 1 PHE HE1 H 1.587 3.425 -7.441 1.00 . B B . 1 PHE HE1 1 1 1 328 2 2 1 PHE HE2 H 1.699 1.696 -11.373 1.00 . B B . 1 PHE HE2 1 1 1 329 2 2 1 PHE HZ H 0.585 3.139 -9.692 1.00 . B B . 1 PHE HZ 1 1 1 330 2 2 1 PHE N N 6.082 2.492 -9.775 1.00 . B B . 1 PHE N 1 1 1 331 2 2 1 PHE O O 7.905 0.375 -9.974 1.00 . B B . 1 PHE O 1 1 1 332 2 2 2 VAL C C 9.953 -1.043 -6.858 1.00 . B B . 2 VAL C 1 1 1 333 2 2 2 VAL CA C 9.726 -0.106 -8.050 1.00 . B B . 2 VAL CA 1 1 1 334 2 2 2 VAL CB C 10.879 0.894 -8.149 1.00 . B B . 2 VAL CB 1 1 1 335 2 2 2 VAL CG1 C 10.582 1.908 -9.256 1.00 . B B . 2 VAL CG1 1 1 1 336 2 2 2 VAL CG2 C 11.031 1.627 -6.813 1.00 . B B . 2 VAL CG2 1 1 1 337 2 2 2 VAL H H 8.221 1.004 -6.982 1.00 . B B . 2 VAL H 1 1 1 338 2 2 2 VAL HA H 9.674 -0.686 -8.960 1.00 . B B . 2 VAL HA 1 1 1 339 2 2 2 VAL HB H 11.794 0.367 -8.379 1.00 . B B . 2 VAL HB 1 1 1 340 2 2 2 VAL HG11 H 10.231 1.389 -10.135 1.00 . B B . 2 VAL HG11 1 1 1 341 2 2 2 VAL HG12 H 11.483 2.454 -9.496 1.00 . B B . 2 VAL HG12 1 1 1 342 2 2 2 VAL HG13 H 9.823 2.598 -8.918 1.00 . B B . 2 VAL HG13 1 1 1 343 2 2 2 VAL HG21 H 10.531 2.583 -6.868 1.00 . B B . 2 VAL HG21 1 1 1 344 2 2 2 VAL HG22 H 12.079 1.781 -6.604 1.00 . B B . 2 VAL HG22 1 1 1 345 2 2 2 VAL HG23 H 10.591 1.035 -6.024 1.00 . B B . 2 VAL HG23 1 1 1 346 2 2 2 VAL N N 8.450 0.639 -7.863 1.00 . B B . 2 VAL N 1 1 1 347 2 2 2 VAL O O 9.030 -1.643 -6.346 1.00 . B B . 2 VAL O 1 1 1 348 2 2 3 ASN C C 11.881 -1.201 -4.063 1.00 . B B . 3 ASN C 1 1 1 349 2 2 3 ASN CA C 11.452 -2.060 -5.249 1.00 . B B . 3 ASN CA 1 1 1 350 2 2 3 ASN CB C 12.576 -3.030 -5.611 1.00 . B B . 3 ASN CB 1 1 1 351 2 2 3 ASN CG C 12.015 -4.167 -6.466 1.00 . B B . 3 ASN CG 1 1 1 352 2 2 3 ASN H H 11.907 -0.674 -6.827 1.00 . B B . 3 ASN H 1 1 1 353 2 2 3 ASN HA H 10.561 -2.612 -4.997 1.00 . B B . 3 ASN HA 1 1 1 354 2 2 3 ASN HB2 H 13.337 -2.501 -6.165 1.00 . B B . 3 ASN HB2 1 1 1 355 2 2 3 ASN HB3 H 13.004 -3.437 -4.707 1.00 . B B . 3 ASN HB3 1 1 1 356 2 2 3 ASN HD21 H 10.724 -4.760 -5.079 1.00 . B B . 3 ASN HD21 1 1 1 357 2 2 3 ASN HD22 H 10.702 -5.655 -6.522 1.00 . B B . 3 ASN HD22 1 1 1 358 2 2 3 ASN N N 11.174 -1.169 -6.408 1.00 . B B . 3 ASN N 1 1 1 359 2 2 3 ASN ND2 N 11.068 -4.924 -5.982 1.00 . B B . 3 ASN ND2 1 1 1 360 2 2 3 ASN O O 12.989 -1.304 -3.574 1.00 . B B . 3 ASN O 1 1 1 361 2 2 3 ASN OD1 O 12.443 -4.370 -7.584 1.00 . B B . 3 ASN OD1 1 1 1 362 2 2 4 GLN C C 10.377 0.380 -1.325 1.00 . B B . 4 GLN C 1 1 1 363 2 2 4 GLN CA C 11.378 0.551 -2.478 1.00 . B B . 4 GLN CA 1 1 1 364 2 2 4 GLN CB C 11.353 1.998 -2.969 1.00 . B B . 4 GLN CB 1 1 1 365 2 2 4 GLN CD C 12.435 4.208 -2.541 1.00 . B B . 4 GLN CD 1 1 1 366 2 2 4 GLN CG C 11.950 2.907 -1.899 1.00 . B B . 4 GLN CG 1 1 1 367 2 2 4 GLN H H 10.141 -0.257 -4.034 1.00 . B B . 4 GLN H 1 1 1 368 2 2 4 GLN HA H 12.372 0.310 -2.133 1.00 . B B . 4 GLN HA 1 1 1 369 2 2 4 GLN HB2 H 11.932 2.079 -3.878 1.00 . B B . 4 GLN HB2 1 1 1 370 2 2 4 GLN HB3 H 10.334 2.295 -3.164 1.00 . B B . 4 GLN HB3 1 1 1 371 2 2 4 GLN HE21 H 14.242 3.496 -2.952 1.00 . B B . 4 GLN HE21 1 1 1 372 2 2 4 GLN HE22 H 13.971 5.104 -3.424 1.00 . B B . 4 GLN HE22 1 1 1 373 2 2 4 GLN HG2 H 11.198 3.128 -1.156 1.00 . B B . 4 GLN HG2 1 1 1 374 2 2 4 GLN HG3 H 12.784 2.407 -1.430 1.00 . B B . 4 GLN HG3 1 1 1 375 2 2 4 GLN N N 11.019 -0.336 -3.612 1.00 . B B . 4 GLN N 1 1 1 376 2 2 4 GLN NE2 N 13.650 4.275 -3.012 1.00 . B B . 4 GLN NE2 1 1 1 377 2 2 4 GLN O O 9.347 -0.269 -1.459 1.00 . B B . 4 GLN O 1 1 1 378 2 2 4 GLN OE1 O 11.701 5.173 -2.615 1.00 . B B . 4 GLN OE1 1 1 1 379 2 2 5 HIS C C 8.666 1.911 0.842 1.00 . B B . 5 HIS C 1 1 1 380 2 2 5 HIS CA C 9.781 0.873 0.990 1.00 . B B . 5 HIS CA 1 1 1 381 2 2 5 HIS CB C 10.577 1.156 2.271 1.00 . B B . 5 HIS CB 1 1 1 382 2 2 5 HIS CD2 C 12.821 -0.119 2.719 1.00 . B B . 5 HIS CD2 1 1 1 383 2 2 5 HIS CE1 C 14.019 0.848 1.184 1.00 . B B . 5 HIS CE1 1 1 1 384 2 2 5 HIS CG C 12.025 0.786 2.071 1.00 . B B . 5 HIS CG 1 1 1 385 2 2 5 HIS H H 11.517 1.477 -0.124 1.00 . B B . 5 HIS H 1 1 1 386 2 2 5 HIS HA H 9.351 -0.116 1.040 1.00 . B B . 5 HIS HA 1 1 1 387 2 2 5 HIS HB2 H 10.506 2.207 2.512 1.00 . B B . 5 HIS HB2 1 1 1 388 2 2 5 HIS HB3 H 10.168 0.575 3.084 1.00 . B B . 5 HIS HB3 1 1 1 389 2 2 5 HIS HD2 H 12.514 -0.757 3.534 1.00 . B B . 5 HIS HD2 1 1 1 390 2 2 5 HIS HE1 H 14.850 1.119 0.550 1.00 . B B . 5 HIS HE1 1 1 1 391 2 2 5 HIS HE2 H 14.861 -0.618 2.418 1.00 . B B . 5 HIS HE2 1 1 1 392 2 2 5 HIS N N 10.684 0.967 -0.194 1.00 . B B . 5 HIS N 1 1 1 393 2 2 5 HIS ND1 N 12.797 1.392 1.101 1.00 . B B . 5 HIS ND1 1 1 1 394 2 2 5 HIS NE2 N 14.082 -0.081 2.160 1.00 . B B . 5 HIS NE2 1 1 1 395 2 2 5 HIS O O 8.639 2.662 -0.112 1.00 . B B . 5 HIS O 1 1 1 396 2 2 6 LEU C C 6.268 3.547 2.994 1.00 . B B . 6 LEU C 1 1 1 397 2 2 6 LEU CA C 6.629 2.953 1.635 1.00 . B B . 6 LEU CA 1 1 1 398 2 2 6 LEU CB C 5.383 2.230 1.101 1.00 . B B . 6 LEU CB 1 1 1 399 2 2 6 LEU CD1 C 6.065 3.260 -1.103 1.00 . B B . 6 LEU CD1 1 1 1 400 2 2 6 LEU CD2 C 4.180 1.649 -1.013 1.00 . B B . 6 LEU CD2 1 1 1 401 2 2 6 LEU CG C 4.890 2.776 -0.259 1.00 . B B . 6 LEU CG 1 1 1 402 2 2 6 LEU H H 7.766 1.345 2.524 1.00 . B B . 6 LEU H 1 1 1 403 2 2 6 LEU HA H 6.933 3.737 0.972 1.00 . B B . 6 LEU HA 1 1 1 404 2 2 6 LEU HB2 H 5.624 1.188 0.995 1.00 . B B . 6 LEU HB2 1 1 1 405 2 2 6 LEU HB3 H 4.590 2.334 1.827 1.00 . B B . 6 LEU HB3 1 1 1 406 2 2 6 LEU HD11 H 6.838 2.508 -1.103 1.00 . B B . 6 LEU HD11 1 1 1 407 2 2 6 LEU HD12 H 6.451 4.179 -0.693 1.00 . B B . 6 LEU HD12 1 1 1 408 2 2 6 LEU HD13 H 5.731 3.431 -2.115 1.00 . B B . 6 LEU HD13 1 1 1 409 2 2 6 LEU HD21 H 3.136 1.898 -1.132 1.00 . B B . 6 LEU HD21 1 1 1 410 2 2 6 LEU HD22 H 4.270 0.730 -0.455 1.00 . B B . 6 LEU HD22 1 1 1 411 2 2 6 LEU HD23 H 4.634 1.528 -1.985 1.00 . B B . 6 LEU HD23 1 1 1 412 2 2 6 LEU HG H 4.183 3.588 -0.103 1.00 . B B . 6 LEU HG 1 1 1 413 2 2 6 LEU N N 7.740 1.961 1.764 1.00 . B B . 6 LEU N 1 1 1 414 2 2 6 LEU O O 6.746 3.122 4.023 1.00 . B B . 6 LEU O 1 1 1 415 2 2 7 CYS C C 4.383 6.553 3.926 1.00 . B B . 7 CYS C 1 1 1 416 2 2 7 CYS CA C 4.931 5.160 4.246 1.00 . B B . 7 CYS CA 1 1 1 417 2 2 7 CYS CB C 6.082 5.271 5.252 1.00 . B B . 7 CYS CB 1 1 1 418 2 2 7 CYS H H 5.011 4.812 2.130 1.00 . B B . 7 CYS H 1 1 1 419 2 2 7 CYS HA H 4.139 4.563 4.677 1.00 . B B . 7 CYS HA 1 1 1 420 2 2 7 CYS HB2 H 7.009 4.984 4.782 1.00 . B B . 7 CYS HB2 1 1 1 421 2 2 7 CYS HB3 H 6.158 6.289 5.598 1.00 . B B . 7 CYS HB3 1 1 1 422 2 2 7 CYS N N 5.390 4.516 2.984 1.00 . B B . 7 CYS N 1 1 1 423 2 2 7 CYS O O 4.911 7.267 3.092 1.00 . B B . 7 CYS O 1 1 1 424 2 2 7 CYS SG S 5.738 4.181 6.660 1.00 . B B . 7 CYS SG 1 1 1 425 2 2 8 GLY C C 2.073 8.301 2.930 1.00 . B B . 8 GLY C 1 1 1 426 2 2 8 GLY CA C 2.729 8.280 4.313 1.00 . B B . 8 GLY CA 1 1 1 427 2 2 8 GLY H H 2.909 6.345 5.236 1.00 . B B . 8 GLY H 1 1 1 428 2 2 8 GLY HA2 H 1.985 8.496 5.067 1.00 . B B . 8 GLY HA2 1 1 1 429 2 2 8 GLY HA3 H 3.504 9.029 4.350 1.00 . B B . 8 GLY HA3 1 1 1 430 2 2 8 GLY N N 3.321 6.940 4.575 1.00 . B B . 8 GLY N 1 1 1 431 2 2 8 GLY O O 1.476 7.334 2.494 1.00 . B B . 8 GLY O 1 1 1 432 2 2 9 SER C C 2.155 8.441 -0.035 1.00 . B B . 9 SER C 1 1 1 433 2 2 9 SER CA C 1.554 9.499 0.888 1.00 . B B . 9 SER CA 1 1 1 434 2 2 9 SER CB C 1.809 10.888 0.304 1.00 . B B . 9 SER CB 1 1 1 435 2 2 9 SER H H 2.656 10.173 2.611 1.00 . B B . 9 SER H 1 1 1 436 2 2 9 SER HA H 0.495 9.335 0.973 1.00 . B B . 9 SER HA 1 1 1 437 2 2 9 SER HB2 H 2.805 11.212 0.556 1.00 . B B . 9 SER HB2 1 1 1 438 2 2 9 SER HB3 H 1.708 10.848 -0.773 1.00 . B B . 9 SER HB3 1 1 1 439 2 2 9 SER HG H 0.957 12.637 0.374 1.00 . B B . 9 SER HG 1 1 1 440 2 2 9 SER N N 2.175 9.404 2.239 1.00 . B B . 9 SER N 1 1 1 441 2 2 9 SER O O 1.526 7.992 -0.972 1.00 . B B . 9 SER O 1 1 1 442 2 2 9 SER OG O 0.867 11.806 0.846 1.00 . B B . 9 SER OG 1 1 1 443 2 2 10 ASP C C 3.122 5.757 -0.678 1.00 . B B . 10 ASP C 1 1 1 444 2 2 10 ASP CA C 3.999 7.007 -0.656 1.00 . B B . 10 ASP CA 1 1 1 445 2 2 10 ASP CB C 5.382 6.648 -0.110 1.00 . B B . 10 ASP CB 1 1 1 446 2 2 10 ASP CG C 6.250 7.906 -0.041 1.00 . B B . 10 ASP CG 1 1 1 447 2 2 10 ASP H H 3.858 8.410 0.979 1.00 . B B . 10 ASP H 1 1 1 448 2 2 10 ASP HA H 4.097 7.395 -1.659 1.00 . B B . 10 ASP HA 1 1 1 449 2 2 10 ASP HB2 H 5.279 6.225 0.878 1.00 . B B . 10 ASP HB2 1 1 1 450 2 2 10 ASP HB3 H 5.849 5.928 -0.765 1.00 . B B . 10 ASP HB3 1 1 1 451 2 2 10 ASP N N 3.367 8.037 0.217 1.00 . B B . 10 ASP N 1 1 1 452 2 2 10 ASP O O 2.895 5.154 -1.711 1.00 . B B . 10 ASP O 1 1 1 453 2 2 10 ASP OD1 O 6.080 8.767 -0.887 1.00 . B B . 10 ASP OD1 1 1 1 454 2 2 10 ASP OD2 O 7.073 7.984 0.856 1.00 . B B . 10 ASP OD2 1 1 1 455 2 2 11 LEU C C 0.405 4.458 -0.120 1.00 . B B . 11 LEU C 1 1 1 456 2 2 11 LEU CA C 1.769 4.147 0.499 1.00 . B B . 11 LEU CA 1 1 1 457 2 2 11 LEU CB C 1.603 3.710 1.954 1.00 . B B . 11 LEU CB 1 1 1 458 2 2 11 LEU CD1 C 1.723 1.385 0.992 1.00 . B B . 11 LEU CD1 1 1 1 459 2 2 11 LEU CD2 C 1.287 1.734 3.426 1.00 . B B . 11 LEU CD2 1 1 1 460 2 2 11 LEU CG C 1.036 2.288 2.024 1.00 . B B . 11 LEU CG 1 1 1 461 2 2 11 LEU H H 2.818 5.855 1.278 1.00 . B B . 11 LEU H 1 1 1 462 2 2 11 LEU HA H 2.242 3.359 -0.063 1.00 . B B . 11 LEU HA 1 1 1 463 2 2 11 LEU HB2 H 2.564 3.736 2.445 1.00 . B B . 11 LEU HB2 1 1 1 464 2 2 11 LEU HB3 H 0.927 4.387 2.456 1.00 . B B . 11 LEU HB3 1 1 1 465 2 2 11 LEU HD11 H 2.795 1.470 1.093 1.00 . B B . 11 LEU HD11 1 1 1 466 2 2 11 LEU HD12 H 1.430 1.685 -0.004 1.00 . B B . 11 LEU HD12 1 1 1 467 2 2 11 LEU HD13 H 1.427 0.358 1.158 1.00 . B B . 11 LEU HD13 1 1 1 468 2 2 11 LEU HD21 H 1.749 2.498 4.035 1.00 . B B . 11 LEU HD21 1 1 1 469 2 2 11 LEU HD22 H 1.945 0.880 3.361 1.00 . B B . 11 LEU HD22 1 1 1 470 2 2 11 LEU HD23 H 0.350 1.436 3.869 1.00 . B B . 11 LEU HD23 1 1 1 471 2 2 11 LEU HG H -0.026 2.313 1.831 1.00 . B B . 11 LEU HG 1 1 1 472 2 2 11 LEU N N 2.625 5.358 0.455 1.00 . B B . 11 LEU N 1 1 1 473 2 2 11 LEU O O -0.172 3.638 -0.802 1.00 . B B . 11 LEU O 1 1 1 474 2 2 12 VAL C C -1.281 6.192 -2.001 1.00 . B B . 12 VAL C 1 1 1 475 2 2 12 VAL CA C -1.445 5.964 -0.496 1.00 . B B . 12 VAL CA 1 1 1 476 2 2 12 VAL CB C -2.029 7.216 0.183 1.00 . B B . 12 VAL CB 1 1 1 477 2 2 12 VAL CG1 C -1.526 7.286 1.621 1.00 . B B . 12 VAL CG1 1 1 1 478 2 2 12 VAL CG2 C -1.600 8.487 -0.558 1.00 . B B . 12 VAL CG2 1 1 1 479 2 2 12 VAL H H 0.358 6.294 0.646 1.00 . B B . 12 VAL H 1 1 1 480 2 2 12 VAL HA H -2.116 5.131 -0.339 1.00 . B B . 12 VAL HA 1 1 1 481 2 2 12 VAL HB H -3.109 7.147 0.187 1.00 . B B . 12 VAL HB 1 1 1 482 2 2 12 VAL HG11 H -1.353 6.286 1.989 1.00 . B B . 12 VAL HG11 1 1 1 483 2 2 12 VAL HG12 H -2.266 7.775 2.236 1.00 . B B . 12 VAL HG12 1 1 1 484 2 2 12 VAL HG13 H -0.603 7.846 1.650 1.00 . B B . 12 VAL HG13 1 1 1 485 2 2 12 VAL HG21 H -0.522 8.537 -0.594 1.00 . B B . 12 VAL HG21 1 1 1 486 2 2 12 VAL HG22 H -1.984 9.353 -0.039 1.00 . B B . 12 VAL HG22 1 1 1 487 2 2 12 VAL HG23 H -1.993 8.467 -1.564 1.00 . B B . 12 VAL HG23 1 1 1 488 2 2 12 VAL N N -0.118 5.633 0.099 1.00 . B B . 12 VAL N 1 1 1 489 2 2 12 VAL O O -2.050 5.695 -2.799 1.00 . B B . 12 VAL O 1 1 1 490 2 2 13 GLU C C -0.071 5.838 -4.583 1.00 . B B . 13 GLU C 1 1 1 491 2 2 13 GLU CA C -0.077 7.182 -3.848 1.00 . B B . 13 GLU CA 1 1 1 492 2 2 13 GLU CB C 1.254 7.922 -4.060 1.00 . B B . 13 GLU CB 1 1 1 493 2 2 13 GLU CD C 3.743 7.661 -4.021 1.00 . B B . 13 GLU CD 1 1 1 494 2 2 13 GLU CG C 2.411 6.923 -4.163 1.00 . B B . 13 GLU CG 1 1 1 495 2 2 13 GLU H H 0.331 7.326 -1.739 1.00 . B B . 13 GLU H 1 1 1 496 2 2 13 GLU HA H -0.888 7.789 -4.224 1.00 . B B . 13 GLU HA 1 1 1 497 2 2 13 GLU HB2 H 1.199 8.501 -4.969 1.00 . B B . 13 GLU HB2 1 1 1 498 2 2 13 GLU HB3 H 1.428 8.584 -3.225 1.00 . B B . 13 GLU HB3 1 1 1 499 2 2 13 GLU HG2 H 2.318 6.190 -3.379 1.00 . B B . 13 GLU HG2 1 1 1 500 2 2 13 GLU HG3 H 2.375 6.430 -5.122 1.00 . B B . 13 GLU HG3 1 1 1 501 2 2 13 GLU N N -0.282 6.935 -2.396 1.00 . B B . 13 GLU N 1 1 1 502 2 2 13 GLU O O -0.455 5.743 -5.732 1.00 . B B . 13 GLU O 1 1 1 503 2 2 13 GLU OE1 O 3.723 8.881 -3.990 1.00 . B B . 13 GLU OE1 1 1 1 504 2 2 13 GLU OE2 O 4.762 6.994 -3.945 1.00 . B B . 13 GLU OE2 1 1 1 505 2 2 14 ALA C C -1.028 2.828 -4.387 1.00 . B B . 14 ALA C 1 1 1 506 2 2 14 ALA CA C 0.350 3.454 -4.566 1.00 . B B . 14 ALA CA 1 1 1 507 2 2 14 ALA CB C 1.406 2.563 -3.910 1.00 . B B . 14 ALA CB 1 1 1 508 2 2 14 ALA H H 0.629 4.885 -2.985 1.00 . B B . 14 ALA H 1 1 1 509 2 2 14 ALA HA H 0.566 3.562 -5.619 1.00 . B B . 14 ALA HA 1 1 1 510 2 2 14 ALA HB1 H 1.583 1.698 -4.532 1.00 . B B . 14 ALA HB1 1 1 1 511 2 2 14 ALA HB2 H 1.054 2.243 -2.940 1.00 . B B . 14 ALA HB2 1 1 1 512 2 2 14 ALA HB3 H 2.325 3.119 -3.794 1.00 . B B . 14 ALA HB3 1 1 1 513 2 2 14 ALA N N 0.342 4.792 -3.916 1.00 . B B . 14 ALA N 1 1 1 514 2 2 14 ALA O O -1.643 2.366 -5.329 1.00 . B B . 14 ALA O 1 1 1 515 2 2 15 LEU C C -3.903 3.009 -3.756 1.00 . B B . 15 LEU C 1 1 1 516 2 2 15 LEU CA C -2.864 2.237 -2.936 1.00 . B B . 15 LEU CA 1 1 1 517 2 2 15 LEU CB C -3.192 2.371 -1.450 1.00 . B B . 15 LEU CB 1 1 1 518 2 2 15 LEU CD1 C -2.902 1.206 0.739 1.00 . B B . 15 LEU CD1 1 1 1 519 2 2 15 LEU CD2 C -2.018 0.122 -1.328 1.00 . B B . 15 LEU CD2 1 1 1 520 2 2 15 LEU CG C -2.266 1.464 -0.619 1.00 . B B . 15 LEU CG 1 1 1 521 2 2 15 LEU H H -1.017 3.198 -2.433 1.00 . B B . 15 LEU H 1 1 1 522 2 2 15 LEU HA H -2.862 1.195 -3.222 1.00 . B B . 15 LEU HA 1 1 1 523 2 2 15 LEU HB2 H -3.038 3.400 -1.153 1.00 . B B . 15 LEU HB2 1 1 1 524 2 2 15 LEU HB3 H -4.229 2.107 -1.275 1.00 . B B . 15 LEU HB3 1 1 1 525 2 2 15 LEU HD11 H -2.132 0.955 1.452 1.00 . B B . 15 LEU HD11 1 1 1 526 2 2 15 LEU HD12 H -3.601 0.390 0.656 1.00 . B B . 15 LEU HD12 1 1 1 527 2 2 15 LEU HD13 H -3.420 2.096 1.065 1.00 . B B . 15 LEU HD13 1 1 1 528 2 2 15 LEU HD21 H -1.760 -0.632 -0.595 1.00 . B B . 15 LEU HD21 1 1 1 529 2 2 15 LEU HD22 H -1.201 0.232 -2.024 1.00 . B B . 15 LEU HD22 1 1 1 530 2 2 15 LEU HD23 H -2.905 -0.184 -1.860 1.00 . B B . 15 LEU HD23 1 1 1 531 2 2 15 LEU HG H -1.323 1.966 -0.472 1.00 . B B . 15 LEU HG 1 1 1 532 2 2 15 LEU N N -1.524 2.818 -3.181 1.00 . B B . 15 LEU N 1 1 1 533 2 2 15 LEU O O -4.801 2.438 -4.342 1.00 . B B . 15 LEU O 1 1 1 534 2 2 16 TYR C C -4.650 4.813 -6.061 1.00 . B B . 16 TYR C 1 1 1 535 2 2 16 TYR CA C -4.772 5.122 -4.567 1.00 . B B . 16 TYR CA 1 1 1 536 2 2 16 TYR CB C -4.500 6.610 -4.340 1.00 . B B . 16 TYR CB 1 1 1 537 2 2 16 TYR CD1 C -6.945 7.177 -4.137 1.00 . B B . 16 TYR CD1 1 1 1 538 2 2 16 TYR CD2 C -5.443 7.832 -2.347 1.00 . B B . 16 TYR CD2 1 1 1 539 2 2 16 TYR CE1 C -8.021 7.744 -3.443 1.00 . B B . 16 TYR CE1 1 1 1 540 2 2 16 TYR CE2 C -6.520 8.399 -1.653 1.00 . B B . 16 TYR CE2 1 1 1 541 2 2 16 TYR CG C -5.656 7.221 -3.590 1.00 . B B . 16 TYR CG 1 1 1 542 2 2 16 TYR CZ C -7.809 8.355 -2.201 1.00 . B B . 16 TYR CZ 1 1 1 543 2 2 16 TYR H H -3.061 4.754 -3.305 1.00 . B B . 16 TYR H 1 1 1 544 2 2 16 TYR HA H -5.771 4.887 -4.234 1.00 . B B . 16 TYR HA 1 1 1 545 2 2 16 TYR HB2 H -3.592 6.728 -3.768 1.00 . B B . 16 TYR HB2 1 1 1 546 2 2 16 TYR HB3 H -4.390 7.104 -5.293 1.00 . B B . 16 TYR HB3 1 1 1 547 2 2 16 TYR HD1 H -7.109 6.705 -5.095 1.00 . B B . 16 TYR HD1 1 1 1 548 2 2 16 TYR HD2 H -4.449 7.866 -1.925 1.00 . B B . 16 TYR HD2 1 1 1 549 2 2 16 TYR HE1 H -9.015 7.709 -3.866 1.00 . B B . 16 TYR HE1 1 1 1 550 2 2 16 TYR HE2 H -6.356 8.870 -0.695 1.00 . B B . 16 TYR HE2 1 1 1 551 2 2 16 TYR HH H -9.040 9.781 -1.890 1.00 . B B . 16 TYR HH 1 1 1 552 2 2 16 TYR N N -3.789 4.310 -3.793 1.00 . B B . 16 TYR N 1 1 1 553 2 2 16 TYR O O -5.630 4.784 -6.778 1.00 . B B . 16 TYR O 1 1 1 554 2 2 16 TYR OH O -8.870 8.913 -1.517 1.00 . B B . 16 TYR OH 1 1 1 555 2 2 17 LEU C C -3.637 2.847 -8.287 1.00 . B B . 17 LEU C 1 1 1 556 2 2 17 LEU CA C -3.285 4.306 -7.995 1.00 . B B . 17 LEU CA 1 1 1 557 2 2 17 LEU CB C -1.831 4.574 -8.398 1.00 . B B . 17 LEU CB 1 1 1 558 2 2 17 LEU CD1 C -2.874 4.979 -10.650 1.00 . B B . 17 LEU CD1 1 1 1 559 2 2 17 LEU CD2 C -0.400 5.146 -10.361 1.00 . B B . 17 LEU CD2 1 1 1 560 2 2 17 LEU CG C -1.660 4.402 -9.913 1.00 . B B . 17 LEU CG 1 1 1 561 2 2 17 LEU H H -2.674 4.632 -5.953 1.00 . B B . 17 LEU H 1 1 1 562 2 2 17 LEU HA H -3.938 4.949 -8.561 1.00 . B B . 17 LEU HA 1 1 1 563 2 2 17 LEU HB2 H -1.563 5.583 -8.119 1.00 . B B . 17 LEU HB2 1 1 1 564 2 2 17 LEU HB3 H -1.184 3.878 -7.885 1.00 . B B . 17 LEU HB3 1 1 1 565 2 2 17 LEU HD11 H -2.984 6.024 -10.400 1.00 . B B . 17 LEU HD11 1 1 1 566 2 2 17 LEU HD12 H -3.763 4.442 -10.355 1.00 . B B . 17 LEU HD12 1 1 1 567 2 2 17 LEU HD13 H -2.729 4.878 -11.715 1.00 . B B . 17 LEU HD13 1 1 1 568 2 2 17 LEU HD21 H -0.077 4.764 -11.318 1.00 . B B . 17 LEU HD21 1 1 1 569 2 2 17 LEU HD22 H 0.383 4.999 -9.632 1.00 . B B . 17 LEU HD22 1 1 1 570 2 2 17 LEU HD23 H -0.616 6.201 -10.449 1.00 . B B . 17 LEU HD23 1 1 1 571 2 2 17 LEU HG H -1.562 3.352 -10.148 1.00 . B B . 17 LEU HG 1 1 1 572 2 2 17 LEU N N -3.456 4.595 -6.542 1.00 . B B . 17 LEU N 1 1 1 573 2 2 17 LEU O O -3.985 2.493 -9.395 1.00 . B B . 17 LEU O 1 1 1 574 2 2 18 VAL C C -5.348 0.330 -7.176 1.00 . B B . 18 VAL C 1 1 1 575 2 2 18 VAL CA C -3.882 0.565 -7.529 1.00 . B B . 18 VAL CA 1 1 1 576 2 2 18 VAL CB C -2.994 -0.311 -6.642 1.00 . B B . 18 VAL CB 1 1 1 577 2 2 18 VAL CG1 C -1.553 0.175 -6.728 1.00 . B B . 18 VAL CG1 1 1 1 578 2 2 18 VAL CG2 C -3.461 -0.216 -5.191 1.00 . B B . 18 VAL CG2 1 1 1 579 2 2 18 VAL H H -3.270 2.307 -6.419 1.00 . B B . 18 VAL H 1 1 1 580 2 2 18 VAL HA H -3.717 0.313 -8.564 1.00 . B B . 18 VAL HA 1 1 1 581 2 2 18 VAL HB H -3.050 -1.337 -6.975 1.00 . B B . 18 VAL HB 1 1 1 582 2 2 18 VAL HG11 H -1.106 0.143 -5.746 1.00 . B B . 18 VAL HG11 1 1 1 583 2 2 18 VAL HG12 H -1.538 1.189 -7.098 1.00 . B B . 18 VAL HG12 1 1 1 584 2 2 18 VAL HG13 H -0.999 -0.463 -7.398 1.00 . B B . 18 VAL HG13 1 1 1 585 2 2 18 VAL HG21 H -4.363 -0.793 -5.065 1.00 . B B . 18 VAL HG21 1 1 1 586 2 2 18 VAL HG22 H -3.656 0.816 -4.946 1.00 . B B . 18 VAL HG22 1 1 1 587 2 2 18 VAL HG23 H -2.692 -0.602 -4.540 1.00 . B B . 18 VAL HG23 1 1 1 588 2 2 18 VAL N N -3.551 2.000 -7.304 1.00 . B B . 18 VAL N 1 1 1 589 2 2 18 VAL O O -6.000 -0.539 -7.720 1.00 . B B . 18 VAL O 1 1 1 590 2 2 19 CYS C C -8.155 1.977 -6.545 1.00 . B B . 19 CYS C 1 1 1 591 2 2 19 CYS CA C -7.286 0.923 -5.857 1.00 . B B . 19 CYS CA 1 1 1 592 2 2 19 CYS CB C -7.392 1.077 -4.341 1.00 . B B . 19 CYS CB 1 1 1 593 2 2 19 CYS H H -5.313 1.786 -5.834 1.00 . B B . 19 CYS H 1 1 1 594 2 2 19 CYS HA H -7.621 -0.063 -6.142 1.00 . B B . 19 CYS HA 1 1 1 595 2 2 19 CYS HB2 H -7.160 2.095 -4.064 1.00 . B B . 19 CYS HB2 1 1 1 596 2 2 19 CYS HB3 H -8.393 0.834 -4.019 1.00 . B B . 19 CYS HB3 1 1 1 597 2 2 19 CYS N N -5.865 1.097 -6.261 1.00 . B B . 19 CYS N 1 1 1 598 2 2 19 CYS O O -8.927 1.675 -7.433 1.00 . B B . 19 CYS O 1 1 1 599 2 2 19 CYS SG S -6.214 -0.048 -3.558 1.00 . B B . 19 CYS SG 1 1 1 600 2 2 20 GLY C C -10.300 4.195 -6.277 1.00 . B B . 20 GLY C 1 1 1 601 2 2 20 GLY CA C -8.855 4.282 -6.774 1.00 . B B . 20 GLY CA 1 1 1 602 2 2 20 GLY H H -7.407 3.434 -5.424 1.00 . B B . 20 GLY H 1 1 1 603 2 2 20 GLY HA2 H -8.443 5.248 -6.516 1.00 . B B . 20 GLY HA2 1 1 1 604 2 2 20 GLY HA3 H -8.839 4.160 -7.846 1.00 . B B . 20 GLY HA3 1 1 1 605 2 2 20 GLY N N -8.036 3.211 -6.142 1.00 . B B . 20 GLY N 1 1 1 606 2 2 20 GLY O O -10.650 4.752 -5.255 1.00 . B B . 20 GLY O 1 1 1 607 2 2 21 GLU C C -12.700 2.448 -5.387 1.00 . B B . 21 GLU C 1 1 1 608 2 2 21 GLU CA C -12.571 3.396 -6.580 1.00 . B B . 21 GLU CA 1 1 1 609 2 2 21 GLU CB C -13.403 2.865 -7.748 1.00 . B B . 21 GLU CB 1 1 1 610 2 2 21 GLU CD C -14.923 3.510 -9.627 1.00 . B B . 21 GLU CD 1 1 1 611 2 2 21 GLU CG C -14.148 4.025 -8.412 1.00 . B B . 21 GLU CG 1 1 1 612 2 2 21 GLU H H -10.845 3.073 -7.824 1.00 . B B . 21 GLU H 1 1 1 613 2 2 21 GLU HA H -12.934 4.370 -6.295 1.00 . B B . 21 GLU HA 1 1 1 614 2 2 21 GLU HB2 H -12.751 2.394 -8.470 1.00 . B B . 21 GLU HB2 1 1 1 615 2 2 21 GLU HB3 H -14.116 2.143 -7.383 1.00 . B B . 21 GLU HB3 1 1 1 616 2 2 21 GLU HG2 H -14.836 4.462 -7.704 1.00 . B B . 21 GLU HG2 1 1 1 617 2 2 21 GLU HG3 H -13.438 4.772 -8.731 1.00 . B B . 21 GLU HG3 1 1 1 618 2 2 21 GLU N N -11.145 3.508 -6.999 1.00 . B B . 21 GLU N 1 1 1 619 2 2 21 GLU O O -13.506 2.661 -4.503 1.00 . B B . 21 GLU O 1 1 1 620 2 2 21 GLU OE1 O -14.610 2.425 -10.090 1.00 . B B . 21 GLU OE1 1 1 1 621 2 2 21 GLU OE2 O -15.817 4.209 -10.075 1.00 . B B . 21 GLU OE2 1 1 1 622 2 2 22 ARG C C -11.306 1.050 -2.988 1.00 . B B . 22 ARG C 1 1 1 623 2 2 22 ARG CA C -12.012 0.459 -4.211 1.00 . B B . 22 ARG CA 1 1 1 624 2 2 22 ARG CB C -11.340 -0.851 -4.611 1.00 . B B . 22 ARG CB 1 1 1 625 2 2 22 ARG CD C -13.261 -1.085 -6.196 1.00 . B B . 22 ARG CD 1 1 1 626 2 2 22 ARG CG C -11.745 -1.218 -6.042 1.00 . B B . 22 ARG CG 1 1 1 627 2 2 22 ARG CZ C -15.160 -1.948 -4.965 1.00 . B B . 22 ARG CZ 1 1 1 628 2 2 22 ARG H H -11.275 1.235 -6.060 1.00 . B B . 22 ARG H 1 1 1 629 2 2 22 ARG HA H -13.050 0.273 -3.976 1.00 . B B . 22 ARG HA 1 1 1 630 2 2 22 ARG HB2 H -10.267 -0.737 -4.557 1.00 . B B . 22 ARG HB2 1 1 1 631 2 2 22 ARG HB3 H -11.652 -1.627 -3.943 1.00 . B B . 22 ARG HB3 1 1 1 632 2 2 22 ARG HD2 H -13.574 -0.107 -5.859 1.00 . B B . 22 ARG HD2 1 1 1 633 2 2 22 ARG HD3 H -13.531 -1.211 -7.235 1.00 . B B . 22 ARG HD3 1 1 1 634 2 2 22 ARG HE H -13.460 -2.957 -5.151 1.00 . B B . 22 ARG HE 1 1 1 635 2 2 22 ARG HG2 H -11.250 -0.556 -6.738 1.00 . B B . 22 ARG HG2 1 1 1 636 2 2 22 ARG HG3 H -11.454 -2.238 -6.246 1.00 . B B . 22 ARG HG3 1 1 1 637 2 2 22 ARG HH11 H -15.555 -0.501 -6.292 1.00 . B B . 22 ARG HH11 1 1 1 638 2 2 22 ARG HH12 H -16.853 -0.909 -5.220 1.00 . B B . 22 ARG HH12 1 1 1 639 2 2 22 ARG HH21 H -15.048 -3.347 -3.538 1.00 . B B . 22 ARG HH21 1 1 1 640 2 2 22 ARG HH22 H -16.566 -2.523 -3.663 1.00 . B B . 22 ARG HH22 1 1 1 641 2 2 22 ARG N N -11.921 1.403 -5.346 1.00 . B B . 22 ARG N 1 1 1 642 2 2 22 ARG NE N -13.935 -2.131 -5.379 1.00 . B B . 22 ARG NE 1 1 1 643 2 2 22 ARG NH1 N -15.914 -1.049 -5.537 1.00 . B B . 22 ARG NH1 1 1 1 644 2 2 22 ARG NH2 N -15.627 -2.661 -3.978 1.00 . B B . 22 ARG NH2 1 1 1 645 2 2 22 ARG O O -11.160 0.398 -1.973 1.00 . B B . 22 ARG O 1 1 1 646 2 2 23 GLY C C -9.165 1.894 -1.338 1.00 . B B . 23 GLY C 1 1 1 647 2 2 23 GLY CA C -10.170 2.895 -1.907 1.00 . B B . 23 GLY CA 1 1 1 648 2 2 23 GLY H H -10.989 2.793 -3.897 1.00 . B B . 23 GLY H 1 1 1 649 2 2 23 GLY HA2 H -9.653 3.789 -2.227 1.00 . B B . 23 GLY HA2 1 1 1 650 2 2 23 GLY HA3 H -10.893 3.148 -1.146 1.00 . B B . 23 GLY HA3 1 1 1 651 2 2 23 GLY N N -10.865 2.279 -3.071 1.00 . B B . 23 GLY N 1 1 1 652 2 2 23 GLY O O -8.879 0.880 -1.944 1.00 . B B . 23 GLY O 1 1 1 653 2 2 24 PHE C C -7.935 1.016 1.899 1.00 . B B . 24 PHE C 1 1 1 654 2 2 24 PHE CA C -7.650 1.203 0.409 1.00 . B B . 24 PHE CA 1 1 1 655 2 2 24 PHE CB C -6.224 1.728 0.223 1.00 . B B . 24 PHE CB 1 1 1 656 2 2 24 PHE CD1 C -6.594 4.000 -0.815 1.00 . B B . 24 PHE CD1 1 1 1 657 2 2 24 PHE CD2 C -5.779 3.877 1.468 1.00 . B B . 24 PHE CD2 1 1 1 658 2 2 24 PHE CE1 C -6.561 5.400 -0.751 1.00 . B B . 24 PHE CE1 1 1 1 659 2 2 24 PHE CE2 C -5.744 5.276 1.531 1.00 . B B . 24 PHE CE2 1 1 1 660 2 2 24 PHE CG C -6.204 3.238 0.295 1.00 . B B . 24 PHE CG 1 1 1 661 2 2 24 PHE CZ C -6.134 6.038 0.422 1.00 . B B . 24 PHE CZ 1 1 1 662 2 2 24 PHE H H -8.870 2.977 0.303 1.00 . B B . 24 PHE H 1 1 1 663 2 2 24 PHE HA H -7.744 0.251 -0.091 1.00 . B B . 24 PHE HA 1 1 1 664 2 2 24 PHE HB2 H -5.592 1.325 1.000 1.00 . B B . 24 PHE HB2 1 1 1 665 2 2 24 PHE HB3 H -5.853 1.411 -0.739 1.00 . B B . 24 PHE HB3 1 1 1 666 2 2 24 PHE HD1 H -6.923 3.509 -1.719 1.00 . B B . 24 PHE HD1 1 1 1 667 2 2 24 PHE HD2 H -5.479 3.290 2.324 1.00 . B B . 24 PHE HD2 1 1 1 668 2 2 24 PHE HE1 H -6.863 5.987 -1.605 1.00 . B B . 24 PHE HE1 1 1 1 669 2 2 24 PHE HE2 H -5.417 5.768 2.436 1.00 . B B . 24 PHE HE2 1 1 1 670 2 2 24 PHE HZ H -6.103 7.117 0.469 1.00 . B B . 24 PHE HZ 1 1 1 671 2 2 24 PHE N N -8.628 2.159 -0.179 1.00 . B B . 24 PHE N 1 1 1 672 2 2 24 PHE O O -8.706 1.743 2.493 1.00 . B B . 24 PHE O 1 1 1 673 2 2 25 PHE C C -6.573 0.620 4.778 1.00 . B B . 25 PHE C 1 1 1 674 2 2 25 PHE CA C -7.548 -0.215 3.953 1.00 . B B . 25 PHE CA 1 1 1 675 2 2 25 PHE CB C -7.324 -1.700 4.248 1.00 . B B . 25 PHE CB 1 1 1 676 2 2 25 PHE CD1 C -8.229 -1.731 6.601 1.00 . B B . 25 PHE CD1 1 1 1 677 2 2 25 PHE CD2 C -9.351 -3.047 4.898 1.00 . B B . 25 PHE CD2 1 1 1 678 2 2 25 PHE CE1 C -9.159 -2.169 7.552 1.00 . B B . 25 PHE CE1 1 1 1 679 2 2 25 PHE CE2 C -10.281 -3.486 5.850 1.00 . B B . 25 PHE CE2 1 1 1 680 2 2 25 PHE CG C -8.325 -2.170 5.274 1.00 . B B . 25 PHE CG 1 1 1 681 2 2 25 PHE CZ C -10.185 -3.047 7.177 1.00 . B B . 25 PHE CZ 1 1 1 682 2 2 25 PHE H H -6.705 -0.538 1.999 1.00 . B B . 25 PHE H 1 1 1 683 2 2 25 PHE HA H -8.554 0.054 4.210 1.00 . B B . 25 PHE HA 1 1 1 684 2 2 25 PHE HB2 H -7.447 -2.269 3.338 1.00 . B B . 25 PHE HB2 1 1 1 685 2 2 25 PHE HB3 H -6.324 -1.843 4.630 1.00 . B B . 25 PHE HB3 1 1 1 686 2 2 25 PHE HD1 H -7.438 -1.054 6.890 1.00 . B B . 25 PHE HD1 1 1 1 687 2 2 25 PHE HD2 H -9.424 -3.385 3.875 1.00 . B B . 25 PHE HD2 1 1 1 688 2 2 25 PHE HE1 H -9.085 -1.831 8.575 1.00 . B B . 25 PHE HE1 1 1 1 689 2 2 25 PHE HE2 H -11.071 -4.163 5.561 1.00 . B B . 25 PHE HE2 1 1 1 690 2 2 25 PHE HZ H -10.901 -3.386 7.911 1.00 . B B . 25 PHE HZ 1 1 1 691 2 2 25 PHE N N -7.319 0.036 2.503 1.00 . B B . 25 PHE N 1 1 1 692 2 2 25 PHE O O -6.963 1.428 5.595 1.00 . B B . 25 PHE O 1 1 1 693 2 2 26 TYR C C -4.519 1.040 6.821 1.00 . B B . 26 TYR C 1 1 1 694 2 2 26 TYR CA C -4.283 1.201 5.317 1.00 . B B . 26 TYR CA 1 1 1 695 2 2 26 TYR CB C -4.388 2.678 4.941 1.00 . B B . 26 TYR CB 1 1 1 696 2 2 26 TYR CD1 C -2.124 3.156 5.947 1.00 . B B . 26 TYR CD1 1 1 1 697 2 2 26 TYR CD2 C -3.991 4.592 6.534 1.00 . B B . 26 TYR CD2 1 1 1 698 2 2 26 TYR CE1 C -1.281 3.915 6.769 1.00 . B B . 26 TYR CE1 1 1 1 699 2 2 26 TYR CE2 C -3.147 5.351 7.357 1.00 . B B . 26 TYR CE2 1 1 1 700 2 2 26 TYR CG C -3.479 3.494 5.830 1.00 . B B . 26 TYR CG 1 1 1 701 2 2 26 TYR CZ C -1.792 5.013 7.474 1.00 . B B . 26 TYR CZ 1 1 1 702 2 2 26 TYR H H -5.031 -0.227 3.893 1.00 . B B . 26 TYR H 1 1 1 703 2 2 26 TYR HA H -3.298 0.835 5.067 1.00 . B B . 26 TYR HA 1 1 1 704 2 2 26 TYR HB2 H -4.096 2.809 3.911 1.00 . B B . 26 TYR HB2 1 1 1 705 2 2 26 TYR HB3 H -5.406 3.006 5.069 1.00 . B B . 26 TYR HB3 1 1 1 706 2 2 26 TYR HD1 H -1.730 2.309 5.405 1.00 . B B . 26 TYR HD1 1 1 1 707 2 2 26 TYR HD2 H -5.034 4.853 6.444 1.00 . B B . 26 TYR HD2 1 1 1 708 2 2 26 TYR HE1 H -0.237 3.654 6.860 1.00 . B B . 26 TYR HE1 1 1 1 709 2 2 26 TYR HE2 H -3.541 6.198 7.900 1.00 . B B . 26 TYR HE2 1 1 1 710 2 2 26 TYR HH H -1.238 5.634 9.192 1.00 . B B . 26 TYR HH 1 1 1 711 2 2 26 TYR N N -5.307 0.427 4.560 1.00 . B B . 26 TYR N 1 1 1 712 2 2 26 TYR O O -5.468 1.562 7.371 1.00 . B B . 26 TYR O 1 1 1 713 2 2 26 TYR OH O -0.961 5.762 8.282 1.00 . B B . 26 TYR OH 1 1 1 714 2 2 27 THR C C -2.747 0.919 9.701 1.00 . B B . 27 THR C 1 1 1 715 2 2 27 THR CA C -3.832 0.135 8.957 1.00 . B B . 27 THR CA 1 1 1 716 2 2 27 THR CB C -3.709 -1.353 9.298 1.00 . B B . 27 THR CB 1 1 1 717 2 2 27 THR CG2 C -4.502 -2.182 8.287 1.00 . B B . 27 THR CG2 1 1 1 718 2 2 27 THR H H -2.898 -0.087 7.029 1.00 . B B . 27 THR H 1 1 1 719 2 2 27 THR HA H -4.806 0.493 9.255 1.00 . B B . 27 THR HA 1 1 1 720 2 2 27 THR HB H -4.100 -1.530 10.289 1.00 . B B . 27 THR HB 1 1 1 721 2 2 27 THR HG1 H -2.027 -1.602 8.354 1.00 . B B . 27 THR HG1 1 1 1 722 2 2 27 THR HG21 H -5.439 -1.690 8.072 1.00 . B B . 27 THR HG21 1 1 1 723 2 2 27 THR HG22 H -4.697 -3.163 8.697 1.00 . B B . 27 THR HG22 1 1 1 724 2 2 27 THR HG23 H -3.931 -2.280 7.375 1.00 . B B . 27 THR HG23 1 1 1 725 2 2 27 THR N N -3.660 0.324 7.490 1.00 . B B . 27 THR N 1 1 1 726 2 2 27 THR O O -2.030 1.710 9.120 1.00 . B B . 27 THR O 1 1 1 727 2 2 27 THR OG1 O -2.341 -1.733 9.253 1.00 . B B . 27 THR OG1 1 1 1 728 2 2 28 LYS C C -1.425 0.792 13.137 1.00 . B B . 28 LYS C 1 1 1 729 2 2 28 LYS CA C -1.572 1.423 11.758 1.00 . B B . 28 LYS CA 1 1 1 730 2 2 28 LYS CB C -1.976 2.883 11.973 1.00 . B B . 28 LYS CB 1 1 1 731 2 2 28 LYS CD C 0.540 3.230 11.838 1.00 . B B . 28 LYS CD 1 1 1 732 2 2 28 LYS CE C 1.482 4.228 12.536 1.00 . B B . 28 LYS CE 1 1 1 733 2 2 28 LYS CG C -0.848 3.854 11.588 1.00 . B B . 28 LYS CG 1 1 1 734 2 2 28 LYS H H -3.193 0.055 11.426 1.00 . B B . 28 LYS H 1 1 1 735 2 2 28 LYS HA H -0.634 1.376 11.230 1.00 . B B . 28 LYS HA 1 1 1 736 2 2 28 LYS HB2 H -2.854 3.098 11.391 1.00 . B B . 28 LYS HB2 1 1 1 737 2 2 28 LYS HB3 H -2.213 3.022 13.017 1.00 . B B . 28 LYS HB3 1 1 1 738 2 2 28 LYS HD2 H 0.433 2.355 12.461 1.00 . B B . 28 LYS HD2 1 1 1 739 2 2 28 LYS HD3 H 0.974 2.939 10.892 1.00 . B B . 28 LYS HD3 1 1 1 740 2 2 28 LYS HE2 H 1.601 3.941 13.571 1.00 . B B . 28 LYS HE2 1 1 1 741 2 2 28 LYS HE3 H 2.447 4.203 12.049 1.00 . B B . 28 LYS HE3 1 1 1 742 2 2 28 LYS HG2 H -0.943 4.110 10.545 1.00 . B B . 28 LYS HG2 1 1 1 743 2 2 28 LYS HG3 H -0.953 4.745 12.184 1.00 . B B . 28 LYS HG3 1 1 1 744 2 2 28 LYS HZ1 H 0.475 5.768 11.552 1.00 . B B . 28 LYS HZ1 1 1 1 745 2 2 28 LYS HZ2 H 1.708 6.299 12.590 1.00 . B B . 28 LYS HZ2 1 1 1 746 2 2 28 LYS HZ3 H 0.234 5.746 13.232 1.00 . B B . 28 LYS HZ3 1 1 1 747 2 2 28 LYS N N -2.615 0.700 10.980 1.00 . B B . 28 LYS N 1 1 1 748 2 2 28 LYS NZ N 0.933 5.615 12.472 1.00 . B B . 28 LYS NZ 1 1 1 749 2 2 28 LYS O O -0.340 0.403 13.522 1.00 . B B . 28 LYS O 1 1 1 750 2 2 29 PRO C C -2.687 -1.283 15.231 1.00 . B B . 29 PRO C 1 1 1 751 2 2 29 PRO CA C -2.510 0.237 15.238 1.00 . B B . 29 PRO CA 1 1 1 752 2 2 29 PRO CB C -3.722 0.925 15.862 1.00 . B B . 29 PRO CB 1 1 1 753 2 2 29 PRO CD C -3.850 1.226 13.416 1.00 . B B . 29 PRO CD 1 1 1 754 2 2 29 PRO CG C -4.681 1.278 14.703 1.00 . B B . 29 PRO CG 1 1 1 755 2 2 29 PRO HA H -1.611 0.523 15.759 1.00 . B B . 29 PRO HA 1 1 1 756 2 2 29 PRO HB2 H -4.205 0.269 16.569 1.00 . B B . 29 PRO HB2 1 1 1 757 2 2 29 PRO HB3 H -3.406 1.837 16.342 1.00 . B B . 29 PRO HB3 1 1 1 758 2 2 29 PRO HD2 H -4.292 0.523 12.724 1.00 . B B . 29 PRO HD2 1 1 1 759 2 2 29 PRO HD3 H -3.793 2.200 12.979 1.00 . B B . 29 PRO HD3 1 1 1 760 2 2 29 PRO HG2 H -5.487 0.557 14.658 1.00 . B B . 29 PRO HG2 1 1 1 761 2 2 29 PRO HG3 H -5.078 2.271 14.841 1.00 . B B . 29 PRO HG3 1 1 1 762 2 2 29 PRO N N -2.514 0.759 13.869 1.00 . B B . 29 PRO N 1 1 1 763 2 2 29 PRO O O -1.968 -2.007 15.891 1.00 . B B . 29 PRO O 1 1 1 764 2 2 30 THR C C -4.150 -3.668 12.995 1.00 . B B . 30 THR C 1 1 1 765 2 2 30 THR CA C -3.869 -3.243 14.438 1.00 . B B . 30 THR CA 1 1 1 766 2 2 30 THR CB C -5.066 -3.606 15.320 1.00 . B B . 30 THR CB 1 1 1 767 2 2 30 THR CG2 C -4.594 -3.818 16.760 1.00 . B B . 30 THR CG2 1 1 1 768 2 2 30 THR H H -4.211 -1.170 13.964 1.00 . B B . 30 THR H 1 1 1 769 2 2 30 THR HA H -2.989 -3.755 14.798 1.00 . B B . 30 THR HA 1 1 1 770 2 2 30 THR HB H -5.520 -4.514 14.957 1.00 . B B . 30 THR HB 1 1 1 771 2 2 30 THR HG1 H -5.639 -1.793 15.733 1.00 . B B . 30 THR HG1 1 1 1 772 2 2 30 THR HG21 H -4.790 -2.928 17.338 1.00 . B B . 30 THR HG21 1 1 1 773 2 2 30 THR HG22 H -3.533 -4.024 16.764 1.00 . B B . 30 THR HG22 1 1 1 774 2 2 30 THR HG23 H -5.125 -4.653 17.194 1.00 . B B . 30 THR HG23 1 1 1 775 2 2 30 THR N N -3.642 -1.772 14.488 1.00 . B B . 30 THR N 1 1 1 776 2 2 30 THR O O -5.312 -3.699 12.624 1.00 . B B . 30 THR O 1 1 1 777 2 2 30 THR OXT O -3.199 -3.956 12.287 1.00 . B B . 30 THR OXT 1 1 1 778 2 2 30 THR OG1 O -6.018 -2.551 15.283 1.00 . B B . 30 THR OG1 1 1 2 779 1 1 1 GLY C C 0.336 -4.776 8.441 1.00 . A A . 1 GLY C 1 1 2 780 1 1 1 GLY CA C -0.567 -4.769 9.627 1.00 . A A . 1 GLY CA 1 1 2 781 1 1 1 GLY H1 H -2.273 -4.180 8.521 1.00 . A A . 1 GLY H1 1 1 2 782 1 1 1 GLY H2 H -2.503 -4.138 10.203 1.00 . A A . 1 GLY H2 1 1 2 783 1 1 1 GLY H3 H -2.488 -5.626 9.384 1.00 . A A . 1 GLY H3 1 1 2 784 1 1 1 GLY HA2 H -0.173 -3.893 9.789 1.00 . A A . 1 GLY HA2 1 1 2 785 1 1 1 GLY HA3 H -0.392 -5.516 10.508 1.00 . A A . 1 GLY HA3 1 1 2 786 1 1 1 GLY N N -2.078 -4.671 9.417 1.00 . A A . 1 GLY N 1 1 2 787 1 1 1 GLY O O 1.324 -5.482 8.402 1.00 . A A . 1 GLY O 1 1 2 788 1 1 2 ILE C C 1.886 -2.805 6.352 1.00 . A A . 2 ILE C 1 1 2 789 1 1 2 ILE CA C 0.882 -3.952 6.228 1.00 . A A . 2 ILE CA 1 1 2 790 1 1 2 ILE CB C 0.000 -3.722 4.997 1.00 . A A . 2 ILE CB 1 1 2 791 1 1 2 ILE CD1 C 0.240 -2.922 2.614 1.00 . A A . 2 ILE CD1 1 1 2 792 1 1 2 ILE CG1 C 0.879 -3.753 3.735 1.00 . A A . 2 ILE CG1 1 1 2 793 1 1 2 ILE CG2 C -0.701 -2.365 5.128 1.00 . A A . 2 ILE CG2 1 1 2 794 1 1 2 ILE H H -0.777 -3.432 7.498 1.00 . A A . 2 ILE H 1 1 2 795 1 1 2 ILE HA H 1.410 -4.884 6.126 1.00 . A A . 2 ILE HA 1 1 2 796 1 1 2 ILE HB H -0.743 -4.505 4.940 1.00 . A A . 2 ILE HB 1 1 2 797 1 1 2 ILE HD11 H 0.407 -1.871 2.804 1.00 . A A . 2 ILE HD11 1 1 2 798 1 1 2 ILE HD12 H -0.822 -3.117 2.582 1.00 . A A . 2 ILE HD12 1 1 2 799 1 1 2 ILE HD13 H 0.685 -3.192 1.668 1.00 . A A . 2 ILE HD13 1 1 2 800 1 1 2 ILE HG12 H 1.850 -3.351 3.969 1.00 . A A . 2 ILE HG12 1 1 2 801 1 1 2 ILE HG13 H 0.987 -4.775 3.402 1.00 . A A . 2 ILE HG13 1 1 2 802 1 1 2 ILE HG21 H -0.124 -1.609 4.616 1.00 . A A . 2 ILE HG21 1 1 2 803 1 1 2 ILE HG22 H -0.790 -2.104 6.172 1.00 . A A . 2 ILE HG22 1 1 2 804 1 1 2 ILE HG23 H -1.686 -2.425 4.688 1.00 . A A . 2 ILE HG23 1 1 2 805 1 1 2 ILE N N 0.024 -3.993 7.445 1.00 . A A . 2 ILE N 1 1 2 806 1 1 2 ILE O O 2.958 -2.836 5.786 1.00 . A A . 2 ILE O 1 1 2 807 1 1 3 ABA C C 3.861 -1.085 7.575 1.00 . A A . 3 ABA C 1 1 2 808 1 1 3 ABA CA C 2.438 -0.626 7.263 1.00 . A A . 3 ABA CA 1 1 2 809 1 1 3 ABA CB C 1.914 0.222 8.419 1.00 . A A . 3 ABA CB 1 1 2 810 1 1 3 ABA CG C 0.400 0.395 8.284 1.00 . A A . 3 ABA CG 1 1 2 811 1 1 3 ABA H H 0.668 -1.795 7.527 1.00 . A A . 3 ABA H 1 1 2 812 1 1 3 ABA HA H 2.443 -0.039 6.365 1.00 . A A . 3 ABA HA 1 1 2 813 1 1 3 ABA HB2 H 2.137 -0.270 9.355 1.00 . A A . 3 ABA HB2 1 1 2 814 1 1 3 ABA HB3 H 2.386 1.184 8.397 1.00 . A A . 3 ABA HB3 1 1 2 815 1 1 3 ABA HG1 H -0.101 -0.430 8.769 1.00 . A A . 3 ABA HG1 1 1 2 816 1 1 3 ABA HG2 H 0.131 0.414 7.237 1.00 . A A . 3 ABA HG2 1 1 2 817 1 1 3 ABA HG3 H 0.099 1.322 8.749 1.00 . A A . 3 ABA HG3 1 1 2 818 1 1 3 ABA N N 1.536 -1.793 7.088 1.00 . A A . 3 ABA N 1 1 2 819 1 1 3 ABA O O 4.819 -0.612 7.000 1.00 . A A . 3 ABA O 1 1 2 820 1 1 4 GLU C C 5.949 -3.269 7.682 1.00 . A A . 4 GLU C 1 1 2 821 1 1 4 GLU CA C 5.355 -2.483 8.856 1.00 . A A . 4 GLU CA 1 1 2 822 1 1 4 GLU CB C 5.215 -3.371 10.098 1.00 . A A . 4 GLU CB 1 1 2 823 1 1 4 GLU CD C 6.860 -4.505 11.594 1.00 . A A . 4 GLU CD 1 1 2 824 1 1 4 GLU CG C 6.345 -4.395 10.157 1.00 . A A . 4 GLU CG 1 1 2 825 1 1 4 GLU H H 3.221 -2.355 8.938 1.00 . A A . 4 GLU H 1 1 2 826 1 1 4 GLU HA H 5.993 -1.642 9.085 1.00 . A A . 4 GLU HA 1 1 2 827 1 1 4 GLU HB2 H 5.245 -2.753 10.983 1.00 . A A . 4 GLU HB2 1 1 2 828 1 1 4 GLU HB3 H 4.268 -3.885 10.055 1.00 . A A . 4 GLU HB3 1 1 2 829 1 1 4 GLU HG2 H 5.971 -5.354 9.830 1.00 . A A . 4 GLU HG2 1 1 2 830 1 1 4 GLU HG3 H 7.148 -4.078 9.510 1.00 . A A . 4 GLU HG3 1 1 2 831 1 1 4 GLU N N 4.005 -1.994 8.487 1.00 . A A . 4 GLU N 1 1 2 832 1 1 4 GLU O O 7.080 -3.058 7.291 1.00 . A A . 4 GLU O 1 1 2 833 1 1 4 GLU OE1 O 7.292 -3.496 12.126 1.00 . A A . 4 GLU OE1 1 1 2 834 1 1 4 GLU OE2 O 6.813 -5.596 12.138 1.00 . A A . 4 GLU OE2 1 1 2 835 1 1 5 GLN C C 5.850 -4.052 4.744 1.00 . A A . 5 GLN C 1 1 2 836 1 1 5 GLN CA C 5.723 -4.962 5.968 1.00 . A A . 5 GLN CA 1 1 2 837 1 1 5 GLN CB C 4.761 -6.109 5.655 1.00 . A A . 5 GLN CB 1 1 2 838 1 1 5 GLN CD C 6.074 -8.214 5.971 1.00 . A A . 5 GLN CD 1 1 2 839 1 1 5 GLN CG C 5.521 -7.229 4.940 1.00 . A A . 5 GLN CG 1 1 2 840 1 1 5 GLN H H 4.285 -4.327 7.442 1.00 . A A . 5 GLN H 1 1 2 841 1 1 5 GLN HA H 6.693 -5.362 6.222 1.00 . A A . 5 GLN HA 1 1 2 842 1 1 5 GLN HB2 H 4.340 -6.486 6.575 1.00 . A A . 5 GLN HB2 1 1 2 843 1 1 5 GLN HB3 H 3.969 -5.750 5.016 1.00 . A A . 5 GLN HB3 1 1 2 844 1 1 5 GLN HE21 H 4.601 -9.523 5.724 1.00 . A A . 5 GLN HE21 1 1 2 845 1 1 5 GLN HE22 H 5.779 -9.963 6.863 1.00 . A A . 5 GLN HE22 1 1 2 846 1 1 5 GLN HG2 H 4.851 -7.746 4.269 1.00 . A A . 5 GLN HG2 1 1 2 847 1 1 5 GLN HG3 H 6.339 -6.805 4.376 1.00 . A A . 5 GLN HG3 1 1 2 848 1 1 5 GLN N N 5.196 -4.171 7.115 1.00 . A A . 5 GLN N 1 1 2 849 1 1 5 GLN NE2 N 5.431 -9.326 6.206 1.00 . A A . 5 GLN NE2 1 1 2 850 1 1 5 GLN O O 6.591 -4.329 3.824 1.00 . A A . 5 GLN O 1 1 2 851 1 1 5 GLN OE1 O 7.103 -7.971 6.569 1.00 . A A . 5 GLN OE1 1 1 2 852 1 1 6 CYS C C 5.978 -0.771 3.948 1.00 . A A . 6 CYS C 1 1 2 853 1 1 6 CYS CA C 5.197 -2.028 3.581 1.00 . A A . 6 CYS CA 1 1 2 854 1 1 6 CYS CB C 3.777 -1.669 3.147 1.00 . A A . 6 CYS CB 1 1 2 855 1 1 6 CYS H H 4.541 -2.765 5.487 1.00 . A A . 6 CYS H 1 1 2 856 1 1 6 CYS HA H 5.704 -2.522 2.751 1.00 . A A . 6 CYS HA 1 1 2 857 1 1 6 CYS HB2 H 3.079 -2.007 3.886 1.00 . A A . 6 CYS HB2 1 1 2 858 1 1 6 CYS HB3 H 3.679 -0.612 3.032 1.00 . A A . 6 CYS HB3 1 1 2 859 1 1 6 CYS N N 5.130 -2.968 4.731 1.00 . A A . 6 CYS N 1 1 2 860 1 1 6 CYS O O 6.187 0.098 3.126 1.00 . A A . 6 CYS O 1 1 2 861 1 1 6 CYS SG S 3.448 -2.489 1.583 1.00 . A A . 6 CYS SG 1 1 2 862 1 1 7 CYS C C 8.638 0.076 5.905 1.00 . A A . 7 CYS C 1 1 2 863 1 1 7 CYS CA C 7.223 0.526 5.546 1.00 . A A . 7 CYS CA 1 1 2 864 1 1 7 CYS CB C 6.573 1.225 6.736 1.00 . A A . 7 CYS CB 1 1 2 865 1 1 7 CYS H H 6.272 -1.388 5.808 1.00 . A A . 7 CYS H 1 1 2 866 1 1 7 CYS HA H 7.268 1.204 4.711 1.00 . A A . 7 CYS HA 1 1 2 867 1 1 7 CYS HB2 H 5.528 1.402 6.526 1.00 . A A . 7 CYS HB2 1 1 2 868 1 1 7 CYS HB3 H 6.659 0.600 7.600 1.00 . A A . 7 CYS HB3 1 1 2 869 1 1 7 CYS N N 6.432 -0.671 5.160 1.00 . A A . 7 CYS N 1 1 2 870 1 1 7 CYS O O 9.589 0.823 5.786 1.00 . A A . 7 CYS O 1 1 2 871 1 1 7 CYS SG S 7.418 2.802 7.035 1.00 . A A . 7 CYS SG 1 1 2 872 1 1 8 THR C C 10.630 -2.501 5.460 1.00 . A A . 8 THR C 1 1 2 873 1 1 8 THR CA C 10.137 -1.675 6.648 1.00 . A A . 8 THR CA 1 1 2 874 1 1 8 THR CB C 10.062 -2.559 7.897 1.00 . A A . 8 THR CB 1 1 2 875 1 1 8 THR CG2 C 9.227 -1.861 8.972 1.00 . A A . 8 THR CG2 1 1 2 876 1 1 8 THR H H 8.007 -1.746 6.378 1.00 . A A . 8 THR H 1 1 2 877 1 1 8 THR HA H 10.813 -0.850 6.823 1.00 . A A . 8 THR HA 1 1 2 878 1 1 8 THR HB H 11.058 -2.729 8.276 1.00 . A A . 8 THR HB 1 1 2 879 1 1 8 THR HG1 H 10.033 -4.240 6.919 1.00 . A A . 8 THR HG1 1 1 2 880 1 1 8 THR HG21 H 8.258 -2.334 9.040 1.00 . A A . 8 THR HG21 1 1 2 881 1 1 8 THR HG22 H 9.101 -0.820 8.710 1.00 . A A . 8 THR HG22 1 1 2 882 1 1 8 THR HG23 H 9.731 -1.934 9.923 1.00 . A A . 8 THR HG23 1 1 2 883 1 1 8 THR N N 8.785 -1.155 6.314 1.00 . A A . 8 THR N 1 1 2 884 1 1 8 THR O O 11.811 -2.736 5.295 1.00 . A A . 8 THR O 1 1 2 885 1 1 8 THR OG1 O 9.466 -3.804 7.559 1.00 . A A . 8 THR OG1 1 1 2 886 1 1 9 SER C C 9.730 -2.955 2.160 1.00 . A A . 9 SER C 1 1 2 887 1 1 9 SER CA C 10.121 -3.726 3.427 1.00 . A A . 9 SER CA 1 1 2 888 1 1 9 SER CB C 9.423 -5.089 3.451 1.00 . A A . 9 SER CB 1 1 2 889 1 1 9 SER H H 8.778 -2.716 4.774 1.00 . A A . 9 SER H 1 1 2 890 1 1 9 SER HA H 11.192 -3.872 3.438 1.00 . A A . 9 SER HA 1 1 2 891 1 1 9 SER HB2 H 8.417 -4.988 3.084 1.00 . A A . 9 SER HB2 1 1 2 892 1 1 9 SER HB3 H 9.966 -5.779 2.815 1.00 . A A . 9 SER HB3 1 1 2 893 1 1 9 SER HG H 8.491 -5.848 4.980 1.00 . A A . 9 SER HG 1 1 2 894 1 1 9 SER N N 9.723 -2.930 4.621 1.00 . A A . 9 SER N 1 1 2 895 1 1 9 SER O O 9.904 -1.755 2.083 1.00 . A A . 9 SER O 1 1 2 896 1 1 9 SER OG O 9.392 -5.579 4.784 1.00 . A A . 9 SER OG 1 1 2 897 1 1 10 ILE C C 7.400 -3.288 -0.487 1.00 . A A . 10 ILE C 1 1 2 898 1 1 10 ILE CA C 8.847 -2.924 -0.100 1.00 . A A . 10 ILE CA 1 1 2 899 1 1 10 ILE CB C 9.830 -3.375 -1.203 1.00 . A A . 10 ILE CB 1 1 2 900 1 1 10 ILE CD1 C 11.507 -1.929 -0.028 1.00 . A A . 10 ILE CD1 1 1 2 901 1 1 10 ILE CG1 C 10.934 -2.330 -1.387 1.00 . A A . 10 ILE CG1 1 1 2 902 1 1 10 ILE CG2 C 9.107 -3.568 -2.539 1.00 . A A . 10 ILE CG2 1 1 2 903 1 1 10 ILE H H 9.099 -4.596 1.231 1.00 . A A . 10 ILE H 1 1 2 904 1 1 10 ILE HA H 8.928 -1.857 0.043 1.00 . A A . 10 ILE HA 1 1 2 905 1 1 10 ILE HB H 10.279 -4.311 -0.909 1.00 . A A . 10 ILE HB 1 1 2 906 1 1 10 ILE HD11 H 10.927 -1.117 0.382 1.00 . A A . 10 ILE HD11 1 1 2 907 1 1 10 ILE HD12 H 12.532 -1.612 -0.152 1.00 . A A . 10 ILE HD12 1 1 2 908 1 1 10 ILE HD13 H 11.471 -2.774 0.641 1.00 . A A . 10 ILE HD13 1 1 2 909 1 1 10 ILE HG12 H 11.722 -2.750 -1.995 1.00 . A A . 10 ILE HG12 1 1 2 910 1 1 10 ILE HG13 H 10.529 -1.461 -1.876 1.00 . A A . 10 ILE HG13 1 1 2 911 1 1 10 ILE HG21 H 8.253 -4.216 -2.397 1.00 . A A . 10 ILE HG21 1 1 2 912 1 1 10 ILE HG22 H 9.781 -4.015 -3.248 1.00 . A A . 10 ILE HG22 1 1 2 913 1 1 10 ILE HG23 H 8.774 -2.610 -2.907 1.00 . A A . 10 ILE HG23 1 1 2 914 1 1 10 ILE N N 9.222 -3.628 1.161 1.00 . A A . 10 ILE N 1 1 2 915 1 1 10 ILE O O 6.789 -4.158 0.101 1.00 . A A . 10 ILE O 1 1 2 916 1 1 11 CYS C C 5.326 -2.741 -3.441 1.00 . A A . 11 CYS C 1 1 2 917 1 1 11 CYS CA C 5.468 -2.958 -1.936 1.00 . A A . 11 CYS CA 1 1 2 918 1 1 11 CYS CB C 4.470 -2.053 -1.227 1.00 . A A . 11 CYS CB 1 1 2 919 1 1 11 CYS H H 7.378 -1.941 -1.958 1.00 . A A . 11 CYS H 1 1 2 920 1 1 11 CYS HA H 5.242 -3.984 -1.702 1.00 . A A . 11 CYS HA 1 1 2 921 1 1 11 CYS HB2 H 4.433 -1.099 -1.726 1.00 . A A . 11 CYS HB2 1 1 2 922 1 1 11 CYS HB3 H 3.491 -2.509 -1.244 1.00 . A A . 11 CYS HB3 1 1 2 923 1 1 11 CYS N N 6.861 -2.635 -1.492 1.00 . A A . 11 CYS N 1 1 2 924 1 1 11 CYS O O 5.525 -1.652 -3.943 1.00 . A A . 11 CYS O 1 1 2 925 1 1 11 CYS SG S 4.996 -1.823 0.475 1.00 . A A . 11 CYS SG 1 1 2 926 1 1 12 SER C C 3.408 -2.941 -5.869 1.00 . A A . 12 SER C 1 1 2 927 1 1 12 SER CA C 4.760 -3.597 -5.626 1.00 . A A . 12 SER CA 1 1 2 928 1 1 12 SER CB C 4.810 -4.957 -6.323 1.00 . A A . 12 SER CB 1 1 2 929 1 1 12 SER H H 4.774 -4.624 -3.735 1.00 . A A . 12 SER H 1 1 2 930 1 1 12 SER HA H 5.537 -2.961 -6.026 1.00 . A A . 12 SER HA 1 1 2 931 1 1 12 SER HB2 H 4.033 -5.007 -7.068 1.00 . A A . 12 SER HB2 1 1 2 932 1 1 12 SER HB3 H 5.771 -5.077 -6.803 1.00 . A A . 12 SER HB3 1 1 2 933 1 1 12 SER HG H 5.363 -6.577 -5.400 1.00 . A A . 12 SER HG 1 1 2 934 1 1 12 SER N N 4.952 -3.761 -4.162 1.00 . A A . 12 SER N 1 1 2 935 1 1 12 SER O O 2.496 -3.050 -5.073 1.00 . A A . 12 SER O 1 1 2 936 1 1 12 SER OG O 4.604 -5.989 -5.369 1.00 . A A . 12 SER OG 1 1 2 937 1 1 13 LEU C C 0.858 -2.564 -7.353 1.00 . A A . 13 LEU C 1 1 2 938 1 1 13 LEU CA C 2.002 -1.555 -7.265 1.00 . A A . 13 LEU CA 1 1 2 939 1 1 13 LEU CB C 2.146 -0.851 -8.606 1.00 . A A . 13 LEU CB 1 1 2 940 1 1 13 LEU CD1 C 1.785 -1.611 -10.953 1.00 . A A . 13 LEU CD1 1 1 2 941 1 1 13 LEU CD2 C 4.030 -1.851 -9.896 1.00 . A A . 13 LEU CD2 1 1 2 942 1 1 13 LEU CG C 2.523 -1.895 -9.650 1.00 . A A . 13 LEU CG 1 1 2 943 1 1 13 LEU H H 4.041 -2.172 -7.571 1.00 . A A . 13 LEU H 1 1 2 944 1 1 13 LEU HA H 1.788 -0.834 -6.500 1.00 . A A . 13 LEU HA 1 1 2 945 1 1 13 LEU HB2 H 1.209 -0.384 -8.875 1.00 . A A . 13 LEU HB2 1 1 2 946 1 1 13 LEU HB3 H 2.923 -0.105 -8.544 1.00 . A A . 13 LEU HB3 1 1 2 947 1 1 13 LEU HD11 H 2.097 -0.653 -11.340 1.00 . A A . 13 LEU HD11 1 1 2 948 1 1 13 LEU HD12 H 0.722 -1.598 -10.767 1.00 . A A . 13 LEU HD12 1 1 2 949 1 1 13 LEU HD13 H 2.016 -2.384 -11.671 1.00 . A A . 13 LEU HD13 1 1 2 950 1 1 13 LEU HD21 H 4.503 -1.259 -9.128 1.00 . A A . 13 LEU HD21 1 1 2 951 1 1 13 LEU HD22 H 4.222 -1.410 -10.862 1.00 . A A . 13 LEU HD22 1 1 2 952 1 1 13 LEU HD23 H 4.426 -2.856 -9.872 1.00 . A A . 13 LEU HD23 1 1 2 953 1 1 13 LEU HG H 2.246 -2.872 -9.284 1.00 . A A . 13 LEU HG 1 1 2 954 1 1 13 LEU N N 3.282 -2.248 -6.956 1.00 . A A . 13 LEU N 1 1 2 955 1 1 13 LEU O O -0.304 -2.201 -7.341 1.00 . A A . 13 LEU O 1 1 2 956 1 1 14 TYR C C -0.085 -5.395 -6.108 1.00 . A A . 14 TYR C 1 1 2 957 1 1 14 TYR CA C 0.078 -4.832 -7.494 1.00 . A A . 14 TYR CA 1 1 2 958 1 1 14 TYR CB C 0.469 -5.932 -8.480 1.00 . A A . 14 TYR CB 1 1 2 959 1 1 14 TYR CD1 C -1.742 -6.479 -9.559 1.00 . A A . 14 TYR CD1 1 1 2 960 1 1 14 TYR CD2 C -0.750 -8.099 -8.048 1.00 . A A . 14 TYR CD2 1 1 2 961 1 1 14 TYR CE1 C -2.829 -7.338 -9.766 1.00 . A A . 14 TYR CE1 1 1 2 962 1 1 14 TYR CE2 C -1.837 -8.958 -8.255 1.00 . A A . 14 TYR CE2 1 1 2 963 1 1 14 TYR CG C -0.702 -6.859 -8.701 1.00 . A A . 14 TYR CG 1 1 2 964 1 1 14 TYR CZ C -2.877 -8.578 -9.114 1.00 . A A . 14 TYR CZ 1 1 2 965 1 1 14 TYR H H 2.102 -4.114 -7.399 1.00 . A A . 14 TYR H 1 1 2 966 1 1 14 TYR HA H -0.838 -4.356 -7.796 1.00 . A A . 14 TYR HA 1 1 2 967 1 1 14 TYR HB2 H 0.756 -5.483 -9.421 1.00 . A A . 14 TYR HB2 1 1 2 968 1 1 14 TYR HB3 H 1.302 -6.492 -8.081 1.00 . A A . 14 TYR HB3 1 1 2 969 1 1 14 TYR HD1 H -1.706 -5.523 -10.061 1.00 . A A . 14 TYR HD1 1 1 2 970 1 1 14 TYR HD2 H 0.052 -8.391 -7.386 1.00 . A A . 14 TYR HD2 1 1 2 971 1 1 14 TYR HE1 H -3.631 -7.045 -10.428 1.00 . A A . 14 TYR HE1 1 1 2 972 1 1 14 TYR HE2 H -1.874 -9.914 -7.753 1.00 . A A . 14 TYR HE2 1 1 2 973 1 1 14 TYR HH H -3.603 -10.290 -9.550 1.00 . A A . 14 TYR HH 1 1 2 974 1 1 14 TYR N N 1.162 -3.825 -7.421 1.00 . A A . 14 TYR N 1 1 2 975 1 1 14 TYR O O -1.164 -5.733 -5.664 1.00 . A A . 14 TYR O 1 1 2 976 1 1 14 TYR OH O -3.948 -9.425 -9.318 1.00 . A A . 14 TYR OH 1 1 2 977 1 1 15 GLN C C 0.179 -4.887 -3.221 1.00 . A A . 15 GLN C 1 1 2 978 1 1 15 GLN CA C 0.966 -5.911 -4.023 1.00 . A A . 15 GLN CA 1 1 2 979 1 1 15 GLN CB C 2.400 -5.957 -3.536 1.00 . A A . 15 GLN CB 1 1 2 980 1 1 15 GLN CD C 2.395 -8.118 -2.286 1.00 . A A . 15 GLN CD 1 1 2 981 1 1 15 GLN CG C 2.902 -7.399 -3.537 1.00 . A A . 15 GLN CG 1 1 2 982 1 1 15 GLN H H 1.836 -5.122 -5.795 1.00 . A A . 15 GLN H 1 1 2 983 1 1 15 GLN HA H 0.505 -6.884 -3.956 1.00 . A A . 15 GLN HA 1 1 2 984 1 1 15 GLN HB2 H 3.009 -5.361 -4.204 1.00 . A A . 15 GLN HB2 1 1 2 985 1 1 15 GLN HB3 H 2.453 -5.550 -2.544 1.00 . A A . 15 GLN HB3 1 1 2 986 1 1 15 GLN HE21 H 1.483 -9.552 -3.312 1.00 . A A . 15 GLN HE21 1 1 2 987 1 1 15 GLN HE22 H 1.356 -9.674 -1.623 1.00 . A A . 15 GLN HE22 1 1 2 988 1 1 15 GLN HG2 H 2.535 -7.903 -4.419 1.00 . A A . 15 GLN HG2 1 1 2 989 1 1 15 GLN HG3 H 3.981 -7.402 -3.542 1.00 . A A . 15 GLN HG3 1 1 2 990 1 1 15 GLN N N 0.994 -5.440 -5.409 1.00 . A A . 15 GLN N 1 1 2 991 1 1 15 GLN NE2 N 1.686 -9.205 -2.418 1.00 . A A . 15 GLN NE2 1 1 2 992 1 1 15 GLN O O -0.521 -5.206 -2.279 1.00 . A A . 15 GLN O 1 1 2 993 1 1 15 GLN OE1 O 2.648 -7.687 -1.179 1.00 . A A . 15 GLN OE1 1 1 2 994 1 1 16 LEU C C -1.895 -2.597 -3.459 1.00 . A A . 16 LEU C 1 1 2 995 1 1 16 LEU CA C -0.480 -2.586 -2.921 1.00 . A A . 16 LEU CA 1 1 2 996 1 1 16 LEU CB C 0.188 -1.247 -3.201 1.00 . A A . 16 LEU CB 1 1 2 997 1 1 16 LEU CD1 C 2.196 0.134 -2.670 1.00 . A A . 16 LEU CD1 1 1 2 998 1 1 16 LEU CD2 C 1.358 -1.550 -1.026 1.00 . A A . 16 LEU CD2 1 1 2 999 1 1 16 LEU CG C 1.548 -1.236 -2.510 1.00 . A A . 16 LEU CG 1 1 2 1000 1 1 16 LEU H H 0.818 -3.419 -4.402 1.00 . A A . 16 LEU H 1 1 2 1001 1 1 16 LEU HA H -0.489 -2.779 -1.858 1.00 . A A . 16 LEU HA 1 1 2 1002 1 1 16 LEU HB2 H 0.319 -1.118 -4.266 1.00 . A A . 16 LEU HB2 1 1 2 1003 1 1 16 LEU HB3 H -0.422 -0.452 -2.816 1.00 . A A . 16 LEU HB3 1 1 2 1004 1 1 16 LEU HD11 H 1.544 0.888 -2.259 1.00 . A A . 16 LEU HD11 1 1 2 1005 1 1 16 LEU HD12 H 2.362 0.331 -3.719 1.00 . A A . 16 LEU HD12 1 1 2 1006 1 1 16 LEU HD13 H 3.140 0.148 -2.148 1.00 . A A . 16 LEU HD13 1 1 2 1007 1 1 16 LEU HD21 H 2.114 -1.039 -0.449 1.00 . A A . 16 LEU HD21 1 1 2 1008 1 1 16 LEU HD22 H 1.445 -2.616 -0.871 1.00 . A A . 16 LEU HD22 1 1 2 1009 1 1 16 LEU HD23 H 0.379 -1.221 -0.711 1.00 . A A . 16 LEU HD23 1 1 2 1010 1 1 16 LEU HG H 2.184 -1.986 -2.958 1.00 . A A . 16 LEU HG 1 1 2 1011 1 1 16 LEU N N 0.270 -3.648 -3.619 1.00 . A A . 16 LEU N 1 1 2 1012 1 1 16 LEU O O -2.837 -2.206 -2.798 1.00 . A A . 16 LEU O 1 1 2 1013 1 1 17 GLU C C -4.180 -4.240 -4.505 1.00 . A A . 17 GLU C 1 1 2 1014 1 1 17 GLU CA C -3.396 -3.156 -5.250 1.00 . A A . 17 GLU CA 1 1 2 1015 1 1 17 GLU CB C -3.257 -3.546 -6.720 1.00 . A A . 17 GLU CB 1 1 2 1016 1 1 17 GLU CD C -4.478 -3.853 -8.876 1.00 . A A . 17 GLU CD 1 1 2 1017 1 1 17 GLU CG C -4.633 -3.544 -7.387 1.00 . A A . 17 GLU CG 1 1 2 1018 1 1 17 GLU H H -1.275 -3.405 -5.163 1.00 . A A . 17 GLU H 1 1 2 1019 1 1 17 GLU HA H -3.893 -2.202 -5.164 1.00 . A A . 17 GLU HA 1 1 2 1020 1 1 17 GLU HB2 H -2.610 -2.841 -7.218 1.00 . A A . 17 GLU HB2 1 1 2 1021 1 1 17 GLU HB3 H -2.825 -4.533 -6.788 1.00 . A A . 17 GLU HB3 1 1 2 1022 1 1 17 GLU HG2 H -5.257 -4.297 -6.925 1.00 . A A . 17 GLU HG2 1 1 2 1023 1 1 17 GLU HG3 H -5.090 -2.573 -7.268 1.00 . A A . 17 GLU HG3 1 1 2 1024 1 1 17 GLU N N -2.051 -3.076 -4.657 1.00 . A A . 17 GLU N 1 1 2 1025 1 1 17 GLU O O -5.397 -4.261 -4.501 1.00 . A A . 17 GLU O 1 1 2 1026 1 1 17 GLU OE1 O -4.115 -2.950 -9.613 1.00 . A A . 17 GLU OE1 1 1 2 1027 1 1 17 GLU OE2 O -4.722 -4.986 -9.255 1.00 . A A . 17 GLU OE2 1 1 2 1028 1 1 18 ASN C C -4.760 -5.733 -1.838 1.00 . A A . 18 ASN C 1 1 2 1029 1 1 18 ASN CA C -4.160 -6.253 -3.144 1.00 . A A . 18 ASN CA 1 1 2 1030 1 1 18 ASN CB C -3.147 -7.356 -2.832 1.00 . A A . 18 ASN CB 1 1 2 1031 1 1 18 ASN CG C -3.873 -8.696 -2.700 1.00 . A A . 18 ASN CG 1 1 2 1032 1 1 18 ASN H H -2.491 -5.108 -3.898 1.00 . A A . 18 ASN H 1 1 2 1033 1 1 18 ASN HA H -4.947 -6.658 -3.762 1.00 . A A . 18 ASN HA 1 1 2 1034 1 1 18 ASN HB2 H -2.423 -7.415 -3.631 1.00 . A A . 18 ASN HB2 1 1 2 1035 1 1 18 ASN HB3 H -2.642 -7.130 -1.904 1.00 . A A . 18 ASN HB3 1 1 2 1036 1 1 18 ASN HD21 H -2.558 -9.442 -1.413 1.00 . A A . 18 ASN HD21 1 1 2 1037 1 1 18 ASN HD22 H -3.841 -10.476 -1.822 1.00 . A A . 18 ASN HD22 1 1 2 1038 1 1 18 ASN N N -3.476 -5.149 -3.878 1.00 . A A . 18 ASN N 1 1 2 1039 1 1 18 ASN ND2 N -3.384 -9.614 -1.913 1.00 . A A . 18 ASN ND2 1 1 2 1040 1 1 18 ASN O O -5.418 -6.459 -1.119 1.00 . A A . 18 ASN O 1 1 2 1041 1 1 18 ASN OD1 O -4.896 -8.910 -3.321 1.00 . A A . 18 ASN OD1 1 1 2 1042 1 1 19 TYR C C -6.301 -3.046 -0.563 1.00 . A A . 19 TYR C 1 1 2 1043 1 1 19 TYR CA C -5.108 -3.951 -0.253 1.00 . A A . 19 TYR CA 1 1 2 1044 1 1 19 TYR CB C -4.028 -3.163 0.490 1.00 . A A . 19 TYR CB 1 1 2 1045 1 1 19 TYR CD1 C -3.091 -4.808 2.156 1.00 . A A . 19 TYR CD1 1 1 2 1046 1 1 19 TYR CD2 C -1.816 -4.325 0.148 1.00 . A A . 19 TYR CD2 1 1 2 1047 1 1 19 TYR CE1 C -2.095 -5.702 2.573 1.00 . A A . 19 TYR CE1 1 1 2 1048 1 1 19 TYR CE2 C -0.821 -5.220 0.564 1.00 . A A . 19 TYR CE2 1 1 2 1049 1 1 19 TYR CG C -2.951 -4.119 0.944 1.00 . A A . 19 TYR CG 1 1 2 1050 1 1 19 TYR CZ C -0.961 -5.908 1.777 1.00 . A A . 19 TYR CZ 1 1 2 1051 1 1 19 TYR H H -4.007 -3.917 -2.105 1.00 . A A . 19 TYR H 1 1 2 1052 1 1 19 TYR HA H -5.437 -4.772 0.367 1.00 . A A . 19 TYR HA 1 1 2 1053 1 1 19 TYR HB2 H -3.601 -2.423 -0.171 1.00 . A A . 19 TYR HB2 1 1 2 1054 1 1 19 TYR HB3 H -4.462 -2.675 1.350 1.00 . A A . 19 TYR HB3 1 1 2 1055 1 1 19 TYR HD1 H -3.965 -4.649 2.770 1.00 . A A . 19 TYR HD1 1 1 2 1056 1 1 19 TYR HD2 H -1.708 -3.794 -0.786 1.00 . A A . 19 TYR HD2 1 1 2 1057 1 1 19 TYR HE1 H -2.204 -6.234 3.507 1.00 . A A . 19 TYR HE1 1 1 2 1058 1 1 19 TYR HE2 H 0.052 -5.381 -0.050 1.00 . A A . 19 TYR HE2 1 1 2 1059 1 1 19 TYR HH H -0.277 -7.204 3.001 1.00 . A A . 19 TYR HH 1 1 2 1060 1 1 19 TYR N N -4.542 -4.491 -1.518 1.00 . A A . 19 TYR N 1 1 2 1061 1 1 19 TYR O O -6.623 -2.149 0.192 1.00 . A A . 19 TYR O 1 1 2 1062 1 1 19 TYR OH O 0.018 -6.790 2.186 1.00 . A A . 19 TYR OH 1 1 2 1063 1 1 20 CYS C C -9.435 -3.171 -1.633 1.00 . A A . 20 CYS C 1 1 2 1064 1 1 20 CYS CA C -8.148 -2.429 -2.001 1.00 . A A . 20 CYS CA 1 1 2 1065 1 1 20 CYS CB C -8.146 -2.122 -3.498 1.00 . A A . 20 CYS CB 1 1 2 1066 1 1 20 CYS H H -6.702 -4.008 -2.257 1.00 . A A . 20 CYS H 1 1 2 1067 1 1 20 CYS HA H -8.096 -1.505 -1.445 1.00 . A A . 20 CYS HA 1 1 2 1068 1 1 20 CYS HB2 H -8.442 -3.001 -4.050 1.00 . A A . 20 CYS HB2 1 1 2 1069 1 1 20 CYS HB3 H -8.840 -1.321 -3.700 1.00 . A A . 20 CYS HB3 1 1 2 1070 1 1 20 CYS N N -6.970 -3.277 -1.662 1.00 . A A . 20 CYS N 1 1 2 1071 1 1 20 CYS O O -9.666 -4.285 -2.059 1.00 . A A . 20 CYS O 1 1 2 1072 1 1 20 CYS SG S -6.486 -1.618 -4.001 1.00 . A A . 20 CYS SG 1 1 2 1073 1 1 21 ASN C C -12.579 -3.055 -1.565 1.00 . A A . 21 ASN C 1 1 2 1074 1 1 21 ASN CA C -11.548 -3.222 -0.447 1.00 . A A . 21 ASN CA 1 1 2 1075 1 1 21 ASN CB C -12.079 -2.578 0.835 1.00 . A A . 21 ASN CB 1 1 2 1076 1 1 21 ASN CG C -13.261 -3.390 1.365 1.00 . A A . 21 ASN CG 1 1 2 1077 1 1 21 ASN H H -10.068 -1.659 -0.514 1.00 . A A . 21 ASN H 1 1 2 1078 1 1 21 ASN HA H -11.369 -4.273 -0.275 1.00 . A A . 21 ASN HA 1 1 2 1079 1 1 21 ASN HB2 H -11.294 -2.555 1.578 1.00 . A A . 21 ASN HB2 1 1 2 1080 1 1 21 ASN HB3 H -12.404 -1.570 0.623 1.00 . A A . 21 ASN HB3 1 1 2 1081 1 1 21 ASN HD21 H -12.914 -2.919 3.262 1.00 . A A . 21 ASN HD21 1 1 2 1082 1 1 21 ASN HD22 H -14.248 -3.934 2.999 1.00 . A A . 21 ASN HD22 1 1 2 1083 1 1 21 ASN N N -10.275 -2.558 -0.845 1.00 . A A . 21 ASN N 1 1 2 1084 1 1 21 ASN ND2 N -13.494 -3.417 2.649 1.00 . A A . 21 ASN ND2 1 1 2 1085 1 1 21 ASN O O -13.403 -2.162 -1.454 1.00 . A A . 21 ASN O 1 1 2 1086 1 1 21 ASN OXT O -12.527 -3.822 -2.512 1.00 . A A . 21 ASN OXT 1 1 2 1087 1 1 21 ASN OD1 O -13.980 -4.007 0.604 1.00 . A A . 21 ASN OD1 1 1 2 1088 2 2 1 PHE C C 9.590 -1.263 -10.798 1.00 . B B . 1 PHE C 1 1 2 1089 2 2 1 PHE CA C 8.799 -2.175 -11.737 1.00 . B B . 1 PHE CA 1 1 2 1090 2 2 1 PHE CB C 8.997 -1.716 -13.182 1.00 . B B . 1 PHE CB 1 1 2 1091 2 2 1 PHE CD1 C 6.973 -2.646 -14.367 1.00 . B B . 1 PHE CD1 1 1 2 1092 2 2 1 PHE CD2 C 9.128 -3.702 -14.731 1.00 . B B . 1 PHE CD2 1 1 2 1093 2 2 1 PHE CE1 C 6.374 -3.571 -15.232 1.00 . B B . 1 PHE CE1 1 1 2 1094 2 2 1 PHE CE2 C 8.529 -4.627 -15.597 1.00 . B B . 1 PHE CE2 1 1 2 1095 2 2 1 PHE CG C 8.351 -2.712 -14.117 1.00 . B B . 1 PHE CG 1 1 2 1096 2 2 1 PHE CZ C 7.152 -4.562 -15.847 1.00 . B B . 1 PHE CZ 1 1 2 1097 2 2 1 PHE H1 H 6.845 -2.884 -11.863 1.00 . B B . 1 PHE H1 1 1 2 1098 2 2 1 PHE H2 H 6.962 -1.197 -11.706 1.00 . B B . 1 PHE H2 1 1 2 1099 2 2 1 PHE H3 H 7.236 -2.199 -10.362 1.00 . B B . 1 PHE H3 1 1 2 1100 2 2 1 PHE HA H 9.149 -3.192 -11.632 1.00 . B B . 1 PHE HA 1 1 2 1101 2 2 1 PHE HB2 H 8.541 -0.745 -13.317 1.00 . B B . 1 PHE HB2 1 1 2 1102 2 2 1 PHE HB3 H 10.053 -1.652 -13.399 1.00 . B B . 1 PHE HB3 1 1 2 1103 2 2 1 PHE HD1 H 6.374 -1.883 -13.893 1.00 . B B . 1 PHE HD1 1 1 2 1104 2 2 1 PHE HD2 H 10.190 -3.753 -14.538 1.00 . B B . 1 PHE HD2 1 1 2 1105 2 2 1 PHE HE1 H 5.312 -3.521 -15.426 1.00 . B B . 1 PHE HE1 1 1 2 1106 2 2 1 PHE HE2 H 9.128 -5.390 -16.071 1.00 . B B . 1 PHE HE2 1 1 2 1107 2 2 1 PHE HZ H 6.690 -5.275 -16.514 1.00 . B B . 1 PHE HZ 1 1 2 1108 2 2 1 PHE N N 7.351 -2.109 -11.391 1.00 . B B . 1 PHE N 1 1 2 1109 2 2 1 PHE O O 10.384 -0.451 -11.229 1.00 . B B . 1 PHE O 1 1 2 1110 2 2 2 VAL C C 10.587 -1.406 -7.375 1.00 . B B . 2 VAL C 1 1 2 1111 2 2 2 VAL CA C 10.117 -0.540 -8.546 1.00 . B B . 2 VAL CA 1 1 2 1112 2 2 2 VAL CB C 9.190 0.564 -8.033 1.00 . B B . 2 VAL CB 1 1 2 1113 2 2 2 VAL CG1 C 9.052 1.652 -9.099 1.00 . B B . 2 VAL CG1 1 1 2 1114 2 2 2 VAL CG2 C 7.812 -0.027 -7.733 1.00 . B B . 2 VAL CG2 1 1 2 1115 2 2 2 VAL H H 8.734 -2.058 -9.194 1.00 . B B . 2 VAL H 1 1 2 1116 2 2 2 VAL HA H 10.972 -0.096 -9.034 1.00 . B B . 2 VAL HA 1 1 2 1117 2 2 2 VAL HB H 9.604 0.994 -7.132 1.00 . B B . 2 VAL HB 1 1 2 1118 2 2 2 VAL HG11 H 8.409 1.299 -9.892 1.00 . B B . 2 VAL HG11 1 1 2 1119 2 2 2 VAL HG12 H 10.026 1.887 -9.503 1.00 . B B . 2 VAL HG12 1 1 2 1120 2 2 2 VAL HG13 H 8.623 2.538 -8.656 1.00 . B B . 2 VAL HG13 1 1 2 1121 2 2 2 VAL HG21 H 7.854 -1.103 -7.824 1.00 . B B . 2 VAL HG21 1 1 2 1122 2 2 2 VAL HG22 H 7.092 0.366 -8.435 1.00 . B B . 2 VAL HG22 1 1 2 1123 2 2 2 VAL HG23 H 7.518 0.238 -6.728 1.00 . B B . 2 VAL HG23 1 1 2 1124 2 2 2 VAL N N 9.379 -1.395 -9.518 1.00 . B B . 2 VAL N 1 1 2 1125 2 2 2 VAL O O 10.574 -2.618 -7.449 1.00 . B B . 2 VAL O 1 1 2 1126 2 2 3 ASN C C 11.805 -0.694 -3.958 1.00 . B B . 3 ASN C 1 1 2 1127 2 2 3 ASN CA C 11.478 -1.612 -5.134 1.00 . B B . 3 ASN CA 1 1 2 1128 2 2 3 ASN CB C 12.736 -2.370 -5.536 1.00 . B B . 3 ASN CB 1 1 2 1129 2 2 3 ASN CG C 12.476 -3.875 -5.467 1.00 . B B . 3 ASN CG 1 1 2 1130 2 2 3 ASN H H 11.017 0.176 -6.248 1.00 . B B . 3 ASN H 1 1 2 1131 2 2 3 ASN HA H 10.710 -2.314 -4.850 1.00 . B B . 3 ASN HA 1 1 2 1132 2 2 3 ASN HB2 H 13.003 -2.093 -6.541 1.00 . B B . 3 ASN HB2 1 1 2 1133 2 2 3 ASN HB3 H 13.542 -2.113 -4.866 1.00 . B B . 3 ASN HB3 1 1 2 1134 2 2 3 ASN HD21 H 10.703 -3.751 -6.351 1.00 . B B . 3 ASN HD21 1 1 2 1135 2 2 3 ASN HD22 H 11.186 -5.317 -5.908 1.00 . B B . 3 ASN HD22 1 1 2 1136 2 2 3 ASN N N 11.007 -0.802 -6.295 1.00 . B B . 3 ASN N 1 1 2 1137 2 2 3 ASN ND2 N 11.363 -4.354 -5.949 1.00 . B B . 3 ASN ND2 1 1 2 1138 2 2 3 ASN O O 12.925 -0.647 -3.488 1.00 . B B . 3 ASN O 1 1 2 1139 2 2 3 ASN OD1 O 13.294 -4.622 -4.968 1.00 . B B . 3 ASN OD1 1 1 2 1140 2 2 4 GLN C C 10.143 0.708 -1.190 1.00 . B B . 4 GLN C 1 1 2 1141 2 2 4 GLN CA C 11.115 0.967 -2.347 1.00 . B B . 4 GLN CA 1 1 2 1142 2 2 4 GLN CB C 10.954 2.409 -2.825 1.00 . B B . 4 GLN CB 1 1 2 1143 2 2 4 GLN CD C 11.433 4.693 -1.942 1.00 . B B . 4 GLN CD 1 1 2 1144 2 2 4 GLN CG C 12.000 3.287 -2.144 1.00 . B B . 4 GLN CG 1 1 2 1145 2 2 4 GLN H H 9.958 0.001 -3.886 1.00 . B B . 4 GLN H 1 1 2 1146 2 2 4 GLN HA H 12.126 0.816 -2.002 1.00 . B B . 4 GLN HA 1 1 2 1147 2 2 4 GLN HB2 H 11.089 2.452 -3.896 1.00 . B B . 4 GLN HB2 1 1 2 1148 2 2 4 GLN HB3 H 9.967 2.765 -2.571 1.00 . B B . 4 GLN HB3 1 1 2 1149 2 2 4 GLN HE21 H 10.777 4.847 -3.809 1.00 . B B . 4 GLN HE21 1 1 2 1150 2 2 4 GLN HE22 H 10.481 6.196 -2.823 1.00 . B B . 4 GLN HE22 1 1 2 1151 2 2 4 GLN HG2 H 12.257 2.858 -1.186 1.00 . B B . 4 GLN HG2 1 1 2 1152 2 2 4 GLN HG3 H 12.882 3.339 -2.764 1.00 . B B . 4 GLN HG3 1 1 2 1153 2 2 4 GLN N N 10.846 0.044 -3.485 1.00 . B B . 4 GLN N 1 1 2 1154 2 2 4 GLN NE2 N 10.848 5.296 -2.941 1.00 . B B . 4 GLN NE2 1 1 2 1155 2 2 4 GLN O O 9.119 0.062 -1.348 1.00 . B B . 4 GLN O 1 1 2 1156 2 2 4 GLN OE1 O 11.522 5.249 -0.865 1.00 . B B . 4 GLN OE1 1 1 2 1157 2 2 5 HIS C C 8.460 2.072 1.101 1.00 . B B . 5 HIS C 1 1 2 1158 2 2 5 HIS CA C 9.573 1.027 1.154 1.00 . B B . 5 HIS CA 1 1 2 1159 2 2 5 HIS CB C 10.372 1.197 2.451 1.00 . B B . 5 HIS CB 1 1 2 1160 2 2 5 HIS CD2 C 12.525 -0.287 2.499 1.00 . B B . 5 HIS CD2 1 1 2 1161 2 2 5 HIS CE1 C 13.879 1.133 1.566 1.00 . B B . 5 HIS CE1 1 1 2 1162 2 2 5 HIS CG C 11.816 0.848 2.216 1.00 . B B . 5 HIS CG 1 1 2 1163 2 2 5 HIS H H 11.291 1.735 0.068 1.00 . B B . 5 HIS H 1 1 2 1164 2 2 5 HIS HA H 9.140 0.038 1.122 1.00 . B B . 5 HIS HA 1 1 2 1165 2 2 5 HIS HB2 H 10.300 2.222 2.785 1.00 . B B . 5 HIS HB2 1 1 2 1166 2 2 5 HIS HB3 H 9.964 0.544 3.209 1.00 . B B . 5 HIS HB3 1 1 2 1167 2 2 5 HIS HD2 H 12.129 -1.175 2.968 1.00 . B B . 5 HIS HD2 1 1 2 1168 2 2 5 HIS HE1 H 14.769 1.583 1.152 1.00 . B B . 5 HIS HE1 1 1 2 1169 2 2 5 HIS HE2 H 14.567 -0.751 2.164 1.00 . B B . 5 HIS HE2 1 1 2 1170 2 2 5 HIS N N 10.463 1.218 -0.026 1.00 . B B . 5 HIS N 1 1 2 1171 2 2 5 HIS ND1 N 12.685 1.740 1.624 1.00 . B B . 5 HIS ND1 1 1 2 1172 2 2 5 HIS NE2 N 13.830 -0.109 2.090 1.00 . B B . 5 HIS NE2 1 1 2 1173 2 2 5 HIS O O 8.399 2.873 0.189 1.00 . B B . 5 HIS O 1 1 2 1174 2 2 6 LEU C C 6.175 3.586 3.435 1.00 . B B . 6 LEU C 1 1 2 1175 2 2 6 LEU CA C 6.456 3.060 2.029 1.00 . B B . 6 LEU CA 1 1 2 1176 2 2 6 LEU CB C 5.186 2.353 1.531 1.00 . B B . 6 LEU CB 1 1 2 1177 2 2 6 LEU CD1 C 5.733 3.508 -0.647 1.00 . B B . 6 LEU CD1 1 1 2 1178 2 2 6 LEU CD2 C 3.871 1.876 -0.541 1.00 . B B . 6 LEU CD2 1 1 2 1179 2 2 6 LEU CG C 4.612 2.966 0.234 1.00 . B B . 6 LEU CG 1 1 2 1180 2 2 6 LEU H H 7.628 1.411 2.779 1.00 . B B . 6 LEU H 1 1 2 1181 2 2 6 LEU HA H 6.721 3.875 1.386 1.00 . B B . 6 LEU HA 1 1 2 1182 2 2 6 LEU HB2 H 5.430 1.321 1.353 1.00 . B B . 6 LEU HB2 1 1 2 1183 2 2 6 LEU HB3 H 4.436 2.406 2.306 1.00 . B B . 6 LEU HB3 1 1 2 1184 2 2 6 LEU HD11 H 5.355 3.673 -1.643 1.00 . B B . 6 LEU HD11 1 1 2 1185 2 2 6 LEU HD12 H 6.535 2.789 -0.682 1.00 . B B . 6 LEU HD12 1 1 2 1186 2 2 6 LEU HD13 H 6.095 4.437 -0.239 1.00 . B B . 6 LEU HD13 1 1 2 1187 2 2 6 LEU HD21 H 3.747 1.008 0.089 1.00 . B B . 6 LEU HD21 1 1 2 1188 2 2 6 LEU HD22 H 4.441 1.607 -1.418 1.00 . B B . 6 LEU HD22 1 1 2 1189 2 2 6 LEU HD23 H 2.901 2.245 -0.841 1.00 . B B . 6 LEU HD23 1 1 2 1190 2 2 6 LEU HG H 3.910 3.762 0.473 1.00 . B B . 6 LEU HG 1 1 2 1191 2 2 6 LEU N N 7.571 2.069 2.057 1.00 . B B . 6 LEU N 1 1 2 1192 2 2 6 LEU O O 6.745 3.141 4.406 1.00 . B B . 6 LEU O 1 1 2 1193 2 2 7 CYS C C 4.232 6.453 4.637 1.00 . B B . 7 CYS C 1 1 2 1194 2 2 7 CYS CA C 4.889 5.088 4.855 1.00 . B B . 7 CYS CA 1 1 2 1195 2 2 7 CYS CB C 6.120 5.239 5.755 1.00 . B B . 7 CYS CB 1 1 2 1196 2 2 7 CYS H H 4.815 4.836 2.724 1.00 . B B . 7 CYS H 1 1 2 1197 2 2 7 CYS HA H 4.178 4.427 5.331 1.00 . B B . 7 CYS HA 1 1 2 1198 2 2 7 CYS HB2 H 7.010 4.969 5.210 1.00 . B B . 7 CYS HB2 1 1 2 1199 2 2 7 CYS HB3 H 6.200 6.262 6.083 1.00 . B B . 7 CYS HB3 1 1 2 1200 2 2 7 CYS N N 5.268 4.519 3.533 1.00 . B B . 7 CYS N 1 1 2 1201 2 2 7 CYS O O 4.669 7.246 3.823 1.00 . B B . 7 CYS O 1 1 2 1202 2 2 7 CYS SG S 5.929 4.159 7.200 1.00 . B B . 7 CYS SG 1 1 2 1203 2 2 8 GLY C C 1.815 8.110 3.819 1.00 . B B . 8 GLY C 1 1 2 1204 2 2 8 GLY CA C 2.488 8.038 5.193 1.00 . B B . 8 GLY CA 1 1 2 1205 2 2 8 GLY H H 2.842 6.074 5.999 1.00 . B B . 8 GLY H 1 1 2 1206 2 2 8 GLY HA2 H 1.740 8.145 5.966 1.00 . B B . 8 GLY HA2 1 1 2 1207 2 2 8 GLY HA3 H 3.208 8.838 5.278 1.00 . B B . 8 GLY HA3 1 1 2 1208 2 2 8 GLY N N 3.180 6.730 5.354 1.00 . B B . 8 GLY N 1 1 2 1209 2 2 8 GLY O O 1.293 7.133 3.311 1.00 . B B . 8 GLY O 1 1 2 1210 2 2 9 SER C C 1.797 8.446 0.893 1.00 . B B . 9 SER C 1 1 2 1211 2 2 9 SER CA C 1.176 9.424 1.886 1.00 . B B . 9 SER CA 1 1 2 1212 2 2 9 SER CB C 1.379 10.854 1.383 1.00 . B B . 9 SER CB 1 1 2 1213 2 2 9 SER H H 2.238 10.041 3.652 1.00 . B B . 9 SER H 1 1 2 1214 2 2 9 SER HA H 0.124 9.221 1.972 1.00 . B B . 9 SER HA 1 1 2 1215 2 2 9 SER HB2 H 1.878 11.437 2.139 1.00 . B B . 9 SER HB2 1 1 2 1216 2 2 9 SER HB3 H 1.986 10.836 0.487 1.00 . B B . 9 SER HB3 1 1 2 1217 2 2 9 SER HG H -0.339 11.585 1.934 1.00 . B B . 9 SER HG 1 1 2 1218 2 2 9 SER N N 1.817 9.269 3.220 1.00 . B B . 9 SER N 1 1 2 1219 2 2 9 SER O O 1.143 7.968 -0.012 1.00 . B B . 9 SER O 1 1 2 1220 2 2 9 SER OG O 0.114 11.438 1.101 1.00 . B B . 9 SER OG 1 1 2 1221 2 2 10 ASP C C 2.876 5.916 0.020 1.00 . B B . 10 ASP C 1 1 2 1222 2 2 10 ASP CA C 3.707 7.195 0.107 1.00 . B B . 10 ASP CA 1 1 2 1223 2 2 10 ASP CB C 5.113 6.858 0.606 1.00 . B B . 10 ASP CB 1 1 2 1224 2 2 10 ASP CG C 5.923 8.146 0.776 1.00 . B B . 10 ASP CG 1 1 2 1225 2 2 10 ASP H H 3.560 8.536 1.791 1.00 . B B . 10 ASP H 1 1 2 1226 2 2 10 ASP HA H 3.770 7.648 -0.871 1.00 . B B . 10 ASP HA 1 1 2 1227 2 2 10 ASP HB2 H 5.045 6.346 1.555 1.00 . B B . 10 ASP HB2 1 1 2 1228 2 2 10 ASP HB3 H 5.604 6.221 -0.112 1.00 . B B . 10 ASP HB3 1 1 2 1229 2 2 10 ASP N N 3.051 8.143 1.052 1.00 . B B . 10 ASP N 1 1 2 1230 2 2 10 ASP O O 2.738 5.319 -1.031 1.00 . B B . 10 ASP O 1 1 2 1231 2 2 10 ASP OD1 O 6.177 8.799 -0.223 1.00 . B B . 10 ASP OD1 1 1 2 1232 2 2 10 ASP OD2 O 6.280 8.454 1.901 1.00 . B B . 10 ASP OD2 1 1 2 1233 2 2 11 LEU C C 0.141 4.544 0.475 1.00 . B B . 11 LEU C 1 1 2 1234 2 2 11 LEU CA C 1.501 4.250 1.104 1.00 . B B . 11 LEU CA 1 1 2 1235 2 2 11 LEU CB C 1.320 3.752 2.542 1.00 . B B . 11 LEU CB 1 1 2 1236 2 2 11 LEU CD1 C 1.747 1.487 1.529 1.00 . B B . 11 LEU CD1 1 1 2 1237 2 2 11 LEU CD2 C 1.195 1.702 3.948 1.00 . B B . 11 LEU CD2 1 1 2 1238 2 2 11 LEU CG C 0.924 2.270 2.556 1.00 . B B . 11 LEU CG 1 1 2 1239 2 2 11 LEU H H 2.443 5.987 1.953 1.00 . B B . 11 LEU H 1 1 2 1240 2 2 11 LEU HA H 2.003 3.499 0.520 1.00 . B B . 11 LEU HA 1 1 2 1241 2 2 11 LEU HB2 H 2.247 3.878 3.081 1.00 . B B . 11 LEU HB2 1 1 2 1242 2 2 11 LEU HB3 H 0.546 4.330 3.024 1.00 . B B . 11 LEU HB3 1 1 2 1243 2 2 11 LEU HD11 H 1.713 0.434 1.767 1.00 . B B . 11 LEU HD11 1 1 2 1244 2 2 11 LEU HD12 H 2.772 1.828 1.552 1.00 . B B . 11 LEU HD12 1 1 2 1245 2 2 11 LEU HD13 H 1.337 1.646 0.543 1.00 . B B . 11 LEU HD13 1 1 2 1246 2 2 11 LEU HD21 H 0.581 0.830 4.106 1.00 . B B . 11 LEU HD21 1 1 2 1247 2 2 11 LEU HD22 H 0.962 2.449 4.692 1.00 . B B . 11 LEU HD22 1 1 2 1248 2 2 11 LEU HD23 H 2.237 1.428 4.026 1.00 . B B . 11 LEU HD23 1 1 2 1249 2 2 11 LEU HG H -0.127 2.174 2.325 1.00 . B B . 11 LEU HG 1 1 2 1250 2 2 11 LEU N N 2.320 5.490 1.118 1.00 . B B . 11 LEU N 1 1 2 1251 2 2 11 LEU O O -0.331 3.802 -0.361 1.00 . B B . 11 LEU O 1 1 2 1252 2 2 12 VAL C C -1.600 6.333 -1.217 1.00 . B B . 12 VAL C 1 1 2 1253 2 2 12 VAL CA C -1.820 5.924 0.240 1.00 . B B . 12 VAL CA 1 1 2 1254 2 2 12 VAL CB C -2.533 7.042 1.026 1.00 . B B . 12 VAL CB 1 1 2 1255 2 2 12 VAL CG1 C -2.055 7.026 2.475 1.00 . B B . 12 VAL CG1 1 1 2 1256 2 2 12 VAL CG2 C -2.235 8.418 0.418 1.00 . B B . 12 VAL CG2 1 1 2 1257 2 2 12 VAL H H -0.102 6.221 1.519 1.00 . B B . 12 VAL H 1 1 2 1258 2 2 12 VAL HA H -2.428 5.031 0.263 1.00 . B B . 12 VAL HA 1 1 2 1259 2 2 12 VAL HB H -3.600 6.864 1.005 1.00 . B B . 12 VAL HB 1 1 2 1260 2 2 12 VAL HG11 H -1.899 6.004 2.788 1.00 . B B . 12 VAL HG11 1 1 2 1261 2 2 12 VAL HG12 H -2.798 7.489 3.105 1.00 . B B . 12 VAL HG12 1 1 2 1262 2 2 12 VAL HG13 H -1.126 7.571 2.550 1.00 . B B . 12 VAL HG13 1 1 2 1263 2 2 12 VAL HG21 H -2.525 9.190 1.116 1.00 . B B . 12 VAL HG21 1 1 2 1264 2 2 12 VAL HG22 H -2.794 8.533 -0.499 1.00 . B B . 12 VAL HG22 1 1 2 1265 2 2 12 VAL HG23 H -1.179 8.498 0.209 1.00 . B B . 12 VAL HG23 1 1 2 1266 2 2 12 VAL N N -0.495 5.620 0.852 1.00 . B B . 12 VAL N 1 1 2 1267 2 2 12 VAL O O -2.340 5.947 -2.099 1.00 . B B . 12 VAL O 1 1 2 1268 2 2 13 GLU C C -0.247 6.254 -3.751 1.00 . B B . 13 GLU C 1 1 2 1269 2 2 13 GLU CA C -0.308 7.512 -2.882 1.00 . B B . 13 GLU CA 1 1 2 1270 2 2 13 GLU CB C 1.017 8.291 -2.953 1.00 . B B . 13 GLU CB 1 1 2 1271 2 2 13 GLU CD C 2.491 7.117 -4.601 1.00 . B B . 13 GLU CD 1 1 2 1272 2 2 13 GLU CG C 2.201 7.330 -3.113 1.00 . B B . 13 GLU CG 1 1 2 1273 2 2 13 GLU H H 0.019 7.393 -0.758 1.00 . B B . 13 GLU H 1 1 2 1274 2 2 13 GLU HA H -1.115 8.143 -3.227 1.00 . B B . 13 GLU HA 1 1 2 1275 2 2 13 GLU HB2 H 0.988 8.966 -3.794 1.00 . B B . 13 GLU HB2 1 1 2 1276 2 2 13 GLU HB3 H 1.143 8.860 -2.043 1.00 . B B . 13 GLU HB3 1 1 2 1277 2 2 13 GLU HG2 H 3.073 7.751 -2.633 1.00 . B B . 13 GLU HG2 1 1 2 1278 2 2 13 GLU HG3 H 1.961 6.383 -2.657 1.00 . B B . 13 GLU HG3 1 1 2 1279 2 2 13 GLU N N -0.575 7.100 -1.480 1.00 . B B . 13 GLU N 1 1 2 1280 2 2 13 GLU O O -0.599 6.270 -4.913 1.00 . B B . 13 GLU O 1 1 2 1281 2 2 13 GLU OE1 O 2.345 8.066 -5.355 1.00 . B B . 13 GLU OE1 1 1 2 1282 2 2 13 GLU OE2 O 2.853 6.009 -4.962 1.00 . B B . 13 GLU OE2 1 1 2 1283 2 2 14 ALA C C -1.139 3.218 -3.863 1.00 . B B . 14 ALA C 1 1 2 1284 2 2 14 ALA CA C 0.227 3.891 -3.965 1.00 . B B . 14 ALA CA 1 1 2 1285 2 2 14 ALA CB C 1.304 2.964 -3.396 1.00 . B B . 14 ALA CB 1 1 2 1286 2 2 14 ALA H H 0.432 5.157 -2.237 1.00 . B B . 14 ALA H 1 1 2 1287 2 2 14 ALA HA H 0.445 4.113 -4.999 1.00 . B B . 14 ALA HA 1 1 2 1288 2 2 14 ALA HB1 H 2.276 3.291 -3.736 1.00 . B B . 14 ALA HB1 1 1 2 1289 2 2 14 ALA HB2 H 1.126 1.954 -3.735 1.00 . B B . 14 ALA HB2 1 1 2 1290 2 2 14 ALA HB3 H 1.271 2.992 -2.317 1.00 . B B . 14 ALA HB3 1 1 2 1291 2 2 14 ALA N N 0.174 5.154 -3.182 1.00 . B B . 14 ALA N 1 1 2 1292 2 2 14 ALA O O -1.715 2.804 -4.849 1.00 . B B . 14 ALA O 1 1 2 1293 2 2 15 LEU C C -4.019 3.288 -3.351 1.00 . B B . 15 LEU C 1 1 2 1294 2 2 15 LEU CA C -3.010 2.506 -2.506 1.00 . B B . 15 LEU CA 1 1 2 1295 2 2 15 LEU CB C -3.409 2.580 -1.032 1.00 . B B . 15 LEU CB 1 1 2 1296 2 2 15 LEU CD1 C -3.178 1.368 1.137 1.00 . B B . 15 LEU CD1 1 1 2 1297 2 2 15 LEU CD2 C -2.222 0.334 -0.931 1.00 . B B . 15 LEU CD2 1 1 2 1298 2 2 15 LEU CG C -2.501 1.660 -0.196 1.00 . B B . 15 LEU CG 1 1 2 1299 2 2 15 LEU H H -1.199 3.477 -1.889 1.00 . B B . 15 LEU H 1 1 2 1300 2 2 15 LEU HA H -2.975 1.477 -2.827 1.00 . B B . 15 LEU HA 1 1 2 1301 2 2 15 LEU HB2 H -3.291 3.600 -0.690 1.00 . B B . 15 LEU HB2 1 1 2 1302 2 2 15 LEU HB3 H -4.447 2.287 -0.915 1.00 . B B . 15 LEU HB3 1 1 2 1303 2 2 15 LEU HD11 H -2.478 1.541 1.940 1.00 . B B . 15 LEU HD11 1 1 2 1304 2 2 15 LEU HD12 H -3.504 0.340 1.156 1.00 . B B . 15 LEU HD12 1 1 2 1305 2 2 15 LEU HD13 H -4.030 2.020 1.255 1.00 . B B . 15 LEU HD13 1 1 2 1306 2 2 15 LEU HD21 H -1.627 -0.312 -0.296 1.00 . B B . 15 LEU HD21 1 1 2 1307 2 2 15 LEU HD22 H -1.679 0.531 -1.844 1.00 . B B . 15 LEU HD22 1 1 2 1308 2 2 15 LEU HD23 H -3.154 -0.157 -1.166 1.00 . B B . 15 LEU HD23 1 1 2 1309 2 2 15 LEU HG H -1.565 2.167 -0.008 1.00 . B B . 15 LEU HG 1 1 2 1310 2 2 15 LEU N N -1.673 3.125 -2.673 1.00 . B B . 15 LEU N 1 1 2 1311 2 2 15 LEU O O -4.860 2.722 -4.020 1.00 . B B . 15 LEU O 1 1 2 1312 2 2 16 TYR C C -4.666 5.153 -5.617 1.00 . B B . 16 TYR C 1 1 2 1313 2 2 16 TYR CA C -4.884 5.421 -4.126 1.00 . B B . 16 TYR CA 1 1 2 1314 2 2 16 TYR CB C -4.631 6.905 -3.848 1.00 . B B . 16 TYR CB 1 1 2 1315 2 2 16 TYR CD1 C -7.059 7.559 -4.027 1.00 . B B . 16 TYR CD1 1 1 2 1316 2 2 16 TYR CD2 C -5.853 8.098 -1.991 1.00 . B B . 16 TYR CD2 1 1 2 1317 2 2 16 TYR CE1 C -8.216 8.145 -3.498 1.00 . B B . 16 TYR CE1 1 1 2 1318 2 2 16 TYR CE2 C -7.011 8.685 -1.461 1.00 . B B . 16 TYR CE2 1 1 2 1319 2 2 16 TYR CG C -5.877 7.535 -3.274 1.00 . B B . 16 TYR CG 1 1 2 1320 2 2 16 TYR CZ C -8.192 8.709 -2.215 1.00 . B B . 16 TYR CZ 1 1 2 1321 2 2 16 TYR H H -3.249 5.030 -2.773 1.00 . B B . 16 TYR H 1 1 2 1322 2 2 16 TYR HA H -5.900 5.172 -3.858 1.00 . B B . 16 TYR HA 1 1 2 1323 2 2 16 TYR HB2 H -3.815 7.008 -3.149 1.00 . B B . 16 TYR HB2 1 1 2 1324 2 2 16 TYR HB3 H -4.374 7.402 -4.772 1.00 . B B . 16 TYR HB3 1 1 2 1325 2 2 16 TYR HD1 H -7.077 7.124 -5.016 1.00 . B B . 16 TYR HD1 1 1 2 1326 2 2 16 TYR HD2 H -4.943 8.079 -1.410 1.00 . B B . 16 TYR HD2 1 1 2 1327 2 2 16 TYR HE1 H -9.126 8.163 -4.079 1.00 . B B . 16 TYR HE1 1 1 2 1328 2 2 16 TYR HE2 H -6.993 9.120 -0.472 1.00 . B B . 16 TYR HE2 1 1 2 1329 2 2 16 TYR HH H -9.308 9.186 -0.742 1.00 . B B . 16 TYR HH 1 1 2 1330 2 2 16 TYR N N -3.937 4.593 -3.323 1.00 . B B . 16 TYR N 1 1 2 1331 2 2 16 TYR O O -5.599 5.107 -6.393 1.00 . B B . 16 TYR O 1 1 2 1332 2 2 16 TYR OH O -9.331 9.288 -1.696 1.00 . B B . 16 TYR OH 1 1 2 1333 2 2 17 LEU C C -3.479 3.292 -7.828 1.00 . B B . 17 LEU C 1 1 2 1334 2 2 17 LEU CA C -3.152 4.744 -7.469 1.00 . B B . 17 LEU CA 1 1 2 1335 2 2 17 LEU CB C -1.669 5.023 -7.750 1.00 . B B . 17 LEU CB 1 1 2 1336 2 2 17 LEU CD1 C -2.129 5.035 -10.211 1.00 . B B . 17 LEU CD1 1 1 2 1337 2 2 17 LEU CD2 C 0.205 4.723 -9.376 1.00 . B B . 17 LEU CD2 1 1 2 1338 2 2 17 LEU CG C -1.270 4.422 -9.102 1.00 . B B . 17 LEU CG 1 1 2 1339 2 2 17 LEU H H -2.696 5.043 -5.384 1.00 . B B . 17 LEU H 1 1 2 1340 2 2 17 LEU HA H -3.760 5.404 -8.066 1.00 . B B . 17 LEU HA 1 1 2 1341 2 2 17 LEU HB2 H -1.503 6.090 -7.768 1.00 . B B . 17 LEU HB2 1 1 2 1342 2 2 17 LEU HB3 H -1.067 4.580 -6.971 1.00 . B B . 17 LEU HB3 1 1 2 1343 2 2 17 LEU HD11 H -3.048 5.411 -9.788 1.00 . B B . 17 LEU HD11 1 1 2 1344 2 2 17 LEU HD12 H -2.355 4.281 -10.949 1.00 . B B . 17 LEU HD12 1 1 2 1345 2 2 17 LEU HD13 H -1.590 5.846 -10.678 1.00 . B B . 17 LEU HD13 1 1 2 1346 2 2 17 LEU HD21 H 0.439 5.721 -9.038 1.00 . B B . 17 LEU HD21 1 1 2 1347 2 2 17 LEU HD22 H 0.396 4.647 -10.437 1.00 . B B . 17 LEU HD22 1 1 2 1348 2 2 17 LEU HD23 H 0.822 4.011 -8.848 1.00 . B B . 17 LEU HD23 1 1 2 1349 2 2 17 LEU HG H -1.421 3.352 -9.079 1.00 . B B . 17 LEU HG 1 1 2 1350 2 2 17 LEU N N -3.435 4.991 -6.025 1.00 . B B . 17 LEU N 1 1 2 1351 2 2 17 LEU O O -3.664 2.957 -8.981 1.00 . B B . 17 LEU O 1 1 2 1352 2 2 18 VAL C C -5.332 0.722 -6.868 1.00 . B B . 18 VAL C 1 1 2 1353 2 2 18 VAL CA C -3.857 1.001 -7.156 1.00 . B B . 18 VAL CA 1 1 2 1354 2 2 18 VAL CB C -2.987 0.090 -6.285 1.00 . B B . 18 VAL CB 1 1 2 1355 2 2 18 VAL CG1 C -1.547 0.593 -6.288 1.00 . B B . 18 VAL CG1 1 1 2 1356 2 2 18 VAL CG2 C -3.510 0.094 -4.851 1.00 . B B . 18 VAL CG2 1 1 2 1357 2 2 18 VAL H H -3.392 2.714 -5.934 1.00 . B B . 18 VAL H 1 1 2 1358 2 2 18 VAL HA H -3.652 0.801 -8.196 1.00 . B B . 18 VAL HA 1 1 2 1359 2 2 18 VAL HB H -3.017 -0.916 -6.677 1.00 . B B . 18 VAL HB 1 1 2 1360 2 2 18 VAL HG11 H -1.528 1.628 -6.593 1.00 . B B . 18 VAL HG11 1 1 2 1361 2 2 18 VAL HG12 H -0.962 0.002 -6.975 1.00 . B B . 18 VAL HG12 1 1 2 1362 2 2 18 VAL HG13 H -1.136 0.503 -5.293 1.00 . B B . 18 VAL HG13 1 1 2 1363 2 2 18 VAL HG21 H -2.810 -0.421 -4.211 1.00 . B B . 18 VAL HG21 1 1 2 1364 2 2 18 VAL HG22 H -4.465 -0.405 -4.816 1.00 . B B . 18 VAL HG22 1 1 2 1365 2 2 18 VAL HG23 H -3.623 1.113 -4.516 1.00 . B B . 18 VAL HG23 1 1 2 1366 2 2 18 VAL N N -3.547 2.427 -6.857 1.00 . B B . 18 VAL N 1 1 2 1367 2 2 18 VAL O O -5.971 -0.057 -7.546 1.00 . B B . 18 VAL O 1 1 2 1368 2 2 19 CYS C C -8.192 2.124 -6.234 1.00 . B B . 19 CYS C 1 1 2 1369 2 2 19 CYS CA C -7.305 1.101 -5.522 1.00 . B B . 19 CYS CA 1 1 2 1370 2 2 19 CYS CB C -7.493 1.229 -4.011 1.00 . B B . 19 CYS CB 1 1 2 1371 2 2 19 CYS H H -5.340 1.962 -5.320 1.00 . B B . 19 CYS H 1 1 2 1372 2 2 19 CYS HA H -7.582 0.106 -5.835 1.00 . B B . 19 CYS HA 1 1 2 1373 2 2 19 CYS HB2 H -7.368 2.262 -3.718 1.00 . B B . 19 CYS HB2 1 1 2 1374 2 2 19 CYS HB3 H -8.484 0.894 -3.740 1.00 . B B . 19 CYS HB3 1 1 2 1375 2 2 19 CYS N N -5.875 1.343 -5.860 1.00 . B B . 19 CYS N 1 1 2 1376 2 2 19 CYS O O -9.003 1.780 -7.072 1.00 . B B . 19 CYS O 1 1 2 1377 2 2 19 CYS SG S -6.260 0.208 -3.168 1.00 . B B . 19 CYS SG 1 1 2 1378 2 2 20 GLY C C -10.276 4.432 -5.892 1.00 . B B . 20 GLY C 1 1 2 1379 2 2 20 GLY CA C -8.897 4.417 -6.552 1.00 . B B . 20 GLY CA 1 1 2 1380 2 2 20 GLY H H -7.400 3.634 -5.219 1.00 . B B . 20 GLY H 1 1 2 1381 2 2 20 GLY HA2 H -8.429 5.385 -6.438 1.00 . B B . 20 GLY HA2 1 1 2 1382 2 2 20 GLY HA3 H -9.007 4.189 -7.602 1.00 . B B . 20 GLY HA3 1 1 2 1383 2 2 20 GLY N N -8.054 3.377 -5.901 1.00 . B B . 20 GLY N 1 1 2 1384 2 2 20 GLY O O -10.413 4.740 -4.724 1.00 . B B . 20 GLY O 1 1 2 1385 2 2 21 GLU C C -12.840 2.865 -5.145 1.00 . B B . 21 GLU C 1 1 2 1386 2 2 21 GLU CA C -12.669 4.094 -6.041 1.00 . B B . 21 GLU CA 1 1 2 1387 2 2 21 GLU CB C -13.705 4.052 -7.165 1.00 . B B . 21 GLU CB 1 1 2 1388 2 2 21 GLU CD C -15.291 5.446 -8.501 1.00 . B B . 21 GLU CD 1 1 2 1389 2 2 21 GLU CG C -14.434 5.396 -7.235 1.00 . B B . 21 GLU CG 1 1 2 1390 2 2 21 GLU H H -11.168 3.852 -7.567 1.00 . B B . 21 GLU H 1 1 2 1391 2 2 21 GLU HA H -12.811 4.989 -5.454 1.00 . B B . 21 GLU HA 1 1 2 1392 2 2 21 GLU HB2 H -13.208 3.861 -8.105 1.00 . B B . 21 GLU HB2 1 1 2 1393 2 2 21 GLU HB3 H -14.418 3.267 -6.968 1.00 . B B . 21 GLU HB3 1 1 2 1394 2 2 21 GLU HG2 H -15.066 5.508 -6.365 1.00 . B B . 21 GLU HG2 1 1 2 1395 2 2 21 GLU HG3 H -13.710 6.196 -7.261 1.00 . B B . 21 GLU HG3 1 1 2 1396 2 2 21 GLU N N -11.300 4.099 -6.628 1.00 . B B . 21 GLU N 1 1 2 1397 2 2 21 GLU O O -13.690 2.833 -4.276 1.00 . B B . 21 GLU O 1 1 2 1398 2 2 21 GLU OE1 O -14.850 4.926 -9.512 1.00 . B B . 21 GLU OE1 1 1 2 1399 2 2 21 GLU OE2 O -16.375 6.002 -8.437 1.00 . B B . 21 GLU OE2 1 1 2 1400 2 2 22 ARG C C -11.732 0.953 -3.073 1.00 . B B . 22 ARG C 1 1 2 1401 2 2 22 ARG CA C -12.159 0.633 -4.508 1.00 . B B . 22 ARG CA 1 1 2 1402 2 2 22 ARG CB C -11.251 -0.454 -5.080 1.00 . B B . 22 ARG CB 1 1 2 1403 2 2 22 ARG CD C -13.027 -2.199 -5.234 1.00 . B B . 22 ARG CD 1 1 2 1404 2 2 22 ARG CG C -11.706 -1.815 -4.564 1.00 . B B . 22 ARG CG 1 1 2 1405 2 2 22 ARG CZ C -13.432 -4.502 -5.859 1.00 . B B . 22 ARG CZ 1 1 2 1406 2 2 22 ARG H H -11.361 1.894 -6.049 1.00 . B B . 22 ARG H 1 1 2 1407 2 2 22 ARG HA H -13.182 0.288 -4.513 1.00 . B B . 22 ARG HA 1 1 2 1408 2 2 22 ARG HB2 H -11.306 -0.438 -6.159 1.00 . B B . 22 ARG HB2 1 1 2 1409 2 2 22 ARG HB3 H -10.233 -0.274 -4.767 1.00 . B B . 22 ARG HB3 1 1 2 1410 2 2 22 ARG HD2 H -13.758 -2.442 -4.476 1.00 . B B . 22 ARG HD2 1 1 2 1411 2 2 22 ARG HD3 H -13.384 -1.371 -5.828 1.00 . B B . 22 ARG HD3 1 1 2 1412 2 2 22 ARG HE H -12.201 -3.322 -6.875 1.00 . B B . 22 ARG HE 1 1 2 1413 2 2 22 ARG HG2 H -10.955 -2.555 -4.795 1.00 . B B . 22 ARG HG2 1 1 2 1414 2 2 22 ARG HG3 H -11.848 -1.763 -3.496 1.00 . B B . 22 ARG HG3 1 1 2 1415 2 2 22 ARG HH11 H -15.149 -3.612 -5.339 1.00 . B B . 22 ARG HH11 1 1 2 1416 2 2 22 ARG HH12 H -15.149 -5.342 -5.263 1.00 . B B . 22 ARG HH12 1 1 2 1417 2 2 22 ARG HH21 H -11.859 -5.653 -6.314 1.00 . B B . 22 ARG HH21 1 1 2 1418 2 2 22 ARG HH22 H -13.287 -6.498 -5.820 1.00 . B B . 22 ARG HH22 1 1 2 1419 2 2 22 ARG N N -12.040 1.853 -5.346 1.00 . B B . 22 ARG N 1 1 2 1420 2 2 22 ARG NE N -12.811 -3.383 -6.110 1.00 . B B . 22 ARG NE 1 1 2 1421 2 2 22 ARG NH1 N -14.674 -4.484 -5.456 1.00 . B B . 22 ARG NH1 1 1 2 1422 2 2 22 ARG NH2 N -12.811 -5.639 -6.008 1.00 . B B . 22 ARG NH2 1 1 2 1423 2 2 22 ARG O O -11.877 0.144 -2.178 1.00 . B B . 22 ARG O 1 1 2 1424 2 2 23 GLY C C -9.703 1.494 -0.996 1.00 . B B . 23 GLY C 1 1 2 1425 2 2 23 GLY CA C -10.766 2.488 -1.469 1.00 . B B . 23 GLY CA 1 1 2 1426 2 2 23 GLY H H -11.092 2.763 -3.582 1.00 . B B . 23 GLY H 1 1 2 1427 2 2 23 GLY HA2 H -10.352 3.487 -1.474 1.00 . B B . 23 GLY HA2 1 1 2 1428 2 2 23 GLY HA3 H -11.612 2.451 -0.799 1.00 . B B . 23 GLY HA3 1 1 2 1429 2 2 23 GLY N N -11.203 2.125 -2.847 1.00 . B B . 23 GLY N 1 1 2 1430 2 2 23 GLY O O -9.618 0.385 -1.485 1.00 . B B . 23 GLY O 1 1 2 1431 2 2 24 PHE C C -8.074 0.631 1.919 1.00 . B B . 24 PHE C 1 1 2 1432 2 2 24 PHE CA C -7.830 0.955 0.443 1.00 . B B . 24 PHE CA 1 1 2 1433 2 2 24 PHE CB C -6.455 1.611 0.287 1.00 . B B . 24 PHE CB 1 1 2 1434 2 2 24 PHE CD1 C -6.773 3.713 1.650 1.00 . B B . 24 PHE CD1 1 1 2 1435 2 2 24 PHE CD2 C -6.506 3.908 -0.755 1.00 . B B . 24 PHE CD2 1 1 2 1436 2 2 24 PHE CE1 C -6.886 5.107 1.750 1.00 . B B . 24 PHE CE1 1 1 2 1437 2 2 24 PHE CE2 C -6.616 5.301 -0.654 1.00 . B B . 24 PHE CE2 1 1 2 1438 2 2 24 PHE CG C -6.583 3.114 0.397 1.00 . B B . 24 PHE CG 1 1 2 1439 2 2 24 PHE CZ C -6.806 5.901 0.598 1.00 . B B . 24 PHE CZ 1 1 2 1440 2 2 24 PHE H H -8.970 2.781 0.327 1.00 . B B . 24 PHE H 1 1 2 1441 2 2 24 PHE HA H -7.858 0.041 -0.132 1.00 . B B . 24 PHE HA 1 1 2 1442 2 2 24 PHE HB2 H -5.796 1.250 1.064 1.00 . B B . 24 PHE HB2 1 1 2 1443 2 2 24 PHE HB3 H -6.043 1.355 -0.678 1.00 . B B . 24 PHE HB3 1 1 2 1444 2 2 24 PHE HD1 H -6.834 3.101 2.537 1.00 . B B . 24 PHE HD1 1 1 2 1445 2 2 24 PHE HD2 H -6.359 3.447 -1.720 1.00 . B B . 24 PHE HD2 1 1 2 1446 2 2 24 PHE HE1 H -7.035 5.569 2.716 1.00 . B B . 24 PHE HE1 1 1 2 1447 2 2 24 PHE HE2 H -6.559 5.912 -1.541 1.00 . B B . 24 PHE HE2 1 1 2 1448 2 2 24 PHE HZ H -6.887 6.976 0.673 1.00 . B B . 24 PHE HZ 1 1 2 1449 2 2 24 PHE N N -8.888 1.881 -0.053 1.00 . B B . 24 PHE N 1 1 2 1450 2 2 24 PHE O O -9.031 1.083 2.516 1.00 . B B . 24 PHE O 1 1 2 1451 2 2 25 PHE C C -6.150 -0.091 4.739 1.00 . B B . 25 PHE C 1 1 2 1452 2 2 25 PHE CA C -7.391 -0.512 3.948 1.00 . B B . 25 PHE CA 1 1 2 1453 2 2 25 PHE CB C -7.585 -2.024 4.077 1.00 . B B . 25 PHE CB 1 1 2 1454 2 2 25 PHE CD1 C -9.626 -1.984 5.559 1.00 . B B . 25 PHE CD1 1 1 2 1455 2 2 25 PHE CD2 C -7.582 -2.974 6.414 1.00 . B B . 25 PHE CD2 1 1 2 1456 2 2 25 PHE CE1 C -10.272 -2.271 6.769 1.00 . B B . 25 PHE CE1 1 1 2 1457 2 2 25 PHE CE2 C -8.227 -3.262 7.624 1.00 . B B . 25 PHE CE2 1 1 2 1458 2 2 25 PHE CG C -8.281 -2.335 5.381 1.00 . B B . 25 PHE CG 1 1 2 1459 2 2 25 PHE CZ C -9.572 -2.910 7.802 1.00 . B B . 25 PHE CZ 1 1 2 1460 2 2 25 PHE H H -6.449 -0.508 2.011 1.00 . B B . 25 PHE H 1 1 2 1461 2 2 25 PHE HA H -8.257 -0.003 4.342 1.00 . B B . 25 PHE HA 1 1 2 1462 2 2 25 PHE HB2 H -8.186 -2.381 3.254 1.00 . B B . 25 PHE HB2 1 1 2 1463 2 2 25 PHE HB3 H -6.623 -2.514 4.059 1.00 . B B . 25 PHE HB3 1 1 2 1464 2 2 25 PHE HD1 H -10.165 -1.491 4.763 1.00 . B B . 25 PHE HD1 1 1 2 1465 2 2 25 PHE HD2 H -6.546 -3.245 6.277 1.00 . B B . 25 PHE HD2 1 1 2 1466 2 2 25 PHE HE1 H -11.308 -2.001 6.906 1.00 . B B . 25 PHE HE1 1 1 2 1467 2 2 25 PHE HE2 H -7.688 -3.754 8.420 1.00 . B B . 25 PHE HE2 1 1 2 1468 2 2 25 PHE HZ H -10.069 -3.132 8.734 1.00 . B B . 25 PHE HZ 1 1 2 1469 2 2 25 PHE N N -7.213 -0.154 2.512 1.00 . B B . 25 PHE N 1 1 2 1470 2 2 25 PHE O O -5.511 -0.897 5.386 1.00 . B B . 25 PHE O 1 1 2 1471 2 2 26 TYR C C -4.805 1.371 6.938 1.00 . B B . 26 TYR C 1 1 2 1472 2 2 26 TYR CA C -4.606 1.638 5.444 1.00 . B B . 26 TYR CA 1 1 2 1473 2 2 26 TYR CB C -4.428 3.139 5.204 1.00 . B B . 26 TYR CB 1 1 2 1474 2 2 26 TYR CD1 C -2.105 2.799 6.136 1.00 . B B . 26 TYR CD1 1 1 2 1475 2 2 26 TYR CD2 C -3.185 4.952 6.435 1.00 . B B . 26 TYR CD2 1 1 2 1476 2 2 26 TYR CE1 C -0.976 3.272 6.820 1.00 . B B . 26 TYR CE1 1 1 2 1477 2 2 26 TYR CE2 C -2.057 5.424 7.119 1.00 . B B . 26 TYR CE2 1 1 2 1478 2 2 26 TYR CG C -3.210 3.640 5.944 1.00 . B B . 26 TYR CG 1 1 2 1479 2 2 26 TYR CZ C -0.953 4.584 7.311 1.00 . B B . 26 TYR CZ 1 1 2 1480 2 2 26 TYR H H -6.333 1.799 4.166 1.00 . B B . 26 TYR H 1 1 2 1481 2 2 26 TYR HA H -3.731 1.110 5.096 1.00 . B B . 26 TYR HA 1 1 2 1482 2 2 26 TYR HB2 H -4.303 3.318 4.147 1.00 . B B . 26 TYR HB2 1 1 2 1483 2 2 26 TYR HB3 H -5.302 3.664 5.557 1.00 . B B . 26 TYR HB3 1 1 2 1484 2 2 26 TYR HD1 H -2.122 1.788 5.758 1.00 . B B . 26 TYR HD1 1 1 2 1485 2 2 26 TYR HD2 H -4.036 5.600 6.287 1.00 . B B . 26 TYR HD2 1 1 2 1486 2 2 26 TYR HE1 H -0.125 2.625 6.968 1.00 . B B . 26 TYR HE1 1 1 2 1487 2 2 26 TYR HE2 H -2.039 6.436 7.497 1.00 . B B . 26 TYR HE2 1 1 2 1488 2 2 26 TYR HH H 0.597 5.692 7.424 1.00 . B B . 26 TYR HH 1 1 2 1489 2 2 26 TYR N N -5.804 1.165 4.693 1.00 . B B . 26 TYR N 1 1 2 1490 2 2 26 TYR O O -5.758 1.825 7.539 1.00 . B B . 26 TYR O 1 1 2 1491 2 2 26 TYR OH O 0.158 5.048 7.985 1.00 . B B . 26 TYR OH 1 1 2 1492 2 2 27 THR C C -3.074 1.207 9.783 1.00 . B B . 27 THR C 1 1 2 1493 2 2 27 THR CA C -4.048 0.331 8.994 1.00 . B B . 27 THR CA 1 1 2 1494 2 2 27 THR CB C -3.726 -1.146 9.238 1.00 . B B . 27 THR CB 1 1 2 1495 2 2 27 THR CG2 C -4.703 -2.020 8.450 1.00 . B B . 27 THR CG2 1 1 2 1496 2 2 27 THR H H -3.153 0.276 7.038 1.00 . B B . 27 THR H 1 1 2 1497 2 2 27 THR HA H -5.059 0.538 9.313 1.00 . B B . 27 THR HA 1 1 2 1498 2 2 27 THR HB H -3.820 -1.367 10.290 1.00 . B B . 27 THR HB 1 1 2 1499 2 2 27 THR HG1 H -1.800 -0.912 9.369 1.00 . B B . 27 THR HG1 1 1 2 1500 2 2 27 THR HG21 H -4.586 -1.829 7.393 1.00 . B B . 27 THR HG21 1 1 2 1501 2 2 27 THR HG22 H -5.715 -1.788 8.748 1.00 . B B . 27 THR HG22 1 1 2 1502 2 2 27 THR HG23 H -4.498 -3.062 8.651 1.00 . B B . 27 THR HG23 1 1 2 1503 2 2 27 THR N N -3.913 0.633 7.541 1.00 . B B . 27 THR N 1 1 2 1504 2 2 27 THR O O -1.920 1.344 9.425 1.00 . B B . 27 THR O 1 1 2 1505 2 2 27 THR OG1 O -2.398 -1.415 8.812 1.00 . B B . 27 THR OG1 1 1 2 1506 2 2 28 LYS C C -1.888 1.865 12.715 1.00 . B B . 28 LYS C 1 1 2 1507 2 2 28 LYS CA C -2.613 2.681 11.645 1.00 . B B . 28 LYS CA 1 1 2 1508 2 2 28 LYS CB C -3.403 3.783 12.353 1.00 . B B . 28 LYS CB 1 1 2 1509 2 2 28 LYS CD C -3.078 5.333 10.420 1.00 . B B . 28 LYS CD 1 1 2 1510 2 2 28 LYS CE C -4.575 5.331 10.108 1.00 . B B . 28 LYS CE 1 1 2 1511 2 2 28 LYS CG C -2.873 5.151 11.925 1.00 . B B . 28 LYS CG 1 1 2 1512 2 2 28 LYS H H -4.460 1.693 11.118 1.00 . B B . 28 LYS H 1 1 2 1513 2 2 28 LYS HA H -1.889 3.135 10.983 1.00 . B B . 28 LYS HA 1 1 2 1514 2 2 28 LYS HB2 H -4.451 3.700 12.109 1.00 . B B . 28 LYS HB2 1 1 2 1515 2 2 28 LYS HB3 H -3.279 3.672 13.422 1.00 . B B . 28 LYS HB3 1 1 2 1516 2 2 28 LYS HD2 H -2.645 6.273 10.108 1.00 . B B . 28 LYS HD2 1 1 2 1517 2 2 28 LYS HD3 H -2.600 4.523 9.889 1.00 . B B . 28 LYS HD3 1 1 2 1518 2 2 28 LYS HE2 H -4.729 5.600 9.074 1.00 . B B . 28 LYS HE2 1 1 2 1519 2 2 28 LYS HE3 H -4.978 4.345 10.287 1.00 . B B . 28 LYS HE3 1 1 2 1520 2 2 28 LYS HG2 H -3.405 5.925 12.459 1.00 . B B . 28 LYS HG2 1 1 2 1521 2 2 28 LYS HG3 H -1.820 5.215 12.153 1.00 . B B . 28 LYS HG3 1 1 2 1522 2 2 28 LYS HZ1 H -4.644 7.135 11.145 1.00 . B B . 28 LYS HZ1 1 1 2 1523 2 2 28 LYS HZ2 H -5.487 5.869 11.902 1.00 . B B . 28 LYS HZ2 1 1 2 1524 2 2 28 LYS HZ3 H -6.144 6.633 10.534 1.00 . B B . 28 LYS HZ3 1 1 2 1525 2 2 28 LYS N N -3.525 1.809 10.849 1.00 . B B . 28 LYS N 1 1 2 1526 2 2 28 LYS NZ N -5.265 6.316 10.988 1.00 . B B . 28 LYS NZ 1 1 2 1527 2 2 28 LYS O O -0.674 1.863 12.770 1.00 . B B . 28 LYS O 1 1 2 1528 2 2 29 PRO C C -1.665 -0.944 14.215 1.00 . B B . 29 PRO C 1 1 2 1529 2 2 29 PRO CA C -2.110 0.447 14.684 1.00 . B B . 29 PRO CA 1 1 2 1530 2 2 29 PRO CB C -3.296 0.342 15.642 1.00 . B B . 29 PRO CB 1 1 2 1531 2 2 29 PRO CD C -4.137 1.230 13.499 1.00 . B B . 29 PRO CD 1 1 2 1532 2 2 29 PRO CG C -4.571 0.524 14.790 1.00 . B B . 29 PRO CG 1 1 2 1533 2 2 29 PRO HA H -1.297 0.971 15.160 1.00 . B B . 29 PRO HA 1 1 2 1534 2 2 29 PRO HB2 H -3.300 -0.620 16.127 1.00 . B B . 29 PRO HB2 1 1 2 1535 2 2 29 PRO HB3 H -3.243 1.134 16.372 1.00 . B B . 29 PRO HB3 1 1 2 1536 2 2 29 PRO HD2 H -4.480 0.675 12.637 1.00 . B B . 29 PRO HD2 1 1 2 1537 2 2 29 PRO HD3 H -4.518 2.234 13.484 1.00 . B B . 29 PRO HD3 1 1 2 1538 2 2 29 PRO HG2 H -5.004 -0.441 14.562 1.00 . B B . 29 PRO HG2 1 1 2 1539 2 2 29 PRO HG3 H -5.286 1.136 15.318 1.00 . B B . 29 PRO HG3 1 1 2 1540 2 2 29 PRO N N -2.656 1.231 13.567 1.00 . B B . 29 PRO N 1 1 2 1541 2 2 29 PRO O O -2.011 -1.945 14.811 1.00 . B B . 29 PRO O 1 1 2 1542 2 2 30 THR C C -1.536 -3.369 12.771 1.00 . B B . 30 THR C 1 1 2 1543 2 2 30 THR CA C -0.419 -2.330 12.649 1.00 . B B . 30 THR CA 1 1 2 1544 2 2 30 THR CB C 0.798 -2.783 13.461 1.00 . B B . 30 THR CB 1 1 2 1545 2 2 30 THR CG2 C 0.393 -3.011 14.918 1.00 . B B . 30 THR CG2 1 1 2 1546 2 2 30 THR H H -0.624 -0.188 12.703 1.00 . B B . 30 THR H 1 1 2 1547 2 2 30 THR HA H -0.138 -2.230 11.611 1.00 . B B . 30 THR HA 1 1 2 1548 2 2 30 THR HB H 1.561 -2.021 13.420 1.00 . B B . 30 THR HB 1 1 2 1549 2 2 30 THR HG1 H 0.949 -4.723 13.425 1.00 . B B . 30 THR HG1 1 1 2 1550 2 2 30 THR HG21 H 0.033 -2.085 15.341 1.00 . B B . 30 THR HG21 1 1 2 1551 2 2 30 THR HG22 H 1.250 -3.353 15.480 1.00 . B B . 30 THR HG22 1 1 2 1552 2 2 30 THR HG23 H -0.387 -3.756 14.964 1.00 . B B . 30 THR HG23 1 1 2 1553 2 2 30 THR N N -0.895 -1.010 13.159 1.00 . B B . 30 THR N 1 1 2 1554 2 2 30 THR O O -2.683 -3.002 12.580 1.00 . B B . 30 THR O 1 1 2 1555 2 2 30 THR OXT O -1.224 -4.514 13.055 1.00 . B B . 30 THR OXT 1 1 2 1556 2 2 30 THR OG1 O 1.306 -3.992 12.914 1.00 . B B . 30 THR OG1 1 1 3 1557 1 1 1 GLY C C 0.301 -4.966 7.519 1.00 . A A . 1 GLY C 1 1 3 1558 1 1 1 GLY CA C -0.364 -5.066 8.847 1.00 . A A . 1 GLY CA 1 1 3 1559 1 1 1 GLY H1 H -0.980 -3.151 9.501 1.00 . A A . 1 GLY H1 1 1 3 1560 1 1 1 GLY H2 H -1.994 -4.410 10.025 1.00 . A A . 1 GLY H2 1 1 3 1561 1 1 1 GLY H3 H -2.061 -3.879 8.413 1.00 . A A . 1 GLY H3 1 1 3 1562 1 1 1 GLY HA2 H 0.511 -4.805 9.187 1.00 . A A . 1 GLY HA2 1 1 3 1563 1 1 1 GLY HA3 H -0.721 -6.102 9.251 1.00 . A A . 1 GLY HA3 1 1 3 1564 1 1 1 GLY N N -1.436 -4.045 9.227 1.00 . A A . 1 GLY N 1 1 3 1565 1 1 1 GLY O O 0.973 -5.878 7.079 1.00 . A A . 1 GLY O 1 1 3 1566 1 1 2 ILE C C 2.056 -2.871 5.666 1.00 . A A . 2 ILE C 1 1 3 1567 1 1 2 ILE CA C 0.786 -3.708 5.513 1.00 . A A . 2 ILE CA 1 1 3 1568 1 1 2 ILE CB C -0.203 -3.062 4.518 1.00 . A A . 2 ILE CB 1 1 3 1569 1 1 2 ILE CD1 C -0.150 -2.257 2.158 1.00 . A A . 2 ILE CD1 1 1 3 1570 1 1 2 ILE CG1 C 0.541 -2.171 3.516 1.00 . A A . 2 ILE CG1 1 1 3 1571 1 1 2 ILE CG2 C -1.245 -2.226 5.266 1.00 . A A . 2 ILE CG2 1 1 3 1572 1 1 2 ILE H H -0.403 -3.135 7.217 1.00 . A A . 2 ILE H 1 1 3 1573 1 1 2 ILE HA H 1.062 -4.680 5.149 1.00 . A A . 2 ILE HA 1 1 3 1574 1 1 2 ILE HB H -0.712 -3.848 3.978 1.00 . A A . 2 ILE HB 1 1 3 1575 1 1 2 ILE HD11 H -1.220 -2.287 2.301 1.00 . A A . 2 ILE HD11 1 1 3 1576 1 1 2 ILE HD12 H 0.171 -3.153 1.648 1.00 . A A . 2 ILE HD12 1 1 3 1577 1 1 2 ILE HD13 H 0.110 -1.392 1.565 1.00 . A A . 2 ILE HD13 1 1 3 1578 1 1 2 ILE HG12 H 0.533 -1.148 3.865 1.00 . A A . 2 ILE HG12 1 1 3 1579 1 1 2 ILE HG13 H 1.560 -2.513 3.420 1.00 . A A . 2 ILE HG13 1 1 3 1580 1 1 2 ILE HG21 H -0.749 -1.514 5.906 1.00 . A A . 2 ILE HG21 1 1 3 1581 1 1 2 ILE HG22 H -1.865 -2.877 5.863 1.00 . A A . 2 ILE HG22 1 1 3 1582 1 1 2 ILE HG23 H -1.861 -1.699 4.552 1.00 . A A . 2 ILE HG23 1 1 3 1583 1 1 2 ILE N N 0.139 -3.861 6.845 1.00 . A A . 2 ILE N 1 1 3 1584 1 1 2 ILE O O 3.146 -3.343 5.428 1.00 . A A . 2 ILE O 1 1 3 1585 1 1 3 ABA C C 4.249 -1.567 6.845 1.00 . A A . 3 ABA C 1 1 3 1586 1 1 3 ABA CA C 3.114 -0.762 6.228 1.00 . A A . 3 ABA CA 1 1 3 1587 1 1 3 ABA CB C 2.796 0.430 7.141 1.00 . A A . 3 ABA CB 1 1 3 1588 1 1 3 ABA CG C 1.437 0.253 7.826 1.00 . A A . 3 ABA CG 1 1 3 1589 1 1 3 ABA H H 1.031 -1.290 6.231 1.00 . A A . 3 ABA H 1 1 3 1590 1 1 3 ABA HA H 3.427 -0.399 5.268 1.00 . A A . 3 ABA HA 1 1 3 1591 1 1 3 ABA HB2 H 3.560 0.504 7.895 1.00 . A A . 3 ABA HB2 1 1 3 1592 1 1 3 ABA HB3 H 2.787 1.333 6.552 1.00 . A A . 3 ABA HB3 1 1 3 1593 1 1 3 ABA HG1 H 1.353 -0.756 8.202 1.00 . A A . 3 ABA HG1 1 1 3 1594 1 1 3 ABA HG2 H 0.648 0.438 7.112 1.00 . A A . 3 ABA HG2 1 1 3 1595 1 1 3 ABA HG3 H 1.353 0.951 8.646 1.00 . A A . 3 ABA HG3 1 1 3 1596 1 1 3 ABA N N 1.919 -1.638 6.057 1.00 . A A . 3 ABA N 1 1 3 1597 1 1 3 ABA O O 5.277 -1.754 6.252 1.00 . A A . 3 ABA O 1 1 3 1598 1 1 4 GLU C C 5.804 -3.772 7.635 1.00 . A A . 4 GLU C 1 1 3 1599 1 1 4 GLU CA C 5.142 -2.855 8.672 1.00 . A A . 4 GLU CA 1 1 3 1600 1 1 4 GLU CB C 4.528 -3.704 9.768 1.00 . A A . 4 GLU CB 1 1 3 1601 1 1 4 GLU CD C 4.664 -4.286 12.195 1.00 . A A . 4 GLU CD 1 1 3 1602 1 1 4 GLU CG C 5.399 -3.633 11.022 1.00 . A A . 4 GLU CG 1 1 3 1603 1 1 4 GLU H H 3.223 -1.896 8.489 1.00 . A A . 4 GLU H 1 1 3 1604 1 1 4 GLU HA H 5.882 -2.194 9.098 1.00 . A A . 4 GLU HA 1 1 3 1605 1 1 4 GLU HB2 H 3.541 -3.336 9.990 1.00 . A A . 4 GLU HB2 1 1 3 1606 1 1 4 GLU HB3 H 4.466 -4.720 9.426 1.00 . A A . 4 GLU HB3 1 1 3 1607 1 1 4 GLU HG2 H 6.330 -4.153 10.843 1.00 . A A . 4 GLU HG2 1 1 3 1608 1 1 4 GLU HG3 H 5.602 -2.600 11.258 1.00 . A A . 4 GLU HG3 1 1 3 1609 1 1 4 GLU N N 4.067 -2.052 8.026 1.00 . A A . 4 GLU N 1 1 3 1610 1 1 4 GLU O O 6.961 -4.118 7.749 1.00 . A A . 4 GLU O 1 1 3 1611 1 1 4 GLU OE1 O 3.445 -4.270 12.185 1.00 . A A . 4 GLU OE1 1 1 3 1612 1 1 4 GLU OE2 O 5.334 -4.789 13.082 1.00 . A A . 4 GLU OE2 1 1 3 1613 1 1 5 GLN C C 5.945 -4.210 4.317 1.00 . A A . 5 GLN C 1 1 3 1614 1 1 5 GLN CA C 5.652 -5.047 5.568 1.00 . A A . 5 GLN CA 1 1 3 1615 1 1 5 GLN CB C 4.643 -6.145 5.223 1.00 . A A . 5 GLN CB 1 1 3 1616 1 1 5 GLN CD C 4.342 -8.604 4.927 1.00 . A A . 5 GLN CD 1 1 3 1617 1 1 5 GLN CG C 5.370 -7.478 5.043 1.00 . A A . 5 GLN CG 1 1 3 1618 1 1 5 GLN H H 4.143 -3.866 6.549 1.00 . A A . 5 GLN H 1 1 3 1619 1 1 5 GLN HA H 6.567 -5.493 5.930 1.00 . A A . 5 GLN HA 1 1 3 1620 1 1 5 GLN HB2 H 3.919 -6.234 6.021 1.00 . A A . 5 GLN HB2 1 1 3 1621 1 1 5 GLN HB3 H 4.135 -5.890 4.305 1.00 . A A . 5 GLN HB3 1 1 3 1622 1 1 5 GLN HE21 H 3.486 -7.841 3.306 1.00 . A A . 5 GLN HE21 1 1 3 1623 1 1 5 GLN HE22 H 2.810 -9.293 3.868 1.00 . A A . 5 GLN HE22 1 1 3 1624 1 1 5 GLN HG2 H 5.971 -7.443 4.146 1.00 . A A . 5 GLN HG2 1 1 3 1625 1 1 5 GLN HG3 H 6.006 -7.661 5.897 1.00 . A A . 5 GLN HG3 1 1 3 1626 1 1 5 GLN N N 5.074 -4.161 6.621 1.00 . A A . 5 GLN N 1 1 3 1627 1 1 5 GLN NE2 N 3.474 -8.577 3.953 1.00 . A A . 5 GLN NE2 1 1 3 1628 1 1 5 GLN O O 7.033 -4.235 3.776 1.00 . A A . 5 GLN O 1 1 3 1629 1 1 5 GLN OE1 O 4.326 -9.516 5.730 1.00 . A A . 5 GLN OE1 1 1 3 1630 1 1 6 CYS C C 5.978 -1.356 3.072 1.00 . A A . 6 CYS C 1 1 3 1631 1 1 6 CYS CA C 5.164 -2.594 2.670 1.00 . A A . 6 CYS CA 1 1 3 1632 1 1 6 CYS CB C 3.780 -2.156 2.185 1.00 . A A . 6 CYS CB 1 1 3 1633 1 1 6 CYS H H 4.114 -3.444 4.324 1.00 . A A . 6 CYS H 1 1 3 1634 1 1 6 CYS HA H 5.676 -3.140 1.889 1.00 . A A . 6 CYS HA 1 1 3 1635 1 1 6 CYS HB2 H 3.210 -1.783 3.022 1.00 . A A . 6 CYS HB2 1 1 3 1636 1 1 6 CYS HB3 H 3.882 -1.381 1.460 1.00 . A A . 6 CYS HB3 1 1 3 1637 1 1 6 CYS N N 4.976 -3.455 3.865 1.00 . A A . 6 CYS N 1 1 3 1638 1 1 6 CYS O O 6.257 -0.491 2.265 1.00 . A A . 6 CYS O 1 1 3 1639 1 1 6 CYS SG S 2.909 -3.560 1.449 1.00 . A A . 6 CYS SG 1 1 3 1640 1 1 7 CYS C C 8.503 -0.560 5.284 1.00 . A A . 7 CYS C 1 1 3 1641 1 1 7 CYS CA C 7.119 -0.099 4.823 1.00 . A A . 7 CYS CA 1 1 3 1642 1 1 7 CYS CB C 6.386 0.535 6.009 1.00 . A A . 7 CYS CB 1 1 3 1643 1 1 7 CYS H H 6.091 -1.976 4.952 1.00 . A A . 7 CYS H 1 1 3 1644 1 1 7 CYS HA H 7.220 0.627 4.043 1.00 . A A . 7 CYS HA 1 1 3 1645 1 1 7 CYS HB2 H 5.352 0.699 5.755 1.00 . A A . 7 CYS HB2 1 1 3 1646 1 1 7 CYS HB3 H 6.432 -0.127 6.846 1.00 . A A . 7 CYS HB3 1 1 3 1647 1 1 7 CYS N N 6.342 -1.268 4.324 1.00 . A A . 7 CYS N 1 1 3 1648 1 1 7 CYS O O 9.461 0.186 5.239 1.00 . A A . 7 CYS O 1 1 3 1649 1 1 7 CYS SG S 7.179 2.107 6.444 1.00 . A A . 7 CYS SG 1 1 3 1650 1 1 8 THR C C 10.586 -3.114 5.095 1.00 . A A . 8 THR C 1 1 3 1651 1 1 8 THR CA C 9.944 -2.278 6.198 1.00 . A A . 8 THR CA 1 1 3 1652 1 1 8 THR CB C 9.754 -3.138 7.446 1.00 . A A . 8 THR CB 1 1 3 1653 1 1 8 THR CG2 C 8.841 -2.408 8.432 1.00 . A A . 8 THR CG2 1 1 3 1654 1 1 8 THR H H 7.835 -2.377 5.765 1.00 . A A . 8 THR H 1 1 3 1655 1 1 8 THR HA H 10.581 -1.438 6.432 1.00 . A A . 8 THR HA 1 1 3 1656 1 1 8 THR HB H 10.710 -3.315 7.911 1.00 . A A . 8 THR HB 1 1 3 1657 1 1 8 THR HG1 H 9.795 -5.075 7.274 1.00 . A A . 8 THR HG1 1 1 3 1658 1 1 8 THR HG21 H 9.381 -1.586 8.879 1.00 . A A . 8 THR HG21 1 1 3 1659 1 1 8 THR HG22 H 8.524 -3.092 9.204 1.00 . A A . 8 THR HG22 1 1 3 1660 1 1 8 THR HG23 H 7.976 -2.028 7.908 1.00 . A A . 8 THR HG23 1 1 3 1661 1 1 8 THR N N 8.619 -1.783 5.732 1.00 . A A . 8 THR N 1 1 3 1662 1 1 8 THR O O 11.788 -3.285 5.048 1.00 . A A . 8 THR O 1 1 3 1663 1 1 8 THR OG1 O 9.166 -4.378 7.078 1.00 . A A . 8 THR OG1 1 1 3 1664 1 1 9 SER C C 9.998 -3.774 1.762 1.00 . A A . 9 SER C 1 1 3 1665 1 1 9 SER CA C 10.353 -4.447 3.092 1.00 . A A . 9 SER CA 1 1 3 1666 1 1 9 SER CB C 9.768 -5.862 3.151 1.00 . A A . 9 SER CB 1 1 3 1667 1 1 9 SER H H 8.825 -3.471 4.256 1.00 . A A . 9 SER H 1 1 3 1668 1 1 9 SER HA H 11.427 -4.496 3.193 1.00 . A A . 9 SER HA 1 1 3 1669 1 1 9 SER HB2 H 8.775 -5.863 2.735 1.00 . A A . 9 SER HB2 1 1 3 1670 1 1 9 SER HB3 H 10.397 -6.532 2.578 1.00 . A A . 9 SER HB3 1 1 3 1671 1 1 9 SER HG H 9.566 -7.240 4.510 1.00 . A A . 9 SER HG 1 1 3 1672 1 1 9 SER N N 9.792 -3.629 4.201 1.00 . A A . 9 SER N 1 1 3 1673 1 1 9 SER O O 10.209 -2.590 1.590 1.00 . A A . 9 SER O 1 1 3 1674 1 1 9 SER OG O 9.709 -6.290 4.505 1.00 . A A . 9 SER OG 1 1 3 1675 1 1 10 ILE C C 7.664 -4.271 -0.846 1.00 . A A . 10 ILE C 1 1 3 1676 1 1 10 ILE CA C 9.098 -3.875 -0.479 1.00 . A A . 10 ILE CA 1 1 3 1677 1 1 10 ILE CB C 10.073 -4.362 -1.563 1.00 . A A . 10 ILE CB 1 1 3 1678 1 1 10 ILE CD1 C 12.408 -4.064 -0.733 1.00 . A A . 10 ILE CD1 1 1 3 1679 1 1 10 ILE CG1 C 11.299 -3.453 -1.590 1.00 . A A . 10 ILE CG1 1 1 3 1680 1 1 10 ILE CG2 C 9.395 -4.329 -2.936 1.00 . A A . 10 ILE CG2 1 1 3 1681 1 1 10 ILE H H 9.289 -5.453 0.968 1.00 . A A . 10 ILE H 1 1 3 1682 1 1 10 ILE HA H 9.164 -2.800 -0.391 1.00 . A A . 10 ILE HA 1 1 3 1683 1 1 10 ILE HB H 10.381 -5.370 -1.340 1.00 . A A . 10 ILE HB 1 1 3 1684 1 1 10 ILE HD11 H 12.967 -4.777 -1.322 1.00 . A A . 10 ILE HD11 1 1 3 1685 1 1 10 ILE HD12 H 11.971 -4.565 0.118 1.00 . A A . 10 ILE HD12 1 1 3 1686 1 1 10 ILE HD13 H 13.071 -3.283 -0.390 1.00 . A A . 10 ILE HD13 1 1 3 1687 1 1 10 ILE HG12 H 11.644 -3.349 -2.609 1.00 . A A . 10 ILE HG12 1 1 3 1688 1 1 10 ILE HG13 H 11.036 -2.484 -1.197 1.00 . A A . 10 ILE HG13 1 1 3 1689 1 1 10 ILE HG21 H 8.765 -3.454 -3.004 1.00 . A A . 10 ILE HG21 1 1 3 1690 1 1 10 ILE HG22 H 8.792 -5.216 -3.059 1.00 . A A . 10 ILE HG22 1 1 3 1691 1 1 10 ILE HG23 H 10.146 -4.293 -3.710 1.00 . A A . 10 ILE HG23 1 1 3 1692 1 1 10 ILE N N 9.459 -4.501 0.822 1.00 . A A . 10 ILE N 1 1 3 1693 1 1 10 ILE O O 7.165 -5.295 -0.422 1.00 . A A . 10 ILE O 1 1 3 1694 1 1 11 CYS C C 5.317 -3.357 -3.462 1.00 . A A . 11 CYS C 1 1 3 1695 1 1 11 CYS CA C 5.602 -3.831 -2.036 1.00 . A A . 11 CYS CA 1 1 3 1696 1 1 11 CYS CB C 4.615 -3.214 -1.053 1.00 . A A . 11 CYS CB 1 1 3 1697 1 1 11 CYS H H 7.423 -2.652 -1.982 1.00 . A A . 11 CYS H 1 1 3 1698 1 1 11 CYS HA H 5.487 -4.899 -2.004 1.00 . A A . 11 CYS HA 1 1 3 1699 1 1 11 CYS HB2 H 5.040 -2.322 -0.625 1.00 . A A . 11 CYS HB2 1 1 3 1700 1 1 11 CYS HB3 H 3.700 -2.972 -1.567 1.00 . A A . 11 CYS HB3 1 1 3 1701 1 1 11 CYS N N 7.000 -3.476 -1.642 1.00 . A A . 11 CYS N 1 1 3 1702 1 1 11 CYS O O 5.460 -2.196 -3.789 1.00 . A A . 11 CYS O 1 1 3 1703 1 1 11 CYS SG S 4.282 -4.428 0.252 1.00 . A A . 11 CYS SG 1 1 3 1704 1 1 12 SER C C 3.270 -3.264 -5.863 1.00 . A A . 12 SER C 1 1 3 1705 1 1 12 SER CA C 4.645 -3.912 -5.735 1.00 . A A . 12 SER CA 1 1 3 1706 1 1 12 SER CB C 4.685 -5.180 -6.586 1.00 . A A . 12 SER CB 1 1 3 1707 1 1 12 SER H H 4.834 -5.199 -4.021 1.00 . A A . 12 SER H 1 1 3 1708 1 1 12 SER HA H 5.393 -3.222 -6.095 1.00 . A A . 12 SER HA 1 1 3 1709 1 1 12 SER HB2 H 3.900 -5.146 -7.322 1.00 . A A . 12 SER HB2 1 1 3 1710 1 1 12 SER HB3 H 5.642 -5.245 -7.086 1.00 . A A . 12 SER HB3 1 1 3 1711 1 1 12 SER HG H 5.338 -6.527 -5.342 1.00 . A A . 12 SER HG 1 1 3 1712 1 1 12 SER N N 4.927 -4.269 -4.315 1.00 . A A . 12 SER N 1 1 3 1713 1 1 12 SER O O 2.398 -3.432 -5.034 1.00 . A A . 12 SER O 1 1 3 1714 1 1 12 SER OG O 4.494 -6.313 -5.748 1.00 . A A . 12 SER OG 1 1 3 1715 1 1 13 LEU C C 0.640 -2.805 -7.212 1.00 . A A . 13 LEU C 1 1 3 1716 1 1 13 LEU CA C 1.800 -1.812 -7.150 1.00 . A A . 13 LEU CA 1 1 3 1717 1 1 13 LEU CB C 1.887 -1.066 -8.481 1.00 . A A . 13 LEU CB 1 1 3 1718 1 1 13 LEU CD1 C 1.634 -1.365 -10.949 1.00 . A A . 13 LEU CD1 1 1 3 1719 1 1 13 LEU CD2 C 3.146 -2.872 -9.679 1.00 . A A . 13 LEU CD2 1 1 3 1720 1 1 13 LEU CG C 1.838 -2.084 -9.624 1.00 . A A . 13 LEU CG 1 1 3 1721 1 1 13 LEU H H 3.827 -2.397 -7.545 1.00 . A A . 13 LEU H 1 1 3 1722 1 1 13 LEU HA H 1.619 -1.113 -6.359 1.00 . A A . 13 LEU HA 1 1 3 1723 1 1 13 LEU HB2 H 1.053 -0.383 -8.567 1.00 . A A . 13 LEU HB2 1 1 3 1724 1 1 13 LEU HB3 H 2.814 -0.515 -8.529 1.00 . A A . 13 LEU HB3 1 1 3 1725 1 1 13 LEU HD11 H 0.760 -1.765 -11.439 1.00 . A A . 13 LEU HD11 1 1 3 1726 1 1 13 LEU HD12 H 2.501 -1.516 -11.575 1.00 . A A . 13 LEU HD12 1 1 3 1727 1 1 13 LEU HD13 H 1.497 -0.310 -10.767 1.00 . A A . 13 LEU HD13 1 1 3 1728 1 1 13 LEU HD21 H 3.171 -3.584 -8.867 1.00 . A A . 13 LEU HD21 1 1 3 1729 1 1 13 LEU HD22 H 3.980 -2.192 -9.588 1.00 . A A . 13 LEU HD22 1 1 3 1730 1 1 13 LEU HD23 H 3.210 -3.398 -10.619 1.00 . A A . 13 LEU HD23 1 1 3 1731 1 1 13 LEU HG H 1.017 -2.761 -9.457 1.00 . A A . 13 LEU HG 1 1 3 1732 1 1 13 LEU N N 3.092 -2.512 -6.910 1.00 . A A . 13 LEU N 1 1 3 1733 1 1 13 LEU O O -0.512 -2.422 -7.155 1.00 . A A . 13 LEU O 1 1 3 1734 1 1 14 TYR C C -0.286 -5.682 -6.018 1.00 . A A . 14 TYR C 1 1 3 1735 1 1 14 TYR CA C -0.202 -5.043 -7.379 1.00 . A A . 14 TYR CA 1 1 3 1736 1 1 14 TYR CB C 0.070 -6.085 -8.467 1.00 . A A . 14 TYR CB 1 1 3 1737 1 1 14 TYR CD1 C -0.474 -8.313 -7.415 1.00 . A A . 14 TYR CD1 1 1 3 1738 1 1 14 TYR CD2 C -2.056 -7.341 -8.979 1.00 . A A . 14 TYR CD2 1 1 3 1739 1 1 14 TYR CE1 C -1.320 -9.417 -7.246 1.00 . A A . 14 TYR CE1 1 1 3 1740 1 1 14 TYR CE2 C -2.902 -8.445 -8.809 1.00 . A A . 14 TYR CE2 1 1 3 1741 1 1 14 TYR CG C -0.842 -7.274 -8.281 1.00 . A A . 14 TYR CG 1 1 3 1742 1 1 14 TYR CZ C -2.534 -9.483 -7.942 1.00 . A A . 14 TYR CZ 1 1 3 1743 1 1 14 TYR H H 1.847 -4.382 -7.347 1.00 . A A . 14 TYR H 1 1 3 1744 1 1 14 TYR HA H -1.122 -4.519 -7.580 1.00 . A A . 14 TYR HA 1 1 3 1745 1 1 14 TYR HB2 H -0.112 -5.641 -9.437 1.00 . A A . 14 TYR HB2 1 1 3 1746 1 1 14 TYR HB3 H 1.099 -6.406 -8.408 1.00 . A A . 14 TYR HB3 1 1 3 1747 1 1 14 TYR HD1 H 0.462 -8.263 -6.877 1.00 . A A . 14 TYR HD1 1 1 3 1748 1 1 14 TYR HD2 H -2.339 -6.541 -9.647 1.00 . A A . 14 TYR HD2 1 1 3 1749 1 1 14 TYR HE1 H -1.037 -10.218 -6.579 1.00 . A A . 14 TYR HE1 1 1 3 1750 1 1 14 TYR HE2 H -3.837 -8.496 -9.347 1.00 . A A . 14 TYR HE2 1 1 3 1751 1 1 14 TYR HH H -2.888 -11.242 -7.286 1.00 . A A . 14 TYR HH 1 1 3 1752 1 1 14 TYR N N 0.914 -4.070 -7.321 1.00 . A A . 14 TYR N 1 1 3 1753 1 1 14 TYR O O -1.344 -6.003 -5.515 1.00 . A A . 14 TYR O 1 1 3 1754 1 1 14 TYR OH O -3.369 -10.570 -7.775 1.00 . A A . 14 TYR OH 1 1 3 1755 1 1 15 GLN C C 0.096 -5.337 -3.177 1.00 . A A . 15 GLN C 1 1 3 1756 1 1 15 GLN CA C 0.865 -6.329 -4.030 1.00 . A A . 15 GLN CA 1 1 3 1757 1 1 15 GLN CB C 2.320 -6.376 -3.584 1.00 . A A . 15 GLN CB 1 1 3 1758 1 1 15 GLN CD C 2.875 -8.380 -2.201 1.00 . A A . 15 GLN CD 1 1 3 1759 1 1 15 GLN CG C 2.831 -7.813 -3.621 1.00 . A A . 15 GLN CG 1 1 3 1760 1 1 15 GLN H H 1.662 -5.477 -5.811 1.00 . A A . 15 GLN H 1 1 3 1761 1 1 15 GLN HA H 0.408 -7.305 -3.986 1.00 . A A . 15 GLN HA 1 1 3 1762 1 1 15 GLN HB2 H 2.910 -5.767 -4.260 1.00 . A A . 15 GLN HB2 1 1 3 1763 1 1 15 GLN HB3 H 2.400 -5.985 -2.586 1.00 . A A . 15 GLN HB3 1 1 3 1764 1 1 15 GLN HE21 H 1.303 -7.336 -1.582 1.00 . A A . 15 GLN HE21 1 1 3 1765 1 1 15 GLN HE22 H 2.009 -8.346 -0.415 1.00 . A A . 15 GLN HE22 1 1 3 1766 1 1 15 GLN HG2 H 2.172 -8.411 -4.232 1.00 . A A . 