NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
397690 | 1t1k | 1344 | cing | 4-filtered-FRED | STAR | entry | full | 295 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1t1k # This FRED archive file contains, for PDB entry <1t1k>: # # - 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_1t1k _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1t1k _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5754.44 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 . 1 1 2 . 2 $Insulin_2 B . 1 1 stop_ save_ save_Insulin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name Insulin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIVEQCCTSICSLYQLENYCN _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 VAL . 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 VAL 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_2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "Insulin 2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FVNQHLCGSDLAEALYLVCGERGFFYTKPT _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 ALA . 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 ALA 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_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 ALA CA 1 33 ALA 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 ALA CA 1 33 ALA 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 VAL 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 VAL 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 2 217 1 . . . 1 2 218 1 . . . 1 2 219 1 . . . 1 2 220 1 . . . 1 2 221 1 . . . 1 2 222 1 . . . 1 2 223 1 . . . 1 2 224 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 QD 1 22 PHEN HD* 1 2 1 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 2 1 1 2 2 1 PHE QE 1 22 PHEN HE* 1 2 2 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 3 1 1 2 2 1 PHE QE 1 22 PHEN HE* 1 2 3 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 4 1 1 2 2 1 PHE QE 1 22 PHEN HE* 1 2 4 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 5 1 1 2 2 1 PHE HA 1 22 PHEN HA 1 2 5 1 2 2 2 2 VAL H 1 23 VAL HN 1 2 6 1 1 2 2 1 PHE HA 1 22 PHEN HA 1 2 6 1 2 2 2 1 PHE QD 1 22 PHEN HD* 1 2 7 1 1 2 2 1 PHE HA 1 22 PHEN HA 1 2 7 1 2 2 2 1 PHE QE 1 22 PHEN HE* 1 2 8 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 8 1 2 2 2 2 VAL HB 1 23 VAL HB 1 2 9 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 9 1 2 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 10 1 1 2 2 2 VAL H 1 23 VAL HN 1 2 10 1 2 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 11 1 1 2 2 2 VAL HA 1 23 VAL HA 1 2 11 1 2 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 12 1 1 2 2 2 VAL HA 1 23 VAL HA 1 2 12 1 2 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 13 1 1 2 2 2 VAL HB 1 23 VAL HB 1 2 13 1 2 2 2 3 ASN H 1 24 ASN HN 1 2 14 1 1 2 2 2 VAL MG1 1 23 VAL HG1* 1 2 14 1 2 2 2 3 ASN H 1 24 ASN HN 1 2 15 1 1 2 2 2 VAL MG2 1 23 VAL HG2* 1 2 15 1 2 2 2 3 ASN H 1 24 ASN HN 1 2 16 1 1 2 2 2 VAL HA 1 23 VAL HA 1 2 16 1 2 2 2 3 ASN HB2 1 24 ASN HB2 1 2 17 1 1 2 2 3 ASN HA 1 24 ASN HA 1 2 17 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 18 1 1 2 2 3 ASN HB3 1 24 ASN HB1 1 2 18 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 19 1 1 2 2 3 ASN HB2 1 24 ASN HB2 1 2 19 1 2 2 2 4 GLN H 1 25 GLN HN 1 2 20 1 1 2 2 3 ASN H 1 24 ASN HN 1 2 20 1 2 2 2 3 ASN HB3 1 24 ASN HB1 1 2 21 1 1 2 2 3 ASN H 1 24 ASN HN 1 2 21 1 2 2 2 3 ASN HB2 1 24 ASN HB2 1 2 22 1 1 2 2 4 GLN H 1 25 GLN HN 1 2 22 1 2 2 2 4 GLN QG 1 25 GLN HG* 1 2 23 1 1 2 2 4 GLN HA 1 25 GLN HA 1 2 23 1 2 2 2 4 GLN QG 1 25 GLN HG* 1 2 24 1 1 2 2 4 GLN H 1 25 GLN HN 1 2 24 1 2 2 2 5 HIS H 1 26 HIS HN 1 2 25 1 1 2 2 4 GLN QB 1 25 GLN HB* 1 2 25 1 2 2 2 5 HIS H 1 26 HIS HN 1 2 26 1 1 2 2 5 HIS HA 1 26 HIS HA 1 2 26 1 2 2 2 6 LEU H 1 27 LEU HN 1 2 27 1 1 2 2 5 HIS QB 1 26 HIS HB* 1 2 27 1 2 2 2 6 LEU H 1 27 LEU HN 1 2 28 1 1 2 2 5 HIS H 1 26 HIS HN 1 2 28 1 2 2 2 6 LEU H 1 27 LEU HN 1 2 29 1 1 2 2 5 HIS H 1 26 HIS HN 1 2 29 1 2 2 2 5 HIS QB 1 26 HIS HB* 1 2 30 1 1 2 2 5 HIS QB 1 26 HIS HB* 1 2 30 1 2 2 2 5 HIS HD2 1 26 HIS HD2 1 2 31 1 1 2 2 5 HIS HA 1 26 HIS HA 1 2 31 1 2 2 2 5 HIS HD2 1 26 HIS HD2 1 2 32 1 1 2 2 6 LEU H 1 27 LEU HN 1 2 32 1 2 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 33 1 1 2 2 6 LEU H 1 27 LEU HN 1 2 33 1 2 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 34 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 34 1 2 2 2 6 LEU HG 1 27 LEU HG 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 HD2* 1 2 36 1 1 2 2 6 LEU H 1 27 LEU HN 1 2 36 1 2 2 2 7 CYS HA 1 28 CYS HA 1 2 37 1 1 2 2 6 LEU QB 1 27 LEU HB* 1 2 37 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 38 1 1 2 2 6 LEU MD1 1 27 LEU HD1* 1 2 38 1 2 2 2 7 CYS H 1 28 CYS HN 1 2 39 1 1 2 2 6 LEU MD2 1 27 LEU HD2* 1 2 39 1 2 2 2 7 CYS H 1 28 CYS HN 1 2 40 1 1 2 2 6 LEU H 1 27 LEU HN 1 2 40 1 2 2 2 7 CYS H 1 28 CYS HN 1 2 41 1 1 2 2 7 CYS H 1 28 CYS HN 1 2 41 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 42 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 42 1 2 2 2 11 LEU QD 1 32 LEU HD2* 1 2 43 1 1 2 2 6 LEU QB 1 27 LEU HB* 1 2 43 1 2 2 2 7 CYS H 1 28 CYS HN 1 2 44 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 44 1 2 2 2 8 GLY H 1 29 GLY HN 1 2 45 1 1 2 2 6 LEU QB 1 27 LEU HB* 1 2 45 1 2 2 2 7 CYS HA 1 28 CYS HA 1 2 46 1 1 2 2 7 CYS HA 1 28 CYS HA 1 2 46 1 2 2 2 11 LEU QB 1 32 LEU HB* 1 2 47 1 1 2 2 7 CYS H 1 28 CYS HN 1 2 47 1 2 2 2 7 CYS QB 1 28 CYS HB* 1 2 48 1 1 2 2 8 GLY QA 1 29 GLY HA* 1 2 48 1 2 2 2 9 SER H 1 30 SER HN 1 2 49 1 1 2 2 8 GLY QA 1 29 GLY HA* 1 2 49 1 2 2 2 10 ASP H 1 31 ASP- HN 1 2 50 1 1 2 2 9 SER HA 1 30 SER HA 1 2 50 1 2 2 2 12 ALA H 1 33 ALA HN 1 2 51 1 1 2 2 7 CYS QB 1 28 CYS HB* 1 2 51 1 2 2 2 9 SER H 1 30 SER HN 1 2 52 1 1 2 2 9 SER QB 1 30 SER HB* 1 2 52 1 2 2 2 12 ALA MB 1 33 ALA HB* 1 2 53 1 1 2 2 9 SER QB 1 30 SER HB* 1 2 53 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 54 1 1 2 2 9 SER H 1 30 SER HN 1 2 54 1 2 2 2 9 SER QB 1 30 SER HB* 1 2 55 1 1 2 2 9 SER HA 1 30 SER HA 1 2 55 1 2 2 2 12 ALA MB 1 33 ALA HB* 1 2 56 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 56 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 57 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 57 1 2 2 2 11 LEU HA 1 32 LEU HA 1 2 58 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 58 1 2 2 2 12 ALA H 1 33 ALA HN 1 2 59 1 1 2 2 9 SER HA 1 30 SER HA 1 2 59 1 2 2 2 10 ASP H 1 31 ASP- HN 1 2 60 1 1 2 2 10 ASP HA 1 31 ASP- HA 1 2 60 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 61 1 1 2 2 9 SER QB 1 30 SER HB* 1 2 61 1 2 2 2 10 ASP H 1 31 ASP- HN 1 2 62 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 62 1 2 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 63 1 1 2 2 6 LEU HA 1 27 LEU HA 1 2 63 1 2 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 64 1 1 2 2 10 ASP HB3 1 31 ASP- HB1 1 2 64 1 2 2 2 11 LEU H 1 32 LEU HN 1 2 65 1 1 2 2 10 ASP HA 1 31 ASP- HA 1 2 65 1 2 2 2 12 ALA H 1 33 ALA HN 1 2 66 1 1 2 2 10 ASP HA 1 31 ASP- HA 1 2 66 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 67 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 67 1 2 2 2 11 LEU H 1 32 LEU HN 1 2 68 1 1 2 2 10 ASP H 1 31 ASP- HN 1 2 68 1 2 2 2 11 LEU QB 1 32 LEU HB* 1 2 69 1 1 2 2 10 ASP HB2 1 31 ASP- HB2 1 2 69 1 2 2 2 11 LEU QD 1 32 LEU HD2* 1 2 70 1 1 2 2 11 LEU H 1 32 LEU HN 1 2 70 1 2 2 2 11 LEU QB 1 32 LEU HB* 1 2 71 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 71 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 72 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 72 1 2 2 2 12 ALA H 1 33 ALA HN 1 2 73 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 73 1 2 2 2 12 ALA MB 1 33 ALA HB* 1 2 74 1 1 2 2 11 LEU QB 1 32 LEU HB* 1 2 74 1 2 2 2 12 ALA H 1 33 ALA HN 1 2 75 1 1 2 2 11 LEU H 1 32 LEU HN 1 2 75 1 2 2 2 12 ALA H 1 33 ALA HN 1 2 76 1 1 2 2 11 LEU HG 1 32 LEU HG 1 2 76 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 77 1 1 2 2 11 LEU HG 1 32 LEU HG 1 2 77 1 2 2 2 12 ALA HA 1 33 ALA HA 1 2 78 1 1 2 2 11 LEU QD 1 32 LEU HD1* 1 2 78 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 79 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 79 1 2 2 2 11 LEU HG 1 32 LEU HG 1 2 80 1 1 2 2 11 LEU HA 1 32 LEU HA 1 2 80 1 2 2 2 11 LEU QD 1 32 LEU HD1* 1 2 81 1 1 2 2 11 LEU QB 1 32 LEU HB* 1 2 81 1 2 2 2 11 LEU QD 1 32 LEU HD2* 1 2 82 1 1 2 2 12 ALA H 1 33 ALA HN 1 2 82 1 2 2 2 12 ALA MB 1 33 ALA HB* 1 2 83 1 1 2 2 12 ALA HA 1 33 ALA HA 1 2 83 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 84 1 1 2 2 12 ALA HA 1 33 ALA HA 1 2 84 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 85 1 1 2 2 12 ALA HA 1 33 ALA HA 1 2 85 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 86 1 1 2 2 12 ALA HA 1 33 ALA HA 1 2 86 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 87 1 1 2 2 12 ALA HA 1 33 ALA HA 1 2 87 1 2 2 2 15 LEU QB 1 36 LEU HB* 1 2 88 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 88 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 89 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 89 1 2 2 2 13 GLU QG 1 34 GLU- HG* 1 2 90 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 90 1 2 2 2 12 ALA MB 1 33 ALA HB* 1 2 91 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 91 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 92 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 92 1 2 2 2 13 GLU H 1 34 GLU- HN 1 2 93 1 1 2 2 12 ALA H 1 33 ALA HN 1 2 93 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 94 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 94 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 95 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 95 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 96 1 1 2 2 13 GLU QB 1 34 GLU- HB* 1 2 96 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 97 1 1 2 2 13 GLU QG 1 34 GLU- HG* 1 2 97 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 98 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 98 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 99 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 99 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 100 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 100 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 101 1 1 2 2 13 GLU QG 1 34 GLU- HG* 1 2 101 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 102 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 102 1 2 2 2 13 GLU QB 1 34 GLU- HB* 1 2 103 1 1 2 2 13 GLU H 1 34 GLU- HN 1 2 103 1 2 2 2 13 GLU QG 1 34 GLU- HG* 1 2 104 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 104 1 2 2 2 13 GLU QG 1 34 GLU- HG* 1 2 105 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 105 1 2 2 2 16 TYR HB3 1 37 TYR HB1 1 2 106 1 1 2 2 13 GLU HA 1 34 GLU- HA 1 2 106 1 2 2 2 16 TYR HB2 1 37 TYR HB2 1 2 107 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 107 1 2 2 2 14 ALA MB 1 35 ALA HB* 1 2 108 1 1 2 2 14 ALA HA 1 35 ALA HA 1 2 108 1 2 2 2 17 LEU HG 1 38 LEU HG 1 2 109 1 1 2 2 14 ALA HA 1 35 ALA HA 1 2 109 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 110 1 1 2 2 14 ALA HA 1 35 ALA HA 1 2 110 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 111 1 1 2 2 11 LEU QB 1 32 LEU HB* 1 2 111 1 2 2 2 14 ALA H 1 35 ALA HN 1 2 112 1 1 2 2 14 ALA MB 1 35 ALA HB* 1 2 112 1 2 2 2 16 TYR H 1 37 TYR HN 1 2 113 1 1 2 2 14 ALA MB 1 35 ALA HB* 1 2 113 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 114 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 114 1 2 2 2 15 LEU H 1 36 LEU HN 1 2 115 1 1 2 2 14 ALA MB 1 35 ALA HB* 1 2 115 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 116 1 1 2 2 14 ALA MB 1 35 ALA HB* 1 2 116 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 117 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 117 1 2 2 2 15 LEU QD 1 36 LEU HD2* 1 2 118 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 118 1 2 2 2 15 LEU HG 1 36 LEU HG 1 2 119 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 119 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 120 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 120 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 121 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 121 1 2 2 2 16 TYR HA 1 37 TYR HA 1 2 122 1 1 2 2 14 ALA MB 1 35 ALA HB* 1 2 122 1 2 2 2 15 LEU HA 1 36 LEU HA 1 2 123 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 123 1 2 2 2 15 LEU QB 1 36 LEU HB* 1 2 124 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 124 1 2 2 2 15 LEU HG 1 36 LEU HG 1 2 125 1 1 2 2 15 LEU H 1 36 LEU HN 1 2 125 1 2 2 2 15 LEU QD 1 36 LEU HD2* 1 2 126 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 126 1 2 2 2 15 LEU HG 1 36 LEU HG 1 2 127 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 127 1 2 2 2 15 LEU QD 1 36 LEU HD2* 1 2 128 1 1 2 2 15 LEU QB 1 36 LEU HB* 1 2 128 1 2 2 2 15 LEU QD 1 36 LEU HD2* 1 2 129 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 129 1 2 2 2 16 TYR HB3 1 37 TYR HB1 1 2 130 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 130 1 2 2 2 16 TYR HB2 1 37 TYR HB2 1 2 131 1 1 2 2 16 TYR H 1 37 TYR HN 1 2 131 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 132 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 132 1 2 2 2 16 TYR HA 1 37 TYR HA 1 2 133 1 1 2 2 16 TYR HA 1 37 TYR HA 1 2 133 1 2 2 2 20 GLY H 1 41 GLY HN 1 2 134 1 1 2 2 16 TYR HA 1 37 TYR HA 1 2 134 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 135 1 1 2 2 16 TYR HB3 1 37 TYR HB1 1 2 135 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 136 1 1 2 2 16 TYR HB2 1 37 TYR HB2 1 2 136 1 2 2 2 17 LEU H 1 38 LEU HN 1 2 137 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 137 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 138 1 1 2 2 12 ALA HA 1 33 ALA HA 1 2 138 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 139 1 1 2 2 12 ALA MB 1 33 ALA HB* 1 2 139 1 2 2 2 16 TYR QE 1 37 TYR HE* 1 2 140 1 1 2 2 16 TYR QD 1 37 TYR HD* 1 2 140 1 2 2 2 17 LEU HA 1 38 LEU HA 1 2 141 1 1 2 2 16 TYR QD 1 37 TYR HD* 1 2 141 1 2 2 2 17 LEU QB 1 38 LEU HB* 1 2 142 1 1 2 2 15 LEU QB 1 36 LEU HB* 1 2 142 1 2 2 2 16 TYR QD 1 37 TYR HD* 1 2 143 1 1 2 2 16 TYR QD 1 37 TYR HD* 1 2 143 1 2 2 2 20 GLY QA 1 41 GLY HA* 1 2 144 1 1 2 2 14 ALA H 1 35 ALA HN 1 2 144 1 2 2 2 16 TYR HA 1 37 TYR HA 1 2 145 1 1 2 2 15 LEU QB 1 36 LEU HB* 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 18 VAL H 1 39 VAL HN 1 2 147 1 1 2 2 17 LEU QB 1 38 LEU HB* 1 2 147 1 2 2 2 18 VAL H 1 39 VAL HN 1 2 148 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 148 1 2 2 2 18 VAL H 1 39 VAL HN 1 2 149 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 149 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 150 1 1 2 2 15 LEU HA 1 36 LEU HA 1 2 150 1 2 2 2 17 LEU H 1 38 LEU HN 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 HG 1 38 LEU HG 1 2 153 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 153 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 154 1 1 2 2 17 LEU H 1 38 LEU HN 1 2 154 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 155 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 155 1 2 2 2 17 LEU HG 1 38 LEU HG 1 2 156 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 156 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 157 1 1 2 2 17 LEU HA 1 38 LEU HA 1 2 157 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 158 1 1 2 2 17 LEU QB 1 38 LEU HB* 1 2 158 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 159 1 1 2 2 17 LEU QB 1 38 LEU HB* 1 2 159 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 160 1 1 2 2 16 TYR QD 1 37 TYR HD* 1 2 160 1 2 2 2 17 LEU MD1 1 38 LEU HD1* 1 2 161 1 1 2 2 16 TYR QD 1 37 TYR HD* 1 2 161 1 2 2 2 17 LEU MD2 1 38 LEU HD2* 1 2 162 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 162 1 2 2 2 18 VAL HB 1 39 VAL HB 1 2 163 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 163 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 164 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 164 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 165 1 1 2 2 18 VAL HA 1 39 VAL HA 1 2 165 1 2 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 166 1 1 2 2 18 VAL HA 1 39 VAL HA 1 2 166 1 2 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 167 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 167 1 2 2 2 19 CYS QB 1 40 CYS HB2 1 2 168 1 1 2 2 18 VAL HA 1 39 VAL HA 1 2 168 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 169 1 1 2 2 18 VAL HB 1 39 VAL HB 1 2 169 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 170 1 1 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 170 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 171 1 1 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 171 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 172 1 1 2 2 18 VAL H 1 39 VAL HN 1 2 172 1 2 2 2 19 CYS H 1 40 CYS HN 1 2 173 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 173 1 2 2 2 20 GLY QA 1 41 GLY HA* 1 2 174 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 174 1 2 2 2 22 ARG HB3 1 43 ARG+ HB1 1 2 175 1 1 2 2 19 CYS QB 1 40 CYS HB1 1 2 175 1 2 2 2 20 GLY H 1 41 GLY HN 1 2 176 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 176 1 2 2 2 20 GLY H 1 41 GLY HN 1 2 177 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 177 1 2 2 2 19 CYS QB 1 40 CYS HB1 1 2 178 1 1 2 2 19 CYS QB 1 40 CYS HB1 1 2 178 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 179 1 1 2 2 19 CYS H 1 40 CYS HN 1 2 179 1 2 2 2 19 CYS QB 1 40 CYS HB1 1 2 180 1 1 2 2 18 VAL MG2 1 39 VAL HG2* 1 2 180 1 2 2 2 19 CYS HA 1 40 CYS HA 1 2 181 1 1 2 2 18 VAL MG1 1 39 VAL HG1* 1 2 181 1 2 2 2 19 CYS HA 1 40 CYS HA 1 2 182 1 1 2 2 18 VAL HB 1 39 VAL HB 1 2 182 1 2 2 2 19 CYS HA 1 40 CYS HA 1 2 183 1 1 2 2 20 GLY QA 1 41 GLY HA* 1 2 183 1 2 2 2 21 GLU H 1 42 GLU- HN 1 2 184 1 1 2 2 20 GLY QA 1 41 GLY HA* 1 2 184 1 2 2 2 22 ARG H 1 43 ARG+ 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 21 GLU H 1 42 GLU- HN 1 2 187 1 2 2 2 21 GLU QB 1 42 GLU- HB* 1 2 188 1 1 2 2 21 GLU HA 1 42 GLU- HA 1 2 188 1 2 2 2 21 GLU QG 1 42 GLU- HG* 1 2 189 1 1 2 2 22 ARG H 1 43 ARG+ HN 1 2 189 1 2 2 2 22 ARG HB2 1 43 ARG+ HB2 1 2 190 1 1 2 2 22 ARG H 1 43 ARG+ HN 1 2 190 1 2 2 2 22 ARG QG 1 43 ARG+ HG* 1 2 191 1 1 2 2 22 ARG H 1 43 ARG+ HN 1 2 191 1 2 2 2 22 ARG QD 1 43 ARG+ HD* 1 2 192 1 1 2 2 21 GLU QB 1 42 GLU- HB* 1 2 192 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 193 1 1 2 2 21 GLU QG 1 42 GLU- HG* 1 2 193 1 2 2 2 22 ARG H 1 43 ARG+ HN 1 2 194 1 1 1 1 1 GLY QA 1 44 GLY HA* 1 2 194 1 2 1 1 2 ILE H 1 45 PHE HN 1 2 195 1 1 1 1 2 ILE HA 1 45 PHE HA 1 2 195 1 2 1 1 3 VAL H 1 46 PHE HN 1 2 196 1 1 1 1 2 ILE H 1 45 PHE HN 1 2 196 1 2 1 1 3 VAL H 1 46 PHE HN 1 2 197 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 197 1 2 2 2 12 ALA HA 1 33 ALA HA 1 2 198 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 198 1 2 1 1 3 VAL H 1 46 PHE HN 1 2 199 1 1 1 1 1 GLY QA 1 44 GLY HA* 1 2 199 1 2 1 1 2 ILE MD 1 45 PHE HD* 1 2 200 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 200 1 2 2 2 15 LEU HA 1 36 LEU HA 1 2 201 1 1 1 1 2 ILE HA 1 45 PHE HA 1 2 201 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 202 1 1 1 1 2 ILE H 1 45 PHE HN 1 2 202 1 2 1 1 2 ILE MD 1 45 PHE HD* 1 2 203 1 1 1 1 2 ILE HA 1 45 PHE HA 1 2 203 1 2 1 1 2 ILE MD 1 45 PHE HD* 1 2 204 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 204 1 2 1 1 4 GLU QB 1 47 TYR HB1 1 2 205 1 1 1 1 3 VAL H 1 46 PHE HN 1 2 205 1 2 1 1 4 GLU H 1 47 TYR HN 1 2 206 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 206 1 2 1 1 3 VAL HA 1 46 PHE HA 1 2 207 1 1 1 1 3 VAL HA 1 46 PHE HA 1 2 207 1 2 1 1 5 GLN QG 1 48 THR HG2* 1 2 208 1 1 1 1 4 GLU HA 1 47 TYR HA 1 2 208 1 2 1 1 5 GLN H 1 48 THR HN 1 2 209 1 1 1 1 4 GLU QB 1 47 TYR HB1 1 2 209 1 2 1 1 5 GLN H 1 48 THR HN 1 2 210 1 1 1 1 4 GLU QB 1 47 TYR HB1 1 2 210 1 2 2 2 11 LEU QD 1 32 LEU HD2* 1 2 211 1 1 1 1 4 GLU H 1 47 TYR HN 1 2 211 1 2 1 1 5 GLN H 1 48 THR HN 1 2 212 1 1 1 1 2 ILE MD 1 45 PHE HD* 1 2 212 1 2 1 1 4 GLU H 1 47 TYR HN 1 2 213 1 1 1 1 4 GLU H 1 47 TYR HN 1 2 213 1 2 1 1 4 GLU QB 1 47 TYR HB1 1 2 214 1 1 1 1 4 GLU QB 1 47 TYR HB2 1 2 214 1 2 2 2 15 LEU QD 1 36 LEU HD1* 1 2 215 1 1 1 1 4 GLU HA 1 47 TYR HA 1 2 215 1 2 2 2 11 LEU QD 1 32 LEU HD2* 1 2 216 1 1 1 1 4 GLU HA 1 47 TYR HA 1 2 216 1 2 1 1 5 GLN QG 1 48 THR HG2* 1 2 217 1 1 1 1 5 GLN H 1 48 THR HN 1 2 217 1 2 1 1 5 GLN QG 1 48 THR HG2* 1 2 218 1 1 1 1 5 GLN HA 1 48 THR HA 1 2 218 1 2 1 1 5 GLN QG 1 48 THR HG2* 1 2 219 1 1 1 1 5 GLN HA 1 48 THR HA 1 2 219 1 2 1 1 6 CYS H 1 49 LYS+ HN 1 2 220 1 1 1 1 6 CYS H 1 49 LYS+ HN 1 2 220 1 2 1 1 6 CYS QB 1 49 LYS+ HB* 1 2 221 1 1 1 1 5 GLN QG 1 48 THR HG2* 1 2 221 1 2 1 1 6 CYS H 1 49 LYS+ HN 1 2 222 1 1 1 1 7 CYS HA 1 50 PRO HA 1 2 222 1 2 1 1 8 THR H 1 51 THRC HN 1 2 223 1 1 1 1 8 THR H 1 51 THRC HN 1 2 223 1 2 1 1 8 THR HG1 1 51 THRC HG* 1 2 223 1 2 1 1 8 THR MG 1 51 THRC HG* 1 2 224 1 1 1 1 8 THR H 1 51 THRC HN 1 2 224 1 2 1 1 8 THR HB 1 51 THRC HB 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 . . . . . 5.0 -1.0 8.0 1 2 2 1 . . . . . 5.0 -1.0 8.0 1 2 3 1 . . . . . 5.0 -1.0 8.0 1 2 4 1 . . . . . 5.0 -1.0 8.0 1 2 5 1 . . . . . 3.0 -1.0 5.0 1 2 6 1 . . . . . 2.7 -1.0 4.7 1 2 7 1 . . . . . 3.0 -1.0 5.4 1 2 8 1 . . . . . 2.7 -1.0 3.4 1 2 9 1 . . . . . 2.5 -1.0 5.0 1 2 10 1 . . . . . 2.5 -1.0 5.0 1 2 11 1 . . . . . 2.7 -1.0 4.4 1 2 12 1 . . . . . 2.7 -1.0 4.4 1 2 13 1 . . . . . 3.0 -1.0 3.4 1 2 14 1 . . . . . 3.0 -1.0 5.0 1 2 15 1 . . . . . 3.0 -1.0 5.0 1 2 16 1 . . . . . 3.0 -1.0 6.0 1 2 17 1 . . . . . 2.7 -1.0 3.0 1 2 18 1 . . . . . 3.0 -1.0 5.0 1 2 19 1 . . . . . 3.0 -1.0 4.4 1 2 20 1 . . . . . 2.7 -1.0 5.0 1 2 21 1 . . . . . 2.7 -1.0 5.0 1 2 22 1 . . . . . 2.7 -1.0 6.0 1 2 23 1 . . . . . 2.7 -1.0 4.4 1 2 24 1 . . . . . 3.0 -1.0 5.0 1 2 25 1 . . . . . 3.0 -1.0 4.0 1 2 26 1 . . . . . 2.7 -1.0 2.7 1 2 27 1 . . . . . 3.0 -1.0 4.0 1 2 28 1 . . . . . 3.0 -1.0 5.0 1 2 29 1 . . . . . 2.7 -1.0 4.4 1 2 30 1 . . . . . 2.5 -1.0 4.4 1 2 31 1 . . . . . 2.7 -1.0 4.4 1 2 32 1 . . . . . 2.7 -1.0 6.0 1 2 33 1 . . . . . 2.7 -1.0 6.0 1 2 34 1 . . . . . 2.7 -1.0 3.4 1 2 35 1 . . . . . 2.7 -1.0 6.0 1 2 36 1 . . . . . 3.0 -1.0 5.0 1 2 37 1 . . . . . 3.0 -1.0 4.4 1 2 38 1 . . . . . 3.0 -1.0 7.0 1 2 39 1 . . . . . 3.0 -1.0 6.0 1 2 40 1 . . . . . 3.0 -1.0 5.0 1 2 41 1 . . . . . 2.7 -1.0 3.0 1 2 42 1 . . . . . 3.0 -1.0 4.4 1 2 43 1 . . . . . 2.7 -1.0 6.0 1 2 44 1 . . . . . 2.7 -1.0 2.7 1 2 45 1 . . . . . 2.7 -1.0 6.0 1 2 46 1 . . . . . 3.0 -1.0 5.5 1 2 47 1 . . . . . 2.7 -1.0 4.4 1 2 48 1 . . . . . 2.7 -1.0 3.7 1 2 49 1 . . . . . 3.0 -1.0 5.5 1 2 50 1 . . . . . 3.0 -1.0 4.0 1 2 51 1 . . . . . 3.0 -1.0 5.5 1 2 52 1 . . . . . 3.0 -1.0 6.4 1 2 53 1 . . . . . 3.0 -1.0 6.0 1 2 54 1 . . . . . 2.7 -1.0 4.4 1 2 55 1 . . . . . 3.0 -1.0 4.4 1 2 56 1 . . . . . 2.7 -1.0 4.0 1 2 57 1 . . . . . 3.0 -1.0 5.4 1 2 58 1 . . . . . 3.0 -1.0 5.0 1 2 59 1 . . . . . 3.0 -1.0 5.0 1 2 60 1 . . . . . 3.0 -1.0 5.0 1 2 61 1 . . . . . 3.0 -1.0 4.4 1 2 62 1 . . . . . 3.0 -1.0 5.0 1 2 63 1 . . . . . 3.0 -1.0 5.0 1 2 64 1 . . . . . 3.0 -1.0 5.0 1 2 65 1 . . . . . 3.0 -1.0 5.0 1 2 66 1 . . . . . 3.0 -1.0 3.4 1 2 67 1 . . . . . 2.7 -1.0 2.8 1 2 68 1 . . . . . 3.0 -1.0 6.0 1 2 69 1 . . . . . 3.0 -1.0 6.6 1 2 70 1 . . . . . 3.0 -1.0 5.0 1 2 71 1 . . . . . 3.0 -1.0 4.4 1 2 72 1 . . . . . 3.0 -1.0 5.0 1 2 73 1 . . . . . 3.0 -1.0 7.0 1 2 74 1 . . . . . 2.7 -1.0 5.0 1 2 75 1 . . . . . 3.0 -1.0 3.4 1 2 76 1 . . . . . 3.0 -1.0 4.4 1 2 77 1 . . . . . 3.0 -1.0 4.5 1 2 78 1 . . . . . 3.0 -1.0 6.0 1 2 79 1 . . . . . 2.7 -1.0 4.0 1 2 80 1 . . . . . 3.0 -1.0 5.5 1 2 81 1 . . . . . 2.7 -1.0 5.4 1 2 82 1 . . . . . 2.7 -1.0 3.7 1 2 83 1 . . . . . 3.0 -1.0 5.0 1 2 84 1 . . . . . 3.0 -1.0 5.0 1 2 85 1 . . . . . 3.0 -1.0 3.4 1 2 86 1 . . . . . 3.0 -1.0 4.4 1 2 87 1 . . . . . 3.0 -1.0 4.4 1 2 88 1 . . . . . 3.0 -1.0 5.4 1 2 89 1 . . . . . 3.0 -1.0 7.0 1 2 90 1 . . . . . 3.0 -1.0 8.0 1 2 91 1 . . . . . 3.0 -1.0 5.3 1 2 92 1 . . . . . 3.0 -1.0 3.7 1 2 93 1 . . . . . 3.0 -1.0 5.5 1 2 94 1 . . . . . 3.0 -1.0 7.0 1 2 95 1 . . . . . 3.0 -1.0 6.0 1 2 96 1 . . . . . 3.0 -1.0 4.4 1 2 97 1 . . . . . 3.0 -1.0 6.0 1 2 98 1 . . . . . 3.0 -1.0 3.4 1 2 99 1 . . . . . 3.0 -1.0 5.0 1 2 100 1 . . . . . 2.7 -1.0 4.7 1 2 101 1 . . . . . 3.0 -1.0 7.0 1 2 102 1 . . . . . 2.7 -1.0 3.7 1 2 103 1 . . . . . 2.7 -1.0 4.4 1 2 104 1 . . . . . 2.7 -1.0 4.4 1 2 105 1 . . . . . 2.7 -1.0 2.7 1 2 106 1 . . . . . 3.0 -1.0 3.4 1 2 107 1 . . . . . 2.7 -1.0 3.7 1 2 108 1 . . . . . 3.0 -1.0 5.1 1 2 109 1 . . . . . 3.0 -1.0 6.0 1 2 110 1 . . . . . 3.0 -1.0 7.0 1 2 111 1 . . . . . 2.7 -1.0 5.3 1 2 112 1 . . . . . 3.0 -1.0 5.0 1 2 113 1 . . . . . 2.7 -1.0 4.4 1 2 114 1 . . . . . 3.0 -1.0 3.4 1 2 115 1 . . . . . 3.0 -1.0 7.0 1 2 116 1 . . . . . 3.0 -1.0 7.0 1 2 117 1 . . . . . 3.0 -1.0 5.7 1 2 118 1 . . . . . 3.0 -1.0 7.0 1 2 119 1 . . . . . 3.0 -1.0 8.0 1 2 120 1 . . . . . 3.0 -1.0 8.0 1 2 121 1 . . . . . 3.0 -1.0 5.2 1 2 122 1 . . . . . 3.0 -1.0 5.0 1 2 123 1 . . . . . 2.7 -1.0 4.4 1 2 124 1 . . . . . 2.7 -1.0 3.4 1 2 125 1 . . . . . 2.7 -1.0 6.0 1 2 126 1 . . . . . 2.7 -1.0 4.0 1 2 127 1 . . . . . 2.7 -1.0 4.5 1 2 128 1 . . . . . 2.7 -1.0 4.7 1 2 129 1 . . . . . 2.7 -1.0 3.3 1 2 130 1 . . . . . 2.7 -1.0 2.7 1 2 131 1 . . . . . 3.0 -1.0 3.4 1 2 132 1 . . . . . 3.0 -1.0 5.4 1 2 133 1 . . . . . 3.0 -1.0 5.0 1 2 134 1 . . . . . 3.0 -1.0 5.0 1 2 135 1 . . . . . 3.0 -1.0 4.0 1 2 136 1 . . . . . 3.0 -1.0 4.0 1 2 137 1 . . . . . 3.0 -1.0 6.4 1 2 138 1 . . . . . 3.0 -1.0 7.0 1 2 139 1 . . . . . 6.4 -1.0 6.4 1 2 140 1 . . . . . 3.0 -1.0 8.0 1 2 141 1 . . . . . 3.0 -1.0 8.5 1 2 142 1 . . . . . 3.0 -1.0 8.5 1 2 143 1 . . . . . 3.0 -1.0 5.4 1 2 144 1 . . . . . 3.0 -1.0 6.4 1 2 145 1 . . . . . 3.0 -1.0 6.0 1 2 146 1 . . . . . 2.7 -1.0 5.0 1 2 147 1 . . . . . 2.7 -1.0 6.0 1 2 148 1 . . . . . 3.0 -1.0 3.4 1 2 149 1 . . . . . 3.0 -1.0 6.0 1 2 150 1 . . . . . 3.0 -1.0 5.0 1 2 151 1 . . . . . 2.7 -1.0 4.4 1 2 152 1 . . . . . 2.7 -1.0 4.2 1 2 153 1 . . . . . 3.0 -1.0 6.0 1 2 154 1 . . . . . 3.0 -1.0 6.0 1 2 155 1 . . . . . 2.7 -1.0 3.4 1 2 156 1 . . . . . 2.7 -1.0 3.4 1 2 157 1 . . . . . 2.7 -1.0 4.1 1 2 158 1 . . . . . 2.7 -1.0 3.4 1 2 159 1 . . . . . 2.7 -1.0 3.4 1 2 160 1 . . . . . 3.0 -1.0 8.6 1 2 161 1 . . . . . 3.0 -1.0 8.5 1 2 162 1 . . . . . 2.7 -1.0 3.7 1 2 163 1 . . . . . 2.7 -1.0 4.4 1 2 164 1 . . . . . 2.7 -1.0 4.4 1 2 165 1 . . . . . 2.7 -1.0 4.4 1 2 166 1 . . . . . 2.7 -1.0 4.4 1 2 167 1 . . . . . 3.0 -1.0 5.5 1 2 168 1 . . . . . 2.7 -1.0 3.6 1 2 169 1 . . . . . 3.0 -1.0 4.0 1 2 170 1 . . . . . 3.0 -1.0 5.0 1 2 171 1 . . . . . 3.0 -1.0 5.0 1 2 172 1 . . . . . 2.7 -1.0 2.7 1 2 173 1 . . . . . 3.0 -1.0 6.0 1 2 174 1 . . . . . 3.0 -1.0 6.0 1 2 175 1 . . . . . 3.0 -1.0 3.4 1 2 176 1 . . . . . 2.7 -1.0 2.7 1 2 177 1 . . . . . 3.0 -1.0 5.4 1 2 178 1 . . . . . 3.0 -1.0 5.0 1 2 179 1 . . . . . 2.7 -1.0 3.4 1 2 180 1 . . . . . 2.7 -1.0 4.4 1 2 181 1 . . . . . 2.7 -1.0 6.3 1 2 182 1 . . . . . 3.0 -1.0 5.5 1 2 183 1 . . . . . 3.0 -1.0 4.4 1 2 184 1 . . . . . 3.0 -1.0 4.4 1 2 185 1 . . . . . 3.0 -1.0 5.0 1 2 186 1 . . . . . 3.0 -1.0 3.4 1 2 187 1 . . . . . 2.7 -1.0 5.0 1 2 188 1 . . . . . 2.7 -1.0 4.4 1 2 189 1 . . . . . 2.7 -1.0 3.4 1 2 190 1 . . . . . 2.7 -1.0 4.4 1 2 191 1 . . . . . 2.7 -1.0 4.4 1 2 192 1 . . . . . 2.7 -1.0 4.4 1 2 193 1 . . . . . 2.7 -1.0 4.4 1 2 194 1 . . . . . 2.7 -1.0 3.7 1 2 195 1 . . . . . 2.7 -1.0 3.4 1 2 196 1 . . . . . 3.0 -1.0 5.0 1 2 197 1 . . . . . 3.0 -1.0 7.0 1 2 198 1 . . . . . 3.0 -1.0 5.4 1 2 199 1 . . . . . 3.0 -1.0 8.0 1 2 200 1 . . . . . 3.0 -1.0 7.0 1 2 201 1 . . . . . 3.0 -1.0 6.0 1 2 202 1 . . . . . 3.0 -1.0 5.4 1 2 203 1 . . . . . 2.7 -1.0 5.4 1 2 204 1 . . . . . 2.7 -1.0 7.5 1 2 205 1 . . . . . 2.7 -1.0 6.0 1 2 206 1 . . . . . 2.7 -1.0 5.4 1 2 207 1 . . . . . 3.0 -1.0 7.0 1 2 208 1 . . . . . 3.0 -1.0 3.4 1 2 209 1 . . . . . 3.0 -1.0 6.0 1 2 210 1 . . . . . 3.0 -1.0 7.0 1 2 211 1 . . . . . 3.0 -1.0 4.2 1 2 212 1 . . . . . 3.0 -1.0 6.4 1 2 213 1 . . . . . 2.7 -1.0 5.0 1 2 214 1 . . . . . 3.0 -1.0 4.4 1 2 215 1 . . . . . 3.0 -1.0 6.6 1 2 216 1 . . . . . 3.0 -1.0 6.0 1 2 217 1 . . . . . 2.7 -1.0 4.4 1 2 218 1 . . . . . 2.7 -1.0 4.4 1 2 219 1 . . . . . 3.0 -1.0 5.0 1 2 220 1 . . . . . 2.7 -1.0 5.0 1 2 221 1 . . . . . 3.0 -1.0 6.0 1 2 222 1 . . . . . 2.7 -1.0 2.7 1 2 223 1 . . . . . 3.0 -1.0 6.0 1 2 224 1 . . . . . 3.0 -1.0 5.0 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 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 11 LEU H 1 32 LEU HN 1 3 2 1 1 2 2 7 CYS O 1 28 CYS O 1 3 2 1 2 2 2 11 LEU N 1 32 LEU 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 8 GLY O 1 29 GLY O 1 3 5 1 2 2 2 12 ALA H 1 33 ALA HN 1 3 6 1 1 2 2 8 GLY O 1 29 GLY O 1 3 6 1 2 2 2 12 ALA N 1 33 ALA N 1 3 7 1 1 2 2 9 SER O 1 30 SER O 1 3 7 1 2 2 2 12 ALA H 1 33 ALA HN 1 3 8 1 1 2 2 9 SER O 1 30 SER O 1 3 8 1 2 2 2 12 ALA N 1 33 ALA N 1 3 9 1 1 2 2 10 ASP O 1 31 ASP- O 1 3 9 1 2 2 2 14 ALA H 1 35 ALA HN 1 3 10 1 1 2 2 10 ASP O 1 31 ASP- O 1 3 10 1 2 2 2 14 ALA N 1 35 ALA N 1 3 11 1 1 2 2 11 LEU O 1 32 LEU O 1 3 11 1 2 2 2 15 LEU H 1 36 LEU HN 1 3 12 1 1 2 2 11 LEU O 1 32 LEU O 1 3 12 1 2 2 2 15 LEU N 1 36 LEU N 1 3 13 1 1 2 2 12 ALA O 1 33 ALA O 1 3 13 1 2 2 2 16 TYR H 1 37 TYR HN 1 3 14 1 1 2 2 12 ALA O 1 33 ALA O 1 3 14 1 2 2 2 16 TYR N 1 37 TYR N 1 3 15 1 1 2 2 13 GLU O 1 34 GLU- O 1 3 15 1 2 2 2 17 LEU H 1 38 LEU HN 1 3 16 1 1 2 2 13 GLU O 1 34 GLU- O 1 3 16 1 2 2 2 17 LEU N 1 38 LEU N 1 3 17 1 1 2 2 14 ALA O 1 35 ALA O 1 3 17 1 2 2 2 18 VAL H 1 39 VAL HN 1 3 18 1 1 2 2 14 ALA O 1 35 ALA O 1 3 18 1 2 2 2 18 VAL N 1 39 VAL N 1 3 19 1 1 2 2 15 LEU O 1 36 LEU O 1 3 19 1 2 2 2 19 CYS H 1 40 CYS HN 1 3 20 1 1 2 2 15 LEU O 1 36 LEU O 1 3 20 1 2 2 2 19 CYS N 1 40 CYS N 1 3 21 1 1 2 2 9 SER O 1 30 SER O 1 3 21 1 2 2 2 13 GLU H 1 34 GLU- HN 1 3 22 1 1 2 2 9 SER O 1 30 SER O 1 3 22 1 2 2 2 13 GLU N 1 34 GLU- 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 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 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 2 . 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 3 . 2 2 11 LEU C 2 2 12 ALA N 2 2 12 ALA CA 2 2 12 ALA C -89.99999 -40.0 1 32 LEU C 1 33 ALA N 1 33 ALA CA 1 33 ALA C 1 1 4 . 2 2 12 ALA C 2 2 13 GLU N 2 2 13 GLU CA 2 2 13 GLU C -89.99999 -40.0 1 33 ALA C 1 34 GLU- N 1 34 GLU- CA 1 34 GLU- C 1 1 5 . 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 6 . 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 7 . 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 8 . 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 9 . 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 10 . 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 11 . 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 12 . 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 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 VAL N 1 1 3 VAL CA 1 1 3 VAL 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 3 ASN N 2 2 3 ASN CA 2 2 3 ASN CB 2 2 3 ASN CG 20.0 100.0 1 24 ASN N 1 24 ASN CA 1 24 ASN CB 1 24 ASN CG 1 1 17 . 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 18 . 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 19 . 2 2 21 GLU N 2 2 21 GLU CA 2 2 21 GLU CB 2 2 21 GLU CG 20.0 100.0 1 42 GLU- N 1 42 GLU- CA 1 42 GLU- CB 1 42 GLU- CG 1 1 20 . 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 21 . 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 -3.392 7.014 -0.029 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -4.830 7.350 0.168 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -5.617 9.304 0.367 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -4.351 8.967 1.446 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -5.896 8.317 1.719 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -4.835 6.541 0.714 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -5.576 7.298 -0.727 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -5.203 8.583 0.991 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -2.519 7.618 0.562 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ILE C C -1.293 6.215 -2.495 1.00 . A A . 2 ILE C 1 1 1 11 1 1 2 ILE CA C -1.684 5.690 -1.118 1.00 . A A . 2 ILE CA 1 1 1 12 1 1 2 ILE CB C -1.535 4.166 -1.080 1.00 . A A . 2 ILE CB 1 1 1 13 1 1 2 ILE CD1 C 0.120 2.313 -0.773 1.00 . A A . 2 ILE CD1 1 1 1 14 1 1 2 ILE CG1 C -0.050 3.795 -1.112 1.00 . A A . 2 ILE CG1 1 1 1 15 1 1 2 ILE CG2 C -2.237 3.557 -2.292 1.00 . A A . 2 ILE CG2 1 1 1 16 1 1 2 ILE H H -3.822 5.591 -1.346 1.00 . A A . 2 ILE H 1 1 1 17 1 1 2 ILE HA H -1.053 6.135 -0.366 1.00 . A A . 2 ILE HA 1 1 1 18 1 1 2 ILE HB H -1.986 3.784 -0.176 1.00 . A A . 2 ILE HB 1 1 1 19 1 1 2 ILE HD11 H -0.616 2.024 -0.038 1.00 . A A . 2 ILE HD11 1 1 1 20 1 1 2 ILE HD12 H 1.111 2.146 -0.377 1.00 . A A . 2 ILE HD12 1 1 1 21 1 1 2 ILE HD13 H -0.013 1.723 -1.667 1.00 . A A . 2 ILE HD13 1 1 1 22 1 1 2 ILE HG12 H 0.348 3.987 -2.099 1.00 . A A . 2 ILE HG12 1 1 1 23 1 1 2 ILE HG13 H 0.485 4.390 -0.387 1.00 . A A . 2 ILE HG13 1 1 1 24 1 1 2 ILE HG21 H -3.291 3.786 -2.249 1.00 . A A . 2 ILE HG21 1 1 1 25 1 1 2 ILE HG22 H -2.099 2.486 -2.288 1.00 . A A . 2 ILE HG22 1 1 1 26 1 1 2 ILE HG23 H -1.816 3.973 -3.196 1.00 . A A . 2 ILE HG23 1 1 1 27 1 1 2 ILE N N -3.104 6.058 -0.867 1.00 . A A . 2 ILE N 1 1 1 28 1 1 2 ILE O O -0.200 6.694 -2.713 1.00 . A A . 2 ILE O 1 1 1 29 1 1 3 VAL C C -1.395 8.058 -4.744 1.00 . A A . 3 VAL C 1 1 1 30 1 1 3 VAL CA C -1.915 6.619 -4.797 1.00 . A A . 3 VAL CA 1 1 1 31 1 1 3 VAL CB C -3.208 6.581 -5.614 1.00 . A A . 3 VAL CB 1 1 1 32 1 1 3 VAL CG1 C -2.887 6.820 -7.084 1.00 . A A . 3 VAL CG1 1 1 1 33 1 1 3 VAL CG2 C -3.878 5.214 -5.456 1.00 . A A . 3 VAL CG2 1 1 1 34 1 1 3 VAL H H -3.074 5.747 -3.214 1.00 . A A . 3 VAL H 1 1 1 35 1 1 3 VAL HA H -1.176 5.984 -5.261 1.00 . A A . 3 VAL HA 1 1 1 36 1 1 3 VAL HB H -3.878 7.353 -5.262 1.00 . A A . 3 VAL HB 1 1 1 37 1 1 3 VAL HG11 H -3.424 6.105 -7.689 1.00 . A A . 3 VAL HG11 1 1 1 38 1 1 3 VAL HG12 H -1.826 6.703 -7.242 1.00 . A A . 3 VAL HG12 1 1 1 39 1 1 3 VAL HG13 H -3.184 7.821 -7.358 1.00 . A A . 3 VAL HG13 1 1 1 40 1 1 3 VAL HG21 H -4.292 5.126 -4.464 1.00 . A A . 3 VAL HG21 1 1 1 41 1 1 3 VAL HG22 H -3.147 4.434 -5.611 1.00 . A A . 3 VAL HG22 1 1 1 42 1 1 3 VAL HG23 H -4.669 5.115 -6.185 1.00 . A A . 3 VAL HG23 1 1 1 43 1 1 3 VAL N N -2.198 6.131 -3.424 1.00 . A A . 3 VAL N 1 1 1 44 1 1 3 VAL O O -0.622 8.477 -5.583 1.00 . A A . 3 VAL O 1 1 1 45 1 1 4 GLU C C -0.323 10.393 -2.564 1.00 . A A . 4 GLU C 1 1 1 46 1 1 4 GLU CA C -1.349 10.238 -3.690 1.00 . A A . 4 GLU CA 1 1 1 47 1 1 4 GLU CB C -2.541 11.155 -3.415 1.00 . A A . 4 GLU CB 1 1 1 48 1 1 4 GLU CD C -3.201 13.451 -2.665 1.00 . A A . 4 GLU CD 1 1 1 49 1 1 4 GLU CG C -2.036 12.570 -3.126 1.00 . A A . 4 GLU CG 1 1 1 50 1 1 4 GLU H H -2.449 8.472 -3.110 1.00 . A A . 4 GLU H 1 1 1 51 1 1 4 GLU HA H -0.893 10.519 -4.627 1.00 . A A . 4 GLU HA 1 1 1 52 1 1 4 GLU HB2 H -3.190 11.171 -4.278 1.00 . A A . 4 GLU HB2 1 1 1 53 1 1 4 GLU HB3 H -3.089 10.789 -2.559 1.00 . A A . 4 GLU HB3 1 1 1 54 1 1 4 GLU HG2 H -1.286 12.532 -2.350 1.00 . A A . 4 GLU HG2 1 1 1 55 1 1 4 GLU HG3 H -1.606 12.989 -4.023 1.00 . A A . 4 GLU HG3 1 1 1 56 1 1 4 GLU N N -1.818 8.824 -3.775 1.00 . A A . 4 GLU N 1 1 1 57 1 1 4 GLU O O 0.642 11.119 -2.692 1.00 . A A . 4 GLU O 1 1 1 58 1 1 4 GLU OE1 O -3.929 13.023 -1.784 1.00 . A A . 4 GLU OE1 1 1 1 59 1 1 4 GLU OE2 O -3.343 14.538 -3.200 1.00 . A A . 4 GLU OE2 1 1 1 60 1 1 5 GLN C C 1.696 9.040 -0.608 1.00 . A A . 5 GLN C 1 1 1 61 1 1 5 GLN CA C 0.438 9.866 -0.329 1.00 . A A . 5 GLN CA 1 1 1 62 1 1 5 GLN CB C -0.217 9.377 0.964 1.00 . A A . 5 GLN CB 1 1 1 63 1 1 5 GLN CD C 0.095 9.658 3.425 1.00 . A A . 5 GLN CD 1 1 1 64 1 1 5 GLN CG C 0.040 10.388 2.081 1.00 . A A . 5 GLN CG 1 1 1 65 1 1 5 GLN H H -1.314 9.159 -1.365 1.00 . A A . 5 GLN H 1 1 1 66 1 1 5 GLN HA H 0.715 10.904 -0.218 1.00 . A A . 5 GLN HA 1 1 1 67 1 1 5 GLN HB2 H -1.281 9.274 0.809 1.00 . A A . 5 GLN HB2 1 1 1 68 1 1 5 GLN HB3 H 0.200 8.422 1.242 1.00 . A A . 5 GLN HB3 1 1 1 69 1 1 5 GLN HE21 H 1.945 10.252 3.832 1.00 . A A . 5 GLN HE21 1 1 1 70 1 1 5 GLN HE22 H 1.223 9.269 5.011 1.00 . A A . 5 GLN HE22 1 1 1 71 1 1 5 GLN HG2 H 0.977 10.891 1.903 1.00 . A A . 5 GLN HG2 1 1 1 72 1 1 5 GLN HG3 H -0.760 11.112 2.101 1.00 . A A . 5 GLN HG3 1 1 1 73 1 1 5 GLN N N -0.525 9.732 -1.458 1.00 . A A . 5 GLN N 1 1 1 74 1 1 5 GLN NE2 N 1.178 9.732 4.149 1.00 . A A . 5 GLN NE2 1 1 1 75 1 1 5 GLN O O 2.785 9.404 -0.210 1.00 . A A . 5 GLN O 1 1 1 76 1 1 5 GLN OE1 O -0.856 9.014 3.820 1.00 . A A . 5 GLN OE1 1 1 1 77 1 1 6 CYS C C 3.481 7.646 -2.813 1.00 . A A . 6 CYS C 1 1 1 78 1 1 6 CYS CA C 2.769 7.102 -1.573 1.00 . A A . 6 CYS CA 1 1 1 79 1 1 6 CYS CB C 2.354 5.649 -1.808 1.00 . A A . 6 CYS CB 1 1 1 80 1 1 6 CYS H H 0.682 7.646 -1.603 1.00 . A A . 6 CYS H 1 1 1 81 1 1 6 CYS HA H 3.441 7.148 -0.729 1.00 . A A . 6 CYS HA 1 1 1 82 1 1 6 CYS HB2 H 1.278 5.580 -1.833 1.00 . A A . 6 CYS HB2 1 1 1 83 1 1 6 CYS HB3 H 2.758 5.308 -2.747 1.00 . A A . 6 CYS HB3 1 1 1 84 1 1 6 CYS N N 1.565 7.932 -1.286 1.00 . A A . 6 CYS N 1 1 1 85 1 1 6 CYS O O 4.659 7.421 -3.012 1.00 . A A . 6 CYS O 1 1 1 86 1 1 6 CYS SG S 2.988 4.615 -0.468 1.00 . A A . 6 CYS SG 1 1 1 87 1 1 7 CYS C C 4.003 10.315 -4.501 1.00 . A A . 7 CYS C 1 1 1 88 1 1 7 CYS CA C 3.434 8.944 -4.856 1.00 . A A . 7 CYS CA 1 1 1 89 1 1 7 CYS CB C 2.404 9.095 -5.979 1.00 . A A . 7 CYS CB 1 1 1 90 1 1 7 CYS H H 1.837 8.554 -3.461 1.00 . A A . 7 CYS H 1 1 1 91 1 1 7 CYS HA H 4.233 8.296 -5.178 1.00 . A A . 7 CYS HA 1 1 1 92 1 1 7 CYS HB2 H 1.860 8.170 -6.095 1.00 . A A . 7 CYS HB2 1 1 1 93 1 1 7 CYS HB3 H 1.716 9.890 -5.731 1.00 . A A . 7 CYS HB3 1 1 1 94 1 1 7 CYS N N 2.783 8.373 -3.643 1.00 . A A . 7 CYS N 1 1 1 95 1 1 7 CYS O O 5.096 10.669 -4.895 1.00 . A A . 7 CYS O 1 1 1 96 1 1 7 CYS SG S 3.252 9.496 -7.528 1.00 . A A . 7 CYS SG 1 1 1 97 1 1 8 THR C C 4.833 12.243 -2.263 1.00 . A A . 8 THR C 1 1 1 98 1 1 8 THR CA C 3.768 12.423 -3.342 1.00 . A A . 8 THR CA 1 1 1 99 1 1 8 THR CB C 2.607 13.250 -2.788 1.00 . A A . 8 THR CB 1 1 1 100 1 1 8 THR CG2 C 3.152 14.480 -2.061 1.00 . A A . 8 THR CG2 1 1 1 101 1 1 8 THR H H 2.396 10.771 -3.427 1.00 . A A . 8 THR H 1 1 1 102 1 1 8 THR HA H 4.197 12.924 -4.199 1.00 . A A . 8 THR HA 1 1 1 103 1 1 8 THR HB H 2.038 12.650 -2.094 1.00 . A A . 8 THR HB 1 1 1 104 1 1 8 THR HG1 H 1.205 14.370 -3.536 1.00 . A A . 8 THR HG1 1 1 1 105 1 1 8 THR HG21 H 3.455 14.204 -1.063 1.00 . A A . 8 THR HG21 1 1 1 106 1 1 8 THR HG22 H 2.381 15.236 -2.007 1.00 . A A . 8 THR HG22 1 1 1 107 1 1 8 THR HG23 H 4.002 14.870 -2.601 1.00 . A A . 8 THR HG23 1 1 1 108 1 1 8 THR N N 3.270 11.083 -3.743 1.00 . A A . 8 THR N 1 1 1 109 1 1 8 THR O O 5.639 13.117 -2.010 1.00 . A A . 8 THR O 1 1 1 110 1 1 8 THR OG1 O 1.768 13.660 -3.857 1.00 . A A . 8 THR OG1 1 1 1 111 1 1 9 SER C C 6.462 9.462 -0.782 1.00 . A A . 9 SER C 1 1 1 112 1 1 9 SER CA C 5.844 10.842 -0.560 1.00 . A A . 9 SER CA 1 1 1 113 1 1 9 SER CB C 5.156 10.877 0.804 1.00 . A A . 9 SER CB 1 1 1 114 1 1 9 SER H H 4.180 10.416 -1.853 1.00 . A A . 9 SER H 1 1 1 115 1 1 9 SER HA H 6.616 11.596 -0.597 1.00 . A A . 9 SER HA 1 1 1 116 1 1 9 SER HB2 H 4.469 10.051 0.884 1.00 . A A . 9 SER HB2 1 1 1 117 1 1 9 SER HB3 H 5.902 10.798 1.584 1.00 . A A . 9 SER HB3 1 1 1 118 1 1 9 SER HG H 4.708 12.510 1.763 1.00 . A A . 9 SER HG 1 1 1 119 1 1 9 SER N N 4.840 11.104 -1.626 1.00 . A A . 9 SER N 1 1 1 120 1 1 9 SER O O 6.023 8.702 -1.621 1.00 . A A . 9 SER O 1 1 1 121 1 1 9 SER OG O 4.438 12.097 0.939 1.00 . A A . 9 SER OG 1 1 1 122 1 1 10 ILE C C 7.525 6.827 0.826 1.00 . A A . 10 ILE C 1 1 1 123 1 1 10 ILE CA C 8.121 7.802 -0.196 1.00 . A A . 10 ILE CA 1 1 1 124 1 1 10 ILE CB C 9.621 7.951 0.043 1.00 . A A . 10 ILE CB 1 1 1 125 1 1 10 ILE CD1 C 11.573 8.528 -1.474 1.00 . A A . 10 ILE CD1 1 1 1 126 1 1 10 ILE CG1 C 10.188 8.961 -0.976 1.00 . A A . 10 ILE CG1 1 1 1 127 1 1 10 ILE CG2 C 10.283 6.582 -0.120 1.00 . A A . 10 ILE CG2 1 1 1 128 1 1 10 ILE H H 7.814 9.759 0.639 1.00 . A A . 10 ILE H 1 1 1 129 1 1 10 ILE HA H 7.947 7.432 -1.196 1.00 . A A . 10 ILE HA 1 1 1 130 1 1 10 ILE HB H 9.790 8.315 1.047 1.00 . A A . 10 ILE HB 1 1 1 131 1 1 10 ILE HD11 H 11.474 7.664 -2.115 1.00 . A A . 10 ILE HD11 1 1 1 132 1 1 10 ILE HD12 H 12.197 8.280 -0.628 1.00 . A A . 10 ILE HD12 1 1 1 133 1 1 10 ILE HD13 H 12.025 9.338 -2.028 1.00 . A A . 10 ILE HD13 1 1 1 134 1 1 10 ILE HG12 H 9.514 9.027 -1.818 1.00 . A A . 10 ILE HG12 1 1 1 135 1 1 10 ILE HG13 H 10.264 9.931 -0.508 1.00 . A A . 10 ILE HG13 1 1 1 136 1 1 10 ILE HG21 H 11.270 6.607 0.314 1.00 . A A . 10 ILE HG21 1 1 1 137 1 1 10 ILE HG22 H 10.357 6.344 -1.170 1.00 . A A . 10 ILE HG22 1 1 1 138 1 1 10 ILE HG23 H 9.688 5.834 0.380 1.00 . A A . 10 ILE HG23 1 1 1 139 1 1 10 ILE N N 7.476 9.131 -0.033 1.00 . A A . 10 ILE N 1 1 1 140 1 1 10 ILE O O 7.061 7.229 1.874 1.00 . A A . 10 ILE O 1 1 1 141 1 1 11 CYS C C 7.831 3.333 1.594 1.00 . A A . 11 CYS C 1 1 1 142 1 1 11 CYS CA C 6.948 4.577 1.510 1.00 . A A . 11 CYS CA 1 1 1 143 1 1 11 CYS CB C 5.533 4.148 1.084 1.00 . A A . 11 CYS CB 1 1 1 144 1 1 11 CYS H H 7.900 5.238 -0.315 1.00 . A A . 11 CYS H 1 1 1 145 1 1 11 CYS HA H 6.899 5.041 2.484 1.00 . A A . 11 CYS HA 1 1 1 146 1 1 11 CYS HB2 H 5.555 3.118 0.763 1.00 . A A . 11 CYS HB2 1 1 1 147 1 1 11 CYS HB3 H 4.865 4.238 1.931 1.00 . A A . 11 CYS HB3 1 1 1 148 1 1 11 CYS N N 7.527 5.552 0.535 1.00 . A A . 11 CYS N 1 1 1 149 1 1 11 CYS O O 8.415 2.902 0.618 1.00 . A A . 11 CYS O 1 1 1 150 1 1 11 CYS SG S 4.917 5.178 -0.275 1.00 . A A . 11 CYS SG 1 1 1 151 1 1 12 SER C C 7.858 0.286 2.932 1.00 . A A . 12 SER C 1 1 1 152 1 1 12 SER CA C 8.760 1.526 2.918 1.00 . A A . 12 SER CA 1 1 1 153 1 1 12 SER CB C 9.530 1.610 4.237 1.00 . A A . 12 SER CB 1 1 1 154 1 1 12 SER H H 7.441 3.114 3.527 1.00 . A A . 12 SER H 1 1 1 155 1 1 12 SER HA H 9.459 1.455 2.098 1.00 . A A . 12 SER HA 1 1 1 156 1 1 12 SER HB2 H 9.541 0.645 4.714 1.00 . A A . 12 SER HB2 1 1 1 157 1 1 12 SER HB3 H 10.546 1.925 4.041 1.00 . A A . 12 SER HB3 1 1 1 158 1 1 12 SER HG H 8.017 2.207 5.306 1.00 . A A . 12 SER HG 1 1 1 159 1 1 12 SER N N 7.926 2.748 2.757 1.00 . A A . 12 SER N 1 1 1 160 1 1 12 SER O O 6.687 0.363 3.254 1.00 . A A . 12 SER O 1 1 1 161 1 1 12 SER OG O 8.888 2.547 5.095 1.00 . A A . 12 SER OG 1 1 1 162 1 1 13 LEU C C 6.572 -2.111 3.692 1.00 . A A . 13 LEU C 1 1 1 163 1 1 13 LEU CA C 7.606 -2.116 2.565 1.00 . A A . 13 LEU CA 1 1 1 164 1 1 13 LEU CB C 8.543 -3.308 2.746 1.00 . A A . 13 LEU CB 1 1 1 165 1 1 13 LEU CD1 C 6.764 -4.719 1.708 1.00 . A A . 13 LEU CD1 1 1 1 166 1 1 13 LEU CD2 C 8.662 -5.790 2.921 1.00 . A A . 13 LEU CD2 1 1 1 167 1 1 13 LEU CG C 7.721 -4.586 2.894 1.00 . A A . 13 LEU CG 1 1 1 168 1 1 13 LEU H H 9.341 -0.879 2.315 1.00 . A A . 13 LEU H 1 1 1 169 1 1 13 LEU HA H 7.108 -2.206 1.624 1.00 . A A . 13 LEU HA 1 1 1 170 1 1 13 LEU HB2 H 9.182 -3.392 1.882 1.00 . A A . 13 LEU HB2 1 1 1 171 1 1 13 LEU HB3 H 9.145 -3.165 3.628 1.00 . A A . 13 LEU HB3 1 1 1 172 1 1 13 LEU HD11 H 7.294 -4.504 0.792 1.00 . A A . 13 LEU HD11 1 1 1 173 1 1 13 LEU HD12 H 5.948 -4.022 1.824 1.00 . A A . 13 LEU HD12 1 1 1 174 1 1 13 LEU HD13 H 6.375 -5.726 1.670 1.00 . A A . 13 LEU HD13 1 1 1 175 1 1 13 LEU HD21 H 9.140 -5.850 3.888 1.00 . A A . 13 LEU HD21 1 1 1 176 1 1 13 LEU HD22 H 9.414 -5.674 2.154 1.00 . A A . 13 LEU HD22 1 1 1 177 1 1 13 LEU HD23 H 8.098 -6.692 2.739 1.00 . A A . 13 LEU HD23 1 1 1 178 1 1 13 LEU HG H 7.155 -4.547 3.813 1.00 . A A . 13 LEU HG 1 1 1 179 1 1 13 LEU N N 8.402 -0.854 2.580 1.00 . A A . 13 LEU N 1 1 1 180 1 1 13 LEU O O 5.443 -2.526 3.514 1.00 . A A . 13 LEU O 1 1 1 181 1 1 14 TYR C C 4.643 -1.049 5.486 1.00 . A A . 14 TYR C 1 1 1 182 1 1 14 TYR CA C 5.979 -1.606 5.980 1.00 . A A . 14 TYR CA 1 1 1 183 1 1 14 TYR CB C 6.527 -0.710 7.094 1.00 . A A . 14 TYR CB 1 1 1 184 1 1 14 TYR CD1 C 4.916 -1.675 8.780 1.00 . A A . 14 TYR CD1 1 1 1 185 1 1 14 TYR CD2 C 7.276 -1.580 9.341 1.00 . A A . 14 TYR CD2 1 1 1 186 1 1 14 TYR CE1 C 4.644 -2.258 10.027 1.00 . A A . 14 TYR CE1 1 1 1 187 1 1 14 TYR CE2 C 7.003 -2.161 10.588 1.00 . A A . 14 TYR CE2 1 1 1 188 1 1 14 TYR CG C 6.233 -1.337 8.438 1.00 . A A . 14 TYR CG 1 1 1 189 1 1 14 TYR CZ C 5.688 -2.501 10.929 1.00 . A A . 14 TYR CZ 1 1 1 190 1 1 14 TYR H H 7.858 -1.308 4.968 1.00 . A A . 14 TYR H 1 1 1 191 1 1 14 TYR HA H 5.834 -2.607 6.360 1.00 . A A . 14 TYR HA 1 1 1 192 1 1 14 TYR HB2 H 7.596 -0.602 6.974 1.00 . A A . 14 TYR HB2 1 1 1 193 1 1 14 TYR HB3 H 6.058 0.259 7.039 1.00 . A A . 14 TYR HB3 1 1 1 194 1 1 14 TYR HD1 H 4.112 -1.487 8.084 1.00 . A A . 14 TYR HD1 1 1 1 195 1 1 14 TYR HD2 H 8.290 -1.318 9.079 1.00 . A A . 14 TYR HD2 1 1 1 196 1 1 14 TYR HE1 H 3.630 -2.519 10.291 1.00 . A A . 14 TYR HE1 1 1 1 197 1 1 14 TYR HE2 H 7.807 -2.348 11.284 1.00 . A A . 14 TYR HE2 1 1 1 198 1 1 14 TYR HH H 5.737 -3.984 12.132 1.00 . A A . 14 TYR HH 1 1 1 199 1 1 14 TYR N N 6.945 -1.641 4.847 1.00 . A A . 14 TYR N 1 1 1 200 1 1 14 TYR O O 3.630 -1.721 5.517 1.00 . A A . 14 TYR O 1 1 1 201 1 1 14 TYR OH O 5.422 -3.077 12.156 1.00 . A A . 14 TYR OH 1 1 1 202 1 1 15 GLN C C 2.756 -0.174 3.480 1.00 . A A . 15 GLN C 1 1 1 203 1 1 15 GLN CA C 3.369 0.766 4.511 1.00 . A A . 15 GLN CA 1 1 1 204 1 1 15 GLN CB C 3.667 2.117 3.857 1.00 . A A . 15 GLN CB 1 1 1 205 1 1 15 GLN CD C 4.298 4.341 4.795 1.00 . A A . 15 GLN CD 1 1 1 206 1 1 15 GLN CG C 3.231 3.245 4.791 1.00 . A A . 15 GLN CG 1 1 1 207 1 1 15 GLN H H 5.464 0.687 4.983 1.00 . A A . 15 GLN H 1 1 1 208 1 1 15 GLN HA H 2.680 0.904 5.331 1.00 . A A . 15 GLN HA 1 1 1 209 1 1 15 GLN HB2 H 4.728 2.196 3.666 1.00 . A A . 15 GLN HB2 1 1 1 210 1 1 15 GLN HB3 H 3.126 2.193 2.926 1.00 . A A . 15 GLN HB3 1 1 1 211 1 1 15 GLN HE21 H 3.058 5.744 5.455 1.00 . A A . 15 GLN HE21 1 1 1 212 1 1 15 GLN HE22 H 4.653 6.255 5.180 1.00 . A A . 15 GLN HE22 1 1 1 213 1 1 15 GLN HG2 H 2.292 3.654 4.447 1.00 . A A . 15 GLN HG2 1 1 1 214 1 1 15 GLN HG3 H 3.111 2.859 5.792 1.00 . A A . 15 GLN HG3 1 1 1 215 1 1 15 GLN N N 4.635 0.168 5.015 1.00 . A A . 15 GLN N 1 1 1 216 1 1 15 GLN NE2 N 3.976 5.547 5.175 1.00 . A A . 15 GLN NE2 1 1 1 217 1 1 15 GLN O O 1.571 -0.443 3.489 1.00 . A A . 15 GLN O 1 1 1 218 1 1 15 GLN OE1 O 5.437 4.097 4.448 1.00 . A A . 15 GLN OE1 1 1 1 219 1 1 16 LEU C C 2.304 -2.770 2.240 1.00 . A A . 16 LEU C 1 1 1 220 1 1 16 LEU CA C 3.035 -1.616 1.558 1.00 . A A . 16 LEU CA 1 1 1 221 1 1 16 LEU CB C 4.196 -2.164 0.748 1.00 . A A . 16 LEU CB 1 1 1 222 1 1 16 LEU CD1 C 6.128 -0.688 0.210 1.00 . A A . 16 LEU CD1 1 1 1 223 1 1 16 LEU CD2 C 4.698 -1.574 -1.614 1.00 . A A . 16 LEU CD2 1 1 1 224 1 1 16 LEU CG C 4.707 -1.068 -0.178 1.00 . A A . 16 LEU CG 1 1 1 225 1 1 16 LEU H H 4.516 -0.453 2.609 1.00 . A A . 16 LEU H 1 1 1 226 1 1 16 LEU HA H 2.364 -1.089 0.902 1.00 . A A . 16 LEU HA 1 1 1 227 1 1 16 LEU HB2 H 4.978 -2.477 1.417 1.00 . A A . 16 LEU HB2 1 1 1 228 1 1 16 LEU HB3 H 3.866 -3.006 0.162 1.00 . A A . 16 LEU HB3 1 1 1 229 1 1 16 LEU HD11 H 6.183 -0.554 1.279 1.00 . A A . 16 LEU HD11 1 1 1 230 1 1 16 LEU HD12 H 6.400 0.232 -0.284 1.00 . A A . 16 LEU HD12 1 1 1 231 1 1 16 LEU HD13 H 6.803 -1.475 -0.091 1.00 . A A . 16 LEU HD13 1 1 1 232 1 1 16 LEU HD21 H 3.727 -1.402 -2.047 1.00 . A A . 16 LEU HD21 1 1 1 233 1 1 16 LEU HD22 H 4.917 -2.632 -1.619 1.00 . A A . 16 LEU HD22 1 1 1 234 1 1 16 LEU HD23 H 5.449 -1.047 -2.182 1.00 . A A . 16 LEU HD23 1 1 1 235 1 1 16 LEU HG H 4.068 -0.201 -0.094 1.00 . A A . 16 LEU HG 1 1 1 236 1 1 16 LEU N N 3.561 -0.682 2.592 1.00 . A A . 16 LEU N 1 1 1 237 1 1 16 LEU O O 1.152 -3.043 1.964 1.00 . A A . 16 LEU O 1 1 1 238 1 1 17 GLU C C 0.978 -4.170 4.430 1.00 . A A . 17 GLU C 1 1 1 239 1 1 17 GLU CA C 2.329 -4.594 3.838 1.00 . A A . 17 GLU CA 1 1 1 240 1 1 17 GLU CB C 3.247 -5.073 4.964 1.00 . A A . 17 GLU CB 1 1 1 241 1 1 17 GLU CD C 4.712 -7.064 5.347 1.00 . A A . 17 GLU CD 1 1 1 242 1 1 17 GLU CG C 3.304 -6.602 4.963 1.00 . A A . 17 GLU CG 1 1 1 243 1 1 17 GLU H H 3.906 -3.211 3.329 1.00 . A A . 17 GLU H 1 1 1 244 1 1 17 GLU HA H 2.171 -5.400 3.140 1.00 . A A . 17 GLU HA 1 1 1 245 1 1 17 GLU HB2 H 4.241 -4.675 4.812 1.00 . A A . 17 GLU HB2 1 1 1 246 1 1 17 GLU HB3 H 2.864 -4.729 5.913 1.00 . A A . 17 GLU HB3 1 1 1 247 1 1 17 GLU HG2 H 2.591 -6.989 5.678 1.00 . A A . 17 GLU HG2 1 1 1 248 1 1 17 GLU HG3 H 3.062 -6.970 3.978 1.00 . A A . 17 GLU HG3 1 1 1 249 1 1 17 GLU N N 2.971 -3.450 3.130 1.00 . A A . 17 GLU N 1 1 1 250 1 1 17 GLU O O 0.156 -4.998 4.768 1.00 . A A . 17 GLU O 1 1 1 251 1 1 17 GLU OE1 O 5.385 -6.329 6.051 1.00 . A A . 17 GLU OE1 1 1 1 252 1 1 17 GLU OE2 O 5.093 -8.145 4.928 1.00 . A A . 17 GLU OE2 1 1 1 253 1 1 18 ASN C C -1.606 -2.285 4.048 1.00 . A A . 18 ASN C 1 1 1 254 1 1 18 ASN CA C -0.556 -2.440 5.151 1.00 . A A . 18 ASN CA 1 1 1 255 1 1 18 ASN CB C -0.356 -1.098 5.855 1.00 . A A . 18 ASN CB 1 1 1 256 1 1 18 ASN CG C -0.678 -1.255 7.343 1.00 . A A . 18 ASN CG 1 1 1 257 1 1 18 ASN H H 1.413 -2.237 4.300 1.00 . A A . 18 ASN H 1 1 1 258 1 1 18 ASN HA H -0.900 -3.171 5.868 1.00 . A A . 18 ASN HA 1 1 1 259 1 1 18 ASN HB2 H 0.669 -0.779 5.738 1.00 . A A . 18 ASN HB2 1 1 1 260 1 1 18 ASN HB3 H -1.016 -0.362 5.422 1.00 . A A . 18 ASN HB3 1 1 1 261 1 1 18 ASN HD21 H -0.573 0.692 7.719 1.00 . A A . 18 ASN HD21 1 1 1 262 1 1 18 ASN HD22 H -0.941 -0.287 9.056 1.00 . A A . 18 ASN HD22 1 1 1 263 1 1 18 ASN N N 0.741 -2.893 4.569 1.00 . A A . 18 ASN N 1 1 1 264 1 1 18 ASN ND2 N -0.735 -0.195 8.102 1.00 . A A . 18 ASN ND2 1 1 1 265 1 1 18 ASN O O -2.671 -1.741 4.267 1.00 . A A . 18 ASN O 1 1 1 266 1 1 18 ASN OD1 O -0.880 -2.353 7.819 1.00 . A A . 18 ASN OD1 1 1 1 267 1 1 19 TYR C C -2.374 -3.963 0.998 1.00 . A A . 19 TYR C 1 1 1 268 1 1 19 TYR CA C -2.313 -2.641 1.759 1.00 . A A . 19 TYR CA 1 1 1 269 1 1 19 TYR CB C -1.886 -1.521 0.808 1.00 . A A . 19 TYR CB 1 1 1 270 1 1 19 TYR CD1 C -2.959 0.391 2.048 1.00 . A A . 19 TYR CD1 1 1 1 271 1 1 19 TYR CD2 C -0.545 0.362 1.807 1.00 . A A . 19 TYR CD2 1 1 1 272 1 1 19 TYR CE1 C -2.874 1.594 2.760 1.00 . A A . 19 TYR CE1 1 1 1 273 1 1 19 TYR CE2 C -0.459 1.564 2.519 1.00 . A A . 19 TYR CE2 1 1 1 274 1 1 19 TYR CG C -1.795 -0.225 1.572 1.00 . A A . 19 TYR CG 1 1 1 275 1 1 19 TYR CZ C -1.623 2.181 2.996 1.00 . A A . 19 TYR CZ 1 1 1 276 1 1 19 TYR H H -0.460 -3.199 2.711 1.00 . A A . 19 TYR H 1 1 1 277 1 1 19 TYR HA H -3.287 -2.415 2.169 1.00 . A A . 19 TYR HA 1 1 1 278 1 1 19 TYR HB2 H -0.922 -1.759 0.382 1.00 . A A . 19 TYR HB2 1 1 1 279 1 1 19 TYR HB3 H -2.616 -1.423 0.018 1.00 . A A . 19 TYR HB3 1 1 1 280 1 1 19 TYR HD1 H -3.924 -0.061 1.865 1.00 . A A . 19 TYR HD1 1 1 1 281 1 1 19 TYR HD2 H 0.352 -0.114 1.439 1.00 . A A . 19 TYR HD2 1 1 1 282 1 1 19 TYR HE1 H -3.771 2.068 3.128 1.00 . A A . 19 TYR HE1 1 1 1 283 1 1 19 TYR HE2 H 0.506 2.016 2.701 1.00 . A A . 19 TYR HE2 1 1 1 284 1 1 19 TYR HH H -0.774 3.846 3.373 1.00 . A A . 19 TYR HH 1 1 1 285 1 1 19 TYR N N -1.323 -2.760 2.868 1.00 . A A . 19 TYR N 1 1 1 286 1 1 19 TYR O O -2.333 -3.996 -0.217 1.00 . A A . 19 TYR O 1 1 1 287 1 1 19 TYR OH O -1.537 3.365 3.697 1.00 . A A . 19 TYR OH 1 1 1 288 1 1 20 CYS C C -2.903 -7.459 2.030 1.00 . A A . 20 CYS C 1 1 1 289 1 1 20 CYS CA C -2.514 -6.376 1.020 1.00 . A A . 20 CYS CA 1 1 1 290 1 1 20 CYS CB C -1.135 -6.690 0.441 1.00 . A A . 20 CYS CB 1 1 1 291 1 1 20 CYS H H -2.486 -5.007 2.681 1.00 . A A . 20 CYS H 1 1 1 292 1 1 20 CYS HA H -3.243 -6.345 0.223 1.00 . A A . 20 CYS HA 1 1 1 293 1 1 20 CYS HB2 H -0.861 -5.924 -0.270 1.00 . A A . 20 CYS HB2 1 1 1 294 1 1 20 CYS HB3 H -0.409 -6.716 1.240 1.00 . A A . 20 CYS HB3 1 1 1 295 1 1 20 CYS N N -2.462 -5.056 1.703 1.00 . A A . 20 CYS N 1 1 1 296 1 1 20 CYS O O -2.790 -7.276 3.226 1.00 . A A . 20 CYS O 1 1 1 297 1 1 20 CYS SG S -1.180 -8.297 -0.388 1.00 . A A . 20 CYS SG 1 1 1 298 1 1 21 ASN C C -2.666 -10.749 2.520 1.00 . A A . 21 ASN C 1 1 1 299 1 1 21 ASN CA C -3.759 -9.679 2.491 1.00 . A A . 21 ASN CA 1 1 1 300 1 1 21 ASN CB C -5.072 -10.300 2.012 1.00 . A A . 21 ASN CB 1 1 1 301 1 1 21 ASN CG C -5.971 -9.203 1.441 1.00 . A A . 21 ASN CG 1 1 1 302 1 1 21 ASN H H -3.449 -8.715 0.591 1.00 . A A . 21 ASN H 1 1 1 303 1 1 21 ASN HA H -3.895 -9.274 3.483 1.00 . A A . 21 ASN HA 1 1 1 304 1 1 21 ASN HB2 H -4.865 -11.034 1.246 1.00 . A A . 21 ASN HB2 1 1 1 305 1 1 21 ASN HB3 H -5.571 -10.775 2.843 1.00 . A A . 21 ASN HB3 1 1 1 306 1 1 21 ASN HD21 H -7.496 -9.631 2.636 1.00 . A A . 21 ASN HD21 1 1 1 307 1 1 21 ASN HD22 H -7.757 -8.345 1.559 1.00 . A A . 21 ASN HD22 1 1 1 308 1 1 21 ASN N N -3.363 -8.587 1.559 1.00 . A A . 21 ASN N 1 1 1 309 1 1 21 ASN ND2 N -7.175 -9.047 1.917 1.00 . A A . 21 ASN ND2 1 1 1 310 1 1 21 ASN O O -2.793 -11.718 1.789 1.00 . A A . 21 ASN O 1 1 1 311 1 1 21 ASN OXT O -1.720 -10.581 3.272 1.00 . A A . 21 ASN OXT 1 1 1 312 1 1 21 ASN OD1 O -5.572 -8.477 0.551 1.00 . A A . 21 ASN OD1 1 1 1 313 2 2 1 PHE C C 13.242 -2.645 -0.641 1.00 . B B . 1 PHE C 1 1 1 314 2 2 1 PHE CA C 12.992 -3.736 -1.681 1.00 . B B . 1 PHE CA 1 1 1 315 2 2 1 PHE CB C 11.521 -4.152 -1.636 1.00 . B B . 1 PHE CB 1 1 1 316 2 2 1 PHE CD1 C 11.256 -3.508 -4.060 1.00 . B B . 1 PHE CD1 1 1 1 317 2 2 1 PHE CD2 C 9.591 -2.753 -2.462 1.00 . B B . 1 PHE CD2 1 1 1 318 2 2 1 PHE CE1 C 10.561 -2.859 -5.090 1.00 . B B . 1 PHE CE1 1 1 1 319 2 2 1 PHE CE2 C 8.897 -2.104 -3.493 1.00 . B B . 1 PHE CE2 1 1 1 320 2 2 1 PHE CG C 10.771 -3.454 -2.746 1.00 . B B . 1 PHE CG 1 1 1 321 2 2 1 PHE CZ C 9.382 -2.157 -4.807 1.00 . B B . 1 PHE CZ 1 1 1 322 2 2 1 PHE H1 H 14.088 -4.922 -0.367 1.00 . B B . 1 PHE H1 1 1 1 323 2 2 1 PHE H2 H 14.733 -4.846 -1.937 1.00 . B B . 1 PHE H2 1 1 1 324 2 2 1 PHE H3 H 13.352 -5.785 -1.629 1.00 . B B . 1 PHE H3 1 1 1 325 2 2 1 PHE HA H 13.229 -3.356 -2.663 1.00 . B B . 1 PHE HA 1 1 1 326 2 2 1 PHE HB2 H 11.445 -5.222 -1.765 1.00 . B B . 1 PHE HB2 1 1 1 327 2 2 1 PHE HB3 H 11.096 -3.872 -0.683 1.00 . B B . 1 PHE HB3 1 1 1 328 2 2 1 PHE HD1 H 12.164 -4.049 -4.278 1.00 . B B . 1 PHE HD1 1 1 1 329 2 2 1 PHE HD2 H 9.217 -2.711 -1.450 1.00 . B B . 1 PHE HD2 1 1 1 330 2 2 1 PHE HE1 H 10.934 -2.901 -6.102 1.00 . B B . 1 PHE HE1 1 1 1 331 2 2 1 PHE HE2 H 7.988 -1.563 -3.274 1.00 . B B . 1 PHE HE2 1 1 1 332 2 2 1 PHE HZ H 8.847 -1.658 -5.600 1.00 . B B . 1 PHE HZ 1 1 1 333 2 2 1 PHE N N 13.856 -4.911 -1.381 1.00 . B B . 1 PHE N 1 1 1 334 2 2 1 PHE O O 13.019 -2.834 0.538 1.00 . B B . 1 PHE O 1 1 1 335 2 2 2 VAL C C 12.715 0.473 0.013 1.00 . B B . 2 VAL C 1 1 1 336 2 2 2 VAL CA C 13.966 -0.404 -0.104 1.00 . B B . 2 VAL CA 1 1 1 337 2 2 2 VAL CB C 15.169 0.419 -0.597 1.00 . B B . 2 VAL CB 1 1 1 338 2 2 2 VAL CG1 C 14.717 1.490 -1.598 1.00 . B B . 2 VAL CG1 1 1 1 339 2 2 2 VAL CG2 C 15.858 1.088 0.597 1.00 . B B . 2 VAL CG2 1 1 1 340 2 2 2 VAL H H 13.876 -1.373 -2.024 1.00 . B B . 2 VAL H 1 1 1 341 2 2 2 VAL HA H 14.195 -0.827 0.864 1.00 . B B . 2 VAL HA 1 1 1 342 2 2 2 VAL HB H 15.868 -0.241 -1.084 1.00 . B B . 2 VAL HB 1 1 1 343 2 2 2 VAL HG11 H 13.715 1.269 -1.938 1.00 . B B . 2 VAL HG11 1 1 1 344 2 2 2 VAL HG12 H 15.388 1.500 -2.444 1.00 . B B . 2 VAL HG12 1 1 1 345 2 2 2 VAL HG13 H 14.728 2.458 -1.118 1.00 . B B . 2 VAL HG13 1 1 1 346 2 2 2 VAL HG21 H 16.089 2.114 0.351 1.00 . B B . 2 VAL HG21 1 1 1 347 2 2 2 VAL HG22 H 16.770 0.559 0.828 1.00 . B B . 2 VAL HG22 1 1 1 348 2 2 2 VAL HG23 H 15.201 1.061 1.454 1.00 . B B . 2 VAL HG23 1 1 1 349 2 2 2 VAL N N 13.703 -1.505 -1.067 1.00 . B B . 2 VAL N 1 1 1 350 2 2 2 VAL O O 11.604 0.016 -0.172 1.00 . B B . 2 VAL O 1 1 1 351 2 2 3 ASN C C 11.810 3.716 -0.645 1.00 . B B . 3 ASN C 1 1 1 352 2 2 3 ASN CA C 11.718 2.640 0.443 1.00 . B B . 3 ASN CA 1 1 1 353 2 2 3 ASN CB C 11.728 3.296 1.832 1.00 . B B . 3 ASN CB 1 1 1 354 2 2 3 ASN CG C 12.580 2.467 2.800 1.00 . B B . 3 ASN CG 1 1 1 355 2 2 3 ASN H H 13.791 2.073 0.457 1.00 . B B . 3 ASN H 1 1 1 356 2 2 3 ASN HA H 10.806 2.075 0.314 1.00 . B B . 3 ASN HA 1 1 1 357 2 2 3 ASN HB2 H 12.142 4.290 1.757 1.00 . B B . 3 ASN HB2 1 1 1 358 2 2 3 ASN HB3 H 10.717 3.356 2.207 1.00 . B B . 3 ASN HB3 1 1 1 359 2 2 3 ASN HD21 H 13.859 3.943 3.162 1.00 . B B . 3 ASN HD21 1 1 1 360 2 2 3 ASN HD22 H 14.176 2.490 3.980 1.00 . B B . 3 ASN HD22 1 1 1 361 2 2 3 ASN N N 12.889 1.728 0.315 1.00 . B B . 3 ASN N 1 1 1 362 2 2 3 ASN ND2 N 13.625 3.012 3.360 1.00 . B B . 3 ASN ND2 1 1 1 363 2 2 3 ASN O O 12.291 4.807 -0.414 1.00 . B B . 3 ASN O 1 1 1 364 2 2 3 ASN OD1 O 12.292 1.312 3.045 1.00 . B B . 3 ASN OD1 1 1 1 365 2 2 4 GLN C C 10.098 5.101 -3.151 1.00 . B B . 4 GLN C 1 1 1 366 2 2 4 GLN CA C 11.451 4.407 -2.947 1.00 . B B . 4 GLN CA 1 1 1 367 2 2 4 GLN CB C 11.886 3.698 -4.244 1.00 . B B . 4 GLN CB 1 1 1 368 2 2 4 GLN CD C 11.069 1.895 -5.779 1.00 . B B . 4 GLN CD 1 1 1 369 2 2 4 GLN CG C 10.666 3.143 -4.993 1.00 . B B . 4 GLN CG 1 1 1 370 2 2 4 GLN H H 10.999 2.515 -2.005 1.00 . B B . 4 GLN H 1 1 1 371 2 2 4 GLN HA H 12.190 5.151 -2.691 1.00 . B B . 4 GLN HA 1 1 1 372 2 2 4 GLN HB2 H 12.401 4.405 -4.879 1.00 . B B . 4 GLN HB2 1 1 1 373 2 2 4 GLN HB3 H 12.554 2.887 -4.001 1.00 . B B . 4 GLN HB3 1 1 1 374 2 2 4 GLN HE21 H 11.898 0.998 -4.212 1.00 . B B . 4 GLN HE21 1 1 1 375 2 2 4 GLN HE22 H 11.951 0.120 -5.664 1.00 . B B . 4 GLN HE22 1 1 1 376 2 2 4 GLN HG2 H 9.892 2.890 -4.285 1.00 . B B . 4 GLN HG2 1 1 1 377 2 2 4 GLN HG3 H 10.294 3.892 -5.680 1.00 . B B . 4 GLN HG3 1 1 1 378 2 2 4 GLN N N 11.369 3.408 -1.838 1.00 . B B . 4 GLN N 1 1 1 379 2 2 4 GLN NE2 N 11.691 0.924 -5.168 1.00 . B B . 4 GLN NE2 1 1 1 380 2 2 4 GLN O O 9.210 5.024 -2.321 1.00 . B B . 4 GLN O 1 1 1 381 2 2 4 GLN OE1 O 10.814 1.801 -6.964 1.00 . B B . 4 GLN OE1 1 1 1 382 2 2 5 HIS C C 7.629 5.509 -5.084 1.00 . B B . 5 HIS C 1 1 1 383 2 2 5 HIS CA C 8.664 6.496 -4.539 1.00 . B B . 5 HIS CA 1 1 1 384 2 2 5 HIS CB C 8.907 7.592 -5.581 1.00 . B B . 5 HIS CB 1 1 1 385 2 2 5 HIS CD2 C 10.421 9.173 -4.144 1.00 . B B . 5 HIS CD2 1 1 1 386 2 2 5 HIS CE1 C 9.177 10.950 -4.259 1.00 . B B . 5 HIS CE1 1 1 1 387 2 2 5 HIS CG C 9.318 8.867 -4.894 1.00 . B B . 5 HIS CG 1 1 1 388 2 2 5 HIS H H 10.678 5.830 -4.906 1.00 . B B . 5 HIS H 1 1 1 389 2 2 5 HIS HA H 8.292 6.943 -3.629 1.00 . B B . 5 HIS HA 1 1 1 390 2 2 5 HIS HB2 H 9.690 7.280 -6.256 1.00 . B B . 5 HIS HB2 1 1 1 391 2 2 5 HIS HB3 H 8.000 7.764 -6.140 1.00 . B B . 5 HIS HB3 1 1 1 392 2 2 5 HIS HD2 H 11.228 8.495 -3.906 1.00 . B B . 5 HIS HD2 1 1 1 393 2 2 5 HIS HE1 H 8.811 11.958 -4.128 1.00 . B B . 5 HIS HE1 1 1 1 394 2 2 5 HIS HE2 H 10.979 10.987 -3.198 1.00 . B B . 5 HIS HE2 1 1 1 395 2 2 5 HIS N N 9.944 5.783 -4.258 1.00 . B B . 5 HIS N 1 1 1 396 2 2 5 HIS ND1 N 8.537 10.002 -4.959 1.00 . B B . 5 HIS ND1 1 1 1 397 2 2 5 HIS NE2 N 10.334 10.489 -3.742 1.00 . B B . 5 HIS NE2 1 1 1 398 2 2 5 HIS O O 7.892 4.760 -6.005 1.00 . B B . 5 HIS O 1 1 1 399 2 2 6 LEU C C 4.424 5.384 -5.897 1.00 . B B . 6 LEU C 1 1 1 400 2 2 6 LEU CA C 5.386 4.593 -5.009 1.00 . B B . 6 LEU CA 1 1 1 401 2 2 6 LEU CB C 4.632 4.031 -3.804 1.00 . B B . 6 LEU CB 1 1 1 402 2 2 6 LEU CD1 C 6.435 2.339 -3.466 1.00 . B B . 6 LEU CD1 1 1 1 403 2 2 6 LEU CD2 C 4.188 1.984 -2.444 1.00 . B B . 6 LEU CD2 1 1 1 404 2 2 6 LEU CG C 4.932 2.539 -3.660 1.00 . B B . 6 LEU CG 1 1 1 405 2 2 6 LEU H H 6.257 6.132 -3.796 1.00 . B B . 6 LEU H 1 1 1 406 2 2 6 LEU HA H 5.827 3.784 -5.574 1.00 . B B . 6 LEU HA 1 1 1 407 2 2 6 LEU HB2 H 4.948 4.550 -2.911 1.00 . B B . 6 LEU HB2 1 1 1 408 2 2 6 LEU HB3 H 3.573 4.174 -3.945 1.00 . B B . 6 LEU HB3 1 1 1 409 2 2 6 LEU HD11 H 6.624 1.325 -3.150 1.00 . B B . 6 LEU HD11 1 1 1 410 2 2 6 LEU HD12 H 6.794 3.024 -2.712 1.00 . B B . 6 LEU HD12 1 1 1 411 2 2 6 LEU HD13 H 6.947 2.528 -4.398 1.00 . B B . 6 LEU HD13 1 1 1 412 2 2 6 LEU HD21 H 4.703 2.278 -1.542 1.00 . B B . 6 LEU HD21 1 1 1 413 2 2 6 LEU HD22 H 4.154 0.907 -2.504 1.00 . B B . 6 LEU HD22 1 1 1 414 2 2 6 LEU HD23 H 3.181 2.376 -2.427 1.00 . B B . 6 LEU HD23 1 1 1 415 2 2 6 LEU HG H 4.610 2.019 -4.551 1.00 . B B . 