15 GLN HG2 1 1 3 1767 1 1 15 GLN HG3 H 3.825 -7.825 -4.043 1.00 . A A . 15 GLN HG3 1 1 3 1768 1 1 15 GLN N N 0.835 -5.796 -5.394 1.00 . A A . 15 GLN N 1 1 3 1769 1 1 15 GLN NE2 N 1.989 -7.988 -1.327 1.00 . A A . 15 GLN NE2 1 1 3 1770 1 1 15 GLN O O -0.635 -5.688 -2.272 1.00 . A A . 15 GLN O 1 1 3 1771 1 1 15 GLN OE1 O 3.726 -9.186 -1.883 1.00 . A A . 15 GLN OE1 1 1 3 1772 1 1 16 LEU C C -1.881 -2.938 -3.363 1.00 . A A . 16 LEU C 1 1 3 1773 1 1 16 LEU CA C -0.483 -3.025 -2.780 1.00 . A A . 16 LEU CA 1 1 3 1774 1 1 16 LEU CB C 0.281 -1.720 -2.964 1.00 . A A . 16 LEU CB 1 1 3 1775 1 1 16 LEU CD1 C 2.449 -0.593 -2.378 1.00 . A A . 16 LEU CD1 1 1 3 1776 1 1 16 LEU CD2 C 1.561 -2.433 -0.945 1.00 . A A . 16 LEU CD2 1 1 3 1777 1 1 16 LEU CG C 1.683 -1.913 -2.378 1.00 . A A . 16 LEU CG 1 1 3 1778 1 1 16 LEU H H 0.808 -3.841 -4.276 1.00 . A A . 16 LEU H 1 1 3 1779 1 1 16 LEU HA H -0.544 -3.273 -1.734 1.00 . A A . 16 LEU HA 1 1 3 1780 1 1 16 LEU HB2 H 0.352 -1.486 -4.017 1.00 . A A . 16 LEU HB2 1 1 3 1781 1 1 16 LEU HB3 H -0.224 -0.926 -2.449 1.00 . A A . 16 LEU HB3 1 1 3 1782 1 1 16 LEU HD11 H 2.604 -0.267 -3.395 1.00 . A A . 16 LEU HD11 1 1 3 1783 1 1 16 LEU HD12 H 3.406 -0.736 -1.895 1.00 . A A . 16 LEU HD12 1 1 3 1784 1 1 16 LEU HD13 H 1.882 0.150 -1.841 1.00 . A A . 16 LEU HD13 1 1 3 1785 1 1 16 LEU HD21 H 2.230 -1.879 -0.304 1.00 . A A . 16 LEU HD21 1 1 3 1786 1 1 16 LEU HD22 H 1.826 -3.481 -0.920 1.00 . A A . 16 LEU HD22 1 1 3 1787 1 1 16 LEU HD23 H 0.546 -2.310 -0.600 1.00 . A A . 16 LEU HD23 1 1 3 1788 1 1 16 LEU HG H 2.222 -2.635 -2.975 1.00 . A A . 16 LEU HG 1 1 3 1789 1 1 16 LEU N N 0.238 -4.084 -3.510 1.00 . A A . 16 LEU N 1 1 3 1790 1 1 16 LEU O O -2.812 -2.474 -2.734 1.00 . A A . 16 LEU O 1 1 3 1791 1 1 17 GLU C C -4.232 -4.464 -4.490 1.00 . A A . 17 GLU C 1 1 3 1792 1 1 17 GLU CA C -3.363 -3.421 -5.195 1.00 . A A . 17 GLU CA 1 1 3 1793 1 1 17 GLU CB C -3.205 -3.790 -6.671 1.00 . A A . 17 GLU CB 1 1 3 1794 1 1 17 GLU CD C -4.846 -5.079 -8.044 1.00 . A A . 17 GLU CD 1 1 3 1795 1 1 17 GLU CG C -4.567 -3.738 -7.364 1.00 . A A . 17 GLU CG 1 1 3 1796 1 1 17 GLU H H -1.271 -3.811 -5.033 1.00 . A A . 17 GLU H 1 1 3 1797 1 1 17 GLU HA H -3.808 -2.447 -5.107 1.00 . A A . 17 GLU HA 1 1 3 1798 1 1 17 GLU HB2 H -2.530 -3.093 -7.143 1.00 . A A . 17 GLU HB2 1 1 3 1799 1 1 17 GLU HB3 H -2.799 -4.787 -6.751 1.00 . A A . 17 GLU HB3 1 1 3 1800 1 1 17 GLU HG2 H -5.336 -3.538 -6.631 1.00 . A A . 17 GLU HG2 1 1 3 1801 1 1 17 GLU HG3 H -4.564 -2.954 -8.107 1.00 . A A . 17 GLU HG3 1 1 3 1802 1 1 17 GLU N N -2.035 -3.422 -4.559 1.00 . A A . 17 GLU N 1 1 3 1803 1 1 17 GLU O O -5.448 -4.378 -4.479 1.00 . A A . 17 GLU O 1 1 3 1804 1 1 17 GLU OE1 O -4.165 -5.385 -9.009 1.00 . A A . 17 GLU OE1 1 1 3 1805 1 1 17 GLU OE2 O -5.735 -5.779 -7.588 1.00 . A A . 17 GLU OE2 1 1 3 1806 1 1 18 ASN C C -4.899 -5.987 -1.842 1.00 . A A . 18 ASN C 1 1 3 1807 1 1 18 ASN CA C -4.406 -6.507 -3.193 1.00 . A A . 18 ASN CA 1 1 3 1808 1 1 18 ASN CB C -3.533 -7.745 -2.976 1.00 . A A . 18 ASN CB 1 1 3 1809 1 1 18 ASN CG C -4.204 -8.959 -3.621 1.00 . A A . 18 ASN CG 1 1 3 1810 1 1 18 ASN H H -2.627 -5.500 -3.903 1.00 . A A . 18 ASN H 1 1 3 1811 1 1 18 ASN HA H -5.256 -6.774 -3.803 1.00 . A A . 18 ASN HA 1 1 3 1812 1 1 18 ASN HB2 H -2.563 -7.587 -3.425 1.00 . A A . 18 ASN HB2 1 1 3 1813 1 1 18 ASN HB3 H -3.415 -7.922 -1.917 1.00 . A A . 18 ASN HB3 1 1 3 1814 1 1 18 ASN HD21 H -3.549 -8.531 -5.446 1.00 . A A . 18 ASN HD21 1 1 3 1815 1 1 18 ASN HD22 H -4.500 -9.932 -5.326 1.00 . A A . 18 ASN HD22 1 1 3 1816 1 1 18 ASN N N -3.613 -5.453 -3.891 1.00 . A A . 18 ASN N 1 1 3 1817 1 1 18 ASN ND2 N -4.074 -9.157 -4.904 1.00 . A A . 18 ASN ND2 1 1 3 1818 1 1 18 ASN O O -5.475 -6.718 -1.061 1.00 . A A . 18 ASN O 1 1 3 1819 1 1 18 ASN OD1 O -4.856 -9.735 -2.950 1.00 . A A . 18 ASN OD1 1 1 3 1820 1 1 19 TYR C C -6.365 -3.297 -0.453 1.00 . A A . 19 TYR C 1 1 3 1821 1 1 19 TYR CA C -5.134 -4.186 -0.250 1.00 . A A . 19 TYR CA 1 1 3 1822 1 1 19 TYR CB C -4.005 -3.369 0.376 1.00 . A A . 19 TYR CB 1 1 3 1823 1 1 19 TYR CD1 C -2.020 -4.888 0.030 1.00 . A A . 19 TYR CD1 1 1 3 1824 1 1 19 TYR CD2 C -2.891 -4.597 2.277 1.00 . A A . 19 TYR CD2 1 1 3 1825 1 1 19 TYR CE1 C -1.040 -5.760 0.524 1.00 . A A . 19 TYR CE1 1 1 3 1826 1 1 19 TYR CE2 C -1.911 -5.470 2.770 1.00 . A A . 19 TYR CE2 1 1 3 1827 1 1 19 TYR CG C -2.946 -4.306 0.907 1.00 . A A . 19 TYR CG 1 1 3 1828 1 1 19 TYR CZ C -0.985 -6.051 1.893 1.00 . A A . 19 TYR CZ 1 1 3 1829 1 1 19 TYR H H -4.207 -4.160 -2.190 1.00 . A A . 19 TYR H 1 1 3 1830 1 1 19 TYR HA H -5.389 -5.002 0.410 1.00 . A A . 19 TYR HA 1 1 3 1831 1 1 19 TYR HB2 H -3.575 -2.720 -0.372 1.00 . A A . 19 TYR HB2 1 1 3 1832 1 1 19 TYR HB3 H -4.398 -2.774 1.188 1.00 . A A . 19 TYR HB3 1 1 3 1833 1 1 19 TYR HD1 H -2.062 -4.665 -1.026 1.00 . A A . 19 TYR HD1 1 1 3 1834 1 1 19 TYR HD2 H -3.605 -4.150 2.953 1.00 . A A . 19 TYR HD2 1 1 3 1835 1 1 19 TYR HE1 H -0.327 -6.208 -0.152 1.00 . A A . 19 TYR HE1 1 1 3 1836 1 1 19 TYR HE2 H -1.870 -5.694 3.825 1.00 . A A . 19 TYR HE2 1 1 3 1837 1 1 19 TYR HH H 0.132 -6.694 3.301 1.00 . A A . 19 TYR HH 1 1 3 1838 1 1 19 TYR N N -4.676 -4.735 -1.554 1.00 . A A . 19 TYR N 1 1 3 1839 1 1 19 TYR O O -6.749 -2.554 0.430 1.00 . A A . 19 TYR O 1 1 3 1840 1 1 19 TYR OH O -0.020 -6.910 2.378 1.00 . A A . 19 TYR OH 1 1 3 1841 1 1 20 CYS C C -9.352 -3.039 -0.950 1.00 . A A . 20 CYS C 1 1 3 1842 1 1 20 CYS CA C -8.204 -2.509 -1.812 1.00 . A A . 20 CYS CA 1 1 3 1843 1 1 20 CYS CB C -8.610 -2.531 -3.289 1.00 . A A . 20 CYS CB 1 1 3 1844 1 1 20 CYS H H -6.684 -3.965 -2.304 1.00 . A A . 20 CYS H 1 1 3 1845 1 1 20 CYS HA H -7.978 -1.493 -1.519 1.00 . A A . 20 CYS HA 1 1 3 1846 1 1 20 CYS HB2 H -8.990 -3.505 -3.549 1.00 . A A . 20 CYS HB2 1 1 3 1847 1 1 20 CYS HB3 H -9.377 -1.790 -3.461 1.00 . A A . 20 CYS HB3 1 1 3 1848 1 1 20 CYS N N -6.996 -3.361 -1.598 1.00 . A A . 20 CYS N 1 1 3 1849 1 1 20 CYS O O -9.186 -3.970 -0.188 1.00 . A A . 20 CYS O 1 1 3 1850 1 1 20 CYS SG S -7.167 -2.147 -4.305 1.00 . A A . 20 CYS SG 1 1 3 1851 1 1 21 ASN C C -11.702 -4.455 -0.240 1.00 . A A . 21 ASN C 1 1 3 1852 1 1 21 ASN CA C -11.666 -2.925 -0.236 1.00 . A A . 21 ASN CA 1 1 3 1853 1 1 21 ASN CB C -12.973 -2.385 -0.823 1.00 . A A . 21 ASN CB 1 1 3 1854 1 1 21 ASN CG C -13.816 -1.767 0.295 1.00 . A A . 21 ASN CG 1 1 3 1855 1 1 21 ASN H H -10.628 -1.699 -1.675 1.00 . A A . 21 ASN H 1 1 3 1856 1 1 21 ASN HA H -11.554 -2.571 0.778 1.00 . A A . 21 ASN HA 1 1 3 1857 1 1 21 ASN HB2 H -12.749 -1.632 -1.566 1.00 . A A . 21 ASN HB2 1 1 3 1858 1 1 21 ASN HB3 H -13.522 -3.192 -1.282 1.00 . A A . 21 ASN HB3 1 1 3 1859 1 1 21 ASN HD21 H -12.755 -0.090 0.357 1.00 . A A . 21 ASN HD21 1 1 3 1860 1 1 21 ASN HD22 H -14.047 -0.173 1.455 1.00 . A A . 21 ASN HD22 1 1 3 1861 1 1 21 ASN N N -10.514 -2.452 -1.057 1.00 . A A . 21 ASN N 1 1 3 1862 1 1 21 ASN ND2 N -13.515 -0.578 0.739 1.00 . A A . 21 ASN ND2 1 1 3 1863 1 1 21 ASN O O -11.502 -5.029 -1.298 1.00 . A A . 21 ASN O 1 1 3 1864 1 1 21 ASN OXT O -11.927 -5.026 0.814 1.00 . A A . 21 ASN OXT 1 1 3 1865 1 1 21 ASN OD1 O -14.757 -2.373 0.767 1.00 . A A . 21 ASN OD1 1 1 3 1866 2 2 1 PHE C C 8.165 -0.038 -9.259 1.00 . B B . 1 PHE C 1 1 3 1867 2 2 1 PHE CA C 6.716 0.451 -9.302 1.00 . B B . 1 PHE CA 1 1 3 1868 2 2 1 PHE CB C 6.036 0.143 -7.965 1.00 . B B . 1 PHE CB 1 1 3 1869 2 2 1 PHE CD1 C 5.203 2.523 -8.004 1.00 . B B . 1 PHE CD1 1 1 3 1870 2 2 1 PHE CD2 C 5.848 1.544 -5.879 1.00 . B B . 1 PHE CD2 1 1 3 1871 2 2 1 PHE CE1 C 4.881 3.722 -7.354 1.00 . B B . 1 PHE CE1 1 1 3 1872 2 2 1 PHE CE2 C 5.525 2.742 -5.229 1.00 . B B . 1 PHE CE2 1 1 3 1873 2 2 1 PHE CG C 5.688 1.435 -7.266 1.00 . B B . 1 PHE CG 1 1 3 1874 2 2 1 PHE CZ C 5.041 3.831 -5.965 1.00 . B B . 1 PHE CZ 1 1 3 1875 2 2 1 PHE H1 H 6.473 -1.128 -10.638 1.00 . B B . 1 PHE H1 1 1 3 1876 2 2 1 PHE H2 H 5.963 0.374 -11.242 1.00 . B B . 1 PHE H2 1 1 3 1877 2 2 1 PHE H3 H 5.016 -0.450 -10.098 1.00 . B B . 1 PHE H3 1 1 3 1878 2 2 1 PHE HA H 6.703 1.516 -9.475 1.00 . B B . 1 PHE HA 1 1 3 1879 2 2 1 PHE HB2 H 5.135 -0.427 -8.142 1.00 . B B . 1 PHE HB2 1 1 3 1880 2 2 1 PHE HB3 H 6.708 -0.430 -7.344 1.00 . B B . 1 PHE HB3 1 1 3 1881 2 2 1 PHE HD1 H 5.080 2.439 -9.074 1.00 . B B . 1 PHE HD1 1 1 3 1882 2 2 1 PHE HD2 H 6.220 0.705 -5.311 1.00 . B B . 1 PHE HD2 1 1 3 1883 2 2 1 PHE HE1 H 4.508 4.562 -7.923 1.00 . B B . 1 PHE HE1 1 1 3 1884 2 2 1 PHE HE2 H 5.651 2.827 -4.159 1.00 . B B . 1 PHE HE2 1 1 3 1885 2 2 1 PHE HZ H 4.792 4.755 -5.464 1.00 . B B . 1 PHE HZ 1 1 3 1886 2 2 1 PHE N N 5.988 -0.241 -10.403 1.00 . B B . 1 PHE N 1 1 3 1887 2 2 1 PHE O O 8.610 -0.770 -10.121 1.00 . B B . 1 PHE O 1 1 3 1888 2 2 2 VAL C C 10.436 -1.126 -7.043 1.00 . B B . 2 VAL C 1 1 3 1889 2 2 2 VAL CA C 10.321 -0.079 -8.154 1.00 . B B . 2 VAL CA 1 1 3 1890 2 2 2 VAL CB C 11.198 1.133 -7.826 1.00 . B B . 2 VAL CB 1 1 3 1891 2 2 2 VAL CG1 C 11.305 2.033 -9.056 1.00 . B B . 2 VAL CG1 1 1 3 1892 2 2 2 VAL CG2 C 10.568 1.921 -6.675 1.00 . B B . 2 VAL CG2 1 1 3 1893 2 2 2 VAL H H 8.522 0.949 -7.576 1.00 . B B . 2 VAL H 1 1 3 1894 2 2 2 VAL HA H 10.636 -0.510 -9.093 1.00 . B B . 2 VAL HA 1 1 3 1895 2 2 2 VAL HB H 12.183 0.800 -7.540 1.00 . B B . 2 VAL HB 1 1 3 1896 2 2 2 VAL HG11 H 10.411 1.934 -9.654 1.00 . B B . 2 VAL HG11 1 1 3 1897 2 2 2 VAL HG12 H 12.164 1.741 -9.642 1.00 . B B . 2 VAL HG12 1 1 3 1898 2 2 2 VAL HG13 H 11.416 3.061 -8.742 1.00 . B B . 2 VAL HG13 1 1 3 1899 2 2 2 VAL HG21 H 9.985 2.738 -7.074 1.00 . B B . 2 VAL HG21 1 1 3 1900 2 2 2 VAL HG22 H 11.348 2.312 -6.038 1.00 . B B . 2 VAL HG22 1 1 3 1901 2 2 2 VAL HG23 H 9.928 1.269 -6.099 1.00 . B B . 2 VAL HG23 1 1 3 1902 2 2 2 VAL N N 8.902 0.360 -8.260 1.00 . B B . 2 VAL N 1 1 3 1903 2 2 2 VAL O O 9.454 -1.712 -6.631 1.00 . B B . 2 VAL O 1 1 3 1904 2 2 3 ASN C C 12.186 -1.632 -4.184 1.00 . B B . 3 ASN C 1 1 3 1905 2 2 3 ASN CA C 11.779 -2.362 -5.454 1.00 . B B . 3 ASN CA 1 1 3 1906 2 2 3 ASN CB C 12.849 -3.377 -5.835 1.00 . B B . 3 ASN CB 1 1 3 1907 2 2 3 ASN CG C 14.107 -2.653 -6.319 1.00 . B B . 3 ASN CG 1 1 3 1908 2 2 3 ASN H H 12.399 -0.875 -6.876 1.00 . B B . 3 ASN H 1 1 3 1909 2 2 3 ASN HA H 10.840 -2.869 -5.293 1.00 . B B . 3 ASN HA 1 1 3 1910 2 2 3 ASN HB2 H 13.090 -3.988 -4.978 1.00 . B B . 3 ASN HB2 1 1 3 1911 2 2 3 ASN HB3 H 12.469 -3.999 -6.624 1.00 . B B . 3 ASN HB3 1 1 3 1912 2 2 3 ASN HD21 H 13.814 -3.120 -8.226 1.00 . B B . 3 ASN HD21 1 1 3 1913 2 2 3 ASN HD22 H 15.204 -2.198 -7.911 1.00 . B B . 3 ASN HD22 1 1 3 1914 2 2 3 ASN N N 11.619 -1.362 -6.543 1.00 . B B . 3 ASN N 1 1 3 1915 2 2 3 ASN ND2 N 14.399 -2.657 -7.591 1.00 . B B . 3 ASN ND2 1 1 3 1916 2 2 3 ASN O O 13.267 -1.810 -3.658 1.00 . B B . 3 ASN O 1 1 3 1917 2 2 3 ASN OD1 O 14.834 -2.079 -5.531 1.00 . B B . 3 ASN OD1 1 1 3 1918 2 2 4 GLN C C 10.525 -0.202 -1.444 1.00 . B B . 4 GLN C 1 1 3 1919 2 2 4 GLN CA C 11.627 -0.002 -2.494 1.00 . B B . 4 GLN CA 1 1 3 1920 2 2 4 GLN CB C 11.700 1.471 -2.890 1.00 . B B . 4 GLN CB 1 1 3 1921 2 2 4 GLN CD C 13.070 3.533 -2.593 1.00 . B B . 4 GLN CD 1 1 3 1922 2 2 4 GLN CG C 12.658 2.206 -1.958 1.00 . B B . 4 GLN CG 1 1 3 1923 2 2 4 GLN H H 10.478 -0.664 -4.175 1.00 . B B . 4 GLN H 1 1 3 1924 2 2 4 GLN HA H 12.578 -0.310 -2.087 1.00 . B B . 4 GLN HA 1 1 3 1925 2 2 4 GLN HB2 H 12.056 1.549 -3.909 1.00 . B B . 4 GLN HB2 1 1 3 1926 2 2 4 GLN HB3 H 10.719 1.912 -2.819 1.00 . B B . 4 GLN HB3 1 1 3 1927 2 2 4 GLN HE21 H 11.201 4.138 -2.872 1.00 . B B . 4 GLN HE21 1 1 3 1928 2 2 4 GLN HE22 H 12.399 5.220 -3.396 1.00 . B B . 4 GLN HE22 1 1 3 1929 2 2 4 GLN HG2 H 12.166 2.394 -1.017 1.00 . B B . 4 GLN HG2 1 1 3 1930 2 2 4 GLN HG3 H 13.534 1.597 -1.794 1.00 . B B . 4 GLN HG3 1 1 3 1931 2 2 4 GLN N N 11.324 -0.791 -3.711 1.00 . B B . 4 GLN N 1 1 3 1932 2 2 4 GLN NE2 N 12.147 4.366 -2.986 1.00 . B B . 4 GLN NE2 1 1 3 1933 2 2 4 GLN O O 9.539 -0.893 -1.668 1.00 . B B . 4 GLN O 1 1 3 1934 2 2 4 GLN OE1 O 14.244 3.815 -2.732 1.00 . B B . 4 GLN OE1 1 1 3 1935 2 2 5 HIS C C 8.581 1.319 0.578 1.00 . B B . 5 HIS C 1 1 3 1936 2 2 5 HIS CA C 9.682 0.278 0.792 1.00 . B B . 5 HIS CA 1 1 3 1937 2 2 5 HIS CB C 10.354 0.514 2.152 1.00 . B B . 5 HIS CB 1 1 3 1938 2 2 5 HIS CD2 C 12.930 0.969 2.247 1.00 . B B . 5 HIS CD2 1 1 3 1939 2 2 5 HIS CE1 C 13.600 -1.028 1.715 1.00 . B B . 5 HIS CE1 1 1 3 1940 2 2 5 HIS CG C 11.822 0.189 2.060 1.00 . B B . 5 HIS CG 1 1 3 1941 2 2 5 HIS H H 11.493 0.946 -0.149 1.00 . B B . 5 HIS H 1 1 3 1942 2 2 5 HIS HA H 9.251 -0.712 0.770 1.00 . B B . 5 HIS HA 1 1 3 1943 2 2 5 HIS HB2 H 10.233 1.549 2.437 1.00 . B B . 5 HIS HB2 1 1 3 1944 2 2 5 HIS HB3 H 9.893 -0.119 2.896 1.00 . B B . 5 HIS HB3 1 1 3 1945 2 2 5 HIS HD2 H 12.925 2.013 2.521 1.00 . B B . 5 HIS HD2 1 1 3 1946 2 2 5 HIS HE1 H 14.235 -1.871 1.485 1.00 . B B . 5 HIS HE1 1 1 3 1947 2 2 5 HIS HE2 H 14.989 0.491 2.088 1.00 . B B . 5 HIS HE2 1 1 3 1948 2 2 5 HIS N N 10.693 0.404 -0.296 1.00 . B B . 5 HIS N 1 1 3 1949 2 2 5 HIS ND1 N 12.259 -1.075 1.724 1.00 . B B . 5 HIS ND1 1 1 3 1950 2 2 5 HIS NE2 N 14.055 0.202 2.030 1.00 . B B . 5 HIS NE2 1 1 3 1951 2 2 5 HIS O O 8.414 1.838 -0.505 1.00 . B B . 5 HIS O 1 1 3 1952 2 2 6 LEU C C 6.292 3.128 2.832 1.00 . B B . 6 LEU C 1 1 3 1953 2 2 6 LEU CA C 6.722 2.624 1.455 1.00 . B B . 6 LEU CA 1 1 3 1954 2 2 6 LEU CB C 5.513 1.938 0.807 1.00 . B B . 6 LEU CB 1 1 3 1955 2 2 6 LEU CD1 C 6.028 3.540 -1.118 1.00 . B B . 6 LEU CD1 1 1 3 1956 2 2 6 LEU CD2 C 4.366 1.716 -1.412 1.00 . B B . 6 LEU CD2 1 1 3 1957 2 2 6 LEU CG C 4.947 2.716 -0.412 1.00 . B B . 6 LEU CG 1 1 3 1958 2 2 6 LEU H H 7.980 1.188 2.456 1.00 . B B . 6 LEU H 1 1 3 1959 2 2 6 LEU HA H 7.065 3.445 0.863 1.00 . B B . 6 LEU HA 1 1 3 1960 2 2 6 LEU HB2 H 5.809 0.948 0.503 1.00 . B B . 6 LEU HB2 1 1 3 1961 2 2 6 LEU HB3 H 4.734 1.847 1.552 1.00 . B B . 6 LEU HB3 1 1 3 1962 2 2 6 LEU HD11 H 5.637 3.916 -2.051 1.00 . B B . 6 LEU HD11 1 1 3 1963 2 2 6 LEU HD12 H 6.885 2.919 -1.315 1.00 . B B . 6 LEU HD12 1 1 3 1964 2 2 6 LEU HD13 H 6.317 4.371 -0.493 1.00 . B B . 6 LEU HD13 1 1 3 1965 2 2 6 LEU HD21 H 4.287 2.183 -2.383 1.00 . B B . 6 LEU HD21 1 1 3 1966 2 2 6 LEU HD22 H 3.386 1.407 -1.081 1.00 . B B . 6 LEU HD22 1 1 3 1967 2 2 6 LEU HD23 H 5.013 0.855 -1.478 1.00 . B B . 6 LEU HD23 1 1 3 1968 2 2 6 LEU HG H 4.153 3.376 -0.082 1.00 . B B . 6 LEU HG 1 1 3 1969 2 2 6 LEU N N 7.825 1.621 1.600 1.00 . B B . 6 LEU N 1 1 3 1970 2 2 6 LEU O O 6.697 2.603 3.840 1.00 . B B . 6 LEU O 1 1 3 1971 2 2 7 CYS C C 4.407 6.072 3.982 1.00 . B B . 7 CYS C 1 1 3 1972 2 2 7 CYS CA C 4.935 4.648 4.171 1.00 . B B . 7 CYS CA 1 1 3 1973 2 2 7 CYS CB C 6.051 4.651 5.220 1.00 . B B . 7 CYS CB 1 1 3 1974 2 2 7 CYS H H 5.108 4.505 2.028 1.00 . B B . 7 CYS H 1 1 3 1975 2 2 7 CYS HA H 4.128 4.017 4.515 1.00 . B B . 7 CYS HA 1 1 3 1976 2 2 7 CYS HB2 H 6.993 4.403 4.755 1.00 . B B . 7 CYS HB2 1 1 3 1977 2 2 7 CYS HB3 H 6.120 5.628 5.665 1.00 . B B . 7 CYS HB3 1 1 3 1978 2 2 7 CYS N N 5.439 4.121 2.867 1.00 . B B . 7 CYS N 1 1 3 1979 2 2 7 CYS O O 4.876 6.817 3.141 1.00 . B B . 7 CYS O 1 1 3 1980 2 2 7 CYS SG S 5.658 3.434 6.505 1.00 . B B . 7 CYS SG 1 1 3 1981 2 2 8 GLY C C 2.116 7.963 3.311 1.00 . B B . 8 GLY C 1 1 3 1982 2 2 8 GLY CA C 2.870 7.828 4.634 1.00 . B B . 8 GLY CA 1 1 3 1983 2 2 8 GLY H H 3.069 5.838 5.429 1.00 . B B . 8 GLY H 1 1 3 1984 2 2 8 GLY HA2 H 2.193 8.015 5.455 1.00 . B B . 8 GLY HA2 1 1 3 1985 2 2 8 GLY HA3 H 3.674 8.548 4.660 1.00 . B B . 8 GLY HA3 1 1 3 1986 2 2 8 GLY N N 3.432 6.455 4.760 1.00 . B B . 8 GLY N 1 1 3 1987 2 2 8 GLY O O 1.545 7.014 2.807 1.00 . B B . 8 GLY O 1 1 3 1988 2 2 9 SER C C 1.954 8.386 0.407 1.00 . B B . 9 SER C 1 1 3 1989 2 2 9 SER CA C 1.388 9.338 1.459 1.00 . B B . 9 SER CA 1 1 3 1990 2 2 9 SER CB C 1.561 10.785 0.993 1.00 . B B . 9 SER CB 1 1 3 1991 2 2 9 SER H H 2.570 9.890 3.171 1.00 . B B . 9 SER H 1 1 3 1992 2 2 9 SER HA H 0.341 9.129 1.600 1.00 . B B . 9 SER HA 1 1 3 1993 2 2 9 SER HB2 H 0.886 10.985 0.179 1.00 . B B . 9 SER HB2 1 1 3 1994 2 2 9 SER HB3 H 1.340 11.454 1.814 1.00 . B B . 9 SER HB3 1 1 3 1995 2 2 9 SER HG H 3.464 10.375 1.031 1.00 . B B . 9 SER HG 1 1 3 1996 2 2 9 SER N N 2.107 9.138 2.746 1.00 . B B . 9 SER N 1 1 3 1997 2 2 9 SER O O 1.274 7.992 -0.519 1.00 . B B . 9 SER O 1 1 3 1998 2 2 9 SER OG O 2.898 10.984 0.551 1.00 . B B . 9 SER OG 1 1 3 1999 2 2 10 ASP C C 2.978 5.779 -0.461 1.00 . B B . 10 ASP C 1 1 3 2000 2 2 10 ASP CA C 3.796 7.066 -0.439 1.00 . B B . 10 ASP CA 1 1 3 2001 2 2 10 ASP CB C 5.237 6.747 -0.031 1.00 . B B . 10 ASP CB 1 1 3 2002 2 2 10 ASP CG C 6.007 8.050 0.198 1.00 . B B . 10 ASP CG 1 1 3 2003 2 2 10 ASP H H 3.717 8.322 1.311 1.00 . B B . 10 ASP H 1 1 3 2004 2 2 10 ASP HA H 3.787 7.515 -1.421 1.00 . B B . 10 ASP HA 1 1 3 2005 2 2 10 ASP HB2 H 5.233 6.166 0.880 1.00 . B B . 10 ASP HB2 1 1 3 2006 2 2 10 ASP HB3 H 5.717 6.182 -0.816 1.00 . B B . 10 ASP HB3 1 1 3 2007 2 2 10 ASP N N 3.191 8.002 0.550 1.00 . B B . 10 ASP N 1 1 3 2008 2 2 10 ASP O O 2.716 5.210 -1.505 1.00 . B B . 10 ASP O 1 1 3 2009 2 2 10 ASP OD1 O 6.122 8.820 -0.741 1.00 . B B . 10 ASP OD1 1 1 3 2010 2 2 10 ASP OD2 O 6.470 8.254 1.308 1.00 . B B . 10 ASP OD2 1 1 3 2011 2 2 11 LEU C C 0.385 4.315 0.155 1.00 . B B . 11 LEU C 1 1 3 2012 2 2 11 LEU CA C 1.771 4.067 0.740 1.00 . B B . 11 LEU CA 1 1 3 2013 2 2 11 LEU CB C 1.651 3.606 2.195 1.00 . B B . 11 LEU CB 1 1 3 2014 2 2 11 LEU CD1 C 1.797 1.314 1.163 1.00 . B B . 11 LEU CD1 1 1 3 2015 2 2 11 LEU CD2 C 1.480 1.570 3.620 1.00 . B B . 11 LEU CD2 1 1 3 2016 2 2 11 LEU CG C 1.136 2.162 2.255 1.00 . B B . 11 LEU CG 1 1 3 2017 2 2 11 LEU H H 2.794 5.794 1.512 1.00 . B B . 11 LEU H 1 1 3 2018 2 2 11 LEU HA H 2.264 3.306 0.162 1.00 . B B . 11 LEU HA 1 1 3 2019 2 2 11 LEU HB2 H 2.621 3.660 2.668 1.00 . B B . 11 LEU HB2 1 1 3 2020 2 2 11 LEU HB3 H 0.962 4.251 2.719 1.00 . B B . 11 LEU HB3 1 1 3 2021 2 2 11 LEU HD11 H 2.865 1.476 1.179 1.00 . B B . 11 LEU HD11 1 1 3 2022 2 2 11 LEU HD12 H 1.404 1.599 0.199 1.00 . B B . 11 LEU HD12 1 1 3 2023 2 2 11 LEU HD13 H 1.587 0.269 1.342 1.00 . B B . 11 LEU HD13 1 1 3 2024 2 2 11 LEU HD21 H 0.590 1.154 4.066 1.00 . B B . 11 LEU HD21 1 1 3 2025 2 2 11 LEU HD22 H 1.874 2.347 4.259 1.00 . B B . 11 LEU HD22 1 1 3 2026 2 2 11 LEU HD23 H 2.221 0.794 3.498 1.00 . B B . 11 LEU HD23 1 1 3 2027 2 2 11 LEU HG H 0.065 2.154 2.117 1.00 . B B . 11 LEU HG 1 1 3 2028 2 2 11 LEU N N 2.571 5.317 0.685 1.00 . B B . 11 LEU N 1 1 3 2029 2 2 11 LEU O O -0.146 3.489 -0.560 1.00 . B B . 11 LEU O 1 1 3 2030 2 2 12 VAL C C -1.396 6.059 -1.618 1.00 . B B . 12 VAL C 1 1 3 2031 2 2 12 VAL CA C -1.557 5.703 -0.139 1.00 . B B . 12 VAL CA 1 1 3 2032 2 2 12 VAL CB C -2.260 6.834 0.637 1.00 . B B . 12 VAL CB 1 1 3 2033 2 2 12 VAL CG1 C -1.705 6.896 2.058 1.00 . B B . 12 VAL CG1 1 1 3 2034 2 2 12 VAL CG2 C -2.042 8.190 -0.046 1.00 . B B . 12 VAL CG2 1 1 3 2035 2 2 12 VAL H H 0.229 6.110 1.000 1.00 . B B . 12 VAL H 1 1 3 2036 2 2 12 VAL HA H -2.149 4.801 -0.060 1.00 . B B . 12 VAL HA 1 1 3 2037 2 2 12 VAL HB H -3.320 6.623 0.682 1.00 . B B . 12 VAL HB 1 1 3 2038 2 2 12 VAL HG11 H -1.488 5.895 2.400 1.00 . B B . 12 VAL HG11 1 1 3 2039 2 2 12 VAL HG12 H -2.436 7.348 2.710 1.00 . B B . 12 VAL HG12 1 1 3 2040 2 2 12 VAL HG13 H -0.800 7.484 2.066 1.00 . B B . 12 VAL HG13 1 1 3 2041 2 2 12 VAL HG21 H -2.602 8.221 -0.969 1.00 . B B . 12 VAL HG21 1 1 3 2042 2 2 12 VAL HG22 H -0.992 8.323 -0.256 1.00 . B B . 12 VAL HG22 1 1 3 2043 2 2 12 VAL HG23 H -2.383 8.979 0.607 1.00 . B B . 12 VAL HG23 1 1 3 2044 2 2 12 VAL N N -0.210 5.441 0.432 1.00 . B B . 12 VAL N 1 1 3 2045 2 2 12 VAL O O -2.203 5.687 -2.444 1.00 . B B . 12 VAL O 1 1 3 2046 2 2 13 GLU C C -0.241 5.825 -4.215 1.00 . B B . 13 GLU C 1 1 3 2047 2 2 13 GLU CA C -0.135 7.111 -3.390 1.00 . B B . 13 GLU CA 1 1 3 2048 2 2 13 GLU CB C 1.251 7.770 -3.559 1.00 . B B . 13 GLU CB 1 1 3 2049 2 2 13 GLU CD C 3.663 7.422 -4.134 1.00 . B B . 13 GLU CD 1 1 3 2050 2 2 13 GLU CG C 2.280 6.769 -4.106 1.00 . B B . 13 GLU CG 1 1 3 2051 2 2 13 GLU H H 0.304 7.037 -1.284 1.00 . B B . 13 GLU H 1 1 3 2052 2 2 13 GLU HA H -0.903 7.803 -3.705 1.00 . B B . 13 GLU HA 1 1 3 2053 2 2 13 GLU HB2 H 1.166 8.599 -4.246 1.00 . B B . 13 GLU HB2 1 1 3 2054 2 2 13 GLU HB3 H 1.588 8.138 -2.600 1.00 . B B . 13 GLU HB3 1 1 3 2055 2 2 13 GLU HG2 H 2.306 5.894 -3.472 1.00 . B B . 13 GLU HG2 1 1 3 2056 2 2 13 GLU HG3 H 2.001 6.479 -5.108 1.00 . B B . 13 GLU HG3 1 1 3 2057 2 2 13 GLU N N -0.347 6.759 -1.961 1.00 . B B . 13 GLU N 1 1 3 2058 2 2 13 GLU O O -0.725 5.824 -5.331 1.00 . B B . 13 GLU O 1 1 3 2059 2 2 13 GLU OE1 O 3.727 8.611 -4.395 1.00 . B B . 13 GLU OE1 1 1 3 2060 2 2 13 GLU OE2 O 4.633 6.721 -3.897 1.00 . B B . 13 GLU OE2 1 1 3 2061 2 2 14 ALA C C -1.290 2.856 -4.129 1.00 . B B . 14 ALA C 1 1 3 2062 2 2 14 ALA CA C 0.096 3.435 -4.383 1.00 . B B . 14 ALA CA 1 1 3 2063 2 2 14 ALA CB C 1.164 2.470 -3.864 1.00 . B B . 14 ALA CB 1 1 3 2064 2 2 14 ALA H H 0.553 4.745 -2.748 1.00 . B B . 14 ALA H 1 1 3 2065 2 2 14 ALA HA H 0.234 3.601 -5.441 1.00 . B B . 14 ALA HA 1 1 3 2066 2 2 14 ALA HB1 H 2.143 2.829 -4.145 1.00 . B B . 14 ALA HB1 1 1 3 2067 2 2 14 ALA HB2 H 1.004 1.490 -4.290 1.00 . B B . 14 ALA HB2 1 1 3 2068 2 2 14 ALA HB3 H 1.099 2.408 -2.787 1.00 . B B . 14 ALA HB3 1 1 3 2069 2 2 14 ALA N N 0.189 4.725 -3.656 1.00 . B B . 14 ALA N 1 1 3 2070 2 2 14 ALA O O -2.034 2.568 -5.046 1.00 . B B . 14 ALA O 1 1 3 2071 2 2 15 LEU C C -4.029 2.932 -3.402 1.00 . B B . 15 LEU C 1 1 3 2072 2 2 15 LEU CA C -2.997 2.161 -2.579 1.00 . B B . 15 LEU CA 1 1 3 2073 2 2 15 LEU CB C -3.279 2.334 -1.085 1.00 . B B . 15 LEU CB 1 1 3 2074 2 2 15 LEU CD1 C -3.002 1.121 1.081 1.00 . B B . 15 LEU CD1 1 1 3 2075 2 2 15 LEU CD2 C -2.105 0.075 -0.995 1.00 . B B . 15 LEU CD2 1 1 3 2076 2 2 15 LEU CG C -2.356 1.409 -0.266 1.00 . B B . 15 LEU CG 1 1 3 2077 2 2 15 LEU H H -1.052 2.948 -2.151 1.00 . B B . 15 LEU H 1 1 3 2078 2 2 15 LEU HA H -3.028 1.119 -2.836 1.00 . B B . 15 LEU HA 1 1 3 2079 2 2 15 LEU HB2 H -3.086 3.362 -0.810 1.00 . B B . 15 LEU HB2 1 1 3 2080 2 2 15 LEU HB3 H -4.317 2.101 -0.876 1.00 . B B . 15 LEU HB3 1 1 3 2081 2 2 15 LEU HD11 H -2.303 1.355 1.870 1.00 . B B . 15 LEU HD11 1 1 3 2082 2 2 15 LEU HD12 H -3.269 0.077 1.132 1.00 . B B . 15 LEU HD12 1 1 3 2083 2 2 15 LEU HD13 H -3.887 1.728 1.189 1.00 . B B . 15 LEU HD13 1 1 3 2084 2 2 15 LEU HD21 H -1.536 -0.586 -0.353 1.00 . B B . 15 LEU HD21 1 1 3 2085 2 2 15 LEU HD22 H -1.547 0.257 -1.901 1.00 . B B . 15 LEU HD22 1 1 3 2086 2 2 15 LEU HD23 H -3.047 -0.391 -1.240 1.00 . B B . 15 LEU HD23 1 1 3 2087 2 2 15 LEU HG H -1.414 1.908 -0.102 1.00 . B B . 15 LEU HG 1 1 3 2088 2 2 15 LEU N N -1.655 2.700 -2.884 1.00 . B B . 15 LEU N 1 1 3 2089 2 2 15 LEU O O -4.941 2.361 -3.967 1.00 . B B . 15 LEU O 1 1 3 2090 2 2 16 TYR C C -4.804 4.597 -5.744 1.00 . B B . 16 TYR C 1 1 3 2091 2 2 16 TYR CA C -4.849 5.039 -4.280 1.00 . B B . 16 TYR CA 1 1 3 2092 2 2 16 TYR CB C -4.477 6.523 -4.198 1.00 . B B . 16 TYR CB 1 1 3 2093 2 2 16 TYR CD1 C -6.943 6.993 -4.373 1.00 . B B . 16 TYR CD1 1 1 3 2094 2 2 16 TYR CD2 C -5.591 8.391 -2.921 1.00 . B B . 16 TYR CD2 1 1 3 2095 2 2 16 TYR CE1 C -8.081 7.733 -4.029 1.00 . B B . 16 TYR CE1 1 1 3 2096 2 2 16 TYR CE2 C -6.730 9.133 -2.577 1.00 . B B . 16 TYR CE2 1 1 3 2097 2 2 16 TYR CG C -5.699 7.322 -3.820 1.00 . B B . 16 TYR CG 1 1 3 2098 2 2 16 TYR CZ C -7.975 8.803 -3.130 1.00 . B B . 16 TYR CZ 1 1 3 2099 2 2 16 TYR H H -3.135 4.670 -3.022 1.00 . B B . 16 TYR H 1 1 3 2100 2 2 16 TYR HA H -5.846 4.896 -3.892 1.00 . B B . 16 TYR HA 1 1 3 2101 2 2 16 TYR HB2 H -3.704 6.669 -3.462 1.00 . B B . 16 TYR HB2 1 1 3 2102 2 2 16 TYR HB3 H -4.120 6.856 -5.159 1.00 . B B . 16 TYR HB3 1 1 3 2103 2 2 16 TYR HD1 H -7.024 6.168 -5.064 1.00 . B B . 16 TYR HD1 1 1 3 2104 2 2 16 TYR HD2 H -4.632 8.645 -2.495 1.00 . B B . 16 TYR HD2 1 1 3 2105 2 2 16 TYR HE1 H -9.039 7.478 -4.455 1.00 . B B . 16 TYR HE1 1 1 3 2106 2 2 16 TYR HE2 H -6.648 9.957 -1.884 1.00 . B B . 16 TYR HE2 1 1 3 2107 2 2 16 TYR HH H -9.505 9.841 -3.606 1.00 . B B . 16 TYR HH 1 1 3 2108 2 2 16 TYR N N -3.883 4.229 -3.483 1.00 . B B . 16 TYR N 1 1 3 2109 2 2 16 TYR O O -5.817 4.293 -6.341 1.00 . B B . 16 TYR O 1 1 3 2110 2 2 16 TYR OH O -9.097 9.532 -2.794 1.00 . B B . 16 TYR OH 1 1 3 2111 2 2 17 LEU C C -3.867 2.674 -7.898 1.00 . B B . 17 LEU C 1 1 3 2112 2 2 17 LEU CA C -3.532 4.156 -7.758 1.00 . B B . 17 LEU CA 1 1 3 2113 2 2 17 LEU CB C -2.101 4.407 -8.256 1.00 . B B . 17 LEU CB 1 1 3 2114 2 2 17 LEU CD1 C -3.280 4.196 -10.484 1.00 . B B . 17 LEU CD1 1 1 3 2115 2 2 17 LEU CD2 C -2.182 6.351 -9.841 1.00 . B B . 17 LEU CD2 1 1 3 2116 2 2 17 LEU CG C -2.097 4.825 -9.739 1.00 . B B . 17 LEU CG 1 1 3 2117 2 2 17 LEU H H -2.835 4.825 -5.832 1.00 . B B . 17 LEU H 1 1 3 2118 2 2 17 LEU HA H -4.224 4.728 -8.343 1.00 . B B . 17 LEU HA 1 1 3 2119 2 2 17 LEU HB2 H -1.653 5.192 -7.666 1.00 . B B . 17 LEU HB2 1 1 3 2120 2 2 17 LEU HB3 H -1.524 3.501 -8.141 1.00 . B B . 17 LEU HB3 1 1 3 2121 2 2 17 LEU HD11 H -3.379 3.160 -10.193 1.00 . B B . 17 LEU HD11 1 1 3 2122 2 2 17 LEU HD12 H -3.110 4.256 -11.548 1.00 . B B . 17 LEU HD12 1 1 3 2123 2 2 17 LEU HD13 H -4.186 4.728 -10.234 1.00 . B B . 17 LEU HD13 1 1 3 2124 2 2 17 LEU HD21 H -1.892 6.663 -10.835 1.00 . B B . 17 LEU HD21 1 1 3 2125 2 2 17 LEU HD22 H -1.517 6.799 -9.117 1.00 . B B . 17 LEU HD22 1 1 3 2126 2 2 17 LEU HD23 H -3.194 6.671 -9.647 1.00 . B B . 17 LEU HD23 1 1 3 2127 2 2 17 LEU HG H -1.176 4.490 -10.196 1.00 . B B . 17 LEU HG 1 1 3 2128 2 2 17 LEU N N -3.638 4.568 -6.329 1.00 . B B . 17 LEU N 1 1 3 2129 2 2 17 LEU O O -4.640 2.277 -8.747 1.00 . B B . 17 LEU O 1 1 3 2130 2 2 18 VAL C C -5.050 0.139 -6.918 1.00 . B B . 18 VAL C 1 1 3 2131 2 2 18 VAL CA C -3.562 0.394 -7.156 1.00 . B B . 18 VAL CA 1 1 3 2132 2 2 18 VAL CB C -2.734 -0.344 -6.100 1.00 . B B . 18 VAL CB 1 1 3 2133 2 2 18 VAL CG1 C -1.330 0.247 -6.052 1.00 . B B . 18 VAL CG1 1 1 3 2134 2 2 18 VAL CG2 C -3.384 -0.187 -4.726 1.00 . B B . 18 VAL CG2 1 1 3 2135 2 2 18 VAL H H -2.670 2.206 -6.404 1.00 . B B . 18 VAL H 1 1 3 2136 2 2 18 VAL HA H -3.292 0.035 -8.136 1.00 . B B . 18 VAL HA 1 1 3 2137 2 2 18 VAL HB H -2.676 -1.392 -6.356 1.00 . B B . 18 VAL HB 1 1 3 2138 2 2 18 VAL HG11 H -1.241 1.021 -6.798 1.00 . B B . 18 VAL HG11 1 1 3 2139 2 2 18 VAL HG12 H -0.608 -0.529 -6.247 1.00 . B B . 18 VAL HG12 1 1 3 2140 2 2 18 VAL HG13 H -1.154 0.667 -5.073 1.00 . B B . 18 VAL HG13 1 1 3 2141 2 2 18 VAL HG21 H -2.709 -0.551 -3.965 1.00 . B B . 18 VAL HG21 1 1 3 2142 2 2 18 VAL HG22 H -4.301 -0.753 -4.696 1.00 . B B . 18 VAL HG22 1 1 3 2143 2 2 18 VAL HG23 H -3.599 0.854 -4.551 1.00 . B B . 18 VAL HG23 1 1 3 2144 2 2 18 VAL N N -3.288 1.856 -7.074 1.00 . B B . 18 VAL N 1 1 3 2145 2 2 18 VAL O O -5.624 -0.792 -7.448 1.00 . B B . 18 VAL O 1 1 3 2146 2 2 19 CYS C C -7.936 1.828 -6.565 1.00 . B B . 19 CYS C 1 1 3 2147 2 2 19 CYS CA C -7.122 0.756 -5.842 1.00 . B B . 19 CYS CA 1 1 3 2148 2 2 19 CYS CB C -7.366 0.864 -4.337 1.00 . B B . 19 CYS CB 1 1 3 2149 2 2 19 CYS H H -5.196 1.696 -5.698 1.00 . B B . 19 CYS H 1 1 3 2150 2 2 19 CYS HA H -7.422 -0.222 -6.187 1.00 . B B . 19 CYS HA 1 1 3 2151 2 2 19 CYS HB2 H -7.026 1.827 -3.986 1.00 . B B . 19 CYS HB2 1 1 3 2152 2 2 19 CYS HB3 H -8.421 0.759 -4.135 1.00 . B B . 19 CYS HB3 1 1 3 2153 2 2 19 CYS N N -5.677 0.955 -6.119 1.00 . B B . 19 CYS N 1 1 3 2154 2 2 19 CYS O O -8.559 1.575 -7.577 1.00 . B B . 19 CYS O 1 1 3 2155 2 2 19 CYS SG S -6.454 -0.446 -3.487 1.00 . B B . 19 CYS SG 1 1 3 2156 2 2 20 GLY C C -10.134 4.141 -6.145 1.00 . B B . 20 GLY C 1 1 3 2157 2 2 20 GLY CA C -8.708 4.119 -6.703 1.00 . B B . 20 GLY CA 1 1 3 2158 2 2 20 GLY H H -7.423 3.208 -5.235 1.00 . B B . 20 GLY H 1 1 3 2159 2 2 20 GLY HA2 H -8.226 5.067 -6.505 1.00 . B B . 20 GLY HA2 1 1 3 2160 2 2 20 GLY HA3 H -8.743 3.950 -7.769 1.00 . B B . 20 GLY HA3 1 1 3 2161 2 2 20 GLY N N -7.934 3.027 -6.051 1.00 . B B . 20 GLY N 1 1 3 2162 2 2 20 GLY O O -10.361 4.511 -5.010 1.00 . B B . 20 GLY O 1 1 3 2163 2 2 21 GLU C C -12.752 2.581 -5.504 1.00 . B B . 21 GLU C 1 1 3 2164 2 2 21 GLU CA C -12.510 3.760 -6.455 1.00 . B B . 21 GLU CA 1 1 3 2165 2 2 21 GLU CB C -13.459 3.652 -7.652 1.00 . B B . 21 GLU CB 1 1 3 2166 2 2 21 GLU CD C -15.617 4.464 -8.624 1.00 . B B . 21 GLU CD 1 1 3 2167 2 2 21 GLU CG C -14.594 4.671 -7.504 1.00 . B B . 21 GLU CG 1 1 3 2168 2 2 21 GLU H H -10.894 3.462 -7.850 1.00 . B B . 21 GLU H 1 1 3 2169 2 2 21 GLU HA H -12.702 4.684 -5.931 1.00 . B B . 21 GLU HA 1 1 3 2170 2 2 21 GLU HB2 H -12.913 3.851 -8.563 1.00 . B B . 21 GLU HB2 1 1 3 2171 2 2 21 GLU HB3 H -13.875 2.657 -7.692 1.00 . B B . 21 GLU HB3 1 1 3 2172 2 2 21 GLU HG2 H -15.076 4.537 -6.546 1.00 . B B . 21 GLU HG2 1 1 3 2173 2 2 21 GLU HG3 H -14.191 5.671 -7.568 1.00 . B B . 21 GLU HG3 1 1 3 2174 2 2 21 GLU N N -11.098 3.753 -6.937 1.00 . B B . 21 GLU N 1 1 3 2175 2 2 21 GLU O O -13.760 2.524 -4.827 1.00 . B B . 21 GLU O 1 1 3 2176 2 2 21 GLU OE1 O -16.449 3.582 -8.485 1.00 . B B . 21 GLU OE1 1 1 3 2177 2 2 21 GLU OE2 O -15.553 5.192 -9.601 1.00 . B B . 21 GLU OE2 1 1 3 2178 2 2 22 ARG C C -11.501 0.812 -3.145 1.00 . B B . 22 ARG C 1 1 3 2179 2 2 22 ARG CA C -12.055 0.480 -4.533 1.00 . B B . 22 ARG CA 1 1 3 2180 2 2 22 ARG CB C -11.325 -0.734 -5.100 1.00 . B B . 22 ARG CB 1 1 3 2181 2 2 22 ARG CD C -13.093 -2.496 -5.266 1.00 . B B . 22 ARG CD 1 1 3 2182 2 2 22 ARG CG C -12.256 -1.484 -6.053 1.00 . B B . 22 ARG CG 1 1 3 2183 2 2 22 ARG CZ C -11.842 -4.549 -4.966 1.00 . B B . 22 ARG CZ 1 1 3 2184 2 2 22 ARG H H -11.039 1.683 -5.989 1.00 . B B . 22 ARG H 1 1 3 2185 2 2 22 ARG HA H -13.110 0.263 -4.458 1.00 . B B . 22 ARG HA 1 1 3 2186 2 2 22 ARG HB2 H -10.445 -0.407 -5.636 1.00 . B B . 22 ARG HB2 1 1 3 2187 2 2 22 ARG HB3 H -11.034 -1.384 -4.296 1.00 . B B . 22 ARG HB3 1 1 3 2188 2 2 22 ARG HD2 H -13.753 -1.970 -4.593 1.00 . B B . 22 ARG HD2 1 1 3 2189 2 2 22 ARG HD3 H -13.678 -3.089 -5.953 1.00 . B B . 22 ARG HD3 1 1 3 2190 2 2 22 ARG HE H -11.865 -3.104 -3.604 1.00 . B B . 22 ARG HE 1 1 3 2191 2 2 22 ARG HG2 H -12.912 -0.778 -6.542 1.00 . B B . 22 ARG HG2 1 1 3 2192 2 2 22 ARG HG3 H -11.669 -2.002 -6.795 1.00 . B B . 22 ARG HG3 1 1 3 2193 2 2 22 ARG HH11 H -11.369 -3.830 -6.772 1.00 . B B . 22 ARG HH11 1 1 3 2194 2 2 22 ARG HH12 H -11.160 -5.536 -6.568 1.00 . B B . 22 ARG HH12 1 1 3 2195 2 2 22 ARG HH21 H -12.232 -5.544 -3.272 1.00 . B B . 22 ARG HH21 1 1 3 2196 2 2 22 ARG HH22 H -11.638 -6.504 -4.585 1.00 . B B . 22 ARG HH22 1 1 3 2197 2 2 22 ARG N N -11.849 1.637 -5.441 1.00 . B B . 22 ARG N 1 1 3 2198 2 2 22 ARG NE N -12.192 -3.388 -4.482 1.00 . B B . 22 ARG NE 1 1 3 2199 2 2 22 ARG NH1 N -11.423 -4.645 -6.197 1.00 . B B . 22 ARG NH1 1 1 3 2200 2 2 22 ARG NH2 N -11.910 -5.616 -4.216 1.00 . B B . 22 ARG NH2 1 1 3 2201 2 2 22 ARG O O -11.429 -0.036 -2.278 1.00 . B B . 22 ARG O 1 1 3 2202 2 2 23 GLY C C -9.477 1.441 -1.179 1.00 . B B . 23 GLY C 1 1 3 2203 2 2 23 GLY CA C -10.566 2.429 -1.598 1.00 . B B . 23 GLY CA 1 1 3 2204 2 2 23 GLY H H -11.182 2.708 -3.642 1.00 . B B . 23 GLY H 1 1 3 2205 2 2 23 GLY HA2 H -10.145 3.422 -1.659 1.00 . B B . 23 GLY HA2 1 1 3 2206 2 2 23 GLY HA3 H -11.359 2.418 -0.865 1.00 . B B . 23 GLY HA3 1 1 3 2207 2 2 23 GLY N N -11.112 2.040 -2.929 1.00 . B B . 23 GLY N 1 1 3 2208 2 2 23 GLY O O -9.204 0.472 -1.861 1.00 . B B . 23 GLY O 1 1 3 2209 2 2 24 PHE C C -7.945 0.476 1.890 1.00 . B B . 24 PHE C 1 1 3 2210 2 2 24 PHE CA C -7.781 0.749 0.395 1.00 . B B . 24 PHE CA 1 1 3 2211 2 2 24 PHE CB C -6.407 1.374 0.137 1.00 . B B . 24 PHE CB 1 1 3 2212 2 2 24 PHE CD1 C -6.447 3.550 1.419 1.00 . B B . 24 PHE CD1 1 1 3 2213 2 2 24 PHE CD2 C -6.640 3.615 -0.999 1.00 . B B . 24 PHE CD2 1 1 3 2214 2 2 24 PHE CE1 C -6.527 4.949 1.463 1.00 . B B . 24 PHE CE1 1 1 3 2215 2 2 24 PHE CE2 C -6.715 5.013 -0.955 1.00 . B B . 24 PHE CE2 1 1 3 2216 2 2 24 PHE CG C -6.504 2.883 0.188 1.00 . B B . 24 PHE CG 1 1 3 2217 2 2 24 PHE CZ C -6.658 5.681 0.274 1.00 . B B . 24 PHE CZ 1 1 3 2218 2 2 24 PHE H H -9.082 2.462 0.476 1.00 . B B . 24 PHE H 1 1 3 2219 2 2 24 PHE HA H -7.858 -0.181 -0.148 1.00 . B B . 24 PHE HA 1 1 3 2220 2 2 24 PHE HB2 H -5.712 1.035 0.891 1.00 . B B . 24 PHE HB2 1 1 3 2221 2 2 24 PHE HB3 H -6.054 1.071 -0.837 1.00 . B B . 24 PHE HB3 1 1 3 2222 2 2 24 PHE HD1 H -6.347 2.987 2.334 1.00 . B B . 24 PHE HD1 1 1 3 2223 2 2 24 PHE HD2 H -6.684 3.102 -1.949 1.00 . B B . 24 PHE HD2 1 1 3 2224 2 2 24 PHE HE1 H -6.486 5.462 2.414 1.00 . B B . 24 PHE HE1 1 1 3 2225 2 2 24 PHE HE2 H -6.822 5.577 -1.869 1.00 . B B . 24 PHE HE2 1 1 3 2226 2 2 24 PHE HZ H -6.709 6.760 0.304 1.00 . B B . 24 PHE HZ 1 1 3 2227 2 2 24 PHE N N -8.850 1.677 -0.061 1.00 . B B . 24 PHE N 1 1 3 2228 2 2 24 PHE O O -8.919 0.869 2.499 1.00 . B B . 24 PHE O 1 1 3 2229 2 2 25 PHE C C -5.838 -0.030 4.659 1.00 . B B . 25 PHE C 1 1 3 2230 2 2 25 PHE CA C -7.104 -0.500 3.936 1.00 . B B . 25 PHE CA 1 1 3 2231 2 2 25 PHE CB C -7.271 -2.008 4.133 1.00 . B B . 25 PHE CB 1 1 3 2232 2 2 25 PHE CD1 C -9.495 -2.228 5.297 1.00 . B B . 25 PHE CD1 1 1 3 2233 2 2 25 PHE CD2 C -7.463 -2.520 6.593 1.00 . B B . 25 PHE CD2 1 1 3 2234 2 2 25 PHE CE1 C -10.261 -2.457 6.448 1.00 . B B . 25 PHE CE1 1 1 3 2235 2 2 25 PHE CE2 C -8.230 -2.749 7.743 1.00 . B B . 25 PHE CE2 1 1 3 2236 2 2 25 PHE CG C -8.096 -2.260 5.370 1.00 . B B . 25 PHE CG 1 1 3 2237 2 2 25 PHE CZ C -9.629 -2.718 7.670 1.00 . B B . 25 PHE CZ 1 1 3 2238 2 2 25 PHE H H -6.224 -0.510 1.972 1.00 . B B . 25 PHE H 1 1 3 2239 2 2 25 PHE HA H -7.961 0.011 4.348 1.00 . B B . 25 PHE HA 1 1 3 2240 2 2 25 PHE HB2 H -7.770 -2.431 3.273 1.00 . B B . 25 PHE HB2 1 1 3 2241 2 2 25 PHE HB3 H -6.300 -2.466 4.248 1.00 . B B . 25 PHE HB3 1 1 3 2242 2 2 25 PHE HD1 H -9.982 -2.028 4.354 1.00 . B B . 25 PHE HD1 1 1 3 2243 2 2 25 PHE HD2 H -6.385 -2.544 6.648 1.00 . B B . 25 PHE HD2 1 1 3 2244 2 2 25 PHE HE1 H -11.340 -2.432 6.392 1.00 . B B . 25 PHE HE1 1 1 3 2245 2 2 25 PHE HE2 H -7.742 -2.950 8.685 1.00 . B B . 25 PHE HE2 1 1 3 2246 2 2 25 PHE HZ H -10.219 -2.894 8.557 1.00 . B B . 25 PHE HZ 1 1 3 2247 2 2 25 PHE N N -6.999 -0.199 2.483 1.00 . B B . 25 PHE N 1 1 3 2248 2 2 25 PHE O O -5.178 -0.797 5.332 1.00 . B B . 25 PHE O 1 1 3 2249 2 2 26 TYR C C -4.469 1.549 6.738 1.00 . B B . 26 TYR C 1 1 3 2250 2 2 26 TYR CA C -4.281 1.733 5.233 1.00 . B B . 26 TYR CA 1 1 3 2251 2 2 26 TYR CB C -4.092 3.219 4.917 1.00 . B B . 26 TYR CB 1 1 3 2252 2 2 26 TYR CD1 C -1.709 2.998 5.729 1.00 . B B . 26 TYR CD1 1 1 3 2253 2 2 26 TYR CD2 C -2.946 5.018 6.260 1.00 . B B . 26 TYR CD2 1 1 3 2254 2 2 26 TYR CE1 C -0.594 3.504 6.411 1.00 . B B . 26 TYR CE1 1 1 3 2255 2 2 26 TYR CE2 C -1.831 5.523 6.942 1.00 . B B . 26 TYR CE2 1 1 3 2256 2 2 26 TYR CG C -2.886 3.755 5.654 1.00 . B B . 26 TYR CG 1 1 3 2257 2 2 26 TYR CZ C -0.655 4.766 7.017 1.00 . B B . 26 TYR CZ 1 1 3 2258 2 2 26 TYR H H -6.046 1.832 3.998 1.00 . B B . 26 TYR H 1 1 3 2259 2 2 26 TYR HA H -3.416 1.176 4.904 1.00 . B B . 26 TYR HA 1 1 3 2260 2 2 26 TYR HB2 H -3.947 3.346 3.856 1.00 . B B . 26 TYR HB2 1 1 3 2261 2 2 26 TYR HB3 H -4.968 3.765 5.224 1.00 . B B . 26 TYR HB3 1 1 3 2262 2 2 26 TYR HD1 H -1.662 2.025 5.262 1.00 . B B . 26 TYR HD1 1 1 3 2263 2 2 26 TYR HD2 H -3.852 5.602 6.202 1.00 . B B . 26 TYR HD2 1 1 3 2264 2 2 26 TYR HE1 H 0.312 2.922 6.469 1.00 . B B . 26 TYR HE1 1 1 3 2265 2 2 26 TYR HE2 H -1.879 6.497 7.408 1.00 . B B . 26 TYR HE2 1 1 3 2266 2 2 26 TYR HH H 0.522 6.197 7.481 1.00 . B B . 26 TYR HH 1 1 3 2267 2 2 26 TYR N N -5.498 1.225 4.537 1.00 . B B . 26 TYR N 1 1 3 2268 2 2 26 TYR O O -5.568 1.641 7.248 1.00 . B B . 26 TYR O 1 1 3 2269 2 2 26 TYR OH O 0.445 5.262 7.687 1.00 . B B . 26 TYR OH 1 1 3 2270 2 2 27 THR C C -2.609 2.023 9.672 1.00 . B B . 27 THR C 1 1 3 2271 2 2 27 THR CA C -3.562 1.089 8.926 1.00 . B B . 27 THR CA 1 1 3 2272 2 2 27 THR CB C -3.236 -0.364 9.284 1.00 . B B . 27 THR CB 1 1 3 2273 2 2 27 THR CG2 C -3.920 -1.303 8.290 1.00 . B B . 27 THR CG2 1 1 3 2274 2 2 27 THR H H -2.535 1.206 7.034 1.00 . B B . 27 THR H 1 1 3 2275 2 2 27 THR HA H -4.578 1.309 9.216 1.00 . B B . 27 THR HA 1 1 3 2276 2 2 27 THR HB H -3.593 -0.578 10.280 1.00 . B B . 27 THR HB 1 1 3 2277 2 2 27 THR HG1 H -1.502 -0.138 8.434 1.00 . B B . 27 THR HG1 1 1 3 2278 2 2 27 THR HG21 H -3.344 -1.343 7.378 1.00 . B B . 27 THR HG21 1 1 3 2279 2 2 27 THR HG22 H -4.913 -0.937 8.074 1.00 . B B . 27 THR HG22 1 1 3 2280 2 2 27 THR HG23 H -3.986 -2.293 8.718 1.00 . B B . 27 THR HG23 1 1 3 2281 2 2 27 THR N N -3.416 1.283 7.457 1.00 . B B . 27 THR N 1 1 3 2282 2 2 27 THR O O -1.698 2.588 9.101 1.00 . B B . 27 THR O 1 1 3 2283 2 2 27 THR OG1 O -1.830 -0.558 9.233 1.00 . B B . 27 THR OG1 1 1 3 2284 2 2 28 LYS C C -1.937 2.619 13.212 1.00 . B B . 28 LYS C 1 1 3 2285 2 2 28 LYS CA C -1.924 3.060 11.753 1.00 . B B . 28 LYS CA 1 1 3 2286 2 2 28 LYS CB C -2.404 4.510 11.693 1.00 . B B . 28 LYS CB 1 1 3 2287 2 2 28 LYS CD C -1.782 6.824 10.912 1.00 . B B . 28 LYS CD 1 1 3 2288 2 2 28 LYS CE C -3.119 6.747 10.169 1.00 . B B . 28 LYS CE 1 1 3 2289 2 2 28 LYS CG C -1.264 5.409 11.214 1.00 . B B . 28 LYS CG 1 1 3 2290 2 2 28 LYS H H -3.545 1.704 11.384 1.00 . B B . 28 LYS H 1 1 3 2291 2 2 28 LYS HA H -0.917 3.001 11.368 1.00 . B B . 28 LYS HA 1 1 3 2292 2 2 28 LYS HB2 H -3.248 4.586 11.029 1.00 . B B . 28 LYS HB2 1 1 3 2293 2 2 28 LYS HB3 H -2.704 4.817 12.683 1.00 . B B . 28 LYS HB3 1 1 3 2294 2 2 28 LYS HD2 H -1.916 7.363 11.838 1.00 . B B . 28 LYS HD2 1 1 3 2295 2 2 28 LYS HD3 H -1.062 7.346 10.296 1.00 . B B . 28 LYS HD3 1 1 3 2296 2 2 28 LYS HE2 H -3.192 7.572 9.475 1.00 . B B . 28 LYS HE2 1 1 3 2297 2 2 28 LYS HE3 H -3.178 5.815 9.628 1.00 . B B . 28 LYS HE3 1 1 3 2298 2 2 28 LYS HG2 H -0.512 5.463 11.988 1.00 . B B . 28 LYS HG2 1 1 3 2299 2 2 28 LYS HG3 H -0.831 4.987 10.323 1.00 . B B . 28 LYS HG3 1 1 3 2300 2 2 28 LYS HZ1 H -3.880 6.613 12.103 1.00 . B B . 28 LYS HZ1 1 1 3 2301 2 2 28 LYS HZ2 H -4.974 6.138 10.893 1.00 . B B . 28 LYS HZ2 1 1 3 2302 2 2 28 LYS HZ3 H -4.641 7.785 11.142 1.00 . B B . 28 LYS HZ3 1 1 3 2303 2 2 28 LYS N N -2.813 2.178 10.950 1.00 . B B . 28 LYS N 1 1 3 2304 2 2 28 LYS NZ N -4.238 6.826 11.151 1.00 . B B . 28 LYS NZ 1 1 3 2305 2 2 28 LYS O O -0.901 2.309 13.766 1.00 . B B . 28 LYS O 1 1 3 2306 2 2 29 PRO C C -3.408 0.775 15.388 1.00 . B B . 29 PRO C 1 1 3 2307 2 2 29 PRO CA C -3.244 2.289 15.231 1.00 . B B . 29 PRO CA 1 1 3 2308 2 2 29 PRO CB C -4.521 3.019 15.634 1.00 . B B . 29 PRO CB 1 1 3 2309 2 2 29 PRO CD C -4.386 3.024 13.170 1.00 . B B . 29 PRO CD 1 1 3 2310 2 2 29 PRO CG C -5.353 3.203 14.345 1.00 . B B . 29 PRO CG 1 1 3 2311 2 2 29 PRO HA H -2.409 2.654 15.807 1.00 . B B . 29 PRO HA 1 1 3 2312 2 2 29 PRO HB2 H -5.071 2.446 16.365 1.00 . B B . 29 PRO HB2 1 1 3 2313 2 2 29 PRO HB3 H -4.264 3.991 16.023 1.00 . B B . 29 PRO HB3 1 1 3 2314 2 2 29 PRO HD2 H -4.742 2.238 12.521 1.00 . B B . 29 PRO HD2 1 1 3 2315 2 2 29 PRO HD3 H -4.290 3.945 12.634 1.00 . B B . 29 PRO HD3 1 1 3 2316 2 2 29 PRO HG2 H -6.136 2.458 14.301 1.00 . B B . 29 PRO HG2 1 1 3 2317 2 2 29 PRO HG3 H -5.781 4.193 14.318 1.00 . B B . 29 PRO HG3 1 1 3 2318 2 2 29 PRO N N -3.103 2.645 13.817 1.00 . B B . 29 PRO N 1 1 3 2319 2 2 29 PRO O O -4.367 0.194 14.920 1.00 . B B . 29 PRO O 1 1 3 2320 2 2 30 THR C C -2.392 -2.043 14.876 1.00 . B B . 30 THR C 1 1 3 2321 2 2 30 THR CA C -2.588 -1.346 16.224 1.00 . B B . 30 THR CA 1 1 3 2322 2 2 30 THR CB C -3.971 -1.696 16.779 1.00 . B B . 30 THR CB 1 1 3 2323 2 2 30 THR CG2 C -3.945 -3.111 17.359 1.00 . B B . 30 THR CG2 1 1 3 2324 2 2 30 THR H H -1.714 0.615 16.410 1.00 . B B . 30 THR H 1 1 3 2325 2 2 30 THR HA H -1.828 -1.679 16.915 1.00 . B B . 30 THR HA 1 1 3 2326 2 2 30 THR HB H -4.700 -1.651 15.985 1.00 . B B . 30 THR HB 1 1 3 2327 2 2 30 THR HG1 H -5.278 -0.740 17.857 1.00 . B B . 30 THR HG1 1 1 3 2328 2 2 30 THR HG21 H -4.893 -3.325 17.829 1.00 . B B . 30 THR HG21 1 1 3 2329 2 2 30 THR HG22 H -3.155 -3.185 18.092 1.00 . B B . 30 THR HG22 1 1 3 2330 2 2 30 THR HG23 H -3.767 -3.822 16.566 1.00 . B B . 30 THR HG23 1 1 3 2331 2 2 30 THR N N -2.481 0.130 16.041 1.00 . B B . 30 THR N 1 1 3 2332 2 2 30 THR O O -1.265 -2.399 14.574 1.00 . B B . 30 THR O 1 1 3 2333 2 2 30 THR OXT O -3.372 -2.211 14.169 1.00 . B B . 30 THR OXT 1 1 3 2334 2 2 30 THR OG1 O -4.320 -0.769 17.797 1.00 . B B . 30 THR OG1 1 1 4 2335 1 1 1 GLY C C 0.767 -3.054 8.675 1.00 . A A . 1 GLY C 1 1 4 2336 1 1 1 GLY CA C 0.052 -2.749 9.948 1.00 . A A . 1 GLY CA 1 1 4 2337 1 1 1 GLY H1 H -1.733 -3.036 11.046 1.00 . A A . 1 GLY H1 1 1 4 2338 1 1 1 GLY H2 H -0.914 -4.479 10.690 1.00 . A A . 1 GLY H2 1 1 4 2339 1 1 1 GLY H3 H -1.790 -3.677 9.475 1.00 . A A . 1 GLY H3 1 1 4 2340 1 1 1 GLY HA2 H -0.181 -1.918 9.494 1.00 . A A . 1 GLY HA2 1 1 4 2341 1 1 1 GLY HA3 H 0.651 -2.576 10.935 1.00 . A A . 1 GLY HA3 1 1 4 2342 1 1 1 GLY N N -1.196 -3.549 10.319 1.00 . A A . 1 GLY N 1 1 4 2343 1 1 1 GLY O O 1.929 -3.410 8.675 1.00 . A A . 1 GLY O 1 1 4 2344 1 1 2 ILE C C 2.057 -2.415 6.159 1.00 . A A . 2 ILE C 1 1 4 2345 1 1 2 ILE CA C 0.760 -3.217 6.261 1.00 . A A . 2 ILE CA 1 1 4 2346 1 1 2 ILE CB C -0.182 -2.844 5.113 1.00 . A A . 2 ILE CB 1 1 4 2347 1 1 2 ILE CD1 C -0.308 -2.336 2.669 1.00 . A A . 2 ILE CD1 1 1 4 2348 1 1 2 ILE CG1 C 0.590 -2.861 3.792 1.00 . A A . 2 ILE CG1 1 1 4 2349 1 1 2 ILE CG2 C -0.757 -1.446 5.347 1.00 . A A . 2 ILE CG2 1 1 4 2350 1 1 2 ILE H H -0.838 -2.638 7.582 1.00 . A A . 2 ILE H 1 1 4 2351 1 1 2 ILE HA H 0.991 -4.264 6.208 1.00 . A A . 2 ILE HA 1 1 4 2352 1 1 2 ILE HB H -0.991 -3.559 5.067 1.00 . A A . 2 ILE HB 1 1 4 2353 1 1 2 ILE HD11 H -0.156 -2.929 1.780 1.00 . A A . 2 ILE HD11 1 1 4 2354 1 1 2 ILE HD12 H -0.059 -1.305 2.461 1.00 . A A . 2 ILE HD12 1 1 4 2355 1 1 2 ILE HD13 H -1.342 -2.402 2.973 1.00 . A A . 2 ILE HD13 1 1 4 2356 1 1 2 ILE HG12 H 1.464 -2.233 3.878 1.00 . A A . 2 ILE HG12 1 1 4 2357 1 1 2 ILE HG13 H 0.892 -3.872 3.565 1.00 . A A . 2 ILE HG13 1 1 4 2358 1 1 2 ILE HG21 H -1.793 -1.428 5.046 1.00 . A A . 2 ILE HG21 1 1 4 2359 1 1 2 ILE HG22 H -0.199 -0.726 4.765 1.00 . A A . 2 ILE HG22 1 1 4 2360 1 1 2 ILE HG23 H -0.682 -1.197 6.395 1.00 . A A . 2 ILE HG23 1 1 4 2361 1 1 2 ILE N N 0.098 -2.926 7.562 1.00 . A A . 2 ILE N 1 1 4 2362 1 1 2 ILE O O 3.121 -2.958 5.946 1.00 . A A . 2 ILE O 1 1 4 2363 1 1 3 ABA C C 4.303 -0.892 7.070 1.00 . A A . 3 ABA C 1 1 4 2364 1 1 3 ABA CA C 3.184 -0.279 6.238 1.00 . A A . 3 ABA CA 1 1 4 2365 1 1 3 ABA CB C 2.851 1.113 6.767 1.00 . A A . 3 ABA CB 1 1 4 2366 1 1 3 ABA CG C 2.081 0.998 8.084 1.00 . A A . 3 ABA CG 1 1 4 2367 1 1 3 ABA H H 1.114 -0.719 6.490 1.00 . A A . 3 ABA H 1 1 4 2368 1 1 3 ABA HA H 3.502 -0.205 5.217 1.00 . A A . 3 ABA HA 1 1 4 2369 1 1 3 ABA HB2 H 3.762 1.654 6.933 1.00 . A A . 3 ABA HB2 1 1 4 2370 1 1 3 ABA HB3 H 2.247 1.637 6.043 1.00 . A A . 3 ABA HB3 1 1 4 2371 1 1 3 ABA HG1 H 2.773 1.052 8.912 1.00 . A A . 3 ABA HG1 1 1 4 2372 1 1 3 ABA HG2 H 1.557 0.055 8.116 1.00 . A A . 3 ABA HG2 1 1 4 2373 1 1 3 ABA HG3 H 1.370 1.808 8.157 1.00 . A A . 3 ABA HG3 1 1 4 2374 1 1 3 ABA N N 1.974 -1.128 6.317 1.00 . A A . 3 ABA N 1 1 4 2375 1 1 3 ABA O O 5.402 -1.070 6.613 1.00 . A A . 3 ABA O 1 1 4 2376 1 1 4 GLU C C 5.787 -2.938 8.301 1.00 . A A . 4 GLU C 1 1 4 2377 1 1 4 GLU CA C 5.094 -1.842 9.122 1.00 . A A . 4 GLU CA 1 1 4 2378 1 1 4 GLU CB C 4.431 -2.411 10.378 1.00 . A A . 4 GLU CB 1 1 4 2379 1 1 4 GLU CD C 4.785 -4.023 12.262 1.00 . A A . 4 GLU CD 1 1 4 2380 1 1 4 GLU CG C 5.081 -3.732 10.788 1.00 . A A . 4 GLU CG 1 1 4 2381 1 1 4 GLU H H 3.140 -1.099 8.644 1.00 . A A . 4 GLU H 1 1 4 2382 1 1 4 GLU HA H 5.815 -1.088 9.401 1.00 . A A . 4 GLU HA 1 1 4 2383 1 1 4 GLU HB2 H 4.527 -1.697 11.181 1.00 . A A . 4 GLU HB2 1 1 4 2384 1 1 4 GLU HB3 H 3.389 -2.577 10.170 1.00 . A A . 4 GLU HB3 1 1 4 2385 1 1 4 GLU HG2 H 4.683 -4.526 10.174 1.00 . A A . 4 GLU HG2 1 1 4 2386 1 1 4 GLU HG3 H 6.147 -3.662 10.642 1.00 . A A . 4 GLU HG3 1 1 4 2387 1 1 4 GLU N N 4.035 -1.232 8.285 1.00 . A A . 4 GLU N 1 1 4 2388 1 1 4 GLU O O 6.940 -3.256 8.511 1.00 . A A . 4 GLU O 1 1 4 2389 1 1 4 GLU OE1 O 3.770 -3.551 12.748 1.00 . A A . 4 GLU OE1 1 1 4 2390 1 1 4 GLU OE2 O 5.578 -4.716 12.879 1.00 . A A . 4 GLU OE2 1 1 4 2391 1 1 5 GLN C C 5.971 -3.994 5.112 1.00 . A A . 5 GLN C 1 1 4 2392 1 1 5 GLN CA C 5.683 -4.566 6.505 1.00 . A A . 5 GLN CA 1 1 4 2393 1 1 5 GLN CB C 4.700 -5.732 6.388 1.00 . A A . 5 GLN CB 1 1 4 2394 1 1 5 GLN CD C 5.183 -7.467 4.653 1.00 . A A . 5 GLN CD 1 1 4 2395 1 1 5 GLN CG C 5.465 -7.025 6.090 1.00 . A A . 5 GLN CG 1 1 4 2396 1 1 5 GLN H H 4.158 -3.221 7.204 1.00 . A A . 5 GLN H 1 1 4 2397 1 1 5 GLN HA H 6.604 -4.912 6.952 1.00 . A A . 5 GLN HA 1 1 4 2398 1 1 5 GLN HB2 H 4.159 -5.839 7.317 1.00 . A A . 5 GLN HB2 1 1 4 2399 1 1 5 GLN HB3 H 4.003 -5.536 5.587 1.00 . A A . 5 GLN HB3 1 1 4 2400 1 1 5 GLN HE21 H 6.630 -6.353 3.877 1.00 . A A . 5 GLN HE21 1 1 4 2401 1 1 5 GLN HE22 H 5.736 -7.263 2.758 1.00 . A A . 5 GLN HE22 1 1 4 2402 1 1 5 GLN HG2 H 6.525 -6.852 6.213 1.00 . A A . 5 GLN HG2 1 1 4 2403 1 1 5 GLN HG3 H 5.145 -7.798 6.772 1.00 . A A . 5 GLN HG3 1 1 4 2404 1 1 5 GLN N N 5.084 -3.504 7.358 1.00 . A A . 5 GLN N 1 1 4 2405 1 1 5 GLN NE2 N 5.910 -6.988 3.682 1.00 . A A . 5 GLN NE2 1 1 4 2406 1 1 5 GLN O O 6.901 -4.398 4.443 1.00 . A A . 5 GLN O 1 1 4 2407 1 1 5 GLN OE1 O 4.292 -8.258 4.412 1.00 . A A . 5 GLN OE1 1 1 4 2408 1 1 6 CYS C C 6.074 -1.101 3.483 1.00 . A A . 6 CYS C 1 1 4 2409 1 1 6 CYS CA C 5.377 -2.461 3.330 1.00 . A A . 6 CYS CA 1 1 4 2410 1 1 6 CYS CB C 4.003 -2.309 2.683 1.00 . A A . 6 CYS CB 1 1 4 2411 1 1 6 CYS H H 4.425 -2.750 5.217 1.00 . A A . 6 CYS H 1 1 4 2412 1 1 6 CYS HA H 5.990 -3.118 2.729 1.00 . A A . 6 CYS HA 1 1 4 2413 1 1 6 CYS HB2 H 3.307 -1.908 3.406 1.00 . A A . 6 CYS HB2 1 1 4 2414 1 1 6 CYS HB3 H 4.063 -1.651 1.848 1.00 . A A . 6 CYS HB3 1 1 4 2415 1 1 6 CYS N N 5.172 -3.059 4.669 1.00 . A A . 6 CYS N 1 1 4 2416 1 1 6 CYS O O 6.195 -0.334 2.548 1.00 . A A . 6 CYS O 1 1 4 2417 1 1 6 CYS SG S 3.441 -3.945 2.147 1.00 . A A . 6 CYS SG 1 1 4 2418 1 1 7 CYS C C 8.663 0.113 5.453 1.00 . A A . 7 CYS C 1 1 4 2419 1 1 7 CYS CA C 7.261 0.457 4.942 1.00 . A A . 7 CYS CA 1 1 4 2420 1 1 7 CYS CB C 6.505 1.269 6.003 1.00 . A A . 7 CYS CB 1 1 4 2421 1 1 7 CYS H H 6.439 -1.470 5.392 1.00 . A A . 7 CYS H 1 1 4 2422 1 1 7 CYS HA H 7.340 1.036 4.036 1.00 . A A . 7 CYS HA 1 1 4 2423 1 1 7 CYS HB2 H 5.514 1.502 5.647 1.00 . A A . 7 CYS HB2 1 1 4 2424 1 1 7 CYS HB3 H 6.426 0.700 6.908 1.00 . A A . 7 CYS HB3 1 1 4 2425 1 1 7 CYS N N 6.547 -0.821 4.668 1.00 . A A . 7 CYS N 1 1 4 2426 1 1 7 CYS O O 9.613 0.835 5.221 1.00 . A A . 7 CYS O 1 1 4 2427 1 1 7 CYS SG S 7.410 2.803 6.335 1.00 . A A . 7 CYS SG 1 1 4 2428 1 1 8 THR C C 10.789 -2.339 5.591 1.00 . A A . 8 THR C 1 1 4 2429 1 1 8 THR CA C 10.152 -1.405 6.623 1.00 . A A . 8 THR CA 1 1 4 2430 1 1 8 THR CB C 10.014 -2.139 7.960 1.00 . A A . 8 THR CB 1 1 4 2431 1 1 8 THR CG2 C 9.332 -1.225 8.979 1.00 . A A . 8 THR CG2 1 1 4 2432 1 1 8 THR H H 8.033 -1.590 6.293 1.00 . A A . 8 THR H 1 1 4 2433 1 1 8 THR HA H 10.770 -0.528 6.749 1.00 . A A . 8 THR HA 1 1 4 2434 1 1 8 THR HB H 10.993 -2.410 8.325 1.00 . A A . 8 THR HB 1 1 4 2435 1 1 8 THR HG1 H 8.773 -3.494 8.598 1.00 . A A . 8 THR HG1 1 1 4 2436 1 1 8 THR HG21 H 9.961 -1.125 9.852 1.00 . A A . 8 THR HG21 1 1 4 2437 1 1 8 THR HG22 H 8.383 -1.652 9.266 1.00 . A A . 8 THR HG22 1 1 4 2438 1 1 8 THR HG23 H 9.170 -0.252 8.539 1.00 . A A . 8 THR HG23 1 1 4 2439 1 1 8 THR N N 8.807 -1.004 6.128 1.00 . A A . 8 THR N 1 1 4 2440 1 1 8 THR O O 11.965 -2.639 5.645 1.00 . A A . 8 THR O 1 1 4 2441 1 1 8 THR OG1 O 9.235 -3.312 7.776 1.00 . A A . 8 THR OG1 1 1 4 2442 1 1 9 SER C C 10.135 -3.166 2.215 1.00 . A A . 9 SER C 1 1 4 2443 1 1 9 SER CA C 10.556 -3.698 3.594 1.00 . A A . 9 SER CA 1 1 4 2444 1 1 9 SER CB C 10.015 -5.115 3.812 1.00 . A A . 9 SER CB 1 1 4 2445 1 1 9 SER H H 9.069 -2.530 4.617 1.00 . A A . 9 SER H 1 1 4 2446 1 1 9 SER HA H 11.634 -3.712 3.657 1.00 . A A . 9 SER HA 1 1 4 2447 1 1 9 SER HB2 H 8.954 -5.133 3.624 1.00 . A A . 9 SER HB2 1 1 4 2448 1 1 9 SER HB3 H 10.510 -5.798 3.133 1.00 . A A . 9 SER HB3 1 1 4 2449 1 1 9 SER HG H 9.736 -4.940 5.732 1.00 . A A . 9 SER HG 1 1 4 2450 1 1 9 SER N N 10.013 -2.792 4.642 1.00 . A A . 9 SER N 1 1 4 2451 1 1 9 SER O O 10.437 -2.042 1.867 1.00 . A A . 9 SER O 1 1 4 2452 1 1 9 SER OG O 10.258 -5.507 5.158 1.00 . A A . 9 SER OG 1 1 4 2453 1 1 10 ILE C C 7.599 -3.905 -0.229 1.00 . A A . 10 ILE C 1 1 4 2454 1 1 10 ILE CA C 9.034 -3.451 0.078 1.00 . A A . 10 ILE CA 1 1 4 2455 1 1 10 ILE CB C 10.009 -4.005 -0.979 1.00 . A A . 10 ILE CB 1 1 4 2456 1 1 10 ILE CD1 C 12.079 -3.002 -0.001 1.00 . A A . 10 ILE CD1 1 1 4 2457 1 1 10 ILE CG1 C 11.136 -2.998 -1.206 1.00 . A A . 10 ILE CG1 1 1 4 2458 1 1 10 ILE CG2 C 9.287 -4.251 -2.309 1.00 . A A . 10 ILE CG2 1 1 4 2459 1 1 10 ILE H H 9.207 -4.855 1.702 1.00 . A A . 10 ILE H 1 1 4 2460 1 1 10 ILE HA H 9.076 -2.372 0.069 1.00 . A A . 10 ILE HA 1 1 4 2461 1 1 10 ILE HB H 10.428 -4.932 -0.626 1.00 . A A . 10 ILE HB 1 1 4 2462 1 1 10 ILE HD11 H 12.033 -2.044 0.495 1.00 . A A . 10 ILE HD11 1 1 4 2463 1 1 10 ILE HD12 H 13.089 -3.186 -0.336 1.00 . A A . 10 ILE HD12 1 1 4 2464 1 1 10 ILE HD13 H 11.781 -3.779 0.686 1.00 . A A . 10 ILE HD13 1 1 4 2465 1 1 10 ILE HG12 H 11.686 -3.271 -2.095 1.00 . A A . 10 ILE HG12 1 1 4 2466 1 1 10 ILE HG13 H 10.716 -2.012 -1.330 1.00 . A A . 10 ILE HG13 1 1 4 2467 1 1 10 ILE HG21 H 8.545 -5.025 -2.176 1.00 . A A . 10 ILE HG21 1 1 4 2468 1 1 10 ILE HG22 H 10.002 -4.562 -3.056 1.00 . A A . 10 ILE HG22 1 1 4 2469 1 1 10 ILE HG23 H 8.803 -3.340 -2.630 1.00 . A A . 10 ILE HG23 1 1 4 2470 1 1 10 ILE N N 9.447 -3.948 1.422 1.00 . A A . 10 ILE N 1 1 4 2471 1 1 10 ILE O O 7.186 -4.989 0.133 1.00 . A A . 10 ILE O 1 1 4 2472 1 1 11 CYS C C 5.252 -3.192 -2.779 1.00 . A A . 11 CYS C 1 1 4 2473 1 1 11 CYS CA C 5.454 -3.463 -1.287 1.00 . A A . 11 CYS CA 1 1 4 2474 1 1 11 CYS CB C 4.455 -2.671 -0.450 1.00 . A A . 11 CYS CB 1 1 4 2475 1 1 11 CYS H H 7.219 -2.223 -1.216 1.00 . A A . 11 CYS H 1 1 4 2476 1 1 11 CYS HA H 5.301 -4.510 -1.103 1.00 . A A . 11 CYS HA 1 1 4 2477 1 1 11 CYS HB2 H 4.965 -2.223 0.385 1.00 . A A . 11 CYS HB2 1 1 4 2478 1 1 11 CYS HB3 H 3.999 -1.901 -1.056 1.00 . A A . 11 CYS HB3 1 1 4 2479 1 1 11 CYS N N 6.851 -3.085 -0.920 1.00 . A A . 11 CYS N 1 1 4 2480 1 1 11 CYS O O 5.431 -2.088 -3.253 1.00 . A A . 11 CYS O 1 1 4 2481 1 1 11 CYS SG S 3.180 -3.813 0.147 1.00 . A A . 11 CYS SG 1 1 4 2482 1 1 12 SER C C 3.384 -3.387 -5.303 1.00 . A A . 12 SER C 1 1 4 2483 1 1 12 SER CA C 4.731 -4.032 -5.000 1.00 . A A . 12 SER CA 1 1 4 2484 1 1 12 SER CB C 4.796 -5.397 -5.686 1.00 . A A . 12 SER CB 1 1 4 2485 1 1 12 SER H H 4.795 -5.093 -3.127 1.00 . A A . 12 SER H 1 1 4 2486 1 1 12 SER HA H 5.517 -3.403 -5.389 1.00 . A A . 12 SER HA 1 1 4 2487 1 1 12 SER HB2 H 4.056 -5.446 -6.467 1.00 . A A . 12 SER HB2 1 1 4 2488 1 1 12 SER HB3 H 5.779 -5.535 -6.116 1.00 . A A . 12 SER HB3 1 1 4 2489 1 1 12 SER HG H 5.141 -7.141 -4.896 1.00 . A A . 12 SER HG 1 1 4 2490 1 1 12 SER N N 4.909 -4.207 -3.529 1.00 . A A . 12 SER N 1 1 4 2491 1 1 12 SER O O 2.450 -3.457 -4.531 1.00 . A A . 12 SER O 1 1 4 2492 1 1 12 SER OG O 4.534 -6.416 -4.730 1.00 . A A . 12 SER OG 1 1 4 2493 1 1 13 LEU C C 0.903 -3.113 -6.968 1.00 . A A . 13 LEU C 1 1 4 2494 1 1 13 LEU CA C 2.029 -2.088 -6.841 1.00 . A A . 13 LEU CA 1 1 4 2495 1 1 13 LEU CB C 2.242 -1.414 -8.190 1.00 . A A . 13 LEU CB 1 1 4 2496 1 1 13 LEU CD1 C 2.036 -2.184 -10.551 1.00 . A A . 13 LEU CD1 1 1 4 2497 1 1 13 LEU CD2 C 4.189 -2.482 -9.328 1.00 . A A . 13 LEU CD2 1 1 4 2498 1 1 13 LEU CG C 2.666 -2.479 -9.194 1.00 . A A . 13 LEU CG 1 1 4 2499 1 1 13 LEU H H 4.069 -2.726 -7.032 1.00 . A A . 13 LEU H 1 1 4 2500 1 1 13 LEU HA H 1.763 -1.348 -6.109 1.00 . A A . 13 LEU HA 1 1 4 2501 1 1 13 LEU HB2 H 1.321 -0.950 -8.514 1.00 . A A . 13 LEU HB2 1 1 4 2502 1 1 13 LEU HB3 H 3.017 -0.668 -8.107 1.00 . A A . 13 LEU HB3 1 1 4 2503 1 1 13 LEU HD11 H 2.496 -1.304 -10.977 1.00 . A A . 13 LEU HD11 1 1 4 2504 1 1 13 LEU HD12 H 0.977 -2.014 -10.425 1.00 . A A . 13 LEU HD12 1 1 4 2505 1 1 13 LEU HD13 H 2.191 -3.026 -11.209 1.00 . A A . 13 LEU HD13 1 1 4 2506 1 1 13 LEU HD21 H 4.608 -1.734 -8.672 1.00 . A A . 13 LEU HD21 1 1 4 2507 1 1 13 LEU HD22 H 4.461 -2.260 -10.349 1.00 . A A . 13 LEU HD22 1 1 4 2508 1 1 13 LEU HD23 H 4.571 -3.454 -9.056 1.00 . A A . 13 LEU HD23 1 1 4 2509 1 1 13 LEU HG H 2.333 -3.444 -8.844 1.00 . A A . 13 LEU HG 1 1 4 2510 1 1 13 LEU N N 3.293 -2.758 -6.437 1.00 . A A . 13 LEU N 1 1 4 2511 1 1 13 LEU O O -0.251 -2.759 -7.110 1.00 . A A . 13 LEU O 1 1 4 2512 1 1 14 TYR C C -0.147 -5.856 -5.594 1.00 . A A . 14 TYR C 1 1 4 2513 1 1 14 TYR CA C 0.132 -5.392 -7.001 1.00 . A A . 14 TYR CA 1 1 4 2514 1 1 14 TYR CB C 0.595 -6.559 -7.876 1.00 . A A . 14 TYR CB 1 1 4 2515 1 1 14 TYR CD1 C -1.637 -7.707 -8.121 1.00 . A A . 14 TYR CD1 1 1 4 2516 1 1 14 TYR CD2 C 0.166 -8.882 -6.997 1.00 . A A . 14 TYR CD2 1 1 4 2517 1 1 14 TYR CE1 C -2.480 -8.808 -7.919 1.00 . A A . 14 TYR CE1 1 1 4 2518 1 1 14 TYR CE2 C -0.677 -9.983 -6.795 1.00 . A A . 14 TYR CE2 1 1 4 2519 1 1 14 TYR CG C -0.314 -7.745 -7.660 1.00 . A A . 14 TYR CG 1 1 4 2520 1 1 14 TYR CZ C -2.000 -9.946 -7.256 1.00 . A A . 14 TYR CZ 1 1 4 2521 1 1 14 TYR H H 2.140 -4.665 -6.757 1.00 . A A . 14 TYR H 1 1 4 2522 1 1 14 TYR HA H -0.753 -4.939 -7.410 1.00 . A A . 14 TYR HA 1 1 4 2523 1 1 14 TYR HB2 H 0.563 -6.262 -8.914 1.00 . A A . 14 TYR HB2 1 1 4 2524 1 1 14 TYR HB3 H 1.607 -6.827 -7.609 1.00 . A A . 14 TYR HB3 1 1 4 2525 1 1 14 TYR HD1 H -2.006 -6.830 -8.631 1.00 . A A . 14 TYR HD1 1 1 4 2526 1 1 14 TYR HD2 H 1.185 -8.910 -6.642 1.00 . A A . 14 TYR HD2 1 1 4 2527 1 1 14 TYR HE1 H -3.500 -8.780 -8.274 1.00 . A A . 14 TYR HE1 1 1 4 2528 1 1 14 TYR HE2 H -0.308 -10.859 -6.284 1.00 . A A . 14 TYR HE2 1 1 4 2529 1 1 14 TYR HH H -2.296 -11.827 -7.126 1.00 . A A . 14 TYR HH 1 1 4 2530 1 1 14 TYR N N 1.210 -4.379 -6.900 1.00 . A A . 14 TYR N 1 1 4 2531 1 1 14 TYR O O -1.270 -6.100 -5.199 1.00 . A A . 14 TYR O 1 1 4 2532 1 1 14 TYR OH O -2.829 -11.031 -7.058 1.00 . A A . 14 TYR OH 1 1 4 2533 1 1 15 GLN C C -0.043 -5.152 -2.758 1.00 . A A . 15 GLN C 1 1 4 2534 1 1 15 GLN CA C 0.744 -6.276 -3.413 1.00 . A A . 15 GLN CA 1 1 4 2535 1 1 15 GLN CB C 2.141 -6.337 -2.821 1.00 . A A . 15 GLN CB 1 1 4 2536 1 1 15 GLN CD C 1.847 -8.442 -1.517 1.00 . A A . 15 GLN CD 1 1 4 2537 1 1 15 GLN CG C 2.586 -7.789 -2.686 1.00 . A A . 15 GLN CG 1 1 4 2538 1 1 15 GLN H H 1.764 -5.659 -5.175 1.00 . A A . 15 GLN H 1 1 4 2539 1 1 15 GLN HA H 0.234 -7.220 -3.305 1.00 . A A . 15 GLN HA 1 1 4 2540 1 1 15 GLN HB2 H 2.823 -5.812 -3.482 1.00 . A A . 15 GLN HB2 1 1 4 2541 1 1 15 GLN HB3 H 2.140 -5.864 -1.858 1.00 . A A . 15 GLN HB3 1 1 4 2542 1 1 15 GLN HE21 H 2.149 -6.910 -0.289 1.00 . A A . 15 GLN HE21 1 1 4 2543 1 1 15 GLN HE22 H 1.279 -8.209 0.372 1.00 . A A . 15 GLN HE22 1 1 4 2544 1 1 15 GLN HG2 H 2.359 -8.316 -3.601 1.00 . A A . 15 GLN HG2 1 1 4 2545 1 1 15 GLN HG3 H 3.649 -7.821 -2.504 1.00 . A A . 15 GLN HG3 1 1 4 2546 1 1 15 GLN N N 0.885 -5.911 -4.825 1.00 . A A . 15 GLN N 1 1 4 2547 1 1 15 GLN NE2 N 1.750 -7.801 -0.384 1.00 . A A . 15 GLN NE2 1 1 4 2548 1 1 15 GLN O O -0.824 -5.348 -1.847 1.00 . A A . 15 GLN O 1 1 4 2549 1 1 15 GLN OE1 O 1.350 -9.545 -1.635 1.00 . A A . 15 GLN OE1 1 1 4 2550 1 1 16 LEU C C -1.927 -2.740 -3.398 1.00 . A A . 16 LEU C 1 1 4 2551 1 1 16 LEU CA C -0.560 -2.782 -2.745 1.00 . A A . 16 LEU CA 1 1 4 2552 1 1 16 LEU CB C 0.254 -1.543 -3.102 1.00 . A A . 16 LEU CB 1 1 4 2553 1 1 16 LEU CD1 C 2.399 -0.356 -2.575 1.00 . A A . 16 LEU CD1 1 1 4 2554 1 1 16 LEU CD2 C 1.309 -1.816 -0.877 1.00 . A A . 16 LEU CD2 1 1 4 2555 1 1 16 LEU CG C 1.587 -1.629 -2.363 1.00 . A A . 16 LEU CG 1 1 4 2556 1 1 16 LEU H H 0.769 -3.862 -4.022 1.00 . A A . 16 LEU H 1 1 4 2557 1 1 16 LEU HA H -0.671 -2.854 -1.675 1.00 . A A . 16 LEU HA 1 1 4 2558 1 1 16 LEU HB2 H 0.427 -1.511 -4.169 1.00 . A A . 16 LEU HB2 1 1 4 2559 1 1 16 LEU HB3 H -0.272 -0.661 -2.797 1.00 . A A . 16 LEU HB3 1 1 4 2560 1 1 16 LEU HD11 H 1.884 0.477 -2.126 1.00 . A A . 16 LEU HD11 1 1 4 2561 1 1 16 LEU HD12 H 2.523 -0.181 -3.632 1.00 . A A . 16 LEU HD12 1 1 4 2562 1 1 16 LEU HD13 H 3.369 -0.472 -2.113 1.00 . A A . 16 LEU HD13 1 1 4 2563 1 1 16 LEU HD21 H 0.499 -1.173 -0.578 1.00 . A A . 16 LEU HD21 1 1 4 2564 1 1 16 LEU HD22 H 2.195 -1.571 -0.312 1.00 . A A . 16 LEU HD22 1 1 4 2565 1 1 16 LEU HD23 H 1.038 -2.847 -0.693 1.00 . A A . 16 LEU HD23 1 1 4 2566 1 1 16 LEU HG H 2.147 -2.473 -2.728 1.00 . A A . 16 LEU HG 1 1 4 2567 1 1 16 LEU N N 0.154 -3.967 -3.265 1.00 . A A . 16 LEU N 1 1 4 2568 1 1 16 LEU O O -2.871 -2.182 -2.876 1.00 . A A . 16 LEU O 1 1 4 2569 1 1 17 GLU C C -4.232 -4.401 -4.478 1.00 . A A . 17 GLU C 1 1 4 2570 1 1 17 GLU CA C -3.337 -3.409 -5.223 1.00 . A A . 17 GLU CA 1 1 4 2571 1 1 17 GLU CB C -3.110 -3.900 -6.654 1.00 . A A . 17 GLU CB 1 1 4 2572 1 1 17 GLU CD C -4.194 -3.312 -8.827 1.00 . A A . 17 GLU CD 1 1 4 2573 1 1 17 GLU CG C -4.432 -3.876 -7.425 1.00 . A A . 17 GLU CG 1 1 4 2574 1 1 17 GLU H H -1.265 -3.825 -4.918 1.00 . A A . 17 GLU H 1 1 4 2575 1 1 17 GLU HA H -3.783 -2.429 -5.234 1.00 . A A . 17 GLU HA 1 1 4 2576 1 1 17 GLU HB2 H -2.392 -3.261 -7.142 1.00 . A A . 17 GLU HB2 1 1 4 2577 1 1 17 GLU HB3 H -2.727 -4.909 -6.630 1.00 . A A . 17 GLU HB3 1 1 4 2578 1 1 17 GLU HG2 H -4.822 -4.881 -7.502 1.00 . A A . 17 GLU HG2 1 1 4 2579 1 1 17 GLU HG3 H -5.142 -3.252 -6.904 1.00 . A A . 17 GLU HG3 1 1 4 2580 1 1 17 GLU N N -2.039 -3.363 -4.531 1.00 . A A . 17 GLU N 1 1 4 2581 1 1 17 GLU O O -5.446 -4.354 -4.556 1.00 . A A . 17 GLU O 1 1 4 2582 1 1 17 GLU OE1 O -3.542 -2.285 -8.929 1.00 . A A . 17 GLU OE1 1 1 4 2583 1 1 17 GLU OE2 O -4.666 -3.917 -9.776 1.00 . A A . 17 GLU OE2 1 1 4 2584 1 1 18 ASN C C -4.997 -5.740 -1.730 1.00 . A A . 18 ASN C 1 1 4 2585 1 1 18 ASN CA C -4.422 -6.331 -3.015 1.00 . A A . 18 ASN CA 1 1 4 2586 1 1 18 ASN CB C -3.523 -7.517 -2.668 1.00 . A A . 18 ASN CB 1 1 4 2587 1 1 18 ASN CG C -4.344 -8.806 -2.706 1.00 . A A . 18 ASN CG 1 1 4 2588 1 1 18 ASN H H -2.642 -5.324 -3.708 1.00 . A A . 18 ASN H 1 1 4 2589 1 1 18 ASN HA H -5.231 -6.674 -3.642 1.00 . A A . 18 ASN HA 1 1 4 2590 1 1 18 ASN HB2 H -2.719 -7.580 -3.387 1.00 . A A . 18 ASN HB2 1 1 4 2591 1 1 18 ASN HB3 H -3.113 -7.381 -1.679 1.00 . A A . 18 ASN HB3 1 1 4 2592 1 1 18 ASN HD21 H -4.190 -9.129 -0.754 1.00 . A A . 18 ASN HD21 1 1 4 2593 1 1 18 ASN HD22 H -5.082 -10.290 -1.613 1.00 . A A . 18 ASN HD22 1 1 4 2594 1 1 18 ASN N N -3.626 -5.310 -3.755 1.00 . A A . 18 ASN N 1 1 4 2595 1 1 18 ASN ND2 N -4.556 -9.462 -1.599 1.00 . A A . 18 ASN ND2 1 1 4 2596 1 1 18 ASN O O -5.653 -6.421 -0.967 1.00 . A A . 18 ASN O 1 1 4 2597 1 1 18 ASN OD1 O -4.799 -9.220 -3.754 1.00 . A A . 18 ASN OD1 1 1 4 2598 1 1 19 TYR C C -6.513 -2.998 -0.585 1.00 . A A . 19 TYR C 1 1 4 2599 1 1 19 TYR CA C -5.315 -3.880 -0.236 1.00 . A A . 19 TYR CA 1 1 4 2600 1 1 19 TYR CB C -4.236 -3.039 0.444 1.00 . A A . 19 TYR CB 1 1 4 2601 1 1 19 TYR CD1 C -3.577 -4.331 2.502 1.00 . A A . 19 TYR CD1 1 1 4 2602 1 1 19 TYR CD2 C -2.122 -4.406 0.561 1.00 . A A . 19 TYR CD2 1 1 4 2603 1 1 19 TYR CE1 C -2.699 -5.176 3.193 1.00 . A A . 19 TYR CE1 1 1 4 2604 1 1 19 TYR CE2 C -1.244 -5.252 1.251 1.00 . A A . 19 TYR CE2 1 1 4 2605 1 1 19 TYR CG C -3.288 -3.946 1.187 1.00 . A A . 19 TYR CG 1 1 4 2606 1 1 19 TYR CZ C -1.532 -5.637 2.568 1.00 . A A . 19 TYR CZ 1 1 4 2607 1 1 19 TYR H H -4.237 -3.945 -2.101 1.00 . A A . 19 TYR H 1 1 4 2608 1 1 19 TYR HA H -5.632 -4.665 0.434 1.00 . A A . 19 TYR HA 1 1 4 2609 1 1 19 TYR HB2 H -3.693 -2.482 -0.302 1.00 . A A . 19 TYR HB2 1 1 4 2610 1 1 19 TYR HB3 H -4.699 -2.356 1.140 1.00 . A A . 19 TYR HB3 1 1 4 2611 1 1 19 TYR HD1 H -4.475 -3.975 2.983 1.00 . A A . 19 TYR HD1 1 1 4 2612 1 1 19 TYR HD2 H -1.899 -4.108 -0.454 1.00 . A A . 19 TYR HD2 1 1 4 2613 1 1 19 TYR HE1 H -2.922 -5.473 4.207 1.00 . A A . 19 TYR HE1 1 1 4 2614 1 1 19 TYR HE2 H -0.345 -5.606 0.770 1.00 . A A . 19 TYR HE2 1 1 4 2615 1 1 19 TYR HH H 0.014 -5.927 3.647 1.00 . A A . 19 TYR HH 1 1 4 2616 1 1 19 TYR N N -4.766 -4.486 -1.478 1.00 . A A . 19 TYR N 1 1 4 2617 1 1 19 TYR O O -6.947 -2.186 0.208 1.00 . A A . 19 TYR O 1 1 4 2618 1 1 19 TYR OH O -0.668 -6.470 3.247 1.00 . A A . 19 TYR OH 1 1 4 2619 1 1 20 CYS C C -9.491 -2.877 -1.467 1.00 . A A . 20 CYS C 1 1 4 2620 1 1 20 CYS CA C -8.234 -2.317 -2.139 1.00 . A A . 20 CYS CA 1 1 4 2621 1 1 20 CYS CB C -8.402 -2.329 -3.659 1.00 . A A . 20 CYS CB 1 1 4 2622 1 1 20 CYS H H -6.700 -3.814 -2.390 1.00 . A A . 20 CYS H 1 1 4 2623 1 1 20 CYS HA H -8.073 -1.303 -1.805 1.00 . A A . 20 CYS HA 1 1 4 2624 1 1 20 CYS HB2 H -8.732 -3.303 -3.984 1.00 . A A . 20 CYS HB2 1 1 4 2625 1 1 20 CYS HB3 H -9.131 -1.587 -3.945 1.00 . A A . 20 CYS HB3 1 1 4 2626 1 1 20 CYS N N -7.058 -3.152 -1.762 1.00 . A A . 20 CYS N 1 1 4 2627 1 1 20 CYS O O -9.437 -3.869 -0.767 1.00 . A A . 20 CYS O 1 1 4 2628 1 1 20 CYS SG S -6.815 -1.935 -4.428 1.00 . A A . 20 CYS SG 1 1 4 2629 1 1 21 ASN C C -11.933 -4.260 -1.092 1.00 . A A . 21 ASN C 1 1 4 2630 1 1 21 ASN CA C -11.879 -2.733 -1.027 1.00 . A A . 21 ASN CA 1 1 4 2631 1 1 21 ASN CB C -13.087 -2.153 -1.766 1.00 . A A . 21 ASN CB 1 1 4 2632 1 1 21 ASN CG C -14.358 -2.424 -0.959 1.00 . A A . 21 ASN CG 1 1 4 2633 1 1 21 ASN H H -10.635 -1.440 -2.225 1.00 . A A . 21 ASN H 1 1 4 2634 1 1 21 ASN HA H -11.906 -2.417 0.005 1.00 . A A . 21 ASN HA 1 1 4 2635 1 1 21 ASN HB2 H -12.959 -1.088 -1.887 1.00 . A A . 21 ASN HB2 1 1 4 2636 1 1 21 ASN HB3 H -13.174 -2.618 -2.737 1.00 . A A . 21 ASN HB3 1 1 4 2637 1 1 21 ASN HD21 H -14.352 -4.375 -1.333 1.00 . A A . 21 ASN HD21 1 1 4 2638 1 1 21 ASN HD22 H -15.634 -3.825 -0.366 1.00 . A A . 21 ASN HD22 1 1 4 2639 1 1 21 ASN N N -10.619 -2.243 -1.664 1.00 . A A . 21 ASN N 1 1 4 2640 1 1 21 ASN ND2 N -14.819 -3.643 -0.879 1.00 . A A . 21 ASN ND2 1 1 4 2641 1 1 21 ASN O O -12.161 -4.781 -2.171 1.00 . A A . 21 ASN O 1 1 4 2642 1 1 21 ASN OXT O -11.745 -4.883 -0.060 1.00 . A A . 21 ASN OXT 1 1 4 2643 1 1 21 ASN OD1 O -14.937 -1.518 -0.393 1.00 . A A . 21 ASN OD1 1 1 4 2644 2 2 1 PHE C C 7.325 0.418 -9.379 1.00 . B B . 1 PHE C 1 1 4 2645 2 2 1 PHE CA C 5.862 0.865 -9.399 1.00 . B B . 1 PHE CA 1 1 4 2646 2 2 1 PHE CB C 5.767 2.265 -10.009 1.00 . B B . 1 PHE CB 1 1 4 2647 2 2 1 PHE CD1 C 5.274 1.171 -12.227 1.00 . B B . 1 PHE CD1 1 1 4 2648 2 2 1 PHE CD2 C 6.765 3.086 -12.177 1.00 . B B . 1 PHE CD2 1 1 4 2649 2 2 1 PHE CE1 C 5.435 1.082 -13.616 1.00 . B B . 1 PHE CE1 1 1 4 2650 2 2 1 PHE CE2 C 6.926 2.997 -13.567 1.00 . B B . 1 PHE CE2 1 1 4 2651 2 2 1 PHE CG C 5.939 2.173 -11.507 1.00 . B B . 1 PHE CG 1 1 4 2652 2 2 1 PHE CZ C 6.261 1.995 -14.286 1.00 . B B . 1 PHE CZ 1 1 4 2653 2 2 1 PHE H1 H 5.301 -0.078 -7.631 1.00 . B B . 1 PHE H1 1 1 4 2654 2 2 1 PHE H2 H 4.369 1.290 -8.013 1.00 . B B . 1 PHE H2 1 1 4 2655 2 2 1 PHE H3 H 5.948 1.474 -7.411 1.00 . B B . 1 PHE H3 1 1 4 2656 2 2 1 PHE HA H 5.283 0.173 -9.992 1.00 . B B . 1 PHE HA 1 1 4 2657 2 2 1 PHE HB2 H 4.801 2.692 -9.782 1.00 . B B . 1 PHE HB2 1 1 4 2658 2 2 1 PHE HB3 H 6.544 2.890 -9.597 1.00 . B B . 1 PHE HB3 1 1 4 2659 2 2 1 PHE HD1 H 4.637 0.468 -11.712 1.00 . B B . 1 PHE HD1 1 1 4 2660 2 2 1 PHE HD2 H 7.278 3.858 -11.624 1.00 . B B . 1 PHE HD2 1 1 4 2661 2 2 1 PHE HE1 H 4.923 0.310 -14.170 1.00 . B B . 1 PHE HE1 1 1 4 2662 2 2 1 PHE HE2 H 7.562 3.700 -14.083 1.00 . B B . 1 PHE HE2 1 1 4 2663 2 2 1 PHE HZ H 6.385 1.926 -15.357 1.00 . B B . 1 PHE HZ 1 1 4 2664 2 2 1 PHE N N 5.330 0.890 -8.008 1.00 . B B . 1 PHE N 1 1 4 2665 2 2 1 PHE O O 7.994 0.406 -10.393 1.00 . B B . 1 PHE O 1 1 4 2666 2 2 2 VAL C C 9.436 -1.304 -6.941 1.00 . B B . 2 VAL C 1 1 4 2667 2 2 2 VAL CA C 9.252 -0.391 -8.154 1.00 . B B . 2 VAL CA 1 1 4 2668 2 2 2 VAL CB C 10.183 0.825 -8.028 1.00 . B B . 2 VAL CB 1 1 4 2669 2 2 2 VAL CG1 C 10.890 1.060 -9.364 1.00 . B B . 2 VAL CG1 1 1 4 2670 2 2 2 VAL CG2 C 9.378 2.075 -7.656 1.00 . B B . 2 VAL CG2 1 1 4 2671 2 2 2 VAL H H 7.277 0.069 -7.424 1.00 . B B . 2 VAL H 1 1 4 2672 2 2 2 VAL HA H 9.503 -0.939 -9.051 1.00 . B B . 2 VAL HA 1 1 4 2673 2 2 2 VAL HB H 10.922 0.633 -7.263 1.00 . B B . 2 VAL HB 1 1 4 2674 2 2 2 VAL HG11 H 11.959 1.057 -9.211 1.00 . B B . 2 VAL HG11 1 1 4 2675 2 2 2 VAL HG12 H 10.587 2.014 -9.769 1.00 . B B . 2 VAL HG12 1 1 4 2676 2 2 2 VAL HG13 H 10.623 0.274 -10.055 1.00 . B B . 2 VAL HG13 1 1 4 2677 2 2 2 VAL HG21 H 8.967 2.518 -8.551 1.00 . B B . 2 VAL HG21 1 1 4 2678 2 2 2 VAL HG22 H 10.025 2.788 -7.166 1.00 . B B . 2 VAL HG22 1 1 4 2679 2 2 2 VAL HG23 H 8.574 1.801 -6.988 1.00 . B B . 2 VAL HG23 1 1 4 2680 2 2 2 VAL N N 7.830 0.052 -8.232 1.00 . B B . 2 VAL N 1 1 4 2681 2 2 2 VAL O O 8.483 -1.797 -6.372 1.00 . B B . 2 VAL O 1 1 4 2682 2 2 3 ASN C C 11.415 -1.555 -4.209 1.00 . B B . 3 ASN C 1 1 4 2683 2 2 3 ASN CA C 10.905 -2.412 -5.365 1.00 . B B . 3 ASN CA 1 1 4 2684 2 2 3 ASN CB C 11.953 -3.461 -5.729 1.00 . B B . 3 ASN CB 1 1 4 2685 2 2 3 ASN CG C 11.256 -4.771 -6.099 1.00 . B B . 3 ASN CG 1 1 4 2686 2 2 3 ASN H H 11.412 -1.124 -7.012 1.00 . B B . 3 ASN H 1 1 4 2687 2 2 3 ASN HA H 9.986 -2.900 -5.079 1.00 . B B . 3 ASN HA 1 1 4 2688 2 2 3 ASN HB2 H 12.532 -3.109 -6.569 1.00 . B B . 3 ASN HB2 1 1 4 2689 2 2 3 ASN HB3 H 12.606 -3.628 -4.885 1.00 . B B . 3 ASN HB3 1 1 4 2690 2 2 3 ASN HD21 H 12.567 -5.905 -5.131 1.00 . B B . 3 ASN HD21 1 1 4 2691 2 2 3 ASN HD22 H 11.316 -6.746 -5.910 1.00 . B B . 3 ASN HD22 1 1 4 2692 2 2 3 ASN N N 10.657 -1.533 -6.541 1.00 . B B . 3 ASN N 1 1 4 2693 2 2 3 ASN ND2 N 11.755 -5.901 -5.679 1.00 . B B . 3 ASN ND2 1 1 4 2694 2 2 3 ASN O O 12.476 -1.788 -3.664 1.00 . B B . 3 ASN O 1 1 4 2695 2 2 3 ASN OD1 O 10.247 -4.766 -6.775 1.00 . B B . 3 ASN OD1 1 1 4 2696 2 2 4 GLN C C 10.120 0.248 -1.574 1.00 . B B . 4 GLN C 1 1 4 2697 2 2 4 GLN CA C 11.099 0.350 -2.750 1.00 . B B . 4 GLN CA 1 1 4 2698 2 2 4 GLN CB C 11.115 1.781 -3.290 1.00 . B B . 4 GLN CB 1 1 4 2699 2 2 4 GLN CD C 11.992 4.100 -2.914 1.00 . B B . 4 GLN CD 1 1 4 2700 2 2 4 GLN CG C 11.826 2.703 -2.303 1.00 . B B . 4 GLN CG 1 1 4 2701 2 2 4 GLN H H 9.830 -0.378 -4.318 1.00 . B B . 4 GLN H 1 1 4 2702 2 2 4 GLN HA H 12.091 0.077 -2.422 1.00 . B B . 4 GLN HA 1 1 4 2703 2 2 4 GLN HB2 H 11.634 1.799 -4.239 1.00 . B B . 4 GLN HB2 1 1 4 2704 2 2 4 GLN HB3 H 10.100 2.122 -3.432 1.00 . B B . 4 GLN HB3 1 1 4 2705 2 2 4 GLN HE21 H 11.250 3.596 -4.691 1.00 . B B . 4 GLN HE21 1 1 4 2706 2 2 4 GLN HE22 H 11.734 5.213 -4.538 1.00 . B B . 4 GLN HE22 1 1 4 2707 2 2 4 GLN HG2 H 11.240 2.777 -1.400 1.00 . B B . 4 GLN HG2 1 1 4 2708 2 2 4 GLN HG3 H 12.798 2.296 -2.071 1.00 . B B . 4 GLN HG3 1 1 4 2709 2 2 4 GLN N N 10.670 -0.551 -3.849 1.00 . B B . 4 GLN N 1 1 4 2710 2 2 4 GLN NE2 N 11.629 4.320 -4.151 1.00 . B B . 4 GLN NE2 1 1 4 2711 2 2 4 GLN O O 9.056 -0.334 -1.681 1.00 . B B . 4 GLN O 1 1 4 2712 2 2 4 GLN OE1 O 12.460 5.006 -2.254 1.00 . B B . 4 GLN OE1 1 1 4 2713 2 2 5 HIS C C 8.481 1.821 0.596 1.00 . B B . 5 HIS C 1 1 4 2714 2 2 5 HIS CA C 9.570 0.754 0.739 1.00 . B B . 5 HIS CA 1 1 4 2715 2 2 5 HIS CB C 10.361 1.012 2.031 1.00 . B B . 5 HIS CB 1 1 4 2716 2 2 5 HIS CD2 C 12.604 -0.332 2.094 1.00 . B B . 5 HIS CD2 1 1 4 2717 2 2 5 HIS CE1 C 13.873 1.177 1.180 1.00 . B B . 5 HIS CE1 1 1 4 2718 2 2 5 HIS CG C 11.828 0.757 1.810 1.00 . B B . 5 HIS CG 1 1 4 2719 2 2 5 HIS H H 11.337 1.273 -0.384 1.00 . B B . 5 HIS H 1 1 4 2720 2 2 5 HIS HA H 9.110 -0.222 0.789 1.00 . B B . 5 HIS HA 1 1 4 2721 2 2 5 HIS HB2 H 10.219 2.037 2.338 1.00 . B B . 5 HIS HB2 1 1 4 2722 2 2 5 HIS HB3 H 9.998 0.355 2.807 1.00 . B B . 5 HIS HB3 1 1 4 2723 2 2 5 HIS HD2 H 12.260 -1.247 2.552 1.00 . B B . 5 HIS HD2 1 1 4 2724 2 2 5 HIS HE1 H 14.735 1.684 0.774 1.00 . B B . 5 HIS HE1 1 1 4 2725 2 2 5 HIS HE2 H 14.675 -0.661 1.778 1.00 . B B . 5 HIS HE2 1 1 4 2726 2 2 5 HIS N N 10.475 0.812 -0.448 1.00 . B B . 5 HIS N 1 1 4 2727 2 2 5 HIS ND1 N 12.642 1.706 1.231 1.00 . B B . 5 HIS ND1 1 1 4 2728 2 2 5 HIS NE2 N 13.898 -0.069 1.697 1.00 . B B . 5 HIS NE2 1 1 4 2729 2 2 5 HIS O O 8.536 2.663 -0.279 1.00 . B B . 5 HIS O 1 1 4 2730 2 2 6 LEU C C 6.110 3.407 2.716 1.00 . B B . 6 LEU C 1 1 4 2731 2 2 6 LEU CA C 6.391 2.796 1.344 1.00 . B B . 6 LEU CA 1 1 4 2732 2 2 6 LEU CB C 5.112 2.097 0.850 1.00 . B B . 6 LEU CB 1 1 4 2733 2 2 6 LEU CD1 C 5.656 3.336 -1.298 1.00 . B B . 6 LEU CD1 1 1 4 2734 2 2 6 LEU CD2 C 3.819 1.667 -1.246 1.00 . B B . 6 LEU CD2 1 1 4 2735 2 2 6 LEU CG C 4.539 2.742 -0.436 1.00 . B B . 6 LEU CG 1 1 4 2736 2 2 6 LEU H H 7.456 1.096 2.132 1.00 . B B . 6 LEU H 1 1 4 2737 2 2 6 LEU HA H 6.691 3.573 0.667 1.00 . B B . 6 LEU HA 1 1 4 2738 2 2 6 LEU HB2 H 5.343 1.063 0.657 1.00 . B B . 6 LEU HB2 1 1 4 2739 2 2 6 LEU HB3 H 4.366 2.142 1.631 1.00 . B B . 6 LEU HB3 1 1 4 2740 2 2 6 LEU HD11 H 5.879 4.337 -0.959 1.00 . B B . 6 LEU HD11 1 1 4 2741 2 2 6 LEU HD12 H 5.335 3.369 -2.329 1.00 . B B . 6 LEU HD12 1 1 4 2742 2 2 6 LEU HD13 H 6.541 2.722 -1.216 1.00 . B B . 6 LEU HD13 1 1 4 2743 2 2 6 LEU HD21 H 3.406 0.928 -0.576 1.00 . B B . 6 LEU HD21 1 1 4 2744 2 2 6 LEU HD22 H 4.518 1.194 -1.919 1.00 . B B . 6 LEU HD22 1 1 4 2745 2 2 6 LEU HD23 H 3.021 2.122 -1.816 1.00 . B B . 6 LEU HD23 1 1 4 2746 2 2 6 LEU HG H 3.825 3.518 -0.174 1.00 . B B . 6 LEU HG 1 1 4 2747 2 2 6 LEU N N 7.487 1.788 1.442 1.00 . B B . 6 LEU N 1 1 4 2748 2 2 6 LEU O O 6.598 2.945 3.725 1.00 . B B . 6 LEU O 1 1 4 2749 2 2 7 CYS C C 4.400 6.492 3.782 1.00 . B B . 7 CYS C 1 1 4 2750 2 2 7 CYS CA C 4.965 5.089 4.043 1.00 . B B . 7 CYS CA 1 1 4 2751 2 2 7 CYS CB C 6.218 5.195 4.913 1.00 . B B . 7 CYS CB 1 1 4 2752 2 2 7 CYS H H 4.919 4.777 1.917 1.00 . B B . 7 CYS H 1 1 4 2753 2 2 7 CYS HA H 4.223 4.496 4.556 1.00 . B B . 7 CYS HA 1 1 4 2754 2 2 7 CYS HB2 H 7.071 4.821 4.370 1.00 . B B . 7 CYS HB2 1 1 4 2755 2 2 7 CYS HB3 H 6.387 6.225 5.174 1.00 . B B . 7 CYS HB3 1 1 4 2756 2 2 7 CYS N N 5.307 4.438 2.749 1.00 . B B . 7 CYS N 1 1 4 2757 2 2 7 CYS O O 4.894 7.228 2.950 1.00 . B B . 7 CYS O 1 1 4 2758 2 2 7 CYS SG S 5.978 4.224 6.422 1.00 . B B . 7 CYS SG 1 1 4 2759 2 2 8 GLY C C 2.095 8.312 2.927 1.00 . B B . 8 GLY C 1 1 4 2760 2 2 8 GLY CA C 2.776 8.222 4.296 1.00 . B B . 8 GLY CA 1 1 4 2761 2 2 8 GLY H H 2.989 6.260 5.160 1.00 . B B . 8 GLY H 1 1 4 2762 2 2 8 GLY HA2 H 2.046 8.407 5.071 1.00 . B B . 8 GLY HA2 1 1 4 2763 2 2 8 GLY HA3 H 3.555 8.967 4.354 1.00 . B B . 8 GLY HA3 1 1 4 2764 2 2 8 GLY N N 3.370 6.868 4.492 1.00 . B B . 8 GLY N 1 1 4 2765 2 2 8 GLY O O 1.612 7.331 2.392 1.00 . B B . 8 GLY O 1 1 4 2766 2 2 9 SER C C 1.921 8.611 0.058 1.00 . B B . 9 SER C 1 1 4 2767 2 2 9 SER CA C 1.392 9.661 1.034 1.00 . B B . 9 SER CA 1 1 4 2768 2 2 9 SER CB C 1.691 11.059 0.494 1.00 . B B . 9 SER CB 1 1 4 2769 2 2 9 SER H H 2.437 10.264 2.817 1.00 . B B . 9 SER H 1 1 4 2770 2 2 9 SER HA H 0.328 9.539 1.144 1.00 . B B . 9 SER HA 1 1 4 2771 2 2 9 SER HB2 H 2.204 11.637 1.245 1.00 . B B . 9 SER HB2 1 1 4 2772 2 2 9 SER HB3 H 2.319 10.978 -0.384 1.00 . B B . 9 SER HB3 1 1 4 2773 2 2 9 SER HG H 0.680 12.543 -0.257 1.00 . B B . 9 SER HG 1 1 4 2774 2 2 9 SER N N 2.046 9.489 2.362 1.00 . B B . 9 SER N 1 1 4 2775 2 2 9 SER O O 1.261 8.248 -0.895 1.00 . B B . 9 SER O 1 1 4 2776 2 2 9 SER OG O 0.469 11.705 0.161 1.00 . B B . 9 SER OG 1 1 4 2777 2 2 10 ASP C C 2.804 5.832 -0.559 1.00 . B B . 10 ASP C 1 1 4 2778 2 2 10 ASP CA C 3.670 7.089 -0.626 1.00 . B B . 10 ASP CA 1 1 4 2779 2 2 10 ASP CB C 5.101 6.756 -0.197 1.00 . B B . 10 ASP CB 1 1 4 2780 2 2 10 ASP CG C 5.869 8.050 0.075 1.00 . B B . 10 ASP CG 1 1 4 2781 2 2 10 ASP H H 3.616 8.425 1.064 1.00 . B B . 10 ASP H 1 1 4 2782 2 2 10 ASP HA H 3.675 7.465 -1.637 1.00 . B B . 10 ASP HA 1 1 4 2783 2 2 10 ASP HB2 H 5.076 6.156 0.700 1.00 . B B . 10 ASP HB2 1 1 4 2784 2 2 10 ASP HB3 H 5.594 6.206 -0.985 1.00 . B B . 10 ASP HB3 1 1 4 2785 2 2 10 ASP N N 3.104 8.119 0.288 1.00 . B B . 10 ASP N 1 1 4 2786 2 2 10 ASP O O 2.562 5.175 -1.553 1.00 . B B . 10 ASP O 1 1 4 2787 2 2 10 ASP OD1 O 5.391 8.844 0.870 1.00 . B B . 10 ASP OD1 1 1 4 2788 2 2 10 ASP OD2 O 6.922 8.226 -0.515 1.00 . B B . 10 ASP OD2 1 1 4 2789 2 2 11 LEU C C 0.097 4.567 0.140 1.00 . B B . 11 LEU C 1 1 4 2790 2 2 11 LEU CA C 1.475 4.285 0.741 1.00 . B B . 11 LEU CA 1 1 4 2791 2 2 11 LEU CB C 1.344 3.918 2.225 1.00 . B B . 11 LEU CB 1 1 4 2792 2 2 11 LEU CD1 C 1.573 1.560 1.350 1.00 . B B . 11 LEU CD1 1 1 4 2793 2 2 11 LEU CD2 C 1.286 1.976 3.791 1.00 . B B . 11 LEU CD2 1 1 4 2794 2 2 11 LEU CG C 0.895 2.457 2.393 1.00 . B B . 11 LEU CG 1 1 4 2795 2 2 11 LEU H H 2.531 6.040 1.397 1.00 . B B . 11 LEU H 1 1 4 2796 2 2 11 LEU HA H 1.932 3.472 0.206 1.00 . B B . 11 LEU HA 1 1 4 2797 2 2 11 LEU HB2 H 2.300 4.054 2.708 1.00 . B B . 11 LEU HB2 1 1 4 2798 2 2 11 LEU HB3 H 0.616 4.568 2.688 1.00 . B B . 11 LEU HB3 1 1 4 2799 2 2 11 LEU HD11 H 1.620 0.547 1.722 1.00 . B B . 11 LEU HD11 1 1 4 2800 2 2 11 LEU HD12 H 2.573 1.921 1.160 1.00 . B B . 11 LEU HD12 1 1 4 2801 2 2 11 LEU HD13 H 1.003 1.580 0.433 1.00 . B B . 11 LEU HD13 1 1 4 2802 2 2 11 LEU HD21 H 2.363 1.987 3.887 1.00 . B B . 11 LEU HD21 1 1 4 2803 2 2 11 LEU HD22 H 0.922 0.971 3.942 1.00 . B B . 11 LEU HD22 1 1 4 2804 2 2 11 LEU HD23 H 0.853 2.631 4.531 1.00 . B B . 11 LEU HD23 1 1 4 2805 2 2 11 LEU HG H -0.177 2.394 2.277 1.00 . B B . 11 LEU HG 1 1 4 2806 2 2 11 LEU N N 2.328 5.495 0.608 1.00 . B B . 11 LEU N 1 1 4 2807 2 2 11 LEU O O -0.559 3.679 -0.359 1.00 . B B . 11 LEU O 1 1 4 2808 2 2 12 VAL C C -1.490 6.412 -1.924 1.00 . B B . 12 VAL C 1 1 4 2809 2 2 12 VAL CA C -1.678 6.097 -0.438 1.00 . B B . 12 VAL CA 1 1 4 2810 2 2 12 VAL CB C -2.338 7.284 0.294 1.00 . B B . 12 VAL CB 1 1 4 2811 2 2 12 VAL CG1 C -1.800 7.363 1.718 1.00 . B B . 12 VAL CG1 1 1 4 2812 2 2 12 VAL CG2 C -2.042 8.608 -0.422 1.00 . B B . 12 VAL CG2 1 1 4 2813 2 2 12 VAL H H 0.196 6.510 0.553 1.00 . B B . 12 VAL H 1 1 4 2814 2 2 12 VAL HA H -2.311 5.225 -0.342 1.00 . B B . 12 VAL HA 1 1 4 2815 2 2 12 VAL HB H -3.407 7.127 0.329 1.00 . B B . 12 VAL HB 1 1 4 2816 2 2 12 VAL HG11 H -1.853 6.387 2.176 1.00 . B B . 12 VAL HG11 1 1 4 2817 2 2 12 VAL HG12 H -2.393 8.063 2.286 1.00 . B B . 12 VAL HG12 1 1 4 2818 2 2 12 VAL HG13 H -0.772 7.696 1.694 1.00 . B B . 12 VAL HG13 1 1 4 2819 2 2 12 VAL HG21 H -0.976 8.768 -0.456 1.00 . B B . 12 VAL HG21 1 1 4 2820 2 2 12 VAL HG22 H -2.510 9.419 0.116 1.00 . B B . 12 VAL HG22 1 1 4 2821 2 2 12 VAL HG23 H -2.434 8.569 -1.427 1.00 . B B . 12 VAL HG23 1 1 4 2822 2 2 12 VAL N N -0.346 5.794 0.161 1.00 . B B . 12 VAL N 1 1 4 2823 2 2 12 VAL O O -2.189 5.898 -2.772 1.00 . B B . 12 VAL O 1 1 4 2824 2 2 13 GLU C C -0.270 6.302 -4.491 1.00 . B B . 13 GLU C 1 1 4 2825 2 2 13 GLU CA C -0.301 7.592 -3.668 1.00 . B B . 13 GLU CA 1 1 4 2826 2 2 13 GLU CB C 1.034 8.331 -3.794 1.00 . B B . 13 GLU CB 1 1 4 2827 2 2 13 GLU CD C 3.518 8.072 -3.884 1.00 . B B . 13 GLU CD 1 1 4 2828 2 2 13 GLU CG C 2.192 7.341 -3.658 1.00 . B B . 13 GLU CG 1 1 4 2829 2 2 13 GLU H H 0.017 7.647 -1.542 1.00 . B B . 13 GLU H 1 1 4 2830 2 2 13 GLU HA H -1.100 8.226 -4.024 1.00 . B B . 13 GLU HA 1 1 4 2831 2 2 13 GLU HB2 H 1.086 8.817 -4.757 1.00 . B B . 13 GLU HB2 1 1 4 2832 2 2 13 GLU HB3 H 1.106 9.074 -3.013 1.00 . B B . 13 GLU HB3 1 1 4 2833 2 2 13 GLU HG2 H 2.182 6.911 -2.667 1.00 . B B . 13 GLU HG2 1 1 4 2834 2 2 13 GLU HG3 H 2.085 6.558 -4.393 1.00 . B B . 13 GLU HG3 1 1 4 2835 2 2 13 GLU N N -0.541 7.249 -2.242 1.00 . B B . 13 GLU N 1 1 4 2836 2 2 13 GLU O O -0.686 6.270 -5.634 1.00 . B B . 13 GLU O 1 1 4 2837 2 2 13 GLU OE1 O 3.564 9.267 -3.638 1.00 . B B . 13 GLU OE1 1 1 4 2838 2 2 13 GLU OE2 O 4.465 7.424 -4.299 1.00 . B B . 13 GLU OE2 1 1 4 2839 2 2 14 ALA C C -1.131 3.272 -4.473 1.00 . B B . 14 ALA C 1 1 4 2840 2 2 14 ALA CA C 0.226 3.943 -4.646 1.00 . B B . 14 ALA CA 1 1 4 2841 2 2 14 ALA CB C 1.326 3.045 -4.074 1.00 . B B . 14 ALA CB 1 1 4 2842 2 2 14 ALA H H 0.502 5.267 -2.980 1.00 . B B . 14 ALA H 1 1 4 2843 2 2 14 ALA HA H 0.411 4.126 -5.694 1.00 . B B . 14 ALA HA 1 1 4 2844 2 2 14 ALA HB1 H 0.883 2.295 -3.435 1.00 . B B . 14 ALA HB1 1 1 4 2845 2 2 14 ALA HB2 H 2.017 3.644 -3.500 1.00 . B B . 14 ALA HB2 1 1 4 2846 2 2 14 ALA HB3 H 1.853 2.563 -4.883 1.00 . B B . 14 ALA HB3 1 1 4 2847 2 2 14 ALA N N 0.195 5.230 -3.908 1.00 . B B . 14 ALA N 1 1 4 2848 2 2 14 ALA O O -1.820 2.979 -5.429 1.00 . B B . 14 ALA O 1 1 4 2849 2 2 15 LEU C C -3.920 3.170 -3.790 1.00 . B B . 15 LEU C 1 1 4 2850 2 2 15 LEU CA C -2.847 2.416 -3.004 1.00 . B B . 15 LEU CA 1 1 4 2851 2 2 15 LEU CB C -3.147 2.485 -1.509 1.00 . B B . 15 LEU CB 1 1 4 2852 2 2 15 LEU CD1 C -2.847 1.263 0.650 1.00 . B B . 15 LEU CD1 1 1 4 2853 2 2 15 LEU CD2 C -2.312 0.078 -1.486 1.00 . B B . 15 LEU CD2 1 1 4 2854 2 2 15 LEU CG C -2.298 1.438 -0.760 1.00 . B B . 15 LEU CG 1 1 4 2855 2 2 15 LEU H H -0.965 3.304 -2.491 1.00 . B B . 15 LEU H 1 1 4 2856 2 2 15 LEU HA H -2.817 1.393 -3.325 1.00 . B B . 15 LEU HA 1 1 4 2857 2 2 15 LEU HB2 H -2.890 3.472 -1.148 1.00 . B B . 15 LEU HB2 1 1 4 2858 2 2 15 LEU HB3 H -4.204 2.310 -1.332 1.00 . B B . 15 LEU HB3 1 1 4 2859 2 2 15 LEU HD11 H -2.320 0.461 1.143 1.00 . B B . 15 LEU HD11 1 1 4 2860 2 2 15 LEU HD12 H -3.899 1.029 0.597 1.00 . B B . 15 LEU HD12 1 1 4 2861 2 2 15 LEU HD13 H -2.708 2.181 1.203 1.00 . B B . 15 LEU HD13 1 1 4 2862 2 2 15 LEU HD21 H -1.835 0.177 -2.449 1.00 . B B . 15 LEU HD21 1 1 4 2863 2 2 15 LEU HD22 H -3.327 -0.258 -1.621 1.00 . B B . 15 LEU HD22 1 1 4 2864 2 2 15 LEU HD23 H -1.768 -0.651 -0.896 1.00 . B B . 15 LEU HD23 1 1 4 2865 2 2 15 LEU HG H -1.281 1.793 -0.696 1.00 . B B . 15 LEU HG 1 1 4 2866 2 2 15 LEU N N -1.530 3.047 -3.251 1.00 . B B . 15 LEU N 1 1 4 2867 2 2 15 LEU O O -4.798 2.580 -4.387 1.00 . B B . 15 LEU O 1 1 4 2868 2 2 16 TYR C C -4.718 4.979 -6.050 1.00 . B B . 16 TYR C 1 1 4 2869 2 2 16 TYR CA C -4.871 5.255 -4.553 1.00 . B B . 16 TYR CA 1 1 4 2870 2 2 16 TYR CB C -4.669 6.748 -4.294 1.00 . B B . 16 TYR CB 1 1 4 2871 2 2 16 TYR CD1 C -7.097 7.413 -4.367 1.00 . B B . 16 TYR CD1 1 1 4 2872 2 2 16 TYR CD2 C -5.865 7.724 -2.299 1.00 . B B . 16 TYR CD2 1 1 4 2873 2 2 16 TYR CE1 C -8.248 7.930 -3.760 1.00 . B B . 16 TYR CE1 1 1 4 2874 2 2 16 TYR CE2 C -7.017 8.241 -1.691 1.00 . B B . 16 TYR CE2 1 1 4 2875 2 2 16 TYR CG C -5.906 7.309 -3.637 1.00 . B B . 16 TYR CG 1 1 4 2876 2 2 16 TYR CZ C -8.209 8.344 -2.422 1.00 . B B . 16 TYR CZ 1 1 4 2877 2 2 16 TYR H H -3.139 4.934 -3.310 1.00 . B B . 16 TYR H 1 1 4 2878 2 2 16 TYR HA H -5.862 4.965 -4.233 1.00 . B B . 16 TYR HA 1 1 4 2879 2 2 16 TYR HB2 H -3.815 6.891 -3.648 1.00 . B B . 16 TYR HB2 1 1 4 2880 2 2 16 TYR HB3 H -4.499 7.256 -5.232 1.00 . B B . 16 TYR HB3 1 1 4 2881 2 2 16 TYR HD1 H -7.127 7.094 -5.398 1.00 . B B . 16 TYR HD1 1 1 4 2882 2 2 16 TYR HD2 H -4.946 7.645 -1.736 1.00 . B B . 16 TYR HD2 1 1 4 2883 2 2 16 TYR HE1 H -9.166 8.009 -4.322 1.00 . B B . 16 TYR HE1 1 1 4 2884 2 2 16 TYR HE2 H -6.987 8.560 -0.660 1.00 . B B . 16 TYR HE2 1 1 4 2885 2 2 16 TYR HH H -9.994 8.148 -1.775 1.00 . B B . 16 TYR HH 1 1 4 2886 2 2 16 TYR N N -3.856 4.472 -3.798 1.00 . B B . 16 TYR N 1 1 4 2887 2 2 16 TYR O O -5.677 5.003 -6.793 1.00 . B B . 16 TYR O 1 1 4 2888 2 2 16 TYR OH O -9.344 8.852 -1.824 1.00 . B B . 16 TYR OH 1 1 4 2889 2 2 17 LEU C C -3.642 2.985 -8.242 1.00 . B B . 17 LEU C 1 1 4 2890 2 2 17 LEU CA C -3.324 4.457 -7.955 1.00 . B B . 17 LEU CA 1 1 4 2891 2 2 17 LEU CB C -1.870 4.812 -8.343 1.00 . B B . 17 LEU CB 1 1 4 2892 2 2 17 LEU CD1 C -1.029 2.543 -9.039 1.00 . B B . 17 LEU CD1 1 1 4 2893 2 2 17 LEU CD2 C -2.354 3.906 -10.667 1.00 . B B . 17 LEU CD2 1 1 4 2894 2 2 17 LEU CG C -1.339 3.961 -9.517 1.00 . B B . 17 LEU CG 1 1 4 2895 2 2 17 LEU H H -2.752 4.714 -5.891 1.00 . B B . 17 LEU H 1 1 4 2896 2 2 17 LEU HA H -4.009 5.083 -8.502 1.00 . B B . 17 LEU HA 1 1 4 2897 2 2 17 LEU HB2 H -1.829 5.853 -8.625 1.00 . B B . 17 LEU HB2 1 1 4 2898 2 2 17 LEU HB3 H -1.233 4.659 -7.484 1.00 . B B . 17 LEU HB3 1 1 4 2899 2 2 17 LEU HD11 H -0.882 2.549 -7.969 1.00 . B B . 17 LEU HD11 1 1 4 2900 2 2 17 LEU HD12 H -0.131 2.190 -9.523 1.00 . B B . 17 LEU HD12 1 1 4 2901 2 2 17 LEU HD13 H -1.852 1.889 -9.287 1.00 . B B . 17 LEU HD13 1 1 4 2902 2 2 17 LEU HD21 H -1.990 4.498 -11.496 1.00 . B B . 17 LEU HD21 1 1 4 2903 2 2 17 LEU HD22 H -3.303 4.295 -10.336 1.00 . B B . 17 LEU HD22 1 1 4 2904 2 2 17 LEU HD23 H -2.477 2.880 -10.990 1.00 . B B . 17 LEU HD23 1 1 4 2905 2 2 17 LEU HG H -0.423 4.409 -9.879 1.00 . B B . 17 LEU HG 1 1 4 2906 2 2 17 LEU N N -3.519 4.724 -6.502 1.00 . B B . 17 LEU N 1 1 4 2907 2 2 17 LEU O O -4.099 2.633 -9.311 1.00 . B B . 17 LEU O 1 1 4 2908 2 2 18 VAL C C -5.219 0.441 -7.196 1.00 . B B . 18 VAL C 1 1 4 2909 2 2 18 VAL CA C -3.738 0.679 -7.493 1.00 . B B . 18 VAL CA 1 1 4 2910 2 2 18 VAL CB C -2.889 -0.191 -6.556 1.00 . B B . 18 VAL CB 1 1 4 2911 2 2 18 VAL CG1 C -1.444 0.298 -6.563 1.00 . B B . 18 VAL CG1 1 1 4 2912 2 2 18 VAL CG2 C -3.437 -0.109 -5.131 1.00 . B B . 18 VAL CG2 1 1 4 2913 2 2 18 VAL H H -3.076 2.435 -6.424 1.00 . B B . 18 VAL H 1 1 4 2914 2 2 18 VAL HA H -3.531 0.412 -8.517 1.00 . B B . 18 VAL HA 1 1 4 2915 2 2 18 VAL HB H -2.920 -1.216 -6.895 1.00 . B B . 18 VAL HB 1 1 4 2916 2 2 18 VAL HG11 H -1.233 0.784 -7.501 1.00 . B B . 18 VAL HG11 1 1 4 2917 2 2 18 VAL HG12 H -0.781 -0.544 -6.435 1.00 . B B . 18 VAL HG12 1 1 4 2918 2 2 18 VAL HG13 H -1.299 0.995 -5.753 1.00 . B B . 18 VAL HG13 1 1 4 2919 2 2 18 VAL HG21 H -2.704 -0.501 -4.440 1.00 . B B . 18 VAL HG21 1 1 4 2920 2 2 18 VAL HG22 H -4.345 -0.687 -5.060 1.00 . B B . 18 VAL HG22 1 1 4 2921 2 2 18 VAL HG23 H -3.646 0.920 -4.889 1.00 . B B . 18 VAL HG23 1 1 4 2922 2 2 18 VAL N N -3.427 2.126 -7.283 1.00 . B B . 18 VAL N 1 1 4 2923 2 2 18 VAL O O -5.880 -0.341 -7.850 1.00 . B B . 18 VAL O 1 1 4 2924 2 2 19 CYS C C -8.008 2.012 -6.520 1.00 . B B . 19 CYS C 1 1 4 2925 2 2 19 CYS CA C -7.171 0.928 -5.845 1.00 . B B . 19 CYS CA 1 1 4 2926 2 2 19 CYS CB C -7.323 1.037 -4.329 1.00 . B B . 19 CYS CB 1 1 4 2927 2 2 19 CYS H H -5.181 1.728 -5.689 1.00 . B B . 19 CYS H 1 1 4 2928 2 2 19 CYS HA H -7.504 -0.046 -6.172 1.00 . B B . 19 CYS HA 1 1 4 2929 2 2 19 CYS HB2 H -7.021 2.024 -4.007 1.00 . B B . 19 CYS HB2 1 1 4 2930 2 2 19 CYS HB3 H -8.354 0.869 -4.056 1.00 . B B . 19 CYS HB3 1 1 4 2931 2 2 19 CYS N N -5.738 1.109 -6.204 1.00 . B B . 19 CYS N 1 1 4 2932 2 2 19 CYS O O -8.798 1.743 -7.403 1.00 . B B . 19 CYS O 1 1 4 2933 2 2 19 CYS SG S -6.276 -0.205 -3.535 1.00 . B B . 19 CYS SG 1 1 4 2934 2 2 20 GLY C C -10.034 4.370 -6.134 1.00 . B B . 20 GLY C 1 1 4 2935 2 2 20 GLY CA C -8.623 4.346 -6.726 1.00 . B B . 20 GLY CA 1 1 4 2936 2 2 20 GLY H H -7.196 3.432 -5.397 1.00 . B B . 20 GLY H 1 1 4 2937 2 2 20 GLY HA2 H -8.131 5.288 -6.526 1.00 . B B . 20 GLY HA2 1 1 4 2938 2 2 20 GLY HA3 H -8.686 4.192 -7.792 1.00 . B B . 20 GLY HA3 1 1 4 2939 2 2 20 GLY N N -7.840 3.239 -6.110 1.00 . B B . 20 GLY N 1 1 4 2940 2 2 20 GLY O O -10.233 4.732 -4.992 1.00 . B B . 20 GLY O 1 1 4 2941 2 2 21 GLU C C -12.638 2.818 -5.456 1.00 . B B . 21 GLU C 1 1 4 2942 2 2 21 GLU CA C -12.415 4.003 -6.400 1.00 . B B . 21 GLU CA 1 1 4 2943 2 2 21 GLU CB C -13.381 3.897 -7.581 1.00 . B B . 21 GLU CB 1 1 4 2944 2 2 21 GLU CD C -15.227 5.166 -6.477 1.00 . B B . 21 GLU CD 1 1 4 2945 2 2 21 GLU CG C -14.244 5.159 -7.649 1.00 . B B . 21 GLU CG 1 1 4 2946 2 2 21 GLU H H -10.830 3.713 -7.828 1.00 . B B . 21 GLU H 1 1 4 2947 2 2 21 GLU HA H -12.599 4.925 -5.868 1.00 . B B . 21 GLU HA 1 1 4 2948 2 2 21 GLU HB2 H -12.818 3.795 -8.498 1.00 . B B . 21 GLU HB2 1 1 4 2949 2 2 21 GLU HB3 H -14.017 3.035 -7.450 1.00 . B B . 21 GLU HB3 1 1 4 2950 2 2 21 GLU HG2 H -13.609 6.031 -7.595 1.00 . B B . 21 GLU HG2 1 1 4 2951 2 2 21 GLU HG3 H -14.793 5.170 -8.578 1.00 . B B . 21 GLU HG3 1 1 4 2952 2 2 21 GLU N N -11.014 3.995 -6.908 1.00 . B B . 21 GLU N 1 1 4 2953 2 2 21 GLU O O -13.605 2.774 -4.723 1.00 . B B . 21 GLU O 1 1 4 2954 2 2 21 GLU OE1 O -14.782 5.353 -5.357 1.00 . B B . 21 GLU OE1 1 1 4 2955 2 2 21 GLU OE2 O -16.409 4.984 -6.721 1.00 . B B . 21 GLU OE2 1 1 4 2956 2 2 22 ARG C C -11.404 1.014 -3.181 1.00 . B B . 22 ARG C 1 1 4 2957 2 2 22 ARG CA C -11.933 0.681 -4.578 1.00 . B B . 22 ARG CA 1 1 4 2958 2 2 22 ARG CB C -11.150 -0.494 -5.154 1.00 . B B . 22 ARG CB 1 1 4 2959 2 2 22 ARG CD C -13.224 -1.860 -5.414 1.00 . B B . 22 ARG CD 1 1 4 2960 2 2 22 ARG CG C -12.027 -1.255 -6.149 1.00 . B B . 22 ARG CG 1 1 4 2961 2 2 22 ARG CZ C -14.037 -4.135 -5.574 1.00 . B B . 22 ARG CZ 1 1 4 2962 2 2 22 ARG H H -10.986 1.897 -6.067 1.00 . B B . 22 ARG H 1 1 4 2963 2 2 22 ARG HA H -12.980 0.423 -4.518 1.00 . B B . 22 ARG HA 1 1 4 2964 2 2 22 ARG HB2 H -10.268 -0.126 -5.657 1.00 . B B . 22 ARG HB2 1 1 4 2965 2 2 22 ARG HB3 H -10.861 -1.153 -4.357 1.00 . B B . 22 ARG HB3 1 1 4 2966 2 2 22 ARG HD2 H -13.296 -1.431 -4.426 1.00 . B B . 22 ARG HD2 1 1 4 2967 2 2 22 ARG HD3 H -14.129 -1.649 -5.965 1.00 . B B . 22 ARG HD3 1 1 4 2968 2 2 22 ARG HE H -12.178 -3.702 -5.028 1.00 . B B . 22 ARG HE 1 1 4 2969 2 2 22 ARG HG2 H -12.376 -0.575 -6.912 1.00 . B B . 22 ARG HG2 1 1 4 2970 2 2 22 ARG HG3 H -11.450 -2.045 -6.606 1.00 . B B . 22 ARG HG3 1 1 4 2971 2 2 22 ARG HH11 H -14.151 -3.591 -7.496 1.00 . B B . 22 ARG HH11 1 1 4 2972 2 2 22 ARG HH12 H -15.294 -4.788 -6.985 1.00 . B B . 22 ARG HH12 1 1 4 2973 2 2 22 ARG HH21 H -14.156 -4.864 -3.714 1.00 . B B . 22 ARG HH21 1 1 4 2974 2 2 22 ARG HH22 H -15.296 -5.509 -4.846 1.00 . B B . 22 ARG HH22 1 1 4 2975 2 2 22 ARG N N -11.759 1.854 -5.470 1.00 . B B . 22 ARG N 1 1 4 2976 2 2 22 ARG NE N -13.043 -3.334 -5.303 1.00 . B B . 22 ARG NE 1 1 4 2977 2 2 22 ARG NH1 N -14.533 -4.175 -6.779 1.00 . B B . 22 ARG NH1 1 1 4 2978 2 2 22 ARG NH2 N -14.535 -4.895 -4.638 1.00 . B B . 22 ARG NH2 1 1 4 2979 2 2 22 ARG O O -11.349 0.168 -2.311 1.00 . B B . 22 ARG O 1 1 4 2980 2 2 23 GLY C C -9.451 1.594 -1.161 1.00 . B B . 23 GLY C 1 1 4 2981 2 2 23 GLY CA C -10.490 2.620 -1.617 1.00 . B B . 23 GLY CA 1 1 4 2982 2 2 23 GLY H H -11.066 2.907 -3.673 1.00 . B B . 23 GLY H 1 1 4 2983 2 2 23 GLY HA2 H -10.032 3.596 -1.675 1.00 . B B . 23 GLY HA2 1 1 4 2984 2 2 23 GLY HA3 H -11.303 2.644 -0.908 1.00 . B B . 23 GLY HA3 1 1 4 2985 2 2 23 GLY N N -11.014 2.238 -2.959 1.00 . B B . 23 GLY N 1 1 4 2986 2 2 23 GLY O O -9.122 0.667 -1.875 1.00 . B B . 23 GLY O 1 1 4 2987 2 2 24 PHE C C -8.049 0.657 2.051 1.00 . B B . 24 PHE C 1 1 4 2988 2 2 24 PHE CA C -7.919 0.786 0.532 1.00 . B B . 24 PHE CA 1 1 4 2989 2 2 24 PHE CB C -6.516 1.285 0.181 1.00 . B B . 24 PHE CB 1 1 4 2990 2 2 24 PHE CD1 C -6.358 3.456 1.453 1.00 . B B . 24 PHE CD1 1 1 4 2991 2 2 24 PHE CD2 C -6.590 3.531 -0.961 1.00 . B B . 24 PHE CD2 1 1 4 2992 2 2 24 PHE CE1 C -6.328 4.856 1.494 1.00 . B B . 24 PHE CE1 1 1 4 2993 2 2 24 PHE CE2 C -6.558 4.931 -0.921 1.00 . B B . 24 PHE CE2 1 1 4 2994 2 2 24 PHE CG C -6.489 2.794 0.225 1.00 . B B . 24 PHE CG 1 1 4 2995 2 2 24 PHE CZ C -6.427 5.594 0.306 1.00 . B B . 24 PHE CZ 1 1 4 2996 2 2 24 PHE H H -9.216 2.505 0.587 1.00 . B B . 24 PHE H 1 1 4 2997 2 2 24 PHE HA H -8.082 -0.179 0.075 1.00 . B B . 24 PHE HA 1 1 4 2998 2 2 24 PHE HB2 H -5.806 0.891 0.892 1.00 . B B . 24 PHE HB2 1 1 4 2999 2 2 24 PHE HB3 H -6.254 0.951 -0.812 1.00 . B B . 24 PHE HB3 1 1 4 3000 2 2 24 PHE HD1 H -6.281 2.887 2.368 1.00 . B B . 24 PHE HD1 1 1 4 3001 2 2 24 PHE HD2 H -6.692 3.020 -1.907 1.00 . B B . 24 PHE HD2 1 1 4 3002 2 2 24 PHE HE1 H -6.228 5.367 2.441 1.00 . B B . 24 PHE HE1 1 1 4 3003 2 2 24 PHE HE2 H -6.638 5.499 -1.835 1.00 . B B . 24 PHE HE2 1 1 4 3004 2 2 24 PHE HZ H -6.399 6.675 0.336 1.00 . B B . 24 PHE HZ 1 1 4 3005 2 2 24 PHE N N -8.934 1.752 0.027 1.00 . B B . 24 PHE N 1 1 4 3006 2 2 24 PHE O O -8.686 1.464 2.699 1.00 . B B . 24 PHE O 1 1 4 3007 2 2 25 PHE C C -6.211 -0.158 4.751 1.00 . B B . 25 PHE C 1 1 4 3008 2 2 25 PHE CA C -7.544 -0.531 4.102 1.00 . B B . 25 PHE CA 1 1 4 3009 2 2 25 PHE CB C -7.869 -1.991 4.420 1.00 . B B . 25 PHE CB 1 1 4 3010 2 2 25 PHE CD1 C -8.722 -1.454 6.731 1.00 . B B . 25 PHE CD1 1 1 4 3011 2 2 25 PHE CD2 C -10.161 -2.680 5.209 1.00 . B B . 25 PHE CD2 1 1 4 3012 2 2 25 PHE CE1 C -9.720 -1.501 7.713 1.00 . B B . 25 PHE CE1 1 1 4 3013 2 2 25 PHE CE2 C -11.159 -2.727 6.191 1.00 . B B . 25 PHE CE2 1 1 4 3014 2 2 25 PHE CG C -8.943 -2.043 5.479 1.00 . B B . 25 PHE CG 1 1 4 3015 2 2 25 PHE CZ C -10.938 -2.138 7.444 1.00 . B B . 25 PHE CZ 1 1 4 3016 2 2 25 PHE H H -6.943 -0.993 2.084 1.00 . B B . 25 PHE H 1 1 4 3017 2 2 25 PHE HA H -8.325 0.104 4.493 1.00 . B B . 25 PHE HA 1 1 4 3018 2 2 25 PHE HB2 H -8.219 -2.485 3.525 1.00 . B B . 25 PHE HB2 1 1 4 3019 2 2 25 PHE HB3 H -6.981 -2.487 4.783 1.00 . B B . 25 PHE HB3 1 1 4 3020 2 2 25 PHE HD1 H -7.782 -0.963 6.939 1.00 . B B . 25 PHE HD1 1 1 4 3021 2 2 25 PHE HD2 H -10.331 -3.134 4.244 1.00 . B B . 25 PHE HD2 1 1 4 3022 2 2 25 PHE HE1 H -9.550 -1.047 8.678 1.00 . B B . 25 PHE HE1 1 1 4 3023 2 2 25 PHE HE2 H -12.098 -3.218 5.983 1.00 . B B . 25 PHE HE2 1 1 4 3024 2 2 25 PHE HZ H -11.708 -2.174 8.201 1.00 . B B . 25 PHE HZ 1 1 4 3025 2 2 25 PHE N N -7.451 -0.352 2.625 1.00 . B B . 25 PHE N 1 1 4 3026 2 2 25 PHE O O -5.367 -0.999 4.986 1.00 . B B . 25 PHE O 1 1 4 3027 2 2 26 TYR C C -4.878 1.465 7.203 1.00 . B B . 26 TYR C 1 1 4 3028 2 2 26 TYR CA C -4.738 1.523 5.678 1.00 . B B . 26 TYR CA 1 1 4 3029 2 2 26 TYR CB C -4.417 2.952 5.236 1.00 . B B . 26 TYR CB 1 1 4 3030 2 2 26 TYR CD1 C -2.041 2.998 6.078 1.00 . B B . 26 TYR CD1 1 1 4 3031 2 2 26 TYR CD2 C -3.628 4.606 6.963 1.00 . B B . 26 TYR CD2 1 1 4 3032 2 2 26 TYR CE1 C -1.037 3.540 6.892 1.00 . B B . 26 TYR CE1 1 1 4 3033 2 2 26 TYR CE2 C -2.626 5.148 7.777 1.00 . B B . 26 TYR CE2 1 1 4 3034 2 2 26 TYR CG C -3.336 3.531 6.114 1.00 . B B . 26 TYR CG 1 1 4 3035 2 2 26 TYR CZ C -1.330 4.616 7.741 1.00 . B B . 26 TYR CZ 1 1 4 3036 2 2 26 TYR H H -6.710 1.760 4.847 1.00 . B B . 26 TYR H 1 1 4 3037 2 2 26 TYR HA H -3.943 0.863 5.364 1.00 . B B . 26 TYR HA 1 1 4 3038 2 2 26 TYR HB2 H -4.078 2.941 4.211 1.00 . B B . 26 TYR HB2 1 1 4 3039 2 2 26 TYR HB3 H -5.306 3.560 5.313 1.00 . B B . 26 TYR HB3 1 1 4 3040 2 2 26 TYR HD1 H -1.816 2.169 5.423 1.00 . B B . 26 TYR HD1 1 1 4 3041 2 2 26 TYR HD2 H -4.627 5.016 6.991 1.00 . B B . 26 TYR HD2 1 1 4 3042 2 2 26 TYR HE1 H -0.039 3.130 6.864 1.00 . B B . 26 TYR HE1 1 1 4 3043 2 2 26 TYR HE2 H -2.852 5.978 8.431 1.00 . B B . 26 TYR HE2 1 1 4 3044 2 2 26 TYR HH H -0.726 5.876 9.041 1.00 . B B . 26 TYR HH 1 1 4 3045 2 2 26 TYR N N -6.016 1.097 5.044 1.00 . B B . 26 TYR N 1 1 4 3046 2 2 26 TYR O O -5.822 1.978 7.770 1.00 . B B . 26 TYR O 1 1 4 3047 2 2 26 TYR OH O -0.342 5.151 8.543 1.00 . B B . 26 TYR OH 1 1 4 3048 2 2 27 THR C C -2.658 1.078 9.965 1.00 . B B . 27 THR C 1 1 4 3049 2 2 27 THR CA C -4.022 0.739 9.355 1.00 . B B . 27 THR CA 1 1 4 3050 2 2 27 THR CB C -4.415 -0.688 9.744 1.00 . B B . 27 THR CB 1 1 4 3051 2 2 27 THR CG2 C -5.435 -1.232 8.742 1.00 . B B . 27 THR CG2 1 1 4 3052 2 2 27 THR H H -3.194 0.428 7.390 1.00 . B B . 27 THR H 1 1 4 3053 2 2 27 THR HA H -4.764 1.431 9.724 1.00 . B B . 27 THR HA 1 1 4 3054 2 2 27 THR HB H -4.852 -0.686 10.731 1.00 . B B . 27 THR HB 1 1 4 3055 2 2 27 THR HG1 H -2.981 -1.631 8.827 1.00 . B B . 27 THR HG1 1 1 4 3056 2 2 27 THR HG21 H -4.916 -1.721 7.930 1.00 . B B . 27 THR HG21 1 1 4 3057 2 2 27 THR HG22 H -6.026 -0.418 8.352 1.00 . B B . 27 THR HG22 1 1 4 3058 2 2 27 THR HG23 H -6.081 -1.942 9.236 1.00 . B B . 27 THR HG23 1 1 4 3059 2 2 27 THR N N -3.944 0.838 7.868 1.00 . B B . 27 THR N 1 1 4 3060 2 2 27 THR O O -1.641 1.030 9.301 1.00 . B B . 27 THR O 1 1 4 3061 2 2 27 THR OG1 O -3.258 -1.512 9.739 1.00 . B B . 27 THR OG1 1 1 4 3062 2 2 28 LYS C C -0.753 0.590 12.632 1.00 . B B . 28 LYS C 1 1 4 3063 2 2 28 LYS CA C -1.331 1.784 11.871 1.00 . B B . 28 LYS CA 1 1 4 3064 2 2 28 LYS CB C -1.530 2.922 12.871 1.00 . B B . 28 LYS CB 1 1 4 3065 2 2 28 LYS CD C -1.088 4.623 11.104 1.00 . B B . 28 LYS CD 1 1 4 3066 2 2 28 LYS CE C -2.592 4.896 11.116 1.00 . B B . 28 LYS CE 1 1 4 3067 2 2 28 LYS CG C -0.658 4.112 12.478 1.00 . B B . 28 LYS CG 1 1 4 3068 2 2 28 LYS H H -3.463 1.474 11.734 1.00 . B B . 28 LYS H 1 1 4 3069 2 2 28 LYS HA H -0.629 2.098 11.114 1.00 . B B . 28 LYS HA 1 1 4 3070 2 2 28 LYS HB2 H -2.568 3.215 12.887 1.00 . B B . 28 LYS HB2 1 1 4 3071 2 2 28 LYS HB3 H -1.243 2.581 13.856 1.00 . B B . 28 LYS HB3 1 1 4 3072 2 2 28 LYS HD2 H -0.555 5.535 10.875 1.00 . B B . 28 LYS HD2 1 1 4 3073 2 2 28 LYS HD3 H -0.866 3.877 10.356 1.00 . B B . 28 LYS HD3 1 1 4 3074 2 2 28 LYS HE2 H -2.885 5.342 10.177 1.00 . B B . 28 LYS HE2 1 1 4 3075 2 2 28 LYS HE3 H -3.126 3.968 11.255 1.00 . B B . 28 LYS HE3 1 1 4 3076 2 2 28 LYS HG2 H -0.772 4.898 13.211 1.00 . B B . 28 LYS HG2 1 1 4 3077 2 2 28 LYS HG3 H 0.376 3.802 12.440 1.00 . B B . 28 LYS HG3 1 1 4 3078 2 2 28 LYS HZ1 H -2.066 6.364 12.496 1.00 . B B . 28 LYS HZ1 1 1 4 3079 2 2 28 LYS HZ2 H -3.251 5.281 13.053 1.00 . B B . 28 LYS HZ2 1 1 4 3080 2 2 28 LYS HZ3 H -3.659 6.489 11.928 1.00 . B B . 28 LYS HZ3 1 1 4 3081 2 2 28 LYS N N -2.630 1.431 11.223 1.00 . B B . 28 LYS N 1 1 4 3082 2 2 28 LYS NZ N -2.917 5.828 12.232 1.00 . B B . 28 LYS NZ 1 1 4 3083 2 2 28 LYS O O 0.359 0.177 12.371 1.00 . B B . 28 LYS O 1 1 4 3084 2 2 29 PRO C C -1.234 -2.355 13.726 1.00 . B B . 29 PRO C 1 1 4 3085 2 2 29 PRO CA C -1.055 -1.011 14.438 1.00 . B B . 29 PRO CA 1 1 4 3086 2 2 29 PRO CB C -1.976 -0.910 15.653 1.00 . B B . 29 PRO CB 1 1 4 3087 2 2 29 PRO CD C -2.864 0.589 13.907 1.00 . B B . 29 PRO CD 1 1 4 3088 2 2 29 PRO CG C -3.248 -0.172 15.182 1.00 . B B . 29 PRO CG 1 1 4 3089 2 2 29 PRO HA H -0.031 -0.872 14.741 1.00 . B B . 29 PRO HA 1 1 4 3090 2 2 29 PRO HB2 H -2.223 -1.893 16.019 1.00 . B B . 29 PRO HB2 1 1 4 3091 2 2 29 PRO HB3 H -1.495 -0.329 16.424 1.00 . B B . 29 PRO HB3 1 1 4 3092 2 2 29 PRO HD2 H -3.554 0.347 13.112 1.00 . B B . 29 PRO HD2 1 1 4 3093 2 2 29 PRO HD3 H -2.854 1.645 14.097 1.00 . B B . 29 PRO HD3 1 1 4 3094 2 2 29 PRO HG2 H -4.031 -0.887 14.970 1.00 . B B . 29 PRO HG2 1 1 4 3095 2 2 29 PRO HG3 H -3.574 0.525 15.938 1.00 . B B . 29 PRO HG3 1 1 4 3096 2 2 29 PRO N N -1.503 0.098 13.587 1.00 . B B . 29 PRO N 1 1 4 3097 2 2 29 PRO O O -1.749 -2.425 12.628 1.00 . B B . 29 PRO O 1 1 4 3098 2 2 30 THR C C -2.292 -5.375 14.105 1.00 . B B . 30 THR C 1 1 4 3099 2 2 30 THR CA C -0.947 -4.761 13.714 1.00 . B B . 30 THR CA 1 1 4 3100 2 2 30 THR CB C 0.189 -5.668 14.195 1.00 . B B . 30 THR CB 1 1 4 3101 2 2 30 THR CG2 C 1.228 -5.821 13.084 1.00 . B B . 30 THR CG2 1 1 4 3102 2 2 30 THR H H -0.394 -3.338 15.232 1.00 . B B . 30 THR H 1 1 4 3103 2 2 30 THR HA H -0.896 -4.660 12.640 1.00 . B B . 30 THR HA 1 1 4 3104 2 2 30 THR HB H -0.208 -6.638 14.449 1.00 . B B . 30 THR HB 1 1 4 3105 2 2 30 THR HG1 H 0.615 -5.655 16.093 1.00 . B B . 30 THR HG1 1 1 4 3106 2 2 30 THR HG21 H 0.991 -5.146 12.274 1.00 . B B . 30 THR HG21 1 1 4 3107 2 2 30 THR HG22 H 1.218 -6.838 12.720 1.00 . B B . 30 THR HG22 1 1 4 3108 2 2 30 THR HG23 H 2.209 -5.588 13.473 1.00 . B B . 30 THR HG23 1 1 4 3109 2 2 30 THR N N -0.808 -3.420 14.347 1.00 . B B . 30 THR N 1 1 4 3110 2 2 30 THR O O -2.972 -5.875 13.223 1.00 . B B . 30 THR O 1 1 4 3111 2 2 30 THR OXT O -2.620 -5.335 15.280 1.00 . B B . 30 THR OXT 1 1 4 3112 2 2 30 THR OG1 O 0.799 -5.089 15.340 1.00 . B B . 30 THR OG1 1 1 5 3113 1 1 1 GLY C C 0.290 -4.470 7.697 1.00 . A A . 1 GLY C 1 1 5 3114 1 1 1 GLY CA C -0.279 -4.524 9.074 1.00 . A A . 1 GLY CA 1 1 5 3115 1 1 1 GLY H1 H -0.879 -2.746 10.051 1.00 . A A . 1 GLY H1 1 1 5 3116 1 1 1 GLY H2 H -2.060 -3.967 10.073 1.00 . A A . 1 GLY H2 1 1 5 3117 1 1 1 GLY H3 H -1.773 -3.086 8.649 1.00 . A A . 1 GLY H3 1 1 5 3118 1 1 1 GLY HA2 H 0.615 -4.240 9.339 1.00 . A A . 1 GLY HA2 1 1 5 3119 1 1 1 GLY HA3 H -0.591 -5.546 9.544 1.00 . A A . 1 GLY HA3 1 1 5 3120 1 1 1 GLY N N -1.332 -3.499 9.495 1.00 . A A . 1 GLY N 1 1 5 3121 1 1 1 GLY O O 0.943 -5.392 7.248 1.00 . A A . 1 GLY O 1 1 5 3122 1 1 2 ILE C C 1.908 -2.466 5.627 1.00 . A A . 2 ILE C 1 1 5 3123 1 1 2 ILE CA C 0.619 -3.290 5.608 1.00 . A A . 2 ILE CA 1 1 5 3124 1 1 2 ILE CB C -0.412 -2.662 4.650 1.00 . A A . 2 ILE CB 1 1 5 3125 1 1 2 ILE CD1 C -0.660 -1.429 2.486 1.00 . A A . 2 ILE CD1 1 1 5 3126 1 1 2 ILE CG1 C 0.284 -2.279 3.338 1.00 . A A . 2 ILE CG1 1 1 5 3127 1 1 2 ILE CG2 C -1.054 -1.411 5.265 1.00 . A A . 2 ILE CG2 1 1 5 3128 1 1 2 ILE H H -0.458 -2.662 7.372 1.00 . A A . 2 ILE H 1 1 5 3129 1 1 2 ILE HA H 0.857 -4.278 5.261 1.00 . A A . 2 ILE HA 1 1 5 3130 1 1 2 ILE HB H -1.186 -3.387 4.441 1.00 . A A . 2 ILE HB 1 1 5 3131 1 1 2 ILE HD11 H -0.699 -0.425 2.883 1.00 . A A . 2 ILE HD11 1 1 5 3132 1 1 2 ILE HD12 H -1.648 -1.862 2.503 1.00 . A A . 2 ILE HD12 1 1 5 3133 1 1 2 ILE HD13 H -0.297 -1.399 1.469 1.00 . A A . 2 ILE HD13 1 1 5 3134 1 1 2 ILE HG12 H 1.178 -1.714 3.555 1.00 . A A . 2 ILE HG12 1 1 5 3135 1 1 2 ILE HG13 H 0.546 -3.175 2.795 1.00 . A A . 2 ILE HG13 1 1 5 3136 1 1 2 ILE HG21 H -0.703 -0.534 4.743 1.00 . A A . 2 ILE HG21 1 1 5 3137 1 1 2 ILE HG22 H -0.789 -1.335 6.306 1.00 . A A . 2 ILE HG22 1 1 5 3138 1 1 2 ILE HG23 H -2.128 -1.476 5.173 1.00 . A A . 2 ILE HG23 1 1 5 3139 1 1 2 ILE N N 0.066 -3.394 6.991 1.00 . A A . 2 ILE N 1 1 5 3140 1 1 2 ILE O O 2.975 -2.966 5.338 1.00 . A A . 2 ILE O 1 1 5 3141 1 1 3 ABA C C 4.105 -1.018 6.870 1.00 . A A . 3 ABA C 1 1 5 3142 1 1 3 ABA CA C 3.034 -0.362 6.004 1.00 . A A . 3 ABA CA 1 1 5 3143 1 1 3 ABA CB C 2.665 1.003 6.580 1.00 . A A . 3 ABA CB 1 1 5 3144 1 1 3 ABA CG C 1.896 0.821 7.889 1.00 . A A . 3 ABA CG 1 1 5 3145 1 1 3 ABA H H 0.966 -0.835 6.192 1.00 . A A . 3 ABA H 1 1 5 3146 1 1 3 ABA HA H 3.414 -0.239 5.008 1.00 . A A . 3 ABA HA 1 1 5 3147 1 1 3 ABA HB2 H 3.562 1.560 6.768 1.00 . A A . 3 ABA HB2 1 1 5 3148 1 1 3 ABA HB3 H 2.049 1.538 5.874 1.00 . A A . 3 ABA HB3 1 1 5 3149 1 1 3 ABA HG1 H 1.629 1.790 8.286 1.00 . A A . 3 ABA HG1 1 1 5 3150 1 1 3 ABA HG2 H 2.516 0.299 8.602 1.00 . A A . 3 ABA HG2 1 1 5 3151 1 1 3 ABA HG3 H 1.000 0.249 7.704 1.00 . A A . 3 ABA HG3 1 1 5 3152 1 1 3 ABA N N 1.823 -1.215 5.965 1.00 . A A . 3 ABA N 1 1 5 3153 1 1 3 ABA O O 5.256 -1.053 6.528 1.00 . A A . 3 ABA O 1 1 5 3154 1 1 4 GLU C C 5.578 -3.164 7.950 1.00 . A A . 4 GLU C 1 1 5 3155 1 1 4 GLU CA C 4.774 -2.198 8.829 1.00 . A A . 4 GLU CA 1 1 5 3156 1 1 4 GLU CB C 4.065 -2.930 9.969 1.00 . A A . 4 GLU CB 1 1 5 3157 1 1 4 GLU CD C 4.585 -4.573 11.780 1.00 . A A . 4 GLU CD 1 1 5 3158 1 1 4 GLU CG C 4.774 -4.243 10.298 1.00 . A A . 4 GLU CG 1 1 5 3159 1 1 4 GLU H H 2.813 -1.537 8.261 1.00 . A A . 4 GLU H 1 1 5 3160 1 1 4 GLU HA H 5.434 -1.445 9.236 1.00 . A A . 4 GLU HA 1 1 5 3161 1 1 4 GLU HB2 H 4.059 -2.296 10.843 1.00 . A A . 4 GLU HB2 1 1 5 3162 1 1 4 GLU HB3 H 3.052 -3.135 9.670 1.00 . A A . 4 GLU HB3 1 1 5 3163 1 1 4 GLU HG2 H 4.354 -5.034 9.693 1.00 . A A . 4 GLU HG2 1 1 5 3164 1 1 4 GLU HG3 H 5.826 -4.144 10.083 1.00 . A A . 4 GLU HG3 1 1 5 3165 1 1 4 GLU N N 3.747 -1.550 7.984 1.00 . A A . 4 GLU N 1 1 5 3166 1 1 4 GLU O O 6.741 -3.422 8.190 1.00 . A A . 4 GLU O 1 1 5 3167 1 1 4 GLU OE1 O 5.289 -3.994 12.591 1.00 . A A . 4 GLU OE1 1 1 5 3168 1 1 4 GLU OE2 O 3.738 -5.399 12.078 1.00 . A A . 4 GLU OE2 1 1 5 3169 1 1 5 GLN C C 5.991 -3.919 4.696 1.00 . A A . 5 GLN C 1 1 5 3170 1 1 5 GLN CA C 5.676 -4.630 6.018 1.00 . A A . 5 GLN CA 1 1 5 3171 1 1 5 GLN CB C 4.786 -5.846 5.750 1.00 . A A . 5 GLN CB 1 1 5 3172 1 1 5 GLN CD C 5.005 -8.231 6.461 1.00 . A A . 5 GLN CD 1 1 5 3173 1 1 5 GLN CG C 5.652 -7.104 5.653 1.00 . A A . 5 GLN CG 1 1 5 3174 1 1 5 GLN H H 4.025 -3.458 6.752 1.00 . A A . 5 GLN H 1 1 5 3175 1 1 5 GLN HA H 6.595 -4.951 6.482 1.00 . A A . 5 GLN HA 1 1 5 3176 1 1 5 GLN HB2 H 4.078 -5.957 6.559 1.00 . A A . 5 GLN HB2 1 1 5 3177 1 1 5 GLN HB3 H 4.252 -5.704 4.822 1.00 . A A . 5 GLN HB3 1 1 5 3178 1 1 5 GLN HE21 H 6.393 -8.206 7.881 1.00 . A A . 5 GLN HE21 1 1 5 3179 1 1 5 GLN HE22 H 5.156 -9.348 8.096 1.00 . A A . 5 GLN HE22 1 1 5 3180 1 1 5 GLN HG2 H 5.738 -7.405 4.619 1.00 . A A . 5 GLN HG2 1 1 5 3181 1 1 5 GLN HG3 H 6.634 -6.897 6.051 1.00 . A A . 5 GLN HG3 1 1 5 3182 1 1 5 GLN N N 4.961 -3.690 6.927 1.00 . A A . 5 GLN N 1 1 5 3183 1 1 5 GLN NE2 N 5.565 -8.628 7.571 1.00 . A A . 5 GLN NE2 1 1 5 3184 1 1 5 GLN O O 6.990 -4.184 4.057 1.00 . A A . 5 GLN O 1 1 5 3185 1 1 5 GLN OE1 O 3.978 -8.756 6.078 1.00 . A A . 5 GLN OE1 1 1 5 3186 1 1 6 CYS C C 6.162 -1.002 3.320 1.00 . A A . 6 CYS C 1 1 5 3187 1 1 6 CYS CA C 5.362 -2.277 3.022 1.00 . A A . 6 CYS CA 1 1 5 3188 1 1 6 CYS CB C 3.986 -1.936 2.451 1.00 . A A . 6 CYS CB 1 1 5 3189 1 1 6 CYS H H 4.344 -2.817 4.815 1.00 . A A . 6 CYS H 1 1 5 3190 1 1 6 CYS HA H 5.904 -2.897 2.324 1.00 . A A . 6 CYS HA 1 1 5 3191 1 1 6 CYS HB2 H 3.406 -1.418 3.202 1.00 . A A . 6 CYS HB2 1 1 5 3192 1 1 6 CYS HB3 H 4.087 -1.315 1.595 1.00 . A A . 6 CYS HB3 1 1 5 3193 1 1 6 CYS N N 5.141 -3.015 4.287 1.00 . A A . 6 CYS N 1 1 5 3194 1 1 6 CYS O O 6.651 -0.333 2.431 1.00 . A A . 6 CYS O 1 1 5 3195 1 1 6 CYS SG S 3.144 -3.475 1.999 1.00 . A A . 6 CYS SG 1 1 5 3196 1 1 7 CYS C C 8.452 0.085 5.492 1.00 . A A . 7 CYS C 1 1 5 3197 1 1 7 CYS CA C 7.074 0.528 4.987 1.00 . A A . 7 CYS CA 1 1 5 3198 1 1 7 CYS CB C 6.333 1.270 6.106 1.00 . A A . 7 CYS CB 1 1 5 3199 1 1 7 CYS H H 5.905 -1.247 5.269 1.00 . A A . 7 CYS H 1 1 5 3200 1 1 7 CYS HA H 7.193 1.183 4.144 1.00 . A A . 7 CYS HA 1 1 5 3201 1 1 7 CYS HB2 H 5.333 1.516 5.784 1.00 . A A . 7 CYS HB2 1 1 5 3202 1 1 7 CYS HB3 H 6.275 0.648 6.974 1.00 . A A . 7 CYS HB3 1 1 5 3203 1 1 7 CYS N N 6.304 -0.680 4.578 1.00 . A A . 7 CYS N 1 1 5 3204 1 1 7 CYS O O 9.426 0.801 5.370 1.00 . A A . 7 CYS O 1 1 5 3205 1 1 7 CYS SG S 7.233 2.787 6.521 1.00 . A A . 7 CYS SG 1 1 5 3206 1 1 8 THR C C 10.547 -2.356 5.411 1.00 . A A . 8 THR C 1 1 5 3207 1 1 8 THR CA C 9.865 -1.587 6.539 1.00 . A A . 8 THR CA 1 1 5 3208 1 1 8 THR CB C 9.661 -2.515 7.740 1.00 . A A . 8 THR CB 1 1 5 3209 1 1 8 THR CG2 C 8.913 -1.768 8.845 1.00 . A A . 8 THR CG2 1 1 5 3210 1 1 8 THR H H 7.752 -1.675 6.128 1.00 . A A . 8 THR H 1 1 5 3211 1 1 8 THR HA H 10.479 -0.746 6.829 1.00 . A A . 8 THR HA 1 1 5 3212 1 1 8 THR HB H 10.620 -2.836 8.114 1.00 . A A . 8 THR HB 1 1 5 3213 1 1 8 THR HG1 H 8.381 -3.937 8.085 1.00 . A A . 8 THR HG1 1 1 5 3214 1 1 8 THR HG21 H 8.330 -0.970 8.409 1.00 . A A . 8 THR HG21 1 1 5 3215 1 1 8 THR HG22 H 9.623 -1.355 9.546 1.00 . A A . 8 THR HG22 1 1 5 3216 1 1 8 THR HG23 H 8.256 -2.453 9.361 1.00 . A A . 8 THR HG23 1 1 5 3217 1 1 8 THR N N 8.546 -1.100 6.047 1.00 . A A . 8 THR N 1 1 5 3218 1 1 8 THR O O 11.754 -2.480 5.363 1.00 . A A . 8 THR O 1 1 5 3219 1 1 8 THR OG1 O 8.906 -3.648 7.335 1.00 . A A . 8 THR OG1 1 1 5 3220 1 1 9 SER C C 9.888 -2.964 2.047 1.00 . A A . 9 SER C 1 1 5 3221 1 1 9 SER CA C 10.350 -3.621 3.351 1.00 . A A . 9 SER CA 1 1 5 3222 1 1 9 SER CB C 9.874 -5.075 3.404 1.00 . A A . 9 SER CB 1 1 5 3223 1 1 9 SER H H 8.799 -2.741 4.557 1.00 . A A . 9 SER H 1 1 5 3224 1 1 9 SER HA H 11.429 -3.590 3.408 1.00 . A A . 9 SER HA 1 1 5 3225 1 1 9 SER HB2 H 8.868 -5.142 3.025 1.00 . A A . 9 SER HB2 1 1 5 3226 1 1 9 SER HB3 H 10.526 -5.689 2.796 1.00 . A A . 9 SER HB3 1 1 5 3227 1 1 9 SER HG H 10.776 -5.869 4.933 1.00 . A A . 9 SER HG 1 1 5 3228 1 1 9 SER N N 9.771 -2.865 4.495 1.00 . A A . 9 SER N 1 1 5 3229 1 1 9 SER O O 9.841 -1.754 1.940 1.00 . A A . 9 SER O 1 1 5 3230 1 1 9 SER OG O 9.897 -5.526 4.751 1.00 . A A . 9 SER OG 1 1 5 3231 1 1 10 ILE C C 7.657 -3.612 -0.525 1.00 . A A . 10 ILE C 1 1 5 3232 1 1 10 ILE CA C 9.082 -3.139 -0.227 1.00 . A A . 10 ILE CA 1 1 5 3233 1 1 10 ILE CB C 10.025 -3.574 -1.357 1.00 . A A . 10 ILE CB 1 1 5 3234 1 1 10 ILE CD1 C 12.291 -3.233 -0.369 1.00 . A A . 10 ILE CD1 1 1 5 3235 1 1 10 ILE CG1 C 11.261 -2.679 -1.354 1.00 . A A . 10 ILE CG1 1 1 5 3236 1 1 10 ILE CG2 C 9.319 -3.455 -2.711 1.00 . A A . 10 ILE CG2 1 1 5 3237 1 1 10 ILE H H 9.581 -4.713 1.152 1.00 . A A . 10 ILE H 1 1 5 3238 1 1 10 ILE HA H 9.093 -2.062 -0.143 1.00 . A A . 10 ILE HA 1 1 5 3239 1 1 10 ILE HB H 10.326 -4.597 -1.199 1.00 . A A . 10 ILE HB 1 1 5 3240 1 1 10 ILE HD11 H 12.862 -2.418 0.050 1.00 . A A . 10 ILE HD11 1 1 5 3241 1 1 10 ILE HD12 H 12.954 -3.910 -0.885 1.00 . A A . 10 ILE HD12 1 1 5 3242 1 1 10 ILE HD13 H 11.782 -3.761 0.424 1.00 . A A . 10 ILE HD13 1 1 5 3243 1 1 10 ILE HG12 H 11.687 -2.656 -2.346 1.00 . A A . 10 ILE HG12 1 1 5 3244 1 1 10 ILE HG13 H 10.981 -1.682 -1.057 1.00 . A A . 10 ILE HG13 1 1 5 3245 1 1 10 ILE HG21 H 8.432 -4.071 -2.709 1.00 . A A . 10 ILE HG21 1 1 5 3246 1 1 10 ILE HG22 H 9.985 -3.785 -3.495 1.00 . A A . 10 ILE HG22 1 1 5 3247 1 1 10 ILE HG23 H 9.042 -2.425 -2.883 1.00 . A A . 10 ILE HG23 1 1 5 3248 1 1 10 ILE N N 9.541 -3.739 1.056 1.00 . A A . 10 ILE N 1 1 5 3249 1 1 10 ILE O O 7.284 -4.726 -0.216 1.00 . A A . 10 ILE O 1 1 5 3250 1 1 11 CYS C C 5.195 -2.947 -2.950 1.00 . A A . 11 CYS C 1 1 5 3251 1 1 11 CYS CA C 5.463 -3.189 -1.462 1.00 . A A . 11 CYS CA 1 1 5 3252 1 1 11 CYS CB C 4.473 -2.425 -0.588 1.00 . A A . 11 CYS CB 1 1 5 3253 1 1 11 CYS H H 7.188 -1.879 -1.383 1.00 . A A . 11 CYS H 1 1 5 3254 1 1 11 CYS HA H 5.346 -4.238 -1.265 1.00 . A A . 11 CYS HA 1 1 5 3255 1 1 11 CYS HB2 H 4.995 -2.013 0.259 1.00 . A A . 11 CYS HB2 1 1 5 3256 1 1 11 CYS HB3 H 4.015 -1.632 -1.159 1.00 . A A . 11 CYS HB3 1 1 5 3257 1 1 11 CYS N N 6.861 -2.776 -1.133 1.00 . A A . 11 CYS N 1 1 5 3258 1 1 11 CYS O O 5.328 -1.848 -3.451 1.00 . A A . 11 CYS O 1 1 5 3259 1 1 11 CYS SG S 3.201 -3.591 -0.024 1.00 . A A . 11 CYS SG 1 1 5 3260 1 1 12 SER C C 3.220 -3.286 -5.402 1.00 . A A . 12 SER C 1 1 5 3261 1 1 12 SER CA C 4.602 -3.870 -5.130 1.00 . A A . 12 SER CA 1 1 5 3262 1 1 12 SER CB C 4.697 -5.256 -5.767 1.00 . A A . 12 SER CB 1 1 5 3263 1 1 12 SER H H 4.775 -4.867 -3.231 1.00 . A A . 12 SER H 1 1 5 3264 1 1 12 SER HA H 5.346 -3.227 -5.573 1.00 . A A . 12 SER HA 1 1 5 3265 1 1 12 SER HB2 H 3.929 -5.365 -6.514 1.00 . A A . 12 SER HB2 1 1 5 3266 1 1 12 SER HB3 H 5.667 -5.372 -6.231 1.00 . A A . 12 SER HB3 1 1 5 3267 1 1 12 SER HG H 4.267 -7.066 -5.196 1.00 . A A . 12 SER HG 1 1 5 3268 1 1 12 SER N N 4.849 -3.991 -3.662 1.00 . A A . 12 SER N 1 1 5 3269 1 1 12 SER O O 2.322 -3.349 -4.588 1.00 . A A . 12 SER O 1 1 5 3270 1 1 12 SER OG O 4.516 -6.246 -4.763 1.00 . A A . 12 SER OG 1 1 5 3271 1 1 13 LEU C C 0.645 -3.143 -6.943 1.00 . A A . 13 LEU C 1 1 5 3272 1 1 13 LEU CA C 1.762 -2.099 -6.944 1.00 . A A . 13 LEU CA 1 1 5 3273 1 1 13 LEU CB C 1.893 -1.514 -8.346 1.00 . A A . 13 LEU CB 1 1 5 3274 1 1 13 LEU CD1 C 1.596 -2.416 -10.649 1.00 . A A . 13 LEU CD1 1 1 5 3275 1 1 13 LEU CD2 C 3.790 -2.660 -9.496 1.00 . A A . 13 LEU CD2 1 1 5 3276 1 1 13 LEU CG C 2.274 -2.638 -9.302 1.00 . A A . 13 LEU CG 1 1 5 3277 1 1 13 LEU H H 3.813 -2.683 -7.186 1.00 . A A . 13 LEU H 1 1 5 3278 1 1 13 LEU HA H 1.518 -1.316 -6.251 1.00 . A A . 13 LEU HA 1 1 5 3279 1 1 13 LEU HB2 H 0.950 -1.081 -8.648 1.00 . A A . 13 LEU HB2 1 1 5 3280 1 1 13 LEU HB3 H 2.661 -0.756 -8.355 1.00 . A A . 13 LEU HB3 1 1 5 3281 1 1 13 LEU HD11 H 2.052 -1.573 -11.144 1.00 . A A . 13 LEU HD11 1 1 5 3282 1 1 13 LEU HD12 H 0.547 -2.221 -10.493 1.00 . A A . 13 LEU HD12 1 1 5 3283 1 1 13 LEU HD13 H 1.714 -3.300 -11.258 1.00 . A A . 13 LEU HD13 1 1 5 3284 1 1 13 LEU HD21 H 4.016 -2.736 -10.548 1.00 . A A . 13 LEU HD21 1 1 5 3285 1 1 13 LEU HD22 H 4.205 -3.510 -8.975 1.00 . A A . 13 LEU HD22 1 1 5 3286 1 1 13 LEU HD23 H 4.215 -1.751 -9.099 1.00 . A A . 13 LEU HD23 1 1 5 3287 1 1 13 LEU HG H 1.949 -3.579 -8.884 1.00 . A A . 13 LEU HG 1 1 5 3288 1 1 13 LEU N N 3.061 -2.714 -6.560 1.00 . A A . 13 LEU N 1 1 5 3289 1 1 13 LEU O O -0.520 -2.807 -7.031 1.00 . A A . 13 LEU O 1 1 5 3290 1 1 14 TYR C C -0.316 -5.778 -5.344 1.00 . A A . 14 TYR C 1 1 5 3291 1 1 14 TYR CA C -0.113 -5.417 -6.791 1.00 . A A . 14 TYR CA 1 1 5 3292 1 1 14 TYR CB C 0.299 -6.649 -7.599 1.00 . A A . 14 TYR CB 1 1 5 3293 1 1 14 TYR CD1 C -2.006 -7.640 -7.338 1.00 . A A . 14 TYR CD1 1 1 5 3294 1 1 14 TYR CD2 C -0.077 -9.032 -6.857 1.00 . A A . 14 TYR CD2 1 1 5 3295 1 1 14 TYR CE1 C -2.856 -8.708 -7.020 1.00 . A A . 14 TYR CE1 1 1 5 3296 1 1 14 TYR CE2 C -0.928 -10.100 -6.539 1.00 . A A . 14 TYR CE2 1 1 5 3297 1 1 14 TYR CG C -0.616 -7.802 -7.257 1.00 . A A . 14 TYR CG 1 1 5 3298 1 1 14 TYR CZ C -2.317 -9.937 -6.621 1.00 . A A . 14 TYR CZ 1 1 5 3299 1 1 14 TYR H H 1.906 -4.672 -6.713 1.00 . A A . 14 TYR H 1 1 5 3300 1 1 14 TYR HA H -1.020 -4.993 -7.183 1.00 . A A . 14 TYR HA 1 1 5 3301 1 1 14 TYR HB2 H 0.224 -6.427 -8.654 1.00 . A A . 14 TYR HB2 1 1 5 3302 1 1 14 TYR HB3 H 1.318 -6.913 -7.359 1.00 . A A . 14 TYR HB3 1 1 5 3303 1 1 14 TYR HD1 H -2.422 -6.693 -7.646 1.00 . A A . 14 TYR HD1 1 1 5 3304 1 1 14 TYR HD2 H 0.994 -9.158 -6.793 1.00 . A A . 14 TYR HD2 1 1 5 3305 1 1 14 TYR HE1 H -3.927 -8.582 -7.083 1.00 . A A . 14 TYR HE1 1 1 5 3306 1 1 14 TYR HE2 H -0.512 -11.048 -6.232 1.00 . A A . 14 TYR HE2 1 1 5 3307 1 1 14 TYR HH H -3.185 -11.577 -7.067 1.00 . A A . 14 TYR HH 1 1 5 3308 1 1 14 TYR N N 0.966 -4.399 -6.819 1.00 . A A . 14 TYR N 1 1 5 3309 1 1 14 TYR O O -1.419 -5.920 -4.855 1.00 . A A . 14 TYR O 1 1 5 3310 1 1 14 TYR OH O -3.155 -10.988 -6.310 1.00 . A A . 14 TYR OH 1 1 5 3311 1 1 15 GLN C C -0.077 -4.996 -2.577 1.00 . A A . 15 GLN C 1 1 5 3312 1 1 15 GLN CA C 0.700 -6.140 -3.211 1.00 . A A . 15 GLN CA 1 1 5 3313 1 1 15 GLN CB C 2.125 -6.139 -2.689 1.00 . A A . 15 GLN CB 1 1 5 3314 1 1 15 GLN CD C 2.291 -8.022 -1.059 1.00 . A A . 15 GLN CD 1 1 5 3315 1 1 15 GLN CG C 2.603 -7.573 -2.487 1.00 . A A . 15 GLN CG 1 1 5 3316 1 1 15 GLN H H 1.630 -5.696 -5.074 1.00 . A A . 15 GLN H 1 1 5 3317 1 1 15 GLN HA H 0.217 -7.086 -3.020 1.00 . A A . 15 GLN HA 1 1 5 3318 1 1 15 GLN HB2 H 2.761 -5.645 -3.417 1.00 . A A . 15 GLN HB2 1 1 5 3319 1 1 15 GLN HB3 H 2.163 -5.605 -1.759 1.00 . A A . 15 GLN HB3 1 1 5 3320 1 1 15 GLN HE21 H 0.853 -6.677 -0.799 1.00 . A A . 15 GLN HE21 1 1 5 3321 1 1 15 GLN HE22 H 1.143 -7.695 0.528 1.00 . A A . 15 GLN HE22 1 1 5 3322 1 1 15 GLN HG2 H 2.098 -8.218 -3.190 1.00 . A A . 15 GLN HG2 1 1 5 3323 1 1 15 GLN HG3 H 3.669 -7.620 -2.655 1.00 . A A . 15 GLN HG3 1 1 5 3324 1 1 15 GLN N N 0.763 -5.863 -4.648 1.00 . A A . 15 GLN N 1 1 5 3325 1 1 15 GLN NE2 N 1.351 -7.414 -0.388 1.00 . A A . 15 GLN NE2 1 1 5 3326 1 1 15 GLN O O -0.786 -5.154 -1.603 1.00 . A A . 15 GLN O 1 1 5 3327 1 1 15 GLN OE1 O 2.910 -8.934 -0.548 1.00 . A A . 15 GLN OE1 1 1 5 3328 1 1 16 LEU C C -2.070 -2.675 -3.221 1.00 . A A . 16 LEU C 1 1 5 3329 1 1 16 LEU CA C -0.667 -2.648 -2.655 1.00 . A A . 16 LEU CA 1 1 5 3330 1 1 16 LEU CB C 0.097 -1.407 -3.107 1.00 . A A . 16 LEU CB 1 1 5 3331 1 1 16 LEU CD1 C 2.294 -0.220 -2.834 1.00 . A A . 16 LEU CD1 1 1 5 3332 1 1 16 LEU CD2 C 1.333 -1.542 -0.955 1.00 . A A . 16 LEU CD2 1 1 5 3333 1 1 16 LEU CG C 1.486 -1.460 -2.469 1.00 . A A . 16 LEU CG 1 1 5 3334 1 1 16 LEU H H 0.608 -3.757 -3.967 1.00 . A A . 16 LEU H 1 1 5 3335 1 1 16 LEU HA H -0.713 -2.675 -1.580 1.00 . A A . 16 LEU HA 1 1 5 3336 1 1 16 LEU HB2 H 0.189 -1.403 -4.184 1.00 . A A . 16 LEU HB2 1 1 5 3337 1 1 16 LEU HB3 H -0.419 -0.522 -2.783 1.00 . A A . 16 LEU HB3 1 1 5 3338 1 1 16 LEU HD11 H 2.141 0.541 -2.084 1.00 . A A . 16 LEU HD11 1 1 5 3339 1 1 16 LEU HD12 H 1.973 0.147 -3.795 1.00 . A A . 16 LEU HD12 1 1 5 3340 1 1 16 LEU HD13 H 3.343 -0.477 -2.876 1.00 . A A . 16 LEU HD13 1 1 5 3341 1 1 16 LEU HD21 H 0.587 -0.838 -0.629 1.00 . A A . 16 LEU HD21 1 1 5 3342 1 1 16 LEU HD22 H 2.279 -1.313 -0.487 1.00 . A A . 16 LEU HD22 1 1 5 3343 1 1 16 LEU HD23 H 1.030 -2.543 -0.681 1.00 . A A . 16 LEU HD23 1 1 5 3344 1 1 16 LEU HG H 2.006 -2.338 -2.819 1.00 . A A . 16 LEU HG 1 1 5 3345 1 1 16 LEU N N 0.048 -3.838 -3.163 1.00 . A A . 16 LEU N 1 1 5 3346 1 1 16 LEU O O -3.004 -2.155 -2.642 1.00 . A A . 16 LEU O 1 1 5 3347 1 1 17 GLU C C -4.362 -4.461 -4.129 1.00 . A A . 17 GLU C 1 1 5 3348 1 1 17 GLU CA C -3.562 -3.445 -4.941 1.00 . A A . 17 GLU CA 1 1 5 3349 1 1 17 GLU CB C -3.401 -3.942 -6.375 1.00 . A A . 17 GLU CB 1 1 5 3350 1 1 17 GLU CD C -4.590 -4.328 -8.539 1.00 . A A . 17 GLU CD 1 1 5 3351 1 1 17 GLU CG C -4.769 -3.986 -7.059 1.00 . A A . 17 GLU CG 1 1 5 3352 1 1 17 GLU H H -1.459 -3.762 -4.758 1.00 . A A . 17 GLU H 1 1 5 3353 1 1 17 GLU HA H -4.058 -2.489 -4.935 1.00 . A A . 17 GLU HA 1 1 5 3354 1 1 17 GLU HB2 H -2.743 -3.275 -6.912 1.00 . A A . 17 GLU HB2 1 1 5 3355 1 1 17 GLU HB3 H -2.972 -4.933 -6.361 1.00 . A A . 17 GLU HB3 1 1 5 3356 1 1 17 GLU HG2 H -5.383 -4.739 -6.586 1.00 . A A . 17 GLU HG2 1 1 5 3357 1 1 17 GLU HG3 H -5.248 -3.023 -6.968 1.00 . A A . 17 GLU HG3 1 1 5 3358 1 1 17 GLU N N -2.226 -3.324 -4.333 1.00 . A A . 17 GLU N 1 1 5 3359 1 1 17 GLU O O -5.577 -4.499 -4.171 1.00 . A A . 17 GLU O 1 1 5 3360 1 1 17 GLU OE1 O -4.269 -3.429 -9.299 1.00 . A A . 17 GLU OE1 1 1 5 3361 1 1 17 GLU OE2 O -4.777 -5.482 -8.887 1.00 . A A . 17 GLU OE2 1 1 5 3362 1 1 18 ASN C C -4.996 -5.662 -1.328 1.00 . A A . 18 ASN C 1 1 5 3363 1 1 18 ASN CA C -4.398 -6.315 -2.574 1.00 . A A . 18 ASN CA 1 1 5 3364 1 1 18 ASN CB C -3.418 -7.413 -2.154 1.00 . A A . 18 ASN CB 1 1 5 3365 1 1 18 ASN CG C -2.818 -8.066 -3.400 1.00 . A A . 18 ASN CG 1 1 5 3366 1 1 18 ASN H H -2.696 -5.242 -3.361 1.00 . A A . 18 ASN H 1 1 5 3367 1 1 18 ASN HA H -5.189 -6.748 -3.165 1.00 . A A . 18 ASN HA 1 1 5 3368 1 1 18 ASN HB2 H -2.628 -6.983 -1.556 1.00 . A A . 18 ASN HB2 1 1 5 3369 1 1 18 ASN HB3 H -3.942 -8.160 -1.576 1.00 . A A . 18 ASN HB3 1 1 5 3370 1 1 18 ASN HD21 H -1.339 -8.936 -2.403 1.00 . A A . 18 ASN HD21 1 1 5 3371 1 1 18 ASN HD22 H -1.354 -9.226 -4.075 1.00 . A A . 18 ASN HD22 1 1 5 3372 1 1 18 ASN N N -3.680 -5.292 -3.384 1.00 . A A . 18 ASN N 1 1 5 3373 1 1 18 ASN ND2 N -1.748 -8.804 -3.283 1.00 . A A . 18 ASN ND2 1 1 5 3374 1 1 18 ASN O O -5.607 -6.317 -0.507 1.00 . A A . 18 ASN O 1 1 5 3375 1 1 18 ASN OD1 O -3.327 -7.903 -4.492 1.00 . A A . 18 ASN OD1 1 1 5 3376 1 1 19 TYR C C -6.608 -2.872 -0.338 1.00 . A A . 19 TYR C 1 1 5 3377 1 1 19 TYR CA C -5.377 -3.703 0.032 1.00 . A A . 19 TYR CA 1 1 5 3378 1 1 19 TYR CB C -4.317 -2.786 0.636 1.00 . A A . 19 TYR CB 1 1 5 3379 1 1 19 TYR CD1 C -3.596 -4.421 2.408 1.00 . A A . 19 TYR CD1 1 1 5 3380 1 1 19 TYR CD2 C -1.938 -3.601 0.837 1.00 . A A . 19 TYR CD2 1 1 5 3381 1 1 19 TYR CE1 C -2.618 -5.201 3.035 1.00 . A A . 19 TYR CE1 1 1 5 3382 1 1 19 TYR CE2 C -0.958 -4.383 1.464 1.00 . A A . 19 TYR CE2 1 1 5 3383 1 1 19 TYR CG C -3.258 -3.621 1.310 1.00 . A A . 19 TYR CG 1 1 5 3384 1 1 19 TYR CZ C -1.299 -5.182 2.564 1.00 . A A . 19 TYR CZ 1 1 5 3385 1 1 19 TYR H H -4.321 -3.864 -1.838 1.00 . A A . 19 TYR H 1 1 5 3386 1 1 19 TYR HA H -5.657 -4.448 0.760 1.00 . A A . 19 TYR HA 1 1 5 3387 1 1 19 TYR HB2 H -3.870 -2.190 -0.145 1.00 . A A . 19 TYR HB2 1 1 5 3388 1 1 19 TYR HB3 H -4.780 -2.138 1.365 1.00 . A A . 19 TYR HB3 1 1 5 3389 1 1 19 TYR HD1 H -4.613 -4.434 2.772 1.00 . A A . 19 TYR HD1 1 1 5 3390 1 1 19 TYR HD2 H -1.677 -2.984 -0.010 1.00 . A A . 19 TYR HD2 1 1 5 3391 1 1 19 TYR HE1 H -2.880 -5.817 3.883 1.00 . A A . 19 TYR HE1 1 1 5 3392 1 1 19 TYR HE2 H 0.059 -4.368 1.101 1.00 . A A . 19 TYR HE2 1 1 5 3393 1 1 19 TYR HH H -0.519 -5.956 4.124 1.00 . A A . 19 TYR HH 1 1 5 3394 1 1 19 TYR N N -4.821 -4.379 -1.171 1.00 . A A . 19 TYR N 1 1 5 3395 1 1 19 TYR O O -7.079 -2.076 0.450 1.00 . A A . 19 TYR O 1 1 5 3396 1 1 19 TYR OH O -0.335 -5.953 3.182 1.00 . A A . 19 TYR OH 1 1 5 3397 1 1 20 CYS C C -9.597 -2.884 -1.321 1.00 . A A . 20 CYS C 1 1 5 3398 1 1 20 CYS CA C -8.338 -2.230 -1.892 1.00 . A A . 20 CYS CA 1 1 5 3399 1 1 20 CYS CB C -8.465 -2.138 -3.412 1.00 . A A . 20 CYS CB 1 1 5 3400 1 1 20 CYS H H -6.754 -3.677 -2.153 1.00 . A A . 20 CYS H 1 1 5 3401 1 1 20 CYS HA H -8.239 -1.235 -1.483 1.00 . A A . 20 CYS HA 1 1 5 3402 1 1 20 CYS HB2 H -8.996 -3.000 -3.784 1.00 . A A . 20 CYS HB2 1 1 5 3403 1 1 20 CYS HB3 H -9.011 -1.244 -3.670 1.00 . A A . 20 CYS HB3 1 1 5 3404 1 1 20 CYS N N -7.138 -3.036 -1.520 1.00 . A A . 20 CYS N 1 1 5 3405 1 1 20 CYS O O -9.550 -3.956 -0.751 1.00 . A A . 20 CYS O 1 1 5 3406 1 1 20 CYS SG S -6.822 -2.070 -4.162 1.00 . A A . 20 CYS SG 1 1 5 3407 1 1 21 ASN C C -12.682 -3.633 -2.035 1.00 . A A . 21 ASN C 1 1 5 3408 1 1 21 ASN CA C -11.990 -2.821 -0.939 1.00 . A A . 21 ASN CA 1 1 5 3409 1 1 21 ASN CB C -12.912 -1.688 -0.487 1.00 . A A . 21 ASN CB 1 1 5 3410 1 1 21 ASN CG C -13.841 -2.193 0.618 1.00 . A A . 21 ASN CG 1 1 5 3411 1 1 21 ASN H H -10.737 -1.381 -1.935 1.00 . A A . 21 ASN H 1 1 5 3412 1 1 21 ASN HA H -11.769 -3.464 -0.100 1.00 . A A . 21 ASN HA 1 1 5 3413 1 1 21 ASN HB2 H -12.315 -0.869 -0.110 1.00 . A A . 21 ASN HB2 1 1 5 3414 1 1 21 ASN HB3 H -13.502 -1.349 -1.324 1.00 . A A . 21 ASN HB3 1 1 5 3415 1 1 21 ASN HD21 H -14.789 -0.459 0.805 1.00 . A A . 21 ASN HD21 1 1 5 3416 1 1 21 ASN HD22 H -15.326 -1.694 1.838 1.00 . A A . 21 ASN HD22 1 1 5 3417 1 1 21 ASN N N -10.724 -2.244 -1.471 1.00 . A A . 21 ASN N 1 1 5 3418 1 1 21 ASN ND2 N -14.725 -1.381 1.130 1.00 . A A . 21 ASN ND2 1 1 5 3419 1 1 21 ASN O O -11.982 -4.267 -2.808 1.00 . A A . 21 ASN O 1 1 5 3420 1 1 21 ASN OXT O -13.901 -3.607 -2.084 1.00 . A A . 21 ASN OXT 1 1 5 3421 1 1 21 ASN OD1 O -13.762 -3.337 1.019 1.00 . A A . 21 ASN OD1 1 1 5 3422 2 2 1 PHE C C 7.880 0.209 -10.130 1.00 . B B . 1 PHE C 1 1 5 3423 2 2 1 PHE CA C 6.464 -0.117 -10.608 1.00 . B B . 1 PHE CA 1 1 5 3424 2 2 1 PHE CB C 6.119 0.764 -11.810 1.00 . B B . 1 PHE CB 1 1 5 3425 2 2 1 PHE CD1 C 6.622 -1.202 -13.306 1.00 . B B . 1 PHE CD1 1 1 5 3426 2 2 1 PHE CD2 C 7.413 0.997 -13.963 1.00 . B B . 1 PHE CD2 1 1 5 3427 2 2 1 PHE CE1 C 7.192 -1.753 -14.461 1.00 . B B . 1 PHE CE1 1 1 5 3428 2 2 1 PHE CE2 C 7.983 0.446 -15.119 1.00 . B B . 1 PHE CE2 1 1 5 3429 2 2 1 PHE CG C 6.732 0.172 -13.057 1.00 . B B . 1 PHE CG 1 1 5 3430 2 2 1 PHE CZ C 7.873 -0.929 -15.367 1.00 . B B . 1 PHE CZ 1 1 5 3431 2 2 1 PHE H1 H 4.527 0.053 -9.865 1.00 . B B . 1 PHE H1 1 1 5 3432 2 2 1 PHE H2 H 5.643 1.105 -9.135 1.00 . B B . 1 PHE H2 1 1 5 3433 2 2 1 PHE H3 H 5.646 -0.548 -8.743 1.00 . B B . 1 PHE H3 1 1 5 3434 2 2 1 PHE HA H 6.412 -1.156 -10.895 1.00 . B B . 1 PHE HA 1 1 5 3435 2 2 1 PHE HB2 H 5.046 0.813 -11.923 1.00 . B B . 1 PHE HB2 1 1 5 3436 2 2 1 PHE HB3 H 6.511 1.757 -11.653 1.00 . B B . 1 PHE HB3 1 1 5 3437 2 2 1 PHE HD1 H 6.098 -1.838 -12.608 1.00 . B B . 1 PHE HD1 1 1 5 3438 2 2 1 PHE HD2 H 7.497 2.056 -13.772 1.00 . B B . 1 PHE HD2 1 1 5 3439 2 2 1 PHE HE1 H 7.108 -2.812 -14.653 1.00 . B B . 1 PHE HE1 1 1 5 3440 2 2 1 PHE HE2 H 8.508 1.080 -15.819 1.00 . B B . 1 PHE HE2 1 1 5 3441 2 2 1 PHE HZ H 8.312 -1.354 -16.258 1.00 . B B . 1 PHE HZ 1 1 5 3442 2 2 1 PHE N N 5.497 0.143 -9.504 1.00 . B B . 1 PHE N 1 1 5 3443 2 2 1 PHE O O 8.682 0.757 -10.861 1.00 . B B . 1 PHE O 1 1 5 3444 2 2 2 VAL C C 9.882 -0.797 -7.245 1.00 . B B . 2 VAL C 1 1 5 3445 2 2 2 VAL CA C 9.557 0.167 -8.386 1.00 . B B . 2 VAL CA 1 1 5 3446 2 2 2 VAL CB C 9.610 1.604 -7.867 1.00 . B B . 2 VAL CB 1 1 5 3447 2 2 2 VAL CG1 C 9.862 2.560 -9.034 1.00 . B B . 2 VAL CG1 1 1 5 3448 2 2 2 VAL CG2 C 8.277 1.955 -7.199 1.00 . B B . 2 VAL CG2 1 1 5 3449 2 2 2 VAL H H 7.532 -0.565 -8.336 1.00 . B B . 2 VAL H 1 1 5 3450 2 2 2 VAL HA H 10.281 0.044 -9.178 1.00 . B B . 2 VAL HA 1 1 5 3451 2 2 2 VAL HB H 10.411 1.696 -7.147 1.00 . B B . 2 VAL HB 1 1 5 3452 2 2 2 VAL HG11 H 8.928 2.774 -9.532 1.00 . B B . 2 VAL HG11 1 1 5 3453 2 2 2 VAL HG12 H 10.545 2.101 -9.733 1.00 . B B . 2 VAL HG12 1 1 5 3454 2 2 2 VAL HG13 H 10.291 3.478 -8.662 1.00 . B B . 2 VAL HG13 1 1 5 3455 2 2 2 VAL HG21 H 7.649 2.482 -7.903 1.00 . B B . 2 VAL HG21 1 1 5 3456 2 2 2 VAL HG22 H 8.460 2.583 -6.340 1.00 . B B . 2 VAL HG22 1 1 5 3457 2 2 2 VAL HG23 H 7.782 1.048 -6.884 1.00 . B B . 2 VAL HG23 1 1 5 3458 2 2 2 VAL N N 8.194 -0.124 -8.910 1.00 . B B . 2 VAL N 1 1 5 3459 2 2 2 VAL O O 9.080 -1.633 -6.877 1.00 . B B . 2 VAL O 1 1 5 3460 2 2 3 ASN C C 11.866 -0.760 -4.364 1.00 . B B . 3 ASN C 1 1 5 3461 2 2 3 ASN CA C 11.437 -1.596 -5.571 1.00 . B B . 3 ASN CA 1 1 5 3462 2 2 3 ASN CB C 12.603 -2.470 -6.022 1.00 . B B . 3 ASN CB 1 1 5 3463 2 2 3 ASN CG C 12.243 -3.172 -7.333 1.00 . B B . 3 ASN CG 1 1 5 3464 2 2 3 ASN H H 11.688 -0.013 -6.994 1.00 . B B . 3 ASN H 1 1 5 3465 2 2 3 ASN HA H 10.599 -2.219 -5.305 1.00 . B B . 3 ASN HA 1 1 5 3466 2 2 3 ASN HB2 H 13.477 -1.853 -6.171 1.00 . B B . 3 ASN HB2 1 1 5 3467 2 2 3 ASN HB3 H 12.808 -3.206 -5.267 1.00 . B B . 3 ASN HB3 1 1 5 3468 2 2 3 ASN HD21 H 10.287 -3.101 -6.999 1.00 . B B . 3 ASN HD21 1 1 5 3469 2 2 3 ASN HD22 H 10.748 -3.836 -8.458 1.00 . B B . 3 ASN HD22 1 1 5 3470 2 2 3 ASN N N 11.055 -0.689 -6.683 1.00 . B B . 3 ASN N 1 1 5 3471 2 2 3 ASN ND2 N 10.988 -3.388 -7.620 1.00 . B B . 3 ASN ND2 1 1 5 3472 2 2 3 ASN O O 13.025 -0.729 -4.003 1.00 . B B . 3 ASN O 1 1 5 3473 2 2 3 ASN OD1 O 13.112 -3.526 -8.105 1.00 . B B . 3 ASN OD1 1 1 5 3474 2 2 4 GLN C C 10.329 0.563 -1.430 1.00 . B B . 4 GLN C 1 1 5 3475 2 2 4 GLN CA C 11.320 0.771 -2.583 1.00 . B B . 4 GLN CA 1 1 5 3476 2 2 4 GLN CB C 11.302 2.237 -3.013 1.00 . B B . 4 GLN CB 1 1 5 3477 2 2 4 GLN CD C 12.825 4.217 -3.080 1.00 . B B . 4 GLN CD 1 1 5 3478 2 2 4 GLN CG C 12.402 2.987 -2.272 1.00 . B B . 4 GLN CG 1 1 5 3479 2 2 4 GLN H H 10.025 -0.090 -4.055 1.00 . B B . 4 GLN H 1 1 5 3480 2 2 4 GLN HA H 12.314 0.509 -2.253 1.00 . B B . 4 GLN HA 1 1 5 3481 2 2 4 GLN HB2 H 11.474 2.302 -4.078 1.00 . B B . 4 GLN HB2 1 1 5 3482 2 2 4 GLN HB3 H 10.344 2.674 -2.774 1.00 . B B . 4 GLN HB3 1 1 5 3483 2 2 4 GLN HE21 H 11.105 5.168 -2.800 1.00 . B B . 4 GLN HE21 1 1 5 3484 2 2 4 GLN HE22 H 12.253 6.004 -3.729 1.00 . B B . 4 GLN HE22 1 1 5 3485 2 2 4 GLN HG2 H 12.032 3.297 -1.307 1.00 . B B . 4 GLN HG2 1 1 5 3486 2 2 4 GLN HG3 H 13.250 2.334 -2.142 1.00 . B B . 4 GLN HG3 1 1 5 3487 2 2 4 GLN N N 10.949 -0.069 -3.746 1.00 . B B . 4 GLN N 1 1 5 3488 2 2 4 GLN NE2 N 11.992 5.212 -3.214 1.00 . B B . 4 GLN NE2 1 1 5 3489 2 2 4 GLN O O 9.396 -0.224 -1.514 1.00 . B B . 4 GLN O 1 1 5 3490 2 2 4 GLN OE1 O 13.925 4.273 -3.593 1.00 . B B . 4 GLN OE1 1 1 5 3491 2 2 5 HIS C C 8.507 2.184 0.707 1.00 . B B . 5 HIS C 1 1 5 3492 2 2 5 HIS CA C 9.630 1.150 0.825 1.00 . B B . 5 HIS CA 1 1 5 3493 2 2 5 HIS CB C 10.430 1.404 2.105 1.00 . B B . 5 HIS CB 1 1 5 3494 2 2 5 HIS CD2 C 12.175 -0.495 2.538 1.00 . B B . 5 HIS CD2 1 1 5 3495 2 2 5 HIS CE1 C 13.840 0.384 1.454 1.00 . B B . 5 HIS CE1 1 1 5 3496 2 2 5 HIS CG C 11.757 0.700 2.021 1.00 . B B . 5 HIS CG 1 1 5 3497 2 2 5 HIS H H 11.290 1.895 -0.316 1.00 . B B . 5 HIS H 1 1 5 3498 2 2 5 HIS HA H 9.206 0.157 0.854 1.00 . B B . 5 HIS HA 1 1 5 3499 2 2 5 HIS HB2 H 10.592 2.465 2.224 1.00 . B B . 5 HIS HB2 1 1 5 3500 2 2 5 HIS HB3 H 9.881 1.028 2.953 1.00 . B B . 5 HIS HB3 1 1 5 3501 2 2 5 HIS HD2 H 11.573 -1.169 3.129 1.00 . B B . 5 HIS HD2 1 1 5 3502 2 2 5 HIS HE1 H 14.817 0.534 1.019 1.00 . B B . 5 HIS HE1 1 1 5 3503 2 2 5 HIS HE2 H 14.056 -1.464 2.411 1.00 . B B . 5 HIS HE2 1 1 5 3504 2 2 5 HIS N N 10.534 1.274 -0.350 1.00 . B B . 5 HIS N 1 1 5 3505 2 2 5 HIS ND1 N 12.821 1.248 1.335 1.00 . B B . 5 HIS ND1 1 1 5 3506 2 2 5 HIS NE2 N 13.492 -0.697 2.182 1.00 . B B . 5 HIS NE2 1 1 5 3507 2 2 5 HIS O O 8.506 3.009 -0.184 1.00 . B B . 5 HIS O 1 1 5 3508 2 2 6 LEU C C 6.046 3.588 2.925 1.00 . B B . 6 LEU C 1 1 5 3509 2 2 6 LEU CA C 6.415 3.111 1.520 1.00 . B B . 6 LEU CA 1 1 5 3510 2 2 6 LEU CB C 5.196 2.399 0.907 1.00 . B B . 6 LEU CB 1 1 5 3511 2 2 6 LEU CD1 C 5.818 3.779 -1.136 1.00 . B B . 6 LEU CD1 1 1 5 3512 2 2 6 LEU CD2 C 4.077 2.013 -1.297 1.00 . B B . 6 LEU CD2 1 1 5 3513 2 2 6 LEU CG C 4.679 3.083 -0.385 1.00 . B B . 6 LEU CG 1 1 5 3514 2 2 6 LEU H H 7.565 1.459 2.293 1.00 . B B . 6 LEU H 1 1 5 3515 2 2 6 LEU HA H 6.710 3.952 0.925 1.00 . B B . 6 LEU HA 1 1 5 3516 2 2 6 LEU HB2 H 5.481 1.388 0.679 1.00 . B B . 6 LEU HB2 1 1 5 3517 2 2 6 LEU HB3 H 4.399 2.376 1.639 1.00 . B B . 6 LEU HB3 1 1 5 3518 2 2 6 LEU HD11 H 5.502 3.997 -2.145 1.00 . B B . 6 LEU HD11 1 1 5 3519 2 2 6 LEU HD12 H 6.680 3.130 -1.164 1.00 . B B . 6 LEU HD12 1 1 5 3520 2 2 6 LEU HD13 H 6.075 4.699 -0.633 1.00 . B B . 6 LEU HD13 1 1 5 3521 2 2 6 LEU HD21 H 3.491 2.488 -2.070 1.00 . B B . 6 LEU HD21 1 1 5 3522 2 2 6 LEU HD22 H 3.443 1.360 -0.715 1.00 . B B . 6 LEU HD22 1 1 5 3523 2 2 6 LEU HD23 H 4.870 1.437 -1.748 1.00 . B B . 6 LEU HD23 1 1 5 3524 2 2 6 LEU HG H 3.907 3.807 -0.139 1.00 . B B . 6 LEU HG 1 1 5 3525 2 2 6 LEU N N 7.547 2.138 1.591 1.00 . B B . 6 LEU N 1 1 5 3526 2 2 6 LEU O O 6.544 3.092 3.908 1.00 . B B . 6 LEU O 1 1 5 3527 2 2 7 CYS C C 4.025 6.391 4.189 1.00 . B B . 7 CYS C 1 1 5 3528 2 2 7 CYS CA C 4.740 5.047 4.354 1.00 . B B . 7 CYS CA 1 1 5 3529 2 2 7 CYS CB C 5.969 5.226 5.251 1.00 . B B . 7 CYS CB 1 1 5 3530 2 2 7 CYS H H 4.761 4.917 2.208 1.00 . B B . 7 CYS H 1 1 5 3531 2 2 7 CYS HA H 4.066 4.336 4.807 1.00 . B B . 7 CYS HA 1 1 5 3532 2 2 7 CYS HB2 H 6.860 4.944 4.712 1.00 . B B . 7 CYS HB2 1 1 5 3533 2 2 7 CYS HB3 H 6.047 6.256 5.551 1.00 . B B . 7 CYS HB3 1 1 5 3534 2 2 7 CYS N N 5.160 4.541 3.019 1.00 . B B . 7 CYS N 1 1 5 3535 2 2 7 CYS O O 4.394 7.208 3.367 1.00 . B B . 7 CYS O 1 1 5 3536 2 2 7 CYS SG S 5.792 4.186 6.723 1.00 . B B . 7 CYS SG 1 1 5 3537 2 2 8 GLY C C 1.649 8.046 3.459 1.00 . B B . 8 GLY C 1 1 5 3538 2 2 8 GLY CA C 2.262 7.916 4.856 1.00 . B B . 8 GLY CA 1 1 5 3539 2 2 8 GLY H H 2.720 5.954 5.621 1.00 . B B . 8 GLY H 1 1 5 3540 2 2 8 GLY HA2 H 1.475 7.941 5.598 1.00 . B B . 8 GLY HA2 1 1 5 3541 2 2 8 GLY HA3 H 2.941 8.738 5.025 1.00 . B B . 8 GLY HA3 1 1 5 3542 2 2 8 GLY N N 3.002 6.627 4.965 1.00 . B B . 8 GLY N 1 1 5 3543 2 2 8 GLY O O 1.214 7.078 2.868 1.00 . B B . 8 GLY O 1 1 5 3544 2 2 9 SER C C 1.651 8.477 0.578 1.00 . B B . 9 SER C 1 1 5 3545 2 2 9 SER CA C 1.012 9.441 1.577 1.00 . B B . 9 SER CA 1 1 5 3546 2 2 9 SER CB C 1.258 10.880 1.124 1.00 . B B . 9 SER CB 1 1 5 3547 2 2 9 SER H H 1.956 10.007 3.429 1.00 . B B . 9 SER H 1 1 5 3548 2 2 9 SER HA H -0.045 9.255 1.620 1.00 . B B . 9 SER HA 1 1 5 3549 2 2 9 SER HB2 H 2.138 10.920 0.505 1.00 . B B . 9 SER HB2 1 1 5 3550 2 2 9 SER HB3 H 0.406 11.229 0.556 1.00 . B B . 9 SER HB3 1 1 5 3551 2 2 9 SER HG H 2.394 11.864 2.358 1.00 . B B . 9 SER HG 1 1 5 3552 2 2 9 SER N N 1.605 9.239 2.931 1.00 . B B . 9 SER N 1 1 5 3553 2 2 9 SER O O 0.994 7.945 -0.294 1.00 . B B . 9 SER O 1 1 5 3554 2 2 9 SER OG O 1.452 11.704 2.265 1.00 . B B . 9 SER OG 1 1 5 3555 2 2 10 ASP C C 2.821 6.013 -0.317 1.00 . B B . 10 ASP C 1 1 5 3556 2 2 10 ASP CA C 3.609 7.322 -0.242 1.00 . B B . 10 ASP CA 1 1 5 3557 2 2 10 ASP CB C 5.026 7.041 0.260 1.00 . B B . 10 ASP CB 1 1 5 3558 2 2 10 ASP CG C 5.689 8.353 0.686 1.00 . B B . 10 ASP CG 1 1 5 3559 2 2 10 ASP H H 3.428 8.689 1.414 1.00 . B B . 10 ASP H 1 1 5 3560 2 2 10 ASP HA H 3.655 7.771 -1.223 1.00 . B B . 10 ASP HA 1 1 5 3561 2 2 10 ASP HB2 H 4.980 6.372 1.105 1.00 . B B . 10 ASP HB2 1 1 5 3562 2 2 10 ASP HB3 H 5.606 6.587 -0.528 1.00 . B B . 10 ASP HB3 1 1 5 3563 2 2 10 ASP N N 2.924 8.250 0.700 1.00 . B B . 10 ASP N 1 1 5 3564 2 2 10 ASP O O 2.713 5.396 -1.359 1.00 . B B . 10 ASP O 1 1 5 3565 2 2 10 ASP OD1 O 6.110 9.091 -0.188 1.00 . B B . 10 ASP OD1 1 1 5 3566 2 2 10 ASP OD2 O 5.765 8.595 1.879 1.00 . B B . 10 ASP OD2 1 1 5 3567 2 2 11 LEU C C 0.123 4.569 0.136 1.00 . B B . 11 LEU C 1 1 5 3568 2 2 11 LEU CA C 1.486 4.321 0.783 1.00 . B B . 11 LEU CA 1 1 5 3569 2 2 11 LEU CB C 1.309 3.848 2.230 1.00 . B B . 11 LEU CB 1 1 5 3570 2 2 11 LEU CD1 C 1.612 1.562 1.204 1.00 . B B . 11 LEU CD1 1 1 5 3571 2 2 11 LEU CD2 C 1.245 1.805 3.655 1.00 . B B . 11 LEU CD2 1 1 5 3572 2 2 11 LEU CG C 0.886 2.373 2.281 1.00 . B B . 11 LEU CG 1 1 5 3573 2 2 11 LEU H H 2.366 6.101 1.610 1.00 . B B . 11 LEU H 1 1 5 3574 2 2 11 LEU HA H 2.016 3.574 0.218 1.00 . B B . 11 LEU HA 1 1 5 3575 2 2 11 LEU HB2 H 2.244 3.968 2.757 1.00 . B B . 11 LEU HB2 1 1 5 3576 2 2 11 LEU HB3 H 0.553 4.451 2.710 1.00 . B B . 11 LEU HB3 1 1 5 3577 2 2 11 LEU HD11 H 2.667 1.787 1.233 1.00 . B B . 11 LEU HD11 1 1 5 3578 2 2 11 LEU HD12 H 1.215 1.818 0.233 1.00 . B B . 11 LEU HD12 1 1 5 3579 2 2 11 LEU HD13 H 1.463 0.507 1.387 1.00 . B B . 11 LEU HD13 1 1 5 3580 2 2 11 LEU HD21 H 1.446 0.748 3.564 1.00 . B B . 11 LEU HD21 1 1 5 3581 2 2 11 LEU HD22 H 0.422 1.960 4.335 1.00 . B B . 11 LEU HD22 1 1 5 3582 2 2 11 LEU HD23 H 2.125 2.307 4.032 1.00 . B B . 11 LEU HD23 1 1 5 3583 2 2 11 LEU HG H -0.180 2.299 2.129 1.00 . B B . 11 LEU HG 1 1 5 3584 2 2 11 LEU N N 2.268 5.586 0.782 1.00 . B B . 11 LEU N 1 1 5 3585 2 2 11 LEU O O -0.295 3.842 -0.744 1.00 . B B . 11 LEU O 1 1 5 3586 2 2 12 VAL C C -1.679 6.186 -1.554 1.00 . B B . 12 VAL C 1 1 5 3587 2 2 12 VAL CA C -1.897 5.878 -0.074 1.00 . B B . 12 VAL CA 1 1 5 3588 2 2 12 VAL CB C -2.572 7.065 0.634 1.00 . B B . 12 VAL CB 1 1 5 3589 2 2 12 VAL CG1 C -2.188 7.051 2.110 1.00 . B B . 12 VAL CG1 1 1 5 3590 2 2 12 VAL CG2 C -2.125 8.394 0.014 1.00 . B B . 12 VAL CG2 1 1 5 3591 2 2 12 VAL H H -0.216 6.185 1.244 1.00 . B B . 12 VAL H 1 1 5 3592 2 2 12 VAL HA H -2.524 5.001 0.018 1.00 . B B . 12 VAL HA 1 1 5 3593 2 2 12 VAL HB H -3.645 6.969 0.545 1.00 . B B . 12 VAL HB 1 1 5 3594 2 2 12 VAL HG11 H -2.921 7.605 2.677 1.00 . B B . 12 VAL HG11 1 1 5 3595 2 2 12 VAL HG12 H -1.217 7.506 2.232 1.00 . B B . 12 VAL HG12 1 1 5 3596 2 2 12 VAL HG13 H -2.155 6.031 2.462 1.00 . B B . 12 VAL HG13 1 1 5 3597 2 2 12 VAL HG21 H -2.548 9.214 0.577 1.00 . B B . 12 VAL HG21 1 1 5 3598 2 2 12 VAL HG22 H -2.466 8.447 -1.009 1.00 . B B . 12 VAL HG22 1 1 5 3599 2 2 12 VAL HG23 H -1.047 8.460 0.038 1.00 . B B . 12 VAL HG23 1 1 5 3600 2 2 12 VAL N N -0.571 5.597 0.546 1.00 . B B . 12 VAL N 1 1 5 3601 2 2 12 VAL O O -2.400 5.716 -2.412 1.00 . B B . 12 VAL O 1 1 5 3602 2 2 13 GLU C C -0.316 5.973 -4.064 1.00 . B B . 13 GLU C 1 1 5 3603 2 2 13 GLU CA C -0.402 7.286 -3.282 1.00 . B B . 13 GLU CA 1 1 5 3604 2 2 13 GLU CB C 0.913 8.079 -3.380 1.00 . B B . 13 GLU CB 1 1 5 3605 2 2 13 GLU CD C 2.316 6.908 -5.089 1.00 . B B . 13 GLU CD 1 1 5 3606 2 2 13 GLU CG C 2.105 7.136 -3.591 1.00 . B B . 13 GLU CG 1 1 5 3607 2 2 13 GLU H H -0.101 7.322 -1.153 1.00 . B B . 13 GLU H 1 1 5 3608 2 2 13 GLU HA H -1.212 7.883 -3.675 1.00 . B B . 13 GLU HA 1 1 5 3609 2 2 13 GLU HB2 H 0.852 8.767 -4.208 1.00 . B B . 13 GLU HB2 1 1 5 3610 2 2 13 GLU HB3 H 1.059 8.636 -2.466 1.00 . B B . 13 GLU HB3 1 1 5 3611 2 2 13 GLU HG2 H 2.993 7.578 -3.164 1.00 . B B . 13 GLU HG2 1 1 5 3612 2 2 13 GLU HG3 H 1.904 6.191 -3.110 1.00 . B B . 13 GLU HG3 1 1 5 3613 2 2 13 GLU N N -0.677 6.963 -1.859 1.00 . B B . 13 GLU N 1 1 5 3614 2 2 13 GLU O O -0.669 5.902 -5.225 1.00 . B B . 13 GLU O 1 1 5 3615 2 2 13 GLU OE1 O 2.540 7.881 -5.791 1.00 . B B . 13 GLU OE1 1 1 5 3616 2 2 13 GLU OE2 O 2.248 5.765 -5.509 1.00 . B B . 13 GLU OE2 1 1 5 3617 2 2 14 ALA C C -1.144 2.916 -3.956 1.00 . B B . 14 ALA C 1 1 5 3618 2 2 14 ALA CA C 0.210 3.609 -4.106 1.00 . B B . 14 ALA CA 1 1 5 3619 2 2 14 ALA CB C 1.304 2.754 -3.461 1.00 . B B . 14 ALA CB 1 1 5 3620 2 2 14 ALA H H 0.387 5.002 -2.479 1.00 . B B . 14 ALA H 1 1 5 3621 2 2 14 ALA HA H 0.429 3.757 -5.154 1.00 . B B . 14 ALA HA 1 1 5 3622 2 2 14 ALA HB1 H 1.935 3.379 -2.846 1.00 . B B . 14 ALA HB1 1 1 5 3623 2 2 14 ALA HB2 H 1.901 2.291 -4.233 1.00 . B B . 14 ALA HB2 1 1 5 3624 2 2 14 ALA HB3 H 0.850 1.988 -2.850 1.00 . B B . 14 ALA HB3 1 1 5 3625 2 2 14 ALA N N 0.128 4.925 -3.420 1.00 . B B . 14 ALA N 1 1 5 3626 2 2 14 ALA O O -1.708 2.415 -4.908 1.00 . B B . 14 ALA O 1 1 5 3627 2 2 15 LEU C C -4.031 2.953 -3.453 1.00 . B B . 15 LEU C 1 1 5 3628 2 2 15 LEU CA C -3.008 2.274 -2.542 1.00 . B B . 15 LEU CA 1 1 5 3629 2 2 15 LEU CB C -3.414 2.469 -1.081 1.00 . B B . 15 LEU CB 1 1 5 3630 2 2 15 LEU CD1 C -3.060 1.531 1.212 1.00 . B B . 15 LEU CD1 1 1 5 3631 2 2 15 LEU CD2 C -2.068 0.337 -0.749 1.00 . B B . 15 LEU CD2 1 1 5 3632 2 2 15 LEU CG C -2.430 1.717 -0.164 1.00 . B B . 15 LEU CG 1 1 5 3633 2 2 15 LEU H H -1.213 3.330 -2.011 1.00 . B B . 15 LEU H 1 1 5 3634 2 2 15 LEU HA H -2.953 1.222 -2.771 1.00 . B B . 15 LEU HA 1 1 5 3635 2 2 15 LEU HB2 H -3.380 3.525 -0.849 1.00 . B B . 15 LEU HB2 1 1 5 3636 2 2 15 LEU HB3 H -4.425 2.105 -0.925 1.00 . B B . 15 LEU HB3 1 1 5 3637 2 2 15 LEU HD11 H -3.131 2.489 1.706 1.00 . B B . 15 LEU HD11 1 1 5 3638 2 2 15 LEU HD12 H -2.446 0.867 1.801 1.00 . B B . 15 LEU HD12 1 1 5 3639 2 2 15 LEU HD13 H -4.047 1.109 1.101 1.00 . B B . 15 LEU HD13 1 1 5 3640 2 2 15 LEU HD21 H -1.364 -0.160 -0.090 1.00 . B B . 15 LEU HD21 1 1 5 3641 2 2 15 LEU HD22 H -1.614 0.459 -1.722 1.00 . B B . 15 LEU HD22 1 1 5 3642 2 2 15 LEU HD23 H -2.958 -0.268 -0.840 1.00 . B B . 15 LEU HD23 1 1 5 3643 2 2 15 LEU HG H -1.530 2.306 -0.060 1.00 . B B . 15 LEU HG 1 1 5 3644 2 2 15 LEU N N -1.680 2.907 -2.763 1.00 . B B . 15 LEU N 1 1 5 3645 2 2 15 LEU O O -4.850 2.312 -4.082 1.00 . B B . 15 LEU O 1 1 5 3646 2 2 16 TYR C C -4.641 4.633 -5.870 1.00 . B B . 16 TYR C 1 1 5 3647 2 2 16 TYR CA C -4.936 4.986 -4.408 1.00 . B B . 16 TYR CA 1 1 5 3648 2 2 16 TYR CB C -4.744 6.492 -4.206 1.00 . B B . 16 TYR CB 1 1 5 3649 2 2 16 TYR CD1 C -7.234 6.884 -4.080 1.00 . B B . 16 TYR CD1 1 1 5 3650 2 2 16 TYR CD2 C -5.810 7.845 -2.366 1.00 . B B . 16 TYR CD2 1 1 5 3651 2 2 16 TYR CE1 C -8.358 7.443 -3.458 1.00 . B B . 16 TYR CE1 1 1 5 3652 2 2 16 TYR CE2 C -6.934 8.405 -1.745 1.00 . B B . 16 TYR CE2 1 1 5 3653 2 2 16 TYR CG C -5.960 7.085 -3.534 1.00 . B B . 16 TYR CG 1 1 5 3654 2 2 16 TYR CZ C -8.209 8.204 -2.291 1.00 . B B . 16 TYR CZ 1 1 5 3655 2 2 16 TYR H H -3.309 4.750 -3.018 1.00 . B B . 16 TYR H 1 1 5 3656 2 2 16 TYR HA H -5.950 4.709 -4.160 1.00 . B B . 16 TYR HA 1 1 5 3657 2 2 16 TYR HB2 H -3.876 6.662 -3.588 1.00 . B B . 16 TYR HB2 1 1 5 3658 2 2 16 TYR HB3 H -4.599 6.966 -5.165 1.00 . B B . 16 TYR HB3 1 1 5 3659 2 2 16 TYR HD1 H -7.351 6.298 -4.979 1.00 . B B . 16 TYR HD1 1 1 5 3660 2 2 16 TYR HD2 H -4.827 7.999 -1.944 1.00 . B B . 16 TYR HD2 1 1 5 3661 2 2 16 TYR HE1 H -9.341 7.288 -3.879 1.00 . B B . 16 TYR HE1 1 1 5 3662 2 2 16 TYR HE2 H -6.818 8.991 -0.845 1.00 . B B . 16 TYR HE2 1 1 5 3663 2 2 16 TYR HH H -9.264 9.711 -1.782 1.00 . B B . 16 TYR HH 1 1 5 3664 2 2 16 TYR N N -3.982 4.253 -3.532 1.00 . B B . 16 TYR N 1 1 5 3665 2 2 16 TYR O O -5.537 4.473 -6.676 1.00 . B B . 16 TYR O 1 1 5 3666 2 2 16 TYR OH O -9.316 8.757 -1.682 1.00 . B B . 16 TYR OH 1 1 5 3667 2 2 17 LEU C C -3.275 2.722 -7.917 1.00 . B B . 17 LEU C 1 1 5 3668 2 2 17 LEU CA C -3.002 4.196 -7.617 1.00 . B B . 17 LEU CA 1 1 5 3669 2 2 17 LEU CB C -1.510 4.494 -7.814 1.00 . B B . 17 LEU CB 1 1 5 3670 2 2 17 LEU CD1 C -1.887 4.186 -10.270 1.00 . B B . 17 LEU CD1 1 1 5 3671 2 2 17 LEU CD2 C 0.438 4.259 -9.360 1.00 . B B . 17 LEU CD2 1 1 5 3672 2 2 17 LEU CG C -0.998 3.808 -9.084 1.00 . B B . 17 LEU CG 1 1 5 3673 2 2 17 LEU H H -2.683 4.665 -5.540 1.00 . B B . 17 LEU H 1 1 5 3674 2 2 17 LEU HA H -3.576 4.802 -8.289 1.00 . B B . 17 LEU HA 1 1 5 3675 2 2 17 LEU HB2 H -1.367 5.561 -7.901 1.00 . B B . 17 LEU HB2 1 1 5 3676 2 2 17 LEU HB3 H -0.956 4.126 -6.963 1.00 . B B . 17 LEU HB3 1 1 5 3677 2 2 17 LEU HD11 H -1.633 5.179 -10.609 1.00 . B B . 17 LEU HD11 1 1 5 3678 2 2 17 LEU HD12 H -2.923 4.164 -9.965 1.00 . B B . 17 LEU HD12 1 1 5 3679 2 2 17 LEU HD13 H -1.734 3.481 -11.075 1.00 . B B . 17 LEU HD13 1 1 5 3680 2 2 17 LEU HD21 H 1.072 3.960 -8.539 1.00 . B B . 17 LEU HD21 1 1 5 3681 2 2 17 LEU HD22 H 0.463 5.334 -9.462 1.00 . B B . 17 LEU HD22 1 1 5 3682 2 2 17 LEU HD23 H 0.791 3.802 -10.272 1.00 . B B . 17 LEU HD23 1 1 5 3683 2 2 17 LEU HG H -1.020 2.736 -8.946 1.00 . B B . 17 LEU HG 1 1 5 3684 2 2 17 LEU N N -3.383 4.522 -6.212 1.00 . B B . 17 LEU N 1 1 5 3685 2 2 17 LEU O O -3.852 2.382 -8.931 1.00 . B B . 17 LEU O 1 1 5 3686 2 2 18 VAL C C -4.561 0.180 -7.613 1.00 . B B . 18 VAL C 1 1 5 3687 2 2 18 VAL CA C -3.090 0.395 -7.307 1.00 . B B . 18 VAL CA 1 1 5 3688 2 2 18 VAL CB C -2.700 -0.423 -6.079 1.00 . B B . 18 VAL CB 1 1 5 3689 2 2 18 VAL CG1 C -1.306 -0.019 -5.640 1.00 . B B . 18 VAL CG1 1 1 5 3690 2 2 18 VAL CG2 C -3.675 -0.154 -4.937 1.00 . B B . 18 VAL CG2 1 1 5 3691 2 2 18 VAL H H -2.392 2.141 -6.250 1.00 . B B . 18 VAL H 1 1 5 3692 2 2 18 VAL HA H -2.499 0.079 -8.150 1.00 . B B . 18 VAL HA 1 1 5 3693 2 2 18 VAL HB H -2.710 -1.475 -6.326 1.00 . B B . 18 VAL HB 1 1 5 3694 2 2 18 VAL HG11 H -1.331 0.272 -4.601 1.00 . B B . 18 VAL HG11 1 1 5 3695 2 2 18 VAL HG12 H -0.972 0.813 -6.242 1.00 . B B . 18 VAL HG12 1 1 5 3696 2 2 18 VAL HG13 H -0.636 -0.853 -5.768 1.00 . B B . 18 VAL HG13 1 1 5 3697 2 2 18 VAL HG21 H -4.686 -0.202 -5.306 1.00 . B B . 18 VAL HG21 1 1 5 3698 2 2 18 VAL HG22 H -3.482 0.824 -4.527 1.00 . B B . 18 VAL HG22 1 1 5 3699 2 2 18 VAL HG23 H -3.537 -0.896 -4.168 1.00 . B B . 18 VAL HG23 1 1 5 3700 2 2 18 VAL N N -2.858 1.845 -7.055 1.00 . B B . 18 VAL N 1 1 5 3701 2 2 18 VAL O O -4.929 -0.687 -8.381 1.00 . B B . 18 VAL O 1 1 5 3702 2 2 19 CYS C C -7.489 2.170 -7.567 1.00 . B B . 19 CYS C 1 1 5 3703 2 2 19 CYS CA C -6.856 0.806 -7.279 1.00 . B B . 19 CYS CA 1 1 5 3704 2 2 19 CYS CB C -7.516 0.170 -6.062 1.00 . B B . 19 CYS CB 1 1 5 3705 2 2 19 CYS H H -5.085 1.657 -6.403 1.00 . B B . 19 CYS H 1 1 5 3706 2 2 19 CYS HA H -6.985 0.162 -8.132 1.00 . B B . 19 CYS HA 1 1 5 3707 2 2 19 CYS HB2 H -7.102 0.598 -5.161 1.00 . B B . 19 CYS HB2 1 1 5 3708 2 2 19 CYS HB3 H -8.578 0.351 -6.093 1.00 . B B . 19 CYS HB3 1 1 5 3709 2 2 19 CYS N N -5.406 0.966 -7.020 1.00 . B B . 19 CYS N 1 1 5 3710 2 2 19 CYS O O -7.870 2.463 -8.683 1.00 . B B . 19 CYS O 1 1 5 3711 2 2 19 CYS SG S -7.202 -1.611 -6.089 1.00 . B B . 19 CYS SG 1 1 5 3712 2 2 20 GLY C C -9.562 4.451 -6.104 1.00 . B B . 20 GLY C 1 1 5 3713 2 2 20 GLY CA C -8.206 4.351 -6.808 1.00 . B B . 20 GLY CA 1 1 5 3714 2 2 20 GLY H H -7.285 2.763 -5.682 1.00 . B B . 20 GLY H 1 1 5 3715 2 2 20 GLY HA2 H -7.544 5.112 -6.421 1.00 . B B . 20 GLY HA2 1 1 5 3716 2 2 20 GLY HA3 H -8.344 4.502 -7.868 1.00 . B B . 20 GLY HA3 1 1 5 3717 2 2 20 GLY N N -7.602 3.010 -6.575 1.00 . B B . 20 GLY N 1 1 5 3718 2 2 20 GLY O O -9.641 4.575 -4.898 1.00 . B B . 20 GLY O 1 1 5 3719 2 2 21 GLU C C -12.346 3.256 -5.480 1.00 . B B . 21 GLU C 1 1 5 3720 2 2 21 GLU CA C -11.985 4.536 -6.240 1.00 . B B . 21 GLU CA 1 1 5 3721 2 2 21 GLU CB C -13.017 4.779 -7.341 1.00 . B B . 21 GLU CB 1 1 5 3722 2 2 21 GLU CD C -15.272 5.736 -7.830 1.00 . B B . 21 GLU CD 1 1 5 3723 2 2 21 GLU CG C -14.151 5.648 -6.793 1.00 . B B . 21 GLU CG 1 1 5 3724 2 2 21 GLU H H -10.542 4.334 -7.826 1.00 . B B . 21 GLU H 1 1 5 3725 2 2 21 GLU HA H -11.994 5.370 -5.555 1.00 . B B . 21 GLU HA 1 1 5 3726 2 2 21 GLU HB2 H -12.544 5.283 -8.172 1.00 . B B . 21 GLU HB2 1 1 5 3727 2 2 21 GLU HB3 H -13.419 3.834 -7.674 1.00 . B B . 21 GLU HB3 1 1 5 3728 2 2 21 GLU HG2 H -14.534 5.208 -5.884 1.00 . B B . 21 GLU HG2 1 1 5 3729 2 2 21 GLU HG3 H -13.777 6.639 -6.585 1.00 . B B . 21 GLU HG3 1 1 5 3730 2 2 21 GLU N N -10.631 4.419 -6.854 1.00 . B B . 21 GLU N 1 1 5 3731 2 2 21 GLU O O -13.342 3.205 -4.786 1.00 . B B . 21 GLU O 1 1 5 3732 2 2 21 GLU OE1 O -15.149 5.097 -8.862 1.00 . B B . 21 GLU OE1 1 1 5 3733 2 2 21 GLU OE2 O -16.234 6.441 -7.574 1.00 . B B . 21 GLU OE2 1 1 5 3734 2 2 22 ARG C C -11.600 1.143 -3.380 1.00 . B B . 22 ARG C 1 1 5 3735 2 2 22 ARG CA C -11.890 0.964 -4.873 1.00 . B B . 22 ARG CA 1 1 5 3736 2 2 22 ARG CB C -11.050 -0.188 -5.427 1.00 . B B . 22 ARG CB 1 1 5 3737 2 2 22 ARG CD C -13.044 -1.598 -4.892 1.00 . B B . 22 ARG CD 1 1 5 3738 2 2 22 ARG CG C -11.976 -1.291 -5.945 1.00 . B B . 22 ARG CG 1 1 5 3739 2 2 22 ARG CZ C -14.417 -3.208 -6.072 1.00 . B B . 22 ARG CZ 1 1 5 3740 2 2 22 ARG H H -10.759 2.271 -6.162 1.00 . B B . 22 ARG H 1 1 5 3741 2 2 22 ARG HA H -12.937 0.740 -5.007 1.00 . B B . 22 ARG HA 1 1 5 3742 2 2 22 ARG HB2 H -10.432 0.173 -6.235 1.00 . B B . 22 ARG HB2 1 1 5 3743 2 2 22 ARG HB3 H -10.424 -0.586 -4.644 1.00 . B B . 22 ARG HB3 1 1 5 3744 2 2 22 ARG HD2 H -12.609 -1.529 -3.906 1.00 . B B . 22 ARG HD2 1 1 5 3745 2 2 22 ARG HD3 H -13.851 -0.886 -4.979 1.00 . B B . 22 ARG HD3 1 1 5 3746 2 2 22 ARG HE H -13.281 -3.707 -4.521 1.00 . B B . 22 ARG HE 1 1 5 3747 2 2 22 ARG HG2 H -12.453 -0.962 -6.856 1.00 . B B . 22 ARG HG2 1 1 5 3748 2 2 22 ARG HG3 H -11.400 -2.183 -6.141 1.00 . B B . 22 ARG HG3 1 1 5 3749 2 2 22 ARG HH11 H -16.023 -2.685 -4.996 1.00 . B B . 22 ARG HH11 1 1 5 3750 2 2 22 ARG HH12 H -16.342 -3.194 -6.621 1.00 . B B . 22 ARG HH12 1 1 5 3751 2 2 22 ARG HH21 H -13.010 -3.785 -7.372 1.00 . B B . 22 ARG HH21 1 1 5 3752 2 2 22 ARG HH22 H -14.636 -3.811 -7.968 1.00 . B B . 22 ARG HH22 1 1 5 3753 2 2 22 ARG N N -11.560 2.222 -5.599 1.00 . B B . 22 ARG N 1 1 5 3754 2 2 22 ARG NE N -13.570 -2.976 -5.106 1.00 . B B . 22 ARG NE 1 1 5 3755 2 2 22 ARG NH1 N -15.693 -3.013 -5.882 1.00 . B B . 22 ARG NH1 1 1 5 3756 2 2 22 ARG NH2 N -13.988 -3.635 -7.227 1.00 . B B . 22 ARG NH2 1 1 5 3757 2 2 22 ARG O O -11.845 0.261 -2.581 1.00 . B B . 22 ARG O 1 1 5 3758 2 2 23 GLY C C -9.736 1.513 -1.077 1.00 . B B . 23 GLY C 1 1 5 3759 2 2 23 GLY CA C -10.787 2.515 -1.555 1.00 . B B . 23 GLY CA 1 1 5 3760 2 2 23 GLY H H -10.899 2.981 -3.655 1.00 . B B . 23 GLY H 1 1 5 3761 2 2 23 GLY HA2 H -10.412 3.520 -1.425 1.00 . B B . 23 GLY HA2 1 1 5 3762 2 2 23 GLY HA3 H -11.689 2.388 -0.975 1.00 . B B . 23 GLY HA3 1 1 5 3763 2 2 23 GLY N N -11.086 2.280 -2.997 1.00 . B B . 23 GLY N 1 1 5 3764 2 2 23 GLY O O -9.523 0.483 -1.687 1.00 . B B . 23 GLY O 1 1 5 3765 2 2 24 PHE C C -8.190 0.729 2.047 1.00 . B B . 24 PHE C 1 1 5 3766 2 2 24 PHE CA C -8.042 0.869 0.530 1.00 . B B . 24 PHE CA 1 1 5 3767 2 2 24 PHE CB C -6.649 1.412 0.200 1.00 . B B . 24 PHE CB 1 1 5 3768 2 2 24 PHE CD1 C -7.148 3.563 1.429 1.00 . B B . 24 PHE CD1 1 1 5 3769 2 2 24 PHE CD2 C -6.156 3.682 -0.783 1.00 . B B . 24 PHE CD2 1 1 5 3770 2 2 24 PHE CE1 C -7.143 4.964 1.505 1.00 . B B . 24 PHE CE1 1 1 5 3771 2 2 24 PHE CE2 C -6.154 5.081 -0.708 1.00 . B B . 24 PHE CE2 1 1 5 3772 2 2 24 PHE CG C -6.653 2.922 0.284 1.00 . B B . 24 PHE CG 1 1 5 3773 2 2 24 PHE CZ C -6.646 5.722 0.435 1.00 . B B . 24 PHE CZ 1 1 5 3774 2 2 24 PHE H H -9.266 2.640 0.489 1.00 . B B . 24 PHE H 1 1 5 3775 2 2 24 PHE HA H -8.169 -0.099 0.067 1.00 . B B . 24 PHE HA 1 1 5 3776 2 2 24 PHE HB2 H -5.933 1.014 0.904 1.00 . B B . 24 PHE HB2 1 1 5 3777 2 2 24 PHE HB3 H -6.374 1.110 -0.799 1.00 . B B . 24 PHE HB3 1 1 5 3778 2 2 24 PHE HD1 H -7.531 2.979 2.253 1.00 . B B . 24 PHE HD1 1 1 5 3779 2 2 24 PHE HD2 H -5.776 3.189 -1.666 1.00 . B B . 24 PHE HD2 1 1 5 3780 2 2 24 PHE HE1 H -7.526 5.459 2.385 1.00 . B B . 24 PHE HE1 1 1 5 3781 2 2 24 PHE HE2 H -5.773 5.666 -1.532 1.00 . B B . 24 PHE HE2 1 1 5 3782 2 2 24 PHE HZ H -6.640 6.801 0.493 1.00 . B B . 24 PHE HZ 1 1 5 3783 2 2 24 PHE N N -9.078 1.805 0.012 1.00 . B B . 24 PHE N 1 1 5 3784 2 2 24 PHE O O -9.046 1.339 2.656 1.00 . B B . 24 PHE O 1 1 5 3785 2 2 25 PHE C C -6.105 0.082 4.780 1.00 . B B . 25 PHE C 1 1 5 3786 2 2 25 PHE CA C -7.455 -0.248 4.141 1.00 . B B . 25 PHE CA 1 1 5 3787 2 2 25 PHE CB C -7.826 -1.698 4.463 1.00 . B B . 25 PHE CB 1 1 5 3788 2 2 25 PHE CD1 C -10.254 -1.231 4.957 1.00 . B B . 25 PHE CD1 1 1 5 3789 2 2 25 PHE CD2 C -8.883 -2.237 6.688 1.00 . B B . 25 PHE CD2 1 1 5 3790 2 2 25 PHE CE1 C -11.359 -1.255 5.818 1.00 . B B . 25 PHE CE1 1 1 5 3791 2 2 25 PHE CE2 C -9.988 -2.261 7.549 1.00 . B B . 25 PHE CE2 1 1 5 3792 2 2 25 PHE CG C -9.016 -1.722 5.392 1.00 . B B . 25 PHE CG 1 1 5 3793 2 2 25 PHE CZ C -11.226 -1.770 7.114 1.00 . B B . 25 PHE CZ 1 1 5 3794 2 2 25 PHE H H -6.677 -0.554 2.154 1.00 . B B . 25 PHE H 1 1 5 3795 2 2 25 PHE HA H -8.211 0.413 4.535 1.00 . B B . 25 PHE HA 1 1 5 3796 2 2 25 PHE HB2 H -8.071 -2.218 3.549 1.00 . B B . 25 PHE HB2 1 1 5 3797 2 2 25 PHE HB3 H -6.989 -2.185 4.941 1.00 . B B . 25 PHE HB3 1 1 5 3798 2 2 25 PHE HD1 H -10.356 -0.834 3.958 1.00 . B B . 25 PHE HD1 1 1 5 3799 2 2 25 PHE HD2 H -7.929 -2.616 7.023 1.00 . B B . 25 PHE HD2 1 1 5 3800 2 2 25 PHE HE1 H -12.314 -0.876 5.483 1.00 . B B . 25 PHE HE1 1 1 5 3801 2 2 25 PHE HE2 H -9.885 -2.659 8.548 1.00 . B B . 25 PHE HE2 1 1 5 3802 2 2 25 PHE HZ H -12.078 -1.789 7.778 1.00 . B B . 25 PHE HZ 1 1 5 3803 2 2 25 PHE N N -7.361 -0.071 2.663 1.00 . B B . 25 PHE N 1 1 5 3804 2 2 25 PHE O O -5.269 -0.779 4.968 1.00 . B B . 25 PHE O 1 1 5 3805 2 2 26 TYR C C -4.686 1.509 7.261 1.00 . B B . 26 TYR C 1 1 5 3806 2 2 26 TYR CA C -4.592 1.709 5.746 1.00 . B B . 26 TYR CA 1 1 5 3807 2 2 26 TYR CB C -4.300 3.180 5.431 1.00 . B B . 26 TYR CB 1 1 5 3808 2 2 26 TYR CD1 C -1.877 3.339 6.114 1.00 . B B . 26 TYR CD1 1 1 5 3809 2 2 26 TYR CD2 C -3.542 4.544 7.406 1.00 . B B . 26 TYR CD2 1 1 5 3810 2 2 26 TYR CE1 C -0.870 3.827 6.957 1.00 . B B . 26 TYR CE1 1 1 5 3811 2 2 26 TYR CE2 C -2.535 5.031 8.249 1.00 . B B . 26 TYR CE2 1 1 5 3812 2 2 26 TYR CG C -3.213 3.698 6.340 1.00 . B B . 26 TYR CG 1 1 5 3813 2 2 26 TYR CZ C -1.199 4.673 8.025 1.00 . B B . 26 TYR CZ 1 1 5 3814 2 2 26 TYR H H -6.574 2.002 4.958 1.00 . B B . 26 TYR H 1 1 5 3815 2 2 26 TYR HA H -3.800 1.091 5.349 1.00 . B B . 26 TYR HA 1 1 5 3816 2 2 26 TYR HB2 H -3.980 3.270 4.405 1.00 . B B . 26 TYR HB2 1 1 5 3817 2 2 26 TYR HB3 H -5.195 3.762 5.578 1.00 . B B . 26 TYR HB3 1 1 5 3818 2 2 26 TYR HD1 H -1.624 2.686 5.292 1.00 . B B . 26 TYR HD1 1 1 5 3819 2 2 26 TYR HD2 H -4.572 4.819 7.578 1.00 . B B . 26 TYR HD2 1 1 5 3820 2 2 26 TYR HE1 H 0.159 3.551 6.784 1.00 . B B . 26 TYR HE1 1 1 5 3821 2 2 26 TYR HE2 H -2.789 5.683 9.072 1.00 . B B . 26 TYR HE2 1 1 5 3822 2 2 26 TYR HH H 0.469 5.556 8.305 1.00 . B B . 26 TYR HH 1 1 5 3823 2 2 26 TYR N N -5.886 1.323 5.117 1.00 . B B . 26 TYR N 1 1 5 3824 2 2 26 TYR O O -5.636 1.927 7.893 1.00 . B B . 26 TYR O 1 1 5 3825 2 2 26 TYR OH O -0.207 5.153 8.855 1.00 . B B . 26 TYR OH 1 1 5 3826 2 2 27 THR C C -2.341 0.748 9.897 1.00 . B B . 27 THR C 1 1 5 3827 2 2 27 THR CA C -3.755 0.641 9.321 1.00 . B B . 27 THR CA 1 1 5 3828 2 2 27 THR CB C -4.319 -0.752 9.607 1.00 . B B . 27 THR CB 1 1 5 3829 2 2 27 THR CG2 C -5.347 -1.121 8.536 1.00 . B B . 27 THR CG2 1 1 5 3830 2 2 27 THR H H -2.955 0.535 7.322 1.00 . B B . 27 THR H 1 1 5 3831 2 2 27 THR HA H -4.387 1.386 9.781 1.00 . B B . 27 THR HA 1 1 5 3832 2 2 27 THR HB H -4.797 -0.754 10.574 1.00 . B B . 27 THR HB 1 1 5 3833 2 2 27 THR HG1 H -3.125 -2.000 10.500 1.00 . B B . 27 THR HG1 1 1 5 3834 2 2 27 THR HG21 H -5.716 -2.120 8.719 1.00 . B B . 27 THR HG21 1 1 5 3835 2 2 27 THR HG22 H -4.881 -1.084 7.561 1.00 . B B . 27 THR HG22 1 1 5 3836 2 2 27 THR HG23 H -6.170 -0.422 8.569 1.00 . B B . 27 THR HG23 1 1 5 3837 2 2 27 THR N N -3.712 0.868 7.848 1.00 . B B . 27 THR N 1 1 5 3838 2 2 27 THR O O -1.361 0.595 9.195 1.00 . B B . 27 THR O 1 1 5 3839 2 2 27 THR OG1 O -3.261 -1.700 9.598 1.00 . B B . 27 THR OG1 1 1 5 3840 2 2 28 LYS C C -0.485 -0.129 12.528 1.00 . B B . 28 LYS C 1 1 5 3841 2 2 28 LYS CA C -0.871 1.147 11.782 1.00 . B B . 28 LYS CA 1 1 5 3842 2 2 28 LYS CB C -0.850 2.305 12.779 1.00 . B B . 28 LYS CB 1 1 5 3843 2 2 28 LYS CD C -0.160 4.740 12.742 1.00 . B B . 28 LYS CD 1 1 5 3844 2 2 28 LYS CE C -1.583 5.020 12.255 1.00 . B B . 28 LYS CE 1 1 5 3845 2 2 28 LYS CG C 0.244 3.303 12.378 1.00 . B B . 28 LYS CG 1 1 5 3846 2 2 28 LYS H H -3.026 1.150 11.717 1.00 . B B . 28 LYS H 1 1 5 3847 2 2 28 LYS HA H -0.146 1.338 11.005 1.00 . B B . 28 LYS HA 1 1 5 3848 2 2 28 LYS HB2 H -1.819 2.777 12.795 1.00 . B B . 28 LYS HB2 1 1 5 3849 2 2 28 LYS HB3 H -0.630 1.917 13.763 1.00 . B B . 28 LYS HB3 1 1 5 3850 2 2 28 LYS HD2 H -0.111 4.870 13.815 1.00 . B B . 28 LYS HD2 1 1 5 3851 2 2 28 LYS HD3 H 0.523 5.436 12.270 1.00 . B B . 28 LYS HD3 1 1 5 3852 2 2 28 LYS HE2 H -1.913 4.211 11.621 1.00 . B B . 28 LYS HE2 1 1 5 3853 2 2 28 LYS HE3 H -2.244 5.103 13.105 1.00 . B B . 28 LYS HE3 1 1 5 3854 2 2 28 LYS HG2 H 1.156 3.047 12.898 1.00 . B B . 28 LYS HG2 1 1 5 3855 2 2 28 LYS HG3 H 0.409 3.236 11.315 1.00 . B B . 28 LYS HG3 1 1 5 3856 2 2 28 LYS HZ1 H -1.376 6.101 10.489 1.00 . B B . 28 LYS HZ1 1 1 5 3857 2 2 28 LYS HZ2 H -0.906 6.953 11.882 1.00 . B B . 28 LYS HZ2 1 1 5 3858 2 2 28 LYS HZ3 H -2.553 6.717 11.542 1.00 . B B . 28 LYS HZ3 1 1 5 3859 2 2 28 LYS N N -2.225 1.020 11.170 1.00 . B B . 28 LYS N 1 1 5 3860 2 2 28 LYS NZ N -1.606 6.294 11.484 1.00 . B B . 28 LYS NZ 1 1 5 3861 2 2 28 LYS O O 0.534 -0.724 12.237 1.00 . B B . 28 LYS O 1 1 5 3862 2 2 29 PRO C C -1.485 -2.947 13.661 1.00 . B B . 29 PRO C 1 1 5 3863 2 2 29 PRO CA C -0.994 -1.663 14.340 1.00 . B B . 29 PRO CA 1 1 5 3864 2 2 29 PRO CB C -1.791 -1.377 15.609 1.00 . B B . 29 PRO CB 1 1 5 3865 2 2 29 PRO CD C -2.525 0.220 13.876 1.00 . B B . 29 PRO CD 1 1 5 3866 2 2 29 PRO CG C -2.938 -0.423 15.207 1.00 . B B . 29 PRO CG 1 1 5 3867 2 2 29 PRO HA H 0.057 -1.726 14.570 1.00 . B B . 29 PRO HA 1 1 5 3868 2 2 29 PRO HB2 H -2.184 -2.292 16.024 1.00 . B B . 29 PRO HB2 1 1 5 3869 2 2 29 PRO HB3 H -1.154 -0.878 16.322 1.00 . B B . 29 PRO HB3 1 1 5 3870 2 2 29 PRO HD2 H -3.294 0.057 13.133 1.00 . B B . 29 PRO HD2 1 1 5 3871 2 2 29 PRO HD3 H -2.344 1.267 14.015 1.00 . B B . 29 PRO HD3 1 1 5 3872 2 2 29 PRO HG2 H -3.856 -0.980 15.085 1.00 . B B . 29 PRO HG2 1 1 5 3873 2 2 29 PRO HG3 H -3.064 0.342 15.957 1.00 . B B . 29 PRO HG3 1 1 5 3874 2 2 29 PRO N N -1.279 -0.491 13.505 1.00 . B B . 29 PRO N 1 1 5 3875 2 2 29 PRO O O -2.324 -2.915 12.783 1.00 . B B . 29 PRO O 1 1 5 3876 2 2 30 THR C C -2.839 -5.675 13.868 1.00 . B B . 30 THR C 1 1 5 3877 2 2 30 THR CA C -1.403 -5.361 13.444 1.00 . B B . 30 THR CA 1 1 5 3878 2 2 30 THR CB C -0.477 -6.489 13.907 1.00 . B B . 30 THR CB 1 1 5 3879 2 2 30 THR CG2 C -0.692 -7.720 13.025 1.00 . B B . 30 THR CG2 1 1 5 3880 2 2 30 THR H H -0.292 -4.080 14.774 1.00 . B B . 30 THR H 1 1 5 3881 2 2 30 THR HA H -1.355 -5.276 12.369 1.00 . B B . 30 THR HA 1 1 5 3882 2 2 30 THR HB H -0.702 -6.743 14.932 1.00 . B B . 30 THR HB 1 1 5 3883 2 2 30 THR HG1 H 0.968 -5.557 12.999 1.00 . B B . 30 THR HG1 1 1 5 3884 2 2 30 THR HG21 H -0.779 -8.599 13.646 1.00 . B B . 30 THR HG21 1 1 5 3885 2 2 30 THR HG22 H 0.149 -7.834 12.356 1.00 . B B . 30 THR HG22 1 1 5 3886 2 2 30 THR HG23 H -1.596 -7.596 12.448 1.00 . B B . 30 THR HG23 1 1 5 3887 2 2 30 THR N N -0.968 -4.076 14.064 1.00 . B B . 30 THR N 1 1 5 3888 2 2 30 THR O O -3.681 -5.798 12.993 1.00 . B B . 30 THR O 1 1 5 3889 2 2 30 THR OXT O -3.073 -5.789 15.060 1.00 . B B . 30 THR OXT 1 1 5 3890 2 2 30 THR OG1 O 0.874 -6.062 13.809 1.00 . B B . 30 THR OG1 1 1 6 3891 1 1 1 GLY C C 0.310 -5.429 7.807 1.00 . A A . 1 GLY C 1 1 6 3892 1 1 1 GLY CA C 0.018 -5.568 9.263 1.00 . A A . 1 GLY CA 1 1 6 3893 1 1 1 GLY H1 H 0.258 -3.627 10.070 1.00 . A A . 1 GLY H1 1 1 6 3894 1 1 1 GLY H2 H -0.705 -4.649 11.026 1.00 . A A . 1 GLY H2 1 1 6 3895 1 1 1 GLY H3 H -1.335 -3.976 9.598 1.00 . A A . 1 GLY H3 1 1 6 3896 1 1 1 GLY HA2 H 0.985 -5.665 9.339 1.00 . A A . 1 GLY HA2 1 1 6 3897 1 1 1 GLY HA3 H -0.566 -6.497 9.662 1.00 . A A . 1 GLY HA3 1 1 6 3898 1 1 1 GLY N N -0.481 -4.358 10.052 1.00 . A A . 1 GLY N 1 1 6 3899 1 1 1 GLY O O 0.728 -6.367 7.158 1.00 . A A . 1 GLY O 1 1 6 3900 1 1 2 ILE C C 1.670 -3.254 5.631 1.00 . A A . 2 ILE C 1 1 6 3901 1 1 2 ILE CA C 0.388 -4.075 5.801 1.00 . A A . 2 ILE CA 1 1 6 3902 1 1 2 ILE CB C -0.819 -3.400 5.104 1.00 . A A . 2 ILE CB 1 1 6 3903 1 1 2 ILE CD1 C -0.437 -1.133 3.990 1.00 . A A . 2 ILE CD1 1 1 6 3904 1 1 2 ILE CG1 C -0.356 -2.658 3.823 1.00 . A A . 2 ILE CG1 1 1 6 3905 1 1 2 ILE CG2 C -1.546 -2.447 6.069 1.00 . A A . 2 ILE CG2 1 1 6 3906 1 1 2 ILE H H -0.224 -3.516 7.794 1.00 . A A . 2 ILE H 1 1 6 3907 1 1 2 ILE HA H 0.547 -5.040 5.358 1.00 . A A . 2 ILE HA 1 1 6 3908 1 1 2 ILE HB H -1.515 -4.177 4.817 1.00 . A A . 2 ILE HB 1 1 6 3909 1 1 2 ILE HD11 H 0.190 -0.825 4.812 1.00 . A A . 2 ILE HD11 1 1 6 3910 1 1 2 ILE HD12 H -1.459 -0.847 4.190 1.00 . A A . 2 ILE HD12 1 1 6 3911 1 1 2 ILE HD13 H -0.101 -0.655 3.082 1.00 . A A . 2 ILE HD13 1 1 6 3912 1 1 2 ILE HG12 H 0.661 -2.934 3.596 1.00 . A A . 2 ILE HG12 1 1 6 3913 1 1 2 ILE HG13 H -0.990 -2.954 3.000 1.00 . A A . 2 ILE HG13 1 1 6 3914 1 1 2 ILE HG21 H -1.729 -2.948 7.006 1.00 . A A . 2 ILE HG21 1 1 6 3915 1 1 2 ILE HG22 H -2.489 -2.151 5.634 1.00 . A A . 2 ILE HG22 1 1 6 3916 1 1 2 ILE HG23 H -0.945 -1.569 6.240 1.00 . A A . 2 ILE HG23 1 1 6 3917 1 1 2 ILE N N 0.105 -4.263 7.254 1.00 . A A . 2 ILE N 1 1 6 3918 1 1 2 ILE O O 2.682 -3.752 5.180 1.00 . A A . 2 ILE O 1 1 6 3919 1 1 3 ABA C C 3.984 -1.763 6.643 1.00 . A A . 3 ABA C 1 1 6 3920 1 1 3 ABA CA C 2.833 -1.155 5.852 1.00 . A A . 3 ABA CA 1 1 6 3921 1 1 3 ABA CB C 2.513 0.238 6.383 1.00 . A A . 3 ABA CB 1 1 6 3922 1 1 3 ABA CG C 1.920 0.134 7.788 1.00 . A A . 3 ABA CG 1 1 6 3923 1 1 3 ABA H H 0.820 -1.635 6.341 1.00 . A A . 3 ABA H 1 1 6 3924 1 1 3 ABA HA H 3.110 -1.090 4.816 1.00 . A A . 3 ABA HA 1 1 6 3925 1 1 3 ABA HB2 H 3.413 0.818 6.418 1.00 . A A . 3 ABA HB2 1 1 6 3926 1 1 3 ABA HB3 H 1.802 0.715 5.728 1.00 . A A . 3 ABA HB3 1 1 6 3927 1 1 3 ABA HG1 H 2.714 0.179 8.517 1.00 . A A . 3 ABA HG1 1 1 6 3928 1 1 3 ABA HG2 H 1.390 -0.801 7.890 1.00 . A A . 3 ABA HG2 1 1 6 3929 1 1 3 ABA HG3 H 1.236 0.955 7.950 1.00 . A A . 3 ABA HG3 1 1 6 3930 1 1 3 ABA N N 1.634 -2.009 5.987 1.00 . A A . 3 ABA N 1 1 6 3931 1 1 3 ABA O O 5.116 -1.719 6.240 1.00 . A A . 3 ABA O 1 1 6 3932 1 1 4 GLU C C 5.586 -3.889 7.586 1.00 . A A . 4 GLU C 1 1 6 3933 1 1 4 GLU CA C 4.810 -2.965 8.534 1.00 . A A . 4 GLU CA 1 1 6 3934 1 1 4 GLU CB C 4.201 -3.732 9.714 1.00 . A A . 4 GLU CB 1 1 6 3935 1 1 4 GLU CD C 4.276 -5.812 11.106 1.00 . A A . 4 GLU CD 1 1 6 3936 1 1 4 GLU CG C 4.817 -5.128 9.848 1.00 . A A . 4 GLU CG 1 1 6 3937 1 1 4 GLU H H 2.789 -2.398 8.076 1.00 . A A . 4 GLU H 1 1 6 3938 1 1 4 GLU HA H 5.469 -2.191 8.903 1.00 . A A . 4 GLU HA 1 1 6 3939 1 1 4 GLU HB2 H 4.376 -3.175 10.622 1.00 . A A . 4 GLU HB2 1 1 6 3940 1 1 4 GLU HB3 H 3.141 -3.826 9.553 1.00 . A A . 4 GLU HB3 1 1 6 3941 1 1 4 GLU HG2 H 4.559 -5.715 8.979 1.00 . A A . 4 GLU HG2 1 1 6 3942 1 1 4 GLU HG3 H 5.890 -5.041 9.919 1.00 . A A . 4 GLU HG3 1 1 6 3943 1 1 4 GLU N N 3.709 -2.348 7.759 1.00 . A A . 4 GLU N 1 1 6 3944 1 1 4 GLU O O 6.768 -4.121 7.746 1.00 . A A . 4 GLU O 1 1 6 3945 1 1 4 GLU OE1 O 4.763 -5.503 12.181 1.00 . A A . 4 GLU OE1 1 1 6 3946 1 1 4 GLU OE2 O 3.383 -6.633 10.972 1.00 . A A . 4 GLU OE2 1 1 6 3947 1 1 5 GLN C C 5.812 -4.499 4.312 1.00 . A A . 5 GLN C 1 1 6 3948 1 1 5 GLN CA C 5.586 -5.291 5.602 1.00 . A A . 5 GLN CA 1 1 6 3949 1 1 5 GLN CB C 4.676 -6.487 5.313 1.00 . A A . 5 GLN CB 1 1 6 3950 1 1 5 GLN CD C 5.737 -8.560 6.230 1.00 . A A . 5 GLN CD 1 1 6 3951 1 1 5 GLN CG C 5.523 -7.716 4.972 1.00 . A A . 5 GLN CG 1 1 6 3952 1 1 5 GLN H H 3.968 -4.181 6.479 1.00 . A A . 5 GLN H 1 1 6 3953 1 1 5 GLN HA H 6.532 -5.633 5.995 1.00 . A A . 5 GLN HA 1 1 6 3954 1 1 5 GLN HB2 H 4.072 -6.696 6.184 1.00 . A A . 5 GLN HB2 1 1 6 3955 1 1 5 GLN HB3 H 4.033 -6.254 4.478 1.00 . A A . 5 GLN HB3 1 1 6 3956 1 1 5 GLN HE21 H 3.940 -9.403 6.146 1.00 . A A . 5 GLN HE21 1 1 6 3957 1 1 5 GLN HE22 H 4.914 -9.898 7.445 1.00 . A A . 5 GLN HE22 1 1 6 3958 1 1 5 GLN HG2 H 5.012 -8.306 4.224 1.00 . A A . 5 GLN HG2 1 1 6 3959 1 1 5 GLN HG3 H 6.480 -7.397 4.587 1.00 . A A . 5 GLN HG3 1 1 6 3960 1 1 5 GLN N N 4.917 -4.398 6.588 1.00 . A A . 5 GLN N 1 1 6 3961 1 1 5 GLN NE2 N 4.784 -9.353 6.641 1.00 . A A . 5 GLN NE2 1 1 6 3962 1 1 5 GLN O O 6.755 -4.727 3.581 1.00 . A A . 5 GLN O 1 1 6 3963 1 1 5 GLN OE1 O 6.783 -8.500 6.844 1.00 . A A . 5 GLN OE1 1 1 6 3964 1 1 6 CYS C C 5.759 -1.422 3.148 1.00 . A A . 6 CYS C 1 1 6 3965 1 1 6 CYS CA C 5.060 -2.748 2.808 1.00 . A A . 6 CYS CA 1 1 6 3966 1 1 6 CYS CB C 3.643 -2.492 2.303 1.00 . A A . 6 CYS CB 1 1 6 3967 1 1 6 CYS H H 4.187 -3.413 4.639 1.00 . A A . 6 CYS H 1 1 6 3968 1 1 6 CYS HA H 5.625 -3.283 2.060 1.00 . A A . 6 CYS HA 1 1 6 3969 1 1 6 CYS HB2 H 3.046 -2.084 3.104 1.00 . A A . 6 CYS HB2 1 1 6 3970 1 1 6 CYS HB3 H 3.662 -1.804 1.493 1.00 . A A . 6 CYS HB3 1 1 6 3971 1 1 6 CYS N N 4.939 -3.571 4.035 1.00 . A A . 6 CYS N 1 1 6 3972 1 1 6 CYS O O 5.804 -0.498 2.357 1.00 . A A . 6 CYS O 1 1 6 3973 1 1 6 CYS SG S 2.922 -4.058 1.756 1.00 . A A . 6 CYS SG 1 1 6 3974 1 1 7 CYS C C 8.387 -0.444 5.296 1.00 . A A . 7 CYS C 1 1 6 3975 1 1 7 CYS CA C 6.995 -0.087 4.765 1.00 . A A . 7 CYS CA 1 1 6 3976 1 1 7 CYS CB C 6.181 0.595 5.872 1.00 . A A . 7 CYS CB 1 1 6 3977 1 1 7 CYS H H 6.243 -2.089 4.946 1.00 . A A . 7 CYS H 1 1 6 3978 1 1 7 CYS HA H 7.089 0.586 3.928 1.00 . A A . 7 CYS HA 1 1 6 3979 1 1 7 CYS HB2 H 5.167 0.738 5.536 1.00 . A A . 7 CYS HB2 1 1 6 3980 1 1 7 CYS HB3 H 6.179 -0.019 6.756 1.00 . A A . 7 CYS HB3 1 1 6 3981 1 1 7 CYS N N 6.300 -1.331 4.330 1.00 . A A . 7 CYS N 1 1 6 3982 1 1 7 CYS O O 9.313 0.338 5.204 1.00 . A A . 7 CYS O 1 1 6 3983 1 1 7 CYS SG S 6.920 2.199 6.263 1.00 . A A . 7 CYS SG 1 1 6 3984 1 1 8 THR C C 10.698 -2.677 5.267 1.00 . A A . 8 THR C 1 1 6 3985 1 1 8 THR CA C 9.884 -2.014 6.379 1.00 . A A . 8 THR CA 1 1 6 3986 1 1 8 THR CB C 9.707 -2.999 7.536 1.00 . A A . 8 THR CB 1 1 6 3987 1 1 8 THR CG2 C 8.674 -2.451 8.523 1.00 . A A . 8 THR CG2 1 1 6 3988 1 1 8 THR H H 7.793 -2.248 5.918 1.00 . A A . 8 THR H 1 1 6 3989 1 1 8 THR HA H 10.405 -1.135 6.730 1.00 . A A . 8 THR HA 1 1 6 3990 1 1 8 THR HB H 10.649 -3.131 8.044 1.00 . A A . 8 THR HB 1 1 6 3991 1 1 8 THR HG1 H 10.021 -4.841 6.998 1.00 . A A . 8 THR HG1 1 1 6 3992 1 1 8 THR HG21 H 8.191 -3.272 9.032 1.00 . A A . 8 THR HG21 1 1 6 3993 1 1 8 THR HG22 H 7.935 -1.874 7.987 1.00 . A A . 8 THR HG22 1 1 6 3994 1 1 8 THR HG23 H 9.169 -1.820 9.247 1.00 . A A . 8 THR HG23 1 1 6 3995 1 1 8 THR N N 8.548 -1.622 5.850 1.00 . A A . 8 THR N 1 1 6 3996 1 1 8 THR O O 11.913 -2.632 5.263 1.00 . A A . 8 THR O 1 1 6 3997 1 1 8 THR OG1 O 9.265 -4.250 7.027 1.00 . A A . 8 THR OG1 1 1 6 3998 1 1 9 SER C C 10.374 -3.322 1.879 1.00 . A A . 9 SER C 1 1 6 3999 1 1 9 SER CA C 10.782 -3.956 3.213 1.00 . A A . 9 SER CA 1 1 6 4000 1 1 9 SER CB C 10.458 -5.451 3.207 1.00 . A A . 9 SER CB 1 1 6 4001 1 1 9 SER H H 9.061 -3.317 4.343 1.00 . A A . 9 SER H 1 1 6 4002 1 1 9 SER HA H 11.841 -3.821 3.360 1.00 . A A . 9 SER HA 1 1 6 4003 1 1 9 SER HB2 H 10.548 -5.838 2.205 1.00 . A A . 9 SER HB2 1 1 6 4004 1 1 9 SER HB3 H 11.152 -5.972 3.855 1.00 . A A . 9 SER HB3 1 1 6 4005 1 1 9 SER HG H 9.159 -5.799 4.612 1.00 . A A . 9 SER HG 1 1 6 4006 1 1 9 SER N N 10.041 -3.292 4.322 1.00 . A A . 9 SER N 1 1 6 4007 1 1 9 SER O O 10.836 -2.255 1.525 1.00 . A A . 9 SER O 1 1 6 4008 1 1 9 SER OG O 9.127 -5.645 3.665 1.00 . A A . 9 SER OG 1 1 6 4009 1 1 10 ILE C C 7.685 -3.897 -0.514 1.00 . A A . 10 ILE C 1 1 6 4010 1 1 10 ILE CA C 9.091 -3.390 -0.169 1.00 . A A . 10 ILE CA 1 1 6 4011 1 1 10 ILE CB C 10.089 -3.823 -1.254 1.00 . A A . 10 ILE CB 1 1 6 4012 1 1 10 ILE CD1 C 12.333 -3.285 -0.290 1.00 . A A . 10 ILE CD1 1 1 6 4013 1 1 10 ILE CG1 C 11.260 -2.842 -1.286 1.00 . A A . 10 ILE CG1 1 1 6 4014 1 1 10 ILE CG2 C 9.408 -3.836 -2.623 1.00 . A A . 10 ILE CG2 1 1 6 4015 1 1 10 ILE H H 9.153 -4.820 1.428 1.00 . A A . 10 ILE H 1 1 6 4016 1 1 10 ILE HA H 9.078 -2.312 -0.101 1.00 . A A . 10 ILE HA 1 1 6 4017 1 1 10 ILE HB H 10.457 -4.811 -1.029 1.00 . A A . 10 ILE HB 1 1 6 4018 1 1 10 ILE HD11 H 12.587 -2.457 0.356 1.00 . A A . 10 ILE HD11 1 1 6 4019 1 1 10 ILE HD12 H 13.214 -3.605 -0.827 1.00 . A A . 10 ILE HD12 1 1 6 4020 1 1 10 ILE HD13 H 11.956 -4.102 0.306 1.00 . A A . 10 ILE HD13 1 1 6 4021 1 1 10 ILE HG12 H 11.680 -2.821 -2.280 1.00 . A A . 10 ILE HG12 1 1 6 4022 1 1 10 ILE HG13 H 10.909 -1.858 -1.019 1.00 . A A . 10 ILE HG13 1 1 6 4023 1 1 10 ILE HG21 H 10.157 -3.817 -3.398 1.00 . A A . 10 ILE HG21 1 1 6 4024 1 1 10 ILE HG22 H 8.770 -2.969 -2.714 1.00 . A A . 10 ILE HG22 1 1 6 4025 1 1 10 ILE HG23 H 8.812 -4.733 -2.718 1.00 . A A . 10 ILE HG23 1 1 6 4026 1 1 10 ILE N N 9.515 -3.963 1.134 1.00 . A A . 10 ILE N 1 1 6 4027 1 1 10 ILE O O 7.347 -5.038 -0.267 1.00 . A A . 10 ILE O 1 1 6 4028 1 1 11 CYS C C 5.256 -3.202 -2.961 1.00 . A A . 11 CYS C 1 1 6 4029 1 1 11 CYS CA C 5.501 -3.515 -1.486 1.00 . A A . 11 CYS CA 1 1 6 4030 1 1 11 CYS CB C 4.452 -2.847 -0.607 1.00 . A A . 11 CYS CB 1 1 6 4031 1 1 11 CYS H H 7.171 -2.149 -1.314 1.00 . A A . 11 CYS H 1 1 6 4032 1 1 11 CYS HA H 5.425 -4.576 -1.349 1.00 . A A . 11 CYS HA 1 1 6 4033 1 1 11 CYS HB2 H 4.908 -2.511 0.313 1.00 . A A . 11 CYS HB2 1 1 6 4034 1 1 11 CYS HB3 H 4.018 -2.009 -1.130 1.00 . A A . 11 CYS HB3 1 1 6 4035 1 1 11 CYS N N 6.872 -3.064 -1.105 1.00 . A A . 11 CYS N 1 1 6 4036 1 1 11 CYS O O 5.396 -2.081 -3.407 1.00 . A A . 11 CYS O 1 1 6 4037 1 1 11 CYS SG S 3.171 -4.081 -0.250 1.00 . A A . 11 CYS SG 1 1 6 4038 1 1 12 SER C C 3.308 -3.405 -5.434 1.00 . A A . 12 SER C 1 1 6 4039 1 1 12 SER CA C 4.686 -4.008 -5.185 1.00 . A A . 12 SER CA 1 1 6 4040 1 1 12 SER CB C 4.780 -5.359 -5.894 1.00 . A A . 12 SER CB 1 1 6 4041 1 1 12 SER H H 4.831 -5.103 -3.340 1.00 . A A . 12 SER H 1 1 6 4042 1 1 12 SER HA H 5.437 -3.344 -5.587 1.00 . A A . 12 SER HA 1 1 6 4043 1 1 12 SER HB2 H 4.050 -5.405 -6.685 1.00 . A A . 12 SER HB2 1 1 6 4044 1 1 12 SER HB3 H 5.771 -5.476 -6.314 1.00 . A A . 12 SER HB3 1 1 6 4045 1 1 12 SER HG H 5.366 -6.750 -4.665 1.00 . A A . 12 SER HG 1 1 6 4046 1 1 12 SER N N 4.915 -4.206 -3.726 1.00 . A A . 12 SER N 1 1 6 4047 1 1 12 SER O O 2.423 -3.456 -4.602 1.00 . A A . 12 SER O 1 1 6 4048 1 1 12 SER OG O 4.521 -6.399 -4.959 1.00 . A A . 12 SER OG 1 1 6 4049 1 1 13 LEU C C 0.741 -3.273 -6.998 1.00 . A A . 13 LEU C 1 1 6 4050 1 1 13 LEU CA C 1.837 -2.209 -6.949 1.00 . A A . 13 LEU CA 1 1 6 4051 1 1 13 LEU CB C 1.968 -1.567 -8.326 1.00 . A A . 13 LEU CB 1 1 6 4052 1 1 13 LEU CD1 C 1.683 -2.404 -10.661 1.00 . A A . 13 LEU CD1 1 1 6 4053 1 1 13 LEU CD2 C 3.887 -2.623 -9.524 1.00 . A A . 13 LEU CD2 1 1 6 4054 1 1 13 LEU CG C 2.372 -2.649 -9.323 1.00 . A A . 13 LEU CG 1 1 6 4055 1 1 13 LEU H H 3.876 -2.813 -7.228 1.00 . A A . 13 LEU H 1 1 6 4056 1 1 13 LEU HA H 1.582 -1.459 -6.225 1.00 . A A . 13 LEU HA 1 1 6 4057 1 1 13 LEU HB2 H 1.021 -1.135 -8.619 1.00 . A A . 13 LEU HB2 1 1 6 4058 1 1 13 LEU HB3 H 2.726 -0.800 -8.300 1.00 . A A . 13 LEU HB3 1 1 6 4059 1 1 13 LEU HD11 H 1.585 -3.340 -11.190 1.00 . A A . 13 LEU HD11 1 1 6 4060 1 1 13 LEU HD12 H 2.275 -1.717 -11.248 1.00 . A A . 13 LEU HD12 1 1 6 4061 1 1 13 LEU HD13 H 0.705 -1.982 -10.488 1.00 . A A . 13 LEU HD13 1 1 6 4062 1 1 13 LEU HD21 H 4.111 -2.296 -10.528 1.00 . A A . 13 LEU HD21 1 1 6 4063 1 1 13 LEU HD22 H 4.286 -3.615 -9.370 1.00 . A A . 13 LEU HD22 1 1 6 4064 1 1 13 LEU HD23 H 4.332 -1.942 -8.814 1.00 . A A . 13 LEU HD23 1 1 6 4065 1 1 13 LEU HG H 2.076 -3.612 -8.936 1.00 . A A . 13 LEU HG 1 1 6 4066 1 1 13 LEU N N 3.136 -2.833 -6.589 1.00 . A A . 13 LEU N 1 1 6 4067 1 1 13 LEU O O -0.430 -2.960 -7.087 1.00 . A A . 13 LEU O 1 1 6 4068 1 1 14 TYR C C -0.120 -6.046 -5.526 1.00 . A A . 14 TYR C 1 1 6 4069 1 1 14 TYR CA C 0.047 -5.576 -6.945 1.00 . A A . 14 TYR CA 1 1 6 4070 1 1 14 TYR CB C 0.482 -6.735 -7.847 1.00 . A A . 14 TYR CB 1 1 6 4071 1 1 14 TYR CD1 C -1.065 -8.460 -6.839 1.00 . A A . 14 TYR CD1 1 1 6 4072 1 1 14 TYR CD2 C -1.261 -7.952 -9.204 1.00 . A A . 14 TYR CD2 1 1 6 4073 1 1 14 TYR CE1 C -2.106 -9.391 -6.953 1.00 . A A . 14 TYR CE1 1 1 6 4074 1 1 14 TYR CE2 C -2.302 -8.883 -9.318 1.00 . A A . 14 TYR CE2 1 1 6 4075 1 1 14 TYR CG C -0.642 -7.739 -7.965 1.00 . A A . 14 TYR CG 1 1 6 4076 1 1 14 TYR CZ C -2.724 -9.602 -8.192 1.00 . A A . 14 TYR CZ 1 1 6 4077 1 1 14 TYR H H 2.042 -4.776 -6.817 1.00 . A A . 14 TYR H 1 1 6 4078 1 1 14 TYR HA H -0.877 -5.152 -7.289 1.00 . A A . 14 TYR HA 1 1 6 4079 1 1 14 TYR HB2 H 0.727 -6.352 -8.828 1.00 . A A . 14 TYR HB2 1 1 6 4080 1 1 14 TYR HB3 H 1.351 -7.215 -7.422 1.00 . A A . 14 TYR HB3 1 1 6 4081 1 1 14 TYR HD1 H -0.588 -8.300 -5.883 1.00 . A A . 14 TYR HD1 1 1 6 4082 1 1 14 TYR HD2 H -0.937 -7.398 -10.072 1.00 . A A . 14 TYR HD2 1 1 6 4083 1 1 14 TYR HE1 H -2.432 -9.946 -6.086 1.00 . A A . 14 TYR HE1 1 1 6 4084 1 1 14 TYR HE2 H -2.779 -9.047 -10.273 1.00 . A A . 14 TYR HE2 1 1 6 4085 1 1 14 TYR HH H -3.370 -11.357 -8.580 1.00 . A A . 14 TYR HH 1 1 6 4086 1 1 14 TYR N N 1.095 -4.526 -6.920 1.00 . A A . 14 TYR N 1 1 6 4087 1 1 14 TYR O O -1.201 -6.354 -5.065 1.00 . A A . 14 TYR O 1 1 6 4088 1 1 14 TYR OH O -3.749 -10.519 -8.304 1.00 . A A . 14 TYR OH 1 1 6 4089 1 1 15 GLN C C 0.163 -5.299 -2.689 1.00 . A A . 15 GLN C 1 1 6 4090 1 1 15 GLN CA C 0.915 -6.414 -3.405 1.00 . A A . 15 GLN CA 1 1 6 4091 1 1 15 GLN CB C 2.349 -6.485 -2.912 1.00 . A A . 15 GLN CB 1 1 6 4092 1 1 15 GLN CD C 2.136 -8.651 -1.682 1.00 . A A . 15 GLN CD 1 1 6 4093 1 1 15 GLN CG C 2.803 -7.943 -2.863 1.00 . A A . 15 GLN CG 1 1 6 4094 1 1 15 GLN H H 1.799 -5.744 -5.221 1.00 . A A . 15 GLN H 1 1 6 4095 1 1 15 GLN HA H 0.415 -7.361 -3.272 1.00 . A A . 15 GLN HA 1 1 6 4096 1 1 15 GLN HB2 H 2.982 -5.933 -3.600 1.00 . A A . 15 GLN HB2 1 1 6 4097 1 1 15 GLN HB3 H 2.413 -6.047 -1.936 1.00 . A A . 15 GLN HB3 1 1 6 4098 1 1 15 GLN HE21 H 3.727 -8.493 -0.505 1.00 . A A . 15 GLN HE21 1 1 6 4099 1 1 15 GLN HE22 H 2.387 -9.270 0.189 1.00 . A A . 15 GLN HE22 1 1 6 4100 1 1 15 GLN HG2 H 2.523 -8.435 -3.785 1.00 . A A . 15 GLN HG2 1 1 6 4101 1 1 15 GLN HG3 H 3.875 -7.982 -2.747 1.00 . A A . 15 GLN HG3 1 1 6 4102 1 1 15 GLN N N 0.955 -6.041 -4.820 1.00 . A A . 15 GLN N 1 1 6 4103 1 1 15 GLN NE2 N 2.806 -8.819 -0.574 1.00 . A A . 15 GLN NE2 1 1 6 4104 1 1 15 GLN O O -0.527 -5.508 -1.710 1.00 . A A . 15 GLN O 1 1 6 4105 1 1 15 GLN OE1 O 0.994 -9.057 -1.768 1.00 . A A . 15 GLN OE1 1 1 6 4106 1 1 16 LEU C C -1.843 -2.951 -3.181 1.00 . A A . 16 LEU C 1 1 6 4107 1 1 16 LEU CA C -0.431 -2.946 -2.639 1.00 . A A . 16 LEU CA 1 1 6 4108 1 1 16 LEU CB C 0.312 -1.678 -3.047 1.00 . A A . 16 LEU CB 1 1 6 4109 1 1 16 LEU CD1 C 2.471 -0.448 -2.715 1.00 . A A . 16 LEU CD1 1 1 6 4110 1 1 16 LEU CD2 C 1.475 -1.783 -0.859 1.00 . A A . 16 LEU CD2 1 1 6 4111 1 1 16 LEU CG C 1.679 -1.704 -2.368 1.00 . A A . 16 LEU CG 1 1 6 4112 1 1 16 LEU H H 0.814 -3.991 -4.031 1.00 . A A . 16 LEU H 1 1 6 4113 1 1 16 LEU HA H -0.458 -3.025 -1.566 1.00 . A A . 16 LEU HA 1 1 6 4114 1 1 16 LEU HB2 H 0.437 -1.652 -4.120 1.00 . A A . 16 LEU HB2 1 1 6 4115 1 1 16 LEU HB3 H -0.239 -0.814 -2.725 1.00 . A A . 16 LEU HB3 1 1 6 4116 1 1 16 LEU HD11 H 2.125 0.374 -2.111 1.00 . A A . 16 LEU HD11 1 1 6 4117 1 1 16 LEU HD12 H 2.334 -0.215 -3.760 1.00 . A A . 16 LEU HD12 1 1 6 4118 1 1 16 LEU HD13 H 3.520 -0.623 -2.519 1.00 . A A . 16 LEU HD13 1 1 6 4119 1 1 16 LEU HD21 H 1.090 -2.761 -0.602 1.00 . A A . 16 LEU HD21 1 1 6 4120 1 1 16 LEU HD22 H 0.772 -1.029 -0.551 1.00 . A A . 16 LEU HD22 1 1 6 4121 1 1 16 LEU HD23 H 2.418 -1.628 -0.358 1.00 . A A . 16 LEU HD23 1 1 6 4122 1 1 16 LEU HG H 2.226 -2.573 -2.700 1.00 . A A . 16 LEU HG 1 1 6 4123 1 1 16 LEU N N 0.276 -4.111 -3.219 1.00 . A A . 16 LEU N 1 1 6 4124 1 1 16 LEU O O -2.770 -2.466 -2.561 1.00 . A A . 16 LEU O 1 1 6 4125 1 1 17 GLU C C -4.154 -4.648 -4.082 1.00 . A A . 17 GLU C 1 1 6 4126 1 1 17 GLU CA C -3.362 -3.638 -4.909 1.00 . A A . 17 GLU CA 1 1 6 4127 1 1 17 GLU CB C -3.233 -4.137 -6.351 1.00 . A A . 17 GLU CB 1 1 6 4128 1 1 17 GLU CD C -5.351 -5.426 -6.667 1.00 . A A . 17 GLU CD 1 1 6 4129 1 1 17 GLU CG C -4.606 -4.138 -7.024 1.00 . A A . 17 GLU CG 1 1 6 4130 1 1 17 GLU H H -1.255 -3.953 -4.785 1.00 . A A . 17 GLU H 1 1 6 4131 1 1 17 GLU HA H -3.843 -2.674 -4.889 1.00 . A A . 17 GLU HA 1 1 6 4132 1 1 17 GLU HB2 H -2.563 -3.490 -6.896 1.00 . A A . 17 GLU HB2 1 1 6 4133 1 1 17 GLU HB3 H -2.834 -5.140 -6.348 1.00 . A A . 17 GLU HB3 1 1 6 4134 1 1 17 GLU HG2 H -5.173 -3.286 -6.682 1.00 . A A . 17 GLU HG2 1 1 6 4135 1 1 17 GLU HG3 H -4.481 -4.081 -8.094 1.00 . A A . 17 GLU HG3 1 1 6 4136 1 1 17 GLU N N -2.016 -3.542 -4.324 1.00 . A A . 17 GLU N 1 1 6 4137 1 1 17 GLU O O -5.371 -4.633 -4.042 1.00 . A A . 17 GLU O 1 1 6 4138 1 1 17 GLU OE1 O -4.763 -6.263 -6.002 1.00 . A A . 17 GLU OE1 1 1 6 4139 1 1 17 GLU OE2 O -6.496 -5.553 -7.067 1.00 . A A . 17 GLU OE2 1 1 6 4140 1 1 18 ASN C C -4.563 -5.958 -1.244 1.00 . A A . 18 ASN C 1 1 6 4141 1 1 18 ASN CA C -4.152 -6.557 -2.585 1.00 . A A . 18 ASN CA 1 1 6 4142 1 1 18 ASN CB C -3.213 -7.742 -2.349 1.00 . A A . 18 ASN CB 1 1 6 4143 1 1 18 ASN CG C -4.006 -8.910 -1.761 1.00 . A A . 18 ASN CG 1 1 6 4144 1 1 18 ASN H H -2.473 -5.510 -3.446 1.00 . A A . 18 ASN H 1 1 6 4145 1 1 18 ASN HA H -5.032 -6.899 -3.109 1.00 . A A . 18 ASN HA 1 1 6 4146 1 1 18 ASN HB2 H -2.769 -8.042 -3.287 1.00 . A A . 18 ASN HB2 1 1 6 4147 1 1 18 ASN HB3 H -2.436 -7.453 -1.658 1.00 . A A . 18 ASN HB3 1 1 6 4148 1 1 18 ASN HD21 H -5.013 -9.257 -3.438 1.00 . A A . 18 ASN HD21 1 1 6 4149 1 1 18 ASN HD22 H -5.386 -10.286 -2.140 1.00 . A A . 18 ASN HD22 1 1 6 4150 1 1 18 ASN N N -3.457 -5.529 -3.409 1.00 . A A . 18 ASN N 1 1 6 4151 1 1 18 ASN ND2 N -4.873 -9.537 -2.508 1.00 . A A . 18 ASN ND2 1 1 6 4152 1 1 18 ASN O O -5.131 -6.628 -0.404 1.00 . A A . 18 ASN O 1 1 6 4153 1 1 18 ASN OD1 O -3.834 -9.257 -0.609 1.00 . A A . 18 ASN OD1 1 1 6 4154 1 1 19 TYR C C -5.882 -3.176 0.063 1.00 . A A . 19 TYR C 1 1 6 4155 1 1 19 TYR CA C -4.666 -4.083 0.262 1.00 . A A . 19 TYR CA 1 1 6 4156 1 1 19 TYR CB C -3.495 -3.262 0.804 1.00 . A A . 19 TYR CB 1 1 6 4157 1 1 19 TYR CD1 C -2.874 -4.945 2.579 1.00 . A A . 19 TYR CD1 1 1 6 4158 1 1 19 TYR CD2 C -1.193 -4.280 0.961 1.00 . A A . 19 TYR CD2 1 1 6 4159 1 1 19 TYR CE1 C -1.948 -5.802 3.189 1.00 . A A . 19 TYR CE1 1 1 6 4160 1 1 19 TYR CE2 C -0.267 -5.137 1.570 1.00 . A A . 19 TYR CE2 1 1 6 4161 1 1 19 TYR CG C -2.497 -4.184 1.464 1.00 . A A . 19 TYR CG 1 1 6 4162 1 1 19 TYR CZ C -0.644 -5.897 2.685 1.00 . A A . 19 TYR CZ 1 1 6 4163 1 1 19 TYR H H -3.826 -4.176 -1.716 1.00 . A A . 19 TYR H 1 1 6 4164 1 1 19 TYR HA H -4.913 -4.858 0.971 1.00 . A A . 19 TYR HA 1 1 6 4165 1 1 19 TYR HB2 H -3.017 -2.735 -0.009 1.00 . A A . 19 TYR HB2 1 1 6 4166 1 1 19 TYR HB3 H -3.860 -2.553 1.530 1.00 . A A . 19 TYR HB3 1 1 6 4167 1 1 19 TYR HD1 H -3.879 -4.871 2.969 1.00 . A A . 19 TYR HD1 1 1 6 4168 1 1 19 TYR HD2 H -0.903 -3.694 0.104 1.00 . A A . 19 TYR HD2 1 1 6 4169 1 1 19 TYR HE1 H -2.239 -6.388 4.048 1.00 . A A . 19 TYR HE1 1 1 6 4170 1 1 19 TYR HE2 H 0.739 -5.210 1.181 1.00 . A A . 19 TYR HE2 1 1 6 4171 1 1 19 TYR HH H 0.111 -6.723 4.231 1.00 . A A . 19 TYR HH 1 1 6 4172 1 1 19 TYR N N -4.284 -4.705 -1.030 1.00 . A A . 19 TYR N 1 1 6 4173 1 1 19 TYR O O -6.266 -2.444 0.954 1.00 . A A . 19 TYR O 1 1 6 4174 1 1 19 TYR OH O 0.268 -6.741 3.284 1.00 . A A . 19 TYR OH 1 1 6 4175 1 1 20 CYS C C -8.930 -3.033 -0.697 1.00 . A A . 20 CYS C 1 1 6 4176 1 1 20 CYS CA C -7.701 -2.344 -1.293 1.00 . A A . 20 CYS CA 1 1 6 4177 1 1 20 CYS CB C -7.939 -2.094 -2.785 1.00 . A A . 20 CYS CB 1 1 6 4178 1 1 20 CYS H H -6.196 -3.813 -1.801 1.00 . A A . 20 CYS H 1 1 6 4179 1 1 20 CYS HA H -7.543 -1.400 -0.791 1.00 . A A . 20 CYS HA 1 1 6 4180 1 1 20 CYS HB2 H -8.562 -2.878 -3.189 1.00 . A A . 20 CYS HB2 1 1 6 4181 1 1 20 CYS HB3 H -8.437 -1.143 -2.911 1.00 . A A . 20 CYS HB3 1 1 6 4182 1 1 20 CYS N N -6.504 -3.215 -1.089 1.00 . A A . 20 CYS N 1 1 6 4183 1 1 20 CYS O O -8.915 -4.216 -0.418 1.00 . A A . 20 CYS O 1 1 6 4184 1 1 20 CYS SG S -6.363 -2.064 -3.669 1.00 . A A . 20 CYS SG 1 1 6 4185 1 1 21 ASN C C -12.052 -3.548 -1.048 1.00 . A A . 21 ASN C 1 1 6 4186 1 1 21 ASN CA C -11.221 -2.925 0.076 1.00 . A A . 21 ASN CA 1 1 6 4187 1 1 21 ASN CB C -12.049 -1.853 0.787 1.00 . A A . 21 ASN CB 1 1 6 4188 1 1 21 ASN CG C -13.217 -2.514 1.522 1.00 . A A . 21 ASN CG 1 1 6 4189 1 1 21 ASN H H -9.989 -1.354 -0.733 1.00 . A A . 21 ASN H 1 1 6 4190 1 1 21 ASN HA H -10.940 -3.691 0.783 1.00 . A A . 21 ASN HA 1 1 6 4191 1 1 21 ASN HB2 H -11.426 -1.328 1.497 1.00 . A A . 21 ASN HB2 1 1 6 4192 1 1 21 ASN HB3 H -12.434 -1.154 0.060 1.00 . A A . 21 ASN HB3 1 1 6 4193 1 1 21 ASN HD21 H -12.367 -2.361 3.310 1.00 . A A . 21 ASN HD21 1 1 6 4194 1 1 21 ASN HD22 H -13.900 -3.091 3.295 1.00 . A A . 21 ASN HD22 1 1 6 4195 1 1 21 ASN N N -9.995 -2.306 -0.500 1.00 . A A . 21 ASN N 1 1 6 4196 1 1 21 ASN ND2 N -13.156 -2.668 2.817 1.00 . A A . 21 ASN ND2 1 1 6 4197 1 1 21 ASN O O -11.585 -4.505 -1.643 1.00 . A A . 21 ASN O 1 1 6 4198 1 1 21 ASN OXT O -13.142 -3.057 -1.294 1.00 . A A . 21 ASN OXT 1 1 6 4199 1 1 21 ASN OD1 O -14.196 -2.896 0.911 1.00 . A A . 21 ASN OD1 1 1 6 4200 2 2 1 PHE C C 6.545 0.427 -8.771 1.00 . B B . 1 PHE C 1 1 6 4201 2 2 1 PHE CA C 5.082 0.748 -8.459 1.00 . B B . 1 PHE CA 1 1 6 4202 2 2 1 PHE CB C 4.851 2.255 -8.597 1.00 . B B . 1 PHE CB 1 1 6 4203 2 2 1 PHE CD1 C 3.275 2.532 -10.549 1.00 . B B . 1 PHE CD1 1 1 6 4204 2 2 1 PHE CD2 C 5.638 2.974 -10.881 1.00 . B B . 1 PHE CD2 1 1 6 4205 2 2 1 PHE CE1 C 3.027 2.848 -11.892 1.00 . B B . 1 PHE CE1 1 1 6 4206 2 2 1 PHE CE2 C 5.390 3.290 -12.223 1.00 . B B . 1 PHE CE2 1 1 6 4207 2 2 1 PHE CG C 4.581 2.595 -10.044 1.00 . B B . 1 PHE CG 1 1 6 4208 2 2 1 PHE CZ C 4.085 3.226 -12.729 1.00 . B B . 1 PHE CZ 1 1 6 4209 2 2 1 PHE H1 H 3.741 0.148 -6.982 1.00 . B B . 1 PHE H1 1 1 6 4210 2 2 1 PHE H2 H 5.043 1.074 -6.402 1.00 . B B . 1 PHE H2 1 1 6 4211 2 2 1 PHE H3 H 5.280 -0.550 -6.842 1.00 . B B . 1 PHE H3 1 1 6 4212 2 2 1 PHE HA H 4.442 0.221 -9.152 1.00 . B B . 1 PHE HA 1 1 6 4213 2 2 1 PHE HB2 H 4.004 2.546 -7.994 1.00 . B B . 1 PHE HB2 1 1 6 4214 2 2 1 PHE HB3 H 5.731 2.785 -8.263 1.00 . B B . 1 PHE HB3 1 1 6 4215 2 2 1 PHE HD1 H 2.460 2.239 -9.903 1.00 . B B . 1 PHE HD1 1 1 6 4216 2 2 1 PHE HD2 H 6.644 3.023 -10.492 1.00 . B B . 1 PHE HD2 1 1 6 4217 2 2 1 PHE HE1 H 2.021 2.799 -12.282 1.00 . B B . 1 PHE HE1 1 1 6 4218 2 2 1 PHE HE2 H 6.206 3.582 -12.869 1.00 . B B . 1 PHE HE2 1 1 6 4219 2 2 1 PHE HZ H 3.895 3.470 -13.764 1.00 . B B . 1 PHE HZ 1 1 6 4220 2 2 1 PHE N N 4.763 0.323 -7.066 1.00 . B B . 1 PHE N 1 1 6 4221 2 2 1 PHE O O 6.930 0.291 -9.916 1.00 . B B . 1 PHE O 1 1 6 4222 2 2 2 VAL C C 9.325 -0.920 -6.898 1.00 . B B . 2 VAL C 1 1 6 4223 2 2 2 VAL CA C 8.803 -0.001 -8.004 1.00 . B B . 2 VAL CA 1 1 6 4224 2 2 2 VAL CB C 9.607 1.301 -8.005 1.00 . B B . 2 VAL CB 1 1 6 4225 2 2 2 VAL CG1 C 9.145 2.185 -9.164 1.00 . B B . 2 VAL CG1 1 1 6 4226 2 2 2 VAL CG2 C 9.385 2.039 -6.682 1.00 . B B . 2 VAL CG2 1 1 6 4227 2 2 2 VAL H H 7.036 0.424 -6.847 1.00 . B B . 2 VAL H 1 1 6 4228 2 2 2 VAL HA H 8.911 -0.491 -8.961 1.00 . B B . 2 VAL HA 1 1 6 4229 2 2 2 VAL HB H 10.657 1.075 -8.121 1.00 . B B . 2 VAL HB 1 1 6 4230 2 2 2 VAL HG11 H 8.093 2.402 -9.053 1.00 . B B . 2 VAL HG11 1 1 6 4231 2 2 2 VAL HG12 H 9.311 1.669 -10.098 1.00 . B B . 2 VAL HG12 1 1 6 4232 2 2 2 VAL HG13 H 9.706 3.108 -9.158 1.00 . B B . 2 VAL HG13 1 1 6 4233 2 2 2 VAL HG21 H 8.861 2.965 -6.870 1.00 . B B . 2 VAL HG21 1 1 6 4234 2 2 2 VAL HG22 H 10.339 2.253 -6.224 1.00 . B B . 2 VAL HG22 1 1 6 4235 2 2 2 VAL HG23 H 8.797 1.422 -6.019 1.00 . B B . 2 VAL HG23 1 1 6 4236 2 2 2 VAL N N 7.365 0.308 -7.762 1.00 . B B . 2 VAL N 1 1 6 4237 2 2 2 VAL O O 8.565 -1.500 -6.148 1.00 . B B . 2 VAL O 1 1 6 4238 2 2 3 ASN C C 11.670 -1.048 -4.578 1.00 . B B . 3 ASN C 1 1 6 4239 2 2 3 ASN CA C 11.189 -1.924 -5.724 1.00 . B B . 3 ASN CA 1 1 6 4240 2 2 3 ASN CB C 12.356 -2.723 -6.284 1.00 . B B . 3 ASN CB 1 1 6 4241 2 2 3 ASN CG C 13.243 -1.814 -7.136 1.00 . B B . 3 ASN CG 1 1 6 4242 2 2 3 ASN H H 11.215 -0.568 -7.395 1.00 . B B . 3 ASN H 1 1 6 4243 2 2 3 ASN HA H 10.427 -2.599 -5.366 1.00 . B B . 3 ASN HA 1 1 6 4244 2 2 3 ASN HB2 H 12.935 -3.135 -5.469 1.00 . B B . 3 ASN HB2 1 1 6 4245 2 2 3 ASN HB3 H 11.971 -3.520 -6.890 1.00 . B B . 3 ASN HB3 1 1 6 4246 2 2 3 ASN HD21 H 12.660 -2.620 -8.856 1.00 . B B . 3 ASN HD21 1 1 6 4247 2 2 3 ASN HD22 H 13.798 -1.368 -8.989 1.00 . B B . 3 ASN HD22 1 1 6 4248 2 2 3 ASN N N 10.619 -1.051 -6.786 1.00 . B B . 3 ASN N 1 1 6 4249 2 2 3 ASN ND2 N 13.232 -1.945 -8.435 1.00 . B B . 3 ASN ND2 1 1 6 4250 2 2 3 ASN O O 12.846 -0.966 -4.284 1.00 . B B . 3 ASN O 1 1 6 4251 2 2 3 ASN OD1 O 13.952 -0.977 -6.616 1.00 . B B . 3 ASN OD1 1 1 6 4252 2 2 4 GLN C C 10.157 0.314 -1.655 1.00 . B B . 4 GLN C 1 1 6 4253 2 2 4 GLN CA C 11.132 0.515 -2.821 1.00 . B B . 4 GLN CA 1 1 6 4254 2 2 4 GLN CB C 11.065 1.964 -3.312 1.00 . B B . 4 GLN CB 1 1 6 4255 2 2 4 GLN CD C 11.717 4.299 -2.707 1.00 . B B . 4 GLN CD 1 1 6 4256 2 2 4 GLN CG C 11.375 2.913 -2.157 1.00 . B B . 4 GLN CG 1 1 6 4257 2 2 4 GLN H H 9.827 -0.465 -4.217 1.00 . B B . 4 GLN H 1 1 6 4258 2 2 4 GLN HA H 12.137 0.291 -2.496 1.00 . B B . 4 GLN HA 1 1 6 4259 2 2 4 GLN HB2 H 11.787 2.109 -4.102 1.00 . B B . 4 GLN HB2 1 1 6 4260 2 2 4 GLN HB3 H 10.074 2.170 -3.688 1.00 . B B . 4 GLN HB3 1 1 6 4261 2 2 4 GLN HE21 H 11.723 5.161 -0.918 1.00 . B B . 4 GLN HE21 1 1 6 4262 2 2 4 GLN HE22 H 12.063 6.193 -2.222 1.00 . B B . 4 GLN HE22 1 1 6 4263 2 2 4 GLN HG2 H 10.512 2.983 -1.511 1.00 . B B . 4 GLN HG2 1 1 6 4264 2 2 4 GLN HG3 H 12.216 2.533 -1.596 1.00 . B B . 4 GLN HG3 1 1 6 4265 2 2 4 GLN N N 10.760 -0.382 -3.943 1.00 . B B . 4 GLN N 1 1 6 4266 2 2 4 GLN NE2 N 11.845 5.301 -1.880 1.00 . B B . 4 GLN NE2 1 1 6 4267 2 2 4 GLN O O 9.134 -0.340 -1.785 1.00 . B B . 4 GLN O 1 1 6 4268 2 2 4 GLN OE1 O 11.868 4.473 -3.900 1.00 . B B . 4 GLN OE1 1 1 6 4269 2 2 5 HIS C C 8.277 1.501 0.414 1.00 . B B . 5 HIS C 1 1 6 4270 2 2 5 HIS CA C 9.567 0.716 0.661 1.00 . B B . 5 HIS CA 1 1 6 4271 2 2 5 HIS CB C 10.256 1.255 1.920 1.00 . B B . 5 HIS CB 1 1 6 4272 2 2 5 HIS CD2 C 12.582 0.133 2.346 1.00 . B B . 5 HIS CD2 1 1 6 4273 2 2 5 HIS CE1 C 13.784 1.500 1.159 1.00 . B B . 5 HIS CE1 1 1 6 4274 2 2 5 HIS CG C 11.746 1.072 1.807 1.00 . B B . 5 HIS CG 1 1 6 4275 2 2 5 HIS H H 11.295 1.386 -0.434 1.00 . B B . 5 HIS H 1 1 6 4276 2 2 5 HIS HA H 9.331 -0.328 0.799 1.00 . B B . 5 HIS HA 1 1 6 4277 2 2 5 HIS HB2 H 10.031 2.305 2.031 1.00 . B B . 5 HIS HB2 1 1 6 4278 2 2 5 HIS HB3 H 9.894 0.717 2.784 1.00 . B B . 5 HIS HB3 1 1 6 4279 2 2 5 HIS HD2 H 12.282 -0.682 2.987 1.00 . B B . 5 HIS HD2 1 1 6 4280 2 2 5 HIS HE1 H 14.628 1.973 0.678 1.00 . B B . 5 HIS HE1 1 1 6 4281 2 2 5 HIS HE2 H 14.681 -0.101 2.163 1.00 . B B . 5 HIS HE2 1 1 6 4282 2 2 5 HIS N N 10.468 0.869 -0.515 1.00 . B B . 5 HIS N 1 1 6 4283 2 2 5 HIS ND1 N 12.519 1.932 1.057 1.00 . B B . 5 HIS ND1 1 1 6 4284 2 2 5 HIS NE2 N 13.872 0.401 1.937 1.00 . B B . 5 HIS NE2 1 1 6 4285 2 2 5 HIS O O 7.988 1.909 -0.693 1.00 . B B . 5 HIS O 1 1 6 4286 2 2 6 LEU C C 5.757 2.980 2.619 1.00 . B B . 6 LEU C 1 1 6 4287 2 2 6 LEU CA C 6.219 2.451 1.268 1.00 . B B . 6 LEU CA 1 1 6 4288 2 2 6 LEU CB C 5.158 1.491 0.733 1.00 . B B . 6 LEU CB 1 1 6 4289 2 2 6 LEU CD1 C 4.316 3.496 -0.494 1.00 . B B . 6 LEU CD1 1 1 6 4290 2 2 6 LEU CD2 C 5.442 1.688 -1.742 1.00 . B B . 6 LEU CD2 1 1 6 4291 2 2 6 LEU CG C 4.530 1.999 -0.566 1.00 . B B . 6 LEU CG 1 1 6 4292 2 2 6 LEU H H 7.745 1.357 2.315 1.00 . B B . 6 LEU H 1 1 6 4293 2 2 6 LEU HA H 6.357 3.272 0.588 1.00 . B B . 6 LEU HA 1 1 6 4294 2 2 6 LEU HB2 H 5.621 0.547 0.546 1.00 . B B . 6 LEU HB2 1 1 6 4295 2 2 6 LEU HB3 H 4.385 1.369 1.478 1.00 . B B . 6 LEU HB3 1 1 6 4296 2 2 6 LEU HD11 H 3.962 3.753 0.488 1.00 . B B . 6 LEU HD11 1 1 6 4297 2 2 6 LEU HD12 H 3.584 3.780 -1.232 1.00 . B B . 6 LEU HD12 1 1 6 4298 2 2 6 LEU HD13 H 5.245 4.007 -0.692 1.00 . B B . 6 LEU HD13 1 1 6 4299 2 2 6 LEU HD21 H 6.025 2.564 -1.980 1.00 . B B . 6 LEU HD21 1 1 6 4300 2 2 6 LEU HD22 H 4.839 1.412 -2.595 1.00 . B B . 6 LEU HD22 1 1 6 4301 2 2 6 LEU HD23 H 6.098 0.875 -1.482 1.00 . B B . 6 LEU HD23 1 1 6 4302 2 2 6 LEU HG H 3.578 1.511 -0.714 1.00 . B B . 6 LEU HG 1 1 6 4303 2 2 6 LEU N N 7.496 1.705 1.437 1.00 . B B . 6 LEU N 1 1 6 4304 2 2 6 LEU O O 5.982 2.371 3.646 1.00 . B B . 6 LEU O 1 1 6 4305 2 2 7 CYS C C 4.109 6.081 3.713 1.00 . B B . 7 CYS C 1 1 6 4306 2 2 7 CYS CA C 4.611 4.648 3.911 1.00 . B B . 7 CYS CA 1 1 6 4307 2 2 7 CYS CB C 5.753 4.634 4.927 1.00 . B B . 7 CYS CB 1 1 6 4308 2 2 7 CYS H H 4.917 4.570 1.791 1.00 . B B . 7 CYS H 1 1 6 4309 2 2 7 CYS HA H 3.805 4.028 4.265 1.00 . B B . 7 CYS HA 1 1 6 4310 2 2 7 CYS HB2 H 6.663 4.321 4.439 1.00 . B B . 7 CYS HB2 1 1 6 4311 2 2 7 CYS HB3 H 5.887 5.622 5.334 1.00 . B B . 7 CYS HB3 1 1 6 4312 2 2 7 CYS N N 5.098 4.100 2.627 1.00 . B B . 7 CYS N 1 1 6 4313 2 2 7 CYS O O 4.512 6.775 2.798 1.00 . B B . 7 CYS O 1 1 6 4314 2 2 7 CYS SG S 5.360 3.480 6.261 1.00 . B B . 7 CYS SG 1 1 6 4315 2 2 8 GLY C C 2.062 8.103 3.063 1.00 . B B . 8 GLY C 1 1 6 4316 2 2 8 GLY CA C 2.702 7.916 4.440 1.00 . B B . 8 GLY CA 1 1 6 4317 2 2 8 GLY H H 2.922 5.954 5.299 1.00 . B B . 8 GLY H 1 1 6 4318 2 2 8 GLY HA2 H 1.963 8.090 5.209 1.00 . B B . 8 GLY HA2 1 1 6 4319 2 2 8 GLY HA3 H 3.512 8.621 4.554 1.00 . B B . 8 GLY HA3 1 1 6 4320 2 2 8 GLY N N 3.231 6.530 4.568 1.00 . B B . 8 GLY N 1 1 6 4321 2 2 8 GLY O O 1.460 7.198 2.514 1.00 . B B . 8 GLY O 1 1 6 4322 2 2 9 SER C C 2.012 8.432 0.193 1.00 . B B . 9 SER C 1 1 6 4323 2 2 9 SER CA C 1.581 9.527 1.163 1.00 . B B . 9 SER CA 1 1 6 4324 2 2 9 SER CB C 2.045 10.886 0.640 1.00 . B B . 9 SER CB 1 1 6 4325 2 2 9 SER H H 2.671 9.990 2.962 1.00 . B B . 9 SER H 1 1 6 4326 2 2 9 SER HA H 0.511 9.522 1.249 1.00 . B B . 9 SER HA 1 1 6 4327 2 2 9 SER HB2 H 3.079 11.039 0.899 1.00 . B B . 9 SER HB2 1 1 6 4328 2 2 9 SER HB3 H 1.938 10.911 -0.437 1.00 . B B . 9 SER HB3 1 1 6 4329 2 2 9 SER HG H 1.700 12.748 1.085 1.00 . B B . 9 SER HG 1 1 6 4330 2 2 9 SER N N 2.184 9.275 2.501 1.00 . B B . 9 SER N 1 1 6 4331 2 2 9 SER O O 1.227 7.928 -0.584 1.00 . B B . 9 SER O 1 1 6 4332 2 2 9 SER OG O 1.256 11.909 1.232 1.00 . B B . 9 SER OG 1 1 6 4333 2 2 10 ASP C C 2.768 5.810 -0.621 1.00 . B B . 10 ASP C 1 1 6 4334 2 2 10 ASP CA C 3.729 6.989 -0.684 1.00 . B B . 10 ASP CA 1 1 6 4335 2 2 10 ASP CB C 5.123 6.514 -0.261 1.00 . B B . 10 ASP CB 1 1 6 4336 2 2 10 ASP CG C 6.063 7.715 -0.150 1.00 . B B . 10 ASP CG 1 1 6 4337 2 2 10 ASP H H 3.865 8.468 0.876 1.00 . B B . 10 ASP H 1 1 6 4338 2 2 10 ASP HA H 3.769 7.367 -1.694 1.00 . B B . 10 ASP HA 1 1 6 4339 2 2 10 ASP HB2 H 5.058 6.014 0.693 1.00 . B B . 10 ASP HB2 1 1 6 4340 2 2 10 ASP HB3 H 5.508 5.823 -0.998 1.00 . B B . 10 ASP HB3 1 1 6 4341 2 2 10 ASP N N 3.252 8.055 0.236 1.00 . B B . 10 ASP N 1 1 6 4342 2 2 10 ASP O O 2.269 5.346 -1.624 1.00 . B B . 10 ASP O 1 1 6 4343 2 2 10 ASP OD1 O 5.921 8.629 -0.946 1.00 . B B . 10 ASP OD1 1 1 6 4344 2 2 10 ASP OD2 O 6.908 7.702 0.730 1.00 . B B . 10 ASP OD2 1 1 6 4345 2 2 11 LEU C C 0.306 4.387 -0.031 1.00 . B B . 11 LEU C 1 1 6 4346 2 2 11 LEU CA C 1.636 4.115 0.673 1.00 . B B . 11 LEU CA 1 1 6 4347 2 2 11 LEU CB C 1.394 3.814 2.155 1.00 . B B . 11 LEU CB 1 1 6 4348 2 2 11 LEU CD1 C 1.450 1.416 1.383 1.00 . B B . 11 LEU CD1 1 1 6 4349 2 2 11 LEU CD2 C 0.987 1.962 3.773 1.00 . B B . 11 LEU CD2 1 1 6 4350 2 2 11 LEU CG C 0.779 2.419 2.328 1.00 . B B . 11 LEU CG 1 1 6 4351 2 2 11 LEU H H 2.965 5.668 1.346 1.00 . B B . 11 LEU H 1 1 6 4352 2 2 11 LEU HA H 2.118 3.264 0.208 1.00 . B B . 11 LEU HA 1 1 6 4353 2 2 11 LEU HB2 H 2.335 3.857 2.685 1.00 . B B . 11 LEU HB2 1 1 6 4354 2 2 11 LEU HB3 H 0.721 4.553 2.563 1.00 . B B . 11 LEU HB3 1 1 6 4355 2 2 11 LEU HD11 H 2.509 1.623 1.330 1.00 . B B . 11 LEU HD11 1 1 6 4356 2 2 11 LEU HD12 H 1.017 1.504 0.397 1.00 . B B . 11 LEU HD12 1 1 6 4357 2 2 11 LEU HD13 H 1.298 0.414 1.755 1.00 . B B . 11 LEU HD13 1 1 6 4358 2 2 11 LEU HD21 H 0.042 1.977 4.294 1.00 . B B . 11 LEU HD21 1 1 6 4359 2 2 11 LEU HD22 H 1.680 2.629 4.265 1.00 . B B . 11 LEU HD22 1 1 6 4360 2 2 11 LEU HD23 H 1.387 0.959 3.780 1.00 . B B . 11 LEU HD23 1 1 6 4361 2 2 11 LEU HG H -0.279 2.462 2.112 1.00 . B B . 11 LEU HG 1 1 6 4362 2 2 11 LEU N N 2.532 5.295 0.549 1.00 . B B . 11 LEU N 1 1 6 4363 2 2 11 LEU O O -0.139 3.603 -0.845 1.00 . B B . 11 LEU O 1 1 6 4364 2 2 12 VAL C C -1.385 5.966 -1.913 1.00 . B B . 12 VAL C 1 1 6 4365 2 2 12 VAL CA C -1.638 5.766 -0.418 1.00 . B B . 12 VAL CA 1 1 6 4366 2 2 12 VAL CB C -2.302 7.013 0.191 1.00 . B B . 12 VAL CB 1 1 6 4367 2 2 12 VAL CG1 C -1.956 7.093 1.675 1.00 . B B . 12 VAL CG1 1 1 6 4368 2 2 12 VAL CG2 C -1.809 8.287 -0.506 1.00 . B B . 12 VAL CG2 1 1 6 4369 2 2 12 VAL H H 0.027 6.119 0.915 1.00 . B B . 12 VAL H 1 1 6 4370 2 2 12 VAL HA H -2.292 4.916 -0.284 1.00 . B B . 12 VAL HA 1 1 6 4371 2 2 12 VAL HB H -3.375 6.934 0.079 1.00 . B B . 12 VAL HB 1 1 6 4372 2 2 12 VAL HG11 H -2.823 7.421 2.227 1.00 . B B . 12 VAL HG11 1 1 6 4373 2 2 12 VAL HG12 H -1.150 7.798 1.817 1.00 . B B . 12 VAL HG12 1 1 6 4374 2 2 12 VAL HG13 H -1.650 6.119 2.026 1.00 . B B . 12 VAL HG13 1 1 6 4375 2 2 12 VAL HG21 H -0.762 8.429 -0.297 1.00 . B B . 12 VAL HG21 1 1 6 4376 2 2 12 VAL HG22 H -2.367 9.136 -0.138 1.00 . B B . 12 VAL HG22 1 1 6 4377 2 2 12 VAL HG23 H -1.956 8.196 -1.572 1.00 . B B . 12 VAL HG23 1 1 6 4378 2 2 12 VAL N N -0.339 5.486 0.261 1.00 . B B . 12 VAL N 1 1 6 4379 2 2 12 VAL O O -2.083 5.425 -2.749 1.00 . B B . 12 VAL O 1 1 6 4380 2 2 13 GLU C C -0.044 5.586 -4.395 1.00 . B B . 13 GLU C 1 1 6 4381 2 2 13 GLU CA C -0.089 6.949 -3.699 1.00 . B B . 13 GLU CA 1 1 6 4382 2 2 13 GLU CB C 1.252 7.694 -3.840 1.00 . B B . 13 GLU CB 1 1 6 4383 2 2 13 GLU CD C 2.672 6.550 -5.557 1.00 . B B . 13 GLU CD 1 1 6 4384 2 2 13 GLU CG C 2.410 6.709 -4.058 1.00 . B B . 13 GLU CG 1 1 6 4385 2 2 13 GLU H H 0.173 7.152 -1.572 1.00 . B B . 13 GLU H 1 1 6 4386 2 2 13 GLU HA H -0.878 7.545 -4.136 1.00 . B B . 13 GLU HA 1 1 6 4387 2 2 13 GLU HB2 H 1.196 8.369 -4.679 1.00 . B B . 13 GLU HB2 1 1 6 4388 2 2 13 GLU HB3 H 1.435 8.262 -2.939 1.00 . B B . 13 GLU HB3 1 1 6 4389 2 2 13 GLU HG2 H 3.300 7.086 -3.574 1.00 . B B . 13 GLU HG2 1 1 6 4390 2 2 13 GLU HG3 H 2.152 5.750 -3.639 1.00 . B B . 13 GLU HG3 1 1 6 4391 2 2 13 GLU N N -0.385 6.731 -2.259 1.00 . B B . 13 GLU N 1 1 6 4392 2 2 13 GLU O O -0.302 5.466 -5.576 1.00 . B B . 13 GLU O 1 1 6 4393 2 2 13 GLU OE1 O 1.944 5.801 -6.188 1.00 . B B . 13 GLU OE1 1 1 6 4394 2 2 13 GLU OE2 O 3.595 7.177 -6.048 1.00 . B B . 13 GLU OE2 1 1 6 4395 2 2 14 ALA C C -1.067 2.559 -4.076 1.00 . B B . 14 ALA C 1 1 6 4396 2 2 14 ALA CA C 0.311 3.193 -4.247 1.00 . B B . 14 ALA CA 1 1 6 4397 2 2 14 ALA CB C 1.365 2.349 -3.526 1.00 . B B . 14 ALA CB 1 1 6 4398 2 2 14 ALA H H 0.453 4.676 -2.701 1.00 . B B . 14 ALA H 1 1 6 4399 2 2 14 ALA HA H 0.551 3.261 -5.298 1.00 . B B . 14 ALA HA 1 1 6 4400 2 2 14 ALA HB1 H 1.290 2.512 -2.461 1.00 . B B . 14 ALA HB1 1 1 6 4401 2 2 14 ALA HB2 H 2.349 2.636 -3.866 1.00 . B B . 14 ALA HB2 1 1 6 4402 2 2 14 ALA HB3 H 1.200 1.304 -3.743 1.00 . B B . 14 ALA HB3 1 1 6 4403 2 2 14 ALA N N 0.266 4.555 -3.654 1.00 . B B . 14 ALA N 1 1 6 4404 2 2 14 ALA O O -1.670 2.095 -5.023 1.00 . B B . 14 ALA O 1 1 6 4405 2 2 15 LEU C C -3.905 2.659 -3.624 1.00 . B B . 15 LEU C 1 1 6 4406 2 2 15 LEU CA C -2.935 1.988 -2.653 1.00 . B B . 15 LEU CA 1 1 6 4407 2 2 15 LEU CB C -3.371 2.277 -1.215 1.00 . B B . 15 LEU CB 1 1 6 4408 2 2 15 LEU CD1 C -3.101 1.406 1.112 1.00 . B B . 15 LEU CD1 1 1 6 4409 2 2 15 LEU CD2 C -1.895 0.256 -0.754 1.00 . B B . 15 LEU CD2 1 1 6 4410 2 2 15 LEU CG C -2.394 1.616 -0.223 1.00 . B B . 15 LEU CG 1 1 6 4411 2 2 15 LEU H H -1.091 2.959 -2.127 1.00 . B B . 15 LEU H 1 1 6 4412 2 2 15 LEU HA H -2.913 0.923 -2.826 1.00 . B B . 15 LEU HA 1 1 6 4413 2 2 15 LEU HB2 H -3.364 3.347 -1.058 1.00 . B B . 15 LEU HB2 1 1 6 4414 2 2 15 LEU HB3 H -4.376 1.902 -1.053 1.00 . B B . 15 LEU HB3 1 1 6 4415 2 2 15 LEU HD11 H -4.129 1.726 1.028 1.00 . B B . 15 LEU HD11 1 1 6 4416 2 2 15 LEU HD12 H -2.604 1.985 1.876 1.00 . B B . 15 LEU HD12 1 1 6 4417 2 2 15 LEU HD13 H -3.069 0.360 1.374 1.00 . B B . 15 LEU HD13 1 1 6 4418 2 2 15 LEU HD21 H -2.736 -0.390 -0.955 1.00 . B B . 15 LEU HD21 1 1 6 4419 2 2 15 LEU HD22 H -1.257 -0.209 -0.012 1.00 . B B . 15 LEU HD22 1 1 6 4420 2 2 15 LEU HD23 H -1.329 0.405 -1.663 1.00 . B B . 15 LEU HD23 1 1 6 4421 2 2 15 LEU HG H -1.550 2.273 -0.073 1.00 . B B . 15 LEU HG 1 1 6 4422 2 2 15 LEU N N -1.584 2.562 -2.877 1.00 . B B . 15 LEU N 1 1 6 4423 2 2 15 LEU O O -4.743 2.022 -4.231 1.00 . B B . 15 LEU O 1 1 6 4424 2 2 16 TYR C C -4.411 4.225 -6.144 1.00 . B B . 16 TYR C 1 1 6 4425 2 2 16 TYR CA C -4.686 4.682 -4.708 1.00 . B B . 16 TYR CA 1 1 6 4426 2 2 16 TYR CB C -4.413 6.184 -4.596 1.00 . B B . 16 TYR CB 1 1 6 4427 2 2 16 TYR CD1 C -6.793 7.018 -4.702 1.00 . B B . 16 TYR CD1 1 1 6 4428 2 2 16 TYR CD2 C -5.518 7.376 -2.668 1.00 . B B . 16 TYR CD2 1 1 6 4429 2 2 16 TYR CE1 C -7.895 7.662 -4.125 1.00 . B B . 16 TYR CE1 1 1 6 4430 2 2 16 TYR CE2 C -6.621 8.020 -2.091 1.00 . B B . 16 TYR CE2 1 1 6 4431 2 2 16 TYR CG C -5.604 6.875 -3.974 1.00 . B B . 16 TYR CG 1 1 6 4432 2 2 16 TYR CZ C -7.809 8.163 -2.819 1.00 . B B . 16 TYR CZ 1 1 6 4433 2 2 16 TYR H H -3.099 4.440 -3.272 1.00 . B B . 16 TYR H 1 1 6 4434 2 2 16 TYR HA H -5.716 4.481 -4.454 1.00 . B B . 16 TYR HA 1 1 6 4435 2 2 16 TYR HB2 H -3.542 6.344 -3.977 1.00 . B B . 16 TYR HB2 1 1 6 4436 2 2 16 TYR HB3 H -4.235 6.591 -5.580 1.00 . B B . 16 TYR HB3 1 1 6 4437 2 2 16 TYR HD1 H -6.859 6.631 -5.708 1.00 . B B . 16 TYR HD1 1 1 6 4438 2 2 16 TYR HD2 H -4.602 7.265 -2.106 1.00 . B B . 16 TYR HD2 1 1 6 4439 2 2 16 TYR HE1 H -8.811 7.772 -4.686 1.00 . B B . 16 TYR HE1 1 1 6 4440 2 2 16 TYR HE2 H -6.554 8.406 -1.084 1.00 . B B . 16 TYR HE2 1 1 6 4441 2 2 16 TYR HH H -9.647 8.204 -2.301 1.00 . B B . 16 TYR HH 1 1 6 4442 2 2 16 TYR N N -3.787 3.950 -3.774 1.00 . B B . 16 TYR N 1 1 6 4443 2 2 16 TYR O O -5.320 3.969 -6.909 1.00 . B B . 16 TYR O 1 1 6 4444 2 2 16 TYR OH O -8.895 8.799 -2.251 1.00 . B B . 16 TYR OH 1 1 6 4445 2 2 17 LEU C C -3.095 2.204 -8.070 1.00 . B B . 17 LEU C 1 1 6 4446 2 2 17 LEU CA C -2.820 3.697 -7.904 1.00 . B B . 17 LEU CA 1 1 6 4447 2 2 17 LEU CB C -1.340 3.980 -8.184 1.00 . B B . 17 LEU CB 1 1 6 4448 2 2 17 LEU CD1 C -1.952 3.774 -10.598 1.00 . B B . 17 LEU CD1 1 1 6 4449 2 2 17 LEU CD2 C 0.450 3.852 -9.925 1.00 . B B . 17 LEU CD2 1 1 6 4450 2 2 17 LEU CG C -0.943 3.359 -9.526 1.00 . B B . 17 LEU CG 1 1 6 4451 2 2 17 LEU H H -2.444 4.344 -5.883 1.00 . B B . 17 LEU H 1 1 6 4452 2 2 17 LEU HA H -3.426 4.244 -8.600 1.00 . B B . 17 LEU HA 1 1 6 4453 2 2 17 LEU HB2 H -1.179 5.048 -8.219 1.00 . B B . 17 LEU HB2 1 1 6 4454 2 2 17 LEU HB3 H -0.736 3.550 -7.399 1.00 . B B . 17 LEU HB3 1 1 6 4455 2 2 17 LEU HD11 H -2.563 4.582 -10.224 1.00 . B B . 17 LEU HD11 1 1 6 4456 2 2 17 LEU HD12 H -2.581 2.932 -10.846 1.00 . B B . 17 LEU HD12 1 1 6 4457 2 2 17 LEU HD13 H -1.424 4.102 -11.482 1.00 . B B . 17 LEU HD13 1 1 6 4458 2 2 17 LEU HD21 H 1.151 3.628 -9.134 1.00 . B B . 17 LEU HD21 1 1 6 4459 2 2 17 LEU HD22 H 0.422 4.919 -10.091 1.00 . B B . 17 LEU HD22 1 1 6 4460 2 2 17 LEU HD23 H 0.761 3.355 -10.832 1.00 . B B . 17 LEU HD23 1 1 6 4461 2 2 17 LEU HG H -0.934 2.282 -9.437 1.00 . B B . 17 LEU HG 1 1 6 4462 2 2 17 LEU N N -3.160 4.127 -6.516 1.00 . B B . 17 LEU N 1 1 6 4463 2 2 17 LEU O O -3.769 1.784 -8.989 1.00 . B B . 17 LEU O 1 1 6 4464 2 2 18 VAL C C -4.307 -0.296 -7.509 1.00 . B B . 18 VAL C 1 1 6 4465 2 2 18 VAL CA C -2.822 -0.065 -7.292 1.00 . B B . 18 VAL CA 1 1 6 4466 2 2 18 VAL CB C -2.384 -0.764 -6.006 1.00 . B B . 18 VAL CB 1 1 6 4467 2 2 18 VAL CG1 C -0.980 -0.315 -5.644 1.00 . B B . 18 VAL CG1 1 1 6 4468 2 2 18 VAL CG2 C -3.331 -0.401 -4.867 1.00 . B B . 18 VAL CG2 1 1 6 4469 2 2 18 VAL H H -2.052 1.765 -6.453 1.00 . B B . 18 VAL H 1 1 6 4470 2 2 18 VAL HA H -2.267 -0.463 -8.126 1.00 . B B . 18 VAL HA 1 1 6 4471 2 2 18 VAL HB H -2.390 -1.832 -6.155 1.00 . B B . 18 VAL HB 1 1 6 4472 2 2 18 VAL HG11 H -0.301 -1.144 -5.758 1.00 . B B . 18 VAL HG11 1 1 6 4473 2 2 18 VAL HG12 H -0.970 0.027 -4.620 1.00 . B B . 18 VAL HG12 1 1 6 4474 2 2 18 VAL HG13 H -0.684 0.490 -6.298 1.00 . B B . 18 VAL HG13 1 1 6 4475 2 2 18 VAL HG21 H -3.078 -0.981 -3.993 1.00 . B B . 18 VAL HG21 1 1 6 4476 2 2 18 VAL HG22 H -4.347 -0.615 -5.161 1.00 . B B . 18 VAL HG22 1 1 6 4477 2 2 18 VAL HG23 H -3.232 0.649 -4.642 1.00 . B B . 18 VAL HG23 1 1 6 4478 2 2 18 VAL N N -2.584 1.401 -7.185 1.00 . B B . 18 VAL N 1 1 6 4479 2 2 18 VAL O O -4.717 -1.218 -8.186 1.00 . B B . 18 VAL O 1 1 6 4480 2 2 19 CYS C C -7.194 1.726 -7.528 1.00 . B B . 19 CYS C 1 1 6 4481 2 2 19 CYS CA C -6.580 0.387 -7.110 1.00 . B B . 19 CYS CA 1 1 6 4482 2 2 19 CYS CB C -7.199 -0.081 -5.795 1.00 . B B . 19 CYS CB 1 1 6 4483 2 2 19 CYS H H -4.759 1.282 -6.400 1.00 . B B . 19 CYS H 1 1 6 4484 2 2 19 CYS HA H -6.763 -0.349 -7.875 1.00 . B B . 19 CYS HA 1 1 6 4485 2 2 19 CYS HB2 H -6.745 0.452 -4.972 1.00 . B B . 19 CYS HB2 1 1 6 4486 2 2 19 CYS HB3 H -8.259 0.113 -5.808 1.00 . B B . 19 CYS HB3 1 1 6 4487 2 2 19 CYS N N -5.117 0.545 -6.939 1.00 . B B . 19 CYS N 1 1 6 4488 2 2 19 CYS O O -7.517 1.937 -8.680 1.00 . B B . 19 CYS O 1 1 6 4489 2 2 19 CYS SG S -6.910 -1.856 -5.601 1.00 . B B . 19 CYS SG 1 1 6 4490 2 2 20 GLY C C -9.300 4.131 -6.298 1.00 . B B . 20 GLY C 1 1 6 4491 2 2 20 GLY CA C -7.932 3.960 -6.962 1.00 . B B . 20 GLY CA 1 1 6 4492 2 2 20 GLY H H -7.076 2.453 -5.684 1.00 . B B . 20 GLY H 1 1 6 4493 2 2 20 GLY HA2 H -7.268 4.744 -6.626 1.00 . B B . 20 GLY HA2 1 1 6 4494 2 2 20 GLY HA3 H -8.047 4.024 -8.034 1.00 . B B . 20 GLY HA3 1 1 6 4495 2 2 20 GLY N N -7.349 2.636 -6.606 1.00 . B B . 20 GLY N 1 1 6 4496 2 2 20 GLY O O -9.404 4.312 -5.100 1.00 . B B . 20 GLY O 1 1 6 4497 2 2 21 GLU C C -12.119 3.032 -5.687 1.00 . B B . 21 GLU C 1 1 6 4498 2 2 21 GLU CA C -11.715 4.268 -6.494 1.00 . B B . 21 GLU CA 1 1 6 4499 2 2 21 GLU CB C -12.723 4.485 -7.625 1.00 . B B . 21 GLU CB 1 1 6 4500 2 2 21 GLU CD C -14.168 6.507 -7.900 1.00 . B B . 21 GLU CD 1 1 6 4501 2 2 21 GLU CG C -13.945 5.231 -7.086 1.00 . B B . 21 GLU CG 1 1 6 4502 2 2 21 GLU H H -10.244 3.955 -8.036 1.00 . B B . 21 GLU H 1 1 6 4503 2 2 21 GLU HA H -11.718 5.132 -5.846 1.00 . B B . 21 GLU HA 1 1 6 4504 2 2 21 GLU HB2 H -12.262 5.067 -8.411 1.00 . B B . 21 GLU HB2 1 1 6 4505 2 2 21 GLU HB3 H -13.032 3.529 -8.020 1.00 . B B . 21 GLU HB3 1 1 6 4506 2 2 21 GLU HG2 H -14.816 4.596 -7.163 1.00 . B B . 21 GLU HG2 1 1 6 4507 2 2 21 GLU HG3 H -13.780 5.491 -6.051 1.00 . B B . 21 GLU HG3 1 1 6 4508 2 2 21 GLU N N -10.352 4.091 -7.071 1.00 . B B . 21 GLU N 1 1 6 4509 2 2 21 GLU O O -13.177 2.994 -5.092 1.00 . B B . 21 GLU O 1 1 6 4510 2 2 21 GLU OE1 O -14.173 6.415 -9.117 1.00 . B B . 21 GLU OE1 1 1 6 4511 2 2 21 GLU OE2 O -14.330 7.553 -7.293 1.00 . B B . 21 GLU OE2 1 1 6 4512 2 2 22 ARG C C -11.465 1.080 -3.383 1.00 . B B . 22 ARG C 1 1 6 4513 2 2 22 ARG CA C -11.665 0.805 -4.875 1.00 . B B . 22 ARG CA 1 1 6 4514 2 2 22 ARG CB C -10.782 -0.370 -5.301 1.00 . B B . 22 ARG CB 1 1 6 4515 2 2 22 ARG CD C -12.665 -1.945 -4.780 1.00 . B B . 22 ARG CD 1 1 6 4516 2 2 22 ARG CG C -11.658 -1.504 -5.847 1.00 . B B . 22 ARG CG 1 1 6 4517 2 2 22 ARG CZ C -14.586 -3.424 -4.679 1.00 . B B . 22 ARG CZ 1 1 6 4518 2 2 22 ARG H H -10.444 2.056 -6.134 1.00 . B B . 22 ARG H 1 1 6 4519 2 2 22 ARG HA H -12.701 0.563 -5.060 1.00 . B B . 22 ARG HA 1 1 6 4520 2 2 22 ARG HB2 H -10.099 -0.042 -6.071 1.00 . B B . 22 ARG HB2 1 1 6 4521 2 2 22 ARG HB3 H -10.219 -0.727 -4.451 1.00 . B B . 22 ARG HB3 1 1 6 4522 2 2 22 ARG HD2 H -12.162 -2.542 -4.035 1.00 . B B . 22 ARG HD2 1 1 6 4523 2 2 22 ARG HD3 H -13.102 -1.077 -4.311 1.00 . B B . 22 ARG HD3 1 1 6 4524 2 2 22 ARG HE H -13.815 -2.788 -6.396 1.00 . B B . 22 ARG HE 1 1 6 4525 2 2 22 ARG HG2 H -12.190 -1.157 -6.722 1.00 . B B . 22 ARG HG2 1 1 6 4526 2 2 22 ARG HG3 H -11.033 -2.342 -6.116 1.00 . B B . 22 ARG HG3 1 1 6 4527 2 2 22 ARG HH11 H -13.732 -2.899 -2.944 1.00 . B B . 22 ARG HH11 1 1 6 4528 2 2 22 ARG HH12 H -15.118 -3.930 -2.815 1.00 . B B . 22 ARG HH12 1 1 6 4529 2 2 22 ARG HH21 H -15.642 -4.107 -6.238 1.00 . B B . 22 ARG HH21 1 1 6 4530 2 2 22 ARG HH22 H -16.199 -4.610 -4.677 1.00 . B B . 22 ARG HH22 1 1 6 4531 2 2 22 ARG N N -11.297 2.019 -5.653 1.00 . B B . 22 ARG N 1 1 6 4532 2 2 22 ARG NE N -13.741 -2.757 -5.419 1.00 . B B . 22 ARG NE 1 1 6 4533 2 2 22 ARG NH1 N -14.469 -3.416 -3.378 1.00 . B B . 22 ARG NH1 1 1 6 4534 2 2 22 ARG NH2 N -15.551 -4.100 -5.242 1.00 . B B . 22 ARG NH2 1 1 6 4535 2 2 22 ARG O O -11.753 0.247 -2.546 1.00 . B B . 22 ARG O 1 1 6 4536 2 2 23 GLY C C -9.769 1.563 -1.006 1.00 . B B . 23 GLY C 1 1 6 4537 2 2 23 GLY CA C -10.757 2.564 -1.604 1.00 . B B . 23 GLY CA 1 1 6 4538 2 2 23 GLY H H -10.748 2.900 -3.731 1.00 . B B . 23 GLY H 1 1 6 4539 2 2 23 GLY HA2 H -10.357 3.565 -1.516 1.00 . B B . 23 GLY HA2 1 1 6 4540 2 2 23 GLY HA3 H -11.694 2.501 -1.073 1.00 . B B . 23 GLY HA3 1 1 6 4541 2 2 23 GLY N N -10.974 2.242 -3.042 1.00 . B B . 23 GLY N 1 1 6 4542 2 2 23 GLY O O -9.687 0.429 -1.432 1.00 . B B . 23 GLY O 1 1 6 4543 2 2 24 PHE C C -8.211 1.037 2.114 1.00 . B B . 24 PHE C 1 1 6 4544 2 2 24 PHE CA C -8.037 1.034 0.595 1.00 . B B . 24 PHE CA 1 1 6 4545 2 2 24 PHE CB C -6.615 1.475 0.242 1.00 . B B . 24 PHE CB 1 1 6 4546 2 2 24 PHE CD1 C -6.955 3.644 -1.003 1.00 . B B . 24 PHE CD1 1 1 6 4547 2 2 24 PHE CD2 C -6.086 3.720 1.262 1.00 . B B . 24 PHE CD2 1 1 6 4548 2 2 24 PHE CE1 C -6.893 5.042 -1.074 1.00 . B B . 24 PHE CE1 1 1 6 4549 2 2 24 PHE CE2 C -6.023 5.118 1.191 1.00 . B B . 24 PHE CE2 1 1 6 4550 2 2 24 PHE CG C -6.552 2.982 0.165 1.00 . B B . 24 PHE CG 1 1 6 4551 2 2 24 PHE CZ C -6.426 5.779 0.023 1.00 . B B . 24 PHE CZ 1 1 6 4552 2 2 24 PHE H H -9.095 2.890 0.310 1.00 . B B . 24 PHE H 1 1 6 4553 2 2 24 PHE HA H -8.208 0.037 0.217 1.00 . B B . 24 PHE HA 1 1 6 4554 2 2 24 PHE HB2 H -5.931 1.125 1.001 1.00 . B B . 24 PHE HB2 1 1 6 4555 2 2 24 PHE HB3 H -6.336 1.056 -0.713 1.00 . B B . 24 PHE HB3 1 1 6 4556 2 2 24 PHE HD1 H -7.315 3.076 -1.848 1.00 . B B . 24 PHE HD1 1 1 6 4557 2 2 24 PHE HD2 H -5.776 3.210 2.162 1.00 . B B . 24 PHE HD2 1 1 6 4558 2 2 24 PHE HE1 H -7.204 5.551 -1.974 1.00 . B B . 24 PHE HE1 1 1 6 4559 2 2 24 PHE HE2 H -5.664 5.686 2.037 1.00 . B B . 24 PHE HE2 1 1 6 4560 2 2 24 PHE HZ H -6.376 6.857 -0.032 1.00 . B B . 24 PHE HZ 1 1 6 4561 2 2 24 PHE N N -9.017 1.970 -0.022 1.00 . B B . 24 PHE N 1 1 6 4562 2 2 24 PHE O O -8.903 1.868 2.668 1.00 . B B . 24 PHE O 1 1 6 4563 2 2 25 PHE C C -6.378 0.429 4.916 1.00 . B B . 25 PHE C 1 1 6 4564 2 2 25 PHE CA C -7.717 0.060 4.274 1.00 . B B . 25 PHE CA 1 1 6 4565 2 2 25 PHE CB C -8.112 -1.354 4.702 1.00 . B B . 25 PHE CB 1 1 6 4566 2 2 25 PHE CD1 C -10.246 -0.959 5.985 1.00 . B B . 25 PHE CD1 1 1 6 4567 2 2 25 PHE CD2 C -8.241 -1.560 7.212 1.00 . B B . 25 PHE CD2 1 1 6 4568 2 2 25 PHE CE1 C -10.964 -0.899 7.186 1.00 . B B . 25 PHE CE1 1 1 6 4569 2 2 25 PHE CE2 C -8.959 -1.501 8.414 1.00 . B B . 25 PHE CE2 1 1 6 4570 2 2 25 PHE CG C -8.885 -1.289 5.998 1.00 . B B . 25 PHE CG 1 1 6 4571 2 2 25 PHE CZ C -10.321 -1.171 8.401 1.00 . B B . 25 PHE CZ 1 1 6 4572 2 2 25 PHE H H -7.035 -0.548 2.324 1.00 . B B . 25 PHE H 1 1 6 4573 2 2 25 PHE HA H -8.476 0.759 4.595 1.00 . B B . 25 PHE HA 1 1 6 4574 2 2 25 PHE HB2 H -8.729 -1.803 3.937 1.00 . B B . 25 PHE HB2 1 1 6 4575 2 2 25 PHE HB3 H -7.223 -1.950 4.844 1.00 . B B . 25 PHE HB3 1 1 6 4576 2 2 25 PHE HD1 H -10.742 -0.749 5.048 1.00 . B B . 25 PHE HD1 1 1 6 4577 2 2 25 PHE HD2 H -7.191 -1.815 7.222 1.00 . B B . 25 PHE HD2 1 1 6 4578 2 2 25 PHE HE1 H -12.014 -0.645 7.176 1.00 . B B . 25 PHE HE1 1 1 6 4579 2 2 25 PHE HE2 H -8.463 -1.710 9.350 1.00 . B B . 25 PHE HE2 1 1 6 4580 2 2 25 PHE HZ H -10.874 -1.125 9.327 1.00 . B B . 25 PHE HZ 1 1 6 4581 2 2 25 PHE N N -7.588 0.112 2.791 1.00 . B B . 25 PHE N 1 1 6 4582 2 2 25 PHE O O -5.603 -0.427 5.294 1.00 . B B . 25 PHE O 1 1 6 4583 2 2 26 TYR C C -4.882 1.926 7.173 1.00 . B B . 26 TYR C 1 1 6 4584 2 2 26 TYR CA C -4.811 2.121 5.657 1.00 . B B . 26 TYR CA 1 1 6 4585 2 2 26 TYR CB C -4.559 3.596 5.341 1.00 . B B . 26 TYR CB 1 1 6 4586 2 2 26 TYR CD1 C -2.132 3.124 5.845 1.00 . B B . 26 TYR CD1 1 1 6 4587 2 2 26 TYR CD2 C -3.058 5.279 6.466 1.00 . B B . 26 TYR CD2 1 1 6 4588 2 2 26 TYR CE1 C -0.888 3.509 6.362 1.00 . B B . 26 TYR CE1 1 1 6 4589 2 2 26 TYR CE2 C -1.815 5.665 6.983 1.00 . B B . 26 TYR CE2 1 1 6 4590 2 2 26 TYR CG C -3.217 4.009 5.897 1.00 . B B . 26 TYR CG 1 1 6 4591 2 2 26 TYR CZ C -0.730 4.780 6.931 1.00 . B B . 26 TYR CZ 1 1 6 4592 2 2 26 TYR H H -6.739 2.372 4.729 1.00 . B B . 26 TYR H 1 1 6 4593 2 2 26 TYR HA H -4.007 1.523 5.255 1.00 . B B . 26 TYR HA 1 1 6 4594 2 2 26 TYR HB2 H -4.566 3.740 4.271 1.00 . B B . 26 TYR HB2 1 1 6 4595 2 2 26 TYR HB3 H -5.334 4.198 5.791 1.00 . B B . 26 TYR HB3 1 1 6 4596 2 2 26 TYR HD1 H -2.254 2.145 5.406 1.00 . B B . 26 TYR HD1 1 1 6 4597 2 2 26 TYR HD2 H -3.895 5.961 6.507 1.00 . B B . 26 TYR HD2 1 1 6 4598 2 2 26 TYR HE1 H -0.052 2.827 6.322 1.00 . B B . 26 TYR HE1 1 1 6 4599 2 2 26 TYR HE2 H -1.694 6.645 7.421 1.00 . B B . 26 TYR HE2 1 1 6 4600 2 2 26 TYR HH H 1.151 5.052 6.748 1.00 . B B . 26 TYR HH 1 1 6 4601 2 2 26 TYR N N -6.100 1.698 5.041 1.00 . B B . 26 TYR N 1 1 6 4602 2 2 26 TYR O O -5.922 2.080 7.781 1.00 . B B . 26 TYR O 1 1 6 4603 2 2 26 TYR OH O 0.495 5.161 7.441 1.00 . B B . 26 TYR OH 1 1 6 4604 2 2 27 THR C C -2.412 1.698 9.841 1.00 . B B . 27 THR C 1 1 6 4605 2 2 27 THR CA C -3.793 1.377 9.265 1.00 . B B . 27 THR CA 1 1 6 4606 2 2 27 THR CB C -4.142 -0.081 9.569 1.00 . B B . 27 THR CB 1 1 6 4607 2 2 27 THR CG2 C -3.546 -0.984 8.487 1.00 . B B . 27 THR CG2 1 1 6 4608 2 2 27 THR H H -2.953 1.462 7.283 1.00 . B B . 27 THR H 1 1 6 4609 2 2 27 THR HA H -4.531 2.024 9.716 1.00 . B B . 27 THR HA 1 1 6 4610 2 2 27 THR HB H -5.215 -0.201 9.581 1.00 . B B . 27 THR HB 1 1 6 4611 2 2 27 THR HG1 H -2.747 -0.835 10.696 1.00 . B B . 27 THR HG1 1 1 6 4612 2 2 27 THR HG21 H -3.028 -1.810 8.951 1.00 . B B . 27 THR HG21 1 1 6 4613 2 2 27 THR HG22 H -2.850 -0.416 7.887 1.00 . B B . 27 THR HG22 1 1 6 4614 2 2 27 THR HG23 H -4.337 -1.364 7.857 1.00 . B B . 27 THR HG23 1 1 6 4615 2 2 27 THR N N -3.783 1.585 7.790 1.00 . B B . 27 THR N 1 1 6 4616 2 2 27 THR O O -1.412 1.146 9.425 1.00 . B B . 27 THR O 1 1 6 4617 2 2 27 THR OG1 O -3.610 -0.439 10.837 1.00 . B B . 27 THR OG1 1 1 6 4618 2 2 28 LYS C C -0.637 1.886 12.439 1.00 . B B . 28 LYS C 1 1 6 4619 2 2 28 LYS CA C -1.027 2.934 11.403 1.00 . B B . 28 LYS CA 1 1 6 4620 2 2 28 LYS CB C -1.099 4.283 12.124 1.00 . B B . 28 LYS CB 1 1 6 4621 2 2 28 LYS CD C -0.200 5.389 10.058 1.00 . B B . 28 LYS CD 1 1 6 4622 2 2 28 LYS CE C -1.061 6.622 9.782 1.00 . B B . 