6 LEU HG 1 1 1 416 2 2 6 LEU N N 6.450 5.512 -4.528 1.00 . B B . 6 LEU N 1 1 1 417 2 2 6 LEU O O 3.751 6.282 -5.436 1.00 . B B . 6 LEU O 1 1 1 418 2 2 7 CYS C C 2.746 4.940 -9.059 1.00 . B B . 7 CYS C 1 1 1 419 2 2 7 CYS CA C 3.437 5.856 -8.041 1.00 . B B . 7 CYS CA 1 1 1 420 2 2 7 CYS CB C 4.236 6.925 -8.787 1.00 . B B . 7 CYS CB 1 1 1 421 2 2 7 CYS H H 4.909 4.362 -7.533 1.00 . B B . 7 CYS H 1 1 1 422 2 2 7 CYS HA H 2.692 6.338 -7.426 1.00 . B B . 7 CYS HA 1 1 1 423 2 2 7 CYS HB2 H 5.094 6.468 -9.259 1.00 . B B . 7 CYS HB2 1 1 1 424 2 2 7 CYS HB3 H 3.611 7.382 -9.540 1.00 . B B . 7 CYS HB3 1 1 1 425 2 2 7 CYS N N 4.356 5.080 -7.164 1.00 . B B . 7 CYS N 1 1 1 426 2 2 7 CYS O O 3.386 4.219 -9.797 1.00 . B B . 7 CYS O 1 1 1 427 2 2 7 CYS SG S 4.791 8.188 -7.615 1.00 . B B . 7 CYS SG 1 1 1 428 2 2 8 GLY C C 1.344 2.827 -10.358 1.00 . B B . 8 GLY C 1 1 1 429 2 2 8 GLY CA C 0.659 4.170 -10.084 1.00 . B B . 8 GLY CA 1 1 1 430 2 2 8 GLY H H 0.962 5.607 -8.510 1.00 . B B . 8 GLY H 1 1 1 431 2 2 8 GLY HA2 H -0.326 3.986 -9.681 1.00 . B B . 8 GLY HA2 1 1 1 432 2 2 8 GLY HA3 H 0.564 4.712 -11.013 1.00 . B B . 8 GLY HA3 1 1 1 433 2 2 8 GLY N N 1.440 4.997 -9.111 1.00 . B B . 8 GLY N 1 1 1 434 2 2 8 GLY O O 1.554 2.032 -9.463 1.00 . B B . 8 GLY O 1 1 1 435 2 2 9 SER C C 3.296 0.842 -10.871 1.00 . B B . 9 SER C 1 1 1 436 2 2 9 SER CA C 2.332 1.280 -11.973 1.00 . B B . 9 SER CA 1 1 1 437 2 2 9 SER CB C 3.105 1.460 -13.279 1.00 . B B . 9 SER CB 1 1 1 438 2 2 9 SER H H 1.477 3.232 -12.299 1.00 . B B . 9 SER H 1 1 1 439 2 2 9 SER HA H 1.576 0.522 -12.108 1.00 . B B . 9 SER HA 1 1 1 440 2 2 9 SER HB2 H 3.790 0.639 -13.410 1.00 . B B . 9 SER HB2 1 1 1 441 2 2 9 SER HB3 H 2.410 1.481 -14.109 1.00 . B B . 9 SER HB3 1 1 1 442 2 2 9 SER HG H 4.733 2.496 -13.532 1.00 . B B . 9 SER HG 1 1 1 443 2 2 9 SER N N 1.674 2.572 -11.601 1.00 . B B . 9 SER N 1 1 1 444 2 2 9 SER O O 3.113 -0.183 -10.247 1.00 . B B . 9 SER O 1 1 1 445 2 2 9 SER OG O 3.839 2.676 -13.229 1.00 . B B . 9 SER OG 1 1 1 446 2 2 10 ASP C C 4.496 0.834 -8.315 1.00 . B B . 10 ASP C 1 1 1 447 2 2 10 ASP CA C 5.281 1.231 -9.556 1.00 . B B . 10 ASP CA 1 1 1 448 2 2 10 ASP CB C 6.165 2.430 -9.223 1.00 . B B . 10 ASP CB 1 1 1 449 2 2 10 ASP CG C 6.920 2.873 -10.478 1.00 . B B . 10 ASP CG 1 1 1 450 2 2 10 ASP H H 4.448 2.437 -11.128 1.00 . B B . 10 ASP H 1 1 1 451 2 2 10 ASP HA H 5.888 0.401 -9.886 1.00 . B B . 10 ASP HA 1 1 1 452 2 2 10 ASP HB2 H 5.542 3.241 -8.865 1.00 . B B . 10 ASP HB2 1 1 1 453 2 2 10 ASP HB3 H 6.873 2.154 -8.457 1.00 . B B . 10 ASP HB3 1 1 1 454 2 2 10 ASP N N 4.318 1.610 -10.622 1.00 . B B . 10 ASP N 1 1 1 455 2 2 10 ASP O O 4.800 -0.135 -7.650 1.00 . B B . 10 ASP O 1 1 1 456 2 2 10 ASP OD1 O 6.392 2.680 -11.560 1.00 . B B . 10 ASP OD1 1 1 1 457 2 2 10 ASP OD2 O 8.013 3.397 -10.336 1.00 . B B . 10 ASP OD2 1 1 1 458 2 2 11 LEU C C 2.219 -0.193 -6.896 1.00 . B B . 11 LEU C 1 1 1 459 2 2 11 LEU CA C 2.656 1.265 -6.817 1.00 . B B . 11 LEU CA 1 1 1 460 2 2 11 LEU CB C 1.426 2.176 -6.832 1.00 . B B . 11 LEU CB 1 1 1 461 2 2 11 LEU CD1 C 1.875 2.371 -4.350 1.00 . B B . 11 LEU CD1 1 1 1 462 2 2 11 LEU CD2 C 0.016 3.633 -5.400 1.00 . B B . 11 LEU CD2 1 1 1 463 2 2 11 LEU CG C 0.801 2.326 -5.436 1.00 . B B . 11 LEU CG 1 1 1 464 2 2 11 LEU H H 3.258 2.355 -8.567 1.00 . B B . 11 LEU H 1 1 1 465 2 2 11 LEU HA H 3.236 1.425 -5.931 1.00 . B B . 11 LEU HA 1 1 1 466 2 2 11 LEU HB2 H 1.717 3.149 -7.194 1.00 . B B . 11 LEU HB2 1 1 1 467 2 2 11 LEU HB3 H 0.692 1.756 -7.504 1.00 . B B . 11 LEU HB3 1 1 1 468 2 2 11 LEU HD11 H 1.541 3.005 -3.539 1.00 . B B . 11 LEU HD11 1 1 1 469 2 2 11 LEU HD12 H 2.787 2.768 -4.762 1.00 . B B . 11 LEU HD12 1 1 1 470 2 2 11 LEU HD13 H 2.051 1.374 -3.974 1.00 . B B . 11 LEU HD13 1 1 1 471 2 2 11 LEU HD21 H 0.670 4.450 -5.670 1.00 . B B . 11 LEU HD21 1 1 1 472 2 2 11 LEU HD22 H -0.370 3.793 -4.406 1.00 . B B . 11 LEU HD22 1 1 1 473 2 2 11 LEU HD23 H -0.802 3.580 -6.103 1.00 . B B . 11 LEU HD23 1 1 1 474 2 2 11 LEU HG H 0.132 1.501 -5.249 1.00 . B B . 11 LEU HG 1 1 1 475 2 2 11 LEU N N 3.481 1.580 -8.008 1.00 . B B . 11 LEU N 1 1 1 476 2 2 11 LEU O O 2.492 -0.985 -6.017 1.00 . B B . 11 LEU O 1 1 1 477 2 2 12 ALA C C 2.339 -2.851 -8.274 1.00 . B B . 12 ALA C 1 1 1 478 2 2 12 ALA CA C 1.111 -1.964 -8.103 1.00 . B B . 12 ALA CA 1 1 1 479 2 2 12 ALA CB C 0.220 -2.096 -9.336 1.00 . B B . 12 ALA CB 1 1 1 480 2 2 12 ALA H H 1.353 0.098 -8.658 1.00 . B B . 12 ALA H 1 1 1 481 2 2 12 ALA HA H 0.562 -2.268 -7.225 1.00 . B B . 12 ALA HA 1 1 1 482 2 2 12 ALA HB1 H -0.547 -2.833 -9.148 1.00 . B B . 12 ALA HB1 1 1 1 483 2 2 12 ALA HB2 H 0.820 -2.407 -10.179 1.00 . B B . 12 ALA HB2 1 1 1 484 2 2 12 ALA HB3 H -0.238 -1.144 -9.551 1.00 . B B . 12 ALA HB3 1 1 1 485 2 2 12 ALA N N 1.553 -0.556 -7.956 1.00 . B B . 12 ALA N 1 1 1 486 2 2 12 ALA O O 2.484 -3.850 -7.606 1.00 . B B . 12 ALA O 1 1 1 487 2 2 13 GLU C C 5.168 -3.493 -8.029 1.00 . B B . 13 GLU C 1 1 1 488 2 2 13 GLU CA C 4.450 -3.319 -9.364 1.00 . B B . 13 GLU CA 1 1 1 489 2 2 13 GLU CB C 5.380 -2.624 -10.360 1.00 . B B . 13 GLU CB 1 1 1 490 2 2 13 GLU CD C 7.337 -3.001 -11.868 1.00 . B B . 13 GLU CD 1 1 1 491 2 2 13 GLU CG C 6.587 -3.520 -10.639 1.00 . B B . 13 GLU CG 1 1 1 492 2 2 13 GLU H H 3.102 -1.672 -9.686 1.00 . B B . 13 GLU H 1 1 1 493 2 2 13 GLU HA H 4.168 -4.289 -9.748 1.00 . B B . 13 GLU HA 1 1 1 494 2 2 13 GLU HB2 H 4.846 -2.440 -11.281 1.00 . B B . 13 GLU HB2 1 1 1 495 2 2 13 GLU HB3 H 5.718 -1.687 -9.944 1.00 . B B . 13 GLU HB3 1 1 1 496 2 2 13 GLU HG2 H 7.246 -3.511 -9.783 1.00 . B B . 13 GLU HG2 1 1 1 497 2 2 13 GLU HG3 H 6.251 -4.529 -10.825 1.00 . B B . 13 GLU HG3 1 1 1 498 2 2 13 GLU N N 3.231 -2.490 -9.160 1.00 . B B . 13 GLU N 1 1 1 499 2 2 13 GLU O O 5.718 -4.537 -7.739 1.00 . B B . 13 GLU O 1 1 1 500 2 2 13 GLU OE1 O 6.699 -2.399 -12.717 1.00 . B B . 13 GLU OE1 1 1 1 501 2 2 13 GLU OE2 O 8.535 -3.216 -11.941 1.00 . B B . 13 GLU OE2 1 1 1 502 2 2 14 ALA C C 5.073 -3.616 -5.041 1.00 . B B . 14 ALA C 1 1 1 503 2 2 14 ALA CA C 5.839 -2.605 -5.886 1.00 . B B . 14 ALA CA 1 1 1 504 2 2 14 ALA CB C 5.849 -1.249 -5.182 1.00 . B B . 14 ALA CB 1 1 1 505 2 2 14 ALA H H 4.706 -1.645 -7.449 1.00 . B B . 14 ALA H 1 1 1 506 2 2 14 ALA HA H 6.856 -2.951 -6.028 1.00 . B B . 14 ALA HA 1 1 1 507 2 2 14 ALA HB1 H 6.608 -0.621 -5.622 1.00 . B B . 14 ALA HB1 1 1 1 508 2 2 14 ALA HB2 H 6.062 -1.391 -4.132 1.00 . B B . 14 ALA HB2 1 1 1 509 2 2 14 ALA HB3 H 4.883 -0.779 -5.293 1.00 . B B . 14 ALA HB3 1 1 1 510 2 2 14 ALA N N 5.163 -2.481 -7.205 1.00 . B B . 14 ALA N 1 1 1 511 2 2 14 ALA O O 5.647 -4.524 -4.471 1.00 . B B . 14 ALA O 1 1 1 512 2 2 15 LEU C C 2.986 -5.790 -4.935 1.00 . B B . 15 LEU C 1 1 1 513 2 2 15 LEU CA C 2.985 -4.461 -4.178 1.00 . B B . 15 LEU CA 1 1 1 514 2 2 15 LEU CB C 1.546 -3.963 -4.031 1.00 . B B . 15 LEU CB 1 1 1 515 2 2 15 LEU CD1 C 0.203 -1.939 -3.481 1.00 . B B . 15 LEU CD1 1 1 1 516 2 2 15 LEU CD2 C 1.666 -2.971 -1.744 1.00 . B B . 15 LEU CD2 1 1 1 517 2 2 15 LEU CG C 1.528 -2.659 -3.235 1.00 . B B . 15 LEU CG 1 1 1 518 2 2 15 LEU H H 3.325 -2.756 -5.452 1.00 . B B . 15 LEU H 1 1 1 519 2 2 15 LEU HA H 3.433 -4.585 -3.200 1.00 . B B . 15 LEU HA 1 1 1 520 2 2 15 LEU HB2 H 1.122 -3.794 -5.011 1.00 . B B . 15 LEU HB2 1 1 1 521 2 2 15 LEU HB3 H 0.961 -4.708 -3.511 1.00 . B B . 15 LEU HB3 1 1 1 522 2 2 15 LEU HD11 H 0.380 -1.051 -4.070 1.00 . B B . 15 LEU HD11 1 1 1 523 2 2 15 LEU HD12 H -0.238 -1.663 -2.534 1.00 . B B . 15 LEU HD12 1 1 1 524 2 2 15 LEU HD13 H -0.469 -2.596 -4.013 1.00 . B B . 15 LEU HD13 1 1 1 525 2 2 15 LEU HD21 H 1.879 -2.061 -1.204 1.00 . B B . 15 LEU HD21 1 1 1 526 2 2 15 LEU HD22 H 2.472 -3.675 -1.597 1.00 . B B . 15 LEU HD22 1 1 1 527 2 2 15 LEU HD23 H 0.744 -3.398 -1.378 1.00 . B B . 15 LEU HD23 1 1 1 528 2 2 15 LEU HG H 2.346 -2.029 -3.553 1.00 . B B . 15 LEU HG 1 1 1 529 2 2 15 LEU N N 3.777 -3.484 -4.970 1.00 . B B . 15 LEU N 1 1 1 530 2 2 15 LEU O O 2.907 -6.856 -4.357 1.00 . B B . 15 LEU O 1 1 1 531 2 2 16 TYR C C 4.330 -7.775 -6.731 1.00 . B B . 16 TYR C 1 1 1 532 2 2 16 TYR CA C 3.101 -6.949 -7.079 1.00 . B B . 16 TYR CA 1 1 1 533 2 2 16 TYR CB C 3.199 -6.549 -8.554 1.00 . B B . 16 TYR CB 1 1 1 534 2 2 16 TYR CD1 C 1.918 -8.549 -9.386 1.00 . B B . 16 TYR CD1 1 1 1 535 2 2 16 TYR CD2 C 1.149 -6.328 -9.986 1.00 . B B . 16 TYR CD2 1 1 1 536 2 2 16 TYR CE1 C 0.856 -9.112 -10.106 1.00 . B B . 16 TYR CE1 1 1 1 537 2 2 16 TYR CE2 C 0.086 -6.888 -10.707 1.00 . B B . 16 TYR CE2 1 1 1 538 2 2 16 TYR CG C 2.061 -7.157 -9.328 1.00 . B B . 16 TYR CG 1 1 1 539 2 2 16 TYR CZ C -0.061 -8.281 -10.767 1.00 . B B . 16 TYR CZ 1 1 1 540 2 2 16 TYR H H 3.150 -4.838 -6.666 1.00 . B B . 16 TYR H 1 1 1 541 2 2 16 TYR HA H 2.204 -7.526 -6.912 1.00 . B B . 16 TYR HA 1 1 1 542 2 2 16 TYR HB2 H 3.159 -5.477 -8.642 1.00 . B B . 16 TYR HB2 1 1 1 543 2 2 16 TYR HB3 H 4.133 -6.904 -8.960 1.00 . B B . 16 TYR HB3 1 1 1 544 2 2 16 TYR HD1 H 2.630 -9.186 -8.874 1.00 . B B . 16 TYR HD1 1 1 1 545 2 2 16 TYR HD2 H 1.268 -5.254 -9.939 1.00 . B B . 16 TYR HD2 1 1 1 546 2 2 16 TYR HE1 H 0.744 -10.185 -10.154 1.00 . B B . 16 TYR HE1 1 1 1 547 2 2 16 TYR HE2 H -0.620 -6.248 -11.217 1.00 . B B . 16 TYR HE2 1 1 1 548 2 2 16 TYR HH H -1.746 -8.140 -11.655 1.00 . B B . 16 TYR HH 1 1 1 549 2 2 16 TYR N N 3.083 -5.718 -6.237 1.00 . B B . 16 TYR N 1 1 1 550 2 2 16 TYR O O 4.399 -8.958 -6.997 1.00 . B B . 16 TYR O 1 1 1 551 2 2 16 TYR OH O -1.107 -8.834 -11.477 1.00 . B B . 16 TYR OH 1 1 1 552 2 2 17 LEU C C 6.601 -8.176 -4.343 1.00 . B B . 17 LEU C 1 1 1 553 2 2 17 LEU CA C 6.564 -7.849 -5.844 1.00 . B B . 17 LEU CA 1 1 1 554 2 2 17 LEU CB C 7.704 -6.924 -6.231 1.00 . B B . 17 LEU CB 1 1 1 555 2 2 17 LEU CD1 C 9.003 -9.087 -6.207 1.00 . B B . 17 LEU CD1 1 1 1 556 2 2 17 LEU CD2 C 10.066 -6.954 -6.904 1.00 . B B . 17 LEU CD2 1 1 1 557 2 2 17 LEU CG C 9.050 -7.572 -5.958 1.00 . B B . 17 LEU CG 1 1 1 558 2 2 17 LEU H H 5.248 -6.183 -5.999 1.00 . B B . 17 LEU H 1 1 1 559 2 2 17 LEU HA H 6.635 -8.758 -6.419 1.00 . B B . 17 LEU HA 1 1 1 560 2 2 17 LEU HB2 H 7.630 -6.690 -7.283 1.00 . B B . 17 LEU HB2 1 1 1 561 2 2 17 LEU HB3 H 7.628 -6.010 -5.659 1.00 . B B . 17 LEU HB3 1 1 1 562 2 2 17 LEU HD11 H 9.918 -9.537 -5.851 1.00 . B B . 17 LEU HD11 1 1 1 563 2 2 17 LEU HD12 H 8.901 -9.274 -7.266 1.00 . B B . 17 LEU HD12 1 1 1 564 2 2 17 LEU HD13 H 8.166 -9.520 -5.686 1.00 . B B . 17 LEU HD13 1 1 1 565 2 2 17 LEU HD21 H 11.058 -7.107 -6.517 1.00 . B B . 17 LEU HD21 1 1 1 566 2 2 17 LEU HD22 H 9.868 -5.896 -6.997 1.00 . B B . 17 LEU HD22 1 1 1 567 2 2 17 LEU HD23 H 9.977 -7.423 -7.874 1.00 . B B . 17 LEU HD23 1 1 1 568 2 2 17 LEU HG H 9.331 -7.370 -4.940 1.00 . B B . 17 LEU HG 1 1 1 569 2 2 17 LEU N N 5.316 -7.142 -6.175 1.00 . B B . 17 LEU N 1 1 1 570 2 2 17 LEU O O 7.407 -8.960 -3.886 1.00 . B B . 17 LEU O 1 1 1 571 2 2 18 VAL C C 4.621 -8.954 -1.859 1.00 . B B . 18 VAL C 1 1 1 572 2 2 18 VAL CA C 5.707 -7.913 -2.115 1.00 . B B . 18 VAL CA 1 1 1 573 2 2 18 VAL CB C 5.421 -6.638 -1.307 1.00 . B B . 18 VAL CB 1 1 1 574 2 2 18 VAL CG1 C 6.058 -5.447 -2.009 1.00 . B B . 18 VAL CG1 1 1 1 575 2 2 18 VAL CG2 C 3.910 -6.397 -1.195 1.00 . B B . 18 VAL CG2 1 1 1 576 2 2 18 VAL H H 5.062 -6.982 -3.948 1.00 . B B . 18 VAL H 1 1 1 577 2 2 18 VAL HA H 6.667 -8.318 -1.826 1.00 . B B . 18 VAL HA 1 1 1 578 2 2 18 VAL HB H 5.845 -6.738 -0.320 1.00 . B B . 18 VAL HB 1 1 1 579 2 2 18 VAL HG11 H 6.630 -4.876 -1.295 1.00 . B B . 18 VAL HG11 1 1 1 580 2 2 18 VAL HG12 H 5.283 -4.826 -2.431 1.00 . B B . 18 VAL HG12 1 1 1 581 2 2 18 VAL HG13 H 6.708 -5.800 -2.795 1.00 . B B . 18 VAL HG13 1 1 1 582 2 2 18 VAL HG21 H 3.492 -7.075 -0.466 1.00 . B B . 18 VAL HG21 1 1 1 583 2 2 18 VAL HG22 H 3.446 -6.568 -2.155 1.00 . B B . 18 VAL HG22 1 1 1 584 2 2 18 VAL HG23 H 3.732 -5.378 -0.884 1.00 . B B . 18 VAL HG23 1 1 1 585 2 2 18 VAL N N 5.721 -7.601 -3.571 1.00 . B B . 18 VAL N 1 1 1 586 2 2 18 VAL O O 4.768 -9.842 -1.043 1.00 . B B . 18 VAL O 1 1 1 587 2 2 19 CYS C C 2.345 -10.723 -3.604 1.00 . B B . 19 CYS C 1 1 1 588 2 2 19 CYS CA C 2.425 -9.811 -2.377 1.00 . B B . 19 CYS CA 1 1 1 589 2 2 19 CYS CB C 1.113 -9.046 -2.207 1.00 . B B . 19 CYS CB 1 1 1 590 2 2 19 CYS H H 3.441 -8.116 -3.212 1.00 . B B . 19 CYS H 1 1 1 591 2 2 19 CYS HA H 2.614 -10.402 -1.496 1.00 . B B . 19 CYS HA 1 1 1 592 2 2 19 CYS HB2 H 1.205 -8.066 -2.655 1.00 . B B . 19 CYS HB2 1 1 1 593 2 2 19 CYS HB3 H 0.313 -9.588 -2.688 1.00 . B B . 19 CYS HB3 1 1 1 594 2 2 19 CYS N N 3.531 -8.843 -2.560 1.00 . B B . 19 CYS N 1 1 1 595 2 2 19 CYS O O 2.063 -11.901 -3.498 1.00 . B B . 19 CYS O 1 1 1 596 2 2 19 CYS SG S 0.752 -8.875 -0.443 1.00 . B B . 19 CYS SG 1 1 1 597 2 2 20 GLY C C 1.207 -11.750 -6.087 1.00 . B B . 20 GLY C 1 1 1 598 2 2 20 GLY CA C 2.549 -11.023 -6.004 1.00 . B B . 20 GLY CA 1 1 1 599 2 2 20 GLY H H 2.829 -9.238 -4.829 1.00 . B B . 20 GLY H 1 1 1 600 2 2 20 GLY HA2 H 2.671 -10.389 -6.871 1.00 . B B . 20 GLY HA2 1 1 1 601 2 2 20 GLY HA3 H 3.346 -11.751 -5.977 1.00 . B B . 20 GLY HA3 1 1 1 602 2 2 20 GLY N N 2.599 -10.189 -4.768 1.00 . B B . 20 GLY N 1 1 1 603 2 2 20 GLY O O 0.247 -11.242 -6.634 1.00 . B B . 20 GLY O 1 1 1 604 2 2 21 GLU C C -0.897 -13.508 -4.270 1.00 . B B . 21 GLU C 1 1 1 605 2 2 21 GLU CA C -0.156 -13.693 -5.595 1.00 . B B . 21 GLU CA 1 1 1 606 2 2 21 GLU CB C 0.097 -15.193 -5.832 1.00 . B B . 21 GLU CB 1 1 1 607 2 2 21 GLU CD C 1.982 -15.487 -4.214 1.00 . B B . 21 GLU CD 1 1 1 608 2 2 21 GLU CG C 1.587 -15.521 -5.692 1.00 . B B . 21 GLU CG 1 1 1 609 2 2 21 GLU H H 1.915 -13.321 -5.108 1.00 . B B . 21 GLU H 1 1 1 610 2 2 21 GLU HA H -0.766 -13.303 -6.398 1.00 . B B . 21 GLU HA 1 1 1 611 2 2 21 GLU HB2 H -0.462 -15.766 -5.108 1.00 . B B . 21 GLU HB2 1 1 1 612 2 2 21 GLU HB3 H -0.232 -15.456 -6.825 1.00 . B B . 21 GLU HB3 1 1 1 613 2 2 21 GLU HG2 H 1.777 -16.506 -6.094 1.00 . B B . 21 GLU HG2 1 1 1 614 2 2 21 GLU HG3 H 2.170 -14.793 -6.235 1.00 . B B . 21 GLU HG3 1 1 1 615 2 2 21 GLU N N 1.130 -12.935 -5.547 1.00 . B B . 21 GLU N 1 1 1 616 2 2 21 GLU O O -2.024 -13.935 -4.114 1.00 . B B . 21 GLU O 1 1 1 617 2 2 21 GLU OE1 O 1.735 -16.468 -3.533 1.00 . B B . 21 GLU OE1 1 1 1 618 2 2 21 GLU OE2 O 2.524 -14.481 -3.789 1.00 . B B . 21 GLU OE2 1 1 1 619 2 2 22 ARG C C -2.178 -11.769 -2.208 1.00 . B B . 22 ARG C 1 1 1 620 2 2 22 ARG CA C -0.946 -12.657 -2.005 1.00 . B B . 22 ARG CA 1 1 1 621 2 2 22 ARG CB C 0.034 -11.977 -1.047 1.00 . B B . 22 ARG CB 1 1 1 622 2 2 22 ARG CD C 0.349 -13.901 0.520 1.00 . B B . 22 ARG CD 1 1 1 623 2 2 22 ARG CG C 1.032 -13.009 -0.518 1.00 . B B . 22 ARG CG 1 1 1 624 2 2 22 ARG CZ C 2.406 -14.014 1.798 1.00 . B B . 22 ARG CZ 1 1 1 625 2 2 22 ARG H H 0.631 -12.533 -3.461 1.00 . B B . 22 ARG H 1 1 1 626 2 2 22 ARG HA H -1.251 -13.609 -1.596 1.00 . B B . 22 ARG HA 1 1 1 627 2 2 22 ARG HB2 H 0.566 -11.201 -1.572 1.00 . B B . 22 ARG HB2 1 1 1 628 2 2 22 ARG HB3 H -0.507 -11.544 -0.219 1.00 . B B . 22 ARG HB3 1 1 1 629 2 2 22 ARG HD2 H -0.658 -13.550 0.687 1.00 . B B . 22 ARG HD2 1 1 1 630 2 2 22 ARG HD3 H 0.318 -14.917 0.155 1.00 . B B . 22 ARG HD3 1 1 1 631 2 2 22 ARG HE H 0.637 -13.706 2.646 1.00 . B B . 22 ARG HE 1 1 1 632 2 2 22 ARG HG2 H 1.387 -13.617 -1.338 1.00 . B B . 22 ARG HG2 1 1 1 633 2 2 22 ARG HG3 H 1.868 -12.502 -0.059 1.00 . B B . 22 ARG HG3 1 1 1 634 2 2 22 ARG HH11 H 2.325 -15.921 1.194 1.00 . B B . 22 ARG HH11 1 1 1 635 2 2 22 ARG HH12 H 3.914 -15.283 1.451 1.00 . B B . 22 ARG HH12 1 1 1 636 2 2 22 ARG HH21 H 2.790 -12.147 2.409 1.00 . B B . 22 ARG HH21 1 1 1 637 2 2 22 ARG HH22 H 4.177 -13.148 2.141 1.00 . B B . 22 ARG HH22 1 1 1 638 2 2 22 ARG N N -0.276 -12.872 -3.316 1.00 . B B . 22 ARG N 1 1 1 639 2 2 22 ARG NE N 1.110 -13.855 1.801 1.00 . B B . 22 ARG NE 1 1 1 640 2 2 22 ARG NH1 N 2.923 -15.162 1.454 1.00 . B B . 22 ARG NH1 1 1 1 641 2 2 22 ARG NH2 N 3.185 -13.026 2.143 1.00 . B B . 22 ARG NH2 1 1 1 642 2 2 22 ARG O O -3.011 -11.638 -1.332 1.00 . B B . 22 ARG O 1 1 1 643 2 2 23 GLY C C -3.325 -8.981 -2.831 1.00 . B B . 23 GLY C 1 1 1 644 2 2 23 GLY CA C -3.478 -10.282 -3.617 1.00 . B B . 23 GLY CA 1 1 1 645 2 2 23 GLY H H -1.618 -11.279 -4.050 1.00 . B B . 23 GLY H 1 1 1 646 2 2 23 GLY HA2 H -3.536 -10.062 -4.674 1.00 . B B . 23 GLY HA2 1 1 1 647 2 2 23 GLY HA3 H -4.380 -10.785 -3.302 1.00 . B B . 23 GLY HA3 1 1 1 648 2 2 23 GLY N N -2.300 -11.160 -3.357 1.00 . B B . 23 GLY N 1 1 1 649 2 2 23 GLY O O -3.521 -8.944 -1.633 1.00 . B B . 23 GLY O 1 1 1 650 2 2 24 PHE C C -3.823 -5.599 -3.275 1.00 . B B . 24 PHE C 1 1 1 651 2 2 24 PHE CA C -2.795 -6.615 -2.778 1.00 . B B . 24 PHE CA 1 1 1 652 2 2 24 PHE CB C -1.386 -6.081 -3.042 1.00 . B B . 24 PHE CB 1 1 1 653 2 2 24 PHE CD1 C -0.717 -7.022 -5.282 1.00 . B B . 24 PHE CD1 1 1 1 654 2 2 24 PHE CD2 C -1.461 -4.714 -5.160 1.00 . B B . 24 PHE CD2 1 1 1 655 2 2 24 PHE CE1 C -0.531 -6.889 -6.665 1.00 . B B . 24 PHE CE1 1 1 1 656 2 2 24 PHE CE2 C -1.275 -4.582 -6.542 1.00 . B B . 24 PHE CE2 1 1 1 657 2 2 24 PHE CG C -1.182 -5.935 -4.530 1.00 . B B . 24 PHE CG 1 1 1 658 2 2 24 PHE CZ C -0.810 -5.669 -7.295 1.00 . B B . 24 PHE CZ 1 1 1 659 2 2 24 PHE H H -2.811 -7.964 -4.459 1.00 . B B . 24 PHE H 1 1 1 660 2 2 24 PHE HA H -2.929 -6.769 -1.721 1.00 . B B . 24 PHE HA 1 1 1 661 2 2 24 PHE HB2 H -1.269 -5.118 -2.564 1.00 . B B . 24 PHE HB2 1 1 1 662 2 2 24 PHE HB3 H -0.657 -6.770 -2.645 1.00 . B B . 24 PHE HB3 1 1 1 663 2 2 24 PHE HD1 H -0.503 -7.962 -4.796 1.00 . B B . 24 PHE HD1 1 1 1 664 2 2 24 PHE HD2 H -1.819 -3.877 -4.580 1.00 . B B . 24 PHE HD2 1 1 1 665 2 2 24 PHE HE1 H -0.175 -7.728 -7.245 1.00 . B B . 24 PHE HE1 1 1 1 666 2 2 24 PHE HE2 H -1.491 -3.642 -7.028 1.00 . B B . 24 PHE HE2 1 1 1 667 2 2 24 PHE HZ H -0.666 -5.568 -8.360 1.00 . B B . 24 PHE HZ 1 1 1 668 2 2 24 PHE N N -2.970 -7.912 -3.494 1.00 . B B . 24 PHE N 1 1 1 669 2 2 24 PHE O O -3.966 -5.373 -4.461 1.00 . B B . 24 PHE O 1 1 1 670 2 2 25 PHE C C -5.002 -2.562 -2.600 1.00 . B B . 25 PHE C 1 1 1 671 2 2 25 PHE CA C -5.556 -3.978 -2.791 1.00 . B B . 25 PHE CA 1 1 1 672 2 2 25 PHE CB C -6.822 -4.149 -1.947 1.00 . B B . 25 PHE CB 1 1 1 673 2 2 25 PHE CD1 C -6.441 -2.798 0.151 1.00 . B B . 25 PHE CD1 1 1 1 674 2 2 25 PHE CD2 C -6.189 -5.210 0.253 1.00 . B B . 25 PHE CD2 1 1 1 675 2 2 25 PHE CE1 C -6.121 -2.708 1.513 1.00 . B B . 25 PHE CE1 1 1 1 676 2 2 25 PHE CE2 C -5.869 -5.120 1.614 1.00 . B B . 25 PHE CE2 1 1 1 677 2 2 25 PHE CG C -6.474 -4.049 -0.479 1.00 . B B . 25 PHE CG 1 1 1 678 2 2 25 PHE CZ C -5.836 -3.869 2.244 1.00 . B B . 25 PHE CZ 1 1 1 679 2 2 25 PHE H H -4.405 -5.177 -1.423 1.00 . B B . 25 PHE H 1 1 1 680 2 2 25 PHE HA H -5.795 -4.130 -3.830 1.00 . B B . 25 PHE HA 1 1 1 681 2 2 25 PHE HB2 H -7.531 -3.376 -2.202 1.00 . B B . 25 PHE HB2 1 1 1 682 2 2 25 PHE HB3 H -7.258 -5.117 -2.147 1.00 . B B . 25 PHE HB3 1 1 1 683 2 2 25 PHE HD1 H -6.661 -1.904 -0.411 1.00 . B B . 25 PHE HD1 1 1 1 684 2 2 25 PHE HD2 H -6.215 -6.175 -0.232 1.00 . B B . 25 PHE HD2 1 1 1 685 2 2 25 PHE HE1 H -6.095 -1.743 1.999 1.00 . B B . 25 PHE HE1 1 1 1 686 2 2 25 PHE HE2 H -5.649 -6.014 2.177 1.00 . B B . 25 PHE HE2 1 1 1 687 2 2 25 PHE HZ H -5.590 -3.799 3.293 1.00 . B B . 25 PHE HZ 1 1 1 688 2 2 25 PHE N N -4.538 -4.981 -2.374 1.00 . B B . 25 PHE N 1 1 1 689 2 2 25 PHE O O -4.377 -2.258 -1.603 1.00 . B B . 25 PHE O 1 1 1 690 2 2 26 TYR C C -5.873 0.684 -3.764 1.00 . B B . 26 TYR C 1 1 1 691 2 2 26 TYR CA C -4.731 -0.293 -3.415 1.00 . B B . 26 TYR CA 1 1 1 692 2 2 26 TYR CB C -3.532 -0.098 -4.363 1.00 . B B . 26 TYR CB 1 1 1 693 2 2 26 TYR CD1 C -4.776 -0.721 -6.460 1.00 . B B . 26 TYR CD1 1 1 1 694 2 2 26 TYR CD2 C -3.763 1.478 -6.309 1.00 . B B . 26 TYR CD2 1 1 1 695 2 2 26 TYR CE1 C -5.266 -0.408 -7.733 1.00 . B B . 26 TYR CE1 1 1 1 696 2 2 26 TYR CE2 C -4.247 1.791 -7.584 1.00 . B B . 26 TYR CE2 1 1 1 697 2 2 26 TYR CG C -4.025 0.221 -5.751 1.00 . B B . 26 TYR CG 1 1 1 698 2 2 26 TYR CZ C -5.002 0.849 -8.297 1.00 . B B . 26 TYR CZ 1 1 1 699 2 2 26 TYR H H -5.746 -1.954 -4.340 1.00 . B B . 26 TYR H 1 1 1 700 2 2 26 TYR HA H -4.415 -0.122 -2.397 1.00 . B B . 26 TYR HA 1 1 1 701 2 2 26 TYR HB2 H -2.920 0.717 -4.004 1.00 . B B . 26 TYR HB2 1 1 1 702 2 2 26 TYR HB3 H -2.944 -1.003 -4.390 1.00 . B B . 26 TYR HB3 1 1 1 703 2 2 26 TYR HD1 H -4.977 -1.690 -6.026 1.00 . B B . 26 TYR HD1 1 1 1 704 2 2 26 TYR HD2 H -3.180 2.203 -5.758 1.00 . B B . 26 TYR HD2 1 1 1 705 2 2 26 TYR HE1 H -5.850 -1.134 -8.277 1.00 . B B . 26 TYR HE1 1 1 1 706 2 2 26 TYR HE2 H -4.044 2.761 -8.012 1.00 . B B . 26 TYR HE2 1 1 1 707 2 2 26 TYR HH H -6.191 1.801 -9.447 1.00 . B B . 26 TYR HH 1 1 1 708 2 2 26 TYR N N -5.234 -1.690 -3.546 1.00 . B B . 26 TYR N 1 1 1 709 2 2 26 TYR O O -5.732 1.561 -4.592 1.00 . B B . 26 TYR O 1 1 1 710 2 2 26 TYR OH O -5.485 1.159 -9.552 1.00 . B B . 26 TYR OH 1 1 1 711 2 2 27 THR C C -7.743 2.836 -3.724 1.00 . B B . 27 THR C 1 1 1 712 2 2 27 THR CA C -8.181 1.404 -3.412 1.00 . B B . 27 THR CA 1 1 1 713 2 2 27 THR CB C -9.092 1.427 -2.188 1.00 . B B . 27 THR CB 1 1 1 714 2 2 27 THR CG2 C -8.249 1.221 -0.931 1.00 . B B . 27 THR CG2 1 1 1 715 2 2 27 THR H H -7.089 -0.204 -2.480 1.00 . B B . 27 THR H 1 1 1 716 2 2 27 THR HA H -8.730 1.009 -4.253 1.00 . B B . 27 THR HA 1 1 1 717 2 2 27 THR HB H -9.820 0.639 -2.268 1.00 . B B . 27 THR HB 1 1 1 718 2 2 27 THR HG1 H -10.622 2.581 -2.518 1.00 . B B . 27 THR HG1 1 1 1 719 2 2 27 THR HG21 H -7.221 1.479 -1.146 1.00 . B B . 27 THR HG21 1 1 1 720 2 2 27 THR HG22 H -8.303 0.187 -0.628 1.00 . B B . 27 THR HG22 1 1 1 721 2 2 27 THR HG23 H -8.621 1.852 -0.140 1.00 . B B . 27 THR HG23 1 1 1 722 2 2 27 THR N N -7.004 0.518 -3.136 1.00 . B B . 27 THR N 1 1 1 723 2 2 27 THR O O -6.654 3.261 -3.392 1.00 . B B . 27 THR O 1 1 1 724 2 2 27 THR OG1 O -9.754 2.682 -2.120 1.00 . B B . 27 THR OG1 1 1 1 725 2 2 28 LYS C C -8.388 5.883 -3.463 1.00 . B B . 28 LYS C 1 1 1 726 2 2 28 LYS CA C -8.266 4.992 -4.705 1.00 . B B . 28 LYS CA 1 1 1 727 2 2 28 LYS CB C -9.234 5.502 -5.781 1.00 . B B . 28 LYS CB 1 1 1 728 2 2 28 LYS CD C -10.082 5.182 -8.109 1.00 . B B . 28 LYS CD 1 1 1 729 2 2 28 LYS CE C -11.446 4.614 -7.718 1.00 . B B . 28 LYS CE 1 1 1 730 2 2 28 LYS CG C -9.029 4.733 -7.093 1.00 . B B . 28 LYS CG 1 1 1 731 2 2 28 LYS H H -9.479 3.211 -4.600 1.00 . B B . 28 LYS H 1 1 1 732 2 2 28 LYS HA H -7.253 5.039 -5.077 1.00 . B B . 28 LYS HA 1 1 1 733 2 2 28 LYS HB2 H -10.249 5.365 -5.440 1.00 . B B . 28 LYS HB2 1 1 1 734 2 2 28 LYS HB3 H -9.054 6.552 -5.953 1.00 . B B . 28 LYS HB3 1 1 1 735 2 2 28 LYS HD2 H -10.131 6.262 -8.120 1.00 . B B . 28 LYS HD2 1 1 1 736 2 2 28 LYS HD3 H -9.812 4.824 -9.091 1.00 . B B . 28 LYS HD3 1 1 1 737 2 2 28 LYS HE2 H -11.342 3.567 -7.473 1.00 . B B . 28 LYS HE2 1 1 1 738 2 2 28 LYS HE3 H -11.827 5.148 -6.860 1.00 . B B . 28 LYS HE3 1 1 1 739 2 2 28 LYS HG2 H -8.043 4.936 -7.485 1.00 . B B . 28 LYS HG2 1 1 1 740 2 2 28 LYS HG3 H -9.137 3.673 -6.917 1.00 . B B . 28 LYS HG3 1 1 1 741 2 2 28 LYS HZ1 H -13.350 4.946 -8.494 1.00 . B B . 28 LYS HZ1 1 1 1 742 2 2 28 LYS HZ2 H -12.396 3.895 -9.427 1.00 . B B . 28 LYS HZ2 1 1 1 743 2 2 28 LYS HZ3 H -12.096 5.567 -9.452 1.00 . B B . 28 LYS HZ3 1 1 1 744 2 2 28 LYS N N -8.604 3.582 -4.356 1.00 . B B . 28 LYS N 1 1 1 745 2 2 28 LYS NZ N -12.394 4.767 -8.858 1.00 . B B . 28 LYS NZ 1 1 1 746 2 2 28 LYS O O -9.081 5.547 -2.524 1.00 . B B . 28 LYS O 1 1 1 747 2 2 29 PRO C C -8.982 8.832 -2.450 1.00 . B B . 29 PRO C 1 1 1 748 2 2 29 PRO CA C -7.706 7.984 -2.409 1.00 . B B . 29 PRO CA 1 1 1 749 2 2 29 PRO CB C -6.475 8.847 -2.704 1.00 . B B . 29 PRO CB 1 1 1 750 2 2 29 PRO CD C -6.866 7.385 -4.662 1.00 . B B . 29 PRO CD 1 1 1 751 2 2 29 PRO CG C -6.182 8.690 -4.215 1.00 . B B . 29 PRO CG 1 1 1 752 2 2 29 PRO HA H -7.597 7.495 -1.455 1.00 . B B . 29 PRO HA 1 1 1 753 2 2 29 PRO HB2 H -6.685 9.882 -2.469 1.00 . B B . 29 PRO HB2 1 1 1 754 2 2 29 PRO HB3 H -5.630 8.501 -2.132 1.00 . B B . 29 PRO HB3 1 1 1 755 2 2 29 PRO HD2 H -7.477 7.560 -5.537 1.00 . B B . 29 PRO HD2 1 1 1 756 2 2 29 PRO HD3 H -6.131 6.620 -4.857 1.00 . B B . 29 PRO HD3 1 1 1 757 2 2 29 PRO HG2 H -6.590 9.530 -4.759 1.00 . B B . 29 PRO HG2 1 1 1 758 2 2 29 PRO HG3 H -5.119 8.620 -4.381 1.00 . B B . 29 PRO HG3 1 1 1 759 2 2 29 PRO N N -7.705 7.001 -3.508 1.00 . B B . 29 PRO N 1 1 1 760 2 2 29 PRO O O -9.766 8.743 -3.374 1.00 . B B . 29 PRO O 1 1 1 761 2 2 30 THR C C -10.265 11.618 -2.497 1.00 . B B . 30 THR C 1 1 1 762 2 2 30 THR CA C -10.414 10.511 -1.450 1.00 . B B . 30 THR CA 1 1 1 763 2 2 30 THR CB C -10.591 11.140 -0.066 1.00 . B B . 30 THR CB 1 1 1 764 2 2 30 THR CG2 C -12.080 11.239 0.268 1.00 . B B . 30 THR CG2 1 1 1 765 2 2 30 THR H H -8.547 9.718 -0.725 1.00 . B B . 30 THR H 1 1 1 766 2 2 30 THR HA H -11.279 9.907 -1.685 1.00 . B B . 30 THR HA 1 1 1 767 2 2 30 THR HB H -10.160 12.130 -0.061 1.00 . B B . 30 THR HB 1 1 1 768 2 2 30 THR HG1 H -10.178 10.668 1.776 1.00 . B B . 30 THR HG1 1 1 1 769 2 2 30 THR HG21 H -12.640 11.433 -0.635 1.00 . B B . 30 THR HG21 1 1 1 770 2 2 30 THR HG22 H -12.239 12.044 0.970 1.00 . B B . 30 THR HG22 1 1 1 771 2 2 30 THR HG23 H -12.413 10.309 0.705 1.00 . B B . 30 THR HG23 1 1 1 772 2 2 30 THR N N -9.193 9.657 -1.459 1.00 . B B . 30 THR N 1 1 1 773 2 2 30 THR O O -11.032 12.566 -2.442 1.00 . B B . 30 THR O 1 1 1 774 2 2 30 THR OXT O -9.387 11.500 -3.335 1.00 . B B . 30 THR OXT 1 1 1 775 2 2 30 THR OG1 O -9.940 10.335 0.908 1.00 . B B . 30 THR OG1 1 1 2 776 1 1 1 GLY C C -3.838 7.080 0.099 1.00 . A A . 1 GLY C 1 1 2 777 1 1 1 GLY CA C -5.303 7.358 0.166 1.00 . A A . 1 GLY CA 1 1 2 778 1 1 1 GLY H1 H -5.814 5.409 0.815 1.00 . A A . 1 GLY H1 1 1 2 779 1 1 1 GLY H2 H -7.158 6.376 0.436 1.00 . A A . 1 GLY H2 1 1 2 780 1 1 1 GLY H3 H -6.306 6.634 1.883 1.00 . A A . 1 GLY H3 1 1 2 781 1 1 1 GLY HA2 H -5.276 7.192 -0.794 1.00 . A A . 1 GLY HA2 1 1 2 782 1 1 1 GLY HA3 H -5.690 8.426 0.433 1.00 . A A . 1 GLY HA3 1 1 2 783 1 1 1 GLY N N -6.218 6.365 0.882 1.00 . A A . 1 GLY N 1 1 2 784 1 1 1 GLY O O -3.039 7.783 0.685 1.00 . A A . 1 GLY O 1 1 2 785 1 1 2 ILE C C -1.499 6.137 -2.101 1.00 . A A . 2 ILE C 1 1 2 786 1 1 2 ILE CA C -1.993 5.737 -0.715 1.00 . A A . 2 ILE CA 1 1 2 787 1 1 2 ILE CB C -1.789 4.238 -0.510 1.00 . A A . 2 ILE CB 1 1 2 788 1 1 2 ILE CD1 C -0.082 2.424 -0.287 1.00 . A A . 2 ILE CD1 1 1 2 789 1 1 2 ILE CG1 C -0.302 3.893 -0.649 1.00 . A A . 2 ILE CG1 1 1 2 790 1 1 2 ILE CG2 C -2.590 3.471 -1.560 1.00 . A A . 2 ILE CG2 1 1 2 791 1 1 2 ILE H H -4.101 5.505 -1.088 1.00 . A A . 2 ILE H 1 1 2 792 1 1 2 ILE HA H -1.447 6.284 0.035 1.00 . A A . 2 ILE HA 1 1 2 793 1 1 2 ILE HB H -2.134 3.966 0.477 1.00 . A A . 2 ILE HB 1 1 2 794 1 1 2 ILE HD11 H 0.203 1.873 -1.170 1.00 . A A . 2 ILE HD11 1 1 2 795 1 1 2 ILE HD12 H -0.996 2.012 0.116 1.00 . A A . 2 ILE HD12 1 1 2 796 1 1 2 ILE HD13 H 0.702 2.350 0.452 1.00 . A A . 2 ILE HD13 1 1 2 797 1 1 2 ILE HG12 H 0.014 4.061 -1.669 1.00 . A A . 2 ILE HG12 1 1 2 798 1 1 2 ILE HG13 H 0.279 4.514 0.015 1.00 . A A . 2 ILE HG13 1 1 2 799 1 1 2 ILE HG21 H -2.241 2.450 -1.602 1.00 . A A . 2 ILE HG21 1 1 2 800 1 1 2 ILE HG22 H -2.455 3.937 -2.524 1.00 . A A . 2 ILE HG22 1 1 2 801 1 1 2 ILE HG23 H -3.636 3.484 -1.295 1.00 . A A . 2 ILE HG23 1 1 2 802 1 1 2 ILE N N -3.443 6.057 -0.613 1.00 . A A . 2 ILE N 1 1 2 803 1 1 2 ILE O O -0.339 6.431 -2.304 1.00 . A A . 2 ILE O 1 1 2 804 1 1 3 VAL C C -1.377 7.922 -4.444 1.00 . A A . 3 VAL C 1 1 2 805 1 1 3 VAL CA C -1.992 6.521 -4.438 1.00 . A A . 3 VAL CA 1 1 2 806 1 1 3 VAL CB C -3.236 6.505 -5.324 1.00 . A A . 3 VAL CB 1 1 2 807 1 1 3 VAL CG1 C -2.825 6.696 -6.779 1.00 . A A . 3 VAL CG1 1 1 2 808 1 1 3 VAL CG2 C -3.952 5.161 -5.169 1.00 . A A . 3 VAL CG2 1 1 2 809 1 1 3 VAL H H -3.313 5.906 -2.861 1.00 . A A . 3 VAL H 1 1 2 810 1 1 3 VAL HA H -1.272 5.809 -4.816 1.00 . A A . 3 VAL HA 1 1 2 811 1 1 3 VAL HB H -3.898 7.306 -5.027 1.00 . A A . 3 VAL HB 1 1 2 812 1 1 3 VAL HG11 H -3.709 6.760 -7.395 1.00 . A A . 3 VAL HG11 1 1 2 813 1 1 3 VAL HG12 H -2.225 5.856 -7.095 1.00 . A A . 3 VAL HG12 1 1 2 814 1 1 3 VAL HG13 H -2.252 7.606 -6.873 1.00 . A A . 3 VAL HG13 1 1 2 815 1 1 3 VAL HG21 H -4.115 4.726 -6.144 1.00 . A A . 3 VAL HG21 1 1 2 816 1 1 3 VAL HG22 H -4.903 5.315 -4.680 1.00 . A A . 3 VAL HG22 1 1 2 817 1 1 3 VAL HG23 H -3.344 4.495 -4.575 1.00 . A A . 3 VAL HG23 1 1 2 818 1 1 3 VAL N N -2.383 6.147 -3.056 1.00 . A A . 3 VAL N 1 1 2 819 1 1 3 VAL O O -0.538 8.238 -5.264 1.00 . A A . 3 VAL O 1 1 2 820 1 1 4 GLU C C -0.097 10.209 -2.466 1.00 . A A . 4 GLU C 1 1 2 821 1 1 4 GLU CA C -1.224 10.145 -3.497 1.00 . A A . 4 GLU CA 1 1 2 822 1 1 4 GLU CB C -2.329 11.132 -3.108 1.00 . A A . 4 GLU CB 1 1 2 823 1 1 4 GLU CD C -2.867 13.544 -2.738 1.00 . A A . 4 GLU CD 1 1 2 824 1 1 4 GLU CG C -1.745 12.543 -3.019 1.00 . A A . 4 GLU CG 1 1 2 825 1 1 4 GLU H H -2.466 8.494 -2.886 1.00 . A A . 4 GLU H 1 1 2 826 1 1 4 GLU HA H -0.837 10.405 -4.471 1.00 . A A . 4 GLU HA 1 1 2 827 1 1 4 GLU HB2 H -3.109 11.111 -3.854 1.00 . A A . 4 GLU HB2 1 1 2 828 1 1 4 GLU HB3 H -2.738 10.854 -2.149 1.00 . A A . 4 GLU HB3 1 1 2 829 1 1 4 GLU HG2 H -1.018 12.582 -2.222 1.00 . A A . 4 GLU HG2 1 1 2 830 1 1 4 GLU HG3 H -1.268 12.795 -3.955 1.00 . A A . 4 GLU HG3 1 1 2 831 1 1 4 GLU N N -1.787 8.766 -3.538 1.00 . A A . 4 GLU N 1 1 2 832 1 1 4 GLU O O 0.887 10.898 -2.648 1.00 . A A . 4 GLU O 1 1 2 833 1 1 4 GLU OE1 O -3.482 13.436 -1.689 1.00 . A A . 4 GLU OE1 1 1 2 834 1 1 4 GLU OE2 O -3.093 14.403 -3.574 1.00 . A A . 4 GLU OE2 1 1 2 835 1 1 5 GLN C C 2.064 8.772 -0.827 1.00 . A A . 5 GLN C 1 1 2 836 1 1 5 GLN CA C 0.826 9.527 -0.335 1.00 . A A . 5 GLN CA 1 1 2 837 1 1 5 GLN CB C 0.292 8.868 0.936 1.00 . A A . 5 GLN CB 1 1 2 838 1 1 5 GLN CD C -1.215 10.611 1.914 1.00 . A A . 5 GLN CD 1 1 2 839 1 1 5 GLN CG C 0.148 9.924 2.033 1.00 . A A . 5 GLN CG 1 1 2 840 1 1 5 GLN H H -1.036 8.955 -1.247 1.00 . A A . 5 GLN H 1 1 2 841 1 1 5 GLN HA H 1.094 10.551 -0.123 1.00 . A A . 5 GLN HA 1 1 2 842 1 1 5 GLN HB2 H -0.672 8.423 0.734 1.00 . A A . 5 GLN HB2 1 1 2 843 1 1 5 GLN HB3 H 0.981 8.103 1.263 1.00 . A A . 5 GLN HB3 1 1 2 844 1 1 5 GLN HE21 H -0.770 11.521 0.205 1.00 . A A . 5 GLN HE21 1 1 2 845 1 1 5 GLN HE22 H -2.327 11.830 0.807 1.00 . A A . 5 GLN HE22 1 1 2 846 1 1 5 GLN HG2 H 0.228 9.449 2.997 1.00 . A A . 5 GLN HG2 1 1 2 847 1 1 5 GLN HG3 H 0.930 10.661 1.928 1.00 . A A . 5 GLN HG3 1 1 2 848 1 1 5 GLN N N -0.234 9.501 -1.379 1.00 . A A . 5 GLN N 1 1 2 849 1 1 5 GLN NE2 N -1.457 11.383 0.890 1.00 . A A . 5 GLN NE2 1 1 2 850 1 1 5 GLN O O 3.183 9.155 -0.551 1.00 . A A . 5 GLN O 1 1 2 851 1 1 5 GLN OE1 O -2.067 10.444 2.762 1.00 . A A . 5 GLN OE1 1 1 2 852 1 1 6 CYS C C 3.753 7.750 -3.151 1.00 . A A . 6 CYS C 1 1 2 853 1 1 6 CYS CA C 3.059 6.941 -2.055 1.00 . A A . 6 CYS CA 1 1 2 854 1 1 6 CYS CB C 2.601 5.600 -2.631 1.00 . A A . 6 CYS CB 1 1 2 855 1 1 6 CYS H H 0.972 7.406 -1.770 1.00 . A A . 6 CYS H 1 1 2 856 1 1 6 CYS HA H 3.748 6.769 -1.242 1.00 . A A . 6 CYS HA 1 1 2 857 1 1 6 CYS HB2 H 1.526 5.604 -2.741 1.00 . A A . 6 CYS HB2 1 1 2 858 1 1 6 CYS HB3 H 3.059 5.450 -3.595 1.00 . A A . 6 CYS HB3 1 1 2 859 1 1 6 CYS N N 1.880 7.704 -1.553 1.00 . A A . 6 CYS N 1 1 2 860 1 1 6 CYS O O 4.964 7.763 -3.255 1.00 . A A . 6 CYS O 1 1 2 861 1 1 6 CYS SG S 3.087 4.260 -1.516 1.00 . A A . 6 CYS SG 1 1 2 862 1 1 7 CYS C C 4.125 10.548 -4.491 1.00 . A A . 7 CYS C 1 1 2 863 1 1 7 CYS CA C 3.607 9.228 -5.062 1.00 . A A . 7 CYS CA 1 1 2 864 1 1 7 CYS CB C 2.558 9.512 -6.140 1.00 . A A . 7 CYS CB 1 1 2 865 1 1 7 CYS H H 2.019 8.396 -3.869 1.00 . A A . 7 CYS H 1 1 2 866 1 1 7 CYS HA H 4.429 8.680 -5.495 1.00 . A A . 7 CYS HA 1 1 2 867 1 1 7 CYS HB2 H 1.841 8.704 -6.164 1.00 . A A . 7 CYS HB2 1 1 2 868 1 1 7 CYS HB3 H 2.051 10.437 -5.915 1.00 . A A . 7 CYS HB3 1 1 2 869 1 1 7 CYS N N 2.993 8.422 -3.971 1.00 . A A . 7 CYS N 1 1 2 870 1 1 7 CYS O O 5.175 11.029 -4.869 1.00 . A A . 7 CYS O 1 1 2 871 1 1 7 CYS SG S 3.372 9.645 -7.751 1.00 . A A . 7 CYS SG 1 1 2 872 1 1 8 THR C C 4.709 12.130 -1.744 1.00 . A A . 8 THR C 1 1 2 873 1 1 8 THR CA C 3.863 12.422 -2.984 1.00 . A A . 8 THR CA 1 1 2 874 1 1 8 THR CB C 2.651 13.269 -2.586 1.00 . A A . 8 THR CB 1 1 2 875 1 1 8 THR CG2 C 3.119 14.494 -1.796 1.00 . A A . 8 THR CG2 1 1 2 876 1 1 8 THR H H 2.559 10.734 -3.283 1.00 . A A . 8 THR H 1 1 2 877 1 1 8 THR HA H 4.457 12.962 -3.707 1.00 . A A . 8 THR HA 1 1 2 878 1 1 8 THR HB H 1.987 12.682 -1.971 1.00 . A A . 8 THR HB 1 1 2 879 1 1 8 THR HG1 H 1.277 13.053 -3.943 1.00 . A A . 8 THR HG1 1 1 2 880 1 1 8 THR HG21 H 3.932 14.973 -2.321 1.00 . A A . 8 THR HG21 1 1 2 881 1 1 8 THR HG22 H 3.455 14.184 -0.818 1.00 . A A . 8 THR HG22 1 1 2 882 1 1 8 THR HG23 H 2.299 15.189 -1.691 1.00 . A A . 8 THR HG23 1 1 2 883 1 1 8 THR N N 3.402 11.138 -3.580 1.00 . A A . 8 THR N 1 1 2 884 1 1 8 THR O O 5.194 13.029 -1.086 1.00 . A A . 8 THR O 1 1 2 885 1 1 8 THR OG1 O 1.966 13.693 -3.756 1.00 . A A . 8 THR OG1 1 1 2 886 1 1 9 SER C C 6.357 9.162 -0.409 1.00 . A A . 9 SER C 1 1 2 887 1 1 9 SER CA C 5.705 10.534 -0.218 1.00 . A A . 9 SER CA 1 1 2 888 1 1 9 SER CB C 4.802 10.499 1.015 1.00 . A A . 9 SER CB 1 1 2 889 1 1 9 SER H H 4.493 10.165 -1.958 1.00 . A A . 9 SER H 1 1 2 890 1 1 9 SER HA H 6.473 11.281 -0.079 1.00 . A A . 9 SER HA 1 1 2 891 1 1 9 SER HB2 H 4.463 9.491 1.187 1.00 . A A . 9 SER HB2 1 1 2 892 1 1 9 SER HB3 H 5.359 10.841 1.878 1.00 . A A . 9 SER HB3 1 1 2 893 1 1 9 SER HG H 3.592 11.924 1.555 1.00 . A A . 9 SER HG 1 1 2 894 1 1 9 SER N N 4.891 10.878 -1.417 1.00 . A A . 9 SER N 1 1 2 895 1 1 9 SER O O 5.804 8.283 -1.040 1.00 . A A . 9 SER O 1 1 2 896 1 1 9 SER OG O 3.677 11.340 0.798 1.00 . A A . 9 SER OG 1 1 2 897 1 1 10 ILE C C 7.517 6.627 0.876 1.00 . A A . 10 ILE C 1 1 2 898 1 1 10 ILE CA C 8.221 7.663 0.000 1.00 . A A . 10 ILE CA 1 1 2 899 1 1 10 ILE CB C 9.668 7.809 0.473 1.00 . A A . 10 ILE CB 1 1 2 900 1 1 10 ILE CD1 C 10.997 8.231 -1.630 1.00 . A A . 10 ILE CD1 1 1 2 901 1 1 10 ILE CG1 C 10.383 8.870 -0.381 1.00 . A A . 10 ILE CG1 1 1 2 902 1 1 10 ILE CG2 C 10.383 6.458 0.366 1.00 . A A . 10 ILE CG2 1 1 2 903 1 1 10 ILE H H 7.952 9.699 0.643 1.00 . A A . 10 ILE H 1 1 2 904 1 1 10 ILE HA H 8.206 7.344 -1.031 1.00 . A A . 10 ILE HA 1 1 2 905 1 1 10 ILE HB H 9.669 8.125 1.505 1.00 . A A . 10 ILE HB 1 1 2 906 1 1 10 ILE HD11 H 11.828 7.604 -1.341 1.00 . A A . 10 ILE HD11 1 1 2 907 1 1 10 ILE HD12 H 11.346 9.005 -2.296 1.00 . A A . 10 ILE HD12 1 1 2 908 1 1 10 ILE HD13 H 10.252 7.632 -2.132 1.00 . A A . 10 ILE HD13 1 1 2 909 1 1 10 ILE HG12 H 9.668 9.623 -0.681 1.00 . A A . 10 ILE HG12 1 1 2 910 1 1 10 ILE HG13 H 11.164 9.333 0.204 1.00 . A A . 10 ILE HG13 1 1 2 911 1 1 10 ILE HG21 H 11.416 6.574 0.654 1.00 . A A . 10 ILE HG21 1 1 2 912 1 1 10 ILE HG22 H 10.330 6.104 -0.653 1.00 . A A . 10 ILE HG22 1 1 2 913 1 1 10 ILE HG23 H 9.904 5.745 1.021 1.00 . A A . 10 ILE HG23 1 1 2 914 1 1 10 ILE N N 7.528 8.975 0.136 1.00 . A A . 10 ILE N 1 1 2 915 1 1 10 ILE O O 7.217 6.882 2.025 1.00 . A A . 10 ILE O 1 1 2 916 1 1 11 CYS C C 7.469 3.184 1.284 1.00 . A A . 11 CYS C 1 1 2 917 1 1 11 CYS CA C 6.582 4.425 1.198 1.00 . A A . 11 CYS CA 1 1 2 918 1 1 11 CYS CB C 5.212 4.035 0.616 1.00 . A A . 11 CYS CB 1 1 2 919 1 1 11 CYS H H 7.511 5.257 -0.567 1.00 . A A . 11 CYS H 1 1 2 920 1 1 11 CYS HA H 6.441 4.821 2.193 1.00 . A A . 11 CYS HA 1 1 2 921 1 1 11 CYS HB2 H 5.114 2.960 0.627 1.00 . A A . 11 CYS HB2 1 1 2 922 1 1 11 CYS HB3 H 4.432 4.467 1.227 1.00 . A A . 11 CYS HB3 1 1 2 923 1 1 11 CYS N N 7.258 5.458 0.358 1.00 . A A . 11 CYS N 1 1 2 924 1 1 11 CYS O O 7.904 2.648 0.283 1.00 . A A . 11 CYS O 1 1 2 925 1 1 11 CYS SG S 5.029 4.625 -1.090 1.00 . A A . 11 CYS SG 1 1 2 926 1 1 12 SER C C 7.730 0.278 2.776 1.00 . A A . 12 SER C 1 1 2 927 1 1 12 SER CA C 8.609 1.520 2.621 1.00 . A A . 12 SER CA 1 1 2 928 1 1 12 SER CB C 9.501 1.676 3.855 1.00 . A A . 12 SER CB 1 1 2 929 1 1 12 SER H H 7.387 3.172 3.268 1.00 . A A . 12 SER H 1 1 2 930 1 1 12 SER HA H 9.228 1.414 1.742 1.00 . A A . 12 SER HA 1 1 2 931 1 1 12 SER HB2 H 9.772 0.704 4.230 1.00 . A A . 12 SER HB2 1 1 2 932 1 1 12 SER HB3 H 10.398 2.216 3.581 1.00 . A A . 12 SER HB3 1 1 2 933 1 1 12 SER HG H 9.416 2.615 5.556 1.00 . A A . 12 SER HG 1 1 2 934 1 1 12 SER N N 7.746 2.724 2.474 1.00 . A A . 12 SER N 1 1 2 935 1 1 12 SER O O 6.555 0.373 3.078 1.00 . A A . 12 SER O 1 1 2 936 1 1 12 SER OG O 8.793 2.387 4.861 1.00 . A A . 12 SER OG 1 1 2 937 1 1 13 LEU C C 6.468 -2.051 3.772 1.00 . A A . 13 LEU C 1 1 2 938 1 1 13 LEU CA C 7.516 -2.150 2.665 1.00 . A A . 13 LEU CA 1 1 2 939 1 1 13 LEU CB C 8.463 -3.311 2.967 1.00 . A A . 13 LEU CB 1 1 2 940 1 1 13 LEU CD1 C 8.171 -5.744 2.483 1.00 . A A . 13 LEU CD1 1 1 2 941 1 1 13 LEU CD2 C 7.802 -4.881 4.795 1.00 . A A . 13 LEU CD2 1 1 2 942 1 1 13 LEU CG C 7.653 -4.564 3.306 1.00 . A A . 13 LEU CG 1 1 2 943 1 1 13 LEU H H 9.235 -0.918 2.295 1.00 . A A . 13 LEU H 1 1 2 944 1 1 13 LEU HA H 7.025 -2.334 1.734 1.00 . A A . 13 LEU HA 1 1 2 945 1 1 13 LEU HB2 H 9.080 -3.505 2.102 1.00 . A A . 13 LEU HB2 1 1 2 946 1 1 13 LEU HB3 H 9.089 -3.055 3.805 1.00 . A A . 13 LEU HB3 1 1 2 947 1 1 13 LEU HD11 H 8.165 -5.483 1.436 1.00 . A A . 13 LEU HD11 1 1 2 948 1 1 13 LEU HD12 H 7.535 -6.602 2.644 1.00 . A A . 13 LEU HD12 1 1 2 949 1 1 13 LEU HD13 H 9.179 -5.980 2.788 1.00 . A A . 13 LEU HD13 1 1 2 950 1 1 13 LEU HD21 H 6.891 -5.330 5.161 1.00 . A A . 13 LEU HD21 1 1 2 951 1 1 13 LEU HD22 H 8.000 -3.970 5.341 1.00 . A A . 13 LEU HD22 1 1 2 952 1 1 13 LEU HD23 H 8.624 -5.569 4.936 1.00 . A A . 13 LEU HD23 1 1 2 953 1 1 13 LEU HG H 6.611 -4.392 3.075 1.00 . A A . 13 LEU HG 1 1 2 954 1 1 13 LEU N N 8.295 -0.882 2.554 1.00 . A A . 13 LEU N 1 1 2 955 1 1 13 LEU O O 5.347 -2.493 3.617 1.00 . A A . 13 LEU O 1 1 2 956 1 1 14 TYR C C 4.488 -0.889 5.438 1.00 . A A . 14 TYR C 1 1 2 957 1 1 14 TYR CA C 5.833 -1.366 5.995 1.00 . A A . 14 TYR CA 1 1 2 958 1 1 14 TYR CB C 6.339 -0.357 7.028 1.00 . A A . 14 TYR CB 1 1 2 959 1 1 14 TYR CD1 C 7.419 -2.103 8.492 1.00 . A A . 14 TYR CD1 1 1 2 960 1 1 14 TYR CD2 C 8.779 -0.274 7.661 1.00 . A A . 14 TYR CD2 1 1 2 961 1 1 14 TYR CE1 C 8.534 -2.629 9.160 1.00 . A A . 14 TYR CE1 1 1 2 962 1 1 14 TYR CE2 C 9.894 -0.800 8.328 1.00 . A A . 14 TYR CE2 1 1 2 963 1 1 14 TYR CG C 7.542 -0.925 7.744 1.00 . A A . 14 TYR CG 1 1 2 964 1 1 14 TYR CZ C 9.771 -1.977 9.077 1.00 . A A . 14 TYR CZ 1 1 2 965 1 1 14 TYR H H 7.728 -1.133 4.994 1.00 . A A . 14 TYR H 1 1 2 966 1 1 14 TYR HA H 5.706 -2.330 6.464 1.00 . A A . 14 TYR HA 1 1 2 967 1 1 14 TYR HB2 H 6.616 0.560 6.530 1.00 . A A . 14 TYR HB2 1 1 2 968 1 1 14 TYR HB3 H 5.557 -0.156 7.746 1.00 . A A . 14 TYR HB3 1 1 2 969 1 1 14 TYR HD1 H 6.466 -2.606 8.556 1.00 . A A . 14 TYR HD1 1 1 2 970 1 1 14 TYR HD2 H 8.874 0.635 7.084 1.00 . A A . 14 TYR HD2 1 1 2 971 1 1 14 TYR HE1 H 8.440 -3.538 9.737 1.00 . A A . 14 TYR HE1 1 1 2 972 1 1 14 TYR HE2 H 10.848 -0.297 8.264 1.00 . A A . 14 TYR HE2 1 1 2 973 1 1 14 TYR HH H 10.633 -3.364 10.065 1.00 . A A . 14 TYR HH 1 1 2 974 1 1 14 TYR N N 6.819 -1.482 4.885 1.00 . A A . 14 TYR N 1 1 2 975 1 1 14 TYR O O 3.508 -1.610 5.453 1.00 . A A . 14 TYR O 1 1 2 976 1 1 14 TYR OH O 10.870 -2.495 9.733 1.00 . A A . 14 TYR OH 1 1 2 977 1 1 15 GLN C C 2.604 -0.121 3.356 1.00 . A A . 15 GLN C 1 1 2 978 1 1 15 GLN CA C 3.165 0.854 4.385 1.00 . A A . 15 GLN CA 1 1 2 979 1 1 15 GLN CB C 3.432 2.201 3.711 1.00 . A A . 15 GLN CB 1 1 2 980 1 1 15 GLN CD C 4.756 3.853 5.036 1.00 . A A . 15 GLN CD 1 1 2 981 1 1 15 GLN CG C 3.351 3.320 4.751 1.00 . A A . 15 GLN CG 1 1 2 982 1 1 15 GLN H H 5.243 0.873 4.932 1.00 . A A . 15 GLN H 1 1 2 983 1 1 15 GLN HA H 2.450 0.987 5.184 1.00 . A A . 15 GLN HA 1 1 2 984 1 1 15 GLN HB2 H 4.417 2.191 3.267 1.00 . A A . 15 GLN HB2 1 1 2 985 1 1 15 GLN HB3 H 2.693 2.371 2.943 1.00 . A A . 15 GLN HB3 1 1 2 986 1 1 15 GLN HE21 H 4.613 3.577 6.997 1.00 . A A . 15 GLN HE21 1 1 2 987 1 1 15 GLN HE22 H 6.087 4.229 6.462 1.00 . A A . 15 GLN HE22 1 1 2 988 1 1 15 GLN HG2 H 2.733 4.120 4.369 1.00 . A A . 15 GLN HG2 1 1 2 989 1 1 15 GLN HG3 H 2.922 2.935 5.663 1.00 . A A . 15 GLN HG3 1 1 2 990 1 1 15 GLN N N 4.439 0.318 4.941 1.00 . A A . 15 GLN N 1 1 2 991 1 1 15 GLN NE2 N 5.188 3.890 6.267 1.00 . A A . 15 GLN NE2 1 1 2 992 1 1 15 GLN O O 1.414 -0.350 3.286 1.00 . A A . 15 GLN O 1 1 2 993 1 1 15 GLN OE1 O 5.468 4.240 4.131 1.00 . A A . 15 GLN OE1 1 1 2 994 1 1 16 LEU C C 2.228 -2.810 2.195 1.00 . A A . 16 LEU C 1 1 2 995 1 1 16 LEU CA C 2.963 -1.654 1.520 1.00 . A A . 16 LEU CA 1 1 2 996 1 1 16 LEU CB C 4.145 -2.210 0.745 1.00 . A A . 16 LEU CB 1 1 2 997 1 1 16 LEU CD1 C 6.133 -0.817 0.218 1.00 . A A . 16 LEU CD1 1 1 2 998 1 1 16 LEU CD2 C 4.652 -1.603 -1.612 1.00 . A A . 16 LEU CD2 1 1 2 999 1 1 16 LEU CG C 4.694 -1.121 -0.167 1.00 . A A . 16 LEU CG 1 1 2 1000 1 1 16 LEU H H 4.409 -0.492 2.627 1.00 . A A . 16 LEU H 1 1 2 1001 1 1 16 LEU HA H 2.303 -1.142 0.838 1.00 . A A . 16 LEU HA 1 1 2 1002 1 1 16 LEU HB2 H 4.903 -2.529 1.435 1.00 . A A . 16 LEU HB2 1 1 2 1003 1 1 16 LEU HB3 H 3.826 -3.050 0.149 1.00 . A A . 16 LEU HB3 1 1 2 1004 1 1 16 LEU HD11 H 6.186 -0.634 1.280 1.00 . A A . 16 LEU HD11 1 1 2 1005 1 1 16 LEU HD12 H 6.470 0.056 -0.318 1.00 . A A . 16 LEU HD12 1 1 2 1006 1 1 16 LEU HD13 H 6.756 -1.662 -0.034 1.00 . A A . 16 LEU HD13 1 1 2 1007 1 1 16 LEU HD21 H 5.549 -1.286 -2.122 1.00 . A A . 16 LEU HD21 1 1 2 1008 1 1 16 LEU HD22 H 3.788 -1.185 -2.105 1.00 . A A . 16 LEU HD22 1 1 2 1009 1 1 16 LEU HD23 H 4.591 -2.681 -1.628 1.00 . A A . 16 LEU HD23 1 1 2 1010 1 1 16 LEU HG H 4.095 -0.229 -0.064 1.00 . A A . 16 LEU HG 1 1 2 1011 1 1 16 LEU N N 3.451 -0.695 2.552 1.00 . A A . 16 LEU N 1 1 2 1012 1 1 16 LEU O O 1.088 -3.101 1.889 1.00 . A A . 16 LEU O 1 1 2 1013 1 1 17 GLU C C 0.894 -4.182 4.410 1.00 . A A . 17 GLU C 1 1 2 1014 1 1 17 GLU CA C 2.230 -4.624 3.808 1.00 . A A . 17 GLU CA 1 1 2 1015 1 1 17 GLU CB C 3.152 -5.131 4.923 1.00 . A A . 17 GLU CB 1 1 2 1016 1 1 17 GLU CD C 2.632 -7.500 5.528 1.00 . A A . 17 GLU CD 1 1 2 1017 1 1 17 GLU CG C 3.510 -6.596 4.663 1.00 . A A . 17 GLU CG 1 1 2 1018 1 1 17 GLU H H 3.802 -3.224 3.333 1.00 . A A . 17 GLU H 1 1 2 1019 1 1 17 GLU HA H 2.056 -5.419 3.100 1.00 . A A . 17 GLU HA 1 1 2 1020 1 1 17 GLU HB2 H 4.054 -4.537 4.941 1.00 . A A . 17 GLU HB2 1 1 2 1021 1 1 17 GLU HB3 H 2.647 -5.050 5.873 1.00 . A A . 17 GLU HB3 1 1 2 1022 1 1 17 GLU HG2 H 3.346 -6.825 3.619 1.00 . A A . 17 GLU HG2 1 1 2 1023 1 1 17 GLU HG3 H 4.548 -6.761 4.909 1.00 . A A . 17 GLU HG3 1 1 2 1024 1 1 17 GLU N N 2.879 -3.476 3.110 1.00 . A A . 17 GLU N 1 1 2 1025 1 1 17 GLU O O 0.059 -4.996 4.751 1.00 . A A . 17 GLU O 1 1 2 1026 1 1 17 GLU OE1 O 1.470 -7.662 5.193 1.00 . A A . 17 GLU OE1 1 1 2 1027 1 1 17 GLU OE2 O 3.135 -8.016 6.513 1.00 . A A . 17 GLU OE2 1 1 2 1028 1 1 18 ASN C C -1.645 -2.263 4.027 1.00 . A A . 18 ASN C 1 1 2 1029 1 1 18 ASN CA C -0.597 -2.420 5.133 1.00 . A A . 18 ASN CA 1 1 2 1030 1 1 18 ASN CB C -0.368 -1.065 5.806 1.00 . A A . 18 ASN CB 1 1 2 1031 1 1 18 ASN CG C -0.753 -1.152 7.283 1.00 . A A . 18 ASN CG 1 1 2 1032 1 1 18 ASN H H 1.369 -2.262 4.273 1.00 . A A . 18 ASN H 1 1 2 1033 1 1 18 ASN HA H -0.951 -3.131 5.864 1.00 . A A . 18 ASN HA 1 1 2 1034 1 1 18 ASN HB2 H 0.673 -0.794 5.719 1.00 . A A . 18 ASN HB2 1 1 2 1035 1 1 18 ASN HB3 H -0.977 -0.317 5.321 1.00 . A A . 18 ASN HB3 1 1 2 1036 1 1 18 ASN HD21 H -2.646 -0.643 6.967 1.00 . A A . 18 ASN HD21 1 1 2 1037 1 1 18 ASN HD22 H -2.237 -0.943 8.586 1.00 . A A . 18 ASN HD22 1 1 2 1038 1 1 18 ASN N N 0.684 -2.903 4.549 1.00 . A A . 18 ASN N 1 1 2 1039 1 1 18 ASN ND2 N -1.981 -0.891 7.642 1.00 . A A . 18 ASN ND2 1 1 2 1040 1 1 18 ASN O O -2.692 -1.682 4.232 1.00 . A A . 18 ASN O 1 1 2 1041 1 1 18 ASN OD1 O 0.072 -1.458 8.121 1.00 . A A . 18 ASN OD1 1 1 2 1042 1 1 19 TYR C C -2.440 -3.956 0.974 1.00 . A A . 19 TYR C 1 1 2 1043 1 1 19 TYR CA C -2.361 -2.641 1.748 1.00 . A A . 19 TYR CA 1 1 2 1044 1 1 19 TYR CB C -1.922 -1.523 0.804 1.00 . A A . 19 TYR CB 1 1 2 1045 1 1 19 TYR CD1 C -2.975 0.401 2.047 1.00 . A A . 19 TYR CD1 1 1 2 1046 1 1 19 TYR CD2 C -0.561 0.340 1.815 1.00 . A A . 19 TYR CD2 1 1 2 1047 1 1 19 TYR CE1 C -2.875 1.603 2.760 1.00 . A A . 19 TYR CE1 1 1 2 1048 1 1 19 TYR CE2 C -0.461 1.543 2.526 1.00 . A A . 19 TYR CE2 1 1 2 1049 1 1 19 TYR CG C -1.816 -0.231 1.575 1.00 . A A . 19 TYR CG 1 1 2 1050 1 1 19 TYR CZ C -1.619 2.175 2.999 1.00 . A A . 19 TYR CZ 1 1 2 1051 1 1 19 TYR H H -0.523 -3.236 2.706 1.00 . A A . 19 TYR H 1 1 2 1052 1 1 19 TYR HA H -3.331 -2.406 2.157 1.00 . A A . 19 TYR HA 1 1 2 1053 1 1 19 TYR HB2 H -0.960 -1.768 0.377 1.00 . A A . 19 TYR HB2 1 1 2 1054 1 1 19 TYR HB3 H -2.649 -1.412 0.014 1.00 . A A . 19 TYR HB3 1 1 2 1055 1 1 19 TYR HD1 H -3.943 -0.042 1.864 1.00 . A A . 19 TYR HD1 1 1 2 1056 1 1 19 TYR HD2 H 0.332 -0.151 1.452 1.00 . A A . 19 TYR HD2 1 1 2 1057 1 1 19 TYR HE1 H -3.767 2.090 3.123 1.00 . A A . 19 TYR HE1 1 1 2 1058 1 1 19 TYR HE2 H 0.508 1.981 2.712 1.00 . A A . 19 TYR HE2 1 1 2 1059 1 1 19 TYR HH H -1.672 4.081 3.081 1.00 . A A . 19 TYR HH 1 1 2 1060 1 1 19 TYR N N -1.373 -2.772 2.856 1.00 . A A . 19 TYR N 1 1 2 1061 1 1 19 TYR O O -2.477 -3.971 -0.241 1.00 . A A . 19 TYR O 1 1 2 1062 1 1 19 TYR OH O -1.521 3.361 3.697 1.00 . A A . 19 TYR OH 1 1 2 1063 1 1 20 CYS C C -2.840 -7.475 1.978 1.00 . A A . 20 CYS C 1 1 2 1064 1 1 20 CYS CA C -2.545 -6.372 0.962 1.00 . A A . 20 CYS CA 1 1 2 1065 1 1 20 CYS CB C -1.210 -6.657 0.270 1.00 . A A . 20 CYS CB 1 1 2 1066 1 1 20 CYS H H -2.436 -5.028 2.644 1.00 . A A . 20 CYS H 1 1 2 1067 1 1 20 CYS HA H -3.333 -6.340 0.225 1.00 . A A . 20 CYS HA 1 1 2 1068 1 1 20 CYS HB2 H -1.007 -5.881 -0.454 1.00 . A A . 20 CYS HB2 1 1 2 1069 1 1 20 CYS HB3 H -0.419 -6.678 1.007 1.00 . A A . 20 CYS HB3 1 1 2 1070 1 1 20 CYS N N -2.467 -5.060 1.664 1.00 . A A . 20 CYS N 1 1 2 1071 1 1 20 CYS O O -2.639 -7.308 3.165 1.00 . A A . 20 CYS O 1 1 2 1072 1 1 20 CYS SG S -1.297 -8.259 -0.568 1.00 . A A . 20 CYS SG 1 1 2 1073 1 1 21 ASN C C -2.316 -10.232 3.077 1.00 . A A . 21 ASN C 1 1 2 1074 1 1 21 ASN CA C -3.623 -9.705 2.479 1.00 . A A . 21 ASN CA 1 1 2 1075 1 1 21 ASN CB C -4.341 -10.837 1.743 1.00 . A A . 21 ASN CB 1 1 2 1076 1 1 21 ASN CG C -5.467 -11.379 2.624 1.00 . A A . 21 ASN CG 1 1 2 1077 1 1 21 ASN H H -3.478 -8.722 0.568 1.00 . A A . 21 ASN H 1 1 2 1078 1 1 21 ASN HA H -4.255 -9.331 3.269 1.00 . A A . 21 ASN HA 1 1 2 1079 1 1 21 ASN HB2 H -4.754 -10.461 0.818 1.00 . A A . 21 ASN HB2 1 1 2 1080 1 1 21 ASN HB3 H -3.640 -11.631 1.529 1.00 . A A . 21 ASN HB3 1 1 2 1081 1 1 21 ASN HD21 H -5.782 -12.974 1.487 1.00 . A A . 21 ASN HD21 1 1 2 1082 1 1 21 ASN HD22 H -6.782 -12.848 2.853 1.00 . A A . 21 ASN HD22 1 1 2 1083 1 1 21 ASN N N -3.318 -8.602 1.527 1.00 . A A . 21 ASN N 1 1 2 1084 1 1 21 ASN ND2 N -6.059 -12.493 2.294 1.00 . A A . 21 ASN ND2 1 1 2 1085 1 1 21 ASN O O -1.272 -9.720 2.710 1.00 . A A . 21 ASN O 1 1 2 1086 1 1 21 ASN OXT O -2.383 -11.137 3.892 1.00 . A A . 21 ASN OXT 1 1 2 1087 1 1 21 ASN OD1 O -5.811 -10.783 3.626 1.00 . A A . 21 ASN OD1 1 1 2 1088 2 2 1 PHE C C 13.739 -1.627 -1.688 1.00 . B B . 1 PHE C 1 1 2 1089 2 2 1 PHE CA C 14.144 -2.943 -1.019 1.00 . B B . 1 PHE CA 1 1 2 1090 2 2 1 PHE CB C 13.078 -3.351 -0.002 1.00 . B B . 1 PHE CB 1 1 2 1091 2 2 1 PHE CD1 C 12.243 -5.130 -1.581 1.00 . B B . 1 PHE CD1 1 1 2 1092 2 2 1 PHE CD2 C 10.629 -3.679 -0.495 1.00 . B B . 1 PHE CD2 1 1 2 1093 2 2 1 PHE CE1 C 11.201 -5.797 -2.237 1.00 . B B . 1 PHE CE1 1 1 2 1094 2 2 1 PHE CE2 C 9.587 -4.346 -1.151 1.00 . B B . 1 PHE CE2 1 1 2 1095 2 2 1 PHE CG C 11.956 -4.071 -0.709 1.00 . B B . 1 PHE CG 1 1 2 1096 2 2 1 PHE CZ C 9.872 -5.405 -2.023 1.00 . B B . 1 PHE CZ 1 1 2 1097 2 2 1 PHE H1 H 15.898 -3.695 -0.186 1.00 . B B . 1 PHE H1 1 1 2 1098 2 2 1 PHE H2 H 15.291 -2.319 0.604 1.00 . B B . 1 PHE H2 1 1 2 1099 2 2 1 PHE H3 H 16.072 -2.167 -0.897 1.00 . B B . 1 PHE H3 1 1 2 1100 2 2 1 PHE HA H 14.238 -3.714 -1.769 1.00 . B B . 1 PHE HA 1 1 2 1101 2 2 1 PHE HB2 H 13.515 -4.006 0.738 1.00 . B B . 1 PHE HB2 1 1 2 1102 2 2 1 PHE HB3 H 12.688 -2.469 0.486 1.00 . B B . 1 PHE HB3 1 1 2 1103 2 2 1 PHE HD1 H 13.266 -5.431 -1.746 1.00 . B B . 1 PHE HD1 1 1 2 1104 2 2 1 PHE HD2 H 10.408 -2.862 0.177 1.00 . B B . 1 PHE HD2 1 1 2 1105 2 2 1 PHE HE1 H 11.421 -6.613 -2.909 1.00 . B B . 1 PHE HE1 1 1 2 1106 2 2 1 PHE HE2 H 8.563 -4.044 -0.986 1.00 . B B . 1 PHE HE2 1 1 2 1107 2 2 1 PHE HZ H 9.069 -5.919 -2.530 1.00 . B B . 1 PHE HZ 1 1 2 1108 2 2 1 PHE N N 15.450 -2.768 -0.322 1.00 . B B . 1 PHE N 1 1 2 1109 2 2 1 PHE O O 14.318 -0.588 -1.437 1.00 . B B . 1 PHE O 1 1 2 1110 2 2 2 VAL C C 12.156 0.710 -2.201 1.00 . B B . 2 VAL C 1 1 2 1111 2 2 2 VAL CA C 12.312 -0.415 -3.227 1.00 . B B . 2 VAL CA 1 1 2 1112 2 2 2 VAL CB C 10.973 -0.659 -3.930 1.00 . B B . 2 VAL CB 1 1 2 1113 2 2 2 VAL CG1 C 11.223 -1.177 -5.348 1.00 . B B . 2 VAL CG1 1 1 2 1114 2 2 2 VAL CG2 C 10.147 -1.688 -3.150 1.00 . B B . 2 VAL CG2 1 1 2 1115 2 2 2 VAL H H 12.296 -2.502 -2.735 1.00 . B B . 2 VAL H 1 1 2 1116 2 2 2 VAL HA H 13.054 -0.130 -3.958 1.00 . B B . 2 VAL HA 1 1 2 1117 2 2 2 VAL HB H 10.433 0.267 -3.981 1.00 . B B . 2 VAL HB 1 1 2 1118 2 2 2 VAL HG11 H 11.400 -0.343 -6.011 1.00 . B B . 2 VAL HG11 1 1 2 1119 2 2 2 VAL HG12 H 10.359 -1.728 -5.687 1.00 . B B . 2 VAL HG12 1 1 2 1120 2 2 2 VAL HG13 H 12.085 -1.826 -5.347 1.00 . B B . 2 VAL HG13 1 1 2 1121 2 2 2 VAL HG21 H 10.288 -2.666 -3.583 1.00 . B B . 2 VAL HG21 1 1 2 1122 2 2 2 VAL HG22 H 9.100 -1.419 -3.200 1.00 . B B . 2 VAL HG22 1 1 2 1123 2 2 2 VAL HG23 H 10.465 -1.699 -2.118 1.00 . B B . 2 VAL HG23 1 1 2 1124 2 2 2 VAL N N 12.749 -1.660 -2.542 1.00 . B B . 2 VAL N 1 1 2 1125 2 2 2 VAL O O 13.058 1.496 -1.988 1.00 . B B . 2 VAL O 1 1 2 1126 2 2 3 ASN C C 11.033 3.234 -1.230 1.00 . B B . 3 ASN C 1 1 2 1127 2 2 3 ASN CA C 10.820 1.880 -0.554 1.00 . B B . 3 ASN CA 1 1 2 1128 2 2 3 ASN CB C 11.825 1.718 0.596 1.00 . B B . 3 ASN CB 1 1 2 1129 2 2 3 ASN CG C 12.346 0.277 0.639 1.00 . B B . 3 ASN CG 1 1 2 1130 2 2 3 ASN H H 10.300 0.159 -1.744 1.00 . B B . 3 ASN H 1 1 2 1131 2 2 3 ASN HA H 9.814 1.828 -0.165 1.00 . B B . 3 ASN HA 1 1 2 1132 2 2 3 ASN HB2 H 12.654 2.395 0.444 1.00 . B B . 3 ASN HB2 1 1 2 1133 2 2 3 ASN HB3 H 11.339 1.949 1.532 1.00 . B B . 3 ASN HB3 1 1 2 1134 2 2 3 ASN HD21 H 14.240 0.815 0.897 1.00 . B B . 3 ASN HD21 1 1 2 1135 2 2 3 ASN HD22 H 13.963 -0.858 0.831 1.00 . B B . 3 ASN HD22 1 1 2 1136 2 2 3 ASN N N 11.020 0.798 -1.562 1.00 . B B . 3 ASN N 1 1 2 1137 2 2 3 ASN ND2 N 13.622 0.061 0.803 1.00 . B B . 3 ASN ND2 1 1 2 1138 2 2 3 ASN O O 11.370 4.213 -0.595 1.00 . B B . 3 ASN O 1 1 2 1139 2 2 3 ASN OD1 O 11.582 -0.660 0.521 1.00 . B B . 3 ASN OD1 1 1 2 1140 2 2 4 GLN C C 9.675 5.236 -3.503 1.00 . B B . 4 GLN C 1 1 2 1141 2 2 4 GLN CA C 11.035 4.579 -3.246 1.00 . B B . 4 GLN CA 1 1 2 1142 2 2 4 GLN CB C 11.737 4.301 -4.578 1.00 . B B . 4 GLN CB 1 1 2 1143 2 2 4 GLN CD C 14.043 5.229 -4.339 1.00 . B B . 4 GLN CD 1 1 2 1144 2 2 4 GLN CG C 12.653 5.475 -4.927 1.00 . B B . 4 GLN CG 1 1 2 1145 2 2 4 GLN H H 10.574 2.489 -3.010 1.00 . B B . 4 GLN H 1 1 2 1146 2 2 4 GLN HA H 11.647 5.238 -2.649 1.00 . B B . 4 GLN HA 1 1 2 1147 2 2 4 GLN HB2 H 12.324 3.398 -4.493 1.00 . B B . 4 GLN HB2 1 1 2 1148 2 2 4 GLN HB3 H 10.998 4.179 -5.356 1.00 . B B . 4 GLN HB3 1 1 2 1149 2 2 4 GLN HE21 H 14.669 7.082 -4.677 1.00 . B B . 4 GLN HE21 1 1 2 1150 2 2 4 GLN HE22 H 15.804 6.056 -3.942 1.00 . B B . 4 GLN HE22 1 1 2 1151 2 2 4 GLN HG2 H 12.726 5.567 -6.001 1.00 . B B . 4 GLN HG2 1 1 2 1152 2 2 4 GLN HG3 H 12.245 6.386 -4.514 1.00 . B B . 4 GLN HG3 1 1 2 1153 2 2 4 GLN N N 10.841 3.293 -2.519 1.00 . B B . 4 GLN N 1 1 2 1154 2 2 4 GLN NE2 N 14.910 6.203 -4.317 1.00 . B B . 4 GLN NE2 1 1 2 1155 2 2 4 GLN O O 8.772 5.161 -2.687 1.00 . B B . 4 GLN O 1 1 2 1156 2 2 4 GLN OE1 O 14.343 4.139 -3.894 1.00 . B B . 4 GLN OE1 1 1 2 1157 2 2 5 HIS C C 7.296 5.529 -5.631 1.00 . B B . 5 HIS C 1 1 2 1158 2 2 5 HIS CA C 8.219 6.540 -4.950 1.00 . B B . 5 HIS CA 1 1 2 1159 2 2 5 HIS CB C 8.459 7.716 -5.898 1.00 . B B . 5 HIS CB 1 1 2 1160 2 2 5 HIS CD2 C 9.302 9.287 -3.987 1.00 . B B . 5 HIS CD2 1 1 2 1161 2 2 5 HIS CE1 C 11.003 10.135 -5.038 1.00 . B B . 5 HIS CE1 1 1 2 1162 2 2 5 HIS CG C 9.348 8.729 -5.234 1.00 . B B . 5 HIS CG 1 1 2 1163 2 2 5 HIS H H 10.256 5.930 -5.277 1.00 . B B . 5 HIS H 1 1 2 1164 2 2 5 HIS HA H 7.760 6.895 -4.039 1.00 . B B . 5 HIS HA 1 1 2 1165 2 2 5 HIS HB2 H 8.933 7.359 -6.801 1.00 . B B . 5 HIS HB2 1 1 2 1166 2 2 5 HIS HB3 H 7.513 8.177 -6.147 1.00 . B B . 5 HIS HB3 1 1 2 1167 2 2 5 HIS HD2 H 8.566 9.068 -3.227 1.00 . B B . 5 HIS HD2 1 1 2 1168 2 2 5 HIS HE1 H 11.879 10.725 -5.266 1.00 . B B . 5 HIS HE1 1 1 2 1169 2 2 5 HIS HE2 H 10.566 10.726 -3.079 1.00 . B B . 5 HIS HE2 1 1 2 1170 2 2 5 HIS N N 9.518 5.881 -4.634 1.00 . B B . 5 HIS N 1 1 2 1171 2 2 5 HIS ND1 N 10.431 9.274 -5.890 1.00 . B B . 5 HIS ND1 1 1 2 1172 2 2 5 HIS NE2 N 10.347 10.177 -3.860 1.00 . B B . 5 HIS NE2 1 1 2 1173 2 2 5 HIS O O 7.590 5.024 -6.695 1.00 . B B . 5 HIS O 1 1 2 1174 2 2 6 LEU C C 4.101 5.019 -6.314 1.00 . B B . 6 LEU C 1 1 2 1175 2 2 6 LEU CA C 5.242 4.256 -5.643 1.00 . B B . 6 LEU CA 1 1 2 1176 2 2 6 LEU CB C 4.699 3.333 -4.553 1.00 . B B . 6 LEU CB 1 1 2 1177 2 2 6 LEU CD1 C 5.325 1.916 -2.591 1.00 . B B . 6 LEU CD1 1 1 2 1178 2 2 6 LEU CD2 C 6.951 2.259 -4.459 1.00 . B B . 6 LEU CD2 1 1 2 1179 2 2 6 LEU CG C 5.843 2.913 -3.629 1.00 . B B . 6 LEU CG 1 1 2 1180 2 2 6 LEU H H 5.956 5.650 -4.173 1.00 . B B . 6 LEU H 1 1 2 1181 2 2 6 LEU HA H 5.765 3.669 -6.383 1.00 . B B . 6 LEU HA 1 1 2 1182 2 2 6 LEU HB2 H 3.945 3.855 -3.981 1.00 . B B . 6 LEU HB2 1 1 2 1183 2 2 6 LEU HB3 H 4.266 2.455 -5.004 1.00 . B B . 6 LEU HB3 1 1 2 1184 2 2 6 LEU HD11 H 6.004 1.882 -1.752 1.00 . B B . 6 LEU HD11 1 1 2 1185 2 2 6 LEU HD12 H 5.255 0.936 -3.038 1.00 . B B . 6 LEU HD12 1 1 2 1186 2 2 6 LEU HD13 H 4.350 2.226 -2.251 1.00 . B B . 6 LEU HD13 1 1 2 1187 2 2 6 LEU HD21 H 7.343 1.406 -3.926 1.00 . B B . 6 LEU HD21 1 1 2 1188 2 2 6 LEU HD22 H 7.742 2.974 -4.630 1.00 . B B . 6 LEU HD22 1 1 2 1189 2 2 6 LEU HD23 H 6.546 1.937 -5.407 1.00 . B B . 6 LEU HD23 1 1 2 1190 2 2 6 LEU HG H 6.237 3.785 -3.125 1.00 . B B . 6 LEU HG 1 1 2 1191 2 2 6 LEU N N 6.180 5.230 -5.029 1.00 . B B . 6 LEU N 1 1 2 1192 2 2 6 LEU O O 3.294 5.650 -5.662 1.00 . B B . 6 LEU O 1 1 2 1193 2 2 7 CYS C C 2.251 4.819 -9.337 1.00 . B B . 7 CYS C 1 1 2 1194 2 2 7 CYS CA C 2.954 5.727 -8.321 1.00 . B B . 7 CYS CA 1 1 2 1195 2 2 7 CYS CB C 3.557 6.922 -9.059 1.00 . B B . 7 CYS CB 1 1 2 1196 2 2 7 CYS H H 4.701 4.485 -8.128 1.00 . B B . 7 CYS H 1 1 2 1197 2 2 7 CYS HA H 2.237 6.081 -7.596 1.00 . B B . 7 CYS HA 1 1 2 1198 2 2 7 CYS HB2 H 4.229 6.567 -9.827 1.00 . B B . 7 CYS HB2 1 1 2 1199 2 2 7 CYS HB3 H 2.767 7.502 -9.511 1.00 . B B . 7 CYS HB3 1 1 2 1200 2 2 7 CYS N N 4.035 4.985 -7.617 1.00 . B B . 7 CYS N 1 1 2 1201 2 2 7 CYS O O 2.882 4.210 -10.180 1.00 . B B . 7 CYS O 1 1 2 1202 2 2 7 CYS SG S 4.472 7.957 -7.890 1.00 . B B . 7 CYS SG 1 1 2 1203 2 2 8 GLY C C 0.937 2.629 -10.587 1.00 . B B . 8 GLY C 1 1 2 1204 2 2 8 GLY CA C 0.169 3.905 -10.232 1.00 . B B . 8 GLY CA 1 1 2 1205 2 2 8 GLY H H 0.469 5.264 -8.588 1.00 . B B . 8 GLY H 1 1 2 1206 2 2 8 GLY HA2 H -0.776 3.637 -9.785 1.00 . B B . 8 GLY HA2 1 1 2 1207 2 2 8 GLY HA3 H -0.012 4.471 -11.134 1.00 . B B . 8 GLY HA3 1 1 2 1208 2 2 8 GLY N N 0.946 4.746 -9.270 1.00 . B B . 8 GLY N 1 1 2 1209 2 2 8 GLY O O 1.245 1.823 -9.734 1.00 . B B . 8 GLY O 1 1 2 1210 2 2 9 SER C C 3.025 0.840 -11.244 1.00 . B B . 9 SER C 1 1 2 1211 2 2 9 SER CA C 1.973 1.219 -12.288 1.00 . B B . 9 SER CA 1 1 2 1212 2 2 9 SER CB C 2.662 1.497 -13.624 1.00 . B B . 9 SER CB 1 1 2 1213 2 2 9 SER H H 0.961 3.108 -12.514 1.00 . B B . 9 SER H 1 1 2 1214 2 2 9 SER HA H 1.276 0.404 -12.407 1.00 . B B . 9 SER HA 1 1 2 1215 2 2 9 SER HB2 H 2.963 0.568 -14.077 1.00 . B B . 9 SER HB2 1 1 2 1216 2 2 9 SER HB3 H 1.973 2.011 -14.282 1.00 . B B . 9 SER HB3 1 1 2 1217 2 2 9 SER HG H 4.588 1.750 -13.512 1.00 . B B . 9 SER HG 1 1 2 1218 2 2 9 SER N N 1.234 2.443 -11.849 1.00 . B B . 9 SER N 1 1 2 1219 2 2 9 SER O O 2.934 -0.189 -10.604 1.00 . B B . 9 SER O 1 1 2 1220 2 2 9 SER OG O 3.811 2.302 -13.398 1.00 . B B . 9 SER OG 1 1 2 1221 2 2 10 ASP C C 4.374 0.959 -8.740 1.00 . B B . 10 ASP C 1 1 2 1222 2 2 10 ASP CA C 5.061 1.353 -10.045 1.00 . B B . 10 ASP CA 1 1 2 1223 2 2 10 ASP CB C 5.917 2.594 -9.807 1.00 . B B . 10 ASP CB 1 1 2 1224 2 2 10 ASP CG C 6.596 3.005 -11.115 1.00 . B B . 10 ASP CG 1 1 2 1225 2 2 10 ASP H H 4.067 2.495 -11.574 1.00 . B B . 10 ASP H 1 1 2 1226 2 2 10 ASP HA H 5.679 0.539 -10.395 1.00 . B B . 10 ASP HA 1 1 2 1227 2 2 10 ASP HB2 H 5.284 3.398 -9.458 1.00 . B B . 10 ASP HB2 1 1 2 1228 2 2 10 ASP HB3 H 6.669 2.377 -9.065 1.00 . B B . 10 ASP HB3 1 1 2 1229 2 2 10 ASP N N 4.015 1.666 -11.058 1.00 . B B . 10 ASP N 1 1 2 1230 2 2 10 ASP O O 4.768 0.027 -8.068 1.00 . B B . 10 ASP O 1 1 2 1231 2 2 10 ASP OD1 O 6.271 2.424 -12.137 1.00 . B B . 10 ASP OD1 1 1 2 1232 2 2 10 ASP OD2 O 7.429 3.895 -11.072 1.00 . B B . 10 ASP OD2 1 1 2 1233 2 2 11 LEU C C 2.312 -0.142 -7.106 1.00 . B B . 11 LEU C 1 1 2 1234 2 2 11 LEU CA C 2.604 1.356 -7.137 1.00 . B B . 11 LEU CA 1 1 2 1235 2 2 11 LEU CB C 1.290 2.145 -7.147 1.00 . B B . 11 LEU CB 1 1 2 1236 2 2 11 LEU CD1 C 1.759 2.334 -4.651 1.00 . B B . 11 LEU CD1 1 1 2 1237 2 2 11 LEU CD2 C -0.059 3.654 -5.704 1.00 . B B . 11 LEU CD2 1 1 2 1238 2 2 11 LEU CG C 0.684 2.321 -5.740 1.00 . B B . 11 LEU CG 1 1 2 1239 2 2 11 LEU H H 3.047 2.412 -8.954 1.00 . B B . 11 LEU H 1 1 2 1240 2 2 11 LEU HA H 3.205 1.633 -6.292 1.00 . B B . 11 LEU HA 1 1 2 1241 2 2 11 LEU HB2 H 1.475 3.119 -7.572 1.00 . B B . 11 LEU HB2 1 1 2 1242 2 2 11 LEU HB3 H 0.580 1.621 -7.770 1.00 . B B . 11 LEU HB3 1 1 2 1243 2 2 11 LEU HD11 H 2.419 3.170 -4.812 1.00 . B B . 11 LEU HD11 1 1 2 1244 2 2 11 LEU HD12 H 2.320 1.414 -4.681 1.00 . B B . 11 LEU HD12 1 1 2 1245 2 2 11 LEU HD13 H 1.284 2.435 -3.684 1.00 . B B . 11 LEU HD13 1 1 2 1246 2 2 11 LEU HD21 H 0.460 4.336 -5.047 1.00 . B B . 11 LEU HD21 1 1 2 1247 2 2 11 LEU HD22 H -1.063 3.497 -5.343 1.00 . B B . 11 LEU HD22 1 1 2 1248 2 2 11 LEU HD23 H -0.094 4.074 -6.700 1.00 . B B . 11 LEU HD23 1 1 2 1249 2 2 11 LEU HG H -0.013 1.519 -5.547 1.00 . B B . 11 LEU HG 1 1 2 1250 2 2 11 LEU N N 3.342 1.670 -8.388 1.00 . B B . 11 LEU N 1 1 2 1251 2 2 11 LEU O O 2.759 -0.856 -6.232 1.00 . B B . 11 LEU O 1 1 2 1252 2 2 12 ALA C C 2.594 -2.841 -8.238 1.00 . B B . 12 ALA C 1 1 2 1253 2 2 12 ALA CA C 1.277 -2.081 -8.111 1.00 . B B . 12 ALA CA 1 1 2 1254 2 2 12 ALA CB C 0.388 -2.398 -9.315 1.00 . B B . 12 ALA CB 1 1 2 1255 2 2 12 ALA H H 1.239 -0.035 -8.775 1.00 . B B . 12 ALA H 1 1 2 1256 2 2 12 ALA HA H 0.775 -2.374 -7.200 1.00 . B B . 12 ALA HA 1 1 2 1257 2 2 12 ALA HB1 H -0.074 -3.365 -9.175 1.00 . B B . 12 ALA HB1 1 1 2 1258 2 2 12 ALA HB2 H 0.989 -2.415 -10.213 1.00 . B B . 12 ALA HB2 1 1 2 1259 2 2 12 ALA HB3 H -0.378 -1.644 -9.409 1.00 . B B . 12 ALA HB3 1 1 2 1260 2 2 12 ALA N N 1.578 -0.627 -8.071 1.00 . B B . 12 ALA N 1 1 2 1261 2 2 12 ALA O O 2.870 -3.747 -7.486 1.00 . B B . 12 ALA O 1 1 2 1262 2 2 13 GLU C C 5.360 -3.365 -7.973 1.00 . B B . 13 GLU C 1 1 2 1263 2 2 13 GLU CA C 4.721 -3.164 -9.347 1.00 . B B . 13 GLU CA 1 1 2 1264 2 2 13 GLU CB C 5.647 -2.315 -10.222 1.00 . B B . 13 GLU CB 1 1 2 1265 2 2 13 GLU CD C 7.610 -2.703 -11.715 1.00 . B B . 13 GLU CD 1 1 2 1266 2 2 13 GLU CG C 6.197 -3.170 -11.366 1.00 . B B . 13 GLU CG 1 1 2 1267 2 2 13 GLU H H 3.179 -1.722 -9.773 1.00 . B B . 13 GLU H 1 1 2 1268 2 2 13 GLU HA H 4.559 -4.125 -9.813 1.00 . B B . 13 GLU HA 1 1 2 1269 2 2 13 GLU HB2 H 5.093 -1.481 -10.628 1.00 . B B . 13 GLU HB2 1 1 2 1270 2 2 13 GLU HB3 H 6.467 -1.946 -9.626 1.00 . B B . 13 GLU HB3 1 1 2 1271 2 2 13 GLU HG2 H 6.221 -4.205 -11.060 1.00 . B B . 13 GLU HG2 1 1 2 1272 2 2 13 GLU HG3 H 5.560 -3.064 -12.232 1.00 . B B . 13 GLU HG3 1 1 2 1273 2 2 13 GLU N N 3.417 -2.466 -9.180 1.00 . B B . 13 GLU N 1 1 2 1274 2 2 13 GLU O O 6.000 -4.365 -7.718 1.00 . B B . 13 GLU O 1 1 2 1275 2 2 13 GLU OE1 O 8.442 -2.676 -10.822 1.00 . B B . 