28 LYS CE 1 1 6 4623 2 2 28 LYS CG C -0.024 5.221 11.572 1.00 . B B . 28 LYS CG 1 1 6 4624 2 2 28 LYS H H -3.168 3.013 11.117 1.00 . B B . 28 LYS H 1 1 6 4625 2 2 28 LYS HA H -0.274 2.977 10.631 1.00 . B B . 28 LYS HA 1 1 6 4626 2 2 28 LYS HB2 H -2.078 4.721 11.998 1.00 . B B . 28 LYS HB2 1 1 6 4627 2 2 28 LYS HB3 H -0.920 4.123 13.179 1.00 . B B . 28 LYS HB3 1 1 6 4628 2 2 28 LYS HD2 H 0.769 5.515 9.593 1.00 . B B . 28 LYS HD2 1 1 6 4629 2 2 28 LYS HD3 H -0.683 4.514 9.649 1.00 . B B . 28 LYS HD3 1 1 6 4630 2 2 28 LYS HE2 H -1.950 6.329 9.243 1.00 . B B . 28 LYS HE2 1 1 6 4631 2 2 28 LYS HE3 H -1.343 7.082 10.718 1.00 . B B . 28 LYS HE3 1 1 6 4632 2 2 28 LYS HG2 H -0.108 6.183 12.055 1.00 . B B . 28 LYS HG2 1 1 6 4633 2 2 28 LYS HG3 H 0.950 4.802 11.774 1.00 . B B . 28 LYS HG3 1 1 6 4634 2 2 28 LYS HZ1 H 0.298 8.190 9.591 1.00 . B B . 28 LYS HZ1 1 1 6 4635 2 2 28 LYS HZ2 H -0.939 8.198 8.426 1.00 . B B . 28 LYS HZ2 1 1 6 4636 2 2 28 LYS HZ3 H 0.336 7.081 8.307 1.00 . B B . 28 LYS HZ3 1 1 6 4637 2 2 28 LYS N N -2.349 2.583 10.798 1.00 . B B . 28 LYS N 1 1 6 4638 2 2 28 LYS NZ N -0.283 7.596 8.965 1.00 . B B . 28 LYS NZ 1 1 6 4639 2 2 28 LYS O O 0.441 1.329 12.383 1.00 . B B . 28 LYS O 1 1 6 4640 2 2 29 PRO C C -1.544 -0.702 14.026 1.00 . B B . 29 PRO C 1 1 6 4641 2 2 29 PRO CA C -1.278 0.736 14.483 1.00 . B B . 29 PRO CA 1 1 6 4642 2 2 29 PRO CB C -2.289 1.177 15.539 1.00 . B B . 29 PRO CB 1 1 6 4643 2 2 29 PRO CD C -2.833 2.357 13.445 1.00 . B B . 29 PRO CD 1 1 6 4644 2 2 29 PRO CG C -3.421 1.912 14.790 1.00 . B B . 29 PRO CG 1 1 6 4645 2 2 29 PRO HA H -0.276 0.839 14.865 1.00 . B B . 29 PRO HA 1 1 6 4646 2 2 29 PRO HB2 H -2.678 0.322 16.064 1.00 . B B . 29 PRO HB2 1 1 6 4647 2 2 29 PRO HB3 H -1.818 1.862 16.226 1.00 . B B . 29 PRO HB3 1 1 6 4648 2 2 29 PRO HD2 H -3.469 2.033 12.633 1.00 . B B . 29 PRO HD2 1 1 6 4649 2 2 29 PRO HD3 H -2.709 3.425 13.430 1.00 . B B . 29 PRO HD3 1 1 6 4650 2 2 29 PRO HG2 H -4.255 1.242 14.629 1.00 . B B . 29 PRO HG2 1 1 6 4651 2 2 29 PRO HG3 H -3.740 2.775 15.352 1.00 . B B . 29 PRO HG3 1 1 6 4652 2 2 29 PRO N N -1.517 1.678 13.384 1.00 . B B . 29 PRO N 1 1 6 4653 2 2 29 PRO O O -0.662 -1.380 13.537 1.00 . B B . 29 PRO O 1 1 6 4654 2 2 30 THR C C -3.030 -2.654 12.229 1.00 . B B . 30 THR C 1 1 6 4655 2 2 30 THR CA C -3.065 -2.566 13.756 1.00 . B B . 30 THR CA 1 1 6 4656 2 2 30 THR CB C -4.460 -2.950 14.258 1.00 . B B . 30 THR CB 1 1 6 4657 2 2 30 THR CG2 C -4.519 -2.789 15.778 1.00 . B B . 30 THR CG2 1 1 6 4658 2 2 30 THR H H -3.449 -0.612 14.578 1.00 . B B . 30 THR H 1 1 6 4659 2 2 30 THR HA H -2.334 -3.243 14.173 1.00 . B B . 30 THR HA 1 1 6 4660 2 2 30 THR HB H -4.665 -3.977 14.001 1.00 . B B . 30 THR HB 1 1 6 4661 2 2 30 THR HG1 H -6.120 -1.936 14.297 1.00 . B B . 30 THR HG1 1 1 6 4662 2 2 30 THR HG21 H -4.003 -1.885 16.065 1.00 . B B . 30 THR HG21 1 1 6 4663 2 2 30 THR HG22 H -4.047 -3.638 16.248 1.00 . B B . 30 THR HG22 1 1 6 4664 2 2 30 THR HG23 H -5.551 -2.730 16.093 1.00 . B B . 30 THR HG23 1 1 6 4665 2 2 30 THR N N -2.751 -1.173 14.182 1.00 . B B . 30 THR N 1 1 6 4666 2 2 30 THR O O -3.915 -3.281 11.671 1.00 . B B . 30 THR O 1 1 6 4667 2 2 30 THR OXT O -2.118 -2.093 11.644 1.00 . B B . 30 THR OXT 1 1 6 4668 2 2 30 THR OG1 O -5.429 -2.106 13.652 1.00 . B B . 30 THR OG1 1 1 7 4669 1 1 1 GLY C C 0.956 -4.143 7.591 1.00 . A A . 1 GLY C 1 1 7 4670 1 1 1 GLY CA C 0.322 -4.412 8.914 1.00 . A A . 1 GLY CA 1 1 7 4671 1 1 1 GLY H1 H -1.455 -5.107 7.999 1.00 . A A . 1 GLY H1 1 1 7 4672 1 1 1 GLY H2 H -1.709 -4.365 9.506 1.00 . A A . 1 GLY H2 1 1 7 4673 1 1 1 GLY H3 H -1.058 -5.932 9.428 1.00 . A A . 1 GLY H3 1 1 7 4674 1 1 1 GLY HA2 H 0.303 -3.439 8.984 1.00 . A A . 1 GLY HA2 1 1 7 4675 1 1 1 GLY HA3 H 0.933 -4.918 9.771 1.00 . A A . 1 GLY HA3 1 1 7 4676 1 1 1 GLY N N -1.088 -5.001 8.966 1.00 . A A . 1 GLY N 1 1 7 4677 1 1 1 GLY O O 1.998 -4.681 7.273 1.00 . A A . 1 GLY O 1 1 7 4678 1 1 2 ILE C C 1.750 -1.706 5.537 1.00 . A A . 2 ILE C 1 1 7 4679 1 1 2 ILE CA C 0.940 -3.002 5.450 1.00 . A A . 2 ILE CA 1 1 7 4680 1 1 2 ILE CB C -0.183 -2.843 4.424 1.00 . A A . 2 ILE CB 1 1 7 4681 1 1 2 ILE CD1 C 0.153 -1.047 2.647 1.00 . A A . 2 ILE CD1 1 1 7 4682 1 1 2 ILE CG1 C 0.433 -2.503 3.048 1.00 . A A . 2 ILE CG1 1 1 7 4683 1 1 2 ILE CG2 C -1.150 -1.747 4.890 1.00 . A A . 2 ILE CG2 1 1 7 4684 1 1 2 ILE H H -0.488 -2.885 7.061 1.00 . A A . 2 ILE H 1 1 7 4685 1 1 2 ILE HA H 1.589 -3.811 5.150 1.00 . A A . 2 ILE HA 1 1 7 4686 1 1 2 ILE HB H -0.723 -3.776 4.351 1.00 . A A . 2 ILE HB 1 1 7 4687 1 1 2 ILE HD11 H -0.914 -0.879 2.622 1.00 . A A . 2 ILE HD11 1 1 7 4688 1 1 2 ILE HD12 H 0.570 -0.856 1.669 1.00 . A A . 2 ILE HD12 1 1 7 4689 1 1 2 ILE HD13 H 0.605 -0.380 3.366 1.00 . A A . 2 ILE HD13 1 1 7 4690 1 1 2 ILE HG12 H 1.502 -2.657 3.093 1.00 . A A . 2 ILE HG12 1 1 7 4691 1 1 2 ILE HG13 H 0.014 -3.162 2.303 1.00 . A A . 2 ILE HG13 1 1 7 4692 1 1 2 ILE HG21 H -1.642 -2.064 5.797 1.00 . A A . 2 ILE HG21 1 1 7 4693 1 1 2 ILE HG22 H -1.888 -1.570 4.123 1.00 . A A . 2 ILE HG22 1 1 7 4694 1 1 2 ILE HG23 H -0.599 -0.836 5.078 1.00 . A A . 2 ILE HG23 1 1 7 4695 1 1 2 ILE N N 0.352 -3.309 6.786 1.00 . A A . 2 ILE N 1 1 7 4696 1 1 2 ILE O O 2.138 -1.132 4.541 1.00 . A A . 2 ILE O 1 1 7 4697 1 1 3 ABA C C 4.187 -0.335 7.376 1.00 . A A . 3 ABA C 1 1 7 4698 1 1 3 ABA CA C 2.779 0.007 6.900 1.00 . A A . 3 ABA CA 1 1 7 4699 1 1 3 ABA CB C 2.090 0.907 7.932 1.00 . A A . 3 ABA CB 1 1 7 4700 1 1 3 ABA CG C 0.665 0.416 8.204 1.00 . A A . 3 ABA CG 1 1 7 4701 1 1 3 ABA H H 1.679 -1.710 7.508 1.00 . A A . 3 ABA H 1 1 7 4702 1 1 3 ABA HA H 2.839 0.523 5.962 1.00 . A A . 3 ABA HA 1 1 7 4703 1 1 3 ABA HB2 H 2.655 0.906 8.851 1.00 . A A . 3 ABA HB2 1 1 7 4704 1 1 3 ABA HB3 H 2.048 1.903 7.545 1.00 . A A . 3 ABA HB3 1 1 7 4705 1 1 3 ABA HG1 H 0.176 1.090 8.891 1.00 . A A . 3 ABA HG1 1 1 7 4706 1 1 3 ABA HG2 H 0.702 -0.574 8.634 1.00 . A A . 3 ABA HG2 1 1 7 4707 1 1 3 ABA HG3 H 0.113 0.385 7.276 1.00 . A A . 3 ABA HG3 1 1 7 4708 1 1 3 ABA N N 2.003 -1.241 6.727 1.00 . A A . 3 ABA N 1 1 7 4709 1 1 3 ABA O O 5.138 -0.251 6.634 1.00 . A A . 3 ABA O 1 1 7 4710 1 1 4 GLU C C 6.251 -2.250 8.341 1.00 . A A . 4 GLU C 1 1 7 4711 1 1 4 GLU CA C 5.680 -1.069 9.130 1.00 . A A . 4 GLU CA 1 1 7 4712 1 1 4 GLU CB C 5.579 -1.451 10.608 1.00 . A A . 4 GLU CB 1 1 7 4713 1 1 4 GLU CD C 3.778 -0.593 12.111 1.00 . A A . 4 GLU CD 1 1 7 4714 1 1 4 GLU CG C 5.097 -0.246 11.418 1.00 . A A . 4 GLU CG 1 1 7 4715 1 1 4 GLU H H 3.544 -0.786 9.186 1.00 . A A . 4 GLU H 1 1 7 4716 1 1 4 GLU HA H 6.335 -0.216 9.024 1.00 . A A . 4 GLU HA 1 1 7 4717 1 1 4 GLU HB2 H 4.879 -2.265 10.720 1.00 . A A . 4 GLU HB2 1 1 7 4718 1 1 4 GLU HB3 H 6.549 -1.758 10.966 1.00 . A A . 4 GLU HB3 1 1 7 4719 1 1 4 GLU HG2 H 5.839 0.008 12.162 1.00 . A A . 4 GLU HG2 1 1 7 4720 1 1 4 GLU HG3 H 4.945 0.595 10.759 1.00 . A A . 4 GLU HG3 1 1 7 4721 1 1 4 GLU N N 4.327 -0.723 8.607 1.00 . A A . 4 GLU N 1 1 7 4722 1 1 4 GLU O O 7.442 -2.343 8.122 1.00 . A A . 4 GLU O 1 1 7 4723 1 1 4 GLU OE1 O 3.517 -1.771 12.288 1.00 . A A . 4 GLU OE1 1 1 7 4724 1 1 4 GLU OE2 O 3.052 0.326 12.452 1.00 . A A . 4 GLU OE2 1 1 7 4725 1 1 5 GLN C C 6.209 -3.896 5.700 1.00 . A A . 5 GLN C 1 1 7 4726 1 1 5 GLN CA C 5.911 -4.325 7.138 1.00 . A A . 5 GLN CA 1 1 7 4727 1 1 5 GLN CB C 4.846 -5.426 7.132 1.00 . A A . 5 GLN CB 1 1 7 4728 1 1 5 GLN CD C 5.004 -7.915 7.310 1.00 . A A . 5 GLN CD 1 1 7 4729 1 1 5 GLN CG C 5.417 -6.692 6.488 1.00 . A A . 5 GLN CG 1 1 7 4730 1 1 5 GLN H H 4.453 -3.059 8.099 1.00 . A A . 5 GLN H 1 1 7 4731 1 1 5 GLN HA H 6.814 -4.700 7.596 1.00 . A A . 5 GLN HA 1 1 7 4732 1 1 5 GLN HB2 H 4.547 -5.642 8.147 1.00 . A A . 5 GLN HB2 1 1 7 4733 1 1 5 GLN HB3 H 3.988 -5.094 6.567 1.00 . A A . 5 GLN HB3 1 1 7 4734 1 1 5 GLN HE21 H 6.046 -7.369 8.909 1.00 . A A . 5 GLN HE21 1 1 7 4735 1 1 5 GLN HE22 H 5.189 -8.826 9.064 1.00 . A A . 5 GLN HE22 1 1 7 4736 1 1 5 GLN HG2 H 5.034 -6.789 5.482 1.00 . A A . 5 GLN HG2 1 1 7 4737 1 1 5 GLN HG3 H 6.494 -6.628 6.459 1.00 . A A . 5 GLN HG3 1 1 7 4738 1 1 5 GLN N N 5.411 -3.153 7.912 1.00 . A A . 5 GLN N 1 1 7 4739 1 1 5 GLN NE2 N 5.451 -8.048 8.529 1.00 . A A . 5 GLN NE2 1 1 7 4740 1 1 5 GLN O O 7.097 -4.415 5.059 1.00 . A A . 5 GLN O 1 1 7 4741 1 1 5 GLN OE1 O 4.268 -8.760 6.837 1.00 . A A . 5 GLN OE1 1 1 7 4742 1 1 6 CYS C C 6.383 -1.113 3.808 1.00 . A A . 6 CYS C 1 1 7 4743 1 1 6 CYS CA C 5.699 -2.483 3.797 1.00 . A A . 6 CYS CA 1 1 7 4744 1 1 6 CYS CB C 4.355 -2.396 3.074 1.00 . A A . 6 CYS CB 1 1 7 4745 1 1 6 CYS H H 4.756 -2.547 5.727 1.00 . A A . 6 CYS H 1 1 7 4746 1 1 6 CYS HA H 6.333 -3.192 3.281 1.00 . A A . 6 CYS HA 1 1 7 4747 1 1 6 CYS HB2 H 3.561 -2.408 3.798 1.00 . A A . 6 CYS HB2 1 1 7 4748 1 1 6 CYS HB3 H 4.299 -1.488 2.511 1.00 . A A . 6 CYS HB3 1 1 7 4749 1 1 6 CYS N N 5.469 -2.952 5.191 1.00 . A A . 6 CYS N 1 1 7 4750 1 1 6 CYS O O 6.548 -0.487 2.780 1.00 . A A . 6 CYS O 1 1 7 4751 1 1 6 CYS SG S 4.177 -3.819 1.972 1.00 . A A . 6 CYS SG 1 1 7 4752 1 1 7 CYS C C 8.965 0.451 5.276 1.00 . A A . 7 CYS C 1 1 7 4753 1 1 7 CYS CA C 7.477 0.675 5.017 1.00 . A A . 7 CYS CA 1 1 7 4754 1 1 7 CYS CB C 6.872 1.529 6.130 1.00 . A A . 7 CYS CB 1 1 7 4755 1 1 7 CYS H H 6.660 -1.169 5.774 1.00 . A A . 7 CYS H 1 1 7 4756 1 1 7 CYS HA H 7.352 1.177 4.082 1.00 . A A . 7 CYS HA 1 1 7 4757 1 1 7 CYS HB2 H 5.848 1.767 5.881 1.00 . A A . 7 CYS HB2 1 1 7 4758 1 1 7 CYS HB3 H 6.896 0.978 7.051 1.00 . A A . 7 CYS HB3 1 1 7 4759 1 1 7 CYS N N 6.793 -0.647 4.956 1.00 . A A . 7 CYS N 1 1 7 4760 1 1 7 CYS O O 9.796 1.275 4.949 1.00 . A A . 7 CYS O 1 1 7 4761 1 1 7 CYS SG S 7.820 3.063 6.309 1.00 . A A . 7 CYS SG 1 1 7 4762 1 1 8 THR C C 11.231 -2.007 5.090 1.00 . A A . 8 THR C 1 1 7 4763 1 1 8 THR CA C 10.742 -0.971 6.107 1.00 . A A . 8 THR CA 1 1 7 4764 1 1 8 THR CB C 10.903 -1.531 7.523 1.00 . A A . 8 THR CB 1 1 7 4765 1 1 8 THR CG2 C 11.032 -0.378 8.521 1.00 . A A . 8 THR CG2 1 1 7 4766 1 1 8 THR H H 8.619 -1.329 6.086 1.00 . A A . 8 THR H 1 1 7 4767 1 1 8 THR HA H 11.323 -0.065 6.008 1.00 . A A . 8 THR HA 1 1 7 4768 1 1 8 THR HB H 11.791 -2.141 7.568 1.00 . A A . 8 THR HB 1 1 7 4769 1 1 8 THR HG1 H 9.730 -3.054 7.231 1.00 . A A . 8 THR HG1 1 1 7 4770 1 1 8 THR HG21 H 11.655 -0.687 9.347 1.00 . A A . 8 THR HG21 1 1 7 4771 1 1 8 THR HG22 H 10.053 -0.108 8.889 1.00 . A A . 8 THR HG22 1 1 7 4772 1 1 8 THR HG23 H 11.481 0.473 8.031 1.00 . A A . 8 THR HG23 1 1 7 4773 1 1 8 THR N N 9.307 -0.674 5.844 1.00 . A A . 8 THR N 1 1 7 4774 1 1 8 THR O O 12.407 -2.296 5.001 1.00 . A A . 8 THR O 1 1 7 4775 1 1 8 THR OG1 O 9.768 -2.320 7.849 1.00 . A A . 8 THR OG1 1 1 7 4776 1 1 9 SER C C 10.320 -3.113 1.914 1.00 . A A . 9 SER C 1 1 7 4777 1 1 9 SER CA C 10.744 -3.583 3.309 1.00 . A A . 9 SER CA 1 1 7 4778 1 1 9 SER CB C 10.085 -4.926 3.632 1.00 . A A . 9 SER CB 1 1 7 4779 1 1 9 SER H H 9.388 -2.321 4.407 1.00 . A A . 9 SER H 1 1 7 4780 1 1 9 SER HA H 11.815 -3.697 3.332 1.00 . A A . 9 SER HA 1 1 7 4781 1 1 9 SER HB2 H 10.482 -5.689 2.984 1.00 . A A . 9 SER HB2 1 1 7 4782 1 1 9 SER HB3 H 10.293 -5.189 4.661 1.00 . A A . 9 SER HB3 1 1 7 4783 1 1 9 SER HG H 8.334 -4.205 4.078 1.00 . A A . 9 SER HG 1 1 7 4784 1 1 9 SER N N 10.333 -2.568 4.320 1.00 . A A . 9 SER N 1 1 7 4785 1 1 9 SER O O 10.996 -2.321 1.288 1.00 . A A . 9 SER O 1 1 7 4786 1 1 9 SER OG O 8.683 -4.823 3.430 1.00 . A A . 9 SER OG 1 1 7 4787 1 1 10 ILE C C 7.274 -3.438 -0.116 1.00 . A A . 10 ILE C 1 1 7 4788 1 1 10 ILE CA C 8.776 -3.166 0.061 1.00 . A A . 10 ILE CA 1 1 7 4789 1 1 10 ILE CB C 9.584 -3.945 -0.989 1.00 . A A . 10 ILE CB 1 1 7 4790 1 1 10 ILE CD1 C 12.039 -3.813 -0.569 1.00 . A A . 10 ILE CD1 1 1 7 4791 1 1 10 ILE CG1 C 10.865 -3.182 -1.318 1.00 . A A . 10 ILE CG1 1 1 7 4792 1 1 10 ILE CG2 C 8.769 -4.132 -2.268 1.00 . A A . 10 ILE CG2 1 1 7 4793 1 1 10 ILE H H 8.684 -4.235 1.921 1.00 . A A . 10 ILE H 1 1 7 4794 1 1 10 ILE HA H 8.962 -2.109 -0.058 1.00 . A A . 10 ILE HA 1 1 7 4795 1 1 10 ILE HB H 9.844 -4.911 -0.591 1.00 . A A . 10 ILE HB 1 1 7 4796 1 1 10 ILE HD11 H 12.551 -4.505 -1.220 1.00 . A A . 10 ILE HD11 1 1 7 4797 1 1 10 ILE HD12 H 11.670 -4.341 0.299 1.00 . A A . 10 ILE HD12 1 1 7 4798 1 1 10 ILE HD13 H 12.724 -3.039 -0.256 1.00 . A A . 10 ILE HD13 1 1 7 4799 1 1 10 ILE HG12 H 11.048 -3.228 -2.381 1.00 . A A . 10 ILE HG12 1 1 7 4800 1 1 10 ILE HG13 H 10.759 -2.156 -1.012 1.00 . A A . 10 ILE HG13 1 1 7 4801 1 1 10 ILE HG21 H 8.515 -3.166 -2.675 1.00 . A A . 10 ILE HG21 1 1 7 4802 1 1 10 ILE HG22 H 7.864 -4.676 -2.038 1.00 . A A . 10 ILE HG22 1 1 7 4803 1 1 10 ILE HG23 H 9.351 -4.687 -2.986 1.00 . A A . 10 ILE HG23 1 1 7 4804 1 1 10 ILE N N 9.216 -3.593 1.414 1.00 . A A . 10 ILE N 1 1 7 4805 1 1 10 ILE O O 6.664 -4.176 0.632 1.00 . A A . 10 ILE O 1 1 7 4806 1 1 11 CYS C C 5.005 -2.751 -2.893 1.00 . A A . 11 CYS C 1 1 7 4807 1 1 11 CYS CA C 5.243 -3.047 -1.409 1.00 . A A . 11 CYS CA 1 1 7 4808 1 1 11 CYS CB C 4.408 -2.113 -0.535 1.00 . A A . 11 CYS CB 1 1 7 4809 1 1 11 CYS H H 7.222 -2.263 -1.709 1.00 . A A . 11 CYS H 1 1 7 4810 1 1 11 CYS HA H 4.969 -4.069 -1.202 1.00 . A A . 11 CYS HA 1 1 7 4811 1 1 11 CYS HB2 H 5.054 -1.606 0.164 1.00 . A A . 11 CYS HB2 1 1 7 4812 1 1 11 CYS HB3 H 3.905 -1.386 -1.156 1.00 . A A . 11 CYS HB3 1 1 7 4813 1 1 11 CYS N N 6.693 -2.844 -1.123 1.00 . A A . 11 CYS N 1 1 7 4814 1 1 11 CYS O O 5.115 -1.626 -3.339 1.00 . A A . 11 CYS O 1 1 7 4815 1 1 11 CYS SG S 3.181 -3.089 0.373 1.00 . A A . 11 CYS SG 1 1 7 4816 1 1 12 SER C C 3.116 -2.997 -5.408 1.00 . A A . 12 SER C 1 1 7 4817 1 1 12 SER CA C 4.503 -3.559 -5.132 1.00 . A A . 12 SER CA 1 1 7 4818 1 1 12 SER CB C 4.660 -4.897 -5.856 1.00 . A A . 12 SER CB 1 1 7 4819 1 1 12 SER H H 4.651 -4.665 -3.288 1.00 . A A . 12 SER H 1 1 7 4820 1 1 12 SER HA H 5.239 -2.866 -5.511 1.00 . A A . 12 SER HA 1 1 7 4821 1 1 12 SER HB2 H 3.923 -4.974 -6.638 1.00 . A A . 12 SER HB2 1 1 7 4822 1 1 12 SER HB3 H 5.649 -4.955 -6.291 1.00 . A A . 12 SER HB3 1 1 7 4823 1 1 12 SER HG H 3.663 -6.414 -5.162 1.00 . A A . 12 SER HG 1 1 7 4824 1 1 12 SER N N 4.712 -3.763 -3.667 1.00 . A A . 12 SER N 1 1 7 4825 1 1 12 SER O O 2.193 -3.145 -4.633 1.00 . A A . 12 SER O 1 1 7 4826 1 1 12 SER OG O 4.474 -5.957 -4.930 1.00 . A A . 12 SER OG 1 1 7 4827 1 1 13 LEU C C 0.608 -2.831 -7.031 1.00 . A A . 13 LEU C 1 1 7 4828 1 1 13 LEU CA C 1.680 -1.745 -6.911 1.00 . A A . 13 LEU CA 1 1 7 4829 1 1 13 LEU CB C 1.852 -1.038 -8.251 1.00 . A A . 13 LEU CB 1 1 7 4830 1 1 13 LEU CD1 C 1.668 -1.552 -10.677 1.00 . A A . 13 LEU CD1 1 1 7 4831 1 1 13 LEU CD2 C 3.656 -2.335 -9.408 1.00 . A A . 13 LEU CD2 1 1 7 4832 1 1 13 LEU CG C 2.150 -2.075 -9.332 1.00 . A A . 13 LEU CG 1 1 7 4833 1 1 13 LEU H H 3.754 -2.247 -7.116 1.00 . A A . 13 LEU H 1 1 7 4834 1 1 13 LEU HA H 1.380 -1.030 -6.170 1.00 . A A . 13 LEU HA 1 1 7 4835 1 1 13 LEU HB2 H 0.944 -0.507 -8.498 1.00 . A A . 13 LEU HB2 1 1 7 4836 1 1 13 LEU HB3 H 2.674 -0.342 -8.187 1.00 . A A . 13 LEU HB3 1 1 7 4837 1 1 13 LEU HD11 H 2.455 -1.668 -11.408 1.00 . A A . 13 LEU HD11 1 1 7 4838 1 1 13 LEU HD12 H 1.414 -0.507 -10.583 1.00 . A A . 13 LEU HD12 1 1 7 4839 1 1 13 LEU HD13 H 0.800 -2.110 -10.988 1.00 . A A . 13 LEU HD13 1 1 7 4840 1 1 13 LEU HD21 H 4.190 -1.463 -9.062 1.00 . A A . 13 LEU HD21 1 1 7 4841 1 1 13 LEU HD22 H 3.934 -2.546 -10.430 1.00 . A A . 13 LEU HD22 1 1 7 4842 1 1 13 LEU HD23 H 3.907 -3.182 -8.785 1.00 . A A . 13 LEU HD23 1 1 7 4843 1 1 13 LEU HG H 1.635 -2.992 -9.094 1.00 . A A . 13 LEU HG 1 1 7 4844 1 1 13 LEU N N 2.982 -2.346 -6.525 1.00 . A A . 13 LEU N 1 1 7 4845 1 1 13 LEU O O -0.571 -2.545 -7.105 1.00 . A A . 13 LEU O 1 1 7 4846 1 1 14 TYR C C -0.215 -5.653 -5.694 1.00 . A A . 14 TYR C 1 1 7 4847 1 1 14 TYR CA C -0.015 -5.161 -7.106 1.00 . A A . 14 TYR CA 1 1 7 4848 1 1 14 TYR CB C 0.505 -6.279 -8.028 1.00 . A A . 14 TYR CB 1 1 7 4849 1 1 14 TYR CD1 C -1.321 -8.019 -7.918 1.00 . A A . 14 TYR CD1 1 1 7 4850 1 1 14 TYR CD2 C 0.808 -8.496 -6.856 1.00 . A A . 14 TYR CD2 1 1 7 4851 1 1 14 TYR CE1 C -1.801 -9.273 -7.517 1.00 . A A . 14 TYR CE1 1 1 7 4852 1 1 14 TYR CE2 C 0.328 -9.749 -6.454 1.00 . A A . 14 TYR CE2 1 1 7 4853 1 1 14 TYR CG C -0.017 -7.630 -7.588 1.00 . A A . 14 TYR CG 1 1 7 4854 1 1 14 TYR CZ C -0.977 -10.138 -6.785 1.00 . A A . 14 TYR CZ 1 1 7 4855 1 1 14 TYR H H 1.948 -4.300 -6.925 1.00 . A A . 14 TYR H 1 1 7 4856 1 1 14 TYR HA H -0.942 -4.762 -7.479 1.00 . A A . 14 TYR HA 1 1 7 4857 1 1 14 TYR HB2 H 0.178 -6.086 -9.038 1.00 . A A . 14 TYR HB2 1 1 7 4858 1 1 14 TYR HB3 H 1.585 -6.288 -8.000 1.00 . A A . 14 TYR HB3 1 1 7 4859 1 1 14 TYR HD1 H -1.957 -7.353 -8.483 1.00 . A A . 14 TYR HD1 1 1 7 4860 1 1 14 TYR HD2 H 1.814 -8.197 -6.600 1.00 . A A . 14 TYR HD2 1 1 7 4861 1 1 14 TYR HE1 H -2.807 -9.573 -7.771 1.00 . A A . 14 TYR HE1 1 1 7 4862 1 1 14 TYR HE2 H 0.963 -10.416 -5.889 1.00 . A A . 14 TYR HE2 1 1 7 4863 1 1 14 TYR HH H -1.880 -11.274 -5.542 1.00 . A A . 14 TYR HH 1 1 7 4864 1 1 14 TYR N N 0.996 -4.076 -7.021 1.00 . A A . 14 TYR N 1 1 7 4865 1 1 14 TYR O O -1.301 -5.993 -5.269 1.00 . A A . 14 TYR O 1 1 7 4866 1 1 14 TYR OH O -1.448 -11.375 -6.394 1.00 . A A . 14 TYR OH 1 1 7 4867 1 1 15 GLN C C -0.098 -4.980 -2.845 1.00 . A A . 15 GLN C 1 1 7 4868 1 1 15 GLN CA C 0.774 -6.012 -3.542 1.00 . A A . 15 GLN CA 1 1 7 4869 1 1 15 GLN CB C 2.187 -5.932 -2.988 1.00 . A A . 15 GLN CB 1 1 7 4870 1 1 15 GLN CD C 2.072 -8.135 -1.816 1.00 . A A . 15 GLN CD 1 1 7 4871 1 1 15 GLN CG C 2.795 -7.327 -2.895 1.00 . A A . 15 GLN CG 1 1 7 4872 1 1 15 GLN H H 1.684 -5.299 -5.329 1.00 . A A . 15 GLN H 1 1 7 4873 1 1 15 GLN HA H 0.366 -7.002 -3.429 1.00 . A A . 15 GLN HA 1 1 7 4874 1 1 15 GLN HB2 H 2.788 -5.323 -3.654 1.00 . A A . 15 GLN HB2 1 1 7 4875 1 1 15 GLN HB3 H 2.162 -5.479 -2.015 1.00 . A A . 15 GLN HB3 1 1 7 4876 1 1 15 GLN HE21 H 3.722 -9.051 -1.203 1.00 . A A . 15 GLN HE21 1 1 7 4877 1 1 15 GLN HE22 H 2.304 -9.478 -0.374 1.00 . A A . 15 GLN HE22 1 1 7 4878 1 1 15 GLN HG2 H 2.694 -7.823 -3.850 1.00 . A A . 15 GLN HG2 1 1 7 4879 1 1 15 GLN HG3 H 3.840 -7.244 -2.641 1.00 . A A . 15 GLN HG3 1 1 7 4880 1 1 15 GLN N N 0.838 -5.625 -4.955 1.00 . A A . 15 GLN N 1 1 7 4881 1 1 15 GLN NE2 N 2.756 -8.956 -1.069 1.00 . A A . 15 GLN NE2 1 1 7 4882 1 1 15 GLN O O -0.824 -5.263 -1.913 1.00 . A A . 15 GLN O 1 1 7 4883 1 1 15 GLN OE1 O 0.873 -8.018 -1.653 1.00 . A A . 15 GLN OE1 1 1 7 4884 1 1 16 LEU C C -2.204 -2.722 -3.349 1.00 . A A . 16 LEU C 1 1 7 4885 1 1 16 LEU CA C -0.817 -2.667 -2.760 1.00 . A A . 16 LEU CA 1 1 7 4886 1 1 16 LEU CB C -0.111 -1.365 -3.118 1.00 . A A . 16 LEU CB 1 1 7 4887 1 1 16 LEU CD1 C 1.954 -0.041 -2.614 1.00 . A A . 16 LEU CD1 1 1 7 4888 1 1 16 LEU CD2 C 0.989 -1.590 -0.908 1.00 . A A . 16 LEU CD2 1 1 7 4889 1 1 16 LEU CG C 1.232 -1.367 -2.399 1.00 . A A . 16 LEU CG 1 1 7 4890 1 1 16 LEU H H 0.557 -3.601 -4.100 1.00 . A A . 16 LEU H 1 1 7 4891 1 1 16 LEU HA H -0.879 -2.764 -1.691 1.00 . A A . 16 LEU HA 1 1 7 4892 1 1 16 LEU HB2 H 0.047 -1.314 -4.185 1.00 . A A . 16 LEU HB2 1 1 7 4893 1 1 16 LEU HB3 H -0.696 -0.527 -2.795 1.00 . A A . 16 LEU HB3 1 1 7 4894 1 1 16 LEU HD11 H 3.009 -0.178 -2.431 1.00 . A A . 16 LEU HD11 1 1 7 4895 1 1 16 LEU HD12 H 1.561 0.697 -1.933 1.00 . A A . 16 LEU HD12 1 1 7 4896 1 1 16 LEU HD13 H 1.805 0.288 -3.631 1.00 . A A . 16 LEU HD13 1 1 7 4897 1 1 16 LEU HD21 H 1.788 -1.140 -0.342 1.00 . A A . 16 LEU HD21 1 1 7 4898 1 1 16 LEU HD22 H 0.958 -2.653 -0.706 1.00 . A A . 16 LEU HD22 1 1 7 4899 1 1 16 LEU HD23 H 0.048 -1.144 -0.625 1.00 . A A . 16 LEU HD23 1 1 7 4900 1 1 16 LEU HG H 1.842 -2.171 -2.785 1.00 . A A . 16 LEU HG 1 1 7 4901 1 1 16 LEU N N -0.024 -3.775 -3.330 1.00 . A A . 16 LEU N 1 1 7 4902 1 1 16 LEU O O -3.166 -2.264 -2.767 1.00 . A A . 16 LEU O 1 1 7 4903 1 1 17 GLU C C -4.421 -4.513 -4.352 1.00 . A A . 17 GLU C 1 1 7 4904 1 1 17 GLU CA C -3.631 -3.451 -5.119 1.00 . A A . 17 GLU CA 1 1 7 4905 1 1 17 GLU CB C -3.432 -3.885 -6.569 1.00 . A A . 17 GLU CB 1 1 7 4906 1 1 17 GLU CD C -4.815 -5.205 -8.174 1.00 . A A . 17 GLU CD 1 1 7 4907 1 1 17 GLU CG C -4.787 -3.969 -7.274 1.00 . A A . 17 GLU CG 1 1 7 4908 1 1 17 GLU H H -1.523 -3.704 -4.925 1.00 . A A . 17 GLU H 1 1 7 4909 1 1 17 GLU HA H -4.146 -2.507 -5.083 1.00 . A A . 17 GLU HA 1 1 7 4910 1 1 17 GLU HB2 H -2.802 -3.165 -7.072 1.00 . A A . 17 GLU HB2 1 1 7 4911 1 1 17 GLU HB3 H -2.954 -4.851 -6.592 1.00 . A A . 17 GLU HB3 1 1 7 4912 1 1 17 GLU HG2 H -5.573 -4.041 -6.536 1.00 . A A . 17 GLU HG2 1 1 7 4913 1 1 17 GLU HG3 H -4.937 -3.085 -7.876 1.00 . A A . 17 GLU HG3 1 1 7 4914 1 1 17 GLU N N -2.313 -3.319 -4.490 1.00 . A A . 17 GLU N 1 1 7 4915 1 1 17 GLU O O -5.638 -4.527 -4.352 1.00 . A A . 17 GLU O 1 1 7 4916 1 1 17 GLU OE1 O -3.764 -5.577 -8.668 1.00 . A A . 17 GLU OE1 1 1 7 4917 1 1 17 GLU OE2 O -5.887 -5.760 -8.353 1.00 . A A . 17 GLU OE2 1 1 7 4918 1 1 18 ASN C C -4.918 -5.928 -1.577 1.00 . A A . 18 ASN C 1 1 7 4919 1 1 18 ASN CA C -4.443 -6.472 -2.922 1.00 . A A . 18 ASN CA 1 1 7 4920 1 1 18 ASN CB C -3.502 -7.654 -2.691 1.00 . A A . 18 ASN CB 1 1 7 4921 1 1 18 ASN CG C -4.074 -8.902 -3.368 1.00 . A A . 18 ASN CG 1 1 7 4922 1 1 18 ASN H H -2.743 -5.369 -3.684 1.00 . A A . 18 ASN H 1 1 7 4923 1 1 18 ASN HA H -5.298 -6.804 -3.492 1.00 . A A . 18 ASN HA 1 1 7 4924 1 1 18 ASN HB2 H -2.534 -7.429 -3.108 1.00 . A A . 18 ASN HB2 1 1 7 4925 1 1 18 ASN HB3 H -3.405 -7.836 -1.631 1.00 . A A . 18 ASN HB3 1 1 7 4926 1 1 18 ASN HD21 H -4.701 -9.709 -1.666 1.00 . A A . 18 ASN HD21 1 1 7 4927 1 1 18 ASN HD22 H -5.010 -10.625 -3.061 1.00 . A A . 18 ASN HD22 1 1 7 4928 1 1 18 ASN N N -3.730 -5.405 -3.684 1.00 . A A . 18 ASN N 1 1 7 4929 1 1 18 ASN ND2 N -4.643 -9.821 -2.638 1.00 . A A . 18 ASN ND2 1 1 7 4930 1 1 18 ASN O O -5.556 -6.621 -0.809 1.00 . A A . 18 ASN O 1 1 7 4931 1 1 18 ASN OD1 O -4.005 -9.039 -4.573 1.00 . A A . 18 ASN OD1 1 1 7 4932 1 1 19 TYR C C -6.249 -3.183 -0.217 1.00 . A A . 19 TYR C 1 1 7 4933 1 1 19 TYR CA C -5.069 -4.128 0.018 1.00 . A A . 19 TYR CA 1 1 7 4934 1 1 19 TYR CB C -3.917 -3.362 0.671 1.00 . A A . 19 TYR CB 1 1 7 4935 1 1 19 TYR CD1 C -3.181 -5.028 2.417 1.00 . A A . 19 TYR CD1 1 1 7 4936 1 1 19 TYR CD2 C -1.702 -4.558 0.551 1.00 . A A . 19 TYR CD2 1 1 7 4937 1 1 19 TYR CE1 C -2.243 -5.934 2.931 1.00 . A A . 19 TYR CE1 1 1 7 4938 1 1 19 TYR CE2 C -0.764 -5.463 1.065 1.00 . A A . 19 TYR CE2 1 1 7 4939 1 1 19 TYR CG C -2.910 -4.340 1.227 1.00 . A A . 19 TYR CG 1 1 7 4940 1 1 19 TYR CZ C -1.035 -6.152 2.255 1.00 . A A . 19 TYR CZ 1 1 7 4941 1 1 19 TYR H H -4.109 -4.146 -1.909 1.00 . A A . 19 TYR H 1 1 7 4942 1 1 19 TYR HA H -5.379 -4.932 0.670 1.00 . A A . 19 TYR HA 1 1 7 4943 1 1 19 TYR HB2 H -3.441 -2.736 -0.066 1.00 . A A . 19 TYR HB2 1 1 7 4944 1 1 19 TYR HB3 H -4.301 -2.748 1.472 1.00 . A A . 19 TYR HB3 1 1 7 4945 1 1 19 TYR HD1 H -4.111 -4.861 2.938 1.00 . A A . 19 TYR HD1 1 1 7 4946 1 1 19 TYR HD2 H -1.493 -4.026 -0.365 1.00 . A A . 19 TYR HD2 1 1 7 4947 1 1 19 TYR HE1 H -2.451 -6.466 3.848 1.00 . A A . 19 TYR HE1 1 1 7 4948 1 1 19 TYR HE2 H 0.167 -5.631 0.543 1.00 . A A . 19 TYR HE2 1 1 7 4949 1 1 19 TYR HH H -0.455 -7.390 3.587 1.00 . A A . 19 TYR HH 1 1 7 4950 1 1 19 TYR N N -4.621 -4.696 -1.281 1.00 . A A . 19 TYR N 1 1 7 4951 1 1 19 TYR O O -6.613 -2.410 0.646 1.00 . A A . 19 TYR O 1 1 7 4952 1 1 19 TYR OH O -0.112 -7.044 2.760 1.00 . A A . 19 TYR OH 1 1 7 4953 1 1 20 CYS C C -9.305 -3.009 -1.148 1.00 . A A . 20 CYS C 1 1 7 4954 1 1 20 CYS CA C -8.020 -2.331 -1.625 1.00 . A A . 20 CYS CA 1 1 7 4955 1 1 20 CYS CB C -8.138 -2.015 -3.119 1.00 . A A . 20 CYS CB 1 1 7 4956 1 1 20 CYS H H -6.564 -3.868 -2.063 1.00 . A A . 20 CYS H 1 1 7 4957 1 1 20 CYS HA H -7.878 -1.412 -1.075 1.00 . A A . 20 CYS HA 1 1 7 4958 1 1 20 CYS HB2 H -8.734 -2.774 -3.602 1.00 . A A . 20 CYS HB2 1 1 7 4959 1 1 20 CYS HB3 H -8.616 -1.054 -3.243 1.00 . A A . 20 CYS HB3 1 1 7 4960 1 1 20 CYS N N -6.860 -3.237 -1.374 1.00 . A A . 20 CYS N 1 1 7 4961 1 1 20 CYS O O -9.346 -4.206 -0.936 1.00 . A A . 20 CYS O 1 1 7 4962 1 1 20 CYS SG S -6.494 -1.969 -3.871 1.00 . A A . 20 CYS SG 1 1 7 4963 1 1 21 ASN C C -12.157 -3.831 -1.567 1.00 . A A . 21 ASN C 1 1 7 4964 1 1 21 ASN CA C -11.637 -2.855 -0.509 1.00 . A A . 21 ASN CA 1 1 7 4965 1 1 21 ASN CB C -12.669 -1.747 -0.287 1.00 . A A . 21 ASN CB 1 1 7 4966 1 1 21 ASN CG C -14.035 -2.370 0.003 1.00 . A A . 21 ASN CG 1 1 7 4967 1 1 21 ASN H H -10.302 -1.292 -1.149 1.00 . A A . 21 ASN H 1 1 7 4968 1 1 21 ASN HA H -11.472 -3.384 0.419 1.00 . A A . 21 ASN HA 1 1 7 4969 1 1 21 ASN HB2 H -12.365 -1.136 0.551 1.00 . A A . 21 ASN HB2 1 1 7 4970 1 1 21 ASN HB3 H -12.736 -1.135 -1.174 1.00 . A A . 21 ASN HB3 1 1 7 4971 1 1 21 ASN HD21 H -13.456 -3.189 1.717 1.00 . A A . 21 ASN HD21 1 1 7 4972 1 1 21 ASN HD22 H -15.074 -3.471 1.288 1.00 . A A . 21 ASN HD22 1 1 7 4973 1 1 21 ASN N N -10.356 -2.255 -0.974 1.00 . A A . 21 ASN N 1 1 7 4974 1 1 21 ASN ND2 N -14.202 -3.068 1.093 1.00 . A A . 21 ASN ND2 1 1 7 4975 1 1 21 ASN O O -12.506 -3.375 -2.643 1.00 . A A . 21 ASN O 1 1 7 4976 1 1 21 ASN OXT O -12.197 -5.017 -1.282 1.00 . A A . 21 ASN OXT 1 1 7 4977 1 1 21 ASN OD1 O -14.961 -2.219 -0.769 1.00 . A A . 21 ASN OD1 1 1 7 4978 2 2 1 PHE C C 8.622 -0.998 -10.603 1.00 . B B . 1 PHE C 1 1 7 4979 2 2 1 PHE CA C 7.293 -1.217 -11.325 1.00 . B B . 1 PHE CA 1 1 7 4980 2 2 1 PHE CB C 6.332 -0.075 -10.988 1.00 . B B . 1 PHE CB 1 1 7 4981 2 2 1 PHE CD1 C 7.624 1.503 -12.471 1.00 . B B . 1 PHE CD1 1 1 7 4982 2 2 1 PHE CD2 C 5.209 1.406 -12.693 1.00 . B B . 1 PHE CD2 1 1 7 4983 2 2 1 PHE CE1 C 7.678 2.471 -13.483 1.00 . B B . 1 PHE CE1 1 1 7 4984 2 2 1 PHE CE2 C 5.263 2.374 -13.704 1.00 . B B . 1 PHE CE2 1 1 7 4985 2 2 1 PHE CG C 6.390 0.970 -12.076 1.00 . B B . 1 PHE CG 1 1 7 4986 2 2 1 PHE CZ C 6.497 2.906 -14.099 1.00 . B B . 1 PHE CZ 1 1 7 4987 2 2 1 PHE H1 H 6.556 -2.492 -9.854 1.00 . B B . 1 PHE H1 1 1 7 4988 2 2 1 PHE H2 H 7.348 -3.288 -11.129 1.00 . B B . 1 PHE H2 1 1 7 4989 2 2 1 PHE H3 H 5.788 -2.654 -11.357 1.00 . B B . 1 PHE H3 1 1 7 4990 2 2 1 PHE HA H 7.463 -1.243 -12.391 1.00 . B B . 1 PHE HA 1 1 7 4991 2 2 1 PHE HB2 H 5.327 -0.462 -10.912 1.00 . B B . 1 PHE HB2 1 1 7 4992 2 2 1 PHE HB3 H 6.618 0.370 -10.046 1.00 . B B . 1 PHE HB3 1 1 7 4993 2 2 1 PHE HD1 H 8.535 1.167 -11.995 1.00 . B B . 1 PHE HD1 1 1 7 4994 2 2 1 PHE HD2 H 4.258 0.996 -12.388 1.00 . B B . 1 PHE HD2 1 1 7 4995 2 2 1 PHE HE1 H 8.629 2.882 -13.787 1.00 . B B . 1 PHE HE1 1 1 7 4996 2 2 1 PHE HE2 H 4.353 2.710 -14.180 1.00 . B B . 1 PHE HE2 1 1 7 4997 2 2 1 PHE HZ H 6.538 3.652 -14.879 1.00 . B B . 1 PHE HZ 1 1 7 4998 2 2 1 PHE N N 6.701 -2.511 -10.883 1.00 . B B . 1 PHE N 1 1 7 4999 2 2 1 PHE O O 9.645 -0.774 -11.219 1.00 . B B . 1 PHE O 1 1 7 5000 2 2 2 VAL C C 9.890 -1.782 -7.318 1.00 . B B . 2 VAL C 1 1 7 5001 2 2 2 VAL CA C 9.880 -0.863 -8.541 1.00 . B B . 2 VAL CA 1 1 7 5002 2 2 2 VAL CB C 9.975 0.595 -8.085 1.00 . B B . 2 VAL CB 1 1 7 5003 2 2 2 VAL CG1 C 9.978 1.513 -9.308 1.00 . B B . 2 VAL CG1 1 1 7 5004 2 2 2 VAL CG2 C 8.774 0.931 -7.197 1.00 . B B . 2 VAL CG2 1 1 7 5005 2 2 2 VAL H H 7.780 -1.249 -8.823 1.00 . B B . 2 VAL H 1 1 7 5006 2 2 2 VAL HA H 10.722 -1.098 -9.175 1.00 . B B . 2 VAL HA 1 1 7 5007 2 2 2 VAL HB H 10.889 0.737 -7.528 1.00 . B B . 2 VAL HB 1 1 7 5008 2 2 2 VAL HG11 H 10.588 1.077 -10.085 1.00 . B B . 2 VAL HG11 1 1 7 5009 2 2 2 VAL HG12 H 10.380 2.477 -9.033 1.00 . B B . 2 VAL HG12 1 1 7 5010 2 2 2 VAL HG13 H 8.968 1.634 -9.670 1.00 . B B . 2 VAL HG13 1 1 7 5011 2 2 2 VAL HG21 H 7.881 0.496 -7.620 1.00 . B B . 2 VAL HG21 1 1 7 5012 2 2 2 VAL HG22 H 8.659 2.003 -7.138 1.00 . B B . 2 VAL HG22 1 1 7 5013 2 2 2 VAL HG23 H 8.936 0.531 -6.207 1.00 . B B . 2 VAL HG23 1 1 7 5014 2 2 2 VAL N N 8.616 -1.064 -9.301 1.00 . B B . 2 VAL N 1 1 7 5015 2 2 2 VAL O O 8.949 -2.509 -7.069 1.00 . B B . 2 VAL O 1 1 7 5016 2 2 3 ASN C C 11.511 -1.787 -4.167 1.00 . B B . 3 ASN C 1 1 7 5017 2 2 3 ASN CA C 11.022 -2.620 -5.349 1.00 . B B . 3 ASN CA 1 1 7 5018 2 2 3 ASN CB C 12.008 -3.758 -5.604 1.00 . B B . 3 ASN CB 1 1 7 5019 2 2 3 ASN CG C 11.359 -4.807 -6.507 1.00 . B B . 3 ASN CG 1 1 7 5020 2 2 3 ASN H H 11.694 -1.159 -6.773 1.00 . B B . 3 ASN H 1 1 7 5021 2 2 3 ASN HA H 10.046 -3.027 -5.130 1.00 . B B . 3 ASN HA 1 1 7 5022 2 2 3 ASN HB2 H 12.893 -3.366 -6.085 1.00 . B B . 3 ASN HB2 1 1 7 5023 2 2 3 ASN HB3 H 12.280 -4.211 -4.666 1.00 . B B . 3 ASN HB3 1 1 7 5024 2 2 3 ASN HD21 H 12.930 -6.020 -6.465 1.00 . B B . 3 ASN HD21 1 1 7 5025 2 2 3 ASN HD22 H 11.617 -6.567 -7.391 1.00 . B B . 3 ASN HD22 1 1 7 5026 2 2 3 ASN N N 10.947 -1.753 -6.555 1.00 . B B . 3 ASN N 1 1 7 5027 2 2 3 ASN ND2 N 12.024 -5.888 -6.813 1.00 . B B . 3 ASN ND2 1 1 7 5028 2 2 3 ASN O O 12.496 -2.110 -3.533 1.00 . B B . 3 ASN O 1 1 7 5029 2 2 3 ASN OD1 O 10.235 -4.643 -6.939 1.00 . B B . 3 ASN OD1 1 1 7 5030 2 2 4 GLN C C 10.285 0.041 -1.585 1.00 . B B . 4 GLN C 1 1 7 5031 2 2 4 GLN CA C 11.278 0.147 -2.741 1.00 . B B . 4 GLN CA 1 1 7 5032 2 2 4 GLN CB C 11.362 1.597 -3.215 1.00 . B B . 4 GLN CB 1 1 7 5033 2 2 4 GLN CD C 12.829 3.616 -3.250 1.00 . B B . 4 GLN CD 1 1 7 5034 2 2 4 GLN CG C 12.567 2.274 -2.565 1.00 . B B . 4 GLN CG 1 1 7 5035 2 2 4 GLN H H 10.054 -0.462 -4.400 1.00 . B B . 4 GLN H 1 1 7 5036 2 2 4 GLN HA H 12.251 -0.177 -2.404 1.00 . B B . 4 GLN HA 1 1 7 5037 2 2 4 GLN HB2 H 11.470 1.618 -4.291 1.00 . B B . 4 GLN HB2 1 1 7 5038 2 2 4 GLN HB3 H 10.462 2.121 -2.934 1.00 . B B . 4 GLN HB3 1 1 7 5039 2 2 4 GLN HE21 H 14.592 3.878 -2.375 1.00 . B B . 4 GLN HE21 1 1 7 5040 2 2 4 GLN HE22 H 14.114 5.117 -3.432 1.00 . B B . 4 GLN HE22 1 1 7 5041 2 2 4 GLN HG2 H 12.365 2.436 -1.518 1.00 . B B . 4 GLN HG2 1 1 7 5042 2 2 4 GLN HG3 H 13.435 1.640 -2.672 1.00 . B B . 4 GLN HG3 1 1 7 5043 2 2 4 GLN N N 10.840 -0.711 -3.872 1.00 . B B . 4 GLN N 1 1 7 5044 2 2 4 GLN NE2 N 13.937 4.257 -2.998 1.00 . B B . 4 GLN NE2 1 1 7 5045 2 2 4 GLN O O 9.267 -0.618 -1.681 1.00 . B B . 4 GLN O 1 1 7 5046 2 2 4 GLN OE1 O 12.017 4.085 -4.023 1.00 . B B . 4 GLN OE1 1 1 7 5047 2 2 5 HIS C C 8.522 1.614 0.504 1.00 . B B . 5 HIS C 1 1 7 5048 2 2 5 HIS CA C 9.667 0.616 0.687 1.00 . B B . 5 HIS CA 1 1 7 5049 2 2 5 HIS CB C 10.434 0.958 1.971 1.00 . B B . 5 HIS CB 1 1 7 5050 2 2 5 HIS CD2 C 12.636 -0.447 2.147 1.00 . B B . 5 HIS CD2 1 1 7 5051 2 2 5 HIS CE1 C 13.971 0.985 1.205 1.00 . B B . 5 HIS CE1 1 1 7 5052 2 2 5 HIS CG C 11.899 0.651 1.797 1.00 . B B . 5 HIS CG 1 1 7 5053 2 2 5 HIS H H 11.411 1.199 -0.432 1.00 . B B . 5 HIS H 1 1 7 5054 2 2 5 HIS HA H 9.261 -0.382 0.769 1.00 . B B . 5 HIS HA 1 1 7 5055 2 2 5 HIS HB2 H 10.313 2.008 2.191 1.00 . B B . 5 HIS HB2 1 1 7 5056 2 2 5 HIS HB3 H 10.041 0.373 2.789 1.00 . B B . 5 HIS HB3 1 1 7 5057 2 2 5 HIS HD2 H 12.256 -1.330 2.638 1.00 . B B . 5 HIS HD2 1 1 7 5058 2 2 5 HIS HE1 H 14.860 1.450 0.804 1.00 . B B . 5 HIS HE1 1 1 7 5059 2 2 5 HIS HE2 H 14.702 -0.852 1.892 1.00 . B B . 5 HIS HE2 1 1 7 5060 2 2 5 HIS N N 10.581 0.680 -0.486 1.00 . B B . 5 HIS N 1 1 7 5061 2 2 5 HIS ND1 N 12.756 1.551 1.202 1.00 . B B . 5 HIS ND1 1 1 7 5062 2 2 5 HIS NE2 N 13.947 -0.239 1.773 1.00 . B B . 5 HIS NE2 1 1 7 5063 2 2 5 HIS O O 8.384 2.240 -0.529 1.00 . B B . 5 HIS O 1 1 7 5064 2 2 6 LEU C C 6.353 3.437 2.730 1.00 . B B . 6 LEU C 1 1 7 5065 2 2 6 LEU CA C 6.545 2.703 1.404 1.00 . B B . 6 LEU CA 1 1 7 5066 2 2 6 LEU CB C 5.266 1.903 1.104 1.00 . B B . 6 LEU CB 1 1 7 5067 2 2 6 LEU CD1 C 5.375 3.083 -1.116 1.00 . B B . 6 LEU CD1 1 1 7 5068 2 2 6 LEU CD2 C 3.583 1.433 -0.681 1.00 . B B . 6 LEU CD2 1 1 7 5069 2 2 6 LEU CG C 4.446 2.519 -0.046 1.00 . B B . 6 LEU CG 1 1 7 5070 2 2 6 LEU H H 7.829 1.235 2.310 1.00 . B B . 6 LEU H 1 1 7 5071 2 2 6 LEU HA H 6.744 3.414 0.627 1.00 . B B . 6 LEU HA 1 1 7 5072 2 2 6 LEU HB2 H 5.544 0.899 0.843 1.00 . B B . 6 LEU HB2 1 1 7 5073 2 2 6 LEU HB3 H 4.656 1.874 1.995 1.00 . B B . 6 LEU HB3 1 1 7 5074 2 2 6 LEU HD11 H 6.238 2.441 -1.212 1.00 . B B . 6 LEU HD11 1 1 7 5075 2 2 6 LEU HD12 H 5.691 4.073 -0.829 1.00 . B B . 6 LEU HD12 1 1 7 5076 2 2 6 LEU HD13 H 4.851 3.128 -2.059 1.00 . B B . 6 LEU HD13 1 1 7 5077 2 2 6 LEU HD21 H 3.530 0.582 -0.020 1.00 . B B . 6 LEU HD21 1 1 7 5078 2 2 6 LEU HD22 H 4.022 1.134 -1.621 1.00 . B B . 6 LEU HD22 1 1 7 5079 2 2 6 LEU HD23 H 2.590 1.820 -0.854 1.00 . B B . 6 LEU HD23 1 1 7 5080 2 2 6 LEU HG H 3.797 3.303 0.336 1.00 . B B . 6 LEU HG 1 1 7 5081 2 2 6 LEU N N 7.696 1.757 1.502 1.00 . B B . 6 LEU N 1 1 7 5082 2 2 6 LEU O O 6.934 3.088 3.731 1.00 . B B . 6 LEU O 1 1 7 5083 2 2 7 CYS C C 4.663 6.571 3.658 1.00 . B B . 7 CYS C 1 1 7 5084 2 2 7 CYS CA C 5.251 5.197 3.998 1.00 . B B . 7 CYS CA 1 1 7 5085 2 2 7 CYS CB C 6.551 5.380 4.793 1.00 . B B . 7 CYS CB 1 1 7 5086 2 2 7 CYS H H 5.046 4.686 1.917 1.00 . B B . 7 CYS H 1 1 7 5087 2 2 7 CYS HA H 4.541 4.647 4.599 1.00 . B B . 7 CYS HA 1 1 7 5088 2 2 7 CYS HB2 H 7.383 4.984 4.233 1.00 . B B . 7 CYS HB2 1 1 7 5089 2 2 7 CYS HB3 H 6.713 6.429 4.974 1.00 . B B . 7 CYS HB3 1 1 7 5090 2 2 7 CYS N N 5.515 4.440 2.740 1.00 . B B . 7 CYS N 1 1 7 5091 2 2 7 CYS O O 5.132 7.260 2.772 1.00 . B B . 7 CYS O 1 1 7 5092 2 2 7 CYS SG S 6.410 4.512 6.379 1.00 . B B . 7 CYS SG 1 1 7 5093 2 2 8 GLY C C 2.280 8.296 2.757 1.00 . B B . 8 GLY C 1 1 7 5094 2 2 8 GLY CA C 3.021 8.305 4.099 1.00 . B B . 8 GLY CA 1 1 7 5095 2 2 8 GLY H H 3.283 6.401 5.074 1.00 . B B . 8 GLY H 1 1 7 5096 2 2 8 GLY HA2 H 2.323 8.536 4.891 1.00 . B B . 8 GLY HA2 1 1 7 5097 2 2 8 GLY HA3 H 3.793 9.059 4.073 1.00 . B B . 8 GLY HA3 1 1 7 5098 2 2 8 GLY N N 3.641 6.974 4.363 1.00 . B B . 8 GLY N 1 1 7 5099 2 2 8 GLY O O 1.733 7.293 2.336 1.00 . B B . 8 GLY O 1 1 7 5100 2 2 9 SER C C 2.041 8.389 -0.143 1.00 . B B . 9 SER C 1 1 7 5101 2 2 9 SER CA C 1.544 9.496 0.779 1.00 . B B . 9 SER CA 1 1 7 5102 2 2 9 SER CB C 1.813 10.854 0.132 1.00 . B B . 9 SER CB 1 1 7 5103 2 2 9 SER H H 2.696 10.213 2.451 1.00 . B B . 9 SER H 1 1 7 5104 2 2 9 SER HA H 0.487 9.377 0.939 1.00 . B B . 9 SER HA 1 1 7 5105 2 2 9 SER HB2 H 2.568 11.379 0.693 1.00 . B B . 9 SER HB2 1 1 7 5106 2 2 9 SER HB3 H 2.160 10.705 -0.883 1.00 . B B . 9 SER HB3 1 1 7 5107 2 2 9 SER HG H 0.258 11.611 1.021 1.00 . B B . 9 SER HG 1 1 7 5108 2 2 9 SER N N 2.253 9.418 2.088 1.00 . B B . 9 SER N 1 1 7 5109 2 2 9 SER O O 1.352 7.966 -1.049 1.00 . B B . 9 SER O 1 1 7 5110 2 2 9 SER OG O 0.615 11.618 0.130 1.00 . B B . 9 SER OG 1 1 7 5111 2 2 10 ASP C C 2.860 5.596 -0.639 1.00 . B B . 10 ASP C 1 1 7 5112 2 2 10 ASP CA C 3.755 6.826 -0.788 1.00 . B B . 10 ASP CA 1 1 7 5113 2 2 10 ASP CB C 5.186 6.494 -0.365 1.00 . B B . 10 ASP CB 1 1 7 5114 2 2 10 ASP CG C 5.975 7.793 -0.185 1.00 . B B . 10 ASP CG 1 1 7 5115 2 2 10 ASP H H 3.766 8.262 0.817 1.00 . B B . 10 ASP H 1 1 7 5116 2 2 10 ASP HA H 3.749 7.149 -1.818 1.00 . B B . 10 ASP HA 1 1 7 5117 2 2 10 ASP HB2 H 5.168 5.950 0.567 1.00 . B B . 10 ASP HB2 1 1 7 5118 2 2 10 ASP HB3 H 5.658 5.893 -1.127 1.00 . B B . 10 ASP HB3 1 1 7 5119 2 2 10 ASP N N 3.227 7.911 0.079 1.00 . B B . 10 ASP N 1 1 7 5120 2 2 10 ASP O O 2.608 4.876 -1.587 1.00 . B B . 10 ASP O 1 1 7 5121 2 2 10 ASP OD1 O 5.515 8.813 -0.670 1.00 . B B . 10 ASP OD1 1 1 7 5122 2 2 10 ASP OD2 O 7.025 7.744 0.434 1.00 . B B . 10 ASP OD2 1 1 7 5123 2 2 11 LEU C C 0.081 4.476 0.229 1.00 . B B . 11 LEU C 1 1 7 5124 2 2 11 LEU CA C 1.482 4.180 0.767 1.00 . B B . 11 LEU CA 1 1 7 5125 2 2 11 LEU CB C 1.410 3.878 2.268 1.00 . B B . 11 LEU CB 1 1 7 5126 2 2 11 LEU CD1 C 1.846 1.500 1.581 1.00 . B B . 11 LEU CD1 1 1 7 5127 2 2 11 LEU CD2 C 1.346 2.042 3.954 1.00 . B B . 11 LEU CD2 1 1 7 5128 2 2 11 LEU CG C 1.035 2.409 2.505 1.00 . B B . 11 LEU CG 1 1 7 5129 2 2 11 LEU H H 2.578 5.958 1.293 1.00 . B B . 11 LEU H 1 1 7 5130 2 2 11 LEU HA H 1.886 3.329 0.244 1.00 . B B . 11 LEU HA 1 1 7 5131 2 2 11 LEU HB2 H 2.371 4.079 2.719 1.00 . B B . 11 LEU HB2 1 1 7 5132 2 2 11 LEU HB3 H 0.663 4.513 2.723 1.00 . B B . 11 LEU HB3 1 1 7 5133 2 2 11 LEU HD11 H 1.399 1.493 0.598 1.00 . B B . 11 LEU HD11 1 1 7 5134 2 2 11 LEU HD12 H 1.854 0.496 1.979 1.00 . B B . 11 LEU HD12 1 1 7 5135 2 2 11 LEU HD13 H 2.858 1.867 1.514 1.00 . B B . 11 LEU HD13 1 1 7 5136 2 2 11 LEU HD21 H 0.455 1.660 4.427 1.00 . B B . 11 LEU HD21 1 1 7 5137 2 2 11 LEU HD22 H 1.689 2.920 4.482 1.00 . B B . 11 LEU HD22 1 1 7 5138 2 2 11 LEU HD23 H 2.118 1.286 3.974 1.00 . B B . 11 LEU HD23 1 1 7 5139 2 2 11 LEU HG H -0.018 2.271 2.315 1.00 . B B . 11 LEU HG 1 1 7 5140 2 2 11 LEU N N 2.368 5.358 0.546 1.00 . B B . 11 LEU N 1 1 7 5141 2 2 11 LEU O O -0.650 3.577 -0.133 1.00 . B B . 11 LEU O 1 1 7 5142 2 2 12 VAL C C -1.550 6.359 -1.861 1.00 . B B . 12 VAL C 1 1 7 5143 2 2 12 VAL CA C -1.663 6.035 -0.371 1.00 . B B . 12 VAL CA 1 1 7 5144 2 2 12 VAL CB C -2.274 7.219 0.400 1.00 . B B . 12 VAL CB 1 1 7 5145 2 2 12 VAL CG1 C -1.690 7.254 1.809 1.00 . B B . 12 VAL CG1 1 1 7 5146 2 2 12 VAL CG2 C -1.965 8.548 -0.302 1.00 . B B . 12 VAL CG2 1 1 7 5147 2 2 12 VAL H H 0.294 6.442 0.448 1.00 . B B . 12 VAL H 1 1 7 5148 2 2 12 VAL HA H -2.296 5.167 -0.249 1.00 . B B . 12 VAL HA 1 1 7 5149 2 2 12 VAL HB H -3.345 7.086 0.464 1.00 . B B . 12 VAL HB 1 1 7 5150 2 2 12 VAL HG11 H -2.389 7.735 2.476 1.00 . B B . 12 VAL HG11 1 1 7 5151 2 2 12 VAL HG12 H -0.762 7.805 1.797 1.00 . B B . 12 VAL HG12 1 1 7 5152 2 2 12 VAL HG13 H -1.506 6.245 2.144 1.00 . B B . 12 VAL HG13 1 1 7 5153 2 2 12 VAL HG21 H -2.444 9.357 0.232 1.00 . B B . 12 VAL HG21 1 1 7 5154 2 2 12 VAL HG22 H -2.341 8.514 -1.315 1.00 . B B . 12 VAL HG22 1 1 7 5155 2 2 12 VAL HG23 H -0.898 8.708 -0.319 1.00 . B B . 12 VAL HG23 1 1 7 5156 2 2 12 VAL N N -0.304 5.721 0.160 1.00 . B B . 12 VAL N 1 1 7 5157 2 2 12 VAL O O -2.301 5.862 -2.674 1.00 . B B . 12 VAL O 1 1 7 5158 2 2 13 GLU C C -0.390 6.232 -4.472 1.00 . B B . 13 GLU C 1 1 7 5159 2 2 13 GLU CA C -0.446 7.528 -3.660 1.00 . B B . 13 GLU CA 1 1 7 5160 2 2 13 GLU CB C 0.844 8.332 -3.847 1.00 . B B . 13 GLU CB 1 1 7 5161 2 2 13 GLU CD C 3.339 8.226 -3.852 1.00 . B B . 13 GLU CD 1 1 7 5162 2 2 13 GLU CG C 2.055 7.398 -3.797 1.00 . B B . 13 GLU CG 1 1 7 5163 2 2 13 GLU H H -0.008 7.570 -1.555 1.00 . B B . 13 GLU H 1 1 7 5164 2 2 13 GLU HA H -1.290 8.119 -3.985 1.00 . B B . 13 GLU HA 1 1 7 5165 2 2 13 GLU HB2 H 0.817 8.838 -4.800 1.00 . B B . 13 GLU HB2 1 1 7 5166 2 2 13 GLU HB3 H 0.926 9.064 -3.055 1.00 . B B . 13 GLU HB3 1 1 7 5167 2 2 13 GLU HG2 H 2.031 6.826 -2.880 1.00 . B B . 13 GLU HG2 1 1 7 5168 2 2 13 GLU HG3 H 2.026 6.726 -4.641 1.00 . B B . 13 GLU HG3 1 1 7 5169 2 2 13 GLU N N -0.609 7.183 -2.225 1.00 . B B . 13 GLU N 1 1 7 5170 2 2 13 GLU O O -0.890 6.158 -5.578 1.00 . B B . 13 GLU O 1 1 7 5171 2 2 13 GLU OE1 O 3.566 8.994 -2.931 1.00 . B B . 13 GLU OE1 1 1 7 5172 2 2 13 GLU OE2 O 4.076 8.078 -4.813 1.00 . B B . 13 GLU OE2 1 1 7 5173 2 2 14 ALA C C -1.102 3.212 -4.464 1.00 . B B . 14 ALA C 1 1 7 5174 2 2 14 ALA CA C 0.243 3.905 -4.647 1.00 . B B . 14 ALA CA 1 1 7 5175 2 2 14 ALA CB C 1.360 3.028 -4.075 1.00 . B B . 14 ALA CB 1 1 7 5176 2 2 14 ALA H H 0.561 5.268 -3.016 1.00 . B B . 14 ALA H 1 1 7 5177 2 2 14 ALA HA H 0.420 4.086 -5.698 1.00 . B B . 14 ALA HA 1 1 7 5178 2 2 14 ALA HB1 H 2.317 3.485 -4.280 1.00 . B B . 14 ALA HB1 1 1 7 5179 2 2 14 ALA HB2 H 1.321 2.051 -4.535 1.00 . B B . 14 ALA HB2 1 1 7 5180 2 2 14 ALA HB3 H 1.229 2.929 -3.008 1.00 . B B . 14 ALA HB3 1 1 7 5181 2 2 14 ALA N N 0.188 5.199 -3.918 1.00 . B B . 14 ALA N 1 1 7 5182 2 2 14 ALA O O -1.709 2.743 -5.406 1.00 . B B . 14 ALA O 1 1 7 5183 2 2 15 LEU C C -3.960 3.239 -3.833 1.00 . B B . 15 LEU C 1 1 7 5184 2 2 15 LEU CA C -2.895 2.528 -2.996 1.00 . B B . 15 LEU CA 1 1 7 5185 2 2 15 LEU CB C -3.216 2.660 -1.507 1.00 . B B . 15 LEU CB 1 1 7 5186 2 2 15 LEU CD1 C -2.867 1.620 0.745 1.00 . B B . 15 LEU CD1 1 1 7 5187 2 2 15 LEU CD2 C -2.764 0.159 -1.287 1.00 . B B . 15 LEU CD2 1 1 7 5188 2 2 15 LEU CG C -2.463 1.564 -0.725 1.00 . B B . 15 LEU CG 1 1 7 5189 2 2 15 LEU H H -1.081 3.562 -2.507 1.00 . B B . 15 LEU H 1 1 7 5190 2 2 15 LEU HA H -2.848 1.491 -3.270 1.00 . B B . 15 LEU HA 1 1 7 5191 2 2 15 LEU HB2 H -2.880 3.632 -1.166 1.00 . B B . 15 LEU HB2 1 1 7 5192 2 2 15 LEU HB3 H -4.286 2.581 -1.345 1.00 . B B . 15 LEU HB3 1 1 7 5193 2 2 15 LEU HD11 H -2.500 0.740 1.251 1.00 . B B . 15 LEU HD11 1 1 7 5194 2 2 15 LEU HD12 H -3.943 1.659 0.821 1.00 . B B . 15 LEU HD12 1 1 7 5195 2 2 15 LEU HD13 H -2.440 2.502 1.199 1.00 . B B . 15 LEU HD13 1 1 7 5196 2 2 15 LEU HD21 H -2.343 0.064 -2.277 1.00 . B B . 15 LEU HD21 1 1 7 5197 2 2 15 LEU HD22 H -3.829 0.001 -1.333 1.00 . B B . 15 LEU HD22 1 1 7 5198 2 2 15 LEU HD23 H -2.318 -0.590 -0.642 1.00 . B B . 15 LEU HD23 1 1 7 5199 2 2 15 LEU HG H -1.401 1.752 -0.799 1.00 . B B . 15 LEU HG 1 1 7 5200 2 2 15 LEU N N -1.582 3.165 -3.252 1.00 . B B . 15 LEU N 1 1 7 5201 2 2 15 LEU O O -4.739 2.619 -4.532 1.00 . B B . 15 LEU O 1 1 7 5202 2 2 16 TYR C C -4.859 4.910 -6.055 1.00 . B B . 16 TYR C 1 1 7 5203 2 2 16 TYR CA C -4.997 5.290 -4.578 1.00 . B B . 16 TYR CA 1 1 7 5204 2 2 16 TYR CB C -4.748 6.793 -4.430 1.00 . B B . 16 TYR CB 1 1 7 5205 2 2 16 TYR CD1 C -7.255 7.061 -4.455 1.00 . B B . 16 TYR CD1 1 1 7 5206 2 2 16 TYR CD2 C -5.938 8.525 -3.036 1.00 . B B . 16 TYR CD2 1 1 7 5207 2 2 16 TYR CE1 C -8.427 7.697 -4.023 1.00 . B B . 16 TYR CE1 1 1 7 5208 2 2 16 TYR CE2 C -7.110 9.161 -2.604 1.00 . B B . 16 TYR CE2 1 1 7 5209 2 2 16 TYR CG C -6.011 7.475 -3.960 1.00 . B B . 16 TYR CG 1 1 7 5210 2 2 16 TYR CZ C -8.354 8.748 -3.098 1.00 . B B . 16 TYR CZ 1 1 7 5211 2 2 16 TYR H H -3.353 5.025 -3.211 1.00 . B B . 16 TYR H 1 1 7 5212 2 2 16 TYR HA H -5.991 5.051 -4.232 1.00 . B B . 16 TYR HA 1 1 7 5213 2 2 16 TYR HB2 H -3.956 6.961 -3.716 1.00 . B B . 16 TYR HB2 1 1 7 5214 2 2 16 TYR HB3 H -4.458 7.203 -5.384 1.00 . B B . 16 TYR HB3 1 1 7 5215 2 2 16 TYR HD1 H -7.310 6.252 -5.168 1.00 . B B . 16 TYR HD1 1 1 7 5216 2 2 16 TYR HD2 H -4.980 8.844 -2.655 1.00 . B B . 16 TYR HD2 1 1 7 5217 2 2 16 TYR HE1 H -9.386 7.378 -4.403 1.00 . B B . 16 TYR HE1 1 1 7 5218 2 2 16 TYR HE2 H -7.053 9.971 -1.891 1.00 . B B . 16 TYR HE2 1 1 7 5219 2 2 16 TYR HH H -9.764 8.993 -1.833 1.00 . B B . 16 TYR HH 1 1 7 5220 2 2 16 TYR N N -3.994 4.540 -3.777 1.00 . B B . 16 TYR N 1 1 7 5221 2 2 16 TYR O O -5.812 4.956 -6.807 1.00 . B B . 16 TYR O 1 1 7 5222 2 2 16 TYR OH O -9.508 9.376 -2.675 1.00 . B B . 16 TYR OH 1 1 7 5223 2 2 17 LEU C C -3.582 2.702 -8.155 1.00 . B B . 17 LEU C 1 1 7 5224 2 2 17 LEU CA C -3.486 4.213 -7.924 1.00 . B B . 17 LEU CA 1 1 7 5225 2 2 17 LEU CB C -2.110 4.709 -8.383 1.00 . B B . 17 LEU CB 1 1 7 5226 2 2 17 LEU CD1 C -3.276 4.935 -10.601 1.00 . B B . 17 LEU CD1 1 1 7 5227 2 2 17 LEU CD2 C -0.851 5.491 -10.391 1.00 . B B . 17 LEU CD2 1 1 7 5228 2 2 17 LEU CG C -1.963 4.560 -9.905 1.00 . B B . 17 LEU CG 1 1 7 5229 2 2 17 LEU H H -2.912 4.545 -5.871 1.00 . B B . 17 LEU H 1 1 7 5230 2 2 17 LEU HA H -4.249 4.704 -8.500 1.00 . B B . 17 LEU HA 1 1 7 5231 2 2 17 LEU HB2 H -1.998 5.749 -8.114 1.00 . B B . 17 LEU HB2 1 1 7 5232 2 2 17 LEU HB3 H -1.342 4.129 -7.894 1.00 . B B . 17 LEU HB3 1 1 7 5233 2 2 17 LEU HD11 H -3.123 4.962 -11.670 1.00 . B B . 17 LEU HD11 1 1 7 5234 2 2 17 LEU HD12 H -3.599 5.908 -10.260 1.00 . B B . 17 LEU HD12 1 1 7 5235 2 2 17 LEU HD13 H -4.031 4.201 -10.363 1.00 . B B . 17 LEU HD13 1 1 7 5236 2 2 17 LEU HD21 H -1.148 6.518 -10.237 1.00 . B B . 17 LEU HD21 1 1 7 5237 2 2 17 LEU HD22 H -0.671 5.322 -11.442 1.00 . B B . 17 LEU HD22 1 1 7 5238 2 2 17 LEU HD23 H 0.054 5.292 -9.835 1.00 . B B . 17 LEU HD23 1 1 7 5239 2 2 17 LEU HG H -1.706 3.537 -10.145 1.00 . B B . 17 LEU HG 1 1 7 5240 2 2 17 LEU N N -3.676 4.559 -6.485 1.00 . B B . 17 LEU N 1 1 7 5241 2 2 17 LEU O O -3.964 2.262 -9.220 1.00 . B B . 17 LEU O 1 1 7 5242 2 2 18 VAL C C -4.747 0.038 -7.732 1.00 . B B . 18 VAL C 1 1 7 5243 2 2 18 VAL CA C -3.313 0.424 -7.412 1.00 . B B . 18 VAL CA 1 1 7 5244 2 2 18 VAL CB C -2.848 -0.351 -6.175 1.00 . B B . 18 VAL CB 1 1 7 5245 2 2 18 VAL CG1 C -1.517 0.200 -5.707 1.00 . B B . 18 VAL CG1 1 1 7 5246 2 2 18 VAL CG2 C -3.865 -0.218 -5.045 1.00 . B B . 18 VAL CG2 1 1 7 5247 2 2 18 VAL H H -2.923 2.263 -6.337 1.00 . B B . 18 VAL H 1 1 7 5248 2 2 18 VAL HA H -2.685 0.162 -8.247 1.00 . B B . 18 VAL HA 1 1 7 5249 2 2 18 VAL HB H -2.731 -1.394 -6.433 1.00 . B B . 18 VAL HB 1 1 7 5250 2 2 18 VAL HG11 H -1.635 0.623 -4.722 1.00 . B B . 18 VAL HG11 1 1 7 5251 2 2 18 VAL HG12 H -1.187 0.962 -6.394 1.00 . B B . 18 VAL HG12 1 1 7 5252 2 2 18 VAL HG13 H -0.795 -0.599 -5.674 1.00 . B B . 18 VAL HG13 1 1 7 5253 2 2 18 VAL HG21 H -4.849 -0.456 -5.412 1.00 . B B . 18 VAL HG21 1 1 7 5254 2 2 18 VAL HG22 H -3.850 0.787 -4.667 1.00 . B B . 18 VAL HG22 1 1 7 5255 2 2 18 VAL HG23 H -3.604 -0.901 -4.252 1.00 . B B . 18 VAL HG23 1 1 7 5256 2 2 18 VAL N N -3.235 1.900 -7.189 1.00 . B B . 18 VAL N 1 1 7 5257 2 2 18 VAL O O -4.999 -0.826 -8.549 1.00 . B B . 18 VAL O 1 1 7 5258 2 2 19 CYS C C -7.917 1.546 -7.740 1.00 . B B . 19 CYS C 1 1 7 5259 2 2 19 CYS CA C -7.106 0.299 -7.366 1.00 . B B . 19 CYS CA 1 1 7 5260 2 2 19 CYS CB C -7.699 -0.357 -6.125 1.00 . B B . 19 CYS CB 1 1 7 5261 2 2 19 CYS H H -5.476 1.344 -6.427 1.00 . B B . 19 CYS H 1 1 7 5262 2 2 19 CYS HA H -7.132 -0.403 -8.184 1.00 . B B . 19 CYS HA 1 1 7 5263 2 2 19 CYS HB2 H -7.544 0.283 -5.269 1.00 . B B . 19 CYS HB2 1 1 7 5264 2 2 19 CYS HB3 H -8.753 -0.516 -6.271 1.00 . B B . 19 CYS HB3 1 1 7 5265 2 2 19 CYS N N -5.694 0.658 -7.091 1.00 . B B . 19 CYS N 1 1 7 5266 2 2 19 CYS O O -8.730 1.514 -8.642 1.00 . B B . 19 CYS O 1 1 7 5267 2 2 19 CYS SG S -6.877 -1.946 -5.852 1.00 . B B . 19 CYS SG 1 1 7 5268 2 2 20 GLY C C -9.630 4.064 -6.420 1.00 . B B . 20 GLY C 1 1 7 5269 2 2 20 GLY CA C -8.472 3.877 -7.403 1.00 . B B . 20 GLY CA 1 1 7 5270 2 2 20 GLY H H -7.043 2.659 -6.343 1.00 . B B . 20 GLY H 1 1 7 5271 2 2 20 GLY HA2 H -7.815 4.732 -7.350 1.00 . B B . 20 GLY HA2 1 1 7 5272 2 2 20 GLY HA3 H -8.867 3.791 -8.404 1.00 . B B . 20 GLY HA3 1 1 7 5273 2 2 20 GLY N N -7.706 2.643 -7.065 1.00 . B B . 20 GLY N 1 1 7 5274 2 2 20 GLY O O -9.458 3.999 -5.219 1.00 . B B . 20 GLY O 1 1 7 5275 2 2 21 GLU C C -12.252 3.290 -5.182 1.00 . B B . 21 GLU C 1 1 7 5276 2 2 21 GLU CA C -11.984 4.532 -6.043 1.00 . B B . 21 GLU CA 1 1 7 5277 2 2 21 GLU CB C -13.205 4.849 -6.920 1.00 . B B . 21 GLU CB 1 1 7 5278 2 2 21 GLU CD C -14.991 3.884 -8.385 1.00 . B B . 21 GLU CD 1 1 7 5279 2 2 21 GLU CG C -13.917 3.558 -7.345 1.00 . B B . 21 GLU CG 1 1 7 5280 2 2 21 GLU H H -10.918 4.377 -7.897 1.00 . B B . 21 GLU H 1 1 7 5281 2 2 21 GLU HA H -11.787 5.373 -5.396 1.00 . B B . 21 GLU HA 1 1 7 5282 2 2 21 GLU HB2 H -13.886 5.469 -6.366 1.00 . B B . 21 GLU HB2 1 1 7 5283 2 2 21 GLU HB3 H -12.879 5.381 -7.803 1.00 . B B . 21 GLU HB3 1 1 7 5284 2 2 21 GLU HG2 H -13.198 2.874 -7.771 1.00 . B B . 21 GLU HG2 1 1 7 5285 2 2 21 GLU HG3 H -14.381 3.102 -6.482 1.00 . B B . 21 GLU HG3 1 1 7 5286 2 2 21 GLU N N -10.807 4.315 -6.927 1.00 . B B . 21 GLU N 1 1 7 5287 2 2 21 GLU O O -13.036 3.332 -4.255 1.00 . B B . 21 GLU O 1 1 7 5288 2 2 21 GLU OE1 O -14.930 4.961 -8.954 1.00 . B B . 21 GLU OE1 1 1 7 5289 2 2 21 GLU OE2 O -15.858 3.051 -8.593 1.00 . B B . 21 GLU OE2 1 1 7 5290 2 2 22 ARG C C -11.615 1.280 -3.184 1.00 . B B . 22 ARG C 1 1 7 5291 2 2 22 ARG CA C -11.860 0.963 -4.660 1.00 . B B . 22 ARG CA 1 1 7 5292 2 2 22 ARG CB C -10.917 -0.154 -5.110 1.00 . B B . 22 ARG CB 1 1 7 5293 2 2 22 ARG CD C -12.787 -1.366 -6.250 1.00 . B B . 22 ARG CD 1 1 7 5294 2 2 22 ARG CG C -11.691 -1.473 -5.186 1.00 . B B . 22 ARG CG 1 1 7 5295 2 2 22 ARG CZ C -14.217 -3.129 -7.108 1.00 . B B . 22 ARG CZ 1 1 7 5296 2 2 22 ARG H H -10.989 2.162 -6.225 1.00 . B B . 22 ARG H 1 1 7 5297 2 2 22 ARG HA H -12.884 0.643 -4.791 1.00 . B B . 22 ARG HA 1 1 7 5298 2 2 22 ARG HB2 H -10.515 0.086 -6.084 1.00 . B B . 22 ARG HB2 1 1 7 5299 2 2 22 ARG HB3 H -10.110 -0.253 -4.400 1.00 . B B . 22 ARG HB3 1 1 7 5300 2 2 22 ARG HD2 H -13.705 -1.034 -5.788 1.00 . B B . 22 ARG HD2 1 1 7 5301 2 2 22 ARG HD3 H -12.488 -0.654 -7.005 1.00 . B B . 22 ARG HD3 1 1 7 5302 2 2 22 ARG HE H -12.236 -3.256 -7.128 1.00 . B B . 22 ARG HE 1 1 7 5303 2 2 22 ARG HG2 H -11.013 -2.273 -5.444 1.00 . B B . 22 ARG HG2 1 1 7 5304 2 2 22 ARG HG3 H -12.143 -1.680 -4.227 1.00 . B B . 22 ARG HG3 1 1 7 5305 2 2 22 ARG HH11 H -14.653 -3.387 -5.171 1.00 . B B . 22 ARG HH11 1 1 7 5306 2 2 22 ARG HH12 H -15.919 -3.788 -6.284 1.00 . B B . 22 ARG HH12 1 1 7 5307 2 2 22 ARG HH21 H -14.068 -2.977 -9.100 1.00 . B B . 22 ARG HH21 1 1 7 5308 2 2 22 ARG HH22 H -15.589 -3.553 -8.504 1.00 . B B . 22 ARG HH22 1 1 7 5309 2 2 22 ARG N N -11.618 2.187 -5.475 1.00 . B B . 22 ARG N 1 1 7 5310 2 2 22 ARG NE N -13.004 -2.699 -6.882 1.00 . B B . 22 ARG NE 1 1 7 5311 2 2 22 ARG NH1 N -14.990 -3.459 -6.110 1.00 . B B . 22 ARG NH1 1 1 7 5312 2 2 22 ARG NH2 N -14.660 -3.227 -8.333 1.00 . B B . 22 ARG NH2 1 1 7 5313 2 2 22 ARG O O -12.071 0.577 -2.304 1.00 . B B . 22 ARG O 1 1 7 5314 2 2 23 GLY C C -9.613 1.733 -0.891 1.00 . B B . 23 GLY C 1 1 7 5315 2 2 23 GLY CA C -10.636 2.701 -1.484 1.00 . B B . 23 GLY CA 1 1 7 5316 2 2 23 GLY H H -10.548 2.894 -3.627 1.00 . B B . 23 GLY H 1 1 7 5317 2 2 23 GLY HA2 H -10.248 3.709 -1.438 1.00 . B B . 23 GLY HA2 1 1 7 5318 2 2 23 GLY HA3 H -11.553 2.643 -0.918 1.00 . B B . 23 GLY HA3 1 1 7 5319 2 2 23 GLY N N -10.903 2.338 -2.904 1.00 . B B . 23 GLY N 1 1 7 5320 2 2 23 GLY O O -9.528 0.586 -1.284 1.00 . B B . 23 GLY O 1 1 7 5321 2 2 24 PHE C C -8.104 1.146 2.170 1.00 . B B . 24 PHE C 1 1 7 5322 2 2 24 PHE CA C -7.822 1.284 0.673 1.00 . B B . 24 PHE CA 1 1 7 5323 2 2 24 PHE CB C -6.420 1.864 0.469 1.00 . B B . 24 PHE CB 1 1 7 5324 2 2 24 PHE CD1 C -6.705 4.022 -0.803 1.00 . B B . 24 PHE CD1 1 1 7 5325 2 2 24 PHE CD2 C -6.315 4.123 1.590 1.00 . B B . 24 PHE CD2 1 1 7 5326 2 2 24 PHE CE1 C -6.753 5.421 -0.853 1.00 . B B . 24 PHE CE1 1 1 7 5327 2 2 24 PHE CE2 C -6.366 5.523 1.540 1.00 . B B . 24 PHE CE2 1 1 7 5328 2 2 24 PHE CG C -6.485 3.373 0.418 1.00 . B B . 24 PHE CG 1 1 7 5329 2 2 24 PHE CZ C -6.584 6.172 0.316 1.00 . B B . 24 PHE CZ 1 1 7 5330 2 2 24 PHE H H -8.921 3.110 0.360 1.00 . B B . 24 PHE H 1 1 7 5331 2 2 24 PHE HA H -7.878 0.310 0.209 1.00 . B B . 24 PHE HA 1 1 7 5332 2 2 24 PHE HB2 H -5.784 1.560 1.287 1.00 . B B . 24 PHE HB2 1 1 7 5333 2 2 24 PHE HB3 H -6.011 1.492 -0.459 1.00 . B B . 24 PHE HB3 1 1 7 5334 2 2 24 PHE HD1 H -6.837 3.444 -1.706 1.00 . B B . 24 PHE HD1 1 1 7 5335 2 2 24 PHE HD2 H -6.148 3.622 2.532 1.00 . B B . 24 PHE HD2 1 1 7 5336 2 2 24 PHE HE1 H -6.925 5.921 -1.793 1.00 . B B . 24 PHE HE1 1 1 7 5337 2 2 24 PHE HE2 H -6.238 6.100 2.446 1.00 . B B . 24 PHE HE2 1 1 7 5338 2 2 24 PHE HZ H -6.615 7.252 0.272 1.00 . B B . 24 PHE HZ 1 1 7 5339 2 2 24 PHE N N -8.836 2.183 0.055 1.00 . B B . 24 PHE N 1 1 7 5340 2 2 24 PHE O O -8.837 1.922 2.749 1.00 . B B . 24 PHE O 1 1 7 5341 2 2 25 PHE C C -6.744 0.784 5.052 1.00 . B B . 25 PHE C 1 1 7 5342 2 2 25 PHE CA C -7.761 -0.032 4.258 1.00 . B B . 25 PHE CA 1 1 7 5343 2 2 25 PHE CB C -7.607 -1.514 4.605 1.00 . B B . 25 PHE CB 1 1 7 5344 2 2 25 PHE CD1 C -10.020 -2.103 5.044 1.00 . B B . 25 PHE CD1 1 1 7 5345 2 2 25 PHE CD2 C -8.447 -2.159 6.891 1.00 . B B . 25 PHE CD2 1 1 7 5346 2 2 25 PHE CE1 C -11.050 -2.496 5.909 1.00 . B B . 25 PHE CE1 1 1 7 5347 2 2 25 PHE CE2 C -9.476 -2.552 7.756 1.00 . B B . 25 PHE CE2 1 1 7 5348 2 2 25 PHE CG C -8.719 -1.935 5.535 1.00 . B B . 25 PHE CG 1 1 7 5349 2 2 25 PHE CZ C -10.778 -2.721 7.265 1.00 . B B . 25 PHE CZ 1 1 7 5350 2 2 25 PHE H H -6.940 -0.455 2.314 1.00 . B B . 25 PHE H 1 1 7 5351 2 2 25 PHE HA H -8.752 0.294 4.509 1.00 . B B . 25 PHE HA 1 1 7 5352 2 2 25 PHE HB2 H -7.654 -2.102 3.700 1.00 . B B . 25 PHE HB2 1 1 7 5353 2 2 25 PHE HB3 H -6.655 -1.674 5.089 1.00 . B B . 25 PHE HB3 1 1 7 5354 2 2 25 PHE HD1 H -10.229 -1.929 3.998 1.00 . B B . 25 PHE HD1 1 1 7 5355 2 2 25 PHE HD2 H -7.444 -2.029 7.269 1.00 . B B . 25 PHE HD2 1 1 7 5356 2 2 25 PHE HE1 H -12.053 -2.626 5.530 1.00 . B B . 25 PHE HE1 1 1 7 5357 2 2 25 PHE HE2 H -9.266 -2.725 8.801 1.00 . B B . 25 PHE HE2 1 1 7 5358 2 2 25 PHE HZ H -11.571 -3.025 7.932 1.00 . B B . 25 PHE HZ 1 1 7 5359 2 2 25 PHE N N -7.527 0.160 2.800 1.00 . B B . 25 PHE N 1 1 7 5360 2 2 25 PHE O O -7.083 1.728 5.738 1.00 . B B . 25 PHE O 1 1 7 5361 2 2 26 TYR C C -4.735 1.112 7.197 1.00 . B B . 26 TYR C 1 1 7 5362 2 2 26 TYR CA C -4.445 1.169 5.695 1.00 . B B . 26 TYR CA 1 1 7 5363 2 2 26 TYR CB C -4.436 2.624 5.227 1.00 . B B . 26 TYR CB 1 1 7 5364 2 2 26 TYR CD1 C -4.050 4.059 7.267 1.00 . B B . 26 TYR CD1 1 1 7 5365 2 2 26 TYR CD2 C -2.179 3.591 5.793 1.00 . B B . 26 TYR CD2 1 1 7 5366 2 2 26 TYR CE1 C -3.209 4.822 8.090 1.00 . B B . 26 TYR CE1 1 1 7 5367 2 2 26 TYR CE2 C -1.340 4.353 6.615 1.00 . B B . 26 TYR CE2 1 1 7 5368 2 2 26 TYR CG C -3.534 3.443 6.119 1.00 . B B . 26 TYR CG 1 1 7 5369 2 2 26 TYR CZ C -1.854 4.969 7.763 1.00 . B B . 26 TYR CZ 1 1 7 5370 2 2 26 TYR H H -5.264 -0.334 4.394 1.00 . B B . 26 TYR H 1 1 7 5371 2 2 26 TYR HA H -3.483 0.721 5.496 1.00 . B B . 26 TYR HA 1 1 7 5372 2 2 26 TYR HB2 H -4.075 2.671 4.211 1.00 . B B . 26 TYR HB2 1 1 7 5373 2 2 26 TYR HB3 H -5.439 3.016 5.269 1.00 . B B . 26 TYR HB3 1 1 7 5374 2 2 26 TYR HD1 H -5.094 3.946 7.519 1.00 . B B . 26 TYR HD1 1 1 7 5375 2 2 26 TYR HD2 H -1.783 3.116 4.908 1.00 . B B . 26 TYR HD2 1 1 7 5376 2 2 26 TYR HE1 H -3.606 5.297 8.975 1.00 . B B . 26 TYR HE1 1 1 7 5377 2 2 26 TYR HE2 H -0.296 4.467 6.363 1.00 . B B . 26 TYR HE2 1 1 7 5378 2 2 26 TYR HH H -1.510 6.501 8.849 1.00 . B B . 26 TYR HH 1 1 7 5379 2 2 26 TYR N N -5.502 0.425 4.956 1.00 . B B . 26 TYR N 1 1 7 5380 2 2 26 TYR O O -5.508 1.889 7.721 1.00 . B B . 26 TYR O 1 1 7 5381 2 2 26 TYR OH O -1.026 5.720 8.573 1.00 . B B . 26 TYR OH 1 1 7 5382 2 2 27 THR C C -3.031 0.346 10.100 1.00 . B B . 27 THR C 1 1 7 5383 2 2 27 THR CA C -4.349 0.088 9.364 1.00 . B B . 27 THR CA 1 1 7 5384 2 2 27 THR CB C -4.872 -1.316 9.716 1.00 . B B . 27 THR CB 1 1 7 5385 2 2 27 THR CG2 C -4.631 -2.281 8.550 1.00 . B B . 27 THR CG2 1 1 7 5386 2 2 27 THR H H -3.494 -0.417 7.450 1.00 . B B . 27 THR H 1 1 7 5387 2 2 27 THR HA H -5.077 0.828 9.665 1.00 . B B . 27 THR HA 1 1 7 5388 2 2 27 THR HB H -5.931 -1.262 9.917 1.00 . B B . 27 THR HB 1 1 7 5389 2 2 27 THR HG1 H -4.036 -2.734 10.757 1.00 . B B . 27 THR HG1 1 1 7 5390 2 2 27 THR HG21 H -3.572 -2.469 8.450 1.00 . B B . 27 THR HG21 1 1 7 5391 2 2 27 THR HG22 H -5.007 -1.843 7.637 1.00 . B B . 27 THR HG22 1 1 7 5392 2 2 27 THR HG23 H -5.146 -3.212 8.739 1.00 . B B . 27 THR HG23 1 1 7 5393 2 2 27 THR N N -4.116 0.197 7.894 1.00 . B B . 27 THR N 1 1 7 5394 2 2 27 THR O O -1.964 0.074 9.588 1.00 . B B . 27 THR O 1 1 7 5395 2 2 27 THR OG1 O -4.198 -1.795 10.873 1.00 . B B . 27 THR OG1 1 1 7 5396 2 2 28 LYS C C -1.525 0.036 13.030 1.00 . B B . 28 LYS C 1 1 7 5397 2 2 28 LYS CA C -1.833 1.158 12.038 1.00 . B B . 28 LYS CA 1 1 7 5398 2 2 28 LYS CB C -1.957 2.466 12.822 1.00 . B B . 28 LYS CB 1 1 7 5399 2 2 28 LYS CD C -1.426 4.791 11.925 1.00 . B B . 28 LYS CD 1 1 7 5400 2 2 28 LYS CE C -2.437 5.297 12.958 1.00 . B B . 28 LYS CE 1 1 7 5401 2 2 28 LYS CG C -0.849 3.435 12.373 1.00 . B B . 28 LYS CG 1 1 7 5402 2 2 28 LYS H H -3.961 1.102 11.683 1.00 . B B . 28 LYS H 1 1 7 5403 2 2 28 LYS HA H -1.017 1.245 11.337 1.00 . B B . 28 LYS HA 1 1 7 5404 2 2 28 LYS HB2 H -2.937 2.888 12.664 1.00 . B B . 28 LYS HB2 1 1 7 5405 2 2 28 LYS HB3 H -1.833 2.252 13.876 1.00 . B B . 28 LYS HB3 1 1 7 5406 2 2 28 LYS HD2 H -0.618 5.512 11.833 1.00 . B B . 28 LYS HD2 1 1 7 5407 2 2 28 LYS HD3 H -1.911 4.684 10.966 1.00 . B B . 28 LYS HD3 1 1 7 5408 2 2 28 LYS HE2 H -2.716 6.313 12.720 1.00 . B B . 28 LYS HE2 1 1 7 5409 2 2 28 LYS HE3 H -3.316 4.672 12.941 1.00 . B B . 28 LYS HE3 1 1 7 5410 2 2 28 LYS HG2 H -0.170 3.595 13.197 1.00 . B B . 28 LYS HG2 1 1 7 5411 2 2 28 LYS HG3 H -0.308 2.992 11.552 1.00 . B B . 28 LYS HG3 1 1 7 5412 2 2 28 LYS HZ1 H -2.505 5.624 15.015 1.00 . B B . 28 LYS HZ1 1 1 7 5413 2 2 28 LYS HZ2 H -0.966 5.846 14.328 1.00 . B B . 28 LYS HZ2 1 1 7 5414 2 2 28 LYS HZ3 H -1.578 4.278 14.560 1.00 . B B . 28 LYS HZ3 1 1 7 5415 2 2 28 LYS N N -3.093 0.878 11.290 1.00 . B B . 28 LYS N 1 1 7 5416 2 2 28 LYS NZ N -1.825 5.258 14.318 1.00 . B B . 28 LYS NZ 1 1 7 5417 2 2 28 LYS O O -0.470 -0.564 12.967 1.00 . B B . 28 LYS O 1 1 7 5418 2 2 29 PRO C C -2.580 -2.601 14.484 1.00 . B B . 29 PRO C 1 1 7 5419 2 2 29 PRO CA C -2.238 -1.198 14.999 1.00 . B B . 29 PRO CA 1 1 7 5420 2 2 29 PRO CB C -3.221 -0.755 16.081 1.00 . B B . 29 PRO CB 1 1 7 5421 2 2 29 PRO CD C -3.722 0.531 14.036 1.00 . B B . 29 PRO CD 1 1 7 5422 2 2 29 PRO CG C -4.317 0.073 15.375 1.00 . B B . 29 PRO CG 1 1 7 5423 2 2 29 PRO HA H -1.231 -1.165 15.382 1.00 . B B . 29 PRO HA 1 1 7 5424 2 2 29 PRO HB2 H -3.652 -1.614 16.572 1.00 . B B . 29 PRO HB2 1 1 7 5425 2 2 29 PRO HB3 H -2.710 -0.127 16.793 1.00 . B B . 29 PRO HB3 1 1 7 5426 2 2 29 PRO HD2 H -4.376 0.245 13.224 1.00 . B B . 29 PRO HD2 1 1 7 5427 2 2 29 PRO HD3 H -3.570 1.593 14.047 1.00 . B B . 29 PRO HD3 1 1 7 5428 2 2 29 PRO HG2 H -5.192 -0.539 15.206 1.00 . B B . 29 PRO HG2 1 1 7 5429 2 2 29 PRO HG3 H -4.574 0.934 15.973 1.00 . B B . 29 PRO HG3 1 1 7 5430 2 2 29 PRO N N -2.429 -0.188 13.950 1.00 . B B . 29 PRO N 1 1 7 5431 2 2 29 PRO O O -3.317 -2.761 13.532 1.00 . B B . 29 PRO O 1 1 7 5432 2 2 30 THR C C -3.769 -5.384 15.069 1.00 . B B . 30 THR C 1 1 7 5433 2 2 30 THR CA C -2.344 -5.009 14.662 1.00 . B B . 30 THR CA 1 1 7 5434 2 2 30 THR CB C -1.359 -5.983 15.316 1.00 . B B . 30 THR CB 1 1 7 5435 2 2 30 THR CG2 C 0.073 -5.508 15.071 1.00 . B B . 30 THR CG2 1 1 7 5436 2 2 30 THR H H -1.458 -3.466 15.878 1.00 . B B . 30 THR H 1 1 7 5437 2 2 30 THR HA H -2.248 -5.069 13.588 1.00 . B B . 30 THR HA 1 1 7 5438 2 2 30 THR HB H -1.486 -6.966 14.887 1.00 . B B . 30 THR HB 1 1 7 5439 2 2 30 THR HG1 H -1.470 -5.163 17.078 1.00 . B B . 30 THR HG1 1 1 7 5440 2 2 30 THR HG21 H 0.763 -6.181 15.558 1.00 . B B . 30 THR HG21 1 1 7 5441 2 2 30 THR HG22 H 0.196 -4.514 15.473 1.00 . B B . 30 THR HG22 1 1 7 5442 2 2 30 THR HG23 H 0.273 -5.495 14.009 1.00 . B B . 30 THR HG23 1 1 7 5443 2 2 30 THR N N -2.049 -3.618 15.111 1.00 . B B . 30 THR N 1 1 7 5444 2 2 30 THR O O -4.657 -4.574 14.859 1.00 . B B . 30 THR O 1 1 7 5445 2 2 30 THR OXT O -3.949 -6.475 15.585 1.00 . B B . 30 THR OXT 1 1 7 5446 2 2 30 THR OG1 O -1.610 -6.041 16.714 1.00 . B B . 30 THR OG1 1 1 8 5447 1 1 1 GLY C C 0.913 -4.772 8.197 1.00 . A A . 1 GLY C 1 1 8 5448 1 1 1 GLY CA C 0.334 -4.891 9.566 1.00 . A A . 1 GLY CA 1 1 8 5449 1 1 1 GLY H1 H 0.143 -3.445 11.101 1.00 . A A . 1 GLY H1 1 1 8 5450 1 1 1 GLY H2 H 1.653 -3.419 10.324 1.00 . A A . 1 GLY H2 1 1 8 5451 1 1 1 GLY H3 H 1.291 -4.648 11.439 1.00 . A A . 1 GLY H3 1 1 8 5452 1 1 1 GLY HA2 H 0.747 -5.773 9.550 1.00 . A A . 1 GLY HA2 1 1 8 5453 1 1 1 GLY HA3 H -0.823 -4.931 9.717 1.00 . A A . 1 GLY HA3 1 1 8 5454 1 1 1 GLY N N 0.901 -4.032 10.698 1.00 . A A . 1 GLY N 1 1 8 5455 1 1 1 GLY O O 1.977 -5.287 7.914 1.00 . A A . 1 GLY O 1 1 8 5456 1 1 2 ILE C C 2.007 -3.074 5.935 1.00 . A A . 2 ILE C 1 1 8 5457 1 1 2 ILE CA C 0.753 -3.946 5.924 1.00 . A A . 2 ILE CA 1 1 8 5458 1 1 2 ILE CB C -0.313 -3.291 5.039 1.00 . A A . 2 ILE CB 1 1 8 5459 1 1 2 ILE CD1 C -0.015 -1.661 3.105 1.00 . A A . 2 ILE CD1 1 1 8 5460 1 1 2 ILE CG1 C 0.276 -3.077 3.626 1.00 . A A . 2 ILE CG1 1 1 8 5461 1 1 2 ILE CG2 C -0.747 -1.957 5.665 1.00 . A A . 2 ILE CG2 1 1 8 5462 1 1 2 ILE H H -0.627 -3.696 7.560 1.00 . A A . 2 ILE H 1 1 8 5463 1 1 2 ILE HA H 0.999 -4.914 5.530 1.00 . A A . 2 ILE HA 1 1 8 5464 1 1 2 ILE HB H -1.170 -3.946 4.974 1.00 . A A . 2 ILE HB 1 1 8 5465 1 1 2 ILE HD11 H -1.078 -1.474 3.145 1.00 . A A . 2 ILE HD11 1 1 8 5466 1 1 2 ILE HD12 H 0.327 -1.575 2.084 1.00 . A A . 2 ILE HD12 1 1 8 5467 1 1 2 ILE HD13 H 0.502 -0.938 3.720 1.00 . A A . 2 ILE HD13 1 1 8 5468 1 1 2 ILE HG12 H 1.345 -3.228 3.661 1.00 . A A . 2 ILE HG12 1 1 8 5469 1 1 2 ILE HG13 H -0.160 -3.798 2.951 1.00 . A A . 2 ILE HG13 1 1 8 5470 1 1 2 ILE HG21 H 0.043 -1.231 5.546 1.00 . A A . 2 ILE HG21 1 1 8 5471 1 1 2 ILE HG22 H -0.950 -2.098 6.716 1.00 . A A . 2 ILE HG22 1 1 8 5472 1 1 2 ILE HG23 H -1.639 -1.602 5.172 1.00 . A A . 2 ILE HG23 1 1 8 5473 1 1 2 ILE N N 0.230 -4.098 7.312 1.00 . A A . 2 ILE N 1 1 8 5474 1 1 2 ILE O O 3.014 -3.413 5.358 1.00 . A A . 2 ILE O 1 1 8 5475 1 1 3 ABA C C 4.317 -1.720 7.250 1.00 . A A . 3 ABA C 1 1 8 5476 1 1 3 ABA CA C 3.099 -1.026 6.640 1.00 . A A . 3 ABA CA 1 1 8 5477 1 1 3 ABA CB C 2.717 0.179 7.497 1.00 . A A . 3 ABA CB 1 1 8 5478 1 1 3 ABA CG C 1.955 1.198 6.646 1.00 . A A . 3 ABA CG 1 1 8 5479 1 1 3 ABA H H 1.113 -1.708 7.024 1.00 . A A . 3 ABA H 1 1 8 5480 1 1 3 ABA HA H 3.341 -0.695 5.649 1.00 . A A . 3 ABA HA 1 1 8 5481 1 1 3 ABA HB2 H 2.092 -0.148 8.315 1.00 . A A . 3 ABA HB2 1 1 8 5482 1 1 3 ABA HB3 H 3.608 0.634 7.888 1.00 . A A . 3 ABA HB3 1 1 8 5483 1 1 3 ABA HG1 H 1.279 0.680 5.983 1.00 . A A . 3 ABA HG1 1 1 8 5484 1 1 3 ABA HG2 H 2.656 1.779 6.065 1.00 . A A . 3 ABA HG2 1 1 8 5485 1 1 3 ABA HG3 H 1.391 1.856 7.292 1.00 . A A . 3 ABA HG3 1 1 8 5486 1 1 3 ABA N N 1.938 -1.952 6.581 1.00 . A A . 3 ABA N 1 1 8 5487 1 1 3 ABA O O 5.406 -1.650 6.737 1.00 . A A . 3 ABA O 1 1 8 5488 1 1 4 GLU C C 6.007 -3.946 7.925 1.00 . A A . 4 GLU C 1 1 8 5489 1 1 4 GLU CA C 5.316 -3.059 8.970 1.00 . A A . 4 GLU CA 1 1 8 5490 1 1 4 GLU CB C 4.803 -3.883 10.152 1.00 . A A . 4 GLU CB 1 1 8 5491 1 1 4 GLU CD C 5.180 -5.914 11.559 1.00 . A A . 4 GLU CD 1 1 8 5492 1 1 4 GLU CG C 5.510 -5.236 10.229 1.00 . A A . 4 GLU CG 1 1 8 5493 1 1 4 GLU H H 3.273 -2.433 8.756 1.00 . A A . 4 GLU H 1 1 8 5494 1 1 4 GLU HA H 6.015 -2.316 9.326 1.00 . A A . 4 GLU HA 1 1 8 5495 1 1 4 GLU HB2 H 4.973 -3.335 11.065 1.00 . A A . 4 GLU HB2 1 1 8 5496 1 1 4 GLU HB3 H 3.749 -4.041 10.021 1.00 . A A . 4 GLU HB3 1 1 8 5497 1 1 4 GLU HG2 H 5.174 -5.857 9.412 1.00 . A A . 4 GLU HG2 1 1 8 5498 1 1 4 GLU HG3 H 6.576 -5.085 10.155 1.00 . A A . 4 GLU HG3 1 1 8 5499 1 1 4 GLU N N 4.154 -2.381 8.343 1.00 . A A . 4 GLU N 1 1 8 5500 1 1 4 GLU O O 7.191 -4.199 7.998 1.00 . A A . 4 GLU O 1 1 8 5501 1 1 4 GLU OE1 O 4.193 -6.629 11.608 1.00 . A A . 4 GLU OE1 1 1 8 5502 1 1 4 GLU OE2 O 5.920 -5.707 12.507 1.00 . A A . 4 GLU OE2 1 1 8 5503 1 1 5 GLN C C 6.045 -4.479 4.624 1.00 . A A . 5 GLN C 1 1 8 5504 1 1 5 GLN CA C 5.898 -5.282 5.914 1.00 . A A . 5 GLN CA 1 1 8 5505 1 1 5 GLN CB C 5.001 -6.495 5.656 1.00 . A A . 5 GLN CB 1 1 8 5506 1 1 5 GLN CD C 6.023 -7.804 3.787 1.00 . A A . 5 GLN CD 1 1 8 5507 1 1 5 GLN CG C 5.867 -7.706 5.306 1.00 . A A . 5 GLN CG 1 1 8 5508 1 1 5 GLN H H 4.321 -4.207 6.914 1.00 . A A . 5 GLN H 1 1 8 5509 1 1 5 GLN HA H 6.869 -5.614 6.249 1.00 . A A . 5 GLN HA 1 1 8 5510 1 1 5 GLN HB2 H 4.422 -6.709 6.543 1.00 . A A . 5 GLN HB2 1 1 8 5511 1 1 5 GLN HB3 H 4.335 -6.282 4.834 1.00 . A A . 5 GLN HB3 1 1 8 5512 1 1 5 GLN HE21 H 4.078 -7.621 3.430 1.00 . A A . 5 GLN HE21 1 1 8 5513 1 1 5 GLN HE22 H 5.054 -7.798 2.053 1.00 . A A . 5 GLN HE22 1 1 8 5514 1 1 5 GLN HG2 H 6.840 -7.595 5.762 1.00 . A A . 5 GLN HG2 1 1 8 5515 1 1 5 GLN HG3 H 5.396 -8.604 5.675 1.00 . A A . 5 GLN HG3 1 1 8 5516 1 1 5 GLN N N 5.277 -4.420 6.957 1.00 . A A . 5 GLN N 1 1 8 5517 1 1 5 GLN NE2 N 4.963 -7.735 3.027 1.00 . A A . 5 GLN NE2 1 1 8 5518 1 1 5 GLN O O 6.898 -4.744 3.805 1.00 . A A . 5 GLN O 1 1 8 5519 1 1 5 GLN OE1 O 7.120 -7.944 3.286 1.00 . A A . 5 GLN OE1 1 1 8 5520 1 1 6 CYS C C 5.837 -1.307 3.525 1.00 . A A . 6 CYS C 1 1 8 5521 1 1 6 CYS CA C 5.252 -2.689 3.202 1.00 . A A . 6 CYS CA 1 1 8 5522 1 1 6 CYS CB C 3.823 -2.570 2.679 1.00 . A A . 6 CYS CB 1 1 8 5523 1 1 6 CYS H H 4.510 -3.326 5.101 1.00 . A A . 6 CYS H 1 1 8 5524 1 1 6 CYS HA H 5.867 -3.181 2.463 1.00 . A A . 6 CYS HA 1 1 8 5525 1 1 6 CYS HB2 H 3.145 -2.445 3.510 1.00 . A A . 6 CYS HB2 1 1 8 5526 1 1 6 CYS HB3 H 3.738 -1.731 2.029 1.00 . A A . 6 CYS HB3 1 1 8 5527 1 1 6 CYS N N 5.200 -3.509 4.433 1.00 . A A . 6 CYS N 1 1 8 5528 1 1 6 CYS O O 5.808 -0.396 2.719 1.00 . A A . 6 CYS O 1 1 8 5529 1 1 6 CYS SG S 3.407 -4.088 1.786 1.00 . A A . 6 CYS SG 1 1 8 5530 1 1 7 CYS C C 8.433 -0.062 5.475 1.00 . A A . 7 CYS C 1 1 8 5531 1 1 7 CYS CA C 6.969 0.154 5.098 1.00 . A A . 7 CYS CA 1 1 8 5532 1 1 7 CYS CB C 6.205 0.738 6.293 1.00 . A A . 7 CYS CB 1 1 8 5533 1 1 7 CYS H H 6.391 -1.902 5.331 1.00 . A A . 7 CYS H 1 1 8 5534 1 1 7 CYS HA H 6.912 0.841 4.271 1.00 . A A . 7 CYS HA 1 1 8 5535 1 1 7 CYS HB2 H 5.149 0.749 6.075 1.00 . A A . 7 CYS HB2 1 1 8 5536 1 1 7 CYS HB3 H 6.380 0.137 7.168 1.00 . A A . 7 CYS HB3 1 1 8 5537 1 1 7 CYS N N 6.375 -1.151 4.701 1.00 . A A . 7 CYS N 1 1 8 5538 1 1 7 CYS O O 9.260 0.811 5.298 1.00 . A A . 7 CYS O 1 1 8 5539 1 1 7 CYS SG S 6.775 2.427 6.606 1.00 . A A . 7 CYS SG 1 1 8 5540 1 1 8 THR C C 10.883 -2.252 5.241 1.00 . A A . 8 THR C 1 1 8 5541 1 1 8 THR CA C 10.194 -1.461 6.356 1.00 . A A . 8 THR CA 1 1 8 5542 1 1 8 THR CB C 10.263 -2.245 7.666 1.00 . A A . 8 THR CB 1 1 8 5543 1 1 8 THR CG2 C 10.724 -1.315 8.788 1.00 . A A . 8 THR CG2 1 1 8 5544 1 1 8 THR H H 8.094 -1.926 6.126 1.00 . A A . 8 THR H 1 1 8 5545 1 1 8 THR HA H 10.694 -0.511 6.481 1.00 . A A . 8 THR HA 1 1 8 5546 1 1 8 THR HB H 10.967 -3.057 7.565 1.00 . A A . 8 THR HB 1 1 8 5547 1 1 8 THR HG1 H 8.695 -3.310 7.238 1.00 . A A . 8 THR HG1 1 1 8 5548 1 1 8 THR HG21 H 9.994 -1.321 9.584 1.00 . A A . 8 THR HG21 1 1 8 5549 1 1 8 THR HG22 H 10.828 -0.312 8.402 1.00 . A A . 8 THR HG22 1 1 8 5550 1 1 8 THR HG23 H 11.675 -1.655 9.169 1.00 . A A . 8 THR HG23 1 1 8 5551 1 1 8 THR N N 8.772 -1.219 5.988 1.00 . A A . 8 THR N 1 1 8 5552 1 1 8 THR O O 12.086 -2.419 5.240 1.00 . A A . 8 THR O 1 1 8 5553 1 1 8 THR OG1 O 8.979 -2.762 7.974 1.00 . A A . 8 THR OG1 1 1 8 5554 1 1 9 SER C C 10.317 -2.901 1.827 1.00 . A A . 9 SER C 1 1 8 5555 1 1 9 SER CA C 10.753 -3.503 3.170 1.00 . A A . 9 SER CA 1 1 8 5556 1 1 9 SER CB C 10.334 -4.973 3.259 1.00 . A A . 9 SER CB 1 1 8 5557 1 1 9 SER H H 9.164 -2.584 4.299 1.00 . A A . 9 SER H 1 1 8 5558 1 1 9 SER HA H 11.827 -3.436 3.251 1.00 . A A . 9 SER HA 1 1 8 5559 1 1 9 SER HB2 H 10.939 -5.562 2.590 1.00 . A A . 9 SER HB2 1 1 8 5560 1 1 9 SER HB3 H 10.475 -5.326 4.272 1.00 . A A . 9 SER HB3 1 1 8 5561 1 1 9 SER HG H 8.433 -4.907 3.657 1.00 . A A . 9 SER HG 1 1 8 5562 1 1 9 SER N N 10.132 -2.733 4.285 1.00 . A A . 9 SER N 1 1 8 5563 1 1 9 SER O O 10.787 -1.852 1.434 1.00 . A A . 9 SER O 1 1 8 5564 1 1 9 SER OG O 8.971 -5.102 2.886 1.00 . A A . 9 SER OG 1 1 8 5565 1 1 10 ILE C C 7.576 -3.501 -0.531 1.00 . A A . 10 ILE C 1 1 8 5566 1 1 10 ILE CA C 8.995 -3.001 -0.203 1.00 . A A . 10 ILE CA 1 1 8 5567 1 1 10 ILE CB C 10.000 -3.465 -1.283 1.00 . A A . 10 ILE CB 1 1 8 5568 1 1 10 ILE CD1 C 12.188 -2.451 -0.619 1.00 . A A . 10 ILE CD1 1 1 8 5569 1 1 10 ILE CG1 C 10.996 -2.342 -1.572 1.00 . A A . 10 ILE CG1 1 1 8 5570 1 1 10 ILE CG2 C 9.282 -3.837 -2.586 1.00 . A A . 10 ILE CG2 1 1 8 5571 1 1 10 ILE H H 9.065 -4.396 1.436 1.00 . A A . 10 ILE H 1 1 8 5572 1 1 10 ILE HA H 8.993 -1.922 -0.158 1.00 . A A . 10 ILE HA 1 1 8 5573 1 1 10 ILE HB H 10.538 -4.326 -0.917 1.00 . A A . 10 ILE HB 1 1 8 5574 1 1 10 ILE HD11 H 12.365 -1.493 -0.153 1.00 . A A . 10 ILE HD11 1 1 8 5575 1 1 10 ILE HD12 H 13.066 -2.750 -1.173 1.00 . A A . 10 ILE HD12 1 1 8 5576 1 1 10 ILE HD13 H 11.975 -3.187 0.141 1.00 . A A . 10 ILE HD13 1 1 8 5577 1 1 10 ILE HG12 H 11.341 -2.425 -2.592 1.00 . A A . 10 ILE HG12 1 1 8 5578 1 1 10 ILE HG13 H 10.512 -1.391 -1.432 1.00 . A A . 10 ILE HG13 1 1 8 5579 1 1 10 ILE HG21 H 9.987 -3.820 -3.404 1.00 . A A . 10 ILE HG21 1 1 8 5580 1 1 10 ILE HG22 H 8.491 -3.126 -2.777 1.00 . A A . 10 ILE HG22 1 1 8 5581 1 1 10 ILE HG23 H 8.861 -4.827 -2.494 1.00 . A A . 10 ILE HG23 1 1 8 5582 1 1 10 ILE N N 9.433 -3.549 1.113 1.00 . A A . 10 ILE N 1 1 8 5583 1 1 10 ILE O O 7.268 -4.666 -0.377 1.00 . A A . 10 ILE O 1 1 8 5584 1 1 11 CYS C C 5.116 -2.772 -2.866 1.00 . A A . 11 CYS C 1 1 8 5585 1 1 11 CYS CA C 5.338 -3.055 -1.380 1.00 . A A . 11 CYS CA 1 1 8 5586 1 1 11 CYS CB C 4.305 -2.320 -0.534 1.00 . A A . 11 CYS CB 1 1 8 5587 1 1 11 CYS H H 7.002 -1.697 -1.145 1.00 . A A . 11 CYS H 1 1 8 5588 1 1 11 CYS HA H 5.227 -4.108 -1.213 1.00 . A A . 11 CYS HA 1 1 8 5589 1 1 11 CYS HB2 H 4.771 -1.945 0.364 1.00 . A A . 11 CYS HB2 1 1 8 5590 1 1 11 CYS HB3 H 3.887 -1.501 -1.099 1.00 . A A . 11 CYS HB3 1 1 8 5591 1 1 11 CYS N N 6.723 -2.629 -1.009 1.00 . A A . 11 CYS N 1 1 8 5592 1 1 11 CYS O O 5.238 -1.654 -3.326 1.00 . A A . 11 CYS O 1 1 8 5593 1 1 11 CYS SG S 2.992 -3.491 -0.097 1.00 . A A . 11 CYS SG 1 1 8 5594 1 1 12 SER C C 3.228 -3.054 -5.377 1.00 . A A . 12 SER C 1 1 8 5595 1 1 12 SER CA C 4.615 -3.617 -5.091 1.00 . A A . 12 SER CA 1 1 8 5596 1 1 12 SER CB C 4.764 -4.972 -5.784 1.00 . A A . 12 SER CB 1 1 8 5597 1 1 12 SER H H 4.746 -4.687 -3.229 1.00 . A A . 12 SER H 1 1 8 5598 1 1 12 SER HA H 5.356 -2.937 -5.483 1.00 . A A . 12 SER HA 1 1 8 5599 1 1 12 SER HB2 H 4.018 -5.068 -6.555 1.00 . A A . 12 SER HB2 1 1 8 5600 1 1 12 SER HB3 H 5.748 -5.041 -6.228 1.00 . A A . 12 SER HB3 1 1 8 5601 1 1 12 SER HG H 5.384 -6.545 -4.821 1.00 . A A . 12 SER HG 1 1 8 5602 1 1 12 SER N N 4.818 -3.794 -3.624 1.00 . A A . 12 SER N 1 1 8 5603 1 1 12 SER O O 2.313 -3.171 -4.589 1.00 . A A . 12 SER O 1 1 8 5604 1 1 12 SER OG O 4.587 -6.010 -4.829 1.00 . A A . 12 SER OG 1 1 8 5605 1 1 13 LEU C C 0.693 -2.935 -6.971 1.00 . A A . 13 LEU C 1 1 8 5606 1 1 13 LEU CA C 1.773 -1.851 -6.904 1.00 . A A . 13 LEU CA 1 1 8 5607 1 1 13 LEU CB C 1.919 -1.212 -8.277 1.00 . A A . 13 LEU CB 1 1 8 5608 1 1 13 LEU CD1 C 1.679 -2.055 -10.608 1.00 . A A . 13 LEU CD1 1 1 8 5609 1 1 13 LEU CD2 C 3.869 -2.252 -9.435 1.00 . A A . 13 LEU CD2 1 1 8 5610 1 1 13 LEU CG C 2.351 -2.291 -9.262 1.00 . A A . 13 LEU CG 1 1 8 5611 1 1 13 LEU H H 3.844 -2.368 -7.124 1.00 . A A . 13 LEU H 1 1 8 5612 1 1 13 LEU HA H 1.489 -1.101 -6.189 1.00 . A A . 13 LEU HA 1 1 8 5613 1 1 13 LEU HB2 H 0.971 -0.792 -8.586 1.00 . A A . 13 LEU HB2 1 1 8 5614 1 1 13 LEU HB3 H 2.667 -0.435 -8.241 1.00 . A A . 13 LEU HB3 1 1 8 5615 1 1 13 LEU HD11 H 0.808 -1.434 -10.469 1.00 . A A . 13 LEU HD11 1 1 8 5616 1 1 13 LEU HD12 H 1.385 -3.003 -11.032 1.00 . A A . 13 LEU HD12 1 1 8 5617 1 1 13 LEU HD13 H 2.372 -1.562 -11.272 1.00 . A A . 13 LEU HD13 1 1 8 5618 1 1 13 LEU HD21 H 4.111 -2.234 -10.487 1.00 . A A . 13 LEU HD21 1 1 8 5619 1 1 13 LEU HD22 H 4.305 -3.129 -8.980 1.00 . A A . 13 LEU HD22 1 1 8 5620 1 1 13 LEU HD23 H 4.263 -1.366 -8.960 1.00 . A A . 13 LEU HD23 1 1 8 5621 1 1 13 LEU HG H 2.057 -3.255 -8.875 1.00 . A A . 13 LEU HG 1 1 8 5622 1 1 13 LEU N N 3.081 -2.442 -6.515 1.00 . A A . 13 LEU N 1 1 8 5623 1 1 13 LEU O O -0.481 -2.640 -7.082 1.00 . A A . 13 LEU O 1 1 8 5624 1 1 14 TYR C C -0.201 -5.677 -5.504 1.00 . A A . 14 TYR C 1 1 8 5625 1 1 14 TYR CA C 0.024 -5.247 -6.929 1.00 . A A . 14 TYR CA 1 1 8 5626 1 1 14 TYR CB C 0.509 -6.426 -7.778 1.00 . A A . 14 TYR CB 1 1 8 5627 1 1 14 TYR CD1 C -0.282 -8.351 -6.352 1.00 . A A . 14 TYR CD1 1 1 8 5628 1 1 14 TYR CD2 C -1.320 -7.998 -8.518 1.00 . A A . 14 TYR CD2 1 1 8 5629 1 1 14 TYR CE1 C -1.115 -9.458 -6.134 1.00 . A A . 14 TYR CE1 1 1 8 5630 1 1 14 TYR CE2 C -2.152 -9.105 -8.300 1.00 . A A . 14 TYR CE2 1 1 8 5631 1 1 14 TYR CG C -0.385 -7.621 -7.544 1.00 . A A . 14 TYR CG 1 1 8 5632 1 1 14 TYR CZ C -2.049 -9.834 -7.107 1.00 . A A . 14 TYR CZ 1 1 8 5633 1 1 14 TYR H H 2.007 -4.425 -6.765 1.00 . A A . 14 TYR H 1 1 8 5634 1 1 14 TYR HA H -0.889 -4.842 -7.327 1.00 . A A . 14 TYR HA 1 1 8 5635 1 1 14 TYR HB2 H 0.477 -6.152 -8.823 1.00 . A A . 14 TYR HB2 1 1 8 5636 1 1 14 TYR HB3 H 1.523 -6.675 -7.503 1.00 . A A . 14 TYR HB3 1 1 8 5637 1 1 14 TYR HD1 H 0.438 -8.061 -5.602 1.00 . A A . 14 TYR HD1 1 1 8 5638 1 1 14 TYR HD2 H -1.398 -7.436 -9.437 1.00 . A A . 14 TYR HD2 1 1 8 5639 1 1 14 TYR HE1 H -1.035 -10.020 -5.215 1.00 . A A . 14 TYR HE1 1 1 8 5640 1 1 14 TYR HE2 H -2.872 -9.395 -9.050 1.00 . A A . 14 TYR HE2 1 1 8 5641 1 1 14 TYR HH H -2.362 -11.718 -7.067 1.00 . A A . 14 TYR HH 1 1 8 5642 1 1 14 TYR N N 1.061 -4.185 -6.885 1.00 . A A . 14 TYR N 1 1 8 5643 1 1 14 TYR O O -1.303 -5.949 -5.071 1.00 . A A . 14 TYR O 1 1 8 5644 1 1 14 TYR OH O -2.870 -10.923 -6.891 1.00 . A A . 14 TYR OH 1 1 8 5645 1 1 15 GLN C C -0.031 -4.881 -2.682 1.00 . A A . 15 GLN C 1 1 8 5646 1 1 15 GLN CA C 0.761 -6.004 -3.338 1.00 . A A . 15 GLN CA 1 1 8 5647 1 1 15 GLN CB C 2.177 -6.023 -2.788 1.00 . A A . 15 GLN CB 1 1 8 5648 1 1 15 GLN CD C 2.390 -7.925 -1.180 1.00 . A A . 15 GLN CD 1 1 8 5649 1 1 15 GLN CG C 2.647 -7.465 -2.616 1.00 . A A . 15 GLN CG 1 1 8 5650 1 1 15 GLN H H 1.711 -5.401 -5.144 1.00 . A A . 15 GLN H 1 1 8 5651 1 1 15 GLN HA H 0.276 -6.956 -3.191 1.00 . A A . 15 GLN HA 1 1 8 5652 1 1 15 GLN HB2 H 2.828 -5.513 -3.489 1.00 . A A . 15 GLN HB2 1 1 8 5653 1 1 15 GLN HB3 H 2.198 -5.516 -1.842 1.00 . A A . 15 GLN HB3 1 1 8 5654 1 1 15 GLN HE21 H 3.412 -9.615 -1.387 1.00 . A A . 15 GLN HE21 1 1 8 5655 1 1 15 GLN HE22 H 2.724 -9.367 0.145 1.00 . A A . 15 GLN HE22 1 1 8 5656 1 1 15 GLN HG2 H 2.109 -8.100 -3.304 1.00 . A A . 15 GLN HG2 1 1 8 5657 1 1 15 GLN HG3 H 3.705 -7.521 -2.826 1.00 . A A . 15 GLN HG3 1 1 8 5658 1 1 15 GLN N N 0.851 -5.673 -4.763 1.00 . A A . 15 GLN N 1 1 8 5659 1 1 15 GLN NE2 N 2.883 -9.064 -0.774 1.00 . A A . 15 GLN NE2 1 1 8 5660 1 1 15 GLN O O -0.740 -5.066 -1.712 1.00 . A A . 15 GLN O 1 1 8 5661 1 1 15 GLN OE1 O 1.733 -7.242 -0.419 1.00 . A A . 15 GLN OE1 1 1 8 5662 1 1 16 LEU C C -2.054 -2.573 -3.298 1.00 . A A . 16 LEU C 1 1 8 5663 1 1 16 LEU CA C -0.656 -2.537 -2.726 1.00 . A A . 16 LEU CA 1 1 8 5664 1 1 16 LEU CB C 0.083 -1.276 -3.157 1.00 . A A . 16 LEU CB 1 1 8 5665 1 1 16 LEU CD1 C 2.257 -0.060 -2.859 1.00 . A A . 16 LEU CD1 1 1 8 5666 1 1 16 LEU CD2 C 1.244 -1.334 -0.969 1.00 . A A . 16 LEU CD2 1 1 8 5667 1 1 16 LEU CG C 1.450 -1.296 -2.479 1.00 . A A . 16 LEU CG 1 1 8 5668 1 1 16 LEU H H 0.636 -3.612 -4.049 1.00 . A A . 16 LEU H 1 1 8 5669 1 1 16 LEU HA H -0.705 -2.581 -1.651 1.00 . A A . 16 LEU HA 1 1 8 5670 1 1 16 LEU HB2 H 0.202 -1.267 -4.231 1.00 . A A . 16 LEU HB2 1 1 8 5671 1 1 16 LEU HB3 H -0.466 -0.407 -2.845 1.00 . A A . 16 LEU HB3 1 1 8 5672 1 1 16 LEU HD11 H 2.076 0.182 -3.895 1.00 . A A . 16 LEU HD11 1 1 8 5673 1 1 16 LEU HD12 H 3.309 -0.264 -2.716 1.00 . A A . 16 LEU HD12 1 1 8 5674 1 1 16 LEU HD13 H 1.962 0.768 -2.235 1.00 . A A . 16 LEU HD13 1 1 8 5675 1 1 16 LEU HD21 H 0.875 -2.311 -0.686 1.00 . A A . 16 LEU HD21 1 1 8 5676 1 1 16 LEU HD22 H 0.529 -0.583 -0.683 1.00 . A A . 16 LEU HD22 1 1 8 5677 1 1 16 LEU HD23 H 2.184 -1.150 -0.475 1.00 . A A . 16 LEU HD23 1 1 8 5678 1 1 16 LEU HG H 1.987 -2.179 -2.785 1.00 . A A . 16 LEU HG 1 1 8 5679 1 1 16 LEU N N 0.078 -3.711 -3.249 1.00 . A A . 16 LEU N 1 1 8 5680 1 1 16 LEU O O -2.993 -2.049 -2.732 1.00 . A A . 16 LEU O 1 1 8 5681 1 1 17 GLU C C -4.327 -4.366 -4.182 1.00 . A A . 17 GLU C 1 1 8 5682 1 1 17 GLU CA C -3.534 -3.355 -5.013 1.00 . A A . 17 GLU CA 1 1 8 5683 1 1 17 GLU CB C -3.374 -3.876 -6.443 1.00 . A A . 17 GLU CB 1 1 8 5684 1 1 17 GLU CD C -5.088 -5.380 -7.464 1.00 . A A . 17 GLU CD 1 1 8 5685 1 1 17 GLU CG C -4.740 -3.929 -7.128 1.00 . A A . 17 GLU CG 1 1 8 5686 1 1 17 GLU H H -1.431 -3.666 -4.827 1.00 . A A . 17 GLU H 1 1 8 5687 1 1 17 GLU HA H -4.028 -2.398 -5.017 1.00 . A A . 17 GLU HA 1 1 8 5688 1 1 17 GLU HB2 H -2.715 -3.221 -6.992 1.00 . A A . 17 GLU HB2 1 1 8 5689 1 1 17 GLU HB3 H -2.947 -4.868 -6.417 1.00 . A A . 17 GLU HB3 1 1 8 5690 1 1 17 GLU HG2 H -5.490 -3.521 -6.466 1.00 . A A . 17 GLU HG2 1 1 8 5691 1 1 17 GLU HG3 H -4.709 -3.348 -8.038 1.00 . A A . 17 GLU HG3 1 1 8 5692 1 1 17 GLU N N -2.202 -3.229 -4.406 1.00 . A A . 17 GLU N 1 1 8 5693 1 1 17 GLU O O -5.545 -4.374 -4.170 1.00 . A A . 17 GLU O 1 1 8 5694 1 1 17 GLU OE1 O -5.465 -6.104 -6.556 1.00 . A A . 17 GLU OE1 1 1 8 5695 1 1 17 GLU OE2 O -4.971 -5.744 -8.622 1.00 . A A . 17 GLU OE2 1 1 8 5696 1 1 18 ASN C C -4.764 -5.651 -1.323 1.00 . A A . 18 ASN C 1 1 8 5697 1 1 18 ASN CA C -4.325 -6.252 -2.654 1.00 . A A . 18 ASN CA 1 1 8 5698 1 1 18 ASN CB C -3.378 -7.426 -2.395 1.00 . A A . 18 ASN CB 1 1 8 5699 1 1 18 ASN CG C -4.157 -8.581 -1.761 1.00 . A A . 18 ASN CG 1 1 8 5700 1 1 18 ASN H H -2.645 -5.185 -3.494 1.00 . A A . 18 ASN H 1 1 8 5701 1 1 18 ASN HA H -5.194 -6.608 -3.187 1.00 . A A . 18 ASN HA 1 1 8 5702 1 1 18 ASN HB2 H -2.946 -7.752 -3.331 1.00 . A A . 18 ASN HB2 1 1 8 5703 1 1 18 ASN HB3 H -2.591 -7.114 -1.724 1.00 . A A . 18 ASN HB3 1 1 8 5704 1 1 18 ASN HD21 H -4.647 -9.398 -3.504 1.00 . A A . 18 ASN HD21 1 1 8 5705 1 1 18 ASN HD22 H -5.224 -10.216 -2.133 1.00 . A A . 18 ASN HD22 1 1 8 5706 1 1 18 ASN N N -3.630 -5.222 -3.478 1.00 . A A . 18 ASN N 1 1 8 5707 1 1 18 ASN ND2 N -4.723 -9.472 -2.530 1.00 . A A . 18 ASN ND2 1 1 8 5708 1 1 18 ASN O O -5.397 -6.305 -0.518 1.00 . A A . 18 ASN O 1 1 8 5709 1 1 18 ASN OD1 O -4.252 -8.674 -0.553 1.00 . A A . 18 ASN OD1 1 1 8 5710 1 1 19 TYR C C -6.001 -2.824 -0.027 1.00 . A A . 19 TYR C 1 1 8 5711 1 1 19 TYR CA C -4.850 -3.804 0.210 1.00 . A A . 19 TYR CA 1 1 8 5712 1 1 19 TYR CB C -3.662 -3.074 0.838 1.00 . A A . 19 TYR CB 1 1 8 5713 1 1 19 TYR CD1 C -2.945 -4.858 2.466 1.00 . A A . 19 TYR CD1 1 1 8 5714 1 1 19 TYR CD2 C -1.443 -4.260 0.656 1.00 . A A . 19 TYR CD2 1 1 8 5715 1 1 19 TYR CE1 C -2.016 -5.801 2.925 1.00 . A A . 19 TYR CE1 1 1 8 5716 1 1 19 TYR CE2 C -0.514 -5.203 1.115 1.00 . A A . 19 TYR CE2 1 1 8 5717 1 1 19 TYR CG C -2.658 -4.088 1.331 1.00 . A A . 19 TYR CG 1 1 8 5718 1 1 19 TYR CZ C -0.801 -5.974 2.250 1.00 . A A . 19 TYR CZ 1 1 8 5719 1 1 19 TYR H H -3.926 -3.899 -1.732 1.00 . A A . 19 TYR H 1 1 8 5720 1 1 19 TYR HA H -5.181 -4.583 0.882 1.00 . A A . 19 TYR HA 1 1 8 5721 1 1 19 TYR HB2 H -3.199 -2.434 0.101 1.00 . A A . 19 TYR HB2 1 1 8 5722 1 1 19 TYR HB3 H -4.007 -2.479 1.669 1.00 . A A . 19 TYR HB3 1 1 8 5723 1 1 19 TYR HD1 H -3.881 -4.725 2.987 1.00 . A A . 19 TYR HD1 1 1 8 5724 1 1 19 TYR HD2 H -1.222 -3.665 -0.217 1.00 . A A . 19 TYR HD2 1 1 8 5725 1 1 19 TYR HE1 H -2.238 -6.395 3.799 1.00 . A A . 19 TYR HE1 1 1 8 5726 1 1 19 TYR HE2 H 0.424 -5.336 0.595 1.00 . A A . 19 TYR HE2 1 1 8 5727 1 1 19 TYR HH H 0.166 -6.821 3.661 1.00 . A A . 19 TYR HH 1 1 8 5728 1 1 19 TYR N N -4.438 -4.418 -1.076 1.00 . A A . 19 TYR N 1 1 8 5729 1 1 19 TYR O O -6.399 -2.104 0.867 1.00 . A A . 19 TYR O 1 1 8 5730 1 1 19 TYR OH O 0.113 -6.902 2.705 1.00 . A A . 19 TYR OH 1 1 8 5731 1 1 20 CYS C C -8.940 -2.373 -0.762 1.00 . A A . 20 CYS C 1 1 8 5732 1 1 20 CYS CA C -7.684 -1.840 -1.453 1.00 . A A . 20 CYS CA 1 1 8 5733 1 1 20 CYS CB C -7.957 -1.691 -2.952 1.00 . A A . 20 CYS CB 1 1 8 5734 1 1 20 CYS H H -6.234 -3.375 -1.932 1.00 . A A . 20 CYS H 1 1 8 5735 1 1 20 CYS HA H -7.432 -0.875 -1.038 1.00 . A A . 20 CYS HA 1 1 8 5736 1 1 20 CYS HB2 H -8.623 -2.474 -3.279 1.00 . A A . 20 CYS HB2 1 1 8 5737 1 1 20 CYS HB3 H -8.418 -0.732 -3.136 1.00 . A A . 20 CYS HB3 1 1 8 5738 1 1 20 CYS N N -6.553 -2.787 -1.215 1.00 . A A . 20 CYS N 1 1 8 5739 1 1 20 CYS O O -8.954 -3.470 -0.240 1.00 . A A . 20 CYS O 1 1 8 5740 1 1 20 CYS SG S -6.405 -1.796 -3.871 1.00 . A A . 20 CYS SG 1 1 8 5741 1 1 21 ASN C C -11.513 -3.529 -0.478 1.00 . A A . 21 ASN C 1 1 8 5742 1 1 21 ASN CA C -11.248 -2.073 -0.090 1.00 . A A . 21 ASN CA 1 1 8 5743 1 1 21 ASN CB C -12.424 -1.204 -0.543 1.00 . A A . 21 ASN CB 1 1 8 5744 1 1 21 ASN CG C -13.716 -1.729 0.084 1.00 . A A . 21 ASN CG 1 1 8 5745 1 1 21 ASN H H -9.967 -0.723 -1.176 1.00 . A A . 21 ASN H 1 1 8 5746 1 1 21 ASN HA H -11.138 -2.000 0.982 1.00 . A A . 21 ASN HA 1 1 8 5747 1 1 21 ASN HB2 H -12.258 -0.183 -0.230 1.00 . A A . 21 ASN HB2 1 1 8 5748 1 1 21 ASN HB3 H -12.507 -1.242 -1.619 1.00 . A A . 21 ASN HB3 1 1 8 5749 1 1 21 ASN HD21 H -14.018 -3.088 -1.332 1.00 . A A . 21 ASN HD21 1 1 8 5750 1 1 21 ASN HD22 H -15.191 -3.046 -0.105 1.00 . A A . 21 ASN HD22 1 1 8 5751 1 1 21 ASN N N -9.997 -1.605 -0.751 1.00 . A A . 21 ASN N 1 1 8 5752 1 1 21 ASN ND2 N -14.362 -2.702 -0.499 1.00 . A A . 21 ASN ND2 1 1 8 5753 1 1 21 ASN O O -11.864 -3.762 -1.623 1.00 . A A . 21 ASN O 1 1 8 5754 1 1 21 ASN OXT O -11.358 -4.386 0.376 1.00 . A A . 21 ASN OXT 1 1 8 5755 1 1 21 ASN OD1 O -14.142 -1.251 1.117 1.00 . A A . 21 ASN OD1 1 1 8 5756 2 2 1 PHE C C 9.395 0.823 -10.744 1.00 . B B . 1 PHE C 1 1 8 5757 2 2 1 PHE CA C 9.318 0.004 -12.036 1.00 . B B . 1 PHE CA 1 1 8 5758 2 2 1 PHE CB C 7.878 -0.459 -12.264 1.00 . B B . 1 PHE CB 1 1 8 5759 2 2 1 PHE CD1 C 7.546 0.390 -14.613 1.00 . B B . 1 PHE CD1 1 1 8 5760 2 2 1 PHE CD2 C 7.553 -2.006 -14.229 1.00 . B B . 1 PHE CD2 1 1 8 5761 2 2 1 PHE CE1 C 7.338 0.170 -15.981 1.00 . B B . 1 PHE CE1 1 1 8 5762 2 2 1 PHE CE2 C 7.344 -2.226 -15.597 1.00 . B B . 1 PHE CE2 1 1 8 5763 2 2 1 PHE CG C 7.654 -0.698 -13.737 1.00 . B B . 1 PHE CG 1 1 8 5764 2 2 1 PHE CZ C 7.237 -1.138 -16.473 1.00 . B B . 1 PHE CZ 1 1 8 5765 2 2 1 PHE H1 H 10.312 -1.452 -10.927 1.00 . B B . 1 PHE H1 1 1 8 5766 2 2 1 PHE H2 H 11.140 -0.961 -12.327 1.00 . B B . 1 PHE H2 1 1 8 5767 2 2 1 PHE H3 H 9.788 -1.982 -12.451 1.00 . B B . 1 PHE H3 1 1 8 5768 2 2 1 PHE HA H 9.635 0.614 -12.868 1.00 . B B . 1 PHE HA 1 1 8 5769 2 2 1 PHE HB2 H 7.705 -1.377 -11.721 1.00 . B B . 1 PHE HB2 1 1 8 5770 2 2 1 PHE HB3 H 7.195 0.300 -11.915 1.00 . B B . 1 PHE HB3 1 1 8 5771 2 2 1 PHE HD1 H 7.624 1.398 -14.234 1.00 . B B . 1 PHE HD1 1 1 8 5772 2 2 1 PHE HD2 H 7.636 -2.845 -13.553 1.00 . B B . 1 PHE HD2 1 1 8 5773 2 2 1 PHE HE1 H 7.255 1.009 -16.656 1.00 . B B . 1 PHE HE1 1 1 8 5774 2 2 1 PHE HE2 H 7.267 -3.235 -15.976 1.00 . B B . 1 PHE HE2 1 1 8 5775 2 2 1 PHE HZ H 7.076 -1.308 -17.527 1.00 . B B . 1 PHE HZ 1 1 8 5776 2 2 1 PHE N N 10.207 -1.187 -11.927 1.00 . B B . 1 PHE N 1 1 8 5777 2 2 1 PHE O O 9.564 2.026 -10.771 1.00 . B B . 1 PHE O 1 1 8 5778 2 2 2 VAL C C 10.323 0.230 -7.380 1.00 . B B . 2 VAL C 1 1 8 5779 2 2 2 VAL CA C 9.342 0.931 -8.323 1.00 . B B . 2 VAL CA 1 1 8 5780 2 2 2 VAL CB C 7.957 0.985 -7.668 1.00 . B B . 2 VAL CB 1 1 8 5781 2 2 2 VAL CG1 C 7.285 2.318 -8.004 1.00 . B B . 2 VAL CG1 1 1 8 5782 2 2 2 VAL CG2 C 7.091 -0.166 -8.187 1.00 . B B . 2 VAL CG2 1 1 8 5783 2 2 2 VAL H H 9.138 -0.787 -9.609 1.00 . B B . 2 VAL H 1 1 8 5784 2 2 2 VAL HA H 9.688 1.937 -8.512 1.00 . B B . 2 VAL HA 1 1 8 5785 2 2 2 VAL HB H 8.065 0.900 -6.596 1.00 . B B . 2 VAL HB 1 1 8 5786 2 2 2 VAL HG11 H 6.618 2.597 -7.202 1.00 . B B . 2 VAL HG11 1 1 8 5787 2 2 2 VAL HG12 H 6.725 2.218 -8.921 1.00 . B B . 2 VAL HG12 1 1 8 5788 2 2 2 VAL HG13 H 8.040 3.081 -8.124 1.00 . B B . 2 VAL HG13 1 1 8 5789 2 2 2 VAL HG21 H 7.494 -1.105 -7.837 1.00 . B B . 2 VAL HG21 1 1 8 5790 2 2 2 VAL HG22 H 7.089 -0.156 -9.267 1.00 . B B . 2 VAL HG22 1 1 8 5791 2 2 2 VAL HG23 H 6.081 -0.050 -7.824 1.00 . B B . 2 VAL HG23 1 1 8 5792 2 2 2 VAL N N 9.273 0.184 -9.612 1.00 . B B . 2 VAL N 1 1 8 5793 2 2 2 VAL O O 11.511 0.479 -7.410 1.00 . B B . 2 VAL O 1 1 8 5794 2 2 3 ASN C C 11.212 -0.340 -4.561 1.00 . B B . 3 ASN C 1 1 8 5795 2 2 3 ASN CA C 10.729 -1.342 -5.598 1.00 . B B . 3 ASN CA 1 1 8 5796 2 2 3 ASN CB C 11.906 -1.914 -6.368 1.00 . B B . 3 ASN CB 1 1 8 5797 2 2 3 ASN CG C 11.448 -2.362 -7.758 1.00 . B B . 3 ASN CG 1 1 8 5798 2 2 3 ASN H H 8.892 -0.823 -6.518 1.00 . B B . 3 ASN H 1 1 8 5799 2 2 3 ASN HA H 10.190 -2.140 -5.110 1.00 . B B . 3 ASN HA 1 1 8 5800 2 2 3 ASN HB2 H 12.670 -1.160 -6.465 1.00 . B B . 3 ASN HB2 1 1 8 5801 2 2 3 ASN HB3 H 12.291 -2.756 -5.834 1.00 . B B . 3 ASN HB3 1 1 8 5802 2 2 3 ASN HD21 H 10.344 -3.860 -7.064 1.00 . B B . 3 ASN HD21 1 1 8 5803 2 2 3 ASN HD22 H 10.349 -3.683 -8.752 1.00 . B B . 3 ASN HD22 1 1 8 5804 2 2 3 ASN N N 9.836 -0.640 -6.537 1.00 . B B . 3 ASN N 1 1 8 5805 2 2 3 ASN ND2 N 10.647 -3.387 -7.867 1.00 . B B . 3 ASN ND2 1 1 8 5806 2 2 3 ASN O O 12.330 0.134 -4.609 1.00 . B B . 3 ASN O 1 1 8 5807 2 2 3 ASN OD1 O 11.823 -1.776 -8.753 1.00 . B B . 3 ASN OD1 1 1 8 5808 2 2 4 GLN C C 9.893 0.842 -1.362 1.00 . B B . 4 GLN C 1 1 8 5809 2 2 4 GLN CA C 10.752 1.011 -2.619 1.00 . B B . 4 GLN CA 1 1 8 5810 2 2 4 GLN CB C 10.528 2.399 -3.211 1.00 . B B . 4 GLN CB 1 1 8 5811 2 2 4 GLN CD C 10.579 4.848 -2.715 1.00 . B B . 4 GLN CD 1 1 8 5812 2 2 4 GLN CG C 10.625 3.448 -2.104 1.00 . B B . 4 GLN CG 1 1 8 5813 2 2 4 GLN H H 9.457 -0.365 -3.636 1.00 . B B . 4 GLN H 1 1 8 5814 2 2 4 GLN HA H 11.795 0.888 -2.368 1.00 . B B . 4 GLN HA 1 1 8 5815 2 2 4 GLN HB2 H 11.278 2.591 -3.966 1.00 . B B . 4 GLN HB2 1 1 8 5816 2 2 4 GLN HB3 H 9.546 2.439 -3.663 1.00 . B B . 4 GLN HB3 1 1 8 5817 2 2 4 GLN HE21 H 11.652 5.668 -1.260 1.00 . B B . 4 GLN HE21 1 1 8 5818 2 2 4 GLN HE22 H 11.156 6.734 -2.485 1.00 . B B . 4 GLN HE22 1 1 8 5819 2 2 4 GLN HG2 H 9.796 3.325 -1.422 1.00 . B B . 4 GLN HG2 1 1 8 5820 2 2 4 GLN HG3 H 11.553 3.320 -1.569 1.00 . B B . 4 GLN HG3 1 1 8 5821 2 2 4 GLN N N 10.361 0.011 -3.640 1.00 . B B . 4 GLN N 1 1 8 5822 2 2 4 GLN NE2 N 11.179 5.832 -2.103 1.00 . B B . 4 GLN NE2 1 1 8 5823 2 2 4 GLN O O 8.891 0.151 -1.367 1.00 . B B . 4 GLN O 1 1 8 5824 2 2 4 GLN OE1 O 9.991 5.050 -3.759 1.00 . B B . 4 GLN OE1 1 1 8 5825 2 2 5 HIS C C 8.137 2.041 0.786 1.00 . B B . 5 HIS C 1 1 8 5826 2 2 5 HIS CA C 9.491 1.358 0.974 1.00 . B B . 5 HIS CA 1 1 8 5827 2 2 5 HIS CB C 10.253 2.035 2.115 1.00 . B B . 5 HIS CB 1 1 8 5828 2 2 5 HIS CD2 C 12.377 0.645 2.740 1.00 . B B . 5 HIS CD2 1 1 8 5829 2 2 5 HIS CE1 C 13.775 1.636 1.405 1.00 . B B . 5 HIS CE1 1 1 8 5830 2 2 5 HIS CG C 11.696 1.619 2.064 1.00 . B B . 5 HIS CG 1 1 8 5831 2 2 5 HIS H H 11.089 2.024 -0.305 1.00 . B B . 5 HIS H 1 1 8 5832 2 2 5 HIS HA H 9.340 0.315 1.210 1.00 . B B . 5 HIS HA 1 1 8 5833 2 2 5 HIS HB2 H 10.182 3.108 2.008 1.00 . B B . 5 HIS HB2 1 1 8 5834 2 2 5 HIS HB3 H 9.825 1.738 3.061 1.00 . B B . 5 HIS HB3 1 1 8 5835 2 2 5 HIS HD2 H 11.954 -0.021 3.478 1.00 . B B . 5 HIS HD2 1 1 8 5836 2 2 5 HIS HE1 H 14.681 1.901 0.880 1.00 . B B . 5 HIS HE1 1 1 8 5837 2 2 5 HIS HE2 H 14.413 0.066 2.632 1.00 . B B . 5 HIS HE2 1 1 8 5838 2 2 5 HIS N N 10.280 1.473 -0.285 1.00 . B B . 5 HIS N 1 1 8 5839 2 2 5 HIS ND1 N 12.593 2.241 1.222 1.00 . B B . 5 HIS ND1 1 1 8 5840 2 2 5 HIS NE2 N 13.692 0.653 2.325 1.00 . B B . 5 HIS NE2 1 1 8 5841 2 2 5 HIS O O 7.827 2.548 -0.274 1.00 . B B . 5 HIS O 1 1 8 5842 2 2 6 LEU C C 5.502 3.170 3.036 1.00 . B B . 6 LEU C 1 1 8 5843 2 2 6 LEU CA C 5.983 2.688 1.674 1.00 . B B . 6 LEU CA 1 1 8 5844 2 2 6 LEU CB C 4.993 1.651 1.148 1.00 . B B . 6 LEU CB 1 1 8 5845 2 2 6 LEU CD1 C 4.045 3.573 -0.136 1.00 . B B . 6 LEU CD1 1 1 8 5846 2 2 6 LEU CD2 C 5.317 1.821 -1.318 1.00 . B B . 6 LEU CD2 1 1 8 5847 2 2 6 LEU CG C 4.359 2.092 -0.173 1.00 . B B . 6 LEU CG 1 1 8 5848 2 2 6 LEU H H 7.583 1.625 2.644 1.00 . B B . 6 LEU H 1 1 8 5849 2 2 6 LEU HA H 6.040 3.522 1.000 1.00 . B B . 6 LEU HA 1 1 8 5850 2 2 6 LEU HB2 H 5.516 0.732 0.989 1.00 . B B . 6 LEU HB2 1 1 8 5851 2 2 6 LEU HB3 H 4.217 1.498 1.882 1.00 . B B . 6 LEU HB3 1 1 8 5852 2 2 6 LEU HD11 H 3.280 3.789 -0.863 1.00 . B B . 6 LEU HD11 1 1 8 5853 2 2 6 LEU HD12 H 4.936 4.138 -0.369 1.00 . B B . 6 LEU HD12 1 1 8 5854 2 2 6 LEU HD13 H 3.697 3.834 0.845 1.00 . B B . 6 LEU HD13 1 1 8 5855 2 2 6 LEU HD21 H 4.758 1.472 -2.172 1.00 . B B . 6 LEU HD21 1 1 8 5856 2 2 6 LEU HD22 H 6.029 1.071 -1.017 1.00 . B B . 6 LEU HD22 1 1 8 5857 2 2 6 LEU HD23 H 5.833 2.734 -1.572 1.00 . B B . 6 LEU HD23 1 1 8 5858 2 2 6 LEU HG H 3.445 1.539 -0.332 1.00 . B B . 6 LEU HG 1 1 8 5859 2 2 6 LEU N N 7.321 2.049 1.803 1.00 . B B . 6 LEU N 1 1 8 5860 2 2 6 LEU O O 5.810 2.593 4.057 1.00 . B B . 6 LEU O 1 1 8 5861 2 2 7 CYS C C 3.609 6.115 4.148 1.00 . B B . 7 CYS C 1 1 8 5862 2 2 7 CYS CA C 4.208 4.719 4.344 1.00 . B B . 7 CYS CA 1 1 8 5863 2 2 7 CYS CB C 5.342 4.781 5.368 1.00 . B B . 7 CYS CB 1 1 8 5864 2 2 7 CYS H H 4.482 4.656 2.224 1.00 . B B . 7 CYS H 1 1 8 5865 2 2 7 CYS HA H 3.445 4.045 4.691 1.00 . B B . 7 CYS HA 1 1 8 5866 2 2 7 CYS HB2 H 6.285 4.602 4.873 1.00 . B B . 7 CYS HB2 1 1 8 5867 2 2 7 CYS HB3 H 5.358 5.754 5.828 1.00 . B B . 7 CYS HB3 1 1 8 5868 2 2 7 CYS N N 4.730 4.215 3.056 1.00 . B B . 7 CYS N 1 1 8 5869 2 2 7 CYS O O 3.994 6.853 3.260 1.00 . B B . 7 CYS O 1 1 8 5870 2 2 7 CYS SG S 5.077 3.519 6.637 1.00 . B B . 7 CYS SG 1 1 8 5871 2 2 8 GLY C C 1.446 7.994 3.447 1.00 . B B . 8 GLY C 1 1 8 5872 2 2 8 GLY CA C 2.039 7.826 4.848 1.00 . B B . 8 GLY CA 1 1 8 5873 2 2 8 GLY H H 2.373 5.870 5.682 1.00 . B B . 8 GLY H 1 1 8 5874 2 2 8 GLY HA2 H 1.256 7.927 5.586 1.00 . B B . 8 GLY HA2 1 1 8 5875 2 2 8 GLY HA3 H 2.787 8.587 5.010 1.00 . B B . 8 GLY HA3 1 1 8 5876 2 2 8 GLY N N 2.667 6.481 4.974 1.00 . B B . 8 GLY N 1 1 8 5877 2 2 8 GLY O O 0.932 7.061 2.859 1.00 . B B . 8 GLY O 1 1 8 5878 2 2 9 SER C C 1.485 8.362 0.591 1.00 . B B . 9 SER C 1 1 8 5879 2 2 9 SER CA C 0.950 9.417 1.551 1.00 . B B . 9 SER CA 1 1 8 5880 2 2 9 SER CB C 1.363 10.805 1.061 1.00 . B B . 9 SER CB 1 1 8 5881 2 2 9 SER H H 1.926 9.920 3.403 1.00 . B B . 9 SER H 1 1 8 5882 2 2 9 SER HA H -0.121 9.353 1.590 1.00 . B B . 9 SER HA 1 1 8 5883 2 2 9 SER HB2 H 2.412 10.959 1.253 1.00 . B B . 9 SER HB2 1 1 8 5884 2 2 9 SER HB3 H 1.180 10.878 -0.003 1.00 . B B . 9 SER HB3 1 1 8 5885 2 2 9 SER HG H 1.045 11.959 2.593 1.00 . B B . 9 SER HG 1 1 8 5886 2 2 9 SER N N 1.510 9.181 2.910 1.00 . B B . 9 SER N 1 1 8 5887 2 2 9 SER O O 0.759 7.806 -0.206 1.00 . B B . 9 SER O 1 1 8 5888 2 2 9 SER OG O 0.611 11.791 1.754 1.00 . B B . 9 SER OG 1 1 8 5889 2 2 10 ASP C C 2.427 5.828 -0.256 1.00 . B B . 10 ASP C 1 1 8 5890 2 2 10 ASP CA C 3.330 7.054 -0.244 1.00 . B B . 10 ASP CA 1 1 8 5891 2 2 10 ASP CB C 4.720 6.648 0.256 1.00 . B B . 10 ASP CB 1 1 8 5892 2 2 10 ASP CG C 5.587 7.895 0.438 1.00 . B B . 10 ASP CG 1 1 8 5893 2 2 10 ASP H H 3.311 8.534 1.322 1.00 . B B . 10 ASP H 1 1 8 5894 2 2 10 ASP HA H 3.410 7.453 -1.243 1.00 . B B . 10 ASP HA 1 1 8 5895 2 2 10 ASP HB2 H 4.625 6.135 1.200 1.00 . B B . 10 ASP HB2 1 1 8 5896 2 2 10 ASP HB3 H 5.185 5.989 -0.464 1.00 . B B . 10 ASP HB3 1 1 8 5897 2 2 10 ASP N N 2.748 8.078 0.665 1.00 . B B . 10 ASP N 1 1 8 5898 2 2 10 ASP O O 1.992 5.372 -1.295 1.00 . B B . 10 ASP O 1 1 8 5899 2 2 10 ASP OD1 O 5.471 8.526 1.476 1.00 . B B . 10 ASP OD1 1 1 8 5900 2 2 10 ASP OD2 O 6.355 8.196 -0.461 1.00 . B B . 10 ASP OD2 1 1 8 5901 2 2 11 LEU C C 0.017 4.300 0.178 1.00 . B B . 11 LEU C 1 1 8 5902 2 2 11 LEU CA C 1.312 4.056 0.953 1.00 . B B . 11 LEU CA 1 1 8 5903 2 2 11 LEU CB C 0.999 3.729 2.418 1.00 . B B . 11 LEU CB 1 1 8 5904 2 2 11 LEU CD1 C 1.396 1.349 1.701 1.00 . B B . 11 LEU CD1 1 1 8 5905 2 2 11 LEU CD2 C 0.655 1.852 4.024 1.00 . B B . 11 LEU CD2 1 1 8 5906 2 2 11 LEU CG C 0.531 2.274 2.560 1.00 . B B . 11 LEU CG 1 1 8 5907 2 2 11 LEU H H 2.539 5.649 1.715 1.00 . B B . 11 LEU H 1 1 8 5908 2 2 11 LEU HA H 1.850 3.230 0.505 1.00 . B B . 11 LEU HA 1 1 8 5909 2 2 11 LEU HB2 H 1.888 3.877 3.014 1.00 . B B . 11 LEU HB2 1 1 8 5910 2 2 11 LEU HB3 H 0.220 4.389 2.772 1.00 . B B . 11 LEU HB3 1 1 8 5911 2 2 11 LEU HD11 H 1.416 0.362 2.141 1.00 . B B . 11 LEU HD11 1 1 8 5912 2 2 11 LEU HD12 H 2.400 1.740 1.650 1.00 . B B . 11 LEU HD12 1 1 8 5913 2 2 11 LEU HD13 H 0.982 1.290 0.704 1.00 . B B . 11 LEU HD13 1 1 8 5914 2 2 11 LEU HD21 H -0.270 1.400 4.347 1.00 . B B . 11 LEU HD21 1 1 8 5915 2 2 11 LEU HD22 H 0.864 2.720 4.632 1.00 . B B . 11 LEU HD22 1 1 8 5916 2 2 11 LEU HD23 H 1.460 1.139 4.126 1.00 . B B . 11 LEU HD23 1 1 8 5917 2 2 11 LEU HG H -0.501 2.196 2.248 1.00 . B B . 11 LEU HG 1 1 8 5918 2 2 11 LEU N N 2.162 5.274 0.893 1.00 . B B . 11 LEU N 1 1 8 5919 2 2 11 LEU O O -0.320 3.555 -0.720 1.00 . B B . 11 LEU O 1 1 8 5920 2 2 12 VAL C C -1.630 5.979 -1.685 1.00 . B B . 12 VAL C 1 1 8 5921 2 2 12 VAL CA C -1.974 5.603 -0.244 1.00 . B B . 12 VAL CA 1 1 8 5922 2 2 12 VAL CB C -2.765 6.730 0.440 1.00 . B B . 12 VAL CB 1 1 8 5923 2 2 12 VAL CG1 C -2.537 6.655 1.947 1.00 . B B . 12 VAL CG1 1 1 8 5924 2 2 12 VAL CG2 C -2.308 8.102 -0.069 1.00 . B B . 12 VAL CG2 1 1 8 5925 2 2 12 VAL H H -0.424 5.939 1.221 1.00 . B B . 12 VAL H 1 1 8 5926 2 2 12 VAL HA H -2.572 4.703 -0.251 1.00 . B B . 12 VAL HA 1 1 8 5927 2 2 12 VAL HB H -3.819 6.600 0.234 1.00 . B B . 12 VAL HB 1 1 8 5928 2 2 12 VAL HG11 H -2.209 5.660 2.211 1.00 . B B . 12 VAL HG11 1 1 8 5929 2 2 12 VAL HG12 H -3.458 6.880 2.462 1.00 . B B . 12 VAL HG12 1 1 8 5930 2 2 12 VAL HG13 H -1.780 7.370 2.231 1.00 . B B . 12 VAL HG13 1 1 8 5931 2 2 12 VAL HG21 H -1.293 8.034 -0.425 1.00 . B B . 12 VAL HG21 1 1 8 5932 2 2 12 VAL HG22 H -2.360 8.820 0.736 1.00 . B B . 12 VAL HG22 1 1 8 5933 2 2 12 VAL HG23 H -2.952 8.419 -0.875 1.00 . B B . 12 VAL HG23 1 1 8 5934 2 2 12 VAL N N -0.710 5.338 0.502 1.00 . B B . 12 VAL N 1 1 8 5935 2 2 12 VAL O O -2.369 5.692 -2.606 1.00 . B B . 12 VAL O 1 1 8 5936 2 2 13 GLU C C -0.196 5.708 -4.135 1.00 . B B . 13 GLU C 1 1 8 5937 2 2 13 GLU CA C -0.108 6.971 -3.275 1.00 . B B . 13 GLU CA 1 1 8 5938 2 2 13 GLU CB C 1.325 7.547 -3.253 1.00 . B B . 13 GLU CB 1 1 8 5939 2 2 13 GLU CD C 3.609 7.452 -4.283 1.00 . B B . 13 GLU CD 1 1 8 5940 2 2 13 GLU CG C 2.282 6.708 -4.113 1.00 . B B . 13 GLU CG 1 1 8 5941 2 2 13 GLU H H 0.088 6.813 -1.139 1.00 . B B . 13 GLU H 1 1 8 5942 2 2 13 GLU HA H -0.793 7.714 -3.657 1.00 . B B . 13 GLU HA 1 1 8 5943 2 2 13 GLU HB2 H 1.304 8.558 -3.630 1.00 . B B . 13 GLU HB2 1 1 8 5944 2 2 13 GLU HB3 H 1.683 7.558 -2.234 1.00 . B B . 13 GLU HB3 1 1 8 5945 2 2 13 GLU HG2 H 2.461 5.758 -3.629 1.00 . B B . 13 GLU HG2 1 1 8 5946 2 2 13 GLU HG3 H 1.840 6.539 -5.084 1.00 . B B . 13 GLU HG3 1 1 8 5947 2 2 13 GLU N N -0.503 6.602 -1.891 1.00 . B B . 13 GLU N 1 1 8 5948 2 2 13 GLU O O -0.515 5.755 -5.307 1.00 . B B . 13 GLU O 1 1 8 5949 2 2 13 GLU OE1 O 3.918 8.272 -3.435 1.00 . B B . 13 GLU OE1 1 1 8 5950 2 2 13 GLU OE2 O 4.293 7.188 -5.258 1.00 . B B . 13 GLU OE2 1 1 8 5951 2 2 14 ALA C C -1.416 2.737 -4.150 1.00 . B B . 14 ALA C 1 1 8 5952 2 2 14 ALA CA C -0.005 3.299 -4.294 1.00 . B B . 14 ALA CA 1 1 8 5953 2 2 14 ALA CB C 1.004 2.305 -3.718 1.00 . B B . 14 ALA CB 1 1 8 5954 2 2 14 ALA H H 0.313 4.569 -2.593 1.00 . B B . 14 ALA H 1 1 8 5955 2 2 14 ALA HA H 0.212 3.475 -5.337 1.00 . B B . 14 ALA HA 1 1 8 5956 2 2 14 ALA HB1 H 0.517 1.355 -3.551 1.00 . B B . 14 ALA HB1 1 1 8 5957 2 2 14 ALA HB2 H 1.385 2.684 -2.781 1.00 . B B . 14 ALA HB2 1 1 8 5958 2 2 14 ALA HB3 H 1.819 2.176 -4.413 1.00 . B B . 14 ALA HB3 1 1 8 5959 2 2 14 ALA N N 0.072 4.577 -3.543 1.00 . B B . 14 ALA N 1 1 8 5960 2 2 14 ALA O O -2.038 2.343 -5.114 1.00 . B B . 14 ALA O 1 1 8 5961 2 2 15 LEU C C -4.237 2.916 -3.742 1.00 . B B . 15 LEU C 1 1 8 5962 2 2 15 LEU CA C -3.315 2.189 -2.766 1.00 . B B . 15 LEU CA 1 1 8 5963 2 2 15 LEU CB C -3.772 2.459 -1.329 1.00 . B B . 15 LEU CB 1 1 8 5964 2 2 15 LEU CD1 C -3.543 1.511 0.973 1.00 . B B . 15 LEU CD1 1 1 8 5965 2 2 15 LEU CD2 C -2.221 0.489 -0.893 1.00 . B B . 15 LEU CD2 1 1 8 5966 2 2 15 LEU CG C -2.802 1.803 -0.328 1.00 . B B . 15 LEU CG 1 1 8 5967 2 2 15 LEU H H -1.427 3.042 -2.184 1.00 . B B . 15 LEU H 1 1 8 5968 2 2 15 LEU HA H -3.330 1.128 -2.963 1.00 . B B . 15 LEU HA 1 1 8 5969 2 2 15 LEU HB2 H -3.785 3.527 -1.161 1.00 . B B . 15 LEU HB2 1 1 8 5970 2 2 15 LEU HB3 H -4.773 2.067 -1.183 1.00 . B B . 15 LEU HB3 1 1 8 5971 2 2 15 LEU HD11 H -4.185 2.346 1.215 1.00 . B B . 15 LEU HD11 1 1 8 5972 2 2 15 LEU HD12 H -2.828 1.365 1.769 1.00 . B B . 15 LEU HD12 1 1 8 5973 2 2 15 LEU HD13 H -4.140 0.620 0.855 1.00 . B B . 15 LEU HD13 1 1 8 5974 2 2 15 LEU HD21 H -3.024 -0.159 -1.211 1.00 . B B . 15 LEU HD21 1 1 8 5975 2 2 15 LEU HD22 H -1.641 -0.009 -0.127 1.00 . B B . 15 LEU HD22 1 1 8 5976 2 2 15 LEU HD23 H -1.581 0.710 -1.736 1.00 . B B . 15 LEU HD23 1 1 8 5977 2 2 15 LEU HG H -1.995 2.489 -0.123 1.00 . B B . 15 LEU HG 1 1 8 5978 2 2 15 LEU N N -1.937 2.710 -2.953 1.00 . B B . 15 LEU N 1 1 8 5979 2 2 15 LEU O O -5.092 2.323 -4.370 1.00 . B B . 15 LEU O 1 1 8 5980 2 2 16 TYR C C -4.574 4.564 -6.255 1.00 . B B . 16 TYR C 1 1 8 5981 2 2 16 TYR CA C -4.910 4.977 -4.821 1.00 . B B . 16 TYR CA 1 1 8 5982 2 2 16 TYR CB C -4.629 6.472 -4.652 1.00 . B B . 16 TYR CB 1 1 8 5983 2 2 16 TYR CD1 C -6.406 7.365 -3.105 1.00 . B B . 16 TYR CD1 1 1 8 5984 2 2 16 TYR CD2 C -6.646 7.730 -5.492 1.00 . B B . 16 TYR CD2 1 1 8 5985 2 2 16 TYR CE1 C -7.610 8.046 -2.880 1.00 . B B . 16 TYR CE1 1 1 8 5986 2 2 16 TYR CE2 C -7.850 8.411 -5.268 1.00 . B B . 16 TYR CE2 1 1 8 5987 2 2 16 TYR CG C -5.924 7.207 -4.410 1.00 . B B . 16 TYR CG 1 1 8 5988 2 2 16 TYR CZ C -8.332 8.569 -3.962 1.00 . B B . 16 TYR CZ 1 1 8 5989 2 2 16 TYR H H -3.359 4.657 -3.362 1.00 . B B . 16 TYR H 1 1 8 5990 2 2 16 TYR HA H -5.952 4.779 -4.619 1.00 . B B . 16 TYR HA 1 1 8 5991 2 2 16 TYR HB2 H -3.964 6.623 -3.815 1.00 . B B . 16 TYR HB2 1 1 8 5992 2 2 16 TYR HB3 H -4.166 6.853 -5.548 1.00 . B B . 16 TYR HB3 1 1 8 5993 2 2 16 TYR HD1 H -5.849 6.963 -2.272 1.00 . B B . 16 TYR HD1 1 1 8 5994 2 2 16 TYR HD2 H -6.274 7.608 -6.499 1.00 . B B . 16 TYR HD2 1 1 8 5995 2 2 16 TYR HE1 H -7.981 8.168 -1.874 1.00 . B B . 16 TYR HE1 1 1 8 5996 2 2 16 TYR HE2 H -8.407 8.814 -6.102 1.00 . B B . 16 TYR HE2 1 1 8 5997 2 2 16 TYR HH H -9.767 9.676 -4.558 1.00 . B B . 16 TYR HH 1 1 8 5998 2 2 16 TYR N N -4.060 4.202 -3.878 1.00 . B B . 16 TYR N 1 1 8 5999 2 2 16 TYR O O -5.445 4.274 -7.050 1.00 . B B . 16 TYR O 1 1 8 6000 2 2 16 TYR OH O -9.517 9.238 -3.741 1.00 . B B . 16 TYR OH 1 1 8 6001 2 2 17 LEU C C -3.220 2.685 -8.221 1.00 . B B . 17 LEU C 1 1 8 6002 2 2 17 LEU CA C -2.904 4.159 -7.971 1.00 . B B . 17 LEU CA 1 1 8 6003 2 2 17 LEU CB C -1.399 4.394 -8.139 1.00 . B B . 17 LEU CB 1 1 8 6004 2 2 17 LEU CD1 C -1.885 4.401 -10.592 1.00 . B B . 17 LEU CD1 1 1 8 6005 2 2 17 LEU CD2 C 0.479 4.365 -9.787 1.00 . B B . 17 LEU CD2 1 1 8 6006 2 2 17 LEU CG C -0.944 3.876 -9.506 1.00 . B B . 17 LEU CG 1 1 8 6007 2 2 17 LEU H H -2.628 4.785 -5.929 1.00 . B B . 17 LEU H 1 1 8 6008 2 2 17 LEU HA H -3.441 4.761 -8.677 1.00 . B B . 17 LEU HA 1 1 8 6009 2 2 17 LEU HB2 H -1.190 5.452 -8.067 1.00 . B B . 17 LEU HB2 1 1 8 6010 2 2 17 LEU HB3 H -0.864 3.868 -7.362 1.00 . B B . 17 LEU HB3 1 1 8 6011 2 2 17 LEU HD11 H -2.039 5.461 -10.454 1.00 . B B . 17 LEU HD11 1 1 8 6012 2 2 17 LEU HD12 H -2.833 3.888 -10.526 1.00 . B B . 17 LEU HD12 1 1 8 6013 2 2 17 LEU HD13 H -1.447 4.224 -11.563 1.00 . B B . 17 LEU HD13 1 1 8 6014 2 2 17 LEU HD21 H 0.889 3.818 -10.622 1.00 . B B . 17 LEU HD21 1 1 8 6015 2 2 17 LEU HD22 H 1.094 4.202 -8.914 1.00 . B B . 17 LEU HD22 1 1 8 6016 2 2 17 LEU HD23 H 0.458 5.419 -10.021 1.00 . B B . 17 LEU HD23 1 1 8 6017 2 2 17 LEU HG H -0.962 2.795 -9.506 1.00 . B B . 17 LEU HG 1 1 8 6018 2 2 17 LEU N N -3.311 4.542 -6.589 1.00 . B B . 17 LEU N 1 1 8 6019 2 2 17 LEU O O -3.833 2.327 -9.207 1.00 . B B . 17 LEU O 1 1 8 6020 2 2 18 VAL C C -4.572 0.171 -7.708 1.00 . B B . 18 VAL C 1 1 8 6021 2 2 18 VAL CA C -3.079 0.375 -7.513 1.00 . B B . 18 VAL CA 1 1 8 6022 2 2 18 VAL CB C -2.624 -0.402 -6.277 1.00 . B B . 18 VAL CB 1 1 8 6023 2 2 18 VAL CG1 C -1.214 0.021 -5.903 1.00 . B B . 18 VAL CG1 1 1 8 6024 2 2 18 VAL CG2 C -3.558 -0.113 -5.104 1.00 . B B . 18 VAL CG2 1 1 8 6025 2 2 18 VAL H H -2.319 2.147 -6.550 1.00 . B B . 18 VAL H 1 1 8 6026 2 2 18 VAL HA H -2.551 0.013 -8.380 1.00 . B B . 18 VAL HA 1 1 8 6027 2 2 18 VAL HB H -2.634 -1.458 -6.494 1.00 . B B . 18 VAL HB 1 1 8 6028 2 2 18 VAL HG11 H -1.192 0.300 -4.861 1.00 . B B . 18 VAL HG11 1 1 8 6029 2 2 18 VAL HG12 H -0.921 0.863 -6.510 1.00 . B B . 18 VAL HG12 1 1 8 6030 2 2 18 VAL HG13 H -0.539 -0.802 -6.071 1.00 . B B . 18 VAL HG13 1 1 8 6031 2 2 18 VAL HG21 H -3.634 0.954 -4.961 1.00 . B B . 18 VAL HG21 1 1 8 6032 2 2 18 VAL HG22 H -3.159 -0.568 -4.209 1.00 . B B . 18 VAL HG22 1 1 8 6033 2 2 18 VAL HG23 H -4.535 -0.522 -5.311 1.00 . B B . 18 VAL HG23 1 1 8 6034 2 2 18 VAL N N -2.807 1.830 -7.334 1.00 . B B . 18 VAL N 1 1 8 6035 2 2 18 VAL O O -5.003 -0.684 -8.456 1.00 . B B . 18 VAL O 1 1 8 6036 2 2 19 CYS C C -7.461 2.156 -7.475 1.00 . B B . 19 CYS C 1 1 8 6037 2 2 19 CYS CA C -6.831 0.794 -7.180 1.00 . B B . 19 CYS CA 1 1 8 6038 2 2 19 CYS CB C -7.400 0.218 -5.888 1.00 . B B . 19 CYS CB 1 1 8 6039 2 2 19 CYS H H -4.998 1.628 -6.435 1.00 . B B . 19 CYS H 1 1 8 6040 2 2 19 CYS HA H -7.033 0.117 -7.993 1.00 . B B . 19 CYS HA 1 1 8 6041 2 2 19 CYS HB2 H -6.978 0.740 -5.043 1.00 . B B . 19 CYS HB2 1 1 8 6042 2 2 19 CYS HB3 H -8.469 0.331 -5.884 1.00 . B B . 19 CYS HB3 1 1 8 6043 2 2 19 CYS N N -5.367 0.947 -7.036 1.00 . B B . 19 CYS N 1 1 8 6044 2 2 19 CYS O O -7.911 2.414 -8.573 1.00 . B B . 19 CYS O 1 1 8 6045 2 2 19 CYS SG S -6.974 -1.538 -5.789 1.00 . B B . 19 CYS SG 1 1 8 6046 2 2 20 GLY C C -9.409 4.524 -6.024 1.00 . B B . 20 GLY C 1 1 8 6047 2 2 20 GLY CA C -8.074 4.383 -6.758 1.00 . B B . 20 GLY CA 1 1 8 6048 2 2 20 GLY H H -7.107 2.818 -5.635 1.00 . B B . 20 GLY H 1 1 8 6049 2 2 20 GLY HA2 H -7.389 5.141 -6.405 1.00 . B B . 20 GLY HA2 1 1 8 6050 2 2 20 GLY HA3 H -8.236 4.513 -7.817 1.00 . B B . 20 GLY HA3 1 1 8 6051 2 2 20 GLY N N -7.485 3.036 -6.512 1.00 . B B . 20 GLY N 1 1 8 6052 2 2 20 GLY O O -9.463 4.570 -4.811 1.00 . B B . 20 GLY O 1 1 8 6053 2 2 21 GLU C C -12.197 3.510 -5.332 1.00 . B B . 21 GLU C 1 1 8 6054 2 2 21 GLU CA C -11.822 4.774 -6.111 1.00 . B B . 21 GLU CA 1 1 8 6055 2 2 21 GLU CB C -12.875 5.031 -7.191 1.00 . B B . 21 GLU CB 1 1 8 6056 2 2 21 GLU CD C -14.865 6.212 -6.248 1.00 . B B . 21 GLU CD 1 1 8 6057 2 2 21 GLU CG C -13.525 6.397 -6.961 1.00 . B B . 21 GLU CG 1 1 8 6058 2 2 21 GLU H H -10.417 4.589 -7.732 1.00 . B B . 21 GLU H 1 1 8 6059 2 2 21 GLU HA H -11.794 5.615 -5.435 1.00 . B B . 21 GLU HA 1 1 8 6060 2 2 21 GLU HB2 H -12.404 5.014 -8.163 1.00 . B B . 21 GLU HB2 1 1 8 6061 2 2 21 GLU HB3 H -13.633 4.263 -7.145 1.00 . B B . 21 GLU HB3 1 1 8 6062 2 2 21 GLU HG2 H -12.873 7.008 -6.352 1.00 . B B . 21 GLU HG2 1 1 8 6063 2 2 21 GLU HG3 H -13.689 6.882 -7.912 1.00 . B B . 21 GLU HG3 1 1 8 6064 2 2 21 GLU N N -10.487 4.613 -6.755 1.00 . B B . 21 GLU N 1 1 8 6065 2 2 21 GLU O O -13.162 3.495 -4.593 1.00 . B B . 21 GLU O 1 1 8 6066 2 2 21 GLU OE1 O -14.869 6.202 -5.028 1.00 . B B . 21 GLU OE1 1 1 8 6067 2 2 21 GLU OE2 O -15.866 6.083 -6.934 1.00 . B B . 21 GLU OE2 1 1 8 6068 2 2 22 ARG C C -11.573 1.417 -3.250 1.00 . B B . 22 ARG C 1 1 8 6069 2 2 22 ARG CA C -11.795 1.201 -4.749 1.00 . B B . 22 ARG CA 1 1 8 6070 2 2 22 ARG CB C -10.913 0.057 -5.248 1.00 . B B . 22 ARG CB 1 1 8 6071 2 2 22 ARG CD C -11.947 -2.131 -4.631 1.00 . B B . 22 ARG CD 1 1 8 6072 2 2 22 ARG CG C -11.799 -1.089 -5.739 1.00 . B B . 22 ARG CG 1 1 8 6073 2 2 22 ARG CZ C -11.273 -4.454 -4.513 1.00 . B B . 22 ARG CZ 1 1 8 6074 2 2 22 ARG H H -10.680 2.469 -6.087 1.00 . B B . 22 ARG H 1 1 8 6075 2 2 22 ARG HA H -12.832 0.954 -4.924 1.00 . B B . 22 ARG HA 1 1 8 6076 2 2 22 ARG HB2 H -10.297 0.409 -6.062 1.00 . B B . 22 ARG HB2 1 1 8 6077 2 2 22 ARG HB3 H -10.284 -0.294 -4.444 1.00 . B B . 22 ARG HB3 1 1 8 6078 2 2 22 ARG HD2 H -11.760 -1.667 -3.673 1.00 . B B . 22 ARG HD2 1 1 8 6079 2 2 22 ARG HD3 H -12.949 -2.533 -4.646 1.00 . B B . 22 ARG HD3 1 1 8 6080 2 2 22 ARG HE H -10.092 -3.037 -5.247 1.00 . B B . 22 ARG HE 1 1 8 6081 2 2 22 ARG HG2 H -12.772 -0.702 -6.005 1.00 . B B . 22 ARG HG2 1 1 8 6082 2 2 22 ARG HG3 H -11.346 -1.550 -6.605 1.00 . B B . 22 ARG HG3 1 1 8 6083 2 2 22 ARG HH11 H -13.127 -4.357 -5.262 1.00 . B B . 22 ARG HH11 1 1 8 6084 2 2 22 ARG HH12 H -12.692 -5.866 -4.531 1.00 . B B . 22 ARG HH12 1 1 8 6085 2 2 22 ARG HH21 H -9.490 -4.832 -3.684 1.00 . B B . 22 ARG HH21 1 1 8 6086 2 2 22 ARG HH22 H -10.628 -6.137 -3.640 1.00 . B B . 22 ARG HH22 1 1 8 6087 2 2 22 ARG N N -11.455 2.448 -5.487 1.00 . B B . 22 ARG N 1 1 8 6088 2 2 22 ARG NE N -10.967 -3.231 -4.850 1.00 . B B . 22 ARG NE 1 1 8 6089 2 2 22 ARG NH1 N -12.456 -4.930 -4.790 1.00 . B B . 22 ARG NH1 1 1 8 6090 2 2 22 ARG NH2 N -10.396 -5.199 -3.897 1.00 . B B . 22 ARG NH2 1 1 8 6091 2 2 22 ARG O O -12.002 0.630 -2.430 1.00 . B B . 22 ARG O 1 1 8 6092 2 2 23 GLY C C -9.623 1.798 -0.887 1.00 . B B . 23 GLY C 1 1 8 6093 2 2 23 GLY CA C -10.680 2.758 -1.439 1.00 . B B . 23 GLY CA 1 1 8 6094 2 2 23 GLY H H -10.586 3.111 -3.563 1.00 . B B . 23 GLY H 1 1 8 6095 2 2 23 GLY HA2 H -10.339 3.776 -1.318 1.00 . B B . 23 GLY HA2 1 1 8 6096 2 2 23 GLY HA3 H -11.601 2.621 -0.893 1.00 . B B . 23 GLY HA3 1 1 8 6097 2 2 23 GLY N N -10.916 2.484 -2.885 1.00 . B B . 23 GLY N 1 1 8 6098 2 2 23 GLY O O -9.144 0.919 -1.575 1.00 . B B . 23 GLY O 1 1 8 6099 2 2 24 PHE C C -8.446 1.022 2.481 1.00 . B B . 24 PHE C 1 1 8 6100 2 2 24 PHE CA C -8.233 1.067 0.965 1.00 . B B . 24 PHE CA 1 1 8 6101 2 2 24 PHE CB C -6.826 1.594 0.657 1.00 . B B . 24 PHE CB 1 1 8 6102 2 2 24 PHE CD1 C -7.285 3.589 -0.818 1.00 . B B . 24 PHE CD1 1 1 8 6103 2 2 24 PHE CD2 C -6.503 3.968 1.448 1.00 . B B . 24 PHE CD2 1 1 8 6104 2 2 24 PHE CE1 C -7.326 4.972 -1.036 1.00 . B B . 24 PHE CE1 1 1 8 6105 2 2 24 PHE CE2 C -6.542 5.353 1.229 1.00 . B B . 24 PHE CE2 1 1 8 6106 2 2 24 PHE CG C -6.873 3.087 0.424 1.00 . B B . 24 PHE CG 1 1 8 6107 2 2 24 PHE CZ C -6.954 5.854 -0.014 1.00 . B B . 24 PHE CZ 1 1 8 6108 2 2 24 PHE H H -9.659 2.679 0.890 1.00 . B B . 24 PHE H 1 1 8 6109 2 2 24 PHE HA H -8.341 0.072 0.558 1.00 . B B . 24 PHE HA 1 1 8 6110 2 2 24 PHE HB2 H -6.173 1.382 1.491 1.00 . B B . 24 PHE HB2 1 1 8 6111 2 2 24 PHE HB3 H -6.446 1.106 -0.229 1.00 . B B . 24 PHE HB3 1 1 8 6112 2 2 24 PHE HD1 H -7.572 2.909 -1.607 1.00 . B B . 24 PHE HD1 1 1 8 6113 2 2 24 PHE HD2 H -6.186 3.581 2.405 1.00 . B B . 24 PHE HD2 1 1 8 6114 2 2 24 PHE HE1 H -7.645 5.358 -1.992 1.00 . B B . 24 PHE HE1 1 1 8 6115 2 2 24 PHE HE2 H -6.259 6.032 2.020 1.00 . B B . 24 PHE HE2 1 1 8 6116 2 2 24 PHE HZ H -6.981 6.920 -0.187 1.00 . B B . 24 PHE HZ 1 1 8 6117 2 2 24 PHE N N -9.257 1.963 0.355 1.00 . B B . 24 PHE N 1 1 8 6118 2 2 24 PHE O O -9.236 1.767 3.026 1.00 . B B . 24 PHE O 1 1 8 6119 2 2 25 PHE C C -6.638 0.469 5.356 1.00 . B B . 25 PHE C 1 1 8 6120 2 2 25 PHE CA C -7.933 0.064 4.647 1.00 . B B . 25 PHE CA 1 1 8 6121 2 2 25 PHE CB C -8.297 -1.372 5.033 1.00 . B B . 25 PHE CB 1 1 8 6122 2 2 25 PHE CD1 C -9.001 -0.330 7.220 1.00 . B B . 25 PHE CD1 1 1 8 6123 2 2 25 PHE CD2 C -10.087 -2.377 6.498 1.00 . B B . 25 PHE CD2 1 1 8 6124 2 2 25 PHE CE1 C -9.791 -0.319 8.377 1.00 . B B . 25 PHE CE1 1 1 8 6125 2 2 25 PHE CE2 C -10.877 -2.366 7.655 1.00 . B B . 25 PHE CE2 1 1 8 6126 2 2 25 PHE CG C -9.149 -1.359 6.280 1.00 . B B . 25 PHE CG 1 1 8 6127 2 2 25 PHE CZ C -10.729 -1.337 8.595 1.00 . B B . 25 PHE CZ 1 1 8 6128 2 2 25 PHE H H -7.125 -0.445 2.712 1.00 . B B . 25 PHE H 1 1 8 6129 2 2 25 PHE HA H -8.728 0.728 4.951 1.00 . B B . 25 PHE HA 1 1 8 6130 2 2 25 PHE HB2 H -8.846 -1.834 4.226 1.00 . B B . 25 PHE HB2 1 1 8 6131 2 2 25 PHE HB3 H -7.394 -1.934 5.222 1.00 . B B . 25 PHE HB3 1 1 8 6132 2 2 25 PHE HD1 H -8.278 0.455 7.052 1.00 . B B . 25 PHE HD1 1 1 8 6133 2 2 25 PHE HD2 H -10.202 -3.169 5.773 1.00 . B B . 25 PHE HD2 1 1 8 6134 2 2 25 PHE HE1 H -9.677 0.474 9.102 1.00 . B B . 25 PHE HE1 1 1 8 6135 2 2 25 PHE HE2 H -11.600 -3.150 7.823 1.00 . B B . 25 PHE HE2 1 1 8 6136 2 2 25 PHE HZ H -11.338 -1.328 9.487 1.00 . B B . 25 PHE HZ 1 1 8 6137 2 2 25 PHE N N -7.754 0.152 3.168 1.00 . B B . 25 PHE N 1 1 8 6138 2 2 25 PHE O O -5.985 -0.341 5.985 1.00 . B B . 25 PHE O 1 1 8 6139 2 2 26 TYR C C -5.140 1.886 7.454 1.00 . B B . 26 TYR C 1 1 8 6140 2 2 26 TYR CA C -5.018 2.170 5.953 1.00 . B B . 26 TYR CA 1 1 8 6141 2 2 26 TYR CB C -4.831 3.672 5.723 1.00 . B B . 26 TYR CB 1 1 8 6142 2 2 26 TYR CD1 C -2.322 3.843 5.515 1.00 . B B . 26 TYR CD1 1 1 8 6143 2 2 26 TYR CD2 C -3.399 4.775 7.481 1.00 . B B . 26 TYR CD2 1 1 8 6144 2 2 26 TYR CE1 C -1.074 4.250 6.006 1.00 . B B . 26 TYR CE1 1 1 8 6145 2 2 26 TYR CE2 C -2.151 5.181 7.972 1.00 . B B . 26 TYR CE2 1 1 8 6146 2 2 26 TYR CG C -3.485 4.106 6.253 1.00 . B B . 26 TYR CG 1 1 8 6147 2 2 26 TYR CZ C -0.989 4.919 7.234 1.00 . B B . 26 TYR CZ 1 1 8 6148 2 2 26 TYR H H -6.808 2.358 4.767 1.00 . B B . 26 TYR H 1 1 8 6149 2 2 26 TYR HA H -4.171 1.634 5.551 1.00 . B B . 26 TYR HA 1 1 8 6150 2 2 26 TYR HB2 H -4.885 3.883 4.665 1.00 . B B . 26 TYR HB2 1 1 8 6151 2 2 26 TYR HB3 H -5.610 4.214 6.238 1.00 . B B . 26 TYR HB3 1 1 8 6152 2 2 26 TYR HD1 H -2.388 3.328 4.568 1.00 . B B . 26 TYR HD1 1 1 8 6153 2 2 26 TYR HD2 H -4.295 4.978 8.049 1.00 . B B . 26 TYR HD2 1 1 8 6154 2 2 26 TYR HE1 H -0.178 4.048 5.438 1.00 . B B . 26 TYR HE1 1 1 8 6155 2 2 26 TYR HE2 H -2.085 5.696 8.918 1.00 . B B . 26 TYR HE2 1 1 8 6156 2 2 26 TYR HH H 0.111 5.678 8.598 1.00 . B B . 26 TYR HH 1 1 8 6157 2 2 26 TYR N N -6.265 1.717 5.271 1.00 . B B . 26 TYR N 1 1 8 6158 2 2 26 TYR O O -5.959 2.466 8.139 1.00 . B B . 26 TYR O 1 1 8 6159 2 2 26 TYR OH O 0.241 5.318 7.718 1.00 . B B . 26 TYR OH 1 1 8 6160 2 2 27 THR C C -3.078 0.934 10.099 1.00 . B B . 27 THR C 1 1 8 6161 2 2 27 THR CA C -4.427 0.663 9.424 1.00 . B B . 27 THR CA 1 1 8 6162 2 2 27 THR CB C -4.795 -0.814 9.591 1.00 . B B . 27 THR CB 1 1 8 6163 2 2 27 THR CG2 C -4.125 -1.637 8.490 1.00 . B B . 27 THR CG2 1 1 8 6164 2 2 27 THR H H -3.693 0.524 7.401 1.00 . B B . 27 THR H 1 1 8 6165 2 2 27 THR HA H -5.188 1.276 9.884 1.00 . B B . 27 THR HA 1 1 8 6166 2 2 27 THR HB H -5.865 -0.929 9.519 1.00 . B B . 27 THR HB 1 1 8 6167 2 2 27 THR HG1 H -4.598 -2.196 10.947 1.00 . B B . 27 THR HG1 1 1 8 6168 2 2 27 THR HG21 H -3.116 -1.282 8.337 1.00 . B B . 27 THR HG21 1 1 8 6169 2 2 27 THR HG22 H -4.685 -1.535 7.572 1.00 . B B . 27 THR HG22 1 1 8 6170 2 2 27 THR HG23 H -4.100 -2.677 8.781 1.00 . B B . 27 THR HG23 1 1 8 6171 2 2 27 THR N N -4.341 0.988 7.970 1.00 . B B . 27 THR N 1 1 8 6172 2 2 27 THR O O -2.030 0.710 9.527 1.00 . B B . 27 THR O 1 1 8 6173 2 2 27 THR OG1 O -4.353 -1.271 10.862 1.00 . B B . 27 THR OG1 1 1 8 6174 2 2 28 LYS C C -1.430 0.555 12.940 1.00 . B B . 28 LYS C 1 1 8 6175 2 2 28 LYS CA C -1.818 1.713 12.024 1.00 . B B . 28 LYS CA 1 1 8 6176 2 2 28 LYS CB C -1.971 2.960 12.897 1.00 . B B . 28 LYS CB 1 1 8 6177 2 2 28 LYS CD C -1.167 5.332 13.189 1.00 . B B . 28 LYS CD 1 1 8 6178 2 2 28 LYS CE C -2.650 5.677 13.014 1.00 . B B . 28 LYS CE 1 1 8 6179 2 2 28 LYS CG C -0.859 3.958 12.571 1.00 . B B . 28 LYS CG 1 1 8 6180 2 2 28 LYS H H -3.954 1.600 11.752 1.00 . B B . 28 LYS H 1 1 8 6181 2 2 28 LYS HA H -1.034 1.878 11.301 1.00 . B B . 28 LYS HA 1 1 8 6182 2 2 28 LYS HB2 H -2.936 3.400 12.723 1.00 . B B . 28 LYS HB2 1 1 8 6183 2 2 28 LYS HB3 H -1.895 2.673 13.937 1.00 . B B . 28 LYS HB3 1 1 8 6184 2 2 28 LYS HD2 H -0.925 5.314 14.242 1.00 . B B . 28 LYS HD2 1 1 8 6185 2 2 28 LYS HD3 H -0.566 6.086 12.699 1.00 . B B . 28 LYS HD3 1 1 8 6186 2 2 28 LYS HE2 H -3.249 4.998 13.603 1.00 . B B . 28 LYS HE2 1 1 8 6187 2 2 28 LYS HE3 H -2.824 6.689 13.348 1.00 . B B . 28 LYS HE3 1 1 8 6188 2 2 28 LYS HG2 H 0.072 3.588 12.974 1.00 . B B . 28 LYS HG2 1 1 8 6189 2 2 28 LYS HG3 H -0.773 4.056 11.502 1.00 . B B . 28 LYS HG3 1 1 8 6190 2 2 28 LYS HZ1 H -2.838 6.456 11.092 1.00 . B B . 28 LYS HZ1 1 1 8 6191 2 2 28 LYS HZ2 H -4.045 5.335 11.505 1.00 . B B . 28 LYS HZ2 1 1 8 6192 2 2 28 LYS HZ3 H -2.477 4.800 11.130 1.00 . B B . 28 LYS HZ3 1 1 8 6193 2 2 28 LYS N N -3.098 1.421 11.313 1.00 . B B . 28 LYS N 1 1 8 6194 2 2 28 LYS NZ N -3.031 5.558 11.577 1.00 . B B . 28 LYS NZ 1 1 8 6195 2 2 28 LYS O O -0.334 0.039 12.849 1.00 . B B . 28 LYS O 1 1 8 6196 2 2 29 PRO C C -2.384 -2.212 14.269 1.00 . B B . 29 PRO C 1 1 8 6197 2 2 29 PRO CA C -2.063 -0.827 14.836 1.00 . B B . 29 PRO CA 1 1 8 6198 2 2 29 PRO CB C -3.035 -0.469 15.955 1.00 . B B . 29 PRO CB 1 1 8 6199 2 2 29 PRO CD C -3.658 0.843 13.960 1.00 . B B . 29 PRO CD 1 1 8 6200 2 2 29 PRO CG C -4.188 0.328 15.303 1.00 . B B . 29 PRO CG 1 1 8 6201 2 2 29 PRO HA H -1.049 -0.779 15.197 1.00 . B B . 29 PRO HA 1 1 8 6202 2 2 29 PRO HB2 H -3.410 -1.361 16.431 1.00 . B B . 29 PRO HB2 1 1 8 6203 2 2 29 PRO HB3 H -2.535 0.164 16.671 1.00 . B B . 29 PRO HB3 1 1 8 6204 2 2 29 PRO HD2 H -4.305 0.517 13.157 1.00 . B B . 29 PRO HD2 1 1 8 6205 2 2 29 PRO HD3 H -3.583 1.912 13.980 1.00 . B B . 29 PRO HD3 1 1 8 6206 2 2 29 PRO HG2 H -5.040 -0.320 15.144 1.00 . B B . 29 PRO HG2 1 1 8 6207 2 2 29 PRO HG3 H -4.466 1.160 15.929 1.00 . B B . 29 PRO HG3 1 1 8 6208 2 2 29 PRO N N -2.318 0.220 13.841 1.00 . B B . 29 PRO N 1 1 8 6209 2 2 29 PRO O O -3.104 -2.981 14.874 1.00 . B B . 29 PRO O 1 1 8 6210 2 2 30 THR C C -3.601 -4.244 12.723 1.00 . B B . 30 THR C 1 1 8 6211 2 2 30 THR CA C -2.129 -3.872 12.515 1.00 . B B . 30 THR CA 1 1 8 6212 2 2 30 THR CB C -1.233 -4.925 13.177 1.00 . B B . 30 THR CB 1 1 8 6213 2 2 30 THR CG2 C -1.502 -4.962 14.682 1.00 . B B . 30 THR CG2 1 1 8 6214 2 2 30 THR H H -1.276 -1.897 12.651 1.00 . B B . 30 THR H 1 1 8 6215 2 2 30 THR HA H -1.916 -3.836 11.457 1.00 . B B . 30 THR HA 1 1 8 6216 2 2 30 THR HB H -0.198 -4.673 13.009 1.00 . B B . 30 THR HB 1 1 8 6217 2 2 30 THR HG1 H -0.947 -6.843 13.057 1.00 . B B . 30 THR HG1 1 1 8 6218 2 2 30 THR HG21 H -1.170 -4.038 15.131 1.00 . B B . 30 THR HG21 1 1 8 6219 2 2 30 THR HG22 H -0.966 -5.790 15.123 1.00 . B B . 30 THR HG22 1 1 8 6220 2 2 30 THR HG23 H -2.561 -5.086 14.856 1.00 . B B . 30 THR HG23 1 1 8 6221 2 2 30 THR N N -1.856 -2.535 13.119 1.00 . B B . 30 THR N 1 1 8 6222 2 2 30 THR O O -3.886 -5.427 12.815 1.00 . B B . 30 THR O 1 1 8 6223 2 2 30 THR OXT O -4.417 -3.339 12.786 1.00 . B B . 30 THR OXT 1 1 8 6224 2 2 30 THR OG1 O -1.508 -6.200 12.616 1.00 . B B . 30 THR OG1 1 1 9 6225 1 1 1 GLY C C 0.561 -4.579 7.056 1.00 . A A . 1 GLY C 1 1 9 6226 1 1 1 GLY CA C -0.118 -5.170 8.245 1.00 . A A . 1 GLY CA 1 1 9 6227 1 1 1 GLY H1 H 1.627 -5.136 9.440 1.00 . A A . 1 GLY H1 1 1 9 6228 1 1 1 GLY H2 H 0.915 -6.673 9.317 1.00 . A A . 1 GLY H2 1 1 9 6229 1 1 1 GLY H3 H 0.213 -5.487 10.311 1.00 . A A . 1 GLY H3 1 1 9 6230 1 1 1 GLY HA2 H -0.327 -5.899 7.632 1.00 . A A . 1 GLY HA2 1 1 9 6231 1 1 1 GLY HA3 H -1.070 -4.665 8.694 1.00 . A A . 1 GLY HA3 1 1 9 6232 1 1 1 GLY N N 0.727 -5.655 9.423 1.00 . A A . 1 GLY N 1 1 9 6233 1 1 1 GLY O O 1.544 -5.101 6.569 1.00 . A A . 1 GLY O 1 1 9 6234 1 1 2 ILE C C 1.630 -1.715 5.844 1.00 . A A . 2 ILE C 1 1 9 6235 1 1 2 ILE CA C 0.706 -2.843 5.376 1.00 . A A . 2 ILE CA 1 1 9 6236 1 1 2 ILE CB C -0.369 -2.275 4.449 1.00 . A A . 2 ILE CB 1 1 9 6237 1 1 2 ILE CD1 C -0.175 -2.509 1.970 1.00 . A A . 2 ILE CD1 1 1 9 6238 1 1 2 ILE CG1 C 0.295 -1.718 3.189 1.00 . A A . 2 ILE CG1 1 1 9 6239 1 1 2 ILE CG2 C -1.126 -1.154 5.163 1.00 . A A . 2 ILE CG2 1 1 9 6240 1 1 2 ILE H H -0.728 -3.071 6.968 1.00 . A A . 2 ILE H 1 1 9 6241 1 1 2 ILE HA H 1.286 -3.582 4.842 1.00 . A A . 2 ILE HA 1 1 9 6242 1 1 2 ILE HB H -1.060 -3.059 4.176 1.00 . A A . 2 ILE HB 1 1 9 6243 1 1 2 ILE HD11 H -0.875 -3.270 2.282 1.00 . A A . 2 ILE HD11 1 1 9 6244 1 1 2 ILE HD12 H 0.675 -2.975 1.493 1.00 . A A . 2 ILE HD12 1 1 9 6245 1 1 2 ILE HD13 H -0.658 -1.841 1.272 1.00 . A A . 2 ILE HD13 1 1 9 6246 1 1 2 ILE HG12 H 0.028 -0.679 3.070 1.00 . A A . 2 ILE HG12 1 1 9 6247 1 1 2 ILE HG13 H 1.365 -1.806 3.280 1.00 . A A . 2 ILE HG13 1 1 9 6248 1 1 2 ILE HG21 H -1.445 -0.418 4.441 1.00 . A A . 2 ILE HG21 1 1 9 6249 1 1 2 ILE HG22 H -0.478 -0.688 5.891 1.00 . A A . 2 ILE HG22 1 1 9 6250 1 1 2 ILE HG23 H -1.991 -1.566 5.663 1.00 . A A . 2 ILE HG23 1 1 9 6251 1 1 2 ILE N N 0.064 -3.479 6.560 1.00 . A A . 2 ILE N 1 1 9 6252 1 1 2 ILE O O 1.958 -0.813 5.101 1.00 . A A . 2 ILE O 1 1 9 6253 1 1 3 ABA C C 4.352 -1.294 7.804 1.00 . A A . 3 ABA C 1 1 9 6254 1 1 3 ABA CA C 2.953 -0.708 7.599 1.00 . A A . 3 ABA CA 1 1 9 6255 1 1 3 ABA CB C 2.412 -0.192 8.923 1.00 . A A . 3 ABA CB 1 1 9 6256 1 1 3 ABA CG C 1.357 0.886 8.664 1.00 . A A . 3 ABA CG 1 1 9 6257 1 1 3 ABA H H 1.774 -2.486 7.659 1.00 . A A . 3 ABA H 1 1 9 6258 1 1 3 ABA HA H 3.008 0.104 6.894 1.00 . A A . 3 ABA HA 1 1 9 6259 1 1 3 ABA HB2 H 1.972 -1.007 9.464 1.00 . A A . 3 ABA HB2 1 1 9 6260 1 1 3 ABA HB3 H 3.215 0.223 9.497 1.00 . A A . 3 ABA HB3 1 1 9 6261 1 1 3 ABA HG1 H 0.642 0.893 9.473 1.00 . A A . 3 ABA HG1 1 1 9 6262 1 1 3 ABA HG2 H 0.847 0.675 7.735 1.00 . A A . 3 ABA HG2 1 1 9 6263 1 1 3 ABA HG3 H 1.836 1.852 8.599 1.00 . A A . 3 ABA HG3 1 1 9 6264 1 1 3 ABA N N 2.048 -1.758 7.076 1.00 . A A . 3 ABA N 1 1 9 6265 1 1 3 ABA O O 5.153 -1.338 6.904 1.00 . A A . 3 ABA O 1 1 9 6266 1 1 4 GLU C C 6.361 -3.334 8.168 1.00 . A A . 4 GLU C 1 1 9 6267 1 1 4 GLU CA C 5.992 -2.321 9.267 1.00 . A A . 4 GLU CA 1 1 9 6268 1 1 4 GLU CB C 5.965 -2.981 10.664 1.00 . A A . 4 GLU CB 1 1 9 6269 1 1 4 GLU CD C 6.847 -4.855 12.067 1.00 . A A . 4 GLU CD 1 1 9 6270 1 1 4 GLU CG C 6.624 -4.363 10.636 1.00 . A A . 4 GLU CG 1 1 9 6271 1 1 4 GLU H H 3.985 -1.702 9.706 1.00 . A A . 4 GLU H 1 1 9 6272 1 1 4 GLU HA H 6.721 -1.524 9.268 1.00 . A A . 4 GLU HA 1 1 9 6273 1 1 4 GLU HB2 H 6.495 -2.351 11.363 1.00 . A A . 4 GLU HB2 1 1 9 6274 1 1 4 GLU HB3 H 4.940 -3.083 10.987 1.00 . A A . 4 GLU HB3 1 1 9 6275 1 1 4 GLU HG2 H 5.980 -5.053 10.112 1.00 . A A . 4 GLU HG2 1 1 9 6276 1 1 4 GLU HG3 H 7.572 -4.296 10.126 1.00 . A A . 4 GLU HG3 1 1 9 6277 1 1 4 GLU N N 4.648 -1.744 8.991 1.00 . A A . 4 GLU N 1 1 9 6278 1 1 4 GLU O O 7.521 -3.605 7.932 1.00 . A A . 4 GLU O 1 1 9 6279 1 1 4 GLU OE1 O 7.639 -4.244 12.766 1.00 . A A . 4 GLU OE1 1 1 9 6280 1 1 4 GLU OE2 O 6.224 -5.835 12.441 1.00 . A A . 4 GLU OE2 1 1 9 6281 1 1 5 GLN C C 5.873 -4.145 5.091 1.00 . A A . 5 GLN C 1 1 9 6282 1 1 5 GLN CA C 5.705 -4.880 6.423 1.00 . A A . 5 GLN CA 1 1 9 6283 1 1 5 GLN CB C 4.564 -5.895 6.310 1.00 . A A . 5 GLN CB 1 1 9 6284 1 1 5 GLN CD C 4.819 -7.547 4.453 1.00 . A A . 5 GLN CD 1 1 9 6285 1 1 5 GLN CG C 5.133 -7.261 5.923 1.00 . A A . 5 GLN CG 1 1 9 6286 1 1 5 GLN H H 4.459 -3.663 7.698 1.00 . A A . 5 GLN H 1 1 9 6287 1 1 5 GLN HA H 6.621 -5.394 6.665 1.00 . A A . 5 GLN HA 1 1 9 6288 1 1 5 GLN HB2 H 4.057 -5.973 7.261 1.00 . A A . 5 GLN HB2 1 1 9 6289 1 1 5 GLN HB3 H 3.865 -5.570 5.555 1.00 . A A . 5 GLN HB3 1 1 9 6290 1 1 5 GLN HE21 H 2.931 -6.953 4.594 1.00 . A A . 5 GLN HE21 1 1 9 6291 1 1 5 GLN HE22 H 3.408 -7.492 3.057 1.00 . A A . 5 GLN HE22 1 1 9 6292 1 1 5 GLN HG2 H 6.203 -7.260 6.069 1.00 . A A . 5 GLN HG2 1 1 9 6293 1 1 5 GLN HG3 H 4.685 -8.025 6.540 1.00 . A A . 5 GLN HG3 1 1 9 6294 1 1 5 GLN N N 5.391 -3.892 7.497 1.00 . A A . 5 GLN N 1 1 9 6295 1 1 5 GLN NE2 N 3.620 -7.311 3.997 1.00 . A A . 5 GLN NE2 1 1 9 6296 1 1 5 GLN O O 6.762 -4.433 4.314 1.00 . A A . 5 GLN O 1 1 9 6297 1 1 5 GLN OE1 O 5.674 -7.991 3.712 1.00 . A A . 5 GLN OE1 1 1 9 6298 1 1 6 CYS C C 5.799 -1.081 3.858 1.00 . A A . 6 CYS C 1 1 9 6299 1 1 6 CYS CA C 5.109 -2.418 3.564 1.00 . A A . 6 CYS CA 1 1 9 6300 1 1 6 CYS CB C 3.681 -2.148 3.080 1.00 . A A . 6 CYS CB 1 1 9 6301 1 1 6 CYS H H 4.322 -2.982 5.478 1.00 . A A . 6 CYS H 1 1 9 6302 1 1 6 CYS HA H 5.667 -2.968 2.815 1.00 . A A . 6 CYS HA 1 1 9 6303 1 1 6 CYS HB2 H 3.044 -2.031 3.932 1.00 . A A . 6 CYS HB2 1 1 9 6304 1 1 6 CYS HB3 H 3.662 -1.245 2.512 1.00 . A A . 6 CYS HB3 1 1 9 6305 1 1 6 CYS N N 5.024 -3.194 4.831 1.00 . A A . 6 CYS N 1 1 9 6306 1 1 6 CYS O O 5.737 -0.152 3.077 1.00 . A A . 6 CYS O 1 1 9 6307 1 1 6 CYS SG S 3.056 -3.517 2.070 1.00 . A A . 6 CYS SG 1 1 9 6308 1 1 7 CYS C C 8.559 0.028 5.783 1.00 . A A . 7 CYS C 1 1 9 6309 1 1 7 CYS CA C 7.110 0.301 5.364 1.00 . A A . 7 CYS CA 1 1 9 6310 1 1 7 CYS CB C 6.359 0.957 6.528 1.00 . A A . 7 CYS CB 1 1 9 6311 1 1 7 CYS H H 6.455 -1.733 5.613 1.00 . A A . 7 CYS H 1 1 9 6312 1 1 7 CYS HA H 7.104 0.968 4.520 1.00 . A A . 7 CYS HA 1 1 9 6313 1 1 7 CYS HB2 H 5.336 1.162 6.239 1.00 . A A . 7 CYS HB2 1 1 9 6314 1 1 7 CYS HB3 H 6.360 0.293 7.374 1.00 . A A . 7 CYS HB3 1 1 9 6315 1 1 7 CYS N N 6.436 -0.975 4.993 1.00 . A A . 7 CYS N 1 1 9 6316 1 1 7 CYS O O 9.418 0.877 5.655 1.00 . A A . 7 CYS O 1 1 9 6317 1 1 7 CYS SG S 7.195 2.502 6.974 1.00 . A A . 7 CYS SG 1 1 9 6318 1 1 8 THR C C 10.892 -2.354 5.643 1.00 . A A . 8 THR C 1 1 9 6319 1 1 8 THR CA C 10.242 -1.452 6.693 1.00 . A A . 8 THR CA 1 1 9 6320 1 1 8 THR CB C 10.233 -2.160 8.049 1.00 . A A . 8 THR CB 1 1 9 6321 1 1 8 THR CG2 C 9.214 -1.485 8.967 1.00 . A A . 8 THR CG2 1 1 9 6322 1 1 8 THR H H 8.145 -1.827 6.373 1.00 . A A . 8 THR H 1 1 9 6323 1 1 8 THR HA H 10.803 -0.532 6.771 1.00 . A A . 8 THR HA 1 1 9 6324 1 1 8 THR HB H 11.212 -2.095 8.497 1.00 . A A . 8 THR HB 1 1 9 6325 1 1 8 THR HG1 H 9.132 -3.562 7.270 1.00 . A A . 8 THR HG1 1 1 9 6326 1 1 8 THR HG21 H 8.751 -0.659 8.446 1.00 . A A . 8 THR HG21 1 1 9 6327 1 1 8 THR HG22 H 9.713 -1.117 9.852 1.00 . A A . 8 THR HG22 1 1 9 6328 1 1 8 THR HG23 H 8.457 -2.200 9.252 1.00 . A A . 8 THR HG23 1 1 9 6329 1 1 8 THR N N 8.845 -1.146 6.278 1.00 . A A . 8 THR N 1 1 9 6330 1 1 8 THR O O 11.980 -2.863 5.831 1.00 . A A . 8 THR O 1 1 9 6331 1 1 8 THR OG1 O 9.883 -3.525 7.868 1.00 . A A . 8 THR OG1 1 1 9 6332 1 1 9 SER C C 10.380 -2.859 2.102 1.00 . A A . 9 SER C 1 1 9 6333 1 1 9 SER CA C 10.799 -3.415 3.467 1.00 . A A . 9 SER CA 1 1 9 6334 1 1 9 SER CB C 10.282 -4.843 3.639 1.00 . A A . 9 SER CB 1 1 9 6335 1 1 9 SER H H 9.356 -2.130 4.406 1.00 . A A . 9 SER H 1 1 9 6336 1 1 9 SER HA H 11.876 -3.412 3.538 1.00 . A A . 9 SER HA 1 1 9 6337 1 1 9 SER HB2 H 9.206 -4.847 3.587 1.00 . A A . 9 SER HB2 1 1 9 6338 1 1 9 SER HB3 H 10.682 -5.467 2.851 1.00 . A A . 9 SER HB3 1 1 9 6339 1 1 9 SER HG H 10.141 -6.095 5.120 1.00 . A A . 9 SER HG 1 1 9 6340 1 1 9 SER N N 10.230 -2.552 4.536 1.00 . A A . 9 SER N 1 1 9 6341 1 1 9 SER O O 10.910 -1.867 1.643 1.00 . A A . 9 SER O 1 1 9 6342 1 1 9 SER OG O 10.690 -5.338 4.907 1.00 . A A . 9 SER OG 1 1 9 6343 1 1 10 ILE C C 7.622 -3.519 -0.234 1.00 . A A . 10 ILE C 1 1 9 6344 1 1 10 ILE CA C 9.010 -2.963 0.118 1.00 . A A . 10 ILE CA 1 1 9 6345 1 1 10 ILE CB C 10.041 -3.399 -0.935 1.00 . A A . 10 ILE CB 1 1 9 6346 1 1 10 ILE CD1 C 12.333 -2.607 -0.348 1.00 . A A . 10 ILE CD1 1 1 9 6347 1 1 10 ILE CG1 C 11.063 -2.282 -1.136 1.00 . A A . 10 ILE CG1 1 1 9 6348 1 1 10 ILE CG2 C 9.348 -3.698 -2.266 1.00 . A A . 10 ILE CG2 1 1 9 6349 1 1 10 ILE H H 9.015 -4.275 1.819 1.00 . A A . 10 ILE H 1 1 9 6350 1 1 10 ILE HA H 8.965 -1.884 0.149 1.00 . A A . 10 ILE HA 1 1 9 6351 1 1 10 ILE HB H 10.548 -4.285 -0.591 1.00 . A A . 10 ILE HB 1 1 9 6352 1 1 10 ILE HD11 H 12.654 -1.729 0.192 1.00 . A A . 10 ILE HD11 1 1 9 6353 1 1 10 ILE HD12 H 13.111 -2.916 -1.030 1.00 . A A . 10 ILE HD12 1 1 9 6354 1 1 10 ILE HD13 H 12.128 -3.405 0.351 1.00 . A A . 10 ILE HD13 1 1 9 6355 1 1 10 ILE HG12 H 11.302 -2.200 -2.186 1.00 . A A . 10 ILE HG12 1 1 9 6356 1 1 10 ILE HG13 H 10.651 -1.351 -0.783 1.00 . A A . 10 ILE HG13 1 1 9 6357 1 1 10 ILE HG21 H 8.701 -2.872 -2.524 1.00 . A A . 10 ILE HG21 1 1 9 6358 1 1 10 ILE HG22 H 8.758 -4.598 -2.165 1.00 . A A . 10 ILE HG22 1 1 9 6359 1 1 10 ILE HG23 H 10.088 -3.834 -3.036 1.00 . A A . 10 ILE HG23 1 1 9 6360 1 1 10 ILE N N 9.438 -3.478 1.445 1.00 . A A . 10 ILE N 1 1 9 6361 1 1 10 ILE O O 7.207 -4.544 0.266 1.00 . A A . 10 ILE O 1 1 9 6362 1 1 11 CYS C C 5.256 -2.807 -2.930 1.00 . A A . 11 CYS C 1 1 9 6363 1 1 11 CYS CA C 5.575 -3.342 -1.536 1.00 . A A . 11 CYS CA 1 1 9 6364 1 1 11 CYS CB C 4.527 -2.898 -0.525 1.00 . A A . 11 CYS CB 1 1 9 6365 1 1 11 CYS H H 7.294 -2.037 -1.519 1.00 . A A . 11 CYS H 1 1 9 6366 1 1 11 CYS HA H 5.581 -4.416 -1.575 1.00 . A A . 11 CYS HA 1 1 9 6367 1 1 11 CYS HB2 H 4.738 -1.894 -0.197 1.00 . A A . 11 CYS HB2 1 1 9 6368 1 1 11 CYS HB3 H 3.551 -2.938 -0.977 1.00 . A A . 11 CYS HB3 1 1 9 6369 1 1 11 CYS N N 6.922 -2.854 -1.117 1.00 . A A . 11 CYS N 1 1 9 6370 1 1 11 CYS O O 5.268 -1.616 -3.174 1.00 . A A . 11 CYS O 1 1 9 6371 1 1 11 CYS SG S 4.595 -4.040 0.879 1.00 . A A . 11 CYS SG 1 1 9 6372 1 1 12 SER C C 3.278 -2.786 -5.399 1.00 . A A . 12 SER C 1 1 9 6373 1 1 12 SER CA C 4.720 -3.271 -5.255 1.00 . A A . 12 SER CA 1 1 9 6374 1 1 12 SER CB C 4.953 -4.452 -6.197 1.00 . A A . 12 SER CB 1 1 9 6375 1 1 12 SER H H 5.024 -4.648 -3.632 1.00 . A A . 12 SER H 1 1 9 6376 1 1 12 SER HA H 5.389 -2.468 -5.526 1.00 . A A . 12 SER HA 1 1 9 6377 1 1 12 SER HB2 H 4.184 -4.472 -6.951 1.00 . A A . 12 SER HB2 1 1 9 6378 1 1 12 SER HB3 H 5.919 -4.346 -6.673 1.00 . A A . 12 SER HB3 1 1 9 6379 1 1 12 SER HG H 5.806 -5.986 -5.359 1.00 . A A . 12 SER HG 1 1 9 6380 1 1 12 SER N N 5.003 -3.695 -3.855 1.00 . A A . 12 SER N 1 1 9 6381 1 1 12 SER O O 2.397 -3.151 -4.649 1.00 . A A . 12 SER O 1 1 9 6382 1 1 12 SER OG O 4.908 -5.661 -5.452 1.00 . A A . 12 SER OG 1 1 9 6383 1 1 13 LEU C C 0.652 -2.497 -6.847 1.00 . A A . 13 LEU C 1 1 9 6384 1 1 13 LEU CA C 1.697 -1.396 -6.636 1.00 . A A . 13 LEU CA 1 1 9 6385 1 1 13 LEU CB C 1.769 -0.551 -7.909 1.00 . A A . 13 LEU CB 1 1 9 6386 1 1 13 LEU CD1 C 1.779 -0.683 -10.410 1.00 . A A . 13 LEU CD1 1 1 9 6387 1 1 13 LEU CD2 C 3.113 -2.308 -9.067 1.00 . A A . 13 LEU CD2 1 1 9 6388 1 1 13 LEU CG C 1.823 -1.487 -9.117 1.00 . A A . 13 LEU CG 1 1 9 6389 1 1 13 LEU H H 3.799 -1.692 -6.953 1.00 . A A . 13 LEU H 1 1 9 6390 1 1 13 LEU HA H 1.397 -0.776 -5.817 1.00 . A A . 13 LEU HA 1 1 9 6391 1 1 13 LEU HB2 H 0.894 0.080 -7.974 1.00 . A A . 13 LEU HB2 1 1 9 6392 1 1 13 LEU HB3 H 2.658 0.061 -7.889 1.00 . A A . 13 LEU HB3 1 1 9 6393 1 1 13 LEU HD11 H 1.325 0.277 -10.220 1.00 . A A . 13 LEU HD11 1 1 9 6394 1 1 13 LEU HD12 H 1.195 -1.221 -11.143 1.00 . A A . 13 LEU HD12 1 1 9 6395 1 1 13 LEU HD13 H 2.783 -0.543 -10.780 1.00 . A A . 13 LEU HD13 1 1 9 6396 1 1 13 LEU HD21 H 3.943 -1.659 -8.830 1.00 . A A . 13 LEU HD21 1 1 9 6397 1 1 13 LEU HD22 H 3.282 -2.774 -10.026 1.00 . A A . 13 LEU HD22 1 1 9 6398 1 1 13 LEU HD23 H 3.025 -3.071 -8.306 1.00 . A A . 13 LEU HD23 1 1 9 6399 1 1 13 LEU HG H 0.975 -2.150 -9.081 1.00 . A A . 13 LEU HG 1 1 9 6400 1 1 13 LEU N N 3.054 -1.958 -6.377 1.00 . A A . 13 LEU N 1 1 9 6401 1 1 13 LEU O O -0.527 -2.219 -6.933 1.00 . A A . 13 LEU O 1 1 9 6402 1 1 14 TYR C C -0.177 -5.474 -5.844 1.00 . A A . 14 TYR C 1 1 9 6403 1 1 14 TYR CA C 0.028 -4.782 -7.164 1.00 . A A . 14 TYR CA 1 1 9 6404 1 1 14 TYR CB C 0.521 -5.742 -8.256 1.00 . A A . 14 TYR CB 1 1 9 6405 1 1 14 TYR CD1 C -1.313 -7.439 -8.595 1.00 . A A . 14 TYR CD1 1 1 9 6406 1 1 14 TYR CD2 C 0.653 -8.087 -7.329 1.00 . A A . 14 TYR CD2 1 1 9 6407 1 1 14 TYR CE1 C -1.854 -8.718 -8.410 1.00 . A A . 14 TYR CE1 1 1 9 6408 1 1 14 TYR CE2 C 0.111 -9.367 -7.143 1.00 . A A . 14 TYR CE2 1 1 9 6409 1 1 14 TYR CG C -0.061 -7.123 -8.054 1.00 . A A . 14 TYR CG 1 1 9 6410 1 1 14 TYR CZ C -1.142 -9.681 -7.685 1.00 . A A . 14 TYR CZ 1 1 9 6411 1 1 14 TYR H H 1.996 -3.971 -6.866 1.00 . A A . 14 TYR H 1 1 9 6412 1 1 14 TYR HA H -0.896 -4.318 -7.460 1.00 . A A . 14 TYR HA 1 1 9 6413 1 1 14 TYR HB2 H 0.218 -5.362 -9.223 1.00 . A A . 14 TYR HB2 1 1 9 6414 1 1 14 TYR HB3 H 1.600 -5.796 -8.221 1.00 . A A . 14 TYR HB3 1 1 9 6415 1 1 14 TYR HD1 H -1.863 -6.697 -9.155 1.00 . A A . 14 TYR HD1 1 1 9 6416 1 1 14 TYR HD2 H 1.620 -7.844 -6.912 1.00 . A A . 14 TYR HD2 1 1 9 6417 1 1 14 TYR HE1 H -2.820 -8.961 -8.827 1.00 . A A . 14 TYR HE1 1 1 9 6418 1 1 14 TYR HE2 H 0.660 -10.110 -6.584 1.00 . A A . 14 TYR HE2 1 1 9 6419 1 1 14 TYR HH H -2.430 -11.029 -8.091 1.00 . A A . 14 TYR HH 1 1 9 6420 1 1 14 TYR N N 1.045 -3.731 -6.943 1.00 . A A . 14 TYR N 1 1 9 6421 1 1 14 TYR O O -1.263 -5.881 -5.485 1.00 . A A . 14 TYR O 1 1 9 6422 1 1 14 TYR OH O -1.677 -10.940 -7.503 1.00 . A A . 14 TYR OH 1 1 9 6423 1 1 15 GLN C C -0.080 -5.126 -2.948 1.00 . A A . 15 GLN C 1 1 9 6424 1 1 15 GLN CA C 0.757 -6.108 -3.753 1.00 . A A . 15 GLN CA 1 1 9 6425 1 1 15 GLN CB C 2.161 -6.191 -3.189 1.00 . A A . 15 GLN CB 1 1 9 6426 1 1 15 GLN CD C 1.904 -8.546 -2.399 1.00 . A A . 15 GLN CD 1 1 9 6427 1 1 15 GLN CG C 2.685 -7.617 -3.331 1.00 . A A . 15 GLN CG 1 1 9 6428 1 1 15 GLN H H 1.706 -5.143 -5.393 1.00 . A A . 15 GLN H 1 1 9 6429 1 1 15 GLN HA H 0.288 -7.079 -3.784 1.00 . A A . 15 GLN HA 1 1 9 6430 1 1 15 GLN HB2 H 2.800 -5.514 -3.747 1.00 . A A . 15 GLN HB2 1 1 9 6431 1 1 15 GLN HB3 H 2.149 -5.905 -2.156 1.00 . A A . 15 GLN HB3 1 1 9 6432 1 1 15 GLN HE21 H 2.508 -7.631 -0.744 1.00 . A A . 15 GLN HE21 1 1 9 6433 1 1 15 GLN HE22 H 1.467 -8.949 -0.505 1.00 . A A . 15 GLN HE22 1 1 9 6434 1 1 15 GLN HG2 H 2.559 -7.940 -4.355 1.00 . A A . 15 GLN HG2 1 1 9 6435 1 1 15 GLN HG3 H 3.732 -7.641 -3.071 1.00 . A A . 15 GLN HG3 1 1 9 6436 1 1 15 GLN N N 0.859 -5.533 -5.092 1.00 . A A . 15 GLN N 1 1 9 6437 1 1 15 GLN NE2 N 1.965 -8.360 -1.109 1.00 . A A . 15 GLN NE2 1 1 9 6438 1 1 15 GLN O O -0.860 -5.487 -2.089 1.00 . A A . 15 GLN O 1 1 9 6439 1 1 15 GLN OE1 O 1.229 -9.451 -2.850 1.00 . A A . 15 GLN OE1 1 1 9 6440 1 1 16 LEU C C -2.070 -2.734 -3.293 1.00 . A A . 16 LEU C 1 1 9 6441 1 1 16 LEU CA C -0.717 -2.811 -2.611 1.00 . A A . 16 LEU CA 1 1 9 6442 1 1 16 LEU CB C 0.059 -1.507 -2.748 1.00 . A A . 16 LEU CB 1 1 9 6443 1 1 16 LEU CD1 C 2.192 -0.382 -2.025 1.00 . A A . 16 LEU CD1 1 1 9 6444 1 1 16 LEU CD2 C 1.336 -2.357 -0.765 1.00 . A A . 16 LEU CD2 1 1 9 6445 1 1 16 LEU CG C 1.458 -1.715 -2.149 1.00 . A A . 16 LEU CG 1 1 9 6446 1 1 16 LEU H H 0.671 -3.630 -4.011 1.00 . A A . 16 LEU H 1 1 9 6447 1 1 16 LEU HA H -0.857 -3.045 -1.573 1.00 . A A . 16 LEU HA 1 1 9 6448 1 1 16 LEU HB2 H 0.145 -1.246 -3.794 1.00 . A A . 16 LEU HB2 1 1 9 6449 1 1 16 LEU HB3 H -0.451 -0.725 -2.222 1.00 . A A . 16 LEU HB3 1 1 9 6450 1 1 16 LEU HD11 H 3.254 -0.567 -1.942 1.00 . A A . 16 LEU HD11 1 1 9 6451 1 1 16 LEU HD12 H 1.848 0.138 -1.145 1.00 . A A . 16 LEU HD12 1 1 9 6452 1 1 16 LEU HD13 H 1.998 0.217 -2.900 1.00 . A A . 16 LEU HD13 1 1 9 6453 1 1 16 LEU HD21 H 1.550 -3.414 -0.841 1.00 . A A . 16 LEU HD21 1 1 9 6454 1 1 16 LEU HD22 H 0.335 -2.218 -0.390 1.00 . A A . 16 LEU HD22 1 1 9 6455 1 1 16 LEU HD23 H 2.043 -1.897 -0.091 1.00 . A A . 16 LEU HD23 1 1 9 6456 1 1 16 LEU HG H 2.024 -2.368 -2.791 1.00 . A A . 16 LEU HG 1 1 9 6457 1 1 16 LEU N N 0.061 -3.873 -3.280 1.00 . A A . 16 LEU N 1 1 9 6458 1 1 16 LEU O O -3.036 -2.241 -2.745 1.00 . A A . 16 LEU O 1 1 9 6459 1 1 17 GLU C C -4.312 -4.367 -4.577 1.00 . A A . 17 GLU C 1 1 9 6460 1 1 17 GLU CA C -3.436 -3.277 -5.198 1.00 . A A . 17 GLU CA 1 1 9 6461 1 1 17 GLU CB C -3.176 -3.593 -6.671 1.00 . A A . 17 GLU CB 1 1 9 6462 1 1 17 GLU CD C -4.302 -4.295 -8.787 1.00 . A A . 17 GLU CD 1 1 9 6463 1 1 17 GLU CG C -4.502 -3.614 -7.432 1.00 . A A . 17 GLU CG 1 1 9 6464 1 1 17 GLU H H -1.361 -3.679 -4.885 1.00 . A A . 17 GLU H 1 1 9 6465 1 1 17 GLU HA H -3.915 -2.319 -5.105 1.00 . A A . 17 GLU HA 1 1 9 6466 1 1 17 GLU HB2 H -2.525 -2.839 -7.087 1.00 . A A . 17 GLU HB2 1 1 9 6467 1 1 17 GLU HB3 H -2.700 -4.558 -6.753 1.00 . A A . 17 GLU HB3 1 1 9 6468 1 1 17 GLU HG2 H -5.236 -4.162 -6.858 1.00 . A A . 17 GLU HG2 1 1 9 6469 1 1 17 GLU HG3 H -4.846 -2.603 -7.585 1.00 . A A . 17 GLU HG3 1 1 9 6470 1 1 17 GLU N N -2.150 -3.263 -4.479 1.00 . A A . 17 GLU N 1 1 9 6471 1 1 17 GLU O O -5.525 -4.332 -4.650 1.00 . A A . 17 GLU O 1 1 9 6472 1 1 17 GLU OE1 O -3.298 -4.968 -8.947 1.00 . A A . 17 GLU OE1 1 1 9 6473 1 1 17 GLU OE2 O -5.157 -4.132 -9.641 1.00 . A A . 17 GLU OE2 1 1 9 6474 1 1 18 ASN C C -5.047 -5.959 -1.982 1.00 . A A . 18 ASN C 1 1 9 6475 1 1 18 ASN CA C -4.483 -6.436 -3.321 1.00 . A A . 18 ASN CA 1 1 9 6476 1 1 18 ASN CB C -3.573 -7.644 -3.091 1.00 . A A . 18 ASN CB 1 1 9 6477 1 1 18 ASN CG C -3.436 -8.434 -4.394 1.00 . A A . 18 ASN CG 1 1 9 6478 1 1 18 ASN H H -2.716 -5.343 -3.899 1.00 . A A . 18 ASN H 1 1 9 6479 1 1 18 ASN HA H -5.296 -6.717 -3.974 1.00 . A A . 18 ASN HA 1 1 9 6480 1 1 18 ASN HB2 H -2.598 -7.305 -2.771 1.00 . A A . 18 ASN HB2 1 1 9 6481 1 1 18 ASN HB3 H -4.000 -8.280 -2.329 1.00 . A A . 18 ASN HB3 1 1 9 6482 1 1 18 ASN HD21 H -1.470 -8.648 -4.225 1.00 . A A . 18 ASN HD21 1 1 9 6483 1 1 18 ASN HD22 H -2.161 -9.352 -5.605 1.00 . A A . 18 ASN HD22 1 1 9 6484 1 1 18 ASN N N -3.697 -5.339 -3.953 1.00 . A A . 18 ASN N 1 1 9 6485 1 1 18 ASN ND2 N -2.258 -8.846 -4.773 1.00 . A A . 18 ASN ND2 1 1 9 6486 1 1 18 ASN O O -5.677 -6.708 -1.262 1.00 . A A . 18 ASN O 1 1 9 6487 1 1 18 ASN OD1 O -4.413 -8.679 -5.074 1.00 . A A . 18 ASN OD1 1 1 9 6488 1 1 19 TYR C C -6.541 -3.290 -0.577 1.00 . A A . 19 TYR C 1 1 9 6489 1 1 19 TYR CA C -5.339 -4.207 -0.339 1.00 . A A . 19 TYR CA 1 1 9 6490 1 1 19 TYR CB C -4.239 -3.417 0.370 1.00 . A A . 19 TYR CB 1 1 9 6491 1 1 19 TYR CD1 C -2.439 -5.181 0.303 1.00 . A A . 19 TYR CD1 1 1 9 6492 1 1 19 TYR CD2 C -3.277 -4.447 2.460 1.00 . A A . 19 TYR CD2 1 1 9 6493 1 1 19 TYR CE1 C -1.564 -6.067 0.945 1.00 . A A . 19 TYR CE1 1 1 9 6494 1 1 19 TYR CE2 C -2.401 -5.333 3.101 1.00 . A A . 19 TYR CE2 1 1 9 6495 1 1 19 TYR CG C -3.295 -4.371 1.061 1.00 . A A . 19 TYR CG 1 1 9 6496 1 1 19 TYR CZ C -1.545 -6.142 2.343 1.00 . A A . 19 TYR CZ 1 1 9 6497 1 1 19 TYR H H -4.305 -4.132 -2.227 1.00 . A A . 19 TYR H 1 1 9 6498 1 1 19 TYR HA H -5.639 -5.038 0.282 1.00 . A A . 19 TYR HA 1 1 9 6499 1 1 19 TYR HB2 H -3.694 -2.831 -0.356 1.00 . A A . 19 TYR HB2 1 1 9 6500 1 1 19 TYR HB3 H -4.684 -2.759 1.102 1.00 . A A . 19 TYR HB3 1 1 9 6501 1 1 19 TYR HD1 H -2.455 -5.123 -0.775 1.00 . A A . 19 TYR HD1 1 1 9 6502 1 1 19 TYR HD2 H -3.937 -3.823 3.043 1.00 . A A . 19 TYR HD2 1 1 9 6503 1 1 19 TYR HE1 H -0.903 -6.691 0.361 1.00 . A A . 19 TYR HE1 1 1 9 6504 1 1 19 TYR HE2 H -2.387 -5.392 4.180 1.00 . A A . 19 TYR HE2 1 1 9 6505 1 1 19 TYR HH H -0.829 -7.891 2.613 1.00 . A A . 19 TYR HH 1 1 9 6506 1 1 19 TYR N N -4.820 -4.721 -1.636 1.00 . A A . 19 TYR N 1 1 9 6507 1 1 19 TYR O O -7.071 -2.707 0.348 1.00 . A A . 19 TYR O 1 1 9 6508 1 1 19 TYR OH O -0.683 -7.014 2.975 1.00 . A A . 19 TYR OH 1 1 9 6509 1 1 20 CYS C C -9.389 -2.798 -1.361 1.00 . A A . 20 CYS C 1 1 9 6510 1 1 20 CYS CA C -8.143 -2.245 -2.053 1.00 . A A . 20 CYS CA 1 1 9 6511 1 1 20 CYS CB C -8.407 -2.135 -3.552 1.00 . A A . 20 CYS CB 1 1 9 6512 1 1 20 CYS H H -6.542 -3.611 -2.542 1.00 . A A . 20 CYS H 1 1 9 6513 1 1 20 CYS HA H -7.925 -1.264 -1.660 1.00 . A A . 20 CYS HA 1 1 9 6514 1 1 20 CYS HB2 H -8.919 -3.020 -3.897 1.00 . A A . 20 CYS HB2 1 1 9 6515 1 1 20 CYS HB3 H -9.022 -1.269 -3.742 1.00 . A A . 20 CYS HB3 1 1 9 6516 1 1 20 CYS N N -6.978 -3.143 -1.800 1.00 . A A . 20 CYS N 1 1 9 6517 1 1 20 CYS O O -9.371 -3.867 -0.783 1.00 . A A . 20 CYS O 1 1 9 6518 1 1 20 CYS SG S -6.839 -1.961 -4.430 1.00 . A A . 20 CYS SG 1 1 9 6519 1 1 21 ASN C C -12.125 -3.906 -1.341 1.00 . A A . 21 ASN C 1 1 9 6520 1 1 21 ASN CA C -11.726 -2.546 -0.763 1.00 . A A . 21 ASN CA 1 1 9 6521 1 1 21 ASN CB C -12.843 -1.534 -1.024 1.00 . A A . 21 ASN CB 1 1 9 6522 1 1 21 ASN CG C -13.906 -1.651 0.069 1.00 . A A . 21 ASN CG 1 1 9 6523 1 1 21 ASN H H -10.462 -1.214 -1.887 1.00 . A A . 21 ASN H 1 1 9 6524 1 1 21 ASN HA H -11.566 -2.639 0.300 1.00 . A A . 21 ASN HA 1 1 9 6525 1 1 21 ASN HB2 H -12.431 -0.535 -1.022 1.00 . A A . 21 ASN HB2 1 1 9 6526 1 1 21 ASN HB3 H -13.294 -1.735 -1.984 1.00 . A A . 21 ASN HB3 1 1 9 6527 1 1 21 ASN HD21 H -12.980 -0.400 1.303 1.00 . A A . 21 ASN HD21 1 1 9 6528 1 1 21 ASN HD22 H -14.440 -1.043 1.883 1.00 . A A . 21 ASN HD22 1 1 9 6529 1 1 21 ASN N N -10.473 -2.073 -1.415 1.00 . A A . 21 ASN N 1 1 9 6530 1 1 21 ASN ND2 N -13.763 -0.976 1.177 1.00 . A A . 21 ASN ND2 1 1 9 6531 1 1 21 ASN O O -11.725 -4.194 -2.457 1.00 . A A . 21 ASN O 1 1 9 6532 1 1 21 ASN OXT O -12.824 -4.636 -0.658 1.00 . A A . 21 ASN OXT 1 1 9 6533 1 1 21 ASN OD1 O -14.876 -2.366 -0.085 1.00 . A A . 21 ASN OD1 1 1 9 6534 2 2 1 PHE C C 7.826 -0.989 -10.512 1.00 . B B . 1 PHE C 1 1 9 6535 2 2 1 PHE CA C 6.807 -1.808 -11.310 1.00 . B B . 1 PHE CA 1 1 9 6536 2 2 1 PHE CB C 6.846 -1.392 -12.782 1.00 . B B . 1 PHE CB 1 1 9 6537 2 2 1 PHE CD1 C 5.361 -3.189 -13.742 1.00 . B B . 1 PHE CD1 1 1 9 6538 2 2 1 PHE CD2 C 7.709 -3.159 -14.359 1.00 . B B . 1 PHE CD2 1 1 9 6539 2 2 1 PHE CE1 C 5.165 -4.321 -14.545 1.00 . B B . 1 PHE CE1 1 1 9 6540 2 2 1 PHE CE2 C 7.512 -4.291 -15.162 1.00 . B B . 1 PHE CE2 1 1 9 6541 2 2 1 PHE CG C 6.634 -2.609 -13.650 1.00 . B B . 1 PHE CG 1 1 9 6542 2 2 1 PHE CZ C 6.240 -4.872 -15.254 1.00 . B B . 1 PHE CZ 1 1 9 6543 2 2 1 PHE H1 H 5.462 -0.746 -10.129 1.00 . B B . 1 PHE H1 1 1 9 6544 2 2 1 PHE H2 H 5.129 -2.409 -10.239 1.00 . B B . 1 PHE H2 1 1 9 6545 2 2 1 PHE H3 H 4.785 -1.383 -11.548 1.00 . B B . 1 PHE H3 1 1 9 6546 2 2 1 PHE HA H 7.048 -2.858 -11.228 1.00 . B B . 1 PHE HA 1 1 9 6547 2 2 1 PHE HB2 H 6.063 -0.671 -12.973 1.00 . B B . 1 PHE HB2 1 1 9 6548 2 2 1 PHE HB3 H 7.805 -0.951 -13.010 1.00 . B B . 1 PHE HB3 1 1 9 6549 2 2 1 PHE HD1 H 4.533 -2.764 -13.195 1.00 . B B . 1 PHE HD1 1 1 9 6550 2 2 1 PHE HD2 H 8.689 -2.711 -14.287 1.00 . B B . 1 PHE HD2 1 1 9 6551 2 2 1 PHE HE1 H 4.184 -4.768 -14.616 1.00 . B B . 1 PHE HE1 1 1 9 6552 2 2 1 PHE HE2 H 8.341 -4.715 -15.709 1.00 . B B . 1 PHE HE2 1 1 9 6553 2 2 1 PHE HZ H 6.088 -5.743 -15.873 1.00 . B B . 1 PHE HZ 1 1 9 6554 2 2 1 PHE N N 5.443 -1.568 -10.765 1.00 . B B . 1 PHE N 1 1 9 6555 2 2 1 PHE O O 8.679 -0.327 -11.068 1.00 . B B . 1 PHE O 1 1 9 6556 2 2 2 VAL C C 9.274 -1.174 -7.282 1.00 . B B . 2 VAL C 1 1 9 6557 2 2 2 VAL CA C 8.704 -0.262 -8.370 1.00 . B B . 2 VAL CA 1 1 9 6558 2 2 2 VAL CB C 7.986 0.922 -7.719 1.00 . B B . 2 VAL CB 1 1 9 6559 2 2 2 VAL CG1 C 7.386 1.814 -8.805 1.00 . B B . 2 VAL CG1 1 1 9 6560 2 2 2 VAL CG2 C 6.870 0.406 -6.809 1.00 . B B . 2 VAL CG2 1 1 9 6561 2 2 2 VAL H H 7.046 -1.575 -8.781 1.00 . B B . 2 VAL H 1 1 9 6562 2 2 2 VAL HA H 9.508 0.102 -8.991 1.00 . B B . 2 VAL HA 1 1 9 6563 2 2 2 VAL HB H 8.693 1.494 -7.135 1.00 . B B . 2 VAL HB 1 1 9 6564 2 2 2 VAL HG11 H 7.120 2.770 -8.379 1.00 . B B . 2 VAL HG11 1 1 9 6565 2 2 2 VAL HG12 H 6.504 1.342 -9.211 1.00 . B B . 2 VAL HG12 1 1 9 6566 2 2 2 VAL HG13 H 8.112 1.961 -9.592 1.00 . B B . 2 VAL HG13 1 1 9 6567 2 2 2 VAL HG21 H 6.282 -0.328 -7.341 1.00 . B B . 2 VAL HG21 1 1 9 6568 2 2 2 VAL HG22 H 6.237 1.230 -6.514 1.00 . B B . 2 VAL HG22 1 1 9 6569 2 2 2 VAL HG23 H 7.303 -0.048 -5.931 1.00 . B B . 2 VAL HG23 1 1 9 6570 2 2 2 VAL N N 7.742 -1.033 -9.209 1.00 . B B . 2 VAL N 1 1 9 6571 2 2 2 VAL O O 8.915 -2.331 -7.178 1.00 . B B . 2 VAL O 1 1 9 6572 2 2 3 ASN C C 11.234 -0.613 -4.252 1.00 . B B . 3 ASN C 1 1 9 6573 2 2 3 ASN CA C 10.762 -1.507 -5.400 1.00 . B B . 3 ASN CA 1 1 9 6574 2 2 3 ASN CB C 11.960 -2.259 -5.970 1.00 . B B . 3 ASN CB 1 1 9 6575 2 2 3 ASN CG C 11.494 -3.571 -6.601 1.00 . B B . 3 ASN CG 1 1 9 6576 2 2 3 ASN H H 10.447 0.264 -6.575 1.00 . B B . 3 ASN H 1 1 9 6577 2 2 3 ASN HA H 10.029 -2.212 -5.036 1.00 . B B . 3 ASN HA 1 1 9 6578 2 2 3 ASN HB2 H 12.438 -1.648 -6.720 1.00 . B B . 3 ASN HB2 1 1 9 6579 2 2 3 ASN HB3 H 12.659 -2.468 -5.179 1.00 . B B . 3 ASN HB3 1 1 9 6580 2 2 3 ASN HD21 H 10.330 -4.059 -5.069 1.00 . B B . 3 ASN HD21 1 1 9 6581 2 2 3 ASN HD22 H 10.349 -5.173 -6.349 1.00 . B B . 3 ASN HD22 1 1 9 6582 2 2 3 ASN N N 10.165 -0.667 -6.473 1.00 . B B . 3 ASN N 1 1 9 6583 2 2 3 ASN ND2 N 10.655 -4.331 -5.952 1.00 . B B . 3 ASN ND2 1 1 9 6584 2 2 3 ASN O O 12.392 -0.622 -3.883 1.00 . B B . 3 ASN O 1 1 9 6585 2 2 3 ASN OD1 O 11.897 -3.909 -7.696 1.00 . B B . 3 ASN OD1 1 1 9 6586 2 2 4 GLN C C 9.899 0.795 -1.342 1.00 . B B . 4 GLN C 1 1 9 6587 2 2 4 GLN CA C 10.760 1.063 -2.579 1.00 . B B . 4 GLN CA 1 1 9 6588 2 2 4 GLN CB C 10.572 2.513 -3.022 1.00 . B B . 4 GLN CB 1 1 9 6589 2 2 4 GLN CD C 11.991 4.514 -3.478 1.00 . B B . 4 GLN CD 1 1 9 6590 2 2 4 GLN CG C 11.744 3.348 -2.520 1.00 . B B . 4 GLN CG 1 1 9 6591 2 2 4 GLN H H 9.431 0.168 -4.006 1.00 . B B . 4 GLN H 1 1 9 6592 2 2 4 GLN HA H 11.799 0.892 -2.339 1.00 . B B . 4 GLN HA 1 1 9 6593 2 2 4 GLN HB2 H 10.529 2.559 -4.100 1.00 . B B . 4 GLN HB2 1 1 9 6594 2 2 4 GLN HB3 H 9.653 2.901 -2.607 1.00 . B B . 4 GLN HB3 1 1 9 6595 2 2 4 GLN HE21 H 13.880 4.759 -2.917 1.00 . B B . 4 GLN HE21 1 1 9 6596 2 2 4 GLN HE22 H 13.335 5.829 -4.117 1.00 . B B . 4 GLN HE22 1 1 9 6597 2 2 4 GLN HG2 H 11.514 3.729 -1.537 1.00 . B B . 4 GLN HG2 1 1 9 6598 2 2 4 GLN HG3 H 12.627 2.730 -2.471 1.00 . B B . 4 GLN HG3 1 1 9 6599 2 2 4 GLN N N 10.354 0.165 -3.690 1.00 . B B . 4 GLN N 1 1 9 6600 2 2 4 GLN NE2 N 13.166 5.081 -3.507 1.00 . B B . 4 GLN NE2 1 1 9 6601 2 2 4 GLN O O 8.886 0.121 -1.407 1.00 . B B . 4 GLN O 1 1 9 6602 2 2 4 GLN OE1 O 11.106 4.915 -4.206 1.00 . B B . 4 GLN OE1 1 1 9 6603 2 2 5 HIS C C 8.313 2.084 1.022 1.00 . B B . 5 HIS C 1 1 9 6604 2 2 5 HIS CA C 9.503 1.124 1.033 1.00 . B B . 5 HIS CA 1 1 9 6605 2 2 5 HIS CB C 10.380 1.414 2.253 1.00 . B B . 5 HIS CB 1 1 9 6606 2 2 5 HIS CD2 C 12.587 0.059 2.607 1.00 . B B . 5 HIS CD2 1 1 9 6607 2 2 5 HIS CE1 C 13.736 0.939 0.986 1.00 . B B . 5 HIS CE1 1 1 9 6608 2 2 5 HIS CG C 11.794 0.980 1.980 1.00 . B B . 5 HIS CG 1 1 9 6609 2 2 5 HIS H H 11.110 1.871 -0.191 1.00 . B B . 5 HIS H 1 1 9 6610 2 2 5 HIS HA H 9.148 0.104 1.074 1.00 . B B . 5 HIS HA 1 1 9 6611 2 2 5 HIS HB2 H 10.363 2.473 2.464 1.00 . B B . 5 HIS HB2 1 1 9 6612 2 2 5 HIS HB3 H 9.997 0.872 3.106 1.00 . B B . 5 HIS HB3 1 1 9 6613 2 2 5 HIS HD2 H 12.300 -0.547 3.453 1.00 . B B . 5 HIS HD2 1 1 9 6614 2 2 5 HIS HE1 H 14.541 1.163 0.302 1.00 . B B . 5 HIS HE1 1 1 9 6615 2 2 5 HIS HE2 H 14.585 -0.530 2.211 1.00 . B B . 5 HIS HE2 1 1 9 6616 2 2 5 HIS N N 10.295 1.328 -0.214 1.00 . B B . 5 HIS N 1 1 9 6617 2 2 5 HIS ND1 N 12.532 1.531 0.955 1.00 . B B . 5 HIS ND1 1 1 9 6618 2 2 5 HIS NE2 N 13.815 0.031 1.980 1.00 . B B . 5 HIS NE2 1 1 9 6619 2 2 5 HIS O O 8.196 2.920 0.149 1.00 . B B . 5 HIS O 1 1 9 6620 2 2 6 LEU C C 5.951 3.375 3.400 1.00 . B B . 6 LEU C 1 1 9 6621 2 2 6 LEU CA C 6.247 2.893 1.978 1.00 . B B . 6 LEU CA 1 1 9 6622 2 2 6 LEU CB C 5.013 2.135 1.456 1.00 . B B . 6 LEU CB 1 1 9 6623 2 2 6 LEU CD1 C 5.465 3.436 -0.663 1.00 . B B . 6 LEU CD1 1 1 9 6624 2 2 6 LEU CD2 C 3.665 1.734 -0.609 1.00 . B B . 6 LEU CD2 1 1 9 6625 2 2 6 LEU CG C 4.385 2.802 0.211 1.00 . B B . 6 LEU CG 1 1 9 6626 2 2 6 LEU H H 7.524 1.295 2.666 1.00 . B B . 6 LEU H 1 1 9 6627 2 2 6 LEU HA H 6.470 3.737 1.357 1.00 . B B . 6 LEU HA 1 1 9 6628 2 2 6 LEU HB2 H 5.312 1.132 1.204 1.00 . B B . 6 LEU HB2 1 1 9 6629 2 2 6 LEU HB3 H 4.272 2.090 2.242 1.00 . B B . 6 LEU HB3 1 1 9 6630 2 2 6 LEU HD11 H 5.071 3.605 -1.653 1.00 . B B . 6 LEU HD11 1 1 9 6631 2 2 6 LEU HD12 H 6.312 2.769 -0.723 1.00 . B B . 6 LEU HD12 1 1 9 6632 2 2 6 LEU HD13 H 5.774 4.375 -0.231 1.00 . B B . 6 LEU HD13 1 1 9 6633 2 2 6 LEU HD21 H 2.598 1.876 -0.526 1.00 . B B . 6 LEU HD21 1 1 9 6634 2 2 6 LEU HD22 H 3.930 0.756 -0.236 1.00 . B B . 6 LEU HD22 1 1 9 6635 2 2 6 LEU HD23 H 3.961 1.818 -1.645 1.00 . B B . 6 LEU HD23 1 1 9 6636 2 2 6 LEU HG H 3.662 3.555 0.513 1.00 . B B . 6 LEU HG 1 1 9 6637 2 2 6 LEU N N 7.424 1.975 1.972 1.00 . B B . 6 LEU N 1 1 9 6638 2 2 6 LEU O O 6.527 2.912 4.357 1.00 . B B . 6 LEU O 1 1 9 6639 2 2 7 CYS C C 3.992 6.199 4.706 1.00 . B B . 7 CYS C 1 1 9 6640 2 2 7 CYS CA C 4.647 4.824 4.871 1.00 . B B . 7 CYS CA 1 1 9 6641 2 2 7 CYS CB C 5.879 4.957 5.773 1.00 . B B . 7 CYS CB 1 1 9 6642 2 2 7 CYS H H 4.573 4.633 2.731 1.00 . B B . 7 CYS H 1 1 9 6643 2 2 7 CYS HA H 3.940 4.149 5.330 1.00 . B B . 7 CYS HA 1 1 9 6644 2 2 7 CYS HB2 H 6.770 4.709 5.220 1.00 . B B . 7 CYS HB2 1 1 9 6645 2 2 7 CYS HB3 H 5.954 5.970 6.128 1.00 . B B . 7 CYS HB3 1 1 9 6646 2 2 7 CYS N N 5.030 4.296 3.528 1.00 . B B . 7 CYS N 1 1 9 6647 2 2 7 CYS O O 4.469 7.043 3.973 1.00 . B B . 7 CYS O 1 1 9 6648 2 2 7 CYS SG S 5.699 3.840 7.187 1.00 . B B . 7 CYS SG 1 1 9 6649 2 2 8 GLY C C 1.591 7.910 3.892 1.00 . B B . 8 GLY C 1 1 9 6650 2 2 8 GLY CA C 2.216 7.750 5.280 1.00 . B B . 8 GLY CA 1 1 9 6651 2 2 8 GLY H H 2.537 5.736 5.974 1.00 . B B . 8 GLY H 1 1 9 6652 2 2 8 GLY HA2 H 1.441 7.811 6.031 1.00 . B B . 8 GLY HA2 1 1 9 6653 2 2 8 GLY HA3 H 2.933 8.540 5.442 1.00 . B B . 8 GLY HA3 1 1 9 6654 2 2 8 GLY N N 2.903 6.430 5.387 1.00 . B B . 8 GLY N 1 1 9 6655 2 2 8 GLY O O 1.138 6.958 3.286 1.00 . B B . 8 GLY O 1 1 9 6656 2 2 9 SER C C 1.591 8.410 1.019 1.00 . B B . 9 SER C 1 1 9 6657 2 2 9 SER CA C 0.960 9.351 2.042 1.00 . B B . 9 SER CA 1 1 9 6658 2 2 9 SER CB C 1.214 10.798 1.620 1.00 . B B . 9 SER CB 1 1 9 6659 2 2 9 SER H H 1.927 9.867 3.896 1.00 . B B . 9 SER H 1 1 9 6660 2 2 9 SER HA H -0.100 9.171 2.087 1.00 . B B . 9 SER HA 1 1 9 6661 2 2 9 SER HB2 H 0.749 10.983 0.666 1.00 . B B . 9 SER HB2 1 1 9 6662 2 2 9 SER HB3 H 0.795 11.467 2.359 1.00 . B B . 9 SER HB3 1 1 9 6663 2 2 9 SER HG H 3.000 10.925 2.381 1.00 . B B . 9 SER HG 1 1 9 6664 2 2 9 SER N N 1.560 9.114 3.387 1.00 . B B . 9 SER N 1 1 9 6665 2 2 9 SER O O 0.988 8.066 0.023 1.00 . B B . 9 SER O 1 1 9 6666 2 2 9 SER OG O 2.614 11.013 1.506 1.00 . B B . 9 SER OG 1 1 9 6667 2 2 10 ASP C C 2.647 5.788 0.173 1.00 . B B . 10 ASP C 1 1 9 6668 2 2 10 ASP CA C 3.468 7.071 0.295 1.00 . B B . 10 ASP CA 1 1 9 6669 2 2 10 ASP CB C 4.872 6.741 0.799 1.00 . B B . 10 ASP CB 1 1 9 6670 2 2 10 ASP CG C 5.619 8.038 1.115 1.00 . B B . 10 ASP CG 1 1 9 6671 2 2 10 ASP H H 3.265 8.280 2.068 1.00 . B B . 10 ASP H 1 1 9 6672 2 2 10 ASP HA H 3.535 7.544 -0.672 1.00 . B B . 10 ASP HA 1 1 9 6673 2 2 10 ASP HB2 H 4.798 6.141 1.691 1.00 . B B . 10 ASP HB2 1 1 9 6674 2 2 10 ASP HB3 H 5.409 6.195 0.038 1.00 . B B . 10 ASP HB3 1 1 9 6675 2 2 10 ASP N N 2.799 7.991 1.257 1.00 . B B . 10 ASP N 1 1 9 6676 2 2 10 ASP O O 2.529 5.211 -0.892 1.00 . B B . 10 ASP O 1 1 9 6677 2 2 10 ASP OD1 O 5.063 8.862 1.822 1.00 . B B . 10 ASP OD1 1 1 9 6678 2 2 10 ASP OD2 O 6.736 8.185 0.645 1.00 . B B . 10 ASP OD2 1 1 9 6679 2 2 11 LEU C C -0.103 4.422 0.571 1.00 . B B . 11 LEU C 1 1 9 6680 2 2 11 LEU CA C 1.253 4.098 1.196 1.00 . B B . 11 LEU CA 1 1 9 6681 2 2 11 LEU CB C 1.069 3.544 2.615 1.00 . B B . 11 LEU CB 1 1 9 6682 2 2 11 LEU CD1 C 1.621 1.336 1.535 1.00 . B B . 11 LEU CD1 1 1 9 6683 2 2 11 LEU CD2 C 1.040 1.443 3.953 1.00 . B B . 11 LEU CD2 1 1 9 6684 2 2 11 LEU CG C 0.752 2.043 2.578 1.00 . B B . 11 LEU CG 1 1 9 6685 2 2 11 LEU H H 2.172 5.821 2.101 1.00 . B B . 11 LEU H 1 1 9 6686 2 2 11 LEU HA H 1.756 3.372 0.582 1.00 . B B . 11 LEU HA 1 1 9 6687 2 2 11 LEU HB2 H 1.978 3.701 3.177 1.00 . B B . 11 LEU HB2 1 1 9 6688 2 2 11 LEU HB3 H 0.258 4.066 3.099 1.00 . B B . 11 LEU HB3 1 1 9 6689 2 2 11 LEU HD11 H 1.124 1.363 0.576 1.00 . B B . 11 LEU HD11 1 1 9 6690 2 2 11 LEU HD12 H 1.774 0.309 1.831 1.00 . B B . 11 LEU HD12 1 1 9 6691 2 2 11 LEU HD13 H 2.575 1.836 1.461 1.00 . B B . 11 LEU HD13 1 1 9 6692 2 2 11 LEU HD21 H 1.092 2.234 4.686 1.00 . B B . 11 LEU HD21 1 1 9 6693 2 2 11 LEU HD22 H 1.982 0.917 3.924 1.00 . B B . 11 LEU HD22 1 1 9 6694 2 2 11 LEU HD23 H 0.251 0.757 4.219 1.00 . B B . 11 LEU HD23 1 1 9 6695 2 2 11 LEU HG H -0.290 1.901 2.333 1.00 . B B . 11 LEU HG 1 1 9 6696 2 2 11 LEU N N 2.071 5.339 1.254 1.00 . B B . 11 LEU N 1 1 9 6697 2 2 11 LEU O O -0.648 3.641 -0.182 1.00 . B B . 11 LEU O 1 1 9 6698 2 2 12 VAL C C -1.733 6.342 -1.211 1.00 . B B . 12 VAL C 1 1 9 6699 2 2 12 VAL CA C -1.960 5.927 0.245 1.00 . B B . 12 VAL CA 1 1 9 6700 2 2 12 VAL CB C -2.631 7.062 1.040 1.00 . B B . 12 VAL CB 1 1 9 6701 2 2 12 VAL CG1 C -2.179 6.994 2.496 1.00 . B B . 12 VAL CG1 1 1 9 6702 2 2 12 VAL CG2 C -2.254 8.431 0.464 1.00 . B B . 12 VAL CG2 1 1 9 6703 2 2 12 VAL H H -0.192 6.205 1.449 1.00 . B B . 12 VAL H 1 1 9 6704 2 2 12 VAL HA H -2.600 5.055 0.264 1.00 . B B . 12 VAL HA 1 1 9 6705 2 2 12 VAL HB H -3.704 6.937 0.997 1.00 . B B . 12 VAL HB 1 1 9 6706 2 2 12 VAL HG11 H -2.199 5.967 2.830 1.00 . B B . 12 VAL HG11 1 1 9 6707 2 2 12 VAL HG12 H -2.845 7.585 3.105 1.00 . B B . 12 VAL HG12 1 1 9 6708 2 2 12 VAL HG13 H -1.175 7.381 2.578 1.00 . B B . 12 VAL HG13 1 1 9 6709 2 2 12 VAL HG21 H -1.182 8.496 0.358 1.00 . B B . 12 VAL HG21 1 1 9 6710 2 2 12 VAL HG22 H -2.598 9.208 1.131 1.00 . B B . 12 VAL HG22 1 1 9 6711 2 2 12 VAL HG23 H -2.720 8.555 -0.503 1.00 . B B . 12 VAL HG23 1 1 9 6712 2 2 12 VAL N N -0.648 5.574 0.854 1.00 . B B . 12 VAL N 1 1 9 6713 2 2 12 VAL O O -2.467 5.953 -2.096 1.00 . B B . 12 VAL O 1 1 9 6714 2 2 13 GLU C C -0.362 6.271 -3.740 1.00 . B B . 13 GLU C 1 1 9 6715 2 2 13 GLU CA C -0.447 7.532 -2.876 1.00 . B B . 13 GLU CA 1 1 9 6716 2 2 13 GLU CB C 0.865 8.336 -2.944 1.00 . B B . 13 GLU CB 1 1 9 6717 2 2 13 GLU CD C 3.358 8.212 -3.140 1.00 . B B . 13 GLU CD 1 1 9 6718 2 2 13 GLU CG C 2.056 7.416 -3.242 1.00 . B B . 13 GLU CG 1 1 9 6719 2 2 13 GLU H H -0.121 7.416 -0.748 1.00 . B B . 13 GLU H 1 1 9 6720 2 2 13 GLU HA H -1.265 8.148 -3.225 1.00 . B B . 13 GLU HA 1 1 9 6721 2 2 13 GLU HB2 H 0.786 9.078 -3.723 1.00 . B B . 13 GLU HB2 1 1 9 6722 2 2 13 GLU HB3 H 1.028 8.831 -1.997 1.00 . B B . 13 GLU HB3 1 1 9 6723 2 2 13 GLU HG2 H 2.071 6.604 -2.528 1.00 . B B . 13 GLU HG2 1 1 9 6724 2 2 13 GLU HG3 H 1.959 7.015 -4.239 1.00 . B B . 13 GLU HG3 1 1 9 6725 2 2 13 GLU N N -0.713 7.118 -1.471 1.00 . B B . 13 GLU N 1 1 9 6726 2 2 13 GLU O O -0.699 6.276 -4.907 1.00 . B B . 13 GLU O 1 1 9 6727 2 2 13 GLU OE1 O 3.281 9.425 -3.029 1.00 . B B . 13 GLU OE1 1 1 9 6728 2 2 13 GLU OE2 O 4.411 7.596 -3.174 1.00 . B B . 13 GLU OE2 1 1 9 6729 2 2 14 ALA C C -1.209 3.237 -3.865 1.00 . B B . 14 ALA C 1 1 9 6730 2 2 14 ALA CA C 0.156 3.912 -3.923 1.00 . B B . 14 ALA CA 1 1 9 6731 2 2 14 ALA CB C 1.212 3.003 -3.292 1.00 . B B . 14 ALA CB 1 1 9 6732 2 2 14 ALA H H 0.315 5.197 -2.210 1.00 . B B . 14 ALA H 1 1 9 6733 2 2 14 ALA HA H 0.416 4.121 -4.950 1.00 . B B . 14 ALA HA 1 1 9 6734 2 2 14 ALA HB1 H 0.730 2.141 -2.854 1.00 . B B . 14 ALA HB1 1 1 9 6735 2 2 14 ALA HB2 H 1.744 3.547 -2.526 1.00 . B B . 14 ALA HB2 1 1 9 6736 2 2 14 ALA HB3 H 1.907 2.679 -4.052 1.00 . B B . 14 ALA HB3 1 1 9 6737 2 2 14 ALA N N 0.069 5.182 -3.158 1.00 . B B . 14 ALA N 1 1 9 6738 2 2 14 ALA O O -1.769 2.855 -4.871 1.00 . B B . 14 ALA O 1 1 9 6739 2 2 15 LEU C C -4.079 3.281 -3.427 1.00 . B B . 15 LEU C 1 1 9 6740 2 2 15 LEU CA C -3.099 2.486 -2.566 1.00 . B B . 15 LEU CA 1 1 9 6741 2 2 15 LEU CB C -3.519 2.520 -1.098 1.00 . B B . 15 LEU CB 1 1 9 6742 2 2 15 LEU CD1 C -3.334 1.257 1.055 1.00 . B B . 15 LEU CD1 1 1 9 6743 2 2 15 LEU CD2 C -2.631 0.131 -1.067 1.00 . B B . 15 LEU CD2 1 1 9 6744 2 2 15 LEU CG C -2.699 1.476 -0.311 1.00 . B B . 15 LEU CG 1 1 9 6745 2 2 15 LEU H H -1.302 3.439 -1.888 1.00 . B B . 15 LEU H 1 1 9 6746 2 2 15 LEU HA H -3.054 1.468 -2.912 1.00 . B B . 15 LEU HA 1 1 9 6747 2 2 15 LEU HB2 H -3.313 3.506 -0.700 1.00 . B B . 15 LEU HB2 1 1 9 6748 2 2 15 LEU HB3 H -4.581 2.315 -1.006 1.00 . B B . 15 LEU HB3 1 1 9 6749 2 2 15 LEU HD11 H -2.699 1.688 1.816 1.00 . B B . 15 LEU HD11 1 1 9 6750 2 2 15 LEU HD12 H -3.445 0.199 1.234 1.00 . B B . 15 LEU HD12 1 1 9 6751 2 2 15 LEU HD13 H -4.302 1.734 1.081 1.00 . B B . 15 LEU HD13 1 1 9 6752 2 2 15 LEU HD21 H -2.028 0.243 -1.958 1.00 . B B . 15 LEU HD21 1 1 9 6753 2 2 15 LEU HD22 H -3.624 -0.187 -1.342 1.00 . B B . 15 LEU HD22 1 1 9 6754 2 2 15 LEU HD23 H -2.180 -0.619 -0.428 1.00 . B B . 15 LEU HD23 1 1 9 6755 2 2 15 LEU HG H -1.697 1.852 -0.172 1.00 . B B . 15 LEU HG 1 1 9 6756 2 2 15 LEU N N -1.762 3.110 -2.689 1.00 . B B . 15 LEU N 1 1 9 6757 2 2 15 LEU O O -4.852 2.725 -4.183 1.00 . B B . 15 LEU O 1 1 9 6758 2 2 16 TYR C C -4.625 5.118 -5.657 1.00 . B B . 16 TYR C 1 1 9 6759 2 2 16 TYR CA C -4.944 5.405 -4.188 1.00 . B B . 16 TYR CA 1 1 9 6760 2 2 16 TYR CB C -4.713 6.893 -3.905 1.00 . B B . 16 TYR CB 1 1 9 6761 2 2 16 TYR CD1 C -7.128 7.612 -3.979 1.00 . B B . 16 TYR CD1 1 1 9 6762 2 2 16 TYR CD2 C -5.889 7.900 -1.912 1.00 . B B . 16 TYR CD2 1 1 9 6763 2 2 16 TYR CE1 C -8.267 8.159 -3.372 1.00 . B B . 16 TYR CE1 1 1 9 6764 2 2 16 TYR CE2 C -7.028 8.447 -1.305 1.00 . B B . 16 TYR CE2 1 1 9 6765 2 2 16 TYR CG C -5.939 7.482 -3.249 1.00 . B B . 16 TYR CG 1 1 9 6766 2 2 16 TYR CZ C -8.217 8.576 -2.036 1.00 . B B . 16 TYR CZ 1 1 9 6767 2 2 16 TYR H H -3.390 5.017 -2.744 1.00 . B B . 16 TYR H 1 1 9 6768 2 2 16 TYR HA H -5.971 5.146 -3.978 1.00 . B B . 16 TYR HA 1 1 9 6769 2 2 16 TYR HB2 H -3.862 7.010 -3.251 1.00 . B B . 16 TYR HB2 1 1 9 6770 2 2 16 TYR HB3 H -4.523 7.409 -4.835 1.00 . B B . 16 TYR HB3 1 1 9 6771 2 2 16 TYR HD1 H -7.167 7.291 -5.009 1.00 . B B . 16 TYR HD1 1 1 9 6772 2 2 16 TYR HD2 H -4.973 7.801 -1.349 1.00 . B B . 16 TYR HD2 1 1 9 6773 2 2 16 TYR HE1 H -9.182 8.259 -3.935 1.00 . B B . 16 TYR HE1 1 1 9 6774 2 2 16 TYR HE2 H -6.990 8.769 -0.275 1.00 . B B . 16 TYR HE2 1 1 9 6775 2 2 16 TYR HH H -9.648 9.838 -1.987 1.00 . B B . 16 TYR HH 1 1 9 6776 2 2 16 TYR N N -4.035 4.583 -3.344 1.00 . B B . 16 TYR N 1 1 9 6777 2 2 16 TYR O O -5.489 5.133 -6.509 1.00 . B B . 16 TYR O 1 1 9 6778 2 2 16 TYR OH O -9.339 9.114 -1.439 1.00 . B B . 16 TYR OH 1 1 9 6779 2 2 17 LEU C C -3.314 3.123 -7.715 1.00 . B B . 17 LEU C 1 1 9 6780 2 2 17 LEU CA C -2.981 4.573 -7.361 1.00 . B B . 17 LEU CA 1 1 9 6781 2 2 17 LEU CB C -1.474 4.802 -7.507 1.00 . B B . 17 LEU CB 1 1 9 6782 2 2 17 LEU CD1 C -1.788 4.797 -9.988 1.00 . B B . 17 LEU CD1 1 1 9 6783 2 2 17 LEU CD2 C 0.501 4.555 -9.010 1.00 . B B . 17 LEU CD2 1 1 9 6784 2 2 17 LEU CG C -0.980 4.210 -8.828 1.00 . B B . 17 LEU CG 1 1 9 6785 2 2 17 LEU H H -2.702 4.855 -5.245 1.00 . B B . 17 LEU H 1 1 9 6786 2 2 17 LEU HA H -3.511 5.230 -8.023 1.00 . B B . 17 LEU HA 1 1 9 6787 2 2 17 LEU HB2 H -1.270 5.863 -7.491 1.00 . B B . 17 LEU HB2 1 1 9 6788 2 2 17 LEU HB3 H -0.959 4.325 -6.688 1.00 . B B . 17 LEU HB3 1 1 9 6789 2 2 17 LEU HD11 H -2.089 5.805 -9.744 1.00 . B B . 17 LEU HD11 1 1 9 6790 2 2 17 LEU HD12 H -2.666 4.191 -10.158 1.00 . B B . 17 LEU HD12 1 1 9 6791 2 2 17 LEU HD13 H -1.180 4.808 -10.881 1.00 . B B . 17 LEU HD13 1 1 9 6792 2 2 17 LEU HD21 H 1.072 4.124 -8.200 1.00 . B B . 17 LEU HD21 1 1 9 6793 2 2 17 LEU HD22 H 0.623 5.628 -9.005 1.00 . B B . 17 LEU HD22 1 1 9 6794 2 2 17 LEU HD23 H 0.851 4.156 -9.950 1.00 . B B . 17 LEU HD23 1 1 9 6795 2 2 17 LEU HG H -1.102 3.136 -8.811 1.00 . B B . 17 LEU HG 1 1 9 6796 2 2 17 LEU N N -3.380 4.858 -5.953 1.00 . B B . 17 LEU N 1 1 9 6797 2 2 17 LEU O O -3.970 2.846 -8.700 1.00 . B B . 17 LEU O 1 1 9 6798 2 2 18 VAL C C -4.641 0.591 -7.406 1.00 . B B . 18 VAL C 1 1 9 6799 2 2 18 VAL CA C -3.145 0.767 -7.209 1.00 . B B . 18 VAL CA 1 1 9 6800 2 2 18 VAL CB C -2.658 -0.105 -6.048 1.00 . B B . 18 VAL CB 1 1 9 6801 2 2 18 VAL CG1 C -1.309 0.405 -5.586 1.00 . B B . 18 VAL CG1 1 1 9 6802 2 2 18 VAL CG2 C -3.633 -0.040 -4.873 1.00 . B B . 18 VAL CG2 1 1 9 6803 2 2 18 VAL H H -2.335 2.452 -6.138 1.00 . B B . 18 VAL H 1 1 9 6804 2 2 18 VAL HA H -2.632 0.477 -8.111 1.00 . B B . 18 VAL HA 1 1 9 6805 2 2 18 VAL HB H -2.559 -1.126 -6.383 1.00 . B B . 18 VAL HB 1 1 9 6806 2 2 18 VAL HG11 H -0.970 1.174 -6.263 1.00 . B B . 18 VAL HG11 1 1 9 6807 2 2 18 VAL HG12 H -0.604 -0.410 -5.577 1.00 . B B . 18 VAL HG12 1 1 9 6808 2 2 18 VAL HG13 H -1.407 0.814 -4.592 1.00 . B B . 18 VAL HG13 1 1 9 6809 2 2 18 VAL HG21 H -4.586 -0.447 -5.172 1.00 . B B . 18 VAL HG21 1 1 9 6810 2 2 18 VAL HG22 H -3.755 0.985 -4.562 1.00 . B B . 18 VAL HG22 1 1 9 6811 2 2 18 VAL HG23 H -3.237 -0.620 -4.050 1.00 . B B . 18 VAL HG23 1 1 9 6812 2 2 18 VAL N N -2.862 2.200 -6.921 1.00 . B B . 18 VAL N 1 1 9 6813 2 2 18 VAL O O -5.093 -0.349 -8.029 1.00 . B B . 18 VAL O 1 1 9 6814 2 2 19 CYS C C -7.525 2.761 -7.133 1.00 . B B . 19 CYS C 1 1 9 6815 2 2 19 CYS CA C -6.881 1.374 -7.052 1.00 . B B . 19 CYS CA 1 1 9 6816 2 2 19 CYS CB C -7.461 0.610 -5.869 1.00 . B B . 19 CYS CB 1 1 9 6817 2 2 19 CYS H H -5.033 2.244 -6.386 1.00 . B B . 19 CYS H 1 1 9 6818 2 2 19 CYS HA H -7.080 0.830 -7.958 1.00 . B B . 19 CYS HA 1 1 9 6819 2 2 19 CYS HB2 H -6.894 0.840 -4.978 1.00 . B B . 19 CYS HB2 1 1 9 6820 2 2 19 CYS HB3 H -8.489 0.898 -5.725 1.00 . B B . 19 CYS HB3 1 1 9 6821 2 2 19 CYS N N -5.416 1.494 -6.884 1.00 . B B . 19 CYS N 1 1 9 6822 2 2 19 CYS O O -8.138 3.113 -8.120 1.00 . B B . 19 CYS O 1 1 9 6823 2 2 19 CYS SG S -7.367 -1.163 -6.205 1.00 . B B . 19 CYS SG 1 1 9 6824 2 2 20 GLY C C -9.519 4.801 -5.935 1.00 . B B . 20 GLY C 1 1 9 6825 2 2 20 GLY CA C -8.004 4.910 -6.120 1.00 . B B . 20 GLY CA 1 1 9 6826 2 2 20 GLY H H -6.897 3.249 -5.313 1.00 . B B . 20 GLY H 1 1 9 6827 2 2 20 GLY HA2 H -7.585 5.501 -5.320 1.00 . B B . 20 GLY HA2 1 1 9 6828 2 2 20 GLY HA3 H -7.795 5.385 -7.067 1.00 . B B . 20 GLY HA3 1 1 9 6829 2 2 20 GLY N N -7.395 3.550 -6.101 1.00 . B B . 20 GLY N 1 1 9 6830 2 2 20 GLY O O -10.037 5.005 -4.855 1.00 . B B . 20 GLY O 1 1 9 6831 2 2 21 GLU C C -12.085 3.071 -6.159 1.00 . B B . 21 GLU C 1 1 9 6832 2 2 21 GLU CA C -11.714 4.377 -6.865 1.00 . B B . 21 GLU CA 1 1 9 6833 2 2 21 GLU CB C -12.339 4.393 -8.262 1.00 . B B . 21 GLU CB 1 1 9 6834 2 2 21 GLU CD C -14.329 5.274 -9.490 1.00 . B B . 21 GLU CD 1 1 9 6835 2 2 21 GLU CG C -13.823 4.742 -8.148 1.00 . B B . 21 GLU CG 1 1 9 6836 2 2 21 GLU H H -9.796 4.335 -7.844 1.00 . B B . 21 GLU H 1 1 9 6837 2 2 21 GLU HA H -12.094 5.213 -6.295 1.00 . B B . 21 GLU HA 1 1 9 6838 2 2 21 GLU HB2 H -11.839 5.132 -8.871 1.00 . B B . 21 GLU HB2 1 1 9 6839 2 2 21 GLU HB3 H -12.234 3.419 -8.716 1.00 . B B . 21 GLU HB3 1 1 9 6840 2 2 21 GLU HG2 H -14.381 3.858 -7.877 1.00 . B B . 21 GLU HG2 1 1 9 6841 2 2 21 GLU HG3 H -13.958 5.499 -7.389 1.00 . B B . 21 GLU HG3 1 1 9 6842 2 2 21 GLU N N -10.233 4.489 -6.981 1.00 . B B . 21 GLU N 1 1 9 6843 2 2 21 GLU O O -13.198 2.899 -5.703 1.00 . B B . 21 GLU O 1 1 9 6844 2 2 21 GLU OE1 O -14.081 6.434 -9.778 1.00 . B B . 21 GLU OE1 1 1 9 6845 2 2 21 GLU OE2 O -14.959 4.513 -10.207 1.00 . B B . 21 GLU OE2 1 1 9 6846 2 2 22 ARG C C -11.251 1.003 -3.882 1.00 . B B . 22 ARG C 1 1 9 6847 2 2 22 ARG CA C -11.485 0.861 -5.390 1.00 . B B . 22 ARG CA 1 1 9 6848 2 2 22 ARG CB C -10.590 -0.241 -5.959 1.00 . B B . 22 ARG CB 1 1 9 6849 2 2 22 ARG CD C -12.259 -2.065 -5.523 1.00 . B B . 22 ARG CD 1 1 9 6850 2 2 22 ARG CG C -11.461 -1.327 -6.602 1.00 . B B . 22 ARG CG 1 1 9 6851 2 2 22 ARG CZ C -14.576 -2.652 -5.126 1.00 . B B . 22 ARG CZ 1 1 9 6852 2 2 22 ARG H H -10.276 2.298 -6.438 1.00 . B B . 22 ARG H 1 1 9 6853 2 2 22 ARG HA H -12.521 0.609 -5.568 1.00 . B B . 22 ARG HA 1 1 9 6854 2 2 22 ARG HB2 H -9.934 0.182 -6.706 1.00 . B B . 22 ARG HB2 1 1 9 6855 2 2 22 ARG HB3 H -10.001 -0.673 -5.167 1.00 . B B . 22 ARG HB3 1 1 9 6856 2 2 22 ARG HD2 H -11.975 -3.108 -5.514 1.00 . B B . 22 ARG HD2 1 1 9 6857 2 2 22 ARG HD3 H -12.054 -1.628 -4.557 1.00 . B B . 22 ARG HD3 1 1 9 6858 2 2 22 ARG HE H -14.027 -1.358 -6.530 1.00 . B B . 22 ARG HE 1 1 9 6859 2 2 22 ARG HG2 H -12.144 -0.868 -7.303 1.00 . B B . 22 ARG HG2 1 1 9 6860 2 2 22 ARG HG3 H -10.830 -2.030 -7.125 1.00 . B B . 22 ARG HG3 1 1 9 6861 2 2 22 ARG HH11 H -13.373 -4.241 -4.942 1.00 . B B . 22 ARG HH11 1 1 9 6862 2 2 22 ARG HH12 H -14.928 -4.387 -4.194 1.00 . B B . 22 ARG HH12 1 1 9 6863 2 2 22 ARG HH21 H -15.983 -1.229 -5.150 1.00 . B B . 22 ARG HH21 1 1 9 6864 2 2 22 ARG HH22 H -16.403 -2.684 -4.309 1.00 . B B . 22 ARG HH22 1 1 9 6865 2 2 22 ARG N N -11.169 2.147 -6.065 1.00 . B B . 22 ARG N 1 1 9 6866 2 2 22 ARG NE N -13.715 -1.955 -5.818 1.00 . B B . 22 ARG NE 1 1 9 6867 2 2 22 ARG NH1 N -14.268 -3.854 -4.723 1.00 . B B . 22 ARG NH1 1 1 9 6868 2 2 22 ARG NH2 N -15.745 -2.149 -4.840 1.00 . B B . 22 ARG NH2 1 1 9 6869 2 2 22 ARG O O -11.329 0.046 -3.139 1.00 . B B . 22 ARG O 1 1 9 6870 2 2 23 GLY C C -9.649 1.466 -1.465 1.00 . B B . 23 GLY C 1 1 9 6871 2 2 23 GLY CA C -10.743 2.409 -1.965 1.00 . B B . 23 GLY CA 1 1 9 6872 2 2 23 GLY H H -10.922 2.957 -4.041 1.00 . B B . 23 GLY H 1 1 9 6873 2 2 23 GLY HA2 H -10.441 3.433 -1.795 1.00 . B B . 23 GLY HA2 1 1 9 6874 2 2 23 GLY HA3 H -11.657 2.211 -1.426 1.00 . B B . 23 GLY HA3 1 1 9 6875 2 2 23 GLY N N -10.973 2.197 -3.424 1.00 . B B . 23 GLY N 1 1 9 6876 2 2 23 GLY O O -9.276 0.521 -2.132 1.00 . B B . 23 GLY O 1 1 9 6877 2 2 24 PHE C C -8.239 0.678 1.768 1.00 . B B . 24 PHE C 1 1 9 6878 2 2 24 PHE CA C -8.066 0.825 0.254 1.00 . B B . 24 PHE CA 1 1 9 6879 2 2 24 PHE CB C -6.689 1.421 -0.052 1.00 . B B . 24 PHE CB 1 1 9 6880 2 2 24 PHE CD1 C -6.515 3.454 1.431 1.00 . B B . 24 PHE CD1 1 1 9 6881 2 2 24 PHE CD2 C -6.945 3.769 -0.937 1.00 . B B . 24 PHE CD2 1 1 9 6882 2 2 24 PHE CE1 C -6.537 4.843 1.620 1.00 . B B . 24 PHE CE1 1 1 9 6883 2 2 24 PHE CE2 C -6.966 5.158 -0.748 1.00 . B B . 24 PHE CE2 1 1 9 6884 2 2 24 PHE CG C -6.719 2.917 0.153 1.00 . B B . 24 PHE CG 1 1 9 6885 2 2 24 PHE CZ C -6.763 5.695 0.530 1.00 . B B . 24 PHE CZ 1 1 9 6886 2 2 24 PHE H H -9.450 2.477 0.234 1.00 . B B . 24 PHE H 1 1 9 6887 2 2 24 PHE HA H -8.144 -0.147 -0.206 1.00 . B B . 24 PHE HA 1 1 9 6888 2 2 24 PHE HB2 H -5.955 0.983 0.608 1.00 . B B . 24 PHE HB2 1 1 9 6889 2 2 24 PHE HB3 H -6.425 1.204 -1.076 1.00 . B B . 24 PHE HB3 1 1 9 6890 2 2 24 PHE HD1 H -6.340 2.798 2.271 1.00 . B B . 24 PHE HD1 1 1 9 6891 2 2 24 PHE HD2 H -7.102 3.356 -1.922 1.00 . B B . 24 PHE HD2 1 1 9 6892 2 2 24 PHE HE1 H -6.381 5.256 2.606 1.00 . B B . 24 PHE HE1 1 1 9 6893 2 2 24 PHE HE2 H -7.142 5.814 -1.588 1.00 . B B . 24 PHE HE2 1 1 9 6894 2 2 24 PHE HZ H -6.777 6.765 0.675 1.00 . B B . 24 PHE HZ 1 1 9 6895 2 2 24 PHE N N -9.132 1.712 -0.290 1.00 . B B . 24 PHE N 1 1 9 6896 2 2 24 PHE O O -9.049 1.345 2.380 1.00 . B B . 24 PHE O 1 1 9 6897 2 2 25 PHE C C -6.271 -0.075 4.522 1.00 . B B . 25 PHE C 1 1 9 6898 2 2 25 PHE CA C -7.606 -0.399 3.847 1.00 . B B . 25 PHE CA 1 1 9 6899 2 2 25 PHE CB C -7.981 -1.856 4.129 1.00 . B B . 25 PHE CB 1 1 9 6900 2 2 25 PHE CD1 C -10.051 -1.642 5.551 1.00 . B B . 25 PHE CD1 1 1 9 6901 2 2 25 PHE CD2 C -7.977 -2.330 6.606 1.00 . B B . 25 PHE CD2 1 1 9 6902 2 2 25 PHE CE1 C -10.706 -1.721 6.787 1.00 . B B . 25 PHE CE1 1 1 9 6903 2 2 25 PHE CE2 C -8.632 -2.410 7.842 1.00 . B B . 25 PHE CE2 1 1 9 6904 2 2 25 PHE CG C -8.687 -1.945 5.461 1.00 . B B . 25 PHE CG 1 1 9 6905 2 2 25 PHE CZ C -9.996 -2.106 7.932 1.00 . B B . 25 PHE CZ 1 1 9 6906 2 2 25 PHE H H -6.842 -0.729 1.862 1.00 . B B . 25 PHE H 1 1 9 6907 2 2 25 PHE HA H -8.375 0.252 4.237 1.00 . B B . 25 PHE HA 1 1 9 6908 2 2 25 PHE HB2 H -8.636 -2.217 3.348 1.00 . B B . 25 PHE HB2 1 1 9 6909 2 2 25 PHE HB3 H -7.086 -2.460 4.155 1.00 . B B . 25 PHE HB3 1 1 9 6910 2 2 25 PHE HD1 H -10.598 -1.345 4.667 1.00 . B B . 25 PHE HD1 1 1 9 6911 2 2 25 PHE HD2 H -6.925 -2.565 6.535 1.00 . B B . 25 PHE HD2 1 1 9 6912 2 2 25 PHE HE1 H -11.758 -1.487 6.856 1.00 . B B . 25 PHE HE1 1 1 9 6913 2 2 25 PHE HE2 H -8.085 -2.706 8.725 1.00 . B B . 25 PHE HE2 1 1 9 6914 2 2 25 PHE HZ H -10.502 -2.167 8.885 1.00 . B B . 25 PHE HZ 1 1 9 6915 2 2 25 PHE N N -7.485 -0.199 2.375 1.00 . B B . 25 PHE N 1 1 9 6916 2 2 25 PHE O O -5.435 -0.936 4.713 1.00 . B B . 25 PHE O 1 1 9 6917 2 2 26 TYR C C -4.894 1.287 7.052 1.00 . B B . 26 TYR C 1 1 9 6918 2 2 26 TYR CA C -4.786 1.546 5.547 1.00 . B B . 26 TYR CA 1 1 9 6919 2 2 26 TYR CB C -4.515 3.031 5.297 1.00 . B B . 26 TYR CB 1 1 9 6920 2 2 26 TYR CD1 C -2.041 2.849 5.763 1.00 . B B . 26 TYR CD1 1 1 9 6921 2 2 26 TYR CD2 C -3.353 4.464 7.012 1.00 . B B . 26 TYR CD2 1 1 9 6922 2 2 26 TYR CE1 C -0.890 3.248 6.457 1.00 . B B . 26 TYR CE1 1 1 9 6923 2 2 26 TYR CE2 C -2.204 4.863 7.705 1.00 . B B . 26 TYR CE2 1 1 9 6924 2 2 26 TYR CG C -3.273 3.457 6.042 1.00 . B B . 26 TYR CG 1 1 9 6925 2 2 26 TYR CZ C -0.972 4.256 7.428 1.00 . B B . 26 TYR CZ 1 1 9 6926 2 2 26 TYR H H -6.753 1.840 4.721 1.00 . B B . 26 TYR H 1 1 9 6927 2 2 26 TYR HA H -3.977 0.958 5.137 1.00 . B B . 26 TYR HA 1 1 9 6928 2 2 26 TYR HB2 H -4.375 3.198 4.239 1.00 . B B . 26 TYR HB2 1 1 9 6929 2 2 26 TYR HB3 H -5.357 3.612 5.644 1.00 . B B . 26 TYR HB3 1 1 9 6930 2 2 26 TYR HD1 H -1.979 2.073 5.014 1.00 . B B . 26 TYR HD1 1 1 9 6931 2 2 26 TYR HD2 H -4.303 4.932 7.226 1.00 . B B . 26 TYR HD2 1 1 9 6932 2 2 26 TYR HE1 H 0.059 2.781 6.243 1.00 . B B . 26 TYR HE1 1 1 9 6933 2 2 26 TYR HE2 H -2.268 5.639 8.453 1.00 . B B . 26 TYR HE2 1 1 9 6934 2 2 26 TYR HH H 0.573 5.361 7.621 1.00 . B B . 26 TYR HH 1 1 9 6935 2 2 26 TYR N N -6.065 1.162 4.884 1.00 . B B . 26 TYR N 1 1 9 6936 2 2 26 TYR O O -5.875 1.631 7.681 1.00 . B B . 26 TYR O 1 1 9 6937 2 2 26 TYR OH O 0.160 4.648 8.114 1.00 . B B . 26 TYR OH 1 1 9 6938 2 2 27 THR C C -2.740 1.036 9.794 1.00 . B B . 27 THR C 1 1 9 6939 2 2 27 THR CA C -3.948 0.397 9.099 1.00 . B B . 27 THR CA 1 1 9 6940 2 2 27 THR CB C -3.923 -1.116 9.326 1.00 . B B . 27 THR CB 1 1 9 6941 2 2 27 THR CG2 C -4.905 -1.796 8.370 1.00 . B B . 27 THR CG2 1 1 9 6942 2 2 27 THR H H -3.114 0.407 7.112 1.00 . B B . 27 THR H 1 1 9 6943 2 2 27 THR HA H -4.858 0.807 9.512 1.00 . B B . 27 THR HA 1 1 9 6944 2 2 27 THR HB H -4.210 -1.332 10.343 1.00 . B B . 27 THR HB 1 1 9 6945 2 2 27 THR HG1 H -2.414 -2.264 9.760 1.00 . B B . 27 THR HG1 1 1 9 6946 2 2 27 THR HG21 H -4.368 -2.475 7.725 1.00 . B B . 27 THR HG21 1 1 9 6947 2 2 27 THR HG22 H -5.402 -1.047 7.771 1.00 . B B . 27 THR HG22 1 1 9 6948 2 2 27 THR HG23 H -5.639 -2.346 8.940 1.00 . B B . 27 THR HG23 1 1 9 6949 2 2 27 THR N N -3.895 0.680 7.636 1.00 . B B . 27 THR N 1 1 9 6950 2 2 27 THR O O -1.652 1.077 9.256 1.00 . B B . 27 THR O 1 1 9 6951 2 2 27 THR OG1 O -2.611 -1.607 9.088 1.00 . B B . 27 THR OG1 1 1 9 6952 2 2 28 LYS C C -1.067 1.165 12.595 1.00 . B B . 28 LYS C 1 1 9 6953 2 2 28 LYS CA C -1.794 2.182 11.718 1.00 . B B . 28 LYS CA 1 1 9 6954 2 2 28 LYS CB C -2.319 3.284 12.641 1.00 . B B . 28 LYS CB 1 1 9 6955 2 2 28 LYS CD C -1.892 5.017 10.885 1.00 . B B . 28 LYS CD 1 1 9 6956 2 2 28 LYS CE C -3.381 5.325 10.725 1.00 . B B . 28 LYS CE 1 1 9 6957 2 2 28 LYS CG C -1.610 4.604 12.331 1.00 . B B . 28 LYS CG 1 1 9 6958 2 2 28 LYS H H -3.816 1.501 11.392 1.00 . B B . 28 LYS H 1 1 9 6959 2 2 28 LYS HA H -1.101 2.609 11.010 1.00 . B B . 28 LYS HA 1 1 9 6960 2 2 28 LYS HB2 H -3.382 3.393 12.511 1.00 . B B . 28 LYS HB2 1 1 9 6961 2 2 28 LYS HB3 H -2.117 3.006 13.667 1.00 . B B . 28 LYS HB3 1 1 9 6962 2 2 28 LYS HD2 H -1.313 5.897 10.644 1.00 . B B . 28 LYS HD2 1 1 9 6963 2 2 28 LYS HD3 H -1.619 4.213 10.218 1.00 . B B . 28 LYS HD3 1 1 9 6964 2 2 28 LYS HE2 H -3.524 5.982 9.880 1.00 . B B . 28 LYS HE2 1 1 9 6965 2 2 28 LYS HE3 H -3.925 4.406 10.564 1.00 . B B . 28 LYS HE3 1 1 9 6966 2 2 28 LYS HG2 H -1.971 5.369 13.002 1.00 . B B . 28 LYS HG2 1 1 9 6967 2 2 28 LYS HG3 H -0.546 4.480 12.467 1.00 . B B . 28 LYS HG3 1 1 9 6968 2 2 28 LYS HZ1 H -3.913 5.299 12.738 1.00 . B B . 28 LYS HZ1 1 1 9 6969 2 2 28 LYS HZ2 H -4.837 6.364 11.790 1.00 . B B . 28 LYS HZ2 1 1 9 6970 2 2 28 LYS HZ3 H -3.245 6.769 12.218 1.00 . B B . 28 LYS HZ3 1 1 9 6971 2 2 28 LYS N N -2.928 1.539 10.985 1.00 . B B . 28 LYS N 1 1 9 6972 2 2 28 LYS NZ N -3.882 5.989 11.961 1.00 . B B . 28 LYS NZ 1 1 9 6973 2 2 28 LYS O O 0.138 1.029 12.511 1.00 . B B . 28 LYS O 1 1 9 6974 2 2 29 PRO C C -0.998 -1.801 13.730 1.00 . B B . 29 PRO C 1 1 9 6975 2 2 29 PRO CA C -1.254 -0.450 14.404 1.00 . B B . 29 PRO CA 1 1 9 6976 2 2 29 PRO CB C -2.349 -0.560 15.464 1.00 . B B . 29 PRO CB 1 1 9 6977 2 2 29 PRO CD C -3.284 0.672 13.543 1.00 . B B . 29 PRO CD 1 1 9 6978 2 2 29 PRO CG C -3.671 -0.145 14.783 1.00 . B B . 29 PRO CG 1 1 9 6979 2 2 29 PRO HA H -0.350 -0.067 14.848 1.00 . B B . 29 PRO HA 1 1 9 6980 2 2 29 PRO HB2 H -2.415 -1.570 15.828 1.00 . B B . 29 PRO HB2 1 1 9 6981 2 2 29 PRO HB3 H -2.140 0.121 16.273 1.00 . B B . 29 PRO HB3 1 1 9 6982 2 2 29 PRO HD2 H -3.768 0.264 12.668 1.00 . B B . 29 PRO HD2 1 1 9 6983 2 2 29 PRO HD3 H -3.548 1.705 13.681 1.00 . B B . 29 PRO HD3 1 1 9 6984 2 2 29 PRO HG2 H -4.228 -1.025 14.491 1.00 . B B . 29 PRO HG2 1 1 9 6985 2 2 29 PRO HG3 H -4.258 0.463 15.452 1.00 . B B . 29 PRO HG3 1 1 9 6986 2 2 29 PRO N N -1.814 0.515 13.450 1.00 . B B . 29 PRO N 1 1 9 6987 2 2 29 PRO O O -1.784 -2.720 13.843 1.00 . B B . 29 PRO O 1 1 9 6988 2 2 30 THR C C -0.834 -3.801 11.732 1.00 . B B . 30 THR C 1 1 9 6989 2 2 30 THR CA C 0.430 -3.212 12.363 1.00 . B B . 30 THR CA 1 1 9 6990 2 2 30 THR CB C 0.996 -4.194 13.391 1.00 . B B . 30 THR CB 1 1 9 6991 2 2 30 THR CG2 C 2.200 -3.562 14.092 1.00 . B B . 30 THR CG2 1 1 9 6992 2 2 30 THR H H 0.725 -1.169 12.973 1.00 . B B . 30 THR H 1 1 9 6993 2 2 30 THR HA H 1.167 -3.035 11.592 1.00 . B B . 30 THR HA 1 1 9 6994 2 2 30 THR HB H 1.309 -5.099 12.893 1.00 . B B . 30 THR HB 1 1 9 6995 2 2 30 THR HG1 H -0.252 -5.421 14.238 1.00 . B B . 30 THR HG1 1 1 9 6996 2 2 30 THR HG21 H 2.214 -2.500 13.896 1.00 . B B . 30 THR HG21 1 1 9 6997 2 2 30 THR HG22 H 3.110 -4.009 13.718 1.00 . B B . 30 THR HG22 1 1 9 6998 2 2 30 THR HG23 H 2.127 -3.731 15.156 1.00 . B B . 30 THR HG23 1 1 9 6999 2 2 30 THR N N 0.105 -1.925 13.041 1.00 . B B . 30 THR N 1 1 9 7000 2 2 30 THR O O -1.700 -3.029 11.354 1.00 . B B . 30 THR O 1 1 9 7001 2 2 30 THR OXT O -0.914 -5.015 11.638 1.00 . B B . 30 THR OXT 1 1 9 7002 2 2 30 THR OG1 O -0.005 -4.501 14.351 1.00 . B B . 30 THR OG1 1 1 10 7003 1 1 1 GLY C C 0.543 -4.630 8.244 1.00 . A A . 1 GLY C 1 1 10 7004 1 1 1 GLY CA C -0.275 -4.919 9.458 1.00 . A A . 1 GLY CA 1 1 10 7005 1 1 1 GLY H1 H 1.189 -6.015 10.523 1.00 . A A . 1 GLY H1 1 1 10 7006 1 1 1 GLY H2 H -0.263 -5.806 11.381 1.00 . A A . 1 GLY H2 1 1 10 7007 1 1 1 GLY H3 H 0.825 -4.511 11.220 1.00 . A A . 1 GLY H3 1 1 10 7008 1 1 1 GLY HA2 H -0.574 -5.691 8.943 1.00 . A A . 1 GLY HA2 1 1 10 7009 1 1 1 GLY HA3 H -1.151 -4.209 9.764 1.00 . A A . 1 GLY HA3 1 1 10 7010 1 1 1 GLY N N 0.425 -5.347 10.749 1.00 . A A . 1 GLY N 1 1 10 7011 1 1 1 GLY O O 1.755 -4.700 8.270 1.00 . A A . 1 GLY O 1 1 10 7012 1 1 2 ILE C C 1.795 -3.016 6.216 1.00 . A A . 2 ILE C 1 1 10 7013 1 1 2 ILE CA C 0.668 -4.003 5.906 1.00 . A A . 2 ILE CA 1 1 10 7014 1 1 2 ILE CB C -0.278 -3.400 4.863 1.00 . A A . 2 ILE CB 1 1 10 7015 1 1 2 ILE CD1 C -0.412 -2.329 2.613 1.00 . A A . 2 ILE CD1 1 1 10 7016 1 1 2 ILE CG1 C 0.536 -2.801 3.716 1.00 . A A . 2 ILE CG1 1 1 10 7017 1 1 2 ILE CG2 C -1.122 -2.301 5.509 1.00 . A A . 2 ILE CG2 1 1 10 7018 1 1 2 ILE H H -1.072 -4.253 7.151 1.00 . A A . 2 ILE H 1 1 10 7019 1 1 2 ILE HA H 1.091 -4.914 5.522 1.00 . A A . 2 ILE HA 1 1 10 7020 1 1 2 ILE HB H -0.928 -4.173 4.479 1.00 . A A . 2 ILE HB 1 1 10 7021 1 1 2 ILE HD11 H -0.125 -2.780 1.674 1.00 . A A . 2 ILE HD11 1 1 10 7022 1 1 2 ILE HD12 H -0.358 -1.254 2.527 1.00 . A A . 2 ILE HD12 1 1 10 7023 1 1 2 ILE HD13 H -1.422 -2.621 2.857 1.00 . A A . 2 ILE HD13 1 1 10 7024 1 1 2 ILE HG12 H 1.110 -1.962 4.082 1.00 . A A . 2 ILE HG12 1 1 10 7025 1 1 2 ILE HG13 H 1.204 -3.550 3.318 1.00 . A A . 2 ILE HG13 1 1 10 7026 1 1 2 ILE HG21 H -0.646 -1.344 5.352 1.00 . A A . 2 ILE HG21 1 1 10 7027 1 1 2 ILE HG22 H -1.212 -2.489 6.568 1.00 . A A . 2 ILE HG22 1 1 10 7028 1 1 2 ILE HG23 H -2.104 -2.291 5.060 1.00 . A A . 2 ILE HG23 1 1 10 7029 1 1 2 ILE N N -0.093 -4.301 7.152 1.00 . A A . 2 ILE N 1 1 10 7030 1 1 2 ILE O O 2.849 -3.053 5.620 1.00 . A A . 2 ILE O 1 1 10 7031 1 1 3 ABA C C 3.971 -1.826 7.679 1.00 . A A . 3 ABA C 1 1 10 7032 1 1 3 ABA CA C 2.614 -1.140 7.509 1.00 . A A . 3 ABA CA 1 1 10 7033 1 1 3 ABA CB C 2.216 -0.466 8.820 1.00 . A A . 3 ABA CB 1 1 10 7034 1 1 3 ABA CG C 1.268 0.701 8.536 1.00 . A A . 3 ABA CG 1 1 10 7035 1 1 3 ABA H H 0.722 -2.126 7.605 1.00 . A A . 3 ABA H 1 1 10 7036 1 1 3 ABA HA H 2.686 -0.396 6.736 1.00 . A A . 3 ABA HA 1 1 10 7037 1 1 3 ABA HB2 H 1.725 -1.184 9.456 1.00 . A A . 3 ABA HB2 1 1 10 7038 1 1 3 ABA HB3 H 3.096 -0.101 9.311 1.00 . A A . 3 ABA HB3 1 1 10 7039 1 1 3 ABA HG1 H 0.483 0.374 7.872 1.00 . A A . 3 ABA HG1 1 1 10 7040 1 1 3 ABA HG2 H 1.818 1.508 8.074 1.00 . A A . 3 ABA HG2 1 1 10 7041 1 1 3 ABA HG3 H 0.835 1.046 9.464 1.00 . A A . 3 ABA HG3 1 1 10 7042 1 1 3 ABA N N 1.575 -2.135 7.145 1.00 . A A . 3 ABA N 1 1 10 7043 1 1 3 ABA O O 4.707 -1.972 6.736 1.00 . A A . 3 ABA O 1 1 10 7044 1 1 4 GLU C C 6.196 -3.544 7.905 1.00 . A A . 4 GLU C 1 1 10 7045 1 1 4 GLU CA C 5.617 -2.890 9.162 1.00 . A A . 4 GLU CA 1 1 10 7046 1 1 4 GLU CB C 5.416 -3.962 10.228 1.00 . A A . 4 GLU CB 1 1 10 7047 1 1 4 GLU CD C 5.747 -4.012 12.703 1.00 . A A . 4 GLU CD 1 1 10 7048 1 1 4 GLU CG C 6.426 -3.754 11.356 1.00 . A A . 4 GLU CG 1 1 10 7049 1 1 4 GLU H H 3.675 -2.077 9.621 1.00 . A A . 4 GLU H 1 1 10 7050 1 1 4 GLU HA H 6.314 -2.152 9.532 1.00 . A A . 4 GLU HA 1 1 10 7051 1 1 4 GLU HB2 H 4.414 -3.889 10.620 1.00 . A A . 4 GLU HB2 1 1 10 7052 1 1 4 GLU HB3 H 5.562 -4.938 9.790 1.00 . A A . 4 GLU HB3 1 1 10 7053 1 1 4 GLU HG2 H 7.251 -4.439 11.230 1.00 . A A . 4 GLU HG2 1 1 10 7054 1 1 4 GLU HG3 H 6.792 -2.739 11.329 1.00 . A A . 4 GLU HG3 1 1 10 7055 1 1 4 GLU N N 4.298 -2.226 8.883 1.00 . A A . 4 GLU N 1 1 10 7056 1 1 4 GLU O O 7.366 -3.407 7.609 1.00 . A A . 4 GLU O 1 1 10 7057 1 1 4 GLU OE1 O 4.593 -3.642 12.842 1.00 . A A . 4 GLU OE1 1 1 10 7058 1 1 4 GLU OE2 O 6.393 -4.575 13.572 1.00 . A A . 4 GLU OE2 1 1 10 7059 1 1 5 GLN C C 6.027 -3.852 4.814 1.00 . A A . 5 GLN C 1 1 10 7060 1 1 5 GLN CA C 5.912 -4.898 5.926 1.00 . A A . 5 GLN CA 1 1 10 7061 1 1 5 GLN CB C 4.946 -6.002 5.491 1.00 . A A . 5 GLN CB 1 1 10 7062 1 1 5 GLN CD C 5.361 -8.458 5.701 1.00 . A A . 5 GLN CD 1 1 10 7063 1 1 5 GLN CG C 5.735 -7.188 4.931 1.00 . A A . 5 GLN CG 1 1 10 7064 1 1 5 GLN H H 4.451 -4.348 7.411 1.00 . A A . 5 GLN H 1 1 10 7065 1 1 5 GLN HA H 6.884 -5.326 6.124 1.00 . A A . 5 GLN HA 1 1 10 7066 1 1 5 GLN HB2 H 4.364 -6.327 6.342 1.00 . A A . 5 GLN HB2 1 1 10 7067 1 1 5 GLN HB3 H 4.284 -5.621 4.728 1.00 . A A . 5 GLN HB3 1 1 10 7068 1 1 5 GLN HE21 H 5.267 -9.592 4.072 1.00 . A A . 5 GLN HE21 1 1 10 7069 1 1 5 GLN HE22 H 4.930 -10.389 5.532 1.00 . A A . 5 GLN HE22 1 1 10 7070 1 1 5 GLN HG2 H 5.497 -7.316 3.885 1.00 . A A . 5 GLN HG2 1 1 10 7071 1 1 5 GLN HG3 H 6.792 -7.002 5.040 1.00 . A A . 5 GLN HG3 1 1 10 7072 1 1 5 GLN N N 5.393 -4.248 7.161 1.00 . A A . 5 GLN N 1 1 10 7073 1 1 5 GLN NE2 N 5.170 -9.572 5.047 1.00 . A A . 5 GLN NE2 1 1 10 7074 1 1 5 GLN O O 7.087 -3.610 4.278 1.00 . A A . 5 GLN O 1 1 10 7075 1 1 5 GLN OE1 O 5.242 -8.435 6.910 1.00 . A A . 5 GLN OE1 1 1 10 7076 1 1 6 CYS C C 5.505 -0.869 3.906 1.00 . A A . 6 CYS C 1 1 10 7077 1 1 6 CYS CA C 4.964 -2.198 3.390 1.00 . A A . 6 CYS CA 1 1 10 7078 1 1 6 CYS CB C 3.546 -1.984 2.855 1.00 . A A . 6 CYS CB 1 1 10 7079 1 1 6 CYS H H 4.100 -3.438 4.923 1.00 . A A . 6 CYS H 1 1 10 7080 1 1 6 CYS HA H 5.596 -2.548 2.581 1.00 . A A . 6 CYS HA 1 1 10 7081 1 1 6 CYS HB2 H 2.827 -2.408 3.532 1.00 . A A . 6 CYS HB2 1 1 10 7082 1 1 6 CYS HB3 H 3.354 -0.934 2.750 1.00 . A A . 6 CYS HB3 1 1 10 7083 1 1 6 CYS N N 4.939 -3.229 4.469 1.00 . A A . 6 CYS N 1 1 10 7084 1 1 6 CYS O O 5.577 0.096 3.187 1.00 . A A . 6 CYS O 1 1 10 7085 1 1 6 CYS SG S 3.412 -2.790 1.256 1.00 . A A . 6 CYS SG 1 1 10 7086 1 1 7 CYS C C 7.877 0.307 6.025 1.00 . A A . 7 CYS C 1 1 10 7087 1 1 7 CYS CA C 6.404 0.487 5.662 1.00 . A A . 7 CYS CA 1 1 10 7088 1 1 7 CYS CB C 5.599 0.868 6.901 1.00 . A A . 7 CYS CB 1 1 10 7089 1 1 7 CYS H H 5.818 -1.581 5.718 1.00 . A A . 7 CYS H 1 1 10 7090 1 1 7 CYS HA H 6.304 1.257 4.912 1.00 . A A . 7 CYS HA 1 1 10 7091 1 1 7 CYS HB2 H 4.661 0.332 6.897 1.00 . A A . 7 CYS HB2 1 1 10 7092 1 1 7 CYS HB3 H 6.156 0.596 7.771 1.00 . A A . 7 CYS HB3 1 1 10 7093 1 1 7 CYS N N 5.882 -0.796 5.135 1.00 . A A . 7 CYS N 1 1 10 7094 1 1 7 CYS O O 8.611 1.263 6.181 1.00 . A A . 7 CYS O 1 1 10 7095 1 1 7 CYS SG S 5.268 2.650 6.923 1.00 . A A . 7 CYS SG 1 1 10 7096 1 1 8 THR C C 10.399 -2.054 5.447 1.00 . A A . 8 THR C 1 1 10 7097 1 1 8 THR CA C 9.744 -1.159 6.507 1.00 . A A . 8 THR CA 1 1 10 7098 1 1 8 THR CB C 9.827 -1.846 7.871 1.00 . A A . 8 THR CB 1 1 10 7099 1 1 8 THR CG2 C 8.705 -1.329 8.774 1.00 . A A . 8 THR CG2 1 1 10 7100 1 1 8 THR H H 7.707 -1.675 6.029 1.00 . A A . 8 THR H 1 1 10 7101 1 1 8 THR HA H 10.267 -0.216 6.550 1.00 . A A . 8 THR HA 1 1 10 7102 1 1 8 THR HB H 10.779 -1.627 8.327 1.00 . A A . 8 THR HB 1 1 10 7103 1 1 8 THR HG1 H 10.573 -3.626 7.631 1.00 . A A . 8 THR HG1 1 1 10 7104 1 1 8 THR HG21 H 8.630 -1.957 9.650 1.00 . A A . 8 THR HG21 1 1 10 7105 1 1 8 THR HG22 H 7.770 -1.351 8.236 1.00 . A A . 8 THR HG22 1 1 10 7106 1 1 8 THR HG23 H 8.924 -0.315 9.076 1.00 . A A . 8 THR HG23 1 1 10 7107 1 1 8 THR N N 8.317 -0.917 6.158 1.00 . A A . 8 THR N 1 1 10 7108 1 1 8 THR O O 11.608 -2.106 5.336 1.00 . A A . 8 THR O 1 1 10 7109 1 1 8 THR OG1 O 9.693 -3.249 7.701 1.00 . A A . 8 THR OG1 1 1 10 7110 1 1 9 SER C C 9.960 -3.064 2.225 1.00 . A A . 9 SER C 1 1 10 7111 1 1 9 SER CA C 10.236 -3.637 3.622 1.00 . A A . 9 SER CA 1 1 10 7112 1 1 9 SER CB C 9.687 -5.069 3.739 1.00 . A A . 9 SER CB 1 1 10 7113 1 1 9 SER H H 8.647 -2.706 4.760 1.00 . A A . 9 SER H 1 1 10 7114 1 1 9 SER HA H 11.304 -3.660 3.776 1.00 . A A . 9 SER HA 1 1 10 7115 1 1 9 SER HB2 H 10.328 -5.745 3.197 1.00 . A A . 9 SER HB2 1 1 10 7116 1 1 9 SER HB3 H 9.667 -5.361 4.781 1.00 . A A . 9 SER HB3 1 1 10 7117 1 1 9 SER HG H 8.185 -6.057 2.995 1.00 . A A . 9 SER HG 1 1 10 7118 1 1 9 SER N N 9.622 -2.758 4.664 1.00 . A A . 9 SER N 1 1 10 7119 1 1 9 SER O O 10.542 -2.072 1.834 1.00 . A A . 9 SER O 1 1 10 7120 1 1 9 SER OG O 8.378 -5.137 3.190 1.00 . A A . 9 SER OG 1 1 10 7121 1 1 10 ILE C C 7.424 -3.563 -0.368 1.00 . A A . 10 ILE C 1 1 10 7122 1 1 10 ILE CA C 8.830 -3.149 0.093 1.00 . A A . 10 ILE CA 1 1 10 7123 1 1 10 ILE CB C 9.897 -3.711 -0.859 1.00 . A A . 10 ILE CB 1 1 10 7124 1 1 10 ILE CD1 C 12.212 -3.331 0.003 1.00 . A A . 10 ILE CD1 1 1 10 7125 1 1 10 ILE CG1 C 11.096 -2.766 -0.876 1.00 . A A . 10 ILE CG1 1 1 10 7126 1 1 10 ILE CG2 C 9.337 -3.850 -2.274 1.00 . A A . 10 ILE CG2 1 1 10 7127 1 1 10 ILE H H 8.641 -4.480 1.770 1.00 . A A . 10 ILE H 1 1 10 7128 1 1 10 ILE HA H 8.897 -2.074 0.106 1.00 . A A . 10 ILE HA 1 1 10 7129 1 1 10 ILE HB H 10.215 -4.678 -0.507 1.00 . A A . 10 ILE HB 1 1 10 7130 1 1 10 ILE HD11 H 12.911 -2.543 0.245 1.00 . A A . 10 ILE HD11 1 1 10 7131 1 1 10 ILE HD12 H 12.726 -4.116 -0.530 1.00 . A A . 10 ILE HD12 1 1 10 7132 1 1 10 ILE HD13 H 11.788 -3.729 0.912 1.00 . A A . 10 ILE HD13 1 1 10 7133 1 1 10 ILE HG12 H 11.453 -2.656 -1.888 1.00 . A A . 10 ILE HG12 1 1 10 7134 1 1 10 ILE HG13 H 10.795 -1.806 -0.491 1.00 . A A . 10 ILE HG13 1 1 10 7135 1 1 10 ILE HG21 H 10.069 -4.327 -2.903 1.00 . A A . 10 ILE HG21 1 1 10 7136 1 1 10 ILE HG22 H 9.104 -2.872 -2.664 1.00 . A A . 10 ILE HG22 1 1 10 7137 1 1 10 ILE HG23 H 8.439 -4.451 -2.246 1.00 . A A . 10 ILE HG23 1 1 10 7138 1 1 10 ILE N N 9.098 -3.675 1.457 1.00 . A A . 10 ILE N 1 1 10 7139 1 1 10 ILE O O 6.772 -4.383 0.248 1.00 . A A . 10 ILE O 1 1 10 7140 1 1 11 CYS C C 5.571 -3.332 -3.487 1.00 . A A . 11 CYS C 1 1 10 7141 1 1 11 CYS CA C 5.602 -3.352 -1.965 1.00 . A A . 11 CYS CA 1 1 10 7142 1 1 11 CYS CB C 4.589 -2.334 -1.467 1.00 . A A . 11 CYS CB 1 1 10 7143 1 1 11 CYS H H 7.507 -2.334 -1.933 1.00 . A A . 11 CYS H 1 1 10 7144 1 1 11 CYS HA H 5.322 -4.329 -1.611 1.00 . A A . 11 CYS HA 1 1 10 7145 1 1 11 CYS HB2 H 4.659 -1.436 -2.062 1.00 . A A . 11 CYS HB2 1 1 10 7146 1 1 11 CYS HB3 H 3.593 -2.745 -1.549 1.00 . A A . 11 CYS HB3 1 1 10 7147 1 1 11 CYS N N 6.960 -2.996 -1.455 1.00 . A A . 11 CYS N 1 1 10 7148 1 1 11 CYS O O 6.387 -2.711 -4.138 1.00 . A A . 11 CYS O 1 1 10 7149 1 1 11 CYS SG S 4.942 -1.949 0.250 1.00 . A A . 11 CYS SG 1 1 10 7150 1 1 12 SER C C 3.074 -3.388 -5.852 1.00 . A A . 12 SER C 1 1 10 7151 1 1 12 SER CA C 4.437 -3.978 -5.523 1.00 . A A . 12 SER CA 1 1 10 7152 1 1 12 SER CB C 4.554 -5.394 -6.085 1.00 . A A . 12 SER CB 1 1 10 7153 1 1 12 SER H H 3.933 -4.436 -3.490 1.00 . A A . 12 SER H 1 1 10 7154 1 1 12 SER HA H 5.202 -3.353 -5.965 1.00 . A A . 12 SER HA 1 1 10 7155 1 1 12 SER HB2 H 3.801 -5.543 -6.842 1.00 . A A . 12 SER HB2 1 1 10 7156 1 1 12 SER HB3 H 5.530 -5.517 -6.528 1.00 . A A . 12 SER HB3 1 1 10 7157 1 1 12 SER HG H 5.092 -6.262 -4.429 1.00 . A A . 12 SER HG 1 1 10 7158 1 1 12 SER N N 4.593 -3.977 -4.049 1.00 . A A . 12 SER N 1 1 10 7159 1 1 12 SER O O 2.136 -3.485 -5.086 1.00 . A A . 12 SER O 1 1 10 7160 1 1 12 SER OG O 4.361 -6.342 -5.045 1.00 . A A . 12 SER OG 1 1 10 7161 1 1 13 LEU C C 0.553 -3.124 -7.399 1.00 . A A . 13 LEU C 1 1 10 7162 1 1 13 LEU CA C 1.691 -2.105 -7.360 1.00 . A A . 13 LEU CA 1 1 10 7163 1 1 13 LEU CB C 1.852 -1.479 -8.741 1.00 . A A . 13 LEU CB 1 1 10 7164 1 1 13 LEU CD1 C 1.620 -2.303 -11.083 1.00 . A A . 13 LEU CD1 1 1 10 7165 1 1 13 LEU CD2 C 3.775 -2.601 -9.869 1.00 . A A . 13 LEU CD2 1 1 10 7166 1 1 13 LEU CG C 2.254 -2.573 -9.723 1.00 . A A . 13 LEU CG 1 1 10 7167 1 1 13 LEU H H 3.760 -2.672 -7.551 1.00 . A A . 13 LEU H 1 1 10 7168 1 1 13 LEU HA H 1.449 -1.340 -6.646 1.00 . A A . 13 LEU HA 1 1 10 7169 1 1 13 LEU HB2 H 0.915 -1.036 -9.051 1.00 . A A . 13 LEU HB2 1 1 10 7170 1 1 13 LEU HB3 H 2.620 -0.721 -8.711 1.00 . A A . 13 LEU HB3 1 1 10 7171 1 1 13 LEU HD11 H 2.258 -1.643 -11.651 1.00 . A A . 13 LEU HD11 1 1 10 7172 1 1 13 LEU HD12 H 0.654 -1.841 -10.944 1.00 . A A . 13 LEU HD12 1 1 10 7173 1 1 13 LEU HD13 H 1.501 -3.236 -11.614 1.00 . A A . 13 LEU HD13 1 1 10 7174 1 1 13 LEU HD21 H 4.213 -1.862 -9.214 1.00 . A A . 13 LEU HD21 1 1 10 7175 1 1 13 LEU HD22 H 4.042 -2.380 -10.892 1.00 . A A . 13 LEU HD22 1 1 10 7176 1 1 13 LEU HD23 H 4.144 -3.580 -9.604 1.00 . A A . 13 LEU HD23 1 1 10 7177 1 1 13 LEU HG H 1.910 -3.524 -9.346 1.00 . A A . 13 LEU HG 1 1 10 7178 1 1 13 LEU N N 2.975 -2.749 -6.970 1.00 . A A . 13 LEU N 1 1 10 7179 1 1 13 LEU O O -0.606 -2.762 -7.444 1.00 . A A . 13 LEU O 1 1 10 7180 1 1 14 TYR C C -0.422 -5.872 -5.965 1.00 . A A . 14 TYR C 1 1 10 7181 1 1 14 TYR CA C -0.256 -5.377 -7.375 1.00 . A A . 14 TYR CA 1 1 10 7182 1 1 14 TYR CB C 0.093 -6.530 -8.319 1.00 . A A . 14 TYR CB 1 1 10 7183 1 1 14 TYR CD1 C -2.135 -7.599 -8.814 1.00 . A A . 14 TYR CD1 1 1 10 7184 1 1 14 TYR CD2 C -0.594 -8.746 -7.331 1.00 . A A . 14 TYR CD2 1 1 10 7185 1 1 14 TYR CE1 C -3.059 -8.642 -8.661 1.00 . A A . 14 TYR CE1 1 1 10 7186 1 1 14 TYR CE2 C -1.518 -9.789 -7.178 1.00 . A A . 14 TYR CE2 1 1 10 7187 1 1 14 TYR CG C -0.903 -7.652 -8.150 1.00 . A A . 14 TYR CG 1 1 10 7188 1 1 14 TYR CZ C -2.750 -9.737 -7.843 1.00 . A A . 14 TYR CZ 1 1 10 7189 1 1 14 TYR H H 1.783 -4.689 -7.283 1.00 . A A . 14 TYR H 1 1 10 7190 1 1 14 TYR HA H -1.163 -4.890 -7.686 1.00 . A A . 14 TYR HA 1 1 10 7191 1 1 14 TYR HB2 H 0.070 -6.178 -9.340 1.00 . A A . 14 TYR HB2 1 1 10 7192 1 1 14 TYR HB3 H 1.084 -6.893 -8.088 1.00 . A A . 14 TYR HB3 1 1 10 7193 1 1 14 TYR HD1 H -2.374 -6.755 -9.445 1.00 . A A . 14 TYR HD1 1 1 10 7194 1 1 14 TYR HD2 H 0.355 -8.787 -6.819 1.00 . A A . 14 TYR HD2 1 1 10 7195 1 1 14 TYR HE1 H -4.009 -8.601 -9.173 1.00 . A A . 14 TYR HE1 1 1 10 7196 1 1 14 TYR HE2 H -1.280 -10.633 -6.548 1.00 . A A . 14 TYR HE2 1 1 10 7197 1 1 14 TYR HH H -3.182 -11.540 -7.387 1.00 . A A . 14 TYR HH 1 1 10 7198 1 1 14 TYR N N 0.848 -4.389 -7.356 1.00 . A A . 14 TYR N 1 1 10 7199 1 1 14 TYR O O -1.508 -6.151 -5.497 1.00 . A A . 14 TYR O 1 1 10 7200 1 1 14 TYR OH O -3.659 -10.765 -7.692 1.00 . A A . 14 TYR OH 1 1 10 7201 1 1 15 GLN C C -0.161 -5.256 -3.127 1.00 . A A . 15 GLN C 1 1 10 7202 1 1 15 GLN CA C 0.617 -6.329 -3.867 1.00 . A A . 15 GLN CA 1 1 10 7203 1 1 15 GLN CB C 2.043 -6.378 -3.364 1.00 . A A . 15 GLN CB 1 1 10 7204 1 1 15 GLN CD C 1.672 -8.622 -2.342 1.00 . A A . 15 GLN CD 1 1 10 7205 1 1 15 GLN CG C 2.523 -7.824 -3.332 1.00 . A A . 15 GLN CG 1 1 10 7206 1 1 15 GLN H H 1.510 -5.650 -5.675 1.00 . A A . 15 GLN H 1 1 10 7207 1 1 15 GLN HA H 0.138 -7.288 -3.761 1.00 . A A . 15 GLN HA 1 1 10 7208 1 1 15 GLN HB2 H 2.663 -5.805 -4.039 1.00 . A A . 15 GLN HB2 1 1 10 7209 1 1 15 GLN HB3 H 2.091 -5.952 -2.381 1.00 . A A . 15 GLN HB3 1 1 10 7210 1 1 15 GLN HE21 H 2.415 -7.705 -0.745 1.00 . A A . 15 GLN HE21 1 1 10 7211 1 1 15 GLN HE22 H 1.246 -8.893 -0.422 1.00 . A A . 15 GLN HE22 1 1 10 7212 1 1 15 GLN HG2 H 2.427 -8.252 -4.320 1.00 . A A . 15 GLN HG2 1 1 10 7213 1 1 15 GLN HG3 H 3.556 -7.853 -3.025 1.00 . A A . 15 GLN HG3 1 1 10 7214 1 1 15 GLN N N 0.660 -5.924 -5.273 1.00 . A A . 15 GLN N 1 1 10 7215 1 1 15 GLN NE2 N 1.787 -8.387 -1.063 1.00 . A A . 15 GLN NE2 1 1 10 7216 1 1 15 GLN O O -0.938 -5.522 -2.231 1.00 . A A . 15 GLN O 1 1 10 7217 1 1 15 GLN OE1 O 0.892 -9.465 -2.737 1.00 . A A . 15 GLN OE1 1 1 10 7218 1 1 16 LEU C C -2.110 -2.906 -3.521 1.00 . A A . 16 LEU C 1 1 10 7219 1 1 16 LEU CA C -0.725 -2.933 -2.903 1.00 . A A . 16 LEU CA 1 1 10 7220 1 1 16 LEU CB C 0.017 -1.633 -3.180 1.00 . A A . 16 LEU CB 1 1 10 7221 1 1 16 LEU CD1 C 2.054 -0.337 -2.526 1.00 . A A . 16 LEU CD1 1 1 10 7222 1 1 16 LEU CD2 C 1.208 -2.164 -1.050 1.00 . A A . 16 LEU CD2 1 1 10 7223 1 1 16 LEU CG C 1.386 -1.705 -2.499 1.00 . A A . 16 LEU CG 1 1 10 7224 1 1 16 LEU H H 0.621 -3.842 -4.290 1.00 . A A . 16 LEU H 1 1 10 7225 1 1 16 LEU HA H -0.798 -3.100 -1.839 1.00 . A A . 16 LEU HA 1 1 10 7226 1 1 16 LEU HB2 H 0.143 -1.507 -4.245 1.00 . A A . 16 LEU HB2 1 1 10 7227 1 1 16 LEU HB3 H -0.543 -0.810 -2.789 1.00 . A A . 16 LEU HB3 1 1 10 7228 1 1 16 LEU HD11 H 3.102 -0.448 -2.291 1.00 . A A . 16 LEU HD11 1 1 10 7229 1 1 16 LEU HD12 H 1.587 0.305 -1.796 1.00 . A A . 16 LEU HD12 1 1 10 7230 1 1 16 LEU HD13 H 1.950 0.093 -3.510 1.00 . A A . 16 LEU HD13 1 1 10 7231 1 1 16 LEU HD21 H 1.898 -1.631 -0.416 1.00 . A A . 16 LEU HD21 1 1 10 7232 1 1 16 LEU HD22 H 1.404 -3.225 -0.984 1.00 . A A . 16 LEU HD22 1 1 10 7233 1 1 16 LEU HD23 H 0.195 -1.966 -0.732 1.00 . A A . 16 LEU HD23 1 1 10 7234 1 1 16 LEU HG H 2.009 -2.411 -3.021 1.00 . A A . 16 LEU HG 1 1 10 7235 1 1 16 LEU N N 0.016 -4.034 -3.536 1.00 . A A . 16 LEU N 1 1 10 7236 1 1 16 LEU O O -3.059 -2.406 -2.950 1.00 . A A . 16 LEU O 1 1 10 7237 1 1 17 GLU C C -4.464 -4.461 -4.620 1.00 . A A . 17 GLU C 1 1 10 7238 1 1 17 GLU CA C -3.532 -3.506 -5.369 1.00 . A A . 17 GLU CA 1 1 10 7239 1 1 17 GLU CB C -3.326 -4.007 -6.797 1.00 . A A . 17 GLU CB 1 1 10 7240 1 1 17 GLU CD C -5.220 -5.469 -7.519 1.00 . A A . 17 GLU CD 1 1 10 7241 1 1 17 GLU CG C -4.670 -4.040 -7.526 1.00 . A A . 17 GLU CG 1 1 10 7242 1 1 17 GLU H H -1.442 -3.866 -5.126 1.00 . A A . 17 GLU H 1 1 10 7243 1 1 17 GLU HA H -3.960 -2.520 -5.388 1.00 . A A . 17 GLU HA 1 1 10 7244 1 1 17 GLU HB2 H -2.647 -3.346 -7.313 1.00 . A A . 17 GLU HB2 1 1 10 7245 1 1 17 GLU HB3 H -2.906 -5.001 -6.772 1.00 . A A . 17 GLU HB3 1 1 10 7246 1 1 17 GLU HG2 H -5.367 -3.383 -7.026 1.00 . A A . 17 GLU HG2 1 1 10 7247 1 1 17 GLU HG3 H -4.535 -3.714 -8.546 1.00 . A A . 17 GLU HG3 1 1 10 7248 1 1 17 GLU N N -2.225 -3.464 -4.691 1.00 . A A . 17 GLU N 1 1 10 7249 1 1 17 GLU O O -5.671 -4.335 -4.687 1.00 . A A . 17 GLU O 1 1 10 7250 1 1 17 GLU OE1 O -4.471 -6.372 -7.855 1.00 . A A . 17 GLU OE1 1 1 10 7251 1 1 17 GLU OE2 O -6.379 -5.635 -7.177 1.00 . A A . 17 GLU OE2 1 1 10 7252 1 1 18 ASN C C -5.323 -5.707 -1.885 1.00 . A A . 18 ASN C 1 1 10 7253 1 1 18 ASN CA C -4.835 -6.358 -3.175 1.00 . A A . 18 ASN CA 1 1 10 7254 1 1 18 ASN CB C -4.121 -7.672 -2.847 1.00 . A A . 18 ASN CB 1 1 10 7255 1 1 18 ASN CG C -2.654 -7.404 -2.544 1.00 . A A . 18 ASN CG 1 1 10 7256 1 1 18 ASN H H -2.945 -5.511 -3.847 1.00 . A A . 18 ASN H 1 1 10 7257 1 1 18 ASN HA H -5.690 -6.569 -3.803 1.00 . A A . 18 ASN HA 1 1 10 7258 1 1 18 ASN HB2 H -4.588 -8.128 -1.986 1.00 . A A . 18 ASN HB2 1 1 10 7259 1 1 18 ASN HB3 H -4.195 -8.341 -3.692 1.00 . A A . 18 ASN HB3 1 1 10 7260 1 1 18 ASN HD21 H -2.901 -7.456 -0.574 1.00 . A A . 18 ASN HD21 1 1 10 7261 1 1 18 ASN HD22 H -1.314 -7.161 -1.099 1.00 . A A . 18 ASN HD22 1 1 10 7262 1 1 18 ASN N N -3.927 -5.417 -3.903 1.00 . A A . 18 ASN N 1 1 10 7263 1 1 18 ASN ND2 N -2.256 -7.335 -1.302 1.00 . A A . 18 ASN ND2 1 1 10 7264 1 1 18 ASN O O -6.158 -6.245 -1.186 1.00 . A A . 18 ASN O 1 1 10 7265 1 1 18 ASN OD1 O -1.861 -7.257 -3.448 1.00 . A A . 18 ASN OD1 1 1 10 7266 1 1 19 TYR C C -6.406 -2.900 -0.663 1.00 . A A . 19 TYR C 1 1 10 7267 1 1 19 TYR CA C -5.276 -3.873 -0.320 1.00 . A A . 19 TYR CA 1 1 10 7268 1 1 19 TYR CB C -4.110 -3.110 0.315 1.00 . A A . 19 TYR CB 1 1 10 7269 1 1 19 TYR CD1 C -3.428 -4.492 2.310 1.00 . A A . 19 TYR CD1 1 1 10 7270 1 1 19 TYR CD2 C -2.071 -4.597 0.301 1.00 . A A . 19 TYR CD2 1 1 10 7271 1 1 19 TYR CE1 C -2.568 -5.401 2.939 1.00 . A A . 19 TYR CE1 1 1 10 7272 1 1 19 TYR CE2 C -1.210 -5.507 0.930 1.00 . A A . 19 TYR CE2 1 1 10 7273 1 1 19 TYR CG C -3.180 -4.089 0.991 1.00 . A A . 19 TYR CG 1 1 10 7274 1 1 19 TYR CZ C -1.459 -5.909 2.249 1.00 . A A . 19 TYR CZ 1 1 10 7275 1 1 19 TYR H H -4.153 -4.123 -2.139 1.00 . A A . 19 TYR H 1 1 10 7276 1 1 19 TYR HA H -5.641 -4.614 0.376 1.00 . A A . 19 TYR HA 1 1 10 7277 1 1 19 TYR HB2 H -3.571 -2.569 -0.449 1.00 . A A . 19 TYR HB2 1 1 10 7278 1 1 19 TYR HB3 H -4.493 -2.416 1.047 1.00 . A A . 19 TYR HB3 1 1 10 7279 1 1 19 TYR HD1 H -4.283 -4.100 2.843 1.00 . A A . 19 TYR HD1 1 1 10 7280 1 1 19 TYR HD2 H -1.880 -4.287 -0.716 1.00 . A A . 19 TYR HD2 1 1 10 7281 1 1 19 TYR HE1 H -2.759 -5.711 3.955 1.00 . A A . 19 TYR HE1 1 1 10 7282 1 1 19 TYR HE2 H -0.356 -5.899 0.398 1.00 . A A . 19 TYR HE2 1 1 10 7283 1 1 19 TYR HH H -1.150 -7.493 3.268 1.00 . A A . 19 TYR HH 1 1 10 7284 1 1 19 TYR N N -4.820 -4.549 -1.563 1.00 . A A . 19 TYR N 1 1 10 7285 1 1 19 TYR O O -6.810 -2.092 0.149 1.00 . A A . 19 TYR O 1 1 10 7286 1 1 19 TYR OH O -0.612 -6.805 2.870 1.00 . A A . 19 TYR OH 1 1 10 7287 1 1 20 CYS C C -9.374 -2.655 -1.815 1.00 . A A . 20 CYS C 1 1 10 7288 1 1 20 CYS CA C -8.036 -2.054 -2.249 1.00 . A A . 20 CYS CA 1 1 10 7289 1 1 20 CYS CB C -8.041 -1.852 -3.766 1.00 . A A . 20 CYS CB 1 1 10 7290 1 1 20 CYS H H -6.591 -3.635 -2.505 1.00 . A A . 20 CYS H 1 1 10 7291 1 1 20 CYS HA H -7.897 -1.101 -1.761 1.00 . A A . 20 CYS HA 1 1 10 7292 1 1 20 CYS HB2 H -8.325 -2.772 -4.254 1.00 . A A . 20 CYS HB2 1 1 10 7293 1 1 20 CYS HB3 H -8.748 -1.077 -4.023 1.00 . A A . 20 CYS HB3 1 1 10 7294 1 1 20 CYS N N -6.926 -2.974 -1.863 1.00 . A A . 20 CYS N 1 1 10 7295 1 1 20 CYS O O -9.545 -3.858 -1.787 1.00 . A A . 20 CYS O 1 1 10 7296 1 1 20 CYS SG S -6.389 -1.363 -4.307 1.00 . A A . 20 CYS SG 1 1 10 7297 1 1 21 ASN C C -11.471 -3.349 0.086 1.00 . A A . 21 ASN C 1 1 10 7298 1 1 21 ASN CA C -11.653 -2.349 -1.059 1.00 . A A . 21 ASN CA 1 1 10 7299 1 1 21 ASN CB C -12.319 -3.047 -2.244 1.00 . A A . 21 ASN CB 1 1 10 7300 1 1 21 ASN CG C -13.541 -3.828 -1.759 1.00 . A A . 21 ASN CG 1 1 10 7301 1 1 21 ASN H H -10.168 -0.861 -1.518 1.00 . A A . 21 ASN H 1 1 10 7302 1 1 21 ASN HA H -12.274 -1.531 -0.728 1.00 . A A . 21 ASN HA 1 1 10 7303 1 1 21 ASN HB2 H -12.627 -2.307 -2.969 1.00 . A A . 21 ASN HB2 1 1 10 7304 1 1 21 ASN HB3 H -11.616 -3.727 -2.701 1.00 . A A . 21 ASN HB3 1 1 10 7305 1 1 21 ASN HD21 H -14.757 -2.262 -1.860 1.00 . A A . 21 ASN HD21 1 1 10 7306 1 1 21 ASN HD22 H -15.476 -3.706 -1.332 1.00 . A A . 21 ASN HD22 1 1 10 7307 1 1 21 ASN N N -10.325 -1.827 -1.483 1.00 . A A . 21 ASN N 1 1 10 7308 1 1 21 ASN ND2 N -14.686 -3.214 -1.640 1.00 . A A . 21 ASN ND2 1 1 10 7309 1 1 21 ASN O O -10.334 -3.654 0.406 1.00 . A A . 21 ASN O 1 1 10 7310 1 1 21 ASN OXT O -12.473 -3.791 0.624 1.00 . A A . 21 ASN OXT 1 1 10 7311 1 1 21 ASN OD1 O -13.453 -5.008 -1.485 1.00 . A A . 21 ASN OD1 1 1 10 7312 2 2 1 PHE C C 8.771 -0.030 -10.308 1.00 . B B . 1 PHE C 1 1 10 7313 2 2 1 PHE CA C 7.340 0.261 -10.762 1.00 . B B . 1 PHE CA 1 1 10 7314 2 2 1 PHE CB C 7.355 0.738 -12.216 1.00 . B B . 1 PHE CB 1 1 10 7315 2 2 1 PHE CD1 C 6.206 -1.215 -13.319 1.00 . B B . 1 PHE CD1 1 1 10 7316 2 2 1 PHE CD2 C 8.548 -0.809 -13.812 1.00 . B B . 1 PHE CD2 1 1 10 7317 2 2 1 PHE CE1 C 6.218 -2.325 -14.174 1.00 . B B . 1 PHE CE1 1 1 10 7318 2 2 1 PHE CE2 C 8.560 -1.920 -14.667 1.00 . B B . 1 PHE CE2 1 1 10 7319 2 2 1 PHE CG C 7.371 -0.457 -13.138 1.00 . B B . 1 PHE CG 1 1 10 7320 2 2 1 PHE CZ C 7.395 -2.677 -14.848 1.00 . B B . 1 PHE CZ 1 1 10 7321 2 2 1 PHE H1 H 7.014 2.257 -10.267 1.00 . B B . 1 PHE H1 1 1 10 7322 2 2 1 PHE H2 H 7.113 1.218 -8.927 1.00 . B B . 1 PHE H2 1 1 10 7323 2 2 1 PHE H3 H 5.716 1.232 -9.893 1.00 . B B . 1 PHE H3 1 1 10 7324 2 2 1 PHE HA H 6.746 -0.638 -10.684 1.00 . B B . 1 PHE HA 1 1 10 7325 2 2 1 PHE HB2 H 6.472 1.330 -12.410 1.00 . B B . 1 PHE HB2 1 1 10 7326 2 2 1 PHE HB3 H 8.236 1.338 -12.390 1.00 . B B . 1 PHE HB3 1 1 10 7327 2 2 1 PHE HD1 H 5.299 -0.943 -12.799 1.00 . B B . 1 PHE HD1 1 1 10 7328 2 2 1 PHE HD2 H 9.446 -0.225 -13.672 1.00 . B B . 1 PHE HD2 1 1 10 7329 2 2 1 PHE HE1 H 5.320 -2.908 -14.313 1.00 . B B . 1 PHE HE1 1 1 10 7330 2 2 1 PHE HE2 H 9.466 -2.192 -15.187 1.00 . B B . 1 PHE HE2 1 1 10 7331 2 2 1 PHE HZ H 7.403 -3.533 -15.507 1.00 . B B . 1 PHE HZ 1 1 10 7332 2 2 1 PHE N N 6.751 1.322 -9.897 1.00 . B B . 1 PHE N 1 1 10 7333 2 2 1 PHE O O 9.708 0.062 -11.076 1.00 . B B . 1 PHE O 1 1 10 7334 2 2 2 VAL C C 10.223 -1.523 -7.290 1.00 . B B . 2 VAL C 1 1 10 7335 2 2 2 VAL CA C 10.320 -0.674 -8.560 1.00 . B B . 2 VAL CA 1 1 10 7336 2 2 2 VAL CB C 11.066 0.634 -8.249 1.00 . B B . 2 VAL CB 1 1 10 7337 2 2 2 VAL CG1 C 12.136 0.873 -9.315 1.00 . B B . 2 VAL CG1 1 1 10 7338 2 2 2 VAL CG2 C 10.087 1.815 -8.240 1.00 . B B . 2 VAL CG2 1 1 10 7339 2 2 2 VAL H H 8.178 -0.445 -8.458 1.00 . B B . 2 VAL H 1 1 10 7340 2 2 2 VAL HA H 10.864 -1.224 -9.314 1.00 . B B . 2 VAL HA 1 1 10 7341 2 2 2 VAL HB H 11.540 0.553 -7.282 1.00 . B B . 2 VAL HB 1 1 10 7342 2 2 2 VAL HG11 H 13.027 0.319 -9.059 1.00 . B B . 2 VAL HG11 1 1 10 7343 2 2 2 VAL HG12 H 12.367 1.926 -9.364 1.00 . B B . 2 VAL HG12 1 1 10 7344 2 2 2 VAL HG13 H 11.768 0.540 -10.275 1.00 . B B . 2 VAL HG13 1 1 10 7345 2 2 2 VAL HG21 H 9.131 1.487 -7.859 1.00 . B B . 2 VAL HG21 1 1 10 7346 2 2 2 VAL HG22 H 9.965 2.190 -9.246 1.00 . B B . 2 VAL HG22 1 1 10 7347 2 2 2 VAL HG23 H 10.476 2.600 -7.608 1.00 . B B . 2 VAL HG23 1 1 10 7348 2 2 2 VAL N N 8.947 -0.379 -9.063 1.00 . B B . 2 VAL N 1 1 10 7349 2 2 2 VAL O O 9.192 -2.093 -6.992 1.00 . B B . 2 VAL O 1 1 10 7350 2 2 3 ASN C C 11.697 -1.564 -4.117 1.00 . B B . 3 ASN C 1 1 10 7351 2 2 3 ASN CA C 11.253 -2.429 -5.293 1.00 . B B . 3 ASN CA 1 1 10 7352 2 2 3 ASN CB C 12.200 -3.612 -5.437 1.00 . B B . 3 ASN CB 1 1 10 7353 2 2 3 ASN CG C 11.402 -4.916 -5.381 1.00 . B B . 3 ASN CG 1 1 10 7354 2 2 3 ASN H H 12.110 -1.148 -6.797 1.00 . B B . 3 ASN H 1 1 10 7355 2 2 3 ASN HA H 10.249 -2.785 -5.125 1.00 . B B . 3 ASN HA 1 1 10 7356 2 2 3 ASN HB2 H 12.710 -3.537 -6.382 1.00 . B B . 3 ASN HB2 1 1 10 7357 2 2 3 ASN HB3 H 12.923 -3.597 -4.635 1.00 . B B . 3 ASN HB3 1 1 10 7358 2 2 3 ASN HD21 H 13.005 -6.055 -5.101 1.00 . B B . 3 ASN HD21 1 1 10 7359 2 2 3 ASN HD22 H 11.527 -6.887 -5.162 1.00 . B B . 3 ASN HD22 1 1 10 7360 2 2 3 ASN N N 11.288 -1.614 -6.540 1.00 . B B . 3 ASN N 1 1 10 7361 2 2 3 ASN ND2 N 12.031 -6.046 -5.200 1.00 . B B . 3 ASN ND2 1 1 10 7362 2 2 3 ASN O O 12.697 -1.825 -3.478 1.00 . B B . 3 ASN O 1 1 10 7363 2 2 3 ASN OD1 O 10.194 -4.908 -5.504 1.00 . B B . 3 ASN OD1 1 1 10 7364 2 2 4 GLN C C 10.371 0.200 -1.547 1.00 . B B . 4 GLN C 1 1 10 7365 2 2 4 GLN CA C 11.344 0.375 -2.719 1.00 . B B . 4 GLN CA 1 1 10 7366 2 2 4 GLN CB C 11.308 1.821 -3.217 1.00 . B B . 4 GLN CB 1 1 10 7367 2 2 4 GLN CD C 11.599 4.216 -2.571 1.00 . B B . 4 GLN CD 1 1 10 7368 2 2 4 GLN CG C 11.570 2.776 -2.052 1.00 . B B . 4 GLN CG 1 1 10 7369 2 2 4 GLN H H 10.175 -0.339 -4.381 1.00 . B B . 4 GLN H 1 1 10 7370 2 2 4 GLN HA H 12.344 0.134 -2.390 1.00 . B B . 4 GLN HA 1 1 10 7371 2 2 4 GLN HB2 H 12.068 1.957 -3.973 1.00 . B B . 4 GLN HB2 1 1 10 7372 2 2 4 GLN HB3 H 10.338 2.031 -3.641 1.00 . B B . 4 GLN HB3 1 1 10 7373 2 2 4 GLN HE21 H 12.540 3.743 -4.254 1.00 . B B . 4 GLN HE21 1 1 10 7374 2 2 4 GLN HE22 H 12.173 5.390 -4.067 1.00 . B B . 4 GLN HE22 1 1 10 7375 2 2 4 GLN HG2 H 10.785 2.672 -1.317 1.00 . B B . 4 GLN HG2 1 1 10 7376 2 2 4 GLN HG3 H 12.521 2.540 -1.599 1.00 . B B . 4 GLN HG3 1 1 10 7377 2 2 4 GLN N N 10.967 -0.529 -3.841 1.00 . B B . 4 GLN N 1 1 10 7378 2 2 4 GLN NE2 N 12.150 4.471 -3.727 1.00 . B B . 4 GLN NE2 1 1 10 7379 2 2 4 GLN O O 9.280 -0.323 -1.697 1.00 . B B . 4 GLN O 1 1 10 7380 2 2 4 GLN OE1 O 11.114 5.118 -1.919 1.00 . B B . 4 GLN OE1 1 1 10 7381 2 2 5 HIS C C 8.789 1.544 0.782 1.00 . B B . 5 HIS C 1 1 10 7382 2 2 5 HIS CA C 9.892 0.487 0.824 1.00 . B B . 5 HIS CA 1 1 10 7383 2 2 5 HIS CB C 10.726 0.679 2.093 1.00 . B B . 5 HIS CB 1 1 10 7384 2 2 5 HIS CD2 C 12.743 -0.932 2.503 1.00 . B B . 5 HIS CD2 1 1 10 7385 2 2 5 HIS CE1 C 14.089 -0.101 1.015 1.00 . B B . 5 HIS CE1 1 1 10 7386 2 2 5 HIS CG C 12.100 0.105 1.885 1.00 . B B . 5 HIS CG 1 1 10 7387 2 2 5 HIS H H 11.657 1.035 -0.283 1.00 . B B . 5 HIS H 1 1 10 7388 2 2 5 HIS HA H 9.447 -0.494 0.834 1.00 . B B . 5 HIS HA 1 1 10 7389 2 2 5 HIS HB2 H 10.806 1.734 2.314 1.00 . B B . 5 HIS HB2 1 1 10 7390 2 2 5 HIS HB3 H 10.246 0.174 2.917 1.00 . B B . 5 HIS HB3 1 1 10 7391 2 2 5 HIS HD2 H 12.333 -1.546 3.292 1.00 . B B . 5 HIS HD2 1 1 10 7392 2 2 5 HIS HE1 H 14.960 0.068 0.399 1.00 . B B . 5 HIS HE1 1 1 10 7393 2 2 5 HIS HE2 H 14.686 -1.722 2.196 1.00 . B B . 5 HIS HE2 1 1 10 7394 2 2 5 HIS N N 10.771 0.627 -0.375 1.00 . B B . 5 HIS N 1 1 10 7395 2 2 5 HIS ND1 N 12.963 0.624 0.944 1.00 . B B . 5 HIS ND1 1 1 10 7396 2 2 5 HIS NE2 N 14.001 -1.064 1.955 1.00 . B B . 5 HIS NE2 1 1 10 7397 2 2 5 HIS O O 8.716 2.339 -0.134 1.00 . B B . 5 HIS O 1 1 10 7398 2 2 6 LEU C C 6.728 3.232 3.127 1.00 . B B . 6 LEU C 1 1 10 7399 2 2 6 LEU CA C 6.835 2.576 1.755 1.00 . B B . 6 LEU CA 1 1 10 7400 2 2 6 LEU CB C 5.493 1.888 1.432 1.00 . B B . 6 LEU CB 1 1 10 7401 2 2 6 LEU CD1 C 5.880 2.937 -0.840 1.00 . B B . 6 LEU CD1 1 1 10 7402 2 2 6 LEU CD2 C 3.992 1.368 -0.507 1.00 . B B . 6 LEU CD2 1 1 10 7403 2 2 6 LEU CG C 4.826 2.461 0.158 1.00 . B B . 6 LEU CG 1 1 10 7404 2 2 6 LEU H H 7.991 0.914 2.495 1.00 . B B . 6 LEU H 1 1 10 7405 2 2 6 LEU HA H 7.068 3.322 1.026 1.00 . B B . 6 LEU HA 1 1 10 7406 2 2 6 LEU HB2 H 5.674 0.835 1.300 1.00 . B B . 6 LEU HB2 1 1 10 7407 2 2 6 LEU HB3 H 4.822 2.016 2.271 1.00 . B B . 6 LEU HB3 1 1 10 7408 2 2 6 LEU HD11 H 6.699 2.234 -0.858 1.00 . B B . 6 LEU HD11 1 1 10 7409 2 2 6 LEU HD12 H 6.244 3.907 -0.541 1.00 . B B . 6 LEU HD12 1 1 10 7410 2 2 6 LEU HD13 H 5.440 3.003 -1.823 1.00 . B B . 6 LEU HD13 1 1 10 7411 2 2 6 LEU HD21 H 3.888 0.534 0.169 1.00 . B B . 6 LEU HD21 1 1 10 7412 2 2 6 LEU HD22 H 4.482 1.042 -1.412 1.00 . B B . 6 LEU HD22 1 1 10 7413 2 2 6 LEU HD23 H 3.014 1.760 -0.749 1.00 . B B . 6 LEU HD23 1 1 10 7414 2 2 6 LEU HG H 4.171 3.288 0.421 1.00 . B B . 6 LEU HG 1 1 10 7415 2 2 6 LEU N N 7.925 1.563 1.763 1.00 . B B . 6 LEU N 1 1 10 7416 2 2 6 LEU O O 7.554 3.016 3.983 1.00 . B B . 6 LEU O 1 1 10 7417 2 2 7 CYS C C 4.842 6.105 4.330 1.00 . B B . 7 CYS C 1 1 10 7418 2 2 7 CYS CA C 5.448 4.724 4.617 1.00 . B B . 7 CYS CA 1 1 10 7419 2 2 7 CYS CB C 6.754 4.908 5.414 1.00 . B B . 7 CYS CB 1 1 10 7420 2 2 7 CYS H H 5.055 4.149 2.584 1.00 . B B . 7 CYS H 1 1 10 7421 2 2 7 CYS HA H 4.743 4.159 5.191 1.00 . B B . 7 CYS HA 1 1 10 7422 2 2 7 CYS HB2 H 7.579 4.979 4.723 1.00 . B B . 7 CYS HB2 1 1 10 7423 2 2 7 CYS HB3 H 6.692 5.825 5.981 1.00 . B B . 7 CYS HB3 1 1 10 7424 2 2 7 CYS N N 5.693 4.022 3.316 1.00 . B B . 7 CYS N 1 1 10 7425 2 2 7 CYS O O 5.306 6.839 3.477 1.00 . B B . 7 CYS O 1 1 10 7426 2 2 7 CYS SG S 7.059 3.516 6.558 1.00 . B B . 7 CYS SG 1 1 10 7427 2 2 8 GLY C C 2.498 7.865 3.462 1.00 . B B . 8 GLY C 1 1 10 7428 2 2 8 GLY CA C 3.171 7.795 4.837 1.00 . B B . 8 GLY CA 1 1 10 7429 2 2 8 GLY H H 3.456 5.856 5.730 1.00 . B B . 8 GLY H 1 1 10 7430 2 2 8 GLY HA2 H 2.428 7.958 5.605 1.00 . B B . 8 GLY HA2 1 1 10 7431 2 2 8 GLY HA3 H 3.924 8.566 4.902 1.00 . B B . 8 GLY HA3 1 1 10 7432 2 2 8 GLY N N 3.809 6.463 5.046 1.00 . B B . 8 GLY N 1 1 10 7433 2 2 8 GLY O O 1.992 6.884 2.946 1.00 . B B . 8 GLY O 1 1 10 7434 2 2 9 SER C C 2.384 8.152 0.573 1.00 . B B . 9 SER C 1 1 10 7435 2 2 9 SER CA C 1.837 9.195 1.542 1.00 . B B . 9 SER CA 1 1 10 7436 2 2 9 SER CB C 2.127 10.598 1.005 1.00 . B B . 9 SER CB 1 1 10 7437 2 2 9 SER H H 2.888 9.806 3.316 1.00 . B B . 9 SER H 1 1 10 7438 2 2 9 SER HA H 0.774 9.061 1.642 1.00 . B B . 9 SER HA 1 1 10 7439 2 2 9 SER HB2 H 3.021 10.984 1.464 1.00 . B B . 9 SER HB2 1 1 10 7440 2 2 9 SER HB3 H 2.267 10.552 -0.067 1.00 . B B . 9 SER HB3 1 1 10 7441 2 2 9 SER HG H 0.773 11.283 2.224 1.00 . B B . 9 SER HG 1 1 10 7442 2 2 9 SER N N 2.481 9.032 2.874 1.00 . B B . 9 SER N 1 1 10 7443 2 2 9 SER O O 1.701 7.709 -0.326 1.00 . B B . 9 SER O 1 1 10 7444 2 2 9 SER OG O 1.035 11.455 1.316 1.00 . B B . 9 SER OG 1 1 10 7445 2 2 10 ASP C C 3.264 5.518 -0.200 1.00 . B B . 10 ASP C 1 1 10 7446 2 2 10 ASP CA C 4.189 6.733 -0.162 1.00 . B B . 10 ASP CA 1 1 10 7447 2 2 10 ASP CB C 5.566 6.325 0.355 1.00 . B B . 10 ASP CB 1 1 10 7448 2 2 10 ASP CG C 6.392 7.577 0.655 1.00 . B B . 10 ASP CG 1 1 10 7449 2 2 10 ASP H H 4.137 8.115 1.489 1.00 . B B . 10 ASP H 1 1 10 7450 2 2 10 ASP HA H 4.281 7.143 -1.155 1.00 . B B . 10 ASP HA 1 1 10 7451 2 2 10 ASP HB2 H 5.451 5.745 1.257 1.00 . B B . 10 ASP HB2 1 1 10 7452 2 2 10 ASP HB3 H 6.071 5.737 -0.395 1.00 . B B . 10 ASP HB3 1 1 10 7453 2 2 10 ASP N N 3.606 7.752 0.752 1.00 . B B . 10 ASP N 1 1 10 7454 2 2 10 ASP O O 3.000 4.949 -1.243 1.00 . B B . 10 ASP O 1 1 10 7455 2 2 10 ASP OD1 O 6.543 8.391 -0.240 1.00 . B B . 10 ASP OD1 1 1 10 7456 2 2 10 ASP OD2 O 6.859 7.699 1.776 1.00 . B B . 10 ASP OD2 1 1 10 7457 2 2 11 LEU C C 0.520 4.330 0.320 1.00 . B B . 11 LEU C 1 1 10 7458 2 2 11 LEU CA C 1.843 3.959 0.983 1.00 . B B . 11 LEU CA 1 1 10 7459 2 2 11 LEU CB C 1.610 3.586 2.449 1.00 . B B . 11 LEU CB 1 1 10 7460 2 2 11 LEU CD1 C 1.722 1.225 1.529 1.00 . B B . 11 LEU CD1 1 1 10 7461 2 2 11 LEU CD2 C 1.498 1.635 3.980 1.00 . B B . 11 LEU CD2 1 1 10 7462 2 2 11 LEU CG C 1.103 2.142 2.594 1.00 . B B . 11 LEU CG 1 1 10 7463 2 2 11 LEU H H 2.982 5.609 1.757 1.00 . B B . 11 LEU H 1 1 10 7464 2 2 11 LEU HA H 2.285 3.131 0.457 1.00 . B B . 11 LEU HA 1 1 10 7465 2 2 11 LEU HB2 H 2.539 3.688 2.990 1.00 . B B . 11 LEU HB2 1 1 10 7466 2 2 11 LEU HB3 H 0.880 4.261 2.872 1.00 . B B . 11 LEU HB3 1 1 10 7467 2 2 11 LEU HD11 H 2.788 1.388 1.488 1.00 . B B . 11 LEU HD11 1 1 10 7468 2 2 11 LEU HD12 H 1.287 1.445 0.564 1.00 . B B . 11 LEU HD12 1 1 10 7469 2 2 11 LEU HD13 H 1.525 0.193 1.783 1.00 . B B . 11 LEU HD13 1 1 10 7470 2 2 11 LEU HD21 H 0.627 1.247 4.483 1.00 . B B . 11 LEU HD21 1 1 10 7471 2 2 11 LEU HD22 H 1.912 2.453 4.554 1.00 . B B . 11 LEU HD22 1 1 10 7472 2 2 11 LEU HD23 H 2.238 0.856 3.880 1.00 . B B . 11 LEU HD23 1 1 10 7473 2 2 11 LEU HG H 0.028 2.128 2.500 1.00 . B B . 11 LEU HG 1 1 10 7474 2 2 11 LEU N N 2.760 5.127 0.932 1.00 . B B . 