13 GLU OE1 1 1 2 1276 2 2 13 GLU OE2 O 7.839 -2.380 -12.869 1.00 . B B . 13 GLU OE2 1 1 2 1277 2 2 14 ALA C C 5.000 -3.636 -4.952 1.00 . B B . 14 ALA C 1 1 2 1278 2 2 14 ALA CA C 5.788 -2.584 -5.726 1.00 . B B . 14 ALA CA 1 1 2 1279 2 2 14 ALA CB C 5.733 -1.249 -4.980 1.00 . B B . 14 ALA CB 1 1 2 1280 2 2 14 ALA H H 4.662 -1.623 -7.301 1.00 . B B . 14 ALA H 1 1 2 1281 2 2 14 ALA HA H 6.819 -2.907 -5.820 1.00 . B B . 14 ALA HA 1 1 2 1282 2 2 14 ALA HB1 H 4.705 -0.935 -4.880 1.00 . B B . 14 ALA HB1 1 1 2 1283 2 2 14 ALA HB2 H 6.286 -0.505 -5.532 1.00 . B B . 14 ALA HB2 1 1 2 1284 2 2 14 ALA HB3 H 6.170 -1.368 -3.999 1.00 . B B . 14 ALA HB3 1 1 2 1285 2 2 14 ALA N N 5.189 -2.427 -7.082 1.00 . B B . 14 ALA N 1 1 2 1286 2 2 14 ALA O O 5.559 -4.581 -4.430 1.00 . B B . 14 ALA O 1 1 2 1287 2 2 15 LEU C C 2.944 -5.826 -4.916 1.00 . B B . 15 LEU C 1 1 2 1288 2 2 15 LEU CA C 2.892 -4.503 -4.146 1.00 . B B . 15 LEU CA 1 1 2 1289 2 2 15 LEU CB C 1.443 -4.026 -4.053 1.00 . B B . 15 LEU CB 1 1 2 1290 2 2 15 LEU CD1 C 0.065 -2.007 -3.552 1.00 . B B . 15 LEU CD1 1 1 2 1291 2 2 15 LEU CD2 C 1.513 -3.006 -1.779 1.00 . B B . 15 LEU CD2 1 1 2 1292 2 2 15 LEU CG C 1.393 -2.713 -3.275 1.00 . B B . 15 LEU CG 1 1 2 1293 2 2 15 LEU H H 3.265 -2.730 -5.317 1.00 . B B . 15 LEU H 1 1 2 1294 2 2 15 LEU HA H 3.296 -4.636 -3.150 1.00 . B B . 15 LEU HA 1 1 2 1295 2 2 15 LEU HB2 H 1.048 -3.874 -5.047 1.00 . B B . 15 LEU HB2 1 1 2 1296 2 2 15 LEU HB3 H 0.851 -4.768 -3.540 1.00 . B B . 15 LEU HB3 1 1 2 1297 2 2 15 LEU HD11 H 0.258 -1.017 -3.938 1.00 . B B . 15 LEU HD11 1 1 2 1298 2 2 15 LEU HD12 H -0.501 -1.933 -2.636 1.00 . B B . 15 LEU HD12 1 1 2 1299 2 2 15 LEU HD13 H -0.497 -2.573 -4.279 1.00 . B B . 15 LEU HD13 1 1 2 1300 2 2 15 LEU HD21 H 2.556 -3.024 -1.499 1.00 . B B . 15 LEU HD21 1 1 2 1301 2 2 15 LEU HD22 H 1.066 -3.966 -1.564 1.00 . B B . 15 LEU HD22 1 1 2 1302 2 2 15 LEU HD23 H 1.003 -2.237 -1.219 1.00 . B B . 15 LEU HD23 1 1 2 1303 2 2 15 LEU HG H 2.210 -2.079 -3.587 1.00 . B B . 15 LEU HG 1 1 2 1304 2 2 15 LEU N N 3.703 -3.494 -4.880 1.00 . B B . 15 LEU N 1 1 2 1305 2 2 15 LEU O O 2.809 -6.896 -4.359 1.00 . B B . 15 LEU O 1 1 2 1306 2 2 16 TYR C C 4.458 -7.764 -6.686 1.00 . B B . 16 TYR C 1 1 2 1307 2 2 16 TYR CA C 3.214 -6.961 -7.053 1.00 . B B . 16 TYR CA 1 1 2 1308 2 2 16 TYR CB C 3.328 -6.531 -8.517 1.00 . B B . 16 TYR CB 1 1 2 1309 2 2 16 TYR CD1 C 2.307 -8.730 -9.188 1.00 . B B . 16 TYR CD1 1 1 2 1310 2 2 16 TYR CD2 C 1.594 -6.708 -10.323 1.00 . B B . 16 TYR CD2 1 1 2 1311 2 2 16 TYR CE1 C 1.427 -9.483 -9.977 1.00 . B B . 16 TYR CE1 1 1 2 1312 2 2 16 TYR CE2 C 0.713 -7.459 -11.112 1.00 . B B . 16 TYR CE2 1 1 2 1313 2 2 16 TYR CG C 2.387 -7.344 -9.363 1.00 . B B . 16 TYR CG 1 1 2 1314 2 2 16 TYR CZ C 0.630 -8.847 -10.938 1.00 . B B . 16 TYR CZ 1 1 2 1315 2 2 16 TYR H H 3.248 -4.858 -6.616 1.00 . B B . 16 TYR H 1 1 2 1316 2 2 16 TYR HA H 2.329 -7.563 -6.914 1.00 . B B . 16 TYR HA 1 1 2 1317 2 2 16 TYR HB2 H 3.076 -5.486 -8.607 1.00 . B B . 16 TYR HB2 1 1 2 1318 2 2 16 TYR HB3 H 4.339 -6.683 -8.860 1.00 . B B . 16 TYR HB3 1 1 2 1319 2 2 16 TYR HD1 H 2.927 -9.218 -8.447 1.00 . B B . 16 TYR HD1 1 1 2 1320 2 2 16 TYR HD2 H 1.663 -5.638 -10.454 1.00 . B B . 16 TYR HD2 1 1 2 1321 2 2 16 TYR HE1 H 1.363 -10.552 -9.842 1.00 . B B . 16 TYR HE1 1 1 2 1322 2 2 16 TYR HE2 H 0.100 -6.968 -11.852 1.00 . B B . 16 TYR HE2 1 1 2 1323 2 2 16 TYR HH H 0.253 -10.330 -12.078 1.00 . B B . 16 TYR HH 1 1 2 1324 2 2 16 TYR N N 3.143 -5.741 -6.202 1.00 . B B . 16 TYR N 1 1 2 1325 2 2 16 TYR O O 4.546 -8.949 -6.939 1.00 . B B . 16 TYR O 1 1 2 1326 2 2 16 TYR OH O -0.236 -9.588 -11.714 1.00 . B B . 16 TYR OH 1 1 2 1327 2 2 17 LEU C C 6.721 -8.100 -4.258 1.00 . B B . 17 LEU C 1 1 2 1328 2 2 17 LEU CA C 6.688 -7.798 -5.762 1.00 . B B . 17 LEU CA 1 1 2 1329 2 2 17 LEU CB C 7.827 -6.869 -6.150 1.00 . B B . 17 LEU CB 1 1 2 1330 2 2 17 LEU CD1 C 9.165 -9.002 -6.073 1.00 . B B . 17 LEU CD1 1 1 2 1331 2 2 17 LEU CD2 C 10.234 -6.836 -6.663 1.00 . B B . 17 LEU CD2 1 1 2 1332 2 2 17 LEU CG C 9.168 -7.490 -5.798 1.00 . B B . 17 LEU CG 1 1 2 1333 2 2 17 LEU H H 5.343 -6.154 -5.949 1.00 . B B . 17 LEU H 1 1 2 1334 2 2 17 LEU HA H 6.777 -8.715 -6.319 1.00 . B B . 17 LEU HA 1 1 2 1335 2 2 17 LEU HB2 H 7.788 -6.684 -7.213 1.00 . B B . 17 LEU HB2 1 1 2 1336 2 2 17 LEU HB3 H 7.718 -5.934 -5.622 1.00 . B B . 17 LEU HB3 1 1 2 1337 2 2 17 LEU HD11 H 8.462 -9.225 -6.862 1.00 . B B . 17 LEU HD11 1 1 2 1338 2 2 17 LEU HD12 H 8.885 -9.536 -5.180 1.00 . B B . 17 LEU HD12 1 1 2 1339 2 2 17 LEU HD13 H 10.154 -9.311 -6.378 1.00 . B B . 17 LEU HD13 1 1 2 1340 2 2 17 LEU HD21 H 10.102 -7.153 -7.687 1.00 . B B . 17 LEU HD21 1 1 2 1341 2 2 17 LEU HD22 H 11.209 -7.131 -6.314 1.00 . B B . 17 LEU HD22 1 1 2 1342 2 2 17 LEU HD23 H 10.133 -5.763 -6.603 1.00 . B B . 17 LEU HD23 1 1 2 1343 2 2 17 LEU HG H 9.375 -7.301 -4.761 1.00 . B B . 17 LEU HG 1 1 2 1344 2 2 17 LEU N N 5.430 -7.113 -6.120 1.00 . B B . 17 LEU N 1 1 2 1345 2 2 17 LEU O O 7.580 -8.812 -3.779 1.00 . B B . 17 LEU O 1 1 2 1346 2 2 18 VAL C C 4.734 -8.933 -1.744 1.00 . B B . 18 VAL C 1 1 2 1347 2 2 18 VAL CA C 5.785 -7.864 -2.041 1.00 . B B . 18 VAL CA 1 1 2 1348 2 2 18 VAL CB C 5.471 -6.579 -1.261 1.00 . B B . 18 VAL CB 1 1 2 1349 2 2 18 VAL CG1 C 6.085 -5.386 -1.983 1.00 . B B . 18 VAL CG1 1 1 2 1350 2 2 18 VAL CG2 C 3.957 -6.368 -1.152 1.00 . B B . 18 VAL CG2 1 1 2 1351 2 2 18 VAL H H 5.095 -7.013 -3.898 1.00 . B B . 18 VAL H 1 1 2 1352 2 2 18 VAL HA H 6.758 -8.232 -1.748 1.00 . B B . 18 VAL HA 1 1 2 1353 2 2 18 VAL HB H 5.895 -6.652 -0.271 1.00 . B B . 18 VAL HB 1 1 2 1354 2 2 18 VAL HG11 H 6.692 -4.824 -1.292 1.00 . B B . 18 VAL HG11 1 1 2 1355 2 2 18 VAL HG12 H 5.296 -4.756 -2.366 1.00 . B B . 18 VAL HG12 1 1 2 1356 2 2 18 VAL HG13 H 6.697 -5.735 -2.800 1.00 . B B . 18 VAL HG13 1 1 2 1357 2 2 18 VAL HG21 H 3.521 -6.370 -2.140 1.00 . B B . 18 VAL HG21 1 1 2 1358 2 2 18 VAL HG22 H 3.760 -5.420 -0.673 1.00 . B B . 18 VAL HG22 1 1 2 1359 2 2 18 VAL HG23 H 3.524 -7.164 -0.565 1.00 . B B . 18 VAL HG23 1 1 2 1360 2 2 18 VAL N N 5.790 -7.580 -3.505 1.00 . B B . 18 VAL N 1 1 2 1361 2 2 18 VAL O O 4.960 -9.848 -0.977 1.00 . B B . 18 VAL O 1 1 2 1362 2 2 19 CYS C C 2.570 -10.885 -3.219 1.00 . B B . 19 CYS C 1 1 2 1363 2 2 19 CYS CA C 2.522 -9.828 -2.112 1.00 . B B . 19 CYS CA 1 1 2 1364 2 2 19 CYS CB C 1.159 -9.131 -2.102 1.00 . B B . 19 CYS CB 1 1 2 1365 2 2 19 CYS H H 3.426 -8.078 -2.968 1.00 . B B . 19 CYS H 1 1 2 1366 2 2 19 CYS HA H 2.692 -10.301 -1.156 1.00 . B B . 19 CYS HA 1 1 2 1367 2 2 19 CYS HB2 H 1.258 -8.140 -2.517 1.00 . B B . 19 CYS HB2 1 1 2 1368 2 2 19 CYS HB3 H 0.458 -9.697 -2.690 1.00 . B B . 19 CYS HB3 1 1 2 1369 2 2 19 CYS N N 3.587 -8.823 -2.352 1.00 . B B . 19 CYS N 1 1 2 1370 2 2 19 CYS O O 2.619 -12.070 -2.955 1.00 . B B . 19 CYS O 1 1 2 1371 2 2 19 CYS SG S 0.566 -9.015 -0.395 1.00 . B B . 19 CYS SG 1 1 2 1372 2 2 20 GLY C C 1.428 -12.388 -5.514 1.00 . B B . 20 GLY C 1 1 2 1373 2 2 20 GLY CA C 2.628 -11.443 -5.584 1.00 . B B . 20 GLY CA 1 1 2 1374 2 2 20 GLY H H 2.541 -9.504 -4.646 1.00 . B B . 20 GLY H 1 1 2 1375 2 2 20 GLY HA2 H 2.612 -10.909 -6.523 1.00 . B B . 20 GLY HA2 1 1 2 1376 2 2 20 GLY HA3 H 3.538 -12.020 -5.514 1.00 . B B . 20 GLY HA3 1 1 2 1377 2 2 20 GLY N N 2.570 -10.465 -4.456 1.00 . B B . 20 GLY N 1 1 2 1378 2 2 20 GLY O O 1.218 -13.051 -4.520 1.00 . B B . 20 GLY O 1 1 2 1379 2 2 21 GLU C C -1.135 -13.520 -5.212 1.00 . B B . 21 GLU C 1 1 2 1380 2 2 21 GLU CA C -0.564 -13.325 -6.614 1.00 . B B . 21 GLU CA 1 1 2 1381 2 2 21 GLU CB C -0.209 -14.685 -7.229 1.00 . B B . 21 GLU CB 1 1 2 1382 2 2 21 GLU CD C 0.450 -16.792 -6.054 1.00 . B B . 21 GLU CD 1 1 2 1383 2 2 21 GLU CG C 0.889 -15.370 -6.411 1.00 . B B . 21 GLU CG 1 1 2 1384 2 2 21 GLU H H 0.858 -11.882 -7.349 1.00 . B B . 21 GLU H 1 1 2 1385 2 2 21 GLU HA H -1.317 -12.850 -7.226 1.00 . B B . 21 GLU HA 1 1 2 1386 2 2 21 GLU HB2 H -1.088 -15.310 -7.238 1.00 . B B . 21 GLU HB2 1 1 2 1387 2 2 21 GLU HB3 H 0.138 -14.539 -8.241 1.00 . B B . 21 GLU HB3 1 1 2 1388 2 2 21 GLU HG2 H 1.799 -15.409 -6.992 1.00 . B B . 21 GLU HG2 1 1 2 1389 2 2 21 GLU HG3 H 1.066 -14.816 -5.506 1.00 . B B . 21 GLU HG3 1 1 2 1390 2 2 21 GLU N N 0.647 -12.440 -6.571 1.00 . B B . 21 GLU N 1 1 2 1391 2 2 21 GLU O O -1.599 -14.584 -4.852 1.00 . B B . 21 GLU O 1 1 2 1392 2 2 21 GLU OE1 O 0.348 -17.604 -6.959 1.00 . B B . 21 GLU OE1 1 1 2 1393 2 2 21 GLU OE2 O 0.223 -17.044 -4.883 1.00 . B B . 21 GLU OE2 1 1 2 1394 2 2 22 ARG C C -2.829 -11.608 -2.926 1.00 . B B . 22 ARG C 1 1 2 1395 2 2 22 ARG CA C -1.647 -12.572 -3.045 1.00 . B B . 22 ARG CA 1 1 2 1396 2 2 22 ARG CB C -0.553 -12.177 -2.048 1.00 . B B . 22 ARG CB 1 1 2 1397 2 2 22 ARG CD C -0.661 -14.541 -1.243 1.00 . B B . 22 ARG CD 1 1 2 1398 2 2 22 ARG CG C 0.271 -13.407 -1.663 1.00 . B B . 22 ARG CG 1 1 2 1399 2 2 22 ARG CZ C -0.221 -15.251 1.030 1.00 . B B . 22 ARG CZ 1 1 2 1400 2 2 22 ARG H H -0.733 -11.644 -4.745 1.00 . B B . 22 ARG H 1 1 2 1401 2 2 22 ARG HA H -1.981 -13.578 -2.849 1.00 . B B . 22 ARG HA 1 1 2 1402 2 2 22 ARG HB2 H 0.095 -11.448 -2.507 1.00 . B B . 22 ARG HB2 1 1 2 1403 2 2 22 ARG HB3 H -1.003 -11.752 -1.165 1.00 . B B . 22 ARG HB3 1 1 2 1404 2 2 22 ARG HD2 H -1.558 -14.125 -0.808 1.00 . B B . 22 ARG HD2 1 1 2 1405 2 2 22 ARG HD3 H -0.922 -15.129 -2.111 1.00 . B B . 22 ARG HD3 1 1 2 1406 2 2 22 ARG HE H 0.659 -16.089 -0.540 1.00 . B B . 22 ARG HE 1 1 2 1407 2 2 22 ARG HG2 H 0.864 -13.724 -2.509 1.00 . B B . 22 ARG HG2 1 1 2 1408 2 2 22 ARG HG3 H 0.924 -13.158 -0.839 1.00 . B B . 22 ARG HG3 1 1 2 1409 2 2 22 ARG HH11 H -2.029 -16.107 0.942 1.00 . B B . 22 ARG HH11 1 1 2 1410 2 2 22 ARG HH12 H -1.537 -15.551 2.507 1.00 . B B . 22 ARG HH12 1 1 2 1411 2 2 22 ARG HH21 H 1.530 -14.358 1.414 1.00 . B B . 22 ARG HH21 1 1 2 1412 2 2 22 ARG HH22 H 0.476 -14.558 2.774 1.00 . B B . 22 ARG HH22 1 1 2 1413 2 2 22 ARG N N -1.107 -12.486 -4.424 1.00 . B B . 22 ARG N 1 1 2 1414 2 2 22 ARG NE N 0.024 -15.406 -0.243 1.00 . B B . 22 ARG NE 1 1 2 1415 2 2 22 ARG NH1 N -1.351 -15.668 1.532 1.00 . B B . 22 ARG NH1 1 1 2 1416 2 2 22 ARG NH2 N 0.664 -14.677 1.800 1.00 . B B . 22 ARG NH2 1 1 2 1417 2 2 22 ARG O O -3.566 -11.624 -1.959 1.00 . B B . 22 ARG O 1 1 2 1418 2 2 23 GLY C C -3.828 -8.638 -2.950 1.00 . B B . 23 GLY C 1 1 2 1419 2 2 23 GLY CA C -4.156 -9.811 -3.874 1.00 . B B . 23 GLY CA 1 1 2 1420 2 2 23 GLY H H -2.416 -10.781 -4.688 1.00 . B B . 23 GLY H 1 1 2 1421 2 2 23 GLY HA2 H -4.345 -9.439 -4.872 1.00 . B B . 23 GLY HA2 1 1 2 1422 2 2 23 GLY HA3 H -5.038 -10.314 -3.509 1.00 . B B . 23 GLY HA3 1 1 2 1423 2 2 23 GLY N N -3.019 -10.772 -3.914 1.00 . B B . 23 GLY N 1 1 2 1424 2 2 23 GLY O O -3.891 -8.750 -1.741 1.00 . B B . 23 GLY O 1 1 2 1425 2 2 24 PHE C C -4.152 -5.191 -3.028 1.00 . B B . 24 PHE C 1 1 2 1426 2 2 24 PHE CA C -3.189 -6.320 -2.661 1.00 . B B . 24 PHE CA 1 1 2 1427 2 2 24 PHE CB C -1.741 -5.868 -2.880 1.00 . B B . 24 PHE CB 1 1 2 1428 2 2 24 PHE CD1 C -1.754 -4.702 -5.118 1.00 . B B . 24 PHE CD1 1 1 2 1429 2 2 24 PHE CD2 C -0.775 -6.917 -4.957 1.00 . B B . 24 PHE CD2 1 1 2 1430 2 2 24 PHE CE1 C -1.441 -4.663 -6.483 1.00 . B B . 24 PHE CE1 1 1 2 1431 2 2 24 PHE CE2 C -0.465 -6.879 -6.322 1.00 . B B . 24 PHE CE2 1 1 2 1432 2 2 24 PHE CG C -1.421 -5.829 -4.355 1.00 . B B . 24 PHE CG 1 1 2 1433 2 2 24 PHE CZ C -0.796 -5.752 -7.086 1.00 . B B . 24 PHE CZ 1 1 2 1434 2 2 24 PHE H H -3.466 -7.430 -4.487 1.00 . B B . 24 PHE H 1 1 2 1435 2 2 24 PHE HA H -3.332 -6.582 -1.624 1.00 . B B . 24 PHE HA 1 1 2 1436 2 2 24 PHE HB2 H -1.608 -4.883 -2.460 1.00 . B B . 24 PHE HB2 1 1 2 1437 2 2 24 PHE HB3 H -1.073 -6.558 -2.389 1.00 . B B . 24 PHE HB3 1 1 2 1438 2 2 24 PHE HD1 H -2.252 -3.863 -4.654 1.00 . B B . 24 PHE HD1 1 1 2 1439 2 2 24 PHE HD2 H -0.519 -7.786 -4.368 1.00 . B B . 24 PHE HD2 1 1 2 1440 2 2 24 PHE HE1 H -1.699 -3.795 -7.071 1.00 . B B . 24 PHE HE1 1 1 2 1441 2 2 24 PHE HE2 H 0.031 -7.718 -6.785 1.00 . B B . 24 PHE HE2 1 1 2 1442 2 2 24 PHE HZ H -0.552 -5.722 -8.138 1.00 . B B . 24 PHE HZ 1 1 2 1443 2 2 24 PHE N N -3.497 -7.504 -3.509 1.00 . B B . 24 PHE N 1 1 2 1444 2 2 24 PHE O O -4.314 -4.852 -4.184 1.00 . B B . 24 PHE O 1 1 2 1445 2 2 25 PHE C C -5.102 -2.162 -2.226 1.00 . B B . 25 PHE C 1 1 2 1446 2 2 25 PHE CA C -5.776 -3.529 -2.370 1.00 . B B . 25 PHE CA 1 1 2 1447 2 2 25 PHE CB C -6.969 -3.614 -1.413 1.00 . B B . 25 PHE CB 1 1 2 1448 2 2 25 PHE CD1 C -6.410 -2.160 0.565 1.00 . B B . 25 PHE CD1 1 1 2 1449 2 2 25 PHE CD2 C -6.149 -4.563 0.780 1.00 . B B . 25 PHE CD2 1 1 2 1450 2 2 25 PHE CE1 C -5.977 -1.993 1.885 1.00 . B B . 25 PHE CE1 1 1 2 1451 2 2 25 PHE CE2 C -5.715 -4.395 2.103 1.00 . B B . 25 PHE CE2 1 1 2 1452 2 2 25 PHE CG C -6.496 -3.444 0.010 1.00 . B B . 25 PHE CG 1 1 2 1453 2 2 25 PHE CZ C -5.630 -3.111 2.655 1.00 . B B . 25 PHE CZ 1 1 2 1454 2 2 25 PHE H H -4.681 -4.911 -1.132 1.00 . B B . 25 PHE H 1 1 2 1455 2 2 25 PHE HA H -6.125 -3.647 -3.383 1.00 . B B . 25 PHE HA 1 1 2 1456 2 2 25 PHE HB2 H -7.677 -2.834 -1.653 1.00 . B B . 25 PHE HB2 1 1 2 1457 2 2 25 PHE HB3 H -7.446 -4.576 -1.520 1.00 . B B . 25 PHE HB3 1 1 2 1458 2 2 25 PHE HD1 H -6.677 -1.299 -0.026 1.00 . B B . 25 PHE HD1 1 1 2 1459 2 2 25 PHE HD2 H -6.213 -5.554 0.356 1.00 . B B . 25 PHE HD2 1 1 2 1460 2 2 25 PHE HE1 H -5.913 -1.002 2.310 1.00 . B B . 25 PHE HE1 1 1 2 1461 2 2 25 PHE HE2 H -5.447 -5.257 2.694 1.00 . B B . 25 PHE HE2 1 1 2 1462 2 2 25 PHE HZ H -5.296 -2.982 3.674 1.00 . B B . 25 PHE HZ 1 1 2 1463 2 2 25 PHE N N -4.809 -4.617 -2.058 1.00 . B B . 25 PHE N 1 1 2 1464 2 2 25 PHE O O -4.406 -1.896 -1.266 1.00 . B B . 25 PHE O 1 1 2 1465 2 2 26 TYR C C -5.782 1.112 -3.417 1.00 . B B . 26 TYR C 1 1 2 1466 2 2 26 TYR CA C -4.702 0.068 -3.105 1.00 . B B . 26 TYR CA 1 1 2 1467 2 2 26 TYR CB C -3.566 0.167 -4.134 1.00 . B B . 26 TYR CB 1 1 2 1468 2 2 26 TYR CD1 C -4.919 -0.591 -6.120 1.00 . B B . 26 TYR CD1 1 1 2 1469 2 2 26 TYR CD2 C -3.931 1.624 -6.159 1.00 . B B . 26 TYR CD2 1 1 2 1470 2 2 26 TYR CE1 C -5.472 -0.367 -7.386 1.00 . B B . 26 TYR CE1 1 1 2 1471 2 2 26 TYR CE2 C -4.484 1.849 -7.424 1.00 . B B . 26 TYR CE2 1 1 2 1472 2 2 26 TYR CG C -4.148 0.403 -5.507 1.00 . B B . 26 TYR CG 1 1 2 1473 2 2 26 TYR CZ C -5.256 0.854 -8.039 1.00 . B B . 26 TYR CZ 1 1 2 1474 2 2 26 TYR H H -5.885 -1.526 -3.937 1.00 . B B . 26 TYR H 1 1 2 1475 2 2 26 TYR HA H -4.310 0.238 -2.113 1.00 . B B . 26 TYR HA 1 1 2 1476 2 2 26 TYR HB2 H -2.915 0.988 -3.872 1.00 . B B . 26 TYR HB2 1 1 2 1477 2 2 26 TYR HB3 H -3.002 -0.754 -4.136 1.00 . B B . 26 TYR HB3 1 1 2 1478 2 2 26 TYR HD1 H -5.087 -1.531 -5.616 1.00 . B B . 26 TYR HD1 1 1 2 1479 2 2 26 TYR HD2 H -3.335 2.391 -5.685 1.00 . B B . 26 TYR HD2 1 1 2 1480 2 2 26 TYR HE1 H -6.069 -1.135 -7.856 1.00 . B B . 26 TYR HE1 1 1 2 1481 2 2 26 TYR HE2 H -4.320 2.792 -7.925 1.00 . B B . 26 TYR HE2 1 1 2 1482 2 2 26 TYR HH H -6.756 1.137 -9.187 1.00 . B B . 26 TYR HH 1 1 2 1483 2 2 26 TYR N N -5.314 -1.289 -3.175 1.00 . B B . 26 TYR N 1 1 2 1484 2 2 26 TYR O O -5.560 2.041 -4.169 1.00 . B B . 26 TYR O 1 1 2 1485 2 2 26 TYR OH O -5.802 1.075 -9.287 1.00 . B B . 26 TYR OH 1 1 2 1486 2 2 27 THR C C -7.547 3.320 -3.313 1.00 . B B . 27 THR C 1 1 2 1487 2 2 27 THR CA C -8.076 1.898 -3.121 1.00 . B B . 27 THR CA 1 1 2 1488 2 2 27 THR CB C -9.069 1.882 -1.953 1.00 . B B . 27 THR CB 1 1 2 1489 2 2 27 THR CG2 C -8.395 1.324 -0.701 1.00 . B B . 27 THR CG2 1 1 2 1490 2 2 27 THR H H -7.100 0.174 -2.269 1.00 . B B . 27 THR H 1 1 2 1491 2 2 27 THR HA H -8.588 1.589 -4.018 1.00 . B B . 27 THR HA 1 1 2 1492 2 2 27 THR HB H -9.911 1.262 -2.211 1.00 . B B . 27 THR HB 1 1 2 1493 2 2 27 THR HG1 H -9.862 3.567 -2.517 1.00 . B B . 27 THR HG1 1 1 2 1494 2 2 27 THR HG21 H -8.982 1.579 0.167 1.00 . B B . 27 THR HG21 1 1 2 1495 2 2 27 THR HG22 H -7.406 1.748 -0.607 1.00 . B B . 27 THR HG22 1 1 2 1496 2 2 27 THR HG23 H -8.319 0.249 -0.784 1.00 . B B . 27 THR HG23 1 1 2 1497 2 2 27 THR N N -6.952 0.944 -2.857 1.00 . B B . 27 THR N 1 1 2 1498 2 2 27 THR O O -6.497 3.682 -2.819 1.00 . B B . 27 THR O 1 1 2 1499 2 2 27 THR OG1 O -9.520 3.205 -1.695 1.00 . B B . 27 THR OG1 1 1 2 1500 2 2 28 LYS C C -8.985 6.494 -3.975 1.00 . B B . 28 LYS C 1 1 2 1501 2 2 28 LYS CA C -7.829 5.531 -4.267 1.00 . B B . 28 LYS CA 1 1 2 1502 2 2 28 LYS CB C -7.393 5.686 -5.728 1.00 . B B . 28 LYS CB 1 1 2 1503 2 2 28 LYS CD C -8.377 4.834 -7.862 1.00 . B B . 28 LYS CD 1 1 2 1504 2 2 28 LYS CE C -9.296 5.287 -8.998 1.00 . B B . 28 LYS CE 1 1 2 1505 2 2 28 LYS CG C -8.628 5.706 -6.631 1.00 . B B . 28 LYS CG 1 1 2 1506 2 2 28 LYS H H -9.119 3.809 -4.416 1.00 . B B . 28 LYS H 1 1 2 1507 2 2 28 LYS HA H -6.997 5.757 -3.617 1.00 . B B . 28 LYS HA 1 1 2 1508 2 2 28 LYS HB2 H -6.847 6.611 -5.843 1.00 . B B . 28 LYS HB2 1 1 2 1509 2 2 28 LYS HB3 H -6.759 4.856 -6.006 1.00 . B B . 28 LYS HB3 1 1 2 1510 2 2 28 LYS HD2 H -7.346 4.934 -8.170 1.00 . B B . 28 LYS HD2 1 1 2 1511 2 2 28 LYS HD3 H -8.585 3.802 -7.623 1.00 . B B . 28 LYS HD3 1 1 2 1512 2 2 28 LYS HE2 H -9.914 6.105 -8.656 1.00 . B B . 28 LYS HE2 1 1 2 1513 2 2 28 LYS HE3 H -8.699 5.613 -9.836 1.00 . B B . 28 LYS HE3 1 1 2 1514 2 2 28 LYS HG2 H -9.478 5.322 -6.086 1.00 . B B . 28 LYS HG2 1 1 2 1515 2 2 28 LYS HG3 H -8.829 6.720 -6.945 1.00 . B B . 28 LYS HG3 1 1 2 1516 2 2 28 LYS HZ1 H -10.179 3.431 -8.669 1.00 . B B . 28 LYS HZ1 1 1 2 1517 2 2 28 LYS HZ2 H -9.789 3.734 -10.294 1.00 . B B . 28 LYS HZ2 1 1 2 1518 2 2 28 LYS HZ3 H -11.131 4.496 -9.581 1.00 . B B . 28 LYS HZ3 1 1 2 1519 2 2 28 LYS N N -8.276 4.128 -4.031 1.00 . B B . 28 LYS N 1 1 2 1520 2 2 28 LYS NZ N -10.164 4.151 -9.417 1.00 . B B . 28 LYS NZ 1 1 2 1521 2 2 28 LYS O O -10.135 6.099 -3.978 1.00 . B B . 28 LYS O 1 1 2 1522 2 2 29 PRO C C -10.263 9.299 -4.735 1.00 . B B . 29 PRO C 1 1 2 1523 2 2 29 PRO CA C -9.623 8.791 -3.439 1.00 . B B . 29 PRO CA 1 1 2 1524 2 2 29 PRO CB C -8.779 9.891 -2.787 1.00 . B B . 29 PRO CB 1 1 2 1525 2 2 29 PRO CD C -7.236 8.195 -3.729 1.00 . B B . 29 PRO CD 1 1 2 1526 2 2 29 PRO CG C -7.321 9.659 -3.256 1.00 . B B . 29 PRO CG 1 1 2 1527 2 2 29 PRO HA H -10.372 8.441 -2.748 1.00 . B B . 29 PRO HA 1 1 2 1528 2 2 29 PRO HB2 H -9.126 10.864 -3.108 1.00 . B B . 29 PRO HB2 1 1 2 1529 2 2 29 PRO HB3 H -8.832 9.812 -1.713 1.00 . B B . 29 PRO HB3 1 1 2 1530 2 2 29 PRO HD2 H -6.816 8.144 -4.724 1.00 . B B . 29 PRO HD2 1 1 2 1531 2 2 29 PRO HD3 H -6.654 7.606 -3.038 1.00 . B B . 29 PRO HD3 1 1 2 1532 2 2 29 PRO HG2 H -7.086 10.329 -4.073 1.00 . B B . 29 PRO HG2 1 1 2 1533 2 2 29 PRO HG3 H -6.638 9.817 -2.437 1.00 . B B . 29 PRO HG3 1 1 2 1534 2 2 29 PRO N N -8.640 7.734 -3.734 1.00 . B B . 29 PRO N 1 1 2 1535 2 2 29 PRO O O -9.587 9.538 -5.716 1.00 . B B . 29 PRO O 1 1 2 1536 2 2 30 THR C C -11.644 9.284 -7.207 1.00 . B B . 30 THR C 1 1 2 1537 2 2 30 THR CA C -12.247 9.959 -5.974 1.00 . B B . 30 THR CA 1 1 2 1538 2 2 30 THR CB C -12.071 11.477 -6.086 1.00 . B B . 30 THR CB 1 1 2 1539 2 2 30 THR CG2 C -10.599 11.810 -6.330 1.00 . B B . 30 THR CG2 1 1 2 1540 2 2 30 THR H H -12.084 9.266 -3.939 1.00 . B B . 30 THR H 1 1 2 1541 2 2 30 THR HA H -13.301 9.724 -5.915 1.00 . B B . 30 THR HA 1 1 2 1542 2 2 30 THR HB H -12.394 11.944 -5.169 1.00 . B B . 30 THR HB 1 1 2 1543 2 2 30 THR HG1 H -13.099 12.870 -6.970 1.00 . B B . 30 THR HG1 1 1 2 1544 2 2 30 THR HG21 H -10.053 11.729 -5.403 1.00 . B B . 30 THR HG21 1 1 2 1545 2 2 30 THR HG22 H -10.516 12.818 -6.711 1.00 . B B . 30 THR HG22 1 1 2 1546 2 2 30 THR HG23 H -10.188 11.118 -7.051 1.00 . B B . 30 THR HG23 1 1 2 1547 2 2 30 THR N N -11.561 9.466 -4.744 1.00 . B B . 30 THR N 1 1 2 1548 2 2 30 THR O O -11.076 8.216 -7.054 1.00 . B B . 30 THR O 1 1 2 1549 2 2 30 THR OXT O -11.758 9.848 -8.283 1.00 . B B . 30 THR OXT 1 1 2 1550 2 2 30 THR OG1 O -12.854 11.963 -7.166 1.00 . B B . 30 THR OG1 1 1 3 1551 1 1 1 GLY C C -3.841 7.199 -0.090 1.00 . A A . 1 GLY C 1 1 3 1552 1 1 1 GLY CA C -5.305 7.477 -0.114 1.00 . A A . 1 GLY CA 1 1 3 1553 1 1 1 GLY H1 H -6.706 7.960 1.396 1.00 . A A . 1 GLY H1 1 1 3 1554 1 1 1 GLY H2 H -6.241 9.289 0.447 1.00 . A A . 1 GLY H2 1 1 3 1555 1 1 1 GLY H3 H -5.184 8.676 1.625 1.00 . A A . 1 GLY H3 1 1 3 1556 1 1 1 GLY HA2 H -5.378 6.547 0.172 1.00 . A A . 1 GLY HA2 1 1 3 1557 1 1 1 GLY HA3 H -5.849 7.688 -1.127 1.00 . A A . 1 GLY HA3 1 1 3 1558 1 1 1 GLY N N -5.908 8.426 0.922 1.00 . A A . 1 GLY N 1 1 3 1559 1 1 1 GLY O O -3.074 7.908 0.531 1.00 . A A . 1 GLY O 1 1 3 1560 1 1 2 ILE C C -1.403 6.247 -2.163 1.00 . A A . 2 ILE C 1 1 3 1561 1 1 2 ILE CA C -1.960 5.847 -0.797 1.00 . A A . 2 ILE CA 1 1 3 1562 1 1 2 ILE CB C -1.767 4.341 -0.562 1.00 . A A . 2 ILE CB 1 1 3 1563 1 1 2 ILE CD1 C -0.072 2.563 -0.096 1.00 . A A . 2 ILE CD1 1 1 3 1564 1 1 2 ILE CG1 C -0.337 4.069 -0.081 1.00 . A A . 2 ILE CG1 1 1 3 1565 1 1 2 ILE CG2 C -2.018 3.573 -1.861 1.00 . A A . 2 ILE CG2 1 1 3 1566 1 1 2 ILE H H -4.045 5.618 -1.276 1.00 . A A . 2 ILE H 1 1 3 1567 1 1 2 ILE HA H -1.452 6.401 -0.024 1.00 . A A . 2 ILE HA 1 1 3 1568 1 1 2 ILE HB H -2.468 4.005 0.190 1.00 . A A . 2 ILE HB 1 1 3 1569 1 1 2 ILE HD11 H 0.702 2.327 0.619 1.00 . A A . 2 ILE HD11 1 1 3 1570 1 1 2 ILE HD12 H 0.246 2.263 -1.083 1.00 . A A . 2 ILE HD12 1 1 3 1571 1 1 2 ILE HD13 H -0.977 2.035 0.166 1.00 . A A . 2 ILE HD13 1 1 3 1572 1 1 2 ILE HG12 H 0.363 4.563 -0.736 1.00 . A A . 2 ILE HG12 1 1 3 1573 1 1 2 ILE HG13 H -0.217 4.442 0.924 1.00 . A A . 2 ILE HG13 1 1 3 1574 1 1 2 ILE HG21 H -1.246 3.818 -2.577 1.00 . A A . 2 ILE HG21 1 1 3 1575 1 1 2 ILE HG22 H -2.981 3.849 -2.262 1.00 . A A . 2 ILE HG22 1 1 3 1576 1 1 2 ILE HG23 H -2.000 2.512 -1.662 1.00 . A A . 2 ILE HG23 1 1 3 1577 1 1 2 ILE N N -3.412 6.171 -0.771 1.00 . A A . 2 ILE N 1 1 3 1578 1 1 2 ILE O O -0.263 6.643 -2.297 1.00 . A A . 2 ILE O 1 1 3 1579 1 1 3 VAL C C -1.169 7.914 -4.539 1.00 . A A . 3 VAL C 1 1 3 1580 1 1 3 VAL CA C -1.764 6.506 -4.545 1.00 . A A . 3 VAL CA 1 1 3 1581 1 1 3 VAL CB C -2.960 6.462 -5.494 1.00 . A A . 3 VAL CB 1 1 3 1582 1 1 3 VAL CG1 C -2.461 6.432 -6.935 1.00 . A A . 3 VAL CG1 1 1 3 1583 1 1 3 VAL CG2 C -3.788 5.205 -5.216 1.00 . A A . 3 VAL CG2 1 1 3 1584 1 1 3 VAL H H -3.129 5.819 -3.036 1.00 . A A . 3 VAL H 1 1 3 1585 1 1 3 VAL HA H -1.017 5.800 -4.876 1.00 . A A . 3 VAL HA 1 1 3 1586 1 1 3 VAL HB H -3.572 7.340 -5.343 1.00 . A A . 3 VAL HB 1 1 3 1587 1 1 3 VAL HG11 H -1.910 7.337 -7.142 1.00 . A A . 3 VAL HG11 1 1 3 1588 1 1 3 VAL HG12 H -3.304 6.360 -7.605 1.00 . A A . 3 VAL HG12 1 1 3 1589 1 1 3 VAL HG13 H -1.816 5.577 -7.073 1.00 . A A . 3 VAL HG13 1 1 3 1590 1 1 3 VAL HG21 H -4.727 5.485 -4.761 1.00 . A A . 3 VAL HG21 1 1 3 1591 1 1 3 VAL HG22 H -3.243 4.556 -4.547 1.00 . A A . 3 VAL HG22 1 1 3 1592 1 1 3 VAL HG23 H -3.979 4.687 -6.144 1.00 . A A . 3 VAL HG23 1 1 3 1593 1 1 3 VAL N N -2.215 6.141 -3.177 1.00 . A A . 3 VAL N 1 1 3 1594 1 1 3 VAL O O -0.170 8.176 -5.176 1.00 . A A . 3 VAL O 1 1 3 1595 1 1 4 GLU C C -0.234 10.346 -2.643 1.00 . A A . 4 GLU C 1 1 3 1596 1 1 4 GLU CA C -1.233 10.213 -3.794 1.00 . A A . 4 GLU CA 1 1 3 1597 1 1 4 GLU CB C -2.377 11.207 -3.591 1.00 . A A . 4 GLU CB 1 1 3 1598 1 1 4 GLU CD C -2.856 13.573 -2.944 1.00 . A A . 4 GLU CD 1 1 3 1599 1 1 4 GLU CG C -1.808 12.625 -3.529 1.00 . A A . 4 GLU CG 1 1 3 1600 1 1 4 GLU H H -2.581 8.601 -3.320 1.00 . A A . 4 GLU H 1 1 3 1601 1 1 4 GLU HA H -0.733 10.427 -4.728 1.00 . A A . 4 GLU HA 1 1 3 1602 1 1 4 GLU HB2 H -3.070 11.131 -4.417 1.00 . A A . 4 GLU HB2 1 1 3 1603 1 1 4 GLU HB3 H -2.889 10.984 -2.668 1.00 . A A . 4 GLU HB3 1 1 3 1604 1 1 4 GLU HG2 H -0.927 12.630 -2.904 1.00 . A A . 4 GLU HG2 1 1 3 1605 1 1 4 GLU HG3 H -1.546 12.951 -4.524 1.00 . A A . 4 GLU HG3 1 1 3 1606 1 1 4 GLU N N -1.773 8.826 -3.829 1.00 . A A . 4 GLU N 1 1 3 1607 1 1 4 GLU O O 0.768 11.023 -2.755 1.00 . A A . 4 GLU O 1 1 3 1608 1 1 4 GLU OE1 O -3.710 14.015 -3.695 1.00 . A A . 4 GLU OE1 1 1 3 1609 1 1 4 GLU OE2 O -2.784 13.845 -1.757 1.00 . A A . 4 GLU OE2 1 1 3 1610 1 1 5 GLN C C 1.733 9.056 -0.706 1.00 . A A . 5 GLN C 1 1 3 1611 1 1 5 GLN CA C 0.436 9.798 -0.379 1.00 . A A . 5 GLN CA 1 1 3 1612 1 1 5 GLN CB C -0.214 9.170 0.857 1.00 . A A . 5 GLN CB 1 1 3 1613 1 1 5 GLN CD C -1.816 9.550 2.739 1.00 . A A . 5 GLN CD 1 1 3 1614 1 1 5 GLN CG C -1.137 10.191 1.527 1.00 . A A . 5 GLN CG 1 1 3 1615 1 1 5 GLN H H -1.314 9.166 -1.466 1.00 . A A . 5 GLN H 1 1 3 1616 1 1 5 GLN HA H 0.658 10.837 -0.180 1.00 . A A . 5 GLN HA 1 1 3 1617 1 1 5 GLN HB2 H -0.788 8.304 0.562 1.00 . A A . 5 GLN HB2 1 1 3 1618 1 1 5 GLN HB3 H 0.555 8.871 1.555 1.00 . A A . 5 GLN HB3 1 1 3 1619 1 1 5 GLN HE21 H -0.270 9.858 3.949 1.00 . A A . 5 GLN HE21 1 1 3 1620 1 1 5 GLN HE22 H -1.605 9.085 4.658 1.00 . A A . 5 GLN HE22 1 1 3 1621 1 1 5 GLN HG2 H -0.557 11.045 1.847 1.00 . A A . 5 GLN HG2 1 1 3 1622 1 1 5 GLN HG3 H -1.890 10.510 0.823 1.00 . A A . 5 GLN HG3 1 1 3 1623 1 1 5 GLN N N -0.499 9.706 -1.537 1.00 . A A . 5 GLN N 1 1 3 1624 1 1 5 GLN NE2 N -1.177 9.493 3.877 1.00 . A A . 5 GLN NE2 1 1 3 1625 1 1 5 GLN O O 2.818 9.567 -0.506 1.00 . A A . 5 GLN O 1 1 3 1626 1 1 5 GLN OE1 O -2.939 9.096 2.652 1.00 . A A . 5 GLN OE1 1 1 3 1627 1 1 6 CYS C C 3.514 7.670 -2.789 1.00 . A A . 6 CYS C 1 1 3 1628 1 1 6 CYS CA C 2.867 7.085 -1.534 1.00 . A A . 6 CYS CA 1 1 3 1629 1 1 6 CYS CB C 2.509 5.620 -1.783 1.00 . A A . 6 CYS CB 1 1 3 1630 1 1 6 CYS H H 0.752 7.457 -1.355 1.00 . A A . 6 CYS H 1 1 3 1631 1 1 6 CYS HA H 3.562 7.149 -0.710 1.00 . A A . 6 CYS HA 1 1 3 1632 1 1 6 CYS HB2 H 1.440 5.522 -1.889 1.00 . A A . 6 CYS HB2 1 1 3 1633 1 1 6 CYS HB3 H 2.993 5.280 -2.688 1.00 . A A . 6 CYS HB3 1 1 3 1634 1 1 6 CYS N N 1.635 7.854 -1.203 1.00 . A A . 6 CYS N 1 1 3 1635 1 1 6 CYS O O 4.709 7.576 -2.983 1.00 . A A . 6 CYS O 1 1 3 1636 1 1 6 CYS SG S 3.072 4.621 -0.386 1.00 . A A . 6 CYS SG 1 1 3 1637 1 1 7 CYS C C 3.896 10.242 -4.557 1.00 . A A . 7 CYS C 1 1 3 1638 1 1 7 CYS CA C 3.320 8.864 -4.881 1.00 . A A . 7 CYS CA 1 1 3 1639 1 1 7 CYS CB C 2.232 9.000 -5.947 1.00 . A A . 7 CYS CB 1 1 3 1640 1 1 7 CYS H H 1.774 8.343 -3.473 1.00 . A A . 7 CYS H 1 1 3 1641 1 1 7 CYS HA H 4.106 8.223 -5.247 1.00 . A A . 7 CYS HA 1 1 3 1642 1 1 7 CYS HB2 H 1.719 8.057 -6.061 1.00 . A A . 7 CYS HB2 1 1 3 1643 1 1 7 CYS HB3 H 1.527 9.761 -5.648 1.00 . A A . 7 CYS HB3 1 1 3 1644 1 1 7 CYS N N 2.738 8.275 -3.645 1.00 . A A . 7 CYS N 1 1 3 1645 1 1 7 CYS O O 4.943 10.619 -5.045 1.00 . A A . 7 CYS O 1 1 3 1646 1 1 7 CYS SG S 2.991 9.467 -7.523 1.00 . A A . 7 CYS SG 1 1 3 1647 1 1 8 THR C C 4.741 12.206 -2.215 1.00 . A A . 8 THR C 1 1 3 1648 1 1 8 THR CA C 3.738 12.342 -3.364 1.00 . A A . 8 THR CA 1 1 3 1649 1 1 8 THR CB C 2.572 13.232 -2.927 1.00 . A A . 8 THR CB 1 1 3 1650 1 1 8 THR CG2 C 3.113 14.553 -2.377 1.00 . A A . 8 THR CG2 1 1 3 1651 1 1 8 THR H H 2.385 10.667 -3.340 1.00 . A A . 8 THR H 1 1 3 1652 1 1 8 THR HA H 4.228 12.784 -4.220 1.00 . A A . 8 THR HA 1 1 3 1653 1 1 8 THR HB H 2.005 12.731 -2.156 1.00 . A A . 8 THR HB 1 1 3 1654 1 1 8 THR HG1 H 0.951 12.937 -3.959 1.00 . A A . 8 THR HG1 1 1 3 1655 1 1 8 THR HG21 H 3.568 14.382 -1.414 1.00 . A A . 8 THR HG21 1 1 3 1656 1 1 8 THR HG22 H 2.301 15.257 -2.273 1.00 . A A . 8 THR HG22 1 1 3 1657 1 1 8 THR HG23 H 3.850 14.950 -3.059 1.00 . A A . 8 THR HG23 1 1 3 1658 1 1 8 THR N N 3.224 10.993 -3.728 1.00 . A A . 8 THR N 1 1 3 1659 1 1 8 THR O O 5.389 13.158 -1.827 1.00 . A A . 8 THR O 1 1 3 1660 1 1 8 THR OG1 O 1.731 13.490 -4.042 1.00 . A A . 8 THR OG1 1 1 3 1661 1 1 9 SER C C 6.520 9.465 -0.710 1.00 . A A . 9 SER C 1 1 3 1662 1 1 9 SER CA C 5.836 10.825 -0.548 1.00 . A A . 9 SER CA 1 1 3 1663 1 1 9 SER CB C 5.084 10.863 0.783 1.00 . A A . 9 SER CB 1 1 3 1664 1 1 9 SER H H 4.344 10.271 -1.997 1.00 . A A . 9 SER H 1 1 3 1665 1 1 9 SER HA H 6.581 11.608 -0.566 1.00 . A A . 9 SER HA 1 1 3 1666 1 1 9 SER HB2 H 4.457 9.992 0.870 1.00 . A A . 9 SER HB2 1 1 3 1667 1 1 9 SER HB3 H 5.797 10.874 1.598 1.00 . A A . 9 SER HB3 1 1 3 1668 1 1 9 SER HG H 4.849 12.785 0.974 1.00 . A A . 9 SER HG 1 1 3 1669 1 1 9 SER N N 4.875 11.026 -1.669 1.00 . A A . 9 SER N 1 1 3 1670 1 1 9 SER O O 6.204 8.705 -1.603 1.00 . A A . 9 SER O 1 1 3 1671 1 1 9 SER OG O 4.274 12.030 0.830 1.00 . A A . 9 SER OG 1 1 3 1672 1 1 10 ILE C C 7.558 6.855 1.038 1.00 . A A . 10 ILE C 1 1 3 1673 1 1 10 ILE CA C 8.153 7.841 0.031 1.00 . A A . 10 ILE CA 1 1 3 1674 1 1 10 ILE CB C 9.641 8.037 0.320 1.00 . A A . 10 ILE CB 1 1 3 1675 1 1 10 ILE CD1 C 11.648 8.416 -1.201 1.00 . A A . 10 ILE CD1 1 1 3 1676 1 1 10 ILE CG1 C 10.251 8.912 -0.799 1.00 . A A . 10 ILE CG1 1 1 3 1677 1 1 10 ILE CG2 C 10.324 6.667 0.387 1.00 . A A . 10 ILE CG2 1 1 3 1678 1 1 10 ILE H H 7.700 9.775 0.856 1.00 . A A . 10 ILE H 1 1 3 1679 1 1 10 ILE HA H 8.029 7.452 -0.970 1.00 . A A . 10 ILE HA 1 1 3 1680 1 1 10 ILE HB H 9.756 8.539 1.271 1.00 . A A . 10 ILE HB 1 1 3 1681 1 1 10 ILE HD11 H 12.118 7.934 -0.358 1.00 . A A . 10 ILE HD11 1 1 3 1682 1 1 10 ILE HD12 H 12.249 9.255 -1.516 1.00 . A A . 10 ILE HD12 1 1 3 1683 1 1 10 ILE HD13 H 11.558 7.712 -2.016 1.00 . A A . 10 ILE HD13 1 1 3 1684 1 1 10 ILE HG12 H 9.605 8.882 -1.663 1.00 . A A . 10 ILE HG12 1 1 3 1685 1 1 10 ILE HG13 H 10.326 9.931 -0.448 1.00 . A A . 10 ILE HG13 1 1 3 1686 1 1 10 ILE HG21 H 11.288 6.770 0.857 1.00 . A A . 10 ILE HG21 1 1 3 1687 1 1 10 ILE HG22 H 10.450 6.279 -0.612 1.00 . A A . 10 ILE HG22 1 1 3 1688 1 1 10 ILE HG23 H 9.713 5.987 0.964 1.00 . A A . 10 ILE HG23 1 1 3 1689 1 1 10 ILE N N 7.455 9.151 0.144 1.00 . A A . 10 ILE N 1 1 3 1690 1 1 10 ILE O O 7.087 7.238 2.091 1.00 . A A . 10 ILE O 1 1 3 1691 1 1 11 CYS C C 7.794 3.274 1.578 1.00 . A A . 11 CYS C 1 1 3 1692 1 1 11 CYS CA C 7.003 4.581 1.676 1.00 . A A . 11 CYS CA 1 1 3 1693 1 1 11 CYS CB C 5.523 4.297 1.357 1.00 . A A . 11 CYS CB 1 1 3 1694 1 1 11 CYS H H 7.956 5.293 -0.127 1.00 . A A . 11 CYS H 1 1 3 1695 1 1 11 CYS HA H 7.081 4.965 2.682 1.00 . A A . 11 CYS HA 1 1 3 1696 1 1 11 CYS HB2 H 5.387 3.234 1.224 1.00 . A A . 11 CYS HB2 1 1 3 1697 1 1 11 CYS HB3 H 4.913 4.631 2.184 1.00 . A A . 11 CYS HB3 1 1 3 1698 1 1 11 CYS N N 7.573 5.585 0.726 1.00 . A A . 11 CYS N 1 1 3 1699 1 1 11 CYS O O 8.213 2.867 0.513 1.00 . A A . 11 CYS O 1 1 3 1700 1 1 11 CYS SG S 5.005 5.155 -0.156 1.00 . A A . 11 CYS SG 1 1 3 1701 1 1 12 SER C C 7.809 0.146 2.722 1.00 . A A . 12 SER C 1 1 3 1702 1 1 12 SER CA C 8.771 1.337 2.665 1.00 . A A . 12 SER CA 1 1 3 1703 1 1 12 SER CB C 9.706 1.291 3.872 1.00 . A A . 12 SER CB 1 1 3 1704 1 1 12 SER H H 7.659 2.965 3.535 1.00 . A A . 12 SER H 1 1 3 1705 1 1 12 SER HA H 9.354 1.284 1.758 1.00 . A A . 12 SER HA 1 1 3 1706 1 1 12 SER HB2 H 9.949 0.268 4.105 1.00 . A A . 12 SER HB2 1 1 3 1707 1 1 12 SER HB3 H 10.616 1.831 3.643 1.00 . A A . 12 SER HB3 1 1 3 1708 1 1 12 SER HG H 8.608 1.189 5.475 1.00 . A A . 12 SER HG 1 1 3 1709 1 1 12 SER N N 8.004 2.616 2.686 1.00 . A A . 12 SER N 1 1 3 1710 1 1 12 SER O O 6.637 0.293 3.016 1.00 . A A . 12 SER O 1 1 3 1711 1 1 12 SER OG O 9.059 1.884 4.990 1.00 . A A . 12 SER OG 1 1 3 1712 1 1 13 LEU C C 6.423 -2.168 3.587 1.00 . A A . 13 LEU C 1 1 3 1713 1 1 13 LEU CA C 7.443 -2.249 2.453 1.00 . A A . 13 LEU CA 1 1 3 1714 1 1 13 LEU CB C 8.309 -3.497 2.642 1.00 . A A . 13 LEU CB 1 1 3 1715 1 1 13 LEU CD1 C 6.275 -4.719 1.832 1.00 . A A . 13 LEU CD1 1 1 3 1716 1 1 13 LEU CD2 C 8.240 -5.995 2.692 1.00 . A A . 13 LEU CD2 1 1 3 1717 1 1 13 LEU CG C 7.411 -4.720 2.858 1.00 . A A . 13 LEU CG 1 1 3 1718 1 1 13 LEU H H 9.242 -1.114 2.184 1.00 . A A . 13 LEU H 1 1 3 1719 1 1 13 LEU HA H 6.928 -2.319 1.525 1.00 . A A . 13 LEU HA 1 1 3 1720 1 1 13 LEU HB2 H 8.919 -3.648 1.763 1.00 . A A . 13 LEU HB2 1 1 3 1721 1 1 13 LEU HB3 H 8.945 -3.366 3.502 1.00 . A A . 13 LEU HB3 1 1 3 1722 1 1 13 LEU HD11 H 6.053 -5.735 1.541 1.00 . A A . 13 LEU HD11 1 1 3 1723 1 1 13 LEU HD12 H 6.573 -4.151 0.964 1.00 . A A . 13 LEU HD12 1 1 3 1724 1 1 13 LEU HD13 H 5.394 -4.272 2.271 1.00 . A A . 13 LEU HD13 1 1 3 1725 1 1 13 LEU HD21 H 7.715 -6.826 3.141 1.00 . A A . 13 LEU HD21 1 1 3 1726 1 1 13 LEU HD22 H 9.196 -5.869 3.176 1.00 . A A . 13 LEU HD22 1 1 3 1727 1 1 13 LEU HD23 H 8.390 -6.192 1.641 1.00 . A A . 13 LEU HD23 1 1 3 1728 1 1 13 LEU HG H 6.995 -4.687 3.855 1.00 . A A . 13 LEU HG 1 1 3 1729 1 1 13 LEU N N 8.302 -1.033 2.431 1.00 . A A . 13 LEU N 1 1 3 1730 1 1 13 LEU O O 5.269 -2.509 3.421 1.00 . A A . 13 LEU O 1 1 3 1731 1 1 14 TYR C C 4.561 -1.036 5.390 1.00 . A A . 14 TYR C 1 1 3 1732 1 1 14 TYR CA C 5.890 -1.618 5.881 1.00 . A A . 14 TYR CA 1 1 3 1733 1 1 14 TYR CB C 6.484 -0.702 6.952 1.00 . A A . 14 TYR CB 1 1 3 1734 1 1 14 TYR CD1 C 4.927 -1.594 8.724 1.00 . A A . 14 TYR CD1 1 1 3 1735 1 1 14 TYR CD2 C 7.308 -1.526 9.189 1.00 . A A . 14 TYR CD2 1 1 3 1736 1 1 14 TYR CE1 C 4.694 -2.136 9.995 1.00 . A A . 14 TYR CE1 1 1 3 1737 1 1 14 TYR CE2 C 7.074 -2.068 10.460 1.00 . A A . 14 TYR CE2 1 1 3 1738 1 1 14 TYR CG C 6.234 -1.289 8.321 1.00 . A A . 14 TYR CG 1 1 3 1739 1 1 14 TYR CZ C 5.768 -2.373 10.863 1.00 . A A . 14 TYR CZ 1 1 3 1740 1 1 14 TYR H H 7.772 -1.452 4.849 1.00 . A A . 14 TYR H 1 1 3 1741 1 1 14 TYR HA H 5.720 -2.600 6.298 1.00 . A A . 14 TYR HA 1 1 3 1742 1 1 14 TYR HB2 H 7.549 -0.606 6.791 1.00 . A A . 14 TYR HB2 1 1 3 1743 1 1 14 TYR HB3 H 6.022 0.272 6.889 1.00 . A A . 14 TYR HB3 1 1 3 1744 1 1 14 TYR HD1 H 4.099 -1.412 8.055 1.00 . A A . 14 TYR HD1 1 1 3 1745 1 1 14 TYR HD2 H 8.315 -1.291 8.878 1.00 . A A . 14 TYR HD2 1 1 3 1746 1 1 14 TYR HE1 H 3.687 -2.371 10.305 1.00 . A A . 14 TYR HE1 1 1 3 1747 1 1 14 TYR HE2 H 7.902 -2.251 11.130 1.00 . A A . 14 TYR HE2 1 1 3 1748 1 1 14 TYR HH H 4.598 -3.091 12.191 1.00 . A A . 14 TYR HH 1 1 3 1749 1 1 14 TYR N N 6.837 -1.720 4.737 1.00 . A A . 14 TYR N 1 1 3 1750 1 1 14 TYR O O 3.535 -1.687 5.429 1.00 . A A . 14 TYR O 1 1 3 1751 1 1 14 TYR OH O 5.538 -2.907 12.115 1.00 . A A . 14 TYR OH 1 1 3 1752 1 1 15 GLN C C 2.672 -0.124 3.394 1.00 . A A . 15 GLN C 1 1 3 1753 1 1 15 GLN CA C 3.313 0.803 4.422 1.00 . A A . 15 GLN CA 1 1 3 1754 1 1 15 GLN CB C 3.630 2.151 3.767 1.00 . A A . 15 GLN CB 1 1 3 1755 1 1 15 GLN CD C 5.321 3.456 5.064 1.00 . A A . 15 GLN CD 1 1 3 1756 1 1 15 GLN CG C 3.826 3.213 4.852 1.00 . A A . 15 GLN CG 1 1 3 1757 1 1 15 GLN H H 5.411 0.685 4.882 1.00 . A A . 15 GLN H 1 1 3 1758 1 1 15 GLN HA H 2.634 0.953 5.248 1.00 . A A . 15 GLN HA 1 1 3 1759 1 1 15 GLN HB2 H 4.531 2.063 3.179 1.00 . A A . 15 GLN HB2 1 1 3 1760 1 1 15 GLN HB3 H 2.809 2.441 3.127 1.00 . A A . 15 GLN HB3 1 1 3 1761 1 1 15 GLN HE21 H 5.157 3.621 7.035 1.00 . A A . 15 GLN HE21 1 1 3 1762 1 1 15 GLN HE22 H 6.730 3.796 6.421 1.00 . A A . 15 GLN HE22 1 1 3 1763 1 1 15 GLN HG2 H 3.351 4.133 4.543 1.00 . A A . 15 GLN HG2 1 1 3 1764 1 1 15 GLN HG3 H 3.384 2.871 5.774 1.00 . A A . 15 GLN HG3 1 1 3 1765 1 1 15 GLN N N 4.573 0.182 4.917 1.00 . A A . 15 GLN N 1 1 3 1766 1 1 15 GLN NE2 N 5.774 3.639 6.273 1.00 . A A . 15 GLN NE2 1 1 3 1767 1 1 15 GLN O O 1.472 -0.316 3.376 1.00 . A A . 15 GLN O 1 1 3 1768 1 1 15 GLN OE1 O 6.085 3.480 4.119 1.00 . A A . 15 GLN OE1 1 1 3 1769 1 1 16 LEU C C 2.191 -2.787 2.197 1.00 . A A . 16 LEU C 1 1 3 1770 1 1 16 LEU CA C 2.906 -1.626 1.511 1.00 . A A . 16 LEU CA 1 1 3 1771 1 1 16 LEU CB C 4.038 -2.174 0.659 1.00 . A A . 16 LEU CB 1 1 3 1772 1 1 16 LEU CD1 C 6.010 -0.739 0.146 1.00 . A A . 16 LEU CD1 1 1 3 1773 1 1 16 LEU CD2 C 4.520 -1.507 -1.682 1.00 . A A . 16 LEU CD2 1 1 3 1774 1 1 16 LEU CG C 4.570 -1.056 -0.229 1.00 . A A . 16 LEU CG 1 1 3 1775 1 1 16 LEU H H 4.431 -0.533 2.576 1.00 . A A . 16 LEU H 1 1 3 1776 1 1 16 LEU HA H 2.218 -1.088 0.881 1.00 . A A . 16 LEU HA 1 1 3 1777 1 1 16 LEU HB2 H 4.819 -2.540 1.300 1.00 . A A . 16 LEU HB2 1 1 3 1778 1 1 16 LEU HB3 H 3.671 -2.979 0.042 1.00 . A A . 16 LEU HB3 1 1 3 1779 1 1 16 LEU HD11 H 6.086 -0.638 1.217 1.00 . A A . 16 LEU HD11 1 1 3 1780 1 1 16 LEU HD12 H 6.309 0.184 -0.327 1.00 . A A . 16 LEU HD12 1 1 3 1781 1 1 16 LEU HD13 H 6.651 -1.541 -0.188 1.00 . A A . 16 LEU HD13 1 1 3 1782 1 1 16 LEU HD21 H 3.693 -1.024 -2.179 1.00 . A A . 16 LEU HD21 1 1 3 1783 1 1 16 LEU HD22 H 4.389 -2.579 -1.717 1.00 . A A . 16 LEU HD22 1 1 3 1784 1 1 16 LEU HD23 H 5.444 -1.241 -2.171 1.00 . A A . 16 LEU HD23 1 1 3 1785 1 1 16 LEU HG H 3.961 -0.173 -0.101 1.00 . A A . 16 LEU HG 1 1 3 1786 1 1 16 LEU N N 3.465 -0.703 2.540 1.00 . A A . 16 LEU N 1 1 3 1787 1 1 16 LEU O O 1.040 -3.071 1.932 1.00 . A A . 16 LEU O 1 1 3 1788 1 1 17 GLU C C 0.954 -4.170 4.470 1.00 . A A . 17 GLU C 1 1 3 1789 1 1 17 GLU CA C 2.250 -4.617 3.790 1.00 . A A . 17 GLU CA 1 1 3 1790 1 1 17 GLU CB C 3.225 -5.146 4.844 1.00 . A A . 17 GLU CB 1 1 3 1791 1 1 17 GLU CD C 3.923 -7.163 6.143 1.00 . A A . 17 GLU CD 1 1 3 1792 1 1 17 GLU CG C 3.054 -6.660 4.988 1.00 . A A . 17 GLU CG 1 1 3 1793 1 1 17 GLU H H 3.802 -3.218 3.271 1.00 . A A . 17 GLU H 1 1 3 1794 1 1 17 GLU HA H 2.029 -5.399 3.081 1.00 . A A . 17 GLU HA 1 1 3 1795 1 1 17 GLU HB2 H 4.238 -4.925 4.539 1.00 . A A . 17 GLU HB2 1 1 3 1796 1 1 17 GLU HB3 H 3.023 -4.671 5.792 1.00 . A A . 17 GLU HB3 1 1 3 1797 1 1 17 GLU HG2 H 2.017 -6.887 5.189 1.00 . A A . 17 GLU HG2 1 1 3 1798 1 1 17 GLU HG3 H 3.359 -7.146 4.073 1.00 . A A . 17 GLU HG3 1 1 3 1799 1 1 17 GLU N N 2.873 -3.466 3.079 1.00 . A A . 17 GLU N 1 1 3 1800 1 1 17 GLU O O 0.129 -4.979 4.846 1.00 . A A . 17 GLU O 1 1 3 1801 1 1 17 GLU OE1 O 3.991 -6.476 7.149 1.00 . A A . 17 GLU OE1 1 1 3 1802 1 1 17 GLU OE2 O 4.504 -8.226 6.002 1.00 . A A . 17 GLU OE2 1 1 3 1803 1 1 18 ASN C C -1.600 -2.301 4.253 1.00 . A A . 18 ASN C 1 1 3 1804 1 1 18 ASN CA C -0.477 -2.398 5.290 1.00 . A A . 18 ASN CA 1 1 3 1805 1 1 18 ASN CB C -0.220 -1.017 5.897 1.00 . A A . 18 ASN CB 1 1 3 1806 1 1 18 ASN CG C -0.622 -1.022 7.374 1.00 . A A . 18 ASN CG 1 1 3 1807 1 1 18 ASN H H 1.442 -2.252 4.326 1.00 . A A . 18 ASN H 1 1 3 1808 1 1 18 ASN HA H -0.767 -3.085 6.072 1.00 . A A . 18 ASN HA 1 1 3 1809 1 1 18 ASN HB2 H 0.831 -0.776 5.810 1.00 . A A . 18 ASN HB2 1 1 3 1810 1 1 18 ASN HB3 H -0.804 -0.277 5.370 1.00 . A A . 18 ASN HB3 1 1 3 1811 1 1 18 ASN HD21 H 0.398 0.627 7.804 1.00 . A A . 18 ASN HD21 1 1 3 1812 1 1 18 ASN HD22 H -0.436 -0.071 9.108 1.00 . A A . 18 ASN HD22 1 1 3 1813 1 1 18 ASN N N 0.766 -2.890 4.634 1.00 . A A . 18 ASN N 1 1 3 1814 1 1 18 ASN ND2 N -0.183 -0.077 8.160 1.00 . A A . 18 ASN ND2 1 1 3 1815 1 1 18 ASN O O -2.735 -2.018 4.581 1.00 . A A . 18 ASN O 1 1 3 1816 1 1 18 ASN OD1 O -1.343 -1.894 7.817 1.00 . A A . 18 ASN OD1 1 1 3 1817 1 1 19 TYR C C -2.398 -3.772 1.179 1.00 . A A . 19 TYR C 1 1 3 1818 1 1 19 TYR CA C -2.351 -2.454 1.956 1.00 . A A . 19 TYR CA 1 1 3 1819 1 1 19 TYR CB C -2.036 -1.303 0.997 1.00 . A A . 19 TYR CB 1 1 3 1820 1 1 19 TYR CD1 C -2.918 0.584 2.417 1.00 . A A . 19 TYR CD1 1 1 3 1821 1 1 19 TYR CD2 C -0.548 0.519 1.901 1.00 . A A . 19 TYR CD2 1 1 3 1822 1 1 19 TYR CE1 C -2.724 1.758 3.158 1.00 . A A . 19 TYR CE1 1 1 3 1823 1 1 19 TYR CE2 C -0.353 1.692 2.642 1.00 . A A . 19 TYR CE2 1 1 3 1824 1 1 19 TYR CG C -1.829 -0.035 1.789 1.00 . A A . 19 TYR CG 1 1 3 1825 1 1 19 TYR CZ C -1.441 2.311 3.271 1.00 . A A . 19 TYR CZ 1 1 3 1826 1 1 19 TYR H H -0.373 -2.763 2.757 1.00 . A A . 19 TYR H 1 1 3 1827 1 1 19 TYR HA H -3.309 -2.280 2.425 1.00 . A A . 19 TYR HA 1 1 3 1828 1 1 19 TYR HB2 H -1.139 -1.533 0.441 1.00 . A A . 19 TYR HB2 1 1 3 1829 1 1 19 TYR HB3 H -2.861 -1.170 0.313 1.00 . A A . 19 TYR HB3 1 1 3 1830 1 1 19 TYR HD1 H -3.906 0.159 2.329 1.00 . A A . 19 TYR HD1 1 1 3 1831 1 1 19 TYR HD2 H 0.291 0.042 1.414 1.00 . A A . 19 TYR HD2 1 1 3 1832 1 1 19 TYR HE1 H -3.562 2.234 3.643 1.00 . A A . 19 TYR HE1 1 1 3 1833 1 1 19 TYR HE2 H 0.637 2.118 2.729 1.00 . A A . 19 TYR HE2 1 1 3 1834 1 1 19 TYR HH H -0.477 3.338 4.560 1.00 . A A . 19 TYR HH 1 1 3 1835 1 1 19 TYR N N -1.295 -2.534 3.005 1.00 . A A . 19 TYR N 1 1 3 1836 1 1 19 TYR O O -2.435 -3.787 -0.036 1.00 . A A . 19 TYR O 1 1 3 1837 1 1 19 TYR OH O -1.248 3.465 4.002 1.00 . A A . 19 TYR OH 1 1 3 1838 1 1 20 CYS C C -2.910 -7.272 2.151 1.00 . A A . 20 CYS C 1 1 3 1839 1 1 20 CYS CA C -2.448 -6.193 1.171 1.00 . A A . 20 CYS CA 1 1 3 1840 1 1 20 CYS CB C -1.056 -6.546 0.641 1.00 . A A . 20 CYS CB 1 1 3 1841 1 1 20 CYS H H -2.372 -4.845 2.849 1.00 . A A . 20 CYS H 1 1 3 1842 1 1 20 CYS HA H -3.142 -6.137 0.345 1.00 . A A . 20 CYS HA 1 1 3 1843 1 1 20 CYS HB2 H -0.740 -5.794 -0.068 1.00 . A A . 20 CYS HB2 1 1 3 1844 1 1 20 CYS HB3 H -0.356 -6.582 1.463 1.00 . A A . 20 CYS HB3 1 1 3 1845 1 1 20 CYS N N -2.399 -4.878 1.870 1.00 . A A . 20 CYS N 1 1 3 1846 1 1 20 CYS O O -2.826 -7.108 3.353 1.00 . A A . 20 CYS O 1 1 3 1847 1 1 20 CYS SG S -1.113 -8.163 -0.175 1.00 . A A . 20 CYS SG 1 1 3 1848 1 1 21 ASN C C -2.738 -9.852 3.511 1.00 . A A . 21 ASN C 1 1 3 1849 1 1 21 ASN CA C -3.869 -9.459 2.559 1.00 . A A . 21 ASN CA 1 1 3 1850 1 1 21 ASN CB C -4.285 -10.677 1.730 1.00 . A A . 21 ASN CB 1 1 3 1851 1 1 21 ASN CG C -5.802 -10.865 1.820 1.00 . A A . 21 ASN CG 1 1 3 1852 1 1 21 ASN H H -3.461 -8.485 0.680 1.00 . A A . 21 ASN H 1 1 3 1853 1 1 21 ASN HA H -4.715 -9.108 3.132 1.00 . A A . 21 ASN HA 1 1 3 1854 1 1 21 ASN HB2 H -4.001 -10.526 0.699 1.00 . A A . 21 ASN HB2 1 1 3 1855 1 1 21 ASN HB3 H -3.792 -11.559 2.114 1.00 . A A . 21 ASN HB3 1 1 3 1856 1 1 21 ASN HD21 H -5.696 -12.846 1.917 1.00 . A A . 21 ASN HD21 1 1 3 1857 1 1 21 ASN HD22 H -7.265 -12.200 1.966 1.00 . A A . 21 ASN HD22 1 1 3 1858 1 1 21 ASN N N -3.400 -8.373 1.651 1.00 . A A . 21 ASN N 1 1 3 1859 1 1 21 ASN ND2 N -6.296 -12.071 1.908 1.00 . A A . 21 ASN ND2 1 1 3 1860 1 1 21 ASN O O -2.924 -9.719 4.709 1.00 . A A . 21 ASN O 1 1 3 1861 1 1 21 ASN OXT O -1.703 -10.279 3.025 1.00 . A A . 21 ASN OXT 1 1 3 1862 1 1 21 ASN OD1 O -6.546 -9.904 1.809 1.00 . A A . 21 ASN OD1 1 1 3 1863 2 2 1 PHE C C 11.620 -0.323 0.359 1.00 . B B . 1 PHE C 1 1 3 1864 2 2 1 PHE CA C 11.107 -1.127 -0.838 1.00 . B B . 1 PHE CA 1 1 3 1865 2 2 1 PHE CB C 9.893 -1.957 -0.406 1.00 . B B . 1 PHE CB 1 1 3 1866 2 2 1 PHE CD1 C 9.525 -3.256 -2.537 1.00 . B B . 1 PHE CD1 1 1 3 1867 2 2 1 PHE CD2 C 10.162 -4.462 -0.529 1.00 . B B . 1 PHE CD2 1 1 3 1868 2 2 1 PHE CE1 C 9.493 -4.462 -3.249 1.00 . B B . 1 PHE CE1 1 1 3 1869 2 2 1 PHE CE2 C 10.130 -5.668 -1.242 1.00 . B B . 1 PHE CE2 1 1 3 1870 2 2 1 PHE CG C 9.859 -3.257 -1.176 1.00 . B B . 1 PHE CG 1 1 3 1871 2 2 1 PHE CZ C 9.796 -5.667 -2.603 1.00 . B B . 1 PHE CZ 1 1 3 1872 2 2 1 PHE H1 H 13.086 -1.502 -1.371 1.00 . B B . 1 PHE H1 1 1 3 1873 2 2 1 PHE H2 H 11.947 -2.374 -2.281 1.00 . B B . 1 PHE H2 1 1 3 1874 2 2 1 PHE H3 H 12.294 -2.833 -0.682 1.00 . B B . 1 PHE H3 1 1 3 1875 2 2 1 PHE HA H 10.818 -0.449 -1.628 1.00 . B B . 1 PHE HA 1 1 3 1876 2 2 1 PHE HB2 H 9.959 -2.169 0.651 1.00 . B B . 1 PHE HB2 1 1 3 1877 2 2 1 PHE HB3 H 8.990 -1.400 -0.606 1.00 . B B . 1 PHE HB3 1 1 3 1878 2 2 1 PHE HD1 H 9.293 -2.327 -3.035 1.00 . B B . 1 PHE HD1 1 1 3 1879 2 2 1 PHE HD2 H 10.420 -4.461 0.519 1.00 . B B . 1 PHE HD2 1 1 3 1880 2 2 1 PHE HE1 H 9.235 -4.462 -4.298 1.00 . B B . 1 PHE HE1 1 1 3 1881 2 2 1 PHE HE2 H 10.363 -6.596 -0.743 1.00 . B B . 1 PHE HE2 1 1 3 1882 2 2 1 PHE HZ H 9.772 -6.596 -3.151 1.00 . B B . 1 PHE HZ 1 1 3 1883 2 2 1 PHE N N 12.191 -2.026 -1.330 1.00 . B B . 1 PHE N 1 1 3 1884 2 2 1 PHE O O 11.059 -0.369 1.436 1.00 . B B . 1 PHE O 1 1 3 1885 2 2 2 VAL C C 12.685 2.654 1.217 1.00 . B B . 2 VAL C 1 1 3 1886 2 2 2 VAL CA C 13.229 1.220 1.307 1.00 . B B . 2 VAL CA 1 1 3 1887 2 2 2 VAL CB C 14.765 1.196 1.255 1.00 . B B . 2 VAL CB 1 1 3 1888 2 2 2 VAL CG1 C 15.252 1.364 -0.188 1.00 . B B . 2 VAL CG1 1 1 3 1889 2 2 2 VAL CG2 C 15.329 2.317 2.126 1.00 . B B . 2 VAL CG2 1 1 3 1890 2 2 2 VAL H H 13.117 0.437 -0.697 1.00 . B B . 2 VAL H 1 1 3 1891 2 2 2 VAL HA H 12.903 0.791 2.238 1.00 . B B . 2 VAL HA 1 1 3 1892 2 2 2 VAL HB H 15.112 0.247 1.631 1.00 . B B . 2 VAL HB 1 1 3 1893 2 2 2 VAL HG11 H 16.087 2.050 -0.206 1.00 . B B . 2 VAL HG11 1 1 3 1894 2 2 2 VAL HG12 H 14.451 1.756 -0.795 1.00 . B B . 2 VAL HG12 1 1 3 1895 2 2 2 VAL HG13 H 15.565 0.406 -0.576 1.00 . B B . 2 VAL HG13 1 1 3 1896 2 2 2 VAL HG21 H 14.539 2.733 2.730 1.00 . B B . 2 VAL HG21 1 1 3 1897 2 2 2 VAL HG22 H 15.745 3.087 1.495 1.00 . B B . 2 VAL HG22 1 1 3 1898 2 2 2 VAL HG23 H 16.102 1.920 2.767 1.00 . B B . 2 VAL HG23 1 1 3 1899 2 2 2 VAL N N 12.681 0.414 0.180 1.00 . B B . 2 VAL N 1 1 3 1900 2 2 2 VAL O O 11.579 2.922 1.640 1.00 . B B . 2 VAL O 1 1 3 1901 2 2 3 ASN C C 12.590 5.275 -0.903 1.00 . B B . 3 ASN C 1 1 3 1902 2 2 3 ASN CA C 12.913 4.968 0.564 1.00 . B B . 3 ASN CA 1 1 3 1903 2 2 3 ASN CB C 13.967 5.961 1.069 1.00 . B B . 3 ASN CB 1 1 3 1904 2 2 3 ASN CG C 14.971 5.265 1.991 1.00 . B B . 3 ASN CG 1 1 3 1905 2 2 3 ASN H H 14.313 3.354 0.326 1.00 . B B . 3 ASN H 1 1 3 1906 2 2 3 ASN HA H 12.014 5.066 1.156 1.00 . B B . 3 ASN HA 1 1 3 1907 2 2 3 ASN HB2 H 14.492 6.369 0.224 1.00 . B B . 3 ASN HB2 1 1 3 1908 2 2 3 ASN HB3 H 13.482 6.760 1.609 1.00 . B B . 3 ASN HB3 1 1 3 1909 2 2 3 ASN HD21 H 16.516 5.604 0.791 1.00 . B B . 3 ASN HD21 1 1 3 1910 2 2 3 ASN HD22 H 16.878 4.762 2.219 1.00 . B B . 3 ASN HD22 1 1 3 1911 2 2 3 ASN N N 13.428 3.574 0.671 1.00 . B B . 3 ASN N 1 1 3 1912 2 2 3 ASN ND2 N 16.226 5.205 1.637 1.00 . B B . 3 ASN ND2 1 1 3 1913 2 2 3 ASN O O 13.056 6.250 -1.458 1.00 . B B . 3 ASN O 1 1 3 1914 2 2 3 ASN OD1 O 14.612 4.783 3.046 1.00 . B B . 3 ASN OD1 1 1 3 1915 2 2 4 GLN C C 10.069 5.320 -3.088 1.00 . B B . 4 GLN C 1 1 3 1916 2 2 4 GLN CA C 11.462 4.689 -2.973 1.00 . B B . 4 GLN CA 1 1 3 1917 2 2 4 GLN CB C 11.481 3.364 -3.736 1.00 . B B . 4 GLN CB 1 1 3 1918 2 2 4 GLN CD C 12.665 2.162 -5.581 1.00 . B B . 4 GLN CD 1 1 3 1919 2 2 4 GLN CG C 12.274 3.536 -5.033 1.00 . B B . 4 GLN CG 1 1 3 1920 2 2 4 GLN H H 11.441 3.660 -1.077 1.00 . B B . 4 GLN H 1 1 3 1921 2 2 4 GLN HA H 12.192 5.358 -3.404 1.00 . B B . 4 GLN HA 1 1 3 1922 2 2 4 GLN HB2 H 11.945 2.603 -3.126 1.00 . B B . 4 GLN HB2 1 1 3 1923 2 2 4 GLN HB3 H 10.469 3.069 -3.972 1.00 . B B . 4 GLN HB3 1 1 3 1924 2 2 4 GLN HE21 H 14.562 2.665 -5.885 1.00 . B B . 4 GLN HE21 1 1 3 1925 2 2 4 GLN HE22 H 14.155 1.072 -6.310 1.00 . B B . 4 GLN HE22 1 1 3 1926 2 2 4 GLN HG2 H 11.666 4.055 -5.760 1.00 . B B . 4 GLN HG2 1 1 3 1927 2 2 4 GLN HG3 H 13.167 4.109 -4.834 1.00 . B B . 4 GLN HG3 1 1 3 1928 2 2 4 GLN N N 11.802 4.446 -1.540 1.00 . B B . 4 GLN N 1 1 3 1929 2 2 4 GLN NE2 N 13.896 1.949 -5.956 1.00 . B B . 4 GLN NE2 1 1 3 1930 2 2 4 GLN O O 9.321 5.390 -2.130 1.00 . B B . 4 GLN O 1 1 3 1931 2 2 4 GLN OE1 O 11.840 1.274 -5.670 1.00 . B B . 4 GLN OE1 1 1 3 1932 2 2 5 HIS C C 7.439 5.407 -5.148 1.00 . B B . 5 HIS C 1 1 3 1933 2 2 5 HIS CA C 8.379 6.405 -4.459 1.00 . B B . 5 HIS CA 1 1 3 1934 2 2 5 HIS CB C 8.522 7.646 -5.346 1.00 . B B . 5 HIS CB 1 1 3 1935 2 2 5 HIS CD2 C 10.688 8.471 -4.134 1.00 . B B . 5 HIS CD2 1 1 3 1936 2 2 5 HIS CE1 C 10.157 10.573 -3.990 1.00 . B B . 5 HIS CE1 1 1 3 1937 2 2 5 HIS CG C 9.452 8.633 -4.697 1.00 . B B . 5 HIS CG 1 1 3 1938 2 2 5 HIS H H 10.338 5.708 -5.019 1.00 . B B . 5 HIS H 1 1 3 1939 2 2 5 HIS HA H 7.971 6.691 -3.501 1.00 . B B . 5 HIS HA 1 1 3 1940 2 2 5 HIS HB2 H 8.920 7.356 -6.308 1.00 . B B . 5 HIS HB2 1 1 3 1941 2 2 5 HIS HB3 H 7.553 8.103 -5.482 1.00 . B B . 5 HIS HB3 1 1 3 1942 2 2 5 HIS HD2 H 11.226 7.537 -4.055 1.00 . B B . 5 HIS HD2 1 1 3 1943 2 2 5 HIS HE1 H 10.200 11.629 -3.771 1.00 . B B . 5 HIS HE1 1 1 3 1944 2 2 5 HIS HE2 H 11.988 9.889 -3.244 1.00 . B B . 5 HIS HE2 1 1 3 1945 2 2 5 HIS N N 9.718 5.778 -4.263 1.00 . B B . 5 HIS N 1 1 3 1946 2 2 5 HIS ND1 N 9.127 9.969 -4.600 1.00 . B B . 5 HIS ND1 1 1 3 1947 2 2 5 HIS NE2 N 11.136 9.696 -3.686 1.00 . B B . 5 HIS NE2 1 1 3 1948 2 2 5 HIS O O 7.756 4.856 -6.182 1.00 . B B . 5 HIS O 1 1 3 1949 2 2 6 LEU C C 4.233 4.997 -5.951 1.00 . B B . 6 LEU C 1 1 3 1950 2 2 6 LEU CA C 5.322 4.217 -5.208 1.00 . B B . 6 LEU CA 1 1 3 1951 2 2 6 LEU CB C 4.694 3.352 -4.115 1.00 . B B . 6 LEU CB 1 1 3 1952 2 2 6 LEU CD1 C 5.137 2.466 -1.819 1.00 . B B . 6 LEU CD1 1 1 3 1953 2 2 6 LEU CD2 C 6.543 1.718 -3.742 1.00 . B B . 6 LEU CD2 1 1 3 1954 2 2 6 LEU CG C 5.780 2.898 -3.138 1.00 . B B . 6 LEU CG 1 1 3 1955 2 2 6 LEU H H 6.044 5.633 -3.753 1.00 . B B . 6 LEU H 1 1 3 1956 2 2 6 LEU HA H 5.843 3.585 -5.908 1.00 . B B . 6 LEU HA 1 1 3 1957 2 2 6 LEU HB2 H 3.947 3.925 -3.585 1.00 . B B . 6 LEU HB2 1 1 3 1958 2 2 6 LEU HB3 H 4.235 2.486 -4.565 1.00 . B B . 6 LEU HB3 1 1 3 1959 2 2 6 LEU HD11 H 4.118 2.818 -1.783 1.00 . B B . 6 LEU HD11 1 1 3 1960 2 2 6 LEU HD12 H 5.693 2.885 -0.993 1.00 . B B . 6 LEU HD12 1 1 3 1961 2 2 6 LEU HD13 H 5.150 1.389 -1.751 1.00 . B B . 6 LEU HD13 1 1 3 1962 2 2 6 LEU HD21 H 7.517 2.047 -4.070 1.00 . B B . 6 LEU HD21 1 1 3 1963 2 2 6 LEU HD22 H 5.991 1.328 -4.586 1.00 . B B . 6 LEU HD22 1 1 3 1964 2 2 6 LEU HD23 H 6.655 0.943 -2.998 1.00 . B B . 6 LEU HD23 1 1 3 1965 2 2 6 LEU HG H 6.464 3.715 -2.954 1.00 . B B . 6 LEU HG 1 1 3 1966 2 2 6 LEU N N 6.284 5.174 -4.584 1.00 . B B . 6 LEU N 1 1 3 1967 2 2 6 LEU O O 3.338 5.557 -5.348 1.00 . B B . 6 LEU O 1 1 3 1968 2 2 7 CYS C C 2.545 4.892 -9.011 1.00 . B B . 7 CYS C 1 1 3 1969 2 2 7 CYS CA C 3.285 5.813 -8.029 1.00 . B B . 7 CYS CA 1 1 3 1970 2 2 7 CYS CB C 3.975 6.922 -8.827 1.00 . B B . 7 CYS CB 1 1 3 1971 2 2 7 CYS H H 5.044 4.607 -7.721 1.00 . B B . 7 CYS H 1 1 3 1972 2 2 7 CYS HA H 2.575 6.252 -7.344 1.00 . B B . 7 CYS HA 1 1 3 1973 2 2 7 CYS HB2 H 4.814 6.507 -9.365 1.00 . B B . 7 CYS HB2 1 1 3 1974 2 2 7 CYS HB3 H 3.274 7.350 -9.528 1.00 . B B . 7 CYS HB3 1 1 3 1975 2 2 7 CYS N N 4.308 5.053 -7.256 1.00 . B B . 7 CYS N 1 1 3 1976 2 2 7 CYS O O 3.148 4.257 -9.852 1.00 . B B . 7 CYS O 1 1 3 1977 2 2 7 CYS SG S 4.562 8.210 -7.701 1.00 . B B . 7 CYS SG 1 1 3 1978 2 2 8 GLY C C 1.167 2.751 -10.281 1.00 . B B . 8 GLY C 1 1 3 1979 2 2 8 GLY CA C 0.413 4.012 -9.845 1.00 . B B . 8 GLY CA 1 1 3 1980 2 2 8 GLY H H 0.789 5.399 -8.239 1.00 . B B . 8 GLY H 1 1 3 1981 2 2 8 GLY HA2 H -0.498 3.723 -9.342 1.00 . B B . 8 GLY HA2 1 1 3 1982 2 2 8 GLY HA3 H 0.163 4.593 -10.720 1.00 . B B . 8 GLY HA3 1 1 3 1983 2 2 8 GLY N N 1.238 4.852 -8.917 1.00 . B B . 8 GLY N 1 1 3 1984 2 2 8 GLY O O 1.485 1.899 -9.478 1.00 . B B . 8 GLY O 1 1 3 1985 2 2 9 SER C C 3.191 0.953 -11.060 1.00 . B B . 9 SER C 1 1 3 1986 2 2 9 SER CA C 2.156 1.425 -12.080 1.00 . B B . 9 SER CA 1 1 3 1987 2 2 9 SER CB C 2.861 1.785 -13.389 1.00 . B B . 9 SER CB 1 1 3 1988 2 2 9 SER H H 1.154 3.330 -12.183 1.00 . B B . 9 SER H 1 1 3 1989 2 2 9 SER HA H 1.445 0.633 -12.264 1.00 . B B . 9 SER HA 1 1 3 1990 2 2 9 SER HB2 H 3.928 1.738 -13.250 1.00 . B B . 9 SER HB2 1 1 3 1991 2 2 9 SER HB3 H 2.570 1.082 -14.158 1.00 . B B . 9 SER HB3 1 1 3 1992 2 2 9 SER HG H 3.125 3.407 -14.432 1.00 . B B . 9 SER HG 1 1 3 1993 2 2 9 SER N N 1.436 2.629 -11.559 1.00 . B B . 9 SER N 1 1 3 1994 2 2 9 SER O O 3.102 -0.138 -10.530 1.00 . B B . 9 SER O 1 1 3 1995 2 2 9 SER OG O 2.495 3.105 -13.772 1.00 . B B . 9 SER OG 1 1 3 1996 2 2 10 ASP C C 4.466 0.869 -8.525 1.00 . B B . 10 ASP C 1 1 3 1997 2 2 10 ASP CA C 5.187 1.365 -9.769 1.00 . B B . 10 ASP CA 1 1 3 1998 2 2 10 ASP CB C 6.033 2.581 -9.400 1.00 . B B . 10 ASP CB 1 1 3 1999 2 2 10 ASP CG C 6.711 3.132 -10.656 1.00 . B B . 10 ASP CG 1 1 3 2000 2 2 10 ASP H H 4.212 2.647 -11.193 1.00 . B B . 10 ASP H 1 1 3 2001 2 2 10 ASP HA H 5.812 0.583 -10.172 1.00 . B B . 10 ASP HA 1 1 3 2002 2 2 10 ASP HB2 H 5.390 3.338 -8.968 1.00 . B B . 10 ASP HB2 1 1 3 2003 2 2 10 ASP HB3 H 6.785 2.293 -8.683 1.00 . B B . 10 ASP HB3 1 1 3 2004 2 2 10 ASP N N 4.164 1.767 -10.768 1.00 . B B . 10 ASP N 1 1 3 2005 2 2 10 ASP O O 4.756 -0.187 -7.996 1.00 . B B . 10 ASP O 1 1 3 2006 2 2 10 ASP OD1 O 6.115 3.977 -11.304 1.00 . B B . 10 ASP OD1 1 1 3 2007 2 2 10 ASP OD2 O 7.812 2.699 -10.950 1.00 . B B . 10 ASP OD2 1 1 3 2008 2 2 11 LEU C C 2.392 -0.248 -6.979 1.00 . B B . 11 LEU C 1 1 3 2009 2 2 11 LEU CA C 2.752 1.230 -6.859 1.00 . B B . 11 LEU CA 1 1 3 2010 2 2 11 LEU CB C 1.480 2.074 -6.798 1.00 . B B . 11 LEU CB 1 1 3 2011 2 2 11 LEU CD1 C 1.858 1.975 -4.297 1.00 . B B . 11 LEU CD1 1 1 3 2012 2 2 11 LEU CD2 C -0.020 3.280 -5.248 1.00 . B B . 11 LEU CD2 1 1 3 2013 2 2 11 LEU CG C 0.816 2.019 -5.416 1.00 . B B . 11 LEU CG 1 1 3 2014 2 2 11 LEU H H 3.309 2.473 -8.518 1.00 . B B . 11 LEU H 1 1 3 2015 2 2 11 LEU HA H 3.354 1.393 -5.984 1.00 . B B . 11 LEU HA 1 1 3 2016 2 2 11 LEU HB2 H 1.730 3.098 -7.027 1.00 . B B . 11 LEU HB2 1 1 3 2017 2 2 11 LEU HB3 H 0.784 1.708 -7.537 1.00 . B B . 11 LEU HB3 1 1 3 2018 2 2 11 LEU HD11 H 2.450 2.874 -4.329 1.00 . B B . 11 LEU HD11 1 1 3 2019 2 2 11 LEU HD12 H 2.492 1.113 -4.419 1.00 . B B . 11 LEU HD12 1 1 3 2020 2 2 11 LEU HD13 H 1.353 1.916 -3.342 1.00 . B B . 11 LEU HD13 1 1 3 2021 2 2 11 LEU HD21 H -0.184 3.465 -4.198 1.00 . B B . 11 LEU HD21 1 1 3 2022 2 2 11 LEU HD22 H -0.966 3.153 -5.748 1.00 . B B . 11 LEU HD22 1 1 3 2023 2 2 11 LEU HD23 H 0.510 4.116 -5.682 1.00 . B B . 11 LEU HD23 1 1 3 2024 2 2 11 LEU HG H 0.177 1.151 -5.353 1.00 . B B . 11 LEU HG 1 1 3 2025 2 2 11 LEU N N 3.520 1.631 -8.063 1.00 . B B . 11 LEU N 1 1 3 2026 2 2 11 LEU O O 2.739 -1.054 -6.139 1.00 . B B . 11 LEU O 1 1 3 2027 2 2 12 ALA C C 2.643 -2.850 -8.343 1.00 . B B . 12 ALA C 1 1 3 2028 2 2 12 ALA CA C 1.354 -2.046 -8.214 1.00 . B B . 12 ALA CA 1 1 3 2029 2 2 12 ALA CB C 0.521 -2.223 -9.486 1.00 . B B . 12 ALA CB 1 1 3 2030 2 2 12 ALA H H 1.455 0.047 -8.708 1.00 . B B . 12 ALA H 1 1 3 2031 2 2 12 ALA HA H 0.793 -2.394 -7.357 1.00 . B B . 12 ALA HA 1 1 3 2032 2 2 12 ALA HB1 H 0.515 -3.267 -9.768 1.00 . B B . 12 ALA HB1 1 1 3 2033 2 2 12 ALA HB2 H 0.952 -1.639 -10.284 1.00 . B B . 12 ALA HB2 1 1 3 2034 2 2 12 ALA HB3 H -0.491 -1.896 -9.303 1.00 . B B . 12 ALA HB3 1 1 3 2035 2 2 12 ALA N N 1.713 -0.616 -8.032 1.00 . B B . 12 ALA N 1 1 3 2036 2 2 12 ALA O O 2.881 -3.774 -7.601 1.00 . B B . 12 ALA O 1 1 3 2037 2 2 13 GLU C C 5.403 -3.444 -8.070 1.00 . B B . 13 GLU C 1 1 3 2038 2 2 13 GLU CA C 4.762 -3.241 -9.441 1.00 . B B . 13 GLU CA 1 1 3 2039 2 2 13 GLU CB C 5.710 -2.444 -10.337 1.00 . B B . 13 GLU CB 1 1 3 2040 2 2 13 GLU CD C 7.959 -3.187 -11.127 1.00 . B B . 13 GLU CD 1 1 3 2041 2 2 13 GLU CG C 6.452 -3.401 -11.270 1.00 . B B . 13 GLU CG 1 1 3 2042 2 2 13 GLU H H 3.282 -1.735 -9.862 1.00 . B B . 13 GLU H 1 1 3 2043 2 2 13 GLU HA H 4.562 -4.202 -9.891 1.00 . B B . 13 GLU HA 1 1 3 2044 2 2 13 GLU HB2 H 5.143 -1.734 -10.921 1.00 . B B . 13 GLU HB2 1 1 3 2045 2 2 13 GLU HB3 H 6.425 -1.915 -9.724 1.00 . B B . 13 GLU HB3 1 1 3 2046 2 2 13 GLU HG2 H 6.205 -4.421 -11.009 1.00 . B B . 13 GLU HG2 1 1 3 2047 2 2 13 GLU HG3 H 6.158 -3.210 -12.291 1.00 . B B . 13 GLU HG3 1 1 3 2048 2 2 13 GLU N N 3.485 -2.496 -9.277 1.00 . B B . 13 GLU N 1 1 3 2049 2 2 13 GLU O O 6.023 -4.455 -7.808 1.00 . B B . 13 GLU O 1 1 3 2050 2 2 13 GLU OE1 O 8.423 -2.120 -11.495 1.00 . B B . 13 GLU OE1 1 1 3 2051 2 2 13 GLU OE2 O 8.624 -4.093 -10.653 1.00 . B B . 13 GLU OE2 1 1 3 2052 2 2 14 ALA C C 5.044 -3.691 -5.060 1.00 . B B . 14 ALA C 1 1 3 2053 2 2 14 ALA CA C 5.851 -2.651 -5.832 1.00 . B B . 14 ALA CA 1 1 3 2054 2 2 14 ALA CB C 5.807 -1.313 -5.091 1.00 . B B . 14 ALA CB 1 1 3 2055 2 2 14 ALA H H 4.743 -1.685 -7.411 1.00 . B B . 14 ALA H 1 1 3 2056 2 2 14 ALA HA H 6.875 -2.986 -5.921 1.00 . B B . 14 ALA HA 1 1 3 2057 2 2 14 ALA HB1 H 5.951 -0.507 -5.795 1.00 . B B . 14 ALA HB1 1 1 3 2058 2 2 14 ALA HB2 H 6.591 -1.287 -4.349 1.00 . B B . 14 ALA HB2 1 1 3 2059 2 2 14 ALA HB3 H 4.847 -1.201 -4.607 1.00 . B B . 14 ALA HB3 1 1 3 2060 2 2 14 ALA N N 5.253 -2.495 -7.186 1.00 . B B . 14 ALA N 1 1 3 2061 2 2 14 ALA O O 5.584 -4.650 -4.543 1.00 . B B . 14 ALA O 1 1 3 2062 2 2 15 LEU C C 2.987 -5.848 -5.033 1.00 . B B . 15 LEU C 1 1 3 2063 2 2 15 LEU CA C 2.927 -4.526 -4.264 1.00 . B B . 15 LEU CA 1 1 3 2064 2 2 15 LEU CB C 1.476 -4.043 -4.196 1.00 . B B . 15 LEU CB 1 1 3 2065 2 2 15 LEU CD1 C 0.070 -2.102 -3.500 1.00 . B B . 15 LEU CD1 1 1 3 2066 2 2 15 LEU CD2 C 1.385 -3.367 -1.797 1.00 . B B . 15 LEU CD2 1 1 3 2067 2 2 15 LEU CG C 1.375 -2.857 -3.239 1.00 . B B . 15 LEU CG 1 1 3 2068 2 2 15 LEU H H 3.324 -2.753 -5.431 1.00 . B B . 15 LEU H 1 1 3 2069 2 2 15 LEU HA H 3.318 -4.657 -3.263 1.00 . B B . 15 LEU HA 1 1 3 2070 2 2 15 LEU HB2 H 1.152 -3.741 -5.181 1.00 . B B . 15 LEU HB2 1 1 3 2071 2 2 15 LEU HB3 H 0.848 -4.845 -3.840 1.00 . B B . 15 LEU HB3 1 1 3 2072 2 2 15 LEU HD11 H 0.182 -1.073 -3.191 1.00 . B B . 15 LEU HD11 1 1 3 2073 2 2 15 LEU HD12 H -0.731 -2.562 -2.940 1.00 . B B . 15 LEU HD12 1 1 3 2074 2 2 15 LEU HD13 H -0.161 -2.137 -4.554 1.00 . B B . 15 LEU HD13 1 1 3 2075 2 2 15 LEU HD21 H 1.674 -2.565 -1.134 1.00 . B B . 15 LEU HD21 1 1 3 2076 2 2 15 LEU HD22 H 2.090 -4.181 -1.709 1.00 . B B . 15 LEU HD22 1 1 3 2077 2 2 15 LEU HD23 H 0.398 -3.716 -1.532 1.00 . B B . 15 LEU HD23 1 1 3 2078 2 2 15 LEU HG H 2.213 -2.193 -3.395 1.00 . B B . 15 LEU HG 1 1 3 2079 2 2 15 LEU N N 3.751 -3.525 -4.992 1.00 . B B . 15 LEU N 1 1 3 2080 2 2 15 LEU O O 2.877 -6.921 -4.473 1.00 . B B . 15 LEU O 1 1 3 2081 2 2 16 TYR C C 4.483 -7.787 -6.788 1.00 . B B . 16 TYR C 1 1 3 2082 2 2 16 TYR CA C 3.253 -6.978 -7.177 1.00 . B B . 16 TYR CA 1 1 3 2083 2 2 16 TYR CB C 3.406 -6.544 -8.636 1.00 . B B . 16 TYR CB 1 1 3 2084 2 2 16 TYR CD1 C 2.382 -8.691 -9.455 1.00 . B B . 16 TYR CD1 1 1 3 2085 2 2 16 TYR CD2 C 1.579 -6.587 -10.356 1.00 . B B . 16 TYR CD2 1 1 3 2086 2 2 16 TYR CE1 C 1.473 -9.384 -10.265 1.00 . B B . 16 TYR CE1 1 1 3 2087 2 2 16 TYR CE2 C 0.669 -7.277 -11.165 1.00 . B B . 16 TYR CE2 1 1 3 2088 2 2 16 TYR CG C 2.432 -7.294 -9.502 1.00 . B B . 16 TYR CG 1 1 3 2089 2 2 16 TYR CZ C 0.615 -8.677 -11.120 1.00 . B B . 16 TYR CZ 1 1 3 2090 2 2 16 TYR H H 3.259 -4.876 -6.735 1.00 . B B . 16 TYR H 1 1 3 2091 2 2 16 TYR HA H 2.362 -7.576 -7.063 1.00 . B B . 16 TYR HA 1 1 3 2092 2 2 16 TYR HB2 H 3.215 -5.487 -8.718 1.00 . B B . 16 TYR HB2 1 1 3 2093 2 2 16 TYR HB3 H 4.413 -6.751 -8.968 1.00 . B B . 16 TYR HB3 1 1 3 2094 2 2 16 TYR HD1 H 3.046 -9.234 -8.796 1.00 . B B . 16 TYR HD1 1 1 3 2095 2 2 16 TYR HD2 H 1.625 -5.508 -10.388 1.00 . B B . 16 TYR HD2 1 1 3 2096 2 2 16 TYR HE1 H 1.431 -10.461 -10.229 1.00 . B B . 16 TYR HE1 1 1 3 2097 2 2 16 TYR HE2 H 0.010 -6.730 -11.823 1.00 . B B . 16 TYR HE2 1 1 3 2098 2 2 16 TYR HH H -0.405 -10.235 -11.545 1.00 . B B . 16 TYR HH 1 1 3 2099 2 2 16 TYR N N 3.170 -5.761 -6.322 1.00 . B B . 16 TYR N 1 1 3 2100 2 2 16 TYR O O 4.581 -8.967 -7.056 1.00 . B B . 16 TYR O 1 1 3 2101 2 2 16 TYR OH O -0.281 -9.359 -11.918 1.00 . B B . 16 TYR OH 1 1 3 2102 2 2 17 LEU C C 6.686 -8.120 -4.300 1.00 . B B . 17 LEU C 1 1 3 2103 2 2 17 LEU CA C 6.682 -7.836 -5.807 1.00 . B B . 17 LEU CA 1 1 3 2104 2 2 17 LEU CB C 7.835 -6.922 -6.182 1.00 . B B . 17 LEU CB 1 1 3 2105 2 2 17 LEU CD1 C 9.117 -9.082 -6.094 1.00 . B B . 17 LEU CD1 1 1 3 2106 2 2 17 LEU CD2 C 10.240 -6.950 -6.708 1.00 . B B . 17 LEU CD2 1 1 3 2107 2 2 17 LEU CG C 9.163 -7.569 -5.832 1.00 . B B . 17 LEU CG 1 1 3 2108 2 2 17 LEU H H 5.348 -6.188 -6.004 1.00 . B B . 17 LEU H 1 1 3 2109 2 2 17 LEU HA H 6.772 -8.761 -6.354 1.00 . B B . 17 LEU HA 1 1 3 2110 2 2 17 LEU HB2 H 7.803 -6.725 -7.244 1.00 . B B . 17 LEU HB2 1 1 3 2111 2 2 17 LEU HB3 H 7.742 -5.990 -5.645 1.00 . B B . 17 LEU HB3 1 1 3 2112 2 2 17 LEU HD11 H 9.009 -9.259 -7.154 1.00 . B B . 17 LEU HD11 1 1 3 2113 2 2 17 LEU HD12 H 8.281 -9.516 -5.570 1.00 . B B . 17 LEU HD12 1 1 3 2114 2 2 17 LEU HD13 H 10.033 -9.535 -5.746 1.00 . B B . 17 LEU HD13 1 1 3 2115 2 2 17 LEU HD21 H 10.289 -7.488 -7.644 1.00 . B B . 17 LEU HD21 1 1 3 2116 2 2 17 LEU HD22 H 11.190 -7.011 -6.206 1.00 . B B . 17 LEU HD22 1 1 3 2117 2 2 17 LEU HD23 H 9.994 -5.917 -6.900 1.00 . B B . 17 LEU HD23 1 1 3 2118 2 2 17 LEU HG H 9.378 -7.379 -4.797 1.00 . B B . 17 LEU HG 1 1 3 2119 2 2 17 LEU N N 5.438 -7.144 -6.187 1.00 . B B . 17 LEU N 1 1 3 2120 2 2 17 LEU O O 7.584 -8.750 -3.778 1.00 . B B . 17 LEU O 1 1 3 2121 2 2 18 VAL C C 4.604 -9.004 -1.842 1.00 . B B . 18 VAL C 1 1 3 2122 2 2 18 VAL CA C 5.637 -7.919 -2.128 1.00 . B B . 18 VAL CA 1 1 3 2123 2 2 18 VAL CB C 5.252 -6.627 -1.400 1.00 . B B . 18 VAL CB 1 1 3 2124 2 2 18 VAL CG1 C 5.951 -5.457 -2.072 1.00 . B B . 18 VAL CG1 1 1 3 2125 2 2 18 VAL CG2 C 3.737 -6.407 -1.466 1.00 . B B . 18 VAL CG2 1 1 3 2126 2 2 18 VAL H H 4.970 -7.159 -4.029 1.00 . B B . 18 VAL H 1 1 3 2127 2 2 18 VAL HA H 6.608 -8.248 -1.786 1.00 . B B . 18 VAL HA 1 1 3 2128 2 2 18 VAL HB H 5.565 -6.686 -0.370 1.00 . B B . 18 VAL HB 1 1 3 2129 2 2 18 VAL HG11 H 6.594 -5.827 -2.855 1.00 . B B . 18 VAL HG11 1 1 3 2130 2 2 18 VAL HG12 H 6.538 -4.925 -1.341 1.00 . B B . 18 VAL HG12 1 1 3 2131 2 2 18 VAL HG13 H 5.211 -4.797 -2.495 1.00 . B B . 18 VAL HG13 1 1 3 2132 2 2 18 VAL HG21 H 3.427 -6.353 -2.498 1.00 . B B . 18 VAL HG21 1 1 3 2133 2 2 18 VAL HG22 H 3.486 -5.483 -0.967 1.00 . B B . 18 VAL HG22 1 1 3 2134 2 2 18 VAL HG23 H 3.233 -7.228 -0.980 1.00 . B B . 18 VAL HG23 1 1 3 2135 2 2 18 VAL N N 5.688 -7.665 -3.594 1.00 . B B . 18 VAL N 1 1 3 2136 2 2 18 VAL O O 4.851 -9.936 -1.102 1.00 . B B . 18 VAL O 1 1 3 2137 2 2 19 CYS C C 2.344 -10.855 -3.394 1.00 . B B . 19 CYS C 1 1 3 2138 2 2 19 CYS CA C 2.394 -9.908 -2.195 1.00 . B B . 19 CYS CA 1 1 3 2139 2 2 19 CYS CB C 1.041 -9.214 -2.027 1.00 . B B . 19 CYS CB 1 1 3 2140 2 2 19 CYS H H 3.270 -8.129 -3.019 1.00 . B B . 19 CYS H 1 1 3 2141 2 2 19 CYS HA H 2.629 -10.463 -1.301 1.00 . B B . 19 CYS HA 1 1 3 2142 2 2 19 CYS HB2 H 1.009 -8.333 -2.651 1.00 . B B . 19 CYS HB2 1 1 3 2143 2 2 19 CYS HB3 H 0.253 -9.890 -2.319 1.00 . B B . 19 CYS HB3 1 1 3 2144 2 2 19 CYS N N 3.446 -8.887 -2.426 1.00 . B B . 19 CYS N 1 1 3 2145 2 2 19 CYS O O 2.131 -12.043 -3.253 1.00 . B B . 19 CYS O 1 1 3 2146 2 2 19 CYS SG S 0.821 -8.736 -0.293 1.00 . B B . 19 CYS SG 1 1 3 2147 2 2 20 GLY C C 1.153 -11.903 -5.874 1.00 . B B . 20 GLY C 1 1 3 2148 2 2 20 GLY CA C 2.506 -11.200 -5.788 1.00 . B B . 20 GLY CA 1 1 3 2149 2 2 20 GLY H H 2.708 -9.375 -4.663 1.00 . B B . 20 GLY H 1 1 3 2150 2 2 20 GLY HA2 H 2.654 -10.591 -6.669 1.00 . B B . 20 GLY HA2 1 1 3 2151 2 2 20 GLY HA3 H 3.289 -11.940 -5.725 1.00 . B B . 20 GLY HA3 1 1 3 2152 2 2 20 GLY N N 2.539 -10.335 -4.574 1.00 . B B . 20 GLY N 1 1 3 2153 2 2 20 GLY O O 0.236 -11.431 -6.515 1.00 . B B . 20 GLY O 1 1 3 2154 2 2 21 GLU C C -0.997 -13.590 -3.925 1.00 . B B . 21 GLU C 1 1 3 2155 2 2 21 GLU CA C -0.282 -13.754 -5.268 1.00 . B B . 21 GLU CA 1 1 3 2156 2 2 21 GLU CB C -0.042 -15.242 -5.550 1.00 . B B . 21 GLU CB 1 1 3 2157 2 2 21 GLU CD C 0.846 -15.578 -3.231 1.00 . B B . 21 GLU CD 1 1 3 2158 2 2 21 GLU CG C 1.143 -15.752 -4.722 1.00 . B B . 21 GLU CG 1 1 3 2159 2 2 21 GLU H H 1.766 -13.389 -4.710 1.00 . B B . 21 GLU H 1 1 3 2160 2 2 21 GLU HA H -0.898 -13.337 -6.052 1.00 . B B . 21 GLU HA 1 1 3 2161 2 2 21 GLU HB2 H -0.929 -15.803 -5.291 1.00 . B B . 21 GLU HB2 1 1 3 2162 2 2 21 GLU HB3 H 0.172 -15.377 -6.600 1.00 . B B . 21 GLU HB3 1 1 3 2163 2 2 21 GLU HG2 H 1.302 -16.799 -4.936 1.00 . B B . 21 GLU HG2 1 1 3 2164 2 2 21 GLU HG3 H 2.031 -15.195 -4.980 1.00 . B B . 21 GLU HG3 1 1 3 2165 2 2 21 GLU N N 1.017 -13.028 -5.227 1.00 . B B . 21 GLU N 1 1 3 2166 2 2 21 GLU O O -2.132 -13.993 -3.762 1.00 . B B . 21 GLU O 1 1 3 2167 2 2 21 GLU OE1 O -0.286 -15.811 -2.842 1.00 . B B . 21 GLU OE1 1 1 3 2168 2 2 21 GLU OE2 O 1.757 -15.216 -2.505 1.00 . B B . 21 GLU OE2 1 1 3 2169 2 2 22 ARG C C -2.264 -11.979 -1.813 1.00 . B B . 22 ARG C 1 1 3 2170 2 2 22 ARG CA C -0.991 -12.807 -1.634 1.00 . B B . 22 ARG CA 1 1 3 2171 2 2 22 ARG CB C -0.030 -12.080 -0.692 1.00 . B B . 22 ARG CB 1 1 3 2172 2 2 22 ARG CD C -0.048 -14.107 0.768 1.00 . B B . 22 ARG CD 1 1 3 2173 2 2 22 ARG CG C 0.844 -13.104 0.034 1.00 . B B . 22 ARG CG 1 1 3 2174 2 2 22 ARG CZ C 1.172 -15.983 1.697 1.00 . B B . 22 ARG CZ 1 1 3 2175 2 2 22 ARG H H 0.570 -12.676 -3.112 1.00 . B B . 22 ARG H 1 1 3 2176 2 2 22 ARG HA H -1.246 -13.769 -1.218 1.00 . B B . 22 ARG HA 1 1 3 2177 2 2 22 ARG HB2 H 0.597 -11.410 -1.263 1.00 . B B . 22 ARG HB2 1 1 3 2178 2 2 22 ARG HB3 H -0.595 -11.514 0.033 1.00 . B B . 22 ARG HB3 1 1 3 2179 2 2 22 ARG HD2 H -0.894 -13.590 1.194 1.00 . B B . 22 ARG HD2 1 1 3 2180 2 2 22 ARG HD3 H -0.396 -14.856 0.071 1.00 . B B . 22 ARG HD3 1 1 3 2181 2 2 22 ARG HE H 0.918 -14.280 2.686 1.00 . B B . 22 ARG HE 1 1 3 2182 2 2 22 ARG HG2 H 1.459 -13.626 -0.685 1.00 . B B . 22 ARG HG2 1 1 3 2183 2 2 22 ARG HG3 H 1.476 -12.598 0.748 1.00 . B B . 22 ARG HG3 1 1 3 2184 2 2 22 ARG HH11 H -0.473 -16.836 2.456 1.00 . B B . 22 ARG HH11 1 1 3 2185 2 2 22 ARG HH12 H 0.767 -17.929 1.939 1.00 . B B . 22 ARG HH12 1 1 3 2186 2 2 22 ARG HH21 H 2.923 -15.416 0.909 1.00 . B B . 22 ARG HH21 1 1 3 2187 2 2 22 ARG HH22 H 2.691 -17.125 1.065 1.00 . B B . 22 ARG HH22 1 1 3 2188 2 2 22 ARG N N -0.343 -12.998 -2.962 1.00 . B B . 22 ARG N 1 1 3 2189 2 2 22 ARG NE N 0.734 -14.764 1.854 1.00 . B B . 22 ARG NE 1 1 3 2190 2 2 22 ARG NH1 N 0.431 -16.995 2.059 1.00 . B B . 22 ARG NH1 1 1 3 2191 2 2 22 ARG NH2 N 2.354 -16.191 1.183 1.00 . B B . 22 ARG NH2 1 1 3 2192 2 2 22 ARG O O -3.141 -11.978 -0.972 1.00 . B B . 22 ARG O 1 1 3 2193 2 2 23 GLY C C -3.461 -9.106 -2.448 1.00 . B B . 23 GLY C 1 1 3 2194 2 2 23 GLY CA C -3.587 -10.458 -3.154 1.00 . B B . 23 GLY CA 1 1 3 2195 2 2 23 GLY H H -1.652 -11.304 -3.573 1.00 . B B . 23 GLY H 1 1 3 2196 2 2 23 GLY HA2 H -3.702 -10.298 -4.217 1.00 . B B . 23 GLY HA2 1 1 3 2197 2 2 23 GLY HA3 H -4.454 -10.976 -2.774 1.00 . B B . 23 GLY HA3 1 1 3 2198 2 2 23 GLY N N -2.370 -11.281 -2.907 1.00 . B B . 23 GLY N 1 1 3 2199 2 2 23 GLY O O -3.916 -8.931 -1.335 1.00 . B B . 23 GLY O 1 1 3 2200 2 2 24 PHE C C -3.770 -5.863 -3.048 1.00 . B B . 24 PHE C 1 1 3 2201 2 2 24 PHE CA C -2.719 -6.801 -2.458 1.00 . B B . 24 PHE CA 1 1 3 2202 2 2 24 PHE CB C -1.317 -6.242 -2.714 1.00 . B B . 24 PHE CB 1 1 3 2203 2 2 24 PHE CD1 C -0.621 -7.250 -4.919 1.00 . B B . 24 PHE CD1 1 1 3 2204 2 2 24 PHE CD2 C -1.277 -4.915 -4.857 1.00 . B B . 24 PHE CD2 1 1 3 2205 2 2 24 PHE CE1 C -0.383 -7.146 -6.296 1.00 . B B . 24 PHE CE1 1 1 3 2206 2 2 24 PHE CE2 C -1.038 -4.809 -6.233 1.00 . B B . 24 PHE CE2 1 1 3 2207 2 2 24 PHE CG C -1.067 -6.134 -4.200 1.00 . B B . 24 PHE CG 1 1 3 2208 2 2 24 PHE CZ C -0.591 -5.926 -6.953 1.00 . B B . 24 PHE CZ 1 1 3 2209 2 2 24 PHE H H -2.506 -8.298 -3.993 1.00 . B B . 24 PHE H 1 1 3 2210 2 2 24 PHE HA H -2.885 -6.890 -1.398 1.00 . B B . 24 PHE HA 1 1 3 2211 2 2 24 PHE HB2 H -1.233 -5.264 -2.264 1.00 . B B . 24 PHE HB2 1 1 3 2212 2 2 24 PHE HB3 H -0.582 -6.902 -2.276 1.00 . B B . 24 PHE HB3 1 1 3 2213 2 2 24 PHE HD1 H -0.460 -8.191 -4.413 1.00 . B B . 24 PHE HD1 1 1 3 2214 2 2 24 PHE HD2 H -1.622 -4.054 -4.302 1.00 . B B . 24 PHE HD2 1 1 3 2215 2 2 24 PHE HE1 H -0.039 -8.006 -6.852 1.00 . B B . 24 PHE HE1 1 1 3 2216 2 2 24 PHE HE2 H -1.199 -3.870 -6.740 1.00 . B B . 24 PHE HE2 1 1 3 2217 2 2 24 PHE HZ H -0.407 -5.845 -8.015 1.00 . B B . 24 PHE HZ 1 1 3 2218 2 2 24 PHE N N -2.857 -8.142 -3.092 1.00 . B B . 24 PHE N 1 1 3 2219 2 2 24 PHE O O -3.861 -5.694 -4.248 1.00 . B B . 24 PHE O 1 1 3 2220 2 2 25 PHE C C -5.231 -2.904 -2.600 1.00 . B B . 25 PHE C 1 1 3 2221 2 2 25 PHE CA C -5.645 -4.372 -2.737 1.00 . B B . 25 PHE CA 1 1 3 2222 2 2 25 PHE CB C -6.937 -4.609 -1.953 1.00 . B B . 25 PHE CB 1 1 3 2223 2 2 25 PHE CD1 C -6.219 -5.313 0.362 1.00 . B B . 25 PHE CD1 1 1 3 2224 2 2 25 PHE CD2 C -6.960 -3.028 0.012 1.00 . B B . 25 PHE CD2 1 1 3 2225 2 2 25 PHE CE1 C -5.998 -5.033 1.718 1.00 . B B . 25 PHE CE1 1 1 3 2226 2 2 25 PHE CE2 C -6.740 -2.749 1.367 1.00 . B B . 25 PHE CE2 1 1 3 2227 2 2 25 PHE CG C -6.700 -4.310 -0.491 1.00 . B B . 25 PHE CG 1 1 3 2228 2 2 25 PHE CZ C -6.259 -3.751 2.221 1.00 . B B . 25 PHE CZ 1 1 3 2229 2 2 25 PHE H H -4.505 -5.437 -1.252 1.00 . B B . 25 PHE H 1 1 3 2230 2 2 25 PHE HA H -5.814 -4.597 -3.776 1.00 . B B . 25 PHE HA 1 1 3 2231 2 2 25 PHE HB2 H -7.712 -3.960 -2.332 1.00 . B B . 25 PHE HB2 1 1 3 2232 2 2 25 PHE HB3 H -7.241 -5.638 -2.064 1.00 . B B . 25 PHE HB3 1 1 3 2233 2 2 25 PHE HD1 H -6.019 -6.301 -0.024 1.00 . B B . 25 PHE HD1 1 1 3 2234 2 2 25 PHE HD2 H -7.331 -2.256 -0.645 1.00 . B B . 25 PHE HD2 1 1 3 2235 2 2 25 PHE HE1 H -5.628 -5.806 2.375 1.00 . B B . 25 PHE HE1 1 1 3 2236 2 2 25 PHE HE2 H -6.941 -1.761 1.754 1.00 . B B . 25 PHE HE2 1 1 3 2237 2 2 25 PHE HZ H -6.088 -3.535 3.265 1.00 . B B . 25 PHE HZ 1 1 3 2238 2 2 25 PHE N N -4.583 -5.272 -2.216 1.00 . B B . 25 PHE N 1 1 3 2239 2 2 25 PHE O O -4.777 -2.467 -1.560 1.00 . B B . 25 PHE O 1 1 3 2240 2 2 26 TYR C C -6.251 0.120 -4.123 1.00 . B B . 26 TYR C 1 1 3 2241 2 2 26 TYR CA C -5.057 -0.691 -3.587 1.00 . B B . 26 TYR CA 1 1 3 2242 2 2 26 TYR CB C -3.778 -0.445 -4.422 1.00 . B B . 26 TYR CB 1 1 3 2243 2 2 26 TYR CD1 C -4.442 1.518 -5.855 1.00 . B B . 26 TYR CD1 1 1 3 2244 2 2 26 TYR CD2 C -4.104 -0.635 -6.920 1.00 . B B . 26 TYR CD2 1 1 3 2245 2 2 26 TYR CE1 C -4.765 2.083 -7.094 1.00 . B B . 26 TYR CE1 1 1 3 2246 2 2 26 TYR CE2 C -4.429 -0.071 -8.161 1.00 . B B . 26 TYR CE2 1 1 3 2247 2 2 26 TYR CG C -4.110 0.161 -5.767 1.00 . B B . 26 TYR CG 1 1 3 2248 2 2 26 TYR CZ C -4.759 1.289 -8.248 1.00 . B B . 26 TYR CZ 1 1 3 2249 2 2 26 TYR H H -5.793 -2.512 -4.463 1.00 . B B . 26 TYR H 1 1 3 2250 2 2 26 TYR HA H -4.869 -0.408 -2.561 1.00 . B B . 26 TYR HA 1 1 3 2251 2 2 26 TYR HB2 H -3.127 0.228 -3.883 1.00 . B B . 26 TYR HB2 1 1 3 2252 2 2 26 TYR HB3 H -3.266 -1.386 -4.571 1.00 . B B . 26 TYR HB3 1 1 3 2253 2 2 26 TYR HD1 H -4.446 2.131 -4.966 1.00 . B B . 26 TYR HD1 1 1 3 2254 2 2 26 TYR HD2 H -3.848 -1.682 -6.852 1.00 . B B . 26 TYR HD2 1 1 3 2255 2 2 26 TYR HE1 H -5.022 3.129 -7.159 1.00 . B B . 26 TYR HE1 1 1 3 2256 2 2 26 TYR HE2 H -4.426 -0.685 -9.049 1.00 . B B . 26 TYR HE2 1 1 3 2257 2 2 26 TYR HH H -4.725 2.738 -9.491 1.00 . B B . 26 TYR HH 1 1 3 2258 2 2 26 TYR N N -5.410 -2.137 -3.643 1.00 . B B . 26 TYR N 1 1 3 2259 2 2 26 TYR O O -6.570 0.081 -5.294 1.00 . B B . 26 TYR O 1 1 3 2260 2 2 26 TYR OH O -5.079 1.845 -9.471 1.00 . B B . 26 TYR OH 1 1 3 2261 2 2 27 THR C C -7.628 2.885 -4.454 1.00 . B B . 27 THR C 1 1 3 2262 2 2 27 THR CA C -8.104 1.620 -3.738 1.00 . B B . 27 THR CA 1 1 3 2263 2 2 27 THR CB C -8.956 2.006 -2.532 1.00 . B B . 27 THR CB 1 1 3 2264 2 2 27 THR CG2 C -9.016 0.830 -1.558 1.00 . B B . 27 THR CG2 1 1 3 2265 2 2 27 THR H H -6.685 0.844 -2.325 1.00 . B B . 27 THR H 1 1 3 2266 2 2 27 THR HA H -8.692 1.021 -4.418 1.00 . B B . 27 THR HA 1 1 3 2267 2 2 27 THR HB H -9.951 2.246 -2.858 1.00 . B B . 27 THR HB 1 1 3 2268 2 2 27 THR HG1 H -7.608 2.832 -1.400 1.00 . B B . 27 THR HG1 1 1 3 2269 2 2 27 THR HG21 H -8.397 1.043 -0.700 1.00 . B B . 27 THR HG21 1 1 3 2270 2 2 27 THR HG22 H -8.655 -0.061 -2.050 1.00 . B B . 27 THR HG22 1 1 3 2271 2 2 27 THR HG23 H -10.036 0.678 -1.239 1.00 . B B . 27 THR HG23 1 1 3 2272 2 2 27 THR N N -6.932 0.835 -3.271 1.00 . B B . 27 THR N 1 1 3 2273 2 2 27 THR O O -6.505 3.317 -4.291 1.00 . B B . 27 THR O 1 1 3 2274 2 2 27 THR OG1 O -8.380 3.132 -1.886 1.00 . B B . 27 THR OG1 1 1 3 2275 2 2 28 LYS C C -9.289 5.642 -6.117 1.00 . B B . 28 LYS C 1 1 3 2276 2 2 28 LYS CA C -8.076 4.717 -5.978 1.00 . B B . 28 LYS CA 1 1 3 2277 2 2 28 LYS CB C -7.543 4.362 -7.375 1.00 . B B . 28 LYS CB 1 1 3 2278 2 2 28 LYS CD C -9.350 2.711 -7.896 1.00 . B B . 28 LYS CD 1 1 3 2279 2 2 28 LYS CE C -9.756 1.308 -7.440 1.00 . B B . 28 LYS CE 1 1 3 2280 2 2 28 LYS CG C -7.843 2.895 -7.705 1.00 . B B . 28 LYS CG 1 1 3 2281 2 2 28 LYS H H -9.377 3.112 -5.365 1.00 . B B . 28 LYS H 1 1 3 2282 2 2 28 LYS HA H -7.304 5.225 -5.419 1.00 . B B . 28 LYS HA 1 1 3 2283 2 2 28 LYS HB2 H -8.016 4.998 -8.110 1.00 . B B . 28 LYS HB2 1 1 3 2284 2 2 28 LYS HB3 H -6.475 4.522 -7.400 1.00 . B B . 28 LYS HB3 1 1 3 2285 2 2 28 LYS HD2 H -9.879 3.448 -7.308 1.00 . B B . 28 LYS HD2 1 1 3 2286 2 2 28 LYS HD3 H -9.599 2.834 -8.938 1.00 . B B . 28 LYS HD3 1 1 3 2287 2 2 28 LYS HE2 H -8.897 0.805 -7.019 1.00 . B B . 28 LYS HE2 1 1 3 2288 2 2 28 LYS HE3 H -10.530 1.383 -6.691 1.00 . B B . 28 LYS HE3 1 1 3 2289 2 2 28 LYS HG2 H -7.328 2.619 -8.614 1.00 . B B . 28 LYS HG2 1 1 3 2290 2 2 28 LYS HG3 H -7.505 2.267 -6.894 1.00 . B B . 28 LYS HG3 1 1 3 2291 2 2 28 LYS HZ1 H -9.510 -0.086 -8.967 1.00 . B B . 28 LYS HZ1 1 1 3 2292 2 2 28 LYS HZ2 H -10.564 1.189 -9.354 1.00 . B B . 28 LYS HZ2 1 1 3 2293 2 2 28 LYS HZ3 H -11.073 -0.050 -8.309 1.00 . B B . 28 LYS HZ3 1 1 3 2294 2 2 28 LYS N N -8.476 3.479 -5.247 1.00 . B B . 28 LYS N 1 1 3 2295 2 2 28 LYS NZ N -10.263 0.531 -8.606 1.00 . B B . 28 LYS NZ 1 1 3 2296 2 2 28 LYS O O -10.411 5.181 -6.202 1.00 . B B . 28 LYS O 1 1 3 2297 2 2 29 PRO C C -10.529 8.076 -7.721 1.00 . B B . 29 PRO C 1 1 3 2298 2 2 29 PRO CA C -10.075 7.951 -6.263 1.00 . B B . 29 PRO CA 1 1 3 2299 2 2 29 PRO CB C -9.379 9.234 -5.801 1.00 . B B . 29 PRO CB 1 1 3 2300 2 2 29 PRO CD C -7.656 7.471 -6.030 1.00 . B B . 29 PRO CD 1 1 3 2301 2 2 29 PRO CG C -7.861 8.997 -5.980 1.00 . B B . 29 PRO CG 1 1 3 2302 2 2 29 PRO HA H -10.910 7.730 -5.618 1.00 . B B . 29 PRO HA 1 1 3 2303 2 2 29 PRO HB2 H -9.703 10.070 -6.407 1.00 . B B . 29 PRO HB2 1 1 3 2304 2 2 29 PRO HB3 H -9.598 9.422 -4.761 1.00 . B B . 29 PRO HB3 1 1 3 2305 2 2 29 PRO HD2 H -7.068 7.198 -6.896 1.00 . B B . 29 PRO HD2 1 1 3 2306 2 2 29 PRO HD3 H -7.184 7.122 -5.125 1.00 . B B . 29 PRO HD3 1 1 3 2307 2 2 29 PRO HG2 H -7.523 9.449 -6.901 1.00 . B B . 29 PRO HG2 1 1 3 2308 2 2 29 PRO HG3 H -7.319 9.410 -5.143 1.00 . B B . 29 PRO HG3 1 1 3 2309 2 2 29 PRO N N -9.025 6.925 -6.135 1.00 . B B . 29 PRO N 1 1 3 2310 2 2 29 PRO O O -9.746 8.373 -8.601 1.00 . B B . 29 PRO O 1 1 3 2311 2 2 30 THR C C -12.346 9.435 -9.791 1.00 . B B . 30 THR C 1 1 3 2312 2 2 30 THR CA C -12.290 7.961 -9.382 1.00 . B B . 30 THR CA 1 1 3 2313 2 2 30 THR CB C -13.692 7.354 -9.469 1.00 . B B . 30 THR CB 1 1 3 2314 2 2 30 THR CG2 C -13.731 6.311 -10.587 1.00 . B B . 30 THR CG2 1 1 3 2315 2 2 30 THR H H -12.404 7.616 -7.258 1.00 . B B . 30 THR H 1 1 3 2316 2 2 30 THR HA H -11.626 7.427 -10.046 1.00 . B B . 30 THR HA 1 1 3 2317 2 2 30 THR HB H -14.409 8.132 -9.685 1.00 . B B . 30 THR HB 1 1 3 2318 2 2 30 THR HG1 H -14.544 7.356 -7.720 1.00 . B B . 30 THR HG1 1 1 3 2319 2 2 30 THR HG21 H -14.179 6.744 -11.468 1.00 . B B . 30 THR HG21 1 1 3 2320 2 2 30 THR HG22 H -14.316 5.461 -10.266 1.00 . B B . 30 THR HG22 1 1 3 2321 2 2 30 THR HG23 H -12.725 5.990 -10.813 1.00 . B B . 30 THR HG23 1 1 3 2322 2 2 30 THR N N -11.788 7.853 -7.982 1.00 . B B . 30 THR N 1 1 3 2323 2 2 30 THR O O -11.472 10.178 -9.377 1.00 . B B . 30 THR O 1 1 3 2324 2 2 30 THR OXT O -13.263 9.795 -10.512 1.00 . B B . 30 THR OXT 1 1 3 2325 2 2 30 THR OG1 O -14.017 6.738 -8.231 1.00 . B B . 30 THR OG1 1 1 4 2326 1 1 1 GLY C C -3.668 7.544 0.354 1.00 . A A . 1 GLY C 1 1 4 2327 1 1 1 GLY CA C -5.084 8.000 0.446 1.00 . A A . 1 GLY CA 1 1 4 2328 1 1 1 GLY H1 H -7.101 7.553 -0.011 1.00 . A A . 1 GLY H1 1 1 4 2329 1 1 1 GLY H2 H -6.052 6.229 -0.188 1.00 . A A . 1 GLY H2 1 1 4 2330 1 1 1 GLY H3 H -6.065 7.467 -1.352 1.00 . A A . 1 GLY H3 1 1 4 2331 1 1 1 GLY HA2 H -4.756 8.774 -0.049 1.00 . A A . 1 GLY HA2 1 1 4 2332 1 1 1 GLY HA3 H -5.548 8.283 1.478 1.00 . A A . 1 GLY HA3 1 1 4 2333 1 1 1 GLY N N -6.162 7.253 -0.339 1.00 . A A . 1 GLY N 1 1 4 2334 1 1 1 GLY O O -2.779 8.127 0.942 1.00 . A A . 1 GLY O 1 1 4 2335 1 1 2 ILE C C -1.517 6.375 -1.924 1.00 . A A . 2 ILE C 1 1 4 2336 1 1 2 ILE CA C -2.023 6.002 -0.535 1.00 . A A . 2 ILE CA 1 1 4 2337 1 1 2 ILE CB C -2.001 4.483 -0.374 1.00 . A A . 2 ILE CB 1 1 4 2338 1 1 2 ILE CD1 C -0.510 2.477 -0.523 1.00 . A A . 2 ILE CD1 1 1 4 2339 1 1 2 ILE CG1 C -0.549 3.997 -0.353 1.00 . A A . 2 ILE CG1 1 1 4 2340 1 1 2 ILE CG2 C -2.741 3.842 -1.547 1.00 . A A . 2 ILE CG2 1 1 4 2341 1 1 2 ILE H H -4.148 6.054 -0.870 1.00 . A A . 2 ILE H 1 1 4 2342 1 1 2 ILE HA H -1.395 6.456 0.212 1.00 . A A . 2 ILE HA 1 1 4 2343 1 1 2 ILE HB H -2.489 4.213 0.552 1.00 . A A . 2 ILE HB 1 1 4 2344 1 1 2 ILE HD11 H 0.236 2.059 0.137 1.00 . A A . 2 ILE HD11 1 1 4 2345 1 1 2 ILE HD12 H -0.258 2.235 -1.546 1.00 . A A . 2 ILE HD12 1 1 4 2346 1 1 2 ILE HD13 H -1.478 2.061 -0.283 1.00 . A A . 2 ILE HD13 1 1 4 2347 1 1 2 ILE HG12 H -0.003 4.464 -1.159 1.00 . A A . 2 ILE HG12 1 1 4 2348 1 1 2 ILE HG13 H -0.095 4.264 0.591 1.00 . A A . 2 ILE HG13 1 1 4 2349 1 1 2 ILE HG21 H -2.834 2.780 -1.378 1.00 . A A . 2 ILE HG21 1 1 4 2350 1 1 2 ILE HG22 H -2.186 4.015 -2.459 1.00 . A A . 2 ILE HG22 1 1 4 2351 1 1 2 ILE HG23 H -3.722 4.282 -1.636 1.00 . A A . 2 ILE HG23 1 1 4 2352 1 1 2 ILE N N -3.418 6.501 -0.392 1.00 . A A . 2 ILE N 1 1 4 2353 1 1 2 ILE O O -0.390 6.791 -2.104 1.00 . A A . 2 ILE O 1 1 4 2354 1 1 3 VAL C C -1.328 7.971 -4.300 1.00 . A A . 3 VAL C 1 1 4 2355 1 1 3 VAL CA C -1.962 6.578 -4.294 1.00 . A A . 3 VAL CA 1 1 4 2356 1 1 3 VAL CB C -3.210 6.575 -5.177 1.00 . A A . 3 VAL CB 1 1 4 2357 1 1 3 VAL CG1 C -2.829 6.979 -6.597 1.00 . A A . 3 VAL CG1 1 1 4 2358 1 1 3 VAL CG2 C -3.820 5.172 -5.193 1.00 . A A . 3 VAL CG2 1 1 4 2359 1 1 3 VAL H H -3.263 5.899 -2.725 1.00 . A A . 3 VAL H 1 1 4 2360 1 1 3 VAL HA H -1.254 5.851 -4.663 1.00 . A A . 3 VAL HA 1 1 4 2361 1 1 3 VAL HB H -3.930 7.279 -4.783 1.00 . A A . 3 VAL HB 1 1 4 2362 1 1 3 VAL HG11 H -3.673 6.822 -7.252 1.00 . A A . 3 VAL HG11 1 1 4 2363 1 1 3 VAL HG12 H -1.996 6.378 -6.929 1.00 . A A . 3 VAL HG12 1 1 4 2364 1 1 3 VAL HG13 H -2.551 8.022 -6.611 1.00 . A A . 3 VAL HG13 1 1 4 2365 1 1 3 VAL HG21 H -3.057 4.445 -4.961 1.00 . A A . 3 VAL HG21 1 1 4 2366 1 1 3 VAL HG22 H -4.226 4.968 -6.172 1.00 . A A . 3 VAL HG22 1 1 4 2367 1 1 3 VAL HG23 H -4.608 5.113 -4.456 1.00 . A A . 3 VAL HG23 1 1 4 2368 1 1 3 VAL N N -2.359 6.232 -2.906 1.00 . A A . 3 VAL N 1 1 4 2369 1 1 3 VAL O O -0.501 8.285 -5.131 1.00 . A A . 3 VAL O 1 1 4 2370 1 1 4 GLU C C -0.070 10.231 -2.215 1.00 . A A . 4 GLU C 1 1 4 2371 1 1 4 GLU CA C -1.132 10.179 -3.313 1.00 . A A . 4 GLU CA 1 1 4 2372 1 1 4 GLU CB C -2.239 11.188 -3.001 1.00 . A A . 4 GLU CB 1 1 4 2373 1 1 4 GLU CD C -2.762 13.631 -2.900 1.00 . A A . 4 GLU CD 1 1 4 2374 1 1 4 GLU CG C -1.639 12.593 -2.924 1.00 . A A . 4 GLU CG 1 1 4 2375 1 1 4 GLU H H -2.378 8.530 -2.709 1.00 . A A . 4 GLU H 1 1 4 2376 1 1 4 GLU HA H -0.679 10.421 -4.263 1.00 . A A . 4 GLU HA 1 1 4 2377 1 1 4 GLU HB2 H -2.986 11.155 -3.781 1.00 . A A . 4 GLU HB2 1 1 4 2378 1 1 4 GLU HB3 H -2.695 10.941 -2.054 1.00 . A A . 4 GLU HB3 1 1 4 2379 1 1 4 GLU HG2 H -1.046 12.681 -2.026 1.00 . A A . 4 GLU HG2 1 1 4 2380 1 1 4 GLU HG3 H -1.013 12.763 -3.787 1.00 . A A . 4 GLU HG3 1 1 4 2381 1 1 4 GLU N N -1.711 8.806 -3.372 1.00 . A A . 4 GLU N 1 1 4 2382 1 1 4 GLU O O 0.953 10.871 -2.356 1.00 . A A . 4 GLU O 1 1 4 2383 1 1 4 GLU OE1 O -3.717 13.425 -2.169 1.00 . A A . 4 GLU OE1 1 1 4 2384 1 1 4 GLU OE2 O -2.648 14.614 -3.614 1.00 . A A . 4 GLU OE2 1 1 4 2385 1 1 5 GLN C C 1.980 8.884 -0.504 1.00 . A A . 5 GLN C 1 1 4 2386 1 1 5 GLN CA C 0.700 9.564 -0.018 1.00 . A A . 5 GLN CA 1 1 4 2387 1 1 5 GLN CB C 0.142 8.804 1.187 1.00 . A A . 5 GLN CB 1 1 4 2388 1 1 5 GLN CD C -0.156 9.358 3.605 1.00 . A A . 5 GLN CD 1 1 4 2389 1 1 5 GLN CG C -0.481 9.793 2.175 1.00 . A A . 5 GLN CG 1 1 4 2390 1 1 5 GLN H H -1.130 9.042 -1.028 1.00 . A A . 5 GLN H 1 1 4 2391 1 1 5 GLN HA H 0.918 10.583 0.265 1.00 . A A . 5 GLN HA 1 1 4 2392 1 1 5 GLN HB2 H -0.611 8.104 0.854 1.00 . A A . 5 GLN HB2 1 1 4 2393 1 1 5 GLN HB3 H 0.940 8.267 1.675 1.00 . A A . 5 GLN HB3 1 1 4 2394 1 1 5 GLN HE21 H -0.812 7.504 3.338 1.00 . A A . 5 GLN HE21 1 1 4 2395 1 1 5 GLN HE22 H -0.209 7.845 4.887 1.00 . A A . 5 GLN HE22 1 1 4 2396 1 1 5 GLN HG2 H -0.079 10.781 1.997 1.00 . A A . 5 GLN HG2 1 1 4 2397 1 1 5 GLN HG3 H -1.552 9.811 2.041 1.00 . A A . 5 GLN HG3 1 1 4 2398 1 1 5 GLN N N -0.301 9.556 -1.121 1.00 . A A . 5 GLN N 1 1 4 2399 1 1 5 GLN NE2 N -0.414 8.134 3.974 1.00 . A A . 5 GLN NE2 1 1 4 2400 1 1 5 GLN O O 3.074 9.245 -0.115 1.00 . A A . 5 GLN O 1 1 4 2401 1 1 5 GLN OE1 O 0.339 10.140 4.392 1.00 . A A . 5 GLN OE1 1 1 4 2402 1 1 6 CYS C C 3.622 7.987 -3.060 1.00 . A A . 6 CYS C 1 1 4 2403 1 1 6 CYS CA C 3.057 7.202 -1.877 1.00 . A A . 6 CYS CA 1 1 4 2404 1 1 6 CYS CB C 2.671 5.798 -2.346 1.00 . A A . 6 CYS CB 1 1 4 2405 1 1 6 CYS H H 0.959 7.635 -1.660 1.00 . A A . 6 CYS H 1 1 4 2406 1 1 6 CYS HA H 3.802 7.135 -1.098 1.00 . A A . 6 CYS HA 1 1 4 2407 1 1 6 CYS HB2 H 1.602 5.748 -2.488 1.00 . A A . 6 CYS HB2 1 1 4 2408 1 1 6 CYS HB3 H 3.167 5.582 -3.281 1.00 . A A . 6 CYS HB3 1 1 4 2409 1 1 6 CYS N N 1.851 7.904 -1.357 1.00 . A A . 6 CYS N 1 1 4 2410 1 1 6 CYS O O 4.805 7.950 -3.338 1.00 . A A . 6 CYS O 1 1 4 2411 1 1 6 CYS SG S 3.169 4.580 -1.104 1.00 . A A . 6 CYS SG 1 1 4 2412 1 1 7 CYS C C 3.831 10.820 -4.453 1.00 . A A . 7 CYS C 1 1 4 2413 1 1 7 CYS CA C 3.264 9.480 -4.932 1.00 . A A . 7 CYS CA 1 1 4 2414 1 1 7 CYS CB C 2.093 9.747 -5.883 1.00 . A A . 7 CYS CB 1 1 4 2415 1 1 7 CYS H H 1.831 8.707 -3.522 1.00 . A A . 7 CYS H 1 1 4 2416 1 1 7 CYS HA H 4.032 8.921 -5.443 1.00 . A A . 7 CYS HA 1 1 4 2417 1 1 7 CYS HB2 H 1.166 9.679 -5.334 1.00 . A A . 7 CYS HB2 1 1 4 2418 1 1 7 CYS HB3 H 2.191 10.737 -6.300 1.00 . A A . 7 CYS HB3 1 1 4 2419 1 1 7 CYS N N 2.781 8.695 -3.762 1.00 . A A . 7 CYS N 1 1 4 2420 1 1 7 CYS O O 4.740 11.367 -5.044 1.00 . A A . 7 CYS O 1 1 4 2421 1 1 7 CYS SG S 2.078 8.531 -7.225 1.00 . A A . 7 CYS SG 1 1 4 2422 1 1 8 THR C C 4.852 12.449 -1.815 1.00 . A A . 8 THR C 1 1 4 2423 1 1 8 THR CA C 3.783 12.670 -2.888 1.00 . A A . 8 THR CA 1 1 4 2424 1 1 8 THR CB C 2.605 13.450 -2.290 1.00 . A A . 8 THR CB 1 1 4 2425 1 1 8 THR CG2 C 3.126 14.595 -1.417 1.00 . A A . 8 THR CG2 1 1 4 2426 1 1 8 THR H H 2.549 10.906 -2.939 1.00 . A A . 8 THR H 1 1 4 2427 1 1 8 THR HA H 4.207 13.236 -3.705 1.00 . A A . 8 THR HA 1 1 4 2428 1 1 8 THR HB H 2.004 12.787 -1.686 1.00 . A A . 8 THR HB 1 1 4 2429 1 1 8 THR HG1 H 0.913 13.663 -3.226 1.00 . A A . 8 THR HG1 1 1 4 2430 1 1 8 THR HG21 H 3.108 14.293 -0.379 1.00 . A A . 8 THR HG21 1 1 4 2431 1 1 8 THR HG22 H 2.499 15.464 -1.550 1.00 . A A . 8 THR HG22 1 1 4 2432 1 1 8 THR HG23 H 4.139 14.835 -1.705 1.00 . A A . 8 THR HG23 1 1 4 2433 1 1 8 THR N N 3.289 11.359 -3.395 1.00 . A A . 8 THR N 1 1 4 2434 1 1 8 THR O O 5.845 13.148 -1.762 1.00 . A A . 8 THR O 1 1 4 2435 1 1 8 THR OG1 O 1.812 13.981 -3.342 1.00 . A A . 8 THR OG1 1 1 4 2436 1 1 9 SER C C 6.399 9.927 -0.163 1.00 . A A . 9 SER C 1 1 4 2437 1 1 9 SER CA C 5.666 11.242 0.114 1.00 . A A . 9 SER CA 1 1 4 2438 1 1 9 SER CB C 4.962 11.160 1.469 1.00 . A A . 9 SER CB 1 1 4 2439 1 1 9 SER H H 3.851 10.938 -1.005 1.00 . A A . 9 SER H 1 1 4 2440 1 1 9 SER HA H 6.379 12.052 0.129 1.00 . A A . 9 SER HA 1 1 4 2441 1 1 9 SER HB2 H 3.953 11.523 1.373 1.00 . A A . 9 SER HB2 1 1 4 2442 1 1 9 SER HB3 H 4.942 10.131 1.803 1.00 . A A . 9 SER HB3 1 1 4 2443 1 1 9 SER HG H 6.399 11.455 2.747 1.00 . A A . 9 SER HG 1 1 4 2444 1 1 9 SER N N 4.659 11.489 -0.954 1.00 . A A . 9 SER N 1 1 4 2445 1 1 9 SER O O 6.109 9.228 -1.113 1.00 . A A . 9 SER O 1 1 4 2446 1 1 9 SER OG O 5.660 11.965 2.410 1.00 . A A . 9 SER OG 1 1 4 2447 1 1 10 ILE C C 7.482 7.214 1.298 1.00 . A A . 10 ILE C 1 1 4 2448 1 1 10 ILE CA C 8.113 8.327 0.460 1.00 . A A . 10 ILE CA 1 1 4 2449 1 1 10 ILE CB C 9.560 8.540 0.908 1.00 . A A . 10 ILE CB 1 1 4 2450 1 1 10 ILE CD1 C 10.612 8.724 -1.356 1.00 . A A . 10 ILE CD1 1 1 4 2451 1 1 10 ILE CG1 C 10.268 9.479 -0.073 1.00 . A A . 10 ILE CG1 1 1 4 2452 1 1 10 ILE CG2 C 10.287 7.195 0.957 1.00 . A A . 10 ILE CG2 1 1 4 2453 1 1 10 ILE H H 7.568 10.174 1.421 1.00 . A A . 10 ILE H 1 1 4 2454 1 1 10 ILE HA H 8.093 8.055 -0.585 1.00 . A A . 10 ILE HA 1 1 4 2455 1 1 10 ILE HB H 9.565 8.982 1.892 1.00 . A A . 10 ILE HB 1 1 4 2456 1 1 10 ILE HD11 H 10.835 9.431 -2.140 1.00 . A A . 10 ILE HD11 1 1 4 2457 1 1 10 ILE HD12 H 9.773 8.111 -1.648 1.00 . A A . 10 ILE HD12 1 1 4 2458 1 1 10 ILE HD13 H 11.473 8.096 -1.181 1.00 . A A . 10 ILE HD13 1 1 4 2459 1 1 10 ILE HG12 H 9.616 10.309 -0.308 1.00 . A A . 10 ILE HG12 1 1 4 2460 1 1 10 ILE HG13 H 11.176 9.851 0.378 1.00 . A A . 10 ILE HG13 1 1 4 2461 1 1 10 ILE HG21 H 11.312 7.352 1.257 1.00 . A A . 10 ILE HG21 1 1 4 2462 1 1 10 ILE HG22 H 10.265 6.737 -0.021 1.00 . A A . 10 ILE HG22 1 1 4 2463 1 1 10 ILE HG23 H 9.798 6.548 1.670 1.00 . A A . 10 ILE HG23 1 1 4 2464 1 1 10 ILE N N 7.352 9.591 0.663 1.00 . A A . 10 ILE N 1 1 4 2465 1 1 10 ILE O O 7.153 7.409 2.450 1.00 . A A . 10 ILE O 1 1 4 2466 1 1 11 CYS C C 7.518 3.660 1.335 1.00 . A A . 11 CYS C 1 1 4 2467 1 1 11 CYS CA C 6.700 4.937 1.526 1.00 . A A . 11 CYS CA 1 1 4 2468 1 1 11 CYS CB C 5.257 4.692 1.074 1.00 . A A . 11 CYS CB 1 1 4 2469 1 1 11 CYS H H 7.581 5.903 -0.195 1.00 . A A . 11 CYS H 1 1 4 2470 1 1 11 CYS HA H 6.704 5.205 2.572 1.00 . A A . 11 CYS HA 1 1 4 2471 1 1 11 CYS HB2 H 4.993 3.662 1.264 1.00 . A A . 11 CYS HB2 1 1 4 2472 1 1 11 CYS HB3 H 4.593 5.339 1.628 1.00 . A A . 11 CYS HB3 1 1 4 2473 1 1 11 CYS N N 7.310 6.048 0.736 1.00 . A A . 11 CYS N 1 1 4 2474 1 1 11 CYS O O 7.865 3.288 0.232 1.00 . A A . 11 CYS O 1 1 4 2475 1 1 11 CYS SG S 5.095 5.034 -0.696 1.00 . A A . 11 CYS SG 1 1 4 2476 1 1 12 SER C C 7.718 0.518 2.407 1.00 . A A . 12 SER C 1 1 4 2477 1 1 12 SER CA C 8.635 1.741 2.302 1.00 . A A . 12 SER CA 1 1 4 2478 1 1 12 SER CB C 9.657 1.703 3.436 1.00 . A A . 12 SER CB 1 1 4 2479 1 1 12 SER H H 7.546 3.313 3.287 1.00 . A A . 12 SER H 1 1 4 2480 1 1 12 SER HA H 9.151 1.723 1.354 1.00 . A A . 12 SER HA 1 1 4 2481 1 1 12 SER HB2 H 9.659 0.727 3.890 1.00 . A A . 12 SER HB2 1 1 4 2482 1 1 12 SER HB3 H 10.642 1.914 3.039 1.00 . A A . 12 SER HB3 1 1 4 2483 1 1 12 SER HG H 8.419 2.483 4.720 1.00 . A A . 12 SER HG 1 1 4 2484 1 1 12 SER N N 7.833 2.990 2.408 1.00 . A A . 12 SER N 1 1 4 2485 1 1 12 SER O O 6.537 0.631 2.680 1.00 . A A . 12 SER O 1 1 4 2486 1 1 12 SER OG O 9.309 2.675 4.415 1.00 . A A . 12 SER OG 1 1 4 2487 1 1 13 LEU C C 6.428 -1.800 3.375 1.00 . A A . 13 LEU C 1 1 4 2488 1 1 13 LEU CA C 7.462 -1.899 2.253 1.00 . A A . 13 LEU CA 1 1 4 2489 1 1 13 LEU CB C 8.388 -3.082 2.522 1.00 . A A . 13 LEU CB 1 1 4 2490 1 1 13 LEU CD1 C 6.807 -4.543 1.257 1.00 . A A . 13 LEU CD1 1 1 4 2491 1 1 13 LEU CD2 C 8.500 -5.558 2.782 1.00 . A A . 13 LEU CD2 1 1 4 2492 1 1 13 LEU CG C 7.566 -4.368 2.574 1.00 . A A . 13 LEU CG 1 1 4 2493 1 1 13 LEU H H 9.211 -0.701 1.948 1.00 . A A . 13 LEU H 1 1 4 2494 1 1 13 LEU HA H 6.966 -2.049 1.321 1.00 . A A . 13 LEU HA 1 1 4 2495 1 1 13 LEU HB2 H 9.119 -3.152 1.730 1.00 . A A . 13 LEU HB2 1 1 4 2496 1 1 13 LEU HB3 H 8.890 -2.941 3.465 1.00 . A A . 13 LEU HB3 1 1 4 2497 1 1 13 LEU HD11 H 6.094 -3.739 1.142 1.00 . A A . 13 LEU HD11 1 1 4 2498 1 1 13 LEU HD12 H 6.286 -5.488 1.264 1.00 . A A . 13 LEU HD12 1 1 4 2499 1 1 13 LEU HD13 H 7.506 -4.523 0.434 1.00 . A A . 13 LEU HD13 1 1 4 2500 1 1 13 LEU HD21 H 7.925 -6.418 3.092 1.00 . A A . 13 LEU HD21 1 1 4 2501 1 1 13 LEU HD22 H 9.227 -5.317 3.542 1.00 . A A . 13 LEU HD22 1 1 4 2502 1 1 13 LEU HD23 H 9.010 -5.782 1.855 1.00 . A A . 13 LEU HD23 1 1 4 2503 1 1 13 LEU HG H 6.860 -4.312 3.390 1.00 . A A . 13 LEU HG 1 1 4 2504 1 1 13 LEU N N 8.264 -0.649 2.180 1.00 . A A . 13 LEU N 1 1 4 2505 1 1 13 LEU O O 5.319 -2.284 3.256 1.00 . A A . 13 LEU O 1 1 4 2506 1 1 14 TYR C C 4.473 -0.552 5.042 1.00 . A A . 14 TYR C 1 1 4 2507 1 1 14 TYR CA C 5.812 -1.048 5.587 1.00 . A A . 14 TYR CA 1 1 4 2508 1 1 14 TYR CB C 6.350 -0.047 6.612 1.00 . A A . 14 TYR CB 1 1 4 2509 1 1 14 TYR CD1 C 7.156 -1.923 8.093 1.00 . A A . 14 TYR CD1 1 1 4 2510 1 1 14 TYR CD2 C 8.684 -0.111 7.568 1.00 . A A . 14 TYR CD2 1 1 4 2511 1 1 14 TYR CE1 C 8.151 -2.537 8.865 1.00 . A A . 14 TYR CE1 1 1 4 2512 1 1 14 TYR CE2 C 9.678 -0.725 8.341 1.00 . A A . 14 TYR CE2 1 1 4 2513 1 1 14 TYR CG C 7.422 -0.709 7.446 1.00 . A A . 14 TYR CG 1 1 4 2514 1 1 14 TYR CZ C 9.412 -1.939 8.988 1.00 . A A . 14 TYR CZ 1 1 4 2515 1 1 14 TYR H H 7.676 -0.791 4.539 1.00 . A A . 14 TYR H 1 1 4 2516 1 1 14 TYR HA H 5.677 -2.012 6.057 1.00 . A A . 14 TYR HA 1 1 4 2517 1 1 14 TYR HB2 H 6.768 0.805 6.098 1.00 . A A . 14 TYR HB2 1 1 4 2518 1 1 14 TYR HB3 H 5.546 0.277 7.255 1.00 . A A . 14 TYR HB3 1 1 4 2519 1 1 14 TYR HD1 H 6.185 -2.383 7.999 1.00 . A A . 14 TYR HD1 1 1 4 2520 1 1 14 TYR HD2 H 8.887 0.825 7.069 1.00 . A A . 14 TYR HD2 1 1 4 2521 1 1 14 TYR HE1 H 7.946 -3.472 9.364 1.00 . A A . 14 TYR HE1 1 1 4 2522 1 1 14 TYR HE2 H 10.650 -0.264 8.435 1.00 . A A . 14 TYR HE2 1 1 4 2523 1 1 14 TYR HH H 10.556 -3.416 9.380 1.00 . A A . 14 TYR HH 1 1 4 2524 1 1 14 TYR N N 6.779 -1.176 4.463 1.00 . A A . 14 TYR N 1 1 4 2525 1 1 14 TYR O O 3.476 -1.248 5.086 1.00 . A A . 14 TYR O 1 1 4 2526 1 1 14 TYR OH O 10.392 -2.545 9.749 1.00 . A A . 14 TYR OH 1 1 4 2527 1 1 15 GLN C C 2.570 0.138 3.024 1.00 . A A . 15 GLN C 1 1 4 2528 1 1 15 GLN CA C 3.173 1.180 3.960 1.00 . A A . 15 GLN CA 1 1 4 2529 1 1 15 GLN CB C 3.459 2.466 3.180 1.00 . A A . 15 GLN CB 1 1 4 2530 1 1 15 GLN CD C 4.843 3.445 5.015 1.00 . A A . 15 GLN CD 1 1 4 2531 1 1 15 GLN CG C 3.593 3.638 4.155 1.00 . A A . 15 GLN CG 1 1 4 2532 1 1 15 GLN H H 5.260 1.179 4.477 1.00 . A A . 15 GLN H 1 1 4 2533 1 1 15 GLN HA H 2.482 1.388 4.765 1.00 . A A . 15 GLN HA 1 1 4 2534 1 1 15 GLN HB2 H 4.379 2.353 2.625 1.00 . A A . 15 GLN HB2 1 1 4 2535 1 1 15 GLN HB3 H 2.647 2.663 2.496 1.00 . A A . 15 GLN HB3 1 1 4 2536 1 1 15 GLN HE21 H 3.863 2.542 6.486 1.00 . A A . 15 GLN HE21 1 1 4 2537 1 1 15 GLN HE22 H 5.532 2.729 6.734 1.00 . A A . 15 GLN HE22 1 1 4 2538 1 1 15 GLN HG2 H 3.677 4.561 3.599 1.00 . A A . 15 GLN HG2 1 1 4 2539 1 1 15 GLN HG3 H 2.723 3.679 4.793 1.00 . A A . 15 GLN HG3 1 1 4 2540 1 1 15 GLN N N 4.444 0.642 4.516 1.00 . A A . 15 GLN N 1 1 4 2541 1 1 15 GLN NE2 N 4.738 2.856 6.175 1.00 . A A . 15 GLN NE2 1 1 4 2542 1 1 15 GLN O O 1.377 -0.089 3.010 1.00 . A A . 15 GLN O 1 1 4 2543 1 1 15 GLN OE1 O 5.928 3.832 4.627 1.00 . A A . 15 GLN OE1 1 1 4 2544 1 1 16 LEU C C 2.217 -2.669 2.074 1.00 . A A . 16 LEU C 1 1 4 2545 1 1 16 LEU CA C 2.885 -1.533 1.300 1.00 . A A . 16 LEU CA 1 1 4 2546 1 1 16 LEU CB C 4.050 -2.096 0.507 1.00 . A A . 16 LEU CB 1 1 4 2547 1 1 16 LEU CD1 C 5.938 -0.603 -0.133 1.00 . A A . 16 LEU CD1 1 1 4 2548 1 1 16 LEU CD2 C 4.522 -1.636 -1.886 1.00 . A A . 16 LEU CD2 1 1 4 2549 1 1 16 LEU CG C 4.525 -1.042 -0.485 1.00 . A A . 16 LEU CG 1 1 4 2550 1 1 16 LEU H H 4.354 -0.295 2.277 1.00 . A A . 16 LEU H 1 1 4 2551 1 1 16 LEU HA H 2.181 -1.088 0.621 1.00 . A A . 16 LEU HA 1 1 4 2552 1 1 16 LEU HB2 H 4.846 -2.354 1.181 1.00 . A A . 16 LEU HB2 1 1 4 2553 1 1 16 LEU HB3 H 3.732 -2.977 -0.030 1.00 . A A . 16 LEU HB3 1 1 4 2554 1 1 16 LEU HD11 H 6.637 -1.362 -0.451 1.00 . A A . 16 LEU HD11 1 1 4 2555 1 1 16 LEU HD12 H 6.014 -0.467 0.935 1.00 . A A . 16 LEU HD12 1 1 4 2556 1 1 16 LEU HD13 H 6.160 0.325 -0.634 1.00 . A A . 16 LEU HD13 1 1 4 2557 1 1 16 LEU HD21 H 5.490 -1.486 -2.338 1.00 . A A . 16 LEU HD21 1 1 4 2558 1 1 16 LEU HD22 H 3.765 -1.150 -2.479 1.00 . A A . 16 LEU HD22 1 1 4 2559 1 1 16 LEU HD23 H 4.313 -2.694 -1.823 1.00 . A A . 16 LEU HD23 1 1 4 2560 1 1 16 LEU HG H 3.864 -0.189 -0.446 1.00 . A A . 16 LEU HG 1 1 4 2561 1 1 16 LEU N N 3.395 -0.499 2.243 1.00 . A A . 16 LEU N 1 1 4 2562 1 1 16 LEU O O 1.070 -3.001 1.851 1.00 . A A . 16 LEU O 1 1 4 2563 1 1 17 GLU C C 1.002 -4.032 4.339 1.00 . A A . 17 GLU C 1 1 4 2564 1 1 17 GLU CA C 2.370 -4.409 3.759 1.00 . A A . 17 GLU CA 1 1 4 2565 1 1 17 GLU CB C 3.325 -4.760 4.901 1.00 . A A . 17 GLU CB 1 1 4 2566 1 1 17 GLU CD C 4.165 -6.806 6.059 1.00 . A A . 17 GLU CD 1 1 4 2567 1 1 17 GLU CG C 2.922 -6.103 5.513 1.00 . A A . 17 GLU CG 1 1 4 2568 1 1 17 GLU H H 3.869 -2.997 3.121 1.00 . A A . 17 GLU H 1 1 4 2569 1 1 17 GLU HA H 2.257 -5.265 3.115 1.00 . A A . 17 GLU HA 1 1 4 2570 1 1 17 GLU HB2 H 4.333 -4.827 4.518 1.00 . A A . 17 GLU HB2 1 1 4 2571 1 1 17 GLU HB3 H 3.278 -3.993 5.659 1.00 . A A . 17 GLU HB3 1 1 4 2572 1 1 17 GLU HG2 H 2.219 -5.935 6.317 1.00 . A A . 17 GLU HG2 1 1 4 2573 1 1 17 GLU HG3 H 2.463 -6.721 4.757 1.00 . A A . 17 GLU HG3 1 1 4 2574 1 1 17 GLU N N 2.940 -3.277 2.972 1.00 . A A . 17 GLU N 1 1 4 2575 1 1 17 GLU O O 0.228 -4.887 4.717 1.00 . A A . 17 GLU O 1 1 4 2576 1 1 17 GLU OE1 O 5.016 -7.165 5.261 1.00 . A A . 17 GLU OE1 1 1 4 2577 1 1 17 GLU OE2 O 4.245 -6.975 7.264 1.00 . A A . 17 GLU OE2 1 1 4 2578 1 1 18 ASN C C -1.682 -2.288 3.906 1.00 . A A . 18 ASN C 1 1 4 2579 1 1 18 ASN CA C -0.616 -2.360 5.003 1.00 . A A . 18 ASN CA 1 1 4 2580 1 1 18 ASN CB C -0.480 -0.990 5.669 1.00 . A A . 18 ASN CB 1 1 4 2581 1 1 18 ASN CG C -1.215 -0.999 7.010 1.00 . A A . 18 ASN CG 1 1 4 2582 1 1 18 ASN H H 1.338 -2.089 4.130 1.00 . A A . 18 ASN H 1 1 4 2583 1 1 18 ASN HA H -0.919 -3.085 5.742 1.00 . A A . 18 ASN HA 1 1 4 2584 1 1 18 ASN HB2 H 0.566 -0.769 5.832 1.00 . A A . 18 ASN HB2 1 1 4 2585 1 1 18 ASN HB3 H -0.911 -0.234 5.029 1.00 . A A . 18 ASN HB3 1 1 4 2586 1 1 18 ASN HD21 H 0.113 0.173 7.906 1.00 . A A . 18 ASN HD21 1 1 4 2587 1 1 18 ASN HD22 H -1.186 -0.327 8.878 1.00 . A A . 18 ASN HD22 1 1 4 2588 1 1 18 ASN N N 0.700 -2.768 4.429 1.00 . A A . 18 ASN N 1 1 4 2589 1 1 18 ASN ND2 N -0.721 -0.329 8.015 1.00 . A A . 18 ASN ND2 1 1 4 2590 1 1 18 ASN O O -2.750 -1.746 4.111 1.00 . A A . 18 ASN O 1 1 4 2591 1 1 18 ASN OD1 O -2.249 -1.622 7.144 1.00 . A A . 18 ASN OD1 1 1 4 2592 1 1 19 TYR C C -2.513 -4.131 0.958 1.00 . A A . 19 TYR C 1 1 4 2593 1 1 19 TYR CA C -2.442 -2.777 1.667 1.00 . A A . 19 TYR CA 1 1 4 2594 1 1 19 TYR CB C -2.073 -1.693 0.653 1.00 . A A . 19 TYR CB 1 1 4 2595 1 1 19 TYR CD1 C -3.143 0.292 1.783 1.00 . A A . 19 TYR CD1 1 1 4 2596 1 1 19 TYR CD2 C -0.727 0.224 1.576 1.00 . A A . 19 TYR CD2 1 1 4 2597 1 1 19 TYR CE1 C -3.052 1.529 2.436 1.00 . A A . 19 TYR CE1 1 1 4 2598 1 1 19 TYR CE2 C -0.635 1.460 2.230 1.00 . A A . 19 TYR CE2 1 1 4 2599 1 1 19 TYR CG C -1.979 -0.360 1.354 1.00 . A A . 19 TYR CG 1 1 4 2600 1 1 19 TYR CZ C -1.798 2.114 2.659 1.00 . A A . 19 TYR CZ 1 1 4 2601 1 1 19 TYR H H -0.552 -3.267 2.592 1.00 . A A . 19 TYR H 1 1 4 2602 1 1 19 TYR HA H -3.406 -2.550 2.098 1.00 . A A . 19 TYR HA 1 1 4 2603 1 1 19 TYR HB2 H -1.121 -1.931 0.204 1.00 . A A . 19 TYR HB2 1 1 4 2604 1 1 19 TYR HB3 H -2.831 -1.644 -0.113 1.00 . A A . 19 TYR HB3 1 1 4 2605 1 1 19 TYR HD1 H -4.110 -0.157 1.610 1.00 . A A . 19 TYR HD1 1 1 4 2606 1 1 19 TYR HD2 H 0.170 -0.279 1.245 1.00 . A A . 19 TYR HD2 1 1 4 2607 1 1 19 TYR HE1 H -3.949 2.033 2.766 1.00 . A A . 19 TYR HE1 1 1 4 2608 1 1 19 TYR HE2 H 0.332 1.910 2.401 1.00 . A A . 19 TYR HE2 1 1 4 2609 1 1 19 TYR HH H -0.853 3.713 3.094 1.00 . A A . 19 TYR HH 1 1 4 2610 1 1 19 TYR N N -1.417 -2.828 2.749 1.00 . A A . 19 TYR N 1 1 4 2611 1 1 19 TYR O O -2.513 -4.204 -0.255 1.00 . A A . 19 TYR O 1 1 4 2612 1 1 19 TYR OH O -1.708 3.331 3.302 1.00 . A A . 19 TYR OH 1 1 4 2613 1 1 20 CYS C C -3.073 -7.600 2.069 1.00 . A A . 20 CYS C 1 1 4 2614 1 1 20 CYS CA C -2.650 -6.542 1.048 1.00 . A A . 20 CYS CA 1 1 4 2615 1 1 20 CYS CB C -1.277 -6.903 0.479 1.00 . A A . 20 CYS CB 1 1 4 2616 1 1 20 CYS H H -2.577 -5.127 2.677 1.00 . A A . 20 CYS H 1 1 4 2617 1 1 20 CYS HA H -3.373 -6.510 0.249 1.00 . A A . 20 CYS HA 1 1 4 2618 1 1 20 CYS HB2 H -0.990 -6.167 -0.259 1.00 . A A . 20 CYS HB2 1 1 4 2619 1 1 20 CYS HB3 H -0.550 -6.914 1.277 1.00 . A A . 20 CYS HB3 1 1 4 2620 1 1 20 CYS N N -2.578 -5.203 1.699 1.00 . A A . 20 CYS N 1 1 4 2621 1 1 20 CYS O O -2.958 -7.408 3.263 1.00 . A A . 20 CYS O 1 1 4 2622 1 1 20 CYS SG S -1.352 -8.537 -0.295 1.00 . A A . 20 CYS SG 1 1 4 2623 1 1 21 ASN C C -2.857 -10.089 3.529 1.00 . A A . 21 ASN C 1 1 4 2624 1 1 21 ASN CA C -3.988 -9.794 2.543 1.00 . A A . 21 ASN CA 1 1 4 2625 1 1 21 ASN CB C -4.316 -11.061 1.749 1.00 . A A . 21 ASN CB 1 1 4 2626 1 1 21 ASN CG C -5.686 -11.588 2.175 1.00 . A A . 21 ASN CG 1 1 4 2627 1 1 21 ASN H H -3.645 -8.857 0.637 1.00 . A A . 21 ASN H 1 1 4 2628 1 1 21 ASN HA H -4.865 -9.473 3.085 1.00 . A A . 21 ASN HA 1 1 4 2629 1 1 21 ASN HB2 H -4.329 -10.830 0.693 1.00 . A A . 21 ASN HB2 1 1 4 2630 1 1 21 ASN HB3 H -3.565 -11.812 1.945 1.00 . A A . 21 ASN HB3 1 1 4 2631 1 1 21 ASN HD21 H -6.687 -10.377 0.961 1.00 . A A . 21 ASN HD21 1 1 4 2632 1 1 21 ASN HD22 H -7.645 -11.419 1.898 1.00 . A A . 21 ASN HD22 1 1 4 2633 1 1 21 ASN N N -3.561 -8.720 1.604 1.00 . A A . 21 ASN N 1 1 4 2634 1 1 21 ASN ND2 N -6.762 -11.086 1.632 1.00 . A A . 21 ASN ND2 1 1 4 2635 1 1 21 ASN O O -1.729 -9.736 3.228 1.00 . A A . 21 ASN O 1 1 4 2636 1 1 21 ASN OXT O -3.138 -10.663 4.568 1.00 . A A . 21 ASN OXT 1 1 4 2637 1 1 21 ASN OD1 O -5.781 -12.466 3.010 1.00 . A A . 21 ASN OD1 1 1 4 2638 2 2 1 PHE C C 11.794 -0.283 -0.095 1.00 . B B . 1 PHE C 1 1 4 2639 2 2 1 PHE CA C 11.160 -0.636 -1.441 1.00 . B B . 1 PHE CA 1 1 4 2640 2 2 1 PHE CB C 12.020 -1.689 -2.142 1.00 . B B . 1 PHE CB 1 1 4 2641 2 2 1 PHE CD1 C 10.982 -1.969 -4.422 1.00 . B B . 1 PHE CD1 1 1 4 2642 2 2 1 PHE CD2 C 10.584 -3.673 -2.740 1.00 . B B . 1 PHE CD2 1 1 4 2643 2 2 1 PHE CE1 C 10.199 -2.687 -5.335 1.00 . B B . 1 PHE CE1 1 1 4 2644 2 2 1 PHE CE2 C 9.800 -4.390 -3.653 1.00 . B B . 1 PHE CE2 1 1 4 2645 2 2 1 PHE CG C 11.175 -2.462 -3.125 1.00 . B B . 1 PHE CG 1 1 4 2646 2 2 1 PHE CZ C 9.608 -3.897 -4.951 1.00 . B B . 1 PHE CZ 1 1 4 2647 2 2 1 PHE H1 H 11.140 1.431 -1.685 1.00 . B B . 1 PHE H1 1 1 4 2648 2 2 1 PHE H2 H 10.183 0.591 -2.810 1.00 . B B . 1 PHE H2 1 1 4 2649 2 2 1 PHE H3 H 11.875 0.592 -2.962 1.00 . B B . 1 PHE H3 1 1 4 2650 2 2 1 PHE HA H 10.166 -1.029 -1.281 1.00 . B B . 1 PHE HA 1 1 4 2651 2 2 1 PHE HB2 H 12.828 -1.200 -2.668 1.00 . B B . 1 PHE HB2 1 1 4 2652 2 2 1 PHE HB3 H 12.428 -2.368 -1.408 1.00 . B B . 1 PHE HB3 1 1 4 2653 2 2 1 PHE HD1 H 11.438 -1.036 -4.718 1.00 . B B . 1 PHE HD1 1 1 4 2654 2 2 1 PHE HD2 H 10.732 -4.053 -1.740 1.00 . B B . 1 PHE HD2 1 1 4 2655 2 2 1 PHE HE1 H 10.049 -2.307 -6.336 1.00 . B B . 1 PHE HE1 1 1 4 2656 2 2 1 PHE HE2 H 9.344 -5.323 -3.357 1.00 . B B . 1 PHE HE2 1 1 4 2657 2 2 1 PHE HZ H 9.003 -4.451 -5.654 1.00 . B B . 1 PHE HZ 1 1 4 2658 2 2 1 PHE N N 11.083 0.587 -2.289 1.00 . B B . 1 PHE N 1 1 4 2659 2 2 1 PHE O O 11.305 -0.656 0.953 1.00 . B B . 1 PHE O 1 1 4 2660 2 2 2 VAL C C 13.204 2.269 1.500 1.00 . B B . 2 VAL C 1 1 4 2661 2 2 2 VAL CA C 13.554 0.825 1.157 1.00 . B B . 2 VAL CA 1 1 4 2662 2 2 2 VAL CB C 15.079 0.687 1.032 1.00 . B B . 2 VAL CB 1 1 4 2663 2 2 2 VAL CG1 C 15.537 -0.544 1.806 1.00 . B B . 2 VAL CG1 1 1 4 2664 2 2 2 VAL CG2 C 15.498 0.537 -0.434 1.00 . B B . 2 VAL CG2 1 1 4 2665 2 2 2 VAL H H 13.248 0.732 -0.976 1.00 . B B . 2 VAL H 1 1 4 2666 2 2 2 VAL HA H 13.203 0.184 1.950 1.00 . B B . 2 VAL HA 1 1 4 2667 2 2 2 VAL HB H 15.547 1.566 1.451 1.00 . B B . 2 VAL HB 1 1 4 2668 2 2 2 VAL HG11 H 16.542 -0.389 2.166 1.00 . B B . 2 VAL HG11 1 1 4 2669 2 2 2 VAL HG12 H 15.516 -1.405 1.154 1.00 . B B . 2 VAL HG12 1 1 4 2670 2 2 2 VAL HG13 H 14.874 -0.710 2.642 1.00 . B B . 2 VAL HG13 1 1 4 2671 2 2 2 VAL HG21 H 16.578 0.546 -0.502 1.00 . B B . 2 VAL HG21 1 1 4 2672 2 2 2 VAL HG22 H 15.098 1.357 -1.011 1.00 . B B . 2 VAL HG22 1 1 4 2673 2 2 2 VAL HG23 H 15.122 -0.396 -0.822 1.00 . B B . 2 VAL HG23 1 1 4 2674 2 2 2 VAL N N 12.881 0.439 -0.119 1.00 . B B . 2 VAL N 1 1 4 2675 2 2 2 VAL O O 13.166 2.654 2.652 1.00 . B B . 2 VAL O 1 1 4 2676 2 2 3 ASN C C 12.440 5.236 -0.545 1.00 . B B . 3 ASN C 1 1 4 2677 2 2 3 ASN CA C 12.624 4.499 0.782 1.00 . B B . 3 ASN CA 1 1 4 2678 2 2 3 ASN CB C 13.762 5.150 1.581 1.00 . B B . 3 ASN CB 1 1 4 2679 2 2 3 ASN CG C 15.073 4.391 1.340 1.00 . B B . 3 ASN CG 1 1 4 2680 2 2 3 ASN H H 13.004 2.745 -0.411 1.00 . B B . 3 ASN H 1 1 4 2681 2 2 3 ASN HA H 11.708 4.551 1.352 1.00 . B B . 3 ASN HA 1 1 4 2682 2 2 3 ASN HB2 H 13.879 6.173 1.266 1.00 . B B . 3 ASN HB2 1 1 4 2683 2 2 3 ASN HB3 H 13.523 5.122 2.634 1.00 . B B . 3 ASN HB3 1 1 4 2684 2 2 3 ASN HD21 H 15.738 4.659 3.194 1.00 . B B . 3 ASN HD21 1 1 4 2685 2 2 3 ASN HD22 H 16.774 3.785 2.171 1.00 . B B . 3 ASN HD22 1 1 4 2686 2 2 3 ASN N N 12.959 3.075 0.511 1.00 . B B . 3 ASN N 1 1 4 2687 2 2 3 ASN ND2 N 15.933 4.269 2.316 1.00 . B B . 3 ASN ND2 1 1 4 2688 2 2 3 ASN O O 12.879 6.356 -0.714 1.00 . B B . 3 ASN O 1 1 4 2689 2 2 3 ASN OD1 O 15.316 3.905 0.253 1.00 . B B . 3 ASN OD1 1 1 4 2690 2 2 4 GLN C C 10.160 5.827 -2.900 1.00 . B B . 4 GLN C 1 1 4 2691 2 2 4 GLN CA C 11.581 5.262 -2.814 1.00 . B B . 4 GLN CA 1 1 4 2692 2 2 4 GLN CB C 11.779 4.228 -3.923 1.00 . B B . 4 GLN CB 1 1 4 2693 2 2 4 GLN CD C 12.733 4.148 -6.231 1.00 . B B . 4 GLN CD 1 1 4 2694 2 2 4 GLN CG C 12.967 4.632 -4.799 1.00 . B B . 4 GLN CG 1 1 4 2695 2 2 4 GLN H H 11.453 3.705 -1.332 1.00 . B B . 4 GLN H 1 1 4 2696 2 2 4 GLN HA H 12.294 6.062 -2.939 1.00 . B B . 4 GLN HA 1 1 4 2697 2 2 4 GLN HB2 H 11.968 3.260 -3.481 1.00 . B B . 4 GLN HB2 1 1 4 2698 2 2 4 GLN HB3 H 10.888 4.177 -4.531 1.00 . B B . 4 GLN HB3 1 1 4 2699 2 2 4 GLN HE21 H 14.664 3.872 -6.601 1.00 . B B . 4 GLN HE21 1 1 4 2700 2 2 4 GLN HE22 H 13.619 3.504 -7.887 1.00 . B B . 4 GLN HE22 1 1 4 2701 2 2 4 GLN HG2 H 13.069 5.707 -4.792 1.00 . B B . 4 GLN HG2 1 1 4 2702 2 2 4 GLN HG3 H 13.868 4.182 -4.413 1.00 . B B . 4 GLN HG3 1 1 4 2703 2 2 4 GLN N N 11.794 4.610 -1.491 1.00 . B B . 4 GLN N 1 1 4 2704 2 2 4 GLN NE2 N 13.757 3.812 -6.967 1.00 . B B . 4 GLN NE2 1 1 4 2705 2 2 4 GLN O O 9.431 5.878 -1.921 1.00 . B B . 4 GLN O 1 1 4 2706 2 2 4 GLN OE1 O 11.608 4.075 -6.684 1.00 . B B . 4 GLN OE1 1 1 4 2707 2 2 5 HIS C C 7.522 5.754 -4.946 1.00 . B B . 5 HIS C 1 1 4 2708 2 2 5 HIS CA C 8.395 6.801 -4.253 1.00 . B B . 5 HIS CA 1 1 4 2709 2 2 5 HIS CB C 8.466 8.066 -5.113 1.00 . B B . 5 HIS CB 1 1 4 2710 2 2 5 HIS CD2 C 9.898 10.066 -4.216 1.00 . B B . 5 HIS CD2 1 1 4 2711 2 2 5 HIS CE1 C 8.523 10.738 -2.674 1.00 . B B . 5 HIS CE1 1 1 4 2712 2 2 5 HIS CG C 8.801 9.246 -4.243 1.00 . B B . 5 HIS CG 1 1 4 2713 2 2 5 HIS H H 10.369 6.184 -4.842 1.00 . B B . 5 HIS H 1 1 4 2714 2 2 5 HIS HA H 7.974 7.041 -3.288 1.00 . B B . 5 HIS HA 1 1 4 2715 2 2 5 HIS HB2 H 9.231 7.946 -5.868 1.00 . B B . 5 HIS HB2 1 1 4 2716 2 2 5 HIS HB3 H 7.511 8.231 -5.589 1.00 . B B . 5 HIS HB3 1 1 4 2717 2 2 5 HIS HD2 H 10.758 9.987 -4.865 1.00 . B B . 5 HIS HD2 1 1 4 2718 2 2 5 HIS HE1 H 8.087 11.300 -1.861 1.00 . B B . 5 HIS HE1 1 1 4 2719 2 2 5 HIS HE2 H 10.343 11.726 -2.975 1.00 . B B . 5 HIS HE2 1 1 4 2720 2 2 5 HIS N N 9.764 6.245 -4.074 1.00 . B B . 5 HIS N 1 1 4 2721 2 2 5 HIS ND1 N 7.938 9.683 -3.260 1.00 . B B . 5 HIS ND1 1 1 4 2722 2 2 5 HIS NE2 N 9.723 11.008 -3.226 1.00 . B B . 5 HIS NE2 1 1 4 2723 2 2 5 HIS O O 7.904 5.169 -5.940 1.00 . B B . 5 HIS O 1 1 4 2724 2 2 6 LEU C C 4.390 5.212 -5.870 1.00 . B B . 6 LEU C 1 1 4 2725 2 2 6 LEU CA C 5.455 4.496 -5.039 1.00 . B B . 6 LEU CA 1 1 4 2726 2 2 6 LEU CB C 4.796 3.686 -3.923 1.00 . B B . 6 LEU CB 1 1 4 2727 2 2 6 LEU CD1 C 6.591 1.997 -4.345 1.00 . B B . 6 LEU CD1 1 1 4 2728 2 2 6 LEU CD2 C 4.648 1.415 -2.889 1.00 . B B . 6 LEU CD2 1 1 4 2729 2 2 6 LEU CG C 5.090 2.199 -4.128 1.00 . B B . 6 LEU CG 1 1 4 2730 2 2 6 LEU H H 6.067 5.990 -3.622 1.00 . B B . 6 LEU H 1 1 4 2731 2 2 6 LEU HA H 6.026 3.840 -5.675 1.00 . B B . 6 LEU HA 1 1 4 2732 2 2 6 LEU HB2 H 5.195 4.002 -2.971 1.00 . B B . 6 LEU HB2 1 1 4 2733 2 2 6 LEU HB3 H 3.731 3.851 -3.937 1.00 . B B . 6 LEU HB3 1 1 4 2734 2 2 6 LEU HD11 H 7.099 2.945 -4.251 1.00 . B B . 6 LEU HD11 1 1 4 2735 2 2 6 LEU HD12 H 6.760 1.593 -5.332 1.00 . B B . 6 LEU HD12 1 1 4 2736 2 2 6 LEU HD13 H 6.973 1.309 -3.605 1.00 . B B . 6 LEU HD13 1 1 4 2737 2 2 6 LEU HD21 H 3.616 1.120 -2.998 1.00 . B B . 6 LEU HD21 1 1 4 2738 2 2 6 LEU HD22 H 4.750 2.039 -2.013 1.00 . B B . 6 LEU HD22 1 1 4 2739 2 2 6 LEU HD23 H 5.266 0.536 -2.779 1.00 . B B . 6 LEU HD23 1 1 4 2740 2 2 6 LEU HG H 4.554 1.842 -4.992 1.00 . B B . 6 LEU HG 1 1 4 2741 2 2 6 LEU N N 6.354 5.508 -4.424 1.00 . B B . 6 LEU N 1 1 4 2742 2 2 6 LEU O O 3.550 5.915 -5.344 1.00 . B B . 6 LEU O 1 1 4 2743 2 2 7 CYS C C 2.771 4.779 -9.013 1.00 . B B . 7 CYS C 1 1 4 2744 2 2 7 CYS CA C 3.414 5.752 -8.013 1.00 . B B . 7 CYS CA 1 1 4 2745 2 2 7 CYS CB C 4.096 6.883 -8.791 1.00 . B B . 7 CYS CB 1 1 4 2746 2 2 7 CYS H H 5.111 4.497 -7.580 1.00 . B B . 7 CYS H 1 1 4 2747 2 2 7 CYS HA H 2.652 6.164 -7.374 1.00 . B B . 7 CYS HA 1 1 4 2748 2 2 7 CYS HB2 H 5.133 6.631 -8.952 1.00 . B B . 7 CYS HB2 1 1 4 2749 2 2 7 CYS HB3 H 3.606 7.007 -9.745 1.00 . B B . 7 CYS HB3 1 1 4 2750 2 2 7 CYS N N 4.422 5.055 -7.167 1.00 . B B . 7 CYS N 1 1 4 2751 2 2 7 CYS O O 3.443 4.018 -9.678 1.00 . B B . 7 CYS O 1 1 4 2752 2 2 7 CYS SG S 3.995 8.433 -7.857 1.00 . B B . 7 CYS SG 1 1 4 2753 2 2 8 GLY C C 1.427 2.633 -10.331 1.00 . B B . 8 GLY C 1 1 4 2754 2 2 8 GLY CA C 0.715 3.969 -10.092 1.00 . B B . 8 GLY CA 1 1 4 2755 2 2 8 GLY H H 0.970 5.487 -8.587 1.00 . B B . 8 GLY H 1 1 4 2756 2 2 8 GLY HA2 H -0.270 3.775 -9.694 1.00 . B B . 8 GLY HA2 1 1 4 2757 2 2 8 GLY HA3 H 0.620 4.488 -11.033 1.00 . B B . 8 GLY HA3 1 1 4 2758 2 2 8 GLY N N 1.467 4.839 -9.129 1.00 . B B . 8 GLY N 1 1 4 2759 2 2 8 GLY O O 1.593 1.835 -9.431 1.00 . B B . 8 GLY O 1 1 4 2760 2 2 9 SER C C 3.423 0.663 -10.754 1.00 . B B . 9 SER C 1 1 4 2761 2 2 9 SER CA C 2.504 1.096 -11.897 1.00 . B B . 9 SER CA 1 1 4 2762 2 2 9 SER CB C 3.330 1.284 -13.171 1.00 . B B . 9 SER CB 1 1 4 2763 2 2 9 SER H H 1.652 3.042 -12.262 1.00 . B B . 9 SER H 1 1 4 2764 2 2 9 SER HA H 1.760 0.333 -12.065 1.00 . B B . 9 SER HA 1 1 4 2765 2 2 9 SER HB2 H 3.690 0.328 -13.513 1.00 . B B . 9 SER HB2 1 1 4 2766 2 2 9 SER HB3 H 2.709 1.728 -13.939 1.00 . B B . 9 SER HB3 1 1 4 2767 2 2 9 SER HG H 4.258 2.990 -13.279 1.00 . B B . 9 SER HG 1 1 4 2768 2 2 9 SER N N 1.822 2.383 -11.556 1.00 . B B . 9 SER N 1 1 4 2769 2 2 9 SER O O 3.178 -0.327 -10.093 1.00 . B B . 9 SER O 1 1 4 2770 2 2 9 SER OG O 4.437 2.129 -12.893 1.00 . B B . 9 SER OG 1 1 4 2771 2 2 10 ASP C C 4.586 0.651 -8.180 1.00 . B B . 10 ASP C 1 1 4 2772 2 2 10 ASP CA C 5.405 1.012 -9.412 1.00 . B B . 10 ASP CA 1 1 4 2773 2 2 10 ASP CB C 6.315 2.197 -9.086 1.00 . B B . 10 ASP CB 1 1 4 2774 2 2 10 ASP CG C 7.166 2.539 -10.311 1.00 . B B . 10 ASP CG 1 1 4 2775 2 2 10 ASP H H 4.660 2.186 -11.055 1.00 . B B . 10 ASP H 1 1 4 2776 2 2 10 ASP HA H 5.999 0.162 -9.713 1.00 . B B . 10 ASP HA 1 1 4 2777 2 2 10 ASP HB2 H 5.707 3.051 -8.813 1.00 . B B . 10 ASP HB2 1 1 4 2778 2 2 10 ASP HB3 H 6.962 1.937 -8.261 1.00 . B B . 10 ASP HB3 1 1 4 2779 2 2 10 ASP N N 4.478 1.391 -10.515 1.00 . B B . 10 ASP N 1 1 4 2780 2 2 10 ASP O O 4.960 -0.193 -7.391 1.00 . B B . 10 ASP O 1 1 4 2781 2 2 10 ASP OD1 O 6.621 3.100 -11.248 1.00 . B B . 10 ASP OD1 1 1 4 2782 2 2 10 ASP OD2 O 8.347 2.233 -10.292 1.00 . B B . 10 ASP OD2 1 1 4 2783 2 2 11 LEU C C 2.126 -0.451 -6.930 1.00 . B B . 11 LEU C 1 1 4 2784 2 2 11 LEU CA C 2.605 0.996 -6.842 1.00 . B B . 11 LEU CA 1 1 4 2785 2 2 11 LEU CB C 1.413 1.957 -6.867 1.00 . B B . 11 LEU CB 1 1 4 2786 2 2 11 LEU CD1 C 1.942 2.243 -4.403 1.00 . B B . 11 LEU CD1 1 1 4 2787 2 2 11 LEU CD2 C 0.145 3.578 -5.467 1.00 . B B . 11 LEU CD2 1 1 4 2788 2 2 11 LEU CG C 0.839 2.218 -5.461 1.00 . B B . 11 LEU CG 1 1 4 2789 2 2 11 LEU H H 3.188 1.963 -8.669 1.00 . B B . 11 LEU H 1 1 4 2790 2 2 11 LEU HA H 3.178 1.126 -5.948 1.00 . B B . 11 LEU HA 1 1 4 2791 2 2 11 LEU HB2 H 1.732 2.895 -7.294 1.00 . B B . 11 LEU HB2 1 1 4 2792 2 2 11 LEU HB3 H 0.639 1.533 -7.489 1.00 . B B . 11 LEU HB3 1 1 4 2793 2 2 11 LEU HD11 H 1.661 2.923 -3.607 1.00 . B B . 11 LEU HD11 1 1 4 2794 2 2 11 LEU HD12 H 2.861 2.579 -4.851 1.00 . B B . 11 LEU HD12 1 1 4 2795 2 2 11 LEU HD13 H 2.073 1.253 -3.997 1.00 . B B . 11 LEU HD13 1 1 4 2796 2 2 11 LEU HD21 H -0.739 3.535 -4.851 1.00 . B B . 11 LEU HD21 1 1 4 2797 2 2 11 LEU HD22 H -0.130 3.836 -6.480 1.00 . B B . 11 LEU HD22 1 1 4 2798 2 2 11 LEU HD23 H 0.820 4.326 -5.077 1.00 . B B . 11 LEU HD23 1 1 4 2799 2 2 11 LEU HG H 0.122 1.450 -5.216 1.00 . B B . 11 LEU HG 1 1 4 2800 2 2 11 LEU N N 3.467 1.288 -8.015 1.00 . B B . 11 LEU N 1 1 4 2801 2 2 11 LEU O O 2.297 -1.227 -6.011 1.00 . B B . 11 LEU O 1 1 4 2802 2 2 12 ALA C C 2.315 -3.118 -8.383 1.00 . B B . 12 ALA C 1 1 4 2803 2 2 12 ALA CA C 1.091 -2.237 -8.171 1.00 . B B . 12 ALA CA 1 1 4 2804 2 2 12 ALA CB C 0.151 -2.375 -9.368 1.00 . B B . 12 ALA CB 1 1 4 2805 2 2 12 ALA H H 1.432 -0.199 -8.775 1.00 . B B . 12 ALA H 1 1 4 2806 2 2 12 ALA HA H 0.579 -2.540 -7.268 1.00 . B B . 12 ALA HA 1 1 4 2807 2 2 12 ALA HB1 H -0.531 -3.196 -9.196 1.00 . B B . 12 ALA HB1 1 1 4 2808 2 2 12 ALA HB2 H 0.731 -2.570 -10.258 1.00 . B B . 12 ALA HB2 1 1 4 2809 2 2 12 ALA HB3 H -0.409 -1.462 -9.494 1.00 . B B . 12 ALA HB3 1 1 4 2810 2 2 12 ALA N N 1.548 -0.830 -8.035 1.00 . B B . 12 ALA N 1 1 4 2811 2 2 12 ALA O O 2.432 -4.176 -7.805 1.00 . B B . 12 ALA O 1 1 4 2812 2 2 13 GLU C C 5.190 -3.666 -8.110 1.00 . B B . 13 GLU C 1 1 4 2813 2 2 13 GLU CA C 4.465 -3.487 -9.438 1.00 . B B . 13 GLU CA 1 1 4 2814 2 2 13 GLU CB C 5.378 -2.763 -10.429 1.00 . B B . 13 GLU CB 1 1 4 2815 2 2 13 GLU CD C 5.935 -2.493 -12.848 1.00 . B B . 13 GLU CD 1 1 4 2816 2 2 13 GLU CG C 4.923 -3.070 -11.858 1.00 . B B . 13 GLU CG 1 1 4 2817 2 2 13 GLU H H 3.132 -1.811 -9.648 1.00 . B B . 13 GLU H 1 1 4 2818 2 2 13 GLU HA H 4.192 -4.454 -9.834 1.00 . B B . 13 GLU HA 1 1 4 2819 2 2 13 GLU HB2 H 5.325 -1.698 -10.255 1.00 . B B . 13 GLU HB2 1 1 4 2820 2 2 13 GLU HB3 H 6.394 -3.100 -10.297 1.00 . B B . 13 GLU HB3 1 1 4 2821 2 2 13 GLU HG2 H 4.857 -4.140 -11.991 1.00 . B B . 13 GLU HG2 1 1 4 2822 2 2 13 GLU HG3 H 3.956 -2.624 -12.033 1.00 . B B . 13 GLU HG3 1 1 4 2823 2 2 13 GLU N N 3.240 -2.678 -9.202 1.00 . B B . 13 GLU N 1 1 4 2824 2 2 13 GLU O O 5.729 -4.716 -7.822 1.00 . B B . 13 GLU O 1 1 4 2825 2 2 13 GLU OE1 O 5.972 -1.282 -12.987 1.00 . B B . 13 GLU OE1 1 1 4 2826 2 2 13 GLU OE2 O 6.657 -3.271 -13.450 1.00 . B B . 13 GLU OE2 1 1 4 2827 2 2 14 ALA C C 5.097 -3.817 -5.150 1.00 . B B . 14 ALA C 1 1 4 2828 2 2 14 ALA CA C 5.862 -2.785 -5.968 1.00 . B B . 14 ALA CA 1 1 4 2829 2 2 14 ALA CB C 5.847 -1.438 -5.245 1.00 . B B . 14 ALA CB 1 1 4 2830 2 2 14 ALA H H 4.733 -1.819 -7.528 1.00 . B B . 14 ALA H 1 1 4 2831 2 2 14 ALA HA H 6.883 -3.118 -6.108 1.00 . B B . 14 ALA HA 1 1 4 2832 2 2 14 ALA HB1 H 4.843 -1.042 -5.243 1.00 . B B . 14 ALA HB1 1 1 4 2833 2 2 14 ALA HB2 H 6.506 -0.749 -5.753 1.00 . B B . 14 ALA HB2 1 1 4 2834 2 2 14 ALA HB3 H 6.182 -1.572 -4.227 1.00 . B B . 14 ALA HB3 1 1 4 2835 2 2 14 ALA N N 5.190 -2.655 -7.287 1.00 . B B . 14 ALA N 1 1 4 2836 2 2 14 ALA O O 5.670 -4.731 -4.592 1.00 . B B . 14 ALA O 1 1 4 2837 2 2 15 LEU C C 3.078 -6.026 -5.083 1.00 . B B . 15 LEU C 1 1 4 2838 2 2 15 LEU CA C 3.005 -4.694 -4.334 1.00 . B B . 15 LEU CA 1 1 4 2839 2 2 15 LEU CB C 1.546 -4.240 -4.242 1.00 . B B . 15 LEU CB 1 1 4 2840 2 2 15 LEU CD1 C 0.141 -2.348 -3.425 1.00 . B B . 15 LEU CD1 1 1 4 2841 2 2 15 LEU CD2 C 1.328 -3.815 -1.792 1.00 . B B . 15 LEU CD2 1 1 4 2842 2 2 15 LEU CG C 1.413 -3.158 -3.171 1.00 . B B . 15 LEU CG 1 1 4 2843 2 2 15 LEU H H 3.346 -2.963 -5.574 1.00 . B B . 15 LEU H 1 1 4 2844 2 2 15 LEU HA H 3.422 -4.801 -3.339 1.00 . B B . 15 LEU HA 1 1 4 2845 2 2 15 LEU HB2 H 1.232 -3.843 -5.196 1.00 . B B . 15 LEU HB2 1 1 4 2846 2 2 15 LEU HB3 H 0.924 -5.082 -3.979 1.00 . B B . 15 LEU HB3 1 1 4 2847 2 2 15 LEU HD11 H -0.594 -2.585 -2.671 1.00 . B B . 15 LEU HD11 1 1 4 2848 2 2 15 LEU HD12 H -0.252 -2.594 -4.401 1.00 . B B . 15 LEU HD12 1 1 4 2849 2 2 15 LEU HD13 H 0.371 -1.294 -3.385 1.00 . B B . 15 LEU HD13 1 1 4 2850 2 2 15 LEU HD21 H 0.876 -4.791 -1.885 1.00 . B B . 15 LEU HD21 1 1 4 2851 2 2 15 LEU HD22 H 0.726 -3.200 -1.139 1.00 . B B . 15 LEU HD22 1 1 4 2852 2 2 15 LEU HD23 H 2.320 -3.915 -1.379 1.00 . B B . 15 LEU HD23 1 1 4 2853 2 2 15 LEU HG H 2.272 -2.503 -3.210 1.00 . B B . 15 LEU HG 1 1 4 2854 2 2 15 LEU N N 3.797 -3.697 -5.096 1.00 . B B . 15 LEU N 1 1 4 2855 2 2 15 LEU O O 2.995 -7.091 -4.506 1.00 . B B . 15 LEU O 1 1 4 2856 2 2 16 TYR C C 4.581 -7.965 -6.802 1.00 . B B . 16 TYR C 1 1 4 2857 2 2 16 TYR CA C 3.334 -7.194 -7.207 1.00 . B B . 16 TYR CA 1 1 4 2858 2 2 16 TYR CB C 3.477 -6.793 -8.684 1.00 . B B . 16 TYR CB 1 1 4 2859 2 2 16 TYR CD1 C 1.388 -8.218 -9.060 1.00 . B B . 16 TYR CD1 1 1 4 2860 2 2 16 TYR CD2 C 2.629 -7.381 -10.971 1.00 . B B . 16 TYR CD2 1 1 4 2861 2 2 16 TYR CE1 C 0.475 -8.834 -9.926 1.00 . B B . 16 TYR CE1 1 1 4 2862 2 2 16 TYR CE2 C 1.714 -7.997 -11.835 1.00 . B B . 16 TYR CE2 1 1 4 2863 2 2 16 TYR CG C 2.470 -7.489 -9.583 1.00 . B B . 16 TYR CG 1 1 4 2864 2 2 16 TYR CZ C 0.637 -8.723 -11.313 1.00 . B B . 16 TYR CZ 1 1 4 2865 2 2 16 TYR H H 3.310 -5.080 -6.812 1.00 . B B . 16 TYR H 1 1 4 2866 2 2 16 TYR HA H 2.466 -7.798 -7.059 1.00 . B B . 16 TYR HA 1 1 4 2867 2 2 16 TYR HB2 H 3.343 -5.730 -8.773 1.00 . B B . 16 TYR HB2 1 1 4 2868 2 2 16 TYR HB3 H 4.474 -7.044 -9.015 1.00 . B B . 16 TYR HB3 1 1 4 2869 2 2 16 TYR HD1 H 1.257 -8.310 -7.999 1.00 . B B . 16 TYR HD1 1 1 4 2870 2 2 16 TYR HD2 H 3.464 -6.823 -11.375 1.00 . B B . 16 TYR HD2 1 1 4 2871 2 2 16 TYR HE1 H -0.357 -9.391 -9.523 1.00 . B B . 16 TYR HE1 1 1 4 2872 2 2 16 TYR HE2 H 1.839 -7.908 -12.903 1.00 . B B . 16 TYR HE2 1 1 4 2873 2 2 16 TYR HH H -0.415 -8.743 -12.906 1.00 . B B . 16 TYR HH 1 1 4 2874 2 2 16 TYR N N 3.241 -5.957 -6.379 1.00 . B B . 16 TYR N 1 1 4 2875 2 2 16 TYR O O 4.722 -9.140 -7.078 1.00 . B B . 16 TYR O 1 1 4 2876 2 2 16 TYR OH O -0.265 -9.330 -12.163 1.00 . B B . 16 TYR OH 1 1 4 2877 2 2 17 LEU C C 6.757 -8.227 -4.279 1.00 . B B . 17 LEU C 1 1 4 2878 2 2 17 LEU CA C 6.762 -7.953 -5.787 1.00 . B B . 17 LEU CA 1 1 4 2879 2 2 17 LEU CB C 7.888 -7.005 -6.165 1.00 . B B . 17 LEU CB 1 1 4 2880 2 2 17 LEU CD1 C 9.236 -9.125 -6.072 1.00 . B B . 17 LEU CD1 1 1 4 2881 2 2 17 LEU CD2 C 10.282 -6.969 -6.725 1.00 . B B . 17 LEU CD2 1 1 4 2882 2 2 17 LEU CG C 9.238 -7.610 -5.825 1.00 . B B . 17 LEU CG 1 1 4 2883 2 2 17 LEU H H 5.381 -6.345 -5.992 1.00 . B B . 17 LEU H 1 1 4 2884 2 2 17 LEU HA H 6.879 -8.878 -6.328 1.00 . B B . 17 LEU HA 1 1 4 2885 2 2 17 LEU HB2 H 7.845 -6.807 -7.225 1.00 . B B . 17 LEU HB2 1 1 4 2886 2 2 17 LEU HB3 H 7.767 -6.078 -5.625 1.00 . B B . 17 LEU HB3 1 1 4 2887 2 2 17 LEU HD11 H 8.893 -9.639 -5.188 1.00 . B B . 17 LEU HD11 1 1 4 2888 2 2 17 LEU HD12 H 10.238 -9.452 -6.310 1.00 . B B . 17 LEU HD12 1 1 4 2889 2 2 17 LEU HD13 H 8.580 -9.354 -6.899 1.00 . B B . 17 LEU HD13 1 1 4 2890 2 2 17 LEU HD21 H 9.883 -6.051 -7.132 1.00 . B B . 17 LEU HD21 1 1 4 2891 2 2 17 LEU HD22 H 10.517 -7.647 -7.533 1.00 . B B . 17 LEU HD22 1 1 4 2892 2 2 17 LEU HD23 H 11.169 -6.760 -6.154 1.00 . B B . 17 LEU HD23 1 1 4 2893 2 2 17 LEU HG H 9.465 -7.401 -4.795 1.00 . B B . 17 LEU HG 1 1 4 2894 2 2 17 LEU N N 5.504 -7.297 -6.180 1.00 . B B . 17 LEU N 1 1 4 2895 2 2 17 LEU O O 7.636 -8.879 -3.753 1.00 . B B . 17 LEU O 1 1 4 2896 2 2 18 VAL C C 4.659 -9.056 -1.806 1.00 . B B . 18 VAL C 1 1 4 2897 2 2 18 VAL CA C 5.717 -7.992 -2.107 1.00 . B B . 18 VAL CA 1 1 4 2898 2 2 18 VAL CB C 5.367 -6.689 -1.375 1.00 . B B . 18 VAL CB 1 1 4 2899 2 2 18 VAL CG1 C 6.041 -5.523 -2.082 1.00 . B B . 18 VAL CG1 1 1 4 2900 2 2 18 VAL CG2 C 3.851 -6.464 -1.373 1.00 . B B . 18 VAL CG2 1 1 4 2901 2 2 18 VAL H H 5.064 -7.222 -4.011 1.00 . B B . 18 VAL H 1 1 4 2902 2 2 18 VAL HA H 6.681 -8.343 -1.769 1.00 . B B . 18 VAL HA 1 1 4 2903 2 2 18 VAL HB H 5.725 -6.742 -0.360 1.00 . B B . 18 VAL HB 1 1 4 2904 2 2 18 VAL HG11 H 6.709 -5.902 -2.841 1.00 . B B . 18 VAL HG11 1 1 4 2905 2 2 18 VAL HG12 H 6.599 -4.945 -1.364 1.00 . B B . 18 VAL HG12 1 1 4 2906 2 2 18 VAL HG13 H 5.287 -4.902 -2.542 1.00 . B B . 18 VAL HG13 1 1 4 2907 2 2 18 VAL HG21 H 3.624 -5.548 -0.846 1.00 . B B . 18 VAL HG21 1 1 4 2908 2 2 18 VAL HG22 H 3.364 -7.293 -0.882 1.00 . B B . 18 VAL HG22 1 1 4 2909 2 2 18 VAL HG23 H 3.496 -6.390 -2.390 1.00 . B B . 18 VAL HG23 1 1 4 2910 2 2 18 VAL N N 5.769 -7.743 -3.575 1.00 . B B . 18 VAL N 1 1 4 2911 2 2 18 VAL O O 4.894 -9.988 -1.063 1.00 . B B . 18 VAL O 1 1 4 2912 2 2 19 CYS C C 2.327 -10.895 -3.274 1.00 . B B . 19 CYS C 1 1 4 2913 2 2 19 CYS CA C 2.416 -9.903 -2.112 1.00 . B B . 19 CYS CA 1 1 4 2914 2 2 19 CYS CB C 1.083 -9.169 -1.970 1.00 . B B . 19 CYS CB 1 1 4 2915 2 2 19 CYS H H 3.324 -8.151 -2.962 1.00 . B B . 19 CYS H 1 1 4 2916 2 2 19 CYS HA H 2.634 -10.433 -1.199 1.00 . B B . 19 CYS HA 1 1 4 2917 2 2 19 CYS HB2 H 1.203 -8.143 -2.286 1.00 . B B . 19 CYS HB2 1 1 4 2918 2 2 19 CYS HB3 H 0.339 -9.650 -2.587 1.00 . B B . 19 CYS HB3 1 1 4 2919 2 2 19 CYS N N 3.493 -8.914 -2.372 1.00 . B B . 19 CYS N 1 1 4 2920 2 2 19 CYS O O 2.211 -12.088 -3.076 1.00 . B B . 19 CYS O 1 1 4 2921 2 2 19 CYS SG S 0.552 -9.207 -0.240 1.00 . B B . 19 CYS SG 1 1 4 2922 2 2 20 GLY C C 0.856 -11.883 -5.750 1.00 . B B . 20 GLY C 1 1 4 2923 2 2 20 GLY CA C 2.280 -11.332 -5.655 1.00 . B B . 20 GLY CA 1 1 4 2924 2 2 20 GLY H H 2.460 -9.446 -4.627 1.00 . B B . 20 GLY H 1 1 4 2925 2 2 20 GLY HA2 H 2.522 -10.791 -6.559 1.00 . B B . 20 GLY HA2 1 1 4 2926 2 2 20 GLY HA3 H 2.972 -12.149 -5.526 1.00 . B B . 20 GLY HA3 1 1 4 2927 2 2 20 GLY N N 2.372 -10.412 -4.486 1.00 . B B . 20 GLY N 1 1 4 2928 2 2 20 GLY O O -0.107 -11.142 -5.776 1.00 . B B . 20 GLY O 1 1 4 2929 2 2 21 GLU C C -1.400 -13.525 -4.563 1.00 . B B . 21 GLU C 1 1 4 2930 2 2 21 GLU CA C -0.652 -13.775 -5.876 1.00 . B B . 21 GLU CA 1 1 4 2931 2 2 21 GLU CB C -0.549 -15.285 -6.128 1.00 . B B . 21 GLU CB 1 1 4 2932 2 2 21 GLU CD C 0.610 -15.346 -3.904 1.00 . B B . 21 GLU CD 1 1 4 2933 2 2 21 GLU CG C 0.627 -15.875 -5.340 1.00 . B B . 21 GLU CG 1 1 4 2934 2 2 21 GLU H H 1.502 -13.758 -5.764 1.00 . B B . 21 GLU H 1 1 4 2935 2 2 21 GLU HA H -1.194 -13.313 -6.689 1.00 . B B . 21 GLU HA 1 1 4 2936 2 2 21 GLU HB2 H -1.466 -15.763 -5.816 1.00 . B B . 21 GLU HB2 1 1 4 2937 2 2 21 GLU HB3 H -0.395 -15.461 -7.183 1.00 . B B . 21 GLU HB3 1 1 4 2938 2 2 21 GLU HG2 H 0.542 -16.952 -5.326 1.00 . B B . 21 GLU HG2 1 1 4 2939 2 2 21 GLU HG3 H 1.557 -15.596 -5.813 1.00 . B B . 21 GLU HG3 1 1 4 2940 2 2 21 GLU N N 0.713 -13.179 -5.792 1.00 . B B . 21 GLU N 1 1 4 2941 2 2 21 GLU O O -2.577 -13.805 -4.443 1.00 . B B . 21 GLU O 1 1 4 2942 2 2 21 GLU OE1 O -0.399 -15.524 -3.241 1.00 . B B . 21 GLU OE1 1 1 4 2943 2 2 21 GLU OE2 O 1.604 -14.773 -3.494 1.00 . B B . 21 GLU OE2 1 1 4 2944 2 2 22 ARG C C -2.549 -11.756 -2.474 1.00 . B B . 22 ARG C 1 1 4 2945 2 2 22 ARG CA C -1.386 -12.729 -2.270 1.00 . B B . 22 ARG CA 1 1 4 2946 2 2 22 ARG CB C -0.369 -12.107 -1.310 1.00 . B B . 22 ARG CB 1 1 4 2947 2 2 22 ARG CD C -0.196 -14.293 -0.099 1.00 . B B . 22 ARG CD 1 1 4 2948 2 2 22 ARG CG C 0.592 -13.185 -0.803 1.00 . B B . 22 ARG CG 1 1 4 2949 2 2 22 ARG CZ C -1.847 -14.466 1.661 1.00 . B B . 22 ARG CZ 1 1 4 2950 2 2 22 ARG H H 0.224 -12.783 -3.695 1.00 . B B . 22 ARG H 1 1 4 2951 2 2 22 ARG HA H -1.757 -13.652 -1.855 1.00 . B B . 22 ARG HA 1 1 4 2952 2 2 22 ARG HB2 H 0.192 -11.344 -1.829 1.00 . B B . 22 ARG HB2 1 1 4 2953 2 2 22 ARG HB3 H -0.885 -11.664 -0.473 1.00 . B B . 22 ARG HB3 1 1 4 2954 2 2 22 ARG HD2 H -0.783 -14.835 -0.825 1.00 . B B . 22 ARG HD2 1 1 4 2955 2 2 22 ARG HD3 H 0.492 -14.969 0.385 1.00 . B B . 22 ARG HD3 1 1 4 2956 2 2 22 ARG HE H -1.135 -12.721 1.039 1.00 . B B . 22 ARG HE 1 1 4 2957 2 2 22 ARG HG2 H 1.133 -13.604 -1.639 1.00 . B B . 22 ARG HG2 1 1 4 2958 2 2 22 ARG HG3 H 1.289 -12.745 -0.106 1.00 . B B . 22 ARG HG3 1 1 4 2959 2 2 22 ARG HH11 H -2.927 -15.150 0.120 1.00 . B B . 22 ARG HH11 1 1 4 2960 2 2 22 ARG HH12 H -3.355 -15.783 1.674 1.00 . B B . 22 ARG HH12 1 1 4 2961 2 2 22 ARG HH21 H -0.943 -13.960 3.373 1.00 . B B . 22 ARG HH21 1 1 4 2962 2 2 22 ARG HH22 H -2.232 -15.108 3.518 1.00 . B B . 22 ARG HH22 1 1 4 2963 2 2 22 ARG N N -0.723 -12.999 -3.576 1.00 . B B . 22 ARG N 1 1 4 2964 2 2 22 ARG NE N -1.101 -13.694 0.922 1.00 . B B . 22 ARG NE 1 1 4 2965 2 2 22 ARG NH1 N -2.783 -15.190 1.109 1.00 . B B . 22 ARG NH1 1 1 4 2966 2 2 22 ARG NH2 N -1.659 -14.515 2.951 1.00 . B B . 22 ARG NH2 1 1 4 2967 2 2 22 ARG O O -3.387 -11.588 -1.610 1.00 . B B . 22 ARG O 1 1 4 2968 2 2 23 GLY C C -3.581 -8.958 -2.909 1.00 . B B . 23 GLY C 1 1 4 2969 2 2 23 GLY CA C -3.714 -10.150 -3.858 1.00 . B B . 23 GLY CA 1 1 4 2970 2 2 23 GLY H H -1.919 -11.261 -4.288 1.00 . B B . 23 GLY H 1 1 4 2971 2 2 23 GLY HA2 H -3.664 -9.805 -4.882 1.00 . B B . 23 GLY HA2 1 1 4 2972 2 2 23 GLY HA3 H -4.662 -10.637 -3.688 1.00 . B B . 23 GLY HA3 1 1 4 2973 2 2 23 GLY N N -2.606 -11.113 -3.606 1.00 . B B . 23 GLY N 1 1 4 2974 2 2 23 GLY O O -3.780 -9.077 -1.714 1.00 . B B . 23 GLY O 1 1 4 2975 2 2 24 PHE C C -4.078 -5.532 -2.986 1.00 . B B . 