11 LEU N 1 1 10 7475 2 2 11 LEU O O 0.001 3.594 -0.494 1.00 . B B . 11 LEU O 1 1 10 7476 2 2 12 VAL C C -1.067 6.138 -1.476 1.00 . B B . 12 VAL C 1 1 10 7477 2 2 12 VAL CA C -1.320 5.849 0.004 1.00 . B B . 12 VAL CA 1 1 10 7478 2 2 12 VAL CB C -1.930 7.075 0.708 1.00 . B B . 12 VAL CB 1 1 10 7479 2 2 12 VAL CG1 C -1.502 7.079 2.173 1.00 . B B . 12 VAL CG1 1 1 10 7480 2 2 12 VAL CG2 C -1.466 8.376 0.044 1.00 . B B . 12 VAL CG2 1 1 10 7481 2 2 12 VAL H H 0.399 6.061 1.293 1.00 . B B . 12 VAL H 1 1 10 7482 2 2 12 VAL HA H -2.008 5.019 0.084 1.00 . B B . 12 VAL HA 1 1 10 7483 2 2 12 VAL HB H -3.008 7.011 0.657 1.00 . B B . 12 VAL HB 1 1 10 7484 2 2 12 VAL HG11 H -2.166 7.712 2.740 1.00 . B B . 12 VAL HG11 1 1 10 7485 2 2 12 VAL HG12 H -0.492 7.453 2.250 1.00 . B B . 12 VAL HG12 1 1 10 7486 2 2 12 VAL HG13 H -1.543 6.072 2.561 1.00 . B B . 12 VAL HG13 1 1 10 7487 2 2 12 VAL HG21 H -0.400 8.484 0.168 1.00 . B B . 12 VAL HG21 1 1 10 7488 2 2 12 VAL HG22 H -1.970 9.213 0.504 1.00 . B B . 12 VAL HG22 1 1 10 7489 2 2 12 VAL HG23 H -1.706 8.346 -1.009 1.00 . B B . 12 VAL HG23 1 1 10 7490 2 2 12 VAL N N -0.032 5.466 0.645 1.00 . B B . 12 VAL N 1 1 10 7491 2 2 12 VAL O O -1.812 5.716 -2.331 1.00 . B B . 12 VAL O 1 1 10 7492 2 2 13 GLU C C 0.111 5.842 -4.023 1.00 . B B . 13 GLU C 1 1 10 7493 2 2 13 GLU CA C 0.280 7.134 -3.215 1.00 . B B . 13 GLU CA 1 1 10 7494 2 2 13 GLU CB C 1.716 7.688 -3.342 1.00 . B B . 13 GLU CB 1 1 10 7495 2 2 13 GLU CD C 4.098 7.186 -3.944 1.00 . B B . 13 GLU CD 1 1 10 7496 2 2 13 GLU CG C 2.688 6.603 -3.831 1.00 . B B . 13 GLU CG 1 1 10 7497 2 2 13 GLU H H 0.587 7.165 -1.082 1.00 . B B . 13 GLU H 1 1 10 7498 2 2 13 GLU HA H -0.421 7.872 -3.576 1.00 . B B . 13 GLU HA 1 1 10 7499 2 2 13 GLU HB2 H 1.719 8.508 -4.044 1.00 . B B . 13 GLU HB2 1 1 10 7500 2 2 13 GLU HB3 H 2.043 8.047 -2.377 1.00 . B B . 13 GLU HB3 1 1 10 7501 2 2 13 GLU HG2 H 2.692 5.781 -3.131 1.00 . B B . 13 GLU HG2 1 1 10 7502 2 2 13 GLU HG3 H 2.371 6.247 -4.800 1.00 . B B . 13 GLU HG3 1 1 10 7503 2 2 13 GLU N N -0.013 6.841 -1.786 1.00 . B B . 13 GLU N 1 1 10 7504 2 2 13 GLU O O -0.367 5.853 -5.140 1.00 . B B . 13 GLU O 1 1 10 7505 2 2 13 GLU OE1 O 4.469 7.960 -3.078 1.00 . B B . 13 GLU OE1 1 1 10 7506 2 2 13 GLU OE2 O 4.782 6.847 -4.895 1.00 . B B . 13 GLU OE2 1 1 10 7507 2 2 14 ALA C C -1.079 2.915 -3.932 1.00 . B B . 14 ALA C 1 1 10 7508 2 2 14 ALA CA C 0.331 3.439 -4.179 1.00 . B B . 14 ALA CA 1 1 10 7509 2 2 14 ALA CB C 1.354 2.427 -3.660 1.00 . B B . 14 ALA CB 1 1 10 7510 2 2 14 ALA H H 0.851 4.735 -2.546 1.00 . B B . 14 ALA H 1 1 10 7511 2 2 14 ALA HA H 0.480 3.598 -5.237 1.00 . B B . 14 ALA HA 1 1 10 7512 2 2 14 ALA HB1 H 0.934 1.890 -2.822 1.00 . B B . 14 ALA HB1 1 1 10 7513 2 2 14 ALA HB2 H 2.247 2.945 -3.345 1.00 . B B . 14 ALA HB2 1 1 10 7514 2 2 14 ALA HB3 H 1.601 1.729 -4.447 1.00 . B B . 14 ALA HB3 1 1 10 7515 2 2 14 ALA N N 0.485 4.727 -3.454 1.00 . B B . 14 ALA N 1 1 10 7516 2 2 14 ALA O O -1.801 2.581 -4.851 1.00 . B B . 14 ALA O 1 1 10 7517 2 2 15 LEU C C -3.874 3.204 -3.138 1.00 . B B . 15 LEU C 1 1 10 7518 2 2 15 LEU CA C -2.845 2.360 -2.381 1.00 . B B . 15 LEU CA 1 1 10 7519 2 2 15 LEU CB C -3.086 2.489 -0.876 1.00 . B B . 15 LEU CB 1 1 10 7520 2 2 15 LEU CD1 C -2.759 1.248 1.264 1.00 . B B . 15 LEU CD1 1 1 10 7521 2 2 15 LEU CD2 C -1.982 0.199 -0.866 1.00 . B B . 15 LEU CD2 1 1 10 7522 2 2 15 LEU CG C -2.160 1.528 -0.107 1.00 . B B . 15 LEU CG 1 1 10 7523 2 2 15 LEU H H -0.888 3.128 -1.963 1.00 . B B . 15 LEU H 1 1 10 7524 2 2 15 LEU HA H -2.929 1.327 -2.677 1.00 . B B . 15 LEU HA 1 1 10 7525 2 2 15 LEU HB2 H -2.870 3.505 -0.575 1.00 . B B . 15 LEU HB2 1 1 10 7526 2 2 15 LEU HB3 H -4.122 2.267 -0.649 1.00 . B B . 15 LEU HB3 1 1 10 7527 2 2 15 LEU HD11 H -3.656 1.836 1.389 1.00 . B B . 15 LEU HD11 1 1 10 7528 2 2 15 LEU HD12 H -2.044 1.515 2.028 1.00 . B B . 15 LEU HD12 1 1 10 7529 2 2 15 LEU HD13 H -2.999 0.200 1.343 1.00 . B B . 15 LEU HD13 1 1 10 7530 2 2 15 LEU HD21 H -2.940 -0.283 -0.989 1.00 . B B . 15 LEU HD21 1 1 10 7531 2 2 15 LEU HD22 H -1.323 -0.452 -0.306 1.00 . B B . 15 LEU HD22 1 1 10 7532 2 2 15 LEU HD23 H -1.549 0.394 -1.836 1.00 . B B . 15 LEU HD23 1 1 10 7533 2 2 15 LEU HG H -1.196 1.995 0.023 1.00 . B B . 15 LEU HG 1 1 10 7534 2 2 15 LEU N N -1.482 2.850 -2.692 1.00 . B B . 15 LEU N 1 1 10 7535 2 2 15 LEU O O -4.903 2.718 -3.554 1.00 . B B . 15 LEU O 1 1 10 7536 2 2 16 TYR C C -4.569 4.992 -5.529 1.00 . B B . 16 TYR C 1 1 10 7537 2 2 16 TYR CA C -4.563 5.350 -4.041 1.00 . B B . 16 TYR CA 1 1 10 7538 2 2 16 TYR CB C -4.133 6.812 -3.890 1.00 . B B . 16 TYR CB 1 1 10 7539 2 2 16 TYR CD1 C -6.481 7.722 -3.799 1.00 . B B . 16 TYR CD1 1 1 10 7540 2 2 16 TYR CD2 C -4.969 8.210 -1.965 1.00 . B B . 16 TYR CD2 1 1 10 7541 2 2 16 TYR CE1 C -7.491 8.456 -3.161 1.00 . B B . 16 TYR CE1 1 1 10 7542 2 2 16 TYR CE2 C -5.978 8.944 -1.327 1.00 . B B . 16 TYR CE2 1 1 10 7543 2 2 16 TYR CG C -5.221 7.598 -3.200 1.00 . B B . 16 TYR CG 1 1 10 7544 2 2 16 TYR CZ C -7.239 9.067 -1.926 1.00 . B B . 16 TYR CZ 1 1 10 7545 2 2 16 TYR H H -2.767 4.843 -2.960 1.00 . B B . 16 TYR H 1 1 10 7546 2 2 16 TYR HA H -5.554 5.222 -3.634 1.00 . B B . 16 TYR HA 1 1 10 7547 2 2 16 TYR HB2 H -3.227 6.864 -3.308 1.00 . B B . 16 TYR HB2 1 1 10 7548 2 2 16 TYR HB3 H -3.953 7.235 -4.867 1.00 . B B . 16 TYR HB3 1 1 10 7549 2 2 16 TYR HD1 H -6.676 7.251 -4.751 1.00 . B B . 16 TYR HD1 1 1 10 7550 2 2 16 TYR HD2 H -3.997 8.114 -1.503 1.00 . B B . 16 TYR HD2 1 1 10 7551 2 2 16 TYR HE1 H -8.462 8.551 -3.623 1.00 . B B . 16 TYR HE1 1 1 10 7552 2 2 16 TYR HE2 H -5.784 9.416 -0.375 1.00 . B B . 16 TYR HE2 1 1 10 7553 2 2 16 TYR HH H -8.641 9.226 -0.640 1.00 . B B . 16 TYR HH 1 1 10 7554 2 2 16 TYR N N -3.603 4.469 -3.313 1.00 . B B . 16 TYR N 1 1 10 7555 2 2 16 TYR O O -5.607 4.771 -6.121 1.00 . B B . 16 TYR O 1 1 10 7556 2 2 16 TYR OH O -8.232 9.791 -1.299 1.00 . B B . 16 TYR OH 1 1 10 7557 2 2 17 LEU C C -3.889 3.216 -7.832 1.00 . B B . 17 LEU C 1 1 10 7558 2 2 17 LEU CA C -3.358 4.631 -7.596 1.00 . B B . 17 LEU CA 1 1 10 7559 2 2 17 LEU CB C -1.901 4.717 -8.072 1.00 . B B . 17 LEU CB 1 1 10 7560 2 2 17 LEU CD1 C -3.048 5.121 -10.295 1.00 . B B . 17 LEU CD1 1 1 10 7561 2 2 17 LEU CD2 C -1.646 6.912 -9.251 1.00 . B B . 17 LEU CD2 1 1 10 7562 2 2 17 LEU CG C -1.801 5.401 -9.448 1.00 . B B . 17 LEU CG 1 1 10 7563 2 2 17 LEU H H -2.594 5.148 -5.650 1.00 . B B . 17 LEU H 1 1 10 7564 2 2 17 LEU HA H -3.963 5.332 -8.141 1.00 . B B . 17 LEU HA 1 1 10 7565 2 2 17 LEU HB2 H -1.328 5.284 -7.354 1.00 . B B . 17 LEU HB2 1 1 10 7566 2 2 17 LEU HB3 H -1.493 3.720 -8.142 1.00 . B B . 17 LEU HB3 1 1 10 7567 2 2 17 LEU HD11 H -3.296 4.072 -10.235 1.00 . B B . 17 LEU HD11 1 1 10 7568 2 2 17 LEU HD12 H -2.849 5.383 -11.324 1.00 . B B . 17 LEU HD12 1 1 10 7569 2 2 17 LEU HD13 H -3.875 5.710 -9.929 1.00 . B B . 17 LEU HD13 1 1 10 7570 2 2 17 LEU HD21 H -1.068 7.324 -10.066 1.00 . B B . 17 LEU HD21 1 1 10 7571 2 2 17 LEU HD22 H -1.137 7.104 -8.318 1.00 . B B . 17 LEU HD22 1 1 10 7572 2 2 17 LEU HD23 H -2.621 7.376 -9.232 1.00 . B B . 17 LEU HD23 1 1 10 7573 2 2 17 LEU HG H -0.932 5.022 -9.966 1.00 . B B . 17 LEU HG 1 1 10 7574 2 2 17 LEU N N -3.418 4.953 -6.143 1.00 . B B . 17 LEU N 1 1 10 7575 2 2 17 LEU O O -4.378 2.892 -8.895 1.00 . B B . 17 LEU O 1 1 10 7576 2 2 18 VAL C C -5.689 0.869 -6.407 1.00 . B B . 18 VAL C 1 1 10 7577 2 2 18 VAL CA C -4.294 0.977 -7.011 1.00 . B B . 18 VAL CA 1 1 10 7578 2 2 18 VAL CB C -3.342 0.011 -6.305 1.00 . B B . 18 VAL CB 1 1 10 7579 2 2 18 VAL CG1 C -1.910 0.358 -6.683 1.00 . B B . 18 VAL CG1 1 1 10 7580 2 2 18 VAL CG2 C -3.495 0.132 -4.790 1.00 . B B . 18 VAL CG2 1 1 10 7581 2 2 18 VAL H H -3.400 2.655 -5.999 1.00 . B B . 18 VAL H 1 1 10 7582 2 2 18 VAL HA H -4.338 0.733 -8.060 1.00 . B B . 18 VAL HA 1 1 10 7583 2 2 18 VAL HB H -3.562 -1.001 -6.614 1.00 . B B . 18 VAL HB 1 1 10 7584 2 2 18 VAL HG11 H -1.271 0.214 -5.826 1.00 . B B . 18 VAL HG11 1 1 10 7585 2 2 18 VAL HG12 H -1.863 1.389 -6.999 1.00 . B B . 18 VAL HG12 1 1 10 7586 2 2 18 VAL HG13 H -1.588 -0.282 -7.488 1.00 . B B . 18 VAL HG13 1 1 10 7587 2 2 18 VAL HG21 H -2.519 0.247 -4.341 1.00 . B B . 18 VAL HG21 1 1 10 7588 2 2 18 VAL HG22 H -3.964 -0.758 -4.403 1.00 . B B . 18 VAL HG22 1 1 10 7589 2 2 18 VAL HG23 H -4.100 0.991 -4.554 1.00 . B B . 18 VAL HG23 1 1 10 7590 2 2 18 VAL N N -3.797 2.372 -6.847 1.00 . B B . 18 VAL N 1 1 10 7591 2 2 18 VAL O O -6.507 0.078 -6.833 1.00 . B B . 18 VAL O 1 1 10 7592 2 2 19 CYS C C -7.992 2.978 -4.997 1.00 . B B . 19 CYS C 1 1 10 7593 2 2 19 CYS CA C -7.300 1.631 -4.778 1.00 . B B . 19 CYS CA 1 1 10 7594 2 2 19 CYS CB C -7.131 1.381 -3.280 1.00 . B B . 19 CYS CB 1 1 10 7595 2 2 19 CYS H H -5.287 2.296 -5.099 1.00 . B B . 19 CYS H 1 1 10 7596 2 2 19 CYS HA H -7.885 0.840 -5.217 1.00 . B B . 19 CYS HA 1 1 10 7597 2 2 19 CYS HB2 H -6.821 2.295 -2.795 1.00 . B B . 19 CYS HB2 1 1 10 7598 2 2 19 CYS HB3 H -8.069 1.055 -2.865 1.00 . B B . 19 CYS HB3 1 1 10 7599 2 2 19 CYS N N -5.965 1.667 -5.420 1.00 . B B . 19 CYS N 1 1 10 7600 2 2 19 CYS O O -8.737 3.451 -4.161 1.00 . B B . 19 CYS O 1 1 10 7601 2 2 19 CYS SG S -5.876 0.104 -3.017 1.00 . B B . 19 CYS SG 1 1 10 7602 2 2 20 GLY C C -9.828 4.925 -5.968 1.00 . B B . 20 GLY C 1 1 10 7603 2 2 20 GLY CA C -8.360 4.926 -6.397 1.00 . B B . 20 GLY CA 1 1 10 7604 2 2 20 GLY H H -7.125 3.203 -6.766 1.00 . B B . 20 GLY H 1 1 10 7605 2 2 20 GLY HA2 H -7.829 5.694 -5.855 1.00 . B B . 20 GLY HA2 1 1 10 7606 2 2 20 GLY HA3 H -8.300 5.129 -7.456 1.00 . B B . 20 GLY HA3 1 1 10 7607 2 2 20 GLY N N -7.738 3.602 -6.114 1.00 . B B . 20 GLY N 1 1 10 7608 2 2 20 GLY O O -10.161 5.288 -4.857 1.00 . B B . 20 GLY O 1 1 10 7609 2 2 21 GLU C C -12.477 3.340 -5.588 1.00 . B B . 21 GLU C 1 1 10 7610 2 2 21 GLU CA C -12.160 4.529 -6.496 1.00 . B B . 21 GLU CA 1 1 10 7611 2 2 21 GLU CB C -12.991 4.429 -7.778 1.00 . B B . 21 GLU CB 1 1 10 7612 2 2 21 GLU CD C -15.122 5.308 -8.741 1.00 . B B . 21 GLU CD 1 1 10 7613 2 2 21 GLU CG C -14.448 4.781 -7.473 1.00 . B B . 21 GLU CG 1 1 10 7614 2 2 21 GLU H H -10.423 4.258 -7.741 1.00 . B B . 21 GLU H 1 1 10 7615 2 2 21 GLU HA H -12.407 5.444 -5.980 1.00 . B B . 21 GLU HA 1 1 10 7616 2 2 21 GLU HB2 H -12.600 5.117 -8.513 1.00 . B B . 21 GLU HB2 1 1 10 7617 2 2 21 GLU HB3 H -12.940 3.422 -8.164 1.00 . B B . 21 GLU HB3 1 1 10 7618 2 2 21 GLU HG2 H -14.966 3.899 -7.128 1.00 . B B . 21 GLU HG2 1 1 10 7619 2 2 21 GLU HG3 H -14.482 5.541 -6.708 1.00 . B B . 21 GLU HG3 1 1 10 7620 2 2 21 GLU N N -10.712 4.535 -6.846 1.00 . B B . 21 GLU N 1 1 10 7621 2 2 21 GLU O O -13.428 3.365 -4.832 1.00 . B B . 21 GLU O 1 1 10 7622 2 2 21 GLU OE1 O -14.677 6.325 -9.245 1.00 . B B . 21 GLU OE1 1 1 10 7623 2 2 21 GLU OE2 O -16.071 4.684 -9.186 1.00 . B B . 21 GLU OE2 1 1 10 7624 2 2 22 ARG C C -11.598 1.463 -3.343 1.00 . B B . 22 ARG C 1 1 10 7625 2 2 22 ARG CA C -11.963 1.124 -4.789 1.00 . B B . 22 ARG CA 1 1 10 7626 2 2 22 ARG CB C -11.114 -0.049 -5.274 1.00 . B B . 22 ARG CB 1 1 10 7627 2 2 22 ARG CD C -13.147 -1.437 -5.716 1.00 . B B . 22 ARG CD 1 1 10 7628 2 2 22 ARG CG C -11.886 -0.834 -6.337 1.00 . B B . 22 ARG CG 1 1 10 7629 2 2 22 ARG CZ C -14.365 -3.344 -6.575 1.00 . B B . 22 ARG CZ 1 1 10 7630 2 2 22 ARG H H -10.930 2.290 -6.262 1.00 . B B . 22 ARG H 1 1 10 7631 2 2 22 ARG HA H -13.008 0.863 -4.847 1.00 . B B . 22 ARG HA 1 1 10 7632 2 2 22 ARG HB2 H -10.194 0.325 -5.700 1.00 . B B . 22 ARG HB2 1 1 10 7633 2 2 22 ARG HB3 H -10.888 -0.695 -4.445 1.00 . B B . 22 ARG HB3 1 1 10 7634 2 2 22 ARG HD2 H -13.096 -1.349 -4.640 1.00 . B B . 22 ARG HD2 1 1 10 7635 2 2 22 ARG HD3 H -14.016 -0.907 -6.079 1.00 . B B . 22 ARG HD3 1 1 10 7636 2 2 22 ARG HE H -12.474 -3.467 -5.983 1.00 . B B . 22 ARG HE 1 1 10 7637 2 2 22 ARG HG2 H -12.163 -0.170 -7.143 1.00 . B B . 22 ARG HG2 1 1 10 7638 2 2 22 ARG HG3 H -11.263 -1.627 -6.722 1.00 . B B . 22 ARG HG3 1 1 10 7639 2 2 22 ARG HH11 H -15.507 -2.462 -5.187 1.00 . B B . 22 ARG HH11 1 1 10 7640 2 2 22 ARG HH12 H -16.355 -3.408 -6.364 1.00 . B B . 22 ARG HH12 1 1 10 7641 2 2 22 ARG HH21 H -13.484 -4.333 -8.076 1.00 . B B . 22 ARG HH21 1 1 10 7642 2 2 22 ARG HH22 H -15.209 -4.467 -8.002 1.00 . B B . 22 ARG HH22 1 1 10 7643 2 2 22 ARG N N -11.695 2.300 -5.651 1.00 . B B . 22 ARG N 1 1 10 7644 2 2 22 ARG NE N -13.247 -2.875 -6.094 1.00 . B B . 22 ARG NE 1 1 10 7645 2 2 22 ARG NH1 N -15.497 -3.048 -5.997 1.00 . B B . 22 ARG NH1 1 1 10 7646 2 2 22 ARG NH2 N -14.352 -4.108 -7.633 1.00 . B B . 22 ARG NH2 1 1 10 7647 2 2 22 ARG O O -11.837 0.689 -2.438 1.00 . B B . 22 ARG O 1 1 10 7648 2 2 23 GLY C C -9.659 1.974 -1.161 1.00 . B B . 23 GLY C 1 1 10 7649 2 2 23 GLY CA C -10.640 3.003 -1.728 1.00 . B B . 23 GLY CA 1 1 10 7650 2 2 23 GLY H H -10.840 3.228 -3.864 1.00 . B B . 23 GLY H 1 1 10 7651 2 2 23 GLY HA2 H -10.175 3.979 -1.742 1.00 . B B . 23 GLY HA2 1 1 10 7652 2 2 23 GLY HA3 H -11.523 3.034 -1.108 1.00 . B B . 23 GLY HA3 1 1 10 7653 2 2 23 GLY N N -11.021 2.616 -3.118 1.00 . B B . 23 GLY N 1 1 10 7654 2 2 23 GLY O O -9.756 0.795 -1.437 1.00 . B B . 23 GLY O 1 1 10 7655 2 2 24 PHE C C -8.045 1.202 1.685 1.00 . B B . 24 PHE C 1 1 10 7656 2 2 24 PHE CA C -7.741 1.430 0.203 1.00 . B B . 24 PHE CA 1 1 10 7657 2 2 24 PHE CB C -6.314 1.959 0.047 1.00 . B B . 24 PHE CB 1 1 10 7658 2 2 24 PHE CD1 C -6.469 4.311 -0.852 1.00 . B B . 24 PHE CD1 1 1 10 7659 2 2 24 PHE CD2 C -6.057 3.993 1.518 1.00 . B B . 24 PHE CD2 1 1 10 7660 2 2 24 PHE CE1 C -6.426 5.701 -0.673 1.00 . B B . 24 PHE CE1 1 1 10 7661 2 2 24 PHE CE2 C -6.010 5.383 1.697 1.00 . B B . 24 PHE CE2 1 1 10 7662 2 2 24 PHE CG C -6.285 3.457 0.243 1.00 . B B . 24 PHE CG 1 1 10 7663 2 2 24 PHE CZ C -6.195 6.236 0.601 1.00 . B B . 24 PHE CZ 1 1 10 7664 2 2 24 PHE H H -8.644 3.356 -0.152 1.00 . B B . 24 PHE H 1 1 10 7665 2 2 24 PHE HA H -7.829 0.490 -0.323 1.00 . B B . 24 PHE HA 1 1 10 7666 2 2 24 PHE HB2 H -5.677 1.492 0.783 1.00 . B B . 24 PHE HB2 1 1 10 7667 2 2 24 PHE HB3 H -5.951 1.722 -0.942 1.00 . B B . 24 PHE HB3 1 1 10 7668 2 2 24 PHE HD1 H -6.647 3.899 -1.834 1.00 . B B . 24 PHE HD1 1 1 10 7669 2 2 24 PHE HD2 H -5.915 3.335 2.363 1.00 . B B . 24 PHE HD2 1 1 10 7670 2 2 24 PHE HE1 H -6.570 6.359 -1.517 1.00 . B B . 24 PHE HE1 1 1 10 7671 2 2 24 PHE HE2 H -5.835 5.795 2.680 1.00 . B B . 24 PHE HE2 1 1 10 7672 2 2 24 PHE HZ H -6.154 7.308 0.736 1.00 . B B . 24 PHE HZ 1 1 10 7673 2 2 24 PHE N N -8.713 2.402 -0.369 1.00 . B B . 24 PHE N 1 1 10 7674 2 2 24 PHE O O -8.954 1.787 2.240 1.00 . B B . 24 PHE O 1 1 10 7675 2 2 25 PHE C C -6.254 0.257 4.566 1.00 . B B . 25 PHE C 1 1 10 7676 2 2 25 PHE CA C -7.548 0.073 3.769 1.00 . B B . 25 PHE CA 1 1 10 7677 2 2 25 PHE CB C -8.042 -1.366 3.929 1.00 . B B . 25 PHE CB 1 1 10 7678 2 2 25 PHE CD1 C -9.079 -0.640 6.111 1.00 . B B . 25 PHE CD1 1 1 10 7679 2 2 25 PHE CD2 C -10.281 -2.219 4.713 1.00 . B B . 25 PHE CD2 1 1 10 7680 2 2 25 PHE CE1 C -10.118 -0.682 7.050 1.00 . B B . 25 PHE CE1 1 1 10 7681 2 2 25 PHE CE2 C -11.320 -2.260 5.652 1.00 . B B . 25 PHE CE2 1 1 10 7682 2 2 25 PHE CG C -9.161 -1.409 4.942 1.00 . B B . 25 PHE CG 1 1 10 7683 2 2 25 PHE CZ C -11.238 -1.491 6.821 1.00 . B B . 25 PHE CZ 1 1 10 7684 2 2 25 PHE H H -6.572 -0.119 1.858 1.00 . B B . 25 PHE H 1 1 10 7685 2 2 25 PHE HA H -8.299 0.754 4.140 1.00 . B B . 25 PHE HA 1 1 10 7686 2 2 25 PHE HB2 H -8.404 -1.729 2.978 1.00 . B B . 25 PHE HB2 1 1 10 7687 2 2 25 PHE HB3 H -7.228 -1.991 4.267 1.00 . B B . 25 PHE HB3 1 1 10 7688 2 2 25 PHE HD1 H -8.215 -0.016 6.288 1.00 . B B . 25 PHE HD1 1 1 10 7689 2 2 25 PHE HD2 H -10.343 -2.811 3.812 1.00 . B B . 25 PHE HD2 1 1 10 7690 2 2 25 PHE HE1 H -10.055 -0.089 7.951 1.00 . B B . 25 PHE HE1 1 1 10 7691 2 2 25 PHE HE2 H -12.183 -2.885 5.475 1.00 . B B . 25 PHE HE2 1 1 10 7692 2 2 25 PHE HZ H -12.039 -1.524 7.544 1.00 . B B . 25 PHE HZ 1 1 10 7693 2 2 25 PHE N N -7.296 0.348 2.327 1.00 . B B . 25 PHE N 1 1 10 7694 2 2 25 PHE O O -5.706 -0.685 5.103 1.00 . B B . 25 PHE O 1 1 10 7695 2 2 26 TYR C C -4.750 1.323 6.890 1.00 . B B . 26 TYR C 1 1 10 7696 2 2 26 TYR CA C -4.511 1.700 5.427 1.00 . B B . 26 TYR CA 1 1 10 7697 2 2 26 TYR CB C -4.130 3.180 5.330 1.00 . B B . 26 TYR CB 1 1 10 7698 2 2 26 TYR CD1 C -1.784 2.437 5.910 1.00 . B B . 26 TYR CD1 1 1 10 7699 2 2 26 TYR CD2 C -2.539 4.622 6.649 1.00 . B B . 26 TYR CD2 1 1 10 7700 2 2 26 TYR CE1 C -0.538 2.666 6.509 1.00 . B B . 26 TYR CE1 1 1 10 7701 2 2 26 TYR CE2 C -1.294 4.850 7.248 1.00 . B B . 26 TYR CE2 1 1 10 7702 2 2 26 TYR CG C -2.786 3.416 5.980 1.00 . B B . 26 TYR CG 1 1 10 7703 2 2 26 TYR CZ C -0.293 3.872 7.178 1.00 . B B . 26 TYR CZ 1 1 10 7704 2 2 26 TYR H H -6.221 2.213 4.221 1.00 . B B . 26 TYR H 1 1 10 7705 2 2 26 TYR HA H -3.718 1.092 5.020 1.00 . B B . 26 TYR HA 1 1 10 7706 2 2 26 TYR HB2 H -4.080 3.470 4.291 1.00 . B B . 26 TYR HB2 1 1 10 7707 2 2 26 TYR HB3 H -4.878 3.775 5.831 1.00 . B B . 26 TYR HB3 1 1 10 7708 2 2 26 TYR HD1 H -1.972 1.507 5.396 1.00 . B B . 26 TYR HD1 1 1 10 7709 2 2 26 TYR HD2 H -3.311 5.377 6.704 1.00 . B B . 26 TYR HD2 1 1 10 7710 2 2 26 TYR HE1 H 0.233 1.912 6.456 1.00 . B B . 26 TYR HE1 1 1 10 7711 2 2 26 TYR HE2 H -1.104 5.780 7.764 1.00 . B B . 26 TYR HE2 1 1 10 7712 2 2 26 TYR HH H 1.515 4.477 7.102 1.00 . B B . 26 TYR HH 1 1 10 7713 2 2 26 TYR N N -5.764 1.463 4.655 1.00 . B B . 26 TYR N 1 1 10 7714 2 2 26 TYR O O -5.747 1.694 7.478 1.00 . B B . 26 TYR O 1 1 10 7715 2 2 26 TYR OH O 0.934 4.098 7.766 1.00 . B B . 26 TYR OH 1 1 10 7716 2 2 27 THR C C -2.846 0.629 9.735 1.00 . B B . 27 THR C 1 1 10 7717 2 2 27 THR CA C -4.049 0.185 8.906 1.00 . B B . 27 THR CA 1 1 10 7718 2 2 27 THR CB C -4.192 -1.337 8.995 1.00 . B B . 27 THR CB 1 1 10 7719 2 2 27 THR CG2 C -5.512 -1.769 8.355 1.00 . B B . 27 THR CG2 1 1 10 7720 2 2 27 THR H H -3.057 0.288 6.998 1.00 . B B . 27 THR H 1 1 10 7721 2 2 27 THR HA H -4.943 0.653 9.291 1.00 . B B . 27 THR HA 1 1 10 7722 2 2 27 THR HB H -4.184 -1.639 10.030 1.00 . B B . 27 THR HB 1 1 10 7723 2 2 27 THR HG1 H -3.247 -2.903 8.332 1.00 . B B . 27 THR HG1 1 1 10 7724 2 2 27 THR HG21 H -5.416 -1.744 7.280 1.00 . B B . 27 THR HG21 1 1 10 7725 2 2 27 THR HG22 H -6.298 -1.095 8.662 1.00 . B B . 27 THR HG22 1 1 10 7726 2 2 27 THR HG23 H -5.754 -2.773 8.671 1.00 . B B . 27 THR HG23 1 1 10 7727 2 2 27 THR N N -3.854 0.584 7.485 1.00 . B B . 27 THR N 1 1 10 7728 2 2 27 THR O O -1.726 0.650 9.263 1.00 . B B . 27 THR O 1 1 10 7729 2 2 27 THR OG1 O -3.108 -1.953 8.312 1.00 . B B . 27 THR OG1 1 1 10 7730 2 2 28 LYS C C -2.306 1.243 13.303 1.00 . B B . 28 LYS C 1 1 10 7731 2 2 28 LYS CA C -1.936 1.402 11.834 1.00 . B B . 28 LYS CA 1 1 10 7732 2 2 28 LYS CB C -1.601 2.871 11.593 1.00 . B B . 28 LYS CB 1 1 10 7733 2 2 28 LYS CD C 0.334 4.484 11.261 1.00 . B B . 28 LYS CD 1 1 10 7734 2 2 28 LYS CE C -0.827 5.413 10.885 1.00 . B B . 28 LYS CE 1 1 10 7735 2 2 28 LYS CG C -0.116 3.008 11.253 1.00 . B B . 28 LYS CG 1 1 10 7736 2 2 28 LYS H H -3.969 0.941 11.335 1.00 . B B . 28 LYS H 1 1 10 7737 2 2 28 LYS HA H -1.070 0.797 11.612 1.00 . B B . 28 LYS HA 1 1 10 7738 2 2 28 LYS HB2 H -2.206 3.251 10.788 1.00 . B B . 28 LYS HB2 1 1 10 7739 2 2 28 LYS HB3 H -1.815 3.427 12.492 1.00 . B B . 28 LYS HB3 1 1 10 7740 2 2 28 LYS HD2 H 0.694 4.743 12.246 1.00 . B B . 28 LYS HD2 1 1 10 7741 2 2 28 LYS HD3 H 1.137 4.614 10.546 1.00 . B B . 28 LYS HD3 1 1 10 7742 2 2 28 LYS HE2 H -0.445 6.259 10.334 1.00 . B B . 28 LYS HE2 1 1 10 7743 2 2 28 LYS HE3 H -1.536 4.878 10.273 1.00 . B B . 28 LYS HE3 1 1 10 7744 2 2 28 LYS HG2 H 0.458 2.462 11.987 1.00 . B B . 28 LYS HG2 1 1 10 7745 2 2 28 LYS HG3 H 0.059 2.587 10.278 1.00 . B B . 28 LYS HG3 1 1 10 7746 2 2 28 LYS HZ1 H -1.773 6.888 12.011 1.00 . B B . 28 LYS HZ1 1 1 10 7747 2 2 28 LYS HZ2 H -0.845 5.801 12.931 1.00 . B B . 28 LYS HZ2 1 1 10 7748 2 2 28 LYS HZ3 H -2.349 5.320 12.304 1.00 . B B . 28 LYS HZ3 1 1 10 7749 2 2 28 LYS N N -3.065 0.973 10.972 1.00 . B B . 28 LYS N 1 1 10 7750 2 2 28 LYS NZ N -1.500 5.891 12.126 1.00 . B B . 28 LYS NZ 1 1 10 7751 2 2 28 LYS O O -1.630 0.546 14.034 1.00 . B B . 28 LYS O 1 1 10 7752 2 2 29 PRO C C -4.706 0.732 15.379 1.00 . B B . 29 PRO C 1 1 10 7753 2 2 29 PRO CA C -3.768 1.916 15.117 1.00 . B B . 29 PRO CA 1 1 10 7754 2 2 29 PRO CB C -4.511 3.241 15.255 1.00 . B B . 29 PRO CB 1 1 10 7755 2 2 29 PRO CD C -4.187 2.794 12.849 1.00 . B B . 29 PRO CD 1 1 10 7756 2 2 29 PRO CG C -5.011 3.621 13.843 1.00 . B B . 29 PRO CG 1 1 10 7757 2 2 29 PRO HA H -2.919 1.895 15.780 1.00 . B B . 29 PRO HA 1 1 10 7758 2 2 29 PRO HB2 H -5.339 3.144 15.941 1.00 . B B . 29 PRO HB2 1 1 10 7759 2 2 29 PRO HB3 H -3.819 3.996 15.592 1.00 . B B . 29 PRO HB3 1 1 10 7760 2 2 29 PRO HD2 H -4.846 2.197 12.235 1.00 . B B . 29 PRO HD2 1 1 10 7761 2 2 29 PRO HD3 H -3.590 3.442 12.243 1.00 . B B . 29 PRO HD3 1 1 10 7762 2 2 29 PRO HG2 H -6.062 3.383 13.747 1.00 . B B . 29 PRO HG2 1 1 10 7763 2 2 29 PRO HG3 H -4.851 4.673 13.663 1.00 . B B . 29 PRO HG3 1 1 10 7764 2 2 29 PRO N N -3.342 1.934 13.716 1.00 . B B . 29 PRO N 1 1 10 7765 2 2 29 PRO O O -5.903 0.895 15.511 1.00 . B B . 29 PRO O 1 1 10 7766 2 2 30 THR C C -4.812 -2.145 17.138 1.00 . B B . 30 THR C 1 1 10 7767 2 2 30 THR CA C -5.036 -1.646 15.709 1.00 . B B . 30 THR CA 1 1 10 7768 2 2 30 THR CB C -4.676 -2.757 14.718 1.00 . B B . 30 THR CB 1 1 10 7769 2 2 30 THR CG2 C -5.739 -3.856 14.771 1.00 . B B . 30 THR CG2 1 1 10 7770 2 2 30 THR H H -3.206 -0.568 15.346 1.00 . B B . 30 THR H 1 1 10 7771 2 2 30 THR HA H -6.074 -1.373 15.582 1.00 . B B . 30 THR HA 1 1 10 7772 2 2 30 THR HB H -3.718 -3.176 14.980 1.00 . B B . 30 THR HB 1 1 10 7773 2 2 30 THR HG1 H -3.696 -2.028 13.205 1.00 . B B . 30 THR HG1 1 1 10 7774 2 2 30 THR HG21 H -6.140 -3.921 15.772 1.00 . B B . 30 THR HG21 1 1 10 7775 2 2 30 THR HG22 H -5.293 -4.801 14.500 1.00 . B B . 30 THR HG22 1 1 10 7776 2 2 30 THR HG23 H -6.535 -3.621 14.080 1.00 . B B . 30 THR HG23 1 1 10 7777 2 2 30 THR N N -4.173 -0.457 15.456 1.00 . B B . 30 THR N 1 1 10 7778 2 2 30 THR O O -5.745 -2.074 17.922 1.00 . B B . 30 THR O 1 1 10 7779 2 2 30 THR OXT O -3.712 -2.588 17.424 1.00 . B B . 30 THR OXT 1 1 10 7780 2 2 30 THR OG1 O -4.616 -2.216 13.406 1.00 . B B . 30 THR OG1 1 1 11 7781 1 1 1 GLY C C 0.679 -4.157 8.197 1.00 . A A . 1 GLY C 1 1 11 7782 1 1 1 GLY CA C 0.074 -4.382 9.541 1.00 . A A . 1 GLY CA 1 1 11 7783 1 1 1 GLY H1 H -0.840 -2.481 9.701 1.00 . A A . 1 GLY H1 1 1 11 7784 1 1 1 GLY H2 H -1.060 -3.460 11.071 1.00 . A A . 1 GLY H2 1 1 11 7785 1 1 1 GLY H3 H -1.948 -3.766 9.656 1.00 . A A . 1 GLY H3 1 1 11 7786 1 1 1 GLY HA2 H 0.948 -4.097 9.865 1.00 . A A . 1 GLY HA2 1 1 11 7787 1 1 1 GLY HA3 H -0.212 -5.459 9.889 1.00 . A A . 1 GLY HA3 1 1 11 7788 1 1 1 GLY N N -1.032 -3.447 10.032 1.00 . A A . 1 GLY N 1 1 11 7789 1 1 1 GLY O O 1.860 -4.358 7.995 1.00 . A A . 1 GLY O 1 1 11 7790 1 1 2 ILE C C 1.640 -2.560 5.960 1.00 . A A . 2 ILE C 1 1 11 7791 1 1 2 ILE CA C 0.434 -3.500 5.879 1.00 . A A . 2 ILE CA 1 1 11 7792 1 1 2 ILE CB C -0.662 -2.890 4.983 1.00 . A A . 2 ILE CB 1 1 11 7793 1 1 2 ILE CD1 C -1.100 -1.446 2.976 1.00 . A A . 2 ILE CD1 1 1 11 7794 1 1 2 ILE CG1 C -0.021 -2.164 3.791 1.00 . A A . 2 ILE CG1 1 1 11 7795 1 1 2 ILE CG2 C -1.508 -1.900 5.788 1.00 . A A . 2 ILE CG2 1 1 11 7796 1 1 2 ILE H H -1.061 -3.589 7.429 1.00 . A A . 2 ILE H 1 1 11 7797 1 1 2 ILE HA H 0.751 -4.435 5.459 1.00 . A A . 2 ILE HA 1 1 11 7798 1 1 2 ILE HB H -1.300 -3.682 4.617 1.00 . A A . 2 ILE HB 1 1 11 7799 1 1 2 ILE HD11 H -1.992 -1.335 3.575 1.00 . A A . 2 ILE HD11 1 1 11 7800 1 1 2 ILE HD12 H -1.328 -2.025 2.094 1.00 . A A . 2 ILE HD12 1 1 11 7801 1 1 2 ILE HD13 H -0.739 -0.472 2.683 1.00 . A A . 2 ILE HD13 1 1 11 7802 1 1 2 ILE HG12 H 0.693 -1.439 4.153 1.00 . A A . 2 ILE HG12 1 1 11 7803 1 1 2 ILE HG13 H 0.482 -2.882 3.162 1.00 . A A . 2 ILE HG13 1 1 11 7804 1 1 2 ILE HG21 H -1.149 -1.860 6.805 1.00 . A A . 2 ILE HG21 1 1 11 7805 1 1 2 ILE HG22 H -2.539 -2.220 5.783 1.00 . A A . 2 ILE HG22 1 1 11 7806 1 1 2 ILE HG23 H -1.434 -0.919 5.341 1.00 . A A . 2 ILE HG23 1 1 11 7807 1 1 2 ILE N N -0.110 -3.740 7.246 1.00 . A A . 2 ILE N 1 1 11 7808 1 1 2 ILE O O 2.754 -2.944 5.680 1.00 . A A . 2 ILE O 1 1 11 7809 1 1 3 ABA C C 3.781 -1.000 6.981 1.00 . A A . 3 ABA C 1 1 11 7810 1 1 3 ABA CA C 2.522 -0.345 6.418 1.00 . A A . 3 ABA CA 1 1 11 7811 1 1 3 ABA CB C 2.095 0.804 7.333 1.00 . A A . 3 ABA CB 1 1 11 7812 1 1 3 ABA CG C 0.624 1.154 7.086 1.00 . A A . 3 ABA CG 1 1 11 7813 1 1 3 ABA H H 0.510 -1.061 6.537 1.00 . A A . 3 ABA H 1 1 11 7814 1 1 3 ABA HA H 2.734 0.041 5.441 1.00 . A A . 3 ABA HA 1 1 11 7815 1 1 3 ABA HB2 H 2.227 0.510 8.364 1.00 . A A . 3 ABA HB2 1 1 11 7816 1 1 3 ABA HB3 H 2.703 1.663 7.125 1.00 . A A . 3 ABA HB3 1 1 11 7817 1 1 3 ABA HG1 H 0.439 2.173 7.395 1.00 . A A . 3 ABA HG1 1 1 11 7818 1 1 3 ABA HG2 H -0.006 0.486 7.654 1.00 . A A . 3 ABA HG2 1 1 11 7819 1 1 3 ABA HG3 H 0.400 1.051 6.034 1.00 . A A . 3 ABA HG3 1 1 11 7820 1 1 3 ABA N N 1.414 -1.335 6.327 1.00 . A A . 3 ABA N 1 1 11 7821 1 1 3 ABA O O 4.813 -1.034 6.349 1.00 . A A . 3 ABA O 1 1 11 7822 1 1 4 GLU C C 5.527 -3.122 7.767 1.00 . A A . 4 GLU C 1 1 11 7823 1 1 4 GLU CA C 4.878 -2.166 8.782 1.00 . A A . 4 GLU CA 1 1 11 7824 1 1 4 GLU CB C 4.388 -2.914 10.027 1.00 . A A . 4 GLU CB 1 1 11 7825 1 1 4 GLU CD C 5.190 -4.582 11.706 1.00 . A A . 4 GLU CD 1 1 11 7826 1 1 4 GLU CG C 5.154 -4.221 10.219 1.00 . A A . 4 GLU CG 1 1 11 7827 1 1 4 GLU H H 2.857 -1.476 8.649 1.00 . A A . 4 GLU H 1 1 11 7828 1 1 4 GLU HA H 5.594 -1.412 9.074 1.00 . A A . 4 GLU HA 1 1 11 7829 1 1 4 GLU HB2 H 4.525 -2.286 10.893 1.00 . A A . 4 GLU HB2 1 1 11 7830 1 1 4 GLU HB3 H 3.340 -3.129 9.907 1.00 . A A . 4 GLU HB3 1 1 11 7831 1 1 4 GLU HG2 H 4.657 -5.005 9.667 1.00 . A A . 4 GLU HG2 1 1 11 7832 1 1 4 GLU HG3 H 6.160 -4.101 9.852 1.00 . A A . 4 GLU HG3 1 1 11 7833 1 1 4 GLU N N 3.699 -1.515 8.162 1.00 . A A . 4 GLU N 1 1 11 7834 1 1 4 GLU O O 6.728 -3.302 7.753 1.00 . A A . 4 GLU O 1 1 11 7835 1 1 4 GLU OE1 O 5.584 -3.736 12.492 1.00 . A A . 4 GLU OE1 1 1 11 7836 1 1 4 GLU OE2 O 4.822 -5.698 12.033 1.00 . A A . 4 GLU OE2 1 1 11 7837 1 1 5 GLN C C 5.554 -3.902 4.598 1.00 . A A . 5 GLN C 1 1 11 7838 1 1 5 GLN CA C 5.321 -4.664 5.907 1.00 . A A . 5 GLN CA 1 1 11 7839 1 1 5 GLN CB C 4.346 -5.821 5.666 1.00 . A A . 5 GLN CB 1 1 11 7840 1 1 5 GLN CD C 5.869 -7.410 6.850 1.00 . A A . 5 GLN CD 1 1 11 7841 1 1 5 GLN CG C 5.125 -7.134 5.542 1.00 . A A . 5 GLN CG 1 1 11 7842 1 1 5 GLN H H 3.777 -3.570 6.942 1.00 . A A . 5 GLN H 1 1 11 7843 1 1 5 GLN HA H 6.261 -5.052 6.271 1.00 . A A . 5 GLN HA 1 1 11 7844 1 1 5 GLN HB2 H 3.657 -5.889 6.496 1.00 . A A . 5 GLN HB2 1 1 11 7845 1 1 5 GLN HB3 H 3.795 -5.645 4.754 1.00 . A A . 5 GLN HB3 1 1 11 7846 1 1 5 GLN HE21 H 4.497 -8.674 7.531 1.00 . A A . 5 GLN HE21 1 1 11 7847 1 1 5 GLN HE22 H 5.822 -8.420 8.560 1.00 . A A . 5 GLN HE22 1 1 11 7848 1 1 5 GLN HG2 H 4.436 -7.942 5.342 1.00 . A A . 5 GLN HG2 1 1 11 7849 1 1 5 GLN HG3 H 5.836 -7.057 4.734 1.00 . A A . 5 GLN HG3 1 1 11 7850 1 1 5 GLN N N 4.743 -3.730 6.918 1.00 . A A . 5 GLN N 1 1 11 7851 1 1 5 GLN NE2 N 5.353 -8.237 7.719 1.00 . A A . 5 GLN NE2 1 1 11 7852 1 1 5 GLN O O 6.496 -4.158 3.874 1.00 . A A . 5 GLN O 1 1 11 7853 1 1 5 GLN OE1 O 6.932 -6.870 7.084 1.00 . A A . 5 GLN OE1 1 1 11 7854 1 1 6 CYS C C 5.665 -0.901 3.400 1.00 . A A . 6 CYS C 1 1 11 7855 1 1 6 CYS CA C 4.852 -2.154 3.065 1.00 . A A . 6 CYS CA 1 1 11 7856 1 1 6 CYS CB C 3.455 -1.742 2.588 1.00 . A A . 6 CYS CB 1 1 11 7857 1 1 6 CYS H H 3.961 -2.765 4.905 1.00 . A A . 6 CYS H 1 1 11 7858 1 1 6 CYS HA H 5.355 -2.729 2.301 1.00 . A A . 6 CYS HA 1 1 11 7859 1 1 6 CYS HB2 H 2.866 -1.429 3.436 1.00 . A A . 6 CYS HB2 1 1 11 7860 1 1 6 CYS HB3 H 3.538 -0.927 1.904 1.00 . A A . 6 CYS HB3 1 1 11 7861 1 1 6 CYS N N 4.704 -2.958 4.302 1.00 . A A . 6 CYS N 1 1 11 7862 1 1 6 CYS O O 5.664 0.070 2.670 1.00 . A A . 6 CYS O 1 1 11 7863 1 1 6 CYS SG S 2.626 -3.131 1.772 1.00 . A A . 6 CYS SG 1 1 11 7864 1 1 7 CYS C C 8.519 -0.160 5.449 1.00 . A A . 7 CYS C 1 1 11 7865 1 1 7 CYS CA C 7.143 0.276 4.929 1.00 . A A . 7 CYS CA 1 1 11 7866 1 1 7 CYS CB C 6.392 1.031 6.025 1.00 . A A . 7 CYS CB 1 1 11 7867 1 1 7 CYS H H 6.314 -1.703 5.095 1.00 . A A . 7 CYS H 1 1 11 7868 1 1 7 CYS HA H 7.273 0.927 4.086 1.00 . A A . 7 CYS HA 1 1 11 7869 1 1 7 CYS HB2 H 5.413 1.310 5.667 1.00 . A A . 7 CYS HB2 1 1 11 7870 1 1 7 CYS HB3 H 6.284 0.398 6.884 1.00 . A A . 7 CYS HB3 1 1 11 7871 1 1 7 CYS N N 6.344 -0.914 4.518 1.00 . A A . 7 CYS N 1 1 11 7872 1 1 7 CYS O O 9.483 0.575 5.355 1.00 . A A . 7 CYS O 1 1 11 7873 1 1 7 CYS SG S 7.323 2.517 6.477 1.00 . A A . 7 CYS SG 1 1 11 7874 1 1 8 THR C C 10.681 -2.559 5.391 1.00 . A A . 8 THR C 1 1 11 7875 1 1 8 THR CA C 9.953 -1.802 6.503 1.00 . A A . 8 THR CA 1 1 11 7876 1 1 8 THR CB C 9.746 -2.725 7.705 1.00 . A A . 8 THR CB 1 1 11 7877 1 1 8 THR CG2 C 8.787 -2.065 8.697 1.00 . A A . 8 THR CG2 1 1 11 7878 1 1 8 THR H H 7.850 -1.934 6.063 1.00 . A A . 8 THR H 1 1 11 7879 1 1 8 THR HA H 10.541 -0.946 6.802 1.00 . A A . 8 THR HA 1 1 11 7880 1 1 8 THR HB H 10.692 -2.905 8.190 1.00 . A A . 8 THR HB 1 1 11 7881 1 1 8 THR HG1 H 9.127 -4.541 8.020 1.00 . A A . 8 THR HG1 1 1 11 7882 1 1 8 THR HG21 H 7.969 -1.611 8.158 1.00 . A A . 8 THR HG21 1 1 11 7883 1 1 8 THR HG22 H 9.314 -1.306 9.257 1.00 . A A . 8 THR HG22 1 1 11 7884 1 1 8 THR HG23 H 8.401 -2.811 9.376 1.00 . A A . 8 THR HG23 1 1 11 7885 1 1 8 THR N N 8.630 -1.344 5.993 1.00 . A A . 8 THR N 1 1 11 7886 1 1 8 THR O O 11.891 -2.675 5.388 1.00 . A A . 8 THR O 1 1 11 7887 1 1 8 THR OG1 O 9.197 -3.959 7.261 1.00 . A A . 8 THR OG1 1 1 11 7888 1 1 9 SER C C 10.156 -3.167 1.989 1.00 . A A . 9 SER C 1 1 11 7889 1 1 9 SER CA C 10.585 -3.810 3.315 1.00 . A A . 9 SER CA 1 1 11 7890 1 1 9 SER CB C 10.165 -5.285 3.360 1.00 . A A . 9 SER CB 1 1 11 7891 1 1 9 SER H H 8.973 -2.950 4.462 1.00 . A A . 9 SER H 1 1 11 7892 1 1 9 SER HA H 11.659 -3.741 3.409 1.00 . A A . 9 SER HA 1 1 11 7893 1 1 9 SER HB2 H 9.112 -5.372 3.156 1.00 . A A . 9 SER HB2 1 1 11 7894 1 1 9 SER HB3 H 10.721 -5.840 2.613 1.00 . A A . 9 SER HB3 1 1 11 7895 1 1 9 SER HG H 11.260 -5.433 4.961 1.00 . A A . 9 SER HG 1 1 11 7896 1 1 9 SER N N 9.947 -3.067 4.440 1.00 . A A . 9 SER N 1 1 11 7897 1 1 9 SER O O 10.547 -2.058 1.683 1.00 . A A . 9 SER O 1 1 11 7898 1 1 9 SER OG O 10.433 -5.810 4.653 1.00 . A A . 9 SER OG 1 1 11 7899 1 1 10 ILE C C 7.472 -3.611 -0.379 1.00 . A A . 10 ILE C 1 1 11 7900 1 1 10 ILE CA C 8.929 -3.231 -0.092 1.00 . A A . 10 ILE CA 1 1 11 7901 1 1 10 ILE CB C 9.831 -3.754 -1.217 1.00 . A A . 10 ILE CB 1 1 11 7902 1 1 10 ILE CD1 C 12.144 -3.541 -0.308 1.00 . A A . 10 ILE CD1 1 1 11 7903 1 1 10 ILE CG1 C 11.116 -2.932 -1.262 1.00 . A A . 10 ILE CG1 1 1 11 7904 1 1 10 ILE CG2 C 9.111 -3.639 -2.561 1.00 . A A . 10 ILE CG2 1 1 11 7905 1 1 10 ILE H H 9.045 -4.727 1.442 1.00 . A A . 10 ILE H 1 1 11 7906 1 1 10 ILE HA H 9.016 -2.156 -0.032 1.00 . A A . 10 ILE HA 1 1 11 7907 1 1 10 ILE HB H 10.075 -4.786 -1.030 1.00 . A A . 10 ILE HB 1 1 11 7908 1 1 10 ILE HD11 H 12.530 -2.773 0.345 1.00 . A A . 10 ILE HD11 1 1 11 7909 1 1 10 ILE HD12 H 12.955 -3.970 -0.879 1.00 . A A . 10 ILE HD12 1 1 11 7910 1 1 10 ILE HD13 H 11.673 -4.312 0.283 1.00 . A A . 10 ILE HD13 1 1 11 7911 1 1 10 ILE HG12 H 11.509 -2.938 -2.268 1.00 . A A . 10 ILE HG12 1 1 11 7912 1 1 10 ILE HG13 H 10.904 -1.919 -0.961 1.00 . A A . 10 ILE HG13 1 1 11 7913 1 1 10 ILE HG21 H 8.219 -4.250 -2.541 1.00 . A A . 10 ILE HG21 1 1 11 7914 1 1 10 ILE HG22 H 9.764 -3.978 -3.349 1.00 . A A . 10 ILE HG22 1 1 11 7915 1 1 10 ILE HG23 H 8.837 -2.609 -2.734 1.00 . A A . 10 ILE HG23 1 1 11 7916 1 1 10 ILE N N 9.359 -3.836 1.197 1.00 . A A . 10 ILE N 1 1 11 7917 1 1 10 ILE O O 6.932 -4.532 0.199 1.00 . A A . 10 ILE O 1 1 11 7918 1 1 11 CYS C C 5.115 -2.689 -3.027 1.00 . A A . 11 CYS C 1 1 11 7919 1 1 11 CYS CA C 5.430 -3.235 -1.634 1.00 . A A . 11 CYS CA 1 1 11 7920 1 1 11 CYS CB C 4.488 -2.638 -0.593 1.00 . A A . 11 CYS CB 1 1 11 7921 1 1 11 CYS H H 7.308 -2.178 -1.746 1.00 . A A . 11 CYS H 1 1 11 7922 1 1 11 CYS HA H 5.303 -4.304 -1.645 1.00 . A A . 11 CYS HA 1 1 11 7923 1 1 11 CYS HB2 H 4.986 -1.837 -0.069 1.00 . A A . 11 CYS HB2 1 1 11 7924 1 1 11 CYS HB3 H 3.604 -2.262 -1.079 1.00 . A A . 11 CYS HB3 1 1 11 7925 1 1 11 CYS N N 6.843 -2.912 -1.285 1.00 . A A . 11 CYS N 1 1 11 7926 1 1 11 CYS O O 5.118 -1.496 -3.259 1.00 . A A . 11 CYS O 1 1 11 7927 1 1 11 CYS SG S 4.033 -3.947 0.577 1.00 . A A . 11 CYS SG 1 1 11 7928 1 1 12 SER C C 3.127 -2.671 -5.483 1.00 . A A . 12 SER C 1 1 11 7929 1 1 12 SER CA C 4.573 -3.137 -5.356 1.00 . A A . 12 SER CA 1 1 11 7930 1 1 12 SER CB C 4.809 -4.313 -6.305 1.00 . A A . 12 SER CB 1 1 11 7931 1 1 12 SER H H 4.887 -4.525 -3.744 1.00 . A A . 12 SER H 1 1 11 7932 1 1 12 SER HA H 5.228 -2.325 -5.632 1.00 . A A . 12 SER HA 1 1 11 7933 1 1 12 SER HB2 H 4.076 -4.295 -7.095 1.00 . A A . 12 SER HB2 1 1 11 7934 1 1 12 SER HB3 H 5.799 -4.233 -6.735 1.00 . A A . 12 SER HB3 1 1 11 7935 1 1 12 SER HG H 5.453 -6.075 -5.788 1.00 . A A . 12 SER HG 1 1 11 7936 1 1 12 SER N N 4.865 -3.570 -3.960 1.00 . A A . 12 SER N 1 1 11 7937 1 1 12 SER O O 2.275 -2.975 -4.672 1.00 . A A . 12 SER O 1 1 11 7938 1 1 12 SER OG O 4.689 -5.531 -5.583 1.00 . A A . 12 SER OG 1 1 11 7939 1 1 13 LEU C C 0.477 -2.527 -6.904 1.00 . A A . 13 LEU C 1 1 11 7940 1 1 13 LEU CA C 1.495 -1.394 -6.758 1.00 . A A . 13 LEU CA 1 1 11 7941 1 1 13 LEU CB C 1.517 -0.585 -8.055 1.00 . A A . 13 LEU CB 1 1 11 7942 1 1 13 LEU CD1 C 1.367 -0.802 -10.537 1.00 . A A . 13 LEU CD1 1 1 11 7943 1 1 13 LEU CD2 C 3.015 -2.175 -9.284 1.00 . A A . 13 LEU CD2 1 1 11 7944 1 1 13 LEU CG C 1.620 -1.550 -9.239 1.00 . A A . 13 LEU CG 1 1 11 7945 1 1 13 LEU H H 3.584 -1.699 -7.133 1.00 . A A . 13 LEU H 1 1 11 7946 1 1 13 LEU HA H 1.202 -0.756 -5.948 1.00 . A A . 13 LEU HA 1 1 11 7947 1 1 13 LEU HB2 H 0.608 -0.006 -8.136 1.00 . A A . 13 LEU HB2 1 1 11 7948 1 1 13 LEU HB3 H 2.369 0.077 -8.055 1.00 . A A . 13 LEU HB3 1 1 11 7949 1 1 13 LEU HD11 H 0.909 0.149 -10.318 1.00 . A A . 13 LEU HD11 1 1 11 7950 1 1 13 LEU HD12 H 0.711 -1.388 -11.163 1.00 . A A . 13 LEU HD12 1 1 11 7951 1 1 13 LEU HD13 H 2.306 -0.644 -11.045 1.00 . A A . 13 LEU HD13 1 1 11 7952 1 1 13 LEU HD21 H 3.752 -1.427 -9.032 1.00 . A A . 13 LEU HD21 1 1 11 7953 1 1 13 LEU HD22 H 3.209 -2.553 -10.277 1.00 . A A . 13 LEU HD22 1 1 11 7954 1 1 13 LEU HD23 H 3.067 -2.986 -8.573 1.00 . A A . 13 LEU HD23 1 1 11 7955 1 1 13 LEU HG H 0.883 -2.326 -9.127 1.00 . A A . 13 LEU HG 1 1 11 7956 1 1 13 LEU N N 2.863 -1.924 -6.512 1.00 . A A . 13 LEU N 1 1 11 7957 1 1 13 LEU O O -0.712 -2.288 -6.957 1.00 . A A . 13 LEU O 1 1 11 7958 1 1 14 TYR C C -0.215 -5.498 -5.770 1.00 . A A . 14 TYR C 1 1 11 7959 1 1 14 TYR CA C -0.086 -4.846 -7.122 1.00 . A A . 14 TYR CA 1 1 11 7960 1 1 14 TYR CB C 0.395 -5.833 -8.196 1.00 . A A . 14 TYR CB 1 1 11 7961 1 1 14 TYR CD1 C -1.524 -7.474 -8.162 1.00 . A A . 14 TYR CD1 1 1 11 7962 1 1 14 TYR CD2 C 0.676 -8.232 -7.470 1.00 . A A . 14 TYR CD2 1 1 11 7963 1 1 14 TYR CE1 C -2.040 -8.754 -7.920 1.00 . A A . 14 TYR CE1 1 1 11 7964 1 1 14 TYR CE2 C 0.159 -9.512 -7.229 1.00 . A A . 14 TYR CE2 1 1 11 7965 1 1 14 TYR CG C -0.166 -7.213 -7.936 1.00 . A A . 14 TYR CG 1 1 11 7966 1 1 14 TYR CZ C -1.199 -9.773 -7.454 1.00 . A A . 14 TYR CZ 1 1 11 7967 1 1 14 TYR H H 1.867 -3.961 -6.918 1.00 . A A . 14 TYR H 1 1 11 7968 1 1 14 TYR HA H -1.036 -4.424 -7.398 1.00 . A A . 14 TYR HA 1 1 11 7969 1 1 14 TYR HB2 H 0.064 -5.489 -9.167 1.00 . A A . 14 TYR HB2 1 1 11 7970 1 1 14 TYR HB3 H 1.474 -5.874 -8.184 1.00 . A A . 14 TYR HB3 1 1 11 7971 1 1 14 TYR HD1 H -2.172 -6.689 -8.522 1.00 . A A . 14 TYR HD1 1 1 11 7972 1 1 14 TYR HD2 H 1.723 -8.031 -7.297 1.00 . A A . 14 TYR HD2 1 1 11 7973 1 1 14 TYR HE1 H -3.086 -8.956 -8.094 1.00 . A A . 14 TYR HE1 1 1 11 7974 1 1 14 TYR HE2 H 0.808 -10.297 -6.869 1.00 . A A . 14 TYR HE2 1 1 11 7975 1 1 14 TYR HH H -1.181 -11.665 -7.714 1.00 . A A . 14 TYR HH 1 1 11 7976 1 1 14 TYR N N 0.905 -3.754 -6.974 1.00 . A A . 14 TYR N 1 1 11 7977 1 1 14 TYR O O -1.275 -5.918 -5.349 1.00 . A A . 14 TYR O 1 1 11 7978 1 1 14 TYR OH O -1.707 -11.035 -7.217 1.00 . A A . 14 TYR OH 1 1 11 7979 1 1 15 GLN C C 0.038 -5.060 -2.874 1.00 . A A . 15 GLN C 1 1 11 7980 1 1 15 GLN CA C 0.844 -6.046 -3.704 1.00 . A A . 15 GLN CA 1 1 11 7981 1 1 15 GLN CB C 2.281 -6.077 -3.217 1.00 . A A . 15 GLN CB 1 1 11 7982 1 1 15 GLN CD C 2.033 -8.481 -2.566 1.00 . A A . 15 GLN CD 1 1 11 7983 1 1 15 GLN CG C 2.861 -7.481 -3.376 1.00 . A A . 15 GLN CG 1 1 11 7984 1 1 15 GLN H H 1.680 -5.113 -5.424 1.00 . A A . 15 GLN H 1 1 11 7985 1 1 15 GLN HA H 0.396 -7.026 -3.676 1.00 . A A . 15 GLN HA 1 1 11 7986 1 1 15 GLN HB2 H 2.862 -5.381 -3.813 1.00 . A A . 15 GLN HB2 1 1 11 7987 1 1 15 GLN HB3 H 2.313 -5.781 -2.189 1.00 . A A . 15 GLN HB3 1 1 11 7988 1 1 15 GLN HE21 H 3.187 -8.351 -0.956 1.00 . A A . 15 GLN HE21 1 1 11 7989 1 1 15 GLN HE22 H 1.869 -9.412 -0.820 1.00 . A A . 15 GLN HE22 1 1 11 7990 1 1 15 GLN HG2 H 2.844 -7.757 -4.421 1.00 . A A . 15 GLN HG2 1 1 11 7991 1 1 15 GLN HG3 H 3.880 -7.487 -3.020 1.00 . A A . 15 GLN HG3 1 1 11 7992 1 1 15 GLN N N 0.858 -5.511 -5.066 1.00 . A A . 15 GLN N 1 1 11 7993 1 1 15 GLN NE2 N 2.393 -8.771 -1.346 1.00 . A A . 15 GLN NE2 1 1 11 7994 1 1 15 GLN O O -0.677 -5.411 -1.956 1.00 . A A . 15 GLN O 1 1 11 7995 1 1 15 GLN OE1 O 1.050 -9.005 -3.050 1.00 . A A . 15 GLN OE1 1 1 11 7996 1 1 16 LEU C C -2.024 -2.736 -3.134 1.00 . A A . 16 LEU C 1 1 11 7997 1 1 16 LEU CA C -0.621 -2.750 -2.556 1.00 . A A . 16 LEU CA 1 1 11 7998 1 1 16 LEU CB C 0.086 -1.426 -2.811 1.00 . A A . 16 LEU CB 1 1 11 7999 1 1 16 LEU CD1 C 2.188 -0.162 -2.311 1.00 . A A . 16 LEU CD1 1 1 11 8000 1 1 16 LEU CD2 C 1.359 -1.909 -0.726 1.00 . A A . 16 LEU CD2 1 1 11 8001 1 1 16 LEU CG C 1.483 -1.510 -2.198 1.00 . A A . 16 LEU CG 1 1 11 8002 1 1 16 LEU H H 0.694 -3.582 -4.018 1.00 . A A . 16 LEU H 1 1 11 8003 1 1 16 LEU HA H -0.662 -2.948 -1.498 1.00 . A A . 16 LEU HA 1 1 11 8004 1 1 16 LEU HB2 H 0.165 -1.254 -3.875 1.00 . A A . 16 LEU HB2 1 1 11 8005 1 1 16 LEU HB3 H -0.464 -0.627 -2.355 1.00 . A A . 16 LEU HB3 1 1 11 8006 1 1 16 LEU HD11 H 1.630 0.583 -1.766 1.00 . A A . 16 LEU HD11 1 1 11 8007 1 1 16 LEU HD12 H 2.254 0.121 -3.350 1.00 . A A . 16 LEU HD12 1 1 11 8008 1 1 16 LEU HD13 H 3.182 -0.244 -1.896 1.00 . A A . 16 LEU HD13 1 1 11 8009 1 1 16 LEU HD21 H 0.380 -1.641 -0.362 1.00 . A A . 16 LEU HD21 1 1 11 8010 1 1 16 LEU HD22 H 2.114 -1.395 -0.150 1.00 . A A . 16 LEU HD22 1 1 11 8011 1 1 16 LEU HD23 H 1.499 -2.977 -0.632 1.00 . A A . 16 LEU HD23 1 1 11 8012 1 1 16 LEU HG H 2.059 -2.258 -2.723 1.00 . A A . 16 LEU HG 1 1 11 8013 1 1 16 LEU N N 0.134 -3.815 -3.246 1.00 . A A . 16 LEU N 1 1 11 8014 1 1 16 LEU O O -2.970 -2.289 -2.517 1.00 . A A . 16 LEU O 1 1 11 8015 1 1 17 GLU C C -4.321 -4.368 -4.207 1.00 . A A . 17 GLU C 1 1 11 8016 1 1 17 GLU CA C -3.489 -3.326 -4.952 1.00 . A A . 17 GLU CA 1 1 11 8017 1 1 17 GLU CB C -3.314 -3.747 -6.409 1.00 . A A . 17 GLU CB 1 1 11 8018 1 1 17 GLU CD C -4.506 -4.326 -8.522 1.00 . A A . 17 GLU CD 1 1 11 8019 1 1 17 GLU CG C -4.672 -3.764 -7.110 1.00 . A A . 17 GLU CG 1 1 11 8020 1 1 17 GLU H H -1.382 -3.631 -4.784 1.00 . A A . 17 GLU H 1 1 11 8021 1 1 17 GLU HA H -3.967 -2.364 -4.901 1.00 . A A . 17 GLU HA 1 1 11 8022 1 1 17 GLU HB2 H -2.658 -3.047 -6.906 1.00 . A A . 17 GLU HB2 1 1 11 8023 1 1 17 GLU HB3 H -2.877 -4.733 -6.445 1.00 . A A . 17 GLU HB3 1 1 11 8024 1 1 17 GLU HG2 H -5.358 -4.384 -6.551 1.00 . A A . 17 GLU HG2 1 1 11 8025 1 1 17 GLU HG3 H -5.060 -2.758 -7.168 1.00 . A A . 17 GLU HG3 1 1 11 8026 1 1 17 GLU N N -2.160 -3.259 -4.318 1.00 . A A . 17 GLU N 1 1 11 8027 1 1 17 GLU O O -5.536 -4.353 -4.239 1.00 . A A . 17 GLU O 1 1 11 8028 1 1 17 GLU OE1 O -3.541 -3.961 -9.174 1.00 . A A . 17 GLU OE1 1 1 11 8029 1 1 17 GLU OE2 O -5.344 -5.113 -8.928 1.00 . A A . 17 GLU OE2 1 1 11 8030 1 1 18 ASN C C -5.075 -5.722 -1.544 1.00 . A A . 18 ASN C 1 1 11 8031 1 1 18 ASN CA C -4.419 -6.330 -2.786 1.00 . A A . 18 ASN CA 1 1 11 8032 1 1 18 ASN CB C -3.457 -7.440 -2.360 1.00 . A A . 18 ASN CB 1 1 11 8033 1 1 18 ASN CG C -3.166 -8.350 -3.554 1.00 . A A . 18 ASN CG 1 1 11 8034 1 1 18 ASN H H -2.680 -5.273 -3.518 1.00 . A A . 18 ASN H 1 1 11 8035 1 1 18 ASN HA H -5.183 -6.745 -3.427 1.00 . A A . 18 ASN HA 1 1 11 8036 1 1 18 ASN HB2 H -2.535 -7.002 -2.005 1.00 . A A . 18 ASN HB2 1 1 11 8037 1 1 18 ASN HB3 H -3.907 -8.022 -1.569 1.00 . A A . 18 ASN HB3 1 1 11 8038 1 1 18 ASN HD21 H -4.290 -9.837 -2.874 1.00 . A A . 18 ASN HD21 1 1 11 8039 1 1 18 ASN HD22 H -3.528 -10.127 -4.363 1.00 . A A . 18 ASN HD22 1 1 11 8040 1 1 18 ASN N N -3.667 -5.280 -3.531 1.00 . A A . 18 ASN N 1 1 11 8041 1 1 18 ASN ND2 N -3.706 -9.537 -3.601 1.00 . A A . 18 ASN ND2 1 1 11 8042 1 1 18 ASN O O -5.769 -6.395 -0.809 1.00 . A A . 18 ASN O 1 1 11 8043 1 1 18 ASN OD1 O -2.440 -7.977 -4.455 1.00 . A A . 18 ASN OD1 1 1 11 8044 1 1 19 TYR C C -6.649 -2.934 -0.505 1.00 . A A . 19 TYR C 1 1 11 8045 1 1 19 TYR CA C -5.477 -3.828 -0.093 1.00 . A A . 19 TYR CA 1 1 11 8046 1 1 19 TYR CB C -4.431 -2.985 0.636 1.00 . A A . 19 TYR CB 1 1 11 8047 1 1 19 TYR CD1 C -3.626 -4.549 2.444 1.00 . A A . 19 TYR CD1 1 1 11 8048 1 1 19 TYR CD2 C -2.166 -4.085 0.563 1.00 . A A . 19 TYR CD2 1 1 11 8049 1 1 19 TYR CE1 C -2.652 -5.395 2.991 1.00 . A A . 19 TYR CE1 1 1 11 8050 1 1 19 TYR CE2 C -1.192 -4.930 1.108 1.00 . A A . 19 TYR CE2 1 1 11 8051 1 1 19 TYR CG C -3.382 -3.894 1.229 1.00 . A A . 19 TYR CG 1 1 11 8052 1 1 19 TYR CZ C -1.434 -5.586 2.323 1.00 . A A . 19 TYR CZ 1 1 11 8053 1 1 19 TYR H H -4.295 -3.927 -1.896 1.00 . A A . 19 TYR H 1 1 11 8054 1 1 19 TYR HA H -5.834 -4.600 0.570 1.00 . A A . 19 TYR HA 1 1 11 8055 1 1 19 TYR HB2 H -3.966 -2.302 -0.061 1.00 . A A . 19 TYR HB2 1 1 11 8056 1 1 19 TYR HB3 H -4.909 -2.425 1.426 1.00 . A A . 19 TYR HB3 1 1 11 8057 1 1 19 TYR HD1 H -4.564 -4.401 2.959 1.00 . A A . 19 TYR HD1 1 1 11 8058 1 1 19 TYR HD2 H -1.980 -3.580 -0.372 1.00 . A A . 19 TYR HD2 1 1 11 8059 1 1 19 TYR HE1 H -2.839 -5.901 3.926 1.00 . A A . 19 TYR HE1 1 1 11 8060 1 1 19 TYR HE2 H -0.254 -5.077 0.593 1.00 . A A . 19 TYR HE2 1 1 11 8061 1 1 19 TYR HH H -0.186 -6.041 3.692 1.00 . A A . 19 TYR HH 1 1 11 8062 1 1 19 TYR N N -4.861 -4.458 -1.296 1.00 . A A . 19 TYR N 1 1 11 8063 1 1 19 TYR O O -6.979 -1.982 0.174 1.00 . A A . 19 TYR O 1 1 11 8064 1 1 19 TYR OH O -0.476 -6.420 2.860 1.00 . A A . 19 TYR OH 1 1 11 8065 1 1 20 CYS C C -9.751 -3.046 -1.637 1.00 . A A . 20 CYS C 1 1 11 8066 1 1 20 CYS CA C -8.433 -2.378 -2.036 1.00 . A A . 20 CYS CA 1 1 11 8067 1 1 20 CYS CB C -8.387 -2.182 -3.551 1.00 . A A . 20 CYS CB 1 1 11 8068 1 1 20 CYS H H -7.013 -3.997 -2.146 1.00 . A A . 20 CYS H 1 1 11 8069 1 1 20 CYS HA H -8.364 -1.415 -1.550 1.00 . A A . 20 CYS HA 1 1 11 8070 1 1 20 CYS HB2 H -8.648 -3.103 -4.048 1.00 . A A . 20 CYS HB2 1 1 11 8071 1 1 20 CYS HB3 H -9.085 -1.412 -3.832 1.00 . A A . 20 CYS HB3 1 1 11 8072 1 1 20 CYS N N -7.286 -3.226 -1.606 1.00 . A A . 20 CYS N 1 1 11 8073 1 1 20 CYS O O -9.841 -4.253 -1.529 1.00 . A A . 20 CYS O 1 1 11 8074 1 1 20 CYS SG S -6.717 -1.684 -4.031 1.00 . A A . 20 CYS SG 1 1 11 8075 1 1 21 ASN C C -11.867 -3.855 0.122 1.00 . A A . 21 ASN C 1 1 11 8076 1 1 21 ASN CA C -12.085 -2.850 -1.011 1.00 . A A . 21 ASN CA 1 1 11 8077 1 1 21 ASN CB C -12.717 -3.558 -2.211 1.00 . A A . 21 ASN CB 1 1 11 8078 1 1 21 ASN CG C -13.955 -4.334 -1.752 1.00 . A A . 21 ASN CG 1 1 11 8079 1 1 21 ASN H H -10.678 -1.297 -1.499 1.00 . A A . 21 ASN H 1 1 11 8080 1 1 21 ASN HA H -12.740 -2.062 -0.672 1.00 . A A . 21 ASN HA 1 1 11 8081 1 1 21 ASN HB2 H -13.004 -2.825 -2.951 1.00 . A A . 21 ASN HB2 1 1 11 8082 1 1 21 ASN HB3 H -12.003 -4.244 -2.641 1.00 . A A . 21 ASN HB3 1 1 11 8083 1 1 21 ASN HD21 H -15.066 -2.704 -1.524 1.00 . A A . 21 ASN HD21 1 1 11 8084 1 1 21 ASN HD22 H -15.843 -4.169 -1.161 1.00 . A A . 21 ASN HD22 1 1 11 8085 1 1 21 ASN N N -10.774 -2.267 -1.410 1.00 . A A . 21 ASN N 1 1 11 8086 1 1 21 ASN ND2 N -15.045 -3.681 -1.454 1.00 . A A . 21 ASN ND2 1 1 11 8087 1 1 21 ASN O O -11.762 -5.035 -0.169 1.00 . A A . 21 ASN O 1 1 11 8088 1 1 21 ASN OXT O -11.807 -3.426 1.263 1.00 . A A . 21 ASN OXT 1 1 11 8089 1 1 21 ASN OD1 O -13.928 -5.545 -1.663 1.00 . A A . 21 ASN OD1 1 1 11 8090 2 2 1 PHE C C 9.949 -1.877 -10.803 1.00 . B B . 1 PHE C 1 1 11 8091 2 2 1 PHE CA C 9.020 -2.589 -11.787 1.00 . B B . 1 PHE CA 1 1 11 8092 2 2 1 PHE CB C 8.236 -3.676 -11.047 1.00 . B B . 1 PHE CB 1 1 11 8093 2 2 1 PHE CD1 C 6.151 -3.774 -12.459 1.00 . B B . 1 PHE CD1 1 1 11 8094 2 2 1 PHE CD2 C 7.659 -5.676 -12.471 1.00 . B B . 1 PHE CD2 1 1 11 8095 2 2 1 PHE CE1 C 5.306 -4.438 -13.357 1.00 . B B . 1 PHE CE1 1 1 11 8096 2 2 1 PHE CE2 C 6.814 -6.340 -13.369 1.00 . B B . 1 PHE CE2 1 1 11 8097 2 2 1 PHE CG C 7.327 -4.392 -12.016 1.00 . B B . 1 PHE CG 1 1 11 8098 2 2 1 PHE CZ C 5.637 -5.721 -13.813 1.00 . B B . 1 PHE CZ 1 1 11 8099 2 2 1 PHE H1 H 10.256 -4.095 -12.525 1.00 . B B . 1 PHE H1 1 1 11 8100 2 2 1 PHE H2 H 10.582 -2.556 -13.164 1.00 . B B . 1 PHE H2 1 1 11 8101 2 2 1 PHE H3 H 9.218 -3.423 -13.686 1.00 . B B . 1 PHE H3 1 1 11 8102 2 2 1 PHE HA H 8.331 -1.876 -12.215 1.00 . B B . 1 PHE HA 1 1 11 8103 2 2 1 PHE HB2 H 8.927 -4.383 -10.611 1.00 . B B . 1 PHE HB2 1 1 11 8104 2 2 1 PHE HB3 H 7.644 -3.224 -10.265 1.00 . B B . 1 PHE HB3 1 1 11 8105 2 2 1 PHE HD1 H 5.896 -2.785 -12.108 1.00 . B B . 1 PHE HD1 1 1 11 8106 2 2 1 PHE HD2 H 8.566 -6.152 -12.129 1.00 . B B . 1 PHE HD2 1 1 11 8107 2 2 1 PHE HE1 H 4.399 -3.961 -13.699 1.00 . B B . 1 PHE HE1 1 1 11 8108 2 2 1 PHE HE2 H 7.070 -7.329 -13.720 1.00 . B B . 1 PHE HE2 1 1 11 8109 2 2 1 PHE HZ H 4.986 -6.233 -14.505 1.00 . B B . 1 PHE HZ 1 1 11 8110 2 2 1 PHE N N 9.830 -3.213 -12.873 1.00 . B B . 1 PHE N 1 1 11 8111 2 2 1 PHE O O 11.123 -1.703 -11.058 1.00 . B B . 1 PHE O 1 1 11 8112 2 2 2 VAL C C 10.557 -1.726 -7.505 1.00 . B B . 2 VAL C 1 1 11 8113 2 2 2 VAL CA C 10.282 -0.776 -8.672 1.00 . B B . 2 VAL CA 1 1 11 8114 2 2 2 VAL CB C 9.556 0.469 -8.159 1.00 . B B . 2 VAL CB 1 1 11 8115 2 2 2 VAL CG1 C 9.684 1.595 -9.187 1.00 . B B . 2 VAL CG1 1 1 11 8116 2 2 2 VAL CG2 C 8.076 0.143 -7.942 1.00 . B B . 2 VAL CG2 1 1 11 8117 2 2 2 VAL H H 8.483 -1.627 -9.488 1.00 . B B . 2 VAL H 1 1 11 8118 2 2 2 VAL HA H 11.217 -0.486 -9.129 1.00 . B B . 2 VAL HA 1 1 11 8119 2 2 2 VAL HB H 9.998 0.784 -7.225 1.00 . B B . 2 VAL HB 1 1 11 8120 2 2 2 VAL HG11 H 9.737 2.545 -8.676 1.00 . B B . 2 VAL HG11 1 1 11 8121 2 2 2 VAL HG12 H 8.824 1.585 -9.841 1.00 . B B . 2 VAL HG12 1 1 11 8122 2 2 2 VAL HG13 H 10.582 1.449 -9.770 1.00 . B B . 2 VAL HG13 1 1 11 8123 2 2 2 VAL HG21 H 7.509 0.452 -8.808 1.00 . B B . 2 VAL HG21 1 1 11 8124 2 2 2 VAL HG22 H 7.716 0.667 -7.069 1.00 . B B . 2 VAL HG22 1 1 11 8125 2 2 2 VAL HG23 H 7.960 -0.921 -7.797 1.00 . B B . 2 VAL HG23 1 1 11 8126 2 2 2 VAL N N 9.431 -1.471 -9.676 1.00 . B B . 2 VAL N 1 1 11 8127 2 2 2 VAL O O 10.140 -2.867 -7.512 1.00 . B B . 2 VAL O 1 1 11 8128 2 2 3 ASN C C 11.935 -1.300 -4.138 1.00 . B B . 3 ASN C 1 1 11 8129 2 2 3 ASN CA C 11.554 -2.154 -5.345 1.00 . B B . 3 ASN CA 1 1 11 8130 2 2 3 ASN CB C 12.717 -3.073 -5.701 1.00 . B B . 3 ASN CB 1 1 11 8131 2 2 3 ASN CG C 12.226 -4.521 -5.773 1.00 . B B . 3 ASN CG 1 1 11 8132 2 2 3 ASN H H 11.586 -0.346 -6.516 1.00 . B B . 3 ASN H 1 1 11 8133 2 2 3 ASN HA H 10.683 -2.746 -5.111 1.00 . B B . 3 ASN HA 1 1 11 8134 2 2 3 ASN HB2 H 13.116 -2.778 -6.656 1.00 . B B . 3 ASN HB2 1 1 11 8135 2 2 3 ASN HB3 H 13.486 -2.992 -4.947 1.00 . B B . 3 ASN HB3 1 1 11 8136 2 2 3 ASN HD21 H 10.936 -4.162 -7.239 1.00 . B B . 3 ASN HD21 1 1 11 8137 2 2 3 ASN HD22 H 10.986 -5.768 -6.693 1.00 . B B . 3 ASN HD22 1 1 11 8138 2 2 3 ASN N N 11.256 -1.269 -6.504 1.00 . B B . 3 ASN N 1 1 11 8139 2 2 3 ASN ND2 N 11.306 -4.844 -6.641 1.00 . B B . 3 ASN ND2 1 1 11 8140 2 2 3 ASN O O 13.011 -1.426 -3.586 1.00 . B B . 3 ASN O 1 1 11 8141 2 2 3 ASN OD1 O 12.685 -5.367 -5.032 1.00 . B B . 3 ASN OD1 1 1 11 8142 2 2 4 GLN C C 10.316 0.273 -1.479 1.00 . B B . 4 GLN C 1 1 11 8143 2 2 4 GLN CA C 11.372 0.453 -2.574 1.00 . B B . 4 GLN CA 1 1 11 8144 2 2 4 GLN CB C 11.375 1.910 -3.037 1.00 . B B . 4 GLN CB 1 1 11 8145 2 2 4 GLN CD C 12.512 4.062 -2.495 1.00 . B B . 4 GLN CD 1 1 11 8146 2 2 4 GLN CG C 11.887 2.797 -1.907 1.00 . B B . 4 GLN CG 1 1 11 8147 2 2 4 GLN H H 10.213 -0.334 -4.201 1.00 . B B . 4 GLN H 1 1 11 8148 2 2 4 GLN HA H 12.344 0.200 -2.179 1.00 . B B . 4 GLN HA 1 1 11 8149 2 2 4 GLN HB2 H 12.018 2.014 -3.899 1.00 . B B . 4 GLN HB2 1 1 11 8150 2 2 4 GLN HB3 H 10.370 2.207 -3.298 1.00 . B B . 4 GLN HB3 1 1 11 8151 2 2 4 GLN HE21 H 10.764 4.861 -2.991 1.00 . B B . 4 GLN HE21 1 1 11 8152 2 2 4 GLN HE22 H 12.126 5.798 -3.377 1.00 . B B . 4 GLN HE22 1 1 11 8153 2 2 4 GLN HG2 H 11.063 3.066 -1.262 1.00 . B B . 4 GLN HG2 1 1 11 8154 2 2 4 GLN HG3 H 12.630 2.260 -1.339 1.00 . B B . 4 GLN HG3 1 1 11 8155 2 2 4 GLN N N 11.065 -0.423 -3.734 1.00 . B B . 4 GLN N 1 1 11 8156 2 2 4 GLN NE2 N 11.736 4.984 -2.995 1.00 . B B . 4 GLN NE2 1 1 11 8157 2 2 4 GLN O O 9.285 -0.347 -1.679 1.00 . B B . 4 GLN O 1 1 11 8158 2 2 4 GLN OE1 O 13.717 4.213 -2.500 1.00 . B B . 4 GLN OE1 1 1 11 8159 2 2 5 HIS C C 8.545 1.799 0.667 1.00 . B B . 5 HIS C 1 1 11 8160 2 2 5 HIS CA C 9.596 0.693 0.800 1.00 . B B . 5 HIS CA 1 1 11 8161 2 2 5 HIS CB C 10.319 0.831 2.149 1.00 . B B . 5 HIS CB 1 1 11 8162 2 2 5 HIS CD2 C 12.425 -0.377 1.160 1.00 . B B . 5 HIS CD2 1 1 11 8163 2 2 5 HIS CE1 C 13.919 0.566 2.424 1.00 . B B . 5 HIS CE1 1 1 11 8164 2 2 5 HIS CG C 11.780 0.489 2.001 1.00 . B B . 5 HIS CG 1 1 11 8165 2 2 5 HIS H H 11.407 1.309 -0.182 1.00 . B B . 5 HIS H 1 1 11 8166 2 2 5 HIS HA H 9.111 -0.271 0.749 1.00 . B B . 5 HIS HA 1 1 11 8167 2 2 5 HIS HB2 H 10.225 1.846 2.503 1.00 . B B . 5 HIS HB2 1 1 11 8168 2 2 5 HIS HB3 H 9.868 0.160 2.865 1.00 . B B . 5 HIS HB3 1 1 11 8169 2 2 5 HIS HD2 H 11.953 -0.995 0.410 1.00 . B B . 5 HIS HD2 1 1 11 8170 2 2 5 HIS HE1 H 14.865 0.834 2.870 1.00 . B B . 5 HIS HE1 1 1 11 8171 2 2 5 HIS HE2 H 14.487 -0.839 0.981 1.00 . B B . 5 HIS HE2 1 1 11 8172 2 2 5 HIS N N 10.571 0.817 -0.318 1.00 . B B . 5 HIS N 1 1 11 8173 2 2 5 HIS ND1 N 12.739 1.080 2.796 1.00 . B B . 5 HIS ND1 1 1 11 8174 2 2 5 HIS NE2 N 13.778 -0.330 1.426 1.00 . B B . 5 HIS NE2 1 1 11 8175 2 2 5 HIS O O 8.603 2.616 -0.230 1.00 . B B . 5 HIS O 1 1 11 8176 2 2 6 LEU C C 6.183 3.396 2.848 1.00 . B B . 6 LEU C 1 1 11 8177 2 2 6 LEU CA C 6.517 2.869 1.452 1.00 . B B . 6 LEU CA 1 1 11 8178 2 2 6 LEU CB C 5.251 2.231 0.856 1.00 . B B . 6 LEU CB 1 1 11 8179 2 2 6 LEU CD1 C 5.892 3.639 -1.158 1.00 . B B . 6 LEU CD1 1 1 11 8180 2 2 6 LEU CD2 C 4.097 1.930 -1.343 1.00 . B B . 6 LEU CD2 1 1 11 8181 2 2 6 LEU CG C 4.742 2.958 -0.413 1.00 . B B . 6 LEU CG 1 1 11 8182 2 2 6 LEU H H 7.544 1.150 2.245 1.00 . B B . 6 LEU H 1 1 11 8183 2 2 6 LEU HA H 6.866 3.678 0.840 1.00 . B B . 6 LEU HA 1 1 11 8184 2 2 6 LEU HB2 H 5.475 1.209 0.610 1.00 . B B . 6 LEU HB2 1 1 11 8185 2 2 6 LEU HB3 H 4.471 2.244 1.604 1.00 . B B . 6 LEU HB3 1 1 11 8186 2 2 6 LEU HD11 H 6.759 2.997 -1.143 1.00 . B B . 6 LEU HD11 1 1 11 8187 2 2 6 LEU HD12 H 6.127 4.576 -0.676 1.00 . B B . 6 LEU HD12 1 1 11 8188 2 2 6 LEU HD13 H 5.598 3.823 -2.181 1.00 . B B . 6 LEU HD13 1 1 11 8189 2 2 6 LEU HD21 H 4.857 1.479 -1.963 1.00 . B B . 6 LEU HD21 1 1 11 8190 2 2 6 LEU HD22 H 3.367 2.421 -1.969 1.00 . B B . 6 LEU HD22 1 1 11 8191 2 2 6 LEU HD23 H 3.612 1.167 -0.753 1.00 . B B . 6 LEU HD23 1 1 11 8192 2 2 6 LEU HG H 3.995 3.697 -0.140 1.00 . B B . 6 LEU HG 1 1 11 8193 2 2 6 LEU N N 7.579 1.824 1.541 1.00 . B B . 6 LEU N 1 1 11 8194 2 2 6 LEU O O 6.587 2.844 3.848 1.00 . B B . 6 LEU O 1 1 11 8195 2 2 7 CYS C C 4.528 6.452 4.049 1.00 . B B . 7 CYS C 1 1 11 8196 2 2 7 CYS CA C 5.044 5.024 4.235 1.00 . B B . 7 CYS CA 1 1 11 8197 2 2 7 CYS CB C 6.257 5.032 5.168 1.00 . B B . 7 CYS CB 1 1 11 8198 2 2 7 CYS H H 5.105 4.879 2.090 1.00 . B B . 7 CYS H 1 1 11 8199 2 2 7 CYS HA H 4.264 4.416 4.669 1.00 . B B . 7 CYS HA 1 1 11 8200 2 2 7 CYS HB2 H 7.125 4.670 4.639 1.00 . B B . 7 CYS HB2 1 1 11 8201 2 2 7 CYS HB3 H 6.441 6.036 5.509 1.00 . B B . 7 CYS HB3 1 1 11 8202 2 2 7 CYS N N 5.428 4.458 2.914 1.00 . B B . 7 CYS N 1 1 11 8203 2 2 7 CYS O O 5.018 7.202 3.226 1.00 . B B . 7 CYS O 1 1 11 8204 2 2 7 CYS SG S 5.922 3.966 6.594 1.00 . B B . 7 CYS SG 1 1 11 8205 2 2 8 GLY C C 2.232 8.348 3.355 1.00 . B B . 8 GLY C 1 1 11 8206 2 2 8 GLY CA C 2.988 8.214 4.678 1.00 . B B . 8 GLY CA 1 1 11 8207 2 2 8 GLY H H 3.155 6.215 5.463 1.00 . B B . 8 GLY H 1 1 11 8208 2 2 8 GLY HA2 H 2.315 8.410 5.500 1.00 . B B . 8 GLY HA2 1 1 11 8209 2 2 8 GLY HA3 H 3.798 8.927 4.699 1.00 . B B . 8 GLY HA3 1 1 11 8210 2 2 8 GLY N N 3.538 6.835 4.807 1.00 . B B . 8 GLY N 1 1 11 8211 2 2 8 GLY O O 1.619 7.413 2.879 1.00 . B B . 8 GLY O 1 1 11 8212 2 2 9 SER C C 2.058 8.713 0.433 1.00 . B B . 9 SER C 1 1 11 8213 2 2 9 SER CA C 1.545 9.709 1.471 1.00 . B B . 9 SER CA 1 1 11 8214 2 2 9 SER CB C 1.777 11.135 0.969 1.00 . B B . 9 SER CB 1 1 11 8215 2 2 9 SER H H 2.763 10.252 3.163 1.00 . B B . 9 SER H 1 1 11 8216 2 2 9 SER HA H 0.491 9.551 1.624 1.00 . B B . 9 SER HA 1 1 11 8217 2 2 9 SER HB2 H 2.071 11.110 -0.067 1.00 . B B . 9 SER HB2 1 1 11 8218 2 2 9 SER HB3 H 0.861 11.703 1.067 1.00 . B B . 9 SER HB3 1 1 11 8219 2 2 9 SER HG H 3.153 12.484 1.231 1.00 . B B . 9 SER HG 1 1 11 8220 2 2 9 SER N N 2.266 9.510 2.760 1.00 . B B . 9 SER N 1 1 11 8221 2 2 9 SER O O 1.364 8.360 -0.499 1.00 . B B . 9 SER O 1 1 11 8222 2 2 9 SER OG O 2.810 11.741 1.734 1.00 . B B . 9 SER OG 1 1 11 8223 2 2 10 ASP C C 2.980 5.998 -0.347 1.00 . B B . 10 ASP C 1 1 11 8224 2 2 10 ASP CA C 3.818 7.276 -0.391 1.00 . B B . 10 ASP CA 1 1 11 8225 2 2 10 ASP CB C 5.268 6.952 -0.028 1.00 . B B . 10 ASP CB 1 1 11 8226 2 2 10 ASP CG C 6.023 8.252 0.255 1.00 . B B . 10 ASP CG 1 1 11 8227 2 2 10 ASP H H 3.808 8.548 1.349 1.00 . B B . 10 ASP H 1 1 11 8228 2 2 10 ASP HA H 3.779 7.698 -1.384 1.00 . B B . 10 ASP HA 1 1 11 8229 2 2 10 ASP HB2 H 5.286 6.325 0.852 1.00 . B B . 10 ASP HB2 1 1 11 8230 2 2 10 ASP HB3 H 5.740 6.433 -0.849 1.00 . B B . 10 ASP HB3 1 1 11 8231 2 2 10 ASP N N 3.266 8.253 0.588 1.00 . B B . 10 ASP N 1 1 11 8232 2 2 10 ASP O O 2.782 5.334 -1.347 1.00 . B B . 10 ASP O 1 1 11 8233 2 2 10 ASP OD1 O 5.961 8.716 1.382 1.00 . B B . 10 ASP OD1 1 1 11 8234 2 2 10 ASP OD2 O 6.648 8.763 -0.660 1.00 . B B . 10 ASP OD2 1 1 11 8235 2 2 11 LEU C C 0.250 4.699 0.406 1.00 . B B . 11 LEU C 1 1 11 8236 2 2 11 LEU CA C 1.662 4.417 0.913 1.00 . B B . 11 LEU CA 1 1 11 8237 2 2 11 LEU CB C 1.612 3.966 2.374 1.00 . B B . 11 LEU CB 1 1 11 8238 2 2 11 LEU CD1 C 1.610 1.664 1.363 1.00 . B B . 11 LEU CD1 1 1 11 8239 2 2 11 LEU CD2 C 1.405 1.954 3.829 1.00 . B B . 11 LEU CD2 1 1 11 8240 2 2 11 LEU CG C 1.034 2.549 2.472 1.00 . B B . 11 LEU CG 1 1 11 8241 2 2 11 LEU H H 2.653 6.198 1.599 1.00 . B B . 11 LEU H 1 1 11 8242 2 2 11 LEU HA H 2.106 3.642 0.312 1.00 . B B . 11 LEU HA 1 1 11 8243 2 2 11 LEU HB2 H 2.611 3.975 2.786 1.00 . B B . 11 LEU HB2 1 1 11 8244 2 2 11 LEU HB3 H 0.987 4.644 2.937 1.00 . B B . 11 LEU HB3 1 1 11 8245 2 2 11 LEU HD11 H 0.997 1.752 0.478 1.00 . B B . 11 LEU HD11 1 1 11 8246 2 2 11 LEU HD12 H 1.622 0.635 1.692 1.00 . B B . 11 LEU HD12 1 1 11 8247 2 2 11 LEU HD13 H 2.617 1.981 1.135 1.00 . B B . 11 LEU HD13 1 1 11 8248 2 2 11 LEU HD21 H 0.631 2.184 4.545 1.00 . B B . 11 LEU HD21 1 1 11 8249 2 2 11 LEU HD22 H 2.341 2.378 4.162 1.00 . B B . 11 LEU HD22 1 1 11 8250 2 2 11 LEU HD23 H 1.507 0.883 3.737 1.00 . B B . 11 LEU HD23 1 1 11 8251 2 2 11 LEU HG H -0.041 2.591 2.378 1.00 . B B . 11 LEU HG 1 1 11 8252 2 2 11 LEU N N 2.484 5.650 0.805 1.00 . B B . 11 LEU N 1 1 11 8253 2 2 11 LEU O O -0.391 3.844 -0.169 1.00 . B B . 11 LEU O 1 1 11 8254 2 2 12 VAL C C -1.534 6.532 -1.382 1.00 . B B . 12 VAL C 1 1 11 8255 2 2 12 VAL CA C -1.614 6.199 0.108 1.00 . B B . 12 VAL CA 1 1 11 8256 2 2 12 VAL CB C -2.208 7.377 0.903 1.00 . B B . 12 VAL CB 1 1 11 8257 2 2 12 VAL CG1 C -1.588 7.407 2.296 1.00 . B B . 12 VAL CG1 1 1 11 8258 2 2 12 VAL CG2 C -1.921 8.712 0.204 1.00 . B B . 12 VAL CG2 1 1 11 8259 2 2 12 VAL H H 0.285 6.575 1.059 1.00 . B B . 12 VAL H 1 1 11 8260 2 2 12 VAL HA H -2.240 5.328 0.240 1.00 . B B . 12 VAL HA 1 1 11 8261 2 2 12 VAL HB H -3.277 7.241 0.993 1.00 . B B . 12 VAL HB 1 1 11 8262 2 2 12 VAL HG11 H -1.361 6.399 2.607 1.00 . B B . 12 VAL HG11 1 1 11 8263 2 2 12 VAL HG12 H -2.283 7.854 2.990 1.00 . B B . 12 VAL HG12 1 1 11 8264 2 2 12 VAL HG13 H -0.678 7.988 2.269 1.00 . B B . 12 VAL HG13 1 1 11 8265 2 2 12 VAL HG21 H -0.866 8.784 -0.014 1.00 . B B . 12 VAL HG21 1 1 11 8266 2 2 12 VAL HG22 H -2.212 9.526 0.851 1.00 . B B . 12 VAL HG22 1 1 11 8267 2 2 12 VAL HG23 H -2.484 8.764 -0.716 1.00 . B B . 12 VAL HG23 1 1 11 8268 2 2 12 VAL N N -0.244 5.889 0.601 1.00 . B B . 12 VAL N 1 1 11 8269 2 2 12 VAL O O -2.373 6.137 -2.162 1.00 . B B . 12 VAL O 1 1 11 8270 2 2 13 GLU C C -0.353 6.303 -4.040 1.00 . B B . 13 GLU C 1 1 11 8271 2 2 13 GLU CA C -0.385 7.596 -3.223 1.00 . B B . 13 GLU CA 1 1 11 8272 2 2 13 GLU CB C 0.906 8.393 -3.433 1.00 . B B . 13 GLU CB 1 1 11 8273 2 2 13 GLU CD C 3.382 8.242 -3.734 1.00 . B B . 13 GLU CD 1 1 11 8274 2 2 13 GLU CG C 2.112 7.453 -3.410 1.00 . B B . 13 GLU CG 1 1 11 8275 2 2 13 GLU H H 0.151 7.554 -1.140 1.00 . B B . 13 GLU H 1 1 11 8276 2 2 13 GLU HA H -1.231 8.192 -3.530 1.00 . B B . 13 GLU HA 1 1 11 8277 2 2 13 GLU HB2 H 0.862 8.900 -4.384 1.00 . B B . 13 GLU HB2 1 1 11 8278 2 2 13 GLU HB3 H 1.006 9.122 -2.641 1.00 . B B . 13 GLU HB3 1 1 11 8279 2 2 13 GLU HG2 H 2.204 7.014 -2.429 1.00 . B B . 13 GLU HG2 1 1 11 8280 2 2 13 GLU HG3 H 1.977 6.673 -4.144 1.00 . B B . 13 GLU HG3 1 1 11 8281 2 2 13 GLU N N -0.521 7.250 -1.784 1.00 . B B . 13 GLU N 1 1 11 8282 2 2 13 GLU O O -0.854 6.241 -5.147 1.00 . B B . 13 GLU O 1 1 11 8283 2 2 13 GLU OE1 O 3.725 9.120 -2.960 1.00 . B B . 13 GLU OE1 1 1 11 8284 2 2 13 GLU OE2 O 3.992 7.955 -4.752 1.00 . B B . 13 GLU OE2 1 1 11 8285 2 2 14 ALA C C -1.128 3.310 -4.066 1.00 . B B . 14 ALA C 1 1 11 8286 2 2 14 ALA CA C 0.239 3.966 -4.220 1.00 . B B . 14 ALA CA 1 1 11 8287 2 2 14 ALA CB C 1.323 3.063 -3.626 1.00 . B B . 14 ALA CB 1 1 11 8288 2 2 14 ALA H H 0.577 5.317 -2.586 1.00 . B B . 14 ALA H 1 1 11 8289 2 2 14 ALA HA H 0.442 4.143 -5.266 1.00 . B B . 14 ALA HA 1 1 11 8290 2 2 14 ALA HB1 H 1.509 2.235 -4.294 1.00 . B B . 14 ALA HB1 1 1 11 8291 2 2 14 ALA HB2 H 0.994 2.687 -2.668 1.00 . B B . 14 ALA HB2 1 1 11 8292 2 2 14 ALA HB3 H 2.233 3.631 -3.495 1.00 . B B . 14 ALA HB3 1 1 11 8293 2 2 14 ALA N N 0.205 5.258 -3.489 1.00 . B B . 14 ALA N 1 1 11 8294 2 2 14 ALA O O -1.718 2.839 -5.018 1.00 . B B . 14 ALA O 1 1 11 8295 2 2 15 LEU C C -4.017 3.494 -3.438 1.00 . B B . 15 LEU C 1 1 11 8296 2 2 15 LEU CA C -2.981 2.700 -2.645 1.00 . B B . 15 LEU CA 1 1 11 8297 2 2 15 LEU CB C -3.299 2.767 -1.154 1.00 . B B . 15 LEU CB 1 1 11 8298 2 2 15 LEU CD1 C -3.003 1.549 1.007 1.00 . B B . 15 LEU CD1 1 1 11 8299 2 2 15 LEU CD2 C -2.484 0.358 -1.129 1.00 . B B . 15 LEU CD2 1 1 11 8300 2 2 15 LEU CG C -2.457 1.718 -0.404 1.00 . B B . 15 LEU CG 1 1 11 8301 2 2 15 LEU H H -1.160 3.695 -2.115 1.00 . B B . 15 LEU H 1 1 11 8302 2 2 15 LEU HA H -2.976 1.677 -2.974 1.00 . B B . 15 LEU HA 1 1 11 8303 2 2 15 LEU HB2 H -3.045 3.754 -0.788 1.00 . B B . 15 LEU HB2 1 1 11 8304 2 2 15 LEU HB3 H -4.355 2.592 -0.991 1.00 . B B . 15 LEU HB3 1 1 11 8305 2 2 15 LEU HD11 H -3.037 0.500 1.255 1.00 . B B . 15 LEU HD11 1 1 11 8306 2 2 15 LEU HD12 H -3.997 1.967 1.059 1.00 . B B . 15 LEU HD12 1 1 11 8307 2 2 15 LEU HD13 H -2.358 2.065 1.703 1.00 . B B . 15 LEU HD13 1 1 11 8308 2 2 15 LEU HD21 H -2.007 -0.391 -0.508 1.00 . B B . 15 LEU HD21 1 1 11 8309 2 2 15 LEU HD22 H -1.947 0.432 -2.065 1.00 . B B . 15 LEU HD22 1 1 11 8310 2 2 15 LEU HD23 H -3.503 0.064 -1.323 1.00 . B B . 15 LEU HD23 1 1 11 8311 2 2 15 LEU HG H -1.437 2.067 -0.344 1.00 . B B . 15 LEU HG 1 1 11 8312 2 2 15 LEU N N -1.646 3.298 -2.869 1.00 . B B . 15 LEU N 1 1 11 8313 2 2 15 LEU O O -4.810 2.942 -4.175 1.00 . B B . 15 LEU O 1 1 11 8314 2 2 16 TYR C C -4.906 5.249 -5.544 1.00 . B B . 16 TYR C 1 1 11 8315 2 2 16 TYR CA C -4.987 5.618 -4.062 1.00 . B B . 16 TYR CA 1 1 11 8316 2 2 16 TYR CB C -4.646 7.101 -3.898 1.00 . B B . 16 TYR CB 1 1 11 8317 2 2 16 TYR CD1 C -7.028 7.898 -3.694 1.00 . B B . 16 TYR CD1 1 1 11 8318 2 2 16 TYR CD2 C -5.491 8.336 -1.867 1.00 . B B . 16 TYR CD2 1 1 11 8319 2 2 16 TYR CE1 C -8.053 8.543 -2.988 1.00 . B B . 16 TYR CE1 1 1 11 8320 2 2 16 TYR CE2 C -6.516 8.982 -1.161 1.00 . B B . 16 TYR CE2 1 1 11 8321 2 2 16 TYR CG C -5.748 7.794 -3.133 1.00 . B B . 16 TYR CG 1 1 11 8322 2 2 16 TYR CZ C -7.797 9.085 -1.721 1.00 . B B . 16 TYR CZ 1 1 11 8323 2 2 16 TYR H H -3.357 5.223 -2.708 1.00 . B B . 16 TYR H 1 1 11 8324 2 2 16 TYR HA H -5.985 5.432 -3.694 1.00 . B B . 16 TYR HA 1 1 11 8325 2 2 16 TYR HB2 H -3.715 7.201 -3.361 1.00 . B B . 16 TYR HB2 1 1 11 8326 2 2 16 TYR HB3 H -4.547 7.555 -4.872 1.00 . B B . 16 TYR HB3 1 1 11 8327 2 2 16 TYR HD1 H -7.225 7.480 -4.669 1.00 . B B . 16 TYR HD1 1 1 11 8328 2 2 16 TYR HD2 H -4.504 8.256 -1.435 1.00 . B B . 16 TYR HD2 1 1 11 8329 2 2 16 TYR HE1 H -9.039 8.622 -3.420 1.00 . B B . 16 TYR HE1 1 1 11 8330 2 2 16 TYR HE2 H -6.318 9.399 -0.185 1.00 . B B . 16 TYR HE2 1 1 11 8331 2 2 16 TYR HH H -9.270 10.299 -1.638 1.00 . B B . 16 TYR HH 1 1 11 8332 2 2 16 TYR N N -4.011 4.792 -3.303 1.00 . B B . 16 TYR N 1 1 11 8333 2 2 16 TYR O O -5.872 5.351 -6.275 1.00 . B B . 16 TYR O 1 1 11 8334 2 2 16 TYR OH O -8.807 9.720 -1.027 1.00 . B B . 16 TYR OH 1 1 11 8335 2 2 17 LEU C C -3.989 2.998 -7.630 1.00 . B B . 17 LEU C 1 1 11 8336 2 2 17 LEU CA C -3.603 4.463 -7.432 1.00 . B B . 17 LEU CA 1 1 11 8337 2 2 17 LEU CB C -2.140 4.661 -7.852 1.00 . B B . 17 LEU CB 1 1 11 8338 2 2 17 LEU CD1 C -3.253 4.937 -10.113 1.00 . B B . 17 LEU CD1 1 1 11 8339 2 2 17 LEU CD2 C -1.954 6.821 -9.102 1.00 . B B . 17 LEU CD2 1 1 11 8340 2 2 17 LEU CG C -2.038 5.299 -9.250 1.00 . B B . 17 LEU CG 1 1 11 8341 2 2 17 LEU H H -2.986 4.760 -5.389 1.00 . B B . 17 LEU H 1 1 11 8342 2 2 17 LEU HA H -4.241 5.086 -8.028 1.00 . B B . 17 LEU HA 1 1 11 8343 2 2 17 LEU HB2 H -1.651 5.303 -7.135 1.00 . B B . 17 LEU HB2 1 1 11 8344 2 2 17 LEU HB3 H -1.643 3.702 -7.864 1.00 . B B . 17 LEU HB3 1 1 11 8345 2 2 17 LEU HD11 H -3.617 3.961 -9.832 1.00 . B B . 17 LEU HD11 1 1 11 8346 2 2 17 LEU HD12 H -2.966 4.928 -11.154 1.00 . B B . 17 LEU HD12 1 1 11 8347 2 2 17 LEU HD13 H -4.032 5.670 -9.962 1.00 . B B . 17 LEU HD13 1 1 11 8348 2 2 17 LEU HD21 H -2.109 7.286 -10.065 1.00 . B B . 17 LEU HD21 1 1 11 8349 2 2 17 LEU HD22 H -0.979 7.093 -8.724 1.00 . B B . 17 LEU HD22 1 1 11 8350 2 2 17 LEU HD23 H -2.714 7.159 -8.414 1.00 . B B . 17 LEU HD23 1 1 11 8351 2 2 17 LEU HG H -1.141 4.941 -9.735 1.00 . B B . 17 LEU HG 1 1 11 8352 2 2 17 LEU N N -3.754 4.829 -5.995 1.00 . B B . 17 LEU N 1 1 11 8353 2 2 17 LEU O O -4.669 2.643 -8.572 1.00 . B B . 17 LEU O 1 1 11 8354 2 2 18 VAL C C -5.368 0.477 -6.605 1.00 . B B . 18 VAL C 1 1 11 8355 2 2 18 VAL CA C -3.880 0.697 -6.879 1.00 . B B . 18 VAL CA 1 1 11 8356 2 2 18 VAL CB C -3.046 -0.114 -5.879 1.00 . B B . 18 VAL CB 1 1 11 8357 2 2 18 VAL CG1 C -1.616 0.414 -5.864 1.00 . B B . 18 VAL CG1 1 1 11 8358 2 2 18 VAL CG2 C -3.638 0.017 -4.474 1.00 . B B . 18 VAL CG2 1 1 11 8359 2 2 18 VAL H H -3.004 2.462 -6.004 1.00 . B B . 18 VAL H 1 1 11 8360 2 2 18 VAL HA H -3.651 0.368 -7.879 1.00 . B B . 18 VAL HA 1 1 11 8361 2 2 18 VAL HB H -3.042 -1.154 -6.174 1.00 . B B . 18 VAL HB 1 1 11 8362 2 2 18 VAL HG11 H -1.531 1.237 -6.557 1.00 . B B . 18 VAL HG11 1 1 11 8363 2 2 18 VAL HG12 H -0.939 -0.373 -6.155 1.00 . B B . 18 VAL HG12 1 1 11 8364 2 2 18 VAL HG13 H -1.370 0.753 -4.869 1.00 . B B . 18 VAL HG13 1 1 11 8365 2 2 18 VAL HG21 H -2.866 -0.161 -3.741 1.00 . B B . 18 VAL HG21 1 1 11 8366 2 2 18 VAL HG22 H -4.429 -0.704 -4.346 1.00 . B B . 18 VAL HG22 1 1 11 8367 2 2 18 VAL HG23 H -4.035 1.011 -4.346 1.00 . B B . 18 VAL HG23 1 1 11 8368 2 2 18 VAL N N -3.552 2.146 -6.749 1.00 . B B . 18 VAL N 1 1 11 8369 2 2 18 VAL O O -5.990 -0.401 -7.170 1.00 . B B . 18 VAL O 1 1 11 8370 2 2 19 CYS C C -8.217 2.147 -6.128 1.00 . B B . 19 CYS C 1 1 11 8371 2 2 19 CYS CA C -7.384 1.079 -5.416 1.00 . B B . 19 CYS CA 1 1 11 8372 2 2 19 CYS CB C -7.583 1.201 -3.907 1.00 . B B . 19 CYS CB 1 1 11 8373 2 2 19 CYS H H -5.421 1.952 -5.280 1.00 . B B . 19 CYS H 1 1 11 8374 2 2 19 CYS HA H -7.702 0.100 -5.740 1.00 . B B . 19 CYS HA 1 1 11 8375 2 2 19 CYS HB2 H -7.379 2.215 -3.597 1.00 . B B . 19 CYS HB2 1 1 11 8376 2 2 19 CYS HB3 H -8.600 0.944 -3.654 1.00 . B B . 19 CYS HB3 1 1 11 8377 2 2 19 CYS N N -5.941 1.257 -5.733 1.00 . B B . 19 CYS N 1 1 11 8378 2 2 19 CYS O O -9.290 1.877 -6.629 1.00 . B B . 19 CYS O 1 1 11 8379 2 2 19 CYS SG S -6.446 0.070 -3.069 1.00 . B B . 19 CYS SG 1 1 11 8380 2 2 20 GLY C C -9.955 4.417 -6.333 1.00 . B B . 20 GLY C 1 1 11 8381 2 2 20 GLY CA C -8.514 4.435 -6.846 1.00 . B B . 20 GLY CA 1 1 11 8382 2 2 20 GLY H H -6.874 3.560 -5.758 1.00 . B B . 20 GLY H 1 1 11 8383 2 2 20 GLY HA2 H -8.064 5.394 -6.629 1.00 . B B . 20 GLY HA2 1 1 11 8384 2 2 20 GLY HA3 H -8.514 4.268 -7.912 1.00 . B B . 20 GLY HA3 1 1 11 8385 2 2 20 GLY N N -7.738 3.358 -6.171 1.00 . B B . 20 GLY N 1 1 11 8386 2 2 20 GLY O O -10.215 4.675 -5.174 1.00 . B B . 20 GLY O 1 1 11 8387 2 2 21 GLU C C -12.558 2.826 -5.895 1.00 . B B . 21 GLU C 1 1 11 8388 2 2 21 GLU CA C -12.319 4.077 -6.743 1.00 . B B . 21 GLU CA 1 1 11 8389 2 2 21 GLU CB C -13.237 4.049 -7.968 1.00 . B B . 21 GLU CB 1 1 11 8390 2 2 21 GLU CD C -15.574 4.762 -8.508 1.00 . B B . 21 GLU CD 1 1 11 8391 2 2 21 GLU CG C -14.250 5.192 -7.873 1.00 . B B . 21 GLU CG 1 1 11 8392 2 2 21 GLU H H -10.667 3.907 -8.115 1.00 . B B . 21 GLU H 1 1 11 8393 2 2 21 GLU HA H -12.534 4.956 -6.154 1.00 . B B . 21 GLU HA 1 1 11 8394 2 2 21 GLU HB2 H -12.645 4.165 -8.864 1.00 . B B . 21 GLU HB2 1 1 11 8395 2 2 21 GLU HB3 H -13.763 3.106 -8.003 1.00 . B B . 21 GLU HB3 1 1 11 8396 2 2 21 GLU HG2 H -14.413 5.442 -6.834 1.00 . B B . 21 GLU HG2 1 1 11 8397 2 2 21 GLU HG3 H -13.867 6.056 -8.394 1.00 . B B . 21 GLU HG3 1 1 11 8398 2 2 21 GLU N N -10.896 4.113 -7.185 1.00 . B B . 21 GLU N 1 1 11 8399 2 2 21 GLU O O -13.558 2.709 -5.213 1.00 . B B . 21 GLU O 1 1 11 8400 2 2 21 GLU OE1 O -15.534 3.978 -9.442 1.00 . B B . 21 GLU OE1 1 1 11 8401 2 2 21 GLU OE2 O -16.605 5.227 -8.051 1.00 . B B . 21 GLU OE2 1 1 11 8402 2 2 22 ARG C C -11.555 0.978 -3.641 1.00 . B B . 22 ARG C 1 1 11 8403 2 2 22 ARG CA C -11.823 0.657 -5.115 1.00 . B B . 22 ARG CA 1 1 11 8404 2 2 22 ARG CB C -10.839 -0.407 -5.603 1.00 . B B . 22 ARG CB 1 1 11 8405 2 2 22 ARG CD C -10.547 -2.851 -6.047 1.00 . B B . 22 ARG CD 1 1 11 8406 2 2 22 ARG CG C -11.430 -1.799 -5.371 1.00 . B B . 22 ARG CG 1 1 11 8407 2 2 22 ARG CZ C -11.047 -4.430 -7.817 1.00 . B B . 22 ARG CZ 1 1 11 8408 2 2 22 ARG H H -10.844 2.004 -6.475 1.00 . B B . 22 ARG H 1 1 11 8409 2 2 22 ARG HA H -12.834 0.293 -5.227 1.00 . B B . 22 ARG HA 1 1 11 8410 2 2 22 ARG HB2 H -10.653 -0.265 -6.659 1.00 . B B . 22 ARG HB2 1 1 11 8411 2 2 22 ARG HB3 H -9.912 -0.314 -5.060 1.00 . B B . 22 ARG HB3 1 1 11 8412 2 2 22 ARG HD2 H -9.550 -2.455 -6.178 1.00 . B B . 22 ARG HD2 1 1 11 8413 2 2 22 ARG HD3 H -10.504 -3.736 -5.429 1.00 . B B . 22 ARG HD3 1 1 11 8414 2 2 22 ARG HE H -11.552 -2.512 -7.923 1.00 . B B . 22 ARG HE 1 1 11 8415 2 2 22 ARG HG2 H -11.478 -1.997 -4.311 1.00 . B B . 22 ARG HG2 1 1 11 8416 2 2 22 ARG HG3 H -12.424 -1.843 -5.792 1.00 . B B . 22 ARG HG3 1 1 11 8417 2 2 22 ARG HH11 H -11.521 -5.255 -6.055 1.00 . B B . 22 ARG HH11 1 1 11 8418 2 2 22 ARG HH12 H -11.223 -6.368 -7.348 1.00 . B B . 22 ARG HH12 1 1 11 8419 2 2 22 ARG HH21 H -10.557 -3.896 -9.683 1.00 . B B . 22 ARG HH21 1 1 11 8420 2 2 22 ARG HH22 H -10.683 -5.599 -9.400 1.00 . B B . 22 ARG HH22 1 1 11 8421 2 2 22 ARG N N -11.647 1.892 -5.924 1.00 . B B . 22 ARG N 1 1 11 8422 2 2 22 ARG NE N -11.120 -3.202 -7.378 1.00 . B B . 22 ARG NE 1 1 11 8423 2 2 22 ARG NH1 N -11.283 -5.428 -7.010 1.00 . B B . 22 ARG NH1 1 1 11 8424 2 2 22 ARG NH2 N -10.738 -4.659 -9.064 1.00 . B B . 22 ARG NH2 1 1 11 8425 2 2 22 ARG O O -11.762 0.158 -2.768 1.00 . B B . 22 ARG O 1 1 11 8426 2 2 23 GLY C C -9.736 1.649 -1.362 1.00 . B B . 23 GLY C 1 1 11 8427 2 2 23 GLY CA C -10.823 2.553 -1.943 1.00 . B B . 23 GLY CA 1 1 11 8428 2 2 23 GLY H H -10.944 2.818 -4.076 1.00 . B B . 23 GLY H 1 1 11 8429 2 2 23 GLY HA2 H -10.493 3.581 -1.909 1.00 . B B . 23 GLY HA2 1 1 11 8430 2 2 23 GLY HA3 H -11.725 2.445 -1.360 1.00 . B B . 23 GLY HA3 1 1 11 8431 2 2 23 GLY N N -11.100 2.171 -3.358 1.00 . B B . 23 GLY N 1 1 11 8432 2 2 23 GLY O O -9.653 0.478 -1.678 1.00 . B B . 23 GLY O 1 1 11 8433 2 2 24 PHE C C -8.005 1.304 1.613 1.00 . B B . 24 PHE C 1 1 11 8434 2 2 24 PHE CA C -7.823 1.354 0.094 1.00 . B B . 24 PHE CA 1 1 11 8435 2 2 24 PHE CB C -6.460 1.965 -0.236 1.00 . B B . 24 PHE CB 1 1 11 8436 2 2 24 PHE CD1 C -6.235 3.909 1.356 1.00 . B B . 24 PHE CD1 1 1 11 8437 2 2 24 PHE CD2 C -6.737 4.363 -0.975 1.00 . B B . 24 PHE CD2 1 1 11 8438 2 2 24 PHE CE1 C -6.246 5.285 1.626 1.00 . B B . 24 PHE CE1 1 1 11 8439 2 2 24 PHE CE2 C -6.750 5.738 -0.704 1.00 . B B . 24 PHE CE2 1 1 11 8440 2 2 24 PHE CG C -6.479 3.448 0.056 1.00 . B B . 24 PHE CG 1 1 11 8441 2 2 24 PHE CZ C -6.503 6.199 0.596 1.00 . B B . 24 PHE CZ 1 1 11 8442 2 2 24 PHE H H -8.989 3.128 -0.269 1.00 . B B . 24 PHE H 1 1 11 8443 2 2 24 PHE HA H -7.873 0.352 -0.306 1.00 . B B . 24 PHE HA 1 1 11 8444 2 2 24 PHE HB2 H -5.699 1.491 0.365 1.00 . B B . 24 PHE HB2 1 1 11 8445 2 2 24 PHE HB3 H -6.240 1.810 -1.281 1.00 . B B . 24 PHE HB3 1 1 11 8446 2 2 24 PHE HD1 H -6.036 3.205 2.150 1.00 . B B . 24 PHE HD1 1 1 11 8447 2 2 24 PHE HD2 H -6.927 4.008 -1.977 1.00 . B B . 24 PHE HD2 1 1 11 8448 2 2 24 PHE HE1 H -6.059 5.640 2.629 1.00 . B B . 24 PHE HE1 1 1 11 8449 2 2 24 PHE HE2 H -6.950 6.443 -1.498 1.00 . B B . 24 PHE HE2 1 1 11 8450 2 2 24 PHE HZ H -6.509 7.260 0.803 1.00 . B B . 24 PHE HZ 1 1 11 8451 2 2 24 PHE N N -8.902 2.183 -0.511 1.00 . B B . 24 PHE N 1 1 11 8452 2 2 24 PHE O O -8.791 2.038 2.179 1.00 . B B . 24 PHE O 1 1 11 8453 2 2 25 PHE C C -6.064 0.635 4.414 1.00 . B B . 25 PHE C 1 1 11 8454 2 2 25 PHE CA C -7.416 0.338 3.757 1.00 . B B . 25 PHE CA 1 1 11 8455 2 2 25 PHE CB C -7.862 -1.079 4.126 1.00 . B B . 25 PHE CB 1 1 11 8456 2 2 25 PHE CD1 C -10.204 -0.537 4.894 1.00 . B B . 25 PHE CD1 1 1 11 8457 2 2 25 PHE CD2 C -8.625 -1.439 6.502 1.00 . B B . 25 PHE CD2 1 1 11 8458 2 2 25 PHE CE1 C -11.187 -0.480 5.892 1.00 . B B . 25 PHE CE1 1 1 11 8459 2 2 25 PHE CE2 C -9.608 -1.382 7.499 1.00 . B B . 25 PHE CE2 1 1 11 8460 2 2 25 PHE CG C -8.923 -1.016 5.200 1.00 . B B . 25 PHE CG 1 1 11 8461 2 2 25 PHE CZ C -10.889 -0.903 7.194 1.00 . B B . 25 PHE CZ 1 1 11 8462 2 2 25 PHE H H -6.658 -0.143 1.799 1.00 . B B . 25 PHE H 1 1 11 8463 2 2 25 PHE HA H -8.151 1.049 4.104 1.00 . B B . 25 PHE HA 1 1 11 8464 2 2 25 PHE HB2 H -8.265 -1.569 3.251 1.00 . B B . 25 PHE HB2 1 1 11 8465 2 2 25 PHE HB3 H -7.015 -1.639 4.493 1.00 . B B . 25 PHE HB3 1 1 11 8466 2 2 25 PHE HD1 H -10.434 -0.211 3.890 1.00 . B B . 25 PHE HD1 1 1 11 8467 2 2 25 PHE HD2 H -7.638 -1.809 6.737 1.00 . B B . 25 PHE HD2 1 1 11 8468 2 2 25 PHE HE1 H -12.174 -0.110 5.657 1.00 . B B . 25 PHE HE1 1 1 11 8469 2 2 25 PHE HE2 H -9.378 -1.708 8.502 1.00 . B B . 25 PHE HE2 1 1 11 8470 2 2 25 PHE HZ H -11.646 -0.860 7.963 1.00 . B B . 25 PHE HZ 1 1 11 8471 2 2 25 PHE N N -7.285 0.441 2.276 1.00 . B B . 25 PHE N 1 1 11 8472 2 2 25 PHE O O -5.248 -0.245 4.600 1.00 . B B . 25 PHE O 1 1 11 8473 2 2 26 TYR C C -4.668 2.117 6.932 1.00 . B B . 26 TYR C 1 1 11 8474 2 2 26 TYR CA C -4.523 2.223 5.413 1.00 . B B . 26 TYR CA 1 1 11 8475 2 2 26 TYR CB C -4.141 3.654 5.025 1.00 . B B . 26 TYR CB 1 1 11 8476 2 2 26 TYR CD1 C -1.717 3.684 5.731 1.00 . B B . 26 TYR CD1 1 1 11 8477 2 2 26 TYR CD2 C -3.297 5.099 6.912 1.00 . B B . 26 TYR CD2 1 1 11 8478 2 2 26 TYR CE1 C -0.682 4.157 6.549 1.00 . B B . 26 TYR CE1 1 1 11 8479 2 2 26 TYR CE2 C -2.262 5.570 7.731 1.00 . B B . 26 TYR CE2 1 1 11 8480 2 2 26 TYR CG C -3.025 4.155 5.913 1.00 . B B . 26 TYR CG 1 1 11 8481 2 2 26 TYR CZ C -0.954 5.100 7.549 1.00 . B B . 26 TYR CZ 1 1 11 8482 2 2 26 TYR H H -6.494 2.564 4.609 1.00 . B B . 26 TYR H 1 1 11 8483 2 2 26 TYR HA H -3.756 1.541 5.076 1.00 . B B . 26 TYR HA 1 1 11 8484 2 2 26 TYR HB2 H -3.811 3.668 3.997 1.00 . B B . 26 TYR HB2 1 1 11 8485 2 2 26 TYR HB3 H -5.001 4.296 5.133 1.00 . B B . 26 TYR HB3 1 1 11 8486 2 2 26 TYR HD1 H -1.507 2.958 4.960 1.00 . B B . 26 TYR HD1 1 1 11 8487 2 2 26 TYR HD2 H -4.305 5.462 7.052 1.00 . B B . 26 TYR HD2 1 1 11 8488 2 2 26 TYR HE1 H 0.325 3.795 6.408 1.00 . B B . 26 TYR HE1 1 1 11 8489 2 2 26 TYR HE2 H -2.471 6.298 8.502 1.00 . B B . 26 TYR HE2 1 1 11 8490 2 2 26 TYR HH H 0.468 6.320 7.920 1.00 . B B . 26 TYR HH 1 1 11 8491 2 2 26 TYR N N -5.822 1.869 4.767 1.00 . B B . 26 TYR N 1 1 11 8492 2 2 26 TYR O O -5.347 2.908 7.557 1.00 . B B . 26 TYR O 1 1 11 8493 2 2 26 TYR OH O 0.066 5.564 8.355 1.00 . B B . 26 TYR OH 1 1 11 8494 2 2 27 THR C C -2.761 0.762 9.607 1.00 . B B . 27 THR C 1 1 11 8495 2 2 27 THR CA C -4.152 0.980 9.007 1.00 . B B . 27 THR CA 1 1 11 8496 2 2 27 THR CB C -5.037 -0.230 9.316 1.00 . B B . 27 THR CB 1 1 11 8497 2 2 27 THR CG2 C -4.706 -1.365 8.346 1.00 . B B . 27 THR CG2 1 1 11 8498 2 2 27 THR H H -3.504 0.510 7.006 1.00 . B B . 27 THR H 1 1 11 8499 2 2 27 THR HA H -4.593 1.867 9.434 1.00 . B B . 27 THR HA 1 1 11 8500 2 2 27 THR HB H -6.074 0.044 9.202 1.00 . B B . 27 THR HB 1 1 11 8501 2 2 27 THR HG1 H -5.274 -1.488 10.783 1.00 . B B . 27 THR HG1 1 1 11 8502 2 2 27 THR HG21 H -5.058 -2.302 8.752 1.00 . B B . 27 THR HG21 1 1 11 8503 2 2 27 THR HG22 H -3.638 -1.415 8.201 1.00 . B B . 27 THR HG22 1 1 11 8504 2 2 27 THR HG23 H -5.190 -1.180 7.398 1.00 . B B . 27 THR HG23 1 1 11 8505 2 2 27 THR N N -4.042 1.141 7.530 1.00 . B B . 27 THR N 1 1 11 8506 2 2 27 THR O O -1.777 0.655 8.903 1.00 . B B . 27 THR O 1 1 11 8507 2 2 27 THR OG1 O -4.804 -0.661 10.651 1.00 . B B . 27 THR OG1 1 1 11 8508 2 2 28 LYS C C -1.538 -0.151 12.938 1.00 . B B . 28 LYS C 1 1 11 8509 2 2 28 LYS CA C -1.356 0.474 11.559 1.00 . B B . 28 LYS CA 1 1 11 8510 2 2 28 LYS CB C -0.626 1.801 11.748 1.00 . B B . 28 LYS CB 1 1 11 8511 2 2 28 LYS CD C 1.433 3.098 11.103 1.00 . B B . 28 LYS CD 1 1 11 8512 2 2 28 LYS CE C 0.419 4.172 10.700 1.00 . B B . 28 LYS CE 1 1 11 8513 2 2 28 LYS CG C 0.762 1.717 11.113 1.00 . B B . 28 LYS CG 1 1 11 8514 2 2 28 LYS H H -3.479 0.772 11.452 1.00 . B B . 28 LYS H 1 1 11 8515 2 2 28 LYS HA H -0.755 -0.179 10.945 1.00 . B B . 28 LYS HA 1 1 11 8516 2 2 28 LYS HB2 H -1.197 2.596 11.299 1.00 . B B . 28 LYS HB2 1 1 11 8517 2 2 28 LYS HB3 H -0.522 1.992 12.805 1.00 . B B . 28 LYS HB3 1 1 11 8518 2 2 28 LYS HD2 H 1.820 3.319 12.087 1.00 . B B . 28 LYS HD2 1 1 11 8519 2 2 28 LYS HD3 H 2.248 3.095 10.393 1.00 . B B . 28 LYS HD3 1 1 11 8520 2 2 28 LYS HE2 H 0.928 4.970 10.182 1.00 . B B . 28 LYS HE2 1 1 11 8521 2 2 28 LYS HE3 H -0.326 3.738 10.050 1.00 . B B . 28 LYS HE3 1 1 11 8522 2 2 28 LYS HG2 H 1.369 1.030 11.687 1.00 . B B . 28 LYS HG2 1 1 11 8523 2 2 28 LYS HG3 H 0.669 1.356 10.104 1.00 . B B . 28 LYS HG3 1 1 11 8524 2 2 28 LYS HZ1 H -0.296 3.973 12.646 1.00 . B B . 28 LYS HZ1 1 1 11 8525 2 2 28 LYS HZ2 H -1.203 5.036 11.679 1.00 . B B . 28 LYS HZ2 1 1 11 8526 2 2 28 LYS HZ3 H 0.309 5.517 12.286 1.00 . B B . 28 LYS HZ3 1 1 11 8527 2 2 28 LYS N N -2.676 0.690 10.908 1.00 . B B . 28 LYS N 1 1 11 8528 2 2 28 LYS NZ N -0.242 4.715 11.920 1.00 . B B . 28 LYS NZ 1 1 11 8529 2 2 28 LYS O O -1.000 -1.207 13.206 1.00 . B B . 28 LYS O 1 1 11 8530 2 2 29 PRO C C -3.617 -0.908 15.248 1.00 . B B . 29 PRO C 1 1 11 8531 2 2 29 PRO CA C -2.444 0.074 15.173 1.00 . B B . 29 PRO CA 1 1 11 8532 2 2 29 PRO CB C -2.762 1.365 15.922 1.00 . B B . 29 PRO CB 1 1 11 8533 2 2 29 PRO CD C -2.917 1.833 13.505 1.00 . B B . 29 PRO CD 1 1 11 8534 2 2 29 PRO CG C -3.337 2.353 14.884 1.00 . B B . 29 PRO CG 1 1 11 8535 2 2 29 PRO HA H -1.543 -0.369 15.563 1.00 . B B . 29 PRO HA 1 1 11 8536 2 2 29 PRO HB2 H -3.476 1.180 16.710 1.00 . B B . 29 PRO HB2 1 1 11 8537 2 2 29 PRO HB3 H -1.848 1.773 16.322 1.00 . B B . 29 PRO HB3 1 1 11 8538 2 2 29 PRO HD2 H -3.793 1.685 12.889 1.00 . B B . 29 PRO HD2 1 1 11 8539 2 2 29 PRO HD3 H -2.241 2.523 13.044 1.00 . B B . 29 PRO HD3 1 1 11 8540 2 2 29 PRO HG2 H -4.416 2.382 14.960 1.00 . B B . 29 PRO HG2 1 1 11 8541 2 2 29 PRO HG3 H -2.926 3.338 15.043 1.00 . B B . 29 PRO HG3 1 1 11 8542 2 2 29 PRO N N -2.248 0.539 13.799 1.00 . B B . 29 PRO N 1 1 11 8543 2 2 29 PRO O O -4.277 -1.179 14.265 1.00 . B B . 29 PRO O 1 1 11 8544 2 2 30 THR C C -6.320 -1.633 16.691 1.00 . B B . 30 THR C 1 1 11 8545 2 2 30 THR CA C -5.005 -2.405 16.555 1.00 . B B . 30 THR CA 1 1 11 8546 2 2 30 THR CB C -4.783 -3.259 17.805 1.00 . B B . 30 THR CB 1 1 11 8547 2 2 30 THR CG2 C -4.509 -4.707 17.396 1.00 . B B . 30 THR CG2 1 1 11 8548 2 2 30 THR H H -3.332 -1.208 17.189 1.00 . B B . 30 THR H 1 1 11 8549 2 2 30 THR HA H -5.050 -3.043 15.684 1.00 . B B . 30 THR HA 1 1 11 8550 2 2 30 THR HB H -5.664 -3.226 18.426 1.00 . B B . 30 THR HB 1 1 11 8551 2 2 30 THR HG1 H -3.648 -3.192 19.383 1.00 . B B . 30 THR HG1 1 1 11 8552 2 2 30 THR HG21 H -5.445 -5.209 17.200 1.00 . B B . 30 THR HG21 1 1 11 8553 2 2 30 THR HG22 H -3.989 -5.214 18.194 1.00 . B B . 30 THR HG22 1 1 11 8554 2 2 30 THR HG23 H -3.900 -4.720 16.504 1.00 . B B . 30 THR HG23 1 1 11 8555 2 2 30 THR N N -3.878 -1.441 16.410 1.00 . B B . 30 THR N 1 1 11 8556 2 2 30 THR O O -6.719 -1.378 17.815 1.00 . B B . 30 THR O 1 1 11 8557 2 2 30 THR OXT O -6.906 -1.313 15.670 1.00 . B B . 30 THR OXT 1 1 11 8558 2 2 30 THR OG1 O -3.671 -2.752 18.530 1.00 . B B . 30 THR OG1 1 1 12 8559 1 1 1 GLY C C 0.299 -4.565 8.003 1.00 . A A . 1 GLY C 1 1 12 8560 1 1 1 GLY CA C -0.464 -4.358 9.267 1.00 . A A . 1 GLY CA 1 1 12 8561 1 1 1 GLY H1 H 1.024 -4.603 10.751 1.00 . A A . 1 GLY H1 1 1 12 8562 1 1 1 GLY H2 H 0.090 -5.997 10.486 1.00 . A A . 1 GLY H2 1 1 12 8563 1 1 1 GLY H3 H -0.560 -4.689 11.355 1.00 . A A . 1 GLY H3 1 1 12 8564 1 1 1 GLY HA2 H -1.119 -4.945 8.843 1.00 . A A . 1 GLY HA2 1 1 12 8565 1 1 1 GLY HA3 H -0.897 -3.306 9.530 1.00 . A A . 1 GLY HA3 1 1 12 8566 1 1 1 GLY N N 0.065 -4.960 10.569 1.00 . A A . 1 GLY N 1 1 12 8567 1 1 1 GLY O O 0.936 -5.581 7.810 1.00 . A A . 1 GLY O 1 1 12 8568 1 1 2 ILE C C 2.246 -2.865 5.866 1.00 . A A . 2 ILE C 1 1 12 8569 1 1 2 ILE CA C 1.004 -3.752 5.831 1.00 . A A . 2 ILE CA 1 1 12 8570 1 1 2 ILE CB C 0.105 -3.332 4.661 1.00 . A A . 2 ILE CB 1 1 12 8571 1 1 2 ILE CD1 C 0.159 -2.634 2.254 1.00 . A A . 2 ILE CD1 1 1 12 8572 1 1 2 ILE CG1 C 0.909 -3.388 3.357 1.00 . A A . 2 ILE CG1 1 1 12 8573 1 1 2 ILE CG2 C -0.404 -1.904 4.882 1.00 . A A . 2 ILE CG2 1 1 12 8574 1 1 2 ILE H H -0.258 -2.799 7.294 1.00 . A A . 2 ILE H 1 1 12 8575 1 1 2 ILE HA H 1.303 -4.775 5.705 1.00 . A A . 2 ILE HA 1 1 12 8576 1 1 2 ILE HB H -0.737 -4.006 4.596 1.00 . A A . 2 ILE HB 1 1 12 8577 1 1 2 ILE HD11 H -0.895 -2.857 2.320 1.00 . A A . 2 ILE HD11 1 1 12 8578 1 1 2 ILE HD12 H 0.532 -2.942 1.288 1.00 . A A . 2 ILE HD12 1 1 12 8579 1 1 2 ILE HD13 H 0.311 -1.572 2.377 1.00 . A A . 2 ILE HD13 1 1 12 8580 1 1 2 ILE HG12 H 1.876 -2.932 3.512 1.00 . A A . 2 ILE HG12 1 1 12 8581 1 1 2 ILE HG13 H 1.041 -4.418 3.060 1.00 . A A . 2 ILE HG13 1 1 12 8582 1 1 2 ILE HG21 H -0.824 -1.817 5.872 1.00 . A A . 2 ILE HG21 1 1 12 8583 1 1 2 ILE HG22 H -1.164 -1.676 4.150 1.00 . A A . 2 ILE HG22 1 1 12 8584 1 1 2 ILE HG23 H 0.416 -1.210 4.777 1.00 . A A . 2 ILE HG23 1 1 12 8585 1 1 2 ILE N N 0.259 -3.610 7.115 1.00 . A A . 2 ILE N 1 1 12 8586 1 1 2 ILE O O 3.339 -3.289 5.548 1.00 . A A . 2 ILE O 1 1 12 8587 1 1 3 ABA C C 4.383 -1.314 7.092 1.00 . A A . 3 ABA C 1 1 12 8588 1 1 3 ABA CA C 3.239 -0.696 6.292 1.00 . A A . 3 ABA CA 1 1 12 8589 1 1 3 ABA CB C 2.849 0.647 6.934 1.00 . A A . 3 ABA CB 1 1 12 8590 1 1 3 ABA CG C 1.452 0.582 7.557 1.00 . A A . 3 ABA CG 1 1 12 8591 1 1 3 ABA H H 1.187 -1.328 6.479 1.00 . A A . 3 ABA H 1 1 12 8592 1 1 3 ABA HA H 3.581 -0.518 5.291 1.00 . A A . 3 ABA HA 1 1 12 8593 1 1 3 ABA HB2 H 3.564 0.888 7.702 1.00 . A A . 3 ABA HB2 1 1 12 8594 1 1 3 ABA HB3 H 2.867 1.417 6.178 1.00 . A A . 3 ABA HB3 1 1 12 8595 1 1 3 ABA HG1 H 1.257 1.495 8.099 1.00 . A A . 3 ABA HG1 1 1 12 8596 1 1 3 ABA HG2 H 1.398 -0.257 8.234 1.00 . A A . 3 ABA HG2 1 1 12 8597 1 1 3 ABA HG3 H 0.716 0.462 6.776 1.00 . A A . 3 ABA HG3 1 1 12 8598 1 1 3 ABA N N 2.078 -1.634 6.242 1.00 . A A . 3 ABA N 1 1 12 8599 1 1 3 ABA O O 5.503 -1.365 6.653 1.00 . A A . 3 ABA O 1 1 12 8600 1 1 4 GLU C C 5.972 -3.402 8.176 1.00 . A A . 4 GLU C 1 1 12 8601 1 1 4 GLU CA C 5.230 -2.379 9.049 1.00 . A A . 4 GLU CA 1 1 12 8602 1 1 4 GLU CB C 4.618 -3.030 10.289 1.00 . A A . 4 GLU CB 1 1 12 8603 1 1 4 GLU CD C 6.724 -4.144 11.047 1.00 . A A . 4 GLU CD 1 1 12 8604 1 1 4 GLU CG C 5.279 -4.374 10.603 1.00 . A A . 4 GLU CG 1 1 12 8605 1 1 4 GLU H H 3.223 -1.745 8.619 1.00 . A A . 4 GLU H 1 1 12 8606 1 1 4 GLU HA H 5.916 -1.602 9.351 1.00 . A A . 4 GLU HA 1 1 12 8607 1 1 4 GLU HB2 H 4.739 -2.365 11.130 1.00 . A A . 4 GLU HB2 1 1 12 8608 1 1 4 GLU HB3 H 3.569 -3.183 10.106 1.00 . A A . 4 GLU HB3 1 1 12 8609 1 1 4 GLU HG2 H 4.730 -4.862 11.393 1.00 . A A . 4 GLU HG2 1 1 12 8610 1 1 4 GLU HG3 H 5.267 -4.993 9.720 1.00 . A A . 4 GLU HG3 1 1 12 8611 1 1 4 GLU N N 4.128 -1.782 8.259 1.00 . A A . 4 GLU N 1 1 12 8612 1 1 4 GLU O O 7.136 -3.679 8.384 1.00 . A A . 4 GLU O 1 1 12 8613 1 1 4 GLU OE1 O 6.926 -3.345 11.947 1.00 . A A . 4 GLU OE1 1 1 12 8614 1 1 4 GLU OE2 O 7.604 -4.772 10.482 1.00 . A A . 4 GLU OE2 1 1 12 8615 1 1 5 GLN C C 6.285 -4.337 4.959 1.00 . A A . 5 GLN C 1 1 12 8616 1 1 5 GLN CA C 5.976 -4.962 6.323 1.00 . A A . 5 GLN CA 1 1 12 8617 1 1 5 GLN CB C 5.058 -6.170 6.127 1.00 . A A . 5 GLN CB 1 1 12 8618 1 1 5 GLN CD C 5.389 -8.522 6.899 1.00 . A A . 5 GLN CD 1 1 12 8619 1 1 5 GLN CG C 5.908 -7.430 5.963 1.00 . A A . 5 GLN CG 1 1 12 8620 1 1 5 GLN H H 4.368 -3.724 7.050 1.00 . A A . 5 GLN H 1 1 12 8621 1 1 5 GLN HA H 6.897 -5.284 6.785 1.00 . A A . 5 GLN HA 1 1 12 8622 1 1 5 GLN HB2 H 4.415 -6.277 6.989 1.00 . A A . 5 GLN HB2 1 1 12 8623 1 1 5 GLN HB3 H 4.456 -6.026 5.243 1.00 . A A . 5 GLN HB3 1 1 12 8624 1 1 5 GLN HE21 H 7.156 -9.410 7.076 1.00 . A A . 5 GLN HE21 1 1 12 8625 1 1 5 GLN HE22 H 5.890 -10.133 7.945 1.00 . A A . 5 GLN HE22 1 1 12 8626 1 1 5 GLN HG2 H 5.850 -7.773 4.939 1.00 . A A . 5 GLN HG2 1 1 12 8627 1 1 5 GLN HG3 H 6.935 -7.205 6.210 1.00 . A A . 5 GLN HG3 1 1 12 8628 1 1 5 GLN N N 5.306 -3.961 7.202 1.00 . A A . 5 GLN N 1 1 12 8629 1 1 5 GLN NE2 N 6.213 -9.431 7.343 1.00 . A A . 5 GLN NE2 1 1 12 8630 1 1 5 GLN O O 7.162 -4.784 4.249 1.00 . A A . 5 GLN O 1 1 12 8631 1 1 5 GLN OE1 O 4.220 -8.549 7.230 1.00 . A A . 5 GLN OE1 1 1 12 8632 1 1 6 CYS C C 6.557 -1.346 3.500 1.00 . A A . 6 CYS C 1 1 12 8633 1 1 6 CYS CA C 5.819 -2.665 3.272 1.00 . A A . 6 CYS CA 1 1 12 8634 1 1 6 CYS CB C 4.477 -2.411 2.595 1.00 . A A . 6 CYS CB 1 1 12 8635 1 1 6 CYS H H 4.866 -2.965 5.168 1.00 . A A . 6 CYS H 1 1 12 8636 1 1 6 CYS HA H 6.420 -3.314 2.655 1.00 . A A . 6 CYS HA 1 1 12 8637 1 1 6 CYS HB2 H 3.701 -2.340 3.339 1.00 . A A . 6 CYS HB2 1 1 12 8638 1 1 6 CYS HB3 H 4.520 -1.496 2.044 1.00 . A A . 6 CYS HB3 1 1 12 8639 1 1 6 CYS N N 5.571 -3.311 4.586 1.00 . A A . 6 CYS N 1 1 12 8640 1 1 6 CYS O O 7.213 -0.819 2.623 1.00 . A A . 6 CYS O 1 1 12 8641 1 1 6 CYS SG S 4.116 -3.780 1.472 1.00 . A A . 6 CYS SG 1 1 12 8642 1 1 7 CYS C C 8.579 0.096 5.476 1.00 . A A . 7 CYS C 1 1 12 8643 1 1 7 CYS CA C 7.154 0.435 5.038 1.00 . A A . 7 CYS CA 1 1 12 8644 1 1 7 CYS CB C 6.404 1.132 6.180 1.00 . A A . 7 CYS CB 1 1 12 8645 1 1 7 CYS H H 5.937 -1.295 5.372 1.00 . A A . 7 CYS H 1 1 12 8646 1 1 7 CYS HA H 7.183 1.080 4.181 1.00 . A A . 7 CYS HA 1 1 12 8647 1 1 7 CYS HB2 H 5.390 1.341 5.873 1.00 . A A . 7 CYS HB2 1 1 12 8648 1 1 7 CYS HB3 H 6.383 0.493 7.040 1.00 . A A . 7 CYS HB3 1 1 12 8649 1 1 7 CYS N N 6.462 -0.830 4.689 1.00 . A A . 7 CYS N 1 1 12 8650 1 1 7 CYS O O 9.495 0.876 5.304 1.00 . A A . 7 CYS O 1 1 12 8651 1 1 7 CYS SG S 7.245 2.681 6.602 1.00 . A A . 7 CYS SG 1 1 12 8652 1 1 8 THR C C 10.772 -2.369 5.382 1.00 . A A . 8 THR C 1 1 12 8653 1 1 8 THR CA C 10.152 -1.467 6.454 1.00 . A A . 8 THR CA 1 1 12 8654 1 1 8 THR CB C 10.084 -2.223 7.785 1.00 . A A . 8 THR CB 1 1 12 8655 1 1 8 THR CG2 C 9.359 -1.367 8.827 1.00 . A A . 8 THR CG2 1 1 12 8656 1 1 8 THR H H 8.030 -1.704 6.150 1.00 . A A . 8 THR H 1 1 12 8657 1 1 8 THR HA H 10.757 -0.580 6.574 1.00 . A A . 8 THR HA 1 1 12 8658 1 1 8 THR HB H 11.085 -2.431 8.131 1.00 . A A . 8 THR HB 1 1 12 8659 1 1 8 THR HG1 H 8.458 -3.239 7.456 1.00 . A A . 8 THR HG1 1 1 12 8660 1 1 8 THR HG21 H 9.667 -0.336 8.722 1.00 . A A . 8 THR HG21 1 1 12 8661 1 1 8 THR HG22 H 9.609 -1.717 9.817 1.00 . A A . 8 THR HG22 1 1 12 8662 1 1 8 THR HG23 H 8.292 -1.441 8.677 1.00 . A A . 8 THR HG23 1 1 12 8663 1 1 8 THR N N 8.780 -1.076 6.027 1.00 . A A . 8 THR N 1 1 12 8664 1 1 8 THR O O 11.831 -2.934 5.571 1.00 . A A . 8 THR O 1 1 12 8665 1 1 8 THR OG1 O 9.384 -3.445 7.599 1.00 . A A . 8 THR OG1 1 1 12 8666 1 1 9 SER C C 10.301 -2.785 1.804 1.00 . A A . 9 SER C 1 1 12 8667 1 1 9 SER CA C 10.672 -3.371 3.171 1.00 . A A . 9 SER CA 1 1 12 8668 1 1 9 SER CB C 10.105 -4.787 3.297 1.00 . A A . 9 SER CB 1 1 12 8669 1 1 9 SER H H 9.267 -2.042 4.123 1.00 . A A . 9 SER H 1 1 12 8670 1 1 9 SER HA H 11.744 -3.410 3.258 1.00 . A A . 9 SER HA 1 1 12 8671 1 1 9 SER HB2 H 9.030 -4.747 3.309 1.00 . A A . 9 SER HB2 1 1 12 8672 1 1 9 SER HB3 H 10.432 -5.379 2.452 1.00 . A A . 9 SER HB3 1 1 12 8673 1 1 9 SER HG H 10.587 -4.688 5.181 1.00 . A A . 9 SER HG 1 1 12 8674 1 1 9 SER N N 10.119 -2.508 4.255 1.00 . A A . 9 SER N 1 1 12 8675 1 1 9 SER O O 10.960 -1.895 1.305 1.00 . A A . 9 SER O 1 1 12 8676 1 1 9 SER OG O 10.567 -5.373 4.508 1.00 . A A . 9 SER OG 1 1 12 8677 1 1 10 ILE C C 7.400 -3.073 -0.445 1.00 . A A . 10 ILE C 1 1 12 8678 1 1 10 ILE CA C 8.873 -2.745 -0.150 1.00 . A A . 10 ILE CA 1 1 12 8679 1 1 10 ILE CB C 9.793 -3.375 -1.214 1.00 . A A . 10 ILE CB 1 1 12 8680 1 1 10 ILE CD1 C 12.178 -2.836 -0.746 1.00 . A A . 10 ILE CD1 1 1 12 8681 1 1 10 ILE CG1 C 10.933 -2.411 -1.522 1.00 . A A . 10 ILE CG1 1 1 12 8682 1 1 10 ILE CG2 C 9.024 -3.677 -2.506 1.00 . A A . 10 ILE CG2 1 1 12 8683 1 1 10 ILE H H 8.747 -4.000 1.596 1.00 . A A . 10 ILE H 1 1 12 8684 1 1 10 ILE HA H 9.006 -1.673 -0.157 1.00 . A A . 10 ILE HA 1 1 12 8685 1 1 10 ILE HB H 10.206 -4.290 -0.826 1.00 . A A . 10 ILE HB 1 1 12 8686 1 1 10 ILE HD11 H 12.574 -1.987 -0.209 1.00 . A A . 10 ILE HD11 1 1 12 8687 1 1 10 ILE HD12 H 12.922 -3.207 -1.434 1.00 . A A . 10 ILE HD12 1 1 12 8688 1 1 10 ILE HD13 H 11.916 -3.615 -0.043 1.00 . A A . 10 ILE HD13 1 1 12 8689 1 1 10 ILE HG12 H 11.142 -2.427 -2.581 1.00 . A A . 10 ILE HG12 1 1 12 8690 1 1 10 ILE HG13 H 10.649 -1.416 -1.225 1.00 . A A . 10 ILE HG13 1 1 12 8691 1 1 10 ILE HG21 H 8.618 -2.759 -2.905 1.00 . A A . 10 ILE HG21 1 1 12 8692 1 1 10 ILE HG22 H 8.217 -4.363 -2.291 1.00 . A A . 10 ILE HG22 1 1 12 8693 1 1 10 ILE HG23 H 9.692 -4.121 -3.228 1.00 . A A . 10 ILE HG23 1 1 12 8694 1 1 10 ILE N N 9.261 -3.279 1.188 1.00 . A A . 10 ILE N 1 1 12 8695 1 1 10 ILE O O 6.837 -4.012 0.081 1.00 . A A . 10 ILE O 1 1 12 8696 1 1 11 CYS C C 5.168 -2.113 -3.137 1.00 . A A . 11 CYS C 1 1 12 8697 1 1 11 CYS CA C 5.368 -2.548 -1.686 1.00 . A A . 11 CYS CA 1 1 12 8698 1 1 11 CYS CB C 4.438 -1.765 -0.766 1.00 . A A . 11 CYS CB 1 1 12 8699 1 1 11 CYS H H 7.280 -1.563 -1.726 1.00 . A A . 11 CYS H 1 1 12 8700 1 1 11 CYS HA H 5.144 -3.596 -1.601 1.00 . A A . 11 CYS HA 1 1 12 8701 1 1 11 CYS HB2 H 5.009 -1.332 0.039 1.00 . A A . 11 CYS HB2 1 1 12 8702 1 1 11 CYS HB3 H 3.946 -0.983 -1.325 1.00 . A A . 11 CYS HB3 1 1 12 8703 1 1 11 CYS N N 6.790 -2.303 -1.309 1.00 . A A . 11 CYS N 1 1 12 8704 1 1 11 CYS O O 5.227 -0.944 -3.463 1.00 . A A . 11 CYS O 1 1 12 8705 1 1 11 CYS SG S 3.199 -2.900 -0.092 1.00 . A A . 11 CYS SG 1 1 12 8706 1 1 12 SER C C 3.370 -2.204 -5.716 1.00 . A A . 12 SER C 1 1 12 8707 1 1 12 SER CA C 4.781 -2.720 -5.454 1.00 . A A . 12 SER CA 1 1 12 8708 1 1 12 SER CB C 5.030 -3.970 -6.296 1.00 . A A . 12 SER CB 1 1 12 8709 1 1 12 SER H H 4.936 -3.991 -3.724 1.00 . A A . 12 SER H 1 1 12 8710 1 1 12 SER HA H 5.491 -1.957 -5.737 1.00 . A A . 12 SER HA 1 1 12 8711 1 1 12 SER HB2 H 4.307 -4.020 -7.092 1.00 . A A . 12 SER HB2 1 1 12 8712 1 1 12 SER HB3 H 6.025 -3.926 -6.718 1.00 . A A . 12 SER HB3 1 1 12 8713 1 1 12 SER HG H 4.381 -5.773 -5.953 1.00 . A A . 12 SER HG 1 1 12 8714 1 1 12 SER N N 4.958 -3.056 -4.013 1.00 . A A . 12 SER N 1 1 12 8715 1 1 12 SER O O 2.437 -2.486 -4.990 1.00 . A A . 12 SER O 1 1 12 8716 1 1 12 SER OG O 4.900 -5.122 -5.473 1.00 . A A . 12 SER OG 1 1 12 8717 1 1 13 LEU C C 0.879 -1.997 -7.325 1.00 . A A . 13 LEU C 1 1 12 8718 1 1 13 LEU CA C 1.897 -0.873 -7.118 1.00 . A A . 13 LEU CA 1 1 12 8719 1 1 13 LEU CB C 2.040 -0.074 -8.410 1.00 . A A . 13 LEU CB 1 1 12 8720 1 1 13 LEU CD1 C 1.961 -0.623 -10.839 1.00 . A A . 13 LEU CD1 1 1 12 8721 1 1 13 LEU CD2 C 4.102 -0.858 -9.585 1.00 . A A . 13 LEU CD2 1 1 12 8722 1 1 13 LEU CG C 2.581 -0.997 -9.497 1.00 . A A . 13 LEU CG 1 1 12 8723 1 1 13 LEU H H 4.003 -1.237 -7.315 1.00 . A A . 13 LEU H 1 1 12 8724 1 1 13 LEU HA H 1.559 -0.225 -6.332 1.00 . A A . 13 LEU HA 1 1 12 8725 1 1 13 LEU HB2 H 1.075 0.313 -8.706 1.00 . A A . 13 LEU HB2 1 1 12 8726 1 1 13 LEU HB3 H 2.729 0.743 -8.257 1.00 . A A . 13 LEU HB3 1 1 12 8727 1 1 13 LEU HD11 H 2.745 -0.380 -11.541 1.00 . A A . 13 LEU HD11 1 1 12 8728 1 1 13 LEU HD12 H 1.315 0.233 -10.709 1.00 . A A . 13 LEU HD12 1 1 12 8729 1 1 13 LEU HD13 H 1.387 -1.456 -11.214 1.00 . A A . 13 LEU HD13 1 1 12 8730 1 1 13 LEU HD21 H 4.417 0.013 -9.030 1.00 . A A . 13 LEU HD21 1 1 12 8731 1 1 13 LEU HD22 H 4.395 -0.752 -10.619 1.00 . A A . 13 LEU HD22 1 1 12 8732 1 1 13 LEU HD23 H 4.568 -1.738 -9.167 1.00 . A A . 13 LEU HD23 1 1 12 8733 1 1 13 LEU HG H 2.324 -2.016 -9.250 1.00 . A A . 13 LEU HG 1 1 12 8734 1 1 13 LEU N N 3.225 -1.442 -6.760 1.00 . A A . 13 LEU N 1 1 12 8735 1 1 13 LEU O O -0.316 -1.769 -7.338 1.00 . A A . 13 LEU O 1 1 12 8736 1 1 14 TYR C C 0.183 -4.952 -6.268 1.00 . A A . 14 TYR C 1 1 12 8737 1 1 14 TYR CA C 0.361 -4.330 -7.632 1.00 . A A . 14 TYR CA 1 1 12 8738 1 1 14 TYR CB C 0.919 -5.347 -8.640 1.00 . A A . 14 TYR CB 1 1 12 8739 1 1 14 TYR CD1 C -0.835 -7.137 -8.941 1.00 . A A . 14 TYR CD1 1 1 12 8740 1 1 14 TYR CD2 C 1.070 -7.597 -7.510 1.00 . A A . 14 TYR CD2 1 1 12 8741 1 1 14 TYR CE1 C -1.341 -8.416 -8.679 1.00 . A A . 14 TYR CE1 1 1 12 8742 1 1 14 TYR CE2 C 0.565 -8.877 -7.248 1.00 . A A . 14 TYR CE2 1 1 12 8743 1 1 14 TYR CG C 0.371 -6.727 -8.358 1.00 . A A . 14 TYR CG 1 1 12 8744 1 1 14 TYR CZ C -0.641 -9.287 -7.832 1.00 . A A . 14 TYR CZ 1 1 12 8745 1 1 14 TYR H H 2.292 -3.402 -7.402 1.00 . A A . 14 TYR H 1 1 12 8746 1 1 14 TYR HA H -0.583 -3.941 -7.972 1.00 . A A . 14 TYR HA 1 1 12 8747 1 1 14 TYR HB2 H 0.637 -5.049 -9.638 1.00 . A A . 14 TYR HB2 1 1 12 8748 1 1 14 TYR HB3 H 1.997 -5.368 -8.566 1.00 . A A . 14 TYR HB3 1 1 12 8749 1 1 14 TYR HD1 H -1.374 -6.466 -9.594 1.00 . A A . 14 TYR HD1 1 1 12 8750 1 1 14 TYR HD2 H 2.000 -7.280 -7.060 1.00 . A A . 14 TYR HD2 1 1 12 8751 1 1 14 TYR HE1 H -2.270 -8.732 -9.129 1.00 . A A . 14 TYR HE1 1 1 12 8752 1 1 14 TYR HE2 H 1.104 -9.547 -6.595 1.00 . A A . 14 TYR HE2 1 1 12 8753 1 1 14 TYR HH H -0.636 -10.925 -6.850 1.00 . A A . 14 TYR HH 1 1 12 8754 1 1 14 TYR N N 1.327 -3.215 -7.455 1.00 . A A . 14 TYR N 1 1 12 8755 1 1 14 TYR O O -0.888 -5.369 -5.875 1.00 . A A . 14 TYR O 1 1 12 8756 1 1 14 TYR OH O -1.140 -10.547 -7.575 1.00 . A A . 14 TYR OH 1 1 12 8757 1 1 15 GLN C C 0.305 -4.545 -3.359 1.00 . A A . 15 GLN C 1 1 12 8758 1 1 15 GLN CA C 1.202 -5.475 -4.163 1.00 . A A . 15 GLN CA 1 1 12 8759 1 1 15 GLN CB C 2.617 -5.399 -3.620 1.00 . A A . 15 GLN CB 1 1 12 8760 1 1 15 GLN CD C 2.673 -7.679 -2.572 1.00 . A A . 15 GLN CD 1 1 12 8761 1 1 15 GLN CG C 3.272 -6.776 -3.657 1.00 . A A . 15 GLN CG 1 1 12 8762 1 1 15 GLN H H 2.072 -4.572 -5.882 1.00 . A A . 15 GLN H 1 1 12 8763 1 1 15 GLN HA H 0.830 -6.486 -4.141 1.00 . A A . 15 GLN HA 1 1 12 8764 1 1 15 GLN HB2 H 3.185 -4.714 -4.239 1.00 . A A . 15 GLN HB2 1 1 12 8765 1 1 15 GLN HB3 H 2.591 -5.032 -2.612 1.00 . A A . 15 GLN HB3 1 1 12 8766 1 1 15 GLN HE21 H 1.418 -6.299 -1.879 1.00 . A A . 15 GLN HE21 1 1 12 8767 1 1 15 GLN HE22 H 1.357 -7.798 -1.090 1.00 . A A . 15 GLN HE22 1 1 12 8768 1 1 15 GLN HG2 H 3.108 -7.220 -4.628 1.00 . A A . 15 GLN HG2 1 1 12 8769 1 1 15 GLN HG3 H 4.333 -6.667 -3.487 1.00 . A A . 15 GLN HG3 1 1 12 8770 1 1 15 GLN N N 1.240 -4.956 -5.534 1.00 . A A . 15 GLN N 1 1 12 8771 1 1 15 GLN NE2 N 1.739 -7.219 -1.782 1.00 . A A . 15 GLN NE2 1 1 12 8772 1 1 15 GLN O O -0.353 -4.933 -2.413 1.00 . A A . 15 GLN O 1 1 12 8773 1 1 15 GLN OE1 O 3.064 -8.822 -2.440 1.00 . A A . 15 GLN OE1 1 1 12 8774 1 1 16 LEU C C -1.969 -2.416 -3.619 1.00 . A A . 16 LEU C 1 1 12 8775 1 1 16 LEU CA C -0.560 -2.300 -3.082 1.00 . A A . 16 LEU CA 1 1 12 8776 1 1 16 LEU CB C 0.045 -0.929 -3.365 1.00 . A A . 16 LEU CB 1 1 12 8777 1 1 16 LEU CD1 C 2.062 0.476 -2.866 1.00 . A A . 16 LEU CD1 1 1 12 8778 1 1 16 LEU CD2 C 1.146 -1.090 -1.154 1.00 . A A . 16 LEU CD2 1 1 12 8779 1 1 16 LEU CG C 1.387 -0.874 -2.644 1.00 . A A . 16 LEU CG 1 1 12 8780 1 1 16 LEU H H 0.803 -3.044 -4.548 1.00 . A A . 16 LEU H 1 1 12 8781 1 1 16 LEU HA H -0.567 -2.482 -2.021 1.00 . A A . 16 LEU HA 1 1 12 8782 1 1 16 LEU HB2 H 0.193 -0.805 -4.429 1.00 . A A . 16 LEU HB2 1 1 12 8783 1 1 16 LEU HB3 H -0.600 -0.157 -2.993 1.00 . A A . 16 LEU HB3 1 1 12 8784 1 1 16 LEU HD11 H 1.858 0.817 -3.868 1.00 . A A . 16 LEU HD11 1 1 12 8785 1 1 16 LEU HD12 H 3.129 0.366 -2.733 1.00 . A A . 16 LEU HD12 1 1 12 8786 1 1 16 LEU HD13 H 1.682 1.191 -2.153 1.00 . A A . 16 LEU HD13 1 1 12 8787 1 1 16 LEU HD21 H 0.277 -0.532 -0.845 1.00 . A A . 16 LEU HD21 1 1 12 8788 1 1 16 LEU HD22 H 2.009 -0.757 -0.598 1.00 . A A . 16 LEU HD22 1 1 12 8789 1 1 16 LEU HD23 H 0.982 -2.143 -0.970 1.00 . A A . 16 LEU HD23 1 1 12 8790 1 1 16 LEU HG H 2.027 -1.658 -3.019 1.00 . A A . 16 LEU HG 1 1 12 8791 1 1 16 LEU N N 0.274 -3.310 -3.765 1.00 . A A . 16 LEU N 1 1 12 8792 1 1 16 LEU O O -2.935 -2.079 -2.965 1.00 . A A . 16 LEU O 1 1 12 8793 1 1 17 GLU C C -4.105 -4.291 -4.653 1.00 . A A . 17 GLU C 1 1 12 8794 1 1 17 GLU CA C -3.425 -3.128 -5.382 1.00 . A A . 17 GLU CA 1 1 12 8795 1 1 17 GLU CB C -3.258 -3.466 -6.860 1.00 . A A . 17 GLU CB 1 1 12 8796 1 1 17 GLU CD C -4.505 -4.427 -8.800 1.00 . A A . 17 GLU CD 1 1 12 8797 1 1 17 GLU CG C -4.632 -3.600 -7.519 1.00 . A A . 17 GLU CG 1 1 12 8798 1 1 17 GLU H H -1.292 -3.224 -5.295 1.00 . A A . 17 GLU H 1 1 12 8799 1 1 17 GLU HA H -4.005 -2.230 -5.272 1.00 . A A . 17 GLU HA 1 1 12 8800 1 1 17 GLU HB2 H -2.695 -2.680 -7.342 1.00 . A A . 17 GLU HB2 1 1 12 8801 1 1 17 GLU HB3 H -2.721 -4.398 -6.952 1.00 . A A . 17 GLU HB3 1 1 12 8802 1 1 17 GLU HG2 H -5.312 -4.092 -6.838 1.00 . A A . 17 GLU HG2 1 1 12 8803 1 1 17 GLU HG3 H -5.013 -2.620 -7.763 1.00 . A A . 17 GLU HG3 1 1 12 8804 1 1 17 GLU N N -2.089 -2.935 -4.799 1.00 . A A . 17 GLU N 1 1 12 8805 1 1 17 GLU O O -5.313 -4.424 -4.657 1.00 . A A . 17 GLU O 1 1 12 8806 1 1 17 GLU OE1 O -4.325 -5.629 -8.690 1.00 . A A . 17 GLU OE1 1 1 12 8807 1 1 17 GLU OE2 O -4.588 -3.845 -9.869 1.00 . A A . 17 GLU OE2 1 1 12 8808 1 1 18 ASN C C -4.526 -5.855 -1.965 1.00 . A A . 18 ASN C 1 1 12 8809 1 1 18 ASN CA C -3.935 -6.301 -3.304 1.00 . A A . 18 ASN CA 1 1 12 8810 1 1 18 ASN CB C -2.862 -7.360 -3.051 1.00 . A A . 18 ASN CB 1 1 12 8811 1 1 18 ASN CG C -2.944 -8.442 -4.130 1.00 . A A . 18 ASN CG 1 1 12 8812 1 1 18 ASN H H -2.352 -5.012 -4.027 1.00 . A A . 18 ASN H 1 1 12 8813 1 1 18 ASN HA H -4.718 -6.728 -3.913 1.00 . A A . 18 ASN HA 1 1 12 8814 1 1 18 ASN HB2 H -1.889 -6.895 -3.077 1.00 . A A . 18 ASN HB2 1 1 12 8815 1 1 18 ASN HB3 H -3.021 -7.808 -2.082 1.00 . A A . 18 ASN HB3 1 1 12 8816 1 1 18 ASN HD21 H -1.995 -7.356 -5.496 1.00 . A A . 18 ASN HD21 1 1 12 8817 1 1 18 ASN HD22 H -2.476 -8.902 -6.004 1.00 . A A . 18 ASN HD22 1 1 12 8818 1 1 18 ASN N N -3.331 -5.139 -4.022 1.00 . A A . 18 ASN N 1 1 12 8819 1 1 18 ASN ND2 N -2.429 -8.214 -5.308 1.00 . A A . 18 ASN ND2 1 1 12 8820 1 1 18 ASN O O -5.150 -6.631 -1.268 1.00 . A A . 18 ASN O 1 1 12 8821 1 1 18 ASN OD1 O -3.482 -9.507 -3.899 1.00 . A A . 18 ASN OD1 1 1 12 8822 1 1 19 TYR C C -6.115 -3.273 -0.521 1.00 . A A . 19 TYR C 1 1 12 8823 1 1 19 TYR CA C -4.888 -4.159 -0.287 1.00 . A A . 19 TYR CA 1 1 12 8824 1 1 19 TYR CB C -3.820 -3.366 0.468 1.00 . A A . 19 TYR CB 1 1 12 8825 1 1 19 TYR CD1 C -2.770 -5.051 2.019 1.00 . A A . 19 TYR CD1 1 1 12 8826 1 1 19 TYR CD2 C -1.557 -4.386 0.025 1.00 . A A . 19 TYR CD2 1 1 12 8827 1 1 19 TYR CE1 C -1.720 -5.910 2.371 1.00 . A A . 19 TYR CE1 1 1 12 8828 1 1 19 TYR CE2 C -0.507 -5.245 0.377 1.00 . A A . 19 TYR CE2 1 1 12 8829 1 1 19 TYR CG C -2.688 -4.289 0.847 1.00 . A A . 19 TYR CG 1 1 12 8830 1 1 19 TYR CZ C -0.589 -6.007 1.551 1.00 . A A . 19 TYR CZ 1 1 12 8831 1 1 19 TYR H H -3.824 -4.007 -2.156 1.00 . A A . 19 TYR H 1 1 12 8832 1 1 19 TYR HA H -5.177 -5.017 0.302 1.00 . A A . 19 TYR HA 1 1 12 8833 1 1 19 TYR HB2 H -3.445 -2.576 -0.164 1.00 . A A . 19 TYR HB2 1 1 12 8834 1 1 19 TYR HB3 H -4.251 -2.941 1.361 1.00 . A A . 19 TYR HB3 1 1 12 8835 1 1 19 TYR HD1 H -3.642 -4.977 2.652 1.00 . A A . 19 TYR HD1 1 1 12 8836 1 1 19 TYR HD2 H -1.494 -3.798 -0.879 1.00 . A A . 19 TYR HD2 1 1 12 8837 1 1 19 TYR HE1 H -1.784 -6.498 3.275 1.00 . A A . 19 TYR HE1 1 1 12 8838 1 1 19 TYR HE2 H 0.365 -5.319 -0.256 1.00 . A A . 19 TYR HE2 1 1 12 8839 1 1 19 TYR HH H 0.482 -6.900 2.855 1.00 . A A . 19 TYR HH 1 1 12 8840 1 1 19 TYR N N -4.334 -4.623 -1.589 1.00 . A A . 19 TYR N 1 1 12 8841 1 1 19 TYR O O -6.753 -2.834 0.415 1.00 . A A . 19 TYR O 1 1 12 8842 1 1 19 TYR OH O 0.445 -6.854 1.897 1.00 . A A . 19 TYR OH 1 1 12 8843 1 1 20 CYS C C -8.909 -2.984 -2.022 1.00 . A A . 20 CYS C 1 1 12 8844 1 1 20 CYS CA C -7.634 -2.134 -2.003 1.00 . A A . 20 CYS CA 1 1 12 8845 1 1 20 CYS CB C -7.455 -1.429 -3.342 1.00 . A A . 20 CYS CB 1 1 12 8846 1 1 20 CYS H H -5.939 -3.342 -2.505 1.00 . A A . 20 CYS H 1 1 12 8847 1 1 20 CYS HA H -7.709 -1.395 -1.220 1.00 . A A . 20 CYS HA 1 1 12 8848 1 1 20 CYS HB2 H -8.285 -0.775 -3.506 1.00 . A A . 20 CYS HB2 1 1 12 8849 1 1 20 CYS HB3 H -6.541 -0.854 -3.327 1.00 . A A . 20 CYS HB3 1 1 12 8850 1 1 20 CYS N N -6.455 -2.996 -1.752 1.00 . A A . 20 CYS N 1 1 12 8851 1 1 20 CYS O O -9.139 -3.759 -2.929 1.00 . A A . 20 CYS O 1 1 12 8852 1 1 20 CYS SG S -7.378 -2.643 -4.680 1.00 . A A . 20 CYS SG 1 1 12 8853 1 1 21 ASN C C -10.763 -5.047 -1.464 1.00 . A A . 21 ASN C 1 1 12 8854 1 1 21 ASN CA C -11.008 -3.622 -0.962 1.00 . A A . 21 ASN CA 1 1 12 8855 1 1 21 ASN CB C -12.068 -2.948 -1.835 1.00 . A A . 21 ASN CB 1 1 12 8856 1 1 21 ASN CG C -13.370 -3.749 -1.770 1.00 . A A . 21 ASN CG 1 1 12 8857 1 1 21 ASN H H -9.531 -2.201 -0.308 1.00 . A A . 21 ASN H 1 1 12 8858 1 1 21 ASN HA H -11.357 -3.658 0.059 1.00 . A A . 21 ASN HA 1 1 12 8859 1 1 21 ASN HB2 H -12.243 -1.944 -1.476 1.00 . A A . 21 ASN HB2 1 1 12 8860 1 1 21 ASN HB3 H -11.720 -2.910 -2.856 1.00 . A A . 21 ASN HB3 1 1 12 8861 1 1 21 ASN HD21 H -13.793 -3.179 0.085 1.00 . A A . 21 ASN HD21 1 1 12 8862 1 1 21 ASN HD22 H -14.925 -4.223 -0.629 1.00 . A A . 21 ASN HD22 1 1 12 8863 1 1 21 ASN N N -9.740 -2.836 -1.022 1.00 . A A . 21 ASN N 1 1 12 8864 1 1 21 ASN ND2 N -14.089 -3.714 -0.681 1.00 . A A . 21 ASN ND2 1 1 12 8865 1 1 21 ASN O O -11.264 -5.373 -2.527 1.00 . A A . 21 ASN O 1 1 12 8866 1 1 21 ASN OXT O -10.081 -5.788 -0.775 1.00 . A A . 21 ASN OXT 1 1 12 8867 1 1 21 ASN OD1 O -13.738 -4.412 -2.719 1.00 . A A . 21 ASN OD1 1 1 12 8868 2 2 1 PHE C C 9.429 -1.984 -10.787 1.00 . B B . 1 PHE C 1 1 12 8869 2 2 1 PHE CA C 8.957 -3.022 -11.808 1.00 . B B . 1 PHE CA 1 1 12 8870 2 2 1 PHE CB C 7.450 -3.242 -11.653 1.00 . B B . 1 PHE CB 1 1 12 8871 2 2 1 PHE CD1 C 6.572 -3.887 -13.930 1.00 . B B . 1 PHE CD1 1 1 12 8872 2 2 1 PHE CD2 C 6.960 -5.633 -12.289 1.00 . B B . 1 PHE CD2 1 1 12 8873 2 2 1 PHE CE1 C 6.138 -4.850 -14.852 1.00 . B B . 1 PHE CE1 1 1 12 8874 2 2 1 PHE CE2 C 6.526 -6.595 -13.211 1.00 . B B . 1 PHE CE2 1 1 12 8875 2 2 1 PHE CG C 6.984 -4.279 -12.648 1.00 . B B . 1 PHE CG 1 1 12 8876 2 2 1 PHE CZ C 6.115 -6.204 -14.492 1.00 . B B . 1 PHE CZ 1 1 12 8877 2 2 1 PHE H1 H 9.672 -4.868 -12.447 1.00 . B B . 1 PHE H1 1 1 12 8878 2 2 1 PHE H2 H 9.193 -4.836 -10.817 1.00 . B B . 1 PHE H2 1 1 12 8879 2 2 1 PHE H3 H 10.654 -4.109 -11.292 1.00 . B B . 