24 PHE C 1 1 4 2976 2 2 24 PHE CA C -3.093 -6.616 -2.550 1.00 . B B . 24 PHE CA 1 1 4 2977 2 2 24 PHE CB C -1.665 -6.079 -2.647 1.00 . B B . 24 PHE CB 1 1 4 2978 2 2 24 PHE CD1 C -1.555 -4.845 -4.843 1.00 . B B . 24 PHE CD1 1 1 4 2979 2 2 24 PHE CD2 C -0.586 -7.065 -4.698 1.00 . B B . 24 PHE CD2 1 1 4 2980 2 2 24 PHE CE1 C -1.178 -4.767 -6.191 1.00 . B B . 24 PHE CE1 1 1 4 2981 2 2 24 PHE CE2 C -0.209 -6.988 -6.044 1.00 . B B . 24 PHE CE2 1 1 4 2982 2 2 24 PHE CG C -1.258 -5.993 -4.098 1.00 . B B . 24 PHE CG 1 1 4 2983 2 2 24 PHE CZ C -0.504 -5.840 -6.791 1.00 . B B . 24 PHE CZ 1 1 4 2984 2 2 24 PHE H H -3.082 -7.734 -4.392 1.00 . B B . 24 PHE H 1 1 4 2985 2 2 24 PHE HA H -3.302 -6.898 -1.531 1.00 . B B . 24 PHE HA 1 1 4 2986 2 2 24 PHE HB2 H -1.618 -5.095 -2.202 1.00 . B B . 24 PHE HB2 1 1 4 2987 2 2 24 PHE HB3 H -0.993 -6.743 -2.127 1.00 . B B . 24 PHE HB3 1 1 4 2988 2 2 24 PHE HD1 H -2.073 -4.018 -4.379 1.00 . B B . 24 PHE HD1 1 1 4 2989 2 2 24 PHE HD2 H -0.358 -7.949 -4.123 1.00 . B B . 24 PHE HD2 1 1 4 2990 2 2 24 PHE HE1 H -1.405 -3.883 -6.765 1.00 . B B . 24 PHE HE1 1 1 4 2991 2 2 24 PHE HE2 H 0.307 -7.815 -6.505 1.00 . B B . 24 PHE HE2 1 1 4 2992 2 2 24 PHE HZ H -0.213 -5.783 -7.830 1.00 . B B . 24 PHE HZ 1 1 4 2993 2 2 24 PHE N N -3.241 -7.810 -3.427 1.00 . B B . 24 PHE N 1 1 4 2994 2 2 24 PHE O O -4.231 -5.252 -4.158 1.00 . B B . 24 PHE O 1 1 4 2995 2 2 25 PHE C C -5.079 -2.481 -2.194 1.00 . B B . 25 PHE C 1 1 4 2996 2 2 25 PHE CA C -5.720 -3.852 -2.413 1.00 . B B . 25 PHE CA 1 1 4 2997 2 2 25 PHE CB C -6.973 -3.981 -1.546 1.00 . B B . 25 PHE CB 1 1 4 2998 2 2 25 PHE CD1 C -6.143 -4.952 0.630 1.00 . B B . 25 PHE CD1 1 1 4 2999 2 2 25 PHE CD2 C -6.712 -2.595 0.543 1.00 . B B . 25 PHE CD2 1 1 4 3000 2 2 25 PHE CE1 C -5.801 -4.819 1.983 1.00 . B B . 25 PHE CE1 1 1 4 3001 2 2 25 PHE CE2 C -6.370 -2.461 1.894 1.00 . B B . 25 PHE CE2 1 1 4 3002 2 2 25 PHE CG C -6.600 -3.839 -0.090 1.00 . B B . 25 PHE CG 1 1 4 3003 2 2 25 PHE CZ C -5.914 -3.573 2.614 1.00 . B B . 25 PHE CZ 1 1 4 3004 2 2 25 PHE H H -4.609 -5.158 -1.112 1.00 . B B . 25 PHE H 1 1 4 3005 2 2 25 PHE HA H -5.990 -3.958 -3.453 1.00 . B B . 25 PHE HA 1 1 4 3006 2 2 25 PHE HB2 H -7.676 -3.204 -1.814 1.00 . B B . 25 PHE HB2 1 1 4 3007 2 2 25 PHE HB3 H -7.425 -4.948 -1.709 1.00 . B B . 25 PHE HB3 1 1 4 3008 2 2 25 PHE HD1 H -6.054 -5.913 0.143 1.00 . B B . 25 PHE HD1 1 1 4 3009 2 2 25 PHE HD2 H -7.062 -1.738 -0.012 1.00 . B B . 25 PHE HD2 1 1 4 3010 2 2 25 PHE HE1 H -5.449 -5.676 2.538 1.00 . B B . 25 PHE HE1 1 1 4 3011 2 2 25 PHE HE2 H -6.459 -1.502 2.381 1.00 . B B . 25 PHE HE2 1 1 4 3012 2 2 25 PHE HZ H -5.651 -3.470 3.657 1.00 . B B . 25 PHE HZ 1 1 4 3013 2 2 25 PHE N N -4.747 -4.918 -2.050 1.00 . B B . 25 PHE N 1 1 4 3014 2 2 25 PHE O O -4.725 -2.119 -1.089 1.00 . B B . 25 PHE O 1 1 4 3015 2 2 26 TYR C C -5.355 0.723 -3.218 1.00 . B B . 26 TYR C 1 1 4 3016 2 2 26 TYR CA C -4.291 -0.375 -3.101 1.00 . B B . 26 TYR CA 1 1 4 3017 2 2 26 TYR CB C -3.217 -0.201 -4.188 1.00 . B B . 26 TYR CB 1 1 4 3018 2 2 26 TYR CD1 C -5.121 -0.083 -5.865 1.00 . B B . 26 TYR CD1 1 1 4 3019 2 2 26 TYR CD2 C -3.074 1.140 -6.322 1.00 . B B . 26 TYR CD2 1 1 4 3020 2 2 26 TYR CE1 C -5.666 0.380 -7.070 1.00 . B B . 26 TYR CE1 1 1 4 3021 2 2 26 TYR CE2 C -3.620 1.598 -7.529 1.00 . B B . 26 TYR CE2 1 1 4 3022 2 2 26 TYR CG C -3.823 0.298 -5.487 1.00 . B B . 26 TYR CG 1 1 4 3023 2 2 26 TYR CZ C -4.915 1.218 -7.903 1.00 . B B . 26 TYR CZ 1 1 4 3024 2 2 26 TYR H H -5.204 -2.041 -4.121 1.00 . B B . 26 TYR H 1 1 4 3025 2 2 26 TYR HA H -3.823 -0.308 -2.129 1.00 . B B . 26 TYR HA 1 1 4 3026 2 2 26 TYR HB2 H -2.479 0.510 -3.847 1.00 . B B . 26 TYR HB2 1 1 4 3027 2 2 26 TYR HB3 H -2.736 -1.152 -4.364 1.00 . B B . 26 TYR HB3 1 1 4 3028 2 2 26 TYR HD1 H -5.704 -0.724 -5.226 1.00 . B B . 26 TYR HD1 1 1 4 3029 2 2 26 TYR HD2 H -2.076 1.434 -6.034 1.00 . B B . 26 TYR HD2 1 1 4 3030 2 2 26 TYR HE1 H -6.664 0.087 -7.359 1.00 . B B . 26 TYR HE1 1 1 4 3031 2 2 26 TYR HE2 H -3.040 2.246 -8.171 1.00 . B B . 26 TYR HE2 1 1 4 3032 2 2 26 TYR HH H -4.934 1.296 -9.811 1.00 . B B . 26 TYR HH 1 1 4 3033 2 2 26 TYR N N -4.919 -1.722 -3.242 1.00 . B B . 26 TYR N 1 1 4 3034 2 2 26 TYR O O -5.105 1.783 -3.755 1.00 . B B . 26 TYR O 1 1 4 3035 2 2 26 TYR OH O -5.450 1.669 -9.092 1.00 . B B . 26 TYR OH 1 1 4 3036 2 2 27 THR C C -7.644 2.322 -1.508 1.00 . B B . 27 THR C 1 1 4 3037 2 2 27 THR CA C -7.602 1.522 -2.809 1.00 . B B . 27 THR CA 1 1 4 3038 2 2 27 THR CB C -8.961 0.853 -3.037 1.00 . B B . 27 THR CB 1 1 4 3039 2 2 27 THR CG2 C -9.362 0.068 -1.789 1.00 . B B . 27 THR CG2 1 1 4 3040 2 2 27 THR H H -6.724 -0.378 -2.287 1.00 . B B . 27 THR H 1 1 4 3041 2 2 27 THR HA H -7.387 2.186 -3.631 1.00 . B B . 27 THR HA 1 1 4 3042 2 2 27 THR HB H -8.896 0.181 -3.875 1.00 . B B . 27 THR HB 1 1 4 3043 2 2 27 THR HG1 H -10.699 1.422 -3.698 1.00 . B B . 27 THR HG1 1 1 4 3044 2 2 27 THR HG21 H -9.539 -0.964 -2.055 1.00 . B B . 27 THR HG21 1 1 4 3045 2 2 27 THR HG22 H -10.263 0.491 -1.372 1.00 . B B . 27 THR HG22 1 1 4 3046 2 2 27 THR HG23 H -8.568 0.122 -1.060 1.00 . B B . 27 THR HG23 1 1 4 3047 2 2 27 THR N N -6.537 0.483 -2.720 1.00 . B B . 27 THR N 1 1 4 3048 2 2 27 THR O O -6.678 2.385 -0.773 1.00 . B B . 27 THR O 1 1 4 3049 2 2 27 THR OG1 O -9.937 1.851 -3.304 1.00 . B B . 27 THR OG1 1 1 4 3050 2 2 28 LYS C C -8.837 2.775 1.240 1.00 . B B . 28 LYS C 1 1 4 3051 2 2 28 LYS CA C -8.862 3.728 0.041 1.00 . B B . 28 LYS CA 1 1 4 3052 2 2 28 LYS CB C -10.177 4.521 0.047 1.00 . B B . 28 LYS CB 1 1 4 3053 2 2 28 LYS CD C -10.690 5.836 -2.019 1.00 . B B . 28 LYS CD 1 1 4 3054 2 2 28 LYS CE C -12.204 5.763 -1.808 1.00 . B B . 28 LYS CE 1 1 4 3055 2 2 28 LYS CG C -9.988 5.868 -0.660 1.00 . B B . 28 LYS CG 1 1 4 3056 2 2 28 LYS H H -9.528 2.867 -1.820 1.00 . B B . 28 LYS H 1 1 4 3057 2 2 28 LYS HA H -8.025 4.407 0.105 1.00 . B B . 28 LYS HA 1 1 4 3058 2 2 28 LYS HB2 H -10.940 3.952 -0.466 1.00 . B B . 28 LYS HB2 1 1 4 3059 2 2 28 LYS HB3 H -10.487 4.694 1.067 1.00 . B B . 28 LYS HB3 1 1 4 3060 2 2 28 LYS HD2 H -10.445 6.732 -2.571 1.00 . B B . 28 LYS HD2 1 1 4 3061 2 2 28 LYS HD3 H -10.363 4.970 -2.574 1.00 . B B . 28 LYS HD3 1 1 4 3062 2 2 28 LYS HE2 H -12.413 5.326 -0.842 1.00 . B B . 28 LYS HE2 1 1 4 3063 2 2 28 LYS HE3 H -12.622 6.758 -1.851 1.00 . B B . 28 LYS HE3 1 1 4 3064 2 2 28 LYS HG2 H -10.416 6.656 -0.054 1.00 . B B . 28 LYS HG2 1 1 4 3065 2 2 28 LYS HG3 H -8.937 6.058 -0.805 1.00 . B B . 28 LYS HG3 1 1 4 3066 2 2 28 LYS HZ1 H -12.400 3.968 -2.847 1.00 . B B . 28 LYS HZ1 1 1 4 3067 2 2 28 LYS HZ2 H -12.629 5.352 -3.806 1.00 . B B . 28 LYS HZ2 1 1 4 3068 2 2 28 LYS HZ3 H -13.840 4.855 -2.723 1.00 . B B . 28 LYS HZ3 1 1 4 3069 2 2 28 LYS N N -8.759 2.933 -1.216 1.00 . B B . 28 LYS N 1 1 4 3070 2 2 28 LYS NZ N -12.814 4.921 -2.877 1.00 . B B . 28 LYS NZ 1 1 4 3071 2 2 28 LYS O O -9.336 1.671 1.162 1.00 . B B . 28 LYS O 1 1 4 3072 2 2 29 PRO C C -9.471 2.460 4.313 1.00 . B B . 29 PRO C 1 1 4 3073 2 2 29 PRO CA C -8.142 2.447 3.554 1.00 . B B . 29 PRO CA 1 1 4 3074 2 2 29 PRO CB C -7.053 3.174 4.347 1.00 . B B . 29 PRO CB 1 1 4 3075 2 2 29 PRO CD C -7.648 4.580 2.398 1.00 . B B . 29 PRO CD 1 1 4 3076 2 2 29 PRO CG C -7.006 4.620 3.797 1.00 . B B . 29 PRO CG 1 1 4 3077 2 2 29 PRO HA H -7.833 1.438 3.339 1.00 . B B . 29 PRO HA 1 1 4 3078 2 2 29 PRO HB2 H -7.303 3.181 5.399 1.00 . B B . 29 PRO HB2 1 1 4 3079 2 2 29 PRO HB3 H -6.099 2.695 4.193 1.00 . B B . 29 PRO HB3 1 1 4 3080 2 2 29 PRO HD2 H -8.407 5.345 2.309 1.00 . B B . 29 PRO HD2 1 1 4 3081 2 2 29 PRO HD3 H -6.897 4.698 1.632 1.00 . B B . 29 PRO HD3 1 1 4 3082 2 2 29 PRO HG2 H -7.564 5.280 4.447 1.00 . B B . 29 PRO HG2 1 1 4 3083 2 2 29 PRO HG3 H -5.983 4.954 3.719 1.00 . B B . 29 PRO HG3 1 1 4 3084 2 2 29 PRO N N -8.253 3.235 2.316 1.00 . B B . 29 PRO N 1 1 4 3085 2 2 29 PRO O O -10.469 2.953 3.828 1.00 . B B . 29 PRO O 1 1 4 3086 2 2 30 THR C C -11.895 1.381 5.409 1.00 . B B . 30 THR C 1 1 4 3087 2 2 30 THR CA C -10.755 1.901 6.287 1.00 . B B . 30 THR CA 1 1 4 3088 2 2 30 THR CB C -11.081 3.320 6.760 1.00 . B B . 30 THR CB 1 1 4 3089 2 2 30 THR CG2 C -10.436 3.564 8.124 1.00 . B B . 30 THR CG2 1 1 4 3090 2 2 30 THR H H -8.675 1.527 5.874 1.00 . B B . 30 THR H 1 1 4 3091 2 2 30 THR HA H -10.636 1.255 7.144 1.00 . B B . 30 THR HA 1 1 4 3092 2 2 30 THR HB H -12.151 3.435 6.845 1.00 . B B . 30 THR HB 1 1 4 3093 2 2 30 THR HG1 H -9.629 4.332 5.952 1.00 . B B . 30 THR HG1 1 1 4 3094 2 2 30 THR HG21 H -9.586 2.909 8.242 1.00 . B B . 30 THR HG21 1 1 4 3095 2 2 30 THR HG22 H -11.157 3.361 8.903 1.00 . B B . 30 THR HG22 1 1 4 3096 2 2 30 THR HG23 H -10.112 4.592 8.191 1.00 . B B . 30 THR HG23 1 1 4 3097 2 2 30 THR N N -9.491 1.920 5.500 1.00 . B B . 30 THR N 1 1 4 3098 2 2 30 THR O O -11.859 0.214 5.056 1.00 . B B . 30 THR O 1 1 4 3099 2 2 30 THR OXT O -12.783 2.159 5.103 1.00 . B B . 30 THR OXT 1 1 4 3100 2 2 30 THR OG1 O -10.577 4.258 5.820 1.00 . B B . 30 THR OG1 1 1 5 3101 1 1 1 GLY C C -3.677 7.259 0.412 1.00 . A A . 1 GLY C 1 1 5 3102 1 1 1 GLY CA C -5.136 7.532 0.547 1.00 . A A . 1 GLY CA 1 1 5 3103 1 1 1 GLY H1 H -6.405 6.159 -0.446 1.00 . A A . 1 GLY H1 1 1 5 3104 1 1 1 GLY H2 H -6.960 6.609 1.096 1.00 . A A . 1 GLY H2 1 1 5 3105 1 1 1 GLY H3 H -5.664 5.521 0.942 1.00 . A A . 1 GLY H3 1 1 5 3106 1 1 1 GLY HA2 H -5.039 7.927 -0.339 1.00 . A A . 1 GLY HA2 1 1 5 3107 1 1 1 GLY HA3 H -5.522 8.290 1.346 1.00 . A A . 1 GLY HA3 1 1 5 3108 1 1 1 GLY N N -6.120 6.361 0.534 1.00 . A A . 1 GLY N 1 1 5 3109 1 1 1 GLY O O -2.851 7.968 0.952 1.00 . A A . 1 GLY O 1 1 5 3110 1 1 2 ILE C C -1.450 6.306 -1.907 1.00 . A A . 2 ILE C 1 1 5 3111 1 1 2 ILE CA C -1.873 5.915 -0.491 1.00 . A A . 2 ILE CA 1 1 5 3112 1 1 2 ILE CB C -1.647 4.415 -0.264 1.00 . A A . 2 ILE CB 1 1 5 3113 1 1 2 ILE CD1 C 0.102 2.653 0.020 1.00 . A A . 2 ILE CD1 1 1 5 3114 1 1 2 ILE CG1 C -0.164 4.159 0.015 1.00 . A A . 2 ILE CG1 1 1 5 3115 1 1 2 ILE CG2 C -2.072 3.629 -1.505 1.00 . A A . 2 ILE CG2 1 1 5 3116 1 1 2 ILE H H -3.997 5.678 -0.753 1.00 . A A . 2 ILE H 1 1 5 3117 1 1 2 ILE HA H -1.292 6.477 0.223 1.00 . A A . 2 ILE HA 1 1 5 3118 1 1 2 ILE HB H -2.233 4.090 0.583 1.00 . A A . 2 ILE HB 1 1 5 3119 1 1 2 ILE HD11 H -0.751 2.138 0.437 1.00 . A A . 2 ILE HD11 1 1 5 3120 1 1 2 ILE HD12 H 0.976 2.444 0.619 1.00 . A A . 2 ILE HD12 1 1 5 3121 1 1 2 ILE HD13 H 0.268 2.313 -0.992 1.00 . A A . 2 ILE HD13 1 1 5 3122 1 1 2 ILE HG12 H 0.434 4.629 -0.752 1.00 . A A . 2 ILE HG12 1 1 5 3123 1 1 2 ILE HG13 H 0.097 4.571 0.978 1.00 . A A . 2 ILE HG13 1 1 5 3124 1 1 2 ILE HG21 H -3.111 3.830 -1.720 1.00 . A A . 2 ILE HG21 1 1 5 3125 1 1 2 ILE HG22 H -1.940 2.573 -1.324 1.00 . A A . 2 ILE HG22 1 1 5 3126 1 1 2 ILE HG23 H -1.465 3.929 -2.347 1.00 . A A . 2 ILE HG23 1 1 5 3127 1 1 2 ILE N N -3.317 6.234 -0.315 1.00 . A A . 2 ILE N 1 1 5 3128 1 1 2 ILE O O -0.320 6.677 -2.154 1.00 . A A . 2 ILE O 1 1 5 3129 1 1 3 VAL C C -1.331 7.942 -4.267 1.00 . A A . 3 VAL C 1 1 5 3130 1 1 3 VAL CA C -2.036 6.585 -4.239 1.00 . A A . 3 VAL CA 1 1 5 3131 1 1 3 VAL CB C -3.334 6.672 -5.042 1.00 . A A . 3 VAL CB 1 1 5 3132 1 1 3 VAL CG1 C -3.048 7.306 -6.399 1.00 . A A . 3 VAL CG1 1 1 5 3133 1 1 3 VAL CG2 C -3.907 5.268 -5.244 1.00 . A A . 3 VAL CG2 1 1 5 3134 1 1 3 VAL H H -3.264 5.920 -2.604 1.00 . A A . 3 VAL H 1 1 5 3135 1 1 3 VAL HA H -1.394 5.830 -4.670 1.00 . A A . 3 VAL HA 1 1 5 3136 1 1 3 VAL HB H -4.048 7.281 -4.505 1.00 . A A . 3 VAL HB 1 1 5 3137 1 1 3 VAL HG11 H -3.687 6.860 -7.146 1.00 . A A . 3 VAL HG11 1 1 5 3138 1 1 3 VAL HG12 H -2.014 7.139 -6.661 1.00 . A A . 3 VAL HG12 1 1 5 3139 1 1 3 VAL HG13 H -3.240 8.367 -6.346 1.00 . A A . 3 VAL HG13 1 1 5 3140 1 1 3 VAL HG21 H -4.341 4.920 -4.319 1.00 . A A . 3 VAL HG21 1 1 5 3141 1 1 3 VAL HG22 H -3.116 4.598 -5.546 1.00 . A A . 3 VAL HG22 1 1 5 3142 1 1 3 VAL HG23 H -4.668 5.297 -6.011 1.00 . A A . 3 VAL HG23 1 1 5 3143 1 1 3 VAL N N -2.360 6.222 -2.834 1.00 . A A . 3 VAL N 1 1 5 3144 1 1 3 VAL O O -0.390 8.150 -5.010 1.00 . A A . 3 VAL O 1 1 5 3145 1 1 4 GLU C C -0.005 10.233 -2.434 1.00 . A A . 4 GLU C 1 1 5 3146 1 1 4 GLU CA C -1.149 10.215 -3.449 1.00 . A A . 4 GLU CA 1 1 5 3147 1 1 4 GLU CB C -2.197 11.259 -3.055 1.00 . A A . 4 GLU CB 1 1 5 3148 1 1 4 GLU CD C -2.167 13.680 -3.664 1.00 . A A . 4 GLU CD 1 1 5 3149 1 1 4 GLU CG C -1.513 12.602 -2.796 1.00 . A A . 4 GLU CG 1 1 5 3150 1 1 4 GLU H H -2.545 8.678 -2.883 1.00 . A A . 4 GLU H 1 1 5 3151 1 1 4 GLU HA H -0.763 10.447 -4.430 1.00 . A A . 4 GLU HA 1 1 5 3152 1 1 4 GLU HB2 H -2.913 11.368 -3.856 1.00 . A A . 4 GLU HB2 1 1 5 3153 1 1 4 GLU HB3 H -2.705 10.937 -2.159 1.00 . A A . 4 GLU HB3 1 1 5 3154 1 1 4 GLU HG2 H -1.620 12.864 -1.753 1.00 . A A . 4 GLU HG2 1 1 5 3155 1 1 4 GLU HG3 H -0.466 12.528 -3.045 1.00 . A A . 4 GLU HG3 1 1 5 3156 1 1 4 GLU N N -1.783 8.868 -3.469 1.00 . A A . 4 GLU N 1 1 5 3157 1 1 4 GLU O O 1.044 10.794 -2.678 1.00 . A A . 4 GLU O 1 1 5 3158 1 1 4 GLU OE1 O -3.242 14.131 -3.304 1.00 . A A . 4 GLU OE1 1 1 5 3159 1 1 4 GLU OE2 O -1.581 14.036 -4.673 1.00 . A A . 4 GLU OE2 1 1 5 3160 1 1 5 GLN C C 2.077 8.820 -0.778 1.00 . A A . 5 GLN C 1 1 5 3161 1 1 5 GLN CA C 0.877 9.619 -0.263 1.00 . A A . 5 GLN CA 1 1 5 3162 1 1 5 GLN CB C 0.346 8.977 1.020 1.00 . A A . 5 GLN CB 1 1 5 3163 1 1 5 GLN CD C 0.993 9.039 3.433 1.00 . A A . 5 GLN CD 1 1 5 3164 1 1 5 GLN CG C 0.644 9.891 2.211 1.00 . A A . 5 GLN CG 1 1 5 3165 1 1 5 GLN H H -1.055 9.186 -1.113 1.00 . A A . 5 GLN H 1 1 5 3166 1 1 5 GLN HA H 1.184 10.634 -0.056 1.00 . A A . 5 GLN HA 1 1 5 3167 1 1 5 GLN HB2 H -0.723 8.833 0.936 1.00 . A A . 5 GLN HB2 1 1 5 3168 1 1 5 GLN HB3 H 0.827 8.023 1.172 1.00 . A A . 5 GLN HB3 1 1 5 3169 1 1 5 GLN HE21 H -0.649 9.544 4.431 1.00 . A A . 5 GLN HE21 1 1 5 3170 1 1 5 GLN HE22 H 0.393 8.475 5.240 1.00 . A A . 5 GLN HE22 1 1 5 3171 1 1 5 GLN HG2 H 1.479 10.534 1.969 1.00 . A A . 5 GLN HG2 1 1 5 3172 1 1 5 GLN HG3 H -0.224 10.494 2.429 1.00 . A A . 5 GLN HG3 1 1 5 3173 1 1 5 GLN N N -0.200 9.630 -1.294 1.00 . A A . 5 GLN N 1 1 5 3174 1 1 5 GLN NE2 N 0.177 9.018 4.453 1.00 . A A . 5 GLN NE2 1 1 5 3175 1 1 5 GLN O O 3.201 9.280 -0.743 1.00 . A A . 5 GLN O 1 1 5 3176 1 1 5 GLN OE1 O 2.017 8.386 3.460 1.00 . A A . 5 GLN OE1 1 1 5 3177 1 1 6 CYS C C 3.589 7.476 -2.999 1.00 . A A . 6 CYS C 1 1 5 3178 1 1 6 CYS CA C 2.983 6.803 -1.766 1.00 . A A . 6 CYS CA 1 1 5 3179 1 1 6 CYS CB C 2.472 5.414 -2.156 1.00 . A A . 6 CYS CB 1 1 5 3180 1 1 6 CYS H H 0.937 7.272 -1.273 1.00 . A A . 6 CYS H 1 1 5 3181 1 1 6 CYS HA H 3.734 6.711 -0.998 1.00 . A A . 6 CYS HA 1 1 5 3182 1 1 6 CYS HB2 H 1.392 5.420 -2.162 1.00 . A A . 6 CYS HB2 1 1 5 3183 1 1 6 CYS HB3 H 2.833 5.165 -3.142 1.00 . A A . 6 CYS HB3 1 1 5 3184 1 1 6 CYS N N 1.850 7.627 -1.254 1.00 . A A . 6 CYS N 1 1 5 3185 1 1 6 CYS O O 4.763 7.332 -3.281 1.00 . A A . 6 CYS O 1 1 5 3186 1 1 6 CYS SG S 3.057 4.176 -0.968 1.00 . A A . 6 CYS SG 1 1 5 3187 1 1 7 CYS C C 3.900 10.244 -4.587 1.00 . A A . 7 CYS C 1 1 5 3188 1 1 7 CYS CA C 3.326 8.876 -4.958 1.00 . A A . 7 CYS CA 1 1 5 3189 1 1 7 CYS CB C 2.191 9.055 -5.967 1.00 . A A . 7 CYS CB 1 1 5 3190 1 1 7 CYS H H 1.853 8.300 -3.497 1.00 . A A . 7 CYS H 1 1 5 3191 1 1 7 CYS HA H 4.103 8.267 -5.395 1.00 . A A . 7 CYS HA 1 1 5 3192 1 1 7 CYS HB2 H 1.637 8.132 -6.053 1.00 . A A . 7 CYS HB2 1 1 5 3193 1 1 7 CYS HB3 H 1.531 9.840 -5.630 1.00 . A A . 7 CYS HB3 1 1 5 3194 1 1 7 CYS N N 2.797 8.202 -3.739 1.00 . A A . 7 CYS N 1 1 5 3195 1 1 7 CYS O O 4.984 10.606 -5.002 1.00 . A A . 7 CYS O 1 1 5 3196 1 1 7 CYS SG S 2.878 9.495 -7.583 1.00 . A A . 7 CYS SG 1 1 5 3197 1 1 8 THR C C 4.667 12.208 -2.251 1.00 . A A . 8 THR C 1 1 5 3198 1 1 8 THR CA C 3.695 12.353 -3.420 1.00 . A A . 8 THR CA 1 1 5 3199 1 1 8 THR CB C 2.523 13.242 -3.001 1.00 . A A . 8 THR CB 1 1 5 3200 1 1 8 THR CG2 C 3.029 14.658 -2.721 1.00 . A A . 8 THR CG2 1 1 5 3201 1 1 8 THR H H 2.312 10.703 -3.487 1.00 . A A . 8 THR H 1 1 5 3202 1 1 8 THR HA H 4.205 12.803 -4.260 1.00 . A A . 8 THR HA 1 1 5 3203 1 1 8 THR HB H 2.071 12.844 -2.107 1.00 . A A . 8 THR HB 1 1 5 3204 1 1 8 THR HG1 H 1.782 14.005 -4.630 1.00 . A A . 8 THR HG1 1 1 5 3205 1 1 8 THR HG21 H 3.607 15.007 -3.565 1.00 . A A . 8 THR HG21 1 1 5 3206 1 1 8 THR HG22 H 3.650 14.651 -1.838 1.00 . A A . 8 THR HG22 1 1 5 3207 1 1 8 THR HG23 H 2.188 15.317 -2.564 1.00 . A A . 8 THR HG23 1 1 5 3208 1 1 8 THR N N 3.184 11.010 -3.812 1.00 . A A . 8 THR N 1 1 5 3209 1 1 8 THR O O 5.367 13.136 -1.893 1.00 . A A . 8 THR O 1 1 5 3210 1 1 8 THR OG1 O 1.560 13.276 -4.045 1.00 . A A . 8 THR OG1 1 1 5 3211 1 1 9 SER C C 6.368 9.513 -0.649 1.00 . A A . 9 SER C 1 1 5 3212 1 1 9 SER CA C 5.648 10.854 -0.503 1.00 . A A . 9 SER CA 1 1 5 3213 1 1 9 SER CB C 4.859 10.870 0.807 1.00 . A A . 9 SER CB 1 1 5 3214 1 1 9 SER H H 4.148 10.316 -1.952 1.00 . A A . 9 SER H 1 1 5 3215 1 1 9 SER HA H 6.377 11.652 -0.491 1.00 . A A . 9 SER HA 1 1 5 3216 1 1 9 SER HB2 H 4.570 9.865 1.067 1.00 . A A . 9 SER HB2 1 1 5 3217 1 1 9 SER HB3 H 5.479 11.279 1.594 1.00 . A A . 9 SER HB3 1 1 5 3218 1 1 9 SER HG H 3.170 11.594 1.446 1.00 . A A . 9 SER HG 1 1 5 3219 1 1 9 SER N N 4.720 11.052 -1.649 1.00 . A A . 9 SER N 1 1 5 3220 1 1 9 SER O O 6.074 8.730 -1.532 1.00 . A A . 9 SER O 1 1 5 3221 1 1 9 SER OG O 3.692 11.664 0.643 1.00 . A A . 9 SER OG 1 1 5 3222 1 1 10 ILE C C 7.421 6.939 1.072 1.00 . A A . 10 ILE C 1 1 5 3223 1 1 10 ILE CA C 8.057 7.961 0.130 1.00 . A A . 10 ILE CA 1 1 5 3224 1 1 10 ILE CB C 9.502 8.203 0.563 1.00 . A A . 10 ILE CB 1 1 5 3225 1 1 10 ILE CD1 C 10.385 8.582 -1.743 1.00 . A A . 10 ILE CD1 1 1 5 3226 1 1 10 ILE CG1 C 10.159 9.218 -0.374 1.00 . A A . 10 ILE CG1 1 1 5 3227 1 1 10 ILE CG2 C 10.275 6.886 0.523 1.00 . A A . 10 ILE CG2 1 1 5 3228 1 1 10 ILE H H 7.530 9.893 0.910 1.00 . A A . 10 ILE H 1 1 5 3229 1 1 10 ILE HA H 8.038 7.588 -0.883 1.00 . A A . 10 ILE HA 1 1 5 3230 1 1 10 ILE HB H 9.511 8.588 1.570 1.00 . A A . 10 ILE HB 1 1 5 3231 1 1 10 ILE HD11 H 9.447 8.529 -2.274 1.00 . A A . 10 ILE HD11 1 1 5 3232 1 1 10 ILE HD12 H 10.787 7.589 -1.618 1.00 . A A . 10 ILE HD12 1 1 5 3233 1 1 10 ILE HD13 H 11.084 9.184 -2.304 1.00 . A A . 10 ILE HD13 1 1 5 3234 1 1 10 ILE HG12 H 9.513 10.079 -0.478 1.00 . A A . 10 ILE HG12 1 1 5 3235 1 1 10 ILE HG13 H 11.106 9.528 0.039 1.00 . A A . 10 ILE HG13 1 1 5 3236 1 1 10 ILE HG21 H 10.002 6.283 1.376 1.00 . A A . 10 ILE HG21 1 1 5 3237 1 1 10 ILE HG22 H 11.335 7.090 0.552 1.00 . A A . 10 ILE HG22 1 1 5 3238 1 1 10 ILE HG23 H 10.035 6.355 -0.385 1.00 . A A . 10 ILE HG23 1 1 5 3239 1 1 10 ILE N N 7.310 9.245 0.210 1.00 . A A . 10 ILE N 1 1 5 3240 1 1 10 ILE O O 7.089 7.248 2.200 1.00 . A A . 10 ILE O 1 1 5 3241 1 1 11 CYS C C 7.507 3.422 1.500 1.00 . A A . 11 CYS C 1 1 5 3242 1 1 11 CYS CA C 6.660 4.692 1.539 1.00 . A A . 11 CYS CA 1 1 5 3243 1 1 11 CYS CB C 5.223 4.364 1.116 1.00 . A A . 11 CYS CB 1 1 5 3244 1 1 11 CYS H H 7.543 5.475 -0.271 1.00 . A A . 11 CYS H 1 1 5 3245 1 1 11 CYS HA H 6.651 5.077 2.548 1.00 . A A . 11 CYS HA 1 1 5 3246 1 1 11 CYS HB2 H 5.008 3.334 1.359 1.00 . A A . 11 CYS HB2 1 1 5 3247 1 1 11 CYS HB3 H 4.538 5.004 1.651 1.00 . A A . 11 CYS HB3 1 1 5 3248 1 1 11 CYS N N 7.260 5.718 0.635 1.00 . A A . 11 CYS N 1 1 5 3249 1 1 11 CYS O O 7.913 2.965 0.450 1.00 . A A . 11 CYS O 1 1 5 3250 1 1 11 CYS SG S 5.009 4.609 -0.666 1.00 . A A . 11 CYS SG 1 1 5 3251 1 1 12 SER C C 7.702 0.387 2.736 1.00 . A A . 12 SER C 1 1 5 3252 1 1 12 SER CA C 8.610 1.616 2.676 1.00 . A A . 12 SER CA 1 1 5 3253 1 1 12 SER CB C 9.515 1.643 3.909 1.00 . A A . 12 SER CB 1 1 5 3254 1 1 12 SER H H 7.448 3.242 3.476 1.00 . A A . 12 SER H 1 1 5 3255 1 1 12 SER HA H 9.221 1.568 1.786 1.00 . A A . 12 SER HA 1 1 5 3256 1 1 12 SER HB2 H 9.822 0.640 4.154 1.00 . A A . 12 SER HB2 1 1 5 3257 1 1 12 SER HB3 H 10.390 2.242 3.700 1.00 . A A . 12 SER HB3 1 1 5 3258 1 1 12 SER HG H 8.526 1.471 5.578 1.00 . A A . 12 SER HG 1 1 5 3259 1 1 12 SER N N 7.782 2.853 2.641 1.00 . A A . 12 SER N 1 1 5 3260 1 1 12 SER O O 6.532 0.479 3.058 1.00 . A A . 12 SER O 1 1 5 3261 1 1 12 SER OG O 8.797 2.194 5.007 1.00 . A A . 12 SER OG 1 1 5 3262 1 1 13 LEU C C 6.433 -1.993 3.584 1.00 . A A . 13 LEU C 1 1 5 3263 1 1 13 LEU CA C 7.437 -2.013 2.432 1.00 . A A . 13 LEU CA 1 1 5 3264 1 1 13 LEU CB C 8.366 -3.215 2.589 1.00 . A A . 13 LEU CB 1 1 5 3265 1 1 13 LEU CD1 C 7.895 -5.410 1.490 1.00 . A A . 13 LEU CD1 1 1 5 3266 1 1 13 LEU CD2 C 7.837 -5.218 3.978 1.00 . A A . 13 LEU CD2 1 1 5 3267 1 1 13 LEU CG C 7.536 -4.497 2.663 1.00 . A A . 13 LEU CG 1 1 5 3268 1 1 13 LEU H H 9.176 -0.796 2.141 1.00 . A A . 13 LEU H 1 1 5 3269 1 1 13 LEU HA H 6.910 -2.096 1.510 1.00 . A A . 13 LEU HA 1 1 5 3270 1 1 13 LEU HB2 H 9.031 -3.267 1.741 1.00 . A A . 13 LEU HB2 1 1 5 3271 1 1 13 LEU HB3 H 8.943 -3.110 3.494 1.00 . A A . 13 LEU HB3 1 1 5 3272 1 1 13 LEU HD11 H 8.936 -5.277 1.236 1.00 . A A . 13 LEU HD11 1 1 5 3273 1 1 13 LEU HD12 H 7.281 -5.158 0.638 1.00 . A A . 13 LEU HD12 1 1 5 3274 1 1 13 LEU HD13 H 7.720 -6.438 1.769 1.00 . A A . 13 LEU HD13 1 1 5 3275 1 1 13 LEU HD21 H 8.838 -5.622 3.945 1.00 . A A . 13 LEU HD21 1 1 5 3276 1 1 13 LEU HD22 H 7.130 -6.020 4.118 1.00 . A A . 13 LEU HD22 1 1 5 3277 1 1 13 LEU HD23 H 7.758 -4.519 4.797 1.00 . A A . 13 LEU HD23 1 1 5 3278 1 1 13 LEU HG H 6.486 -4.249 2.619 1.00 . A A . 13 LEU HG 1 1 5 3279 1 1 13 LEU N N 8.239 -0.761 2.413 1.00 . A A . 13 LEU N 1 1 5 3280 1 1 13 LEU O O 5.315 -2.450 3.451 1.00 . A A . 13 LEU O 1 1 5 3281 1 1 14 TYR C C 4.520 -0.881 5.376 1.00 . A A . 14 TYR C 1 1 5 3282 1 1 14 TYR CA C 5.868 -1.422 5.859 1.00 . A A . 14 TYR CA 1 1 5 3283 1 1 14 TYR CB C 6.427 -0.512 6.955 1.00 . A A . 14 TYR CB 1 1 5 3284 1 1 14 TYR CD1 C 6.608 -2.348 8.675 1.00 . A A . 14 TYR CD1 1 1 5 3285 1 1 14 TYR CD2 C 5.280 -0.384 9.198 1.00 . A A . 14 TYR CD2 1 1 5 3286 1 1 14 TYR CE1 C 6.302 -2.889 9.931 1.00 . A A . 14 TYR CE1 1 1 5 3287 1 1 14 TYR CE2 C 4.976 -0.926 10.454 1.00 . A A . 14 TYR CE2 1 1 5 3288 1 1 14 TYR CG C 6.097 -1.096 8.308 1.00 . A A . 14 TYR CG 1 1 5 3289 1 1 14 TYR CZ C 5.486 -2.178 10.820 1.00 . A A . 14 TYR CZ 1 1 5 3290 1 1 14 TYR H H 7.718 -1.099 4.802 1.00 . A A . 14 TYR H 1 1 5 3291 1 1 14 TYR HA H 5.734 -2.420 6.251 1.00 . A A . 14 TYR HA 1 1 5 3292 1 1 14 TYR HB2 H 7.498 -0.435 6.845 1.00 . A A . 14 TYR HB2 1 1 5 3293 1 1 14 TYR HB3 H 5.984 0.468 6.869 1.00 . A A . 14 TYR HB3 1 1 5 3294 1 1 14 TYR HD1 H 7.236 -2.897 7.989 1.00 . A A . 14 TYR HD1 1 1 5 3295 1 1 14 TYR HD2 H 4.886 0.580 8.916 1.00 . A A . 14 TYR HD2 1 1 5 3296 1 1 14 TYR HE1 H 6.696 -3.854 10.214 1.00 . A A . 14 TYR HE1 1 1 5 3297 1 1 14 TYR HE2 H 4.347 -0.378 11.140 1.00 . A A . 14 TYR HE2 1 1 5 3298 1 1 14 TYR HH H 4.969 -1.987 12.649 1.00 . A A . 14 TYR HH 1 1 5 3299 1 1 14 TYR N N 6.814 -1.466 4.711 1.00 . A A . 14 TYR N 1 1 5 3300 1 1 14 TYR O O 3.510 -1.553 5.445 1.00 . A A . 14 TYR O 1 1 5 3301 1 1 14 TYR OH O 5.186 -2.711 12.057 1.00 . A A . 14 TYR OH 1 1 5 3302 1 1 15 GLN C C 2.597 -0.059 3.377 1.00 . A A . 15 GLN C 1 1 5 3303 1 1 15 GLN CA C 3.220 0.906 4.382 1.00 . A A . 15 GLN CA 1 1 5 3304 1 1 15 GLN CB C 3.498 2.250 3.701 1.00 . A A . 15 GLN CB 1 1 5 3305 1 1 15 GLN CD C 4.907 3.090 5.584 1.00 . A A . 15 GLN CD 1 1 5 3306 1 1 15 GLN CG C 3.641 3.340 4.764 1.00 . A A . 15 GLN CG 1 1 5 3307 1 1 15 GLN H H 5.326 0.846 4.815 1.00 . A A . 15 GLN H 1 1 5 3308 1 1 15 GLN HA H 2.544 1.053 5.212 1.00 . A A . 15 GLN HA 1 1 5 3309 1 1 15 GLN HB2 H 4.412 2.180 3.130 1.00 . A A . 15 GLN HB2 1 1 5 3310 1 1 15 GLN HB3 H 2.678 2.498 3.042 1.00 . A A . 15 GLN HB3 1 1 5 3311 1 1 15 GLN HE21 H 4.208 3.996 7.206 1.00 . A A . 15 GLN HE21 1 1 5 3312 1 1 15 GLN HE22 H 5.776 3.361 7.349 1.00 . A A . 15 GLN HE22 1 1 5 3313 1 1 15 GLN HG2 H 3.707 4.306 4.281 1.00 . A A . 15 GLN HG2 1 1 5 3314 1 1 15 GLN HG3 H 2.781 3.323 5.416 1.00 . A A . 15 GLN HG3 1 1 5 3315 1 1 15 GLN N N 4.500 0.326 4.876 1.00 . A A . 15 GLN N 1 1 5 3316 1 1 15 GLN NE2 N 4.968 3.518 6.815 1.00 . A A . 15 GLN NE2 1 1 5 3317 1 1 15 GLN O O 1.408 -0.310 3.392 1.00 . A A . 15 GLN O 1 1 5 3318 1 1 15 GLN OE1 O 5.850 2.497 5.100 1.00 . A A . 15 GLN OE1 1 1 5 3319 1 1 16 LEU C C 2.187 -2.738 2.219 1.00 . A A . 16 LEU C 1 1 5 3320 1 1 16 LEU CA C 2.861 -1.568 1.503 1.00 . A A . 16 LEU CA 1 1 5 3321 1 1 16 LEU CB C 4.004 -2.093 0.649 1.00 . A A . 16 LEU CB 1 1 5 3322 1 1 16 LEU CD1 C 5.900 -0.574 0.096 1.00 . A A . 16 LEU CD1 1 1 5 3323 1 1 16 LEU CD2 C 4.462 -1.472 -1.714 1.00 . A A . 16 LEU CD2 1 1 5 3324 1 1 16 LEU CG C 4.481 -0.978 -0.274 1.00 . A A . 16 LEU CG 1 1 5 3325 1 1 16 LEU H H 4.354 -0.392 2.520 1.00 . A A . 16 LEU H 1 1 5 3326 1 1 16 LEU HA H 2.150 -1.067 0.869 1.00 . A A . 16 LEU HA 1 1 5 3327 1 1 16 LEU HB2 H 4.805 -2.410 1.289 1.00 . A A . 16 LEU HB2 1 1 5 3328 1 1 16 LEU HB3 H 3.664 -2.928 0.059 1.00 . A A . 16 LEU HB3 1 1 5 3329 1 1 16 LEU HD11 H 5.966 -0.442 1.165 1.00 . A A . 16 LEU HD11 1 1 5 3330 1 1 16 LEU HD12 H 6.150 0.350 -0.401 1.00 . A A . 16 LEU HD12 1 1 5 3331 1 1 16 LEU HD13 H 6.584 -1.350 -0.214 1.00 . A A . 16 LEU HD13 1 1 5 3332 1 1 16 LEU HD21 H 4.701 -2.525 -1.732 1.00 . A A . 16 LEU HD21 1 1 5 3333 1 1 16 LEU HD22 H 5.195 -0.926 -2.288 1.00 . A A . 16 LEU HD22 1 1 5 3334 1 1 16 LEU HD23 H 3.482 -1.315 -2.134 1.00 . A A . 16 LEU HD23 1 1 5 3335 1 1 16 LEU HG H 3.826 -0.125 -0.174 1.00 . A A . 16 LEU HG 1 1 5 3336 1 1 16 LEU N N 3.398 -0.608 2.508 1.00 . A A . 16 LEU N 1 1 5 3337 1 1 16 LEU O O 1.047 -3.067 1.962 1.00 . A A . 16 LEU O 1 1 5 3338 1 1 17 GLU C C 0.953 -4.151 4.455 1.00 . A A . 17 GLU C 1 1 5 3339 1 1 17 GLU CA C 2.310 -4.531 3.851 1.00 . A A . 17 GLU CA 1 1 5 3340 1 1 17 GLU CB C 3.259 -4.946 4.976 1.00 . A A . 17 GLU CB 1 1 5 3341 1 1 17 GLU CD C 4.544 -6.935 5.768 1.00 . A A . 17 GLU CD 1 1 5 3342 1 1 17 GLU CG C 4.075 -6.161 4.535 1.00 . A A . 17 GLU CG 1 1 5 3343 1 1 17 GLU H H 3.818 -3.091 3.297 1.00 . A A . 17 GLU H 1 1 5 3344 1 1 17 GLU HA H 2.177 -5.356 3.172 1.00 . A A . 17 GLU HA 1 1 5 3345 1 1 17 GLU HB2 H 3.926 -4.128 5.205 1.00 . A A . 17 GLU HB2 1 1 5 3346 1 1 17 GLU HB3 H 2.686 -5.201 5.855 1.00 . A A . 17 GLU HB3 1 1 5 3347 1 1 17 GLU HG2 H 3.462 -6.803 3.917 1.00 . A A . 17 GLU HG2 1 1 5 3348 1 1 17 GLU HG3 H 4.934 -5.833 3.971 1.00 . A A . 17 GLU HG3 1 1 5 3349 1 1 17 GLU N N 2.894 -3.373 3.115 1.00 . A A . 17 GLU N 1 1 5 3350 1 1 17 GLU O O 0.166 -5.005 4.811 1.00 . A A . 17 GLU O 1 1 5 3351 1 1 17 GLU OE1 O 3.780 -7.016 6.716 1.00 . A A . 17 GLU OE1 1 1 5 3352 1 1 17 GLU OE2 O 5.657 -7.433 5.743 1.00 . A A . 17 GLU OE2 1 1 5 3353 1 1 18 ASN C C -1.689 -2.333 4.085 1.00 . A A . 18 ASN C 1 1 5 3354 1 1 18 ASN CA C -0.628 -2.468 5.179 1.00 . A A . 18 ASN CA 1 1 5 3355 1 1 18 ASN CB C -0.457 -1.126 5.891 1.00 . A A . 18 ASN CB 1 1 5 3356 1 1 18 ASN CG C -0.435 -1.351 7.403 1.00 . A A . 18 ASN CG 1 1 5 3357 1 1 18 ASN H H 1.322 -2.206 4.302 1.00 . A A . 18 ASN H 1 1 5 3358 1 1 18 ASN HA H -0.948 -3.211 5.894 1.00 . A A . 18 ASN HA 1 1 5 3359 1 1 18 ASN HB2 H 0.472 -0.669 5.579 1.00 . A A . 18 ASN HB2 1 1 5 3360 1 1 18 ASN HB3 H -1.280 -0.475 5.637 1.00 . A A . 18 ASN HB3 1 1 5 3361 1 1 18 ASN HD21 H -1.029 0.495 7.829 1.00 . A A . 18 ASN HD21 1 1 5 3362 1 1 18 ASN HD22 H -0.759 -0.508 9.172 1.00 . A A . 18 ASN HD22 1 1 5 3363 1 1 18 ASN N N 0.674 -2.884 4.585 1.00 . A A . 18 ASN N 1 1 5 3364 1 1 18 ASN ND2 N -0.769 -0.373 8.201 1.00 . A A . 18 ASN ND2 1 1 5 3365 1 1 18 ASN O O -2.751 -1.785 4.305 1.00 . A A . 18 ASN O 1 1 5 3366 1 1 18 ASN OD1 O -0.113 -2.428 7.864 1.00 . A A . 18 ASN OD1 1 1 5 3367 1 1 19 TYR C C -2.484 -4.039 1.045 1.00 . A A . 19 TYR C 1 1 5 3368 1 1 19 TYR CA C -2.428 -2.721 1.816 1.00 . A A . 19 TYR CA 1 1 5 3369 1 1 19 TYR CB C -2.037 -1.585 0.867 1.00 . A A . 19 TYR CB 1 1 5 3370 1 1 19 TYR CD1 C -3.177 0.347 2.023 1.00 . A A . 19 TYR CD1 1 1 5 3371 1 1 19 TYR CD2 C -0.751 0.275 1.977 1.00 . A A . 19 TYR CD2 1 1 5 3372 1 1 19 TYR CE1 C -3.126 1.547 2.745 1.00 . A A . 19 TYR CE1 1 1 5 3373 1 1 19 TYR CE2 C -0.701 1.475 2.699 1.00 . A A . 19 TYR CE2 1 1 5 3374 1 1 19 TYR CG C -1.987 -0.289 1.639 1.00 . A A . 19 TYR CG 1 1 5 3375 1 1 19 TYR CZ C -1.890 2.110 3.083 1.00 . A A . 19 TYR CZ 1 1 5 3376 1 1 19 TYR H H -0.559 -3.270 2.744 1.00 . A A . 19 TYR H 1 1 5 3377 1 1 19 TYR HA H -3.397 -2.514 2.243 1.00 . A A . 19 TYR HA 1 1 5 3378 1 1 19 TYR HB2 H -1.065 -1.789 0.442 1.00 . A A . 19 TYR HB2 1 1 5 3379 1 1 19 TYR HB3 H -2.769 -1.507 0.077 1.00 . A A . 19 TYR HB3 1 1 5 3380 1 1 19 TYR HD1 H -4.130 -0.087 1.761 1.00 . A A . 19 TYR HD1 1 1 5 3381 1 1 19 TYR HD2 H 0.165 -0.213 1.680 1.00 . A A . 19 TYR HD2 1 1 5 3382 1 1 19 TYR HE1 H -4.042 2.036 3.042 1.00 . A A . 19 TYR HE1 1 1 5 3383 1 1 19 TYR HE2 H 0.252 1.908 2.960 1.00 . A A . 19 TYR HE2 1 1 5 3384 1 1 19 TYR HH H -0.979 3.348 4.215 1.00 . A A . 19 TYR HH 1 1 5 3385 1 1 19 TYR N N -1.420 -2.828 2.909 1.00 . A A . 19 TYR N 1 1 5 3386 1 1 19 TYR O O -2.481 -4.059 -0.170 1.00 . A A . 19 TYR O 1 1 5 3387 1 1 19 TYR OH O -1.841 3.292 3.795 1.00 . A A . 19 TYR OH 1 1 5 3388 1 1 20 CYS C C -2.871 -7.571 2.059 1.00 . A A . 20 CYS C 1 1 5 3389 1 1 20 CYS CA C -2.590 -6.458 1.045 1.00 . A A . 20 CYS CA 1 1 5 3390 1 1 20 CYS CB C -1.249 -6.724 0.362 1.00 . A A . 20 CYS CB 1 1 5 3391 1 1 20 CYS H H -2.534 -5.104 2.721 1.00 . A A . 20 CYS H 1 1 5 3392 1 1 20 CYS HA H -3.374 -6.441 0.302 1.00 . A A . 20 CYS HA 1 1 5 3393 1 1 20 CYS HB2 H -1.090 -5.992 -0.415 1.00 . A A . 20 CYS HB2 1 1 5 3394 1 1 20 CYS HB3 H -0.454 -6.654 1.091 1.00 . A A . 20 CYS HB3 1 1 5 3395 1 1 20 CYS N N -2.535 -5.142 1.742 1.00 . A A . 20 CYS N 1 1 5 3396 1 1 20 CYS O O -2.656 -7.412 3.244 1.00 . A A . 20 CYS O 1 1 5 3397 1 1 20 CYS SG S -1.261 -8.383 -0.360 1.00 . A A . 20 CYS SG 1 1 5 3398 1 1 21 ASN C C -2.322 -10.381 3.087 1.00 . A A . 21 ASN C 1 1 5 3399 1 1 21 ASN CA C -3.636 -9.821 2.538 1.00 . A A . 21 ASN CA 1 1 5 3400 1 1 21 ASN CB C -4.387 -10.927 1.795 1.00 . A A . 21 ASN CB 1 1 5 3401 1 1 21 ASN CG C -5.380 -11.597 2.746 1.00 . A A . 21 ASN CG 1 1 5 3402 1 1 21 ASN H H -3.511 -8.806 0.641 1.00 . A A . 21 ASN H 1 1 5 3403 1 1 21 ASN HA H -4.244 -9.459 3.354 1.00 . A A . 21 ASN HA 1 1 5 3404 1 1 21 ASN HB2 H -4.920 -10.500 0.957 1.00 . A A . 21 ASN HB2 1 1 5 3405 1 1 21 ASN HB3 H -3.683 -11.662 1.436 1.00 . A A . 21 ASN HB3 1 1 5 3406 1 1 21 ASN HD21 H -5.630 -13.193 1.593 1.00 . A A . 21 ASN HD21 1 1 5 3407 1 1 21 ASN HD22 H -6.523 -13.194 3.036 1.00 . A A . 21 ASN HD22 1 1 5 3408 1 1 21 ASN N N -3.347 -8.698 1.601 1.00 . A A . 21 ASN N 1 1 5 3409 1 1 21 ASN ND2 N -5.886 -12.758 2.432 1.00 . A A . 21 ASN ND2 1 1 5 3410 1 1 21 ASN O O -1.531 -10.865 2.296 1.00 . A A . 21 ASN O 1 1 5 3411 1 1 21 ASN OXT O -2.131 -10.317 4.291 1.00 . A A . 21 ASN OXT 1 1 5 3412 1 1 21 ASN OD1 O -5.698 -11.058 3.788 1.00 . A A . 21 ASN OD1 1 1 5 3413 2 2 1 PHE C C 13.639 -1.374 -0.587 1.00 . B B . 1 PHE C 1 1 5 3414 2 2 1 PHE CA C 12.748 -2.604 -0.771 1.00 . B B . 1 PHE CA 1 1 5 3415 2 2 1 PHE CB C 11.329 -2.155 -1.128 1.00 . B B . 1 PHE CB 1 1 5 3416 2 2 1 PHE CD1 C 11.697 -2.748 -3.552 1.00 . B B . 1 PHE CD1 1 1 5 3417 2 2 1 PHE CD2 C 9.678 -3.526 -2.452 1.00 . B B . 1 PHE CD2 1 1 5 3418 2 2 1 PHE CE1 C 11.289 -3.369 -4.739 1.00 . B B . 1 PHE CE1 1 1 5 3419 2 2 1 PHE CE2 C 9.270 -4.146 -3.640 1.00 . B B . 1 PHE CE2 1 1 5 3420 2 2 1 PHE CG C 10.892 -2.826 -2.408 1.00 . B B . 1 PHE CG 1 1 5 3421 2 2 1 PHE CZ C 10.076 -4.068 -4.784 1.00 . B B . 1 PHE CZ 1 1 5 3422 2 2 1 PHE H1 H 13.578 -3.967 0.566 1.00 . B B . 1 PHE H1 1 1 5 3423 2 2 1 PHE H2 H 11.880 -3.997 0.510 1.00 . B B . 1 PHE H2 1 1 5 3424 2 2 1 PHE H3 H 12.685 -2.730 1.305 1.00 . B B . 1 PHE H3 1 1 5 3425 2 2 1 PHE HA H 13.144 -3.221 -1.564 1.00 . B B . 1 PHE HA 1 1 5 3426 2 2 1 PHE HB2 H 10.654 -2.427 -0.330 1.00 . B B . 1 PHE HB2 1 1 5 3427 2 2 1 PHE HB3 H 11.313 -1.084 -1.262 1.00 . B B . 1 PHE HB3 1 1 5 3428 2 2 1 PHE HD1 H 12.632 -2.209 -3.517 1.00 . B B . 1 PHE HD1 1 1 5 3429 2 2 1 PHE HD2 H 9.057 -3.587 -1.571 1.00 . B B . 1 PHE HD2 1 1 5 3430 2 2 1 PHE HE1 H 11.910 -3.309 -5.621 1.00 . B B . 1 PHE HE1 1 1 5 3431 2 2 1 PHE HE2 H 8.334 -4.686 -3.675 1.00 . B B . 1 PHE HE2 1 1 5 3432 2 2 1 PHE HZ H 9.761 -4.547 -5.700 1.00 . B B . 1 PHE HZ 1 1 5 3433 2 2 1 PHE N N 12.721 -3.384 0.498 1.00 . B B . 1 PHE N 1 1 5 3434 2 2 1 PHE O O 14.407 -1.285 0.351 1.00 . B B . 1 PHE O 1 1 5 3435 2 2 2 VAL C C 13.538 1.938 -0.756 1.00 . B B . 2 VAL C 1 1 5 3436 2 2 2 VAL CA C 14.377 0.803 -1.351 1.00 . B B . 2 VAL CA 1 1 5 3437 2 2 2 VAL CB C 14.886 1.215 -2.733 1.00 . B B . 2 VAL CB 1 1 5 3438 2 2 2 VAL CG1 C 16.062 2.180 -2.575 1.00 . B B . 2 VAL CG1 1 1 5 3439 2 2 2 VAL CG2 C 15.348 -0.028 -3.498 1.00 . B B . 2 VAL CG2 1 1 5 3440 2 2 2 VAL H H 12.913 -0.514 -2.221 1.00 . B B . 2 VAL H 1 1 5 3441 2 2 2 VAL HA H 15.218 0.600 -0.704 1.00 . B B . 2 VAL HA 1 1 5 3442 2 2 2 VAL HB H 14.091 1.702 -3.278 1.00 . B B . 2 VAL HB 1 1 5 3443 2 2 2 VAL HG11 H 16.913 1.647 -2.178 1.00 . B B . 2 VAL HG11 1 1 5 3444 2 2 2 VAL HG12 H 15.787 2.976 -1.899 1.00 . B B . 2 VAL HG12 1 1 5 3445 2 2 2 VAL HG13 H 16.314 2.598 -3.538 1.00 . B B . 2 VAL HG13 1 1 5 3446 2 2 2 VAL HG21 H 14.592 -0.311 -4.215 1.00 . B B . 2 VAL HG21 1 1 5 3447 2 2 2 VAL HG22 H 15.508 -0.839 -2.804 1.00 . B B . 2 VAL HG22 1 1 5 3448 2 2 2 VAL HG23 H 16.271 0.191 -4.015 1.00 . B B . 2 VAL HG23 1 1 5 3449 2 2 2 VAL N N 13.541 -0.423 -1.474 1.00 . B B . 2 VAL N 1 1 5 3450 2 2 2 VAL O O 14.044 2.998 -0.444 1.00 . B B . 2 VAL O 1 1 5 3451 2 2 3 ASN C C 11.440 4.025 -0.930 1.00 . B B . 3 ASN C 1 1 5 3452 2 2 3 ASN CA C 11.391 2.793 -0.024 1.00 . B B . 3 ASN CA 1 1 5 3453 2 2 3 ASN CB C 11.881 3.172 1.381 1.00 . B B . 3 ASN CB 1 1 5 3454 2 2 3 ASN CG C 12.738 2.042 1.962 1.00 . B B . 3 ASN CG 1 1 5 3455 2 2 3 ASN H H 11.872 0.863 -0.855 1.00 . B B . 3 ASN H 1 1 5 3456 2 2 3 ASN HA H 10.374 2.434 0.036 1.00 . B B . 3 ASN HA 1 1 5 3457 2 2 3 ASN HB2 H 12.472 4.075 1.322 1.00 . B B . 3 ASN HB2 1 1 5 3458 2 2 3 ASN HB3 H 11.030 3.342 2.024 1.00 . B B . 3 ASN HB3 1 1 5 3459 2 2 3 ASN HD21 H 14.461 2.921 1.516 1.00 . B B . 3 ASN HD21 1 1 5 3460 2 2 3 ASN HD22 H 14.593 1.414 2.286 1.00 . B B . 3 ASN HD22 1 1 5 3461 2 2 3 ASN N N 12.260 1.724 -0.597 1.00 . B B . 3 ASN N 1 1 5 3462 2 2 3 ASN ND2 N 14.038 2.133 1.917 1.00 . B B . 3 ASN ND2 1 1 5 3463 2 2 3 ASN O O 11.814 5.102 -0.510 1.00 . B B . 3 ASN O 1 1 5 3464 2 2 3 ASN OD1 O 12.215 1.065 2.461 1.00 . B B . 3 ASN OD1 1 1 5 3465 2 2 4 GLN C C 9.692 5.606 -3.279 1.00 . B B . 4 GLN C 1 1 5 3466 2 2 4 GLN CA C 11.105 5.029 -3.112 1.00 . B B . 4 GLN CA 1 1 5 3467 2 2 4 GLN CB C 11.634 4.558 -4.469 1.00 . B B . 4 GLN CB 1 1 5 3468 2 2 4 GLN CD C 13.948 5.389 -4.926 1.00 . B B . 4 GLN CD 1 1 5 3469 2 2 4 GLN CG C 12.456 5.675 -5.115 1.00 . B B . 4 GLN CG 1 1 5 3470 2 2 4 GLN H H 10.780 2.992 -2.492 1.00 . B B . 4 GLN H 1 1 5 3471 2 2 4 GLN HA H 11.760 5.791 -2.718 1.00 . B B . 4 GLN HA 1 1 5 3472 2 2 4 GLN HB2 H 12.257 3.685 -4.331 1.00 . B B . 4 GLN HB2 1 1 5 3473 2 2 4 GLN HB3 H 10.803 4.307 -5.113 1.00 . B B . 4 GLN HB3 1 1 5 3474 2 2 4 GLN HE21 H 13.842 5.387 -2.943 1.00 . B B . 4 GLN HE21 1 1 5 3475 2 2 4 GLN HE22 H 15.386 5.100 -3.589 1.00 . B B . 4 GLN HE22 1 1 5 3476 2 2 4 GLN HG2 H 12.229 5.723 -6.171 1.00 . B B . 4 GLN HG2 1 1 5 3477 2 2 4 GLN HG3 H 12.210 6.617 -4.650 1.00 . B B . 4 GLN HG3 1 1 5 3478 2 2 4 GLN N N 11.073 3.871 -2.173 1.00 . B B . 4 GLN N 1 1 5 3479 2 2 4 GLN NE2 N 14.432 5.283 -3.719 1.00 . B B . 4 GLN NE2 1 1 5 3480 2 2 4 GLN O O 8.903 5.627 -2.349 1.00 . B B . 4 GLN O 1 1 5 3481 2 2 4 GLN OE1 O 14.680 5.262 -5.888 1.00 . B B . 4 GLN OE1 1 1 5 3482 2 2 5 HIS C C 7.164 5.618 -5.446 1.00 . B B . 5 HIS C 1 1 5 3483 2 2 5 HIS CA C 8.015 6.647 -4.701 1.00 . B B . 5 HIS CA 1 1 5 3484 2 2 5 HIS CB C 8.138 7.911 -5.557 1.00 . B B . 5 HIS CB 1 1 5 3485 2 2 5 HIS CD2 C 10.117 9.406 -4.721 1.00 . B B . 5 HIS CD2 1 1 5 3486 2 2 5 HIS CE1 C 8.972 10.686 -3.390 1.00 . B B . 5 HIS CE1 1 1 5 3487 2 2 5 HIS CG C 8.809 9.003 -4.768 1.00 . B B . 5 HIS CG 1 1 5 3488 2 2 5 HIS H H 10.020 6.044 -5.193 1.00 . B B . 5 HIS H 1 1 5 3489 2 2 5 HIS HA H 7.550 6.890 -3.758 1.00 . B B . 5 HIS HA 1 1 5 3490 2 2 5 HIS HB2 H 8.722 7.693 -6.437 1.00 . B B . 5 HIS HB2 1 1 5 3491 2 2 5 HIS HB3 H 7.151 8.239 -5.853 1.00 . B B . 5 HIS HB3 1 1 5 3492 2 2 5 HIS HD2 H 10.932 8.962 -5.273 1.00 . B B . 5 HIS HD2 1 1 5 3493 2 2 5 HIS HE1 H 8.711 11.459 -2.683 1.00 . B B . 5 HIS HE1 1 1 5 3494 2 2 5 HIS HE2 H 11.032 10.969 -3.618 1.00 . B B . 5 HIS HE2 1 1 5 3495 2 2 5 HIS N N 9.370 6.073 -4.461 1.00 . B B . 5 HIS N 1 1 5 3496 2 2 5 HIS ND1 N 8.095 9.821 -3.920 1.00 . B B . 5 HIS ND1 1 1 5 3497 2 2 5 HIS NE2 N 10.221 10.472 -3.851 1.00 . B B . 5 HIS NE2 1 1 5 3498 2 2 5 HIS O O 7.536 5.136 -6.496 1.00 . B B . 5 HIS O 1 1 5 3499 2 2 6 LEU C C 4.032 5.005 -6.336 1.00 . B B . 6 LEU C 1 1 5 3500 2 2 6 LEU CA C 5.154 4.279 -5.593 1.00 . B B . 6 LEU CA 1 1 5 3501 2 2 6 LEU CB C 4.563 3.338 -4.544 1.00 . B B . 6 LEU CB 1 1 5 3502 2 2 6 LEU CD1 C 5.142 1.836 -2.635 1.00 . B B . 6 LEU CD1 1 1 5 3503 2 2 6 LEU CD2 C 6.908 2.525 -4.262 1.00 . B B . 6 LEU CD2 1 1 5 3504 2 2 6 LEU CG C 5.643 2.974 -3.524 1.00 . B B . 6 LEU CG 1 1 5 3505 2 2 6 LEU H H 5.739 5.677 -4.067 1.00 . B B . 6 LEU H 1 1 5 3506 2 2 6 LEU HA H 5.741 3.709 -6.298 1.00 . B B . 6 LEU HA 1 1 5 3507 2 2 6 LEU HB2 H 3.743 3.828 -4.042 1.00 . B B . 6 LEU HB2 1 1 5 3508 2 2 6 LEU HB3 H 4.209 2.440 -5.023 1.00 . B B . 6 LEU HB3 1 1 5 3509 2 2 6 LEU HD11 H 5.642 0.918 -2.908 1.00 . B B . 6 LEU HD11 1 1 5 3510 2 2 6 LEU HD12 H 4.076 1.718 -2.768 1.00 . B B . 6 LEU HD12 1 1 5 3511 2 2 6 LEU HD13 H 5.352 2.066 -1.601 1.00 . B B . 6 LEU HD13 1 1 5 3512 2 2 6 LEU HD21 H 6.635 2.076 -5.205 1.00 . B B . 6 LEU HD21 1 1 5 3513 2 2 6 LEU HD22 H 7.440 1.803 -3.660 1.00 . B B . 6 LEU HD22 1 1 5 3514 2 2 6 LEU HD23 H 7.543 3.380 -4.442 1.00 . B B . 6 LEU HD23 1 1 5 3515 2 2 6 LEU HG H 5.867 3.837 -2.913 1.00 . B B . 6 LEU HG 1 1 5 3516 2 2 6 LEU N N 6.024 5.277 -4.913 1.00 . B B . 6 LEU N 1 1 5 3517 2 2 6 LEU O O 3.094 5.495 -5.737 1.00 . B B . 6 LEU O 1 1 5 3518 2 2 7 CYS C C 2.456 4.872 -9.465 1.00 . B B . 7 CYS C 1 1 5 3519 2 2 7 CYS CA C 3.066 5.801 -8.409 1.00 . B B . 7 CYS CA 1 1 5 3520 2 2 7 CYS CB C 3.678 7.014 -9.111 1.00 . B B . 7 CYS CB 1 1 5 3521 2 2 7 CYS H H 4.893 4.701 -8.101 1.00 . B B . 7 CYS H 1 1 5 3522 2 2 7 CYS HA H 2.294 6.134 -7.731 1.00 . B B . 7 CYS HA 1 1 5 3523 2 2 7 CYS HB2 H 4.467 6.686 -9.770 1.00 . B B . 7 CYS HB2 1 1 5 3524 2 2 7 CYS HB3 H 2.916 7.519 -9.686 1.00 . B B . 7 CYS HB3 1 1 5 3525 2 2 7 CYS N N 4.124 5.092 -7.637 1.00 . B B . 7 CYS N 1 1 5 3526 2 2 7 CYS O O 3.153 4.259 -10.250 1.00 . B B . 7 CYS O 1 1 5 3527 2 2 7 CYS SG S 4.356 8.151 -7.878 1.00 . B B . 7 CYS SG 1 1 5 3528 2 2 8 GLY C C 1.242 2.632 -10.757 1.00 . B B . 8 GLY C 1 1 5 3529 2 2 8 GLY CA C 0.463 3.929 -10.511 1.00 . B B . 8 GLY CA 1 1 5 3530 2 2 8 GLY H H 0.619 5.310 -8.864 1.00 . B B . 8 GLY H 1 1 5 3531 2 2 8 GLY HA2 H -0.526 3.686 -10.152 1.00 . B B . 8 GLY HA2 1 1 5 3532 2 2 8 GLY HA3 H 0.380 4.473 -11.440 1.00 . B B . 8 GLY HA3 1 1 5 3533 2 2 8 GLY N N 1.152 4.788 -9.500 1.00 . B B . 8 GLY N 1 1 5 3534 2 2 8 GLY O O 1.459 1.846 -9.859 1.00 . B B . 8 GLY O 1 1 5 3535 2 2 9 SER C C 3.350 0.776 -11.191 1.00 . B B . 9 SER C 1 1 5 3536 2 2 9 SER CA C 2.389 1.150 -12.320 1.00 . B B . 9 SER CA 1 1 5 3537 2 2 9 SER CB C 3.184 1.366 -13.609 1.00 . B B . 9 SER CB 1 1 5 3538 2 2 9 SER H H 1.437 3.049 -12.688 1.00 . B B . 9 SER H 1 1 5 3539 2 2 9 SER HA H 1.685 0.346 -12.469 1.00 . B B . 9 SER HA 1 1 5 3540 2 2 9 SER HB2 H 4.209 1.073 -13.455 1.00 . B B . 9 SER HB2 1 1 5 3541 2 2 9 SER HB3 H 2.756 0.763 -14.399 1.00 . B B . 9 SER HB3 1 1 5 3542 2 2 9 SER HG H 3.909 3.171 -13.590 1.00 . B B . 9 SER HG 1 1 5 3543 2 2 9 SER N N 1.642 2.401 -11.982 1.00 . B B . 9 SER N 1 1 5 3544 2 2 9 SER O O 3.203 -0.248 -10.554 1.00 . B B . 9 SER O 1 1 5 3545 2 2 9 SER OG O 3.138 2.742 -13.966 1.00 . B B . 9 SER OG 1 1 5 3546 2 2 10 ASP C C 4.500 0.865 -8.611 1.00 . B B . 10 ASP C 1 1 5 3547 2 2 10 ASP CA C 5.292 1.270 -9.842 1.00 . B B . 10 ASP CA 1 1 5 3548 2 2 10 ASP CB C 6.123 2.507 -9.513 1.00 . B B . 10 ASP CB 1 1 5 3549 2 2 10 ASP CG C 6.884 2.959 -10.761 1.00 . B B . 10 ASP CG 1 1 5 3550 2 2 10 ASP H H 4.437 2.416 -11.449 1.00 . B B . 10 ASP H 1 1 5 3551 2 2 10 ASP HA H 5.936 0.459 -10.147 1.00 . B B . 10 ASP HA 1 1 5 3552 2 2 10 ASP HB2 H 5.465 3.299 -9.176 1.00 . B B . 10 ASP HB2 1 1 5 3553 2 2 10 ASP HB3 H 6.828 2.268 -8.731 1.00 . B B . 10 ASP HB3 1 1 5 3554 2 2 10 ASP N N 4.332 1.593 -10.932 1.00 . B B . 10 ASP N 1 1 5 3555 2 2 10 ASP O O 4.799 -0.110 -7.950 1.00 . B B . 10 ASP O 1 1 5 3556 2 2 10 ASP OD1 O 7.136 2.122 -11.612 1.00 . B B . 10 ASP OD1 1 1 5 3557 2 2 10 ASP OD2 O 7.199 4.134 -10.844 1.00 . B B . 10 ASP OD2 1 1 5 3558 2 2 11 LEU C C 2.315 -0.200 -7.170 1.00 . B B . 11 LEU C 1 1 5 3559 2 2 11 LEU CA C 2.648 1.287 -7.127 1.00 . B B . 11 LEU CA 1 1 5 3560 2 2 11 LEU CB C 1.363 2.115 -7.196 1.00 . B B . 11 LEU CB 1 1 5 3561 2 2 11 LEU CD1 C 1.588 2.017 -4.664 1.00 . B B . 11 LEU CD1 1 1 5 3562 2 2 11 LEU CD2 C -0.088 3.508 -5.739 1.00 . B B . 11 LEU CD2 1 1 5 3563 2 2 11 LEU CG C 0.623 2.161 -5.846 1.00 . B B . 11 LEU CG 1 1 5 3564 2 2 11 LEU H H 3.263 2.387 -8.865 1.00 . B B . 11 LEU H 1 1 5 3565 2 2 11 LEU HA H 3.195 1.516 -6.235 1.00 . B B . 11 LEU HA 1 1 5 3566 2 2 11 LEU HB2 H 1.612 3.121 -7.494 1.00 . B B . 11 LEU HB2 1 1 5 3567 2 2 11 LEU HB3 H 0.710 1.679 -7.937 1.00 . B B . 11 LEU HB3 1 1 5 3568 2 2 11 LEU HD11 H 2.129 1.089 -4.749 1.00 . B B . 11 LEU HD11 1 1 5 3569 2 2 11 LEU HD12 H 1.024 2.021 -3.740 1.00 . B B . 11 LEU HD12 1 1 5 3570 2 2 11 LEU HD13 H 2.282 2.844 -4.663 1.00 . B B . 11 LEU HD13 1 1 5 3571 2 2 11 LEU HD21 H -0.986 3.489 -6.338 1.00 . B B . 11 LEU HD21 1 1 5 3572 2 2 11 LEU HD22 H 0.570 4.286 -6.100 1.00 . B B . 11 LEU HD22 1 1 5 3573 2 2 11 LEU HD23 H -0.341 3.699 -4.709 1.00 . B B . 11 LEU HD23 1 1 5 3574 2 2 11 LEU HG H -0.108 1.368 -5.811 1.00 . B B . 11 LEU HG 1 1 5 3575 2 2 11 LEU N N 3.482 1.611 -8.308 1.00 . B B . 11 LEU N 1 1 5 3576 2 2 11 LEU O O 2.668 -0.953 -6.285 1.00 . B B . 11 LEU O 1 1 5 3577 2 2 12 ALA C C 2.629 -2.861 -8.383 1.00 . B B . 12 ALA C 1 1 5 3578 2 2 12 ALA CA C 1.326 -2.073 -8.321 1.00 . B B . 12 ALA CA 1 1 5 3579 2 2 12 ALA CB C 0.517 -2.325 -9.594 1.00 . B B . 12 ALA CB 1 1 5 3580 2 2 12 ALA H H 1.397 -0.009 -8.920 1.00 . B B . 12 ALA H 1 1 5 3581 2 2 12 ALA HA H 0.753 -2.385 -7.458 1.00 . B B . 12 ALA HA 1 1 5 3582 2 2 12 ALA HB1 H 0.985 -1.816 -10.423 1.00 . B B . 12 ALA HB1 1 1 5 3583 2 2 12 ALA HB2 H -0.488 -1.954 -9.461 1.00 . B B . 12 ALA HB2 1 1 5 3584 2 2 12 ALA HB3 H 0.485 -3.387 -9.795 1.00 . B B . 12 ALA HB3 1 1 5 3585 2 2 12 ALA N N 1.656 -0.631 -8.209 1.00 . B B . 12 ALA N 1 1 5 3586 2 2 12 ALA O O 2.855 -3.755 -7.600 1.00 . B B . 12 ALA O 1 1 5 3587 2 2 13 GLU C C 5.376 -3.422 -7.999 1.00 . B B . 13 GLU C 1 1 5 3588 2 2 13 GLU CA C 4.790 -3.258 -9.399 1.00 . B B . 13 GLU CA 1 1 5 3589 2 2 13 GLU CB C 5.765 -2.468 -10.275 1.00 . B B . 13 GLU CB 1 1 5 3590 2 2 13 GLU CD C 6.840 -2.522 -12.529 1.00 . B B . 13 GLU CD 1 1 5 3591 2 2 13 GLU CG C 5.582 -2.877 -11.737 1.00 . B B . 13 GLU CG 1 1 5 3592 2 2 13 GLU H H 3.303 -1.788 -9.919 1.00 . B B . 13 GLU H 1 1 5 3593 2 2 13 GLU HA H 4.621 -4.233 -9.834 1.00 . B B . 13 GLU HA 1 1 5 3594 2 2 13 GLU HB2 H 5.570 -1.411 -10.168 1.00 . B B . 13 GLU HB2 1 1 5 3595 2 2 13 GLU HB3 H 6.778 -2.681 -9.969 1.00 . B B . 13 GLU HB3 1 1 5 3596 2 2 13 GLU HG2 H 5.408 -3.942 -11.793 1.00 . B B . 13 GLU HG2 1 1 5 3597 2 2 13 GLU HG3 H 4.734 -2.353 -12.156 1.00 . B B . 13 GLU HG3 1 1 5 3598 2 2 13 GLU N N 3.498 -2.526 -9.302 1.00 . B B . 13 GLU N 1 1 5 3599 2 2 13 GLU O O 5.995 -4.420 -7.689 1.00 . B B . 13 GLU O 1 1 5 3600 2 2 13 GLU OE1 O 7.922 -2.691 -11.990 1.00 . B B . 13 GLU OE1 1 1 5 3601 2 2 13 GLU OE2 O 6.703 -2.089 -13.662 1.00 . B B . 13 GLU OE2 1 1 5 3602 2 2 14 ALA C C 4.888 -3.596 -4.993 1.00 . B B . 14 ALA C 1 1 5 3603 2 2 14 ALA CA C 5.719 -2.573 -5.763 1.00 . B B . 14 ALA CA 1 1 5 3604 2 2 14 ALA CB C 5.646 -1.215 -5.063 1.00 . B B . 14 ALA CB 1 1 5 3605 2 2 14 ALA H H 4.667 -1.658 -7.409 1.00 . B B . 14 ALA H 1 1 5 3606 2 2 14 ALA HA H 6.750 -2.907 -5.804 1.00 . B B . 14 ALA HA 1 1 5 3607 2 2 14 ALA HB1 H 4.619 -0.994 -4.814 1.00 . B B . 14 ALA HB1 1 1 5 3608 2 2 14 ALA HB2 H 6.029 -0.450 -5.722 1.00 . B B . 14 ALA HB2 1 1 5 3609 2 2 14 ALA HB3 H 6.237 -1.242 -4.160 1.00 . B B . 14 ALA HB3 1 1 5 3610 2 2 14 ALA N N 5.179 -2.456 -7.145 1.00 . B B . 14 ALA N 1 1 5 3611 2 2 14 ALA O O 5.409 -4.557 -4.464 1.00 . B B . 14 ALA O 1 1 5 3612 2 2 15 LEU C C 2.845 -5.744 -4.939 1.00 . B B . 15 LEU C 1 1 5 3613 2 2 15 LEU CA C 2.747 -4.399 -4.214 1.00 . B B . 15 LEU CA 1 1 5 3614 2 2 15 LEU CB C 1.286 -3.937 -4.223 1.00 . B B . 15 LEU CB 1 1 5 3615 2 2 15 LEU CD1 C -0.290 -2.131 -3.534 1.00 . B B . 15 LEU CD1 1 1 5 3616 2 2 15 LEU CD2 C 1.278 -3.109 -1.866 1.00 . B B . 15 LEU CD2 1 1 5 3617 2 2 15 LEU CG C 1.112 -2.707 -3.332 1.00 . B B . 15 LEU CG 1 1 5 3618 2 2 15 LEU H H 3.182 -2.642 -5.388 1.00 . B B . 15 LEU H 1 1 5 3619 2 2 15 LEU HA H 3.098 -4.496 -3.193 1.00 . B B . 15 LEU HA 1 1 5 3620 2 2 15 LEU HB2 H 0.996 -3.689 -5.234 1.00 . B B . 15 LEU HB2 1 1 5 3621 2 2 15 LEU HB3 H 0.656 -4.734 -3.858 1.00 . B B . 15 LEU HB3 1 1 5 3622 2 2 15 LEU HD11 H -0.929 -2.447 -2.722 1.00 . B B . 15 LEU HD11 1 1 5 3623 2 2 15 LEU HD12 H -0.695 -2.490 -4.469 1.00 . B B . 15 LEU HD12 1 1 5 3624 2 2 15 LEU HD13 H -0.238 -1.053 -3.555 1.00 . B B . 15 LEU HD13 1 1 5 3625 2 2 15 LEU HD21 H 1.795 -2.324 -1.335 1.00 . B B . 15 LEU HD21 1 1 5 3626 2 2 15 LEU HD22 H 1.849 -4.024 -1.807 1.00 . B B . 15 LEU HD22 1 1 5 3627 2 2 15 LEU HD23 H 0.305 -3.262 -1.425 1.00 . B B . 15 LEU HD23 1 1 5 3628 2 2 15 LEU HG H 1.851 -1.963 -3.592 1.00 . B B . 15 LEU HG 1 1 5 3629 2 2 15 LEU N N 3.594 -3.414 -4.940 1.00 . B B . 15 LEU N 1 1 5 3630 2 2 15 LEU O O 2.699 -6.799 -4.353 1.00 . B B . 15 LEU O 1 1 5 3631 2 2 16 TYR C C 4.436 -7.723 -6.627 1.00 . B B . 16 TYR C 1 1 5 3632 2 2 16 TYR CA C 3.190 -6.943 -7.032 1.00 . B B . 16 TYR CA 1 1 5 3633 2 2 16 TYR CB C 3.316 -6.562 -8.510 1.00 . B B . 16 TYR CB 1 1 5 3634 2 2 16 TYR CD1 C 2.242 -8.747 -9.148 1.00 . B B . 16 TYR CD1 1 1 5 3635 2 2 16 TYR CD2 C 1.532 -6.718 -10.271 1.00 . B B . 16 TYR CD2 1 1 5 3636 2 2 16 TYR CE1 C 1.330 -9.489 -9.911 1.00 . B B . 16 TYR CE1 1 1 5 3637 2 2 16 TYR CE2 C 0.621 -7.457 -11.036 1.00 . B B . 16 TYR CE2 1 1 5 3638 2 2 16 TYR CG C 2.340 -7.363 -9.328 1.00 . B B . 16 TYR CG 1 1 5 3639 2 2 16 TYR CZ C 0.519 -8.843 -10.856 1.00 . B B . 16 TYR CZ 1 1 5 3640 2 2 16 TYR H H 3.189 -4.827 -6.659 1.00 . B B . 16 TYR H 1 1 5 3641 2 2 16 TYR HA H 2.312 -7.551 -6.886 1.00 . B B . 16 TYR HA 1 1 5 3642 2 2 16 TYR HB2 H 3.105 -5.512 -8.631 1.00 . B B . 16 TYR HB2 1 1 5 3643 2 2 16 TYR HB3 H 4.320 -6.764 -8.849 1.00 . B B . 16 TYR HB3 1 1 5 3644 2 2 16 TYR HD1 H 2.870 -9.242 -8.419 1.00 . B B . 16 TYR HD1 1 1 5 3645 2 2 16 TYR HD2 H 1.615 -5.649 -10.410 1.00 . B B . 16 TYR HD2 1 1 5 3646 2 2 16 TYR HE1 H 1.252 -10.556 -9.773 1.00 . B B . 16 TYR HE1 1 1 5 3647 2 2 16 TYR HE2 H -0.003 -6.957 -11.763 1.00 . B B . 16 TYR HE2 1 1 5 3648 2 2 16 TYR HH H -0.547 -10.400 -11.153 1.00 . B B . 16 TYR HH 1 1 5 3649 2 2 16 TYR N N 3.084 -5.696 -6.221 1.00 . B B . 16 TYR N 1 1 5 3650 2 2 16 TYR O O 4.493 -8.930 -6.747 1.00 . B B . 16 TYR O 1 1 5 3651 2 2 16 TYR OH O -0.378 -9.572 -11.610 1.00 . B B . 16 TYR OH 1 1 5 3652 2 2 17 LEU C C 6.721 -7.988 -4.294 1.00 . B B . 17 LEU C 1 1 5 3653 2 2 17 LEU CA C 6.696 -7.725 -5.805 1.00 . B B . 17 LEU CA 1 1 5 3654 2 2 17 LEU CB C 7.849 -6.822 -6.217 1.00 . B B . 17 LEU CB 1 1 5 3655 2 2 17 LEU CD1 C 9.121 -8.993 -6.085 1.00 . B B . 17 LEU CD1 1 1 5 3656 2 2 17 LEU CD2 C 10.239 -6.895 -6.810 1.00 . B B . 17 LEU CD2 1 1 5 3657 2 2 17 LEU CG C 9.181 -7.471 -5.880 1.00 . B B . 17 LEU CG 1 1 5 3658 2 2 17 LEU H H 5.394 -6.066 -6.112 1.00 . B B . 17 LEU H 1 1 5 3659 2 2 17 LEU HA H 6.774 -8.660 -6.338 1.00 . B B . 17 LEU HA 1 1 5 3660 2 2 17 LEU HB2 H 7.799 -6.643 -7.281 1.00 . B B . 17 LEU HB2 1 1 5 3661 2 2 17 LEU HB3 H 7.770 -5.882 -5.693 1.00 . B B . 17 LEU HB3 1 1 5 3662 2 2 17 LEU HD11 H 8.284 -9.403 -5.543 1.00 . B B . 17 LEU HD11 1 1 5 3663 2 2 17 LEU HD12 H 10.035 -9.440 -5.724 1.00 . B B . 17 LEU HD12 1 1 5 3664 2 2 17 LEU HD13 H 9.007 -9.209 -7.137 1.00 . B B . 17 LEU HD13 1 1 5 3665 2 2 17 LEU HD21 H 10.864 -7.694 -7.179 1.00 . B B . 17 LEU HD21 1 1 5 3666 2 2 17 LEU HD22 H 10.840 -6.179 -6.272 1.00 . B B . 17 LEU HD22 1 1 5 3667 2 2 17 LEU HD23 H 9.751 -6.407 -7.642 1.00 . B B . 17 LEU HD23 1 1 5 3668 2 2 17 LEU HG H 9.429 -7.243 -4.860 1.00 . B B . 17 LEU HG 1 1 5 3669 2 2 17 LEU N N 5.447 -7.040 -6.180 1.00 . B B . 17 LEU N 1 1 5 3670 2 2 17 LEU O O 7.637 -8.592 -3.773 1.00 . B B . 17 LEU O 1 1 5 3671 2 2 18 VAL C C 4.667 -8.879 -1.803 1.00 . B B . 18 VAL C 1 1 5 3672 2 2 18 VAL CA C 5.692 -7.792 -2.112 1.00 . B B . 18 VAL CA 1 1 5 3673 2 2 18 VAL CB C 5.310 -6.500 -1.380 1.00 . B B . 18 VAL CB 1 1 5 3674 2 2 18 VAL CG1 C 5.987 -5.318 -2.058 1.00 . B B . 18 VAL CG1 1 1 5 3675 2 2 18 VAL CG2 C 3.792 -6.293 -1.420 1.00 . B B . 18 VAL CG2 1 1 5 3676 2 2 18 VAL H H 4.982 -7.068 -4.013 1.00 . B B . 18 VAL H 1 1 5 3677 2 2 18 VAL HA H 6.669 -8.115 -1.784 1.00 . B B . 18 VAL HA 1 1 5 3678 2 2 18 VAL HB H 5.639 -6.562 -0.356 1.00 . B B . 18 VAL HB 1 1 5 3679 2 2 18 VAL HG11 H 5.233 -4.623 -2.393 1.00 . B B . 18 VAL HG11 1 1 5 3680 2 2 18 VAL HG12 H 6.560 -5.667 -2.904 1.00 . B B . 18 VAL HG12 1 1 5 3681 2 2 18 VAL HG13 H 6.642 -4.830 -1.355 1.00 . B B . 18 VAL HG13 1 1 5 3682 2 2 18 VAL HG21 H 3.550 -5.334 -0.987 1.00 . B B . 18 VAL HG21 1 1 5 3683 2 2 18 VAL HG22 H 3.307 -7.075 -0.852 1.00 . B B . 18 VAL HG22 1 1 5 3684 2 2 18 VAL HG23 H 3.450 -6.324 -2.443 1.00 . B B . 18 VAL HG23 1 1 5 3685 2 2 18 VAL N N 5.719 -7.549 -3.582 1.00 . B B . 18 VAL N 1 1 5 3686 2 2 18 VAL O O 4.898 -9.759 -0.998 1.00 . B B . 18 VAL O 1 1 5 3687 2 2 19 CYS C C 2.428 -10.837 -3.312 1.00 . B B . 19 CYS C 1 1 5 3688 2 2 19 CYS CA C 2.475 -9.823 -2.167 1.00 . B B . 19 CYS CA 1 1 5 3689 2 2 19 CYS CB C 1.122 -9.123 -2.053 1.00 . B B . 19 CYS CB 1 1 5 3690 2 2 19 CYS H H 3.361 -8.085 -3.066 1.00 . B B . 19 CYS H 1 1 5 3691 2 2 19 CYS HA H 2.696 -10.330 -1.241 1.00 . B B . 19 CYS HA 1 1 5 3692 2 2 19 CYS HB2 H 1.187 -8.142 -2.501 1.00 . B B . 19 CYS HB2 1 1 5 3693 2 2 19 CYS HB3 H 0.371 -9.704 -2.567 1.00 . B B . 19 CYS HB3 1 1 5 3694 2 2 19 CYS N N 3.528 -8.811 -2.429 1.00 . B B . 19 CYS N 1 1 5 3695 2 2 19 CYS O O 2.431 -12.032 -3.095 1.00 . B B . 19 CYS O 1 1 5 3696 2 2 19 CYS SG S 0.672 -8.960 -0.310 1.00 . B B . 19 CYS SG 1 1 5 3697 2 2 20 GLY C C 0.955 -12.019 -5.669 1.00 . B B . 20 GLY C 1 1 5 3698 2 2 20 GLY CA C 2.311 -11.312 -5.681 1.00 . B B . 20 GLY CA 1 1 5 3699 2 2 20 GLY H H 2.363 -9.402 -4.685 1.00 . B B . 20 GLY H 1 1 5 3700 2 2 20 GLY HA2 H 2.427 -10.762 -6.605 1.00 . B B . 20 GLY HA2 1 1 5 3701 2 2 20 GLY HA3 H 3.097 -12.045 -5.594 1.00 . B B . 20 GLY HA3 1 1 5 3702 2 2 20 GLY N N 2.373 -10.370 -4.529 1.00 . B B . 20 GLY N 1 1 5 3703 2 2 20 GLY O O -0.083 -11.388 -5.695 1.00 . B B . 20 GLY O 1 1 5 3704 2 2 21 GLU C C -1.061 -13.785 -4.273 1.00 . B B . 21 GLU C 1 1 5 3705 2 2 21 GLU CA C -0.345 -14.058 -5.600 1.00 . B B . 21 GLU CA 1 1 5 3706 2 2 21 GLU CB C -0.098 -15.566 -5.747 1.00 . B B . 21 GLU CB 1 1 5 3707 2 2 21 GLU CD C 1.253 -15.277 -3.654 1.00 . B B . 21 GLU CD 1 1 5 3708 2 2 21 GLU CG C 1.190 -15.967 -5.018 1.00 . B B . 21 GLU CG 1 1 5 3709 2 2 21 GLU H H 1.798 -13.814 -5.598 1.00 . B B . 21 GLU H 1 1 5 3710 2 2 21 GLU HA H -0.965 -13.715 -6.416 1.00 . B B . 21 GLU HA 1 1 5 3711 2 2 21 GLU HB2 H -0.932 -16.107 -5.325 1.00 . B B . 21 GLU HB2 1 1 5 3712 2 2 21 GLU HB3 H -0.006 -15.812 -6.794 1.00 . B B . 21 GLU HB3 1 1 5 3713 2 2 21 GLU HG2 H 1.202 -17.038 -4.878 1.00 . B B . 21 GLU HG2 1 1 5 3714 2 2 21 GLU HG3 H 2.045 -15.673 -5.608 1.00 . B B . 21 GLU HG3 1 1 5 3715 2 2 21 GLU N N 0.951 -13.322 -5.622 1.00 . B B . 21 GLU N 1 1 5 3716 2 2 21 GLU O O -2.226 -14.087 -4.111 1.00 . B B . 21 GLU O 1 1 5 3717 2 2 21 GLU OE1 O 0.502 -15.671 -2.778 1.00 . B B . 21 GLU OE1 1 1 5 3718 2 2 21 GLU OE2 O 2.051 -14.365 -3.511 1.00 . B B . 21 GLU OE2 1 1 5 3719 2 2 22 ARG C C -2.273 -12.104 -2.235 1.00 . B B . 22 ARG C 1 1 5 3720 2 2 22 ARG CA C -1.007 -12.924 -2.007 1.00 . B B . 22 ARG CA 1 1 5 3721 2 2 22 ARG CB C -0.034 -12.131 -1.131 1.00 . B B . 22 ARG CB 1 1 5 3722 2 2 22 ARG CD C 0.390 -14.085 0.369 1.00 . B B . 22 ARG CD 1 1 5 3723 2 2 22 ARG CG C 1.038 -13.069 -0.572 1.00 . B B . 22 ARG CG 1 1 5 3724 2 2 22 ARG CZ C 1.128 -16.291 1.031 1.00 . B B . 22 ARG CZ 1 1 5 3725 2 2 22 ARG H H 0.570 -12.980 -3.470 1.00 . B B . 22 ARG H 1 1 5 3726 2 2 22 ARG HA H -1.262 -13.850 -1.519 1.00 . B B . 22 ARG HA 1 1 5 3727 2 2 22 ARG HB2 H 0.437 -11.361 -1.724 1.00 . B B . 22 ARG HB2 1 1 5 3728 2 2 22 ARG HB3 H -0.573 -11.678 -0.313 1.00 . B B . 22 ARG HB3 1 1 5 3729 2 2 22 ARG HD2 H 0.627 -13.830 1.391 1.00 . B B . 22 ARG HD2 1 1 5 3730 2 2 22 ARG HD3 H -0.681 -14.069 0.234 1.00 . B B . 22 ARG HD3 1 1 5 3731 2 2 22 ARG HE H 1.086 -15.708 -0.865 1.00 . B B . 22 ARG HE 1 1 5 3732 2 2 22 ARG HG2 H 1.521 -13.589 -1.387 1.00 . B B . 22 ARG HG2 1 1 5 3733 2 2 22 ARG HG3 H 1.772 -12.493 -0.027 1.00 . B B . 22 ARG HG3 1 1 5 3734 2 2 22 ARG HH11 H 2.040 -14.947 2.201 1.00 . B B . 22 ARG HH11 1 1 5 3735 2 2 22 ARG HH12 H 1.910 -16.544 2.857 1.00 . B B . 22 ARG HH12 1 1 5 3736 2 2 22 ARG HH21 H 0.270 -17.833 0.088 1.00 . B B . 22 ARG HH21 1 1 5 3737 2 2 22 ARG HH22 H 0.906 -18.179 1.661 1.00 . B B . 22 ARG HH22 1 1 5 3738 2 2 22 ARG N N -0.369 -13.215 -3.321 1.00 . B B . 22 ARG N 1 1 5 3739 2 2 22 ARG NE N 0.909 -15.447 0.063 1.00 . B B . 22 ARG NE 1 1 5 3740 2 2 22 ARG NH1 N 1.740 -15.897 2.114 1.00 . B B . 22 ARG NH1 1 1 5 3741 2 2 22 ARG NH2 N 0.738 -17.531 0.917 1.00 . B B . 22 ARG NH2 1 1 5 3742 2 2 22 ARG O O -3.177 -12.093 -1.422 1.00 . B B . 22 ARG O 1 1 5 3743 2 2 23 GLY C C -3.493 -9.297 -2.822 1.00 . B B . 23 GLY C 1 1 5 3744 2 2 23 GLY CA C -3.546 -10.594 -3.631 1.00 . B B . 23 GLY CA 1 1 5 3745 2 2 23 GLY H H -1.600 -11.446 -3.975 1.00 . B B . 23 GLY H 1 1 5 3746 2 2 23 GLY HA2 H -3.573 -10.362 -4.687 1.00 . B B . 23 GLY HA2 1 1 5 3747 2 2 23 GLY HA3 H -4.434 -11.147 -3.361 1.00 . B B . 23 GLY HA3 1 1 5 3748 2 2 23 GLY N N -2.343 -11.418 -3.338 1.00 . B B . 23 GLY N 1 1 5 3749 2 2 23 GLY O O -3.819 -9.270 -1.651 1.00 . B B . 23 GLY O 1 1 5 3750 2 2 24 PHE C C -4.106 -5.990 -3.242 1.00 . B B . 24 PHE C 1 1 5 3751 2 2 24 PHE CA C -3.022 -6.923 -2.704 1.00 . B B . 24 PHE CA 1 1 5 3752 2 2 24 PHE CB C -1.643 -6.286 -2.895 1.00 . B B . 24 PHE CB 1 1 5 3753 2 2 24 PHE CD1 C -1.868 -5.070 -5.094 1.00 . B B . 24 PHE CD1 1 1 5 3754 2 2 24 PHE CD2 C -0.536 -7.097 -5.011 1.00 . B B . 24 PHE CD2 1 1 5 3755 2 2 24 PHE CE1 C -1.584 -4.940 -6.461 1.00 . B B . 24 PHE CE1 1 1 5 3756 2 2 24 PHE CE2 C -0.252 -6.967 -6.377 1.00 . B B . 24 PHE CE2 1 1 5 3757 2 2 24 PHE CG C -1.343 -6.148 -4.369 1.00 . B B . 24 PHE CG 1 1 5 3758 2 2 24 PHE CZ C -0.777 -5.888 -7.103 1.00 . B B . 24 PHE CZ 1 1 5 3759 2 2 24 PHE H H -2.834 -8.260 -4.382 1.00 . B B . 24 PHE H 1 1 5 3760 2 2 24 PHE HA H -3.197 -7.099 -1.654 1.00 . B B . 24 PHE HA 1 1 5 3761 2 2 24 PHE HB2 H -1.631 -5.311 -2.432 1.00 . B B . 24 PHE HB2 1 1 5 3762 2 2 24 PHE HB3 H -0.893 -6.912 -2.435 1.00 . B B . 24 PHE HB3 1 1 5 3763 2 2 24 PHE HD1 H -2.491 -4.338 -4.600 1.00 . B B . 24 PHE HD1 1 1 5 3764 2 2 24 PHE HD2 H -0.132 -7.927 -4.453 1.00 . B B . 24 PHE HD2 1 1 5 3765 2 2 24 PHE HE1 H -1.989 -4.108 -7.018 1.00 . B B . 24 PHE HE1 1 1 5 3766 2 2 24 PHE HE2 H 0.369 -7.699 -6.871 1.00 . B B . 24 PHE HE2 1 1 5 3767 2 2 24 PHE HZ H -0.555 -5.787 -8.156 1.00 . B B . 24 PHE HZ 1 1 5 3768 2 2 24 PHE N N -3.088 -8.218 -3.438 1.00 . B B . 24 PHE N 1 1 5 3769 2 2 24 PHE O O -4.279 -5.849 -4.437 1.00 . B B . 24 PHE O 1 1 5 3770 2 2 25 PHE C C -5.410 -3.025 -2.956 1.00 . B B . 25 PHE C 1 1 5 3771 2 2 25 PHE CA C -5.931 -4.459 -2.842 1.00 . B B . 25 PHE CA 1 1 5 3772 2 2 25 PHE CB C -7.108 -4.504 -1.862 1.00 . B B . 25 PHE CB 1 1 5 3773 2 2 25 PHE CD1 C -6.080 -4.971 0.396 1.00 . B B . 25 PHE CD1 1 1 5 3774 2 2 25 PHE CD2 C -6.824 -2.715 -0.107 1.00 . B B . 25 PHE CD2 1 1 5 3775 2 2 25 PHE CE1 C -5.669 -4.552 1.668 1.00 . B B . 25 PHE CE1 1 1 5 3776 2 2 25 PHE CE2 C -6.414 -2.298 1.166 1.00 . B B . 25 PHE CE2 1 1 5 3777 2 2 25 PHE CG C -6.657 -4.054 -0.493 1.00 . B B . 25 PHE CG 1 1 5 3778 2 2 25 PHE CZ C -5.836 -3.215 2.054 1.00 . B B . 25 PHE CZ 1 1 5 3779 2 2 25 PHE H H -4.703 -5.500 -1.412 1.00 . B B . 25 PHE H 1 1 5 3780 2 2 25 PHE HA H -6.266 -4.790 -3.812 1.00 . B B . 25 PHE HA 1 1 5 3781 2 2 25 PHE HB2 H -7.892 -3.851 -2.215 1.00 . B B . 25 PHE HB2 1 1 5 3782 2 2 25 PHE HB3 H -7.483 -5.514 -1.801 1.00 . B B . 25 PHE HB3 1 1 5 3783 2 2 25 PHE HD1 H -5.952 -6.001 0.098 1.00 . B B . 25 PHE HD1 1 1 5 3784 2 2 25 PHE HD2 H -7.269 -2.007 -0.790 1.00 . B B . 25 PHE HD2 1 1 5 3785 2 2 25 PHE HE1 H -5.224 -5.259 2.351 1.00 . B B . 25 PHE HE1 1 1 5 3786 2 2 25 PHE HE2 H -6.543 -1.266 1.464 1.00 . B B . 25 PHE HE2 1 1 5 3787 2 2 25 PHE HZ H -5.521 -2.893 3.034 1.00 . B B . 25 PHE HZ 1 1 5 3788 2 2 25 PHE N N -4.849 -5.364 -2.372 1.00 . B B . 25 PHE N 1 1 5 3789 2 2 25 PHE O O -5.037 -2.405 -1.980 1.00 . B B . 25 PHE O 1 1 5 3790 2 2 26 TYR C C -6.111 -0.236 -4.779 1.00 . B B . 26 TYR C 1 1 5 3791 2 2 26 TYR CA C -4.914 -1.101 -4.351 1.00 . B B . 26 TYR CA 1 1 5 3792 2 2 26 TYR CB C -3.804 -1.107 -5.427 1.00 . B B . 26 TYR CB 1 1 5 3793 2 2 26 TYR CD1 C -3.792 1.334 -6.082 1.00 . B B . 26 TYR CD1 1 1 5 3794 2 2 26 TYR CD2 C -4.433 -0.319 -7.739 1.00 . B B . 26 TYR CD2 1 1 5 3795 2 2 26 TYR CE1 C -3.991 2.353 -7.022 1.00 . B B . 26 TYR CE1 1 1 5 3796 2 2 26 TYR CE2 C -4.632 0.700 -8.679 1.00 . B B . 26 TYR CE2 1 1 5 3797 2 2 26 TYR CG C -4.012 -0.003 -6.441 1.00 . B B . 26 TYR CG 1 1 5 3798 2 2 26 TYR CZ C -4.412 2.036 -8.321 1.00 . B B . 26 TYR CZ 1 1 5 3799 2 2 26 TYR H H -5.710 -3.017 -4.915 1.00 . B B . 26 TYR H 1 1 5 3800 2 2 26 TYR HA H -4.513 -0.720 -3.423 1.00 . B B . 26 TYR HA 1 1 5 3801 2 2 26 TYR HB2 H -2.847 -0.969 -4.947 1.00 . B B . 26 TYR HB2 1 1 5 3802 2 2 26 TYR HB3 H -3.810 -2.061 -5.934 1.00 . B B . 26 TYR HB3 1 1 5 3803 2 2 26 TYR HD1 H -3.467 1.577 -5.080 1.00 . B B . 26 TYR HD1 1 1 5 3804 2 2 26 TYR HD2 H -4.601 -1.349 -8.015 1.00 . B B . 26 TYR HD2 1 1 5 3805 2 2 26 TYR HE1 H -3.822 3.383 -6.747 1.00 . B B . 26 TYR HE1 1 1 5 3806 2 2 26 TYR HE2 H -4.956 0.456 -9.681 1.00 . B B . 26 TYR HE2 1 1 5 3807 2 2 26 TYR HH H -3.754 3.416 -9.464 1.00 . B B . 26 TYR HH 1 1 5 3808 2 2 26 TYR N N -5.395 -2.495 -4.149 1.00 . B B . 26 TYR N 1 1 5 3809 2 2 26 TYR O O -6.507 -0.230 -5.927 1.00 . B B . 26 TYR O 1 1 5 3810 2 2 26 TYR OH O -4.610 3.040 -9.246 1.00 . B B . 26 TYR OH 1 1 5 3811 2 2 27 THR C C -7.389 2.650 -4.816 1.00 . B B . 27 THR C 1 1 5 3812 2 2 27 THR CA C -7.864 1.328 -4.204 1.00 . B B . 27 THR CA 1 1 5 3813 2 2 27 THR CB C -8.660 1.610 -2.933 1.00 . B B . 27 THR CB 1 1 5 3814 2 2 27 THR CG2 C -9.130 0.288 -2.321 1.00 . B B . 27 THR CG2 1 1 5 3815 2 2 27 THR H H -6.372 0.456 -2.937 1.00 . B B . 27 THR H 1 1 5 3816 2 2 27 THR HA H -8.490 0.808 -4.914 1.00 . B B . 27 THR HA 1 1 5 3817 2 2 27 THR HB H -9.515 2.214 -3.172 1.00 . B B . 27 THR HB 1 1 5 3818 2 2 27 THR HG1 H -7.447 1.648 -1.412 1.00 . B B . 27 THR HG1 1 1 5 3819 2 2 27 THR HG21 H -10.182 0.151 -2.524 1.00 . B B . 27 THR HG21 1 1 5 3820 2 2 27 THR HG22 H -8.969 0.308 -1.254 1.00 . B B . 27 THR HG22 1 1 5 3821 2 2 27 THR HG23 H -8.570 -0.528 -2.755 1.00 . B B . 27 THR HG23 1 1 5 3822 2 2 27 THR N N -6.695 0.482 -3.859 1.00 . B B . 27 THR N 1 1 5 3823 2 2 27 THR O O -6.209 2.869 -5.011 1.00 . B B . 27 THR O 1 1 5 3824 2 2 27 THR OG1 O -7.835 2.298 -2.002 1.00 . B B . 27 THR OG1 1 1 5 3825 2 2 28 LYS C C -9.087 5.821 -5.612 1.00 . B B . 28 LYS C 1 1 5 3826 2 2 28 LYS CA C -7.915 4.840 -5.720 1.00 . B B . 28 LYS CA 1 1 5 3827 2 2 28 LYS CB C -7.560 4.635 -7.194 1.00 . B B . 28 LYS CB 1 1 5 3828 2 2 28 LYS CD C -8.167 2.727 -8.692 1.00 . B B . 28 LYS CD 1 1 5 3829 2 2 28 LYS CE C -8.815 2.695 -10.076 1.00 . B B . 28 LYS CE 1 1 5 3830 2 2 28 LYS CG C -8.713 3.917 -7.900 1.00 . B B . 28 LYS CG 1 1 5 3831 2 2 28 LYS H H -9.247 3.332 -4.954 1.00 . B B . 28 LYS H 1 1 5 3832 2 2 28 LYS HA H -7.059 5.238 -5.195 1.00 . B B . 28 LYS HA 1 1 5 3833 2 2 28 LYS HB2 H -7.394 5.596 -7.661 1.00 . B B . 28 LYS HB2 1 1 5 3834 2 2 28 LYS HB3 H -6.666 4.037 -7.271 1.00 . B B . 28 LYS HB3 1 1 5 3835 2 2 28 LYS HD2 H -7.096 2.825 -8.796 1.00 . B B . 28 LYS HD2 1 1 5 3836 2 2 28 LYS HD3 H -8.396 1.810 -8.168 1.00 . B B . 28 LYS HD3 1 1 5 3837 2 2 28 LYS HE2 H -9.861 2.950 -9.991 1.00 . B B . 28 LYS HE2 1 1 5 3838 2 2 28 LYS HE3 H -8.321 3.406 -10.721 1.00 . B B . 28 LYS HE3 1 1 5 3839 2 2 28 LYS HG2 H -9.422 3.567 -7.164 1.00 . B B . 28 LYS HG2 1 1 5 3840 2 2 28 LYS HG3 H -9.204 4.601 -8.574 1.00 . B B . 28 LYS HG3 1 1 5 3841 2 2 28 LYS HZ1 H -8.954 0.623 -9.938 1.00 . B B . 28 LYS HZ1 1 1 5 3842 2 2 28 LYS HZ2 H -7.696 1.168 -10.942 1.00 . B B . 28 LYS HZ2 1 1 5 3843 2 2 28 LYS HZ3 H -9.307 1.237 -11.481 1.00 . B B . 28 LYS HZ3 1 1 5 3844 2 2 28 LYS N N -8.304 3.531 -5.119 1.00 . B B . 28 LYS N 1 1 5 3845 2 2 28 LYS NZ N -8.683 1.327 -10.653 1.00 . B B . 28 LYS NZ 1 1 5 3846 2 2 28 LYS O O -9.728 6.128 -6.597 1.00 . B B . 28 LYS O 1 1 5 3847 2 2 29 PRO C C -10.024 8.648 -4.564 1.00 . B B . 29 PRO C 1 1 5 3848 2 2 29 PRO CA C -10.425 7.233 -4.135 1.00 . B B . 29 PRO CA 1 1 5 3849 2 2 29 PRO CB C -10.597 7.149 -2.615 1.00 . B B . 29 PRO CB 1 1 5 3850 2 2 29 PRO CD C -8.546 5.900 -3.221 1.00 . B B . 29 PRO CD 1 1 5 3851 2 2 29 PRO CG C -9.260 6.608 -2.054 1.00 . B B . 29 PRO CG 1 1 5 3852 2 2 29 PRO HA H -11.332 6.926 -4.627 1.00 . B B . 29 PRO HA 1 1 5 3853 2 2 29 PRO HB2 H -10.804 8.131 -2.212 1.00 . B B . 29 PRO HB2 1 1 5 3854 2 2 29 PRO HB3 H -11.397 6.468 -2.369 1.00 . B B . 29 PRO HB3 1 1 5 3855 2 2 29 PRO HD2 H -7.528 6.250 -3.308 1.00 . B B . 29 PRO HD2 1 1 5 3856 2 2 29 PRO HD3 H -8.572 4.830 -3.087 1.00 . B B . 29 PRO HD3 1 1 5 3857 2 2 29 PRO HG2 H -8.656 7.426 -1.688 1.00 . B B . 29 PRO HG2 1 1 5 3858 2 2 29 PRO HG3 H -9.450 5.902 -1.261 1.00 . B B . 29 PRO HG3 1 1 5 3859 2 2 29 PRO N N -9.333 6.282 -4.411 1.00 . B B . 29 PRO N 1 1 5 3860 2 2 29 PRO O O -8.945 9.117 -4.262 1.00 . B B . 29 PRO O 1 1 5 3861 2 2 30 THR C C -10.794 11.695 -4.559 1.00 . B B . 30 THR C 1 1 5 3862 2 2 30 THR CA C -10.555 10.716 -5.710 1.00 . B B . 30 THR CA 1 1 5 3863 2 2 30 THR CB C -11.442 11.098 -6.897 1.00 . B B . 30 THR CB 1 1 5 3864 2 2 30 THR CG2 C -10.873 10.490 -8.179 1.00 . B B . 30 THR CG2 1 1 5 3865 2 2 30 THR H H -11.752 8.938 -5.498 1.00 . B B . 30 THR H 1 1 5 3866 2 2 30 THR HA H -9.517 10.759 -6.008 1.00 . B B . 30 THR HA 1 1 5 3867 2 2 30 THR HB H -11.470 12.171 -6.995 1.00 . B B . 30 THR HB 1 1 5 3868 2 2 30 THR HG1 H -13.371 11.334 -6.804 1.00 . B B . 30 THR HG1 1 1 5 3869 2 2 30 THR HG21 H -9.815 10.700 -8.238 1.00 . B B . 30 THR HG21 1 1 5 3870 2 2 30 THR HG22 H -11.374 10.919 -9.034 1.00 . B B . 30 THR HG22 1 1 5 3871 2 2 30 THR HG23 H -11.028 9.421 -8.170 1.00 . B B . 30 THR HG23 1 1 5 3872 2 2 30 THR N N -10.887 9.333 -5.264 1.00 . B B . 30 THR N 1 1 5 3873 2 2 30 THR O O -11.915 11.755 -4.081 1.00 . B B . 30 THR O 1 1 5 3874 2 2 30 THR OXT O -9.853 12.368 -4.175 1.00 . B B . 30 THR OXT 1 1 5 3875 2 2 30 THR OG1 O -12.757 10.606 -6.679 1.00 . B B . 30 THR OG1 1 1 6 3876 1 1 1 GLY C C -3.970 7.316 0.009 1.00 . A A . 1 GLY C 1 1 6 3877 1 1 1 GLY CA C -5.416 7.681 0.000 1.00 . A A . 1 GLY CA 1 1 6 3878 1 1 1 GLY H1 H -6.914 8.564 1.206 1.00 . A A . 1 GLY H1 1 1 6 3879 1 1 1 GLY H2 H -5.875 9.692 0.476 1.00 . A A . 1 GLY H2 1 1 6 3880 1 1 1 GLY H3 H -5.342 8.783 1.807 1.00 . A A . 1 GLY H3 1 1 6 3881 1 1 1 GLY HA2 H -5.533 6.793 0.385 1.00 . A A . 1 GLY HA2 1 1 6 3882 1 1 1 GLY HA3 H -5.981 7.820 -1.011 1.00 . A A . 1 GLY HA3 1 1 6 3883 1 1 1 GLY N N -5.928 8.767 0.948 1.00 . A A . 1 GLY N 1 1 6 3884 1 1 1 GLY O O -3.166 7.933 0.680 1.00 . A A . 1 GLY O 1 1 6 3885 1 1 2 ILE C C -1.587 6.350 -2.124 1.00 . A A . 2 ILE C 1 1 6 3886 1 1 2 ILE CA C -2.173 5.898 -0.791 1.00 . A A . 2 ILE CA 1 1 6 3887 1 1 2 ILE CB C -2.079 4.375 -0.681 1.00 . A A . 2 ILE CB 1 1 6 3888 1 1 2 ILE CD1 C -0.489 2.444 -0.766 1.00 . A A . 2 ILE CD1 1 1 6 3889 1 1 2 ILE CG1 C -0.610 3.954 -0.557 1.00 . A A . 2 ILE CG1 1 1 6 3890 1 1 2 ILE CG2 C -2.688 3.742 -1.931 1.00 . A A . 2 ILE CG2 1 1 6 3891 1 1 2 ILE H H -4.265 5.838 -1.285 1.00 . A A . 2 ILE H 1 1 6 3892 1 1 2 ILE HA H -1.631 6.356 0.020 1.00 . A A . 2 ILE HA 1 1 6 3893 1 1 2 ILE HB H -2.626 4.044 0.191 1.00 . A A . 2 ILE HB 1 1 6 3894 1 1 2 ILE HD11 H -1.250 1.939 -0.191 1.00 . A A . 2 ILE HD11 1 1 6 3895 1 1 2 ILE HD12 H 0.487 2.112 -0.442 1.00 . A A . 2 ILE HD12 1 1 6 3896 1 1 2 ILE HD13 H -0.617 2.215 -1.814 1.00 . A A . 2 ILE HD13 1 1 6 3897 1 1 2 ILE HG12 H -0.023 4.469 -1.304 1.00 . A A . 2 ILE HG12 1 1 6 3898 1 1 2 ILE HG13 H -0.243 4.208 0.426 1.00 . A A . 2 ILE HG13 1 1 6 3899 1 1 2 ILE HG21 H -3.599 4.262 -2.189 1.00 . A A . 2 ILE HG21 1 1 6 3900 1 1 2 ILE HG22 H -2.907 2.704 -1.738 1.00 . A A . 2 ILE HG22 1 1 6 3901 1 1 2 ILE HG23 H -1.987 3.818 -2.749 1.00 . A A . 2 ILE HG23 1 1 6 3902 1 1 2 ILE N N -3.601 6.312 -0.741 1.00 . A A . 2 ILE N 1 1 6 3903 1 1 2 ILE O O -0.456 6.781 -2.212 1.00 . A A . 2 ILE O 1 1 6 3904 1 1 3 VAL C C -1.312 8.081 -4.444 1.00 . A A . 3 VAL C 1 1 6 3905 1 1 3 VAL CA C -1.891 6.667 -4.508 1.00 . A A . 3 VAL CA 1 1 6 3906 1 1 3 VAL CB C -3.071 6.644 -5.478 1.00 . A A . 3 VAL CB 1 1 6 3907 1 1 3 VAL CG1 C -2.553 6.759 -6.907 1.00 . A A . 3 VAL CG1 1 1 6 3908 1 1 3 VAL CG2 C -3.839 5.329 -5.320 1.00 . A A . 3 VAL CG2 1 1 6 3909 1 1 3 VAL H H -3.276 5.902 -3.055 1.00 . A A . 3 VAL H 1 1 6 3910 1 1 3 VAL HA H -1.130 5.981 -4.849 1.00 . A A . 3 VAL HA 1 1 6 3911 1 1 3 VAL HB H -3.727 7.475 -5.265 1.00 . A A . 3 VAL HB 1 1 6 3912 1 1 3 VAL HG11 H -3.332 7.157 -7.540 1.00 . A A . 3 VAL HG11 1 1 6 3913 1 1 3 VAL HG12 H -2.261 5.782 -7.263 1.00 . A A . 3 VAL HG12 1 1 6 3914 1 1 3 VAL HG13 H -1.700 7.421 -6.926 1.00 . A A . 3 VAL HG13 1 1 6 3915 1 1 3 VAL HG21 H -4.332 5.087 -6.250 1.00 . A A . 3 VAL HG21 1 1 6 3916 1 1 3 VAL HG22 H -4.578 5.435 -4.538 1.00 . A A . 3 VAL HG22 1 1 6 3917 1 1 3 VAL HG23 H -3.151 4.539 -5.060 1.00 . A A . 3 VAL HG23 1 1 6 3918 1 1 3 VAL N N -2.366 6.252 -3.162 1.00 . A A . 3 VAL N 1 1 6 3919 1 1 3 VAL O O -0.322 8.384 -5.080 1.00 . A A . 3 VAL O 1 1 6 3920 1 1 4 GLU C C -0.349 10.438 -2.493 1.00 . A A . 4 GLU C 1 1 6 3921 1 1 4 GLU CA C -1.406 10.350 -3.595 1.00 . A A . 4 GLU CA 1 1 6 3922 1 1 4 GLU CB C -2.562 11.297 -3.265 1.00 . A A . 4 GLU CB 1 1 6 3923 1 1 4 GLU CD C -2.519 13.676 -4.026 1.00 . A A . 4 GLU CD 1 1 6 3924 1 1 4 GLU CG C -2.011 12.694 -2.969 1.00 . A A . 4 GLU CG 1 1 6 3925 1 1 4 GLU H H -2.723 8.692 -3.187 1.00 . A A . 4 GLU H 1 1 6 3926 1 1 4 GLU HA H -0.966 10.636 -4.539 1.00 . A A . 4 GLU HA 1 1 6 3927 1 1 4 GLU HB2 H -3.237 11.346 -4.107 1.00 . A A . 4 GLU HB2 1 1 6 3928 1 1 4 GLU HB3 H -3.090 10.929 -2.398 1.00 . A A . 4 GLU HB3 1 1 6 3929 1 1 4 GLU HG2 H -2.343 13.012 -1.991 1.00 . A A . 4 GLU HG2 1 1 6 3930 1 1 4 GLU HG3 H -0.933 12.668 -2.992 1.00 . A A . 4 GLU HG3 1 1 6 3931 1 1 4 GLU N N -1.922 8.953 -3.688 1.00 . A A . 4 GLU N 1 1 6 3932 1 1 4 GLU O O 0.620 11.162 -2.605 1.00 . A A . 4 GLU O 1 1 6 3933 1 1 4 GLU OE1 O -3.574 14.251 -3.814 1.00 . A A . 4 GLU OE1 1 1 6 3934 1 1 4 GLU OE2 O -1.844 13.837 -5.030 1.00 . A A . 4 GLU OE2 1 1 6 3935 1 1 5 GLN C C 1.721 8.993 -0.707 1.00 . A A . 5 GLN C 1 1 6 3936 1 1 5 GLN CA C 0.454 9.756 -0.311 1.00 . A A . 5 GLN CA 1 1 6 3937 1 1 5 GLN CB C -0.161 9.114 0.934 1.00 . A A . 5 GLN CB 1 1 6 3938 1 1 5 GLN CD C 0.190 9.322 3.400 1.00 . A A . 5 GLN CD 1 1 6 3939 1 1 5 GLN CG C -0.093 10.093 2.108 1.00 . A A . 5 GLN CG 1 1 6 3940 1 1 5 GLN H H -1.327 9.140 -1.356 1.00 . A A . 5 GLN H 1 1 6 3941 1 1 5 GLN HA H 0.707 10.784 -0.097 1.00 . A A . 5 GLN HA 1 1 6 3942 1 1 5 GLN HB2 H -1.191 8.860 0.736 1.00 . A A . 5 GLN HB2 1 1 6 3943 1 1 5 GLN HB3 H 0.389 8.219 1.184 1.00 . A A . 5 GLN HB3 1 1 6 3944 1 1 5 GLN HE21 H -1.558 8.379 3.388 1.00 . A A . 5 GLN HE21 1 1 6 3945 1 1 5 GLN HE22 H -0.537 7.999 4.690 1.00 . A A . 5 GLN HE22 1 1 6 3946 1 1 5 GLN HG2 H 0.696 10.810 1.934 1.00 . A A . 5 GLN HG2 1 1 6 3947 1 1 5 GLN HG3 H -1.036 10.611 2.201 1.00 . A A . 5 GLN HG3 1 1 6 3948 1 1 5 GLN N N -0.534 9.712 -1.427 1.00 . A A . 5 GLN N 1 1 6 3949 1 1 5 GLN NE2 N -0.709 8.499 3.865 1.00 . A A . 5 GLN NE2 1 1 6 3950 1 1 5 GLN O O 2.821 9.386 -0.373 1.00 . A A . 5 GLN O 1 1 6 3951 1 1 5 GLN OE1 O 1.241 9.469 3.990 1.00 . A A . 5 GLN OE1 1 1 6 3952 1 1 6 CYS C C 3.448 7.820 -3.020 1.00 . A A . 6 CYS C 1 1 6 3953 1 1 6 CYS CA C 2.785 7.129 -1.829 1.00 . A A . 6 CYS CA 1 1 6 3954 1 1 6 CYS CB C 2.375 5.709 -2.231 1.00 . A A . 6 CYS CB 1 1 6 3955 1 1 6 CYS H H 0.686 7.603 -1.682 1.00 . A A . 6 CYS H 1 1 6 3956 1 1 6 CYS HA H 3.482 7.084 -1.006 1.00 . A A . 6 CYS HA 1 1 6 3957 1 1 6 CYS HB2 H 1.306 5.665 -2.365 1.00 . A A . 6 CYS HB2 1 1 6 3958 1 1 6 CYS HB3 H 2.864 5.440 -3.156 1.00 . A A . 6 CYS HB3 1 1 6 3959 1 1 6 CYS N N 1.580 7.905 -1.418 1.00 . A A . 6 CYS N 1 1 6 3960 1 1 6 CYS O O 4.600 7.585 -3.325 1.00 . A A . 6 CYS O 1 1 6 3961 1 1 6 CYS SG S 2.867 4.547 -0.931 1.00 . A A . 6 CYS SG 1 1 6 3962 1 1 7 CYS C C 4.002 10.661 -4.400 1.00 . A A . 7 CYS C 1 1 6 3963 1 1 7 CYS CA C 3.318 9.378 -4.869 1.00 . A A . 7 CYS CA 1 1 6 3964 1 1 7 CYS CB C 2.211 9.736 -5.865 1.00 . A A . 7 CYS CB 1 1 6 3965 1 1 7 CYS H H 1.800 8.847 -3.437 1.00 . A A . 7 CYS H 1 1 6 3966 1 1 7 CYS HA H 4.042 8.736 -5.345 1.00 . A A . 7 CYS HA 1 1 6 3967 1 1 7 CYS HB2 H 1.259 9.720 -5.359 1.00 . A A . 7 CYS HB2 1 1 6 3968 1 1 7 CYS HB3 H 2.391 10.725 -6.257 1.00 . A A . 7 CYS HB3 1 1 6 3969 1 1 7 CYS N N 2.728 8.673 -3.698 1.00 . A A . 7 CYS N 1 1 6 3970 1 1 7 CYS O O 5.106 10.971 -4.803 1.00 . A A . 7 CYS O 1 1 6 3971 1 1 7 CYS SG S 2.185 8.544 -7.227 1.00 . A A . 7 CYS SG 1 1 6 3972 1 1 8 THR C C 4.808 12.376 -1.814 1.00 . A A . 8 THR C 1 1 6 3973 1 1 8 THR CA C 3.969 12.676 -3.059 1.00 . A A . 8 THR CA 1 1 6 3974 1 1 8 THR CB C 2.865 13.686 -2.721 1.00 . A A . 8 THR CB 1 1 6 3975 1 1 8 THR CG2 C 2.255 13.365 -1.353 1.00 . A A . 8 THR CG2 1 1 6 3976 1 1 8 THR H H 2.464 11.145 -3.238 1.00 . A A . 8 THR H 1 1 6 3977 1 1 8 THR HA H 4.607 13.086 -3.828 1.00 . A A . 8 THR HA 1 1 6 3978 1 1 8 THR HB H 2.091 13.635 -3.473 1.00 . A A . 8 THR HB 1 1 6 3979 1 1 8 THR HG1 H 2.901 15.544 -3.295 1.00 . A A . 8 THR HG1 1 1 6 3980 1 1 8 THR HG21 H 2.956 13.630 -0.577 1.00 . A A . 8 THR HG21 1 1 6 3981 1 1 8 THR HG22 H 2.036 12.308 -1.295 1.00 . A A . 8 THR HG22 1 1 6 3982 1 1 8 THR HG23 H 1.344 13.929 -1.223 1.00 . A A . 8 THR HG23 1 1 6 3983 1 1 8 THR N N 3.354 11.413 -3.552 1.00 . A A . 8 THR N 1 1 6 3984 1 1 8 THR O O 5.721 13.103 -1.476 1.00 . A A . 8 THR O 1 1 6 3985 1 1 8 THR OG1 O 3.415 14.995 -2.698 1.00 . A A . 8 THR OG1 1 1 6 3986 1 1 9 SER C C 5.973 9.602 -0.132 1.00 . A A . 9 SER C 1 1 6 3987 1 1 9 SER CA C 5.285 10.950 0.086 1.00 . A A . 9 SER CA 1 1 6 3988 1 1 9 SER CB C 4.342 10.852 1.285 1.00 . A A . 9 SER CB 1 1 6 3989 1 1 9 SER H H 3.768 10.729 -1.426 1.00 . A A . 9 SER H 1 1 6 3990 1 1 9 SER HA H 6.029 11.710 0.272 1.00 . A A . 9 SER HA 1 1 6 3991 1 1 9 SER HB2 H 4.054 9.826 1.437 1.00 . A A . 9 SER HB2 1 1 6 3992 1 1 9 SER HB3 H 4.848 11.216 2.170 1.00 . A A . 9 SER HB3 1 1 6 3993 1 1 9 SER HG H 2.465 11.278 1.566 1.00 . A A . 9 SER HG 1 1 6 3994 1 1 9 SER N N 4.506 11.304 -1.133 1.00 . A A . 9 SER N 1 1 6 3995 1 1 9 SER O O 5.474 8.746 -0.835 1.00 . A A . 9 SER O 1 1 6 3996 1 1 9 SER OG O 3.181 11.632 1.034 1.00 . A A . 9 SER OG 1 1 6 3997 1 1 10 ILE C C 7.221 7.052 1.195 1.00 . A A . 10 ILE C 1 1 6 3998 1 1 10 ILE CA C 7.836 8.113 0.283 1.00 . A A . 10 ILE CA 1 1 6 3999 1 1 10 ILE CB C 9.309 8.300 0.641 1.00 . A A . 10 ILE CB 1 1 6 4000 1 1 10 ILE CD1 C 11.350 8.914 -0.735 1.00 . A A . 10 ILE CD1 1 1 6 4001 1 1 10 ILE CG1 C 9.928 9.323 -0.332 1.00 . A A . 10 ILE CG1 1 1 6 4002 1 1 10 ILE CG2 C 10.023 6.945 0.547 1.00 . A A . 10 ILE CG2 1 1 6 4003 1 1 10 ILE H H 7.508 10.107 1.022 1.00 . A A . 10 ILE H 1 1 6 4004 1 1 10 ILE HA H 7.754 7.794 -0.746 1.00 . A A . 10 ILE HA 1 1 6 4005 1 1 10 ILE HB H 9.385 8.672 1.654 1.00 . A A . 10 ILE HB 1 1 6 4006 1 1 10 ILE HD11 H 11.305 8.233 -1.572 1.00 . A A . 10 ILE HD11 1 1 6 4007 1 1 10 ILE HD12 H 11.833 8.426 0.099 1.00 . A A . 10 ILE HD12 1 1 6 4008 1 1 10 ILE HD13 H 11.911 9.793 -1.014 1.00 . A A . 10 ILE HD13 1 1 6 4009 1 1 10 ILE HG12 H 9.313 9.385 -1.217 1.00 . A A . 10 ILE HG12 1 1 6 4010 1 1 10 ILE HG13 H 9.958 10.292 0.146 1.00 . A A . 10 ILE HG13 1 1 6 4011 1 1 10 ILE HG21 H 9.338 6.156 0.821 1.00 . A A . 10 ILE HG21 1 1 6 4012 1 1 10 ILE HG22 H 10.868 6.937 1.219 1.00 . A A . 10 ILE HG22 1 1 6 4013 1 1 10 ILE HG23 H 10.366 6.789 -0.466 1.00 . A A . 10 ILE HG23 1 1 6 4014 1 1 10 ILE N N 7.118 9.405 0.462 1.00 . A A . 10 ILE N 1 1 6 4015 1 1 10 ILE O O 6.852 7.325 2.320 1.00 . A A . 10 ILE O 1 1 6 4016 1 1 11 CYS C C 7.386 3.499 1.427 1.00 . A A . 11 CYS C 1 1 6 4017 1 1 11 CYS CA C 6.530 4.759 1.564 1.00 . A A . 11 CYS CA 1 1 6 4018 1 1 11 CYS CB C 5.087 4.453 1.126 1.00 . A A . 11 CYS CB 1 1 6 4019 1 1 11 CYS H H 7.423 5.643 -0.189 1.00 . A A . 11 CYS H 1 1 6 4020 1 1 11 CYS HA H 6.529 5.076 2.597 1.00 . A A . 11 CYS HA 1 1 6 4021 1 1 11 CYS HB2 H 4.905 3.394 1.216 1.00 . A A . 11 CYS HB2 1 1 6 4022 1 1 11 CYS HB3 H 4.400 4.986 1.769 1.00 . A A . 11 CYS HB3 1 1 6 4023 1 1 11 CYS N N 7.115 5.842 0.720 1.00 . A A . 11 CYS N 1 1 6 4024 1 1 11 CYS O O 7.698 3.066 0.337 1.00 . A A . 11 CYS O 1 1 6 4025 1 1 11 CYS SG S 4.817 4.960 -0.594 1.00 . A A . 11 CYS SG 1 1 6 4026 1 1 12 SER C C 7.743 0.437 2.529 1.00 . A A . 12 SER C 1 1 6 4027 1 1 12 SER CA C 8.623 1.687 2.456 1.00 . A A . 12 SER CA 1 1 6 4028 1 1 12 SER CB C 9.610 1.682 3.624 1.00 . A A . 12 SER CB 1 1 6 4029 1 1 12 SER H H 7.520 3.281 3.397 1.00 . A A . 12 SER H 1 1 6 4030 1 1 12 SER HA H 9.171 1.685 1.526 1.00 . A A . 12 SER HA 1 1 6 4031 1 1 12 SER HB2 H 10.050 0.704 3.723 1.00 . A A . 12 SER HB2 1 1 6 4032 1 1 12 SER HB3 H 10.390 2.408 3.438 1.00 . A A . 12 SER HB3 1 1 6 4033 1 1 12 SER HG H 9.074 2.935 5.013 1.00 . A A . 12 SER HG 1 1 6 4034 1 1 12 SER N N 7.777 2.912 2.526 1.00 . A A . 12 SER N 1 1 6 4035 1 1 12 SER O O 6.567 0.508 2.834 1.00 . A A . 12 SER O 1 1 6 4036 1 1 12 SER OG O 8.920 2.007 4.824 1.00 . A A . 12 SER OG 1 1 6 4037 1 1 13 LEU C C 6.496 -1.956 3.380 1.00 . A A . 13 LEU C 1 1 6 4038 1 1 13 LEU CA C 7.540 -1.979 2.263 1.00 . A A . 13 LEU CA 1 1 6 4039 1 1 13 LEU CB C 8.494 -3.152 2.488 1.00 . A A . 13 LEU CB 1 1 6 4040 1 1 13 LEU CD1 C 8.362 -5.490 1.612 1.00 . A A . 13 LEU CD1 1 1 6 4041 1 1 13 LEU CD2 C 7.678 -4.993 3.961 1.00 . A A . 13 LEU CD2 1 1 6 4042 1 1 13 LEU CG C 7.700 -4.459 2.529 1.00 . A A . 13 LEU CG 1 1 6 4043 1 1 13 LEU H H 9.253 -0.720 1.974 1.00 . A A . 13 LEU H 1 1 6 4044 1 1 13 LEU HA H 7.052 -2.103 1.324 1.00 . A A . 13 LEU HA 1 1 6 4045 1 1 13 LEU HB2 H 9.209 -3.191 1.682 1.00 . A A . 13 LEU HB2 1 1 6 4046 1 1 13 LEU HB3 H 9.013 -3.019 3.424 1.00 . A A . 13 LEU HB3 1 1 6 4047 1 1 13 LEU HD11 H 8.154 -6.485 1.978 1.00 . A A . 13 LEU HD11 1 1 6 4048 1 1 13 LEU HD12 H 9.429 -5.327 1.598 1.00 . A A . 13 LEU HD12 1 1 6 4049 1 1 13 LEU HD13 H 7.970 -5.386 0.611 1.00 . A A . 13 LEU HD13 1 1 6 4050 1 1 13 LEU HD21 H 6.660 -5.019 4.319 1.00 . A A . 13 LEU HD21 1 1 6 4051 1 1 13 LEU HD22 H 8.266 -4.347 4.596 1.00 . A A . 13 LEU HD22 1 1 6 4052 1 1 13 LEU HD23 H 8.091 -5.990 3.981 1.00 . A A . 13 LEU HD23 1 1 6 4053 1 1 13 LEU HG H 6.689 -4.275 2.195 1.00 . A A . 13 LEU HG 1 1 6 4054 1 1 13 LEU N N 8.312 -0.705 2.234 1.00 . A A . 13 LEU N 1 1 6 4055 1 1 13 LEU O O 5.373 -2.383 3.199 1.00 . A A . 13 LEU O 1 1 6 4056 1 1 14 TYR C C 4.532 -0.900 5.138 1.00 . A A . 14 TYR C 1 1 6 4057 1 1 14 TYR CA C 5.875 -1.424 5.651 1.00 . A A . 14 TYR CA 1 1 6 4058 1 1 14 TYR CB C 6.398 -0.505 6.756 1.00 . A A . 14 TYR CB 1 1 6 4059 1 1 14 TYR CD1 C 6.589 -2.175 8.633 1.00 . A A . 14 TYR CD1 1 1 6 4060 1 1 14 TYR CD2 C 8.618 -1.209 7.717 1.00 . A A . 14 TYR CD2 1 1 6 4061 1 1 14 TYR CE1 C 7.354 -2.931 9.532 1.00 . A A . 14 TYR CE1 1 1 6 4062 1 1 14 TYR CE2 C 9.383 -1.964 8.615 1.00 . A A . 14 TYR CE2 1 1 6 4063 1 1 14 TYR CG C 7.222 -1.315 7.727 1.00 . A A . 14 TYR CG 1 1 6 4064 1 1 14 TYR CZ C 8.750 -2.825 9.523 1.00 . A A . 14 TYR CZ 1 1 6 4065 1 1 14 TYR H H 7.764 -1.128 4.658 1.00 . A A . 14 TYR H 1 1 6 4066 1 1 14 TYR HA H 5.742 -2.420 6.047 1.00 . A A . 14 TYR HA 1 1 6 4067 1 1 14 TYR HB2 H 7.011 0.269 6.319 1.00 . A A . 14 TYR HB2 1 1 6 4068 1 1 14 TYR HB3 H 5.566 -0.057 7.278 1.00 . A A . 14 TYR HB3 1 1 6 4069 1 1 14 TYR HD1 H 5.512 -2.256 8.641 1.00 . A A . 14 TYR HD1 1 1 6 4070 1 1 14 TYR HD2 H 9.104 -0.545 7.017 1.00 . A A . 14 TYR HD2 1 1 6 4071 1 1 14 TYR HE1 H 6.866 -3.594 10.232 1.00 . A A . 14 TYR HE1 1 1 6 4072 1 1 14 TYR HE2 H 10.459 -1.883 8.608 1.00 . A A . 14 TYR HE2 1 1 6 4073 1 1 14 TYR HH H 10.357 -3.737 10.001 1.00 . A A . 14 TYR HH 1 1 6 4074 1 1 14 TYR N N 6.854 -1.466 4.530 1.00 . A A . 14 TYR N 1 1 6 4075 1 1 14 TYR O O 3.540 -1.601 5.144 1.00 . A A . 14 TYR O 1 1 6 4076 1 1 14 TYR OH O 9.504 -3.570 10.407 1.00 . A A . 14 TYR OH 1 1 6 4077 1 1 15 GLN C C 2.631 -0.085 3.150 1.00 . A A . 15 GLN C 1 1 6 4078 1 1 15 GLN CA C 3.219 0.886 4.169 1.00 . A A . 15 GLN CA 1 1 6 4079 1 1 15 GLN CB C 3.492 2.233 3.495 1.00 . A A . 15 GLN CB 1 1 6 4080 1 1 15 GLN CD C 4.710 3.147 5.475 1.00 . A A . 15 GLN CD 1 1 6 4081 1 1 15 GLN CG C 3.507 3.339 4.551 1.00 . A A . 15 GLN CG 1 1 6 4082 1 1 15 GLN H H 5.306 0.867 4.679 1.00 . A A . 15 GLN H 1 1 6 4083 1 1 15 GLN HA H 2.524 1.021 4.985 1.00 . A A . 15 GLN HA 1 1 6 4084 1 1 15 GLN HB2 H 4.450 2.196 2.997 1.00 . A A . 15 GLN HB2 1 1 6 4085 1 1 15 GLN HB3 H 2.717 2.437 2.772 1.00 . A A . 15 GLN HB3 1 1 6 4086 1 1 15 GLN HE21 H 3.844 4.037 7.024 1.00 . A A . 15 GLN HE21 1 1 6 4087 1 1 15 GLN HE22 H 5.421 3.470 7.301 1.00 . A A . 15 GLN HE22 1 1 6 4088 1 1 15 GLN HG2 H 3.577 4.300 4.062 1.00 . A A . 15 GLN HG2 1 1 6 4089 1 1 15 GLN HG3 H 2.598 3.296 5.131 1.00 . A A . 15 GLN HG3 1 1 6 4090 1 1 15 GLN N N 4.494 0.323 4.686 1.00 . A A . 15 GLN N 1 1 6 4091 1 1 15 GLN NE2 N 4.654 3.587 6.702 1.00 . A A . 15 GLN NE2 1 1 6 4092 1 1 15 GLN O O 1.441 -0.327 3.115 1.00 . A A . 15 GLN O 1 1 6 4093 1 1 15 GLN OE1 O 5.715 2.590 5.077 1.00 . A A . 15 GLN OE1 1 1 6 4094 1 1 16 LEU C C 2.301 -2.793 1.994 1.00 . A A . 16 LEU C 1 1 6 4095 1 1 16 LEU CA C 2.971 -1.608 1.301 1.00 . A A . 16 LEU CA 1 1 6 4096 1 1 16 LEU CB C 4.144 -2.115 0.483 1.00 . A A . 16 LEU CB 1 1 6 4097 1 1 16 LEU CD1 C 6.040 -0.599 -0.096 1.00 . A A . 16 LEU CD1 1 1 6 4098 1 1 16 LEU CD2 C 4.571 -1.505 -1.881 1.00 . A A . 16 LEU CD2 1 1 6 4099 1 1 16 LEU CG C 4.613 -1.002 -0.446 1.00 . A A . 16 LEU CG 1 1 6 4100 1 1 16 LEU H H 4.422 -0.431 2.374 1.00 . A A . 16 LEU H 1 1 6 4101 1 1 16 LEU HA H 2.270 -1.116 0.647 1.00 . A A . 16 LEU HA 1 1 6 4102 1 1 16 LEU HB2 H 4.940 -2.404 1.144 1.00 . A A . 16 LEU HB2 1 1 6 4103 1 1 16 LEU HB3 H 3.837 -2.966 -0.105 1.00 . A A . 16 LEU HB3 1 1 6 4104 1 1 16 LEU HD11 H 6.117 -0.445 0.969 1.00 . A A . 16 LEU HD11 1 1 6 4105 1 1 16 LEU HD12 H 6.292 0.314 -0.614 1.00 . A A . 16 LEU HD12 1 1 6 4106 1 1 16 LEU HD13 H 6.717 -1.385 -0.397 1.00 . A A . 16 LEU HD13 1 1 6 4107 1 1 16 LEU HD21 H 5.533 -1.922 -2.140 1.00 . A A . 16 LEU HD21 1 1 6 4108 1 1 16 LEU HD22 H 4.340 -0.686 -2.541 1.00 . A A . 16 LEU HD22 1 1 6 4109 1 1 16 LEU HD23 H 3.812 -2.268 -1.969 1.00 . A A . 16 LEU HD23 1 1 6 4110 1 1 16 LEU HG H 3.962 -0.148 -0.339 1.00 . A A . 16 LEU HG 1 1 6 4111 1 1 16 LEU N N 3.465 -0.645 2.322 1.00 . A A . 16 LEU N 1 1 6 4112 1 1 16 LEU O O 1.158 -3.115 1.738 1.00 . A A . 16 LEU O 1 1 6 4113 1 1 17 GLU C C 1.137 -4.204 4.284 1.00 . A A . 17 GLU C 1 1 6 4114 1 1 17 GLU CA C 2.435 -4.615 3.587 1.00 . A A . 17 GLU CA 1 1 6 4115 1 1 17 GLU CB C 3.436 -5.121 4.630 1.00 . A A . 17 GLU CB 1 1 6 4116 1 1 17 GLU CD C 4.149 -7.136 5.927 1.00 . A A . 17 GLU CD 1 1 6 4117 1 1 17 GLU CG C 3.379 -6.649 4.698 1.00 . A A . 17 GLU CG 1 1 6 4118 1 1 17 GLU H H 3.938 -3.165 3.056 1.00 . A A . 17 GLU H 1 1 6 4119 1 1 17 GLU HA H 2.228 -5.402 2.879 1.00 . A A . 17 GLU HA 1 1 6 4120 1 1 17 GLU HB2 H 4.433 -4.810 4.351 1.00 . A A . 17 GLU HB2 1 1 6 4121 1 1 17 GLU HB3 H 3.188 -4.710 5.596 1.00 . A A . 17 GLU HB3 1 1 6 4122 1 1 17 GLU HG2 H 2.349 -6.966 4.769 1.00 . A A . 17 GLU HG2 1 1 6 4123 1 1 17 GLU HG3 H 3.824 -7.066 3.808 1.00 . A A . 17 GLU HG3 1 1 6 4124 1 1 17 GLU N N 3.015 -3.445 2.871 1.00 . A A . 17 GLU N 1 1 6 4125 1 1 17 GLU O O 0.346 -5.037 4.683 1.00 . A A . 17 GLU O 1 1 6 4126 1 1 17 GLU OE1 O 4.701 -6.302 6.626 1.00 . A A . 17 GLU OE1 1 1 6 4127 1 1 17 GLU OE2 O 4.174 -8.336 6.148 1.00 . A A . 17 GLU OE2 1 1 6 4128 1 1 18 ASN C C -1.456 -2.326 4.081 1.00 . A A . 18 ASN C 1 1 6 4129 1 1 18 ASN CA C -0.335 -2.474 5.111 1.00 . A A . 18 ASN CA 1 1 6 4130 1 1 18 ASN CB C -0.081 -1.127 5.788 1.00 . A A . 18 ASN CB 1 1 6 4131 1 1 18 ASN CG C -0.617 -1.168 7.220 1.00 . A A . 18 ASN CG 1 1 6 4132 1 1 18 ASN H H 1.559 -2.272 4.114 1.00 . A A . 18 ASN H 1 1 6 4133 1 1 18 ASN HA H -0.625 -3.200 5.857 1.00 . A A . 18 ASN HA 1 1 6 4134 1 1 18 ASN HB2 H 0.981 -0.928 5.807 1.00 . A A . 18 ASN HB2 1 1 6 4135 1 1 18 ASN HB3 H -0.585 -0.346 5.240 1.00 . A A . 18 ASN HB3 1 1 6 4136 1 1 18 ASN HD21 H -0.561 0.803 7.447 1.00 . A A . 18 ASN HD21 1 1 6 4137 1 1 18 ASN HD22 H -1.126 -0.067 8.791 1.00 . A A . 18 ASN HD22 1 1 6 4138 1 1 18 ASN N N 0.910 -2.930 4.438 1.00 . A A . 18 ASN N 1 1 6 4139 1 1 18 ASN ND2 N -0.782 -0.052 7.874 1.00 . A A . 18 ASN ND2 1 1 6 4140 1 1 18 ASN O O -2.524 -1.833 4.384 1.00 . A A . 18 ASN O 1 1 6 4141 1 1 18 ASN OD1 O -0.888 -2.228 7.749 1.00 . A A . 18 ASN OD1 1 1 6 4142 1 1 19 TYR C C -2.420 -3.940 1.063 1.00 . A A . 19 TYR C 1 1 6 4143 1 1 19 TYR CA C -2.294 -2.622 1.830 1.00 . A A . 19 TYR CA 1 1 6 4144 1 1 19 TYR CB C -1.940 -1.494 0.859 1.00 . A A . 19 TYR CB 1 1 6 4145 1 1 19 TYR CD1 C -2.856 0.273 2.408 1.00 . A A . 19 TYR CD1 1 1 6 4146 1 1 19 TYR CD2 C -0.596 0.522 1.559 1.00 . A A . 19 TYR CD2 1 1 6 4147 1 1 19 TYR CE1 C -2.719 1.470 3.124 1.00 . A A . 19 TYR CE1 1 1 6 4148 1 1 19 TYR CE2 C -0.458 1.718 2.276 1.00 . A A . 19 TYR CE2 1 1 6 4149 1 1 19 TYR CG C -1.795 -0.201 1.625 1.00 . A A . 19 TYR CG 1 1 6 4150 1 1 19 TYR CZ C -1.520 2.192 3.059 1.00 . A A . 19 TYR CZ 1 1 6 4151 1 1 19 TYR H H -0.358 -3.143 2.633 1.00 . A A . 19 TYR H 1 1 6 4152 1 1 19 TYR HA H -3.234 -2.398 2.311 1.00 . A A . 19 TYR HA 1 1 6 4153 1 1 19 TYR HB2 H -1.009 -1.725 0.361 1.00 . A A . 19 TYR HB2 1 1 6 4154 1 1 19 TYR HB3 H -2.725 -1.389 0.125 1.00 . A A . 19 TYR HB3 1 1 6 4155 1 1 19 TYR HD1 H -3.782 -0.282 2.458 1.00 . A A . 19 TYR HD1 1 1 6 4156 1 1 19 TYR HD2 H 0.221 0.159 0.954 1.00 . A A . 19 TYR HD2 1 1 6 4157 1 1 19 TYR HE1 H -3.536 1.833 3.728 1.00 . A A . 19 TYR HE1 1 1 6 4158 1 1 19 TYR HE2 H 0.466 2.274 2.226 1.00 . A A . 19 TYR HE2 1 1 6 4159 1 1 19 TYR HH H -0.530 3.750 3.550 1.00 . A A . 19 TYR HH 1 1 6 4160 1 1 19 TYR N N -1.227 -2.747 2.865 1.00 . A A . 19 TYR N 1 1 6 4161 1 1 19 TYR O O -2.613 -3.956 -0.137 1.00 . A A . 19 TYR O 1 1 6 4162 1 1 19 TYR OH O -1.385 3.370 3.767 1.00 . A A . 19 TYR OH 1 1 6 4163 1 1 20 CYS C C -2.773 -7.450 2.081 1.00 . A A . 20 CYS C 1 1 6 4164 1 1 20 CYS CA C -2.438 -6.362 1.057 1.00 . A A . 20 CYS CA 1 1 6 4165 1 1 20 CYS CB C -1.114 -6.702 0.369 1.00 . A A . 20 CYS CB 1 1 6 4166 1 1 20 CYS H H -2.168 -5.013 2.714 1.00 . A A . 20 CYS H 1 1 6 4167 1 1 20 CYS HA H -3.225 -6.310 0.319 1.00 . A A . 20 CYS HA 1 1 6 4168 1 1 20 CYS HB2 H -0.856 -5.911 -0.322 1.00 . A A . 20 CYS HB2 1 1 6 4169 1 1 20 CYS HB3 H -0.337 -6.800 1.111 1.00 . A A . 20 CYS HB3 1 1 6 4170 1 1 20 CYS N N -2.319 -5.047 1.748 1.00 . A A . 20 CYS N 1 1 6 4171 1 1 20 CYS O O -2.563 -7.288 3.266 1.00 . A A . 20 CYS O 1 1 6 4172 1 1 20 CYS SG S -1.292 -8.262 -0.534 1.00 . A A . 20 CYS SG 1 1 6 4173 1 1 21 ASN C C -2.436 -9.962 3.467 1.00 . A A . 21 ASN C 1 1 6 4174 1 1 21 ASN CA C -3.642 -9.656 2.577 1.00 . A A . 21 ASN CA 1 1 6 4175 1 1 21 ASN CB C -4.022 -10.911 1.787 1.00 . A A . 21 ASN CB 1 1 6 4176 1 1 21 ASN CG C -5.536 -11.120 1.856 1.00 . A A . 21 ASN CG 1 1 6 4177 1 1 21 ASN H H -3.457 -8.670 0.671 1.00 . A A . 21 ASN H 1 1 6 4178 1 1 21 ASN HA H -4.476 -9.352 3.192 1.00 . A A . 21 ASN HA 1 1 6 4179 1 1 21 ASN HB2 H -3.722 -10.791 0.756 1.00 . A A . 21 ASN HB2 1 1 6 4180 1 1 21 ASN HB3 H -3.524 -11.769 2.211 1.00 . A A . 21 ASN HB3 1 1 6 4181 1 1 21 ASN HD21 H -5.623 -12.069 0.116 1.00 . A A . 21 ASN HD21 1 1 6 4182 1 1 21 ASN HD22 H -7.109 -11.883 0.915 1.00 . A A . 21 ASN HD22 1 1 6 4183 1 1 21 ASN N N -3.295 -8.559 1.631 1.00 . A A . 21 ASN N 1 1 6 4184 1 1 21 ASN ND2 N -6.139 -11.741 0.882 1.00 . A A . 21 ASN ND2 1 1 6 4185 1 1 21 ASN O O -2.601 -10.703 4.422 1.00 . A A . 21 ASN O 1 1 6 4186 1 1 21 ASN OXT O -1.366 -9.450 3.176 1.00 . A A . 21 ASN OXT 1 1 6 4187 1 1 21 ASN OD1 O -6.175 -10.714 2.807 1.00 . A A . 21 ASN OD1 1 1 6 4188 2 2 1 PHE C C 11.573 -1.095 0.621 1.00 . B B . 1 PHE C 1 1 6 4189 2 2 1 PHE CA C 10.706 -1.720 -0.475 1.00 . B B . 1 PHE CA 1 1 6 4190 2 2 1 PHE CB C 11.590 -2.149 -1.648 1.00 . B B . 1 PHE CB 1 1 6 4191 2 2 1 PHE CD1 C 10.230 -4.140 -2.395 1.00 . B B . 1 PHE CD1 1 1 6 4192 2 2 1 PHE CD2 C 10.492 -2.267 -3.915 1.00 . B B . 1 PHE CD2 1 1 6 4193 2 2 1 PHE CE1 C 9.452 -4.807 -3.351 1.00 . B B . 1 PHE CE1 1 1 6 4194 2 2 1 PHE CE2 C 9.715 -2.933 -4.871 1.00 . B B . 1 PHE CE2 1 1 6 4195 2 2 1 PHE CG C 10.750 -2.869 -2.676 1.00 . B B . 1 PHE CG 1 1 6 4196 2 2 1 PHE CZ C 9.195 -4.204 -4.590 1.00 . B B . 1 PHE CZ 1 1 6 4197 2 2 1 PHE H1 H 8.966 -1.203 -1.497 1.00 . B B . 1 PHE H1 1 1 6 4198 2 2 1 PHE H2 H 10.178 -0.014 -1.546 1.00 . B B . 1 PHE H2 1 1 6 4199 2 2 1 PHE H3 H 9.272 -0.251 -0.128 1.00 . B B . 1 PHE H3 1 1 6 4200 2 2 1 PHE HA H 10.193 -2.583 -0.078 1.00 . B B . 1 PHE HA 1 1 6 4201 2 2 1 PHE HB2 H 12.040 -1.276 -2.098 1.00 . B B . 1 PHE HB2 1 1 6 4202 2 2 1 PHE HB3 H 12.364 -2.811 -1.292 1.00 . B B . 1 PHE HB3 1 1 6 4203 2 2 1 PHE HD1 H 10.428 -4.606 -1.441 1.00 . B B . 1 PHE HD1 1 1 6 4204 2 2 1 PHE HD2 H 10.892 -1.287 -4.132 1.00 . B B . 1 PHE HD2 1 1 6 4205 2 2 1 PHE HE1 H 9.052 -5.786 -3.134 1.00 . B B . 1 PHE HE1 1 1 6 4206 2 2 1 PHE HE2 H 9.517 -2.468 -5.826 1.00 . B B . 1 PHE HE2 1 1 6 4207 2 2 1 PHE HZ H 8.597 -4.718 -5.327 1.00 . B B . 1 PHE HZ 1 1 6 4208 2 2 1 PHE N N 9.705 -0.722 -0.947 1.00 . B B . 1 PHE N 1 1 6 4209 2 2 1 PHE O O 11.360 -1.320 1.796 1.00 . B B . 1 PHE O 1 1 6 4210 2 2 2 VAL C C 12.835 1.692 1.661 1.00 . B B . 2 VAL C 1 1 6 4211 2 2 2 VAL CA C 13.420 0.332 1.278 1.00 . B B . 2 VAL CA 1 1 6 4212 2 2 2 VAL CB C 14.834 0.530 0.720 1.00 . B B . 2 VAL CB 1 1 6 4213 2 2 2 VAL CG1 C 15.852 0.386 1.853 1.00 . B B . 2 VAL CG1 1 1 6 4214 2 2 2 VAL CG2 C 15.121 -0.522 -0.355 1.00 . B B . 2 VAL CG2 1 1 6 4215 2 2 2 VAL H H 12.704 -0.134 -0.702 1.00 . B B . 2 VAL H 1 1 6 4216 2 2 2 VAL HA H 13.463 -0.297 2.154 1.00 . B B . 2 VAL HA 1 1 6 4217 2 2 2 VAL HB H 14.915 1.518 0.290 1.00 . B B . 2 VAL HB 1 1 6 4218 2 2 2 VAL HG11 H 15.440 -0.239 2.629 1.00 . B B . 2 VAL HG11 1 1 6 4219 2 2 2 VAL HG12 H 16.080 1.361 2.258 1.00 . B B . 2 VAL HG12 1 1 6 4220 2 2 2 VAL HG13 H 16.757 -0.064 1.469 1.00 . B B . 2 VAL HG13 1 1 6 4221 2 2 2 VAL HG21 H 14.767 -0.165 -1.311 1.00 . B B . 2 VAL HG21 1 1 6 4222 2 2 2 VAL HG22 H 14.614 -1.441 -0.103 1.00 . B B . 2 VAL HG22 1 1 6 4223 2 2 2 VAL HG23 H 16.185 -0.700 -0.409 1.00 . B B . 2 VAL HG23 1 1 6 4224 2 2 2 VAL N N 12.547 -0.307 0.249 1.00 . B B . 2 VAL N 1 1 6 4225 2 2 2 VAL O O 12.420 1.909 2.782 1.00 . B B . 2 VAL O 1 1 6 4226 2 2 3 ASN C C 12.183 4.767 -0.261 1.00 . B B . 3 ASN C 1 1 6 4227 2 2 3 ASN CA C 12.253 3.962 1.036 1.00 . B B . 3 ASN CA 1 1 6 4228 2 2 3 ASN CB C 13.161 4.690 2.040 1.00 . B B . 3 ASN CB 1 1 6 4229 2 2 3 ASN CG C 14.522 3.990 2.133 1.00 . B B . 3 ASN CG 1 1 6 4230 2 2 3 ASN H H 13.148 2.410 -0.160 1.00 . B B . 3 ASN H 1 1 6 4231 2 2 3 ASN HA H 11.261 3.862 1.453 1.00 . B B . 3 ASN HA 1 1 6 4232 2 2 3 ASN HB2 H 13.307 5.709 1.713 1.00 . B B . 3 ASN HB2 1 1 6 4233 2 2 3 ASN HB3 H 12.693 4.689 3.013 1.00 . B B . 3 ASN HB3 1 1 6 4234 2 2 3 ASN HD21 H 15.382 5.170 0.786 1.00 . B B . 3 ASN HD21 1 1 6 4235 2 2 3 ASN HD22 H 16.385 3.968 1.445 1.00 . B B . 3 ASN HD22 1 1 6 4236 2 2 3 ASN N N 12.804 2.609 0.735 1.00 . B B . 3 ASN N 1 1 6 4237 2 2 3 ASN ND2 N 15.511 4.411 1.393 1.00 . B B . 3 ASN ND2 1 1 6 4238 2 2 3 ASN O O 12.673 5.876 -0.346 1.00 . B B . 3 ASN O 1 1 6 4239 2 2 3 ASN OD1 O 14.683 3.049 2.884 1.00 . B B . 3 ASN OD1 1 1 6 4240 2 2 4 GLN C C 10.095 5.523 -2.757 1.00 . B B . 4 GLN C 1 1 6 4241 2 2 4 GLN CA C 11.493 4.925 -2.581 1.00 . B B . 4 GLN CA 1 1 6 4242 2 2 4 GLN CB C 11.768 3.942 -3.720 1.00 . B B . 4 GLN CB 1 1 6 4243 2 2 4 GLN CD C 13.669 3.822 -5.335 1.00 . B B . 4 GLN CD 1 1 6 4244 2 2 4 GLN CG C 12.486 4.667 -4.860 1.00 . B B . 4 GLN CG 1 1 6 4245 2 2 4 GLN H H 11.209 3.307 -1.189 1.00 . B B . 4 GLN H 1 1 6 4246 2 2 4 GLN HA H 12.228 5.716 -2.608 1.00 . B B . 4 GLN HA 1 1 6 4247 2 2 4 GLN HB2 H 12.388 3.136 -3.358 1.00 . B B . 4 GLN HB2 1 1 6 4248 2 2 4 GLN HB3 H 10.832 3.542 -4.083 1.00 . B B . 4 GLN HB3 1 1 6 4249 2 2 4 GLN HE21 H 14.949 5.340 -5.297 1.00 . B B . 4 GLN HE21 1 1 6 4250 2 2 4 GLN HE22 H 15.601 3.852 -5.788 1.00 . B B . 4 GLN HE22 1 1 6 4251 2 2 4 GLN HG2 H 11.798 4.817 -5.680 1.00 . B B . 4 GLN HG2 1 1 6 4252 2 2 4 GLN HG3 H 12.844 5.623 -4.511 1.00 . B B . 4 GLN HG3 1 1 6 4253 2 2 4 GLN N N 11.589 4.206 -1.279 1.00 . B B . 4 GLN N 1 1 6 4254 2 2 4 GLN NE2 N 14.837 4.385 -5.486 1.00 . B B . 4 GLN NE2 1 1 6 4255 2 2 4 GLN O O 9.291 5.547 -1.841 1.00 . B B . 4 GLN O 1 1 6 4256 2 2 4 GLN OE1 O 13.531 2.638 -5.569 1.00 . B B . 4 GLN OE1 1 1 6 4257 2 2 5 HIS C C 7.586 5.558 -4.907 1.00 . B B . 5 HIS C 1 1 6 4258 2 2 5 HIS CA C 8.466 6.594 -4.202 1.00 . B B . 5 HIS CA 1 1 6 4259 2 2 5 HIS CB C 8.624 7.818 -5.107 1.00 . B B . 5 HIS CB 1 1 6 4260 2 2 5 HIS CD2 C 8.279 10.092 -3.866 1.00 . B B . 5 HIS CD2 1 1 6 4261 2 2 5 HIS CE1 C 10.302 10.323 -3.112 1.00 . B B . 5 HIS CE1 1 1 6 4262 2 2 5 HIS CG C 9.009 9.013 -4.280 1.00 . B B . 5 HIS CG 1 1 6 4263 2 2 5 HIS H H 10.471 5.962 -4.655 1.00 . B B . 5 HIS H 1 1 6 4264 2 2 5 HIS HA H 8.007 6.889 -3.270 1.00 . B B . 5 HIS HA 1 1 6 4265 2 2 5 HIS HB2 H 9.393 7.625 -5.840 1.00 . B B . 5 HIS HB2 1 1 6 4266 2 2 5 HIS HB3 H 7.689 8.016 -5.610 1.00 . B B . 5 HIS HB3 1 1 6 4267 2 2 5 HIS HD2 H 7.235 10.265 -4.084 1.00 . B B . 5 HIS HD2 1 1 6 4268 2 2 5 HIS HE1 H 11.171 10.721 -2.609 1.00 . B B . 5 HIS HE1 1 1 6 4269 2 2 5 HIS HE2 H 8.847 11.769 -2.701 1.00 . B B . 5 HIS HE2 1 1 6 4270 2 2 5 HIS N N 9.804 6.000 -3.937 1.00 . B B . 5 HIS N 1 1 6 4271 2 2 5 HIS ND1 N 10.291 9.171 -3.797 1.00 . B B . 5 HIS ND1 1 1 6 4272 2 2 5 HIS NE2 N 9.094 10.922 -3.126 1.00 . B B . 5 HIS NE2 1 1 6 4273 2 2 5 HIS O O 7.963 4.995 -5.915 1.00 . B B . 5 HIS O 1 1 6 4274 2 2 6 LEU C C 4.447 5.063 -5.834 1.00 . B B . 6 LEU C 1 1 6 4275 2 2 6 LEU CA C 5.513 4.312 -5.033 1.00 . B B . 6 LEU CA 1 1 6 4276 2 2 6 LEU CB C 4.860 3.454 -3.948 1.00 . B B . 6 LEU CB 1 1 6 4277 2 2 6 LEU CD1 C 5.260 2.263 -1.785 1.00 . B B . 6 LEU CD1 1 1 6 4278 2 2 6 LEU CD2 C 6.922 2.081 -3.641 1.00 . B B . 6 LEU CD2 1 1 6 4279 2 2 6 LEU CG C 5.925 3.009 -2.943 1.00 . B B . 6 LEU CG 1 1 6 4280 2 2 6 LEU H H 6.128 5.776 -3.581 1.00 . B B . 6 LEU H 1 1 6 4281 2 2 6 LEU HA H 6.082 3.681 -5.699 1.00 . B B . 6 LEU HA 1 1 6 4282 2 2 6 LEU HB2 H 4.101 4.030 -3.440 1.00 . B B . 6 LEU HB2 1 1 6 4283 2 2 6 LEU HB3 H 4.412 2.583 -4.400 1.00 . B B . 6 LEU HB3 1 1 6 4284 2 2 6 LEU HD11 H 5.298 1.199 -1.972 1.00 . B B . 6 LEU HD11 1 1 6 4285 2 2 6 LEU HD12 H 4.230 2.575 -1.697 1.00 . B B . 6 LEU HD12 1 1 6 4286 2 2 6 LEU HD13 H 5.783 2.485 -0.866 1.00 . B B . 6 LEU HD13 1 1 6 4287 2 2 6 LEU HD21 H 7.180 1.268 -2.979 1.00 . B B . 6 LEU HD21 1 1 6 4288 2 2 6 LEU HD22 H 7.813 2.636 -3.895 1.00 . B B . 6 LEU HD22 1 1 6 4289 2 2 6 LEU HD23 H 6.475 1.685 -4.540 1.00 . B B . 6 LEU HD23 1 1 6 4290 2 2 6 LEU HG H 6.444 3.877 -2.561 1.00 . B B . 6 LEU HG 1 1 6 4291 2 2 6 LEU N N 6.417 5.305 -4.390 1.00 . B B . 6 LEU N 1 1 6 4292 2 2 6 LEU O O 3.608 5.742 -5.277 1.00 . B B . 6 LEU O 1 1 6 4293 2 2 7 CYS C C 2.782 4.764 -8.951 1.00 . B B . 7 CYS C 1 1 6 4294 2 2 7 CYS CA C 3.473 5.704 -7.955 1.00 . B B . 7 CYS CA 1 1 6 4295 2 2 7 CYS CB C 4.172 6.822 -8.736 1.00 . B B . 7 CYS CB 1 1 6 4296 2 2 7 CYS H H 5.173 4.428 -7.578 1.00 . B B . 7 CYS H 1 1 6 4297 2 2 7 CYS HA H 2.735 6.135 -7.298 1.00 . B B . 7 CYS HA 1 1 6 4298 2 2 7 CYS HB2 H 5.201 6.547 -8.913 1.00 . B B . 7 CYS HB2 1 1 6 4299 2 2 7 CYS HB3 H 3.671 6.964 -9.682 1.00 . B B . 7 CYS HB3 1 1 6 4300 2 2 7 CYS N N 4.481 4.967 -7.140 1.00 . B B . 7 CYS N 1 1 6 4301 2 2 7 CYS O O 3.419 4.136 -9.772 1.00 . B B . 7 CYS O 1 1 6 4302 2 2 7 CYS SG S 4.117 8.366 -7.790 1.00 . B B . 7 CYS SG 1 1 6 4303 2 2 8 GLY C C 1.472 2.564 -10.202 1.00 . B B . 8 GLY C 1 1 6 4304 2 2 8 GLY CA C 0.697 3.834 -9.837 1.00 . B B . 8 GLY CA 1 1 6 4305 2 2 8 GLY H H 0.998 5.236 -8.229 1.00 . B B . 8 GLY H 1 1 6 4306 2 2 8 GLY HA2 H -0.238 3.557 -9.373 1.00 . B B . 8 GLY HA2 1 1 6 4307 2 2 8 GLY HA3 H 0.493 4.393 -10.737 1.00 . B B . 8 GLY HA3 1 1 6 4308 2 2 8 GLY N N 1.476 4.696 -8.892 1.00 . B B . 8 GLY N 1 1 6 4309 2 2 8 GLY O O 1.658 1.685 -9.385 1.00 . B B . 8 GLY O 1 1 6 4310 2 2 9 SER C C 3.547 0.737 -10.765 1.00 . B B . 9 SER C 1 1 6 4311 2 2 9 SER CA C 2.652 1.251 -11.891 1.00 . B B . 9 SER CA 1 1 6 4312 2 2 9 SER CB C 3.515 1.612 -13.102 1.00 . B B . 9 SER CB 1 1 6 4313 2 2 9 SER H H 1.721 3.185 -12.073 1.00 . B B . 9 SER H 1 1 6 4314 2 2 9 SER HA H 1.950 0.480 -12.170 1.00 . B B . 9 SER HA 1 1 6 4315 2 2 9 SER HB2 H 4.359 0.945 -13.156 1.00 . B B . 9 SER HB2 1 1 6 4316 2 2 9 SER HB3 H 2.924 1.516 -14.003 1.00 . B B . 9 SER HB3 1 1 6 4317 2 2 9 SER HG H 3.393 3.520 -13.463 1.00 . B B . 9 SER HG 1 1 6 4318 2 2 9 SER N N 1.903 2.463 -11.437 1.00 . B B . 9 SER N 1 1 6 4319 2 2 9 SER O O 3.298 -0.303 -10.189 1.00 . B B . 9 SER O 1 1 6 4320 2 2 9 SER OG O 3.982 2.948 -12.965 1.00 . B B . 9 SER OG 1 1 6 4321 2 2 10 ASP C C 4.619 0.657 -8.131 1.00 . B B . 10 ASP C 1 1 6 4322 2 2 10 ASP CA C 5.474 1.015 -9.338 1.00 . B B . 10 ASP CA 1 1 6 4323 2 2 10 ASP CB C 6.419 2.154 -8.964 1.00 . B B . 10 ASP CB 1 1 6 4324 2 2 10 ASP CG C 7.254 2.544 -10.186 1.00 . B B . 10 ASP CG 1 1 6 4325 2 2 10 ASP H H 4.757 2.302 -10.906 1.00 . B B . 10 ASP H 1 1 6 4326 2 2 10 ASP HA H 6.039 0.150 -9.654 1.00 . B B . 10 ASP HA 1 1 6 4327 2 2 10 ASP HB2 H 5.836 3.006 -8.632 1.00 . B B . 10 ASP HB2 1 1 6 4328 2 2 10 ASP HB3 H 7.075 1.834 -8.169 1.00 . B B . 10 ASP HB3 1 1 6 4329 2 2 10 ASP N N 4.578 1.460 -10.437 1.00 . B B . 10 ASP N 1 1 6 4330 2 2 10 ASP O O 4.829 -0.341 -7.474 1.00 . B B . 10 ASP O 1 1 6 4331 2 2 10 ASP OD1 O 6.705 3.165 -11.081 1.00 . B B . 10 ASP OD1 1 1 6 4332 2 2 10 ASP OD2 O 8.427 2.212 -10.208 1.00 . B B . 10 ASP OD2 1 1 6 4333 2 2 11 LEU C C 2.278 -0.252 -6.779 1.00 . B B . 11 LEU C 1 1 6 4334 2 2 11 LEU CA C 2.763 1.192 -6.685 1.00 . B B . 11 LEU CA 1 1 6 4335 2 2 11 LEU CB C 1.569 2.143 -6.757 1.00 . B B . 11 LEU CB 1 1 6 4336 2 2 11 LEU CD1 C 1.900 2.308 -4.244 1.00 . B B . 11 LEU CD1 1 1 6 4337 2 2 11 LEU CD2 C 0.200 3.695 -5.394 1.00 . B B . 11 LEU CD2 1 1 6 4338 2 2 11 LEU CG C 0.888 2.336 -5.391 1.00 . B B . 11 LEU CG 1 1 6 4339 2 2 11 LEU H H 3.499 2.268 -8.391 1.00 . B B . 11 LEU H 1 1 6 4340 2 2 11 LEU HA H 3.312 1.340 -5.775 1.00 . B B . 11 LEU HA 1 1 6 4341 2 2 11 LEU HB2 H 1.907 3.100 -7.120 1.00 . B B . 11 LEU HB2 1 1 6 4342 2 2 11 LEU HB3 H 0.848 1.738 -7.454 1.00 . B B . 11 LEU HB3 1 1 6 4343 2 2 11 LEU HD11 H 2.636 3.078 -4.400 1.00 . B B . 11 LEU HD11 1 1 6 4344 2 2 11 LEU HD12 H 2.384 1.344 -4.204 1.00 . B B . 11 LEU HD12 1 1 6 4345 2 2 11 LEU HD13 H 1.386 2.489 -3.309 1.00 . B B . 11 LEU HD13 1 1 6 4346 2 2 11 LEU HD21 H -0.146 3.927 -4.399 1.00 . B B . 11 LEU HD21 1 1 6 4347 2 2 11 LEU HD22 H -0.636 3.673 -6.075 1.00 . B B . 11 LEU HD22 1 1 6 4348 2 2 11 LEU HD23 H 0.906 4.450 -5.715 1.00 . B B . 11 LEU HD23 1 1 6 4349 2 2 11 LEU HG H 0.151 1.561 -5.242 1.00 . B B . 11 LEU HG 1 1 6 4350 2 2 11 LEU N N 3.649 1.471 -7.841 1.00 . B B . 11 LEU N 1 1 6 4351 2 2 11 LEU O O 2.400 -1.023 -5.849 1.00 . B B . 11 LEU O 1 1 6 4352 2 2 12 ALA C C 2.473 -2.933 -8.260 1.00 . B B . 12 ALA C 1 1 6 4353 2 2 12 ALA CA C 1.264 -2.020 -8.077 1.00 . B B . 12 ALA CA 1 1 6 4354 2 2 12 ALA CB C 0.360 -2.114 -9.308 1.00 . B B . 12 ALA CB 1 1 6 4355 2 2 12 ALA H H 1.665 0.013 -8.648 1.00 . B B . 12 ALA H 1 1 6 4356 2 2 12 ALA HA H 0.712 -2.324 -7.197 1.00 . B B . 12 ALA HA 1 1 6 4357 2 2 12 ALA HB1 H 0.768 -1.506 -10.101 1.00 . B B . 12 ALA HB1 1 1 6 4358 2 2 12 ALA HB2 H -0.629 -1.762 -9.056 1.00 . B B . 12 ALA HB2 1 1 6 4359 2 2 12 ALA HB3 H 0.304 -3.142 -9.635 1.00 . B B . 12 ALA HB3 1 1 6 4360 2 2 12 ALA N N 1.743 -0.624 -7.908 1.00 . B B . 12 ALA N 1 1 6 4361 2 2 12 ALA O O 2.639 -3.895 -7.547 1.00 . B B . 12 ALA O 1 1 6 4362 2 2 13 GLU C C 5.226 -3.687 -8.068 1.00 . B B . 13 GLU C 1 1 6 4363 2 2 13 GLU CA C 4.528 -3.488 -9.409 1.00 . B B . 13 GLU CA 1 1 6 4364 2 2 13 GLU CB C 5.486 -2.812 -10.392 1.00 . B B . 13 GLU CB 1 1 6 4365 2 2 13 GLU CD C 6.423 -2.939 -12.706 1.00 . B B . 13 GLU CD 1 1 6 4366 2 2 13 GLU CG C 5.301 -3.419 -11.784 1.00 . B B . 13 GLU CG 1 1 6 4367 2 2 13 GLU H H 3.189 -1.838 -9.764 1.00 . B B . 13 GLU H 1 1 6 4368 2 2 13 GLU HA H 4.223 -4.451 -9.801 1.00 . B B . 13 GLU HA 1 1 6 4369 2 2 13 GLU HB2 H 5.277 -1.752 -10.428 1.00 . B B . 13 GLU HB2 1 1 6 4370 2 2 13 GLU HB3 H 6.504 -2.967 -10.067 1.00 . B B . 13 GLU HB3 1 1 6 4371 2 2 13 GLU HG2 H 5.328 -4.497 -11.712 1.00 . B B . 13 GLU HG2 1 1 6 4372 2 2 13 GLU HG3 H 4.349 -3.108 -12.188 1.00 . B B . 13 GLU HG3 1 1 6 4373 2 2 13 GLU N N 3.328 -2.631 -9.203 1.00 . B B . 13 GLU N 1 1 6 4374 2 2 13 GLU O O 5.819 -4.716 -7.812 1.00 . B B . 13 GLU O 1 1 6 4375 2 2 13 GLU OE1 O 7.292 -2.228 -12.230 1.00 . B B . 13 GLU OE1 1 1 6 4376 2 2 13 GLU OE2 O 6.396 -3.294 -13.873 1.00 . B B . 13 GLU OE2 1 1 6 4377 2 2 14 ALA C C 4.959 -3.848 -5.045 1.00 . B B . 14 ALA C 1 1 6 4378 2 2 14 ALA CA C 5.793 -2.874 -5.870 1.00 . B B . 14 ALA CA 1 1 6 4379 2 2 14 ALA CB C 5.857 -1.520 -5.163 1.00 . B B . 14 ALA CB 1 1 6 4380 2 2 14 ALA H H 4.649 -1.895 -7.413 1.00 . B B . 14 ALA H 1 1 6 4381 2 2 14 ALA HA H 6.793 -3.270 -5.995 1.00 . B B . 14 ALA HA 1 1 6 4382 2 2 14 ALA HB1 H 4.868 -1.093 -5.112 1.00 . B B . 14 ALA HB1 1 1 6 4383 2 2 14 ALA HB2 H 6.508 -0.857 -5.714 1.00 . B B . 14 ALA HB2 1 1 6 4384 2 2 14 ALA HB3 H 6.243 -1.655 -4.163 1.00 . B B . 14 ALA HB3 1 1 6 4385 2 2 14 ALA N N 5.147 -2.718 -7.198 1.00 . B B . 14 ALA N 1 1 6 4386 2 2 14 ALA O O 5.458 -4.833 -4.541 1.00 . B B . 14 ALA O 1 1 6 4387 2 2 15 LEU C C 2.754 -5.862 -4.899 1.00 . B B . 15 LEU C 1 1 6 4388 2 2 15 LEU CA C 2.819 -4.527 -4.151 1.00 . B B . 15 LEU CA 1 1 6 4389 2 2 15 LEU CB C 1.409 -3.943 -4.036 1.00 . B B . 15 LEU CB 1 1 6 4390 2 2 15 LEU CD1 C 0.160 -1.911 -3.296 1.00 . B B . 15 LEU CD1 1 1 6 4391 2 2 15 LEU CD2 C 1.487 -3.235 -1.647 1.00 . B B . 15 LEU CD2 1 1 6 4392 2 2 15 LEU CG C 1.428 -2.742 -3.093 1.00 . B B . 15 LEU CG 1 1 6 4393 2 2 15 LEU H H 3.292 -2.804 -5.358 1.00 . B B . 15 LEU H 1 1 6 4394 2 2 15 LEU HA H 3.237 -4.674 -3.164 1.00 . B B . 15 LEU HA 1 1 6 4395 2 2 15 LEU HB2 H 1.068 -3.631 -5.012 1.00 . B B . 15 LEU HB2 1 1 6 4396 2 2 15 LEU HB3 H 0.739 -4.695 -3.644 1.00 . B B . 15 LEU HB3 1 1 6 4397 2 2 15 LEU HD11 H 0.098 -1.155 -2.526 1.00 . B B . 15 LEU HD11 1 1 6 4398 2 2 15 LEU HD12 H -0.705 -2.554 -3.239 1.00 . B B . 15 LEU HD12 1 1 6 4399 2 2 15 LEU HD13 H 0.193 -1.436 -4.265 1.00 . B B . 15 LEU HD13 1 1 6 4400 2 2 15 LEU HD21 H 0.533 -3.660 -1.373 1.00 . B B . 15 LEU HD21 1 1 6 4401 2 2 15 LEU HD22 H 1.715 -2.408 -0.993 1.00 . B B . 15 LEU HD22 1 1 6 4402 2 2 15 LEU HD23 H 2.255 -3.990 -1.556 1.00 . B B . 15 LEU HD23 1 1 6 4403 2 2 15 LEU HG H 2.296 -2.133 -3.304 1.00 . B B . 15 LEU HG 1 1 6 4404 2 2 15 LEU N N 3.683 -3.596 -4.925 1.00 . B B . 15 LEU N 1 1 6 4405 2 2 15 LEU O O 2.474 -6.899 -4.330 1.00 . B B . 15 LEU O 1 1 6 4406 2 2 16 TYR C C 4.199 -7.931 -6.660 1.00 . B B . 16 TYR C 1 1 6 4407 2 2 16 TYR CA C 2.983 -7.078 -6.995 1.00 . B B . 16 TYR CA 1 1 6 4408 2 2 16 TYR CB C 3.046 -6.708 -8.480 1.00 . B B . 16 TYR CB 1 1 6 4409 2 2 16 TYR CD1 C 1.884 -8.751 -9.386 1.00 . B B . 16 TYR CD1 1 1 6 4410 2 2 16 TYR CD2 C 0.878 -6.571 -9.740 1.00 . B B . 16 TYR CD2 1 1 6 4411 2 2 16 TYR CE1 C 0.822 -9.353 -10.077 1.00 . B B . 16 TYR CE1 1 1 6 4412 2 2 16 TYR CE2 C -0.183 -7.171 -10.430 1.00 . B B . 16 TYR CE2 1 1 6 4413 2 2 16 TYR CG C 1.908 -7.360 -9.220 1.00 . B B . 16 TYR CG 1 1 6 4414 2 2 16 TYR CZ C -0.212 -8.561 -10.598 1.00 . B B . 16 TYR CZ 1 1 6 4415 2 2 16 TYR H H 3.241 -4.979 -6.607 1.00 . B B . 16 TYR H 1 1 6 4416 2 2 16 TYR HA H 2.077 -7.628 -6.792 1.00 . B B . 16 TYR HA 1 1 6 4417 2 2 16 TYR HB2 H 2.979 -5.638 -8.590 1.00 . B B . 16 TYR HB2 1 1 6 4418 2 2 16 TYR HB3 H 3.981 -7.046 -8.895 1.00 . B B . 16 TYR HB3 1 1 6 4419 2 2 16 TYR HD1 H 2.684 -9.359 -8.984 1.00 . B B . 16 TYR HD1 1 1 6 4420 2 2 16 TYR HD2 H 0.904 -5.500 -9.609 1.00 . B B . 16 TYR HD2 1 1 6 4421 2 2 16 TYR HE1 H 0.800 -10.424 -10.207 1.00 . B B . 16 TYR HE1 1 1 6 4422 2 2 16 TYR HE2 H -0.980 -6.561 -10.832 1.00 . B B . 16 TYR HE2 1 1 6 4423 2 2 16 TYR HH H -1.983 -9.270 -10.659 1.00 . B B . 16 TYR HH 1 1 6 4424 2 2 16 TYR N N 3.017 -5.832 -6.178 1.00 . B B . 16 TYR N 1 1 6 4425 2 2 16 TYR O O 4.200 -9.135 -6.828 1.00 . B B . 16 TYR O 1 1 6 4426 2 2 16 TYR OH O -1.258 -9.153 -11.276 1.00 . B B . 16 TYR OH 1 1 6 4427 2 2 17 LEU C C 6.585 -8.259 -4.379 1.00 . B B . 17 LEU C 1 1 6 4428 2 2 17 LEU CA C 6.482 -8.049 -5.897 1.00 . B B . 17 LEU CA 1 1 6 4429 2 2 17 LEU CB C 7.647 -7.222 -6.413 1.00 . B B . 17 LEU CB 1 1 6 4430 2 2 17 LEU CD1 C 8.798 -9.455 -6.321 1.00 . B B . 17 LEU CD1 1 1 6 4431 2 2 17 LEU CD2 C 9.976 -7.440 -7.180 1.00 . B B . 17 LEU CD2 1 1 6 4432 2 2 17 LEU CG C 8.962 -7.936 -6.160 1.00 . B B . 17 LEU CG 1 1 6 4433 2 2 17 LEU H H 5.236 -6.336 -6.106 1.00 . B B . 17 LEU H 1 1 6 4434 2 2 17 LEU HA H 6.475 -9.004 -6.398 1.00 . B B . 17 LEU HA 1 1 6 4435 2 2 17 LEU HB2 H 7.528 -7.062 -7.475 1.00 . B B . 17 LEU HB2 1 1 6 4436 2 2 17 LEU HB3 H 7.658 -6.268 -5.909 1.00 . B B . 17 LEU HB3 1 1 6 4437 2 2 17 LEU HD11 H 9.732 -9.944 -6.083 1.00 . B B . 17 LEU HD11 1 1 6 4438 2 2 17 LEU HD12 H 8.524 -9.680 -7.341 1.00 . B B . 17 LEU HD12 1 1 6 4439 2 2 17 LEU HD13 H 8.027 -9.810 -5.657 1.00 . B B . 17 LEU HD13 1 1 6 4440 2 2 17 LEU HD21 H 9.939 -8.076 -8.055 1.00 . B B . 17 LEU HD21 1 1 6 4441 2 2 17 LEU HD22 H 10.963 -7.470 -6.752 1.00 . B B . 17 LEU HD22 1 1 6 4442 2 2 17 LEU HD23 H 9.730 -6.428 -7.463 1.00 . B B . 17 LEU HD23 1 1 6 4443 2 2 17 LEU HG H 9.299 -7.703 -5.166 1.00 . B B . 17 LEU HG 1 1 6 4444 2 2 17 LEU N N 5.249 -7.306 -6.213 1.00 . B B . 17 LEU N 1 1 6 4445 2 2 17 LEU O O 7.488 -8.905 -3.889 1.00 . B B . 17 LEU O 1 1 6 4446 2 2 18 VAL C C 4.614 -8.938 -1.782 1.00 . B B . 18 VAL C 1 1 6 4447 2 2 18 VAL CA C 5.682 -7.919 -2.155 1.00 . B B . 18 VAL CA 1 1 6 4448 2 2 18 VAL CB C 5.387 -6.590 -1.455 1.00 . B B . 18 VAL CB 1 1 6 4449 2 2 18 VAL CG1 C 6.155 -5.479 -2.150 1.00 . B B . 18 VAL CG1 1 1 6 4450 2 2 18 VAL CG2 C 3.889 -6.275 -1.521 1.00 . B B . 18 VAL CG2 1 1 6 4451 2 2 18 VAL H H 4.923 -7.223 -4.043 1.00 . B B . 18 VAL H 1 1 6 4452 2 2 18 VAL HA H 6.653 -8.283 -1.854 1.00 . B B . 18 VAL HA 1 1 6 4453 2 2 18 VAL HB H 5.700 -6.647 -0.426 1.00 . B B . 18 VAL HB 1 1 6 4454 2 2 18 VAL HG11 H 6.878 -5.065 -1.468 1.00 . B B . 18 VAL HG11 1 1 6 4455 2 2 18 VAL HG12 H 5.465 -4.712 -2.461 1.00 . B B . 18 VAL HG12 1 1 6 4456 2 2 18 VAL HG13 H 6.662 -5.882 -3.015 1.00 . B B . 18 VAL HG13 1 1 6 4457 2 2 18 VAL HG21 H 3.355 -6.924 -0.844 1.00 . B B . 18 VAL HG21 1 1 6 4458 2 2 18 VAL HG22 H 3.534 -6.433 -2.528 1.00 . B B . 18 VAL HG22 1 1 6 4459 2 2 18 VAL HG23 H 3.726 -5.246 -1.238 1.00 . B B . 18 VAL HG23 1 1 6 4460 2 2 18 VAL N N 5.652 -7.730 -3.633 1.00 . B B . 18 VAL N 1 1 6 4461 2 2 18 VAL O O 4.763 -9.709 -0.854 1.00 . B B . 18 VAL O 1 1 6 4462 2 2 19 CYS C C 2.414 -10.968 -3.314 1.00 . B B . 19 CYS C 1 1 6 4463 2 2 19 CYS CA C 2.448 -9.907 -2.210 1.00 . B B . 19 CYS CA 1 1 6 4464 2 2 19 CYS CB C 1.111 -9.162 -2.145 1.00 . B B . 19 CYS CB 1 1 6 4465 2 2 19 CYS H H 3.437 -8.313 -3.251 1.00 . B B . 19 CYS H 1 1 6 4466 2 2 19 CYS HA H 2.647 -10.375 -1.260 1.00 . B B . 19 CYS HA 1 1 6 4467 2 2 19 CYS HB2 H 1.245 -8.154 -2.508 1.00 . B B . 19 CYS HB2 1 1 6 4468 2 2 19 CYS HB3 H 0.382 -9.670 -2.757 1.00 . B B . 19 CYS HB3 1 1 6 4469 2 2 19 CYS N N 3.533 -8.944 -2.507 1.00 . B B . 19 CYS N 1 1 6 4470 2 2 19 CYS O O 2.216 -12.138 -3.061 1.00 . B B . 19 CYS O 1 1 6 4471 2 2 19 CYS SG S 0.537 -9.114 -0.428 1.00 . B B . 19 CYS SG 1 1 6 4472 2 2 20 GLY C C 1.355 -12.375 -5.660 1.00 . B B . 20 GLY C 1 1 6 4473 2 2 20 GLY CA C 2.634 -11.534 -5.669 1.00 . B B . 20 GLY CA 1 1 6 4474 2 2 20 GLY H H 2.798 -9.613 -4.710 1.00 . B B . 20 GLY H 1 1 6 4475 2 2 20 GLY HA2 H 2.699 -10.993 -6.602 1.00 . B B . 20 GLY HA2 1 1 6 4476 2 2 20 GLY HA3 H 3.489 -12.186 -5.574 1.00 . B B . 20 GLY HA3 1 1 6 4477 2 2 20 GLY N N 2.628 -10.561 -4.537 1.00 . B B . 20 GLY N 1 1 6 4478 2 2 20 GLY O O 1.181 -13.246 -4.832 1.00 . B B . 20 GLY O 1 1 6 4479 2 2 21 GLU C C -1.323 -13.215 -5.263 1.00 . B B . 21 GLU C 1 1 6 4480 2 2 21 GLU CA C -0.803 -12.901 -6.668 1.00 . B B . 21 GLU CA 1 1 6 4481 2 2 21 GLU CB C -0.559 -14.206 -7.424 1.00 . B B . 21 GLU CB 1 1 6 4482 2 2 21 GLU CD C 0.405 -16.494 -7.146 1.00 . B B . 21 GLU CD 1 1 6 4483 2 2 21 GLU CG C 0.495 -15.037 -6.690 1.00 . B B . 21 GLU CG 1 1 6 4484 2 2 21 GLU H H 0.647 -11.419 -7.248 1.00 . B B . 21 GLU H 1 1 6 4485 2 2 21 GLU HA H -1.544 -12.319 -7.197 1.00 . B B . 21 GLU HA 1 1 6 4486 2 2 21 GLU HB2 H -1.481 -14.765 -7.483 1.00 . B B . 21 GLU HB2 1 1 6 4487 2 2 21 GLU HB3 H -0.208 -13.982 -8.419 1.00 . B B . 21 GLU HB3 1 1 6 4488 2 2 21 GLU HG2 H 1.478 -14.649 -6.913 1.00 . B B . 21 GLU HG2 1 1 6 4489 2 2 21 GLU HG3 H 0.318 -14.984 -5.627 1.00 . B B . 21 GLU HG3 1 1 6 4490 2 2 21 GLU N N 0.470 -12.122 -6.589 1.00 . B B . 21 GLU N 1 1 6 4491 2 2 21 GLU O O -1.992 -14.205 -5.046 1.00 . B B . 21 GLU O 1 1 6 4492 2 2 21 GLU OE1 O -0.090 -16.723 -8.237 1.00 . B B . 21 GLU OE1 1 1 6 4493 2 2 21 GLU OE2 O 0.831 -17.356 -6.396 1.00 . B B . 21 GLU OE2 1 1 6 4494 2 2 22 ARG C C -2.770 -11.802 -2.677 1.00 . B B . 22 ARG C 1 1 6 4495 2 2 22 ARG CA C -1.507 -12.628 -2.925 1.00 . B B . 22 ARG CA 1 1 6 4496 2 2 22 ARG CB C -0.416 -12.226 -1.933 1.00 . B B . 22 ARG CB 1 1 6 4497 2 2 22 ARG CD C -0.413 -14.587 -1.133 1.00 . B B . 22 ARG CD 1 1 6 4498 2 2 22 ARG CG C 0.464 -13.438 -1.624 1.00 . B B . 22 ARG CG 1 1 6 4499 2 2 22 ARG CZ C 0.101 -14.884 1.217 1.00 . B B . 22 ARG CZ 1 1 6 4500 2 2 22 ARG H H -0.492 -11.587 -4.504 1.00 . B B . 22 ARG H 1 1 6 4501 2 2 22 ARG HA H -1.737 -13.676 -2.807 1.00 . B B . 22 ARG HA 1 1 6 4502 2 2 22 ARG HB2 H 0.188 -11.444 -2.366 1.00 . B B . 22 ARG HB2 1 1 6 4503 2 2 22 ARG HB3 H -0.868 -11.869 -1.021 1.00 . B B . 22 ARG HB3 1 1 6 4504 2 2 22 ARG HD2 H -1.359 -14.193 -0.790 1.00 . B B . 22 ARG HD2 1 1 6 4505 2 2 22 ARG HD3 H -0.585 -15.278 -1.945 1.00 . B B . 22 ARG HD3 1 1 6 4506 2 2 22 ARG HE H 0.840 -16.068 -0.196 1.00 . B B . 22 ARG HE 1 1 6 4507 2 2 22 ARG HG2 H 0.986 -13.741 -2.520 1.00 . B B . 22 ARG HG2 1 1 6 4508 2 2 22 ARG HG3 H 1.181 -13.180 -0.859 1.00 . B B . 22 ARG HG3 1 1 6 4509 2 2 22 ARG HH11 H 0.293 -12.944 0.762 1.00 . B B . 22 ARG HH11 1 1 6 4510 2 2 22 ARG HH12 H 0.010 -13.297 2.433 1.00 . B B . 22 ARG HH12 1 1 6 4511 2 2 22 ARG HH21 H -0.135 -16.728 1.962 1.00 . B B . 22 ARG HH21 1 1 6 4512 2 2 22 ARG HH22 H -0.232 -15.437 3.112 1.00 . B B . 22 ARG HH22 1 1 6 4513 2 2 22 ARG N N -1.027 -12.380 -4.310 1.00 . B B . 22 ARG N 1 1 6 4514 2 2 22 ARG NE N 0.267 -15.294 -0.012 1.00 . B B . 22 ARG NE 1 1 6 4515 2 2 22 ARG NH1 N 0.138 -13.609 1.492 1.00 . B B . 22 ARG NH1 1 1 6 4516 2 2 22 ARG NH2 N -0.105 -15.751 2.171 1.00 . B B . 22 ARG NH2 1 1 6 4517 2 2 22 ARG O O -3.462 -11.984 -1.696 1.00 . B B . 22 ARG O 1 1 6 4518 2 2 23 GLY C C -3.943 -8.766 -2.663 1.00 . B B . 23 GLY C 1 1 6 4519 2 2 23 GLY CA C -4.299 -10.063 -3.391 1.00 . B B . 23 GLY CA 1 1 6 4520 2 2 23 GLY H H -2.507 -10.770 -4.352 1.00 . B B . 23 GLY H 1 1 6 4521 2 2 23 GLY HA2 H -4.715 -9.829 -4.361 1.00 . B B . 23 GLY HA2 1 1 6 4522 2 2 23 GLY HA3 H -5.027 -10.609 -2.811 1.00 . B B . 23 GLY HA3 1 1 6 4523 2 2 23 GLY N N -3.077 -10.896 -3.566 1.00 . B B . 23 GLY N 1 1 6 4524 2 2 23 GLY O O -4.228 -8.604 -1.493 1.00 . B B . 23 GLY O 1 1 6 4525 2 2 24 PHE C C -3.887 -5.443 -3.176 1.00 . B B . 24 PHE C 1 1 6 4526 2 2 24 PHE CA C -2.967 -6.554 -2.673 1.00 . B B . 24 PHE CA 1 1 6 4527 2 2 24 PHE CB C -1.511 -6.191 -2.981 1.00 . B B . 24 PHE CB 1 1 6 4528 2 2 24 PHE CD1 C -1.058 -7.124 -5.280 1.00 . B B . 24 PHE CD1 1 1 6 4529 2 2 24 PHE CD2 C -1.409 -4.735 -5.035 1.00 . B B . 24 PHE CD2 1 1 6 4530 2 2 24 PHE CE1 C -0.875 -6.956 -6.659 1.00 . B B . 24 PHE CE1 1 1 6 4531 2 2 24 PHE CE2 C -1.222 -4.566 -6.413 1.00 . B B . 24 PHE CE2 1 1 6 4532 2 2 24 PHE CG C -1.326 -6.013 -4.469 1.00 . B B . 24 PHE CG 1 1 6 4533 2 2 24 PHE CZ C -0.955 -5.676 -7.226 1.00 . B B . 24 PHE CZ 1 1 6 4534 2 2 24 PHE H H -3.106 -7.977 -4.286 1.00 . B B . 24 PHE H 1 1 6 4535 2 2 24 PHE HA H -3.094 -6.663 -1.609 1.00 . B B . 24 PHE HA 1 1 6 4536 2 2 24 PHE HB2 H -1.257 -5.271 -2.476 1.00 . B B . 24 PHE HB2 1 1 6 4537 2 2 24 PHE HB3 H -0.863 -6.981 -2.633 1.00 . B B . 24 PHE HB3 1 1 6 4538 2 2 24 PHE HD1 H -0.997 -8.110 -4.843 1.00 . B B . 24 PHE HD1 1 1 6 4539 2 2 24 PHE HD2 H -1.615 -3.880 -4.410 1.00 . B B . 24 PHE HD2 1 1 6 4540 2 2 24 PHE HE1 H -0.671 -7.811 -7.285 1.00 . B B . 24 PHE HE1 1 1 6 4541 2 2 24 PHE HE2 H -1.288 -3.580 -6.849 1.00 . B B . 24 PHE HE2 1 1 6 4542 2 2 24 PHE HZ H -0.804 -5.545 -8.287 1.00 . B B . 24 PHE HZ 1 1 6 4543 2 2 24 PHE N N -3.327 -7.836 -3.342 1.00 . B B . 24 PHE N 1 1 6 4544 2 2 24 PHE O O -3.937 -5.148 -4.353 1.00 . B B . 24 PHE O 1 1 6 4545 2 2 25 PHE C C -4.912 -2.382 -2.425 1.00 . B B . 25 PHE C 1 1 6 4546 2 2 25 PHE CA C -5.546 -3.744 -2.715 1.00 . B B . 25 PHE CA 1 1 6 4547 2 2 25 PHE CB C -6.863 -3.867 -1.946 1.00 . B B . 25 PHE CB 1 1 6 4548 2 2 25 PHE CD1 C -6.250 -4.876 0.286 1.00 . B B . 25 PHE CD1 1 1 6 4549 2 2 25 PHE CD2 C -6.684 -2.492 0.159 1.00 . B B . 25 PHE CD2 1 1 6 4550 2 2 25 PHE CE1 C -5.997 -4.756 1.659 1.00 . B B . 25 PHE CE1 1 1 6 4551 2 2 25 PHE CE2 C -6.431 -2.371 1.531 1.00 . B B . 25 PHE CE2 1 1 6 4552 2 2 25 PHE CG C -6.594 -3.743 -0.464 1.00 . B B . 25 PHE CG 1 1 6 4553 2 2 25 PHE CZ C -6.088 -3.503 2.281 1.00 . B B . 25 PHE CZ 1 1 6 4554 2 2 25 PHE H H -4.570 -5.088 -1.346 1.00 . B B . 25 PHE H 1 1 6 4555 2 2 25 PHE HA H -5.735 -3.834 -3.771 1.00 . B B . 25 PHE HA 1 1 6 4556 2 2 25 PHE HB2 H -7.537 -3.084 -2.257 1.00 . B B . 25 PHE HB2 1 1 6 4557 2 2 25 PHE HB3 H -7.310 -4.829 -2.150 1.00 . B B . 25 PHE HB3 1 1 6 4558 2 2 25 PHE HD1 H -6.180 -5.843 -0.192 1.00 . B B . 25 PHE HD1 1 1 6 4559 2 2 25 PHE HD2 H -6.950 -1.619 -0.418 1.00 . B B . 25 PHE HD2 1 1 6 4560 2 2 25 PHE HE1 H -5.732 -5.628 2.237 1.00 . B B . 25 PHE HE1 1 1 6 4561 2 2 25 PHE HE2 H -6.501 -1.406 2.010 1.00 . B B . 25 PHE HE2 1 1 6 4562 2 2 25 PHE HZ H -5.892 -3.411 3.340 1.00 . B B . 25 PHE HZ 1 1 6 4563 2 2 25 PHE N N -4.623 -4.830 -2.290 1.00 . B B . 25 PHE N 1 1 6 4564 2 2 25 PHE O O -4.369 -2.153 -1.363 1.00 . B B . 25 PHE O 1 1 6 4565 2 2 26 TYR C C -5.470 0.943 -3.263 1.00 . B B . 26 TYR C 1 1 6 4566 2 2 26 TYR CA C -4.382 -0.127 -3.130 1.00 . B B . 26 TYR CA 1 1 6 4567 2 2 26 TYR CB C -3.272 0.120 -4.161 1.00 . B B . 26 TYR CB 1 1 6 4568 2 2 26 TYR CD1 C -4.605 -0.337 -6.255 1.00 . B B . 26 TYR CD1 1 1 6 4569 2 2 26 TYR CD2 C -3.705 1.889 -5.906 1.00 . B B . 26 TYR CD2 1 1 6 4570 2 2 26 TYR CE1 C -5.169 0.081 -7.467 1.00 . B B . 26 TYR CE1 1 1 6 4571 2 2 26 TYR CE2 C -4.267 2.308 -7.119 1.00 . B B . 26 TYR CE2 1 1 6 4572 2 2 26 TYR CG C -3.873 0.567 -5.474 1.00 . B B . 26 TYR CG 1 1 6 4573 2 2 26 TYR CZ C -5.000 1.403 -7.900 1.00 . B B . 26 TYR CZ 1 1 6 4574 2 2 26 TYR H H -5.423 -1.672 -4.212 1.00 . B B . 26 TYR H 1 1 6 4575 2 2 26 TYR HA H -3.963 -0.088 -2.136 1.00 . B B . 26 TYR HA 1 1 6 4576 2 2 26 TYR HB2 H -2.610 0.887 -3.793 1.00 . B B . 26 TYR HB2 1 1 6 4577 2 2 26 TYR HB3 H -2.714 -0.792 -4.313 1.00 . B B . 26 TYR HB3 1 1 6 4578 2 2 26 TYR HD1 H -4.733 -1.356 -5.922 1.00 . B B . 26 TYR HD1 1 1 6 4579 2 2 26 TYR HD2 H -3.138 2.585 -5.305 1.00 . B B . 26 TYR HD2 1 1 6 4580 2 2 26 TYR HE1 H -5.733 -0.616 -8.067 1.00 . B B . 26 TYR HE1 1 1 6 4581 2 2 26 TYR HE2 H -4.136 3.327 -7.452 1.00 . B B . 26 TYR HE2 1 1 6 4582 2 2 26 TYR HH H -4.867 1.809 -9.762 1.00 . B B . 26 TYR HH 1 1 6 4583 2 2 26 TYR N N -4.979 -1.472 -3.360 1.00 . B B . 26 TYR N 1 1 6 4584 2 2 26 TYR O O -5.195 2.086 -3.569 1.00 . B B . 26 TYR O 1 1 6 4585 2 2 26 TYR OH O -5.556 1.816 -9.094 1.00 . B B . 26 TYR OH 1 1 6 4586 2 2 27 THR C C -7.580 2.720 -2.179 1.00 . B B . 27 THR C 1 1 6 4587 2 2 27 THR CA C -7.804 1.574 -3.167 1.00 . B B . 27 THR CA 1 1 6 4588 2 2 27 THR CB C -9.142 0.898 -2.864 1.00 . B B . 27 THR CB 1 1 6 4589 2 2 27 THR CG2 C -9.198 0.522 -1.383 1.00 . B B . 27 THR CG2 1 1 6 4590 2 2 27 THR H H -6.905 -0.349 -2.804 1.00 . B B . 27 THR H 1 1 6 4591 2 2 27 THR HA H -7.821 1.966 -4.173 1.00 . B B . 27 THR HA 1 1 6 4592 2 2 27 THR HB H -9.241 0.007 -3.462 1.00 . B B . 27 THR HB 1 1 6 4593 2 2 27 THR HG1 H -9.959 2.286 -3.955 1.00 . B B . 27 THR HG1 1 1 6 4594 2 2 27 THR HG21 H -8.240 0.128 -1.078 1.00 . B B . 27 THR HG21 1 1 6 4595 2 2 27 THR HG22 H -9.961 -0.227 -1.231 1.00 . B B . 27 THR HG22 1 1 6 4596 2 2 27 THR HG23 H -9.431 1.398 -0.797 1.00 . B B . 27 THR HG23 1 1 6 4597 2 2 27 THR N N -6.703 0.579 -3.044 1.00 . B B . 27 THR N 1 1 6 4598 2 2 27 THR O O -6.474 2.979 -1.749 1.00 . B B . 27 THR O 1 1 6 4599 2 2 27 THR OG1 O -10.201 1.795 -3.166 1.00 . B B . 27 THR OG1 1 1 6 4600 2 2 28 LYS C C -9.331 4.263 0.386 1.00 . B B . 28 LYS C 1 1 6 4601 2 2 28 LYS CA C -8.487 4.540 -0.862 1.00 . B B . 28 LYS CA 1 1 6 4602 2 2 28 LYS CB C -8.977 5.829 -1.529 1.00 . B B . 28 LYS CB 1 1 6 4603 2 2 28 LYS CD C -8.112 7.753 -2.861 1.00 . B B . 28 LYS CD 1 1 6 4604 2 2 28 LYS CE C -9.492 8.082 -3.431 1.00 . B B . 28 LYS CE 1 1 6 4605 2 2 28 LYS CG C -8.003 6.246 -2.633 1.00 . B B . 28 LYS CG 1 1 6 4606 2 2 28 LYS H H -9.510 3.180 -2.181 1.00 . B B . 28 LYS H 1 1 6 4607 2 2 28 LYS HA H -7.450 4.650 -0.579 1.00 . B B . 28 LYS HA 1 1 6 4608 2 2 28 LYS HB2 H -9.955 5.661 -1.957 1.00 . B B . 28 LYS HB2 1 1 6 4609 2 2 28 LYS HB3 H -9.040 6.614 -0.791 1.00 . B B . 28 LYS HB3 1 1 6 4610 2 2 28 LYS HD2 H -7.976 8.270 -1.921 1.00 . B B . 28 LYS HD2 1 1 6 4611 2 2 28 LYS HD3 H -7.351 8.070 -3.559 1.00 . B B . 28 LYS HD3 1 1 6 4612 2 2 28 LYS HE2 H -10.246 7.879 -2.685 1.00 . B B . 28 LYS HE2 1 1 6 4613 2 2 28 LYS HE3 H -9.529 9.126 -3.705 1.00 . B B . 28 LYS HE3 1 1 6 4614 2 2 28 LYS HG2 H -6.995 5.996 -2.339 1.00 . B B . 28 LYS HG2 1 1 6 4615 2 2 28 LYS HG3 H -8.253 5.727 -3.548 1.00 . B B . 28 LYS HG3 1 1 6 4616 2 2 28 LYS HZ1 H -10.190 6.346 -4.347 1.00 . B B . 28 LYS HZ1 1 1 6 4617 2 2 28 LYS HZ2 H -8.846 7.045 -5.119 1.00 . B B . 28 LYS HZ2 1 1 6 4618 2 2 28 LYS HZ3 H -10.385 7.748 -5.283 1.00 . B B . 28 LYS HZ3 1 1 6 4619 2 2 28 LYS N N -8.627 3.408 -1.818 1.00 . B B . 28 LYS N 1 1 6 4620 2 2 28 LYS NZ N -9.747 7.241 -4.636 1.00 . B B . 28 LYS NZ 1 1 6 4621 2 2 28 LYS O O -10.233 3.451 0.355 1.00 . B B . 28 LYS O 1 1 6 4622 2 2 29 PRO C C -11.063 5.555 2.676 1.00 . B B . 29 PRO C 1 1 6 4623 2 2 29 PRO CA C -9.725 4.812 2.730 1.00 . B B . 29 PRO CA 1 1 6 4624 2 2 29 PRO CB C -8.777 5.459 3.744 1.00 . B B . 29 PRO CB 1 1 6 4625 2 2 29 PRO CD C -7.912 5.943 1.477 1.00 . B B . 29 PRO CD 1 1 6 4626 2 2 29 PRO CG C -7.867 6.417 2.941 1.00 . B B . 29 PRO CG 1 1 6 4627 2 2 29 PRO HA H -9.873 3.773 2.973 1.00 . B B . 29 PRO HA 1 1 6 4628 2 2 29 PRO HB2 H -9.347 6.011 4.481 1.00 . B B . 29 PRO HB2 1 1 6 4629 2 2 29 PRO HB3 H -8.176 4.705 4.226 1.00 . B B . 29 PRO HB3 1 1 6 4630 2 2 29 PRO HD2 H -8.128 6.773 0.820 1.00 . B B . 29 PRO HD2 1 1 6 4631 2 2 29 PRO HD3 H -6.981 5.472 1.202 1.00 . B B . 29 PRO HD3 1 1 6 4632 2 2 29 PRO HG2 H -8.240 7.430 3.017 1.00 . B B . 29 PRO HG2 1 1 6 4633 2 2 29 PRO HG3 H -6.855 6.365 3.311 1.00 . B B . 29 PRO HG3 1 1 6 4634 2 2 29 PRO N N -9.012 4.954 1.451 1.00 . B B . 29 PRO N 1 1 6 4635 2 2 29 PRO O O -11.387 6.199 1.698 1.00 . B B . 29 PRO O 1 1 6 4636 2 2 30 THR C C -13.655 6.302 5.169 1.00 . B B . 30 THR C 1 1 6 4637 2 2 30 THR CA C -13.156 6.172 3.728 1.00 . B B . 30 THR CA 1 1 6 4638 2 2 30 THR CB C -14.167 5.368 2.904 1.00 . B B . 30 THR CB 1 1 6 4639 2 2 30 THR CG2 C -14.098 5.805 1.440 1.00 . B B . 30 THR CG2 1 1 6 4640 2 2 30 THR H H -11.560 4.946 4.499 1.00 . B B . 30 THR H 1 1 6 4641 2 2 30 THR HA H -13.041 7.155 3.297 1.00 . B B . 30 THR HA 1 1 6 4642 2 2 30 THR HB H -15.161 5.546 3.282 1.00 . B B . 30 THR HB 1 1 6 4643 2 2 30 THR HG1 H -14.222 3.545 2.229 1.00 . B B . 30 THR HG1 1 1 6 4644 2 2 30 THR HG21 H -13.866 6.858 1.388 1.00 . B B . 30 THR HG21 1 1 6 4645 2 2 30 THR HG22 H -15.051 5.622 0.964 1.00 . B B . 30 THR HG22 1 1 6 4646 2 2 30 THR HG23 H -13.329 5.242 0.932 1.00 . B B . 30 THR HG23 1 1 6 4647 2 2 30 THR N N -11.841 5.470 3.720 1.00 . B B . 30 THR N 1 1 6 4648 2 2 30 THR O O -12.842 6.181 6.069 1.00 . B B . 30 THR O 1 1 6 4649 2 2 30 THR OXT O -14.843 6.518 5.346 1.00 . B B . 30 THR OXT 1 1 6 4650 2 2 30 THR OG1 O -13.861 3.984 3.003 1.00 . B B . 30 THR OG1 1 1 7 4651 1 1 1 GLY C C -3.898 7.218 -0.140 1.00 . A A . 1 GLY C 1 1 7 4652 1 1 1 GLY CA C -5.364 7.480 -0.155 1.00 . A A . 1 GLY CA 1 1 7 4653 1 1 1 GLY H1 H -6.579 8.224 1.410 1.00 . A A . 1 GLY H1 1 1 7 4654 1 1 1 GLY H2 H -6.458 9.277 0.082 1.00 . A A . 1 GLY H2 1 1 7 4655 1 1 1 GLY H3 H -5.159 9.120 1.165 1.00 . A A . 1 GLY H3 1 1 7 4656 1 1 1 GLY HA2 H -5.414 6.628 0.315 1.00 . A A . 1 GLY HA2 1 1 7 4657 1 1 1 GLY HA3 H -5.954 7.479 -1.163 1.00 . A A . 1 GLY HA3 1 1 7 4658 1 1 1 GLY N N -5.936 8.616 0.693 1.00 . A A . 1 GLY N 1 1 7 4659 1 1 1 GLY O O -3.135 7.941 0.468 1.00 . A A . 1 GLY O 1 1 7 4660 1 1 2 ILE C C -1.468 6.286 -2.216 1.00 . A A . 2 ILE C 1 1 7 4661 1 1 2 ILE CA C -2.009 5.881 -0.849 1.00 . A A . 2 ILE CA 1 1 7 4662 1 1 2 ILE CB C -1.798 4.377 -0.615 1.00 . A A . 2 ILE CB 1 1 7 4663 1 1 2 ILE CD1 C -0.084 2.624 -0.120 1.00 . A A . 2 ILE CD1 1 1 7 4664 1 1 2 ILE CG1 C -0.362 4.128 -0.141 1.00 . A A . 2 ILE CG1 1 1 7 4665 1 1 2 ILE CG2 C -2.048 3.605 -1.913 1.00 . A A . 2 ILE CG2 1 1 7 4666 1 1 2 ILE H H -4.094 5.624 -1.311 1.00 . A A . 2 ILE H 1 1 7 4667 1 1 2 ILE HA H -1.502 6.441 -0.080 1.00 . A A . 2 ILE HA 1 1 7 4668 1 1 2 ILE HB H -2.490 4.034 0.142 1.00 . A A . 2 ILE HB 1 1 7 4669 1 1 2 ILE HD11 H 0.511 2.381 0.748 1.00 . A A . 2 ILE HD11 1 1 7 4670 1 1 2 ILE HD12 H 0.451 2.344 -1.015 1.00 . A A . 2 ILE HD12 1 1 7 4671 1 1 2 ILE HD13 H -1.019 2.086 -0.076 1.00 . A A . 2 ILE HD13 1 1 7 4672 1 1 2 ILE HG12 H 0.328 4.612 -0.814 1.00 . A A . 2 ILE HG12 1 1 7 4673 1 1 2 ILE HG13 H -0.237 4.529 0.854 1.00 . A A . 2 ILE HG13 1 1 7 4674 1 1 2 ILE HG21 H -3.064 3.771 -2.238 1.00 . A A . 2 ILE HG21 1 1 7 4675 1 1 2 ILE HG22 H -1.890 2.552 -1.741 1.00 . A A . 2 ILE HG22 1 1 7 4676 1 1 2 ILE HG23 H -1.365 3.953 -2.673 1.00 . A A . 