1 PHE H3 1 1 12 8880 2 2 1 PHE HA H 9.169 -2.667 -12.806 1.00 . B B . 1 PHE HA 1 1 12 8881 2 2 1 PHE HB2 H 7.238 -3.583 -10.650 1.00 . B B . 1 PHE HB2 1 1 12 8882 2 2 1 PHE HB3 H 6.931 -2.313 -11.833 1.00 . B B . 1 PHE HB3 1 1 12 8883 2 2 1 PHE HD1 H 6.590 -2.844 -14.207 1.00 . B B . 1 PHE HD1 1 1 12 8884 2 2 1 PHE HD2 H 7.276 -5.936 -11.301 1.00 . B B . 1 PHE HD2 1 1 12 8885 2 2 1 PHE HE1 H 5.821 -4.549 -15.840 1.00 . B B . 1 PHE HE1 1 1 12 8886 2 2 1 PHE HE2 H 6.508 -7.638 -12.933 1.00 . B B . 1 PHE HE2 1 1 12 8887 2 2 1 PHE HZ H 5.780 -6.946 -15.202 1.00 . B B . 1 PHE HZ 1 1 12 8888 2 2 1 PHE N N 9.673 -4.306 -11.573 1.00 . B B . 1 PHE N 1 1 12 8889 2 2 1 PHE O O 10.213 -1.108 -11.094 1.00 . B B . 1 PHE O 1 1 12 8890 2 2 2 VAL C C 10.072 -1.858 -7.386 1.00 . B B . 2 VAL C 1 1 12 8891 2 2 2 VAL CA C 9.388 -1.104 -8.529 1.00 . B B . 2 VAL CA 1 1 12 8892 2 2 2 VAL CB C 8.162 -0.362 -7.992 1.00 . B B . 2 VAL CB 1 1 12 8893 2 2 2 VAL CG1 C 7.731 0.709 -8.997 1.00 . B B . 2 VAL CG1 1 1 12 8894 2 2 2 VAL CG2 C 7.016 -1.356 -7.788 1.00 . B B . 2 VAL CG2 1 1 12 8895 2 2 2 VAL H H 8.335 -2.797 -9.343 1.00 . B B . 2 VAL H 1 1 12 8896 2 2 2 VAL HA H 10.080 -0.395 -8.959 1.00 . B B . 2 VAL HA 1 1 12 8897 2 2 2 VAL HB H 8.408 0.105 -7.050 1.00 . B B . 2 VAL HB 1 1 12 8898 2 2 2 VAL HG11 H 7.437 1.603 -8.466 1.00 . B B . 2 VAL HG11 1 1 12 8899 2 2 2 VAL HG12 H 6.896 0.344 -9.577 1.00 . B B . 2 VAL HG12 1 1 12 8900 2 2 2 VAL HG13 H 8.555 0.937 -9.656 1.00 . B B . 2 VAL HG13 1 1 12 8901 2 2 2 VAL HG21 H 7.392 -2.247 -7.309 1.00 . B B . 2 VAL HG21 1 1 12 8902 2 2 2 VAL HG22 H 6.588 -1.614 -8.745 1.00 . B B . 2 VAL HG22 1 1 12 8903 2 2 2 VAL HG23 H 6.257 -0.906 -7.165 1.00 . B B . 2 VAL HG23 1 1 12 8904 2 2 2 VAL N N 8.963 -2.080 -9.572 1.00 . B B . 2 VAL N 1 1 12 8905 2 2 2 VAL O O 10.126 -3.072 -7.381 1.00 . B B . 2 VAL O 1 1 12 8906 2 2 3 ASN C C 11.679 -0.842 -4.216 1.00 . B B . 3 ASN C 1 1 12 8907 2 2 3 ASN CA C 11.276 -1.853 -5.288 1.00 . B B . 3 ASN CA 1 1 12 8908 2 2 3 ASN CB C 12.528 -2.551 -5.806 1.00 . B B . 3 ASN CB 1 1 12 8909 2 2 3 ASN CG C 12.353 -4.066 -5.699 1.00 . B B . 3 ASN CG 1 1 12 8910 2 2 3 ASN H H 10.549 -0.179 -6.435 1.00 . B B . 3 ASN H 1 1 12 8911 2 2 3 ASN HA H 10.608 -2.585 -4.866 1.00 . B B . 3 ASN HA 1 1 12 8912 2 2 3 ASN HB2 H 12.684 -2.274 -6.836 1.00 . B B . 3 ASN HB2 1 1 12 8913 2 2 3 ASN HB3 H 13.380 -2.246 -5.218 1.00 . B B . 3 ASN HB3 1 1 12 8914 2 2 3 ASN HD21 H 12.080 -4.315 -7.649 1.00 . B B . 3 ASN HD21 1 1 12 8915 2 2 3 ASN HD22 H 12.018 -5.734 -6.721 1.00 . B B . 3 ASN HD22 1 1 12 8916 2 2 3 ASN N N 10.598 -1.157 -6.418 1.00 . B B . 3 ASN N 1 1 12 8917 2 2 3 ASN ND2 N 12.132 -4.763 -6.779 1.00 . B B . 3 ASN ND2 1 1 12 8918 2 2 3 ASN O O 12.828 -0.763 -3.826 1.00 . B B . 3 ASN O 1 1 12 8919 2 2 3 ASN OD1 O 12.417 -4.622 -4.621 1.00 . B B . 3 ASN OD1 1 1 12 8920 2 2 4 GLN C C 10.148 0.810 -1.500 1.00 . B B . 4 GLN C 1 1 12 8921 2 2 4 GLN CA C 11.097 0.936 -2.696 1.00 . B B . 4 GLN CA 1 1 12 8922 2 2 4 GLN CB C 10.989 2.336 -3.297 1.00 . B B . 4 GLN CB 1 1 12 8923 2 2 4 GLN CD C 12.038 4.600 -3.367 1.00 . B B . 4 GLN CD 1 1 12 8924 2 2 4 GLN CG C 12.149 3.187 -2.793 1.00 . B B . 4 GLN CG 1 1 12 8925 2 2 4 GLN H H 9.837 -0.140 -4.066 1.00 . B B . 4 GLN H 1 1 12 8926 2 2 4 GLN HA H 12.109 0.764 -2.362 1.00 . B B . 4 GLN HA 1 1 12 8927 2 2 4 GLN HB2 H 11.030 2.268 -4.375 1.00 . B B . 4 GLN HB2 1 1 12 8928 2 2 4 GLN HB3 H 10.055 2.787 -2.998 1.00 . B B . 4 GLN HB3 1 1 12 8929 2 2 4 GLN HE21 H 13.203 5.407 -1.976 1.00 . B B . 4 GLN HE21 1 1 12 8930 2 2 4 GLN HE22 H 12.601 6.489 -3.136 1.00 . B B . 4 GLN HE22 1 1 12 8931 2 2 4 GLN HG2 H 12.118 3.229 -1.715 1.00 . B B . 4 GLN HG2 1 1 12 8932 2 2 4 GLN HG3 H 13.081 2.742 -3.110 1.00 . B B . 4 GLN HG3 1 1 12 8933 2 2 4 GLN N N 10.752 -0.067 -3.737 1.00 . B B . 4 GLN N 1 1 12 8934 2 2 4 GLN NE2 N 12.666 5.580 -2.778 1.00 . B B . 4 GLN NE2 1 1 12 8935 2 2 4 GLN O O 9.062 0.279 -1.606 1.00 . B B . 4 GLN O 1 1 12 8936 2 2 4 GLN OE1 O 11.373 4.815 -4.362 1.00 . B B . 4 GLN OE1 1 1 12 8937 2 2 5 HIS C C 8.503 2.122 0.723 1.00 . B B . 5 HIS C 1 1 12 8938 2 2 5 HIS CA C 9.711 1.194 0.860 1.00 . B B . 5 HIS CA 1 1 12 8939 2 2 5 HIS CB C 10.527 1.606 2.086 1.00 . B B . 5 HIS CB 1 1 12 8940 2 2 5 HIS CD2 C 12.531 0.140 2.905 1.00 . B B . 5 HIS CD2 1 1 12 8941 2 2 5 HIS CE1 C 13.842 0.460 1.202 1.00 . B B . 5 HIS CE1 1 1 12 8942 2 2 5 HIS CG C 11.885 0.963 2.024 1.00 . B B . 5 HIS CG 1 1 12 8943 2 2 5 HIS H H 11.451 1.704 -0.299 1.00 . B B . 5 HIS H 1 1 12 8944 2 2 5 HIS HA H 9.370 0.176 0.982 1.00 . B B . 5 HIS HA 1 1 12 8945 2 2 5 HIS HB2 H 10.637 2.679 2.100 1.00 . B B . 5 HIS HB2 1 1 12 8946 2 2 5 HIS HB3 H 10.018 1.285 2.983 1.00 . B B . 5 HIS HB3 1 1 12 8947 2 2 5 HIS HD2 H 12.137 -0.202 3.850 1.00 . B B . 5 HIS HD2 1 1 12 8948 2 2 5 HIS HE1 H 14.693 0.415 0.539 1.00 . B B . 5 HIS HE1 1 1 12 8949 2 2 5 HIS HE2 H 14.452 -0.752 2.794 1.00 . B B . 5 HIS HE2 1 1 12 8950 2 2 5 HIS N N 10.566 1.288 -0.358 1.00 . B B . 5 HIS N 1 1 12 8951 2 2 5 HIS ND1 N 12.726 1.159 0.949 1.00 . B B . 5 HIS ND1 1 1 12 8952 2 2 5 HIS NE2 N 13.769 -0.179 2.387 1.00 . B B . 5 HIS NE2 1 1 12 8953 2 2 5 HIS O O 8.368 2.843 -0.245 1.00 . B B . 5 HIS O 1 1 12 8954 2 2 6 LEU C C 6.056 3.494 3.009 1.00 . B B . 6 LEU C 1 1 12 8955 2 2 6 LEU CA C 6.418 2.984 1.616 1.00 . B B . 6 LEU CA 1 1 12 8956 2 2 6 LEU CB C 5.227 2.168 1.079 1.00 . B B . 6 LEU CB 1 1 12 8957 2 2 6 LEU CD1 C 5.565 3.580 -0.988 1.00 . B B . 6 LEU CD1 1 1 12 8958 2 2 6 LEU CD2 C 3.855 1.789 -0.984 1.00 . B B . 6 LEU CD2 1 1 12 8959 2 2 6 LEU CG C 4.538 2.851 -0.125 1.00 . B B . 6 LEU CG 1 1 12 8960 2 2 6 LEU H H 7.753 1.515 2.452 1.00 . B B . 6 LEU H 1 1 12 8961 2 2 6 LEU HA H 6.633 3.816 0.978 1.00 . B B . 6 LEU HA 1 1 12 8962 2 2 6 LEU HB2 H 5.583 1.196 0.785 1.00 . B B . 6 LEU HB2 1 1 12 8963 2 2 6 LEU HB3 H 4.507 2.047 1.874 1.00 . B B . 6 LEU HB3 1 1 12 8964 2 2 6 LEU HD11 H 6.454 2.973 -1.074 1.00 . B B . 6 LEU HD11 1 1 12 8965 2 2 6 LEU HD12 H 5.815 4.524 -0.530 1.00 . B B . 6 LEU HD12 1 1 12 8966 2 2 6 LEU HD13 H 5.151 3.753 -1.969 1.00 . B B . 6 LEU HD13 1 1 12 8967 2 2 6 LEU HD21 H 3.356 2.267 -1.813 1.00 . B B . 6 LEU HD21 1 1 12 8968 2 2 6 LEU HD22 H 3.131 1.255 -0.387 1.00 . B B . 6 LEU HD22 1 1 12 8969 2 2 6 LEU HD23 H 4.594 1.099 -1.359 1.00 . B B . 6 LEU HD23 1 1 12 8970 2 2 6 LEU HG H 3.784 3.553 0.225 1.00 . B B . 6 LEU HG 1 1 12 8971 2 2 6 LEU N N 7.623 2.106 1.688 1.00 . B B . 6 LEU N 1 1 12 8972 2 2 6 LEU O O 6.536 3.000 4.002 1.00 . B B . 6 LEU O 1 1 12 8973 2 2 7 CYS C C 4.129 6.392 4.210 1.00 . B B . 7 CYS C 1 1 12 8974 2 2 7 CYS CA C 4.769 5.011 4.400 1.00 . B B . 7 CYS CA 1 1 12 8975 2 2 7 CYS CB C 5.983 5.128 5.327 1.00 . B B . 7 CYS CB 1 1 12 8976 2 2 7 CYS H H 4.806 4.838 2.257 1.00 . B B . 7 CYS H 1 1 12 8977 2 2 7 CYS HA H 4.046 4.343 4.843 1.00 . B B . 7 CYS HA 1 1 12 8978 2 2 7 CYS HB2 H 6.878 4.848 4.795 1.00 . B B . 7 CYS HB2 1 1 12 8979 2 2 7 CYS HB3 H 6.076 6.143 5.669 1.00 . B B . 7 CYS HB3 1 1 12 8980 2 2 7 CYS N N 5.191 4.470 3.079 1.00 . B B . 7 CYS N 1 1 12 8981 2 2 7 CYS O O 4.522 7.163 3.352 1.00 . B B . 7 CYS O 1 1 12 8982 2 2 7 CYS SG S 5.751 4.033 6.752 1.00 . B B . 7 CYS SG 1 1 12 8983 2 2 8 GLY C C 1.799 8.164 3.516 1.00 . B B . 8 GLY C 1 1 12 8984 2 2 8 GLY CA C 2.475 8.036 4.884 1.00 . B B . 8 GLY CA 1 1 12 8985 2 2 8 GLY H H 2.844 6.073 5.689 1.00 . B B . 8 GLY H 1 1 12 8986 2 2 8 GLY HA2 H 1.731 8.134 5.662 1.00 . B B . 8 GLY HA2 1 1 12 8987 2 2 8 GLY HA3 H 3.210 8.819 4.990 1.00 . B B . 8 GLY HA3 1 1 12 8988 2 2 8 GLY N N 3.144 6.709 5.007 1.00 . B B . 8 GLY N 1 1 12 8989 2 2 8 GLY O O 1.253 7.214 2.985 1.00 . B B . 8 GLY O 1 1 12 8990 2 2 9 SER C C 1.700 8.516 0.622 1.00 . B B . 9 SER C 1 1 12 8991 2 2 9 SER CA C 1.183 9.549 1.620 1.00 . B B . 9 SER CA 1 1 12 8992 2 2 9 SER CB C 1.513 10.952 1.109 1.00 . B B . 9 SER CB 1 1 12 8993 2 2 9 SER H H 2.266 10.089 3.400 1.00 . B B . 9 SER H 1 1 12 8994 2 2 9 SER HA H 0.119 9.445 1.718 1.00 . B B . 9 SER HA 1 1 12 8995 2 2 9 SER HB2 H 1.182 11.053 0.090 1.00 . B B . 9 SER HB2 1 1 12 8996 2 2 9 SER HB3 H 1.010 11.686 1.724 1.00 . B B . 9 SER HB3 1 1 12 8997 2 2 9 SER HG H 3.133 11.917 0.629 1.00 . B B . 9 SER HG 1 1 12 8998 2 2 9 SER N N 1.826 9.339 2.948 1.00 . B B . 9 SER N 1 1 12 8999 2 2 9 SER O O 0.961 7.998 -0.187 1.00 . B B . 9 SER O 1 1 12 9000 2 2 9 SER OG O 2.919 11.151 1.166 1.00 . B B . 9 SER OG 1 1 12 9001 2 2 10 ASP C C 2.662 5.961 -0.271 1.00 . B B . 10 ASP C 1 1 12 9002 2 2 10 ASP CA C 3.533 7.215 -0.271 1.00 . B B . 10 ASP CA 1 1 12 9003 2 2 10 ASP CB C 4.952 6.856 0.169 1.00 . B B . 10 ASP CB 1 1 12 9004 2 2 10 ASP CG C 5.716 8.134 0.523 1.00 . B B . 10 ASP CG 1 1 12 9005 2 2 10 ASP H H 3.536 8.644 1.345 1.00 . B B . 10 ASP H 1 1 12 9006 2 2 10 ASP HA H 3.559 7.628 -1.267 1.00 . B B . 10 ASP HA 1 1 12 9007 2 2 10 ASP HB2 H 4.906 6.214 1.034 1.00 . B B . 10 ASP HB2 1 1 12 9008 2 2 10 ASP HB3 H 5.461 6.347 -0.635 1.00 . B B . 10 ASP HB3 1 1 12 9009 2 2 10 ASP N N 2.963 8.215 0.677 1.00 . B B . 10 ASP N 1 1 12 9010 2 2 10 ASP O O 2.382 5.384 -1.304 1.00 . B B . 10 ASP O 1 1 12 9011 2 2 10 ASP OD1 O 5.746 9.030 -0.303 1.00 . B B . 10 ASP OD1 1 1 12 9012 2 2 10 ASP OD2 O 6.258 8.193 1.614 1.00 . B B . 10 ASP OD2 1 1 12 9013 2 2 11 LEU C C 0.019 4.600 0.318 1.00 . B B . 11 LEU C 1 1 12 9014 2 2 11 LEU CA C 1.382 4.318 0.952 1.00 . B B . 11 LEU CA 1 1 12 9015 2 2 11 LEU CB C 1.210 3.918 2.422 1.00 . B B . 11 LEU CB 1 1 12 9016 2 2 11 LEU CD1 C 1.880 1.617 1.635 1.00 . B B . 11 LEU CD1 1 1 12 9017 2 2 11 LEU CD2 C 1.196 1.987 3.995 1.00 . B B . 11 LEU CD2 1 1 12 9018 2 2 11 LEU CG C 0.944 2.411 2.550 1.00 . B B . 11 LEU CG 1 1 12 9019 2 2 11 LEU H H 2.469 6.017 1.700 1.00 . B B . 11 LEU H 1 1 12 9020 2 2 11 LEU HA H 1.861 3.522 0.412 1.00 . B B . 11 LEU HA 1 1 12 9021 2 2 11 LEU HB2 H 2.110 4.166 2.965 1.00 . B B . 11 LEU HB2 1 1 12 9022 2 2 11 LEU HB3 H 0.379 4.462 2.845 1.00 . B B . 11 LEU HB3 1 1 12 9023 2 2 11 LEU HD11 H 1.356 1.343 0.731 1.00 . B B . 11 LEU HD11 1 1 12 9024 2 2 11 LEU HD12 H 2.209 0.722 2.144 1.00 . B B . 11 LEU HD12 1 1 12 9025 2 2 11 LEU HD13 H 2.738 2.222 1.385 1.00 . B B . 11 LEU HD13 1 1 12 9026 2 2 11 LEU HD21 H 1.523 0.958 4.014 1.00 . B B . 11 LEU HD21 1 1 12 9027 2 2 11 LEU HD22 H 0.285 2.088 4.564 1.00 . B B . 11 LEU HD22 1 1 12 9028 2 2 11 LEU HD23 H 1.963 2.616 4.423 1.00 . B B . 11 LEU HD23 1 1 12 9029 2 2 11 LEU HG H -0.083 2.203 2.287 1.00 . B B . 11 LEU HG 1 1 12 9030 2 2 11 LEU N N 2.231 5.536 0.880 1.00 . B B . 11 LEU N 1 1 12 9031 2 2 11 LEU O O -0.451 3.847 -0.510 1.00 . B B . 11 LEU O 1 1 12 9032 2 2 12 VAL C C -1.779 6.400 -1.368 1.00 . B B . 12 VAL C 1 1 12 9033 2 2 12 VAL CA C -1.954 5.972 0.091 1.00 . B B . 12 VAL CA 1 1 12 9034 2 2 12 VAL CB C -2.648 7.075 0.901 1.00 . B B . 12 VAL CB 1 1 12 9035 2 2 12 VAL CG1 C -2.261 6.933 2.371 1.00 . B B . 12 VAL CG1 1 1 12 9036 2 2 12 VAL CG2 C -2.222 8.459 0.401 1.00 . B B . 12 VAL CG2 1 1 12 9037 2 2 12 VAL H H -0.234 6.274 1.358 1.00 . B B . 12 VAL H 1 1 12 9038 2 2 12 VAL HA H -2.558 5.080 0.121 1.00 . B B . 12 VAL HA 1 1 12 9039 2 2 12 VAL HB H -3.720 6.969 0.803 1.00 . B B . 12 VAL HB 1 1 12 9040 2 2 12 VAL HG11 H -3.122 7.129 2.989 1.00 . B B . 12 VAL HG11 1 1 12 9041 2 2 12 VAL HG12 H -1.478 7.638 2.606 1.00 . B B . 12 VAL HG12 1 1 12 9042 2 2 12 VAL HG13 H -1.907 5.928 2.551 1.00 . B B . 12 VAL HG13 1 1 12 9043 2 2 12 VAL HG21 H -1.145 8.502 0.335 1.00 . B B . 12 VAL HG21 1 1 12 9044 2 2 12 VAL HG22 H -2.572 9.212 1.091 1.00 . B B . 12 VAL HG22 1 1 12 9045 2 2 12 VAL HG23 H -2.650 8.636 -0.574 1.00 . B B . 12 VAL HG23 1 1 12 9046 2 2 12 VAL N N -0.623 5.672 0.690 1.00 . B B . 12 VAL N 1 1 12 9047 2 2 12 VAL O O -2.539 6.008 -2.232 1.00 . B B . 12 VAL O 1 1 12 9048 2 2 13 GLU C C -0.617 6.373 -3.955 1.00 . B B . 13 GLU C 1 1 12 9049 2 2 13 GLU CA C -0.567 7.619 -3.065 1.00 . B B . 13 GLU CA 1 1 12 9050 2 2 13 GLU CB C 0.791 8.350 -3.184 1.00 . B B . 13 GLU CB 1 1 12 9051 2 2 13 GLU CD C 2.931 8.514 -4.479 1.00 . B B . 13 GLU CD 1 1 12 9052 2 2 13 GLU CG C 1.747 7.609 -4.131 1.00 . B B . 13 GLU CG 1 1 12 9053 2 2 13 GLU H H -0.171 7.490 -0.951 1.00 . B B . 13 GLU H 1 1 12 9054 2 2 13 GLU HA H -1.363 8.291 -3.354 1.00 . B B . 13 GLU HA 1 1 12 9055 2 2 13 GLU HB2 H 0.624 9.347 -3.561 1.00 . B B . 13 GLU HB2 1 1 12 9056 2 2 13 GLU HB3 H 1.244 8.415 -2.207 1.00 . B B . 13 GLU HB3 1 1 12 9057 2 2 13 GLU HG2 H 2.107 6.712 -3.647 1.00 . B B . 13 GLU HG2 1 1 12 9058 2 2 13 GLU HG3 H 1.221 7.342 -5.035 1.00 . B B . 13 GLU HG3 1 1 12 9059 2 2 13 GLU N N -0.780 7.190 -1.656 1.00 . B B . 13 GLU N 1 1 12 9060 2 2 13 GLU O O -1.066 6.418 -5.084 1.00 . B B . 13 GLU O 1 1 12 9061 2 2 13 GLU OE1 O 3.004 9.600 -3.928 1.00 . B B . 13 GLU OE1 1 1 12 9062 2 2 13 GLU OE2 O 3.746 8.106 -5.291 1.00 . B B . 13 GLU OE2 1 1 12 9063 2 2 14 ALA C C -1.566 3.336 -4.016 1.00 . B B . 14 ALA C 1 1 12 9064 2 2 14 ALA CA C -0.215 4.007 -4.246 1.00 . B B . 14 ALA CA 1 1 12 9065 2 2 14 ALA CB C 0.909 3.071 -3.802 1.00 . B B . 14 ALA CB 1 1 12 9066 2 2 14 ALA H H 0.165 5.235 -2.526 1.00 . B B . 14 ALA H 1 1 12 9067 2 2 14 ALA HA H -0.100 4.245 -5.294 1.00 . B B . 14 ALA HA 1 1 12 9068 2 2 14 ALA HB1 H 1.124 2.368 -4.593 1.00 . B B . 14 ALA HB1 1 1 12 9069 2 2 14 ALA HB2 H 0.604 2.535 -2.916 1.00 . B B . 14 ALA HB2 1 1 12 9070 2 2 14 ALA HB3 H 1.795 3.650 -3.586 1.00 . B B . 14 ALA HB3 1 1 12 9071 2 2 14 ALA N N -0.176 5.255 -3.444 1.00 . B B . 14 ALA N 1 1 12 9072 2 2 14 ALA O O -2.288 3.036 -4.942 1.00 . B B . 14 ALA O 1 1 12 9073 2 2 15 LEU C C -4.322 3.217 -3.255 1.00 . B B . 15 LEU C 1 1 12 9074 2 2 15 LEU CA C -3.228 2.478 -2.486 1.00 . B B . 15 LEU CA 1 1 12 9075 2 2 15 LEU CB C -3.495 2.570 -0.982 1.00 . B B . 15 LEU CB 1 1 12 9076 2 2 15 LEU CD1 C -3.075 1.370 1.174 1.00 . B B . 15 LEU CD1 1 1 12 9077 2 2 15 LEU CD2 C -2.340 0.306 -0.963 1.00 . B B . 15 LEU CD2 1 1 12 9078 2 2 15 LEU CG C -2.527 1.643 -0.221 1.00 . B B . 15 LEU CG 1 1 12 9079 2 2 15 LEU H H -1.329 3.372 -2.041 1.00 . B B . 15 LEU H 1 1 12 9080 2 2 15 LEU HA H -3.205 1.447 -2.791 1.00 . B B . 15 LEU HA 1 1 12 9081 2 2 15 LEU HB2 H -3.333 3.590 -0.662 1.00 . B B . 15 LEU HB2 1 1 12 9082 2 2 15 LEU HB3 H -4.521 2.295 -0.770 1.00 . B B . 15 LEU HB3 1 1 12 9083 2 2 15 LEU HD11 H -2.263 1.388 1.887 1.00 . B B . 15 LEU HD11 1 1 12 9084 2 2 15 LEU HD12 H -3.548 0.400 1.191 1.00 . B B . 15 LEU HD12 1 1 12 9085 2 2 15 LEU HD13 H -3.797 2.130 1.431 1.00 . B B . 15 LEU HD13 1 1 12 9086 2 2 15 LEU HD21 H -1.885 0.489 -1.923 1.00 . B B . 15 LEU HD21 1 1 12 9087 2 2 15 LEU HD22 H -3.296 -0.173 -1.104 1.00 . B B . 15 LEU HD22 1 1 12 9088 2 2 15 LEU HD23 H -1.696 -0.343 -0.382 1.00 . B B . 15 LEU HD23 1 1 12 9089 2 2 15 LEU HG H -1.570 2.134 -0.129 1.00 . B B . 15 LEU HG 1 1 12 9090 2 2 15 LEU N N -1.920 3.113 -2.779 1.00 . B B . 15 LEU N 1 1 12 9091 2 2 15 LEU O O -5.236 2.620 -3.790 1.00 . B B . 15 LEU O 1 1 12 9092 2 2 16 TYR C C -5.101 5.066 -5.559 1.00 . B B . 16 TYR C 1 1 12 9093 2 2 16 TYR CA C -5.262 5.295 -4.055 1.00 . B B . 16 TYR CA 1 1 12 9094 2 2 16 TYR CB C -5.082 6.783 -3.756 1.00 . B B . 16 TYR CB 1 1 12 9095 2 2 16 TYR CD1 C -7.541 7.300 -3.559 1.00 . B B . 16 TYR CD1 1 1 12 9096 2 2 16 TYR CD2 C -6.099 7.730 -1.654 1.00 . B B . 16 TYR CD2 1 1 12 9097 2 2 16 TYR CE1 C -8.644 7.762 -2.829 1.00 . B B . 16 TYR CE1 1 1 12 9098 2 2 16 TYR CE2 C -7.202 8.192 -0.924 1.00 . B B . 16 TYR CE2 1 1 12 9099 2 2 16 TYR CG C -6.269 7.284 -2.971 1.00 . B B . 16 TYR CG 1 1 12 9100 2 2 16 TYR CZ C -8.475 8.208 -1.511 1.00 . B B . 16 TYR CZ 1 1 12 9101 2 2 16 TYR H H -3.486 4.978 -2.879 1.00 . B B . 16 TYR H 1 1 12 9102 2 2 16 TYR HA H -6.247 4.980 -3.745 1.00 . B B . 16 TYR HA 1 1 12 9103 2 2 16 TYR HB2 H -4.180 6.928 -3.181 1.00 . B B . 16 TYR HB2 1 1 12 9104 2 2 16 TYR HB3 H -5.009 7.330 -4.683 1.00 . B B . 16 TYR HB3 1 1 12 9105 2 2 16 TYR HD1 H -7.672 6.956 -4.574 1.00 . B B . 16 TYR HD1 1 1 12 9106 2 2 16 TYR HD2 H -5.118 7.717 -1.202 1.00 . B B . 16 TYR HD2 1 1 12 9107 2 2 16 TYR HE1 H -9.624 7.774 -3.281 1.00 . B B . 16 TYR HE1 1 1 12 9108 2 2 16 TYR HE2 H -7.071 8.536 0.091 1.00 . B B . 16 TYR HE2 1 1 12 9109 2 2 16 TYR HH H -10.037 7.898 -0.459 1.00 . B B . 16 TYR HH 1 1 12 9110 2 2 16 TYR N N -4.233 4.515 -3.317 1.00 . B B . 16 TYR N 1 1 12 9111 2 2 16 TYR O O -6.066 5.019 -6.295 1.00 . B B . 16 TYR O 1 1 12 9112 2 2 16 TYR OH O -9.561 8.662 -0.792 1.00 . B B . 16 TYR OH 1 1 12 9113 2 2 17 LEU C C -3.841 3.253 -7.832 1.00 . B B . 17 LEU C 1 1 12 9114 2 2 17 LEU CA C -3.672 4.734 -7.484 1.00 . B B . 17 LEU CA 1 1 12 9115 2 2 17 LEU CB C -2.262 5.255 -7.854 1.00 . B B . 17 LEU CB 1 1 12 9116 2 2 17 LEU CD1 C -1.123 3.053 -8.285 1.00 . B B . 17 LEU CD1 1 1 12 9117 2 2 17 LEU CD2 C -2.491 4.108 -10.099 1.00 . B B . 17 LEU CD2 1 1 12 9118 2 2 17 LEU CG C -1.558 4.379 -8.912 1.00 . B B . 17 LEU CG 1 1 12 9119 2 2 17 LEU H H -3.120 4.990 -5.417 1.00 . B B . 17 LEU H 1 1 12 9120 2 2 17 LEU HA H -4.412 5.304 -8.016 1.00 . B B . 17 LEU HA 1 1 12 9121 2 2 17 LEU HB2 H -2.352 6.258 -8.240 1.00 . B B . 17 LEU HB2 1 1 12 9122 2 2 17 LEU HB3 H -1.656 5.280 -6.960 1.00 . B B . 17 LEU HB3 1 1 12 9123 2 2 17 LEU HD11 H -1.155 3.139 -7.209 1.00 . B B . 17 LEU HD11 1 1 12 9124 2 2 17 LEU HD12 H -0.115 2.820 -8.597 1.00 . B B . 17 LEU HD12 1 1 12 9125 2 2 17 LEU HD13 H -1.790 2.267 -8.605 1.00 . B B . 17 LEU HD13 1 1 12 9126 2 2 17 LEU HD21 H -2.555 3.043 -10.272 1.00 . B B . 17 LEU HD21 1 1 12 9127 2 2 17 LEU HD22 H -2.098 4.591 -10.983 1.00 . B B . 17 LEU HD22 1 1 12 9128 2 2 17 LEU HD23 H -3.473 4.498 -9.883 1.00 . B B . 17 LEU HD23 1 1 12 9129 2 2 17 LEU HG H -0.679 4.900 -9.265 1.00 . B B . 17 LEU HG 1 1 12 9130 2 2 17 LEU N N -3.888 4.939 -6.024 1.00 . B B . 17 LEU N 1 1 12 9131 2 2 17 LEU O O -4.394 2.909 -8.857 1.00 . B B . 17 LEU O 1 1 12 9132 2 2 18 VAL C C -4.995 0.598 -7.487 1.00 . B B . 18 VAL C 1 1 12 9133 2 2 18 VAL CA C -3.518 0.921 -7.295 1.00 . B B . 18 VAL CA 1 1 12 9134 2 2 18 VAL CB C -2.949 0.078 -6.150 1.00 . B B . 18 VAL CB 1 1 12 9135 2 2 18 VAL CG1 C -1.624 0.670 -5.698 1.00 . B B . 18 VAL CG1 1 1 12 9136 2 2 18 VAL CG2 C -3.914 0.069 -4.967 1.00 . B B . 18 VAL CG2 1 1 12 9137 2 2 18 VAL H H -2.935 2.671 -6.173 1.00 . B B . 18 VAL H 1 1 12 9138 2 2 18 VAL HA H -2.985 0.693 -8.204 1.00 . B B . 18 VAL HA 1 1 12 9139 2 2 18 VAL HB H -2.789 -0.933 -6.494 1.00 . B B . 18 VAL HB 1 1 12 9140 2 2 18 VAL HG11 H -1.691 0.935 -4.654 1.00 . B B . 18 VAL HG11 1 1 12 9141 2 2 18 VAL HG12 H -1.410 1.551 -6.283 1.00 . B B . 18 VAL HG12 1 1 12 9142 2 2 18 VAL HG13 H -0.842 -0.059 -5.837 1.00 . B B . 18 VAL HG13 1 1 12 9143 2 2 18 VAL HG21 H -4.173 1.081 -4.708 1.00 . B B . 18 VAL HG21 1 1 12 9144 2 2 18 VAL HG22 H -3.438 -0.408 -4.121 1.00 . B B . 18 VAL HG22 1 1 12 9145 2 2 18 VAL HG23 H -4.805 -0.478 -5.233 1.00 . B B . 18 VAL HG23 1 1 12 9146 2 2 18 VAL N N -3.375 2.375 -6.993 1.00 . B B . 18 VAL N 1 1 12 9147 2 2 18 VAL O O -5.358 -0.252 -8.275 1.00 . B B . 18 VAL O 1 1 12 9148 2 2 19 CYS C C -8.081 2.317 -6.967 1.00 . B B . 19 CYS C 1 1 12 9149 2 2 19 CYS CA C -7.303 1.000 -6.935 1.00 . B B . 19 CYS CA 1 1 12 9150 2 2 19 CYS CB C -7.792 0.138 -5.773 1.00 . B B . 19 CYS CB 1 1 12 9151 2 2 19 CYS H H -5.543 1.960 -6.150 1.00 . B B . 19 CYS H 1 1 12 9152 2 2 19 CYS HA H -7.455 0.470 -7.860 1.00 . B B . 19 CYS HA 1 1 12 9153 2 2 19 CYS HB2 H -7.094 0.212 -4.953 1.00 . B B . 19 CYS HB2 1 1 12 9154 2 2 19 CYS HB3 H -8.763 0.481 -5.452 1.00 . B B . 19 CYS HB3 1 1 12 9155 2 2 19 CYS N N -5.853 1.274 -6.778 1.00 . B B . 19 CYS N 1 1 12 9156 2 2 19 CYS O O -8.840 2.577 -7.879 1.00 . B B . 19 CYS O 1 1 12 9157 2 2 19 CYS SG S -7.906 -1.586 -6.315 1.00 . B B . 19 CYS SG 1 1 12 9158 2 2 20 GLY C C -9.987 4.292 -5.293 1.00 . B B . 20 GLY C 1 1 12 9159 2 2 20 GLY CA C -8.619 4.455 -5.965 1.00 . B B . 20 GLY CA 1 1 12 9160 2 2 20 GLY H H -7.272 2.929 -5.260 1.00 . B B . 20 GLY H 1 1 12 9161 2 2 20 GLY HA2 H -8.035 5.181 -5.418 1.00 . B B . 20 GLY HA2 1 1 12 9162 2 2 20 GLY HA3 H -8.760 4.801 -6.978 1.00 . B B . 20 GLY HA3 1 1 12 9163 2 2 20 GLY N N -7.894 3.154 -5.983 1.00 . B B . 20 GLY N 1 1 12 9164 2 2 20 GLY O O -10.083 3.971 -4.125 1.00 . B B . 20 GLY O 1 1 12 9165 2 2 21 GLU C C -12.577 3.073 -4.705 1.00 . B B . 21 GLU C 1 1 12 9166 2 2 21 GLU CA C -12.414 4.410 -5.436 1.00 . B B . 21 GLU CA 1 1 12 9167 2 2 21 GLU CB C -13.457 4.506 -6.551 1.00 . B B . 21 GLU CB 1 1 12 9168 2 2 21 GLU CD C -14.914 6.293 -7.518 1.00 . B B . 21 GLU CD 1 1 12 9169 2 2 21 GLU CG C -14.450 5.623 -6.223 1.00 . B B . 21 GLU CG 1 1 12 9170 2 2 21 GLU H H -10.939 4.797 -6.960 1.00 . B B . 21 GLU H 1 1 12 9171 2 2 21 GLU HA H -12.569 5.217 -4.737 1.00 . B B . 21 GLU HA 1 1 12 9172 2 2 21 GLU HB2 H -12.964 4.724 -7.488 1.00 . B B . 21 GLU HB2 1 1 12 9173 2 2 21 GLU HB3 H -13.986 3.568 -6.631 1.00 . B B . 21 GLU HB3 1 1 12 9174 2 2 21 GLU HG2 H -15.303 5.206 -5.707 1.00 . B B . 21 GLU HG2 1 1 12 9175 2 2 21 GLU HG3 H -13.971 6.356 -5.592 1.00 . B B . 21 GLU HG3 1 1 12 9176 2 2 21 GLU N N -11.045 4.528 -6.024 1.00 . B B . 21 GLU N 1 1 12 9177 2 2 21 GLU O O -13.446 2.921 -3.870 1.00 . B B . 21 GLU O 1 1 12 9178 2 2 21 GLU OE1 O -14.817 5.662 -8.557 1.00 . B B . 21 GLU OE1 1 1 12 9179 2 2 21 GLU OE2 O -15.361 7.427 -7.447 1.00 . B B . 21 GLU OE2 1 1 12 9180 2 2 22 ARG C C -11.510 0.945 -2.835 1.00 . B B . 22 ARG C 1 1 12 9181 2 2 22 ARG CA C -11.893 0.788 -4.311 1.00 . B B . 22 ARG CA 1 1 12 9182 2 2 22 ARG CB C -10.980 -0.245 -4.975 1.00 . B B . 22 ARG CB 1 1 12 9183 2 2 22 ARG CD C -12.927 -1.112 -6.300 1.00 . B B . 22 ARG CD 1 1 12 9184 2 2 22 ARG CG C -11.797 -1.491 -5.337 1.00 . B B . 22 ARG CG 1 1 12 9185 2 2 22 ARG CZ C -15.114 -1.192 -5.257 1.00 . B B . 22 ARG CZ 1 1 12 9186 2 2 22 ARG H H -11.061 2.234 -5.681 1.00 . B B . 22 ARG H 1 1 12 9187 2 2 22 ARG HA H -12.918 0.453 -4.378 1.00 . B B . 22 ARG HA 1 1 12 9188 2 2 22 ARG HB2 H -10.547 0.178 -5.871 1.00 . B B . 22 ARG HB2 1 1 12 9189 2 2 22 ARG HB3 H -10.191 -0.522 -4.292 1.00 . B B . 22 ARG HB3 1 1 12 9190 2 2 22 ARG HD2 H -13.095 -0.046 -6.261 1.00 . B B . 22 ARG HD2 1 1 12 9191 2 2 22 ARG HD3 H -12.654 -1.396 -7.307 1.00 . B B . 22 ARG HD3 1 1 12 9192 2 2 22 ARG HE H -14.292 -2.770 -6.138 1.00 . B B . 22 ARG HE 1 1 12 9193 2 2 22 ARG HG2 H -11.152 -2.219 -5.808 1.00 . B B . 22 ARG HG2 1 1 12 9194 2 2 22 ARG HG3 H -12.221 -1.914 -4.439 1.00 . B B . 22 ARG HG3 1 1 12 9195 2 2 22 ARG HH11 H -14.882 0.516 -6.275 1.00 . B B . 22 ARG HH11 1 1 12 9196 2 2 22 ARG HH12 H -16.107 0.533 -5.051 1.00 . B B . 22 ARG HH12 1 1 12 9197 2 2 22 ARG HH21 H -15.571 -2.753 -4.090 1.00 . B B . 22 ARG HH21 1 1 12 9198 2 2 22 ARG HH22 H -16.500 -1.317 -3.817 1.00 . B B . 22 ARG HH22 1 1 12 9199 2 2 22 ARG N N -11.759 2.102 -5.004 1.00 . B B . 22 ARG N 1 1 12 9200 2 2 22 ARG NE N -14.176 -1.825 -5.908 1.00 . B B . 22 ARG NE 1 1 12 9201 2 2 22 ARG NH1 N -15.390 0.049 -5.551 1.00 . B B . 22 ARG NH1 1 1 12 9202 2 2 22 ARG NH2 N -15.780 -1.802 -4.315 1.00 . B B . 22 ARG NH2 1 1 12 9203 2 2 22 ARG O O -11.654 0.031 -2.046 1.00 . B B . 22 ARG O 1 1 12 9204 2 2 23 GLY C C -9.552 1.326 -0.634 1.00 . B B . 23 GLY C 1 1 12 9205 2 2 23 GLY CA C -10.647 2.315 -1.028 1.00 . B B . 23 GLY CA 1 1 12 9206 2 2 23 GLY H H -10.923 2.825 -3.100 1.00 . B B . 23 GLY H 1 1 12 9207 2 2 23 GLY HA2 H -10.282 3.325 -0.904 1.00 . B B . 23 GLY HA2 1 1 12 9208 2 2 23 GLY HA3 H -11.509 2.164 -0.397 1.00 . B B . 23 GLY HA3 1 1 12 9209 2 2 23 GLY N N -11.030 2.099 -2.453 1.00 . B B . 23 GLY N 1 1 12 9210 2 2 23 GLY O O -9.449 0.246 -1.181 1.00 . B B . 23 GLY O 1 1 12 9211 2 2 24 PHE C C -7.797 0.447 2.231 1.00 . B B . 24 PHE C 1 1 12 9212 2 2 24 PHE CA C -7.643 0.766 0.743 1.00 . B B . 24 PHE CA 1 1 12 9213 2 2 24 PHE CB C -6.286 1.428 0.499 1.00 . B B . 24 PHE CB 1 1 12 9214 2 2 24 PHE CD1 C -6.994 3.694 -0.363 1.00 . B B . 24 PHE CD1 1 1 12 9215 2 2 24 PHE CD2 C -5.932 3.551 1.815 1.00 . B B . 24 PHE CD2 1 1 12 9216 2 2 24 PHE CE1 C -7.102 5.084 -0.218 1.00 . B B . 24 PHE CE1 1 1 12 9217 2 2 24 PHE CE2 C -6.038 4.941 1.959 1.00 . B B . 24 PHE CE2 1 1 12 9218 2 2 24 PHE CG C -6.409 2.927 0.654 1.00 . B B . 24 PHE CG 1 1 12 9219 2 2 24 PHE CZ C -6.623 5.708 0.942 1.00 . B B . 24 PHE CZ 1 1 12 9220 2 2 24 PHE H H -8.831 2.562 0.743 1.00 . B B . 24 PHE H 1 1 12 9221 2 2 24 PHE HA H -7.703 -0.149 0.173 1.00 . B B . 24 PHE HA 1 1 12 9222 2 2 24 PHE HB2 H -5.570 1.051 1.214 1.00 . B B . 24 PHE HB2 1 1 12 9223 2 2 24 PHE HB3 H -5.953 1.196 -0.500 1.00 . B B . 24 PHE HB3 1 1 12 9224 2 2 24 PHE HD1 H -7.362 3.213 -1.257 1.00 . B B . 24 PHE HD1 1 1 12 9225 2 2 24 PHE HD2 H -5.481 2.960 2.599 1.00 . B B . 24 PHE HD2 1 1 12 9226 2 2 24 PHE HE1 H -7.554 5.675 -1.001 1.00 . B B . 24 PHE HE1 1 1 12 9227 2 2 24 PHE HE2 H -5.673 5.421 2.855 1.00 . B B . 24 PHE HE2 1 1 12 9228 2 2 24 PHE HZ H -6.700 6.780 1.052 1.00 . B B . 24 PHE HZ 1 1 12 9229 2 2 24 PHE N N -8.732 1.686 0.314 1.00 . B B . 24 PHE N 1 1 12 9230 2 2 24 PHE O O -8.495 1.128 2.955 1.00 . B B . 24 PHE O 1 1 12 9231 2 2 25 PHE C C -5.973 -0.562 4.855 1.00 . B B . 25 PHE C 1 1 12 9232 2 2 25 PHE CA C -7.259 -0.958 4.129 1.00 . B B . 25 PHE CA 1 1 12 9233 2 2 25 PHE CB C -7.468 -2.469 4.247 1.00 . B B . 25 PHE CB 1 1 12 9234 2 2 25 PHE CD1 C -7.970 -1.856 6.656 1.00 . B B . 25 PHE CD1 1 1 12 9235 2 2 25 PHE CD2 C -8.315 -4.146 5.928 1.00 . B B . 25 PHE CD2 1 1 12 9236 2 2 25 PHE CE1 C -8.396 -2.202 7.945 1.00 . B B . 25 PHE CE1 1 1 12 9237 2 2 25 PHE CE2 C -8.741 -4.491 7.217 1.00 . B B . 25 PHE CE2 1 1 12 9238 2 2 25 PHE CG C -7.929 -2.829 5.645 1.00 . B B . 25 PHE CG 1 1 12 9239 2 2 25 PHE CZ C -8.781 -3.519 8.225 1.00 . B B . 25 PHE CZ 1 1 12 9240 2 2 25 PHE H H -6.596 -1.127 2.089 1.00 . B B . 25 PHE H 1 1 12 9241 2 2 25 PHE HA H -8.098 -0.442 4.572 1.00 . B B . 25 PHE HA 1 1 12 9242 2 2 25 PHE HB2 H -8.215 -2.782 3.533 1.00 . B B . 25 PHE HB2 1 1 12 9243 2 2 25 PHE HB3 H -6.538 -2.975 4.036 1.00 . B B . 25 PHE HB3 1 1 12 9244 2 2 25 PHE HD1 H -7.673 -0.840 6.440 1.00 . B B . 25 PHE HD1 1 1 12 9245 2 2 25 PHE HD2 H -8.284 -4.895 5.151 1.00 . B B . 25 PHE HD2 1 1 12 9246 2 2 25 PHE HE1 H -8.427 -1.453 8.722 1.00 . B B . 25 PHE HE1 1 1 12 9247 2 2 25 PHE HE2 H -9.038 -5.506 7.434 1.00 . B B . 25 PHE HE2 1 1 12 9248 2 2 25 PHE HZ H -9.110 -3.785 9.219 1.00 . B B . 25 PHE HZ 1 1 12 9249 2 2 25 PHE N N -7.151 -0.589 2.691 1.00 . B B . 25 PHE N 1 1 12 9250 2 2 25 PHE O O -5.101 -1.376 5.085 1.00 . B B . 25 PHE O 1 1 12 9251 2 2 26 TYR C C -4.696 0.707 7.397 1.00 . B B . 26 TYR C 1 1 12 9252 2 2 26 TYR CA C -4.619 1.137 5.929 1.00 . B B . 26 TYR CA 1 1 12 9253 2 2 26 TYR CB C -4.521 2.661 5.836 1.00 . B B . 26 TYR CB 1 1 12 9254 2 2 26 TYR CD1 C -2.049 2.491 6.314 1.00 . B B . 26 TYR CD1 1 1 12 9255 2 2 26 TYR CD2 C -3.335 4.244 7.391 1.00 . B B . 26 TYR CD2 1 1 12 9256 2 2 26 TYR CE1 C -0.890 2.947 6.958 1.00 . B B . 26 TYR CE1 1 1 12 9257 2 2 26 TYR CE2 C -2.179 4.699 8.035 1.00 . B B . 26 TYR CE2 1 1 12 9258 2 2 26 TYR CG C -3.271 3.141 6.531 1.00 . B B . 26 TYR CG 1 1 12 9259 2 2 26 TYR CZ C -0.956 4.051 7.819 1.00 . B B . 26 TYR CZ 1 1 12 9260 2 2 26 TYR H H -6.564 1.325 5.021 1.00 . B B . 26 TYR H 1 1 12 9261 2 2 26 TYR HA H -3.751 0.691 5.466 1.00 . B B . 26 TYR HA 1 1 12 9262 2 2 26 TYR HB2 H -4.490 2.956 4.797 1.00 . B B . 26 TYR HB2 1 1 12 9263 2 2 26 TYR HB3 H -5.384 3.105 6.307 1.00 . B B . 26 TYR HB3 1 1 12 9264 2 2 26 TYR HD1 H -1.999 1.640 5.650 1.00 . B B . 26 TYR HD1 1 1 12 9265 2 2 26 TYR HD2 H -4.278 4.744 7.558 1.00 . B B . 26 TYR HD2 1 1 12 9266 2 2 26 TYR HE1 H 0.052 2.447 6.791 1.00 . B B . 26 TYR HE1 1 1 12 9267 2 2 26 TYR HE2 H -2.230 5.550 8.698 1.00 . B B . 26 TYR HE2 1 1 12 9268 2 2 26 TYR HH H 0.669 5.054 7.835 1.00 . B B . 26 TYR HH 1 1 12 9269 2 2 26 TYR N N -5.848 0.685 5.217 1.00 . B B . 26 TYR N 1 1 12 9270 2 2 26 TYR O O -5.759 0.646 7.980 1.00 . B B . 26 TYR O 1 1 12 9271 2 2 26 TYR OH O 0.185 4.500 8.453 1.00 . B B . 26 TYR OH 1 1 12 9272 2 2 27 THR C C -3.143 1.133 10.319 1.00 . B B . 27 THR C 1 1 12 9273 2 2 27 THR CA C -3.585 -0.030 9.426 1.00 . B B . 27 THR CA 1 1 12 9274 2 2 27 THR CB C -2.620 -1.203 9.605 1.00 . B B . 27 THR CB 1 1 12 9275 2 2 27 THR CG2 C -2.777 -2.179 8.438 1.00 . B B . 27 THR CG2 1 1 12 9276 2 2 27 THR H H -2.729 0.455 7.508 1.00 . B B . 27 THR H 1 1 12 9277 2 2 27 THR HA H -4.583 -0.338 9.704 1.00 . B B . 27 THR HA 1 1 12 9278 2 2 27 THR HB H -2.841 -1.715 10.529 1.00 . B B . 27 THR HB 1 1 12 9279 2 2 27 THR HG1 H -0.701 -1.459 9.788 1.00 . B B . 27 THR HG1 1 1 12 9280 2 2 27 THR HG21 H -3.737 -2.026 7.968 1.00 . B B . 27 THR HG21 1 1 12 9281 2 2 27 THR HG22 H -2.712 -3.192 8.805 1.00 . B B . 27 THR HG22 1 1 12 9282 2 2 27 THR HG23 H -1.992 -2.006 7.717 1.00 . B B . 27 THR HG23 1 1 12 9283 2 2 27 THR N N -3.576 0.403 7.998 1.00 . B B . 27 THR N 1 1 12 9284 2 2 27 THR O O -2.046 1.640 10.194 1.00 . B B . 27 THR O 1 1 12 9285 2 2 27 THR OG1 O -1.287 -0.714 9.641 1.00 . B B . 27 THR OG1 1 1 12 9286 2 2 28 LYS C C -3.187 2.206 13.486 1.00 . B B . 28 LYS C 1 1 12 9287 2 2 28 LYS CA C -3.615 2.703 12.103 1.00 . B B . 28 LYS CA 1 1 12 9288 2 2 28 LYS CB C -4.811 3.642 12.292 1.00 . B B . 28 LYS CB 1 1 12 9289 2 2 28 LYS CD C -3.567 5.065 10.576 1.00 . B B . 28 LYS CD 1 1 12 9290 2 2 28 LYS CE C -2.126 5.337 11.020 1.00 . B B . 28 LYS CE 1 1 12 9291 2 2 28 LYS CG C -4.489 5.072 11.810 1.00 . B B . 28 LYS CG 1 1 12 9292 2 2 28 LYS H H -4.873 1.151 11.291 1.00 . B B . 28 LYS H 1 1 12 9293 2 2 28 LYS HA H -2.799 3.241 11.661 1.00 . B B . 28 LYS HA 1 1 12 9294 2 2 28 LYS HB2 H -5.666 3.252 11.759 1.00 . B B . 28 LYS HB2 1 1 12 9295 2 2 28 LYS HB3 H -5.052 3.677 13.346 1.00 . B B . 28 LYS HB3 1 1 12 9296 2 2 28 LYS HD2 H -3.617 4.105 10.084 1.00 . B B . 28 LYS HD2 1 1 12 9297 2 2 28 LYS HD3 H -3.876 5.839 9.886 1.00 . B B . 28 LYS HD3 1 1 12 9298 2 2 28 LYS HE2 H -2.066 5.282 12.096 1.00 . B B . 28 LYS HE2 1 1 12 9299 2 2 28 LYS HE3 H -1.470 4.598 10.584 1.00 . B B . 28 LYS HE3 1 1 12 9300 2 2 28 LYS HG2 H -5.411 5.573 11.559 1.00 . B B . 28 LYS HG2 1 1 12 9301 2 2 28 LYS HG3 H -4.003 5.608 12.611 1.00 . B B . 28 LYS HG3 1 1 12 9302 2 2 28 LYS HZ1 H -1.638 7.326 11.391 1.00 . B B . 28 LYS HZ1 1 1 12 9303 2 2 28 LYS HZ2 H -2.427 7.070 9.908 1.00 . B B . 28 LYS HZ2 1 1 12 9304 2 2 28 LYS HZ3 H -0.794 6.637 10.091 1.00 . B B . 28 LYS HZ3 1 1 12 9305 2 2 28 LYS N N -3.990 1.566 11.214 1.00 . B B . 28 LYS N 1 1 12 9306 2 2 28 LYS NZ N -1.715 6.695 10.568 1.00 . B B . 28 LYS NZ 1 1 12 9307 2 2 28 LYS O O -2.087 2.484 13.921 1.00 . B B . 28 LYS O 1 1 12 9308 2 2 29 PRO C C -2.982 -0.240 15.500 1.00 . B B . 29 PRO C 1 1 12 9309 2 2 29 PRO CA C -3.813 1.045 15.527 1.00 . B B . 29 PRO CA 1 1 12 9310 2 2 29 PRO CB C -5.212 0.784 16.081 1.00 . B B . 29 PRO CB 1 1 12 9311 2 2 29 PRO CD C -5.424 1.169 13.652 1.00 . B B . 29 PRO CD 1 1 12 9312 2 2 29 PRO CG C -6.133 0.549 14.865 1.00 . B B . 29 PRO CG 1 1 12 9313 2 2 29 PRO HA H -3.323 1.805 16.112 1.00 . B B . 29 PRO HA 1 1 12 9314 2 2 29 PRO HB2 H -5.204 -0.082 16.725 1.00 . B B . 29 PRO HB2 1 1 12 9315 2 2 29 PRO HB3 H -5.554 1.652 16.620 1.00 . B B . 29 PRO HB3 1 1 12 9316 2 2 29 PRO HD2 H -5.349 0.441 12.856 1.00 . B B . 29 PRO HD2 1 1 12 9317 2 2 29 PRO HD3 H -5.953 2.043 13.323 1.00 . B B . 29 PRO HD3 1 1 12 9318 2 2 29 PRO HG2 H -6.280 -0.512 14.711 1.00 . B B . 29 PRO HG2 1 1 12 9319 2 2 29 PRO HG3 H -7.083 1.036 15.020 1.00 . B B . 29 PRO HG3 1 1 12 9320 2 2 29 PRO N N -4.080 1.527 14.165 1.00 . B B . 29 PRO N 1 1 12 9321 2 2 29 PRO O O -2.020 -0.382 16.230 1.00 . B B . 29 PRO O 1 1 12 9322 2 2 30 THR C C -2.700 -3.062 13.217 1.00 . B B . 30 THR C 1 1 12 9323 2 2 30 THR CA C -2.571 -2.448 14.611 1.00 . B B . 30 THR CA 1 1 12 9324 2 2 30 THR CB C -3.117 -3.426 15.654 1.00 . B B . 30 THR CB 1 1 12 9325 2 2 30 THR CG2 C -2.167 -4.617 15.785 1.00 . B B . 30 THR CG2 1 1 12 9326 2 2 30 THR H H -4.125 -1.048 14.093 1.00 . B B . 30 THR H 1 1 12 9327 2 2 30 THR HA H -1.531 -2.245 14.819 1.00 . B B . 30 THR HA 1 1 12 9328 2 2 30 THR HB H -4.090 -3.777 15.345 1.00 . B B . 30 THR HB 1 1 12 9329 2 2 30 THR HG1 H -3.956 -2.141 16.851 1.00 . B B . 30 THR HG1 1 1 12 9330 2 2 30 THR HG21 H -1.658 -4.570 16.737 1.00 . B B . 30 THR HG21 1 1 12 9331 2 2 30 THR HG22 H -1.441 -4.588 14.986 1.00 . B B . 30 THR HG22 1 1 12 9332 2 2 30 THR HG23 H -2.732 -5.536 15.725 1.00 . B B . 30 THR HG23 1 1 12 9333 2 2 30 THR N N -3.344 -1.177 14.672 1.00 . B B . 30 THR N 1 1 12 9334 2 2 30 THR O O -1.757 -2.947 12.451 1.00 . B B . 30 THR O 1 1 12 9335 2 2 30 THR OXT O -3.738 -3.639 12.939 1.00 . B B . 30 THR OXT 1 1 12 9336 2 2 30 THR OG1 O -3.228 -2.764 16.907 1.00 . B B . 30 THR OG1 1 1 13 9337 1 1 1 GLY C C 0.638 -4.169 8.281 1.00 . A A . 1 GLY C 1 1 13 9338 1 1 1 GLY CA C -0.049 -4.421 9.580 1.00 . A A . 1 GLY CA 1 1 13 9339 1 1 1 GLY H1 H -0.073 -5.623 11.322 1.00 . A A . 1 GLY H1 1 1 13 9340 1 1 1 GLY H2 H 1.372 -4.754 11.112 1.00 . A A . 1 GLY H2 1 1 13 9341 1 1 1 GLY H3 H 1.059 -6.128 10.162 1.00 . A A . 1 GLY H3 1 1 13 9342 1 1 1 GLY HA2 H -0.669 -4.936 9.031 1.00 . A A . 1 GLY HA2 1 1 13 9343 1 1 1 GLY HA3 H -0.567 -3.547 10.154 1.00 . A A . 1 GLY HA3 1 1 13 9344 1 1 1 GLY N N 0.632 -5.302 10.628 1.00 . A A . 1 GLY N 1 1 13 9345 1 1 1 GLY O O 1.811 -4.444 8.126 1.00 . A A . 1 GLY O 1 1 13 9346 1 1 2 ILE C C 1.639 -2.291 6.151 1.00 . A A . 2 ILE C 1 1 13 9347 1 1 2 ILE CA C 0.570 -3.378 5.994 1.00 . A A . 2 ILE CA 1 1 13 9348 1 1 2 ILE CB C -0.506 -2.946 4.973 1.00 . A A . 2 ILE CB 1 1 13 9349 1 1 2 ILE CD1 C -0.288 -2.764 2.486 1.00 . A A . 2 ILE CD1 1 1 13 9350 1 1 2 ILE CG1 C 0.128 -2.153 3.822 1.00 . A A . 2 ILE CG1 1 1 13 9351 1 1 2 ILE CG2 C -1.559 -2.072 5.655 1.00 . A A . 2 ILE CG2 1 1 13 9352 1 1 2 ILE H H -1.013 -3.437 7.458 1.00 . A A . 2 ILE H 1 1 13 9353 1 1 2 ILE HA H 1.043 -4.278 5.649 1.00 . A A . 2 ILE HA 1 1 13 9354 1 1 2 ILE HB H -0.986 -3.829 4.576 1.00 . A A . 2 ILE HB 1 1 13 9355 1 1 2 ILE HD11 H -1.295 -2.457 2.249 1.00 . A A . 2 ILE HD11 1 1 13 9356 1 1 2 ILE HD12 H -0.244 -3.840 2.553 1.00 . A A . 2 ILE HD12 1 1 13 9357 1 1 2 ILE HD13 H 0.385 -2.423 1.712 1.00 . A A . 2 ILE HD13 1 1 13 9358 1 1 2 ILE HG12 H -0.206 -1.127 3.865 1.00 . A A . 2 ILE HG12 1 1 13 9359 1 1 2 ILE HG13 H 1.196 -2.186 3.906 1.00 . A A . 2 ILE HG13 1 1 13 9360 1 1 2 ILE HG21 H -2.236 -2.697 6.219 1.00 . A A . 2 ILE HG21 1 1 13 9361 1 1 2 ILE HG22 H -2.113 -1.527 4.904 1.00 . A A . 2 ILE HG22 1 1 13 9362 1 1 2 ILE HG23 H -1.074 -1.374 6.320 1.00 . A A . 2 ILE HG23 1 1 13 9363 1 1 2 ILE N N -0.067 -3.646 7.315 1.00 . A A . 2 ILE N 1 1 13 9364 1 1 2 ILE O O 2.720 -2.389 5.611 1.00 . A A . 2 ILE O 1 1 13 9365 1 1 3 ABA C C 3.708 -0.767 7.396 1.00 . A A . 3 ABA C 1 1 13 9366 1 1 3 ABA CA C 2.342 -0.177 7.080 1.00 . A A . 3 ABA CA 1 1 13 9367 1 1 3 ABA CB C 1.894 0.703 8.240 1.00 . A A . 3 ABA CB 1 1 13 9368 1 1 3 ABA CG C 0.836 1.692 7.754 1.00 . A A . 3 ABA CG 1 1 13 9369 1 1 3 ABA H H 0.486 -1.210 7.324 1.00 . A A . 3 ABA H 1 1 13 9370 1 1 3 ABA HA H 2.407 0.413 6.186 1.00 . A A . 3 ABA HA 1 1 13 9371 1 1 3 ABA HB2 H 1.482 0.083 9.021 1.00 . A A . 3 ABA HB2 1 1 13 9372 1 1 3 ABA HB3 H 2.738 1.242 8.621 1.00 . A A . 3 ABA HB3 1 1 13 9373 1 1 3 ABA HG1 H 0.516 2.310 8.579 1.00 . A A . 3 ABA HG1 1 1 13 9374 1 1 3 ABA HG2 H -0.010 1.148 7.361 1.00 . A A . 3 ABA HG2 1 1 13 9375 1 1 3 ABA HG3 H 1.256 2.315 6.978 1.00 . A A . 3 ABA HG3 1 1 13 9376 1 1 3 ABA N N 1.351 -1.266 6.889 1.00 . A A . 3 ABA N 1 1 13 9377 1 1 3 ABA O O 4.609 -0.741 6.590 1.00 . A A . 3 ABA O 1 1 13 9378 1 1 4 GLU C C 5.806 -2.628 7.810 1.00 . A A . 4 GLU C 1 1 13 9379 1 1 4 GLU CA C 5.165 -1.874 8.983 1.00 . A A . 4 GLU CA 1 1 13 9380 1 1 4 GLU CB C 4.926 -2.843 10.138 1.00 . A A . 4 GLU CB 1 1 13 9381 1 1 4 GLU CD C 5.977 -3.511 12.304 1.00 . A A . 4 GLU CD 1 1 13 9382 1 1 4 GLU CG C 5.637 -2.332 11.392 1.00 . A A . 4 GLU CG 1 1 13 9383 1 1 4 GLU H H 3.111 -1.276 9.202 1.00 . A A . 4 GLU H 1 1 13 9384 1 1 4 GLU HA H 5.829 -1.088 9.310 1.00 . A A . 4 GLU HA 1 1 13 9385 1 1 4 GLU HB2 H 3.865 -2.918 10.330 1.00 . A A . 4 GLU HB2 1 1 13 9386 1 1 4 GLU HB3 H 5.312 -3.812 9.874 1.00 . A A . 4 GLU HB3 1 1 13 9387 1 1 4 GLU HG2 H 6.546 -1.821 11.108 1.00 . A A . 4 GLU HG2 1 1 13 9388 1 1 4 GLU HG3 H 4.989 -1.648 11.919 1.00 . A A . 4 GLU HG3 1 1 13 9389 1 1 4 GLU N N 3.861 -1.284 8.574 1.00 . A A . 4 GLU N 1 1 13 9390 1 1 4 GLU O O 6.832 -2.232 7.293 1.00 . A A . 4 GLU O 1 1 13 9391 1 1 4 GLU OE1 O 5.055 -4.152 12.780 1.00 . A A . 4 GLU OE1 1 1 13 9392 1 1 4 GLU OE2 O 7.155 -3.752 12.513 1.00 . A A . 4 GLU OE2 1 1 13 9393 1 1 5 GLN C C 5.967 -3.610 5.029 1.00 . A A . 5 GLN C 1 1 13 9394 1 1 5 GLN CA C 5.789 -4.503 6.261 1.00 . A A . 5 GLN CA 1 1 13 9395 1 1 5 GLN CB C 4.841 -5.654 5.916 1.00 . A A . 5 GLN CB 1 1 13 9396 1 1 5 GLN CD C 6.341 -7.446 6.799 1.00 . A A . 5 GLN CD 1 1 13 9397 1 1 5 GLN CG C 5.657 -6.895 5.547 1.00 . A A . 5 GLN CG 1 1 13 9398 1 1 5 GLN H H 4.390 -4.017 7.829 1.00 . A A . 5 GLN H 1 1 13 9399 1 1 5 GLN HA H 6.747 -4.904 6.555 1.00 . A A . 5 GLN HA 1 1 13 9400 1 1 5 GLN HB2 H 4.215 -5.873 6.770 1.00 . A A . 5 GLN HB2 1 1 13 9401 1 1 5 GLN HB3 H 4.221 -5.370 5.079 1.00 . A A . 5 GLN HB3 1 1 13 9402 1 1 5 GLN HE21 H 4.725 -7.257 7.938 1.00 . A A . 5 GLN HE21 1 1 13 9403 1 1 5 GLN HE22 H 6.093 -7.890 8.719 1.00 . A A . 5 GLN HE22 1 1 13 9404 1 1 5 GLN HG2 H 5.002 -7.647 5.132 1.00 . A A . 5 GLN HG2 1 1 13 9405 1 1 5 GLN HG3 H 6.407 -6.628 4.818 1.00 . A A . 5 GLN HG3 1 1 13 9406 1 1 5 GLN N N 5.213 -3.714 7.393 1.00 . A A . 5 GLN N 1 1 13 9407 1 1 5 GLN NE2 N 5.663 -7.539 7.911 1.00 . A A . 5 GLN NE2 1 1 13 9408 1 1 5 GLN O O 7.001 -3.615 4.390 1.00 . A A . 5 GLN O 1 1 13 9409 1 1 5 GLN OE1 O 7.504 -7.795 6.766 1.00 . A A . 5 GLN OE1 1 1 13 9410 1 1 6 CYS C C 5.702 -0.619 3.886 1.00 . A A . 6 CYS C 1 1 13 9411 1 1 6 CYS CA C 5.062 -1.950 3.503 1.00 . A A . 6 CYS CA 1 1 13 9412 1 1 6 CYS CB C 3.663 -1.711 2.932 1.00 . A A . 6 CYS CB 1 1 13 9413 1 1 6 CYS H H 4.147 -2.865 5.230 1.00 . A A . 6 CYS H 1 1 13 9414 1 1 6 CYS HA H 5.678 -2.430 2.739 1.00 . A A . 6 CYS HA 1 1 13 9415 1 1 6 CYS HB2 H 2.924 -2.028 3.631 1.00 . A A . 6 CYS HB2 1 1 13 9416 1 1 6 CYS HB3 H 3.523 -0.673 2.722 1.00 . A A . 6 CYS HB3 1 1 13 9417 1 1 6 CYS N N 4.966 -2.849 4.694 1.00 . A A . 6 CYS N 1 1 13 9418 1 1 6 CYS O O 5.605 0.356 3.168 1.00 . A A . 6 CYS O 1 1 13 9419 1 1 6 CYS SG S 3.498 -2.660 1.421 1.00 . A A . 6 CYS SG 1 1 13 9420 1 1 7 CYS C C 8.468 0.403 5.831 1.00 . A A . 7 CYS C 1 1 13 9421 1 1 7 CYS CA C 7.024 0.696 5.413 1.00 . A A . 7 CYS CA 1 1 13 9422 1 1 7 CYS CB C 6.251 1.342 6.565 1.00 . A A . 7 CYS CB 1 1 13 9423 1 1 7 CYS H H 6.440 -1.371 5.560 1.00 . A A . 7 CYS H 1 1 13 9424 1 1 7 CYS HA H 7.036 1.368 4.574 1.00 . A A . 7 CYS HA 1 1 13 9425 1 1 7 CYS HB2 H 5.238 1.542 6.250 1.00 . A A . 7 CYS HB2 1 1 13 9426 1 1 7 CYS HB3 H 6.234 0.677 7.410 1.00 . A A . 7 CYS HB3 1 1 13 9427 1 1 7 CYS N N 6.367 -0.572 5.001 1.00 . A A . 7 CYS N 1 1 13 9428 1 1 7 CYS O O 9.346 1.227 5.675 1.00 . A A . 7 CYS O 1 1 13 9429 1 1 7 CYS SG S 7.064 2.896 7.024 1.00 . A A . 7 CYS SG 1 1 13 9430 1 1 8 THR C C 10.678 -2.072 5.634 1.00 . A A . 8 THR C 1 1 13 9431 1 1 8 THR CA C 10.120 -1.134 6.707 1.00 . A A . 8 THR CA 1 1 13 9432 1 1 8 THR CB C 10.121 -1.840 8.066 1.00 . A A . 8 THR CB 1 1 13 9433 1 1 8 THR CG2 C 9.434 -0.952 9.104 1.00 . A A . 8 THR CG2 1 1 13 9434 1 1 8 THR H H 8.018 -1.442 6.418 1.00 . A A . 8 THR H 1 1 13 9435 1 1 8 THR HA H 10.724 -0.239 6.759 1.00 . A A . 8 THR HA 1 1 13 9436 1 1 8 THR HB H 11.138 -2.028 8.375 1.00 . A A . 8 THR HB 1 1 13 9437 1 1 8 THR HG1 H 10.040 -3.737 7.646 1.00 . A A . 8 THR HG1 1 1 13 9438 1 1 8 THR HG21 H 9.920 -1.075 10.061 1.00 . A A . 8 THR HG21 1 1 13 9439 1 1 8 THR HG22 H 8.395 -1.234 9.188 1.00 . A A . 8 THR HG22 1 1 13 9440 1 1 8 THR HG23 H 9.503 0.081 8.796 1.00 . A A . 8 THR HG23 1 1 13 9441 1 1 8 THR N N 8.729 -0.778 6.325 1.00 . A A . 8 THR N 1 1 13 9442 1 1 8 THR O O 11.820 -2.484 5.682 1.00 . A A . 8 THR O 1 1 13 9443 1 1 8 THR OG1 O 9.422 -3.072 7.957 1.00 . A A . 8 THR OG1 1 1 13 9444 1 1 9 SER C C 9.967 -2.699 2.211 1.00 . A A . 9 SER C 1 1 13 9445 1 1 9 SER CA C 10.328 -3.318 3.573 1.00 . A A . 9 SER CA 1 1 13 9446 1 1 9 SER CB C 9.650 -4.679 3.737 1.00 . A A . 9 SER CB 1 1 13 9447 1 1 9 SER H H 8.952 -2.065 4.643 1.00 . A A . 9 SER H 1 1 13 9448 1 1 9 SER HA H 11.399 -3.439 3.639 1.00 . A A . 9 SER HA 1 1 13 9449 1 1 9 SER HB2 H 8.637 -4.626 3.374 1.00 . A A . 9 SER HB2 1 1 13 9450 1 1 9 SER HB3 H 10.195 -5.423 3.169 1.00 . A A . 9 SER HB3 1 1 13 9451 1 1 9 SER HG H 9.085 -4.396 5.576 1.00 . A A . 9 SER HG 1 1 13 9452 1 1 9 SER N N 9.868 -2.411 4.659 1.00 . A A . 9 SER N 1 1 13 9453 1 1 9 SER O O 10.327 -1.575 1.926 1.00 . A A . 9 SER O 1 1 13 9454 1 1 9 SER OG O 9.634 -5.033 5.113 1.00 . A A . 9 SER OG 1 1 13 9455 1 1 10 ILE C C 7.521 -3.318 -0.403 1.00 . A A . 10 ILE C 1 1 13 9456 1 1 10 ILE CA C 8.920 -2.840 0.028 1.00 . A A . 10 ILE CA 1 1 13 9457 1 1 10 ILE CB C 9.986 -3.295 -0.988 1.00 . A A . 10 ILE CB 1 1 13 9458 1 1 10 ILE CD1 C 12.247 -2.406 -0.419 1.00 . A A . 10 ILE CD1 1 1 13 9459 1 1 10 ILE CG1 C 10.977 -2.158 -1.234 1.00 . A A . 10 ILE CG1 1 1 13 9460 1 1 10 ILE CG2 C 9.341 -3.707 -2.313 1.00 . A A . 10 ILE CG2 1 1 13 9461 1 1 10 ILE H H 8.990 -4.321 1.588 1.00 . A A . 10 ILE H 1 1 13 9462 1 1 10 ILE HA H 8.925 -1.762 0.091 1.00 . A A . 10 ILE HA 1 1 13 9463 1 1 10 ILE HB H 10.520 -4.136 -0.582 1.00 . A A . 10 ILE HB 1 1 13 9464 1 1 10 ILE HD11 H 12.610 -3.405 -0.611 1.00 . A A . 10 ILE HD11 1 1 13 9465 1 1 10 ILE HD12 H 12.026 -2.299 0.633 1.00 . A A . 10 ILE HD12 1 1 13 9466 1 1 10 ILE HD13 H 13.003 -1.688 -0.702 1.00 . A A . 10 ILE HD13 1 1 13 9467 1 1 10 ILE HG12 H 11.224 -2.117 -2.285 1.00 . A A . 10 ILE HG12 1 1 13 9468 1 1 10 ILE HG13 H 10.534 -1.226 -0.930 1.00 . A A . 10 ILE HG13 1 1 13 9469 1 1 10 ILE HG21 H 8.564 -4.435 -2.121 1.00 . A A . 10 ILE HG21 1 1 13 9470 1 1 10 ILE HG22 H 10.087 -4.141 -2.955 1.00 . A A . 10 ILE HG22 1 1 13 9471 1 1 10 ILE HG23 H 8.911 -2.840 -2.787 1.00 . A A . 10 ILE HG23 1 1 13 9472 1 1 10 ILE N N 9.271 -3.413 1.360 1.00 . A A . 10 ILE N 1 1 13 9473 1 1 10 ILE O O 6.929 -4.183 0.212 1.00 . A A . 10 ILE O 1 1 13 9474 1 1 11 CYS C C 5.560 -3.049 -3.476 1.00 . A A . 11 CYS C 1 1 13 9475 1 1 11 CYS CA C 5.647 -3.178 -1.960 1.00 . A A . 11 CYS CA 1 1 13 9476 1 1 11 CYS CB C 4.577 -2.282 -1.354 1.00 . A A . 11 CYS CB 1 1 13 9477 1 1 11 CYS H H 7.497 -2.063 -1.952 1.00 . A A . 11 CYS H 1 1 13 9478 1 1 11 CYS HA H 5.458 -4.199 -1.673 1.00 . A A . 11 CYS HA 1 1 13 9479 1 1 11 CYS HB2 H 4.510 -1.365 -1.922 1.00 . A A . 11 CYS HB2 1 1 13 9480 1 1 11 CYS HB3 H 3.625 -2.790 -1.376 1.00 . A A . 11 CYS HB3 1 1 13 9481 1 1 11 CYS N N 6.999 -2.758 -1.472 1.00 . A A . 11 CYS N 1 1 13 9482 1 1 11 CYS O O 5.786 -1.993 -4.033 1.00 . A A . 11 CYS O 1 1 13 9483 1 1 11 CYS SG S 5.019 -1.906 0.344 1.00 . A A . 11 CYS SG 1 1 13 9484 1 1 12 SER C C 3.694 -3.353 -5.916 1.00 . A A . 12 SER C 1 1 13 9485 1 1 12 SER CA C 5.036 -4.006 -5.623 1.00 . A A . 12 SER CA 1 1 13 9486 1 1 12 SER CB C 5.097 -5.390 -6.265 1.00 . A A . 12 SER CB 1 1 13 9487 1 1 12 SER H H 4.975 -4.935 -3.682 1.00 . A A . 12 SER H 1 1 13 9488 1 1 12 SER HA H 5.823 -3.385 -6.028 1.00 . A A . 12 SER HA 1 1 13 9489 1 1 12 SER HB2 H 4.344 -5.463 -7.032 1.00 . A A . 12 SER HB2 1 1 13 9490 1 1 12 SER HB3 H 6.071 -5.529 -6.710 1.00 . A A . 12 SER HB3 1 1 13 9491 1 1 12 SER HG H 5.216 -7.215 -5.605 1.00 . A A . 12 SER HG 1 1 13 9492 1 1 12 SER N N 5.187 -4.101 -4.149 1.00 . A A . 12 SER N 1 1 13 9493 1 1 12 SER O O 2.752 -3.466 -5.157 1.00 . A A . 12 SER O 1 1 13 9494 1 1 12 SER OG O 4.857 -6.386 -5.281 1.00 . A A . 12 SER OG 1 1 13 9495 1 1 13 LEU C C 1.184 -2.949 -7.432 1.00 . A A . 13 LEU C 1 1 13 9496 1 1 13 LEU CA C 2.342 -1.954 -7.346 1.00 . A A . 13 LEU CA 1 1 13 9497 1 1 13 LEU CB C 2.515 -1.261 -8.693 1.00 . A A . 13 LEU CB 1 1 13 9498 1 1 13 LEU CD1 C 2.244 -1.948 -11.071 1.00 . A A . 13 LEU CD1 1 1 13 9499 1 1 13 LEU CD2 C 4.396 -2.382 -9.892 1.00 . A A . 13 LEU CD2 1 1 13 9500 1 1 13 LEU CG C 2.876 -2.314 -9.734 1.00 . A A . 13 LEU CG 1 1 13 9501 1 1 13 LEU H H 4.395 -2.567 -7.579 1.00 . A A . 13 LEU H 1 1 13 9502 1 1 13 LEU HA H 2.119 -1.222 -6.591 1.00 . A A . 13 LEU HA 1 1 13 9503 1 1 13 LEU HB2 H 1.592 -0.774 -8.972 1.00 . A A . 13 LEU HB2 1 1 13 9504 1 1 13 LEU HB3 H 3.308 -0.532 -8.628 1.00 . A A . 13 LEU HB3 1 1 13 9505 1 1 13 LEU HD11 H 2.413 -2.746 -11.778 1.00 . A A . 13 LEU HD11 1 1 13 9506 1 1 13 LEU HD12 H 2.691 -1.037 -11.441 1.00 . A A . 13 LEU HD12 1 1 13 9507 1 1 13 LEU HD13 H 1.183 -1.801 -10.939 1.00 . A A . 13 LEU HD13 1 1 13 9508 1 1 13 LEU HD21 H 4.647 -2.422 -10.941 1.00 . A A . 13 LEU HD21 1 1 13 9509 1 1 13 LEU HD22 H 4.769 -3.267 -9.398 1.00 . A A . 13 LEU HD22 1 1 13 9510 1 1 13 LEU HD23 H 4.843 -1.506 -9.447 1.00 . A A . 13 LEU HD23 1 1 13 9511 1 1 13 LEU HG H 2.503 -3.272 -9.407 1.00 . A A . 13 LEU HG 1 1 13 9512 1 1 13 LEU N N 3.611 -2.651 -6.998 1.00 . A A . 13 LEU N 1 1 13 9513 1 1 13 LEU O O 0.029 -2.567 -7.431 1.00 . A A . 13 LEU O 1 1 13 9514 1 1 14 TYR C C 0.158 -5.726 -6.143 1.00 . A A . 14 TYR C 1 1 13 9515 1 1 14 TYR CA C 0.348 -5.195 -7.539 1.00 . A A . 14 TYR CA 1 1 13 9516 1 1 14 TYR CB C 0.701 -6.330 -8.501 1.00 . A A . 14 TYR CB 1 1 13 9517 1 1 14 TYR CD1 C -0.622 -8.164 -7.387 1.00 . A A . 14 TYR CD1 1 1 13 9518 1 1 14 TYR CD2 C -1.230 -7.483 -9.635 1.00 . A A . 14 TYR CD2 1 1 13 9519 1 1 14 TYR CE1 C -1.654 -9.111 -7.394 1.00 . A A . 14 TYR CE1 1 1 13 9520 1 1 14 TYR CE2 C -2.262 -8.430 -9.643 1.00 . A A . 14 TYR CE2 1 1 13 9521 1 1 14 TYR CG C -0.410 -7.350 -8.507 1.00 . A A . 14 TYR CG 1 1 13 9522 1 1 14 TYR CZ C -2.474 -9.244 -8.523 1.00 . A A . 14 TYR CZ 1 1 13 9523 1 1 14 TYR H H 2.393 -4.532 -7.439 1.00 . A A . 14 TYR H 1 1 13 9524 1 1 14 TYR HA H -0.552 -4.696 -7.856 1.00 . A A . 14 TYR HA 1 1 13 9525 1 1 14 TYR HB2 H 0.830 -5.930 -9.496 1.00 . A A . 14 TYR HB2 1 1 13 9526 1 1 14 TYR HB3 H 1.619 -6.801 -8.180 1.00 . A A . 14 TYR HB3 1 1 13 9527 1 1 14 TYR HD1 H 0.010 -8.061 -6.517 1.00 . A A . 14 TYR HD1 1 1 13 9528 1 1 14 TYR HD2 H -1.066 -6.855 -10.499 1.00 . A A . 14 TYR HD2 1 1 13 9529 1 1 14 TYR HE1 H -1.817 -9.739 -6.531 1.00 . A A . 14 TYR HE1 1 1 13 9530 1 1 14 TYR HE2 H -2.894 -8.533 -10.513 1.00 . A A . 14 TYR HE2 1 1 13 9531 1 1 14 TYR HH H -3.186 -10.950 -8.048 1.00 . A A . 14 TYR HH 1 1 13 9532 1 1 14 TYR N N 1.462 -4.219 -7.477 1.00 . A A . 14 TYR N 1 1 13 9533 1 1 14 TYR O O -0.934 -6.026 -5.703 1.00 . A A . 14 TYR O 1 1 13 9534 1 1 14 TYR OH O -3.490 -10.178 -8.531 1.00 . A A . 14 TYR OH 1 1 13 9535 1 1 15 GLN C C 0.353 -5.214 -3.271 1.00 . A A . 15 GLN C 1 1 13 9536 1 1 15 GLN CA C 1.178 -6.236 -4.040 1.00 . A A . 15 GLN CA 1 1 13 9537 1 1 15 GLN CB C 2.602 -6.256 -3.518 1.00 . A A . 15 GLN CB 1 1 13 9538 1 1 15 GLN CD C 2.551 -8.369 -2.189 1.00 . A A . 15 GLN CD 1 1 13 9539 1 1 15 GLN CG C 3.104 -7.697 -3.447 1.00 . A A . 15 GLN CG 1 1 13 9540 1 1 15 GLN H H 2.085 -5.504 -5.819 1.00 . A A . 15 GLN H 1 1 13 9541 1 1 15 GLN HA H 0.731 -7.215 -3.969 1.00 . A A . 15 GLN HA 1 1 13 9542 1 1 15 GLN HB2 H 3.226 -5.688 -4.197 1.00 . A A . 15 GLN HB2 1 1 13 9543 1 1 15 GLN HB3 H 2.632 -5.809 -2.542 1.00 . A A . 15 GLN HB3 1 1 13 9544 1 1 15 GLN HE21 H 3.397 -10.123 -2.579 1.00 . A A . 15 GLN HE21 1 1 13 9545 1 1 15 GLN HE22 H 2.482 -10.061 -1.151 1.00 . A A . 15 GLN HE22 1 1 13 9546 1 1 15 GLN HG2 H 2.768 -8.235 -4.323 1.00 . A A . 15 GLN HG2 1 1 13 9547 1 1 15 GLN HG3 H 4.183 -7.700 -3.413 1.00 . A A . 15 GLN HG3 1 1 13 9548 1 1 15 GLN N N 1.231 -5.790 -5.434 1.00 . A A . 15 GLN N 1 1 13 9549 1 1 15 GLN NE2 N 2.834 -9.622 -1.953 1.00 . A A . 15 GLN NE2 1 1 13 9550 1 1 15 GLN O O -0.389 -5.539 -2.364 1.00 . A A . 15 GLN O 1 1 13 9551 1 1 15 GLN OE1 O 1.853 -7.748 -1.412 1.00 . A A . 15 GLN OE1 1 1 13 9552 1 1 16 LEU C C -1.724 -2.942 -3.595 1.00 . A A . 16 LEU C 1 1 13 9553 1 1 16 LEU CA C -0.333 -2.915 -2.995 1.00 . A A . 16 LEU CA 1 1 13 9554 1 1 16 LEU CB C 0.336 -1.569 -3.251 1.00 . A A . 16 LEU CB 1 1 13 9555 1 1 16 LEU CD1 C 2.312 -0.181 -2.615 1.00 . A A . 16 LEU CD1 1 1 13 9556 1 1 16 LEU CD2 C 1.444 -1.930 -1.053 1.00 . A A . 16 LEU CD2 1 1 13 9557 1 1 16 LEU CG C 1.675 -1.561 -2.520 1.00 . A A . 16 LEU CG 1 1 13 9558 1 1 16 LEU H H 1.036 -3.737 -4.421 1.00 . A A . 16 LEU H 1 1 13 9559 1 1 16 LEU HA H -0.384 -3.106 -1.931 1.00 . A A . 16 LEU HA 1 1 13 9560 1 1 16 LEU HB2 H 0.495 -1.433 -4.310 1.00 . A A . 16 LEU HB2 1 1 13 9561 1 1 16 LEU HB3 H -0.286 -0.779 -2.880 1.00 . A A . 16 LEU HB3 1 1 13 9562 1 1 16 LEU HD11 H 3.121 -0.111 -1.904 1.00 . A A . 16 LEU HD11 1 1 13 9563 1 1 16 LEU HD12 H 1.572 0.572 -2.397 1.00 . A A . 16 LEU HD12 1 1 13 9564 1 1 16 LEU HD13 H 2.697 -0.034 -3.614 1.00 . A A . 16 LEU HD13 1 1 13 9565 1 1 16 LEU HD21 H 2.044 -1.294 -0.422 1.00 . A A . 16 LEU HD21 1 1 13 9566 1 1 16 LEU HD22 H 1.720 -2.962 -0.895 1.00 . A A . 16 LEU HD22 1 1 13 9567 1 1 16 LEU HD23 H 0.399 -1.798 -0.811 1.00 . A A . 16 LEU HD23 1 1 13 9568 1 1 16 LEU HG H 2.332 -2.287 -2.970 1.00 . A A . 16 LEU HG 1 1 13 9569 1 1 16 LEU N N 0.456 -3.971 -3.661 1.00 . A A . 16 LEU N 1 1 13 9570 1 1 16 LEU O O -2.698 -2.558 -2.977 1.00 . A A . 16 LEU O 1 1 13 9571 1 1 17 GLU C C -3.940 -4.625 -4.754 1.00 . A A . 17 GLU C 1 1 13 9572 1 1 17 GLU CA C -3.138 -3.525 -5.452 1.00 . A A . 17 GLU CA 1 1 13 9573 1 1 17 GLU CB C -2.930 -3.904 -6.920 1.00 . A A . 17 GLU CB 1 1 13 9574 1 1 17 GLU CD C -4.050 -4.107 -9.144 1.00 . A A . 17 GLU CD 1 1 13 9575 1 1 17 GLU CG C -4.279 -3.929 -7.642 1.00 . A A . 17 GLU CG 1 1 13 9576 1 1 17 GLU H H -1.020 -3.750 -5.267 1.00 . A A . 17 GLU H 1 1 13 9577 1 1 17 GLU HA H -3.652 -2.581 -5.383 1.00 . A A . 17 GLU HA 1 1 13 9578 1 1 17 GLU HB2 H -2.280 -3.183 -7.388 1.00 . A A . 17 GLU HB2 1 1 13 9579 1 1 17 GLU HB3 H -2.473 -4.881 -6.977 1.00 . A A . 17 GLU HB3 1 1 13 9580 1 1 17 GLU HG2 H -4.872 -4.751 -7.268 1.00 . A A . 17 GLU HG2 1 1 13 9581 1 1 17 GLU HG3 H -4.799 -3.001 -7.467 1.00 . A A . 17 GLU HG3 1 1 13 9582 1 1 17 GLU N N -1.821 -3.428 -4.798 1.00 . A A . 17 GLU N 1 1 13 9583 1 1 17 GLU O O -5.153 -4.650 -4.787 1.00 . A A . 17 GLU O 1 1 13 9584 1 1 17 GLU OE1 O -3.164 -3.453 -9.668 1.00 . A A . 17 GLU OE1 1 1 13 9585 1 1 17 GLU OE2 O -4.764 -4.894 -9.743 1.00 . A A . 17 GLU OE2 1 1 13 9586 1 1 18 ASN C C -4.614 -6.172 -2.141 1.00 . A A . 18 ASN C 1 1 13 9587 1 1 18 ASN CA C -3.970 -6.661 -3.438 1.00 . A A . 18 ASN CA 1 1 13 9588 1 1 18 ASN CB C -2.965 -7.769 -3.114 1.00 . A A . 18 ASN CB 1 1 13 9589 1 1 18 ASN CG C -3.682 -9.119 -3.061 1.00 . A A . 18 ASN CG 1 1 13 9590 1 1 18 ASN H H -2.276 -5.502 -4.107 1.00 . A A . 18 ASN H 1 1 13 9591 1 1 18 ASN HA H -4.734 -7.053 -4.092 1.00 . A A . 18 ASN HA 1 1 13 9592 1 1 18 ASN HB2 H -2.203 -7.796 -3.880 1.00 . A A . 18 ASN HB2 1 1 13 9593 1 1 18 ASN HB3 H -2.506 -7.569 -2.158 1.00 . A A . 18 ASN HB3 1 1 13 9594 1 1 18 ASN HD21 H -2.603 -9.790 -1.534 1.00 . A A . 18 ASN HD21 1 1 13 9595 1 1 18 ASN HD22 H -3.776 -10.867 -2.121 1.00 . A A . 18 ASN HD22 1 1 13 9596 1 1 18 ASN N N -3.259 -5.544 -4.123 1.00 . A A . 18 ASN N 1 1 13 9597 1 1 18 ASN ND2 N -3.325 -9.998 -2.164 1.00 . A A . 18 ASN ND2 1 1 13 9598 1 1 18 ASN O O -5.247 -6.932 -1.436 1.00 . A A . 18 ASN O 1 1 13 9599 1 1 18 ASN OD1 O -4.575 -9.379 -3.843 1.00 . A A . 18 ASN OD1 1 1 13 9600 1 1 19 TYR C C -6.285 -3.554 -0.812 1.00 . A A . 19 TYR C 1 1 13 9601 1 1 19 TYR CA C -5.061 -4.432 -0.537 1.00 . A A . 19 TYR CA 1 1 13 9602 1 1 19 TYR CB C -4.025 -3.632 0.252 1.00 . A A . 19 TYR CB 1 1 13 9603 1 1 19 TYR CD1 C -1.979 -5.051 -0.124 1.00 . A A . 19 TYR CD1 1 1 13 9604 1 1 19 TYR CD2 C -2.946 -4.965 2.099 1.00 . A A . 19 TYR CD2 1 1 13 9605 1 1 19 TYR CE1 C -0.987 -5.925 0.340 1.00 . A A . 19 TYR CE1 1 1 13 9606 1 1 19 TYR CE2 C -1.955 -5.839 2.564 1.00 . A A . 19 TYR CE2 1 1 13 9607 1 1 19 TYR CG C -2.957 -4.571 0.755 1.00 . A A . 19 TYR CG 1 1 13 9608 1 1 19 TYR CZ C -0.975 -6.319 1.685 1.00 . A A . 19 TYR CZ 1 1 13 9609 1 1 19 TYR H H -3.934 -4.319 -2.373 1.00 . A A . 19 TYR H 1 1 13 9610 1 1 19 TYR HA H -5.367 -5.281 0.054 1.00 . A A . 19 TYR HA 1 1 13 9611 1 1 19 TYR HB2 H -3.579 -2.885 -0.387 1.00 . A A . 19 TYR HB2 1 1 13 9612 1 1 19 TYR HB3 H -4.504 -3.152 1.091 1.00 . A A . 19 TYR HB3 1 1 13 9613 1 1 19 TYR HD1 H -1.991 -4.747 -1.160 1.00 . A A . 19 TYR HD1 1 1 13 9614 1 1 19 TYR HD2 H -3.703 -4.596 2.778 1.00 . A A . 19 TYR HD2 1 1 13 9615 1 1 19 TYR HE1 H -0.233 -6.295 -0.339 1.00 . A A . 19 TYR HE1 1 1 13 9616 1 1 19 TYR HE2 H -1.946 -6.142 3.601 1.00 . A A . 19 TYR HE2 1 1 13 9617 1 1 19 TYR HH H 0.802 -7.016 1.639 1.00 . A A . 19 TYR HH 1 1 13 9618 1 1 19 TYR N N -4.455 -4.924 -1.805 1.00 . A A . 19 TYR N 1 1 13 9619 1 1 19 TYR O O -6.688 -2.782 0.035 1.00 . A A . 19 TYR O 1 1 13 9620 1 1 19 TYR OH O 0.001 -7.179 2.143 1.00 . A A . 19 TYR OH 1 1 13 9621 1 1 20 CYS C C -9.075 -2.982 -1.033 1.00 . A A . 20 CYS C 1 1 13 9622 1 1 20 CYS CA C -8.098 -2.793 -2.197 1.00 . A A . 20 CYS CA 1 1 13 9623 1 1 20 CYS CB C -8.802 -3.167 -3.506 1.00 . A A . 20 CYS CB 1 1 13 9624 1 1 20 CYS H H -6.585 -4.279 -2.649 1.00 . A A . 20 CYS H 1 1 13 9625 1 1 20 CYS HA H -7.790 -1.759 -2.235 1.00 . A A . 20 CYS HA 1 1 13 9626 1 1 20 CYS HB2 H -9.405 -4.047 -3.355 1.00 . A A . 20 CYS HB2 1 1 13 9627 1 1 20 CYS HB3 H -9.438 -2.350 -3.807 1.00 . A A . 20 CYS HB3 1 1 13 9628 1 1 20 CYS N N -6.898 -3.653 -1.963 1.00 . A A . 20 CYS N 1 1 13 9629 1 1 20 CYS O O -8.866 -3.804 -0.163 1.00 . A A . 20 CYS O 1 1 13 9630 1 1 20 CYS SG S -7.587 -3.484 -4.803 1.00 . A A . 20 CYS SG 1 1 13 9631 1 1 21 ASN C C -12.422 -2.981 -0.453 1.00 . A A . 21 ASN C 1 1 13 9632 1 1 21 ASN CA C -11.131 -2.371 0.096 1.00 . A A . 21 ASN CA 1 1 13 9633 1 1 21 ASN CB C -11.431 -0.991 0.688 1.00 . A A . 21 ASN CB 1 1 13 9634 1 1 21 ASN CG C -12.068 -1.151 2.070 1.00 . A A . 21 ASN CG 1 1 13 9635 1 1 21 ASN H H -10.294 -1.575 -1.722 1.00 . A A . 21 ASN H 1 1 13 9636 1 1 21 ASN HA H -10.726 -3.013 0.864 1.00 . A A . 21 ASN HA 1 1 13 9637 1 1 21 ASN HB2 H -10.511 -0.431 0.777 1.00 . A A . 21 ASN HB2 1 1 13 9638 1 1 21 ASN HB3 H -12.113 -0.463 0.039 1.00 . A A . 21 ASN HB3 1 1 13 9639 1 1 21 ASN HD21 H -10.328 -1.194 3.027 1.00 . A A . 21 ASN HD21 1 1 13 9640 1 1 21 ASN HD22 H -11.702 -1.334 4.014 1.00 . A A . 21 ASN HD22 1 1 13 9641 1 1 21 ASN N N -10.142 -2.231 -1.011 1.00 . A A . 21 ASN N 1 1 13 9642 1 1 21 ASN ND2 N -11.303 -1.234 3.124 1.00 . A A . 21 ASN ND2 1 1 13 9643 1 1 21 ASN O O -12.727 -2.731 -1.608 1.00 . A A . 21 ASN O 1 1 13 9644 1 1 21 ASN OXT O -13.083 -3.688 0.289 1.00 . A A . 21 ASN OXT 1 1 13 9645 1 1 21 ASN OD1 O -13.276 -1.199 2.193 1.00 . A A . 21 ASN OD1 1 1 13 9646 2 2 1 PHE C C 9.269 -0.615 -10.708 1.00 . B B . 1 PHE C 1 1 13 9647 2 2 1 PHE CA C 9.359 -1.708 -11.775 1.00 . B B . 1 PHE CA 1 1 13 9648 2 2 1 PHE CB C 9.586 -1.064 -13.149 1.00 . B B . 1 PHE CB 1 1 13 9649 2 2 1 PHE CD1 C 7.496 0.247 -13.677 1.00 . B B . 1 PHE CD1 1 1 13 9650 2 2 1 PHE CD2 C 7.826 -1.908 -14.744 1.00 . B B . 1 PHE CD2 1 1 13 9651 2 2 1 PHE CE1 C 6.277 0.395 -14.352 1.00 . B B . 1 PHE CE1 1 1 13 9652 2 2 1 PHE CE2 C 6.607 -1.760 -15.419 1.00 . B B . 1 PHE CE2 1 1 13 9653 2 2 1 PHE CG C 8.270 -0.904 -13.873 1.00 . B B . 1 PHE CG 1 1 13 9654 2 2 1 PHE CZ C 5.832 -0.609 -15.223 1.00 . B B . 1 PHE CZ 1 1 13 9655 2 2 1 PHE H1 H 7.281 -1.861 -11.721 1.00 . B B . 1 PHE H1 1 1 13 9656 2 2 1 PHE H2 H 8.091 -3.152 -10.969 1.00 . B B . 1 PHE H2 1 1 13 9657 2 2 1 PHE H3 H 8.036 -3.051 -12.664 1.00 . B B . 1 PHE H3 1 1 13 9658 2 2 1 PHE HA H 10.189 -2.361 -11.546 1.00 . B B . 1 PHE HA 1 1 13 9659 2 2 1 PHE HB2 H 10.042 -0.093 -13.018 1.00 . B B . 1 PHE HB2 1 1 13 9660 2 2 1 PHE HB3 H 10.243 -1.691 -13.734 1.00 . B B . 1 PHE HB3 1 1 13 9661 2 2 1 PHE HD1 H 7.838 1.020 -13.006 1.00 . B B . 1 PHE HD1 1 1 13 9662 2 2 1 PHE HD2 H 8.423 -2.795 -14.895 1.00 . B B . 1 PHE HD2 1 1 13 9663 2 2 1 PHE HE1 H 5.679 1.282 -14.201 1.00 . B B . 1 PHE HE1 1 1 13 9664 2 2 1 PHE HE2 H 6.265 -2.534 -16.090 1.00 . B B . 1 PHE HE2 1 1 13 9665 2 2 1 PHE HZ H 4.893 -0.495 -15.744 1.00 . B B . 1 PHE HZ 1 1 13 9666 2 2 1 PHE N N 8.096 -2.503 -11.783 1.00 . B B . 1 PHE N 1 1 13 9667 2 2 1 PHE O O 8.834 0.489 -10.969 1.00 . B B . 1 PHE O 1 1 13 9668 2 2 2 VAL C C 10.597 -0.308 -7.306 1.00 . B B . 2 VAL C 1 1 13 9669 2 2 2 VAL CA C 9.628 0.099 -8.416 1.00 . B B . 2 VAL CA 1 1 13 9670 2 2 2 VAL CB C 8.207 0.185 -7.842 1.00 . B B . 2 VAL CB 1 1 13 9671 2 2 2 VAL CG1 C 7.486 1.390 -8.446 1.00 . B B . 2 VAL CG1 1 1 13 9672 2 2 2 VAL CG2 C 7.428 -1.093 -8.175 1.00 . B B . 2 VAL CG2 1 1 13 9673 2 2 2 VAL H H 10.030 -1.813 -9.323 1.00 . B B . 2 VAL H 1 1 13 9674 2 2 2 VAL HA H 9.916 1.063 -8.808 1.00 . B B . 2 VAL HA 1 1 13 9675 2 2 2 VAL HB H 8.262 0.304 -6.769 1.00 . B B . 2 VAL HB 1 1 13 9676 2 2 2 VAL HG11 H 7.245 1.185 -9.478 1.00 . B B . 2 VAL HG11 1 1 13 9677 2 2 2 VAL HG12 H 8.127 2.257 -8.390 1.00 . B B . 2 VAL HG12 1 1 13 9678 2 2 2 VAL HG13 H 6.576 1.579 -7.894 1.00 . B B . 2 VAL HG13 1 1 13 9679 2 2 2 VAL HG21 H 7.511 -1.300 -9.232 1.00 . B B . 2 VAL HG21 1 1 13 9680 2 2 2 VAL HG22 H 6.388 -0.959 -7.915 1.00 . B B . 2 VAL HG22 1 1 13 9681 2 2 2 VAL HG23 H 7.835 -1.920 -7.613 1.00 . B B . 2 VAL HG23 1 1 13 9682 2 2 2 VAL N N 9.682 -0.916 -9.508 1.00 . B B . 2 VAL N 1 1 13 9683 2 2 2 VAL O O 11.726 0.139 -7.257 1.00 . B B . 2 VAL O 1 1 13 9684 2 2 3 ASN C C 11.296 -0.419 -4.391 1.00 . B B . 3 ASN C 1 1 13 9685 2 2 3 ASN CA C 11.045 -1.599 -5.318 1.00 . B B . 3 ASN CA 1 1 13 9686 2 2 3 ASN CB C 12.359 -2.093 -5.902 1.00 . B B . 3 ASN CB 1 1 13 9687 2 2 3 ASN CG C 12.127 -2.667 -7.303 1.00 . B B . 3 ASN CG 1 1 13 9688 2 2 3 ASN H H 9.268 -1.502 -6.468 1.00 . B B . 3 ASN H 1 1 13 9689 2 2 3 ASN HA H 10.570 -2.395 -4.773 1.00 . B B . 3 ASN HA 1 1 13 9690 2 2 3 ASN HB2 H 13.052 -1.272 -5.960 1.00 . B B . 3 ASN HB2 1 1 13 9691 2 2 3 ASN HB3 H 12.754 -2.860 -5.267 1.00 . B B . 3 ASN HB3 1 1 13 9692 2 2 3 ASN HD21 H 10.834 -4.038 -6.680 1.00 . B B . 3 ASN HD21 1 1 13 9693 2 2 3 ASN HD22 H 11.145 -4.039 -8.349 1.00 . B B . 3 ASN HD22 1 1 13 9694 2 2 3 ASN N N 10.164 -1.157 -6.415 1.00 . B B . 3 ASN N 1 1 13 9695 2 2 3 ASN ND2 N 11.300 -3.664 -7.457 1.00 . B B . 3 ASN ND2 1 1 13 9696 2 2 3 ASN O O 12.311 0.242 -4.472 1.00 . B B . 3 ASN O 1 1 13 9697 2 2 3 ASN OD1 O 12.704 -2.202 -8.266 1.00 . B B . 3 ASN OD1 1 1 13 9698 2 2 4 GLN C C 9.709 0.881 -1.361 1.00 . B B . 4 GLN C 1 1 13 9699 2 2 4 GLN CA C 10.549 1.039 -2.636 1.00 . B B . 4 GLN CA 1 1 13 9700 2 2 4 GLN CB C 10.112 2.278 -3.415 1.00 . B B . 4 GLN CB 1 1 13 9701 2 2 4 GLN CD C 11.400 4.333 -2.819 1.00 . B B . 4 GLN CD 1 1 13 9702 2 2 4 GLN CG C 10.148 3.508 -2.513 1.00 . B B . 4 GLN CG 1 1 13 9703 2 2 4 GLN H H 9.536 -0.642 -3.492 1.00 . B B . 4 GLN H 1 1 13 9704 2 2 4 GLN HA H 11.590 1.122 -2.371 1.00 . B B . 4 GLN HA 1 1 13 9705 2 2 4 GLN HB2 H 10.778 2.422 -4.254 1.00 . B B . 4 GLN HB2 1 1 13 9706 2 2 4 GLN HB3 H 9.106 2.129 -3.782 1.00 . B B . 4 GLN HB3 1 1 13 9707 2 2 4 GLN HE21 H 12.440 2.774 -3.476 1.00 . B B . 4 GLN HE21 1 1 13 9708 2 2 4 GLN HE22 H 13.261 4.259 -3.507 1.00 . B B . 4 GLN HE22 1 1 13 9709 2 2 4 GLN HG2 H 9.268 4.105 -2.694 1.00 . B B . 4 GLN HG2 1 1 13 9710 2 2 4 GLN HG3 H 10.167 3.198 -1.484 1.00 . B B . 4 GLN HG3 1 1 13 9711 2 2 4 GLN N N 10.363 -0.123 -3.529 1.00 . B B . 4 GLN N 1 1 13 9712 2 2 4 GLN NE2 N 12.454 3.739 -3.308 1.00 . B B . 4 GLN NE2 1 1 13 9713 2 2 4 GLN O O 8.660 0.261 -1.363 1.00 . B B . 4 GLN O 1 1 13 9714 2 2 4 GLN OE1 O 11.420 5.529 -2.609 1.00 . B B . 4 GLN OE1 1 1 13 9715 2 2 5 HIS C C 8.241 2.321 0.978 1.00 . B B . 5 HIS C 1 1 13 9716 2 2 5 HIS CA C 9.419 1.345 1.017 1.00 . B B . 5 HIS CA 1 1 13 9717 2 2 5 HIS CB C 10.335 1.699 2.200 1.00 . B B . 5 HIS CB 1 1 13 9718 2 2 5 HIS CD2 C 12.534 0.375 1.670 1.00 . B B . 5 HIS CD2 1 1 13 9719 2 2 5 HIS CE1 C 13.805 2.086 1.247 1.00 . B B . 5 HIS CE1 1 1 13 9720 2 2 5 HIS CG C 11.781 1.508 1.820 1.00 . B B . 5 HIS CG 1 1 13 9721 2 2 5 HIS H H 11.018 1.937 -0.305 1.00 . B B . 5 HIS H 1 1 13 9722 2 2 5 HIS HA H 9.047 0.338 1.138 1.00 . B B . 5 HIS HA 1 1 13 9723 2 2 5 HIS HB2 H 10.173 2.729 2.481 1.00 . B B . 5 HIS HB2 1 1 13 9724 2 2 5 HIS HB3 H 10.098 1.059 3.037 1.00 . B B . 5 HIS HB3 1 1 13 9725 2 2 5 HIS HD2 H 12.185 -0.636 1.810 1.00 . B B . 5 HIS HD2 1 1 13 9726 2 2 5 HIS HE1 H 14.663 2.687 0.988 1.00 . B B . 5 HIS HE1 1 1 13 9727 2 2 5 HIS HE2 H 14.571 0.142 1.130 1.00 . B B . 5 HIS HE2 1 1 13 9728 2 2 5 HIS N N 10.172 1.444 -0.271 1.00 . B B . 5 HIS N 1 1 13 9729 2 2 5 HIS ND1 N 12.598 2.585 1.550 1.00 . B B . 5 HIS ND1 1 1 13 9730 2 2 5 HIS NE2 N 13.814 0.738 1.307 1.00 . B B . 5 HIS NE2 1 1 13 9731 2 2 5 HIS O O 8.101 3.093 0.051 1.00 . B B . 5 HIS O 1 1 13 9732 2 2 6 LEU C C 5.889 3.695 3.372 1.00 . B B . 6 LEU C 1 1 13 9733 2 2 6 LEU CA C 6.206 3.210 1.954 1.00 . B B . 6 LEU CA 1 1 13 9734 2 2 6 LEU CB C 4.984 2.431 1.437 1.00 . B B . 6 LEU CB 1 1 13 9735 2 2 6 LEU CD1 C 5.396 3.723 -0.694 1.00 . B B . 6 LEU CD1 1 1 13 9736 2 2 6 LEU CD2 C 3.661 1.953 -0.625 1.00 . B B . 6 LEU CD2 1 1 13 9737 2 2 6 LEU CG C 4.339 3.061 0.183 1.00 . B B . 6 LEU CG 1 1 13 9738 2 2 6 LEU H H 7.504 1.653 2.698 1.00 . B B . 6 LEU H 1 1 13 9739 2 2 6 LEU HA H 6.421 4.049 1.326 1.00 . B B . 6 LEU HA 1 1 13 9740 2 2 6 LEU HB2 H 5.299 1.430 1.199 1.00 . B B . 6 LEU HB2 1 1 13 9741 2 2 6 LEU HB3 H 4.247 2.389 2.225 1.00 . B B . 6 LEU HB3 1 1 13 9742 2 2 6 LEU HD11 H 5.724 4.641 -0.234 1.00 . B B . 6 LEU HD11 1 1 13 9743 2 2 6 LEU HD12 H 4.970 3.937 -1.662 1.00 . B B . 6 LEU HD12 1 1 13 9744 2 2 6 LEU HD13 H 6.233 3.054 -0.811 1.00 . B B . 6 LEU HD13 1 1 13 9745 2 2 6 LEU HD21 H 2.628 2.215 -0.799 1.00 . B B . 6 LEU HD21 1 1 13 9746 2 2 6 LEU HD22 H 3.709 1.025 -0.075 1.00 . B B . 6 LEU HD22 1 1 13 9747 2 2 6 LEU HD23 H 4.168 1.836 -1.572 1.00 . B B . 6 LEU HD23 1 1 13 9748 2 2 6 LEU HG H 3.589 3.791 0.474 1.00 . B B . 6 LEU HG 1 1 13 9749 2 2 6 LEU N N 7.383 2.288 1.965 1.00 . B B . 6 LEU N 1 1 13 9750 2 2 6 LEU O O 6.509 3.294 4.332 1.00 . B B . 6 LEU O 1 1 13 9751 2 2 7 CYS C C 3.724 6.379 4.655 1.00 . B B . 7 CYS C 1 1 13 9752 2 2 7 CYS CA C 4.479 5.059 4.833 1.00 . B B . 7 CYS CA 1 1 13 9753 2 2 7 CYS CB C 5.695 5.292 5.738 1.00 . B B . 7 CYS CB 1 1 13 9754 2 2 7 CYS H H 4.405 4.824 2.695 1.00 . B B . 7 CYS H 1 1 13 9755 2 2 7 CYS HA H 3.823 4.338 5.299 1.00 . B B . 7 CYS HA 1 1 13 9756 2 2 7 CYS HB2 H 6.603 5.068 5.205 1.00 . B B . 7 CYS HB2 1 1 13 9757 2 2 7 CYS HB3 H 5.712 6.324 6.050 1.00 . B B . 7 CYS HB3 1 1 13 9758 2 2 7 CYS N N 4.897 4.541 3.495 1.00 . B B . 7 CYS N 1 1 13 9759 2 2 7 CYS O O 4.111 7.231 3.877 1.00 . B B . 7 CYS O 1 1 13 9760 2 2 7 CYS SG S 5.555 4.228 7.201 1.00 . B B . 7 CYS SG 1 1 13 9761 2 2 8 GLY C C 1.220 7.911 3.876 1.00 . B B . 8 GLY C 1 1 13 9762 2 2 8 GLY CA C 1.867 7.819 5.258 1.00 . B B . 8 GLY CA 1 1 13 9763 2 2 8 GLY H H 2.358 5.855 5.995 1.00 . B B . 8 GLY H 1 1 13 9764 2 2 8 GLY HA2 H 1.098 7.834 6.016 1.00 . B B . 8 GLY HA2 1 1 13 9765 2 2 8 GLY HA3 H 2.526 8.662 5.399 1.00 . B B . 8 GLY HA3 1 1 13 9766 2 2 8 GLY N N 2.649 6.555 5.374 1.00 . B B . 8 GLY N 1 1 13 9767 2 2 8 GLY O O 0.805 6.924 3.299 1.00 . B B . 8 GLY O 1 1 13 9768 2 2 9 SER C C 1.190 8.341 0.998 1.00 . B B . 9 SER C 1 1 13 9769 2 2 9 SER CA C 0.505 9.265 2.001 1.00 . B B . 9 SER CA 1 1 13 9770 2 2 9 SER CB C 0.661 10.717 1.548 1.00 . B B . 9 SER CB 1 1 13 9771 2 2 9 SER H H 1.466 9.879 3.826 1.00 . B B . 9 SER H 1 1 13 9772 2 2 9 SER HA H -0.538 9.017 2.059 1.00 . B B . 9 SER HA 1 1 13 9773 2 2 9 SER HB2 H 0.043 10.896 0.684 1.00 . B B . 9 SER HB2 1 1 13 9774 2 2 9 SER HB3 H 0.358 11.378 2.349 1.00 . B B . 9 SER HB3 1 1 13 9775 2 2 9 SER HG H 2.056 11.750 0.668 1.00 . B B . 9 SER HG 1 1 13 9776 2 2 9 SER N N 1.128 9.097 3.342 1.00 . B B . 9 SER N 1 1 13 9777 2 2 9 SER O O 0.571 7.827 0.088 1.00 . B B . 9 SER O 1 1 13 9778 2 2 9 SER OG O 2.020 10.958 1.208 1.00 . B B . 9 SER OG 1 1 13 9779 2 2 10 ASP C C 2.447 5.902 0.094 1.00 . B B . 10 ASP C 1 1 13 9780 2 2 10 ASP CA C 3.191 7.232 0.212 1.00 . B B . 10 ASP CA 1 1 13 9781 2 2 10 ASP CB C 4.607 6.979 0.735 1.00 . B B . 10 ASP CB 1 1 13 9782 2 2 10 ASP CG C 5.271 8.315 1.074 1.00 . B B . 10 ASP CG 1 1 13 9783 2 2 10 ASP H H 2.938 8.547 1.902 1.00 . B B . 10 ASP H 1 1 13 9784 2 2 10 ASP HA H 3.245 7.702 -0.758 1.00 . B B . 10 ASP HA 1 1 13 9785 2 2 10 ASP HB2 H 4.557 6.364 1.622 1.00 . B B . 10 ASP HB2 1 1 13 9786 2 2 10 ASP HB3 H 5.187 6.473 -0.022 1.00 . B B . 10 ASP HB3 1 1 13 9787 2 2 10 ASP N N 2.463 8.124 1.158 1.00 . B B . 10 ASP N 1 1 13 9788 2 2 10 ASP O O 2.381 5.303 -0.962 1.00 . B B . 10 ASP O 1 1 13 9789 2 2 10 ASP OD1 O 4.777 9.331 0.617 1.00 . B B . 10 ASP OD1 1 1 13 9790 2 2 10 ASP OD2 O 6.262 8.298 1.786 1.00 . B B . 10 ASP OD2 1 1 13 9791 2 2 11 LEU C C -0.221 4.352 0.495 1.00 . B B . 11 LEU C 1 1 13 9792 2 2 11 LEU CA C 1.154 4.143 1.129 1.00 . B B . 11 LEU CA 1 1 13 9793 2 2 11 LEU CB C 1.001 3.606 2.555 1.00 . B B . 11 LEU CB 1 1 13 9794 2 2 11 LEU CD1 C 1.302 1.374 1.406 1.00 . B B . 11 LEU CD1 1 1 13 9795 2 2 11 LEU CD2 C 1.004 1.502 3.879 1.00 . B B . 11 LEU CD2 1 1 13 9796 2 2 11 LEU CG C 0.599 2.124 2.545 1.00 . B B . 11 LEU CG 1 1 13 9797 2 2 11 LEU H H 1.955 5.932 2.014 1.00 . B B . 11 LEU H 1 1 13 9798 2 2 11 LEU HA H 1.710 3.438 0.536 1.00 . B B . 11 LEU HA 1 1 13 9799 2 2 11 LEU HB2 H 1.940 3.715 3.077 1.00 . B B . 11 LEU HB2 1 1 13 9800 2 2 11 LEU HB3 H 0.241 4.176 3.069 1.00 . B B . 11 LEU HB3 1 1 13 9801 2 2 11 LEU HD11 H 2.342 1.665 1.370 1.00 . B B . 11 LEU HD11 1 1 13 9802 2 2 11 LEU HD12 H 0.828 1.618 0.467 1.00 . B B . 11 LEU HD12 1 1 13 9803 2 2 11 LEU HD13 H 1.232 0.309 1.578 1.00 . B B . 11 LEU HD13 1 1 13 9804 2 2 11 LEU HD21 H 1.817 2.070 4.308 1.00 . B B . 11 LEU HD21 1 1 13 9805 2 2 11 LEU HD22 H 1.322 0.483 3.720 1.00 . B B . 11 LEU HD22 1 1 13 9806 2 2 11 LEU HD23 H 0.161 1.517 4.553 1.00 . B B . 11 LEU HD23 1 1 13 9807 2 2 11 LEU HG H -0.471 2.042 2.421 1.00 . B B . 11 LEU HG 1 1 13 9808 2 2 11 LEU N N 1.888 5.434 1.173 1.00 . B B . 11 LEU N 1 1 13 9809 2 2 11 LEU O O -0.636 3.595 -0.357 1.00 . B B . 11 LEU O 1 1 13 9810 2 2 12 VAL C C -2.070 6.058 -1.177 1.00 . B B . 12 VAL C 1 1 13 9811 2 2 12 VAL CA C -2.270 5.601 0.269 1.00 . B B . 12 VAL CA 1 1 13 9812 2 2 12 VAL CB C -3.065 6.649 1.071 1.00 . B B . 12 VAL CB 1 1 13 9813 2 2 12 VAL CG1 C -2.603 6.628 2.523 1.00 . B B . 12 VAL CG1 1 1 13 9814 2 2 12 VAL CG2 C -2.853 8.055 0.499 1.00 . B B . 12 VAL CG2 1 1 13 9815 2 2 12 VAL H H -0.584 5.990 1.565 1.00 . B B . 12 VAL H 1 1 13 9816 2 2 12 VAL HA H -2.815 4.669 0.268 1.00 . B B . 12 VAL HA 1 1 13 9817 2 2 12 VAL HB H -4.116 6.400 1.032 1.00 . B B . 12 VAL HB 1 1 13 9818 2 2 12 VAL HG11 H -1.764 7.297 2.641 1.00 . B B . 12 VAL HG11 1 1 13 9819 2 2 12 VAL HG12 H -2.304 5.625 2.789 1.00 . B B . 12 VAL HG12 1 1 13 9820 2 2 12 VAL HG13 H -3.412 6.947 3.162 1.00 . B B . 12 VAL HG13 1 1 13 9821 2 2 12 VAL HG21 H -1.813 8.329 0.590 1.00 . B B . 12 VAL HG21 1 1 13 9822 2 2 12 VAL HG22 H -3.461 8.760 1.047 1.00 . B B . 12 VAL HG22 1 1 13 9823 2 2 12 VAL HG23 H -3.140 8.066 -0.542 1.00 . B B . 12 VAL HG23 1 1 13 9824 2 2 12 VAL N N -0.931 5.375 0.885 1.00 . B B . 12 VAL N 1 1 13 9825 2 2 12 VAL O O -2.754 5.617 -2.078 1.00 . B B . 12 VAL O 1 1 13 9826 2 2 13 GLU C C -0.693 6.159 -3.685 1.00 . B B . 13 GLU C 1 1 13 9827 2 2 13 GLU CA C -0.872 7.391 -2.795 1.00 . B B . 13 GLU CA 1 1 13 9828 2 2 13 GLU CB C 0.387 8.271 -2.824 1.00 . B B . 13 GLU CB 1 1 13 9829 2 2 13 GLU CD C 1.991 7.166 -4.392 1.00 . B B . 13 GLU CD 1 1 13 9830 2 2 13 GLU CG C 1.645 7.402 -2.921 1.00 . B B . 13 GLU CG 1 1 13 9831 2 2 13 GLU H H -0.572 7.262 -0.668 1.00 . B B . 13 GLU H 1 1 13 9832 2 2 13 GLU HA H -1.721 7.963 -3.141 1.00 . B B . 13 GLU HA 1 1 13 9833 2 2 13 GLU HB2 H 0.341 8.931 -3.677 1.00 . B B . 13 GLU HB2 1 1 13 9834 2 2 13 GLU HB3 H 0.430 8.859 -1.919 1.00 . B B . 13 GLU HB3 1 1 13 9835 2 2 13 GLU HG2 H 2.467 7.905 -2.433 1.00 . B B . 13 GLU HG2 1 1 13 9836 2 2 13 GLU HG3 H 1.465 6.453 -2.440 1.00 . B B . 13 GLU HG3 1 1 13 9837 2 2 13 GLU N N -1.123 6.927 -1.406 1.00 . B B . 13 GLU N 1 1 13 9838 2 2 13 GLU O O -1.056 6.156 -4.845 1.00 . B B . 13 GLU O 1 1 13 9839 2 2 13 GLU OE1 O 2.124 8.142 -5.112 1.00 . B B . 13 GLU OE1 1 1 13 9840 2 2 13 GLU OE2 O 2.116 6.014 -4.774 1.00 . B B . 13 GLU OE2 1 1 13 9841 2 2 14 ALA C C -1.272 3.051 -3.826 1.00 . B B . 14 ALA C 1 1 13 9842 2 2 14 ALA CA C 0.020 3.856 -3.920 1.00 . B B . 14 ALA CA 1 1 13 9843 2 2 14 ALA CB C 1.177 3.043 -3.337 1.00 . B B . 14 ALA CB 1 1 13 9844 2 2 14 ALA H H 0.103 5.123 -2.189 1.00 . B B . 14 ALA H 1 1 13 9845 2 2 14 ALA HA H 0.225 4.100 -4.952 1.00 . B B . 14 ALA HA 1 1 13 9846 2 2 14 ALA HB1 H 2.114 3.500 -3.614 1.00 . B B . 14 ALA HB1 1 1 13 9847 2 2 14 ALA HB2 H 1.139 2.035 -3.723 1.00 . B B . 14 ALA HB2 1 1 13 9848 2 2 14 ALA HB3 H 1.093 3.019 -2.260 1.00 . B B . 14 ALA HB3 1 1 13 9849 2 2 14 ALA N N -0.159 5.102 -3.132 1.00 . B B . 14 ALA N 1 1 13 9850 2 2 14 ALA O O -1.827 2.624 -4.819 1.00 . B B . 14 ALA O 1 1 13 9851 2 2 15 LEU C C -4.122 2.765 -3.305 1.00 . B B . 15 LEU C 1 1 13 9852 2 2 15 LEU CA C -3.027 2.098 -2.466 1.00 . B B . 15 LEU CA 1 1 13 9853 2 2 15 LEU CB C -3.425 2.120 -0.992 1.00 . B B . 15 LEU CB 1 1 13 9854 2 2 15 LEU CD1 C -3.117 0.901 1.162 1.00 . B B . 15 LEU CD1 1 1 13 9855 2 2 15 LEU CD2 C -2.142 -0.076 -0.926 1.00 . B B . 15 LEU CD2 1 1 13 9856 2 2 15 LEU CG C -2.469 1.232 -0.176 1.00 . B B . 15 LEU CG 1 1 13 9857 2 2 15 LEU H H -1.309 3.216 -1.843 1.00 . B B . 15 LEU H 1 1 13 9858 2 2 15 LEU HA H -2.879 1.080 -2.792 1.00 . B B . 15 LEU HA 1 1 13 9859 2 2 15 LEU HB2 H -3.359 3.137 -0.630 1.00 . B B . 15 LEU HB2 1 1 13 9860 2 2 15 LEU HB3 H -4.445 1.773 -0.880 1.00 . B B . 15 LEU HB3 1 1 13 9861 2 2 15 LEU HD11 H -3.447 -0.126 1.157 1.00 . B B . 15 LEU HD11 1 1 13 9862 2 2 15 LEU HD12 H -3.963 1.553 1.319 1.00 . B B . 15 LEU HD12 1 1 13 9863 2 2 15 LEU HD13 H -2.398 1.047 1.954 1.00 . B B . 15 LEU HD13 1 1 13 9864 2 2 15 LEU HD21 H -1.890 -0.850 -0.211 1.00 . B B . 15 LEU HD21 1 1 13 9865 2 2 15 LEU HD22 H -1.298 0.085 -1.583 1.00 . B B . 15 LEU HD22 1 1 13 9866 2 2 15 LEU HD23 H -2.995 -0.389 -1.507 1.00 . B B . 15 LEU HD23 1 1 13 9867 2 2 15 LEU HG H -1.554 1.776 0.006 1.00 . B B . 15 LEU HG 1 1 13 9868 2 2 15 LEU N N -1.765 2.855 -2.632 1.00 . B B . 15 LEU N 1 1 13 9869 2 2 15 LEU O O -4.910 2.108 -3.952 1.00 . B B . 15 LEU O 1 1 13 9870 2 2 16 TYR C C -4.957 4.527 -5.595 1.00 . B B . 16 TYR C 1 1 13 9871 2 2 16 TYR CA C -5.219 4.771 -4.106 1.00 . B B . 16 TYR CA 1 1 13 9872 2 2 16 TYR CB C -5.166 6.276 -3.826 1.00 . B B . 16 TYR CB 1 1 13 9873 2 2 16 TYR CD1 C -7.667 6.595 -3.786 1.00 . B B . 16 TYR CD1 1 1 13 9874 2 2 16 TYR CD2 C -6.382 7.204 -1.819 1.00 . B B . 16 TYR CD2 1 1 13 9875 2 2 16 TYR CE1 C -8.846 6.989 -3.138 1.00 . B B . 16 TYR CE1 1 1 13 9876 2 2 16 TYR CE2 C -7.562 7.599 -1.171 1.00 . B B . 16 TYR CE2 1 1 13 9877 2 2 16 TYR CG C -6.435 6.702 -3.126 1.00 . B B . 16 TYR CG 1 1 13 9878 2 2 16 TYR CZ C -8.793 7.491 -1.831 1.00 . B B . 16 TYR CZ 1 1 13 9879 2 2 16 TYR H H -3.533 4.590 -2.769 1.00 . B B . 16 TYR H 1 1 13 9880 2 2 16 TYR HA H -6.195 4.389 -3.844 1.00 . B B . 16 TYR HA 1 1 13 9881 2 2 16 TYR HB2 H -4.313 6.498 -3.203 1.00 . B B . 16 TYR HB2 1 1 13 9882 2 2 16 TYR HB3 H -5.077 6.811 -4.760 1.00 . B B . 16 TYR HB3 1 1 13 9883 2 2 16 TYR HD1 H -7.708 6.208 -4.794 1.00 . B B . 16 TYR HD1 1 1 13 9884 2 2 16 TYR HD2 H -5.434 7.287 -1.309 1.00 . B B . 16 TYR HD2 1 1 13 9885 2 2 16 TYR HE1 H -9.795 6.906 -3.647 1.00 . B B . 16 TYR HE1 1 1 13 9886 2 2 16 TYR HE2 H -7.521 7.986 -0.164 1.00 . B B . 16 TYR HE2 1 1 13 9887 2 2 16 TYR HH H -10.618 7.203 -1.346 1.00 . B B . 16 TYR HH 1 1 13 9888 2 2 16 TYR N N -4.177 4.071 -3.300 1.00 . B B . 16 TYR N 1 1 13 9889 2 2 16 TYR O O -5.859 4.240 -6.357 1.00 . B B . 16 TYR O 1 1 13 9890 2 2 16 TYR OH O -9.954 7.879 -1.193 1.00 . B B . 16 TYR OH 1 1 13 9891 2 2 17 LEU C C -3.632 2.964 -7.824 1.00 . B B . 17 LEU C 1 1 13 9892 2 2 17 LEU CA C -3.397 4.431 -7.453 1.00 . B B . 17 LEU CA 1 1 13 9893 2 2 17 LEU CB C -1.926 4.799 -7.691 1.00 . B B . 17 LEU CB 1 1 13 9894 2 2 17 LEU CD1 C -2.244 4.754 -10.172 1.00 . B B . 17 LEU CD1 1 1 13 9895 2 2 17 LEU CD2 C 0.046 4.526 -9.201 1.00 . B B . 17 LEU CD2 1 1 13 9896 2 2 17 LEU CG C -1.434 4.186 -9.006 1.00 . B B . 17 LEU CG 1 1 13 9897 2 2 17 LEU H H -3.017 4.884 -5.381 1.00 . B B . 17 LEU H 1 1 13 9898 2 2 17 LEU HA H -4.028 5.058 -8.061 1.00 . B B . 17 LEU HA 1 1 13 9899 2 2 17 LEU HB2 H -1.830 5.875 -7.738 1.00 . B B . 17 LEU HB2 1 1 13 9900 2 2 17 LEU HB3 H -1.326 4.423 -6.876 1.00 . B B . 17 LEU HB3 1 1 13 9901 2 2 17 LEU HD11 H -2.310 4.015 -10.958 1.00 . B B . 17 LEU HD11 1 1 13 9902 2 2 17 LEU HD12 H -1.759 5.641 -10.551 1.00 . B B . 17 LEU HD12 1 1 13 9903 2 2 17 LEU HD13 H -3.238 5.005 -9.832 1.00 . B B . 17 LEU HD13 1 1 13 9904 2 2 17 LEU HD21 H 0.330 4.329 -10.224 1.00 . B B . 17 LEU HD21 1 1 13 9905 2 2 17 LEU HD22 H 0.644 3.919 -8.538 1.00 . B B . 17 LEU HD22 1 1 13 9906 2 2 17 LEU HD23 H 0.208 5.570 -8.977 1.00 . B B . 17 LEU HD23 1 1 13 9907 2 2 17 LEU HG H -1.556 3.112 -8.972 1.00 . B B . 17 LEU HG 1 1 13 9908 2 2 17 LEU N N -3.727 4.646 -6.014 1.00 . B B . 17 LEU N 1 1 13 9909 2 2 17 LEU O O -3.836 2.630 -8.974 1.00 . B B . 17 LEU O 1 1 13 9910 2 2 18 VAL C C -5.261 0.269 -6.838 1.00 . B B . 18 VAL C 1 1 13 9911 2 2 18 VAL CA C -3.818 0.645 -7.160 1.00 . B B . 18 VAL CA 1 1 13 9912 2 2 18 VAL CB C -2.870 -0.198 -6.310 1.00 . B B . 18 VAL CB 1 1 13 9913 2 2 18 VAL CG1 C -1.448 0.314 -6.489 1.00 . B B . 18 VAL CG1 1 1 13 9914 2 2 18 VAL CG2 C -3.259 -0.078 -4.841 1.00 . B B . 18 VAL CG2 1 1 13 9915 2 2 18 VAL H H -3.432 2.381 -5.942 1.00 . B B . 18 VAL H 1 1 13 9916 2 2 18 VAL HA H -3.624 0.459 -8.203 1.00 . B B . 18 VAL HA 1 1 13 9917 2 2 18 VAL HB H -2.925 -1.231 -6.620 1.00 . B B . 18 VAL HB 1 1 13 9918 2 2 18 VAL HG11 H -1.126 0.797 -5.579 1.00 . B B . 18 VAL HG11 1 1 13 9919 2 2 18 VAL HG12 H -1.425 1.024 -7.303 1.00 . B B . 18 VAL HG12 1 1 13 9920 2 2 18 VAL HG13 H -0.795 -0.514 -6.711 1.00 . B B . 18 VAL HG13 1 1 13 9921 2 2 18 VAL HG21 H -4.226 -0.529 -4.685 1.00 . B B . 18 VAL HG21 1 1 13 9922 2 2 18 VAL HG22 H -3.298 0.964 -4.571 1.00 . B B . 18 VAL HG22 1 1 13 9923 2 2 18 VAL HG23 H -2.523 -0.581 -4.232 1.00 . B B . 18 VAL HG23 1 1 13 9924 2 2 18 VAL N N -3.600 2.088 -6.861 1.00 . B B . 18 VAL N 1 1 13 9925 2 2 18 VAL O O -5.930 -0.387 -7.611 1.00 . B B . 18 VAL O 1 1 13 9926 2 2 19 CYS C C -7.897 1.629 -4.989 1.00 . B B . 19 CYS C 1 1 13 9927 2 2 19 CYS CA C -7.139 0.343 -5.332 1.00 . B B . 19 CYS CA 1 1 13 9928 2 2 19 CYS CB C -7.123 -0.579 -4.118 1.00 . B B . 19 CYS CB 1 1 13 9929 2 2 19 CYS H H -5.194 1.203 -5.090 1.00 . B B . 19 CYS H 1 1 13 9930 2 2 19 CYS HA H -7.615 -0.155 -6.160 1.00 . B B . 19 CYS HA 1 1 13 9931 2 2 19 CYS HB2 H -6.664 -0.069 -3.284 1.00 . B B . 19 CYS HB2 1 1 13 9932 2 2 19 CYS HB3 H -8.132 -0.849 -3.861 1.00 . B B . 19 CYS HB3 1 1 13 9933 2 2 19 CYS N N -5.747 0.678 -5.702 1.00 . B B . 19 CYS N 1 1 13 9934 2 2 19 CYS O O -8.668 1.677 -4.050 1.00 . B B . 19 CYS O 1 1 13 9935 2 2 19 CYS SG S -6.177 -2.072 -4.507 1.00 . B B . 19 CYS SG 1 1 13 9936 2 2 20 GLY C C -9.877 3.741 -5.343 1.00 . B B . 20 GLY C 1 1 13 9937 2 2 20 GLY CA C -8.366 3.963 -5.456 1.00 . B B . 20 GLY CA 1 1 13 9938 2 2 20 GLY H H -7.041 2.611 -6.484 1.00 . B B . 20 GLY H 1 1 13 9939 2 2 20 GLY HA2 H -7.993 4.374 -4.529 1.00 . B B . 20 GLY HA2 1 1 13 9940 2 2 20 GLY HA3 H -8.170 4.657 -6.260 1.00 . B B . 20 GLY HA3 1 1 13 9941 2 2 20 GLY N N -7.673 2.673 -5.738 1.00 . B B . 20 GLY N 1 1 13 9942 2 2 20 GLY O O -10.428 3.697 -4.261 1.00 . B B . 20 GLY O 1 1 13 9943 2 2 21 GLU C C -12.387 2.207 -5.553 1.00 . B B . 21 GLU C 1 1 13 9944 2 2 21 GLU CA C -12.032 3.424 -6.409 1.00 . B B . 21 GLU CA 1 1 13 9945 2 2 21 GLU CB C -12.564 3.223 -7.830 1.00 . B B . 21 GLU CB 1 1 13 9946 2 2 21 GLU CD C -13.671 5.003 -9.188 1.00 . B B . 21 GLU CD 1 1 13 9947 2 2 21 GLU CG C -13.845 4.038 -8.015 1.00 . B B . 21 GLU CG 1 1 13 9948 2 2 21 GLU H H -10.092 3.672 -7.315 1.00 . B B . 21 GLU H 1 1 13 9949 2 2 21 GLU HA H -12.490 4.300 -5.979 1.00 . B B . 21 GLU HA 1 1 13 9950 2 2 21 GLU HB2 H -11.821 3.551 -8.541 1.00 . B B . 21 GLU HB2 1 1 13 9951 2 2 21 GLU HB3 H -12.781 2.177 -7.991 1.00 . B B . 21 GLU HB3 1 1 13 9952 2 2 21 GLU HG2 H -14.670 3.369 -8.217 1.00 . B B . 21 GLU HG2 1 1 13 9953 2 2 21 GLU HG3 H -14.049 4.600 -7.116 1.00 . B B . 21 GLU HG3 1 1 13 9954 2 2 21 GLU N N -10.554 3.620 -6.452 1.00 . B B . 21 GLU N 1 1 13 9955 2 2 21 GLU O O -13.409 2.184 -4.898 1.00 . B B . 21 GLU O 1 1 13 9956 2 2 21 GLU OE1 O -12.536 5.280 -9.538 1.00 . B B . 21 GLU OE1 1 1 13 9957 2 2 21 GLU OE2 O -14.676 5.450 -9.717 1.00 . B B . 21 GLU OE2 1 1 13 9958 2 2 22 ARG C C -11.390 0.223 -3.292 1.00 . B B . 22 ARG C 1 1 13 9959 2 2 22 ARG CA C -11.882 0.003 -4.725 1.00 . B B . 22 ARG CA 1 1 13 9960 2 2 22 ARG CB C -11.190 -1.215 -5.333 1.00 . B B . 22 ARG CB 1 1 13 9961 2 2 22 ARG CD C -13.047 -2.811 -5.829 1.00 . B B . 22 ARG CD 1 1 13 9962 2 2 22 ARG CG C -12.068 -1.805 -6.438 1.00 . B B . 22 ARG CG 1 1 13 9963 2 2 22 ARG CZ C -14.811 -2.534 -4.191 1.00 . B B . 22 ARG CZ 1 1 13 9964 2 2 22 ARG H H -10.739 1.215 -6.069 1.00 . B B . 22 ARG H 1 1 13 9965 2 2 22 ARG HA H -12.950 -0.156 -4.718 1.00 . B B . 22 ARG HA 1 1 13 9966 2 2 22 ARG HB2 H -10.238 -0.917 -5.748 1.00 . B B . 22 ARG HB2 1 1 13 9967 2 2 22 ARG HB3 H -11.034 -1.952 -4.570 1.00 . B B . 22 ARG HB3 1 1 13 9968 2 2 22 ARG HD2 H -13.382 -3.495 -6.594 1.00 . B B . 22 ARG HD2 1 1 13 9969 2 2 22 ARG HD3 H -12.553 -3.363 -5.043 1.00 . B B . 22 ARG HD3 1 1 13 9970 2 2 22 ARG HE H -14.546 -1.268 -5.698 1.00 . B B . 22 ARG HE 1 1 13 9971 2 2 22 ARG HG2 H -12.620 -1.012 -6.921 1.00 . B B . 22 ARG HG2 1 1 13 9972 2 2 22 ARG HG3 H -11.446 -2.306 -7.164 1.00 . B B . 22 ARG HG3 1 1 13 9973 2 2 22 ARG HH11 H -14.308 -4.442 -4.525 1.00 . B B . 22 ARG HH11 1 1 13 9974 2 2 22 ARG HH12 H -15.238 -4.152 -3.093 1.00 . B B . 22 ARG HH12 1 1 13 9975 2 2 22 ARG HH21 H -15.454 -0.731 -3.605 1.00 . B B . 22 ARG HH21 1 1 13 9976 2 2 22 ARG HH22 H -15.883 -2.052 -2.571 1.00 . B B . 22 ARG HH22 1 1 13 9977 2 2 22 ARG N N -11.564 1.195 -5.543 1.00 . B B . 22 ARG N 1 1 13 9978 2 2 22 ARG NE N -14.219 -2.084 -5.264 1.00 . B B . 22 ARG NE 1 1 13 9979 2 2 22 ARG NH1 N -14.783 -3.809 -3.915 1.00 . B B . 22 ARG NH1 1 1 13 9980 2 2 22 ARG NH2 N -15.431 -1.708 -3.394 1.00 . B B . 22 ARG NH2 1 1 13 9981 2 2 22 ARG O O -11.264 -0.706 -2.521 1.00 . B B . 22 ARG O 1 1 13 9982 2 2 23 GLY C C -9.420 0.846 -1.239 1.00 . B B . 23 GLY C 1 1 13 9983 2 2 23 GLY CA C -10.636 1.722 -1.542 1.00 . B B . 23 GLY CA 1 1 13 9984 2 2 23 GLY H H -11.225 2.187 -3.561 1.00 . B B . 23 GLY H 1 1 13 9985 2 2 23 GLY HA2 H -10.361 2.764 -1.456 1.00 . B B . 23 GLY HA2 1 1 13 9986 2 2 23 GLY HA3 H -11.422 1.497 -0.837 1.00 . B B . 23 GLY HA3 1 1 13 9987 2 2 23 GLY N N -11.115 1.448 -2.926 1.00 . B B . 23 GLY N 1 1 13 9988 2 2 23 GLY O O -8.984 0.068 -2.064 1.00 . B B . 23 GLY O 1 1 13 9989 2 2 24 PHE C C -7.775 -0.312 1.747 1.00 . B B . 24 PHE C 1 1 13 9990 2 2 24 PHE CA C -7.682 0.133 0.287 1.00 . B B . 24 PHE CA 1 1 13 9991 2 2 24 PHE CB C -6.400 0.945 0.080 1.00 . B B . 24 PHE CB 1 1 13 9992 2 2 24 PHE CD1 C -7.216 3.166 -0.800 1.00 . B B . 24 PHE CD1 1 1 13 9993 2 2 24 PHE CD2 C -6.393 3.046 1.480 1.00 . B B . 24 PHE CD2 1 1 13 9994 2 2 24 PHE CE1 C -7.467 4.536 -0.637 1.00 . B B . 24 PHE CE1 1 1 13 9995 2 2 24 PHE CE2 C -6.641 4.416 1.642 1.00 . B B . 24 PHE CE2 1 1 13 9996 2 2 24 PHE CG C -6.680 2.420 0.259 1.00 . B B . 24 PHE CG 1 1 13 9997 2 2 24 PHE CZ C -7.177 5.161 0.584 1.00 . B B . 24 PHE CZ 1 1 13 9998 2 2 24 PHE H H -9.235 1.595 0.591 1.00 . B B . 24 PHE H 1 1 13 9999 2 2 24 PHE HA H -7.658 -0.740 -0.350 1.00 . B B . 24 PHE HA 1 1 13 10000 2 2 24 PHE HB2 H -5.658 0.631 0.799 1.00 . B B . 24 PHE HB2 1 1 13 10001 2 2 24 PHE HB3 H -6.025 0.771 -0.918 1.00 . B B . 24 PHE HB3 1 1 13 10002 2 2 24 PHE HD1 H -7.440 2.685 -1.741 1.00 . B B . 24 PHE HD1 1 1 13 10003 2 2 24 PHE HD2 H -5.980 2.472 2.297 1.00 . B B . 24 PHE HD2 1 1 13 10004 2 2 24 PHE HE1 H -7.882 5.109 -1.452 1.00 . B B . 24 PHE HE1 1 1 13 10005 2 2 24 PHE HE2 H -6.422 4.897 2.584 1.00 . B B . 24 PHE HE2 1 1 13 10006 2 2 24 PHE HZ H -7.364 6.218 0.708 1.00 . B B . 24 PHE HZ 1 1 13 10007 2 2 24 PHE N N -8.869 0.963 -0.062 1.00 . B B . 24 PHE N 1 1 13 10008 2 2 24 PHE O O -8.711 0.015 2.449 1.00 . B B . 24 PHE O 1 1 13 10009 2 2 25 PHE C C -5.673 -0.931 4.397 1.00 . B B . 25 PHE C 1 1 13 10010 2 2 25 PHE CA C -6.846 -1.535 3.622 1.00 . B B . 25 PHE CA 1 1 13 10011 2 2 25 PHE CB C -6.744 -3.061 3.652 1.00 . B B . 25 PHE CB 1 1 13 10012 2 2 25 PHE CD1 C -8.264 -3.274 5.654 1.00 . B B . 25 PHE CD1 1 1 13 10013 2 2 25 PHE CD2 C -6.072 -4.313 5.734 1.00 . B B . 25 PHE CD2 1 1 13 10014 2 2 25 PHE CE1 C -8.531 -3.740 6.949 1.00 . B B . 25 PHE CE1 1 1 13 10015 2 2 25 PHE CE2 C -6.339 -4.779 7.028 1.00 . B B . 25 PHE CE2 1 1 13 10016 2 2 25 PHE CG C -7.034 -3.561 5.047 1.00 . B B . 25 PHE CG 1 1 13 10017 2 2 25 PHE CZ C -7.568 -4.493 7.635 1.00 . B B . 25 PHE CZ 1 1 13 10018 2 2 25 PHE H H -6.067 -1.320 1.625 1.00 . B B . 25 PHE H 1 1 13 10019 2 2 25 PHE HA H -7.775 -1.228 4.080 1.00 . B B . 25 PHE HA 1 1 13 10020 2 2 25 PHE HB2 H -7.459 -3.483 2.962 1.00 . B B . 25 PHE HB2 1 1 13 10021 2 2 25 PHE HB3 H -5.747 -3.359 3.365 1.00 . B B . 25 PHE HB3 1 1 13 10022 2 2 25 PHE HD1 H -9.006 -2.695 5.125 1.00 . B B . 25 PHE HD1 1 1 13 10023 2 2 25 PHE HD2 H -5.124 -4.533 5.265 1.00 . B B . 25 PHE HD2 1 1 13 10024 2 2 25 PHE HE1 H -9.479 -3.520 7.417 1.00 . B B . 25 PHE HE1 1 1 13 10025 2 2 25 PHE HE2 H -5.597 -5.358 7.557 1.00 . B B . 25 PHE HE2 1 1 13 10026 2 2 25 PHE HZ H -7.774 -4.851 8.633 1.00 . B B . 25 PHE HZ 1 1 13 10027 2 2 25 PHE N N -6.811 -1.063 2.209 1.00 . B B . 25 PHE N 1 1 13 10028 2 2 25 PHE O O -4.746 -1.620 4.776 1.00 . B B . 25 PHE O 1 1 13 10029 2 2 26 TYR C C -4.726 0.621 6.877 1.00 . B B . 26 TYR C 1 1 13 10030 2 2 26 TYR CA C -4.600 0.995 5.400 1.00 . B B . 26 TYR CA 1 1 13 10031 2 2 26 TYR CB C -4.696 2.515 5.237 1.00 . B B . 26 TYR CB 1 1 13 10032 2 2 26 TYR CD1 C -2.256 3.026 5.624 1.00 . B B . 26 TYR CD1 1 1 13 10033 2 2 26 TYR CD2 C -3.906 4.011 7.107 1.00 . B B . 26 TYR CD2 1 1 13 10034 2 2 26 TYR CE1 C -1.234 3.672 6.333 1.00 . B B . 26 TYR CE1 1 1 13 10035 2 2 26 TYR CE2 C -2.884 4.654 7.817 1.00 . B B . 26 TYR CE2 1 1 13 10036 2 2 26 TYR CG C -3.592 3.196 6.010 1.00 . B B . 26 TYR CG 1 1 13 10037 2 2 26 TYR CZ C -1.548 4.485 7.430 1.00 . B B . 26 TYR CZ 1 1 13 10038 2 2 26 TYR H H -6.467 0.887 4.332 1.00 . B B . 26 TYR H 1 1 13 10039 2 2 26 TYR HA H -3.650 0.649 5.018 1.00 . B B . 26 TYR HA 1 1 13 10040 2 2 26 TYR HB2 H -4.605 2.767 4.193 1.00 . B B . 26 TYR HB2 1 1 13 10041 2 2 26 TYR HB3 H -5.650 2.853 5.605 1.00 . B B . 26 TYR HB3 1 1 13 10042 2 2 26 TYR HD1 H -2.013 2.399 4.779 1.00 . B B . 26 TYR HD1 1 1 13 10043 2 2 26 TYR HD2 H -4.936 4.142 7.405 1.00 . B B . 26 TYR HD2 1 1 13 10044 2 2 26 TYR HE1 H -0.205 3.542 6.035 1.00 . B B . 26 TYR HE1 1 1 13 10045 2 2 26 TYR HE2 H -3.126 5.283 8.662 1.00 . B B . 26 TYR HE2 1 1 13 10046 2 2 26 TYR HH H -0.787 6.043 8.226 1.00 . B B . 26 TYR HH 1 1 13 10047 2 2 26 TYR N N -5.708 0.350 4.642 1.00 . B B . 26 TYR N 1 1 13 10048 2 2 26 TYR O O -5.742 0.115 7.311 1.00 . B B . 26 TYR O 1 1 13 10049 2 2 26 TYR OH O -0.541 5.121 8.126 1.00 . B B . 26 TYR OH 1 1 13 10050 2 2 27 THR C C -3.522 1.750 9.943 1.00 . B B . 27 THR C 1 1 13 10051 2 2 27 THR CA C -3.775 0.502 9.096 1.00 . B B . 27 THR CA 1 1 13 10052 2 2 27 THR CB C -2.715 -0.558 9.409 1.00 . B B . 27 THR CB 1 1 13 10053 2 2 27 THR CG2 C -2.847 -1.717 8.421 1.00 . B B . 27 THR CG2 1 1 13 10054 2 2 27 THR H H -2.892 1.259 7.283 1.00 . B B . 27 THR H 1 1 13 10055 2 2 27 THR HA H -4.755 0.107 9.323 1.00 . B B . 27 THR HA 1 1 13 10056 2 2 27 THR HB H -2.857 -0.927 10.412 1.00 . B B . 27 THR HB 1 1 13 10057 2 2 27 THR HG1 H -1.102 -0.148 8.401 1.00 . B B . 27 THR HG1 1 1 13 10058 2 2 27 THR HG21 H -3.151 -2.609 8.948 1.00 . B B . 27 THR HG21 1 1 13 10059 2 2 27 THR HG22 H -1.895 -1.889 7.943 1.00 . B B . 27 THR HG22 1 1 13 10060 2 2 27 THR HG23 H -3.586 -1.471 7.672 1.00 . B B . 27 THR HG23 1 1 13 10061 2 2 27 THR N N -3.705 0.855 7.651 1.00 . B B . 27 THR N 1 1 13 10062 2 2 27 THR O O -2.695 2.578 9.616 1.00 . B B . 27 THR O 1 1 13 10063 2 2 27 THR OG1 O -1.422 0.019 9.291 1.00 . B B . 27 THR OG1 1 1 13 10064 2 2 28 LYS C C -2.771 2.903 12.748 1.00 . B B . 28 LYS C 1 1 13 10065 2 2 28 LYS CA C -4.024 3.090 11.899 1.00 . B B . 28 LYS CA 1 1 13 10066 2 2 28 LYS CB C -5.206 3.275 12.857 1.00 . B B . 28 LYS CB 1 1 13 10067 2 2 28 LYS CD C -6.158 4.938 11.239 1.00 . B B . 28 LYS CD 1 1 13 10068 2 2 28 LYS CE C -6.923 3.737 10.678 1.00 . B B . 28 LYS CE 1 1 13 10069 2 2 28 LYS CG C -5.792 4.679 12.704 1.00 . B B . 28 LYS CG 1 1 13 10070 2 2 28 LYS H H -4.888 1.211 11.275 1.00 . B B . 28 LYS H 1 1 13 10071 2 2 28 LYS HA H -3.916 3.970 11.284 1.00 . B B . 28 LYS HA 1 1 13 10072 2 2 28 LYS HB2 H -5.963 2.537 12.654 1.00 . B B . 28 LYS HB2 1 1 13 10073 2 2 28 LYS HB3 H -4.854 3.146 13.872 1.00 . B B . 28 LYS HB3 1 1 13 10074 2 2 28 LYS HD2 H -6.777 5.821 11.175 1.00 . B B . 28 LYS HD2 1 1 13 10075 2 2 28 LYS HD3 H -5.257 5.089 10.664 1.00 . B B . 28 LYS HD3 1 1 13 10076 2 2 28 LYS HE2 H -6.362 2.833 10.864 1.00 . B B . 28 LYS HE2 1 1 13 10077 2 2 28 LYS HE3 H -7.888 3.668 11.158 1.00 . B B . 28 LYS HE3 1 1 13 10078 2 2 28 LYS HG2 H -6.677 4.763 13.318 1.00 . B B . 28 LYS HG2 1 1 13 10079 2 2 28 LYS HG3 H -5.062 5.406 13.026 1.00 . B B . 28 LYS HG3 1 1 13 10080 2 2 28 LYS HZ1 H -6.267 4.360 8.801 1.00 . B B . 28 LYS HZ1 1 1 13 10081 2 2 28 LYS HZ2 H -7.943 4.512 9.035 1.00 . B B . 28 LYS HZ2 1 1 13 10082 2 2 28 LYS HZ3 H -7.255 2.982 8.765 1.00 . B B . 28 LYS HZ3 1 1 13 10083 2 2 28 LYS N N -4.228 1.892 11.031 1.00 . B B . 28 LYS N 1 1 13 10084 2 2 28 LYS NZ N -7.111 3.911 9.209 1.00 . B B . 28 LYS NZ 1 1 13 10085 2 2 28 LYS O O -1.888 3.738 12.744 1.00 . B B . 28 LYS O 1 1 13 10086 2 2 29 PRO C C -0.455 0.930 13.613 1.00 . B B . 29 PRO C 1 1 13 10087 2 2 29 PRO CA C -1.640 1.512 14.389 1.00 . B B . 29 PRO CA 1 1 13 10088 2 2 29 PRO CB C -2.246 0.475 15.333 1.00 . B B . 29 PRO CB 1 1 13 10089 2 2 29 PRO CD C -3.828 0.803 13.475 1.00 . B B . 29 PRO CD 1 1 13 10090 2 2 29 PRO CG C -3.420 -0.182 14.577 1.00 . B B . 29 PRO CG 1 1 13 10091 2 2 29 PRO HA H -1.343 2.386 14.944 1.00 . B B . 29 PRO HA 1 1 13 10092 2 2 29 PRO HB2 H -1.510 -0.263 15.599 1.00 . B B . 29 PRO HB2 1 1 13 10093 2 2 29 PRO HB3 H -2.626 0.967 16.214 1.00 . B B . 29 PRO HB3 1 1 13 10094 2 2 29 PRO HD2 H -3.872 0.299 12.519 1.00 . B B . 29 PRO HD2 1 1 13 10095 2 2 29 PRO HD3 H -4.774 1.252 13.713 1.00 . B B . 29 PRO HD3 1 1 13 10096 2 2 29 PRO HG2 H -3.102 -1.120 14.143 1.00 . B B . 29 PRO HG2 1 1 13 10097 2 2 29 PRO HG3 H -4.250 -0.343 15.247 1.00 . B B . 29 PRO HG3 1 1 13 10098 2 2 29 PRO N N -2.751 1.822 13.482 1.00 . B B . 29 PRO N 1 1 13 10099 2 2 29 PRO O O -0.607 0.409 12.525 1.00 . B B . 29 PRO O 1 1 13 10100 2 2 30 THR C C 2.673 -0.473 14.405 1.00 . B B . 30 THR C 1 1 13 10101 2 2 30 THR CA C 1.919 0.470 13.464 1.00 . B B . 30 THR CA 1 1 13 10102 2 2 30 THR CB C 2.840 1.622 13.052 1.00 . B B . 30 THR CB 1 1 13 10103 2 2 30 THR CG2 C 2.805 1.791 11.531 1.00 . B B . 30 THR CG2 1 1 13 10104 2 2 30 THR H H 0.823 1.440 15.043 1.00 . B B . 30 THR H 1 1 13 10105 2 2 30 THR HA H 1.604 -0.074 12.585 1.00 . B B . 30 THR HA 1 1 13 10106 2 2 30 THR HB H 3.850 1.403 13.362 1.00 . B B . 30 THR HB 1 1 13 10107 2 2 30 THR HG1 H 1.615 3.124 13.216 1.00 . B B . 30 THR HG1 1 1 13 10108 2 2 30 THR HG21 H 1.871 2.249 11.241 1.00 . B B . 30 THR HG21 1 1 13 10109 2 2 30 THR HG22 H 2.895 0.825 11.058 1.00 . B B . 30 THR HG22 1 1 13 10110 2 2 30 THR HG23 H 3.626 2.421 11.220 1.00 . B B . 30 THR HG23 1 1 13 10111 2 2 30 THR N N 0.724 1.016 14.166 1.00 . B B . 30 THR N 1 1 13 10112 2 2 30 THR O O 2.501 -0.340 15.606 1.00 . B B . 30 THR O 1 1 13 10113 2 2 30 THR OXT O 3.407 -1.310 13.909 1.00 . B B . 30 THR OXT 1 1 13 10114 2 2 30 THR OG1 O 2.401 2.821 13.675 1.00 . B B . 30 THR OG1 1 1 14 10115 1 1 1 GLY C C 0.897 -4.733 7.746 1.00 . A A . 1 GLY C 1 1 14 10116 1 1 1 GLY CA C 0.173 -5.083 9.001 1.00 . A A . 1 GLY CA 1 1 14 10117 1 1 1 GLY H1 H 1.102 -4.172 10.671 1.00 . A A . 1 GLY H1 1 1 14 10118 1 1 1 GLY H2 H 1.864 -5.602 10.163 1.00 . A A . 1 GLY H2 1 1 14 10119 1 1 1 GLY H3 H 0.400 -5.678 11.020 1.00 . A A . 1 GLY H3 1 1 14 10120 1 1 1 GLY HA2 H 0.106 -5.965 8.591 1.00 . A A . 1 GLY HA2 1 1 14 10121 1 1 1 GLY HA3 H -0.867 -4.608 9.236 1.00 . A A . 1 GLY HA3 1 1 14 10122 1 1 1 GLY N N 0.947 -5.138 10.319 1.00 . A A . 1 GLY N 1 1 14 10123 1 1 1 GLY O O 2.108 -4.797 7.682 1.00 . A A . 1 GLY O 1 1 14 10124 1 1 2 ILE C C 2.080 -3.134 5.728 1.00 . A A . 2 ILE C 1 1 14 10125 1 1 2 ILE CA C 0.852 -3.997 5.437 1.00 . A A . 2 ILE CA 1 1 14 10126 1 1 2 ILE CB C -0.136 -3.235 4.533 1.00 . A A . 2 ILE CB 1 1 14 10127 1 1 2 ILE CD1 C 0.012 -2.566 2.125 1.00 . A A . 2 ILE CD1 1 1 14 10128 1 1 2 ILE CG1 C 0.630 -2.383 3.511 1.00 . A A . 2 ILE CG1 1 1 14 10129 1 1 2 ILE CG2 C -1.028 -2.324 5.382 1.00 . A A . 2 ILE CG2 1 1 14 10130 1 1 2 ILE H H -0.794 -4.314 6.792 1.00 . A A . 2 ILE H 1 1 14 10131 1 1 2 ILE HA H 1.167 -4.894 4.939 1.00 . A A . 2 ILE HA 1 1 14 10132 1 1 2 ILE HB H -0.757 -3.948 4.010 1.00 . A A . 2 ILE HB 1 1 14 10133 1 1 2 ILE HD11 H -0.823 -3.247 2.190 1.00 . A A . 2 ILE HD11 1 1 14 10134 1 1 2 ILE HD12 H 0.754 -2.968 1.451 1.00 . A A . 2 ILE HD12 1 1 14 10135 1 1 2 ILE HD13 H -0.330 -1.611 1.754 1.00 . A A . 2 ILE HD13 1 1 14 10136 1 1 2 ILE HG12 H 0.573 -1.342 3.797 1.00 . A A . 2 ILE HG12 1 1 14 10137 1 1 2 ILE HG13 H 1.663 -2.693 3.485 1.00 . A A . 2 ILE HG13 1 1 14 10138 1 1 2 ILE HG21 H -2.060 -2.619 5.261 1.00 . A A . 2 ILE HG21 1 1 14 10139 1 1 2 ILE HG22 H -0.906 -1.301 5.059 1.00 . A A . 2 ILE HG22 1 1 14 10140 1 1 2 ILE HG23 H -0.748 -2.408 6.421 1.00 . A A . 2 ILE HG23 1 1 14 10141 1 1 2 ILE N N 0.182 -4.357 6.720 1.00 . A A . 2 ILE N 1 1 14 10142 1 1 2 ILE O O 3.197 -3.533 5.488 1.00 . A A . 2 ILE O 1 1 14 10143 1 1 3 ABA C C 4.211 -1.812 7.044 1.00 . A A . 3 ABA C 1 1 14 10144 1 1 3 ABA CA C 2.991 -1.036 6.541 1.00 . A A . 3 ABA CA 1 1 14 10145 1 1 3 ABA CB C 2.523 -0.051 7.605 1.00 . A A . 3 ABA CB 1 1 14 10146 1 1 3 ABA CG C 1.569 0.965 6.973 1.00 . A A . 3 ABA CG 1 1 14 10147 1 1 3 ABA H H 0.961 -1.669 6.404 1.00 . A A . 3 ABA H 1 1 14 10148 1 1 3 ABA HA H 3.260 -0.492 5.652 1.00 . A A . 3 ABA HA 1 1 14 10149 1 1 3 ABA HB2 H 2.014 -0.586 8.393 1.00 . A A . 3 ABA HB2 1 1 14 10150 1 1 3 ABA HB3 H 3.371 0.461 8.011 1.00 . A A . 3 ABA HB3 1 1 14 10151 1 1 3 ABA HG1 H 0.663 1.022 7.559 1.00 . A A . 3 ABA HG1 1 1 14 10152 1 1 3 ABA HG2 H 1.328 0.655 5.967 1.00 . A A . 3 ABA HG2 1 1 14 10153 1 1 3 ABA HG3 H 2.042 1.936 6.947 1.00 . A A . 3 ABA HG3 1 1 14 10154 1 1 3 ABA N N 1.869 -1.957 6.232 1.00 . A A . 3 ABA N 1 1 14 10155 1 1 3 ABA O O 5.005 -2.277 6.265 1.00 . A A . 3 ABA O 1 1 14 10156 1 1 4 GLU C C 6.116 -3.703 7.949 1.00 . A A . 4 GLU C 1 1 14 10157 1 1 4 GLU CA C 5.540 -2.661 8.923 1.00 . A A . 4 GLU CA 1 1 14 10158 1 1 4 GLU CB C 5.091 -3.370 10.197 1.00 . A A . 4 GLU CB 1 1 14 10159 1 1 4 GLU CD C 5.847 -4.186 12.436 1.00 . A A . 4 GLU CD 1 1 14 10160 1 1 4 GLU CG C 6.193 -3.278 11.254 1.00 . A A . 4 GLU CG 1 1 14 10161 1 1 4 GLU H H 3.704 -1.531 8.934 1.00 . A A . 4 GLU H 1 1 14 10162 1 1 4 GLU HA H 6.310 -1.947 9.172 1.00 . A A . 4 GLU HA 1 1 14 10163 1 1 4 GLU HB2 H 4.195 -2.898 10.569 1.00 . A A . 4 GLU HB2 1 1 14 10164 1 1 4 GLU HB3 H 4.888 -4.406 9.978 1.00 . A A . 4 GLU HB3 1 1 14 10165 1 1 4 GLU HG2 H 7.132 -3.591 10.821 1.00 . A A . 4 GLU HG2 1 1 14 10166 1 1 4 GLU HG3 H 6.277 -2.259 11.599 1.00 . A A . 4 GLU HG3 1 1 14 10167 1 1 4 GLU N N 4.365 -1.934 8.335 1.00 . A A . 4 GLU N 1 1 14 10168 1 1 4 GLU O O 7.316 -3.837 7.815 1.00 . A A . 4 GLU O 1 1 14 10169 1 1 4 GLU OE1 O 5.058 -3.769 13.267 1.00 . A A . 4 GLU OE1 1 1 14 10170 1 1 4 GLU OE2 O 6.379 -5.283 12.490 1.00 . A A . 4 GLU OE2 1 1 14 10171 1 1 5 GLN C C 6.143 -4.836 4.980 1.00 . A A . 5 GLN C 1 1 14 10172 1 1 5 GLN CA C 5.787 -5.479 6.326 1.00 . A A . 5 GLN CA 1 1 14 10173 1 1 5 GLN CB C 4.700 -6.533 6.107 1.00 . A A . 5 GLN CB 1 1 14 10174 1 1 5 GLN CD C 5.097 -8.942 6.641 1.00 . A A . 5 GLN CD 1 1 14 10175 1 1 5 GLN CG C 5.338 -7.833 5.615 1.00 . A A . 5 GLN CG 1 1 14 10176 1 1 5 GLN H H 4.313 -4.328 7.402 1.00 . A A . 5 GLN H 1 1 14 10177 1 1 5 GLN HA H 6.665 -5.950 6.742 1.00 . A A . 5 GLN HA 1 1 14 10178 1 1 5 GLN HB2 H 4.182 -6.713 7.038 1.00 . A A . 5 GLN HB2 1 1 14 10179 1 1 5 GLN HB3 H 3.998 -6.177 5.368 1.00 . A A . 5 GLN HB3 1 1 14 10180 1 1 5 GLN HE21 H 5.527 -7.790 8.200 1.00 . A A . 5 GLN HE21 1 1 14 10181 1 1 5 GLN HE22 H 5.106 -9.391 8.575 1.00 . A A . 5 GLN HE22 1 1 14 10182 1 1 5 GLN HG2 H 4.897 -8.115 4.669 1.00 . A A . 5 GLN HG2 1 1 14 10183 1 1 5 GLN HG3 H 6.400 -7.687 5.488 1.00 . A A . 5 GLN HG3 1 1 14 10184 1 1 5 GLN N N 5.277 -4.444 7.277 1.00 . A A . 5 GLN N 1 1 14 10185 1 1 5 GLN NE2 N 5.256 -8.686 7.911 1.00 . A A . 5 GLN NE2 1 1 14 10186 1 1 5 GLN O O 7.121 -5.185 4.350 1.00 . A A . 5 GLN O 1 1 14 10187 1 1 5 GLN OE1 O 4.759 -10.054 6.284 1.00 . A A . 5 GLN OE1 1 1 14 10188 1 1 6 CYS C C 6.183 -1.840 3.474 1.00 . A A . 6 CYS C 1 1 14 10189 1 1 6 CYS CA C 5.601 -3.239 3.230 1.00 . A A . 6 CYS CA 1 1 14 10190 1 1 6 CYS CB C 4.275 -3.153 2.477 1.00 . A A . 6 CYS CB 1 1 14 10191 1 1 6 CYS H H 4.559 -3.653 5.060 1.00 . A A . 6 CYS H 1 1 14 10192 1 1 6 CYS HA H 6.305 -3.821 2.648 1.00 . A A . 6 CYS HA 1 1 14 10193 1 1 6 CYS HB2 H 3.455 -3.170 3.178 1.00 . A A . 6 CYS HB2 1 1 14 10194 1 1 6 CYS HB3 H 4.234 -2.249 1.910 1.00 . A A . 6 CYS HB3 1 1 14 10195 1 1 6 CYS N N 5.345 -3.909 4.534 1.00 . A A . 6 CYS N 1 1 14 10196 1 1 6 CYS O O 6.299 -1.027 2.576 1.00 . A A . 6 CYS O 1 1 14 10197 1 1 6 CYS SG S 4.149 -4.575 1.369 1.00 . A A . 6 CYS SG 1 1 14 10198 1 1 7 CYS C C 8.613 -0.487 5.444 1.00 . A A . 7 CYS C 1 1 14 10199 1 1 7 CYS CA C 7.163 -0.249 5.024 1.00 . A A . 7 CYS CA 1 1 14 10200 1 1 7 CYS CB C 6.375 0.395 6.168 1.00 . A A . 7 CYS CB 1 1 14 10201 1 1 7 CYS H H 6.472 -2.246 5.389 1.00 . A A . 7 CYS H 1 1 14 10202 1 1 7 CYS HA H 7.138 0.395 4.156 1.00 . A A . 7 CYS HA 1 1 14 10203 1 1 7 CYS HB2 H 5.347 0.529 5.866 1.00 . A A . 7 CYS HB2 1 1 14 10204 1 1 7 CYS HB3 H 6.410 -0.242 7.034 1.00 . A A . 7 CYS HB3 1 1 14 10205 1 1 7 CYS N N 6.567 -1.568 4.689 1.00 . A A . 7 CYS N 1 1 14 10206 1 1 7 CYS O O 9.468 0.362 5.289 1.00 . A A . 7 CYS O 1 1 14 10207 1 1 7 CYS SG S 7.099 2.004 6.572 1.00 . A A . 7 CYS SG 1 1 14 10208 1 1 8 THR C C 10.974 -2.653 5.153 1.00 . A A . 8 THR C 1 1 14 10209 1 1 8 THR CA C 10.291 -1.988 6.348 1.00 . A A . 8 THR CA 1 1 14 10210 1 1 8 THR CB C 10.274 -2.959 7.532 1.00 . A A . 8 THR CB 1 1 14 10211 1 1 8 THR CG2 C 9.341 -2.427 8.623 1.00 . A A . 8 THR CG2 1 1 14 10212 1 1 8 THR H H 8.194 -2.338 6.042 1.00 . A A . 8 THR H 1 1 14 10213 1 1 8 THR HA H 10.819 -1.085 6.617 1.00 . A A . 8 THR HA 1 1 14 10214 1 1 8 THR HB H 11.271 -3.055 7.932 1.00 . A A . 8 THR HB 1 1 14 10215 1 1 8 THR HG1 H 9.487 -4.709 7.856 1.00 . A A . 8 THR HG1 1 1 14 10216 1 1 8 THR HG21 H 8.568 -1.822 8.173 1.00 . A A . 8 THR HG21 1 1 14 10217 1 1 8 THR HG22 H 9.908 -1.828 9.320 1.00 . A A . 8 THR HG22 1 1 14 10218 1 1 8 THR HG23 H 8.890 -3.257 9.146 1.00 . A A . 8 THR HG23 1 1 14 10219 1 1 8 THR N N 8.897 -1.660 5.949 1.00 . A A . 8 THR N 1 1 14 10220 1 1 8 THR O O 12.183 -2.683 5.045 1.00 . A A . 8 THR O 1 1 14 10221 1 1 8 THR OG1 O 9.815 -4.230 7.091 1.00 . A A . 8 THR OG1 1 1 14 10222 1 1 9 SER C C 10.217 -3.136 1.791 1.00 . A A . 9 SER C 1 1 14 10223 1 1 9 SER CA C 10.757 -3.843 3.043 1.00 . A A . 9 SER CA 1 1 14 10224 1 1 9 SER CB C 10.350 -5.321 3.036 1.00 . A A . 9 SER CB 1 1 14 10225 1 1 9 SER H H 9.216 -3.132 4.365 1.00 . A A . 9 SER H 1 1 14 10226 1 1 9 SER HA H 11.835 -3.765 3.064 1.00 . A A . 9 SER HA 1 1 14 10227 1 1 9 SER HB2 H 9.327 -5.414 2.712 1.00 . A A . 9 SER HB2 1 1 14 10228 1 1 9 SER HB3 H 10.991 -5.868 2.356 1.00 . A A . 9 SER HB3 1 1 14 10229 1 1 9 SER HG H 10.909 -6.700 4.289 1.00 . A A . 9 SER HG 1 1 14 10230 1 1 9 SER N N 10.189 -3.180 4.250 1.00 . A A . 9 SER N 1 1 14 10231 1 1 9 SER O O 10.283 -1.928 1.686 1.00 . A A . 9 SER O 1 1 14 10232 1 1 9 SER OG O 10.473 -5.848 4.351 1.00 . A A . 9 SER OG 1 1 14 10233 1 1 10 ILE C C 7.712 -3.685 -0.647 1.00 . A A . 10 ILE C 1 1 14 10234 1 1 10 ILE CA C 9.153 -3.205 -0.387 1.00 . A A . 10 ILE CA 1 1 14 10235 1 1 10 ILE CB C 10.055 -3.576 -1.581 1.00 . A A . 10 ILE CB 1 1 14 10236 1 1 10 ILE CD1 C 11.965 -2.401 -0.459 1.00 . A A . 10 ILE CD1 1 1 14 10237 1 1 10 ILE CG1 C 11.157 -2.528 -1.752 1.00 . A A . 10 ILE CG1 1 1 14 10238 1 1 10 ILE CG2 C 9.229 -3.642 -2.868 1.00 . A A . 10 ILE CG2 1 1 14 10239 1 1 10 ILE H H 9.636 -4.836 0.932 1.00 . A A . 10 ILE H 1 1 14 10240 1 1 10 ILE HA H 9.157 -2.133 -0.252 1.00 . A A . 10 ILE HA 1 1 14 10241 1 1 10 ILE HB H 10.508 -4.538 -1.400 1.00 . A A . 10 ILE HB 1 1 14 10242 1 1 10 ILE HD11 H 13.007 -2.251 -0.700 1.00 . A A . 10 ILE HD11 1 1 14 10243 1 1 10 ILE HD12 H 11.857 -3.303 0.125 1.00 . A A . 10 ILE HD12 1 1 14 10244 1 1 10 ILE HD13 H 11.604 -1.557 0.109 1.00 . A A . 10 ILE HD13 1 1 14 10245 1 1 10 ILE HG12 H 11.813 -2.827 -2.556 1.00 . A A . 10 ILE HG12 1 1 14 10246 1 1 10 ILE HG13 H 10.712 -1.579 -1.990 1.00 . A A . 10 ILE HG13 1 1 14 10247 1 1 10 ILE HG21 H 9.877 -3.853 -3.703 1.00 . A A . 10 ILE HG21 1 1 14 10248 1 1 10 ILE HG22 H 8.732 -2.696 -3.024 1.00 . A A . 10 ILE HG22 1 1 14 10249 1 1 10 ILE HG23 H 8.489 -4.425 -2.778 1.00 . A A . 10 ILE HG23 1 1 14 10250 1 1 10 ILE N N 9.685 -3.863 0.842 1.00 . A A . 10 ILE N 1 1 14 10251 1 1 10 ILE O O 7.289 -4.710 -0.149 1.00 . A A . 10 ILE O 1 1 14 10252 1 1 11 CYS C C 5.295 -3.136 -3.254 1.00 . A A . 11 CYS C 1 1 14 10253 1 1 11 CYS CA C 5.572 -3.383 -1.771 1.00 . A A . 11 CYS CA 1 1 14 10254 1 1 11 CYS CB C 4.568 -2.627 -0.913 1.00 . A A . 11 CYS CB 1 1 14 10255 1 1 11 CYS H H 7.344 -2.144 -1.854 1.00 . A A . 11 CYS H 1 1 14 10256 1 1 11 CYS HA H 5.459 -4.432 -1.573 1.00 . A A . 11 CYS HA 1 1 14 10257 1 1 11 CYS HB2 H 5.075 -2.173 -0.076 1.00 . A A . 11 CYS HB2 1 1 14 10258 1 1 11 CYS HB3 H 4.079 -1.867 -1.502 1.00 . A A . 11 CYS HB3 1 1 14 10259 1 1 11 CYS N N 6.971 -2.960 -1.448 1.00 . A A . 11 CYS N 1 1 14 10260 1 1 11 CYS O O 5.473 -2.047 -3.761 1.00 . A A . 11 CYS O 1 1 14 10261 1 1 11 CYS SG S 3.342 -3.818 -0.313 1.00 . A A . 11 CYS SG 1 1 14 10262 1 1 12 SER C C 3.244 -3.364 -5.641 1.00 . A A . 12 SER C 1 1 14 10263 1 1 12 SER CA C 4.606 -4.013 -5.415 1.00 . A A . 12 SER CA 1 1 14 10264 1 1 12 SER CB C 4.627 -5.394 -6.071 1.00 . A A . 12 SER CB 1 1 14 10265 1 1 12 SER H H 4.758 -5.028 -3.523 1.00 . A A . 12 SER H 1 1 14 10266 1 1 12 SER HA H 5.367 -3.395 -5.867 1.00 . A A . 12 SER HA 1 1 14 10267 1 1 12 SER HB2 H 3.827 -5.465 -6.790 1.00 . A A . 12 SER HB2 1 1 14 10268 1 1 12 SER HB3 H 5.574 -5.538 -6.574 1.00 . A A . 12 SER HB3 1 1 14 10269 1 1 12 SER HG H 3.718 -6.953 -5.343 1.00 . A A . 12 SER HG 1 1 14 10270 1 1 12 SER N N 4.879 -4.157 -3.956 1.00 . A A . 12 SER N 1 1 14 10271 1 1 12 SER O O 2.367 -3.400 -4.800 1.00 . A A . 12 SER O 1 1 14 10272 1 1 12 SER OG O 4.448 -6.390 -5.073 1.00 . A A . 12 SER OG 1 1 14 10273 1 1 13 LEU C C 0.665 -3.139 -7.180 1.00 . A A . 13 LEU C 1 1 14 10274 1 1 13 LEU CA C 1.788 -2.103 -7.116 1.00 . A A . 13 LEU CA 1 1 14 10275 1 1 13 LEU CB C 1.921 -1.419 -8.474 1.00 . A A . 13 LEU CB 1 1 14 10276 1 1 13 LEU CD1 C 1.621 -2.165 -10.833 1.00 . A A . 13 LEU CD1 1 1 14 10277 1 1 13 LEU CD2 C 3.827 -2.451 -9.713 1.00 . A A . 13 LEU CD2 1 1 14 10278 1 1 13 LEU CG C 2.313 -2.468 -9.509 1.00 . A A . 13 LEU CG 1 1 14 10279 1 1 13 LEU H H 3.806 -2.762 -7.434 1.00 . A A . 13 LEU H 1 1 14 10280 1 1 13 LEU HA H 1.558 -1.370 -6.365 1.00 . A A . 13 LEU HA 1 1 14 10281 1 1 13 LEU HB2 H 0.977 -0.971 -8.749 1.00 . A A . 13 LEU HB2 1 1 14 10282 1 1 13 LEU HB3 H 2.685 -0.658 -8.426 1.00 . A A . 13 LEU HB3 1 1 14 10283 1 1 13 LEU HD11 H 0.773 -2.822 -10.953 1.00 . A A . 13 LEU HD11 1 1 14 10284 1 1 13 LEU HD12 H 2.317 -2.322 -11.644 1.00 . A A . 13 LEU HD12 1 1 14 10285 1 1 13 LEU HD13 H 1.287 -1.139 -10.837 1.00 . A A . 13 LEU HD13 1 1 14 10286 1 1 13 LEU HD21 H 4.047 -2.399 -10.768 1.00 . A A . 