2 ILE HG23 1 1 7 4677 1 1 2 ILE N N -3.463 6.189 -0.815 1.00 . A A . 2 ILE N 1 1 7 4678 1 1 2 ILE O O -0.385 6.820 -2.345 1.00 . A A . 2 ILE O 1 1 7 4679 1 1 3 VAL C C -1.236 7.828 -4.603 1.00 . A A . 3 VAL C 1 1 7 4680 1 1 3 VAL CA C -1.803 6.407 -4.609 1.00 . A A . 3 VAL CA 1 1 7 4681 1 1 3 VAL CB C -3.013 6.350 -5.542 1.00 . A A . 3 VAL CB 1 1 7 4682 1 1 3 VAL CG1 C -2.534 6.331 -6.991 1.00 . A A . 3 VAL CG1 1 1 7 4683 1 1 3 VAL CG2 C -3.825 5.082 -5.255 1.00 . A A . 3 VAL CG2 1 1 7 4684 1 1 3 VAL H H -3.108 5.616 -3.097 1.00 . A A . 3 VAL H 1 1 7 4685 1 1 3 VAL HA H -1.049 5.715 -4.950 1.00 . A A . 3 VAL HA 1 1 7 4686 1 1 3 VAL HB H -3.631 7.221 -5.377 1.00 . A A . 3 VAL HB 1 1 7 4687 1 1 3 VAL HG11 H -3.288 6.776 -7.623 1.00 . A A . 3 VAL HG11 1 1 7 4688 1 1 3 VAL HG12 H -2.361 5.311 -7.298 1.00 . A A . 3 VAL HG12 1 1 7 4689 1 1 3 VAL HG13 H -1.616 6.894 -7.073 1.00 . A A . 3 VAL HG13 1 1 7 4690 1 1 3 VAL HG21 H -3.197 4.356 -4.760 1.00 . A A . 3 VAL HG21 1 1 7 4691 1 1 3 VAL HG22 H -4.190 4.669 -6.183 1.00 . A A . 3 VAL HG22 1 1 7 4692 1 1 3 VAL HG23 H -4.661 5.328 -4.616 1.00 . A A . 3 VAL HG23 1 1 7 4693 1 1 3 VAL N N -2.235 6.040 -3.237 1.00 . A A . 3 VAL N 1 1 7 4694 1 1 3 VAL O O -0.313 8.141 -5.327 1.00 . A A . 3 VAL O 1 1 7 4695 1 1 4 GLU C C -0.267 10.248 -2.621 1.00 . A A . 4 GLU C 1 1 7 4696 1 1 4 GLU CA C -1.288 10.094 -3.750 1.00 . A A . 4 GLU CA 1 1 7 4697 1 1 4 GLU CB C -2.465 11.040 -3.505 1.00 . A A . 4 GLU CB 1 1 7 4698 1 1 4 GLU CD C -2.548 13.069 -2.050 1.00 . A A . 4 GLU CD 1 1 7 4699 1 1 4 GLU CG C -1.937 12.460 -3.313 1.00 . A A . 4 GLU CG 1 1 7 4700 1 1 4 GLU H H -2.537 8.424 -3.223 1.00 . A A . 4 GLU H 1 1 7 4701 1 1 4 GLU HA H -0.822 10.340 -4.691 1.00 . A A . 4 GLU HA 1 1 7 4702 1 1 4 GLU HB2 H -3.131 11.013 -4.355 1.00 . A A . 4 GLU HB2 1 1 7 4703 1 1 4 GLU HB3 H -2.998 10.733 -2.617 1.00 . A A . 4 GLU HB3 1 1 7 4704 1 1 4 GLU HG2 H -0.861 12.431 -3.215 1.00 . A A . 4 GLU HG2 1 1 7 4705 1 1 4 GLU HG3 H -2.205 13.061 -4.167 1.00 . A A . 4 GLU HG3 1 1 7 4706 1 1 4 GLU N N -1.788 8.693 -3.794 1.00 . A A . 4 GLU N 1 1 7 4707 1 1 4 GLU O O 0.766 10.865 -2.790 1.00 . A A . 4 GLU O 1 1 7 4708 1 1 4 GLU OE1 O -2.005 12.840 -0.982 1.00 . A A . 4 GLU OE1 1 1 7 4709 1 1 4 GLU OE2 O -3.549 13.756 -2.173 1.00 . A A . 4 GLU OE2 1 1 7 4710 1 1 5 GLN C C 1.692 9.046 -0.642 1.00 . A A . 5 GLN C 1 1 7 4711 1 1 5 GLN CA C 0.413 9.832 -0.334 1.00 . A A . 5 GLN CA 1 1 7 4712 1 1 5 GLN CB C -0.225 9.284 0.944 1.00 . A A . 5 GLN CB 1 1 7 4713 1 1 5 GLN CD C 0.848 9.748 3.155 1.00 . A A . 5 GLN CD 1 1 7 4714 1 1 5 GLN CG C -0.073 10.310 2.070 1.00 . A A . 5 GLN CG 1 1 7 4715 1 1 5 GLN H H -1.387 9.213 -1.349 1.00 . A A . 5 GLN H 1 1 7 4716 1 1 5 GLN HA H 0.660 10.874 -0.192 1.00 . A A . 5 GLN HA 1 1 7 4717 1 1 5 GLN HB2 H -1.274 9.092 0.768 1.00 . A A . 5 GLN HB2 1 1 7 4718 1 1 5 GLN HB3 H 0.268 8.367 1.227 1.00 . A A . 5 GLN HB3 1 1 7 4719 1 1 5 GLN HE21 H 0.473 11.218 4.437 1.00 . A A . 5 GLN HE21 1 1 7 4720 1 1 5 GLN HE22 H 1.558 10.034 4.988 1.00 . A A . 5 GLN HE22 1 1 7 4721 1 1 5 GLN HG2 H 0.353 11.221 1.671 1.00 . A A . 5 GLN HG2 1 1 7 4722 1 1 5 GLN HG3 H -1.041 10.522 2.497 1.00 . A A . 5 GLN HG3 1 1 7 4723 1 1 5 GLN N N -0.546 9.703 -1.469 1.00 . A A . 5 GLN N 1 1 7 4724 1 1 5 GLN NE2 N 0.969 10.385 4.287 1.00 . A A . 5 GLN NE2 1 1 7 4725 1 1 5 GLN O O 2.779 9.455 -0.289 1.00 . A A . 5 GLN O 1 1 7 4726 1 1 5 GLN OE1 O 1.465 8.717 2.970 1.00 . A A . 5 GLN OE1 1 1 7 4727 1 1 6 CYS C C 3.541 7.758 -2.769 1.00 . A A . 6 CYS C 1 1 7 4728 1 1 6 CYS CA C 2.785 7.113 -1.607 1.00 . A A . 6 CYS CA 1 1 7 4729 1 1 6 CYS CB C 2.374 5.691 -1.993 1.00 . A A . 6 CYS CB 1 1 7 4730 1 1 6 CYS H H 0.686 7.603 -1.561 1.00 . A A . 6 CYS H 1 1 7 4731 1 1 6 CYS HA H 3.426 7.078 -0.739 1.00 . A A . 6 CYS HA 1 1 7 4732 1 1 6 CYS HB2 H 1.298 5.623 -2.028 1.00 . A A . 6 CYS HB2 1 1 7 4733 1 1 6 CYS HB3 H 2.781 5.449 -2.964 1.00 . A A . 6 CYS HB3 1 1 7 4734 1 1 6 CYS N N 1.571 7.919 -1.289 1.00 . A A . 6 CYS N 1 1 7 4735 1 1 6 CYS O O 4.754 7.710 -2.834 1.00 . A A . 6 CYS O 1 1 7 4736 1 1 6 CYS SG S 3.014 4.526 -0.765 1.00 . A A . 6 CYS SG 1 1 7 4737 1 1 7 CYS C C 4.097 10.354 -4.389 1.00 . A A . 7 CYS C 1 1 7 4738 1 1 7 CYS CA C 3.530 9.009 -4.839 1.00 . A A . 7 CYS CA 1 1 7 4739 1 1 7 CYS CB C 2.533 9.230 -5.980 1.00 . A A . 7 CYS CB 1 1 7 4740 1 1 7 CYS H H 1.862 8.392 -3.621 1.00 . A A . 7 CYS H 1 1 7 4741 1 1 7 CYS HA H 4.334 8.374 -5.180 1.00 . A A . 7 CYS HA 1 1 7 4742 1 1 7 CYS HB2 H 1.915 8.351 -6.093 1.00 . A A . 7 CYS HB2 1 1 7 4743 1 1 7 CYS HB3 H 1.909 10.082 -5.753 1.00 . A A . 7 CYS HB3 1 1 7 4744 1 1 7 CYS N N 2.839 8.362 -3.689 1.00 . A A . 7 CYS N 1 1 7 4745 1 1 7 CYS O O 5.171 10.754 -4.791 1.00 . A A . 7 CYS O 1 1 7 4746 1 1 7 CYS SG S 3.436 9.535 -7.518 1.00 . A A . 7 CYS SG 1 1 7 4747 1 1 8 THR C C 4.778 12.139 -1.843 1.00 . A A . 8 THR C 1 1 7 4748 1 1 8 THR CA C 3.874 12.365 -3.059 1.00 . A A . 8 THR CA 1 1 7 4749 1 1 8 THR CB C 2.673 13.233 -2.666 1.00 . A A . 8 THR CB 1 1 7 4750 1 1 8 THR CG2 C 3.132 14.392 -1.779 1.00 . A A . 8 THR CG2 1 1 7 4751 1 1 8 THR H H 2.522 10.701 -3.236 1.00 . A A . 8 THR H 1 1 7 4752 1 1 8 THR HA H 4.436 12.855 -3.840 1.00 . A A . 8 THR HA 1 1 7 4753 1 1 8 THR HB H 1.957 12.632 -2.126 1.00 . A A . 8 THR HB 1 1 7 4754 1 1 8 THR HG1 H 1.216 13.317 -3.952 1.00 . A A . 8 THR HG1 1 1 7 4755 1 1 8 THR HG21 H 3.382 14.018 -0.797 1.00 . A A . 8 THR HG21 1 1 7 4756 1 1 8 THR HG22 H 2.337 15.118 -1.697 1.00 . A A . 8 THR HG22 1 1 7 4757 1 1 8 THR HG23 H 4.002 14.860 -2.218 1.00 . A A . 8 THR HG23 1 1 7 4758 1 1 8 THR N N 3.382 11.049 -3.549 1.00 . A A . 8 THR N 1 1 7 4759 1 1 8 THR O O 5.459 13.036 -1.386 1.00 . A A . 8 THR O 1 1 7 4760 1 1 8 THR OG1 O 2.066 13.750 -3.842 1.00 . A A . 8 THR OG1 1 1 7 4761 1 1 9 SER C C 6.235 9.246 -0.274 1.00 . A A . 9 SER C 1 1 7 4762 1 1 9 SER CA C 5.649 10.651 -0.138 1.00 . A A . 9 SER CA 1 1 7 4763 1 1 9 SER CB C 4.804 10.731 1.134 1.00 . A A . 9 SER CB 1 1 7 4764 1 1 9 SER H H 4.236 10.233 -1.705 1.00 . A A . 9 SER H 1 1 7 4765 1 1 9 SER HA H 6.450 11.374 -0.086 1.00 . A A . 9 SER HA 1 1 7 4766 1 1 9 SER HB2 H 4.416 9.754 1.371 1.00 . A A . 9 SER HB2 1 1 7 4767 1 1 9 SER HB3 H 5.419 11.080 1.952 1.00 . A A . 9 SER HB3 1 1 7 4768 1 1 9 SER HG H 3.231 11.701 1.744 1.00 . A A . 9 SER HG 1 1 7 4769 1 1 9 SER N N 4.791 10.943 -1.319 1.00 . A A . 9 SER N 1 1 7 4770 1 1 9 SER O O 5.516 8.273 -0.392 1.00 . A A . 9 SER O 1 1 7 4771 1 1 9 SER OG O 3.719 11.624 0.921 1.00 . A A . 9 SER OG 1 1 7 4772 1 1 10 ILE C C 7.571 6.852 0.677 1.00 . A A . 10 ILE C 1 1 7 4773 1 1 10 ILE CA C 8.156 7.778 -0.389 1.00 . A A . 10 ILE CA 1 1 7 4774 1 1 10 ILE CB C 9.670 7.894 -0.205 1.00 . A A . 10 ILE CB 1 1 7 4775 1 1 10 ILE CD1 C 11.581 8.212 -1.850 1.00 . A A . 10 ILE CD1 1 1 7 4776 1 1 10 ILE CG1 C 10.242 8.766 -1.343 1.00 . A A . 10 ILE CG1 1 1 7 4777 1 1 10 ILE CG2 C 10.285 6.490 -0.231 1.00 . A A . 10 ILE CG2 1 1 7 4778 1 1 10 ILE H H 8.100 9.919 -0.164 1.00 . A A . 10 ILE H 1 1 7 4779 1 1 10 ILE HA H 7.942 7.377 -1.369 1.00 . A A . 10 ILE HA 1 1 7 4780 1 1 10 ILE HB H 9.880 8.359 0.748 1.00 . A A . 10 ILE HB 1 1 7 4781 1 1 10 ILE HD11 H 12.245 8.053 -1.014 1.00 . A A . 10 ILE HD11 1 1 7 4782 1 1 10 ILE HD12 H 12.027 8.918 -2.535 1.00 . A A . 10 ILE HD12 1 1 7 4783 1 1 10 ILE HD13 H 11.413 7.273 -2.360 1.00 . A A . 10 ILE HD13 1 1 7 4784 1 1 10 ILE HG12 H 9.536 8.787 -2.160 1.00 . A A . 10 ILE HG12 1 1 7 4785 1 1 10 ILE HG13 H 10.389 9.771 -0.977 1.00 . A A . 10 ILE HG13 1 1 7 4786 1 1 10 ILE HG21 H 9.649 5.809 0.312 1.00 . A A . 10 ILE HG21 1 1 7 4787 1 1 10 ILE HG22 H 11.260 6.518 0.230 1.00 . A A . 10 ILE HG22 1 1 7 4788 1 1 10 ILE HG23 H 10.379 6.159 -1.255 1.00 . A A . 10 ILE HG23 1 1 7 4789 1 1 10 ILE N N 7.535 9.126 -0.260 1.00 . A A . 10 ILE N 1 1 7 4790 1 1 10 ILE O O 7.200 7.283 1.750 1.00 . A A . 10 ILE O 1 1 7 4791 1 1 11 CYS C C 7.769 3.383 1.478 1.00 . A A . 11 CYS C 1 1 7 4792 1 1 11 CYS CA C 6.897 4.637 1.392 1.00 . A A . 11 CYS CA 1 1 7 4793 1 1 11 CYS CB C 5.466 4.228 0.995 1.00 . A A . 11 CYS CB 1 1 7 4794 1 1 11 CYS H H 7.771 5.251 -0.485 1.00 . A A . 11 CYS H 1 1 7 4795 1 1 11 CYS HA H 6.874 5.119 2.358 1.00 . A A . 11 CYS HA 1 1 7 4796 1 1 11 CYS HB2 H 5.436 3.163 0.820 1.00 . A A . 11 CYS HB2 1 1 7 4797 1 1 11 CYS HB3 H 4.790 4.473 1.802 1.00 . A A . 11 CYS HB3 1 1 7 4798 1 1 11 CYS N N 7.474 5.582 0.389 1.00 . A A . 11 CYS N 1 1 7 4799 1 1 11 CYS O O 8.346 2.945 0.502 1.00 . A A . 11 CYS O 1 1 7 4800 1 1 11 CYS SG S 4.936 5.091 -0.510 1.00 . A A . 11 CYS SG 1 1 7 4801 1 1 12 SER C C 7.797 0.335 2.805 1.00 . A A . 12 SER C 1 1 7 4802 1 1 12 SER CA C 8.699 1.573 2.799 1.00 . A A . 12 SER CA 1 1 7 4803 1 1 12 SER CB C 9.471 1.647 4.117 1.00 . A A . 12 SER CB 1 1 7 4804 1 1 12 SER H H 7.393 3.171 3.416 1.00 . A A . 12 SER H 1 1 7 4805 1 1 12 SER HA H 9.397 1.506 1.977 1.00 . A A . 12 SER HA 1 1 7 4806 1 1 12 SER HB2 H 9.835 0.668 4.378 1.00 . A A . 12 SER HB2 1 1 7 4807 1 1 12 SER HB3 H 10.309 2.323 4.004 1.00 . A A . 12 SER HB3 1 1 7 4808 1 1 12 SER HG H 9.001 2.897 5.532 1.00 . A A . 12 SER HG 1 1 7 4809 1 1 12 SER N N 7.867 2.800 2.643 1.00 . A A . 12 SER N 1 1 7 4810 1 1 12 SER O O 6.639 0.401 3.169 1.00 . A A . 12 SER O 1 1 7 4811 1 1 12 SER OG O 8.605 2.114 5.142 1.00 . A A . 12 SER OG 1 1 7 4812 1 1 13 LEU C C 6.535 -2.095 3.517 1.00 . A A . 13 LEU C 1 1 7 4813 1 1 13 LEU CA C 7.524 -2.045 2.354 1.00 . A A . 13 LEU CA 1 1 7 4814 1 1 13 LEU CB C 8.453 -3.257 2.432 1.00 . A A . 13 LEU CB 1 1 7 4815 1 1 13 LEU CD1 C 6.510 -4.581 1.586 1.00 . A A . 13 LEU CD1 1 1 7 4816 1 1 13 LEU CD2 C 8.526 -5.750 2.484 1.00 . A A . 13 LEU CD2 1 1 7 4817 1 1 13 LEU CG C 7.623 -4.525 2.634 1.00 . A A . 13 LEU CG 1 1 7 4818 1 1 13 LEU H H 9.253 -0.805 2.088 1.00 . A A . 13 LEU H 1 1 7 4819 1 1 13 LEU HA H 6.986 -2.080 1.436 1.00 . A A . 13 LEU HA 1 1 7 4820 1 1 13 LEU HB2 H 9.010 -3.337 1.513 1.00 . A A . 13 LEU HB2 1 1 7 4821 1 1 13 LEU HB3 H 9.133 -3.137 3.260 1.00 . A A . 13 LEU HB3 1 1 7 4822 1 1 13 LEU HD11 H 5.689 -3.955 1.899 1.00 . A A . 13 LEU HD11 1 1 7 4823 1 1 13 LEU HD12 H 6.166 -5.599 1.478 1.00 . A A . 13 LEU HD12 1 1 7 4824 1 1 13 LEU HD13 H 6.891 -4.228 0.638 1.00 . A A . 13 LEU HD13 1 1 7 4825 1 1 13 LEU HD21 H 8.948 -5.765 1.489 1.00 . A A . 13 LEU HD21 1 1 7 4826 1 1 13 LEU HD22 H 7.944 -6.646 2.640 1.00 . A A . 13 LEU HD22 1 1 7 4827 1 1 13 LEU HD23 H 9.320 -5.703 3.212 1.00 . A A . 13 LEU HD23 1 1 7 4828 1 1 13 LEU HG H 7.187 -4.516 3.623 1.00 . A A . 13 LEU HG 1 1 7 4829 1 1 13 LEU N N 8.326 -0.790 2.391 1.00 . A A . 13 LEU N 1 1 7 4830 1 1 13 LEU O O 5.389 -2.461 3.349 1.00 . A A . 13 LEU O 1 1 7 4831 1 1 14 TYR C C 4.693 -1.174 5.444 1.00 . A A . 14 TYR C 1 1 7 4832 1 1 14 TYR CA C 6.041 -1.768 5.855 1.00 . A A . 14 TYR CA 1 1 7 4833 1 1 14 TYR CB C 6.636 -0.954 7.006 1.00 . A A . 14 TYR CB 1 1 7 4834 1 1 14 TYR CD1 C 7.636 -2.883 8.284 1.00 . A A . 14 TYR CD1 1 1 7 4835 1 1 14 TYR CD2 C 5.890 -1.567 9.335 1.00 . A A . 14 TYR CD2 1 1 7 4836 1 1 14 TYR CE1 C 7.715 -3.691 9.426 1.00 . A A . 14 TYR CE1 1 1 7 4837 1 1 14 TYR CE2 C 5.969 -2.376 10.478 1.00 . A A . 14 TYR CE2 1 1 7 4838 1 1 14 TYR CG C 6.723 -1.821 8.239 1.00 . A A . 14 TYR CG 1 1 7 4839 1 1 14 TYR CZ C 6.881 -3.438 10.522 1.00 . A A . 14 TYR CZ 1 1 7 4840 1 1 14 TYR H H 7.893 -1.446 4.804 1.00 . A A . 14 TYR H 1 1 7 4841 1 1 14 TYR HA H 5.901 -2.791 6.173 1.00 . A A . 14 TYR HA 1 1 7 4842 1 1 14 TYR HB2 H 7.623 -0.612 6.733 1.00 . A A . 14 TYR HB2 1 1 7 4843 1 1 14 TYR HB3 H 6.003 -0.104 7.209 1.00 . A A . 14 TYR HB3 1 1 7 4844 1 1 14 TYR HD1 H 8.280 -3.080 7.438 1.00 . A A . 14 TYR HD1 1 1 7 4845 1 1 14 TYR HD2 H 5.186 -0.748 9.301 1.00 . A A . 14 TYR HD2 1 1 7 4846 1 1 14 TYR HE1 H 8.419 -4.510 9.460 1.00 . A A . 14 TYR HE1 1 1 7 4847 1 1 14 TYR HE2 H 5.327 -2.180 11.324 1.00 . A A . 14 TYR HE2 1 1 7 4848 1 1 14 TYR HH H 7.732 -4.797 11.558 1.00 . A A . 14 TYR HH 1 1 7 4849 1 1 14 TYR N N 6.965 -1.735 4.690 1.00 . A A . 14 TYR N 1 1 7 4850 1 1 14 TYR O O 3.666 -1.819 5.539 1.00 . A A . 14 TYR O 1 1 7 4851 1 1 14 TYR OH O 6.959 -4.236 11.646 1.00 . A A . 14 TYR OH 1 1 7 4852 1 1 15 GLN C C 2.759 -0.215 3.482 1.00 . A A . 15 GLN C 1 1 7 4853 1 1 15 GLN CA C 3.411 0.670 4.540 1.00 . A A . 15 GLN CA 1 1 7 4854 1 1 15 GLN CB C 3.699 2.051 3.948 1.00 . A A . 15 GLN CB 1 1 7 4855 1 1 15 GLN CD C 4.633 3.973 5.242 1.00 . A A . 15 GLN CD 1 1 7 4856 1 1 15 GLN CG C 3.383 3.130 4.986 1.00 . A A . 15 GLN CG 1 1 7 4857 1 1 15 GLN H H 5.530 0.536 4.885 1.00 . A A . 15 GLN H 1 1 7 4858 1 1 15 GLN HA H 2.751 0.769 5.390 1.00 . A A . 15 GLN HA 1 1 7 4859 1 1 15 GLN HB2 H 4.742 2.112 3.672 1.00 . A A . 15 GLN HB2 1 1 7 4860 1 1 15 GLN HB3 H 3.085 2.203 3.074 1.00 . A A . 15 GLN HB3 1 1 7 4861 1 1 15 GLN HE21 H 3.654 5.376 6.252 1.00 . A A . 15 GLN HE21 1 1 7 4862 1 1 15 GLN HE22 H 5.324 5.634 6.085 1.00 . A A . 15 GLN HE22 1 1 7 4863 1 1 15 GLN HG2 H 2.591 3.765 4.614 1.00 . A A . 15 GLN HG2 1 1 7 4864 1 1 15 GLN HG3 H 3.069 2.665 5.908 1.00 . A A . 15 GLN HG3 1 1 7 4865 1 1 15 GLN N N 4.690 0.041 4.971 1.00 . A A . 15 GLN N 1 1 7 4866 1 1 15 GLN NE2 N 4.528 5.087 5.916 1.00 . A A . 15 GLN NE2 1 1 7 4867 1 1 15 GLN O O 1.577 -0.497 3.532 1.00 . A A . 15 GLN O 1 1 7 4868 1 1 15 GLN OE1 O 5.718 3.615 4.827 1.00 . A A . 15 GLN OE1 1 1 7 4869 1 1 16 LEU C C 2.242 -2.719 2.103 1.00 . A A . 16 LEU C 1 1 7 4870 1 1 16 LEU CA C 2.956 -1.533 1.461 1.00 . A A . 16 LEU CA 1 1 7 4871 1 1 16 LEU CB C 4.085 -2.044 0.582 1.00 . A A . 16 LEU CB 1 1 7 4872 1 1 16 LEU CD1 C 6.001 -0.539 0.054 1.00 . A A . 16 LEU CD1 1 1 7 4873 1 1 16 LEU CD2 C 4.520 -1.348 -1.762 1.00 . A A . 16 LEU CD2 1 1 7 4874 1 1 16 LEU CG C 4.570 -0.905 -0.308 1.00 . A A . 16 LEU CG 1 1 7 4875 1 1 16 LEU H H 4.475 -0.419 2.509 1.00 . A A . 16 LEU H 1 1 7 4876 1 1 16 LEU HA H 2.265 -0.968 0.859 1.00 . A A . 16 LEU HA 1 1 7 4877 1 1 16 LEU HB2 H 4.889 -2.393 1.204 1.00 . A A . 16 LEU HB2 1 1 7 4878 1 1 16 LEU HB3 H 3.730 -2.854 -0.034 1.00 . A A . 16 LEU HB3 1 1 7 4879 1 1 16 LEU HD11 H 6.267 0.389 -0.430 1.00 . A A . 16 LEU HD11 1 1 7 4880 1 1 16 LEU HD12 H 6.665 -1.324 -0.279 1.00 . A A . 16 LEU HD12 1 1 7 4881 1 1 16 LEU HD13 H 6.082 -0.427 1.124 1.00 . A A . 16 LEU HD13 1 1 7 4882 1 1 16 LEU HD21 H 5.460 -1.114 -2.240 1.00 . A A . 16 LEU HD21 1 1 7 4883 1 1 16 LEU HD22 H 3.718 -0.833 -2.266 1.00 . A A . 16 LEU HD22 1 1 7 4884 1 1 16 LEU HD23 H 4.350 -2.413 -1.804 1.00 . A A . 16 LEU HD23 1 1 7 4885 1 1 16 LEU HG H 3.933 -0.044 -0.167 1.00 . A A . 16 LEU HG 1 1 7 4886 1 1 16 LEU N N 3.524 -0.658 2.525 1.00 . A A . 16 LEU N 1 1 7 4887 1 1 16 LEU O O 1.106 -3.019 1.794 1.00 . A A . 16 LEU O 1 1 7 4888 1 1 17 GLU C C 0.974 -4.151 4.355 1.00 . A A . 17 GLU C 1 1 7 4889 1 1 17 GLU CA C 2.278 -4.571 3.669 1.00 . A A . 17 GLU CA 1 1 7 4890 1 1 17 GLU CB C 3.244 -5.131 4.715 1.00 . A A . 17 GLU CB 1 1 7 4891 1 1 17 GLU CD C 4.475 -7.177 5.455 1.00 . A A . 17 GLU CD 1 1 7 4892 1 1 17 GLU CG C 3.371 -6.646 4.538 1.00 . A A . 17 GLU CG 1 1 7 4893 1 1 17 GLU H H 3.826 -3.135 3.229 1.00 . A A . 17 GLU H 1 1 7 4894 1 1 17 GLU HA H 2.065 -5.331 2.933 1.00 . A A . 17 GLU HA 1 1 7 4895 1 1 17 GLU HB2 H 4.214 -4.672 4.589 1.00 . A A . 17 GLU HB2 1 1 7 4896 1 1 17 GLU HB3 H 2.869 -4.917 5.703 1.00 . A A . 17 GLU HB3 1 1 7 4897 1 1 17 GLU HG2 H 2.432 -7.118 4.792 1.00 . A A . 17 GLU HG2 1 1 7 4898 1 1 17 GLU HG3 H 3.620 -6.869 3.511 1.00 . A A . 17 GLU HG3 1 1 7 4899 1 1 17 GLU N N 2.906 -3.397 2.999 1.00 . A A . 17 GLU N 1 1 7 4900 1 1 17 GLU O O 0.176 -4.978 4.748 1.00 . A A . 17 GLU O 1 1 7 4901 1 1 17 GLU OE1 O 5.189 -6.366 6.021 1.00 . A A . 17 GLU OE1 1 1 7 4902 1 1 17 GLU OE2 O 4.588 -8.386 5.574 1.00 . A A . 17 GLU OE2 1 1 7 4903 1 1 18 ASN C C -1.617 -2.246 4.148 1.00 . A A . 18 ASN C 1 1 7 4904 1 1 18 ASN CA C -0.498 -2.412 5.181 1.00 . A A . 18 ASN CA 1 1 7 4905 1 1 18 ASN CB C -0.237 -1.071 5.870 1.00 . A A . 18 ASN CB 1 1 7 4906 1 1 18 ASN CG C -0.430 -1.227 7.380 1.00 . A A . 18 ASN CG 1 1 7 4907 1 1 18 ASN H H 1.407 -2.218 4.196 1.00 . A A . 18 ASN H 1 1 7 4908 1 1 18 ASN HA H -0.798 -3.141 5.919 1.00 . A A . 18 ASN HA 1 1 7 4909 1 1 18 ASN HB2 H 0.775 -0.753 5.666 1.00 . A A . 18 ASN HB2 1 1 7 4910 1 1 18 ASN HB3 H -0.929 -0.332 5.494 1.00 . A A . 18 ASN HB3 1 1 7 4911 1 1 18 ASN HD21 H -1.258 0.565 7.601 1.00 . A A . 18 ASN HD21 1 1 7 4912 1 1 18 ASN HD22 H -1.104 -0.345 9.026 1.00 . A A . 18 ASN HD22 1 1 7 4913 1 1 18 ASN N N 0.752 -2.873 4.511 1.00 . A A . 18 ASN N 1 1 7 4914 1 1 18 ASN ND2 N -0.976 -0.255 8.059 1.00 . A A . 18 ASN ND2 1 1 7 4915 1 1 18 ASN O O -2.711 -1.829 4.471 1.00 . A A . 18 ASN O 1 1 7 4916 1 1 18 ASN OD1 O -0.079 -2.242 7.947 1.00 . A A . 18 ASN OD1 1 1 7 4917 1 1 19 TYR C C -2.541 -3.736 1.081 1.00 . A A . 19 TYR C 1 1 7 4918 1 1 19 TYR CA C -2.417 -2.429 1.868 1.00 . A A . 19 TYR CA 1 1 7 4919 1 1 19 TYR CB C -2.049 -1.292 0.914 1.00 . A A . 19 TYR CB 1 1 7 4920 1 1 19 TYR CD1 C -2.960 0.782 2.020 1.00 . A A . 19 TYR CD1 1 1 7 4921 1 1 19 TYR CD2 C -0.573 0.357 2.121 1.00 . A A . 19 TYR CD2 1 1 7 4922 1 1 19 TYR CE1 C -2.781 1.960 2.757 1.00 . A A . 19 TYR CE1 1 1 7 4923 1 1 19 TYR CE2 C -0.394 1.535 2.857 1.00 . A A . 19 TYR CE2 1 1 7 4924 1 1 19 TYR CG C -1.856 -0.020 1.702 1.00 . A A . 19 TYR CG 1 1 7 4925 1 1 19 TYR CZ C -1.498 2.336 3.176 1.00 . A A . 19 TYR CZ 1 1 7 4926 1 1 19 TYR H H -0.471 -2.908 2.664 1.00 . A A . 19 TYR H 1 1 7 4927 1 1 19 TYR HA H -3.361 -2.206 2.344 1.00 . A A . 19 TYR HA 1 1 7 4928 1 1 19 TYR HB2 H -1.134 -1.538 0.395 1.00 . A A . 19 TYR HB2 1 1 7 4929 1 1 19 TYR HB3 H -2.843 -1.152 0.196 1.00 . A A . 19 TYR HB3 1 1 7 4930 1 1 19 TYR HD1 H -3.949 0.491 1.697 1.00 . A A . 19 TYR HD1 1 1 7 4931 1 1 19 TYR HD2 H 0.278 -0.260 1.873 1.00 . A A . 19 TYR HD2 1 1 7 4932 1 1 19 TYR HE1 H -3.632 2.577 3.003 1.00 . A A . 19 TYR HE1 1 1 7 4933 1 1 19 TYR HE2 H 0.596 1.826 3.179 1.00 . A A . 19 TYR HE2 1 1 7 4934 1 1 19 TYR HH H -0.786 3.284 4.672 1.00 . A A . 19 TYR HH 1 1 7 4935 1 1 19 TYR N N -1.358 -2.571 2.909 1.00 . A A . 19 TYR N 1 1 7 4936 1 1 19 TYR O O -2.666 -3.734 -0.128 1.00 . A A . 19 TYR O 1 1 7 4937 1 1 19 TYR OH O -1.322 3.495 3.904 1.00 . A A . 19 TYR OH 1 1 7 4938 1 1 20 CYS C C -3.095 -7.229 2.028 1.00 . A A . 20 CYS C 1 1 7 4939 1 1 20 CYS CA C -2.623 -6.153 1.046 1.00 . A A . 20 CYS CA 1 1 7 4940 1 1 20 CYS CB C -1.256 -6.537 0.473 1.00 . A A . 20 CYS CB 1 1 7 4941 1 1 20 CYS H H -2.405 -4.829 2.731 1.00 . A A . 20 CYS H 1 1 7 4942 1 1 20 CYS HA H -3.337 -6.062 0.242 1.00 . A A . 20 CYS HA 1 1 7 4943 1 1 20 CYS HB2 H -1.023 -5.889 -0.359 1.00 . A A . 20 CYS HB2 1 1 7 4944 1 1 20 CYS HB3 H -0.502 -6.424 1.237 1.00 . A A . 20 CYS HB3 1 1 7 4945 1 1 20 CYS N N -2.507 -4.850 1.756 1.00 . A A . 20 CYS N 1 1 7 4946 1 1 20 CYS O O -2.984 -7.080 3.229 1.00 . A A . 20 CYS O 1 1 7 4947 1 1 20 CYS SG S -1.292 -8.257 -0.093 1.00 . A A . 20 CYS SG 1 1 7 4948 1 1 21 ASN C C -2.912 -10.067 3.106 1.00 . A A . 21 ASN C 1 1 7 4949 1 1 21 ASN CA C -4.108 -9.393 2.431 1.00 . A A . 21 ASN CA 1 1 7 4950 1 1 21 ASN CB C -4.884 -10.429 1.617 1.00 . A A . 21 ASN CB 1 1 7 4951 1 1 21 ASN CG C -6.349 -10.429 2.055 1.00 . A A . 21 ASN CG 1 1 7 4952 1 1 21 ASN H H -3.709 -8.412 0.556 1.00 . A A . 21 ASN H 1 1 7 4953 1 1 21 ASN HA H -4.755 -8.971 3.185 1.00 . A A . 21 ASN HA 1 1 7 4954 1 1 21 ASN HB2 H -4.821 -10.181 0.566 1.00 . A A . 21 ASN HB2 1 1 7 4955 1 1 21 ASN HB3 H -4.460 -11.409 1.781 1.00 . A A . 21 ASN HB3 1 1 7 4956 1 1 21 ASN HD21 H -6.718 -12.236 1.321 1.00 . A A . 21 ASN HD21 1 1 7 4957 1 1 21 ASN HD22 H -8.036 -11.476 2.073 1.00 . A A . 21 ASN HD22 1 1 7 4958 1 1 21 ASN N N -3.625 -8.311 1.527 1.00 . A A . 21 ASN N 1 1 7 4959 1 1 21 ASN ND2 N -7.096 -11.466 1.795 1.00 . A A . 21 ASN ND2 1 1 7 4960 1 1 21 ASN O O -2.265 -10.871 2.455 1.00 . A A . 21 ASN O 1 1 7 4961 1 1 21 ASN OXT O -2.664 -9.769 4.263 1.00 . A A . 21 ASN OXT 1 1 7 4962 1 1 21 ASN OD1 O -6.818 -9.475 2.644 1.00 . A A . 21 ASN OD1 1 1 7 4963 2 2 1 PHE C C 12.345 -1.732 -3.080 1.00 . B B . 1 PHE C 1 1 7 4964 2 2 1 PHE CA C 12.240 -2.356 -4.473 1.00 . B B . 1 PHE CA 1 1 7 4965 2 2 1 PHE CB C 12.646 -3.829 -4.402 1.00 . B B . 1 PHE CB 1 1 7 4966 2 2 1 PHE CD1 C 10.346 -4.586 -3.696 1.00 . B B . 1 PHE CD1 1 1 7 4967 2 2 1 PHE CD2 C 12.251 -5.206 -2.326 1.00 . B B . 1 PHE CD2 1 1 7 4968 2 2 1 PHE CE1 C 9.492 -5.263 -2.815 1.00 . B B . 1 PHE CE1 1 1 7 4969 2 2 1 PHE CE2 C 11.397 -5.883 -1.445 1.00 . B B . 1 PHE CE2 1 1 7 4970 2 2 1 PHE CG C 11.726 -4.558 -3.452 1.00 . B B . 1 PHE CG 1 1 7 4971 2 2 1 PHE CZ C 10.017 -5.911 -1.690 1.00 . B B . 1 PHE CZ 1 1 7 4972 2 2 1 PHE H1 H 14.129 -1.918 -5.235 1.00 . B B . 1 PHE H1 1 1 7 4973 2 2 1 PHE H2 H 13.047 -0.608 -5.268 1.00 . B B . 1 PHE H2 1 1 7 4974 2 2 1 PHE H3 H 12.889 -1.872 -6.392 1.00 . B B . 1 PHE H3 1 1 7 4975 2 2 1 PHE HA H 11.221 -2.281 -4.824 1.00 . B B . 1 PHE HA 1 1 7 4976 2 2 1 PHE HB2 H 12.573 -4.270 -5.386 1.00 . B B . 1 PHE HB2 1 1 7 4977 2 2 1 PHE HB3 H 13.662 -3.906 -4.047 1.00 . B B . 1 PHE HB3 1 1 7 4978 2 2 1 PHE HD1 H 9.941 -4.086 -4.564 1.00 . B B . 1 PHE HD1 1 1 7 4979 2 2 1 PHE HD2 H 13.315 -5.185 -2.138 1.00 . B B . 1 PHE HD2 1 1 7 4980 2 2 1 PHE HE1 H 8.429 -5.284 -3.003 1.00 . B B . 1 PHE HE1 1 1 7 4981 2 2 1 PHE HE2 H 11.802 -6.383 -0.577 1.00 . B B . 1 PHE HE2 1 1 7 4982 2 2 1 PHE HZ H 9.359 -6.432 -1.010 1.00 . B B . 1 PHE HZ 1 1 7 4983 2 2 1 PHE N N 13.144 -1.634 -5.412 1.00 . B B . 1 PHE N 1 1 7 4984 2 2 1 PHE O O 11.459 -1.869 -2.258 1.00 . B B . 1 PHE O 1 1 7 4985 2 2 2 VAL C C 12.489 0.615 -1.251 1.00 . B B . 2 VAL C 1 1 7 4986 2 2 2 VAL CA C 13.592 -0.421 -1.476 1.00 . B B . 2 VAL CA 1 1 7 4987 2 2 2 VAL CB C 14.954 0.260 -1.431 1.00 . B B . 2 VAL CB 1 1 7 4988 2 2 2 VAL CG1 C 16.050 -0.780 -1.656 1.00 . B B . 2 VAL CG1 1 1 7 4989 2 2 2 VAL CG2 C 15.032 1.324 -2.528 1.00 . B B . 2 VAL CG2 1 1 7 4990 2 2 2 VAL H H 14.125 -0.951 -3.477 1.00 . B B . 2 VAL H 1 1 7 4991 2 2 2 VAL HA H 13.540 -1.177 -0.707 1.00 . B B . 2 VAL HA 1 1 7 4992 2 2 2 VAL HB H 15.089 0.722 -0.472 1.00 . B B . 2 VAL HB 1 1 7 4993 2 2 2 VAL HG11 H 16.974 -0.429 -1.221 1.00 . B B . 2 VAL HG11 1 1 7 4994 2 2 2 VAL HG12 H 16.186 -0.936 -2.716 1.00 . B B . 2 VAL HG12 1 1 7 4995 2 2 2 VAL HG13 H 15.763 -1.710 -1.188 1.00 . B B . 2 VAL HG13 1 1 7 4996 2 2 2 VAL HG21 H 14.971 0.847 -3.496 1.00 . B B . 2 VAL HG21 1 1 7 4997 2 2 2 VAL HG22 H 15.967 1.857 -2.448 1.00 . B B . 2 VAL HG22 1 1 7 4998 2 2 2 VAL HG23 H 14.212 2.017 -2.417 1.00 . B B . 2 VAL HG23 1 1 7 4999 2 2 2 VAL N N 13.422 -1.050 -2.807 1.00 . B B . 2 VAL N 1 1 7 5000 2 2 2 VAL O O 11.637 0.824 -2.090 1.00 . B B . 2 VAL O 1 1 7 5001 2 2 3 ASN C C 11.609 3.457 -0.822 1.00 . B B . 3 ASN C 1 1 7 5002 2 2 3 ASN CA C 11.459 2.291 0.161 1.00 . B B . 3 ASN CA 1 1 7 5003 2 2 3 ASN CB C 11.629 2.803 1.593 1.00 . B B . 3 ASN CB 1 1 7 5004 2 2 3 ASN CG C 13.074 3.266 1.802 1.00 . B B . 3 ASN CG 1 1 7 5005 2 2 3 ASN H H 13.200 1.083 0.541 1.00 . B B . 3 ASN H 1 1 7 5006 2 2 3 ASN HA H 10.480 1.848 0.050 1.00 . B B . 3 ASN HA 1 1 7 5007 2 2 3 ASN HB2 H 10.956 3.630 1.763 1.00 . B B . 3 ASN HB2 1 1 7 5008 2 2 3 ASN HB3 H 11.404 2.009 2.288 1.00 . B B . 3 ASN HB3 1 1 7 5009 2 2 3 ASN HD21 H 12.594 5.189 1.932 1.00 . B B . 3 ASN HD21 1 1 7 5010 2 2 3 ASN HD22 H 14.247 4.842 2.088 1.00 . B B . 3 ASN HD22 1 1 7 5011 2 2 3 ASN N N 12.502 1.267 -0.122 1.00 . B B . 3 ASN N 1 1 7 5012 2 2 3 ASN ND2 N 13.326 4.537 1.952 1.00 . B B . 3 ASN ND2 1 1 7 5013 2 2 3 ASN O O 12.054 4.529 -0.463 1.00 . B B . 3 ASN O 1 1 7 5014 2 2 3 ASN OD1 O 13.983 2.460 1.826 1.00 . B B . 3 ASN OD1 1 1 7 5015 2 2 4 GLN C C 10.002 5.017 -3.270 1.00 . B B . 4 GLN C 1 1 7 5016 2 2 4 GLN CA C 11.367 4.347 -3.066 1.00 . B B . 4 GLN CA 1 1 7 5017 2 2 4 GLN CB C 11.864 3.758 -4.395 1.00 . B B . 4 GLN CB 1 1 7 5018 2 2 4 GLN CD C 13.908 5.182 -4.075 1.00 . B B . 4 GLN CD 1 1 7 5019 2 2 4 GLN CG C 12.843 4.725 -5.076 1.00 . B B . 4 GLN CG 1 1 7 5020 2 2 4 GLN H H 10.889 2.380 -2.328 1.00 . B B . 4 GLN H 1 1 7 5021 2 2 4 GLN HA H 12.071 5.080 -2.709 1.00 . B B . 4 GLN HA 1 1 7 5022 2 2 4 GLN HB2 H 12.365 2.819 -4.203 1.00 . B B . 4 GLN HB2 1 1 7 5023 2 2 4 GLN HB3 H 11.021 3.587 -5.047 1.00 . B B . 4 GLN HB3 1 1 7 5024 2 2 4 GLN HE21 H 15.154 3.700 -4.505 1.00 . B B . 4 GLN HE21 1 1 7 5025 2 2 4 GLN HE22 H 15.697 4.784 -3.317 1.00 . B B . 4 GLN HE22 1 1 7 5026 2 2 4 GLN HG2 H 13.324 4.222 -5.902 1.00 . B B . 4 GLN HG2 1 1 7 5027 2 2 4 GLN HG3 H 12.307 5.585 -5.445 1.00 . B B . 4 GLN HG3 1 1 7 5028 2 2 4 GLN N N 11.243 3.254 -2.059 1.00 . B B . 4 GLN N 1 1 7 5029 2 2 4 GLN NE2 N 15.011 4.499 -3.956 1.00 . B B . 4 GLN NE2 1 1 7 5030 2 2 4 GLN O O 9.124 4.924 -2.434 1.00 . B B . 4 GLN O 1 1 7 5031 2 2 4 GLN OE1 O 13.731 6.174 -3.397 1.00 . B B . 4 GLN OE1 1 1 7 5032 2 2 5 HIS C C 7.494 5.393 -5.150 1.00 . B B . 5 HIS C 1 1 7 5033 2 2 5 HIS CA C 8.528 6.392 -4.628 1.00 . B B . 5 HIS CA 1 1 7 5034 2 2 5 HIS CB C 8.737 7.490 -5.674 1.00 . B B . 5 HIS CB 1 1 7 5035 2 2 5 HIS CD2 C 10.188 9.400 -4.631 1.00 . B B . 5 HIS CD2 1 1 7 5036 2 2 5 HIS CE1 C 8.557 10.681 -3.983 1.00 . B B . 5 HIS CE1 1 1 7 5037 2 2 5 HIS CG C 9.012 8.795 -4.979 1.00 . B B . 5 HIS CG 1 1 7 5038 2 2 5 HIS H H 10.549 5.770 -5.023 1.00 . B B . 5 HIS H 1 1 7 5039 2 2 5 HIS HA H 8.169 6.835 -3.712 1.00 . B B . 5 HIS HA 1 1 7 5040 2 2 5 HIS HB2 H 9.574 7.233 -6.305 1.00 . B B . 5 HIS HB2 1 1 7 5041 2 2 5 HIS HB3 H 7.847 7.585 -6.277 1.00 . B B . 5 HIS HB3 1 1 7 5042 2 2 5 HIS HD2 H 11.176 9.010 -4.823 1.00 . B B . 5 HIS HD2 1 1 7 5043 2 2 5 HIS HE1 H 8.009 11.508 -3.556 1.00 . B B . 5 HIS HE1 1 1 7 5044 2 2 5 HIS HE2 H 10.544 11.237 -3.635 1.00 . B B . 5 HIS HE2 1 1 7 5045 2 2 5 HIS N N 9.825 5.701 -4.370 1.00 . B B . 5 HIS N 1 1 7 5046 2 2 5 HIS ND1 N 7.985 9.617 -4.563 1.00 . B B . 5 HIS ND1 1 1 7 5047 2 2 5 HIS NE2 N 9.903 10.592 -4.000 1.00 . B B . 5 HIS NE2 1 1 7 5048 2 2 5 HIS O O 7.732 4.676 -6.102 1.00 . B B . 5 HIS O 1 1 7 5049 2 2 6 LEU C C 4.257 5.197 -5.823 1.00 . B B . 6 LEU C 1 1 7 5050 2 2 6 LEU CA C 5.279 4.414 -4.997 1.00 . B B . 6 LEU CA 1 1 7 5051 2 2 6 LEU CB C 4.594 3.798 -3.775 1.00 . B B . 6 LEU CB 1 1 7 5052 2 2 6 LEU CD1 C 6.489 2.398 -2.944 1.00 . B B . 6 LEU CD1 1 1 7 5053 2 2 6 LEU CD2 C 4.140 1.615 -2.641 1.00 . B B . 6 LEU CD2 1 1 7 5054 2 2 6 LEU CG C 5.095 2.366 -3.571 1.00 . B B . 6 LEU CG 1 1 7 5055 2 2 6 LEU H H 6.170 5.947 -3.780 1.00 . B B . 6 LEU H 1 1 7 5056 2 2 6 LEU HA H 5.717 3.634 -5.602 1.00 . B B . 6 LEU HA 1 1 7 5057 2 2 6 LEU HB2 H 4.826 4.387 -2.901 1.00 . B B . 6 LEU HB2 1 1 7 5058 2 2 6 LEU HB3 H 3.527 3.788 -3.927 1.00 . B B . 6 LEU HB3 1 1 7 5059 2 2 6 LEU HD11 H 6.670 3.376 -2.522 1.00 . B B . 6 LEU HD11 1 1 7 5060 2 2 6 LEU HD12 H 7.230 2.188 -3.700 1.00 . B B . 6 LEU HD12 1 1 7 5061 2 2 6 LEU HD13 H 6.549 1.654 -2.163 1.00 . B B . 6 LEU HD13 1 1 7 5062 2 2 6 LEU HD21 H 3.642 0.832 -3.193 1.00 . B B . 6 LEU HD21 1 1 7 5063 2 2 6 LEU HD22 H 3.403 2.302 -2.249 1.00 . B B . 6 LEU HD22 1 1 7 5064 2 2 6 LEU HD23 H 4.698 1.180 -1.825 1.00 . B B . 6 LEU HD23 1 1 7 5065 2 2 6 LEU HG H 5.142 1.862 -4.526 1.00 . B B . 6 LEU HG 1 1 7 5066 2 2 6 LEU N N 6.342 5.351 -4.538 1.00 . B B . 6 LEU N 1 1 7 5067 2 2 6 LEU O O 3.507 5.994 -5.293 1.00 . B B . 6 LEU O 1 1 7 5068 2 2 7 CYS C C 2.499 4.837 -8.910 1.00 . B B . 7 CYS C 1 1 7 5069 2 2 7 CYS CA C 3.248 5.766 -7.944 1.00 . B B . 7 CYS CA 1 1 7 5070 2 2 7 CYS CB C 3.998 6.830 -8.750 1.00 . B B . 7 CYS CB 1 1 7 5071 2 2 7 CYS H H 4.840 4.366 -7.535 1.00 . B B . 7 CYS H 1 1 7 5072 2 2 7 CYS HA H 2.539 6.251 -7.291 1.00 . B B . 7 CYS HA 1 1 7 5073 2 2 7 CYS HB2 H 4.764 6.355 -9.345 1.00 . B B . 7 CYS HB2 1 1 7 5074 2 2 7 CYS HB3 H 3.306 7.346 -9.398 1.00 . B B . 7 CYS HB3 1 1 7 5075 2 2 7 CYS N N 4.223 5.000 -7.114 1.00 . B B . 7 CYS N 1 1 7 5076 2 2 7 CYS O O 3.098 4.163 -9.724 1.00 . B B . 7 CYS O 1 1 7 5077 2 2 7 CYS SG S 4.765 8.017 -7.621 1.00 . B B . 7 CYS SG 1 1 7 5078 2 2 8 GLY C C 1.095 2.745 -10.215 1.00 . B B . 8 GLY C 1 1 7 5079 2 2 8 GLY CA C 0.340 3.987 -9.735 1.00 . B B . 8 GLY CA 1 1 7 5080 2 2 8 GLY H H 0.749 5.409 -8.168 1.00 . B B . 8 GLY H 1 1 7 5081 2 2 8 GLY HA2 H -0.546 3.676 -9.201 1.00 . B B . 8 GLY HA2 1 1 7 5082 2 2 8 GLY HA3 H 0.047 4.575 -10.592 1.00 . B B . 8 GLY HA3 1 1 7 5083 2 2 8 GLY N N 1.187 4.832 -8.829 1.00 . B B . 8 GLY N 1 1 7 5084 2 2 8 GLY O O 1.377 1.845 -9.449 1.00 . B B . 8 GLY O 1 1 7 5085 2 2 9 SER C C 3.137 0.977 -11.026 1.00 . B B . 9 SER C 1 1 7 5086 2 2 9 SER CA C 2.133 1.510 -12.048 1.00 . B B . 9 SER CA 1 1 7 5087 2 2 9 SER CB C 2.873 1.929 -13.318 1.00 . B B . 9 SER CB 1 1 7 5088 2 2 9 SER H H 1.155 3.429 -12.078 1.00 . B B . 9 SER H 1 1 7 5089 2 2 9 SER HA H 1.423 0.733 -12.288 1.00 . B B . 9 SER HA 1 1 7 5090 2 2 9 SER HB2 H 3.563 1.156 -13.608 1.00 . B B . 9 SER HB2 1 1 7 5091 2 2 9 SER HB3 H 2.157 2.087 -14.114 1.00 . B B . 9 SER HB3 1 1 7 5092 2 2 9 SER HG H 3.609 3.641 -13.878 1.00 . B B . 9 SER HG 1 1 7 5093 2 2 9 SER N N 1.408 2.690 -11.486 1.00 . B B . 9 SER N 1 1 7 5094 2 2 9 SER O O 2.982 -0.106 -10.497 1.00 . B B . 9 SER O 1 1 7 5095 2 2 9 SER OG O 3.592 3.129 -13.067 1.00 . B B . 9 SER OG 1 1 7 5096 2 2 10 ASP C C 4.407 0.749 -8.514 1.00 . B B . 10 ASP C 1 1 7 5097 2 2 10 ASP CA C 5.155 1.259 -9.736 1.00 . B B . 10 ASP CA 1 1 7 5098 2 2 10 ASP CB C 6.040 2.431 -9.315 1.00 . B B . 10 ASP CB 1 1 7 5099 2 2 10 ASP CG C 6.758 2.997 -10.542 1.00 . B B . 10 ASP CG 1 1 7 5100 2 2 10 ASP H H 4.265 2.604 -11.160 1.00 . B B . 10 ASP H 1 1 7 5101 2 2 10 ASP HA H 5.758 0.468 -10.156 1.00 . B B . 10 ASP HA 1 1 7 5102 2 2 10 ASP HB2 H 5.421 3.200 -8.867 1.00 . B B . 10 ASP HB2 1 1 7 5103 2 2 10 ASP HB3 H 6.771 2.092 -8.596 1.00 . B B . 10 ASP HB3 1 1 7 5104 2 2 10 ASP N N 4.160 1.729 -10.732 1.00 . B B . 10 ASP N 1 1 7 5105 2 2 10 ASP O O 4.717 -0.287 -7.960 1.00 . B B . 10 ASP O 1 1 7 5106 2 2 10 ASP OD1 O 7.760 2.422 -10.935 1.00 . B B . 10 ASP OD1 1 1 7 5107 2 2 10 ASP OD2 O 6.294 3.996 -11.067 1.00 . B B . 10 ASP OD2 1 1 7 5108 2 2 11 LEU C C 2.274 -0.414 -7.055 1.00 . B B . 11 LEU C 1 1 7 5109 2 2 11 LEU CA C 2.630 1.060 -6.911 1.00 . B B . 11 LEU CA 1 1 7 5110 2 2 11 LEU CB C 1.355 1.906 -6.854 1.00 . B B . 11 LEU CB 1 1 7 5111 2 2 11 LEU CD1 C 1.811 1.893 -4.360 1.00 . B B . 11 LEU CD1 1 1 7 5112 2 2 11 LEU CD2 C -0.066 3.220 -5.297 1.00 . B B . 11 LEU CD2 1 1 7 5113 2 2 11 LEU CG C 0.736 1.931 -5.446 1.00 . B B . 11 LEU CG 1 1 7 5114 2 2 11 LEU H H 3.193 2.310 -8.564 1.00 . B B . 11 LEU H 1 1 7 5115 2 2 11 LEU HA H 3.221 1.207 -6.029 1.00 . B B . 11 LEU HA 1 1 7 5116 2 2 11 LEU HB2 H 1.591 2.915 -7.153 1.00 . B B . 11 LEU HB2 1 1 7 5117 2 2 11 LEU HB3 H 0.635 1.494 -7.543 1.00 . B B . 11 LEU HB3 1 1 7 5118 2 2 11 LEU HD11 H 1.454 2.418 -3.483 1.00 . B B . 11 LEU HD11 1 1 7 5119 2 2 11 LEU HD12 H 2.707 2.371 -4.723 1.00 . B B . 11 LEU HD12 1 1 7 5120 2 2 11 LEU HD13 H 2.024 0.868 -4.102 1.00 . B B . 11 LEU HD13 1 1 7 5121 2 2 11 LEU HD21 H 0.614 4.056 -5.222 1.00 . B B . 11 LEU HD21 1 1 7 5122 2 2 11 LEU HD22 H -0.670 3.166 -4.407 1.00 . B B . 11 LEU HD22 1 1 7 5123 2 2 11 LEU HD23 H -0.700 3.349 -6.161 1.00 . B B . 11 LEU HD23 1 1 7 5124 2 2 11 LEU HG H 0.076 1.085 -5.328 1.00 . B B . 11 LEU HG 1 1 7 5125 2 2 11 LEU N N 3.419 1.479 -8.095 1.00 . B B . 11 LEU N 1 1 7 5126 2 2 11 LEU O O 2.601 -1.227 -6.214 1.00 . B B . 11 LEU O 1 1 7 5127 2 2 12 ALA C C 2.544 -3.007 -8.439 1.00 . B B . 12 ALA C 1 1 7 5128 2 2 12 ALA CA C 1.259 -2.196 -8.318 1.00 . B B . 12 ALA CA 1 1 7 5129 2 2 12 ALA CB C 0.436 -2.357 -9.595 1.00 . B B . 12 ALA CB 1 1 7 5130 2 2 12 ALA H H 1.369 -0.102 -8.795 1.00 . B B . 12 ALA H 1 1 7 5131 2 2 12 ALA HA H 0.688 -2.548 -7.469 1.00 . B B . 12 ALA HA 1 1 7 5132 2 2 12 ALA HB1 H -0.355 -1.623 -9.609 1.00 . B B . 12 ALA HB1 1 1 7 5133 2 2 12 ALA HB2 H 0.008 -3.349 -9.623 1.00 . B B . 12 ALA HB2 1 1 7 5134 2 2 12 ALA HB3 H 1.075 -2.216 -10.456 1.00 . B B . 12 ALA HB3 1 1 7 5135 2 2 12 ALA N N 1.616 -0.770 -8.122 1.00 . B B . 12 ALA N 1 1 7 5136 2 2 12 ALA O O 2.765 -3.932 -7.696 1.00 . B B . 12 ALA O 1 1 7 5137 2 2 13 GLU C C 5.321 -3.574 -8.141 1.00 . B B . 13 GLU C 1 1 7 5138 2 2 13 GLU CA C 4.671 -3.419 -9.514 1.00 . B B . 13 GLU CA 1 1 7 5139 2 2 13 GLU CB C 5.615 -2.661 -10.449 1.00 . B B . 13 GLU CB 1 1 7 5140 2 2 13 GLU CD C 6.161 -3.790 -12.608 1.00 . B B . 13 GLU CD 1 1 7 5141 2 2 13 GLU CG C 5.170 -2.867 -11.898 1.00 . B B . 13 GLU CG 1 1 7 5142 2 2 13 GLU H H 3.211 -1.897 -9.953 1.00 . B B . 13 GLU H 1 1 7 5143 2 2 13 GLU HA H 4.462 -4.398 -9.923 1.00 . B B . 13 GLU HA 1 1 7 5144 2 2 13 GLU HB2 H 5.591 -1.608 -10.209 1.00 . B B . 13 GLU HB2 1 1 7 5145 2 2 13 GLU HB3 H 6.620 -3.036 -10.326 1.00 . B B . 13 GLU HB3 1 1 7 5146 2 2 13 GLU HG2 H 4.186 -3.313 -11.913 1.00 . B B . 13 GLU HG2 1 1 7 5147 2 2 13 GLU HG3 H 5.143 -1.915 -12.405 1.00 . B B . 13 GLU HG3 1 1 7 5148 2 2 13 GLU N N 3.400 -2.659 -9.364 1.00 . B B . 13 GLU N 1 1 7 5149 2 2 13 GLU O O 5.867 -4.611 -7.817 1.00 . B B . 13 GLU O 1 1 7 5150 2 2 13 GLU OE1 O 7.353 -3.585 -12.445 1.00 . B B . 13 GLU OE1 1 1 7 5151 2 2 13 GLU OE2 O 5.712 -4.686 -13.302 1.00 . B B . 13 GLU OE2 1 1 7 5152 2 2 14 ALA C C 5.021 -3.655 -5.151 1.00 . B B . 14 ALA C 1 1 7 5153 2 2 14 ALA CA C 5.859 -2.677 -5.968 1.00 . B B . 14 ALA CA 1 1 7 5154 2 2 14 ALA CB C 5.867 -1.307 -5.288 1.00 . B B . 14 ALA CB 1 1 7 5155 2 2 14 ALA H H 4.798 -1.733 -7.591 1.00 . B B . 14 ALA H 1 1 7 5156 2 2 14 ALA HA H 6.873 -3.053 -6.050 1.00 . B B . 14 ALA HA 1 1 7 5157 2 2 14 ALA HB1 H 5.001 -0.743 -5.603 1.00 . B B . 14 ALA HB1 1 1 7 5158 2 2 14 ALA HB2 H 6.764 -0.772 -5.565 1.00 . B B . 14 ALA HB2 1 1 7 5159 2 2 14 ALA HB3 H 5.842 -1.436 -4.216 1.00 . B B . 14 ALA HB3 1 1 7 5160 2 2 14 ALA N N 5.256 -2.562 -7.322 1.00 . B B . 14 ALA N 1 1 7 5161 2 2 14 ALA O O 5.527 -4.611 -4.599 1.00 . B B . 14 ALA O 1 1 7 5162 2 2 15 LEU C C 2.921 -5.748 -5.019 1.00 . B B . 15 LEU C 1 1 7 5163 2 2 15 LEU CA C 2.873 -4.382 -4.326 1.00 . B B . 15 LEU CA 1 1 7 5164 2 2 15 LEU CB C 1.432 -3.866 -4.324 1.00 . B B . 15 LEU CB 1 1 7 5165 2 2 15 LEU CD1 C -0.031 -2.029 -3.473 1.00 . B B . 15 LEU CD1 1 1 7 5166 2 2 15 LEU CD2 C 1.225 -3.472 -1.871 1.00 . B B . 15 LEU CD2 1 1 7 5167 2 2 15 LEU CG C 1.271 -2.798 -3.242 1.00 . B B . 15 LEU CG 1 1 7 5168 2 2 15 LEU H H 3.336 -2.675 -5.562 1.00 . B B . 15 LEU H 1 1 7 5169 2 2 15 LEU HA H 3.239 -4.464 -3.309 1.00 . B B . 15 LEU HA 1 1 7 5170 2 2 15 LEU HB2 H 1.200 -3.439 -5.290 1.00 . B B . 15 LEU HB2 1 1 7 5171 2 2 15 LEU HB3 H 0.757 -4.685 -4.121 1.00 . B B . 15 LEU HB3 1 1 7 5172 2 2 15 LEU HD11 H -0.047 -1.152 -2.841 1.00 . B B . 15 LEU HD11 1 1 7 5173 2 2 15 LEU HD12 H -0.872 -2.662 -3.231 1.00 . B B . 15 LEU HD12 1 1 7 5174 2 2 15 LEU HD13 H -0.093 -1.727 -4.507 1.00 . B B . 15 LEU HD13 1 1 7 5175 2 2 15 LEU HD21 H 1.768 -4.405 -1.911 1.00 . B B . 15 LEU HD21 1 1 7 5176 2 2 15 LEU HD22 H 0.197 -3.666 -1.601 1.00 . B B . 15 LEU HD22 1 1 7 5177 2 2 15 LEU HD23 H 1.675 -2.823 -1.137 1.00 . B B . 15 LEU HD23 1 1 7 5178 2 2 15 LEU HG H 2.107 -2.115 -3.282 1.00 . B B . 15 LEU HG 1 1 7 5179 2 2 15 LEU N N 3.735 -3.442 -5.091 1.00 . B B . 15 LEU N 1 1 7 5180 2 2 15 LEU O O 2.620 -6.771 -4.437 1.00 . B B . 15 LEU O 1 1 7 5181 2 2 16 TYR C C 4.586 -7.824 -6.588 1.00 . B B . 16 TYR C 1 1 7 5182 2 2 16 TYR CA C 3.381 -7.019 -7.052 1.00 . B B . 16 TYR CA 1 1 7 5183 2 2 16 TYR CB C 3.575 -6.669 -8.530 1.00 . B B . 16 TYR CB 1 1 7 5184 2 2 16 TYR CD1 C 2.348 -8.783 -9.130 1.00 . B B . 16 TYR CD1 1 1 7 5185 2 2 16 TYR CD2 C 1.903 -6.762 -10.395 1.00 . B B . 16 TYR CD2 1 1 7 5186 2 2 16 TYR CE1 C 1.424 -9.481 -9.917 1.00 . B B . 16 TYR CE1 1 1 7 5187 2 2 16 TYR CE2 C 0.978 -7.458 -11.185 1.00 . B B . 16 TYR CE2 1 1 7 5188 2 2 16 TYR CG C 2.585 -7.425 -9.371 1.00 . B B . 16 TYR CG 1 1 7 5189 2 2 16 TYR CZ C 0.738 -8.818 -10.946 1.00 . B B . 16 TYR CZ 1 1 7 5190 2 2 16 TYR H H 3.530 -4.905 -6.705 1.00 . B B . 16 TYR H 1 1 7 5191 2 2 16 TYR HA H 2.476 -7.594 -6.926 1.00 . B B . 16 TYR HA 1 1 7 5192 2 2 16 TYR HB2 H 3.428 -5.612 -8.673 1.00 . B B . 16 TYR HB2 1 1 7 5193 2 2 16 TYR HB3 H 4.577 -6.932 -8.834 1.00 . B B . 16 TYR HB3 1 1 7 5194 2 2 16 TYR HD1 H 2.881 -9.291 -8.337 1.00 . B B . 16 TYR HD1 1 1 7 5195 2 2 16 TYR HD2 H 2.092 -5.714 -10.577 1.00 . B B . 16 TYR HD2 1 1 7 5196 2 2 16 TYR HE1 H 1.238 -10.528 -9.733 1.00 . B B . 16 TYR HE1 1 1 7 5197 2 2 16 TYR HE2 H 0.450 -6.944 -11.976 1.00 . B B . 16 TYR HE2 1 1 7 5198 2 2 16 TYR HH H 0.320 -10.092 -12.305 1.00 . B B . 16 TYR HH 1 1 7 5199 2 2 16 TYR N N 3.298 -5.752 -6.270 1.00 . B B . 16 TYR N 1 1 7 5200 2 2 16 TYR O O 4.625 -9.034 -6.695 1.00 . B B . 16 TYR O 1 1 7 5201 2 2 16 TYR OH O -0.171 -9.505 -11.725 1.00 . B B . 16 TYR OH 1 1 7 5202 2 2 17 LEU C C 6.764 -8.058 -4.149 1.00 . B B . 17 LEU C 1 1 7 5203 2 2 17 LEU CA C 6.810 -7.835 -5.665 1.00 . B B . 17 LEU CA 1 1 7 5204 2 2 17 LEU CB C 7.973 -6.933 -6.047 1.00 . B B . 17 LEU CB 1 1 7 5205 2 2 17 LEU CD1 C 9.271 -9.078 -5.822 1.00 . B B . 17 LEU CD1 1 1 7 5206 2 2 17 LEU CD2 C 10.382 -6.974 -6.542 1.00 . B B . 17 LEU CD2 1 1 7 5207 2 2 17 LEU CG C 9.300 -7.553 -5.646 1.00 . B B . 17 LEU CG 1 1 7 5208 2 2 17 LEU H H 5.535 -6.175 -6.055 1.00 . B B . 17 LEU H 1 1 7 5209 2 2 17 LEU HA H 6.907 -8.778 -6.173 1.00 . B B . 17 LEU HA 1 1 7 5210 2 2 17 LEU HB2 H 7.965 -6.777 -7.115 1.00 . B B . 17 LEU HB2 1 1 7 5211 2 2 17 LEU HB3 H 7.862 -5.981 -5.549 1.00 . B B . 17 LEU HB3 1 1 7 5212 2 2 17 LEU HD11 H 8.957 -9.546 -4.904 1.00 . B B . 17 LEU HD11 1 1 7 5213 2 2 17 LEU HD12 H 10.261 -9.425 -6.082 1.00 . B B . 17 LEU HD12 1 1 7 5214 2 2 17 LEU HD13 H 8.585 -9.338 -6.613 1.00 . B B . 17 LEU HD13 1 1 7 5215 2 2 17 LEU HD21 H 11.300 -6.882 -5.986 1.00 . B B . 17 LEU HD21 1 1 7 5216 2 2 17 LEU HD22 H 10.069 -6.002 -6.893 1.00 . B B . 17 LEU HD22 1 1 7 5217 2 2 17 LEU HD23 H 10.533 -7.630 -7.387 1.00 . B B . 17 LEU HD23 1 1 7 5218 2 2 17 LEU HG H 9.502 -7.302 -4.621 1.00 . B B . 17 LEU HG 1 1 7 5219 2 2 17 LEU N N 5.582 -7.150 -6.106 1.00 . B B . 17 LEU N 1 1 7 5220 2 2 17 LEU O O 7.650 -8.656 -3.572 1.00 . B B . 17 LEU O 1 1 7 5221 2 2 18 VAL C C 4.588 -8.839 -1.708 1.00 . B B . 18 VAL C 1 1 7 5222 2 2 18 VAL CA C 5.639 -7.776 -2.023 1.00 . B B . 18 VAL CA 1 1 7 5223 2 2 18 VAL CB C 5.256 -6.448 -1.361 1.00 . B B . 18 VAL CB 1 1 7 5224 2 2 18 VAL CG1 C 5.961 -5.312 -2.088 1.00 . B B . 18 VAL CG1 1 1 7 5225 2 2 18 VAL CG2 C 3.740 -6.227 -1.436 1.00 . B B . 18 VAL CG2 1 1 7 5226 2 2 18 VAL H H 5.029 -7.104 -3.977 1.00 . B B . 18 VAL H 1 1 7 5227 2 2 18 VAL HA H 6.597 -8.100 -1.644 1.00 . B B . 18 VAL HA 1 1 7 5228 2 2 18 VAL HB H 5.569 -6.460 -0.330 1.00 . B B . 18 VAL HB 1 1 7 5229 2 2 18 VAL HG11 H 6.555 -4.751 -1.386 1.00 . B B . 18 VAL HG11 1 1 7 5230 2 2 18 VAL HG12 H 5.224 -4.665 -2.537 1.00 . B B . 18 VAL HG12 1 1 7 5231 2 2 18 VAL HG13 H 6.601 -5.718 -2.858 1.00 . B B . 18 VAL HG13 1 1 7 5232 2 2 18 VAL HG21 H 3.233 -7.032 -0.927 1.00 . B B . 18 VAL HG21 1 1 7 5233 2 2 18 VAL HG22 H 3.430 -6.200 -2.469 1.00 . B B . 18 VAL HG22 1 1 7 5234 2 2 18 VAL HG23 H 3.492 -5.288 -0.962 1.00 . B B . 18 VAL HG23 1 1 7 5235 2 2 18 VAL N N 5.735 -7.585 -3.498 1.00 . B B . 18 VAL N 1 1 7 5236 2 2 18 VAL O O 4.817 -9.744 -0.932 1.00 . B B . 18 VAL O 1 1 7 5237 2 2 19 CYS C C 2.285 -10.715 -3.197 1.00 . B B . 19 CYS C 1 1 7 5238 2 2 19 CYS CA C 2.369 -9.730 -2.030 1.00 . B B . 19 CYS CA 1 1 7 5239 2 2 19 CYS CB C 1.028 -9.014 -1.871 1.00 . B B . 19 CYS CB 1 1 7 5240 2 2 19 CYS H H 3.265 -7.992 -2.921 1.00 . B B . 19 CYS H 1 1 7 5241 2 2 19 CYS HA H 2.605 -10.261 -1.122 1.00 . B B . 19 CYS HA 1 1 7 5242 2 2 19 CYS HB2 H 1.082 -8.041 -2.338 1.00 . B B . 19 CYS HB2 1 1 7 5243 2 2 19 CYS HB3 H 0.251 -9.596 -2.343 1.00 . B B . 19 CYS HB3 1 1 7 5244 2 2 19 CYS N N 3.433 -8.732 -2.302 1.00 . B B . 19 CYS N 1 1 7 5245 2 2 19 CYS O O 2.132 -11.905 -3.008 1.00 . B B . 19 CYS O 1 1 7 5246 2 2 19 CYS SG S 0.648 -8.817 -0.113 1.00 . B B . 19 CYS SG 1 1 7 5247 2 2 20 GLY C C 0.950 -11.845 -5.585 1.00 . B B . 20 GLY C 1 1 7 5248 2 2 20 GLY CA C 2.304 -11.136 -5.582 1.00 . B B . 20 GLY CA 1 1 7 5249 2 2 20 GLY H H 2.503 -9.264 -4.536 1.00 . B B . 20 GLY H 1 1 7 5250 2 2 20 GLY HA2 H 2.414 -10.561 -6.489 1.00 . B B . 20 GLY HA2 1 1 7 5251 2 2 20 GLY HA3 H 3.091 -11.873 -5.522 1.00 . B B . 20 GLY HA3 1 1 7 5252 2 2 20 GLY N N 2.381 -10.227 -4.404 1.00 . B B . 20 GLY N 1 1 7 5253 2 2 20 GLY O O -0.090 -11.216 -5.537 1.00 . B B . 20 GLY O 1 1 7 5254 2 2 21 GLU C C -1.071 -13.654 -4.322 1.00 . B B . 21 GLU C 1 1 7 5255 2 2 21 GLU CA C -0.340 -13.889 -5.647 1.00 . B B . 21 GLU CA 1 1 7 5256 2 2 21 GLU CB C -0.067 -15.384 -5.824 1.00 . B B . 21 GLU CB 1 1 7 5257 2 2 21 GLU CD C 1.164 -17.302 -4.804 1.00 . B B . 21 GLU CD 1 1 7 5258 2 2 21 GLU CG C 1.152 -15.785 -4.992 1.00 . B B . 21 GLU CG 1 1 7 5259 2 2 21 GLU H H 1.798 -13.636 -5.679 1.00 . B B . 21 GLU H 1 1 7 5260 2 2 21 GLU HA H -0.954 -13.537 -6.462 1.00 . B B . 21 GLU HA 1 1 7 5261 2 2 21 GLU HB2 H -0.928 -15.949 -5.498 1.00 . B B . 21 GLU HB2 1 1 7 5262 2 2 21 GLU HB3 H 0.127 -15.593 -6.865 1.00 . B B . 21 GLU HB3 1 1 7 5263 2 2 21 GLU HG2 H 2.053 -15.477 -5.502 1.00 . B B . 21 GLU HG2 1 1 7 5264 2 2 21 GLU HG3 H 1.101 -15.305 -4.025 1.00 . B B . 21 GLU HG3 1 1 7 5265 2 2 21 GLU N N 0.950 -13.147 -5.641 1.00 . B B . 21 GLU N 1 1 7 5266 2 2 21 GLU O O -2.234 -13.971 -4.178 1.00 . B B . 21 GLU O 1 1 7 5267 2 2 21 GLU OE1 O 0.114 -17.905 -4.949 1.00 . B B . 21 GLU OE1 1 1 7 5268 2 2 21 GLU OE2 O 2.224 -17.835 -4.520 1.00 . B B . 21 GLU OE2 1 1 7 5269 2 2 22 ARG C C -2.302 -11.972 -2.267 1.00 . B B . 22 ARG C 1 1 7 5270 2 2 22 ARG CA C -1.066 -12.844 -2.040 1.00 . B B . 22 ARG CA 1 1 7 5271 2 2 22 ARG CB C -0.096 -12.130 -1.097 1.00 . B B . 22 ARG CB 1 1 7 5272 2 2 22 ARG CD C 0.093 -14.282 0.160 1.00 . B B . 22 ARG CD 1 1 7 5273 2 2 22 ARG CG C 0.880 -13.146 -0.498 1.00 . B B . 22 ARG CG 1 1 7 5274 2 2 22 ARG CZ C 0.551 -14.463 2.530 1.00 . B B . 22 ARG CZ 1 1 7 5275 2 2 22 ARG H H 0.538 -12.844 -3.480 1.00 . B B . 22 ARG H 1 1 7 5276 2 2 22 ARG HA H -1.367 -13.784 -1.604 1.00 . B B . 22 ARG HA 1 1 7 5277 2 2 22 ARG HB2 H 0.455 -11.382 -1.649 1.00 . B B . 22 ARG HB2 1 1 7 5278 2 2 22 ARG HB3 H -0.651 -11.655 -0.303 1.00 . B B . 22 ARG HB3 1 1 7 5279 2 2 22 ARG HD2 H -0.857 -13.907 0.506 1.00 . B B . 22 ARG HD2 1 1 7 5280 2 2 22 ARG HD3 H -0.072 -15.070 -0.560 1.00 . B B . 22 ARG HD3 1 1 7 5281 2 2 22 ARG HE H 1.612 -15.436 1.161 1.00 . B B . 22 ARG HE 1 1 7 5282 2 2 22 ARG HG2 H 1.509 -13.546 -1.280 1.00 . B B . 22 ARG HG2 1 1 7 5283 2 2 22 ARG HG3 H 1.494 -12.660 0.245 1.00 . B B . 22 ARG HG3 1 1 7 5284 2 2 22 ARG HH11 H -1.415 -14.734 2.259 1.00 . B B . 22 ARG HH11 1 1 7 5285 2 2 22 ARG HH12 H -0.942 -14.193 3.835 1.00 . B B . 22 ARG HH12 1 1 7 5286 2 2 22 ARG HH21 H 2.441 -14.106 3.081 1.00 . B B . 22 ARG HH21 1 1 7 5287 2 2 22 ARG HH22 H 1.242 -13.839 4.301 1.00 . B B . 22 ARG HH22 1 1 7 5288 2 2 22 ARG N N -0.400 -13.097 -3.349 1.00 . B B . 22 ARG N 1 1 7 5289 2 2 22 ARG NE N 0.867 -14.818 1.314 1.00 . B B . 22 ARG NE 1 1 7 5290 2 2 22 ARG NH1 N -0.699 -14.464 2.904 1.00 . B B . 22 ARG NH1 1 1 7 5291 2 2 22 ARG NH2 N 1.484 -14.109 3.370 1.00 . B B . 22 ARG NH2 1 1 7 5292 2 2 22 ARG O O -3.222 -11.955 -1.473 1.00 . B B . 22 ARG O 1 1 7 5293 2 2 23 GLY C C -3.418 -9.090 -2.853 1.00 . B B . 23 GLY C 1 1 7 5294 2 2 23 GLY CA C -3.506 -10.389 -3.656 1.00 . B B . 23 GLY CA 1 1 7 5295 2 2 23 GLY H H -1.580 -11.296 -3.983 1.00 . B B . 23 GLY H 1 1 7 5296 2 2 23 GLY HA2 H -3.522 -10.159 -4.711 1.00 . B B . 23 GLY HA2 1 1 7 5297 2 2 23 GLY HA3 H -4.413 -10.909 -3.388 1.00 . B B . 23 GLY HA3 1 1 7 5298 2 2 23 GLY N N -2.331 -11.256 -3.356 1.00 . B B . 23 GLY N 1 1 7 5299 2 2 23 GLY O O -3.783 -9.038 -1.695 1.00 . B B . 23 GLY O 1 1 7 5300 2 2 24 PHE C C -3.925 -5.787 -3.273 1.00 . B B . 24 PHE C 1 1 7 5301 2 2 24 PHE CA C -2.858 -6.738 -2.732 1.00 . B B . 24 PHE CA 1 1 7 5302 2 2 24 PHE CB C -1.466 -6.129 -2.921 1.00 . B B . 24 PHE CB 1 1 7 5303 2 2 24 PHE CD1 C -1.471 -5.025 -5.188 1.00 . B B . 24 PHE CD1 1 1 7 5304 2 2 24 PHE CD2 C -0.415 -7.197 -4.949 1.00 . B B . 24 PHE CD2 1 1 7 5305 2 2 24 PHE CE1 C -1.139 -5.013 -6.548 1.00 . B B . 24 PHE CE1 1 1 7 5306 2 2 24 PHE CE2 C -0.082 -7.185 -6.310 1.00 . B B . 24 PHE CE2 1 1 7 5307 2 2 24 PHE CG C -1.109 -6.117 -4.388 1.00 . B B . 24 PHE CG 1 1 7 5308 2 2 24 PHE CZ C -0.445 -6.094 -7.110 1.00 . B B . 24 PHE CZ 1 1 7 5309 2 2 24 PHE H H -2.670 -8.091 -4.400 1.00 . B B . 24 PHE H 1 1 7 5310 2 2 24 PHE HA H -3.039 -6.910 -1.684 1.00 . B B . 24 PHE HA 1 1 7 5311 2 2 24 PHE HB2 H -1.461 -5.118 -2.541 1.00 . B B . 24 PHE HB2 1 1 7 5312 2 2 24 PHE HB3 H -0.740 -6.720 -2.380 1.00 . B B . 24 PHE HB3 1 1 7 5313 2 2 24 PHE HD1 H -2.006 -4.193 -4.755 1.00 . B B . 24 PHE HD1 1 1 7 5314 2 2 24 PHE HD2 H -0.135 -8.038 -4.331 1.00 . B B . 24 PHE HD2 1 1 7 5315 2 2 24 PHE HE1 H -1.419 -4.172 -7.166 1.00 . B B . 24 PHE HE1 1 1 7 5316 2 2 24 PHE HE2 H 0.452 -8.017 -6.742 1.00 . B B . 24 PHE HE2 1 1 7 5317 2 2 24 PHE HZ H -0.189 -6.084 -8.159 1.00 . B B . 24 PHE HZ 1 1 7 5318 2 2 24 PHE N N -2.950 -8.034 -3.462 1.00 . B B . 24 PHE N 1 1 7 5319 2 2 24 PHE O O -3.891 -5.382 -4.417 1.00 . B B . 24 PHE O 1 1 7 5320 2 2 25 PHE C C -5.634 -3.073 -2.784 1.00 . B B . 25 PHE C 1 1 7 5321 2 2 25 PHE CA C -5.987 -4.562 -2.943 1.00 . B B . 25 PHE CA 1 1 7 5322 2 2 25 PHE CB C -7.295 -4.876 -2.196 1.00 . B B . 25 PHE CB 1 1 7 5323 2 2 25 PHE CD1 C -5.903 -4.424 -0.103 1.00 . B B . 25 PHE CD1 1 1 7 5324 2 2 25 PHE CD2 C -8.203 -5.155 0.139 1.00 . B B . 25 PHE CD2 1 1 7 5325 2 2 25 PHE CE1 C -5.775 -4.373 1.292 1.00 . B B . 25 PHE CE1 1 1 7 5326 2 2 25 PHE CE2 C -8.073 -5.104 1.532 1.00 . B B . 25 PHE CE2 1 1 7 5327 2 2 25 PHE CG C -7.120 -4.816 -0.684 1.00 . B B . 25 PHE CG 1 1 7 5328 2 2 25 PHE CZ C -6.859 -4.713 2.109 1.00 . B B . 25 PHE CZ 1 1 7 5329 2 2 25 PHE H H -4.913 -5.822 -1.559 1.00 . B B . 25 PHE H 1 1 7 5330 2 2 25 PHE HA H -6.140 -4.761 -3.990 1.00 . B B . 25 PHE HA 1 1 7 5331 2 2 25 PHE HB2 H -8.048 -4.162 -2.489 1.00 . B B . 25 PHE HB2 1 1 7 5332 2 2 25 PHE HB3 H -7.627 -5.868 -2.472 1.00 . B B . 25 PHE HB3 1 1 7 5333 2 2 25 PHE HD1 H -5.062 -4.163 -0.727 1.00 . B B . 25 PHE HD1 1 1 7 5334 2 2 25 PHE HD2 H -9.141 -5.458 -0.303 1.00 . B B . 25 PHE HD2 1 1 7 5335 2 2 25 PHE HE1 H -4.838 -4.072 1.737 1.00 . B B . 25 PHE HE1 1 1 7 5336 2 2 25 PHE HE2 H -8.909 -5.367 2.163 1.00 . B B . 25 PHE HE2 1 1 7 5337 2 2 25 PHE HZ H -6.759 -4.673 3.184 1.00 . B B . 25 PHE HZ 1 1 7 5338 2 2 25 PHE N N -4.894 -5.457 -2.465 1.00 . B B . 25 PHE N 1 1 7 5339 2 2 25 PHE O O -5.736 -2.498 -1.721 1.00 . B B . 25 PHE O 1 1 7 5340 2 2 26 TYR C C -6.189 -0.200 -4.234 1.00 . B B . 26 TYR C 1 1 7 5341 2 2 26 TYR CA C -4.940 -0.981 -3.793 1.00 . B B . 26 TYR CA 1 1 7 5342 2 2 26 TYR CB C -3.722 -0.677 -4.696 1.00 . B B . 26 TYR CB 1 1 7 5343 2 2 26 TYR CD1 C -4.618 -0.771 -7.054 1.00 . B B . 26 TYR CD1 1 1 7 5344 2 2 26 TYR CD2 C -4.079 1.392 -6.096 1.00 . B B . 26 TYR CD2 1 1 7 5345 2 2 26 TYR CE1 C -5.022 -0.146 -8.240 1.00 . B B . 26 TYR CE1 1 1 7 5346 2 2 26 TYR CE2 C -4.481 2.018 -7.282 1.00 . B B . 26 TYR CE2 1 1 7 5347 2 2 26 TYR CG C -4.146 -0.003 -5.982 1.00 . B B . 26 TYR CG 1 1 7 5348 2 2 26 TYR CZ C -4.954 1.249 -8.354 1.00 . B B . 26 TYR CZ 1 1 7 5349 2 2 26 TYR H H -5.214 -2.900 -4.715 1.00 . B B . 26 TYR H 1 1 7 5350 2 2 26 TYR HA H -4.702 -0.714 -2.773 1.00 . B B . 26 TYR HA 1 1 7 5351 2 2 26 TYR HB2 H -3.041 -0.028 -4.165 1.00 . B B . 26 TYR HB2 1 1 7 5352 2 2 26 TYR HB3 H -3.217 -1.603 -4.930 1.00 . B B . 26 TYR HB3 1 1 7 5353 2 2 26 TYR HD1 H -4.669 -1.846 -6.965 1.00 . B B . 26 TYR HD1 1 1 7 5354 2 2 26 TYR HD2 H -3.715 1.985 -5.269 1.00 . B B . 26 TYR HD2 1 1 7 5355 2 2 26 TYR HE1 H -5.387 -0.740 -9.066 1.00 . B B . 26 TYR HE1 1 1 7 5356 2 2 26 TYR HE2 H -4.430 3.092 -7.369 1.00 . B B . 26 TYR HE2 1 1 7 5357 2 2 26 TYR HH H -5.025 2.768 -9.506 1.00 . B B . 26 TYR HH 1 1 7 5358 2 2 26 TYR N N -5.259 -2.433 -3.860 1.00 . B B . 26 TYR N 1 1 7 5359 2 2 26 TYR O O -6.591 -0.240 -5.380 1.00 . B B . 26 TYR O 1 1 7 5360 2 2 26 TYR OH O -5.352 1.866 -9.521 1.00 . B B . 26 TYR OH 1 1 7 5361 2 2 27 THR C C -7.689 2.577 -4.311 1.00 . B B . 27 THR C 1 1 7 5362 2 2 27 THR CA C -8.051 1.234 -3.672 1.00 . B B . 27 THR CA 1 1 7 5363 2 2 27 THR CB C -8.856 1.470 -2.398 1.00 . B B . 27 THR CB 1 1 7 5364 2 2 27 THR CG2 C -9.372 0.131 -1.875 1.00 . B B . 27 THR CG2 1 1 7 5365 2 2 27 THR H H -6.496 0.476 -2.402 1.00 . B B . 27 THR H 1 1 7 5366 2 2 27 THR HA H -8.641 0.655 -4.366 1.00 . B B . 27 THR HA 1 1 7 5367 2 2 27 THR HB H -9.690 2.112 -2.614 1.00 . B B . 27 THR HB 1 1 7 5368 2 2 27 THR HG1 H -7.470 2.725 -1.863 1.00 . B B . 27 THR HG1 1 1 7 5369 2 2 27 THR HG21 H -9.724 0.251 -0.862 1.00 . B B . 27 THR HG21 1 1 7 5370 2 2 27 THR HG22 H -8.570 -0.595 -1.894 1.00 . B B . 27 THR HG22 1 1 7 5371 2 2 27 THR HG23 H -10.183 -0.213 -2.501 1.00 . B B . 27 THR HG23 1 1 7 5372 2 2 27 THR N N -6.819 0.479 -3.323 1.00 . B B . 27 THR N 1 1 7 5373 2 2 27 THR O O -6.533 2.899 -4.498 1.00 . B B . 27 THR O 1 1 7 5374 2 2 27 THR OG1 O -8.026 2.078 -1.420 1.00 . B B . 27 THR OG1 1 1 7 5375 2 2 28 LYS C C -7.688 4.461 -6.624 1.00 . B B . 28 LYS C 1 1 7 5376 2 2 28 LYS CA C -8.408 4.681 -5.288 1.00 . B B . 28 LYS CA 1 1 7 5377 2 2 28 LYS CB C -7.526 5.525 -4.364 1.00 . B B . 28 LYS CB 1 1 7 5378 2 2 28 LYS CD C -7.539 7.918 -3.632 1.00 . B B . 28 LYS CD 1 1 7 5379 2 2 28 LYS CE C -8.923 8.553 -3.485 1.00 . B B . 28 LYS CE 1 1 7 5380 2 2 28 LYS CG C -7.529 6.981 -4.841 1.00 . B B . 28 LYS CG 1 1 7 5381 2 2 28 LYS H H -9.602 3.072 -4.496 1.00 . B B . 28 LYS H 1 1 7 5382 2 2 28 LYS HA H -9.343 5.193 -5.457 1.00 . B B . 28 LYS HA 1 1 7 5383 2 2 28 LYS HB2 H -7.912 5.475 -3.355 1.00 . B B . 28 LYS HB2 1 1 7 5384 2 2 28 LYS HB3 H -6.516 5.145 -4.383 1.00 . B B . 28 LYS HB3 1 1 7 5385 2 2 28 LYS HD2 H -7.303 7.356 -2.740 1.00 . B B . 28 LYS HD2 1 1 7 5386 2 2 28 LYS HD3 H -6.803 8.695 -3.773 1.00 . B B . 28 LYS HD3 1 1 7 5387 2 2 28 LYS HE2 H -8.817 9.614 -3.320 1.00 . B B . 28 LYS HE2 1 1 7 5388 2 2 28 LYS HE3 H -9.494 8.385 -4.387 1.00 . B B . 28 LYS HE3 1 1 7 5389 2 2 28 LYS HG2 H -6.645 7.166 -5.433 1.00 . B B . 28 LYS HG2 1 1 7 5390 2 2 28 LYS HG3 H -8.408 7.162 -5.442 1.00 . B B . 28 LYS HG3 1 1 7 5391 2 2 28 LYS HZ1 H -10.649 7.887 -2.531 1.00 . B B . 28 LYS HZ1 1 1 7 5392 2 2 28 LYS HZ2 H -9.476 8.521 -1.479 1.00 . B B . 28 LYS HZ2 1 1 7 5393 2 2 28 LYS HZ3 H -9.263 6.980 -2.164 1.00 . B B . 28 LYS HZ3 1 1 7 5394 2 2 28 LYS N N -8.678 3.359 -4.653 1.00 . B B . 28 LYS N 1 1 7 5395 2 2 28 LYS NZ N -9.631 7.938 -2.327 1.00 . B B . 28 LYS NZ 1 1 7 5396 2 2 28 LYS O O -6.499 4.211 -6.649 1.00 . B B . 28 LYS O 1 1 7 5397 2 2 29 PRO C C -7.105 5.601 -9.498 1.00 . B B . 29 PRO C 1 1 7 5398 2 2 29 PRO CA C -7.890 4.364 -9.054 1.00 . B B . 29 PRO CA 1 1 7 5399 2 2 29 PRO CB C -9.139 4.166 -9.918 1.00 . B B . 29 PRO CB 1 1 7 5400 2 2 29 PRO CD C -9.877 4.864 -7.663 1.00 . B B . 29 PRO CD 1 1 7 5401 2 2 29 PRO CG C -10.313 4.802 -9.139 1.00 . B B . 29 PRO CG 1 1 7 5402 2 2 29 PRO HA H -7.270 3.484 -9.096 1.00 . B B . 29 PRO HA 1 1 7 5403 2 2 29 PRO HB2 H -9.010 4.658 -10.872 1.00 . B B . 29 PRO HB2 1 1 7 5404 2 2 29 PRO HB3 H -9.328 3.114 -10.064 1.00 . B B . 29 PRO HB3 1 1 7 5405 2 2 29 PRO HD2 H -10.046 5.855 -7.261 1.00 . B B . 29 PRO HD2 1 1 7 5406 2 2 29 PRO HD3 H -10.403 4.124 -7.081 1.00 . B B . 29 PRO HD3 1 1 7 5407 2 2 29 PRO HG2 H -10.507 5.799 -9.512 1.00 . B B . 29 PRO HG2 1 1 7 5408 2 2 29 PRO HG3 H -11.196 4.190 -9.233 1.00 . B B . 29 PRO HG3 1 1 7 5409 2 2 29 PRO N N -8.433 4.556 -7.698 1.00 . B B . 29 PRO N 1 1 7 5410 2 2 29 PRO O O -7.426 6.716 -9.135 1.00 . B B . 29 PRO O 1 1 7 5411 2 2 30 THR C C -6.041 7.333 -11.824 1.00 . B B . 30 THR C 1 1 7 5412 2 2 30 THR CA C -5.270 6.572 -10.745 1.00 . B B . 30 THR CA 1 1 7 5413 2 2 30 THR CB C -3.945 6.069 -11.323 1.00 . B B . 30 THR CB 1 1 7 5414 2 2 30 THR CG2 C -2.782 6.789 -10.639 1.00 . B B . 30 THR CG2 1 1 7 5415 2 2 30 THR H H -5.836 4.504 -10.557 1.00 . B B . 30 THR H 1 1 7 5416 2 2 30 THR HA H -5.072 7.231 -9.911 1.00 . B B . 30 THR HA 1 1 7 5417 2 2 30 THR HB H -3.915 6.271 -12.382 1.00 . B B . 30 THR HB 1 1 7 5418 2 2 30 THR HG1 H -3.184 4.324 -11.715 1.00 . B B . 30 THR HG1 1 1 7 5419 2 2 30 THR HG21 H -3.013 6.932 -9.594 1.00 . B B . 30 THR HG21 1 1 7 5420 2 2 30 THR HG22 H -2.628 7.750 -11.107 1.00 . B B . 30 THR HG22 1 1 7 5421 2 2 30 THR HG23 H -1.887 6.193 -10.731 1.00 . B B . 30 THR HG23 1 1 7 5422 2 2 30 THR N N -6.078 5.411 -10.279 1.00 . B B . 30 THR N 1 1 7 5423 2 2 30 THR O O -5.400 7.961 -12.651 1.00 . B B . 30 THR O 1 1 7 5424 2 2 30 THR OXT O -7.260 7.275 -11.808 1.00 . B B . 30 THR OXT 1 1 7 5425 2 2 30 THR OG1 O -3.836 4.671 -11.101 1.00 . B B . 30 THR OG1 1 1 8 5426 1 1 1 GLY C C -3.994 6.931 0.180 1.00 . A A . 1 GLY C 1 1 8 5427 1 1 1 GLY CA C -5.475 7.133 0.170 1.00 . A A . 1 GLY CA 1 1 8 5428 1 1 1 GLY H1 H -6.210 5.901 1.726 1.00 . A A . 1 GLY H1 1 1 8 5429 1 1 1 GLY H2 H -6.189 5.140 0.208 1.00 . A A . 1 GLY H2 1 1 8 5430 1 1 1 GLY H3 H -7.381 6.298 0.563 1.00 . A A . 1 GLY H3 1 1 8 5431 1 1 1 GLY HA2 H -5.375 7.071 -0.797 1.00 . A A . 1 GLY HA2 1 1 8 5432 1 1 1 GLY HA3 H -5.935 8.149 0.516 1.00 . A A . 1 GLY HA3 1 1 8 5433 1 1 1 GLY N N -6.386 6.030 0.710 1.00 . A A . 1 GLY N 1 1 8 5434 1 1 1 GLY O O -3.274 7.611 0.885 1.00 . A A . 1 GLY O 1 1 8 5435 1 1 2 ILE C C -1.464 6.308 -1.938 1.00 . A A . 2 ILE C 1 1 8 5436 1 1 2 ILE CA C -2.029 5.763 -0.629 1.00 . A A . 2 ILE CA 1 1 8 5437 1 1 2 ILE CB C -1.758 4.262 -0.534 1.00 . A A . 2 ILE CB 1 1 8 5438 1 1 2 ILE CD1 C 0.058 2.539 -0.528 1.00 . A A . 2 ILE CD1 1 1 8 5439 1 1 2 ILE CG1 C -0.262 4.020 -0.310 1.00 . A A . 2 ILE CG1 1 1 8 5440 1 1 2 ILE CG2 C -2.195 3.585 -1.832 1.00 . A A . 2 ILE CG2 1 1 8 5441 1 1 2 ILE H H -4.093 5.471 -1.168 1.00 . A A . 2 ILE H 1 1 8 5442 1 1 2 ILE HA H -1.561 6.268 0.200 1.00 . A A . 2 ILE HA 1 1 8 5443 1 1 2 ILE HB H -2.319 3.849 0.292 1.00 . A A . 2 ILE HB 1 1 8 5444 1 1 2 ILE HD11 H -0.816 1.945 -0.301 1.00 . A A . 2 ILE HD11 1 1 8 5445 1 1 2 ILE HD12 H 0.869 2.247 0.121 1.00 . A A . 2 ILE HD12 1 1 8 5446 1 1 2 ILE HD13 H 0.343 2.380 -1.558 1.00 . A A . 2 ILE HD13 1 1 8 5447 1 1 2 ILE HG12 H 0.307 4.617 -1.008 1.00 . A A . 2 ILE HG12 1 1 8 5448 1 1 2 ILE HG13 H 0.001 4.297 0.699 1.00 . A A . 2 ILE HG13 1 1 8 5449 1 1 2 ILE HG21 H -2.860 4.240 -2.372 1.00 . A A . 2 ILE HG21 1 1 8 5450 1 1 2 ILE HG22 H -2.707 2.663 -1.601 1.00 . A A . 2 ILE HG22 1 1 8 5451 1 1 2 ILE HG23 H -1.326 3.375 -2.437 1.00 . A A . 2 ILE HG23 1 1 8 5452 1 1 2 ILE N N -3.499 6.004 -0.597 1.00 . A A . 2 ILE N 1 1 8 5453 1 1 2 ILE O O -0.322 6.709 -2.017 1.00 . A A . 2 ILE O 1 1 8 5454 1 1 3 VAL C C -1.271 8.266 -4.111 1.00 . A A . 3 VAL C 1 1 8 5455 1 1 3 VAL CA C -1.789 6.838 -4.277 1.00 . A A . 3 VAL CA 1 1 8 5456 1 1 3 VAL CB C -2.953 6.827 -5.265 1.00 . A A . 3 VAL CB 1 1 8 5457 1 1 3 VAL CG1 C -2.419 6.982 -6.686 1.00 . A A . 3 VAL CG1 1 1 8 5458 1 1 3 VAL CG2 C -3.705 5.501 -5.149 1.00 . A A . 3 VAL CG2 1 1 8 5459 1 1 3 VAL H H -3.183 5.997 -2.875 1.00 . A A . 3 VAL H 1 1 8 5460 1 1 3 VAL HA H -0.995 6.206 -4.647 1.00 . A A . 3 VAL HA 1 1 8 5461 1 1 3 VAL HB H -3.623 7.644 -5.042 1.00 . A A . 3 VAL HB 1 1 8 5462 1 1 3 VAL HG11 H -1.379 6.696 -6.711 1.00 . A A . 3 VAL HG11 1 1 8 5463 1 1 3 VAL HG12 H -2.519 8.012 -6.995 1.00 . A A . 3 VAL HG12 1 1 8 5464 1 1 3 VAL HG13 H -2.985 6.348 -7.351 1.00 . A A . 3 VAL HG13 1 1 8 5465 1 1 3 VAL HG21 H -4.706 5.686 -4.789 1.00 . A A . 3 VAL HG21 1 1 8 5466 1 1 3 VAL HG22 H -3.187 4.852 -4.458 1.00 . A A . 3 VAL HG22 1 1 8 5467 1 1 3 VAL HG23 H -3.754 5.028 -6.119 1.00 . A A . 3 VAL HG23 1 1 8 5468 1 1 3 VAL N N -2.264 6.324 -2.965 1.00 . A A . 3 VAL N 1 1 8 5469 1 1 3 VAL O O -0.191 8.599 -4.550 1.00 . A A . 3 VAL O 1 1 8 5470 1 1 4 GLU C C -0.453 10.581 -2.279 1.00 . A A . 4 GLU C 1 1 8 5471 1 1 4 GLU CA C -1.599 10.522 -3.294 1.00 . A A . 4 GLU CA 1 1 8 5472 1 1 4 GLU CB C -2.775 11.345 -2.768 1.00 . A A . 4 GLU CB 1 1 8 5473 1 1 4 GLU CD C -2.575 13.624 -3.768 1.00 . A A . 4 GLU CD 1 1 8 5474 1 1 4 GLU CG C -2.322 12.782 -2.516 1.00 . A A . 4 GLU CG 1 1 8 5475 1 1 4 GLU H H -2.909 8.822 -3.141 1.00 . A A . 4 GLU H 1 1 8 5476 1 1 4 GLU HA H -1.267 10.930 -4.237 1.00 . A A . 4 GLU HA 1 1 8 5477 1 1 4 GLU HB2 H -3.574 11.339 -3.497 1.00 . A A . 4 GLU HB2 1 1 8 5478 1 1 4 GLU HB3 H -3.128 10.913 -1.843 1.00 . A A . 4 GLU HB3 1 1 8 5479 1 1 4 GLU HG2 H -2.876 13.194 -1.685 1.00 . A A . 4 GLU HG2 1 1 8 5480 1 1 4 GLU HG3 H -1.267 12.792 -2.286 1.00 . A A . 4 GLU HG3 1 1 8 5481 1 1 4 GLU N N -2.039 9.112 -3.485 1.00 . A A . 4 GLU N 1 1 8 5482 1 1 4 GLU O O 0.430 11.409 -2.375 1.00 . A A . 4 GLU O 1 1 8 5483 1 1 4 GLU OE1 O -2.752 13.040 -4.824 1.00 . A A . 4 GLU OE1 1 1 8 5484 1 1 4 GLU OE2 O -2.590 14.838 -3.648 1.00 . A A . 4 GLU OE2 1 1 8 5485 1 1 5 GLN C C 1.853 9.015 -0.783 1.00 . A A . 5 GLN C 1 1 8 5486 1 1 5 GLN CA C 0.607 9.743 -0.269 1.00 . A A . 5 GLN CA 1 1 8 5487 1 1 5 GLN CB C 0.109 9.059 1.005 1.00 . A A . 5 GLN CB 1 1 8 5488 1 1 5 GLN CD C 1.419 10.304 2.731 1.00 . A A . 5 GLN CD 1 1 8 5489 1 1 5 GLN CG C 0.027 10.087 2.136 1.00 . A A . 5 GLN CG 1 1 8 5490 1 1 5 GLN H H -1.202 9.070 -1.232 1.00 . A A . 5 GLN H 1 1 8 5491 1 1 5 GLN HA H 0.864 10.767 -0.046 1.00 . A A . 5 GLN HA 1 1 8 5492 1 1 5 GLN HB2 H -0.869 8.637 0.829 1.00 . A A . 5 GLN HB2 1 1 8 5493 1 1 5 GLN HB3 H 0.795 8.274 1.285 1.00 . A A . 5 GLN HB3 1 1 8 5494 1 1 5 GLN HE21 H 0.858 11.841 3.855 1.00 . A A . 5 GLN HE21 1 1 8 5495 1 1 5 GLN HE22 H 2.495 11.413 3.978 1.00 . A A . 5 GLN HE22 1 1 8 5496 1 1 5 GLN HG2 H -0.349 11.022 1.745 1.00 . A A . 5 GLN HG2 1 1 8 5497 1 1 5 GLN HG3 H -0.638 9.725 2.905 1.00 . A A . 5 GLN HG3 1 1 8 5498 1 1 5 GLN N N -0.472 9.722 -1.298 1.00 . A A . 5 GLN N 1 1 8 5499 1 1 5 GLN NE2 N 1.606 11.266 3.593 1.00 . A A . 5 GLN NE2 1 1 8 5500 1 1 5 GLN O O 2.966 9.369 -0.447 1.00 . A A . 5 GLN O 1 1 8 5501 1 1 5 GLN OE1 O 2.348 9.590 2.407 1.00 . A A . 5 GLN OE1 1 1 8 5502 1 1 6 CYS C C 3.482 8.022 -3.284 1.00 . A A . 6 CYS C 1 1 8 5503 1 1 6 CYS CA C 2.882 7.268 -2.098 1.00 . A A . 6 CYS CA 1 1 8 5504 1 1 6 CYS CB C 2.480 5.862 -2.547 1.00 . A A . 6 CYS CB 1 1 8 5505 1 1 6 CYS H H 0.785 7.720 -1.850 1.00 . A A . 6 CYS H 1 1 8 5506 1 1 6 CYS HA H 3.618 7.196 -1.313 1.00 . A A . 6 CYS HA 1 1 8 5507 1 1 6 CYS HB2 H 1.419 5.830 -2.731 1.00 . A A . 6 CYS HB2 1 1 8 5508 1 1 6 CYS HB3 H 3.010 5.611 -3.454 1.00 . A A . 6 CYS HB3 1 1 8 5509 1 1 6 CYS N N 1.688 8.001 -1.587 1.00 . A A . 6 CYS N 1 1 8 5510 1 1 6 CYS O O 4.675 7.985 -3.513 1.00 . A A . 6 CYS O 1 1 8 5511 1 1 6 CYS SG S 2.905 4.671 -1.252 1.00 . A A . 6 CYS SG 1 1 8 5512 1 1 7 CYS C C 3.859 10.744 -4.733 1.00 . A A . 7 CYS C 1 1 8 5513 1 1 7 CYS CA C 3.208 9.445 -5.215 1.00 . A A . 7 CYS CA 1 1 8 5514 1 1 7 CYS CB C 2.069 9.781 -6.182 1.00 . A A . 7 CYS CB 1 1 8 5515 1 1 7 CYS H H 1.710 8.716 -3.849 1.00 . A A . 7 CYS H 1 1 8 5516 1 1 7 CYS HA H 3.943 8.835 -5.717 1.00 . A A . 7 CYS HA 1 1 8 5517 1 1 7 CYS HB2 H 1.131 9.753 -5.650 1.00 . A A . 7 CYS HB2 1 1 8 5518 1 1 7 CYS HB3 H 2.222 10.770 -6.583 1.00 . A A . 7 CYS HB3 1 1 8 5519 1 1 7 CYS N N 2.669 8.699 -4.045 1.00 . A A . 7 CYS N 1 1 8 5520 1 1 7 CYS O O 4.806 11.229 -5.320 1.00 . A A . 7 CYS O 1 1 8 5521 1 1 7 CYS SG S 2.021 8.582 -7.538 1.00 . A A . 7 CYS SG 1 1 8 5522 1 1 8 THR C C 4.850 12.284 -1.960 1.00 . A A . 8 THR C 1 1 8 5523 1 1 8 THR CA C 3.943 12.583 -3.156 1.00 . A A . 8 THR CA 1 1 8 5524 1 1 8 THR CB C 2.817 13.526 -2.723 1.00 . A A . 8 THR CB 1 1 8 5525 1 1 8 THR CG2 C 2.195 13.021 -1.420 1.00 . A A . 8 THR CG2 1 1 8 5526 1 1 8 THR H H 2.589 10.907 -3.214 1.00 . A A . 8 THR H 1 1 8 5527 1 1 8 THR HA H 4.523 13.052 -3.938 1.00 . A A . 8 THR HA 1 1 8 5528 1 1 8 THR HB H 2.058 13.557 -3.489 1.00 . A A . 8 THR HB 1 1 8 5529 1 1 8 THR HG1 H 2.696 15.464 -2.839 1.00 . A A . 