13 LEU HD21 1 1 14 10287 1 1 13 LEU HD22 H 4.254 -3.353 -9.299 1.00 . A A . 13 LEU HD22 1 1 14 10288 1 1 13 LEU HD23 H 4.248 -1.591 -9.213 1.00 . A A . 13 LEU HD23 1 1 14 10289 1 1 13 LEU HG H 2.006 -3.440 -9.154 1.00 . A A . 13 LEU HG 1 1 14 10290 1 1 13 LEU N N 3.075 -2.770 -6.785 1.00 . A A . 13 LEU N 1 1 14 10291 1 1 13 LEU O O -0.500 -2.798 -7.244 1.00 . A A . 13 LEU O 1 1 14 10292 1 1 14 TYR C C -0.248 -5.919 -5.758 1.00 . A A . 14 TYR C 1 1 14 10293 1 1 14 TYR CA C -0.076 -5.432 -7.174 1.00 . A A . 14 TYR CA 1 1 14 10294 1 1 14 TYR CB C 0.341 -6.578 -8.104 1.00 . A A . 14 TYR CB 1 1 14 10295 1 1 14 TYR CD1 C -1.805 -7.907 -8.101 1.00 . A A . 14 TYR CD1 1 1 14 10296 1 1 14 TYR CD2 C 0.190 -8.910 -7.149 1.00 . A A . 14 TYR CD2 1 1 14 10297 1 1 14 TYR CE1 C -2.531 -9.068 -7.800 1.00 . A A . 14 TYR CE1 1 1 14 10298 1 1 14 TYR CE2 C -0.537 -10.070 -6.848 1.00 . A A . 14 TYR CE2 1 1 14 10299 1 1 14 TYR CG C -0.444 -7.828 -7.776 1.00 . A A . 14 TYR CG 1 1 14 10300 1 1 14 TYR CZ C -1.897 -10.149 -7.174 1.00 . A A . 14 TYR CZ 1 1 14 10301 1 1 14 TYR H H 1.935 -4.672 -7.051 1.00 . A A . 14 TYR H 1 1 14 10302 1 1 14 TYR HA H -0.995 -4.986 -7.511 1.00 . A A . 14 TYR HA 1 1 14 10303 1 1 14 TYR HB2 H 0.151 -6.292 -9.128 1.00 . A A . 14 TYR HB2 1 1 14 10304 1 1 14 TYR HB3 H 1.396 -6.773 -7.977 1.00 . A A . 14 TYR HB3 1 1 14 10305 1 1 14 TYR HD1 H -2.294 -7.074 -8.584 1.00 . A A . 14 TYR HD1 1 1 14 10306 1 1 14 TYR HD2 H 1.239 -8.850 -6.897 1.00 . A A . 14 TYR HD2 1 1 14 10307 1 1 14 TYR HE1 H -3.580 -9.129 -8.051 1.00 . A A . 14 TYR HE1 1 1 14 10308 1 1 14 TYR HE2 H -0.048 -10.903 -6.365 1.00 . A A . 14 TYR HE2 1 1 14 10309 1 1 14 TYR HH H -2.176 -12.033 -7.310 1.00 . A A . 14 TYR HH 1 1 14 10310 1 1 14 TYR N N 0.992 -4.401 -7.137 1.00 . A A . 14 TYR N 1 1 14 10311 1 1 14 TYR O O -1.333 -6.214 -5.297 1.00 . A A . 14 TYR O 1 1 14 10312 1 1 14 TYR OH O -2.611 -11.293 -6.880 1.00 . A A . 14 TYR OH 1 1 14 10313 1 1 15 GLN C C 0.013 -5.240 -2.917 1.00 . A A . 15 GLN C 1 1 14 10314 1 1 15 GLN CA C 0.790 -6.328 -3.642 1.00 . A A . 15 GLN CA 1 1 14 10315 1 1 15 GLN CB C 2.223 -6.353 -3.137 1.00 . A A . 15 GLN CB 1 1 14 10316 1 1 15 GLN CD C 2.080 -8.483 -1.845 1.00 . A A . 15 GLN CD 1 1 14 10317 1 1 15 GLN CG C 2.722 -7.791 -3.048 1.00 . A A . 15 GLN CG 1 1 14 10318 1 1 15 GLN H H 1.675 -5.650 -5.455 1.00 . A A . 15 GLN H 1 1 14 10319 1 1 15 GLN HA H 0.318 -7.288 -3.518 1.00 . A A . 15 GLN HA 1 1 14 10320 1 1 15 GLN HB2 H 2.845 -5.799 -3.831 1.00 . A A . 15 GLN HB2 1 1 14 10321 1 1 15 GLN HB3 H 2.266 -5.891 -2.170 1.00 . A A . 15 GLN HB3 1 1 14 10322 1 1 15 GLN HE21 H 2.228 -10.299 -2.633 1.00 . A A . 15 GLN HE21 1 1 14 10323 1 1 15 GLN HE22 H 1.520 -10.232 -1.092 1.00 . A A . 15 GLN HE22 1 1 14 10324 1 1 15 GLN HG2 H 2.459 -8.317 -3.954 1.00 . A A . 15 GLN HG2 1 1 14 10325 1 1 15 GLN HG3 H 3.795 -7.788 -2.932 1.00 . A A . 15 GLN HG3 1 1 14 10326 1 1 15 GLN N N 0.829 -5.939 -5.054 1.00 . A A . 15 GLN N 1 1 14 10327 1 1 15 GLN NE2 N 1.930 -9.779 -1.857 1.00 . A A . 15 GLN NE2 1 1 14 10328 1 1 15 GLN O O -0.706 -5.476 -1.965 1.00 . A A . 15 GLN O 1 1 14 10329 1 1 15 GLN OE1 O 1.713 -7.838 -0.883 1.00 . A A . 15 GLN OE1 1 1 14 10330 1 1 16 LEU C C -1.973 -2.881 -3.366 1.00 . A A . 16 LEU C 1 1 14 10331 1 1 16 LEU CA C -0.564 -2.888 -2.816 1.00 . A A . 16 LEU CA 1 1 14 10332 1 1 16 LEU CB C 0.185 -1.618 -3.207 1.00 . A A . 16 LEU CB 1 1 14 10333 1 1 16 LEU CD1 C 2.337 -0.386 -2.826 1.00 . A A . 16 LEU CD1 1 1 14 10334 1 1 16 LEU CD2 C 1.363 -1.819 -1.036 1.00 . A A . 16 LEU CD2 1 1 14 10335 1 1 16 LEU CG C 1.556 -1.663 -2.538 1.00 . A A . 16 LEU CG 1 1 14 10336 1 1 16 LEU H H 0.714 -3.901 -4.196 1.00 . A A . 16 LEU H 1 1 14 10337 1 1 16 LEU HA H -0.596 -2.978 -1.744 1.00 . A A . 16 LEU HA 1 1 14 10338 1 1 16 LEU HB2 H 0.305 -1.577 -4.280 1.00 . A A . 16 LEU HB2 1 1 14 10339 1 1 16 LEU HB3 H -0.358 -0.755 -2.869 1.00 . A A . 16 LEU HB3 1 1 14 10340 1 1 16 LEU HD11 H 2.971 -0.156 -1.982 1.00 . A A . 16 LEU HD11 1 1 14 10341 1 1 16 LEU HD12 H 1.649 0.425 -2.993 1.00 . A A . 16 LEU HD12 1 1 14 10342 1 1 16 LEU HD13 H 2.948 -0.530 -3.705 1.00 . A A . 16 LEU HD13 1 1 14 10343 1 1 16 LEU HD21 H 0.574 -1.168 -0.703 1.00 . A A . 16 LEU HD21 1 1 14 10344 1 1 16 LEU HD22 H 2.283 -1.565 -0.529 1.00 . A A . 16 LEU HD22 1 1 14 10345 1 1 16 LEU HD23 H 1.103 -2.845 -0.816 1.00 . A A . 16 LEU HD23 1 1 14 10346 1 1 16 LEU HG H 2.109 -2.508 -2.914 1.00 . A A . 16 LEU HG 1 1 14 10347 1 1 16 LEU N N 0.148 -4.041 -3.406 1.00 . A A . 16 LEU N 1 1 14 10348 1 1 16 LEU O O -2.899 -2.390 -2.752 1.00 . A A . 16 LEU O 1 1 14 10349 1 1 17 GLU C C -4.305 -4.558 -4.349 1.00 . A A . 17 GLU C 1 1 14 10350 1 1 17 GLU CA C -3.478 -3.528 -5.120 1.00 . A A . 17 GLU CA 1 1 14 10351 1 1 17 GLU CB C -3.325 -3.970 -6.573 1.00 . A A . 17 GLU CB 1 1 14 10352 1 1 17 GLU CD C -4.568 -4.616 -8.641 1.00 . A A . 17 GLU CD 1 1 14 10353 1 1 17 GLU CG C -4.690 -3.966 -7.262 1.00 . A A . 17 GLU CG 1 1 14 10354 1 1 17 GLU H H -1.376 -3.866 -4.977 1.00 . A A . 17 GLU H 1 1 14 10355 1 1 17 GLU HA H -3.949 -2.560 -5.076 1.00 . A A . 17 GLU HA 1 1 14 10356 1 1 17 GLU HB2 H -2.655 -3.291 -7.082 1.00 . A A . 17 GLU HB2 1 1 14 10357 1 1 17 GLU HB3 H -2.910 -4.967 -6.599 1.00 . A A . 17 GLU HB3 1 1 14 10358 1 1 17 GLU HG2 H -5.397 -4.521 -6.662 1.00 . A A . 17 GLU HG2 1 1 14 10359 1 1 17 GLU HG3 H -5.034 -2.949 -7.375 1.00 . A A . 17 GLU HG3 1 1 14 10360 1 1 17 GLU N N -2.139 -3.457 -4.515 1.00 . A A . 17 GLU N 1 1 14 10361 1 1 17 GLU O O -5.521 -4.548 -4.378 1.00 . A A . 17 GLU O 1 1 14 10362 1 1 17 GLU OE1 O -3.631 -4.286 -9.350 1.00 . A A . 17 GLU OE1 1 1 14 10363 1 1 17 GLU OE2 O -5.413 -5.434 -8.966 1.00 . A A . 17 GLU OE2 1 1 14 10364 1 1 18 ASN C C -4.988 -5.864 -1.617 1.00 . A A . 18 ASN C 1 1 14 10365 1 1 18 ASN CA C -4.407 -6.485 -2.885 1.00 . A A . 18 ASN CA 1 1 14 10366 1 1 18 ASN CB C -3.474 -7.635 -2.504 1.00 . A A . 18 ASN CB 1 1 14 10367 1 1 18 ASN CG C -3.653 -8.789 -3.492 1.00 . A A . 18 ASN CG 1 1 14 10368 1 1 18 ASN H H -2.663 -5.441 -3.633 1.00 . A A . 18 ASN H 1 1 14 10369 1 1 18 ASN HA H -5.211 -6.865 -3.497 1.00 . A A . 18 ASN HA 1 1 14 10370 1 1 18 ASN HB2 H -2.453 -7.291 -2.530 1.00 . A A . 18 ASN HB2 1 1 14 10371 1 1 18 ASN HB3 H -3.712 -7.977 -1.508 1.00 . A A . 18 ASN HB3 1 1 14 10372 1 1 18 ASN HD21 H -2.390 -8.032 -4.824 1.00 . A A . 18 ASN HD21 1 1 14 10373 1 1 18 ASN HD22 H -3.100 -9.512 -5.257 1.00 . A A . 18 ASN HD22 1 1 14 10374 1 1 18 ASN N N -3.650 -5.452 -3.651 1.00 . A A . 18 ASN N 1 1 14 10375 1 1 18 ASN ND2 N -2.993 -8.777 -4.618 1.00 . A A . 18 ASN ND2 1 1 14 10376 1 1 18 ASN O O -5.654 -6.523 -0.843 1.00 . A A . 18 ASN O 1 1 14 10377 1 1 18 ASN OD1 O -4.401 -9.712 -3.237 1.00 . A A . 18 ASN OD1 1 1 14 10378 1 1 19 TYR C C -6.458 -3.051 -0.534 1.00 . A A . 19 TYR C 1 1 14 10379 1 1 19 TYR CA C -5.284 -3.960 -0.169 1.00 . A A . 19 TYR CA 1 1 14 10380 1 1 19 TYR CB C -4.181 -3.152 0.509 1.00 . A A . 19 TYR CB 1 1 14 10381 1 1 19 TYR CD1 C -2.079 -4.521 0.256 1.00 . A A . 19 TYR CD1 1 1 14 10382 1 1 19 TYR CD2 C -3.267 -4.583 2.370 1.00 . A A . 19 TYR CD2 1 1 14 10383 1 1 19 TYR CE1 C -1.126 -5.413 0.765 1.00 . A A . 19 TYR CE1 1 1 14 10384 1 1 19 TYR CE2 C -2.316 -5.476 2.880 1.00 . A A . 19 TYR CE2 1 1 14 10385 1 1 19 TYR CG C -3.149 -4.105 1.059 1.00 . A A . 19 TYR CG 1 1 14 10386 1 1 19 TYR CZ C -1.244 -5.891 2.077 1.00 . A A . 19 TYR CZ 1 1 14 10387 1 1 19 TYR H H -4.201 -4.088 -2.024 1.00 . A A . 19 TYR H 1 1 14 10388 1 1 19 TYR HA H -5.628 -4.724 0.510 1.00 . A A . 19 TYR HA 1 1 14 10389 1 1 19 TYR HB2 H -3.721 -2.491 -0.212 1.00 . A A . 19 TYR HB2 1 1 14 10390 1 1 19 TYR HB3 H -4.603 -2.574 1.316 1.00 . A A . 19 TYR HB3 1 1 14 10391 1 1 19 TYR HD1 H -1.988 -4.152 -0.755 1.00 . A A . 19 TYR HD1 1 1 14 10392 1 1 19 TYR HD2 H -4.093 -4.263 2.989 1.00 . A A . 19 TYR HD2 1 1 14 10393 1 1 19 TYR HE1 H -0.300 -5.733 0.147 1.00 . A A . 19 TYR HE1 1 1 14 10394 1 1 19 TYR HE2 H -2.408 -5.844 3.890 1.00 . A A . 19 TYR HE2 1 1 14 10395 1 1 19 TYR HH H -0.637 -7.663 2.446 1.00 . A A . 19 TYR HH 1 1 14 10396 1 1 19 TYR N N -4.742 -4.606 -1.392 1.00 . A A . 19 TYR N 1 1 14 10397 1 1 19 TYR O O -6.774 -2.117 0.176 1.00 . A A . 19 TYR O 1 1 14 10398 1 1 19 TYR OH O -0.307 -6.772 2.579 1.00 . A A . 19 TYR OH 1 1 14 10399 1 1 20 CYS C C -9.576 -3.180 -1.637 1.00 . A A . 20 CYS C 1 1 14 10400 1 1 20 CYS CA C -8.277 -2.470 -2.021 1.00 . A A . 20 CYS CA 1 1 14 10401 1 1 20 CYS CB C -8.261 -2.235 -3.530 1.00 . A A . 20 CYS CB 1 1 14 10402 1 1 20 CYS H H -6.854 -4.082 -2.188 1.00 . A A . 20 CYS H 1 1 14 10403 1 1 20 CYS HA H -8.219 -1.522 -1.508 1.00 . A A . 20 CYS HA 1 1 14 10404 1 1 20 CYS HB2 H -8.707 -3.081 -4.031 1.00 . A A . 20 CYS HB2 1 1 14 10405 1 1 20 CYS HB3 H -8.825 -1.344 -3.760 1.00 . A A . 20 CYS HB3 1 1 14 10406 1 1 20 CYS N N -7.116 -3.320 -1.630 1.00 . A A . 20 CYS N 1 1 14 10407 1 1 20 CYS O O -9.662 -4.392 -1.662 1.00 . A A . 20 CYS O 1 1 14 10408 1 1 20 CYS SG S -6.556 -2.030 -4.093 1.00 . A A . 20 CYS SG 1 1 14 10409 1 1 21 ASN C C -12.268 -4.114 -1.955 1.00 . A A . 21 ASN C 1 1 14 10410 1 1 21 ASN CA C -11.878 -3.078 -0.899 1.00 . A A . 21 ASN CA 1 1 14 10411 1 1 21 ASN CB C -12.970 -2.010 -0.805 1.00 . A A . 21 ASN CB 1 1 14 10412 1 1 21 ASN CG C -14.189 -2.589 -0.088 1.00 . A A . 21 ASN CG 1 1 14 10413 1 1 21 ASN H H -10.501 -1.462 -1.269 1.00 . A A . 21 ASN H 1 1 14 10414 1 1 21 ASN HA H -11.768 -3.564 0.059 1.00 . A A . 21 ASN HA 1 1 14 10415 1 1 21 ASN HB2 H -12.595 -1.160 -0.253 1.00 . A A . 21 ASN HB2 1 1 14 10416 1 1 21 ASN HB3 H -13.254 -1.697 -1.799 1.00 . A A . 21 ASN HB3 1 1 14 10417 1 1 21 ASN HD21 H -13.633 -1.921 1.697 1.00 . A A . 21 ASN HD21 1 1 14 10418 1 1 21 ASN HD22 H -15.093 -2.787 1.668 1.00 . A A . 21 ASN HD22 1 1 14 10419 1 1 21 ASN N N -10.589 -2.439 -1.282 1.00 . A A . 21 ASN N 1 1 14 10420 1 1 21 ASN ND2 N -14.316 -2.418 1.199 1.00 . A A . 21 ASN ND2 1 1 14 10421 1 1 21 ASN O O -12.211 -3.786 -3.128 1.00 . A A . 21 ASN O 1 1 14 10422 1 1 21 ASN OXT O -12.617 -5.218 -1.571 1.00 . A A . 21 ASN OXT 1 1 14 10423 1 1 21 ASN OD1 O -15.037 -3.203 -0.705 1.00 . A A . 21 ASN OD1 1 1 14 10424 2 2 1 PHE C C 8.809 1.274 -10.579 1.00 . B B . 1 PHE C 1 1 14 10425 2 2 1 PHE CA C 7.396 1.587 -11.075 1.00 . B B . 1 PHE CA 1 1 14 10426 2 2 1 PHE CB C 6.891 0.428 -11.941 1.00 . B B . 1 PHE CB 1 1 14 10427 2 2 1 PHE CD1 C 4.618 1.352 -12.525 1.00 . B B . 1 PHE CD1 1 1 14 10428 2 2 1 PHE CD2 C 6.233 1.011 -14.304 1.00 . B B . 1 PHE CD2 1 1 14 10429 2 2 1 PHE CE1 C 3.689 1.829 -13.460 1.00 . B B . 1 PHE CE1 1 1 14 10430 2 2 1 PHE CE2 C 5.305 1.488 -15.239 1.00 . B B . 1 PHE CE2 1 1 14 10431 2 2 1 PHE CG C 5.890 0.943 -12.947 1.00 . B B . 1 PHE CG 1 1 14 10432 2 2 1 PHE CZ C 4.033 1.897 -14.817 1.00 . B B . 1 PHE CZ 1 1 14 10433 2 2 1 PHE H1 H 6.448 3.155 -12.067 1.00 . B B . 1 PHE H1 1 1 14 10434 2 2 1 PHE H2 H 7.905 2.659 -12.786 1.00 . B B . 1 PHE H2 1 1 14 10435 2 2 1 PHE H3 H 7.929 3.580 -11.359 1.00 . B B . 1 PHE H3 1 1 14 10436 2 2 1 PHE HA H 6.738 1.718 -10.229 1.00 . B B . 1 PHE HA 1 1 14 10437 2 2 1 PHE HB2 H 7.725 -0.021 -12.461 1.00 . B B . 1 PHE HB2 1 1 14 10438 2 2 1 PHE HB3 H 6.420 -0.311 -11.311 1.00 . B B . 1 PHE HB3 1 1 14 10439 2 2 1 PHE HD1 H 4.353 1.300 -11.480 1.00 . B B . 1 PHE HD1 1 1 14 10440 2 2 1 PHE HD2 H 7.214 0.695 -14.629 1.00 . B B . 1 PHE HD2 1 1 14 10441 2 2 1 PHE HE1 H 2.709 2.145 -13.134 1.00 . B B . 1 PHE HE1 1 1 14 10442 2 2 1 PHE HE2 H 5.570 1.540 -16.285 1.00 . B B . 1 PHE HE2 1 1 14 10443 2 2 1 PHE HZ H 3.317 2.264 -15.537 1.00 . B B . 1 PHE HZ 1 1 14 10444 2 2 1 PHE N N 7.421 2.840 -11.883 1.00 . B B . 1 PHE N 1 1 14 10445 2 2 1 PHE O O 9.781 1.478 -11.279 1.00 . B B . 1 PHE O 1 1 14 10446 2 2 2 VAL C C 10.154 -0.530 -7.677 1.00 . B B . 2 VAL C 1 1 14 10447 2 2 2 VAL CA C 10.290 0.458 -8.841 1.00 . B B . 2 VAL CA 1 1 14 10448 2 2 2 VAL CB C 10.990 1.734 -8.344 1.00 . B B . 2 VAL CB 1 1 14 10449 2 2 2 VAL CG1 C 12.335 1.887 -9.057 1.00 . B B . 2 VAL CG1 1 1 14 10450 2 2 2 VAL CG2 C 10.125 2.967 -8.635 1.00 . B B . 2 VAL CG2 1 1 14 10451 2 2 2 VAL H H 8.139 0.624 -8.826 1.00 . B B . 2 VAL H 1 1 14 10452 2 2 2 VAL HA H 10.883 0.007 -9.623 1.00 . B B . 2 VAL HA 1 1 14 10453 2 2 2 VAL HB H 11.159 1.656 -7.279 1.00 . B B . 2 VAL HB 1 1 14 10454 2 2 2 VAL HG11 H 12.751 2.860 -8.837 1.00 . B B . 2 VAL HG11 1 1 14 10455 2 2 2 VAL HG12 H 12.190 1.792 -10.123 1.00 . B B . 2 VAL HG12 1 1 14 10456 2 2 2 VAL HG13 H 13.014 1.120 -8.716 1.00 . B B . 2 VAL HG13 1 1 14 10457 2 2 2 VAL HG21 H 9.135 2.815 -8.232 1.00 . B B . 2 VAL HG21 1 1 14 10458 2 2 2 VAL HG22 H 10.060 3.118 -9.702 1.00 . B B . 2 VAL HG22 1 1 14 10459 2 2 2 VAL HG23 H 10.571 3.837 -8.175 1.00 . B B . 2 VAL HG23 1 1 14 10460 2 2 2 VAL N N 8.934 0.781 -9.376 1.00 . B B . 2 VAL N 1 1 14 10461 2 2 2 VAL O O 9.150 -1.197 -7.529 1.00 . B B . 2 VAL O 1 1 14 10462 2 2 3 ASN C C 11.486 -0.822 -4.425 1.00 . B B . 3 ASN C 1 1 14 10463 2 2 3 ASN CA C 11.101 -1.568 -5.697 1.00 . B B . 3 ASN CA 1 1 14 10464 2 2 3 ASN CB C 12.083 -2.705 -5.933 1.00 . B B . 3 ASN CB 1 1 14 10465 2 2 3 ASN CG C 11.514 -4.007 -5.367 1.00 . B B . 3 ASN CG 1 1 14 10466 2 2 3 ASN H H 11.962 -0.078 -6.992 1.00 . B B . 3 ASN H 1 1 14 10467 2 2 3 ASN HA H 10.101 -1.963 -5.599 1.00 . B B . 3 ASN HA 1 1 14 10468 2 2 3 ASN HB2 H 12.241 -2.809 -6.990 1.00 . B B . 3 ASN HB2 1 1 14 10469 2 2 3 ASN HB3 H 13.021 -2.481 -5.447 1.00 . B B . 3 ASN HB3 1 1 14 10470 2 2 3 ASN HD21 H 12.759 -4.042 -3.820 1.00 . B B . 3 ASN HD21 1 1 14 10471 2 2 3 ASN HD22 H 11.665 -5.338 -3.900 1.00 . B B . 3 ASN HD22 1 1 14 10472 2 2 3 ASN N N 11.161 -0.626 -6.852 1.00 . B B . 3 ASN N 1 1 14 10473 2 2 3 ASN ND2 N 12.021 -4.504 -4.271 1.00 . B B . 3 ASN ND2 1 1 14 10474 2 2 3 ASN O O 12.481 -1.114 -3.791 1.00 . B B . 3 ASN O 1 1 14 10475 2 2 3 ASN OD1 O 10.599 -4.579 -5.926 1.00 . B B . 3 ASN OD1 1 1 14 10476 2 2 4 GLN C C 10.057 0.589 -1.706 1.00 . B B . 4 GLN C 1 1 14 10477 2 2 4 GLN CA C 11.026 0.944 -2.839 1.00 . B B . 4 GLN CA 1 1 14 10478 2 2 4 GLN CB C 10.915 2.435 -3.167 1.00 . B B . 4 GLN CB 1 1 14 10479 2 2 4 GLN CD C 11.009 4.746 -2.226 1.00 . B B . 4 GLN CD 1 1 14 10480 2 2 4 GLN CG C 10.986 3.257 -1.879 1.00 . B B . 4 GLN CG 1 1 14 10481 2 2 4 GLN H H 9.926 0.367 -4.602 1.00 . B B . 4 GLN H 1 1 14 10482 2 2 4 GLN HA H 12.034 0.720 -2.524 1.00 . B B . 4 GLN HA 1 1 14 10483 2 2 4 GLN HB2 H 11.728 2.720 -3.820 1.00 . B B . 4 GLN HB2 1 1 14 10484 2 2 4 GLN HB3 H 9.974 2.625 -3.662 1.00 . B B . 4 GLN HB3 1 1 14 10485 2 2 4 GLN HE21 H 11.322 5.322 -0.352 1.00 . B B . 4 GLN HE21 1 1 14 10486 2 2 4 GLN HE22 H 11.213 6.578 -1.488 1.00 . B B . 4 GLN HE22 1 1 14 10487 2 2 4 GLN HG2 H 10.121 3.041 -1.267 1.00 . B B . 4 GLN HG2 1 1 14 10488 2 2 4 GLN HG3 H 11.884 3.001 -1.338 1.00 . B B . 4 GLN HG3 1 1 14 10489 2 2 4 GLN N N 10.710 0.151 -4.061 1.00 . B B . 4 GLN N 1 1 14 10490 2 2 4 GLN NE2 N 11.197 5.621 -1.277 1.00 . B B . 4 GLN NE2 1 1 14 10491 2 2 4 GLN O O 9.040 -0.051 -1.912 1.00 . B B . 4 GLN O 1 1 14 10492 2 2 4 GLN OE1 O 10.856 5.118 -3.373 1.00 . B B . 4 GLN OE1 1 1 14 10493 2 2 5 HIS C C 8.184 1.437 0.527 1.00 . B B . 5 HIS C 1 1 14 10494 2 2 5 HIS CA C 9.500 0.675 0.656 1.00 . B B . 5 HIS CA 1 1 14 10495 2 2 5 HIS CB C 10.195 1.085 1.958 1.00 . B B . 5 HIS CB 1 1 14 10496 2 2 5 HIS CD2 C 12.480 -0.174 2.141 1.00 . B B . 5 HIS CD2 1 1 14 10497 2 2 5 HIS CE1 C 13.742 1.397 1.330 1.00 . B B . 5 HIS CE1 1 1 14 10498 2 2 5 HIS CG C 11.680 0.889 1.826 1.00 . B B . 5 HIS CG 1 1 14 10499 2 2 5 HIS H H 11.210 1.492 -0.367 1.00 . B B . 5 HIS H 1 1 14 10500 2 2 5 HIS HA H 9.299 -0.385 0.676 1.00 . B B . 5 HIS HA 1 1 14 10501 2 2 5 HIS HB2 H 9.987 2.125 2.164 1.00 . B B . 5 HIS HB2 1 1 14 10502 2 2 5 HIS HB3 H 9.823 0.478 2.770 1.00 . B B . 5 HIS HB3 1 1 14 10503 2 2 5 HIS HD2 H 12.146 -1.108 2.568 1.00 . B B . 5 HIS HD2 1 1 14 10504 2 2 5 HIS HE1 H 14.609 1.944 0.988 1.00 . B B . 5 HIS HE1 1 1 14 10505 2 2 5 HIS HE2 H 14.577 -0.421 1.941 1.00 . B B . 5 HIS HE2 1 1 14 10506 2 2 5 HIS N N 10.380 0.990 -0.505 1.00 . B B . 5 HIS N 1 1 14 10507 2 2 5 HIS ND1 N 12.491 1.879 1.312 1.00 . B B . 5 HIS ND1 1 1 14 10508 2 2 5 HIS NE2 N 13.785 0.145 1.828 1.00 . B B . 5 HIS NE2 1 1 14 10509 2 2 5 HIS O O 7.816 1.886 -0.541 1.00 . B B . 5 HIS O 1 1 14 10510 2 2 6 LEU C C 5.761 2.778 2.920 1.00 . B B . 6 LEU C 1 1 14 10511 2 2 6 LEU CA C 6.164 2.293 1.536 1.00 . B B . 6 LEU CA 1 1 14 10512 2 2 6 LEU CB C 5.104 1.322 1.023 1.00 . B B . 6 LEU CB 1 1 14 10513 2 2 6 LEU CD1 C 4.256 3.314 -0.228 1.00 . B B . 6 LEU CD1 1 1 14 10514 2 2 6 LEU CD2 C 5.391 1.492 -1.446 1.00 . B B . 6 LEU CD2 1 1 14 10515 2 2 6 LEU CG C 4.472 1.815 -0.281 1.00 . B B . 6 LEU CG 1 1 14 10516 2 2 6 LEU H H 7.769 1.193 2.454 1.00 . B B . 6 LEU H 1 1 14 10517 2 2 6 LEU HA H 6.246 3.133 0.875 1.00 . B B . 6 LEU HA 1 1 14 10518 2 2 6 LEU HB2 H 5.573 0.382 0.842 1.00 . B B . 6 LEU HB2 1 1 14 10519 2 2 6 LEU HB3 H 4.338 1.201 1.772 1.00 . B B . 6 LEU HB3 1 1 14 10520 2 2 6 LEU HD11 H 5.164 3.821 -0.518 1.00 . B B . 6 LEU HD11 1 1 14 10521 2 2 6 LEU HD12 H 3.989 3.595 0.775 1.00 . B B . 6 LEU HD12 1 1 14 10522 2 2 6 LEU HD13 H 3.462 3.580 -0.907 1.00 . B B . 6 LEU HD13 1 1 14 10523 2 2 6 LEU HD21 H 4.797 1.317 -2.329 1.00 . B B . 6 LEU HD21 1 1 14 10524 2 2 6 LEU HD22 H 5.966 0.611 -1.213 1.00 . B B . 6 LEU HD22 1 1 14 10525 2 2 6 LEU HD23 H 6.054 2.326 -1.616 1.00 . B B . 6 LEU HD23 1 1 14 10526 2 2 6 LEU HG H 3.522 1.322 -0.426 1.00 . B B . 6 LEU HG 1 1 14 10527 2 2 6 LEU N N 7.463 1.574 1.605 1.00 . B B . 6 LEU N 1 1 14 10528 2 2 6 LEU O O 6.044 2.153 3.921 1.00 . B B . 6 LEU O 1 1 14 10529 2 2 7 CYS C C 4.087 5.818 4.136 1.00 . B B . 7 CYS C 1 1 14 10530 2 2 7 CYS CA C 4.643 4.398 4.293 1.00 . B B . 7 CYS CA 1 1 14 10531 2 2 7 CYS CB C 5.831 4.409 5.257 1.00 . B B . 7 CYS CB 1 1 14 10532 2 2 7 CYS H H 4.854 4.365 2.166 1.00 . B B . 7 CYS H 1 1 14 10533 2 2 7 CYS HA H 3.875 3.748 4.673 1.00 . B B . 7 CYS HA 1 1 14 10534 2 2 7 CYS HB2 H 6.724 4.107 4.730 1.00 . B B . 7 CYS HB2 1 1 14 10535 2 2 7 CYS HB3 H 5.966 5.403 5.651 1.00 . B B . 7 CYS HB3 1 1 14 10536 2 2 7 CYS N N 5.083 3.884 2.981 1.00 . B B . 7 CYS N 1 1 14 10537 2 2 7 CYS O O 4.465 6.552 3.243 1.00 . B B . 7 CYS O 1 1 14 10538 2 2 7 CYS SG S 5.518 3.259 6.617 1.00 . B B . 7 CYS SG 1 1 14 10539 2 2 8 GLY C C 1.986 7.805 3.538 1.00 . B B . 8 GLY C 1 1 14 10540 2 2 8 GLY CA C 2.610 7.579 4.919 1.00 . B B . 8 GLY CA 1 1 14 10541 2 2 8 GLY H H 2.905 5.600 5.716 1.00 . B B . 8 GLY H 1 1 14 10542 2 2 8 GLY HA2 H 1.849 7.691 5.678 1.00 . B B . 8 GLY HA2 1 1 14 10543 2 2 8 GLY HA3 H 3.388 8.309 5.081 1.00 . B B . 8 GLY HA3 1 1 14 10544 2 2 8 GLY N N 3.192 6.209 5.003 1.00 . B B . 8 GLY N 1 1 14 10545 2 2 8 GLY O O 1.361 6.928 2.971 1.00 . B B . 8 GLY O 1 1 14 10546 2 2 9 SER C C 2.001 8.231 0.653 1.00 . B B . 9 SER C 1 1 14 10547 2 2 9 SER CA C 1.561 9.287 1.663 1.00 . B B . 9 SER CA 1 1 14 10548 2 2 9 SER CB C 2.033 10.668 1.202 1.00 . B B . 9 SER CB 1 1 14 10549 2 2 9 SER H H 2.648 9.677 3.480 1.00 . B B . 9 SER H 1 1 14 10550 2 2 9 SER HA H 0.490 9.282 1.735 1.00 . B B . 9 SER HA 1 1 14 10551 2 2 9 SER HB2 H 2.722 11.075 1.924 1.00 . B B . 9 SER HB2 1 1 14 10552 2 2 9 SER HB3 H 2.532 10.576 0.245 1.00 . B B . 9 SER HB3 1 1 14 10553 2 2 9 SER HG H 0.379 11.437 1.880 1.00 . B B . 9 SER HG 1 1 14 10554 2 2 9 SER N N 2.146 8.985 3.000 1.00 . B B . 9 SER N 1 1 14 10555 2 2 9 SER O O 1.219 7.749 -0.142 1.00 . B B . 9 SER O 1 1 14 10556 2 2 9 SER OG O 0.912 11.533 1.086 1.00 . B B . 9 SER OG 1 1 14 10557 2 2 10 ASP C C 2.769 5.666 -0.313 1.00 . B B . 10 ASP C 1 1 14 10558 2 2 10 ASP CA C 3.744 6.838 -0.274 1.00 . B B . 10 ASP CA 1 1 14 10559 2 2 10 ASP CB C 5.116 6.335 0.180 1.00 . B B . 10 ASP CB 1 1 14 10560 2 2 10 ASP CG C 6.072 7.519 0.331 1.00 . B B . 10 ASP CG 1 1 14 10561 2 2 10 ASP H H 3.852 8.266 1.337 1.00 . B B . 10 ASP H 1 1 14 10562 2 2 10 ASP HA H 3.829 7.263 -1.261 1.00 . B B . 10 ASP HA 1 1 14 10563 2 2 10 ASP HB2 H 5.017 5.828 1.126 1.00 . B B . 10 ASP HB2 1 1 14 10564 2 2 10 ASP HB3 H 5.509 5.649 -0.556 1.00 . B B . 10 ASP HB3 1 1 14 10565 2 2 10 ASP N N 3.246 7.866 0.682 1.00 . B B . 10 ASP N 1 1 14 10566 2 2 10 ASP O O 2.295 5.274 -1.361 1.00 . B B . 10 ASP O 1 1 14 10567 2 2 10 ASP OD1 O 6.112 8.342 -0.568 1.00 . B B . 10 ASP OD1 1 1 14 10568 2 2 10 ASP OD2 O 6.749 7.582 1.344 1.00 . B B . 10 ASP OD2 1 1 14 10569 2 2 11 LEU C C 0.241 4.266 0.183 1.00 . B B . 11 LEU C 1 1 14 10570 2 2 11 LEU CA C 1.571 3.906 0.845 1.00 . B B . 11 LEU CA 1 1 14 10571 2 2 11 LEU CB C 1.330 3.481 2.294 1.00 . B B . 11 LEU CB 1 1 14 10572 2 2 11 LEU CD1 C 1.740 1.121 1.533 1.00 . B B . 11 LEU CD1 1 1 14 10573 2 2 11 LEU CD2 C 0.770 1.569 3.790 1.00 . B B . 11 LEU CD2 1 1 14 10574 2 2 11 LEU CG C 0.811 2.040 2.336 1.00 . B B . 11 LEU CG 1 1 14 10575 2 2 11 LEU H H 2.901 5.398 1.649 1.00 . B B . 11 LEU H 1 1 14 10576 2 2 11 LEU HA H 2.027 3.086 0.305 1.00 . B B . 11 LEU HA 1 1 14 10577 2 2 11 LEU HB2 H 2.257 3.545 2.845 1.00 . B B . 11 LEU HB2 1 1 14 10578 2 2 11 LEU HB3 H 0.600 4.137 2.742 1.00 . B B . 11 LEU HB3 1 1 14 10579 2 2 11 LEU HD11 H 2.643 1.652 1.281 1.00 . B B . 11 LEU HD11 1 1 14 10580 2 2 11 LEU HD12 H 1.243 0.807 0.626 1.00 . B B . 11 LEU HD12 1 1 14 10581 2 2 11 LEU HD13 H 1.988 0.251 2.125 1.00 . B B . 11 LEU HD13 1 1 14 10582 2 2 11 LEU HD21 H -0.255 1.404 4.086 1.00 . B B . 11 LEU HD21 1 1 14 10583 2 2 11 LEU HD22 H 1.210 2.325 4.424 1.00 . B B . 11 LEU HD22 1 1 14 10584 2 2 11 LEU HD23 H 1.327 0.650 3.887 1.00 . B B . 11 LEU HD23 1 1 14 10585 2 2 11 LEU HG H -0.183 2.003 1.916 1.00 . B B . 11 LEU HG 1 1 14 10586 2 2 11 LEU N N 2.489 5.080 0.818 1.00 . B B . 11 LEU N 1 1 14 10587 2 2 11 LEU O O -0.227 3.571 -0.696 1.00 . B B . 11 LEU O 1 1 14 10588 2 2 12 VAL C C -1.432 6.066 -1.512 1.00 . B B . 12 VAL C 1 1 14 10589 2 2 12 VAL CA C -1.676 5.712 -0.044 1.00 . B B . 12 VAL CA 1 1 14 10590 2 2 12 VAL CB C -2.310 6.894 0.706 1.00 . B B . 12 VAL CB 1 1 14 10591 2 2 12 VAL CG1 C -1.966 6.789 2.190 1.00 . B B . 12 VAL CG1 1 1 14 10592 2 2 12 VAL CG2 C -1.784 8.226 0.161 1.00 . B B . 12 VAL CG2 1 1 14 10593 2 2 12 VAL H H 0.008 5.902 1.294 1.00 . B B . 12 VAL H 1 1 14 10594 2 2 12 VAL HA H -2.342 4.863 0.006 1.00 . B B . 12 VAL HA 1 1 14 10595 2 2 12 VAL HB H -3.384 6.855 0.587 1.00 . B B . 12 VAL HB 1 1 14 10596 2 2 12 VAL HG11 H -1.616 5.790 2.408 1.00 . B B . 12 VAL HG11 1 1 14 10597 2 2 12 VAL HG12 H -2.846 6.999 2.780 1.00 . B B . 12 VAL HG12 1 1 14 10598 2 2 12 VAL HG13 H -1.192 7.502 2.431 1.00 . B B . 12 VAL HG13 1 1 14 10599 2 2 12 VAL HG21 H -0.731 8.314 0.379 1.00 . B B . 12 VAL HG21 1 1 14 10600 2 2 12 VAL HG22 H -2.318 9.040 0.629 1.00 . B B . 12 VAL HG22 1 1 14 10601 2 2 12 VAL HG23 H -1.936 8.264 -0.907 1.00 . B B . 12 VAL HG23 1 1 14 10602 2 2 12 VAL N N -0.377 5.343 0.587 1.00 . B B . 12 VAL N 1 1 14 10603 2 2 12 VAL O O -2.126 5.603 -2.394 1.00 . B B . 12 VAL O 1 1 14 10604 2 2 13 GLU C C -0.131 5.937 -4.022 1.00 . B B . 13 GLU C 1 1 14 10605 2 2 13 GLU CA C -0.154 7.230 -3.198 1.00 . B B . 13 GLU CA 1 1 14 10606 2 2 13 GLU CB C 1.195 7.979 -3.274 1.00 . B B . 13 GLU CB 1 1 14 10607 2 2 13 GLU CD C 3.536 7.949 -4.161 1.00 . B B . 13 GLU CD 1 1 14 10608 2 2 13 GLU CG C 2.290 7.101 -3.899 1.00 . B B . 13 GLU CG 1 1 14 10609 2 2 13 GLU H H 0.118 7.228 -1.061 1.00 . B B . 13 GLU H 1 1 14 10610 2 2 13 GLU HA H -0.942 7.871 -3.568 1.00 . B B . 13 GLU HA 1 1 14 10611 2 2 13 GLU HB2 H 1.073 8.869 -3.872 1.00 . B B . 13 GLU HB2 1 1 14 10612 2 2 13 GLU HB3 H 1.497 8.262 -2.276 1.00 . B B . 13 GLU HB3 1 1 14 10613 2 2 13 GLU HG2 H 2.536 6.296 -3.222 1.00 . B B . 13 GLU HG2 1 1 14 10614 2 2 13 GLU HG3 H 1.933 6.691 -4.832 1.00 . B B . 13 GLU HG3 1 1 14 10615 2 2 13 GLU N N -0.441 6.872 -1.784 1.00 . B B . 13 GLU N 1 1 14 10616 2 2 13 GLU O O -0.409 5.932 -5.204 1.00 . B B . 13 GLU O 1 1 14 10617 2 2 13 GLU OE1 O 3.414 8.950 -4.849 1.00 . B B . 13 GLU OE1 1 1 14 10618 2 2 13 GLU OE2 O 4.591 7.584 -3.670 1.00 . B B . 13 GLU OE2 1 1 14 10619 2 2 14 ALA C C -1.140 2.855 -3.922 1.00 . B B . 14 ALA C 1 1 14 10620 2 2 14 ALA CA C 0.212 3.540 -4.112 1.00 . B B . 14 ALA CA 1 1 14 10621 2 2 14 ALA CB C 1.326 2.659 -3.543 1.00 . B B . 14 ALA CB 1 1 14 10622 2 2 14 ALA H H 0.390 4.866 -2.432 1.00 . B B . 14 ALA H 1 1 14 10623 2 2 14 ALA HA H 0.386 3.713 -5.164 1.00 . B B . 14 ALA HA 1 1 14 10624 2 2 14 ALA HB1 H 2.185 3.271 -3.309 1.00 . B B . 14 ALA HB1 1 1 14 10625 2 2 14 ALA HB2 H 1.604 1.914 -4.274 1.00 . B B . 14 ALA HB2 1 1 14 10626 2 2 14 ALA HB3 H 0.976 2.170 -2.646 1.00 . B B . 14 ALA HB3 1 1 14 10627 2 2 14 ALA N N 0.185 4.838 -3.390 1.00 . B B . 14 ALA N 1 1 14 10628 2 2 14 ALA O O -1.811 2.513 -4.873 1.00 . B B . 14 ALA O 1 1 14 10629 2 2 15 LEU C C -3.915 2.729 -3.338 1.00 . B B . 15 LEU C 1 1 14 10630 2 2 15 LEU CA C -2.879 2.035 -2.456 1.00 . B B . 15 LEU CA 1 1 14 10631 2 2 15 LEU CB C -3.252 2.202 -0.982 1.00 . B B . 15 LEU CB 1 1 14 10632 2 2 15 LEU CD1 C -2.908 1.133 1.256 1.00 . B B . 15 LEU CD1 1 1 14 10633 2 2 15 LEU CD2 C -1.895 0.060 -0.760 1.00 . B B . 15 LEU CD2 1 1 14 10634 2 2 15 LEU CG C -2.269 1.403 -0.101 1.00 . B B . 15 LEU CG 1 1 14 10635 2 2 15 LEU H H -1.014 2.970 -1.938 1.00 . B B . 15 LEU H 1 1 14 10636 2 2 15 LEU HA H -2.827 0.987 -2.705 1.00 . B B . 15 LEU HA 1 1 14 10637 2 2 15 LEU HB2 H -3.190 3.250 -0.722 1.00 . B B . 15 LEU HB2 1 1 14 10638 2 2 15 LEU HB3 H -4.267 1.856 -0.815 1.00 . B B . 15 LEU HB3 1 1 14 10639 2 2 15 LEU HD11 H -3.422 0.184 1.229 1.00 . B B . 15 LEU HD11 1 1 14 10640 2 2 15 LEU HD12 H -3.612 1.919 1.484 1.00 . B B . 15 LEU HD12 1 1 14 10641 2 2 15 LEU HD13 H -2.140 1.106 2.015 1.00 . B B . 15 LEU HD13 1 1 14 10642 2 2 15 LEU HD21 H -2.739 -0.327 -1.311 1.00 . B B . 15 LEU HD21 1 1 14 10643 2 2 15 LEU HD22 H -1.610 -0.652 0.005 1.00 . B B . 15 LEU HD22 1 1 14 10644 2 2 15 LEU HD23 H -1.062 0.206 -1.434 1.00 . B B . 15 LEU HD23 1 1 14 10645 2 2 15 LEU HG H -1.374 1.990 0.045 1.00 . B B . 15 LEU HG 1 1 14 10646 2 2 15 LEU N N -1.559 2.673 -2.697 1.00 . B B . 15 LEU N 1 1 14 10647 2 2 15 LEU O O -4.758 2.100 -3.948 1.00 . B B . 15 LEU O 1 1 14 10648 2 2 16 TYR C C -4.497 4.461 -5.746 1.00 . B B . 16 TYR C 1 1 14 10649 2 2 16 TYR CA C -4.800 4.777 -4.281 1.00 . B B . 16 TYR CA 1 1 14 10650 2 2 16 TYR CB C -4.619 6.279 -4.050 1.00 . B B . 16 TYR CB 1 1 14 10651 2 2 16 TYR CD1 C -7.107 6.563 -3.751 1.00 . B B . 16 TYR CD1 1 1 14 10652 2 2 16 TYR CD2 C -5.608 7.614 -2.159 1.00 . B B . 16 TYR CD2 1 1 14 10653 2 2 16 TYR CE1 C -8.208 7.078 -3.054 1.00 . B B . 16 TYR CE1 1 1 14 10654 2 2 16 TYR CE2 C -6.708 8.129 -1.461 1.00 . B B . 16 TYR CE2 1 1 14 10655 2 2 16 TYR CG C -5.807 6.831 -3.303 1.00 . B B . 16 TYR CG 1 1 14 10656 2 2 16 TYR CZ C -8.009 7.861 -1.909 1.00 . B B . 16 TYR CZ 1 1 14 10657 2 2 16 TYR H H -3.145 4.514 -2.931 1.00 . B B . 16 TYR H 1 1 14 10658 2 2 16 TYR HA H -5.813 4.487 -4.043 1.00 . B B . 16 TYR HA 1 1 14 10659 2 2 16 TYR HB2 H -3.722 6.447 -3.473 1.00 . B B . 16 TYR HB2 1 1 14 10660 2 2 16 TYR HB3 H -4.531 6.779 -5.002 1.00 . B B . 16 TYR HB3 1 1 14 10661 2 2 16 TYR HD1 H -7.261 5.959 -4.633 1.00 . B B . 16 TYR HD1 1 1 14 10662 2 2 16 TYR HD2 H -4.605 7.820 -1.814 1.00 . B B . 16 TYR HD2 1 1 14 10663 2 2 16 TYR HE1 H -9.210 6.872 -3.399 1.00 . B B . 16 TYR HE1 1 1 14 10664 2 2 16 TYR HE2 H -6.554 8.733 -0.580 1.00 . B B . 16 TYR HE2 1 1 14 10665 2 2 16 TYR HH H -9.501 9.043 -1.769 1.00 . B B . 16 TYR HH 1 1 14 10666 2 2 16 TYR N N -3.842 4.029 -3.423 1.00 . B B . 16 TYR N 1 1 14 10667 2 2 16 TYR O O -5.385 4.227 -6.544 1.00 . B B . 16 TYR O 1 1 14 10668 2 2 16 TYR OH O -9.093 8.368 -1.222 1.00 . B B . 16 TYR OH 1 1 14 10669 2 2 17 LEU C C -3.111 2.714 -7.852 1.00 . B B . 17 LEU C 1 1 14 10670 2 2 17 LEU CA C -2.846 4.179 -7.510 1.00 . B B . 17 LEU CA 1 1 14 10671 2 2 17 LEU CB C -1.356 4.482 -7.687 1.00 . B B . 17 LEU CB 1 1 14 10672 2 2 17 LEU CD1 C -1.810 4.493 -10.145 1.00 . B B . 17 LEU CD1 1 1 14 10673 2 2 17 LEU CD2 C 0.542 4.456 -9.307 1.00 . B B . 17 LEU CD2 1 1 14 10674 2 2 17 LEU CG C -0.884 3.967 -9.047 1.00 . B B . 17 LEU CG 1 1 14 10675 2 2 17 LEU H H -2.548 4.661 -5.435 1.00 . B B . 17 LEU H 1 1 14 10676 2 2 17 LEU HA H -3.417 4.803 -8.169 1.00 . B B . 17 LEU HA 1 1 14 10677 2 2 17 LEU HB2 H -1.198 5.549 -7.629 1.00 . B B . 17 LEU HB2 1 1 14 10678 2 2 17 LEU HB3 H -0.795 3.992 -6.904 1.00 . B B . 17 LEU HB3 1 1 14 10679 2 2 17 LEU HD11 H -2.430 5.283 -9.746 1.00 . B B . 17 LEU HD11 1 1 14 10680 2 2 17 LEU HD12 H -2.437 3.690 -10.503 1.00 . B B . 17 LEU HD12 1 1 14 10681 2 2 17 LEU HD13 H -1.217 4.879 -10.961 1.00 . B B . 17 LEU HD13 1 1 14 10682 2 2 17 LEU HD21 H 0.747 4.421 -10.366 1.00 . B B . 17 LEU HD21 1 1 14 10683 2 2 17 LEU HD22 H 1.241 3.822 -8.783 1.00 . B B . 17 LEU HD22 1 1 14 10684 2 2 17 LEU HD23 H 0.644 5.472 -8.954 1.00 . B B . 17 LEU HD23 1 1 14 10685 2 2 17 LEU HG H -0.902 2.886 -9.049 1.00 . B B . 17 LEU HG 1 1 14 10686 2 2 17 LEU N N -3.239 4.462 -6.101 1.00 . B B . 17 LEU N 1 1 14 10687 2 2 17 LEU O O -3.734 2.401 -8.847 1.00 . B B . 17 LEU O 1 1 14 10688 2 2 18 VAL C C -4.336 0.168 -7.645 1.00 . B B . 18 VAL C 1 1 14 10689 2 2 18 VAL CA C -2.869 0.370 -7.329 1.00 . B B . 18 VAL CA 1 1 14 10690 2 2 18 VAL CB C -2.492 -0.485 -6.120 1.00 . B B . 18 VAL CB 1 1 14 10691 2 2 18 VAL CG1 C -1.106 -0.096 -5.641 1.00 . B B . 18 VAL CG1 1 1 14 10692 2 2 18 VAL CG2 C -3.488 -0.258 -4.987 1.00 . B B . 18 VAL CG2 1 1 14 10693 2 2 18 VAL H H -2.146 2.090 -6.247 1.00 . B B . 18 VAL H 1 1 14 10694 2 2 18 VAL HA H -2.274 0.075 -8.179 1.00 . B B . 18 VAL HA 1 1 14 10695 2 2 18 VAL HB H -2.496 -1.528 -6.402 1.00 . B B . 18 VAL HB 1 1 14 10696 2 2 18 VAL HG11 H -0.416 -0.892 -5.866 1.00 . B B . 18 VAL HG11 1 1 14 10697 2 2 18 VAL HG12 H -1.134 0.073 -4.575 1.00 . B B . 18 VAL HG12 1 1 14 10698 2 2 18 VAL HG13 H -0.797 0.807 -6.143 1.00 . B B . 18 VAL HG13 1 1 14 10699 2 2 18 VAL HG21 H -4.494 -0.332 -5.368 1.00 . B B . 18 VAL HG21 1 1 14 10700 2 2 18 VAL HG22 H -3.330 0.721 -4.564 1.00 . B B . 18 VAL HG22 1 1 14 10701 2 2 18 VAL HG23 H -3.336 -1.006 -4.225 1.00 . B B . 18 VAL HG23 1 1 14 10702 2 2 18 VAL N N -2.642 1.814 -7.040 1.00 . B B . 18 VAL N 1 1 14 10703 2 2 18 VAL O O -4.709 -0.677 -8.433 1.00 . B B . 18 VAL O 1 1 14 10704 2 2 19 CYS C C -7.252 2.172 -7.514 1.00 . B B . 19 CYS C 1 1 14 10705 2 2 19 CYS CA C -6.623 0.795 -7.289 1.00 . B B . 19 CYS CA 1 1 14 10706 2 2 19 CYS CB C -7.273 0.110 -6.097 1.00 . B B . 19 CYS CB 1 1 14 10707 2 2 19 CYS H H -4.852 1.613 -6.394 1.00 . B B . 19 CYS H 1 1 14 10708 2 2 19 CYS HA H -6.758 0.187 -8.168 1.00 . B B . 19 CYS HA 1 1 14 10709 2 2 19 CYS HB2 H -6.966 0.602 -5.185 1.00 . B B . 19 CYS HB2 1 1 14 10710 2 2 19 CYS HB3 H -8.340 0.162 -6.194 1.00 . B B . 19 CYS HB3 1 1 14 10711 2 2 19 CYS N N -5.176 0.941 -7.029 1.00 . B B . 19 CYS N 1 1 14 10712 2 2 19 CYS O O -7.535 2.556 -8.632 1.00 . B B . 19 CYS O 1 1 14 10713 2 2 19 CYS SG S -6.751 -1.622 -6.058 1.00 . B B . 19 CYS SG 1 1 14 10714 2 2 20 GLY C C -9.377 4.398 -5.864 1.00 . B B . 20 GLY C 1 1 14 10715 2 2 20 GLY CA C -8.063 4.279 -6.645 1.00 . B B . 20 GLY CA 1 1 14 10716 2 2 20 GLY H H -7.222 2.608 -5.574 1.00 . B B . 20 GLY H 1 1 14 10717 2 2 20 GLY HA2 H -7.367 5.024 -6.288 1.00 . B B . 20 GLY HA2 1 1 14 10718 2 2 20 GLY HA3 H -8.258 4.447 -7.693 1.00 . B B . 20 GLY HA3 1 1 14 10719 2 2 20 GLY N N -7.465 2.926 -6.468 1.00 . B B . 20 GLY N 1 1 14 10720 2 2 20 GLY O O -9.391 4.434 -4.650 1.00 . B B . 20 GLY O 1 1 14 10721 2 2 21 GLU C C -12.196 3.345 -5.156 1.00 . B B . 21 GLU C 1 1 14 10722 2 2 21 GLU CA C -11.800 4.635 -5.882 1.00 . B B . 21 GLU CA 1 1 14 10723 2 2 21 GLU CB C -12.864 4.963 -6.930 1.00 . B B . 21 GLU CB 1 1 14 10724 2 2 21 GLU CD C -13.838 7.247 -7.193 1.00 . B B . 21 GLU CD 1 1 14 10725 2 2 21 GLU CG C -13.861 5.968 -6.354 1.00 . B B . 21 GLU CG 1 1 14 10726 2 2 21 GLU H H -10.435 4.474 -7.540 1.00 . B B . 21 GLU H 1 1 14 10727 2 2 21 GLU HA H -11.746 5.444 -5.169 1.00 . B B . 21 GLU HA 1 1 14 10728 2 2 21 GLU HB2 H -12.389 5.386 -7.804 1.00 . B B . 21 GLU HB2 1 1 14 10729 2 2 21 GLU HB3 H -13.386 4.059 -7.207 1.00 . B B . 21 GLU HB3 1 1 14 10730 2 2 21 GLU HG2 H -14.854 5.542 -6.374 1.00 . B B . 21 GLU HG2 1 1 14 10731 2 2 21 GLU HG3 H -13.590 6.203 -5.335 1.00 . B B . 21 GLU HG3 1 1 14 10732 2 2 21 GLU N N -10.479 4.486 -6.561 1.00 . B B . 21 GLU N 1 1 14 10733 2 2 21 GLU O O -13.229 3.282 -4.520 1.00 . B B . 21 GLU O 1 1 14 10734 2 2 21 GLU OE1 O -12.948 8.055 -6.981 1.00 . B B . 21 GLU OE1 1 1 14 10735 2 2 21 GLU OE2 O -14.710 7.398 -8.033 1.00 . B B . 21 GLU OE2 1 1 14 10736 2 2 22 ARG C C -11.470 1.179 -3.053 1.00 . B B . 22 ARG C 1 1 14 10737 2 2 22 ARG CA C -11.765 1.050 -4.549 1.00 . B B . 22 ARG CA 1 1 14 10738 2 2 22 ARG CB C -10.947 -0.099 -5.136 1.00 . B B . 22 ARG CB 1 1 14 10739 2 2 22 ARG CD C -12.996 -1.486 -5.516 1.00 . B B . 22 ARG CD 1 1 14 10740 2 2 22 ARG CG C -11.779 -0.841 -6.184 1.00 . B B . 22 ARG CG 1 1 14 10741 2 2 22 ARG CZ C -14.643 -3.166 -6.095 1.00 . B B . 22 ARG CZ 1 1 14 10742 2 2 22 ARG H H -10.570 2.372 -5.758 1.00 . B B . 22 ARG H 1 1 14 10743 2 2 22 ARG HA H -12.817 0.852 -4.693 1.00 . B B . 22 ARG HA 1 1 14 10744 2 2 22 ARG HB2 H -10.058 0.298 -5.598 1.00 . B B . 22 ARG HB2 1 1 14 10745 2 2 22 ARG HB3 H -10.669 -0.780 -4.349 1.00 . B B . 22 ARG HB3 1 1 14 10746 2 2 22 ARG HD2 H -12.707 -1.896 -4.559 1.00 . B B . 22 ARG HD2 1 1 14 10747 2 2 22 ARG HD3 H -13.765 -0.742 -5.373 1.00 . B B . 22 ARG HD3 1 1 14 10748 2 2 22 ARG HE H -13.013 -2.849 -7.183 1.00 . B B . 22 ARG HE 1 1 14 10749 2 2 22 ARG HG2 H -12.111 -0.144 -6.939 1.00 . B B . 22 ARG HG2 1 1 14 10750 2 2 22 ARG HG3 H -11.176 -1.609 -6.644 1.00 . B B . 22 ARG HG3 1 1 14 10751 2 2 22 ARG HH11 H -15.511 -1.500 -5.405 1.00 . B B . 22 ARG HH11 1 1 14 10752 2 2 22 ARG HH12 H -16.486 -2.930 -5.352 1.00 . B B . 22 ARG HH12 1 1 14 10753 2 2 22 ARG HH21 H -14.037 -4.970 -6.718 1.00 . B B . 22 ARG HH21 1 1 14 10754 2 2 22 ARG HH22 H -15.652 -4.896 -6.097 1.00 . B B . 22 ARG HH22 1 1 14 10755 2 2 22 ARG N N -11.400 2.316 -5.241 1.00 . B B . 22 ARG N 1 1 14 10756 2 2 22 ARG NE N -13.517 -2.576 -6.388 1.00 . B B . 22 ARG NE 1 1 14 10757 2 2 22 ARG NH1 N -15.623 -2.479 -5.577 1.00 . B B . 22 ARG NH1 1 1 14 10758 2 2 22 ARG NH2 N -14.789 -4.444 -6.321 1.00 . B B . 22 ARG NH2 1 1 14 10759 2 2 22 ARG O O -11.798 0.310 -2.270 1.00 . B B . 22 ARG O 1 1 14 10760 2 2 23 GLY C C -9.523 1.390 -0.765 1.00 . B B . 23 GLY C 1 1 14 10761 2 2 23 GLY CA C -10.543 2.441 -1.202 1.00 . B B . 23 GLY CA 1 1 14 10762 2 2 23 GLY H H -10.600 2.949 -3.295 1.00 . B B . 23 GLY H 1 1 14 10763 2 2 23 GLY HA2 H -10.136 3.429 -1.044 1.00 . B B . 23 GLY HA2 1 1 14 10764 2 2 23 GLY HA3 H -11.445 2.325 -0.621 1.00 . B B . 23 GLY HA3 1 1 14 10765 2 2 23 GLY N N -10.856 2.259 -2.648 1.00 . B B . 23 GLY N 1 1 14 10766 2 2 23 GLY O O -9.435 0.322 -1.337 1.00 . B B . 23 GLY O 1 1 14 10767 2 2 24 PHE C C -7.903 0.449 2.209 1.00 . B B . 24 PHE C 1 1 14 10768 2 2 24 PHE CA C -7.737 0.692 0.709 1.00 . B B . 24 PHE CA 1 1 14 10769 2 2 24 PHE CB C -6.329 1.225 0.431 1.00 . B B . 24 PHE CB 1 1 14 10770 2 2 24 PHE CD1 C -6.301 3.366 1.770 1.00 . B B . 24 PHE CD1 1 1 14 10771 2 2 24 PHE CD2 C -6.324 3.502 -0.653 1.00 . B B . 24 PHE CD2 1 1 14 10772 2 2 24 PHE CE1 C -6.286 4.767 1.848 1.00 . B B . 24 PHE CE1 1 1 14 10773 2 2 24 PHE CE2 C -6.307 4.900 -0.574 1.00 . B B . 24 PHE CE2 1 1 14 10774 2 2 24 PHE CG C -6.320 2.734 0.519 1.00 . B B . 24 PHE CG 1 1 14 10775 2 2 24 PHE CZ C -6.288 5.533 0.675 1.00 . B B . 24 PHE CZ 1 1 14 10776 2 2 24 PHE H H -8.833 2.547 0.694 1.00 . B B . 24 PHE H 1 1 14 10777 2 2 24 PHE HA H -7.878 -0.238 0.179 1.00 . B B . 24 PHE HA 1 1 14 10778 2 2 24 PHE HB2 H -5.642 0.819 1.159 1.00 . B B . 24 PHE HB2 1 1 14 10779 2 2 24 PHE HB3 H -6.021 0.922 -0.559 1.00 . B B . 24 PHE HB3 1 1 14 10780 2 2 24 PHE HD1 H -6.300 2.775 2.674 1.00 . B B . 24 PHE HD1 1 1 14 10781 2 2 24 PHE HD2 H -6.339 3.016 -1.617 1.00 . B B . 24 PHE HD2 1 1 14 10782 2 2 24 PHE HE1 H -6.274 5.254 2.811 1.00 . B B . 24 PHE HE1 1 1 14 10783 2 2 24 PHE HE2 H -6.313 5.491 -1.476 1.00 . B B . 24 PHE HE2 1 1 14 10784 2 2 24 PHE HZ H -6.271 6.612 0.734 1.00 . B B . 24 PHE HZ 1 1 14 10785 2 2 24 PHE N N -8.749 1.681 0.244 1.00 . B B . 24 PHE N 1 1 14 10786 2 2 24 PHE O O -8.825 0.939 2.830 1.00 . B B . 24 PHE O 1 1 14 10787 2 2 25 PHE C C -5.828 -0.168 4.953 1.00 . B B . 25 PHE C 1 1 14 10788 2 2 25 PHE CA C -7.123 -0.589 4.255 1.00 . B B . 25 PHE CA 1 1 14 10789 2 2 25 PHE CB C -7.353 -2.087 4.470 1.00 . B B . 25 PHE CB 1 1 14 10790 2 2 25 PHE CD1 C -7.764 -1.820 6.944 1.00 . B B . 25 PHE CD1 1 1 14 10791 2 2 25 PHE CD2 C -9.426 -2.972 5.602 1.00 . B B . 25 PHE CD2 1 1 14 10792 2 2 25 PHE CE1 C -8.550 -2.017 8.087 1.00 . B B . 25 PHE CE1 1 1 14 10793 2 2 25 PHE CE2 C -10.213 -3.168 6.745 1.00 . B B . 25 PHE CE2 1 1 14 10794 2 2 25 PHE CG C -8.202 -2.298 5.701 1.00 . B B . 25 PHE CG 1 1 14 10795 2 2 25 PHE CZ C -9.775 -2.691 7.987 1.00 . B B . 25 PHE CZ 1 1 14 10796 2 2 25 PHE H H -6.283 -0.696 2.275 1.00 . B B . 25 PHE H 1 1 14 10797 2 2 25 PHE HA H -7.952 -0.035 4.669 1.00 . B B . 25 PHE HA 1 1 14 10798 2 2 25 PHE HB2 H -7.859 -2.500 3.609 1.00 . B B . 25 PHE HB2 1 1 14 10799 2 2 25 PHE HB3 H -6.403 -2.582 4.600 1.00 . B B . 25 PHE HB3 1 1 14 10800 2 2 25 PHE HD1 H -6.820 -1.301 7.021 1.00 . B B . 25 PHE HD1 1 1 14 10801 2 2 25 PHE HD2 H -9.764 -3.340 4.644 1.00 . B B . 25 PHE HD2 1 1 14 10802 2 2 25 PHE HE1 H -8.213 -1.649 9.045 1.00 . B B . 25 PHE HE1 1 1 14 10803 2 2 25 PHE HE2 H -11.156 -3.688 6.668 1.00 . B B . 25 PHE HE2 1 1 14 10804 2 2 25 PHE HZ H -10.381 -2.842 8.868 1.00 . B B . 25 PHE HZ 1 1 14 10805 2 2 25 PHE N N -7.017 -0.309 2.796 1.00 . B B . 25 PHE N 1 1 14 10806 2 2 25 PHE O O -4.890 -0.933 5.053 1.00 . B B . 25 PHE O 1 1 14 10807 2 2 26 TYR C C -4.414 0.775 7.473 1.00 . B B . 26 TYR C 1 1 14 10808 2 2 26 TYR CA C -4.541 1.510 6.136 1.00 . B B . 26 TYR CA 1 1 14 10809 2 2 26 TYR CB C -4.639 3.018 6.375 1.00 . B B . 26 TYR CB 1 1 14 10810 2 2 26 TYR CD1 C -2.371 3.376 5.338 1.00 . B B . 26 TYR CD1 1 1 14 10811 2 2 26 TYR CD2 C -2.869 4.443 7.460 1.00 . B B . 26 TYR CD2 1 1 14 10812 2 2 26 TYR CE1 C -1.092 3.946 5.350 1.00 . B B . 26 TYR CE1 1 1 14 10813 2 2 26 TYR CE2 C -1.589 5.013 7.473 1.00 . B B . 26 TYR CE2 1 1 14 10814 2 2 26 TYR CG C -3.259 3.624 6.393 1.00 . B B . 26 TYR CG 1 1 14 10815 2 2 26 TYR CZ C -0.700 4.765 6.418 1.00 . B B . 26 TYR CZ 1 1 14 10816 2 2 26 TYR H H -6.544 1.639 5.350 1.00 . B B . 26 TYR H 1 1 14 10817 2 2 26 TYR HA H -3.677 1.296 5.523 1.00 . B B . 26 TYR HA 1 1 14 10818 2 2 26 TYR HB2 H -5.212 3.468 5.579 1.00 . B B . 26 TYR HB2 1 1 14 10819 2 2 26 TYR HB3 H -5.127 3.203 7.321 1.00 . B B . 26 TYR HB3 1 1 14 10820 2 2 26 TYR HD1 H -2.673 2.744 4.516 1.00 . B B . 26 TYR HD1 1 1 14 10821 2 2 26 TYR HD2 H -3.554 4.634 8.272 1.00 . B B . 26 TYR HD2 1 1 14 10822 2 2 26 TYR HE1 H -0.408 3.755 4.537 1.00 . B B . 26 TYR HE1 1 1 14 10823 2 2 26 TYR HE2 H -1.289 5.644 8.296 1.00 . B B . 26 TYR HE2 1 1 14 10824 2 2 26 TYR HH H 1.194 4.633 6.620 1.00 . B B . 26 TYR HH 1 1 14 10825 2 2 26 TYR N N -5.773 1.041 5.439 1.00 . B B . 26 TYR N 1 1 14 10826 2 2 26 TYR O O -5.274 0.002 7.845 1.00 . B B . 26 TYR O 1 1 14 10827 2 2 26 TYR OH O 0.560 5.328 6.431 1.00 . B B . 26 TYR OH 1 1 14 10828 2 2 27 THR C C -2.543 1.218 10.533 1.00 . B B . 27 THR C 1 1 14 10829 2 2 27 THR CA C -3.187 0.287 9.502 1.00 . B B . 27 THR CA 1 1 14 10830 2 2 27 THR CB C -2.295 -0.941 9.302 1.00 . B B . 27 THR CB 1 1 14 10831 2 2 27 THR CG2 C -3.166 -2.183 9.106 1.00 . B B . 27 THR CG2 1 1 14 10832 2 2 27 THR H H -2.657 1.614 7.884 1.00 . B B . 27 THR H 1 1 14 10833 2 2 27 THR HA H -4.155 -0.030 9.860 1.00 . B B . 27 THR HA 1 1 14 10834 2 2 27 THR HB H -1.670 -1.078 10.171 1.00 . B B . 27 THR HB 1 1 14 10835 2 2 27 THR HG1 H -0.826 -1.451 8.132 1.00 . B B . 27 THR HG1 1 1 14 10836 2 2 27 THR HG21 H -3.755 -2.071 8.207 1.00 . B B . 27 THR HG21 1 1 14 10837 2 2 27 THR HG22 H -3.823 -2.299 9.955 1.00 . B B . 27 THR HG22 1 1 14 10838 2 2 27 THR HG23 H -2.535 -3.054 9.017 1.00 . B B . 27 THR HG23 1 1 14 10839 2 2 27 THR N N -3.349 0.995 8.198 1.00 . B B . 27 THR N 1 1 14 10840 2 2 27 THR O O -1.410 1.030 10.927 1.00 . B B . 27 THR O 1 1 14 10841 2 2 27 THR OG1 O -1.477 -0.746 8.155 1.00 . B B . 27 THR OG1 1 1 14 10842 2 2 28 LYS C C -2.990 2.657 13.403 1.00 . B B . 28 LYS C 1 1 14 10843 2 2 28 LYS CA C -2.676 3.151 11.990 1.00 . B B . 28 LYS CA 1 1 14 10844 2 2 28 LYS CB C -3.280 4.552 11.839 1.00 . B B . 28 LYS CB 1 1 14 10845 2 2 28 LYS CD C -1.040 5.088 10.731 1.00 . B B . 28 LYS CD 1 1 14 10846 2 2 28 LYS CE C 0.142 4.684 11.616 1.00 . B B . 28 LYS CE 1 1 14 10847 2 2 28 LYS CG C -2.185 5.618 11.615 1.00 . B B . 28 LYS CG 1 1 14 10848 2 2 28 LYS H H -4.168 2.351 10.648 1.00 . B B . 28 LYS H 1 1 14 10849 2 2 28 LYS HA H -1.609 3.197 11.862 1.00 . B B . 28 LYS HA 1 1 14 10850 2 2 28 LYS HB2 H -3.984 4.562 11.020 1.00 . B B . 28 LYS HB2 1 1 14 10851 2 2 28 LYS HB3 H -3.813 4.790 12.750 1.00 . B B . 28 LYS HB3 1 1 14 10852 2 2 28 LYS HD2 H -1.375 4.233 10.166 1.00 . B B . 28 LYS HD2 1 1 14 10853 2 2 28 LYS HD3 H -0.719 5.866 10.051 1.00 . B B . 28 LYS HD3 1 1 14 10854 2 2 28 LYS HE2 H -0.136 4.779 12.654 1.00 . B B . 28 LYS HE2 1 1 14 10855 2 2 28 LYS HE3 H 0.414 3.660 11.407 1.00 . B B . 28 LYS HE3 1 1 14 10856 2 2 28 LYS HG2 H -2.628 6.479 11.138 1.00 . B B . 28 LYS HG2 1 1 14 10857 2 2 28 LYS HG3 H -1.784 5.914 12.573 1.00 . B B . 28 LYS HG3 1 1 14 10858 2 2 28 LYS HZ1 H 1.190 5.998 10.387 1.00 . B B . 28 LYS HZ1 1 1 14 10859 2 2 28 LYS HZ2 H 2.181 5.014 11.354 1.00 . B B . 28 LYS HZ2 1 1 14 10860 2 2 28 LYS HZ3 H 1.349 6.325 12.044 1.00 . B B . 28 LYS HZ3 1 1 14 10861 2 2 28 LYS N N -3.256 2.217 10.978 1.00 . B B . 28 LYS N 1 1 14 10862 2 2 28 LYS NZ N 1.303 5.573 11.329 1.00 . B B . 28 LYS NZ 1 1 14 10863 2 2 28 LYS O O -2.096 2.477 14.204 1.00 . B B . 28 LYS O 1 1 14 10864 2 2 29 PRO C C -4.608 0.550 15.162 1.00 . B B . 29 PRO C 1 1 14 10865 2 2 29 PRO CA C -4.719 2.070 15.012 1.00 . B B . 29 PRO CA 1 1 14 10866 2 2 29 PRO CB C -6.180 2.514 15.029 1.00 . B B . 29 PRO CB 1 1 14 10867 2 2 29 PRO CD C -5.355 2.711 12.710 1.00 . B B . 29 PRO CD 1 1 14 10868 2 2 29 PRO CG C -6.633 2.600 13.555 1.00 . B B . 29 PRO CG 1 1 14 10869 2 2 29 PRO HA H -4.170 2.576 15.789 1.00 . B B . 29 PRO HA 1 1 14 10870 2 2 29 PRO HB2 H -6.783 1.803 15.568 1.00 . B B . 29 PRO HB2 1 1 14 10871 2 2 29 PRO HB3 H -6.255 3.492 15.478 1.00 . B B . 29 PRO HB3 1 1 14 10872 2 2 29 PRO HD2 H -5.348 1.945 11.948 1.00 . B B . 29 PRO HD2 1 1 14 10873 2 2 29 PRO HD3 H -5.287 3.689 12.272 1.00 . B B . 29 PRO HD3 1 1 14 10874 2 2 29 PRO HG2 H -7.183 1.709 13.285 1.00 . B B . 29 PRO HG2 1 1 14 10875 2 2 29 PRO HG3 H -7.246 3.475 13.405 1.00 . B B . 29 PRO HG3 1 1 14 10876 2 2 29 PRO N N -4.260 2.494 13.683 1.00 . B B . 29 PRO N 1 1 14 10877 2 2 29 PRO O O -4.001 -0.121 14.351 1.00 . B B . 29 PRO O 1 1 14 10878 2 2 30 THR C C -3.671 -1.938 16.237 1.00 . B B . 30 THR C 1 1 14 10879 2 2 30 THR CA C -5.119 -1.474 16.396 1.00 . B B . 30 THR CA 1 1 14 10880 2 2 30 THR CB C -5.996 -2.176 15.357 1.00 . B B . 30 THR CB 1 1 14 10881 2 2 30 THR CG2 C -7.463 -2.089 15.781 1.00 . B B . 30 THR CG2 1 1 14 10882 2 2 30 THR H H -5.676 0.560 16.837 1.00 . B B . 30 THR H 1 1 14 10883 2 2 30 THR HA H -5.470 -1.719 17.388 1.00 . B B . 30 THR HA 1 1 14 10884 2 2 30 THR HB H -5.708 -3.214 15.284 1.00 . B B . 30 THR HB 1 1 14 10885 2 2 30 THR HG1 H -4.887 -1.479 13.920 1.00 . B B . 30 THR HG1 1 1 14 10886 2 2 30 THR HG21 H -7.520 -1.800 16.820 1.00 . B B . 30 THR HG21 1 1 14 10887 2 2 30 THR HG22 H -7.933 -3.052 15.648 1.00 . B B . 30 THR HG22 1 1 14 10888 2 2 30 THR HG23 H -7.969 -1.354 15.174 1.00 . B B . 30 THR HG23 1 1 14 10889 2 2 30 THR N N -5.191 0.001 16.194 1.00 . B B . 30 THR N 1 1 14 10890 2 2 30 THR O O -2.836 -1.483 17.001 1.00 . B B . 30 THR O 1 1 14 10891 2 2 30 THR OXT O -3.421 -2.741 15.353 1.00 . B B . 30 THR OXT 1 1 14 10892 2 2 30 THR OG1 O -5.829 -1.547 14.094 1.00 . B B . 30 THR OG1 1 1 15 10893 1 1 1 GLY C C 0.762 -3.613 8.225 1.00 . A A . 1 GLY C 1 1 15 10894 1 1 1 GLY CA C 0.197 -3.734 9.600 1.00 . A A . 1 GLY CA 1 1 15 10895 1 1 1 GLY H1 H -1.752 -4.399 9.108 1.00 . A A . 1 GLY H1 1 1 15 10896 1 1 1 GLY H2 H -1.693 -2.785 9.635 1.00 . A A . 1 GLY H2 1 1 15 10897 1 1 1 GLY H3 H -1.546 -4.052 10.757 1.00 . A A . 1 GLY H3 1 1 15 10898 1 1 1 GLY HA2 H 0.563 -2.838 9.714 1.00 . A A . 1 GLY HA2 1 1 15 10899 1 1 1 GLY HA3 H 0.640 -4.506 10.355 1.00 . A A . 1 GLY HA3 1 1 15 10900 1 1 1 GLY N N -1.320 -3.743 9.790 1.00 . A A . 1 GLY N 1 1 15 10901 1 1 1 GLY O O 1.933 -3.850 8.003 1.00 . A A . 1 GLY O 1 1 15 10902 1 1 2 ILE C C 1.658 -2.149 5.860 1.00 . A A . 2 ILE C 1 1 15 10903 1 1 2 ILE CA C 0.472 -3.112 5.877 1.00 . A A . 2 ILE CA 1 1 15 10904 1 1 2 ILE CB C -0.638 -2.594 4.949 1.00 . A A . 2 ILE CB 1 1 15 10905 1 1 2 ILE CD1 C -0.970 -1.222 2.862 1.00 . A A . 2 ILE CD1 1 1 15 10906 1 1 2 ILE CG1 C -0.028 -2.180 3.596 1.00 . A A . 2 ILE CG1 1 1 15 10907 1 1 2 ILE CG2 C -1.340 -1.396 5.594 1.00 . A A . 2 ILE CG2 1 1 15 10908 1 1 2 ILE H H -0.987 -3.062 7.464 1.00 . A A . 2 ILE H 1 1 15 10909 1 1 2 ILE HA H 0.801 -4.074 5.532 1.00 . A A . 2 ILE HA 1 1 15 10910 1 1 2 ILE HB H -1.360 -3.382 4.788 1.00 . A A . 2 ILE HB 1 1 15 10911 1 1 2 ILE HD11 H -1.986 -1.404 3.177 1.00 . A A . 2 ILE HD11 1 1 15 10912 1 1 2 ILE HD12 H -0.887 -1.382 1.797 1.00 . A A . 2 ILE HD12 1 1 15 10913 1 1 2 ILE HD13 H -0.697 -0.202 3.094 1.00 . A A . 2 ILE HD13 1 1 15 10914 1 1 2 ILE HG12 H 0.919 -1.689 3.758 1.00 . A A . 2 ILE HG12 1 1 15 10915 1 1 2 ILE HG13 H 0.126 -3.061 2.990 1.00 . A A . 2 ILE HG13 1 1 15 10916 1 1 2 ILE HG21 H -1.173 -1.410 6.661 1.00 . A A . 2 ILE HG21 1 1 15 10917 1 1 2 ILE HG22 H -2.400 -1.450 5.395 1.00 . A A . 2 ILE HG22 1 1 15 10918 1 1 2 ILE HG23 H -0.942 -0.481 5.180 1.00 . A A . 2 ILE HG23 1 1 15 10919 1 1 2 ILE N N -0.045 -3.245 7.268 1.00 . A A . 2 ILE N 1 1 15 10920 1 1 2 ILE O O 2.740 -2.498 5.440 1.00 . A A . 2 ILE O 1 1 15 10921 1 1 3 ABA C C 3.869 -0.607 6.696 1.00 . A A . 3 ABA C 1 1 15 10922 1 1 3 ABA CA C 2.558 0.066 6.309 1.00 . A A . 3 ABA CA 1 1 15 10923 1 1 3 ABA CB C 2.265 1.205 7.303 1.00 . A A . 3 ABA CB 1 1 15 10924 1 1 3 ABA CG C 0.974 0.940 8.084 1.00 . A A . 3 ABA CG 1 1 15 10925 1 1 3 ABA H H 0.574 -0.698 6.619 1.00 . A A . 3 ABA H 1 1 15 10926 1 1 3 ABA HA H 2.661 0.480 5.322 1.00 . A A . 3 ABA HA 1 1 15 10927 1 1 3 ABA HB2 H 3.084 1.285 7.996 1.00 . A A . 3 ABA HB2 1 1 15 10928 1 1 3 ABA HB3 H 2.168 2.132 6.759 1.00 . A A . 3 ABA HB3 1 1 15 10929 1 1 3 ABA HG1 H 0.936 1.588 8.946 1.00 . A A . 3 ABA HG1 1 1 15 10930 1 1 3 ABA HG2 H 0.953 -0.091 8.405 1.00 . A A . 3 ABA HG2 1 1 15 10931 1 1 3 ABA HG3 H 0.123 1.136 7.448 1.00 . A A . 3 ABA HG3 1 1 15 10932 1 1 3 ABA N N 1.454 -0.942 6.302 1.00 . A A . 3 ABA N 1 1 15 10933 1 1 3 ABA O O 4.679 -0.915 5.853 1.00 . A A . 3 ABA O 1 1 15 10934 1 1 4 GLU C C 5.901 -2.420 7.385 1.00 . A A . 4 GLU C 1 1 15 10935 1 1 4 GLU CA C 5.330 -1.479 8.452 1.00 . A A . 4 GLU CA 1 1 15 10936 1 1 4 GLU CB C 5.012 -2.284 9.709 1.00 . A A . 4 GLU CB 1 1 15 10937 1 1 4 GLU CD C 5.929 -3.091 11.890 1.00 . A A . 4 GLU CD 1 1 15 10938 1 1 4 GLU CG C 6.163 -2.149 10.707 1.00 . A A . 4 GLU CG 1 1 15 10939 1 1 4 GLU H H 3.390 -0.558 8.609 1.00 . A A . 4 GLU H 1 1 15 10940 1 1 4 GLU HA H 6.060 -0.720 8.689 1.00 . A A . 4 GLU HA 1 1 15 10941 1 1 4 GLU HB2 H 4.100 -1.912 10.154 1.00 . A A . 4 GLU HB2 1 1 15 10942 1 1 4 GLU HB3 H 4.887 -3.319 9.442 1.00 . A A . 4 GLU HB3 1 1 15 10943 1 1 4 GLU HG2 H 7.092 -2.405 10.219 1.00 . A A . 4 GLU HG2 1 1 15 10944 1 1 4 GLU HG3 H 6.211 -1.131 11.064 1.00 . A A . 4 GLU HG3 1 1 15 10945 1 1 4 GLU N N 4.073 -0.827 7.965 1.00 . A A . 4 GLU N 1 1 15 10946 1 1 4 GLU O O 7.056 -2.327 7.017 1.00 . A A . 4 GLU O 1 1 15 10947 1 1 4 GLU OE1 O 5.242 -2.690 12.815 1.00 . A A . 4 GLU OE1 1 1 15 10948 1 1 4 GLU OE2 O 6.443 -4.197 11.852 1.00 . A A . 4 GLU OE2 1 1 15 10949 1 1 5 GLN C C 5.745 -3.494 4.517 1.00 . A A . 5 GLN C 1 1 15 10950 1 1 5 GLN CA C 5.595 -4.255 5.832 1.00 . A A . 5 GLN CA 1 1 15 10951 1 1 5 GLN CB C 4.584 -5.386 5.649 1.00 . A A . 5 GLN CB 1 1 15 10952 1 1 5 GLN CD C 4.334 -7.558 4.441 1.00 . A A . 5 GLN CD 1 1 15 10953 1 1 5 GLN CG C 5.312 -6.648 5.186 1.00 . A A . 5 GLN CG 1 1 15 10954 1 1 5 GLN H H 4.171 -3.371 7.186 1.00 . A A . 5 GLN H 1 1 15 10955 1 1 5 GLN HA H 6.549 -4.663 6.129 1.00 . A A . 5 GLN HA 1 1 15 10956 1 1 5 GLN HB2 H 4.085 -5.578 6.588 1.00 . A A . 5 GLN HB2 1 1 15 10957 1 1 5 GLN HB3 H 3.855 -5.100 4.905 1.00 . A A . 5 GLN HB3 1 1 15 10958 1 1 5 GLN HE21 H 4.871 -9.185 5.442 1.00 . A A . 5 GLN HE21 1 1 15 10959 1 1 5 GLN HE22 H 3.662 -9.418 4.274 1.00 . A A . 5 GLN HE22 1 1 15 10960 1 1 5 GLN HG2 H 6.124 -6.374 4.528 1.00 . A A . 5 GLN HG2 1 1 15 10961 1 1 5 GLN HG3 H 5.705 -7.171 6.044 1.00 . A A . 5 GLN HG3 1 1 15 10962 1 1 5 GLN N N 5.100 -3.317 6.880 1.00 . A A . 5 GLN N 1 1 15 10963 1 1 5 GLN NE2 N 4.285 -8.825 4.744 1.00 . A A . 5 GLN NE2 1 1 15 10964 1 1 5 GLN O O 6.728 -3.620 3.814 1.00 . A A . 5 GLN O 1 1 15 10965 1 1 5 GLN OE1 O 3.608 -7.111 3.576 1.00 . A A . 5 GLN OE1 1 1 15 10966 1 1 6 CYS C C 5.507 -0.561 3.247 1.00 . A A . 6 CYS C 1 1 15 10967 1 1 6 CYS CA C 4.815 -1.896 2.945 1.00 . A A . 6 CYS CA 1 1 15 10968 1 1 6 CYS CB C 3.368 -1.639 2.506 1.00 . A A . 6 CYS CB 1 1 15 10969 1 1 6 CYS H H 3.998 -2.608 4.782 1.00 . A A . 6 CYS H 1 1 15 10970 1 1 6 CYS HA H 5.355 -2.428 2.174 1.00 . A A . 6 CYS HA 1 1 15 10971 1 1 6 CYS HB2 H 2.787 -1.330 3.362 1.00 . A A . 6 CYS HB2 1 1 15 10972 1 1 6 CYS HB3 H 3.347 -0.861 1.780 1.00 . A A . 6 CYS HB3 1 1 15 10973 1 1 6 CYS N N 4.772 -2.694 4.192 1.00 . A A . 6 CYS N 1 1 15 10974 1 1 6 CYS O O 5.258 0.437 2.602 1.00 . A A . 6 CYS O 1 1 15 10975 1 1 6 CYS SG S 2.632 -3.140 1.805 1.00 . A A . 6 CYS SG 1 1 15 10976 1 1 7 CYS C C 8.484 0.416 5.085 1.00 . A A . 7 CYS C 1 1 15 10977 1 1 7 CYS CA C 7.054 0.727 4.617 1.00 . A A . 7 CYS CA 1 1 15 10978 1 1 7 CYS CB C 6.266 1.413 5.738 1.00 . A A . 7 CYS CB 1 1 15 10979 1 1 7 CYS H H 6.526 -1.351 4.754 1.00 . A A . 7 CYS H 1 1 15 10980 1 1 7 CYS HA H 7.097 1.380 3.763 1.00 . A A . 7 CYS HA 1 1 15 10981 1 1 7 CYS HB2 H 5.314 1.744 5.357 1.00 . A A . 7 CYS HB2 1 1 15 10982 1 1 7 CYS HB3 H 6.095 0.716 6.536 1.00 . A A . 7 CYS HB3 1 1 15 10983 1 1 7 CYS N N 6.359 -0.538 4.241 1.00 . A A . 7 CYS N 1 1 15 10984 1 1 7 CYS O O 9.392 1.194 4.870 1.00 . A A . 7 CYS O 1 1 15 10985 1 1 7 CYS SG S 7.199 2.834 6.360 1.00 . A A . 7 CYS SG 1 1 15 10986 1 1 8 THR C C 10.675 -2.011 5.098 1.00 . A A . 8 THR C 1 1 15 10987 1 1 8 THR CA C 10.080 -1.074 6.143 1.00 . A A . 8 THR CA 1 1 15 10988 1 1 8 THR CB C 10.027 -1.783 7.500 1.00 . A A . 8 THR CB 1 1 15 10989 1 1 8 THR CG2 C 9.174 -0.969 8.473 1.00 . A A . 8 THR CG2 1 1 15 10990 1 1 8 THR H H 7.971 -1.351 5.849 1.00 . A A . 8 THR H 1 1 15 10991 1 1 8 THR HA H 10.681 -0.179 6.219 1.00 . A A . 8 THR HA 1 1 15 10992 1 1 8 THR HB H 11.026 -1.876 7.896 1.00 . A A . 8 THR HB 1 1 15 10993 1 1 8 THR HG1 H 10.177 -3.698 7.195 1.00 . A A . 8 THR HG1 1 1 15 10994 1 1 8 THR HG21 H 8.237 -0.710 8.002 1.00 . A A . 8 THR HG21 1 1 15 10995 1 1 8 THR HG22 H 9.702 -0.067 8.746 1.00 . A A . 8 THR HG22 1 1 15 10996 1 1 8 THR HG23 H 8.981 -1.555 9.359 1.00 . A A . 8 THR HG23 1 1 15 10997 1 1 8 THR N N 8.703 -0.721 5.699 1.00 . A A . 8 THR N 1 1 15 10998 1 1 8 THR O O 11.841 -1.939 4.763 1.00 . A A . 8 THR O 1 1 15 10999 1 1 8 THR OG1 O 9.460 -3.076 7.336 1.00 . A A . 8 THR OG1 1 1 15 11000 1 1 9 SER C C 9.908 -3.246 2.152 1.00 . A A . 9 SER C 1 1 15 11001 1 1 9 SER CA C 10.332 -3.812 3.510 1.00 . A A . 9 SER CA 1 1 15 11002 1 1 9 SER CB C 9.704 -5.195 3.726 1.00 . A A . 9 SER CB 1 1 15 11003 1 1 9 SER H H 8.917 -2.887 4.844 1.00 . A A . 9 SER H 1 1 15 11004 1 1 9 SER HA H 11.409 -3.889 3.552 1.00 . A A . 9 SER HA 1 1 15 11005 1 1 9 SER HB2 H 8.784 -5.269 3.170 1.00 . A A . 9 SER HB2 1 1 15 11006 1 1 9 SER HB3 H 10.391 -5.959 3.381 1.00 . A A . 9 SER HB3 1 1 15 11007 1 1 9 SER HG H 8.476 -5.430 5.217 1.00 . A A . 9 SER HG 1 1 15 11008 1 1 9 SER N N 9.857 -2.874 4.563 1.00 . A A . 9 SER N 1 1 15 11009 1 1 9 SER O O 9.988 -2.056 1.923 1.00 . A A . 9 SER O 1 1 15 11010 1 1 9 SER OG O 9.429 -5.376 5.109 1.00 . A A . 9 SER OG 1 1 15 11011 1 1 10 ILE C C 7.562 -3.941 -0.336 1.00 . A A . 10 ILE C 1 1 15 11012 1 1 10 ILE CA C 9.015 -3.534 -0.068 1.00 . A A . 10 ILE CA 1 1 15 11013 1 1 10 ILE CB C 9.926 -4.089 -1.173 1.00 . A A . 10 ILE CB 1 1 15 11014 1 1 10 ILE CD1 C 12.194 -3.597 -0.247 1.00 . A A . 10 ILE CD1 1 1 15 11015 1 1 10 ILE CG1 C 11.163 -3.202 -1.306 1.00 . A A . 10 ILE CG1 1 1 15 11016 1 1 10 ILE CG2 C 9.177 -4.108 -2.509 1.00 . A A . 10 ILE CG2 1 1 15 11017 1 1 10 ILE H H 9.375 -5.026 1.442 1.00 . A A . 10 ILE H 1 1 15 11018 1 1 10 ILE HA H 9.087 -2.456 -0.055 1.00 . A A . 10 ILE HA 1 1 15 11019 1 1 10 ILE HB H 10.231 -5.090 -0.917 1.00 . A A . 10 ILE HB 1 1 15 11020 1 1 10 ILE HD11 H 11.992 -3.063 0.669 1.00 . A A . 10 ILE HD11 1 1 15 11021 1 1 10 ILE HD12 H 13.184 -3.347 -0.599 1.00 . A A . 10 ILE HD12 1 1 15 11022 1 1 10 ILE HD13 H 12.133 -4.660 -0.066 1.00 . A A . 10 ILE HD13 1 1 15 11023 1 1 10 ILE HG12 H 11.590 -3.330 -2.290 1.00 . A A . 10 ILE HG12 1 1 15 11024 1 1 10 ILE HG13 H 10.882 -2.170 -1.165 1.00 . A A . 10 ILE HG13 1 1 15 11025 1 1 10 ILE HG21 H 9.869 -4.325 -3.307 1.00 . A A . 10 ILE HG21 1 1 15 11026 1 1 10 ILE HG22 H 8.720 -3.144 -2.678 1.00 . A A . 10 ILE HG22 1 1 15 11027 1 1 10 ILE HG23 H 8.410 -4.869 -2.478 1.00 . A A . 10 ILE HG23 1 1 15 11028 1 1 10 ILE N N 9.445 -4.068 1.252 1.00 . A A . 10 ILE N 1 1 15 11029 1 1 10 ILE O O 7.059 -4.901 0.212 1.00 . A A . 10 ILE O 1 1 15 11030 1 1 11 CYS C C 5.199 -3.130 -2.966 1.00 . A A . 11 CYS C 1 1 15 11031 1 1 11 CYS CA C 5.484 -3.556 -1.528 1.00 . A A . 11 CYS CA 1 1 15 11032 1 1 11 CYS CB C 4.539 -2.859 -0.554 1.00 . A A . 11 CYS CB 1 1 15 11033 1 1 11 CYS H H 7.334 -2.453 -1.631 1.00 . A A . 11 CYS H 1 1 15 11034 1 1 11 CYS HA H 5.343 -4.620 -1.448 1.00 . A A . 11 CYS HA 1 1 15 11035 1 1 11 CYS HB2 H 5.026 -1.993 -0.134 1.00 . A A . 11 CYS HB2 1 1 15 11036 1 1 11 CYS HB3 H 3.644 -2.558 -1.071 1.00 . A A . 11 CYS HB3 1 1 15 11037 1 1 11 CYS N N 6.896 -3.218 -1.195 1.00 . A A . 11 CYS N 1 1 15 11038 1 1 11 CYS O O 5.281 -1.969 -3.312 1.00 . A A . 11 CYS O 1 1 15 11039 1 1 11 CYS SG S 4.119 -4.027 0.767 1.00 . A A . 11 CYS SG 1 1 15 11040 1 1 12 SER C C 3.225 -3.173 -5.406 1.00 . A A . 12 SER C 1 1 15 11041 1 1 12 SER CA C 4.625 -3.750 -5.240 1.00 . A A . 12 SER CA 1 1 15 11042 1 1 12 SER CB C 4.753 -5.019 -6.083 1.00 . A A . 12 SER CB 1 1 15 11043 1 1 12 SER H H 4.849 -5.006 -3.508 1.00 . A A . 12 SER H 1 1 15 11044 1 1 12 SER HA H 5.345 -3.023 -5.586 1.00 . A A . 12 SER HA 1 1 15 11045 1 1 12 SER HB2 H 3.968 -5.044 -6.820 1.00 . A A . 12 SER HB2 1 1 15 11046 1 1 12 SER HB3 H 5.713 -5.023 -6.583 1.00 . A A . 12 SER HB3 1 1 15 11047 1 1 12 SER HG H 4.684 -6.942 -5.791 1.00 . A A . 12 SER HG 1 1 15 11048 1 1 12 SER N N 4.888 -4.075 -3.811 1.00 . A A . 12 SER N 1 1 15 11049 1 1 12 SER O O 2.334 -3.410 -4.618 1.00 . A A . 12 SER O 1 1 15 11050 1 1 12 SER OG O 4.636 -6.158 -5.239 1.00 . A A . 12 SER OG 1 1 15 11051 1 1 13 LEU C C 0.629 -2.851 -6.850 1.00 . A A . 13 LEU C 1 1 15 11052 1 1 13 LEU CA C 1.723 -1.786 -6.714 1.00 . A A . 13 LEU CA 1 1 15 11053 1 1 13 LEU CB C 1.818 -0.999 -8.016 1.00 . A A . 13 LEU CB 1 1 15 11054 1 1 13 LEU CD1 C 1.500 -1.549 -10.425 1.00 . A A . 13 LEU CD1 1 1 15 11055 1 1 13 LEU CD2 C 3.709 -1.944 -9.348 1.00 . A A . 13 LEU CD2 1 1 15 11056 1 1 13 LEU CG C 2.195 -1.964 -9.134 1.00 . A A . 13 LEU CG 1 1 15 11057 1 1 13 LEU H H 3.790 -2.246 -7.053 1.00 . A A . 13 LEU H 1 1 15 11058 1 1 13 LEU HA H 1.473 -1.116 -5.913 1.00 . A A . 13 LEU HA 1 1 15 11059 1 1 13 LEU HB2 H 0.863 -0.542 -8.234 1.00 . A A . 13 LEU HB2 1 1 15 11060 1 1 13 LEU HB3 H 2.577 -0.237 -7.928 1.00 . A A . 13 LEU HB3 1 1 15 11061 1 1 13 LEU HD11 H 1.476 -0.472 -10.488 1.00 . A A . 13 LEU HD11 1 1 15 11062 1 1 13 LEU HD12 H 0.493 -1.935 -10.430 1.00 . A A . 13 LEU HD12 1 1 15 11063 1 1 13 LEU HD13 H 2.045 -1.947 -11.268 1.00 . A A . 13 LEU HD13 1 1 15 11064 1 1 13 LEU HD21 H 4.123 -1.047 -8.911 1.00 . A A . 13 LEU HD21 1 1 15 11065 1 1 13 LEU HD22 H 3.923 -1.961 -10.406 1.00 . A A . 13 LEU HD22 1 1 15 11066 1 1 13 LEU HD23 H 4.150 -2.811 -8.878 1.00 . A A . 13 LEU HD23 1 1 15 11067 1 1 13 LEU HG H 1.882 -2.960 -8.858 1.00 . A A . 13 LEU HG 1 1 15 11068 1 1 13 LEU N N 3.043 -2.412 -6.443 1.00 . A A . 13 LEU N 1 1 15 11069 1 1 13 LEU O O -0.542 -2.534 -6.907 1.00 . A A . 13 LEU O 1 1 15 11070 1 1 14 TYR C C -0.281 -5.695 -5.603 1.00 . A A . 14 TYR C 1 1 15 11071 1 1 14 TYR CA C -0.074 -5.150 -6.991 1.00 . A A . 14 TYR CA 1 1 15 11072 1 1 14 TYR CB C 0.385 -6.255 -7.945 1.00 . A A . 14 TYR CB 1 1 15 11073 1 1 14 TYR CD1 C -0.353 -8.353 -6.754 1.00 . A A . 14 TYR CD1 1 1 15 11074 1 1 14 TYR CD2 C -1.535 -7.671 -8.761 1.00 . A A . 14 TYR CD2 1 1 15 11075 1 1 14 TYR CE1 C -1.193 -9.469 -6.639 1.00 . A A . 14 TYR CE1 1 1 15 11076 1 1 14 TYR CE2 C -2.376 -8.787 -8.646 1.00 . A A . 14 TYR CE2 1 1 15 11077 1 1 14 TYR CG C -0.524 -7.454 -7.816 1.00 . A A . 14 TYR CG 1 1 15 11078 1 1 14 TYR CZ C -2.205 -9.686 -7.585 1.00 . A A . 14 TYR CZ 1 1 15 11079 1 1 14 TYR H H 1.921 -4.375 -6.804 1.00 . A A . 14 TYR H 1 1 15 11080 1 1 14 TYR HA H -0.987 -4.702 -7.337 1.00 . A A . 14 TYR HA 1 1 15 11081 1 1 14 TYR HB2 H 0.354 -5.888 -8.961 1.00 . A A . 14 TYR HB2 1 1 15 11082 1 1 14 TYR HB3 H 1.396 -6.543 -7.699 1.00 . A A . 14 TYR HB3 1 1 15 11083 1 1 14 TYR HD1 H 0.426 -8.187 -6.026 1.00 . A A . 14 TYR HD1 1 1 15 11084 1 1 14 TYR HD2 H -1.667 -6.979 -9.579 1.00 . A A . 14 TYR HD2 1 1 15 11085 1 1 14 TYR HE1 H -1.061 -10.163 -5.821 1.00 . A A . 14 TYR HE1 1 1 15 11086 1 1 14 TYR HE2 H -3.155 -8.954 -9.375 1.00 . A A . 14 TYR HE2 1 1 15 11087 1 1 14 TYR HH H -2.797 -11.405 -8.166 1.00 . A A . 14 TYR HH 1 1 15 11088 1 1 14 TYR N N 0.978 -4.110 -6.880 1.00 . A A . 14 TYR N 1 1 15 11089 1 1 14 TYR O O -1.383 -5.962 -5.166 1.00 . A A . 14 TYR O 1 1 15 11090 1 1 14 TYR OH O -3.031 -10.784 -7.472 1.00 . A A . 14 TYR OH 1 1 15 11091 1 1 15 GLN C C -0.077 -5.176 -2.748 1.00 . A A . 15 GLN C 1 1 15 11092 1 1 15 GLN CA C 0.714 -6.238 -3.496 1.00 . A A . 15 GLN CA 1 1 15 11093 1 1 15 GLN CB C 2.136 -6.283 -2.965 1.00 . A A . 15 GLN CB 1 1 15 11094 1 1 15 GLN CD C 1.951 -8.519 -1.864 1.00 . A A . 15 GLN CD 1 1 15 11095 1 1 15 GLN CG C 2.650 -7.719 -2.966 1.00 . A A . 15 GLN CG 1 1 15 11096 1 1 15 GLN H H 1.648 -5.518 -5.268 1.00 . A A . 15 GLN H 1 1 15 11097 1 1 15 GLN HA H 0.237 -7.202 -3.419 1.00 . A A . 15 GLN HA 1 1 15 11098 1 1 15 GLN HB2 H 2.764 -5.676 -3.609 1.00 . A A . 15 GLN HB2 1 1 15 11099 1 1 15 GLN HB3 H 2.156 -5.886 -1.970 1.00 . A A . 15 GLN HB3 1 1 15 11100 1 1 15 GLN HE21 H 2.509 -7.284 -0.411 1.00 . A A . 15 GLN HE21 1 1 15 11101 1 1 15 GLN HE22 H 1.573 -8.611 0.084 1.00 . A A . 15 GLN HE22 1 1 15 11102 1 1 15 GLN HG2 H 2.444 -8.169 -3.927 1.00 . A A . 15 GLN HG2 1 1 15 11103 1 1 15 GLN HG3 H 3.714 -7.717 -2.791 1.00 . A A . 15 GLN HG3 1 1 15 11104 1 1 15 GLN N N 0.786 -5.791 -4.891 1.00 . A A . 15 GLN N 1 1 15 11105 1 1 15 GLN NE2 N 2.017 -8.103 -0.628 1.00 . A A . 15 GLN NE2 1 1 15 11106 1 1 15 GLN O O -0.823 -5.444 -1.827 1.00 . A A . 15 GLN O 1 1 15 11107 1 1 15 GLN OE1 O 1.341 -9.535 -2.130 1.00 . A A . 15 GLN OE1 1 1 15 11108 1 1 16 LEU C C -2.025 -2.770 -3.196 1.00 . A A . 16 LEU C 1 1 15 11109 1 1 16 LEU CA C -0.643 -2.822 -2.582 1.00 . A A . 16 LEU CA 1 1 15 11110 1 1 16 LEU CB C 0.152 -1.558 -2.884 1.00 . A A . 16 LEU CB 1 1 15 11111 1 1 16 LEU CD1 C 2.319 -0.403 -2.354 1.00 . A A . 16 LEU CD1 1 1 15 11112 1 1 16 LEU CD2 C 1.393 -2.114 -0.788 1.00 . A A . 16 LEU CD2 1 1 15 11113 1 1 16 LEU CG C 1.542 -1.713 -2.258 1.00 . A A . 16 LEU CG 1 1 15 11114 1 1 16 LEU H H 0.667 -3.799 -3.956 1.00 . A A . 16 LEU H 1 1 15 11115 1 1 16 LEU HA H -0.730 -2.954 -1.519 1.00 . A A . 16 LEU HA 1 1 15 11116 1 1 16 LEU HB2 H 0.245 -1.436 -3.954 1.00 . A A . 16 LEU HB2 1 1 15 11117 1 1 16 LEU HB3 H -0.344 -0.707 -2.464 1.00 . A A . 16 LEU HB3 1 1 15 11118 1 1 16 LEU HD11 H 2.021 0.252 -1.551 1.00 . A A . 16 LEU HD11 1 1 15 11119 1 1 16 LEU HD12 H 2.113 0.068 -3.303 1.00 . A A . 16 LEU HD12 1 1 15 11120 1 1 16 LEU HD13 H 3.378 -0.610 -2.277 1.00 . A A . 16 LEU HD13 1 1 15 11121 1 1 16 LEU HD21 H 2.143 -1.607 -0.199 1.00 . A A . 16 LEU HD21 1 1 15 11122 1 1 16 LEU HD22 H 1.524 -3.183 -0.694 1.00 . A A . 16 LEU HD22 1 1 15 11123 1 1 16 LEU HD23 H 0.410 -1.840 -0.438 1.00 . A A . 16 LEU HD23 1 1 15 11124 1 1 16 LEU HG H 2.084 -2.483 -2.781 1.00 . A A . 16 LEU HG 1 1 15 11125 1 1 16 LEU N N 0.078 -3.961 -3.188 1.00 . A A . 16 LEU N 1 1 15 11126 1 1 16 LEU O O -2.956 -2.227 -2.634 1.00 . A A . 16 LEU O 1 1 15 11127 1 1 17 GLU C C -4.342 -4.456 -4.251 1.00 . A A . 17 GLU C 1 1 15 11128 1 1 17 GLU CA C -3.489 -3.414 -4.983 1.00 . A A . 17 GLU CA 1 1 15 11129 1 1 17 GLU CB C -3.302 -3.826 -6.443 1.00 . A A . 17 GLU CB 1 1 15 11130 1 1 17 GLU CD C -4.577 -4.678 -8.414 1.00 . A A . 17 GLU CD 1 1 15 11131 1 1 17 GLU CG C -4.653 -3.808 -7.158 1.00 . A A . 17 GLU CG 1 1 15 11132 1 1 17 GLU H H -1.408 -3.829 -4.752 1.00 . A A . 17 GLU H 1 1 15 11133 1 1 17 GLU HA H -3.951 -2.443 -4.928 1.00 . A A . 17 GLU HA 1 1 15 11134 1 1 17 GLU HB2 H -2.623 -3.137 -6.925 1.00 . A A . 17 GLU HB2 1 1 15 11135 1 1 17 GLU HB3 H -2.885 -4.821 -6.483 1.00 . A A . 17 GLU HB3 1 1 15 11136 1 1 17 GLU HG2 H -5.415 -4.196 -6.496 1.00 . A A . 17 GLU HG2 1 1 15 11137 1 1 17 GLU HG3 H -4.900 -2.796 -7.437 1.00 . A A . 17 GLU HG3 1 1 15 11138 1 1 17 GLU N N -2.170 -3.374 -4.335 1.00 . A A . 17 GLU N 1 1 15 11139 1 1 17 GLU O O -5.558 -4.427 -4.284 1.00 . A A . 17 GLU O 1 1 15 11140 1 1 17 GLU OE1 O -3.579 -4.592 -9.110 1.00 . A A . 17 GLU OE1 1 1 15 11141 1 1 17 GLU OE2 O -5.518 -5.414 -8.658 1.00 . A A . 17 GLU OE2 1 1 15 11142 1 1 18 ASN C C -4.994 -5.892 -1.530 1.00 . A A . 18 ASN C 1 1 15 11143 1 1 18 ASN CA C -4.451 -6.442 -2.851 1.00 . A A . 18 ASN CA 1 1 15 11144 1 1 18 ASN CB C -3.515 -7.618 -2.560 1.00 . A A . 18 ASN CB 1 1 15 11145 1 1 18 ASN CG C -4.326 -8.914 -2.486 1.00 . A A . 18 ASN CG 1 1 15 11146 1 1 18 ASN H H -2.715 -5.380 -3.570 1.00 . A A . 18 ASN H 1 1 15 11147 1 1 18 ASN HA H -5.274 -6.784 -3.461 1.00 . A A . 18 ASN HA 1 1 15 11148 1 1 18 ASN HB2 H -2.782 -7.697 -3.349 1.00 . A A . 18 ASN HB2 1 1 15 11149 1 1 18 ASN HB3 H -3.014 -7.456 -1.617 1.00 . A A . 18 ASN HB3 1 1 15 11150 1 1 18 ASN HD21 H -5.753 -8.127 -1.351 1.00 . A A . 18 ASN HD21 1 1 15 11151 1 1 18 ASN HD22 H -5.966 -9.762 -1.754 1.00 . A A . 18 ASN HD22 1 1 15 11152 1 1 18 ASN N N -3.698 -5.382 -3.584 1.00 . A A . 18 ASN N 1 1 15 11153 1 1 18 ASN ND2 N -5.441 -8.936 -1.808 1.00 . A A . 18 ASN ND2 1 1 15 11154 1 1 18 ASN O O -5.706 -6.569 -0.816 1.00 . A A . 18 ASN O 1 1 15 11155 1 1 18 ASN OD1 O -3.939 -9.918 -3.049 1.00 . A A . 18 ASN OD1 1 1 15 11156 1 1 19 TYR C C -6.441 -3.295 -0.170 1.00 . A A . 19 TYR C 1 1 15 11157 1 1 19 TYR CA C -5.176 -4.111 0.090 1.00 . A A . 19 TYR CA 1 1 15 11158 1 1 19 TYR CB C -4.116 -3.208 0.720 1.00 . A A . 19 TYR CB 1 1 15 11159 1 1 19 TYR CD1 C -1.999 -4.577 0.726 1.00 . A A . 19 TYR CD1 1 1 15 11160 1 1 19 TYR CD2 C -3.223 -4.317 2.805 1.00 . A A . 19 TYR CD2 1 1 15 11161 1 1 19 TYR CE1 C -1.044 -5.362 1.385 1.00 . A A . 19 TYR CE1 1 1 15 11162 1 1 19 TYR CE2 C -2.268 -5.103 3.465 1.00 . A A . 19 TYR CE2 1 1 15 11163 1 1 19 TYR CG C -3.088 -4.054 1.434 1.00 . A A . 19 TYR CG 1 1 15 11164 1 1 19 TYR CZ C -1.179 -5.625 2.755 1.00 . A A . 19 TYR CZ 1 1 15 11165 1 1 19 TYR H H -4.090 -4.138 -1.773 1.00 . A A . 19 TYR H 1 1 15 11166 1 1 19 TYR HA H -5.404 -4.918 0.769 1.00 . A A . 19 TYR HA 1 1 15 11167 1 1 19 TYR HB2 H -3.632 -2.627 -0.052 1.00 . A A . 19 TYR HB2 1 1 15 11168 1 1 19 TYR HB3 H -4.590 -2.544 1.427 1.00 . A A . 19 TYR HB3 1 1 15 11169 1 1 19 TYR HD1 H -1.894 -4.374 -0.329 1.00 . A A . 19 TYR HD1 1 1 15 11170 1 1 19 TYR HD2 H -4.063 -3.915 3.354 1.00 . A A . 19 TYR HD2 1 1 15 11171 1 1 19 TYR HE1 H -0.205 -5.765 0.839 1.00 . A A . 19 TYR HE1 1 1 15 11172 1 1 19 TYR HE2 H -2.371 -5.306 4.520 1.00 . A A . 19 TYR HE2 1 1 15 11173 1 1 19 TYR HH H 0.555 -6.416 2.864 1.00 . A A . 19 TYR HH 1 1 15 11174 1 1 19 TYR N N -4.667 -4.676 -1.191 1.00 . A A . 19 TYR N 1 1 15 11175 1 1 19 TYR O O -6.930 -2.603 0.702 1.00 . A A . 19 TYR O 1 1 15 11176 1 1 19 TYR OH O -0.239 -6.400 3.404 1.00 . A A . 19 TYR OH 1 1 15 11177 1 1 20 CYS C C -9.446 -3.396 -1.238 1.00 . A A . 20 CYS C 1 1 15 11178 1 1 20 CYS CA C -8.219 -2.578 -1.638 1.00 . A A . 20 CYS CA 1 1 15 11179 1 1 20 CYS CB C -8.300 -2.245 -3.127 1.00 . A A . 20 CYS CB 1 1 15 11180 1 1 20 CYS H H -6.583 -3.924 -2.052 1.00 . A A . 20 CYS H 1 1 15 11181 1 1 20 CYS HA H -8.198 -1.662 -1.066 1.00 . A A . 20 CYS HA 1 1 15 11182 1 1 20 CYS HB2 H -8.763 -3.064 -3.655 1.00 . A A . 20 CYS HB2 1 1 15 11183 1 1 20 CYS HB3 H -8.892 -1.351 -3.263 1.00 . A A . 20 CYS HB3 1 1 15 11184 1 1 20 CYS N N -6.983 -3.363 -1.356 1.00 . A A . 20 CYS N 1 1 15 11185 1 1 20 CYS O O -9.334 -4.495 -0.733 1.00 . A A . 20 CYS O 1 1 15 11186 1 1 20 CYS SG S -6.638 -1.968 -3.782 1.00 . A A . 20 CYS SG 1 1 15 11187 1 1 21 ASN C C -12.012 -4.817 -2.027 1.00 . A A . 21 ASN C 1 1 15 11188 1 1 21 ASN CA C -11.853 -3.615 -1.095 1.00 . A A . 21 ASN CA 1 1 15 11189 1 1 21 ASN CB C -13.065 -2.693 -1.238 1.00 . A A . 21 ASN CB 1 1 15 11190 1 1 21 ASN CG C -14.202 -3.207 -0.355 1.00 . A A . 21 ASN CG 1 1 15 11191 1 1 21 ASN H H -10.684 -1.980 -1.870 1.00 . A A . 21 ASN H 1 1 15 11192 1 1 21 ASN HA H -11.778 -3.957 -0.074 1.00 . A A . 21 ASN HA 1 1 15 11193 1 1 21 ASN HB2 H -12.794 -1.692 -0.933 1.00 . A A . 21 ASN HB2 1 1 15 11194 1 1 21 ASN HB3 H -13.389 -2.680 -2.268 1.00 . A A . 21 ASN HB3 1 1 15 11195 1 1 21 ASN HD21 H -13.238 -2.844 1.342 1.00 . A A . 21 ASN HD21 1 1 15 11196 1 1 21 ASN HD22 H -14.788 -3.514 1.518 1.00 . A A . 21 ASN HD22 1 1 15 11197 1 1 21 ASN N N -10.617 -2.868 -1.461 1.00 . A A . 21 ASN N 1 1 15 11198 1 1 21 ASN ND2 N -14.065 -3.187 0.943 1.00 . A A . 21 ASN ND2 1 1 15 11199 1 1 21 ASN O O -11.315 -4.864 -3.026 1.00 . A A . 21 ASN O 1 1 15 11200 1 1 21 ASN OXT O -12.830 -5.671 -1.725 1.00 . A A . 21 ASN OXT 1 1 15 11201 1 1 21 ASN OD1 O -15.227 -3.633 -0.850 1.00 . A A . 21 ASN OD1 1 1 15 11202 2 2 1 PHE C C 9.163 -0.999 -10.599 1.00 . B B . 1 PHE C 1 1 15 11203 2 2 1 PHE CA C 7.778 -1.058 -11.246 1.00 . B B . 1 PHE CA 1 1 15 11204 2 2 1 PHE CB C 7.061 0.280 -11.048 1.00 . B B . 1 PHE CB 1 1 15 11205 2 2 1 PHE CD1 C 8.309 1.556 -12.829 1.00 . B B . 1 PHE CD1 1 1 15 11206 2 2 1 PHE CD2 C 5.904 1.307 -13.041 1.00 . B B . 1 PHE CD2 1 1 15 11207 2 2 1 PHE CE1 C 8.339 2.287 -14.025 1.00 . B B . 1 PHE CE1 1 1 15 11208 2 2 1 PHE CE2 C 5.935 2.038 -14.237 1.00 . B B . 1 PHE CE2 1 1 15 11209 2 2 1 PHE CG C 7.092 1.066 -12.337 1.00 . B B . 1 PHE CG 1 1 15 11210 2 2 1 PHE CZ C 7.152 2.527 -14.728 1.00 . B B . 1 PHE CZ 1 1 15 11211 2 2 1 PHE H1 H 7.287 -3.065 -10.990 1.00 . B B . 1 PHE H1 1 1 15 11212 2 2 1 PHE H2 H 5.973 -2.003 -10.819 1.00 . B B . 1 PHE H2 1 1 15 11213 2 2 1 PHE H3 H 7.130 -2.131 -9.583 1.00 . B B . 1 PHE H3 1 1 15 11214 2 2 1 PHE HA H 7.881 -1.257 -12.302 1.00 . B B . 1 PHE HA 1 1 15 11215 2 2 1 PHE HB2 H 6.035 0.099 -10.761 1.00 . B B . 1 PHE HB2 1 1 15 11216 2 2 1 PHE HB3 H 7.557 0.843 -10.271 1.00 . B B . 1 PHE HB3 1 1 15 11217 2 2 1 PHE HD1 H 9.225 1.371 -12.286 1.00 . B B . 1 PHE HD1 1 1 15 11218 2 2 1 PHE HD2 H 4.966 0.930 -12.663 1.00 . B B . 1 PHE HD2 1 1 15 11219 2 2 1 PHE HE1 H 9.278 2.665 -14.404 1.00 . B B . 1 PHE HE1 1 1 15 11220 2 2 1 PHE HE2 H 5.020 2.224 -14.780 1.00 . B B . 1 PHE HE2 1 1 15 11221 2 2 1 PHE HZ H 7.175 3.090 -15.650 1.00 . B B . 1 PHE HZ 1 1 15 11222 2 2 1 PHE N N 6.982 -2.147 -10.612 1.00 . B B . 1 PHE N 1 1 15 11223 2 2 1 PHE O O 10.175 -1.047 -11.270 1.00 . B B . 1 PHE O 1 1 15 11224 2 2 2 VAL C C 10.510 -1.760 -7.385 1.00 . B B . 2 VAL C 1 1 15 11225 2 2 2 VAL CA C 10.536 -0.837 -8.607 1.00 . B B . 2 VAL CA 1 1 15 11226 2 2 2 VAL CB C 10.809 0.601 -8.163 1.00 . B B . 2 VAL CB 1 1 15 11227 2 2 2 VAL CG1 C 10.874 1.510 -9.392 1.00 . B B . 2 VAL CG1 1 1 15 11228 2 2 2 VAL CG2 C 9.681 1.069 -7.243 1.00 . B B . 2 VAL CG2 1 1 15 11229 2 2 2 VAL H H 8.388 -0.860 -8.776 1.00 . B B . 2 VAL H 1 1 15 11230 2 2 2 VAL HA H 11.312 -1.159 -9.286 1.00 . B B . 2 VAL HA 1 1 15 11231 2 2 2 VAL HB H 11.751 0.643 -7.635 1.00 . B B . 2 VAL HB 1 1 15 11232 2 2 2 VAL HG11 H 11.018 2.533 -9.076 1.00 . B B . 2 VAL HG11 1 1 15 11233 2 2 2 VAL HG12 H 9.950 1.432 -9.946 1.00 . B B . 2 VAL HG12 1 1 15 11234 2 2 2 VAL HG13 H 11.698 1.207 -10.021 1.00 . B B . 2 VAL HG13 1 1 15 11235 2 2 2 VAL HG21 H 10.101 1.502 -6.348 1.00 . B B . 2 VAL HG21 1 1 15 11236 2 2 2 VAL HG22 H 9.061 0.225 -6.978 1.00 . B B . 2 VAL HG22 1 1 15 11237 2 2 2 VAL HG23 H 9.082 1.808 -7.755 1.00 . B B . 2 VAL HG23 1 1 15 11238 2 2 2 VAL N N 9.216 -0.897 -9.299 1.00 . B B . 2 VAL N 1 1 15 11239 2 2 2 VAL O O 9.694 -2.655 -7.292 1.00 . B B . 2 VAL O 1 1 15 11240 2 2 3 ASN C C 11.804 -1.618 -4.010 1.00 . B B . 3 ASN C 1 1 15 11241 2 2 3 ASN CA C 11.419 -2.437 -5.243 1.00 . B B . 3 ASN CA 1 1 15 11242 2 2 3 ASN CB C 12.444 -3.546 -5.453 1.00 . B B . 3 ASN CB 1 1 15 11243 2 2 3 ASN CG C 11.727 -4.891 -5.586 1.00 . B B . 3 ASN CG 1 1 15 11244 2 2 3 ASN H H 12.054 -0.836 -6.539 1.00 . B B . 3 ASN H 1 1 15 11245 2 2 3 ASN HA H 10.442 -2.872 -5.099 1.00 . B B . 3 ASN HA 1 1 15 11246 2 2 3 ASN HB2 H 13.002 -3.342 -6.351 1.00 . B B . 3 ASN HB2 1 1 15 11247 2 2 3 ASN HB3 H 13.118 -3.580 -4.610 1.00 . B B . 3 ASN HB3 1 1 15 11248 2 2 3 ASN HD21 H 10.939 -4.456 -7.355 1.00 . B B . 3 ASN HD21 1 1 15 11249 2 2 3 ASN HD22 H 10.550 -5.991 -6.745 1.00 . B B . 3 ASN HD22 1 1 15 11250 2 2 3 ASN N N 11.399 -1.558 -6.448 1.00 . B B . 3 ASN N 1 1 15 11251 2 2 3 ASN ND2 N 11.013 -5.132 -6.651 1.00 . B B . 3 ASN ND2 1 1 15 11252 2 2 3 ASN O O 12.779 -1.900 -3.343 1.00 . B B . 3 ASN O 1 1 15 11253 2 2 3 ASN OD1 O 11.819 -5.730 -4.713 1.00 . B B . 3 ASN OD1 1 1 15 11254 2 2 4 GLN C C 10.292 0.083 -1.446 1.00 . B B . 4 GLN C 1 1 15 11255 2 2 4 GLN CA C 11.370 0.244 -2.526 1.00 . B B . 4 GLN CA 1 1 15 11256 2 2 4 GLN CB C 11.443 1.710 -2.959 1.00 . B B . 4 GLN CB 1 1 15 11257 2 2 4 GLN CD C 12.385 3.912 -2.246 1.00 . B B . 4 GLN CD 1 1 15 11258 2 2 4 GLN CG C 12.608 2.399 -2.245 1.00 . B B . 4 GLN CG 1 1 15 11259 2 2 4 GLN H H 10.274 -0.395 -4.269 1.00 . B B . 4 GLN H 1 1 15 11260 2 2 4 GLN HA H 12.325 -0.057 -2.121 1.00 . B B . 4 GLN HA 1 1 15 11261 2 2 4 GLN HB2 H 11.596 1.760 -4.028 1.00 . B B . 4 GLN HB2 1 1 15 11262 2 2 4 GLN HB3 H 10.521 2.208 -2.703 1.00 . B B . 4 GLN HB3 1 1 15 11263 2 2 4 GLN HE21 H 14.276 4.330 -1.809 1.00 . B B . 4 GLN HE21 1 1 15 11264 2 2 4 GLN HE22 H 13.259 5.676 -1.994 1.00 . B B . 4 GLN HE22 1 1 15 11265 2 2 4 GLN HG2 H 12.667 2.043 -1.227 1.00 . B B . 4 GLN HG2 1 1 15 11266 2 2 4 GLN HG3 H 13.530 2.172 -2.759 1.00 . B B . 4 GLN HG3 1 1 15 11267 2 2 4 GLN N N 11.048 -0.603 -3.710 1.00 . B B . 4 GLN N 1 1 15 11268 2 2 4 GLN NE2 N 13.390 4.705 -1.996 1.00 . B B . 4 GLN NE2 1 1 15 11269 2 2 4 GLN O O 9.396 -0.737 -1.554 1.00 . B B . 4 GLN O 1 1 15 11270 2 2 4 GLN OE1 O 11.287 4.377 -2.478 1.00 . B B . 4 GLN OE1 1 1 15 11271 2 2 5 HIS C C 8.337 1.880 0.540 1.00 . B B . 5 HIS C 1 1 15 11272 2 2 5 HIS CA C 9.385 0.772 0.706 1.00 . B B . 5 HIS CA 1 1 15 11273 2 2 5 HIS CB C 10.093 0.931 2.060 1.00 . B B . 5 HIS CB 1 1 15 11274 2 2 5 HIS CD2 C 12.637 1.463 1.726 1.00 . B B . 5 HIS CD2 1 1 15 11275 2 2 5 HIS CE1 C 13.375 -0.579 1.792 1.00 . B B . 5 HIS CE1 1 1 15 11276 2 2 5 HIS CG C 11.565 0.634 1.914 1.00 . B B . 5 HIS CG 1 1 15 11277 2 2 5 HIS H H 11.117 1.509 -0.339 1.00 . B B . 5 HIS H 1 1 15 11278 2 2 5 HIS HA H 8.896 -0.191 0.667 1.00 . B B . 5 HIS HA 1 1 15 11279 2 2 5 HIS HB2 H 9.966 1.942 2.416 1.00 . B B . 5 HIS HB2 1 1 15 11280 2 2 5 HIS HB3 H 9.660 0.244 2.772 1.00 . B B . 5 HIS HB3 1 1 15 11281 2 2 5 HIS HD2 H 12.594 2.539 1.650 1.00 . B B . 5 HIS HD2 1 1 15 11282 2 2 5 HIS HE1 H 14.037 -1.433 1.778 1.00 . B B . 5 HIS HE1 1 1 15 11283 2 2 5 HIS HE2 H 14.700 1.017 1.514 1.00 . B B . 5 HIS HE2 1 1 15 11284 2 2 5 HIS N N 10.383 0.863 -0.400 1.00 . B B . 5 HIS N 1 1 15 11285 2 2 5 HIS ND1 N 12.046 -0.658 1.955 1.00 . B B . 5 HIS ND1 1 1 15 11286 2 2 5 HIS NE2 N 13.782 0.699 1.648 1.00 . B B . 5 HIS NE2 1 1 15 11287 2 2 5 HIS O O 8.501 2.787 -0.252 1.00 . B B . 5 HIS O 1 1 15 11288 2 2 6 LEU C C 5.747 3.362 2.488 1.00 . B B . 6 LEU C 1 1 15 11289 2 2 6 LEU CA C 6.189 2.848 1.123 1.00 . B B . 6 LEU CA 1 1 15 11290 2 2 6 LEU CB C 4.962 2.210 0.469 1.00 . B B . 6 LEU CB 1 1 15 11291 2 2 6 LEU CD1 C 5.733 3.511 -1.559 1.00 . B B . 6 LEU CD1 1 1 15 11292 2 2 6 LEU CD2 C 3.860 1.884 -1.731 1.00 . B B . 6 LEU CD2 1 1 15 11293 2 2 6 LEU CG C 4.526 2.917 -0.830 1.00 . B B . 6 LEU CG 1 1 15 11294 2 2 6 LEU H H 7.127 1.058 1.882 1.00 . B B . 6 LEU H 1 1 15 11295 2 2 6 LEU HA H 6.562 3.662 0.534 1.00 . B B . 6 LEU HA 1 1 15 11296 2 2 6 LEU HB2 H 5.196 1.185 0.255 1.00 . B B . 6 LEU HB2 1 1 15 11297 2 2 6 LEU HB3 H 4.145 2.239 1.175 1.00 . B B . 6 LEU HB3 1 1 15 11298 2 2 6 LEU HD11 H 5.502 3.619 -2.608 1.00 . B B . 6 LEU HD11 1 1 15 11299 2 2 6 LEU HD12 H 6.582 2.854 -1.443 1.00 . B B . 6 LEU HD12 1 1 15 11300 2 2 6 LEU HD13 H 5.966 4.478 -1.140 1.00 . B B . 6 LEU HD13 1 1 15 11301 2 2 6 LEU HD21 H 4.178 0.895 -1.436 1.00 . B B . 6 LEU HD21 1 1 15 11302 2 2 6 LEU HD22 H 4.143 2.065 -2.755 1.00 . B B . 6 LEU HD22 1 1 15 11303 2 2 6 LEU HD23 H 2.787 1.962 -1.631 1.00 . B B . 6 LEU HD23 1 1 15 11304 2 2 6 LEU HG H 3.805 3.701 -0.606 1.00 . B B . 6 LEU HG 1 1 15 11305 2 2 6 LEU N N 7.252 1.806 1.264 1.00 . B B . 6 LEU N 1 1 15 11306 2 2 6 LEU O O 5.481 2.600 3.394 1.00 . B B . 6 LEU O 1 1 15 11307 2 2 7 CYS C C 4.479 6.545 3.715 1.00 . B B . 7 CYS C 1 1 15 11308 2 2 7 CYS CA C 5.152 5.185 3.937 1.00 . B B . 7 CYS CA 1 1 15 11309 2 2 7 CYS CB C 6.328 5.350 4.912 1.00 . B B . 7 CYS CB 1 1 15 11310 2 2 7 CYS H H 5.809 5.252 1.889 1.00 . B B . 7 CYS H 1 1 15 11311 2 2 7 CYS HA H 4.432 4.495 4.353 1.00 . B B . 7 CYS HA 1 1 15 11312 2 2 7 CYS HB2 H 6.830 6.285 4.715 1.00 . B B . 7 CYS HB2 1 1 15 11313 2 2 7 CYS HB3 H 5.950 5.355 5.922 1.00 . B B . 7 CYS HB3 1 1 15 11314 2 2 7 CYS N N 5.623 4.647 2.637 1.00 . B B . 7 CYS N 1 1 15 11315 2 2 7 CYS O O 4.862 7.307 2.846 1.00 . B B . 7 CYS O 1 1 15 11316 2 2 7 CYS SG S 7.508 3.987 4.729 1.00 . B B . 7 CYS SG 1 1 15 11317 2 2 8 GLY C C 2.061 8.239 3.002 1.00 . B B . 8 GLY C 1 1 15 11318 2 2 8 GLY CA C 2.790 8.168 4.346 1.00 . B B . 8 GLY CA 1 1 15 11319 2 2 8 GLY H H 3.192 6.228 5.193 1.00 . B B . 8 GLY H 1 1 15 11320 2 2 8 GLY HA2 H 2.075 8.287 5.148 1.00 . B B . 8 GLY HA2 1 1 15 11321 2 2 8 GLY HA3 H 3.518 8.963 4.397 1.00 . B B . 8 GLY HA3 1 1 15 11322 2 2 8 GLY N N 3.482 6.856 4.498 1.00 . B B . 8 GLY N 1 1 15 11323 2 2 8 GLY O O 1.557 7.253 2.495 1.00 . B B . 8 GLY O 1 1 15 11324 2 2 9 SER C C 1.805 8.541 0.122 1.00 . B B . 9 SER C 1 1 15 11325 2 2 9 SER CA C 1.289 9.570 1.124 1.00 . B B . 9 SER CA 1 1 15 11326 2 2 9 SER CB C 1.537 10.977 0.579 1.00 . B B . 9 SER CB 1 1 15 11327 2 2 9 SER H H 2.397 10.191 2.861 1.00 . B B . 9 SER H 1 1 15 11328 2 2 9 SER HA H 0.234 9.424 1.270 1.00 . B B . 9 SER HA 1 1 15 11329 2 2 9 SER HB2 H 2.475 11.351 0.953 1.00 . B B . 9 SER HB2 1 1 15 11330 2 2 9 SER HB3 H 1.571 10.943 -0.502 1.00 . B B . 9 SER HB3 1 1 15 11331 2 2 9 SER HG H 0.245 11.586 1.900 1.00 . B B . 9 SER HG 1 1 15 11332 2 2 9 SER N N 1.992 9.411 2.427 1.00 . B B . 9 SER N 1 1 15 11333 2 2 9 SER O O 1.073 8.059 -0.720 1.00 . B B . 9 SER O 1 1 15 11334 2 2 9 SER OG O 0.488 11.836 1.006 1.00 . B B . 9 SER OG 1 1 15 11335 2 2 10 ASP C C 2.779 5.925 -0.678 1.00 . B B . 10 ASP C 1 1 15 11336 2 2 10 ASP CA C 3.612 7.202 -0.750 1.00 . B B . 10 ASP CA 1 1 15 11337 2 2 10 ASP CB C 5.062 6.888 -0.378 1.00 . B B . 10 ASP CB 1 1 15 11338 2 2 10 ASP CG C 5.806 8.191 -0.084 1.00 . B B . 10 ASP CG 1 1 15 11339 2 2 10 ASP H H 3.627 8.599 0.892 1.00 . B B . 10 ASP H 1 1 15 11340 2 2 10 ASP HA H 3.576 7.601 -1.752 1.00 . B B . 10 ASP HA 1 1 15 11341 2 2 10 ASP HB2 H 5.078 6.256 0.498 1.00 . B B . 10 ASP HB2 1 1 15 11342 2 2 10 ASP HB3 H 5.542 6.377 -1.199 1.00 . B B . 10 ASP HB3 1 1 15 11343 2 2 10 ASP N N 3.056 8.200 0.204 1.00 . B B . 10 ASP N 1 1 15 11344 2 2 10 ASP O O 2.563 5.251 -1.667 1.00 . B B . 10 ASP O 1 1 15 11345 2 2 10 ASP OD1 O 5.701 8.670 1.033 1.00 . B B . 10 ASP OD1 1 1 15 11346 2 2 10 ASP OD2 O 6.469 8.687 -0.980 1.00 . B B . 10 ASP OD2 1 1 15 11347 2 2 11 LEU C C 0.095 4.590 0.054 1.00 . B B . 11 LEU C 1 1 15 11348 2 2 11 LEU CA C 1.491 4.353 0.631 1.00 . B B . 11 LEU CA 1 1 15 11349 2 2 11 LEU CB C 1.389 3.982 2.113 1.00 . B B . 11 LEU CB 1 1 15 11350 2 2 11 LEU CD1 C 1.315 1.634 1.204 1.00 . B B . 11 LEU CD1 1 1 15 11351 2 2 11 LEU CD2 C 1.135 2.041 3.658 1.00 . B B . 11 LEU CD2 1 1 15 11352 2 2 11 LEU CG C 0.773 2.586 2.275 1.00 . B B . 11 LEU CG 1 1 15 11353 2 2 11 LEU H H 2.494 6.145 1.272 1.00 . B B . 11 LEU H 1 1 15 11354 2 2 11 LEU HA H 1.967 3.549 0.092 1.00 . B B . 11 LEU HA 1 1 15 11355 2 2 11 LEU HB2 H 2.377 3.989 2.552 1.00 . B B . 11 LEU HB2 1 1 15 11356 2 2 11 LEU HB3 H 0.768 4.706 2.620 1.00 . B B . 11 LEU HB3 1 1 15 11357 2 2 11 LEU HD11 H 2.394 1.654 1.215 1.00 . B B . 11 LEU HD11 1 1 15 11358 2 2 11 LEU HD12 H 0.960 1.943 0.232 1.00 . B B . 11 LEU HD12 1 1 15 11359 2 2 11 LEU HD13 H 0.974 0.629 1.408 1.00 . B B . 11 LEU HD13 1 1 15 11360 2 2 11 LEU HD21 H 0.891 2.777 4.409 1.00 . B B . 11 LEU HD21 1 1 15 11361 2 2 11 LEU HD22 H 2.193 1.827 3.693 1.00 . B B . 11 LEU HD22 1 1 15 11362 2 2 11 LEU HD23 H 0.577 1.136 3.845 1.00 . B B . 11 LEU HD23 1 1 15 11363 2 2 11 LEU HG H -0.301 2.655 2.185 1.00 . B B . 11 LEU HG 1 1 15 11364 2 2 11 LEU N N 2.308 5.587 0.489 1.00 . B B . 11 LEU N 1 1 15 11365 2 2 11 LEU O O -0.431 3.765 -0.665 1.00 . B B . 11 LEU O 1 1 15 11366 2 2 12 VAL C C -1.735 6.282 -1.698 1.00 . B B . 12 VAL C 1 1 15 11367 2 2 12 VAL CA C -1.871 5.968 -0.209 1.00 . B B . 12 VAL CA 1 1 15 11368 2 2 12 VAL CB C -2.536 7.139 0.535 1.00 . B B . 12 VAL CB 1 1 15 11369 2 2 12 VAL CG1 C -2.027 7.171 1.973 1.00 . B B . 12 VAL CG1 1 1 15 11370 2 2 12 VAL CG2 C -2.205 8.476 -0.140 1.00 . B B . 12 VAL CG2 1 1 15 11371 2 2 12 VAL H H -0.076 6.373 0.923 1.00 . B B . 12 VAL H 1 1 15 11372 2 2 12 VAL HA H -2.475 5.080 -0.090 1.00 . B B . 12 VAL HA 1 1 15 11373 2 2 12 VAL HB H -3.607 6.994 0.541 1.00 . B B . 12 VAL HB 1 1 15 11374 2 2 12 VAL HG11 H -1.201 7.862 2.044 1.00 . B B . 12 VAL HG11 1 1 15 11375 2 2 12 VAL HG12 H -1.697 6.183 2.257 1.00 . B B . 12 VAL HG12 1 1 15 11376 2 2 12 VAL HG13 H -2.823 7.489 2.628 1.00 . B B . 12 VAL HG13 1 1 15 11377 2 2 12 VAL HG21 H -2.489 8.434 -1.182 1.00 . B B . 12 VAL HG21 1 1 15 11378 2 2 12 VAL HG22 H -1.146 8.667 -0.062 1.00 . B B . 12 VAL HG22 1 1 15 11379 2 2 12 VAL HG23 H -2.751 9.270 0.349 1.00 . B B . 12 VAL HG23 1 1 15 11380 2 2 12 VAL N N -0.512 5.709 0.349 1.00 . B B . 12 VAL N 1 1 15 11381 2 2 12 VAL O O -2.413 5.711 -2.529 1.00 . B B . 12 VAL O 1 1 15 11382 2 2 13 GLU C C -0.571 6.200 -4.261 1.00 . B B . 13 GLU C 1 1 15 11383 2 2 13 GLU CA C -0.662 7.509 -3.476 1.00 . B B . 13 GLU CA 1 1 15 11384 2 2 13 GLU CB C 0.622 8.333 -3.644 1.00 . B B . 13 GLU CB 1 1 15 11385 2 2 13 GLU CD C 2.059 6.918 -5.120 1.00 . B B . 13 GLU CD 1 1 15 11386 2 2 13 GLU CG C 1.843 7.411 -3.688 1.00 . B B . 13 GLU CG 1 1 15 11387 2 2 13 GLU H H -0.304 7.617 -1.359 1.00 . B B . 13 GLU H 1 1 15 11388 2 2 13 GLU HA H -1.508 8.082 -3.827 1.00 . B B . 13 GLU HA 1 1 15 11389 2 2 13 GLU HB2 H 0.567 8.899 -4.561 1.00 . B B . 13 GLU HB2 1 1 15 11390 2 2 13 GLU HB3 H 0.720 9.013 -2.809 1.00 . B B . 13 GLU HB3 1 1 15 11391 2 2 13 GLU HG2 H 2.716 7.954 -3.358 1.00 . B B . 13 GLU HG2 1 1 15 11392 2 2 13 GLU HG3 H 1.679 6.565 -3.039 1.00 . B B . 13 GLU HG3 1 1 15 11393 2 2 13 GLU N N -0.850 7.176 -2.042 1.00 . B B . 13 GLU N 1 1 15 11394 2 2 13 GLU O O -0.914 6.131 -5.425 1.00 . B B . 13 GLU O 1 1 15 11395 2 2 13 GLU OE1 O 2.137 7.752 -6.006 1.00 . B B . 13 GLU OE1 1 1 15 11396 2 2 13 GLU OE2 O 2.144 5.715 -5.306 1.00 . B B . 13 GLU OE2 1 1 15 11397 2 2 14 ALA C C -1.364 3.105 -4.096 1.00 . B B . 14 ALA C 1 1 15 11398 2 2 14 ALA CA C -0.038 3.835 -4.297 1.00 . B B . 14 ALA CA 1 1 15 11399 2 2 14 ALA CB C 1.103 3.017 -3.689 1.00 . B B . 14 ALA CB 1 1 15 11400 2 2 14 ALA H H 0.123 5.228 -2.669 1.00 . B B . 14 ALA H 1 1 15 11401 2 2 14 ALA HA H 0.141 3.984 -5.352 1.00 . B B . 14 ALA HA 1 1 15 11402 2 2 14 ALA HB1 H 0.857 2.761 -2.669 1.00 . B B . 14 ALA HB1 1 1 15 11403 2 2 14 ALA HB2 H 2.013 3.600 -3.704 1.00 . B B . 14 ALA HB2 1 1 15 11404 2 2 14 ALA HB3 H 1.244 2.114 -4.263 1.00 . B B . 14 ALA HB3 1 1 15 11405 2 2 14 ALA N N -0.130 5.151 -3.614 1.00 . B B . 14 ALA N 1 1 15 11406 2 2 14 ALA O O -1.997 2.673 -5.038 1.00 . B B . 14 ALA O 1 1 15 11407 2 2 15 LEU C C -4.180 2.976 -3.449 1.00 . B B . 15 LEU C 1 1 15 11408 2 2 15 LEU CA C -3.095 2.305 -2.609 1.00 . B B . 15 LEU CA 1 1 15 11409 2 2 15 LEU CB C -3.427 2.437 -1.123 1.00 . B B . 15 LEU CB 1 1 15 11410 2 2 15 LEU CD1 C -3.049 1.334 1.091 1.00 . B B . 15 LEU CD1 1 1 15 11411 2 2 15 LEU CD2 C -2.284 0.171 -0.980 1.00 . B B . 15 LEU CD2 1 1 15 11412 2 2 15 LEU CG C -2.477 1.542 -0.303 1.00 . B B . 15 LEU CG 1 1 15 11413 2 2 15 LEU H H -1.286 3.349 -2.123 1.00 . B B . 15 LEU H 1 1 15 11414 2 2 15 LEU HA H -3.021 1.265 -2.879 1.00 . B B . 15 LEU HA 1 1 15 11415 2 2 15 LEU HB2 H -3.286 3.469 -0.826 1.00 . B B . 15 LEU HB2 1 1 15 11416 2 2 15 LEU HB3 H -4.459 2.155 -0.944 1.00 . B B . 15 LEU HB3 1 1 15 11417 2 2 15 LEU HD11 H -2.241 1.164 1.787 1.00 . B B . 15 LEU HD11 1 1 15 11418 2 2 15 LEU HD12 H -3.705 0.477 1.083 1.00 . B B . 15 LEU HD12 1 1 15 11419 2 2 15 LEU HD13 H -3.601 2.212 1.386 1.00 . B B . 15 LEU HD13 1 1 15 11420 2 2 15 LEU HD21 H -1.756 0.300 -1.913 1.00 . B B . 15 LEU HD21 1 1 15 11421 2 2 15 LEU HD22 H -3.244 -0.281 -1.171 1.00 . B B . 15 LEU HD22 1 1 15 11422 2 2 15 LEU HD23 H -1.706 -0.476 -0.330 1.00 . B B . 15 LEU HD23 1 1 15 11423 2 2 15 LEU HG H -1.518 2.034 -0.218 1.00 . B B . 15 LEU HG 1 1 15 11424 2 2 15 LEU N N -1.802 2.982 -2.871 1.00 . B B . 15 LEU N 1 1 15 11425 2 2 15 LEU O O -5.021 2.324 -4.035 1.00 . B B . 15 LEU O 1 1 15 11426 2 2 16 TYR C C -4.944 4.655 -5.819 1.00 . B B . 16 TYR C 1 1 15 11427 2 2 16 TYR CA C -5.182 4.981 -4.342 1.00 . B B . 16 TYR CA 1 1 15 11428 2 2 16 TYR CB C -5.059 6.492 -4.128 1.00 . B B . 16 TYR CB 1 1 15 11429 2 2 16 TYR CD1 C -7.541 6.799 -3.807 1.00 . B B . 16 TYR CD1 1 1 15 11430 2 2 16 TYR CD2 C -6.031 7.642 -2.104 1.00 . B B . 16 TYR CD2 1 1 15 11431 2 2 16 TYR CE1 C -8.636 7.261 -3.065 1.00 . B B . 16 TYR CE1 1 1 15 11432 2 2 16 TYR CE2 C -7.127 8.104 -1.361 1.00 . B B . 16 TYR CE2 1 1 15 11433 2 2 16 TYR CG C -6.239 6.988 -3.326 1.00 . B B . 16 TYR CG 1 1 15 11434 2 2 16 TYR CZ C -8.429 7.915 -1.842 1.00 . B B . 16 TYR CZ 1 1 15 11435 2 2 16 TYR H H -3.468 4.789 -3.049 1.00 . B B . 16 TYR H 1 1 15 11436 2 2 16 TYR HA H -6.169 4.652 -4.052 1.00 . B B . 16 TYR HA 1 1 15 11437 2 2 16 TYR HB2 H -4.144 6.708 -3.597 1.00 . B B . 16 TYR HB2 1 1 15 11438 2 2 16 TYR HB3 H -5.042 6.989 -5.087 1.00 . B B . 16 TYR HB3 1 1 15 11439 2 2 16 TYR HD1 H -7.701 6.296 -4.749 1.00 . B B . 16 TYR HD1 1 1 15 11440 2 2 16 TYR HD2 H -5.027 7.789 -1.734 1.00 . B B . 16 TYR HD2 1 1 15 11441 2 2 16 TYR HE1 H -9.640 7.114 -3.435 1.00 . B B . 16 TYR HE1 1 1 15 11442 2 2 16 TYR HE2 H -6.967 8.608 -0.420 1.00 . B B . 16 TYR HE2 1 1 15 11443 2 2 16 TYR HH H -10.016 8.963 -1.671 1.00 . B B . 16 TYR HH 1 1 15 11444 2 2 16 TYR N N -4.160 4.277 -3.524 1.00 . B B . 16 TYR N 1 1 15 11445 2 2 16 TYR O O -5.870 4.484 -6.585 1.00 . B B . 16 TYR O 1 1 15 11446 2 2 16 TYR OH O -9.509 8.370 -1.112 1.00 . B B . 16 TYR OH 1 1 15 11447 2 2 17 LEU C C -3.594 2.770 -7.920 1.00 . B B . 17 LEU C 1 1 15 11448 2 2 17 LEU CA C -3.404 4.262 -7.652 1.00 . B B . 17 LEU CA 1 1 15 11449 2 2 17 LEU CB C -1.960 4.662 -7.970 1.00 . B B . 17 LEU CB 1 1 15 11450 2 2 17 LEU CD1 C -2.629 4.572 -10.377 1.00 . B B . 17 LEU CD1 1 1 15 11451 2 2 17 LEU CD2 C -0.213 4.704 -9.755 1.00 . B B . 17 LEU CD2 1 1 15 11452 2 2 17 LEU CG C -1.576 4.135 -9.355 1.00 . B B . 17 LEU CG 1 1 15 11453 2 2 17 LEU H H -2.971 4.713 -5.590 1.00 . B B . 17 LEU H 1 1 15 11454 2 2 17 LEU HA H -4.074 4.818 -8.279 1.00 . B B . 17 LEU HA 1 1 15 11455 2 2 17 LEU HB2 H -1.875 5.739 -7.958 1.00 . B B . 17 LEU HB2 1 1 15 11456 2 2 17 LEU HB3 H -1.298 4.239 -7.230 1.00 . B B . 17 LEU HB3 1 1 15 11457 2 2 17 LEU HD11 H -3.602 4.226 -10.062 1.00 . B B . 17 LEU HD11 1 1 15 11458 2 2 17 LEU HD12 H -2.391 4.150 -11.342 1.00 . B B . 17 LEU HD12 1 1 15 11459 2 2 17 LEU HD13 H -2.635 5.650 -10.447 1.00 . B B . 17 LEU HD13 1 1 15 11460 2 2 17 LEU HD21 H -0.258 5.783 -9.753 1.00 . B B . 17 LEU HD21 1 1 15 11461 2 2 17 LEU HD22 H 0.046 4.356 -10.744 1.00 . B B . 17 LEU HD22 1 1 15 11462 2 2 17 LEU HD23 H 0.536 4.374 -9.050 1.00 . B B . 17 LEU HD23 1 1 15 11463 2 2 17 LEU HG H -1.525 3.055 -9.329 1.00 . B B . 17 LEU HG 1 1 15 11464 2 2 17 LEU N N -3.704 4.570 -6.224 1.00 . B B . 17 LEU N 1 1 15 11465 2 2 17 LEU O O -4.230 2.379 -8.878 1.00 . B B . 17 LEU O 1 1 15 11466 2 2 18 VAL C C -4.682 0.159 -7.493 1.00 . B B . 18 VAL C 1 1 15 11467 2 2 18 VAL CA C -3.209 0.466 -7.300 1.00 . B B . 18 VAL CA 1 1 15 11468 2 2 18 VAL CB C -2.670 -0.317 -6.101 1.00 . B B . 18 VAL CB 1 1 15 11469 2 2 18 VAL CG1 C -1.304 0.220 -5.735 1.00 . B B . 18 VAL CG1 1 1 15 11470 2 2 18 VAL CG2 C -3.592 -0.163 -4.894 1.00 . B B . 18 VAL CG2 1 1 15 11471 2 2 18 VAL H H -2.548 2.272 -6.319 1.00 . B B . 18 VAL H 1 1 15 11472 2 2 18 VAL HA H -2.668 0.177 -8.187 1.00 . B B . 18 VAL HA 1 1 15 11473 2 2 18 VAL HB H -2.586 -1.362 -6.362 1.00 . B B . 18 VAL HB 1 1 15 11474 2 2 18 VAL HG11 H -0.561 -0.535 -5.932 1.00 . B B . 18 VAL HG11 1 1 15 11475 2 2 18 VAL HG12 H -1.296 0.478 -4.687 1.00 . B B . 18 VAL HG12 1 1 15 11476 2 2 18 VAL HG13 H -1.099 1.096 -6.328 1.00 . B B . 18 VAL HG13 1 1 15 11477 2 2 18 VAL HG21 H -4.577 -0.525 -5.142 1.00 . B B . 18 VAL HG21 1 1 15 11478 2 2 18 VAL HG22 H -3.645 0.875 -4.613 1.00 . B B . 18 VAL HG22 1 1 15 11479 2 2 18 VAL HG23 H -3.195 -0.737 -4.069 1.00 . B B . 18 VAL HG23 1 1 15 11480 2 2 18 VAL N N -3.052 1.934 -7.083 1.00 . B B . 18 VAL N 1 1 15 11481 2 2 18 VAL O O -5.051 -0.795 -8.147 1.00 . B B . 18 VAL O 1 1 15 11482 2 2 19 CYS C C -7.714 2.035 -7.357 1.00 . B B . 19 CYS C 1 1 15 11483 2 2 19 CYS CA C -6.979 0.719 -7.087 1.00 . B B . 19 CYS CA 1 1 15 11484 2 2 19 CYS CB C -7.513 0.077 -5.815 1.00 . B B . 19 CYS CB 1 1 15 11485 2 2 19 CYS H H -5.210 1.727 -6.406 1.00 . B B . 19 CYS H 1 1 15 11486 2 2 19 CYS HA H -7.126 0.046 -7.914 1.00 . B B . 19 CYS HA 1 1 15 11487 2 2 19 CYS HB2 H -7.142 0.615 -4.955 1.00 . B B . 19 CYS HB2 1 1 15 11488 2 2 19 CYS HB3 H -8.588 0.107 -5.823 1.00 . B B . 19 CYS HB3 1 1 15 11489 2 2 19 CYS N N -5.529 0.965 -6.930 1.00 . B B . 19 CYS N 1 1 15 11490 2 2 19 CYS O O -8.180 2.280 -8.451 1.00 . B B . 19 CYS O 1 1 15 11491 2 2 19 CYS SG S -6.953 -1.641 -5.746 1.00 . B B . 19 CYS SG 1 1 15 11492 2 2 20 GLY C C -9.772 4.258 -5.692 1.00 . B B . 20 GLY C 1 1 15 11493 2 2 20 GLY CA C -8.532 4.181 -6.587 1.00 . B B . 20 GLY CA 1 1 15 11494 2 2 20 GLY H H -7.441 2.676 -5.494 1.00 . B B . 20 GLY H 1 1 15 11495 2 2 20 GLY HA2 H -7.867 4.998 -6.348 1.00 . B B . 20 GLY HA2 1 1 15 11496 2 2 20 GLY HA3 H -8.835 4.255 -7.620 1.00 . B B . 20 GLY HA3 1 1 15 11497 2 2 20 GLY N N -7.824 2.886 -6.371 1.00 . B B . 20 GLY N 1 1 15 11498 2 2 20 GLY O O -9.679 4.257 -4.480 1.00 . B B . 20 GLY O 1 1 15 11499 2 2 21 GLU C C -12.462 3.109 -4.763 1.00 . B B . 21 GLU C 1 1 15 11500 2 2 21 GLU CA C -12.184 4.436 -5.475 1.00 . B B . 21 GLU CA 1 1 15 11501 2 2 21 GLU CB C -13.356 4.766 -6.401 1.00 . B B . 21 GLU CB 1 1 15 11502 2 2 21 GLU CD C -15.579 5.897 -6.553 1.00 . B B . 21 GLU CD 1 1 15 11503 2 2 21 GLU CG C -14.350 5.670 -5.669 1.00 . B B . 21 GLU CG 1 1 15 11504 2 2 21 GLU H H -10.984 4.349 -7.261 1.00 . B B . 21 GLU H 1 1 15 11505 2 2 21 GLU HA H -12.078 5.220 -4.740 1.00 . B B . 21 GLU HA 1 1 15 11506 2 2 21 GLU HB2 H -12.987 5.275 -7.280 1.00 . B B . 21 GLU HB2 1 1 15 11507 2 2 21 GLU HB3 H -13.851 3.853 -6.694 1.00 . B B . 21 GLU HB3 1 1 15 11508 2 2 21 GLU HG2 H -14.652 5.198 -4.745 1.00 . B B . 21 GLU HG2 1 1 15 11509 2 2 21 GLU HG3 H -13.884 6.619 -5.454 1.00 . B B . 21 GLU HG3 1 1 15 11510 2 2 21 GLU N N -10.934 4.340 -6.282 1.00 . B B . 21 GLU N 1 1 15 11511 2 2 21 GLU O O -13.398 2.995 -3.996 1.00 . B B . 21 GLU O 1 1 15 11512 2 2 21 GLU OE1 O -15.397 6.139 -7.735 1.00 . B B . 21 GLU OE1 1 1 15 11513 2 2 21 GLU OE2 O -16.680 5.825 -6.033 1.00 . B B . 21 GLU OE2 1 1 15 11514 2 2 22 ARG C C -11.564 0.913 -2.849 1.00 . B B . 22 ARG C 1 1 15 11515 2 2 22 ARG CA C -11.914 0.796 -4.333 1.00 . B B . 22 ARG CA 1 1 15 11516 2 2 22 ARG CB C -11.055 -0.289 -4.984 1.00 . B B . 22 ARG CB 1 1 15 11517 2 2 22 ARG CD C -11.684 -2.710 -4.849 1.00 . B B . 22 ARG CD 1 1 15 11518 2 2 22 ARG CG C -11.965 -1.381 -5.554 1.00 . B B . 22 ARG CG 1 1 15 11519 2 2 22 ARG CZ C -11.081 -4.513 -6.346 1.00 . B B . 22 ARG CZ 1 1 15 11520 2 2 22 ARG H H -10.918 2.203 -5.627 1.00 . B B . 22 ARG H 1 1 15 11521 2 2 22 ARG HA H -12.957 0.535 -4.434 1.00 . B B . 22 ARG HA 1 1 15 11522 2 2 22 ARG HB2 H -10.469 0.147 -5.781 1.00 . B B . 22 ARG HB2 1 1 15 11523 2 2 22 ARG HB3 H -10.395 -0.719 -4.246 1.00 . B B . 22 ARG HB3 1 1 15 11524 2 2 22 ARG HD2 H -11.290 -2.519 -3.862 1.00 . B B . 22 ARG HD2 1 1 15 11525 2 2 22 ARG HD3 H -12.602 -3.275 -4.767 1.00 . B B . 22 ARG HD3 1 1 15 11526 2 2 22 ARG HE H -9.745 -3.234 -5.625 1.00 . B B . 22 ARG HE 1 1 15 11527 2 2 22 ARG HG2 H -12.998 -1.105 -5.401 1.00 . B B . 22 ARG HG2 1 1 15 11528 2 2 22 ARG HG3 H -11.775 -1.491 -6.612 1.00 . B B . 22 ARG HG3 1 1 15 11529 2 2 22 ARG HH11 H -11.388 -5.692 -4.757 1.00 . B B . 22 ARG HH11 1 1 15 11530 2 2 22 ARG HH12 H -11.721 -6.410 -6.298 1.00 . B B . 22 ARG HH12 1 1 15 11531 2 2 22 ARG HH21 H -10.871 -3.571 -8.100 1.00 . B B . 22 ARG HH21 1 1 15 11532 2 2 22 ARG HH22 H -11.430 -5.208 -8.192 1.00 . B B . 22 ARG HH22 1 1 15 11533 2 2 22 ARG N N -11.669 2.102 -5.006 1.00 . B B . 22 ARG N 1 1 15 11534 2 2 22 ARG NE N -10.691 -3.490 -5.638 1.00 . B B . 22 ARG NE 1 1 15 11535 2 2 22 ARG NH1 N -11.424 -5.625 -5.755 1.00 . B B . 22 ARG NH1 1 1 15 11536 2 2 22 ARG NH2 N -11.131 -4.424 -7.648 1.00 . B B . 22 ARG NH2 1 1 15 11537 2 2 22 ARG O O -11.783 0.001 -2.077 1.00 . B B . 22 ARG O 1 1 15 11538 2 2 23 GLY C C -9.542 1.250 -0.633 1.00 . B B . 23 GLY C 1 1 15 11539 2 2 23 GLY CA C -10.673 2.208 -1.005 1.00 . B B . 23 GLY CA 1 1 15 11540 2 2 23 GLY H H -10.864 2.758 -3.078 1.00 . B B . 23 GLY H 1 1 15 11541 2 2 23 GLY HA2 H -10.353 3.227 -0.837 1.00 . B B . 23 GLY HA2 1 1 15 11542 2 2 23 GLY HA3 H -11.536 1.996 -0.393 1.00 . B B . 23 GLY HA3 1 1 15 11543 2 2 23 GLY N N -11.028 2.032 -2.441 1.00 . B B . 23 GLY N 1 1 15 11544 2 2 23 GLY O O -9.416 0.176 -1.186 1.00 . B B . 23 GLY O 1 1 15 11545 2 2 24 PHE C C -7.651 0.509 2.224 1.00 . B B . 24 PHE C 1 1 15 11546 2 2 24 PHE CA C -7.595 0.741 0.711 1.00 . B B . 24 PHE CA 1 1 15 11547 2 2 24 PHE CB C -6.261 1.392 0.341 1.00 . B B . 24 PHE CB 1 1 15 11548 2 2 24 PHE CD1 C -7.042 3.615 -0.570 1.00 . B B . 24 PHE CD1 1 1 15 11549 2 2 24 PHE CD2 C -5.810 3.577 1.521 1.00 . B B . 24 PHE CD2 1 1 15 11550 2 2 24 PHE CE1 C -7.142 5.011 -0.485 1.00 . B B . 24 PHE CE1 1 1 15 11551 2 2 24 PHE CE2 C -5.909 4.973 1.604 1.00 . B B . 24 PHE CE2 1 1 15 11552 2 2 24 PHE CG C -6.376 2.897 0.434 1.00 . B B . 24 PHE CG 1 1 15 11553 2 2 24 PHE CZ C -6.575 5.690 0.602 1.00 . B B . 24 PHE CZ 1 1 15 11554 2 2 24 PHE H H -8.835 2.501 0.737 1.00 . B B . 24 PHE H 1 1 15 11555 2 2 24 PHE HA H -7.686 -0.206 0.200 1.00 . B B . 24 PHE HA 1 1 15 11556 2 2 24 PHE HB2 H -5.497 1.048 1.021 1.00 . B B . 24 PHE HB2 1 1 15 11557 2 2 24 PHE HB3 H -5.993 1.114 -0.668 1.00 . B B . 24 PHE HB3 1 1 15 11558 2 2 24 PHE HD1 H -7.479 3.092 -1.408 1.00 . B B . 24 PHE HD1 1 1 15 11559 2 2 24 PHE HD2 H -5.296 3.026 2.295 1.00 . B B . 24 PHE HD2 1 1 15 11560 2 2 24 PHE HE1 H -7.657 5.565 -1.258 1.00 . B B . 24 PHE HE1 1 1 15 11561 2 2 24 PHE HE2 H -5.474 5.497 2.442 1.00 . B B . 24 PHE HE2 1 1 15 11562 2 2 24 PHE HZ H -6.647 6.767 0.666 1.00 . B B . 24 PHE HZ 1 1 15 11563 2 2 24 PHE N N -8.716 1.631 0.303 1.00 . B B . 24 PHE N 1 1 15 11564 2 2 24 PHE O O -8.145 1.330 2.970 1.00 . B B . 24 PHE O 1 1 15 11565 2 2 25 PHE C C -5.922 -0.330 4.809 1.00 . B B . 25 PHE C 1 1 15 11566 2 2 25 PHE CA C -7.178 -0.900 4.142 1.00 . B B . 25 PHE CA 1 1 15 11567 2 2 25 PHE CB C -7.221 -2.415 4.353 1.00 . B B . 25 PHE CB 1 1 15 11568 2 2 25 PHE CD1 C -9.620 -2.915 4.953 1.00 . B B . 25 PHE CD1 1 1 15 11569 2 2 25 PHE CD2 C -7.950 -2.920 6.715 1.00 . B B . 25 PHE CD2 1 1 15 11570 2 2 25 PHE CE1 C -10.610 -3.235 5.891 1.00 . B B . 25 PHE CE1 1 1 15 11571 2 2 25 PHE CE2 C -8.942 -3.240 7.653 1.00 . B B . 25 PHE CE2 1 1 15 11572 2 2 25 PHE CG C -8.289 -2.757 5.365 1.00 . B B . 25 PHE CG 1 1 15 11573 2 2 25 PHE CZ C -10.271 -3.397 7.241 1.00 . B B . 25 PHE CZ 1 1 15 11574 2 2 25 PHE H H -6.761 -1.258 2.058 1.00 . B B . 25 PHE H 1 1 15 11575 2 2 25 PHE HA H -8.055 -0.451 4.583 1.00 . B B . 25 PHE HA 1 1 15 11576 2 2 25 PHE HB2 H -7.445 -2.902 3.416 1.00 . B B . 25 PHE HB2 1 1 15 11577 2 2 25 PHE HB3 H -6.262 -2.755 4.715 1.00 . B B . 25 PHE HB3 1 1 15 11578 2 2 25 PHE HD1 H -9.881 -2.790 3.913 1.00 . B B . 25 PHE HD1 1 1 15 11579 2 2 25 PHE HD2 H -6.925 -2.798 7.033 1.00 . B B . 25 PHE HD2 1 1 15 11580 2 2 25 PHE HE1 H -11.635 -3.356 5.573 1.00 . B B . 25 PHE HE1 1 1 15 11581 2 2 25 PHE HE2 H -8.680 -3.365 8.694 1.00 . B B . 25 PHE HE2 1 1 15 11582 2 2 25 PHE HZ H -11.035 -3.644 7.963 1.00 . B B . 25 PHE HZ 1 1 15 11583 2 2 25 PHE N N -7.151 -0.608 2.679 1.00 . B B . 25 PHE N 1 1 15 11584 2 2 25 PHE O O -5.002 -1.052 5.138 1.00 . B B . 25 PHE O 1 1 15 11585 2 2 26 TYR C C -4.845 1.509 7.186 1.00 . B B . 26 TYR C 1 1 15 11586 2 2 26 TYR CA C -4.683 1.570 5.665 1.00 . B B . 26 TYR CA 1 1 15 11587 2 2 26 TYR CB C -4.551 3.029 5.222 1.00 . B B . 26 TYR CB 1 1 15 11588 2 2 26 TYR CD1 C -2.211 3.343 6.107 1.00 . B B . 26 TYR CD1 1 1 15 11589 2 2 26 TYR CD2 C -3.971 4.808 6.912 1.00 . B B . 26 TYR CD2 1 1 15 11590 2 2 26 TYR CE1 C -1.286 4.007 6.922 1.00 . B B . 26 TYR CE1 1 1 15 11591 2 2 26 TYR CE2 C -3.045 5.472 7.727 1.00 . B B . 26 TYR CE2 1 1 15 11592 2 2 26 TYR CG C -3.554 3.743 6.102 1.00 . B B . 26 TYR CG 1 1 15 11593 2 2 26 TYR CZ C -1.702 5.071 7.732 1.00 . B B . 26 TYR CZ 1 1 15 11594 2 2 26 TYR H H -6.633 1.524 4.746 1.00 . B B . 26 TYR H 1 1 15 11595 2 2 26 TYR HA H -3.797 1.024 5.376 1.00 . B B . 26 TYR HA 1 1 15 11596 2 2 26 TYR HB2 H -4.211 3.064 4.200 1.00 . B B . 26 TYR HB2 1 1 15 11597 2 2 26 TYR HB3 H -5.509 3.517 5.299 1.00 . B B . 26 TYR HB3 1 1 15 11598 2 2 26 TYR HD1 H -1.891 2.522 5.483 1.00 . B B . 26 TYR HD1 1 1 15 11599 2 2 26 TYR HD2 H -5.006 5.116 6.908 1.00 . B B . 26 TYR HD2 1 1 15 11600 2 2 26 TYR HE1 H -0.251 3.698 6.926 1.00 . B B . 26 TYR HE1 1 1 15 11601 2 2 26 TYR HE2 H -3.367 6.292 8.352 1.00 . B B . 26 TYR HE2 1 1 15 11602 2 2 26 TYR HH H -0.200 5.068 8.908 1.00 . B B . 26 TYR HH 1 1 15 11603 2 2 26 TYR N N -5.878 0.959 5.015 1.00 . B B . 26 TYR N 1 1 15 11604 2 2 26 TYR O O -5.543 2.307 7.779 1.00 . B B . 26 TYR O 1 1 15 11605 2 2 26 TYR OH O -0.790 5.725 8.534 1.00 . B B . 26 TYR OH 1 1 15 11606 2 2 27 THR C C -2.952 0.724 9.941 1.00 . B B . 27 THR C 1 1 15 11607 2 2 27 THR CA C -4.319 0.454 9.306 1.00 . B B . 27 THR CA 1 1 15 11608 2 2 27 THR CB C -4.799 -0.957 9.692 1.00 . B B . 27 THR CB 1 1 15 11609 2 2 27 THR CG2 C -4.672 -1.909 8.496 1.00 . B B . 27 THR CG2 1 1 15 11610 2 2 27 THR H H -3.645 -0.065 7.323 1.00 . B B . 27 THR H 1 1 15 11611 2 2 27 THR HA H -5.029 1.185 9.665 1.00 . B B . 27 THR HA 1 1 15 11612 2 2 27 THR HB H -5.832 -0.911 9.998 1.00 . B B . 27 THR HB 1 1 15 11613 2 2 27 THR HG1 H -4.330 -1.044 11.579 1.00 . B B . 27 THR HG1 1 1 15 11614 2 2 27 THR HG21 H -3.670 -1.856 8.097 1.00 . B B . 27 THR HG21 1 1 15 11615 2 2 27 THR HG22 H -5.380 -1.623 7.732 1.00 . B B . 27 THR HG22 1 1 15 11616 2 2 27 THR HG23 H -4.878 -2.920 8.816 1.00 . B B . 27 THR HG23 1 1 15 11617 2 2 27 THR N N -4.203 0.568 7.822 1.00 . B B . 27 THR N 1 1 15 11618 2 2 27 THR O O -1.927 0.343 9.412 1.00 . B B . 27 THR O 1 1 15 11619 2 2 27 THR OG1 O -4.011 -1.448 10.769 1.00 . B B . 27 THR OG1 1 1 15 11620 2 2 28 LYS C C -1.301 0.624 12.778 1.00 . B B . 28 LYS C 1 1 15 11621 2 2 28 LYS CA C -1.618 1.678 11.722 1.00 . B B . 28 LYS CA 1 1 15 11622 2 2 28 LYS CB C -1.659 3.043 12.411 1.00 . B B . 28 LYS CB 1 1 15 11623 2 2 28 LYS CD C -0.860 5.399 11.877 1.00 . B B . 28 LYS CD 1 1 15 11624 2 2 28 LYS CE C -1.769 5.738 13.063 1.00 . B B . 28 LYS CE 1 1 15 11625 2 2 28 LYS CG C -0.493 3.903 11.899 1.00 . B B . 28 LYS CG 1 1 15 11626 2 2 28 LYS H H -3.761 1.691 11.475 1.00 . B B . 28 LYS H 1 1 15 11627 2 2 28 LYS HA H -0.838 1.682 10.976 1.00 . B B . 28 LYS HA 1 1 15 11628 2 2 28 LYS HB2 H -2.607 3.515 12.215 1.00 . B B . 28 LYS HB2 1 1 15 11629 2 2 28 LYS HB3 H -1.550 2.901 13.478 1.00 . B B . 28 LYS HB3 1 1 15 11630 2 2 28 LYS HD2 H 0.048 5.990 11.942 1.00 . B B . 28 LYS HD2 1 1 15 11631 2 2 28 LYS HD3 H -1.368 5.636 10.954 1.00 . B B . 28 LYS HD3 1 1 15 11632 2 2 28 LYS HE2 H -2.711 5.221 12.955 1.00 . B B . 28 LYS HE2 1 1 15 11633 2 2 28 LYS HE3 H -1.292 5.429 13.981 1.00 . B B . 28 LYS HE3 1 1 15 11634 2 2 28 LYS HG2 H 0.357 3.758 12.549 1.00 . B B . 28 LYS HG2 1 1 15 11635 2 2 28 LYS HG3 H -0.234 3.585 10.902 1.00 . B B . 28 LYS HG3 1 1 15 11636 2 2 28 LYS HZ1 H -1.202 7.682 13.545 1.00 . B B . 28 LYS HZ1 1 1 15 11637 2 2 28 LYS HZ2 H -2.875 7.402 13.646 1.00 . B B . 28 LYS HZ2 1 1 15 11638 2 2 28 LYS HZ3 H -2.128 7.563 12.129 1.00 . B B . 28 LYS HZ3 1 1 15 11639 2 2 28 LYS N N -2.926 1.385 11.067 1.00 . B B . 28 LYS N 1 1 15 11640 2 2 28 LYS NZ N -2.012 7.207 13.098 1.00 . B B . 28 LYS NZ 1 1 15 11641 2 2 28 LYS O O -0.260 0.000 12.730 1.00 . B B . 28 LYS O 1 1 15 11642 2 2 29 PRO C C -2.430 -1.863 14.435 1.00 . B B . 29 PRO C 1 1 15 11643 2 2 29 PRO CA C -1.990 -0.452 14.841 1.00 . B B . 29 PRO CA 1 1 15 11644 2 2 29 PRO CB C -2.902 0.114 15.926 1.00 . B B . 29 PRO CB 1 1 15 11645 2 2 29 PRO CD C -3.459 1.240 13.801 1.00 . B B . 29 PRO CD 1 1 15 11646 2 2 29 PRO CG C -3.997 0.932 15.205 1.00 . B B . 29 PRO CG 1 1 15 11647 2 2 29 PRO HA H -0.967 -0.447 15.176 1.00 . B B . 29 PRO HA 1 1 15 11648 2 2 29 PRO HB2 H -3.341 -0.682 16.504 1.00 . B B . 29 PRO HB2 1 1 15 11649 2 2 29 PRO HB3 H -2.332 0.775 16.559 1.00 . B B . 29 PRO HB3 1 1 15 11650 2 2 29 PRO HD2 H -4.156 0.887 13.053 1.00 . B B . 29 PRO HD2 1 1 15 11651 2 2 29 PRO HD3 H -3.288 2.293 13.697 1.00 . B B . 29 PRO HD3 1 1 15 11652 2 2 29 PRO HG2 H -4.907 0.353 15.139 1.00 . B B . 29 PRO HG2 1 1 15 11653 2 2 29 PRO HG3 H -4.180 1.854 15.735 1.00 . B B . 29 PRO HG3 1 1 15 11654 2 2 29 PRO N N -2.186 0.486 13.732 1.00 . B B . 29 PRO N 1 1 15 11655 2 2 29 PRO O O -3.546 -2.271 14.689 1.00 . B B . 29 PRO O 1 1 15 11656 2 2 30 THR C C -3.338 -3.987 12.789 1.00 . B B . 30 THR C 1 1 15 11657 2 2 30 THR CA C -1.928 -3.991 13.383 1.00 . B B . 30 THR CA 1 1 15 11658 2 2 30 THR CB C -1.886 -4.924 14.596 1.00 . B B . 30 THR CB 1 1 15 11659 2 2 30 THR CG2 C -0.494 -5.547 14.714 1.00 . B B . 30 THR CG2 1 1 15 11660 2 2 30 THR H H -0.666 -2.259 13.612 1.00 . B B . 30 THR H 1 1 15 11661 2 2 30 THR HA H -1.225 -4.337 12.640 1.00 . B B . 30 THR HA 1 1 15 11662 2 2 30 THR HB H -2.617 -5.708 14.473 1.00 . B B . 30 THR HB 1 1 15 11663 2 2 30 THR HG1 H -1.360 -3.788 16.084 1.00 . B B . 30 THR HG1 1 1 15 11664 2 2 30 THR HG21 H -0.566 -6.615 14.573 1.00 . B B . 30 THR HG21 1 1 15 11665 2 2 30 THR HG22 H -0.088 -5.339 15.692 1.00 . B B . 30 THR HG22 1 1 15 11666 2 2 30 THR HG23 H 0.153 -5.127 13.958 1.00 . B B . 30 THR HG23 1 1 15 11667 2 2 30 THR N N -1.561 -2.609 13.806 1.00 . B B . 30 THR N 1 1 15 11668 2 2 30 THR O O -3.473 -3.610 11.636 1.00 . B B . 30 THR O 1 1 15 11669 2 2 30 THR OXT O -4.260 -4.358 13.498 1.00 . B B . 30 THR OXT 1 1 15 11670 2 2 30 THR OG1 O -2.178 -4.183 15.772 1.00 . B B . 30 THR OG1 1 1 stop_ save_
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