8 THR HG1 1 1 8 5530 1 1 8 THR HG21 H 2.711 13.460 -0.579 1.00 . A A . 8 THR HG21 1 1 8 5531 1 1 8 THR HG22 H 2.280 11.945 -1.373 1.00 . A A . 8 THR HG22 1 1 8 5532 1 1 8 THR HG23 H 1.152 13.301 -1.387 1.00 . A A . 8 THR HG23 1 1 8 5533 1 1 8 THR N N 3.355 11.313 -3.671 1.00 . A A . 8 THR N 1 1 8 5534 1 1 8 THR O O 5.808 12.986 -1.707 1.00 . A A . 8 THR O 1 1 8 5535 1 1 8 THR OG1 O 3.344 14.831 -2.524 1.00 . A A . 8 THR OG1 1 1 8 5536 1 1 9 SER C C 6.115 9.585 -0.276 1.00 . A A . 9 SER C 1 1 8 5537 1 1 9 SER CA C 5.404 10.919 -0.039 1.00 . A A . 9 SER CA 1 1 8 5538 1 1 9 SER CB C 4.526 10.817 1.208 1.00 . A A . 9 SER CB 1 1 8 5539 1 1 9 SER H H 3.777 10.698 -1.434 1.00 . A A . 9 SER H 1 1 8 5540 1 1 9 SER HA H 6.140 11.697 0.104 1.00 . A A . 9 SER HA 1 1 8 5541 1 1 9 SER HB2 H 3.563 11.258 1.010 1.00 . A A . 9 SER HB2 1 1 8 5542 1 1 9 SER HB3 H 4.394 9.776 1.471 1.00 . A A . 9 SER HB3 1 1 8 5543 1 1 9 SER HG H 5.120 12.453 2.076 1.00 . A A . 9 SER HG 1 1 8 5544 1 1 9 SER N N 4.556 11.251 -1.217 1.00 . A A . 9 SER N 1 1 8 5545 1 1 9 SER O O 5.777 8.842 -1.175 1.00 . A A . 9 SER O 1 1 8 5546 1 1 9 SER OG O 5.147 11.515 2.279 1.00 . A A . 9 SER OG 1 1 8 5547 1 1 10 ILE C C 7.148 6.891 1.150 1.00 . A A . 10 ILE C 1 1 8 5548 1 1 10 ILE CA C 7.838 7.997 0.347 1.00 . A A . 10 ILE CA 1 1 8 5549 1 1 10 ILE CB C 9.271 8.170 0.853 1.00 . A A . 10 ILE CB 1 1 8 5550 1 1 10 ILE CD1 C 11.135 8.753 -0.784 1.00 . A A . 10 ILE CD1 1 1 8 5551 1 1 10 ILE CG1 C 9.961 9.295 0.045 1.00 . A A . 10 ILE CG1 1 1 8 5552 1 1 10 ILE CG2 C 10.017 6.838 0.712 1.00 . A A . 10 ILE CG2 1 1 8 5553 1 1 10 ILE H H 7.358 9.894 1.241 1.00 . A A . 10 ILE H 1 1 8 5554 1 1 10 ILE HA H 7.854 7.729 -0.699 1.00 . A A . 10 ILE HA 1 1 8 5555 1 1 10 ILE HB H 9.243 8.447 1.898 1.00 . A A . 10 ILE HB 1 1 8 5556 1 1 10 ILE HD11 H 11.882 8.338 -0.123 1.00 . A A . 10 ILE HD11 1 1 8 5557 1 1 10 ILE HD12 H 11.571 9.557 -1.359 1.00 . A A . 10 ILE HD12 1 1 8 5558 1 1 10 ILE HD13 H 10.779 7.984 -1.452 1.00 . A A . 10 ILE HD13 1 1 8 5559 1 1 10 ILE HG12 H 9.240 9.745 -0.619 1.00 . A A . 10 ILE HG12 1 1 8 5560 1 1 10 ILE HG13 H 10.329 10.045 0.730 1.00 . A A . 10 ILE HG13 1 1 8 5561 1 1 10 ILE HG21 H 9.577 6.109 1.374 1.00 . A A . 10 ILE HG21 1 1 8 5562 1 1 10 ILE HG22 H 11.055 6.980 0.968 1.00 . A A . 10 ILE HG22 1 1 8 5563 1 1 10 ILE HG23 H 9.941 6.491 -0.308 1.00 . A A . 10 ILE HG23 1 1 8 5564 1 1 10 ILE N N 7.100 9.279 0.523 1.00 . A A . 10 ILE N 1 1 8 5565 1 1 10 ILE O O 6.661 7.118 2.241 1.00 . A A . 10 ILE O 1 1 8 5566 1 1 11 CYS C C 7.413 3.390 1.460 1.00 . A A . 11 CYS C 1 1 8 5567 1 1 11 CYS CA C 6.453 4.578 1.378 1.00 . A A . 11 CYS CA 1 1 8 5568 1 1 11 CYS CB C 5.155 4.119 0.687 1.00 . A A . 11 CYS CB 1 1 8 5569 1 1 11 CYS H H 7.510 5.525 -0.250 1.00 . A A . 11 CYS H 1 1 8 5570 1 1 11 CYS HA H 6.224 4.913 2.379 1.00 . A A . 11 CYS HA 1 1 8 5571 1 1 11 CYS HB2 H 5.240 3.074 0.433 1.00 . A A . 11 CYS HB2 1 1 8 5572 1 1 11 CYS HB3 H 4.328 4.250 1.368 1.00 . A A . 11 CYS HB3 1 1 8 5573 1 1 11 CYS N N 7.108 5.692 0.628 1.00 . A A . 11 CYS N 1 1 8 5574 1 1 11 CYS O O 7.975 2.963 0.471 1.00 . A A . 11 CYS O 1 1 8 5575 1 1 11 CYS SG S 4.842 5.068 -0.825 1.00 . A A . 11 CYS SG 1 1 8 5576 1 1 12 SER C C 7.682 0.401 2.818 1.00 . A A . 12 SER C 1 1 8 5577 1 1 12 SER CA C 8.514 1.684 2.779 1.00 . A A . 12 SER CA 1 1 8 5578 1 1 12 SER CB C 9.309 1.820 4.078 1.00 . A A . 12 SER CB 1 1 8 5579 1 1 12 SER H H 7.130 3.206 3.416 1.00 . A A . 12 SER H 1 1 8 5580 1 1 12 SER HA H 9.193 1.650 1.939 1.00 . A A . 12 SER HA 1 1 8 5581 1 1 12 SER HB2 H 9.352 0.866 4.578 1.00 . A A . 12 SER HB2 1 1 8 5582 1 1 12 SER HB3 H 10.315 2.150 3.850 1.00 . A A . 12 SER HB3 1 1 8 5583 1 1 12 SER HG H 9.288 3.018 5.611 1.00 . A A . 12 SER HG 1 1 8 5584 1 1 12 SER N N 7.598 2.849 2.632 1.00 . A A . 12 SER N 1 1 8 5585 1 1 12 SER O O 6.516 0.425 3.165 1.00 . A A . 12 SER O 1 1 8 5586 1 1 12 SER OG O 8.667 2.763 4.926 1.00 . A A . 12 SER OG 1 1 8 5587 1 1 13 LEU C C 6.514 -2.037 3.596 1.00 . A A . 13 LEU C 1 1 8 5588 1 1 13 LEU CA C 7.520 -2.000 2.447 1.00 . A A . 13 LEU CA 1 1 8 5589 1 1 13 LEU CB C 8.493 -3.165 2.584 1.00 . A A . 13 LEU CB 1 1 8 5590 1 1 13 LEU CD1 C 7.932 -5.184 1.228 1.00 . A A . 13 LEU CD1 1 1 8 5591 1 1 13 LEU CD2 C 8.197 -5.370 3.706 1.00 . A A . 13 LEU CD2 1 1 8 5592 1 1 13 LEU CG C 7.710 -4.476 2.567 1.00 . A A . 13 LEU CG 1 1 8 5593 1 1 13 LEU H H 9.199 -0.692 2.153 1.00 . A A . 13 LEU H 1 1 8 5594 1 1 13 LEU HA H 6.998 -2.092 1.522 1.00 . A A . 13 LEU HA 1 1 8 5595 1 1 13 LEU HB2 H 9.188 -3.149 1.760 1.00 . A A . 13 LEU HB2 1 1 8 5596 1 1 13 LEU HB3 H 9.031 -3.081 3.514 1.00 . A A . 13 LEU HB3 1 1 8 5597 1 1 13 LEU HD11 H 7.445 -6.148 1.246 1.00 . A A . 13 LEU HD11 1 1 8 5598 1 1 13 LEU HD12 H 8.991 -5.318 1.063 1.00 . A A . 13 LEU HD12 1 1 8 5599 1 1 13 LEU HD13 H 7.516 -4.585 0.432 1.00 . A A . 13 LEU HD13 1 1 8 5600 1 1 13 LEU HD21 H 9.216 -5.672 3.515 1.00 . A A . 13 LEU HD21 1 1 8 5601 1 1 13 LEU HD22 H 7.567 -6.244 3.770 1.00 . A A . 13 LEU HD22 1 1 8 5602 1 1 13 LEU HD23 H 8.152 -4.823 4.635 1.00 . A A . 13 LEU HD23 1 1 8 5603 1 1 13 LEU HG H 6.658 -4.268 2.694 1.00 . A A . 13 LEU HG 1 1 8 5604 1 1 13 LEU N N 8.267 -0.710 2.449 1.00 . A A . 13 LEU N 1 1 8 5605 1 1 13 LEU O O 5.435 -2.581 3.470 1.00 . A A . 13 LEU O 1 1 8 5606 1 1 14 TYR C C 4.540 -0.947 5.353 1.00 . A A . 14 TYR C 1 1 8 5607 1 1 14 TYR CA C 5.895 -1.453 5.850 1.00 . A A . 14 TYR CA 1 1 8 5608 1 1 14 TYR CB C 6.416 -0.528 6.954 1.00 . A A . 14 TYR CB 1 1 8 5609 1 1 14 TYR CD1 C 5.110 -1.653 8.797 1.00 . A A . 14 TYR CD1 1 1 8 5610 1 1 14 TYR CD2 C 7.522 -1.478 9.012 1.00 . A A . 14 TYR CD2 1 1 8 5611 1 1 14 TYR CE1 C 5.047 -2.307 10.034 1.00 . A A . 14 TYR CE1 1 1 8 5612 1 1 14 TYR CE2 C 7.458 -2.133 10.249 1.00 . A A . 14 TYR CE2 1 1 8 5613 1 1 14 TYR CG C 6.347 -1.237 8.286 1.00 . A A . 14 TYR CG 1 1 8 5614 1 1 14 TYR CZ C 6.221 -2.547 10.760 1.00 . A A . 14 TYR CZ 1 1 8 5615 1 1 14 TYR H H 7.718 -1.012 4.793 1.00 . A A . 14 TYR H 1 1 8 5616 1 1 14 TYR HA H 5.788 -2.456 6.237 1.00 . A A . 14 TYR HA 1 1 8 5617 1 1 14 TYR HB2 H 7.440 -0.258 6.741 1.00 . A A . 14 TYR HB2 1 1 8 5618 1 1 14 TYR HB3 H 5.809 0.364 6.991 1.00 . A A . 14 TYR HB3 1 1 8 5619 1 1 14 TYR HD1 H 4.205 -1.467 8.238 1.00 . A A . 14 TYR HD1 1 1 8 5620 1 1 14 TYR HD2 H 8.475 -1.159 8.618 1.00 . A A . 14 TYR HD2 1 1 8 5621 1 1 14 TYR HE1 H 4.093 -2.626 10.428 1.00 . A A . 14 TYR HE1 1 1 8 5622 1 1 14 TYR HE2 H 8.364 -2.319 10.809 1.00 . A A . 14 TYR HE2 1 1 8 5623 1 1 14 TYR HH H 7.047 -3.471 12.214 1.00 . A A . 14 TYR HH 1 1 8 5624 1 1 14 TYR N N 6.849 -1.455 4.711 1.00 . A A . 14 TYR N 1 1 8 5625 1 1 14 TYR O O 3.543 -1.638 5.426 1.00 . A A . 14 TYR O 1 1 8 5626 1 1 14 TYR OH O 6.159 -3.192 11.980 1.00 . A A . 14 TYR OH 1 1 8 5627 1 1 15 GLN C C 2.634 -0.169 3.296 1.00 . A A . 15 GLN C 1 1 8 5628 1 1 15 GLN CA C 3.214 0.802 4.321 1.00 . A A . 15 GLN CA 1 1 8 5629 1 1 15 GLN CB C 3.466 2.154 3.653 1.00 . A A . 15 GLN CB 1 1 8 5630 1 1 15 GLN CD C 4.132 4.198 4.918 1.00 . A A . 15 GLN CD 1 1 8 5631 1 1 15 GLN CG C 2.964 3.277 4.561 1.00 . A A . 15 GLN CG 1 1 8 5632 1 1 15 GLN H H 5.319 0.784 4.770 1.00 . A A . 15 GLN H 1 1 8 5633 1 1 15 GLN HA H 2.520 0.923 5.139 1.00 . A A . 15 GLN HA 1 1 8 5634 1 1 15 GLN HB2 H 4.526 2.278 3.480 1.00 . A A . 15 GLN HB2 1 1 8 5635 1 1 15 GLN HB3 H 2.942 2.194 2.710 1.00 . A A . 15 GLN HB3 1 1 8 5636 1 1 15 GLN HE21 H 3.066 5.301 6.178 1.00 . A A . 15 GLN HE21 1 1 8 5637 1 1 15 GLN HE22 H 4.691 5.759 6.008 1.00 . A A . 15 GLN HE22 1 1 8 5638 1 1 15 GLN HG2 H 2.202 3.844 4.044 1.00 . A A . 15 GLN HG2 1 1 8 5639 1 1 15 GLN HG3 H 2.550 2.854 5.464 1.00 . A A . 15 GLN HG3 1 1 8 5640 1 1 15 GLN N N 4.500 0.251 4.834 1.00 . A A . 15 GLN N 1 1 8 5641 1 1 15 GLN NE2 N 3.947 5.166 5.772 1.00 . A A . 15 GLN NE2 1 1 8 5642 1 1 15 GLN O O 1.456 -0.462 3.296 1.00 . A A . 15 GLN O 1 1 8 5643 1 1 15 GLN OE1 O 5.226 4.032 4.415 1.00 . A A . 15 GLN OE1 1 1 8 5644 1 1 16 LEU C C 2.315 -2.825 2.099 1.00 . A A . 16 LEU C 1 1 8 5645 1 1 16 LEU CA C 2.964 -1.634 1.400 1.00 . A A . 16 LEU CA 1 1 8 5646 1 1 16 LEU CB C 4.129 -2.127 0.560 1.00 . A A . 16 LEU CB 1 1 8 5647 1 1 16 LEU CD1 C 6.027 -0.596 0.056 1.00 . A A . 16 LEU CD1 1 1 8 5648 1 1 16 LEU CD2 C 4.599 -1.451 -1.784 1.00 . A A . 16 LEU CD2 1 1 8 5649 1 1 16 LEU CG C 4.610 -0.989 -0.333 1.00 . A A . 16 LEU CG 1 1 8 5650 1 1 16 LEU H H 4.410 -0.426 2.448 1.00 . A A . 16 LEU H 1 1 8 5651 1 1 16 LEU HA H 2.249 -1.143 0.761 1.00 . A A . 16 LEU HA 1 1 8 5652 1 1 16 LEU HB2 H 4.923 -2.447 1.208 1.00 . A A . 16 LEU HB2 1 1 8 5653 1 1 16 LEU HB3 H 3.811 -2.953 -0.053 1.00 . A A . 16 LEU HB3 1 1 8 5654 1 1 16 LEU HD11 H 6.711 -1.373 -0.251 1.00 . A A . 16 LEU HD11 1 1 8 5655 1 1 16 LEU HD12 H 6.081 -0.469 1.127 1.00 . A A . 16 LEU HD12 1 1 8 5656 1 1 16 LEU HD13 H 6.289 0.329 -0.432 1.00 . A A . 16 LEU HD13 1 1 8 5657 1 1 16 LEU HD21 H 4.584 -0.590 -2.433 1.00 . A A . 16 LEU HD21 1 1 8 5658 1 1 16 LEU HD22 H 3.721 -2.055 -1.960 1.00 . A A . 16 LEU HD22 1 1 8 5659 1 1 16 LEU HD23 H 5.485 -2.036 -1.977 1.00 . A A . 16 LEU HD23 1 1 8 5660 1 1 16 LEU HG H 3.954 -0.138 -0.218 1.00 . A A . 16 LEU HG 1 1 8 5661 1 1 16 LEU N N 3.461 -0.675 2.425 1.00 . A A . 16 LEU N 1 1 8 5662 1 1 16 LEU O O 1.196 -3.199 1.811 1.00 . A A . 16 LEU O 1 1 8 5663 1 1 17 GLU C C 1.116 -4.227 4.384 1.00 . A A . 17 GLU C 1 1 8 5664 1 1 17 GLU CA C 2.460 -4.596 3.750 1.00 . A A . 17 GLU CA 1 1 8 5665 1 1 17 GLU CB C 3.442 -5.021 4.844 1.00 . A A . 17 GLU CB 1 1 8 5666 1 1 17 GLU CD C 4.278 -6.947 6.196 1.00 . A A . 17 GLU CD 1 1 8 5667 1 1 17 GLU CG C 3.201 -6.487 5.212 1.00 . A A . 17 GLU CG 1 1 8 5668 1 1 17 GLU H H 3.925 -3.101 3.229 1.00 . A A . 17 GLU H 1 1 8 5669 1 1 17 GLU HA H 2.318 -5.412 3.060 1.00 . A A . 17 GLU HA 1 1 8 5670 1 1 17 GLU HB2 H 4.454 -4.903 4.485 1.00 . A A . 17 GLU HB2 1 1 8 5671 1 1 17 GLU HB3 H 3.296 -4.405 5.719 1.00 . A A . 17 GLU HB3 1 1 8 5672 1 1 17 GLU HG2 H 2.227 -6.587 5.669 1.00 . A A . 17 GLU HG2 1 1 8 5673 1 1 17 GLU HG3 H 3.245 -7.094 4.322 1.00 . A A . 17 GLU HG3 1 1 8 5674 1 1 17 GLU N N 3.020 -3.424 3.020 1.00 . A A . 17 GLU N 1 1 8 5675 1 1 17 GLU O O 0.353 -5.084 4.786 1.00 . A A . 17 GLU O 1 1 8 5676 1 1 17 GLU OE1 O 5.333 -6.334 6.219 1.00 . A A . 17 GLU OE1 1 1 8 5677 1 1 17 GLU OE2 O 4.030 -7.904 6.911 1.00 . A A . 17 GLU OE2 1 1 8 5678 1 1 18 ASN C C -1.536 -2.366 4.014 1.00 . A A . 18 ASN C 1 1 8 5679 1 1 18 ASN CA C -0.475 -2.550 5.103 1.00 . A A . 18 ASN CA 1 1 8 5680 1 1 18 ASN CB C -0.280 -1.231 5.855 1.00 . A A . 18 ASN CB 1 1 8 5681 1 1 18 ASN CG C -0.628 -1.427 7.333 1.00 . A A . 18 ASN CG 1 1 8 5682 1 1 18 ASN H H 1.445 -2.281 4.166 1.00 . A A . 18 ASN H 1 1 8 5683 1 1 18 ASN HA H -0.800 -3.311 5.794 1.00 . A A . 18 ASN HA 1 1 8 5684 1 1 18 ASN HB2 H 0.749 -0.914 5.766 1.00 . A A . 18 ASN HB2 1 1 8 5685 1 1 18 ASN HB3 H -0.927 -0.477 5.433 1.00 . A A . 18 ASN HB3 1 1 8 5686 1 1 18 ASN HD21 H -1.351 0.410 7.552 1.00 . A A . 18 ASN HD21 1 1 8 5687 1 1 18 ASN HD22 H -1.395 -0.559 8.945 1.00 . A A . 18 ASN HD22 1 1 8 5688 1 1 18 ASN N N 0.818 -2.960 4.487 1.00 . A A . 18 ASN N 1 1 8 5689 1 1 18 ASN ND2 N -1.170 -0.443 7.999 1.00 . A A . 18 ASN ND2 1 1 8 5690 1 1 18 ASN O O -2.566 -1.761 4.238 1.00 . A A . 18 ASN O 1 1 8 5691 1 1 18 ASN OD1 O -0.403 -2.484 7.887 1.00 . A A . 18 ASN OD1 1 1 8 5692 1 1 19 TYR C C -2.385 -4.032 0.944 1.00 . A A . 19 TYR C 1 1 8 5693 1 1 19 TYR CA C -2.309 -2.736 1.749 1.00 . A A . 19 TYR CA 1 1 8 5694 1 1 19 TYR CB C -1.902 -1.588 0.825 1.00 . A A . 19 TYR CB 1 1 8 5695 1 1 19 TYR CD1 C -2.954 0.113 2.359 1.00 . A A . 19 TYR CD1 1 1 8 5696 1 1 19 TYR CD2 C -0.678 0.472 1.598 1.00 . A A . 19 TYR CD2 1 1 8 5697 1 1 19 TYR CE1 C -2.897 1.308 3.091 1.00 . A A . 19 TYR CE1 1 1 8 5698 1 1 19 TYR CE2 C -0.621 1.666 2.329 1.00 . A A . 19 TYR CE2 1 1 8 5699 1 1 19 TYR CG C -1.844 -0.303 1.613 1.00 . A A . 19 TYR CG 1 1 8 5700 1 1 19 TYR CZ C -1.730 2.084 3.075 1.00 . A A . 19 TYR CZ 1 1 8 5701 1 1 19 TYR H H -0.467 -3.373 2.674 1.00 . A A . 19 TYR H 1 1 8 5702 1 1 19 TYR HA H -3.275 -2.525 2.181 1.00 . A A . 19 TYR HA 1 1 8 5703 1 1 19 TYR HB2 H -0.931 -1.796 0.400 1.00 . A A . 19 TYR HB2 1 1 8 5704 1 1 19 TYR HB3 H -2.628 -1.490 0.032 1.00 . A A . 19 TYR HB3 1 1 8 5705 1 1 19 TYR HD1 H -3.855 -0.485 2.370 1.00 . A A . 19 TYR HD1 1 1 8 5706 1 1 19 TYR HD2 H 0.176 0.150 1.022 1.00 . A A . 19 TYR HD2 1 1 8 5707 1 1 19 TYR HE1 H -3.753 1.629 3.666 1.00 . A A . 19 TYR HE1 1 1 8 5708 1 1 19 TYR HE2 H 0.279 2.263 2.317 1.00 . A A . 19 TYR HE2 1 1 8 5709 1 1 19 TYR HH H -2.394 3.253 4.430 1.00 . A A . 19 TYR HH 1 1 8 5710 1 1 19 TYR N N -1.302 -2.885 2.839 1.00 . A A . 19 TYR N 1 1 8 5711 1 1 19 TYR O O -2.424 -4.018 -0.271 1.00 . A A . 19 TYR O 1 1 8 5712 1 1 19 TYR OH O -1.675 3.260 3.795 1.00 . A A . 19 TYR OH 1 1 8 5713 1 1 20 CYS C C -2.763 -7.582 1.852 1.00 . A A . 20 CYS C 1 1 8 5714 1 1 20 CYS CA C -2.482 -6.446 0.869 1.00 . A A . 20 CYS CA 1 1 8 5715 1 1 20 CYS CB C -1.153 -6.701 0.158 1.00 . A A . 20 CYS CB 1 1 8 5716 1 1 20 CYS H H -2.375 -5.148 2.586 1.00 . A A . 20 CYS H 1 1 8 5717 1 1 20 CYS HA H -3.277 -6.397 0.140 1.00 . A A . 20 CYS HA 1 1 8 5718 1 1 20 CYS HB2 H -0.974 -5.917 -0.563 1.00 . A A . 20 CYS HB2 1 1 8 5719 1 1 20 CYS HB3 H -0.353 -6.711 0.884 1.00 . A A . 20 CYS HB3 1 1 8 5720 1 1 20 CYS N N -2.407 -5.154 1.606 1.00 . A A . 20 CYS N 1 1 8 5721 1 1 20 CYS O O -2.537 -7.461 3.040 1.00 . A A . 20 CYS O 1 1 8 5722 1 1 20 CYS SG S -1.219 -8.298 -0.691 1.00 . A A . 20 CYS SG 1 1 8 5723 1 1 21 ASN C C -2.246 -10.369 2.861 1.00 . A A . 21 ASN C 1 1 8 5724 1 1 21 ASN CA C -3.552 -9.834 2.269 1.00 . A A . 21 ASN CA 1 1 8 5725 1 1 21 ASN CB C -4.245 -10.943 1.475 1.00 . A A . 21 ASN CB 1 1 8 5726 1 1 21 ASN CG C -5.761 -10.757 1.555 1.00 . A A . 21 ASN CG 1 1 8 5727 1 1 21 ASN H H -3.431 -8.764 0.405 1.00 . A A . 21 ASN H 1 1 8 5728 1 1 21 ASN HA H -4.201 -9.503 3.067 1.00 . A A . 21 ASN HA 1 1 8 5729 1 1 21 ASN HB2 H -3.929 -10.897 0.442 1.00 . A A . 21 ASN HB2 1 1 8 5730 1 1 21 ASN HB3 H -3.980 -11.903 1.891 1.00 . A A . 21 ASN HB3 1 1 8 5731 1 1 21 ASN HD21 H -5.811 -9.385 0.120 1.00 . A A . 21 ASN HD21 1 1 8 5732 1 1 21 ASN HD22 H -7.315 -9.773 0.806 1.00 . A A . 21 ASN HD22 1 1 8 5733 1 1 21 ASN N N -3.255 -8.688 1.365 1.00 . A A . 21 ASN N 1 1 8 5734 1 1 21 ASN ND2 N -6.344 -9.900 0.762 1.00 . A A . 21 ASN ND2 1 1 8 5735 1 1 21 ASN O O -1.535 -11.056 2.146 1.00 . A A . 21 ASN O 1 1 8 5736 1 1 21 ASN OXT O -1.980 -10.084 4.017 1.00 . A A . 21 ASN OXT 1 1 8 5737 1 1 21 ASN OD1 O -6.422 -11.397 2.349 1.00 . A A . 21 ASN OD1 1 1 8 5738 2 2 1 PHE C C 10.749 -1.158 -0.603 1.00 . B B . 1 PHE C 1 1 8 5739 2 2 1 PHE CA C 9.821 -2.117 -1.348 1.00 . B B . 1 PHE CA 1 1 8 5740 2 2 1 PHE CB C 10.617 -3.362 -1.767 1.00 . B B . 1 PHE CB 1 1 8 5741 2 2 1 PHE CD1 C 11.501 -2.864 -4.068 1.00 . B B . 1 PHE CD1 1 1 8 5742 2 2 1 PHE CD2 C 9.569 -4.313 -3.845 1.00 . B B . 1 PHE CD2 1 1 8 5743 2 2 1 PHE CE1 C 11.444 -2.999 -5.458 1.00 . B B . 1 PHE CE1 1 1 8 5744 2 2 1 PHE CE2 C 9.511 -4.450 -5.235 1.00 . B B . 1 PHE CE2 1 1 8 5745 2 2 1 PHE CG C 10.565 -3.522 -3.263 1.00 . B B . 1 PHE CG 1 1 8 5746 2 2 1 PHE CZ C 10.447 -3.793 -6.045 1.00 . B B . 1 PHE CZ 1 1 8 5747 2 2 1 PHE H1 H 8.583 -2.051 -3.022 1.00 . B B . 1 PHE H1 1 1 8 5748 2 2 1 PHE H2 H 10.034 -1.188 -3.202 1.00 . B B . 1 PHE H2 1 1 8 5749 2 2 1 PHE H3 H 8.777 -0.554 -2.252 1.00 . B B . 1 PHE H3 1 1 8 5750 2 2 1 PHE HA H 9.013 -2.414 -0.703 1.00 . B B . 1 PHE HA 1 1 8 5751 2 2 1 PHE HB2 H 11.645 -3.253 -1.452 1.00 . B B . 1 PHE HB2 1 1 8 5752 2 2 1 PHE HB3 H 10.189 -4.235 -1.297 1.00 . B B . 1 PHE HB3 1 1 8 5753 2 2 1 PHE HD1 H 12.269 -2.255 -3.615 1.00 . B B . 1 PHE HD1 1 1 8 5754 2 2 1 PHE HD2 H 8.847 -4.820 -3.221 1.00 . B B . 1 PHE HD2 1 1 8 5755 2 2 1 PHE HE1 H 12.164 -2.491 -6.076 1.00 . B B . 1 PHE HE1 1 1 8 5756 2 2 1 PHE HE2 H 8.743 -5.060 -5.682 1.00 . B B . 1 PHE HE2 1 1 8 5757 2 2 1 PHE HZ H 10.401 -3.897 -7.120 1.00 . B B . 1 PHE HZ 1 1 8 5758 2 2 1 PHE N N 9.262 -1.424 -2.547 1.00 . B B . 1 PHE N 1 1 8 5759 2 2 1 PHE O O 10.544 -0.849 0.555 1.00 . B B . 1 PHE O 1 1 8 5760 2 2 2 VAL C C 11.960 1.497 -0.143 1.00 . B B . 2 VAL C 1 1 8 5761 2 2 2 VAL CA C 12.715 0.253 -0.611 1.00 . B B . 2 VAL CA 1 1 8 5762 2 2 2 VAL CB C 13.779 0.653 -1.629 1.00 . B B . 2 VAL CB 1 1 8 5763 2 2 2 VAL CG1 C 14.739 -0.516 -1.857 1.00 . B B . 2 VAL CG1 1 1 8 5764 2 2 2 VAL CG2 C 13.100 1.022 -2.951 1.00 . B B . 2 VAL CG2 1 1 8 5765 2 2 2 VAL H H 11.917 -0.943 -2.193 1.00 . B B . 2 VAL H 1 1 8 5766 2 2 2 VAL HA H 13.183 -0.230 0.233 1.00 . B B . 2 VAL HA 1 1 8 5767 2 2 2 VAL HB H 14.326 1.499 -1.258 1.00 . B B . 2 VAL HB 1 1 8 5768 2 2 2 VAL HG11 H 14.282 -1.234 -2.524 1.00 . B B . 2 VAL HG11 1 1 8 5769 2 2 2 VAL HG12 H 14.960 -0.990 -0.913 1.00 . B B . 2 VAL HG12 1 1 8 5770 2 2 2 VAL HG13 H 15.655 -0.149 -2.298 1.00 . B B . 2 VAL HG13 1 1 8 5771 2 2 2 VAL HG21 H 12.175 1.542 -2.748 1.00 . B B . 2 VAL HG21 1 1 8 5772 2 2 2 VAL HG22 H 12.894 0.123 -3.512 1.00 . B B . 2 VAL HG22 1 1 8 5773 2 2 2 VAL HG23 H 13.754 1.663 -3.525 1.00 . B B . 2 VAL HG23 1 1 8 5774 2 2 2 VAL N N 11.770 -0.684 -1.263 1.00 . B B . 2 VAL N 1 1 8 5775 2 2 2 VAL O O 10.746 1.523 -0.109 1.00 . B B . 2 VAL O 1 1 8 5776 2 2 3 ASN C C 11.912 4.762 -0.496 1.00 . B B . 3 ASN C 1 1 8 5777 2 2 3 ASN CA C 11.996 3.779 0.675 1.00 . B B . 3 ASN CA 1 1 8 5778 2 2 3 ASN CB C 12.789 4.421 1.826 1.00 . B B . 3 ASN CB 1 1 8 5779 2 2 3 ASN CG C 13.887 3.469 2.319 1.00 . B B . 3 ASN CG 1 1 8 5780 2 2 3 ASN H H 13.649 2.490 0.174 1.00 . B B . 3 ASN H 1 1 8 5781 2 2 3 ASN HA H 10.998 3.540 1.014 1.00 . B B . 3 ASN HA 1 1 8 5782 2 2 3 ASN HB2 H 13.242 5.338 1.478 1.00 . B B . 3 ASN HB2 1 1 8 5783 2 2 3 ASN HB3 H 12.118 4.643 2.643 1.00 . B B . 3 ASN HB3 1 1 8 5784 2 2 3 ASN HD21 H 12.911 2.964 3.973 1.00 . B B . 3 ASN HD21 1 1 8 5785 2 2 3 ASN HD22 H 14.423 2.223 3.768 1.00 . B B . 3 ASN HD22 1 1 8 5786 2 2 3 ASN N N 12.671 2.531 0.213 1.00 . B B . 3 ASN N 1 1 8 5787 2 2 3 ASN ND2 N 13.727 2.833 3.447 1.00 . B B . 3 ASN ND2 1 1 8 5788 2 2 3 ASN O O 12.292 5.909 -0.386 1.00 . B B . 3 ASN O 1 1 8 5789 2 2 3 ASN OD1 O 14.900 3.305 1.669 1.00 . B B . 3 ASN OD1 1 1 8 5790 2 2 4 GLN C C 9.875 5.711 -2.961 1.00 . B B . 4 GLN C 1 1 8 5791 2 2 4 GLN CA C 11.317 5.213 -2.806 1.00 . B B . 4 GLN CA 1 1 8 5792 2 2 4 GLN CB C 11.727 4.442 -4.064 1.00 . B B . 4 GLN CB 1 1 8 5793 2 2 4 GLN CD C 13.681 5.966 -4.389 1.00 . B B . 4 GLN CD 1 1 8 5794 2 2 4 GLN CG C 13.248 4.509 -4.231 1.00 . B B . 4 GLN CG 1 1 8 5795 2 2 4 GLN H H 11.126 3.381 -1.688 1.00 . B B . 4 GLN H 1 1 8 5796 2 2 4 GLN HA H 11.976 6.057 -2.674 1.00 . B B . 4 GLN HA 1 1 8 5797 2 2 4 GLN HB2 H 11.419 3.410 -3.971 1.00 . B B . 4 GLN HB2 1 1 8 5798 2 2 4 GLN HB3 H 11.253 4.882 -4.928 1.00 . B B . 4 GLN HB3 1 1 8 5799 2 2 4 GLN HE21 H 15.615 5.559 -4.196 1.00 . B B . 4 GLN HE21 1 1 8 5800 2 2 4 GLN HE22 H 15.240 7.196 -4.437 1.00 . B B . 4 GLN HE22 1 1 8 5801 2 2 4 GLN HG2 H 13.723 4.084 -3.359 1.00 . B B . 4 GLN HG2 1 1 8 5802 2 2 4 GLN HG3 H 13.539 3.951 -5.108 1.00 . B B . 4 GLN HG3 1 1 8 5803 2 2 4 GLN N N 11.422 4.312 -1.621 1.00 . B B . 4 GLN N 1 1 8 5804 2 2 4 GLN NE2 N 14.951 6.265 -4.337 1.00 . B B . 4 GLN NE2 1 1 8 5805 2 2 4 GLN O O 9.048 5.542 -2.084 1.00 . B B . 4 GLN O 1 1 8 5806 2 2 4 GLN OE1 O 12.858 6.842 -4.563 1.00 . B B . 4 GLN OE1 1 1 8 5807 2 2 5 HIS C C 7.410 5.812 -5.141 1.00 . B B . 5 HIS C 1 1 8 5808 2 2 5 HIS CA C 8.188 6.829 -4.303 1.00 . B B . 5 HIS CA 1 1 8 5809 2 2 5 HIS CB C 8.249 8.163 -5.053 1.00 . B B . 5 HIS CB 1 1 8 5810 2 2 5 HIS CD2 C 9.762 9.931 -3.861 1.00 . B B . 5 HIS CD2 1 1 8 5811 2 2 5 HIS CE1 C 8.259 10.747 -2.522 1.00 . B B . 5 HIS CE1 1 1 8 5812 2 2 5 HIS CG C 8.589 9.266 -4.090 1.00 . B B . 5 HIS CG 1 1 8 5813 2 2 5 HIS H H 10.253 6.443 -4.768 1.00 . B B . 5 HIS H 1 1 8 5814 2 2 5 HIS HA H 7.693 6.969 -3.354 1.00 . B B . 5 HIS HA 1 1 8 5815 2 2 5 HIS HB2 H 9.006 8.110 -5.820 1.00 . B B . 5 HIS HB2 1 1 8 5816 2 2 5 HIS HB3 H 7.290 8.364 -5.507 1.00 . B B . 5 HIS HB3 1 1 8 5817 2 2 5 HIS HD2 H 10.697 9.754 -4.374 1.00 . B B . 5 HIS HD2 1 1 8 5818 2 2 5 HIS HE1 H 7.775 11.344 -1.763 1.00 . B B . 5 HIS HE1 1 1 8 5819 2 2 5 HIS HE2 H 10.215 11.489 -2.497 1.00 . B B . 5 HIS HE2 1 1 8 5820 2 2 5 HIS N N 9.571 6.321 -4.077 1.00 . B B . 5 HIS N 1 1 8 5821 2 2 5 HIS ND1 N 7.644 9.792 -3.236 1.00 . B B . 5 HIS ND1 1 1 8 5822 2 2 5 HIS NE2 N 9.556 10.868 -2.870 1.00 . B B . 5 HIS NE2 1 1 8 5823 2 2 5 HIS O O 7.866 5.370 -6.177 1.00 . B B . 5 HIS O 1 1 8 5824 2 2 6 LEU C C 4.352 5.194 -6.257 1.00 . B B . 6 LEU C 1 1 8 5825 2 2 6 LEU CA C 5.434 4.455 -5.477 1.00 . B B . 6 LEU CA 1 1 8 5826 2 2 6 LEU CB C 4.789 3.455 -4.518 1.00 . B B . 6 LEU CB 1 1 8 5827 2 2 6 LEU CD1 C 5.345 2.381 -2.332 1.00 . B B . 6 LEU CD1 1 1 8 5828 2 2 6 LEU CD2 C 6.277 1.453 -4.456 1.00 . B B . 6 LEU CD2 1 1 8 5829 2 2 6 LEU CG C 5.877 2.735 -3.721 1.00 . B B . 6 LEU CG 1 1 8 5830 2 2 6 LEU H H 5.885 5.811 -3.872 1.00 . B B . 6 LEU H 1 1 8 5831 2 2 6 LEU HA H 6.073 3.928 -6.168 1.00 . B B . 6 LEU HA 1 1 8 5832 2 2 6 LEU HB2 H 4.129 3.978 -3.840 1.00 . B B . 6 LEU HB2 1 1 8 5833 2 2 6 LEU HB3 H 4.225 2.731 -5.083 1.00 . B B . 6 LEU HB3 1 1 8 5834 2 2 6 LEU HD11 H 4.386 2.853 -2.184 1.00 . B B . 6 LEU HD11 1 1 8 5835 2 2 6 LEU HD12 H 6.038 2.729 -1.581 1.00 . B B . 6 LEU HD12 1 1 8 5836 2 2 6 LEU HD13 H 5.234 1.309 -2.251 1.00 . B B . 6 LEU HD13 1 1 8 5837 2 2 6 LEU HD21 H 6.485 0.675 -3.736 1.00 . B B . 6 LEU HD21 1 1 8 5838 2 2 6 LEU HD22 H 7.158 1.639 -5.050 1.00 . B B . 6 LEU HD22 1 1 8 5839 2 2 6 LEU HD23 H 5.467 1.141 -5.099 1.00 . B B . 6 LEU HD23 1 1 8 5840 2 2 6 LEU HG H 6.739 3.380 -3.623 1.00 . B B . 6 LEU HG 1 1 8 5841 2 2 6 LEU N N 6.240 5.438 -4.705 1.00 . B B . 6 LEU N 1 1 8 5842 2 2 6 LEU O O 3.527 5.883 -5.690 1.00 . B B . 6 LEU O 1 1 8 5843 2 2 7 CYS C C 2.650 4.786 -9.321 1.00 . B B . 7 CYS C 1 1 8 5844 2 2 7 CYS CA C 3.316 5.770 -8.352 1.00 . B B . 7 CYS CA 1 1 8 5845 2 2 7 CYS CB C 3.970 6.906 -9.144 1.00 . B B . 7 CYS CB 1 1 8 5846 2 2 7 CYS H H 5.023 4.509 -7.994 1.00 . B B . 7 CYS H 1 1 8 5847 2 2 7 CYS HA H 2.572 6.177 -7.685 1.00 . B B . 7 CYS HA 1 1 8 5848 2 2 7 CYS HB2 H 4.994 6.646 -9.365 1.00 . B B . 7 CYS HB2 1 1 8 5849 2 2 7 CYS HB3 H 3.430 7.058 -10.068 1.00 . B B . 7 CYS HB3 1 1 8 5850 2 2 7 CYS N N 4.349 5.065 -7.551 1.00 . B B . 7 CYS N 1 1 8 5851 2 2 7 CYS O O 3.309 4.125 -10.101 1.00 . B B . 7 CYS O 1 1 8 5852 2 2 7 CYS SG S 3.935 8.434 -8.169 1.00 . B B . 7 CYS SG 1 1 8 5853 2 2 8 GLY C C 1.397 2.529 -10.514 1.00 . B B . 8 GLY C 1 1 8 5854 2 2 8 GLY CA C 0.589 3.789 -10.190 1.00 . B B . 8 GLY CA 1 1 8 5855 2 2 8 GLY H H 0.852 5.261 -8.640 1.00 . B B . 8 GLY H 1 1 8 5856 2 2 8 GLY HA2 H -0.338 3.502 -9.714 1.00 . B B . 8 GLY HA2 1 1 8 5857 2 2 8 GLY HA3 H 0.367 4.311 -11.109 1.00 . B B . 8 GLY HA3 1 1 8 5858 2 2 8 GLY N N 1.345 4.704 -9.277 1.00 . B B . 8 GLY N 1 1 8 5859 2 2 8 GLY O O 1.526 1.635 -9.701 1.00 . B B . 8 GLY O 1 1 8 5860 2 2 9 SER C C 3.565 0.751 -10.955 1.00 . B B . 9 SER C 1 1 8 5861 2 2 9 SER CA C 2.714 1.253 -12.121 1.00 . B B . 9 SER CA 1 1 8 5862 2 2 9 SER CB C 3.628 1.627 -13.288 1.00 . B B . 9 SER CB 1 1 8 5863 2 2 9 SER H H 1.791 3.185 -12.344 1.00 . B B . 9 SER H 1 1 8 5864 2 2 9 SER HA H 2.039 0.469 -12.434 1.00 . B B . 9 SER HA 1 1 8 5865 2 2 9 SER HB2 H 4.091 0.739 -13.685 1.00 . B B . 9 SER HB2 1 1 8 5866 2 2 9 SER HB3 H 3.043 2.102 -14.064 1.00 . B B . 9 SER HB3 1 1 8 5867 2 2 9 SER HG H 5.220 2.710 -13.566 1.00 . B B . 9 SER HG 1 1 8 5868 2 2 9 SER N N 1.925 2.452 -11.709 1.00 . B B . 9 SER N 1 1 8 5869 2 2 9 SER O O 3.274 -0.266 -10.356 1.00 . B B . 9 SER O 1 1 8 5870 2 2 9 SER OG O 4.638 2.515 -12.828 1.00 . B B . 9 SER OG 1 1 8 5871 2 2 10 ASP C C 4.595 0.670 -8.313 1.00 . B B . 10 ASP C 1 1 8 5872 2 2 10 ASP CA C 5.477 1.007 -9.503 1.00 . B B . 10 ASP CA 1 1 8 5873 2 2 10 ASP CB C 6.429 2.137 -9.113 1.00 . B B . 10 ASP CB 1 1 8 5874 2 2 10 ASP CG C 7.293 2.517 -10.316 1.00 . B B . 10 ASP CG 1 1 8 5875 2 2 10 ASP H H 4.830 2.267 -11.119 1.00 . B B . 10 ASP H 1 1 8 5876 2 2 10 ASP HA H 6.041 0.135 -9.797 1.00 . B B . 10 ASP HA 1 1 8 5877 2 2 10 ASP HB2 H 5.850 2.995 -8.793 1.00 . B B . 10 ASP HB2 1 1 8 5878 2 2 10 ASP HB3 H 7.064 1.810 -8.305 1.00 . B B . 10 ASP HB3 1 1 8 5879 2 2 10 ASP N N 4.613 1.451 -10.628 1.00 . B B . 10 ASP N 1 1 8 5880 2 2 10 ASP O O 4.776 -0.329 -7.647 1.00 . B B . 10 ASP O 1 1 8 5881 2 2 10 ASP OD1 O 7.584 1.640 -11.112 1.00 . B B . 10 ASP OD1 1 1 8 5882 2 2 10 ASP OD2 O 7.651 3.679 -10.421 1.00 . B B . 10 ASP OD2 1 1 8 5883 2 2 11 LEU C C 2.279 -0.218 -6.960 1.00 . B B . 11 LEU C 1 1 8 5884 2 2 11 LEU CA C 2.726 1.239 -6.901 1.00 . B B . 11 LEU CA 1 1 8 5885 2 2 11 LEU CB C 1.509 2.158 -7.022 1.00 . B B . 11 LEU CB 1 1 8 5886 2 2 11 LEU CD1 C 1.754 2.279 -4.483 1.00 . B B . 11 LEU CD1 1 1 8 5887 2 2 11 LEU CD2 C 0.174 3.766 -5.681 1.00 . B B . 11 LEU CD2 1 1 8 5888 2 2 11 LEU CG C 0.792 2.372 -5.673 1.00 . B B . 11 LEU CG 1 1 8 5889 2 2 11 LEU H H 3.507 2.300 -8.602 1.00 . B B . 11 LEU H 1 1 8 5890 2 2 11 LEU HA H 3.255 1.426 -5.988 1.00 . B B . 11 LEU HA 1 1 8 5891 2 2 11 LEU HB2 H 1.831 3.113 -7.404 1.00 . B B . 11 LEU HB2 1 1 8 5892 2 2 11 LEU HB3 H 0.813 1.717 -7.722 1.00 . B B . 11 LEU HB3 1 1 8 5893 2 2 11 LEU HD11 H 1.196 2.406 -3.565 1.00 . B B . 11 LEU HD11 1 1 8 5894 2 2 11 LEU HD12 H 2.494 3.058 -4.559 1.00 . B B . 11 LEU HD12 1 1 8 5895 2 2 11 LEU HD13 H 2.236 1.315 -4.477 1.00 . B B . 11 LEU HD13 1 1 8 5896 2 2 11 LEU HD21 H -0.500 3.855 -6.519 1.00 . B B . 11 LEU HD21 1 1 8 5897 2 2 11 LEU HD22 H 0.960 4.502 -5.771 1.00 . B B . 11 LEU HD22 1 1 8 5898 2 2 11 LEU HD23 H -0.366 3.925 -4.761 1.00 . B B . 11 LEU HD23 1 1 8 5899 2 2 11 LEU HG H 0.010 1.636 -5.561 1.00 . B B . 11 LEU HG 1 1 8 5900 2 2 11 LEU N N 3.633 1.501 -8.046 1.00 . B B . 11 LEU N 1 1 8 5901 2 2 11 LEU O O 2.418 -0.963 -6.010 1.00 . B B . 11 LEU O 1 1 8 5902 2 2 12 ALA C C 2.545 -2.938 -8.312 1.00 . B B . 12 ALA C 1 1 8 5903 2 2 12 ALA CA C 1.313 -2.044 -8.216 1.00 . B B . 12 ALA CA 1 1 8 5904 2 2 12 ALA CB C 0.473 -2.199 -9.483 1.00 . B B . 12 ALA CB 1 1 8 5905 2 2 12 ALA H H 1.665 -0.016 -8.835 1.00 . B B . 12 ALA H 1 1 8 5906 2 2 12 ALA HA H 0.725 -2.328 -7.354 1.00 . B B . 12 ALA HA 1 1 8 5907 2 2 12 ALA HB1 H -0.563 -1.999 -9.255 1.00 . B B . 12 ALA HB1 1 1 8 5908 2 2 12 ALA HB2 H 0.572 -3.208 -9.858 1.00 . B B . 12 ALA HB2 1 1 8 5909 2 2 12 ALA HB3 H 0.819 -1.502 -10.232 1.00 . B B . 12 ALA HB3 1 1 8 5910 2 2 12 ALA N N 1.757 -0.632 -8.079 1.00 . B B . 12 ALA N 1 1 8 5911 2 2 12 ALA O O 2.722 -3.843 -7.528 1.00 . B B . 12 ALA O 1 1 8 5912 2 2 13 GLU C C 5.273 -3.677 -8.018 1.00 . B B . 13 GLU C 1 1 8 5913 2 2 13 GLU CA C 4.626 -3.527 -9.392 1.00 . B B . 13 GLU CA 1 1 8 5914 2 2 13 GLU CB C 5.611 -2.863 -10.357 1.00 . B B . 13 GLU CB 1 1 8 5915 2 2 13 GLU CD C 6.708 -3.155 -12.584 1.00 . B B . 13 GLU CD 1 1 8 5916 2 2 13 GLU CG C 5.490 -3.519 -11.734 1.00 . B B . 13 GLU CG 1 1 8 5917 2 2 13 GLU H H 3.255 -1.941 -9.882 1.00 . B B . 13 GLU H 1 1 8 5918 2 2 13 GLU HA H 4.353 -4.504 -9.768 1.00 . B B . 13 GLU HA 1 1 8 5919 2 2 13 GLU HB2 H 5.383 -1.811 -10.436 1.00 . B B . 13 GLU HB2 1 1 8 5920 2 2 13 GLU HB3 H 6.617 -2.989 -9.989 1.00 . B B . 13 GLU HB3 1 1 8 5921 2 2 13 GLU HG2 H 5.439 -4.592 -11.618 1.00 . B B . 13 GLU HG2 1 1 8 5922 2 2 13 GLU HG3 H 4.594 -3.166 -12.223 1.00 . B B . 13 GLU HG3 1 1 8 5923 2 2 13 GLU N N 3.406 -2.686 -9.262 1.00 . B B . 13 GLU N 1 1 8 5924 2 2 13 GLU O O 5.890 -4.681 -7.720 1.00 . B B . 13 GLU O 1 1 8 5925 2 2 13 GLU OE1 O 7.607 -2.521 -12.055 1.00 . B B . 13 GLU OE1 1 1 8 5926 2 2 13 GLU OE2 O 6.724 -3.517 -13.749 1.00 . B B . 13 GLU OE2 1 1 8 5927 2 2 14 ALA C C 4.869 -3.766 -4.984 1.00 . B B . 14 ALA C 1 1 8 5928 2 2 14 ALA CA C 5.723 -2.809 -5.811 1.00 . B B . 14 ALA CA 1 1 8 5929 2 2 14 ALA CB C 5.754 -1.432 -5.142 1.00 . B B . 14 ALA CB 1 1 8 5930 2 2 14 ALA H H 4.610 -1.893 -7.418 1.00 . B B . 14 ALA H 1 1 8 5931 2 2 14 ALA HA H 6.730 -3.200 -5.888 1.00 . B B . 14 ALA HA 1 1 8 5932 2 2 14 ALA HB1 H 6.169 -0.708 -5.828 1.00 . B B . 14 ALA HB1 1 1 8 5933 2 2 14 ALA HB2 H 6.365 -1.478 -4.254 1.00 . B B . 14 ALA HB2 1 1 8 5934 2 2 14 ALA HB3 H 4.750 -1.140 -4.874 1.00 . B B . 14 ALA HB3 1 1 8 5935 2 2 14 ALA N N 5.125 -2.695 -7.168 1.00 . B B . 14 ALA N 1 1 8 5936 2 2 14 ALA O O 5.359 -4.736 -4.442 1.00 . B B . 14 ALA O 1 1 8 5937 2 2 15 LEU C C 2.673 -5.791 -4.825 1.00 . B B . 15 LEU C 1 1 8 5938 2 2 15 LEU CA C 2.712 -4.432 -4.118 1.00 . B B . 15 LEU CA 1 1 8 5939 2 2 15 LEU CB C 1.291 -3.863 -4.066 1.00 . B B . 15 LEU CB 1 1 8 5940 2 2 15 LEU CD1 C -0.057 -1.855 -3.472 1.00 . B B . 15 LEU CD1 1 1 8 5941 2 2 15 LEU CD2 C 1.427 -2.906 -1.768 1.00 . B B . 15 LEU CD2 1 1 8 5942 2 2 15 LEU CG C 1.274 -2.572 -3.251 1.00 . B B . 15 LEU CG 1 1 8 5943 2 2 15 LEU H H 3.207 -2.737 -5.357 1.00 . B B . 15 LEU H 1 1 8 5944 2 2 15 LEU HA H 3.103 -4.541 -3.113 1.00 . B B . 15 LEU HA 1 1 8 5945 2 2 15 LEU HB2 H 0.949 -3.659 -5.070 1.00 . B B . 15 LEU HB2 1 1 8 5946 2 2 15 LEU HB3 H 0.634 -4.586 -3.604 1.00 . B B . 15 LEU HB3 1 1 8 5947 2 2 15 LEU HD11 H 0.033 -0.823 -3.167 1.00 . B B . 15 LEU HD11 1 1 8 5948 2 2 15 LEU HD12 H -0.827 -2.337 -2.886 1.00 . B B . 15 LEU HD12 1 1 8 5949 2 2 15 LEU HD13 H -0.322 -1.900 -4.518 1.00 . B B . 15 LEU HD13 1 1 8 5950 2 2 15 LEU HD21 H 0.523 -3.376 -1.411 1.00 . B B . 15 LEU HD21 1 1 8 5951 2 2 15 LEU HD22 H 1.605 -1.998 -1.212 1.00 . B B . 15 LEU HD22 1 1 8 5952 2 2 15 LEU HD23 H 2.261 -3.580 -1.636 1.00 . B B . 15 LEU HD23 1 1 8 5953 2 2 15 LEU HG H 2.086 -1.934 -3.568 1.00 . B B . 15 LEU HG 1 1 8 5954 2 2 15 LEU N N 3.589 -3.516 -4.898 1.00 . B B . 15 LEU N 1 1 8 5955 2 2 15 LEU O O 2.458 -6.821 -4.219 1.00 . B B . 15 LEU O 1 1 8 5956 2 2 16 TYR C C 3.998 -7.950 -6.515 1.00 . B B . 16 TYR C 1 1 8 5957 2 2 16 TYR CA C 2.837 -7.045 -6.911 1.00 . B B . 16 TYR CA 1 1 8 5958 2 2 16 TYR CB C 2.986 -6.700 -8.396 1.00 . B B . 16 TYR CB 1 1 8 5959 2 2 16 TYR CD1 C 1.956 -8.777 -9.372 1.00 . B B . 16 TYR CD1 1 1 8 5960 2 2 16 TYR CD2 C 0.861 -6.641 -9.725 1.00 . B B . 16 TYR CD2 1 1 8 5961 2 2 16 TYR CE1 C 0.948 -9.416 -10.105 1.00 . B B . 16 TYR CE1 1 1 8 5962 2 2 16 TYR CE2 C -0.148 -7.277 -10.460 1.00 . B B . 16 TYR CE2 1 1 8 5963 2 2 16 TYR CG C 1.908 -7.390 -9.184 1.00 . B B . 16 TYR CG 1 1 8 5964 2 2 16 TYR CZ C -0.105 -8.665 -10.649 1.00 . B B . 16 TYR CZ 1 1 8 5965 2 2 16 TYR H H 3.029 -4.929 -6.574 1.00 . B B . 16 TYR H 1 1 8 5966 2 2 16 TYR HA H 1.901 -7.557 -6.751 1.00 . B B . 16 TYR HA 1 1 8 5967 2 2 16 TYR HB2 H 2.906 -5.634 -8.532 1.00 . B B . 16 TYR HB2 1 1 8 5968 2 2 16 TYR HB3 H 3.950 -7.028 -8.746 1.00 . B B . 16 TYR HB3 1 1 8 5969 2 2 16 TYR HD1 H 2.772 -9.352 -8.951 1.00 . B B . 16 TYR HD1 1 1 8 5970 2 2 16 TYR HD2 H 0.835 -5.572 -9.576 1.00 . B B . 16 TYR HD2 1 1 8 5971 2 2 16 TYR HE1 H 0.982 -10.485 -10.252 1.00 . B B . 16 TYR HE1 1 1 8 5972 2 2 16 TYR HE2 H -0.958 -6.698 -10.878 1.00 . B B . 16 TYR HE2 1 1 8 5973 2 2 16 TYR HH H -1.822 -8.672 -11.483 1.00 . B B . 16 TYR HH 1 1 8 5974 2 2 16 TYR N N 2.868 -5.782 -6.117 1.00 . B B . 16 TYR N 1 1 8 5975 2 2 16 TYR O O 3.878 -9.158 -6.478 1.00 . B B . 16 TYR O 1 1 8 5976 2 2 16 TYR OH O -1.099 -9.293 -11.371 1.00 . B B . 16 TYR OH 1 1 8 5977 2 2 17 LEU C C 6.333 -8.460 -4.398 1.00 . B B . 17 LEU C 1 1 8 5978 2 2 17 LEU CA C 6.320 -8.167 -5.902 1.00 . B B . 17 LEU CA 1 1 8 5979 2 2 17 LEU CB C 7.530 -7.343 -6.310 1.00 . B B . 17 LEU CB 1 1 8 5980 2 2 17 LEU CD1 C 8.723 -9.548 -5.966 1.00 . B B . 17 LEU CD1 1 1 8 5981 2 2 17 LEU CD2 C 9.917 -7.562 -6.861 1.00 . B B . 17 LEU CD2 1 1 8 5982 2 2 17 LEU CG C 8.832 -8.017 -5.899 1.00 . B B . 17 LEU CG 1 1 8 5983 2 2 17 LEU H H 5.203 -6.397 -6.318 1.00 . B B . 17 LEU H 1 1 8 5984 2 2 17 LEU HA H 6.319 -9.089 -6.452 1.00 . B B . 17 LEU HA 1 1 8 5985 2 2 17 LEU HB2 H 7.524 -7.215 -7.382 1.00 . B B . 17 LEU HB2 1 1 8 5986 2 2 17 LEU HB3 H 7.468 -6.375 -5.839 1.00 . B B . 17 LEU HB3 1 1 8 5987 2 2 17 LEU HD11 H 9.660 -9.955 -6.315 1.00 . B B . 17 LEU HD11 1 1 8 5988 2 2 17 LEU HD12 H 7.937 -9.827 -6.648 1.00 . B B . 17 LEU HD12 1 1 8 5989 2 2 17 LEU HD13 H 8.509 -9.938 -4.984 1.00 . B B . 17 LEU HD13 1 1 8 5990 2 2 17 LEU HD21 H 10.697 -7.063 -6.314 1.00 . B B . 17 LEU HD21 1 1 8 5991 2 2 17 LEU HD22 H 9.486 -6.880 -7.582 1.00 . B B . 17 LEU HD22 1 1 8 5992 2 2 17 LEU HD23 H 10.320 -8.420 -7.376 1.00 . B B . 17 LEU HD23 1 1 8 5993 2 2 17 LEU HG H 9.080 -7.709 -4.901 1.00 . B B . 17 LEU HG 1 1 8 5994 2 2 17 LEU N N 5.127 -7.371 -6.256 1.00 . B B . 17 LEU N 1 1 8 5995 2 2 17 LEU O O 6.787 -9.498 -3.961 1.00 . B B . 17 LEU O 1 1 8 5996 2 2 18 VAL C C 4.791 -8.894 -1.811 1.00 . B B . 18 VAL C 1 1 8 5997 2 2 18 VAL CA C 5.814 -7.805 -2.130 1.00 . B B . 18 VAL CA 1 1 8 5998 2 2 18 VAL CB C 5.441 -6.510 -1.399 1.00 . B B . 18 VAL CB 1 1 8 5999 2 2 18 VAL CG1 C 6.140 -5.336 -2.071 1.00 . B B . 18 VAL CG1 1 1 8 6000 2 2 18 VAL CG2 C 3.927 -6.287 -1.457 1.00 . B B . 18 VAL CG2 1 1 8 6001 2 2 18 VAL H H 5.460 -6.732 -3.966 1.00 . B B . 18 VAL H 1 1 8 6002 2 2 18 VAL HA H 6.794 -8.129 -1.810 1.00 . B B . 18 VAL HA 1 1 8 6003 2 2 18 VAL HB H 5.759 -6.573 -0.369 1.00 . B B . 18 VAL HB 1 1 8 6004 2 2 18 VAL HG11 H 5.402 -4.602 -2.358 1.00 . B B . 18 VAL HG11 1 1 8 6005 2 2 18 VAL HG12 H 6.666 -5.683 -2.947 1.00 . B B . 18 VAL HG12 1 1 8 6006 2 2 18 VAL HG13 H 6.840 -4.895 -1.381 1.00 . B B . 18 VAL HG13 1 1 8 6007 2 2 18 VAL HG21 H 3.431 -7.032 -0.854 1.00 . B B . 18 VAL HG21 1 1 8 6008 2 2 18 VAL HG22 H 3.590 -6.368 -2.479 1.00 . B B . 18 VAL HG22 1 1 8 6009 2 2 18 VAL HG23 H 3.694 -5.303 -1.077 1.00 . B B . 18 VAL HG23 1 1 8 6010 2 2 18 VAL N N 5.831 -7.562 -3.601 1.00 . B B . 18 VAL N 1 1 8 6011 2 2 18 VAL O O 5.024 -9.761 -0.993 1.00 . B B . 18 VAL O 1 1 8 6012 2 2 19 CYS C C 2.700 -10.965 -3.271 1.00 . B B . 19 CYS C 1 1 8 6013 2 2 19 CYS CA C 2.622 -9.882 -2.189 1.00 . B B . 19 CYS CA 1 1 8 6014 2 2 19 CYS CB C 1.238 -9.229 -2.201 1.00 . B B . 19 CYS CB 1 1 8 6015 2 2 19 CYS H H 3.491 -8.144 -3.110 1.00 . B B . 19 CYS H 1 1 8 6016 2 2 19 CYS HA H 2.805 -10.323 -1.222 1.00 . B B . 19 CYS HA 1 1 8 6017 2 2 19 CYS HB2 H 1.302 -8.260 -2.670 1.00 . B B . 19 CYS HB2 1 1 8 6018 2 2 19 CYS HB3 H 0.550 -9.851 -2.753 1.00 . B B . 19 CYS HB3 1 1 8 6019 2 2 19 CYS N N 3.659 -8.852 -2.454 1.00 . B B . 19 CYS N 1 1 8 6020 2 2 19 CYS O O 2.983 -12.113 -2.994 1.00 . B B . 19 CYS O 1 1 8 6021 2 2 19 CYS SG S 0.650 -9.039 -0.498 1.00 . B B . 19 CYS SG 1 1 8 6022 2 2 20 GLY C C 1.339 -12.568 -5.510 1.00 . B B . 20 GLY C 1 1 8 6023 2 2 20 GLY CA C 2.529 -11.611 -5.602 1.00 . B B . 20 GLY CA 1 1 8 6024 2 2 20 GLY H H 2.239 -9.672 -4.706 1.00 . B B . 20 GLY H 1 1 8 6025 2 2 20 GLY HA2 H 2.509 -11.102 -6.555 1.00 . B B . 20 GLY HA2 1 1 8 6026 2 2 20 GLY HA3 H 3.446 -12.175 -5.513 1.00 . B B . 20 GLY HA3 1 1 8 6027 2 2 20 GLY N N 2.459 -10.605 -4.503 1.00 . B B . 20 GLY N 1 1 8 6028 2 2 20 GLY O O 1.222 -13.339 -4.579 1.00 . B B . 20 GLY O 1 1 8 6029 2 2 21 GLU C C -1.286 -13.555 -5.049 1.00 . B B . 21 GLU C 1 1 8 6030 2 2 21 GLU CA C -0.731 -13.423 -6.466 1.00 . B B . 21 GLU CA 1 1 8 6031 2 2 21 GLU CB C -0.333 -14.804 -6.991 1.00 . B B . 21 GLU CB 1 1 8 6032 2 2 21 GLU CD C 1.221 -16.735 -6.670 1.00 . B B . 21 GLU CD 1 1 8 6033 2 2 21 GLU CG C 0.909 -15.299 -6.246 1.00 . B B . 21 GLU CG 1 1 8 6034 2 2 21 GLU H H 0.584 -11.889 -7.213 1.00 . B B . 21 GLU H 1 1 8 6035 2 2 21 GLU HA H -1.496 -13.005 -7.103 1.00 . B B . 21 GLU HA 1 1 8 6036 2 2 21 GLU HB2 H -1.147 -15.495 -6.833 1.00 . B B . 21 GLU HB2 1 1 8 6037 2 2 21 GLU HB3 H -0.114 -14.737 -8.046 1.00 . B B . 21 GLU HB3 1 1 8 6038 2 2 21 GLU HG2 H 1.749 -14.662 -6.485 1.00 . B B . 21 GLU HG2 1 1 8 6039 2 2 21 GLU HG3 H 0.727 -15.273 -5.183 1.00 . B B . 21 GLU HG3 1 1 8 6040 2 2 21 GLU N N 0.459 -12.521 -6.475 1.00 . B B . 21 GLU N 1 1 8 6041 2 2 21 GLU O O -1.886 -14.551 -4.697 1.00 . B B . 21 GLU O 1 1 8 6042 2 2 21 GLU OE1 O 0.439 -17.612 -6.341 1.00 . B B . 21 GLU OE1 1 1 8 6043 2 2 21 GLU OE2 O 2.236 -16.936 -7.317 1.00 . B B . 21 GLU OE2 1 1 8 6044 2 2 22 ARG C C -2.878 -11.721 -2.770 1.00 . B B . 22 ARG C 1 1 8 6045 2 2 22 ARG CA C -1.637 -12.609 -2.855 1.00 . B B . 22 ARG CA 1 1 8 6046 2 2 22 ARG CB C -0.574 -12.101 -1.883 1.00 . B B . 22 ARG CB 1 1 8 6047 2 2 22 ARG CD C 1.483 -13.193 -0.967 1.00 . B B . 22 ARG CD 1 1 8 6048 2 2 22 ARG CG C -0.041 -13.275 -1.057 1.00 . B B . 22 ARG CG 1 1 8 6049 2 2 22 ARG CZ C 2.959 -13.517 0.928 1.00 . B B . 22 ARG CZ 1 1 8 6050 2 2 22 ARG H H -0.630 -11.756 -4.552 1.00 . B B . 22 ARG H 1 1 8 6051 2 2 22 ARG HA H -1.901 -13.626 -2.607 1.00 . B B . 22 ARG HA 1 1 8 6052 2 2 22 ARG HB2 H 0.232 -11.654 -2.444 1.00 . B B . 22 ARG HB2 1 1 8 6053 2 2 22 ARG HB3 H -1.009 -11.366 -1.223 1.00 . B B . 22 ARG HB3 1 1 8 6054 2 2 22 ARG HD2 H 1.921 -13.621 -1.857 1.00 . B B . 22 ARG HD2 1 1 8 6055 2 2 22 ARG HD3 H 1.785 -12.160 -0.878 1.00 . B B . 22 ARG HD3 1 1 8 6056 2 2 22 ARG HE H 1.489 -14.777 0.493 1.00 . B B . 22 ARG HE 1 1 8 6057 2 2 22 ARG HG2 H -0.463 -13.235 -0.063 1.00 . B B . 22 ARG HG2 1 1 8 6058 2 2 22 ARG HG3 H -0.322 -14.204 -1.530 1.00 . B B . 22 ARG HG3 1 1 8 6059 2 2 22 ARG HH11 H 2.164 -11.706 1.234 1.00 . B B . 22 ARG HH11 1 1 8 6060 2 2 22 ARG HH12 H 3.723 -11.969 1.941 1.00 . B B . 22 ARG HH12 1 1 8 6061 2 2 22 ARG HH21 H 3.989 -15.229 0.789 1.00 . B B . 22 ARG HH21 1 1 8 6062 2 2 22 ARG HH22 H 4.758 -13.964 1.689 1.00 . B B . 22 ARG HH22 1 1 8 6063 2 2 22 ARG N N -1.105 -12.552 -4.242 1.00 . B B . 22 ARG N 1 1 8 6064 2 2 22 ARG NE N 1.947 -13.952 0.229 1.00 . B B . 22 ARG NE 1 1 8 6065 2 2 22 ARG NH1 N 2.948 -12.303 1.405 1.00 . B B . 22 ARG NH1 1 1 8 6066 2 2 22 ARG NH2 N 3.982 -14.298 1.152 1.00 . B B . 22 ARG NH2 1 1 8 6067 2 2 22 ARG O O -3.642 -11.785 -1.829 1.00 . B B . 22 ARG O 1 1 8 6068 2 2 23 GLY C C -3.999 -8.748 -2.937 1.00 . B B . 23 GLY C 1 1 8 6069 2 2 23 GLY CA C -4.281 -10.007 -3.760 1.00 . B B . 23 GLY CA 1 1 8 6070 2 2 23 GLY H H -2.454 -10.873 -4.514 1.00 . B B . 23 GLY H 1 1 8 6071 2 2 23 GLY HA2 H -4.518 -9.725 -4.777 1.00 . B B . 23 GLY HA2 1 1 8 6072 2 2 23 GLY HA3 H -5.118 -10.533 -3.329 1.00 . B B . 23 GLY HA3 1 1 8 6073 2 2 23 GLY N N -3.085 -10.898 -3.762 1.00 . B B . 23 GLY N 1 1 8 6074 2 2 23 GLY O O -4.308 -8.681 -1.763 1.00 . B B . 23 GLY O 1 1 8 6075 2 2 24 PHE C C -4.118 -5.402 -3.234 1.00 . B B . 24 PHE C 1 1 8 6076 2 2 24 PHE CA C -3.140 -6.487 -2.788 1.00 . B B . 24 PHE CA 1 1 8 6077 2 2 24 PHE CB C -1.706 -6.030 -3.057 1.00 . B B . 24 PHE CB 1 1 8 6078 2 2 24 PHE CD1 C -1.881 -4.731 -5.211 1.00 . B B . 24 PHE CD1 1 1 8 6079 2 2 24 PHE CD2 C -0.870 -6.937 -5.253 1.00 . B B . 24 PHE CD2 1 1 8 6080 2 2 24 PHE CE1 C -1.664 -4.605 -6.590 1.00 . B B . 24 PHE CE1 1 1 8 6081 2 2 24 PHE CE2 C -0.656 -6.813 -6.631 1.00 . B B . 24 PHE CE2 1 1 8 6082 2 2 24 PHE CG C -1.483 -5.896 -4.544 1.00 . B B . 24 PHE CG 1 1 8 6083 2 2 24 PHE CZ C -1.051 -5.647 -7.300 1.00 . B B . 24 PHE CZ 1 1 8 6084 2 2 24 PHE H H -3.189 -7.809 -4.491 1.00 . B B . 24 PHE H 1 1 8 6085 2 2 24 PHE HA H -3.269 -6.667 -1.734 1.00 . B B . 24 PHE HA 1 1 8 6086 2 2 24 PHE HB2 H -1.538 -5.076 -2.581 1.00 . B B . 24 PHE HB2 1 1 8 6087 2 2 24 PHE HB3 H -1.016 -6.758 -2.656 1.00 . B B . 24 PHE HB3 1 1 8 6088 2 2 24 PHE HD1 H -2.353 -3.929 -4.663 1.00 . B B . 24 PHE HD1 1 1 8 6089 2 2 24 PHE HD2 H -0.565 -7.835 -4.737 1.00 . B B . 24 PHE HD2 1 1 8 6090 2 2 24 PHE HE1 H -1.974 -3.707 -7.105 1.00 . B B . 24 PHE HE1 1 1 8 6091 2 2 24 PHE HE2 H -0.186 -7.616 -7.176 1.00 . B B . 24 PHE HE2 1 1 8 6092 2 2 24 PHE HZ H -0.877 -5.550 -8.362 1.00 . B B . 24 PHE HZ 1 1 8 6093 2 2 24 PHE N N -3.425 -7.742 -3.542 1.00 . B B . 24 PHE N 1 1 8 6094 2 2 24 PHE O O -4.327 -5.185 -4.411 1.00 . B B . 24 PHE O 1 1 8 6095 2 2 25 PHE C C -5.058 -2.282 -2.575 1.00 . B B . 25 PHE C 1 1 8 6096 2 2 25 PHE CA C -5.704 -3.666 -2.678 1.00 . B B . 25 PHE CA 1 1 8 6097 2 2 25 PHE CB C -6.916 -3.732 -1.745 1.00 . B B . 25 PHE CB 1 1 8 6098 2 2 25 PHE CD1 C -6.301 -2.435 0.327 1.00 . B B . 25 PHE CD1 1 1 8 6099 2 2 25 PHE CD2 C -6.170 -4.858 0.385 1.00 . B B . 25 PHE CD2 1 1 8 6100 2 2 25 PHE CE1 C -5.870 -2.378 1.659 1.00 . B B . 25 PHE CE1 1 1 8 6101 2 2 25 PHE CE2 C -5.739 -4.801 1.718 1.00 . B B . 25 PHE CE2 1 1 8 6102 2 2 25 PHE CG C -6.451 -3.674 -0.310 1.00 . B B . 25 PHE CG 1 1 8 6103 2 2 25 PHE CZ C -5.589 -3.561 2.354 1.00 . B B . 25 PHE CZ 1 1 8 6104 2 2 25 PHE H H -4.556 -4.921 -1.358 1.00 . B B . 25 PHE H 1 1 8 6105 2 2 25 PHE HA H -6.028 -3.831 -3.694 1.00 . B B . 25 PHE HA 1 1 8 6106 2 2 25 PHE HB2 H -7.570 -2.897 -1.945 1.00 . B B . 25 PHE HB2 1 1 8 6107 2 2 25 PHE HB3 H -7.449 -4.656 -1.913 1.00 . B B . 25 PHE HB3 1 1 8 6108 2 2 25 PHE HD1 H -6.518 -1.523 -0.209 1.00 . B B . 25 PHE HD1 1 1 8 6109 2 2 25 PHE HD2 H -6.286 -5.814 -0.105 1.00 . B B . 25 PHE HD2 1 1 8 6110 2 2 25 PHE HE1 H -5.755 -1.424 2.148 1.00 . B B . 25 PHE HE1 1 1 8 6111 2 2 25 PHE HE2 H -5.522 -5.713 2.253 1.00 . B B . 25 PHE HE2 1 1 8 6112 2 2 25 PHE HZ H -5.257 -3.519 3.380 1.00 . B B . 25 PHE HZ 1 1 8 6113 2 2 25 PHE N N -4.730 -4.725 -2.302 1.00 . B B . 25 PHE N 1 1 8 6114 2 2 25 PHE O O -4.427 -1.949 -1.592 1.00 . B B . 25 PHE O 1 1 8 6115 2 2 26 TYR C C -5.800 0.902 -3.871 1.00 . B B . 26 TYR C 1 1 8 6116 2 2 26 TYR CA C -4.659 -0.095 -3.559 1.00 . B B . 26 TYR CA 1 1 8 6117 2 2 26 TYR CB C -3.509 -0.007 -4.589 1.00 . B B . 26 TYR CB 1 1 8 6118 2 2 26 TYR CD1 C -4.860 -0.359 -6.683 1.00 . B B . 26 TYR CD1 1 1 8 6119 2 2 26 TYR CD2 C -3.711 1.753 -6.371 1.00 . B B . 26 TYR CD2 1 1 8 6120 2 2 26 TYR CE1 C -5.380 0.101 -7.898 1.00 . B B . 26 TYR CE1 1 1 8 6121 2 2 26 TYR CE2 C -4.223 2.215 -7.589 1.00 . B B . 26 TYR CE2 1 1 8 6122 2 2 26 TYR CG C -4.028 0.466 -5.922 1.00 . B B . 26 TYR CG 1 1 8 6123 2 2 26 TYR CZ C -5.060 1.389 -8.355 1.00 . B B . 26 TYR CZ 1 1 8 6124 2 2 26 TYR H H -5.760 -1.763 -4.354 1.00 . B B . 26 TYR H 1 1 8 6125 2 2 26 TYR HA H -4.272 0.111 -2.571 1.00 . B B . 26 TYR HA 1 1 8 6126 2 2 26 TYR HB2 H -2.762 0.686 -4.232 1.00 . B B . 26 TYR HB2 1 1 8 6127 2 2 26 TYR HB3 H -3.061 -0.983 -4.706 1.00 . B B . 26 TYR HB3 1 1 8 6128 2 2 26 TYR HD1 H -5.102 -1.352 -6.333 1.00 . B B . 26 TYR HD1 1 1 8 6129 2 2 26 TYR HD2 H -3.066 2.388 -5.781 1.00 . B B . 26 TYR HD2 1 1 8 6130 2 2 26 TYR HE1 H -6.027 -0.535 -8.480 1.00 . B B . 26 TYR HE1 1 1 8 6131 2 2 26 TYR HE2 H -3.979 3.208 -7.932 1.00 . B B . 26 TYR HE2 1 1 8 6132 2 2 26 TYR HH H -5.851 2.754 -9.433 1.00 . B B . 26 TYR HH 1 1 8 6133 2 2 26 TYR N N -5.234 -1.470 -3.582 1.00 . B B . 26 TYR N 1 1 8 6134 2 2 26 TYR O O -5.796 1.611 -4.854 1.00 . B B . 26 TYR O 1 1 8 6135 2 2 26 TYR OH O -5.571 1.843 -9.554 1.00 . B B . 26 TYR OH 1 1 8 6136 2 2 27 THR C C -7.486 3.217 -3.764 1.00 . B B . 27 THR C 1 1 8 6137 2 2 27 THR CA C -7.957 1.841 -3.284 1.00 . B B . 27 THR CA 1 1 8 6138 2 2 27 THR CB C -8.749 2.008 -1.991 1.00 . B B . 27 THR CB 1 1 8 6139 2 2 27 THR CG2 C -7.776 2.034 -0.816 1.00 . B B . 27 THR CG2 1 1 8 6140 2 2 27 THR H H -6.804 0.337 -2.260 1.00 . B B . 27 THR H 1 1 8 6141 2 2 27 THR HA H -8.594 1.405 -4.040 1.00 . B B . 27 THR HA 1 1 8 6142 2 2 27 THR HB H -9.431 1.183 -1.875 1.00 . B B . 27 THR HB 1 1 8 6143 2 2 27 THR HG1 H -10.306 3.061 -2.492 1.00 . B B . 27 THR HG1 1 1 8 6144 2 2 27 THR HG21 H -6.855 2.508 -1.125 1.00 . B B . 27 THR HG21 1 1 8 6145 2 2 27 THR HG22 H -7.571 1.023 -0.498 1.00 . B B . 27 THR HG22 1 1 8 6146 2 2 27 THR HG23 H -8.211 2.589 0.000 1.00 . B B . 27 THR HG23 1 1 8 6147 2 2 27 THR N N -6.801 0.930 -3.039 1.00 . B B . 27 THR N 1 1 8 6148 2 2 27 THR O O -6.313 3.525 -3.766 1.00 . B B . 27 THR O 1 1 8 6149 2 2 27 THR OG1 O -9.477 3.228 -2.037 1.00 . B B . 27 THR OG1 1 1 8 6150 2 2 28 LYS C C -7.431 5.290 -6.050 1.00 . B B . 28 LYS C 1 1 8 6151 2 2 28 LYS CA C -8.072 5.406 -4.664 1.00 . B B . 28 LYS CA 1 1 8 6152 2 2 28 LYS CB C -7.102 6.096 -3.700 1.00 . B B . 28 LYS CB 1 1 8 6153 2 2 28 LYS CD C -6.475 8.415 -3.012 1.00 . B B . 28 LYS CD 1 1 8 6154 2 2 28 LYS CE C -7.729 8.644 -2.168 1.00 . B B . 28 LYS CE 1 1 8 6155 2 2 28 LYS CG C -6.815 7.513 -4.199 1.00 . B B . 28 LYS CG 1 1 8 6156 2 2 28 LYS H H -9.355 3.756 -4.150 1.00 . B B . 28 LYS H 1 1 8 6157 2 2 28 LYS HA H -8.977 5.993 -4.741 1.00 . B B . 28 LYS HA 1 1 8 6158 2 2 28 LYS HB2 H -7.543 6.141 -2.716 1.00 . B B . 28 LYS HB2 1 1 8 6159 2 2 28 LYS HB3 H -6.178 5.544 -3.655 1.00 . B B . 28 LYS HB3 1 1 8 6160 2 2 28 LYS HD2 H -5.714 7.941 -2.408 1.00 . B B . 28 LYS HD2 1 1 8 6161 2 2 28 LYS HD3 H -6.108 9.364 -3.374 1.00 . B B . 28 LYS HD3 1 1 8 6162 2 2 28 LYS HE2 H -8.562 8.120 -2.612 1.00 . B B . 28 LYS HE2 1 1 8 6163 2 2 28 LYS HE3 H -7.561 8.275 -1.167 1.00 . B B . 28 LYS HE3 1 1 8 6164 2 2 28 LYS HG2 H -5.982 7.490 -4.885 1.00 . B B . 28 LYS HG2 1 1 8 6165 2 2 28 LYS HG3 H -7.687 7.901 -4.705 1.00 . B B . 28 LYS HG3 1 1 8 6166 2 2 28 LYS HZ1 H -8.760 10.279 -1.396 1.00 . B B . 28 LYS HZ1 1 1 8 6167 2 2 28 LYS HZ2 H -8.374 10.420 -3.045 1.00 . B B . 28 LYS HZ2 1 1 8 6168 2 2 28 LYS HZ3 H -7.168 10.626 -1.867 1.00 . B B . 28 LYS HZ3 1 1 8 6169 2 2 28 LYS N N -8.417 4.042 -4.169 1.00 . B B . 28 LYS N 1 1 8 6170 2 2 28 LYS NZ N -8.030 10.102 -2.115 1.00 . B B . 28 LYS NZ 1 1 8 6171 2 2 28 LYS O O -6.247 5.514 -6.207 1.00 . B B . 28 LYS O 1 1 8 6172 2 2 29 PRO C C -7.661 6.139 -9.091 1.00 . B B . 29 PRO C 1 1 8 6173 2 2 29 PRO CA C -7.799 4.774 -8.412 1.00 . B B . 29 PRO CA 1 1 8 6174 2 2 29 PRO CB C -8.927 3.958 -9.052 1.00 . B B . 29 PRO CB 1 1 8 6175 2 2 29 PRO CD C -9.683 4.670 -6.804 1.00 . B B . 29 PRO CD 1 1 8 6176 2 2 29 PRO CG C -10.183 4.188 -8.178 1.00 . B B . 29 PRO CG 1 1 8 6177 2 2 29 PRO HA H -6.873 4.225 -8.458 1.00 . B B . 29 PRO HA 1 1 8 6178 2 2 29 PRO HB2 H -9.105 4.303 -10.062 1.00 . B B . 29 PRO HB2 1 1 8 6179 2 2 29 PRO HB3 H -8.673 2.910 -9.055 1.00 . B B . 29 PRO HB3 1 1 8 6180 2 2 29 PRO HD2 H -10.199 5.573 -6.510 1.00 . B B . 29 PRO HD2 1 1 8 6181 2 2 29 PRO HD3 H -9.812 3.899 -6.061 1.00 . B B . 29 PRO HD3 1 1 8 6182 2 2 29 PRO HG2 H -10.814 4.941 -8.631 1.00 . B B . 29 PRO HG2 1 1 8 6183 2 2 29 PRO HG3 H -10.730 3.264 -8.063 1.00 . B B . 29 PRO HG3 1 1 8 6184 2 2 29 PRO N N -8.243 4.937 -7.016 1.00 . B B . 29 PRO N 1 1 8 6185 2 2 29 PRO O O -8.211 7.126 -8.644 1.00 . B B . 29 PRO O 1 1 8 6186 2 2 30 THR C C -7.471 7.446 -12.226 1.00 . B B . 30 THR C 1 1 8 6187 2 2 30 THR CA C -6.752 7.501 -10.876 1.00 . B B . 30 THR CA 1 1 8 6188 2 2 30 THR CB C -5.260 7.760 -11.101 1.00 . B B . 30 THR CB 1 1 8 6189 2 2 30 THR CG2 C -4.666 8.427 -9.860 1.00 . B B . 30 THR CG2 1 1 8 6190 2 2 30 THR H H -6.492 5.395 -10.514 1.00 . B B . 30 THR H 1 1 8 6191 2 2 30 THR HA H -7.170 8.296 -10.278 1.00 . B B . 30 THR HA 1 1 8 6192 2 2 30 THR HB H -5.131 8.410 -11.951 1.00 . B B . 30 THR HB 1 1 8 6193 2 2 30 THR HG1 H -4.297 6.180 -10.497 1.00 . B B . 30 THR HG1 1 1 8 6194 2 2 30 THR HG21 H -3.705 7.987 -9.638 1.00 . B B . 30 THR HG21 1 1 8 6195 2 2 30 THR HG22 H -5.330 8.284 -9.020 1.00 . B B . 30 THR HG22 1 1 8 6196 2 2 30 THR HG23 H -4.542 9.484 -10.045 1.00 . B B . 30 THR HG23 1 1 8 6197 2 2 30 THR N N -6.928 6.202 -10.169 1.00 . B B . 30 THR N 1 1 8 6198 2 2 30 THR O O -7.870 6.363 -12.618 1.00 . B B . 30 THR O 1 1 8 6199 2 2 30 THR OXT O -7.610 8.490 -12.844 1.00 . B B . 30 THR OXT 1 1 8 6200 2 2 30 THR OG1 O -4.599 6.525 -11.341 1.00 . B B . 30 THR OG1 1 1 9 6201 1 1 1 GLY C C -3.746 7.390 0.027 1.00 . A A . 1 GLY C 1 1 9 6202 1 1 1 GLY CA C -5.177 7.804 0.112 1.00 . A A . 1 GLY CA 1 1 9 6203 1 1 1 GLY H1 H -4.964 9.882 0.457 1.00 . A A . 1 GLY H1 1 1 9 6204 1 1 1 GLY H2 H -5.375 8.999 1.849 1.00 . A A . 1 GLY H2 1 1 9 6205 1 1 1 GLY H3 H -6.551 9.317 0.665 1.00 . A A . 1 GLY H3 1 1 9 6206 1 1 1 GLY HA2 H -5.255 7.038 0.709 1.00 . A A . 1 GLY HA2 1 1 9 6207 1 1 1 GLY HA3 H -5.869 7.727 -0.825 1.00 . A A . 1 GLY HA3 1 1 9 6208 1 1 1 GLY N N -5.546 9.105 0.828 1.00 . A A . 1 GLY N 1 1 9 6209 1 1 1 GLY O O -2.876 7.999 0.618 1.00 . A A . 1 GLY O 1 1 9 6210 1 1 2 ILE C C -1.564 6.298 -2.249 1.00 . A A . 2 ILE C 1 1 9 6211 1 1 2 ILE CA C -2.057 5.896 -0.861 1.00 . A A . 2 ILE CA 1 1 9 6212 1 1 2 ILE CB C -1.999 4.371 -0.714 1.00 . A A . 2 ILE CB 1 1 9 6213 1 1 2 ILE CD1 C -0.442 2.406 -0.830 1.00 . A A . 2 ILE CD1 1 1 9 6214 1 1 2 ILE CG1 C -0.537 3.915 -0.594 1.00 . A A . 2 ILE CG1 1 1 9 6215 1 1 2 ILE CG2 C -2.641 3.722 -1.941 1.00 . A A . 2 ILE CG2 1 1 9 6216 1 1 2 ILE H H -4.182 5.890 -1.200 1.00 . A A . 2 ILE H 1 1 9 6217 1 1 2 ILE HA H -1.442 6.359 -0.107 1.00 . A A . 2 ILE HA 1 1 9 6218 1 1 2 ILE HB H -2.545 4.077 0.173 1.00 . A A . 2 ILE HB 1 1 9 6219 1 1 2 ILE HD11 H -1.166 1.898 -0.210 1.00 . A A . 2 ILE HD11 1 1 9 6220 1 1 2 ILE HD12 H 0.552 2.064 -0.576 1.00 . A A . 2 ILE HD12 1 1 9 6221 1 1 2 ILE HD13 H -0.642 2.191 -1.869 1.00 . A A . 2 ILE HD13 1 1 9 6222 1 1 2 ILE HG12 H 0.064 4.430 -1.327 1.00 . A A . 2 ILE HG12 1 1 9 6223 1 1 2 ILE HG13 H -0.169 4.142 0.397 1.00 . A A . 2 ILE HG13 1 1 9 6224 1 1 2 ILE HG21 H -3.668 4.046 -2.021 1.00 . A A . 2 ILE HG21 1 1 9 6225 1 1 2 ILE HG22 H -2.608 2.647 -1.838 1.00 . A A . 2 ILE HG22 1 1 9 6226 1 1 2 ILE HG23 H -2.101 4.017 -2.828 1.00 . A A . 2 ILE HG23 1 1 9 6227 1 1 2 ILE N N -3.465 6.357 -0.718 1.00 . A A . 2 ILE N 1 1 9 6228 1 1 2 ILE O O -0.418 6.643 -2.445 1.00 . A A . 2 ILE O 1 1 9 6229 1 1 3 VAL C C -1.497 8.055 -4.626 1.00 . A A . 3 VAL C 1 1 9 6230 1 1 3 VAL CA C -2.057 6.629 -4.597 1.00 . A A . 3 VAL CA 1 1 9 6231 1 1 3 VAL CB C -3.295 6.550 -5.488 1.00 . A A . 3 VAL CB 1 1 9 6232 1 1 3 VAL CG1 C -2.884 6.733 -6.945 1.00 . A A . 3 VAL CG1 1 1 9 6233 1 1 3 VAL CG2 C -3.964 5.185 -5.319 1.00 . A A . 3 VAL CG2 1 1 9 6234 1 1 3 VAL H H -3.358 5.975 -3.019 1.00 . A A . 3 VAL H 1 1 9 6235 1 1 3 VAL HA H -1.309 5.941 -4.962 1.00 . A A . 3 VAL HA 1 1 9 6236 1 1 3 VAL HB H -3.989 7.331 -5.209 1.00 . A A . 3 VAL HB 1 1 9 6237 1 1 3 VAL HG11 H -2.559 7.751 -7.100 1.00 . A A . 3 VAL HG11 1 1 9 6238 1 1 3 VAL HG12 H -3.727 6.520 -7.585 1.00 . A A . 3 VAL HG12 1 1 9 6239 1 1 3 VAL HG13 H -2.074 6.057 -7.174 1.00 . A A . 3 VAL HG13 1 1 9 6240 1 1 3 VAL HG21 H -4.272 4.812 -6.285 1.00 . A A . 3 VAL HG21 1 1 9 6241 1 1 3 VAL HG22 H -4.828 5.284 -4.679 1.00 . A A . 3 VAL HG22 1 1 9 6242 1 1 3 VAL HG23 H -3.264 4.492 -4.874 1.00 . A A . 3 VAL HG23 1 1 9 6243 1 1 3 VAL N N -2.440 6.256 -3.210 1.00 . A A . 3 VAL N 1 1 9 6244 1 1 3 VAL O O -0.681 8.392 -5.460 1.00 . A A . 3 VAL O 1 1 9 6245 1 1 4 GLU C C -0.333 10.451 -2.657 1.00 . A A . 4 GLU C 1 1 9 6246 1 1 4 GLU CA C -1.423 10.302 -3.720 1.00 . A A . 4 GLU CA 1 1 9 6247 1 1 4 GLU CB C -2.574 11.258 -3.399 1.00 . A A . 4 GLU CB 1 1 9 6248 1 1 4 GLU CD C -3.209 13.677 -3.429 1.00 . A A . 4 GLU CD 1 1 9 6249 1 1 4 GLU CG C -2.043 12.692 -3.320 1.00 . A A . 4 GLU CG 1 1 9 6250 1 1 4 GLU H H -2.594 8.613 -3.066 1.00 . A A . 4 GLU H 1 1 9 6251 1 1 4 GLU HA H -1.016 10.544 -4.690 1.00 . A A . 4 GLU HA 1 1 9 6252 1 1 4 GLU HB2 H -3.323 11.193 -4.173 1.00 . A A . 4 GLU HB2 1 1 9 6253 1 1 4 GLU HB3 H -3.010 10.987 -2.449 1.00 . A A . 4 GLU HB3 1 1 9 6254 1 1 4 GLU HG2 H -1.535 12.837 -2.378 1.00 . A A . 4 GLU HG2 1 1 9 6255 1 1 4 GLU HG3 H -1.353 12.865 -4.132 1.00 . A A . 4 GLU HG3 1 1 9 6256 1 1 4 GLU N N -1.931 8.899 -3.729 1.00 . A A . 4 GLU N 1 1 9 6257 1 1 4 GLU O O 0.619 11.188 -2.828 1.00 . A A . 4 GLU O 1 1 9 6258 1 1 4 GLU OE1 O -4.219 13.442 -2.784 1.00 . A A . 4 GLU OE1 1 1 9 6259 1 1 4 GLU OE2 O -3.074 14.647 -4.155 1.00 . A A . 4 GLU OE2 1 1 9 6260 1 1 5 GLN C C 1.811 9.092 -0.865 1.00 . A A . 5 GLN C 1 1 9 6261 1 1 5 GLN CA C 0.554 9.877 -0.479 1.00 . A A . 5 GLN CA 1 1 9 6262 1 1 5 GLN CB C -0.019 9.311 0.822 1.00 . A A . 5 GLN CB 1 1 9 6263 1 1 5 GLN CD C 1.531 9.385 2.779 1.00 . A A . 5 GLN CD 1 1 9 6264 1 1 5 GLN CG C 0.463 10.157 2.002 1.00 . A A . 5 GLN CG 1 1 9 6265 1 1 5 GLN H H -1.248 9.184 -1.437 1.00 . A A . 5 GLN H 1 1 9 6266 1 1 5 GLN HA H 0.811 10.916 -0.333 1.00 . A A . 5 GLN HA 1 1 9 6267 1 1 5 GLN HB2 H -1.099 9.334 0.778 1.00 . A A . 5 GLN HB2 1 1 9 6268 1 1 5 GLN HB3 H 0.316 8.294 0.951 1.00 . A A . 5 GLN HB3 1 1 9 6269 1 1 5 GLN HE21 H 0.251 8.697 4.131 1.00 . A A . 5 GLN HE21 1 1 9 6270 1 1 5 GLN HE22 H 1.863 8.211 4.345 1.00 . A A . 5 GLN HE22 1 1 9 6271 1 1 5 GLN HG2 H 0.882 11.082 1.634 1.00 . A A . 5 GLN HG2 1 1 9 6272 1 1 5 GLN HG3 H -0.370 10.372 2.654 1.00 . A A . 5 GLN HG3 1 1 9 6273 1 1 5 GLN N N -0.469 9.766 -1.557 1.00 . A A . 5 GLN N 1 1 9 6274 1 1 5 GLN NE2 N 1.186 8.708 3.839 1.00 . A A . 5 GLN NE2 1 1 9 6275 1 1 5 GLN O O 2.917 9.582 -0.750 1.00 . A A . 5 GLN O 1 1 9 6276 1 1 5 GLN OE1 O 2.690 9.399 2.416 1.00 . A A . 5 GLN OE1 1 1 9 6277 1 1 6 CYS C C 3.538 7.713 -2.904 1.00 . A A . 6 CYS C 1 1 9 6278 1 1 6 CYS CA C 2.849 7.072 -1.698 1.00 . A A . 6 CYS CA 1 1 9 6279 1 1 6 CYS CB C 2.416 5.651 -2.062 1.00 . A A . 6 CYS CB 1 1 9 6280 1 1 6 CYS H H 0.757 7.496 -1.396 1.00 . A A . 6 CYS H 1 1 9 6281 1 1 6 CYS HA H 3.538 7.036 -0.868 1.00 . A A . 6 CYS HA 1 1 9 6282 1 1 6 CYS HB2 H 1.341 5.605 -2.113 1.00 . A A . 6 CYS HB2 1 1 9 6283 1 1 6 CYS HB3 H 2.832 5.386 -3.023 1.00 . A A . 6 CYS HB3 1 1 9 6284 1 1 6 CYS N N 1.655 7.878 -1.315 1.00 . A A . 6 CYS N 1 1 9 6285 1 1 6 CYS O O 4.745 7.679 -3.029 1.00 . A A . 6 CYS O 1 1 9 6286 1 1 6 CYS SG S 3.005 4.490 -0.806 1.00 . A A . 6 CYS SG 1 1 9 6287 1 1 7 CYS C C 4.017 10.271 -4.601 1.00 . A A . 7 CYS C 1 1 9 6288 1 1 7 CYS CA C 3.403 8.927 -4.992 1.00 . A A . 7 CYS CA 1 1 9 6289 1 1 7 CYS CB C 2.338 9.143 -6.070 1.00 . A A . 7 CYS CB 1 1 9 6290 1 1 7 CYS H H 1.809 8.307 -3.682 1.00 . A A . 7 CYS H 1 1 9 6291 1 1 7 CYS HA H 4.175 8.279 -5.375 1.00 . A A . 7 CYS HA 1 1 9 6292 1 1 7 CYS HB2 H 1.777 8.231 -6.207 1.00 . A A . 7 CYS HB2 1 1 9 6293 1 1 7 CYS HB3 H 1.670 9.933 -5.762 1.00 . A A . 7 CYS HB3 1 1 9 6294 1 1 7 CYS N N 2.782 8.293 -3.795 1.00 . A A . 7 CYS N 1 1 9 6295 1 1 7 CYS O O 5.047 10.665 -5.111 1.00 . A A . 7 CYS O 1 1 9 6296 1 1 7 CYS SG S 3.137 9.601 -7.628 1.00 . A A . 7 CYS SG 1 1 9 6297 1 1 8 THR C C 4.928 12.080 -2.115 1.00 . A A . 8 THR C 1 1 9 6298 1 1 8 THR CA C 3.953 12.293 -3.273 1.00 . A A . 8 THR CA 1 1 9 6299 1 1 8 THR CB C 2.813 13.207 -2.816 1.00 . A A . 8 THR CB 1 1 9 6300 1 1 8 THR CG2 C 2.268 12.713 -1.475 1.00 . A A . 8 THR CG2 1 1 9 6301 1 1 8 THR H H 2.569 10.641 -3.295 1.00 . A A . 8 THR H 1 1 9 6302 1 1 8 THR HA H 4.471 12.750 -4.103 1.00 . A A . 8 THR HA 1 1 9 6303 1 1 8 THR HB H 2.021 13.193 -3.550 1.00 . A A . 8 THR HB 1 1 9 6304 1 1 8 THR HG1 H 2.551 15.128 -2.665 1.00 . A A . 8 THR HG1 1 1 9 6305 1 1 8 THR HG21 H 1.191 12.795 -1.472 1.00 . A A . 8 THR HG21 1 1 9 6306 1 1 8 THR HG22 H 2.677 13.315 -0.677 1.00 . A A . 8 THR HG22 1 1 9 6307 1 1 8 THR HG23 H 2.551 11.681 -1.329 1.00 . A A . 8 THR HG23 1 1 9 6308 1 1 8 THR N N 3.398 10.978 -3.697 1.00 . A A . 8 THR N 1 1 9 6309 1 1 8 THR O O 5.812 12.879 -1.878 1.00 . A A . 8 THR O 1 1 9 6310 1 1 8 THR OG1 O 3.303 14.532 -2.671 1.00 . A A . 8 THR OG1 1 1 9 6311 1 1 9 SER C C 6.410 9.412 -0.458 1.00 . A A . 9 SER C 1 1 9 6312 1 1 9 SER CA C 5.687 10.744 -0.245 1.00 . A A . 9 SER CA 1 1 9 6313 1 1 9 SER CB C 4.874 10.681 1.048 1.00 . A A . 9 SER CB 1 1 9 6314 1 1 9 SER H H 4.051 10.376 -1.595 1.00 . A A . 9 SER H 1 1 9 6315 1 1 9 SER HA H 6.413 11.540 -0.174 1.00 . A A . 9 SER HA 1 1 9 6316 1 1 9 SER HB2 H 4.015 11.326 0.967 1.00 . A A . 9 SER HB2 1 1 9 6317 1 1 9 SER HB3 H 4.545 9.665 1.217 1.00 . A A . 9 SER HB3 1 1 9 6318 1 1 9 SER HG H 5.137 11.641 2.720 1.00 . A A . 9 SER HG 1 1 9 6319 1 1 9 SER N N 4.772 11.008 -1.390 1.00 . A A . 9 SER N 1 1 9 6320 1 1 9 SER O O 6.132 8.684 -1.390 1.00 . A A . 9 SER O 1 1 9 6321 1 1 9 SER OG O 5.685 11.117 2.132 1.00 . A A . 9 SER OG 1 1 9 6322 1 1 10 ILE C C 7.426 6.734 1.123 1.00 . A A . 10 ILE C 1 1 9 6323 1 1 10 ILE CA C 8.085 7.809 0.258 1.00 . A A . 10 ILE CA 1 1 9 6324 1 1 10 ILE CB C 9.523 8.011 0.735 1.00 . A A . 10 ILE CB 1 1 9 6325 1 1 10 ILE CD1 C 10.249 8.511 -1.596 1.00 . A A . 10 ILE CD1 1 1 9 6326 1 1 10 ILE CG1 C 10.223 9.031 -0.161 1.00 . A A . 10 ILE CG1 1 1 9 6327 1 1 10 ILE CG2 C 10.269 6.680 0.678 1.00 . A A . 10 ILE CG2 1 1 9 6328 1 1 10 ILE H H 7.546 9.693 1.145 1.00 . A A . 10 ILE H 1 1 9 6329 1 1 10 ILE HA H 8.085 7.497 -0.775 1.00 . A A . 10 ILE HA 1 1 9 6330 1 1 10 ILE HB H 9.516 8.372 1.751 1.00 . A A . 10 ILE HB 1 1 9 6331 1 1 10 ILE HD11 H 9.237 8.393 -1.953 1.00 . A A . 10 ILE HD11 1 1 9 6332 1 1 10 ILE HD12 H 10.754 7.557 -1.621 1.00 . A A . 10 ILE HD12 1 1 9 6333 1 1 10 ILE HD13 H 10.774 9.215 -2.223 1.00 . A A . 10 ILE HD13 1 1 9 6334 1 1 10 ILE HG12 H 9.687 9.968 -0.126 1.00 . A A . 10 ILE HG12 1 1 9 6335 1 1 10 ILE HG13 H 11.235 9.180 0.184 1.00 . A A . 10 ILE HG13 1 1 9 6336 1 1 10 ILE HG21 H 11.316 6.845 0.881 1.00 . A A . 10 ILE HG21 1 1 9 6337 1 1 10 ILE HG22 H 10.155 6.246 -0.303 1.00 . A A . 10 ILE HG22 1 1 9 6338 1 1 10 ILE HG23 H 9.859 6.009 1.419 1.00 . A A . 10 ILE HG23 1 1 9 6339 1 1 10 ILE N N 7.338 9.090 0.401 1.00 . A A . 10 ILE N 1 1 9 6340 1 1 10 ILE O O 6.947 7.011 2.205 1.00 . A A . 10 ILE O 1 1 9 6341 1 1 11 CYS C C 7.668 3.194 1.509 1.00 . A A . 11 CYS C 1 1 9 6342 1 1 11 CYS CA C 6.778 4.437 1.506 1.00 . A A . 11 CYS CA 1 1 9 6343 1 1 11 CYS CB C 5.383 4.048 0.983 1.00 . A A . 11 CYS CB 1 1 9 6344 1 1 11 CYS H H 7.801 5.292 -0.196 1.00 . A A . 11 CYS H 1 1 9 6345 1 1 11 CYS HA H 6.684 4.798 2.521 1.00 . A A . 11 CYS HA 1 1 9 6346 1 1 11 CYS HB2 H 5.380 2.998 0.738 1.00 . A A . 11 CYS HB2 1 1 9 6347 1 1 11 CYS HB3 H 4.653 4.232 1.759 1.00 . A A . 11 CYS HB3 1 1 9 6348 1 1 11 CYS N N 7.404 5.508 0.673 1.00 . A A . 11 CYS N 1 1 9 6349 1 1 11 CYS O O 8.152 2.759 0.483 1.00 . A A . 11 CYS O 1 1 9 6350 1 1 11 CYS SG S 4.935 5.000 -0.493 1.00 . A A . 11 CYS SG 1 1 9 6351 1 1 12 SER C C 7.834 0.161 2.808 1.00 . A A . 12 SER C 1 1 9 6352 1 1 12 SER CA C 8.730 1.401 2.746 1.00 . A A . 12 SER CA 1 1 9 6353 1 1 12 SER CB C 9.585 1.472 4.012 1.00 . A A . 12 SER CB 1 1 9 6354 1 1 12 SER H H 7.476 2.988 3.473 1.00 . A A . 12 SER H 1 1 9 6355 1 1 12 SER HA H 9.371 1.343 1.879 1.00 . A A . 12 SER HA 1 1 9 6356 1 1 12 SER HB2 H 9.509 0.544 4.553 1.00 . A A . 12 SER HB2 1 1 9 6357 1 1 12 SER HB3 H 10.616 1.643 3.736 1.00 . A A . 12 SER HB3 1 1 9 6358 1 1 12 SER HG H 8.278 2.269 5.214 1.00 . A A . 12 SER HG 1 1 9 6359 1 1 12 SER N N 7.880 2.618 2.661 1.00 . A A . 12 SER N 1 1 9 6360 1 1 12 SER O O 6.659 0.251 3.106 1.00 . A A . 12 SER O 1 1 9 6361 1 1 12 SER OG O 9.118 2.535 4.833 1.00 . A A . 12 SER OG 1 1 9 6362 1 1 13 LEU C C 6.533 -2.198 3.649 1.00 . A A . 13 LEU C 1 1 9 6363 1 1 13 LEU CA C 7.583 -2.249 2.539 1.00 . A A . 13 LEU CA 1 1 9 6364 1 1 13 LEU CB C 8.507 -3.443 2.777 1.00 . A A . 13 LEU CB 1 1 9 6365 1 1 13 LEU CD1 C 8.506 -5.876 2.220 1.00 . A A . 13 LEU CD1 1 1 9 6366 1 1 13 LEU CD2 C 7.322 -5.067 4.264 1.00 . A A . 13 LEU CD2 1 1 9 6367 1 1 13 LEU CG C 7.683 -4.731 2.814 1.00 . A A . 13 LEU CG 1 1 9 6368 1 1 13 LEU H H 9.325 -1.026 2.260 1.00 . A A . 13 LEU H 1 1 9 6369 1 1 13 LEU HA H 7.097 -2.365 1.595 1.00 . A A . 13 LEU HA 1 1 9 6370 1 1 13 LEU HB2 H 9.227 -3.502 1.977 1.00 . A A . 13 LEU HB2 1 1 9 6371 1 1 13 LEU HB3 H 9.020 -3.320 3.716 1.00 . A A . 13 LEU HB3 1 1 9 6372 1 1 13 LEU HD11 H 8.920 -5.566 1.272 1.00 . A A . 13 LEU HD11 1 1 9 6373 1 1 13 LEU HD12 H 7.872 -6.737 2.073 1.00 . A A . 13 LEU HD12 1 1 9 6374 1 1 13 LEU HD13 H 9.308 -6.131 2.897 1.00 . A A . 13 LEU HD13 1 1 9 6375 1 1 13 LEU HD21 H 7.787 -6.001 4.542 1.00 . A A . 13 LEU HD21 1 1 9 6376 1 1 13 LEU HD22 H 6.249 -5.157 4.357 1.00 . A A . 13 LEU HD22 1 1 9 6377 1 1 13 LEU HD23 H 7.675 -4.281 4.914 1.00 . A A . 13 LEU HD23 1 1 9 6378 1 1 13 LEU HG H 6.780 -4.599 2.237 1.00 . A A . 13 LEU HG 1 1 9 6379 1 1 13 LEU N N 8.383 -0.990 2.514 1.00 . A A . 13 LEU N 1 1 9 6380 1 1 13 LEU O O 5.454 -2.740 3.520 1.00 . A A . 13 LEU O 1 1 9 6381 1 1 14 TYR C C 4.525 -0.923 5.307 1.00 . A A . 14 TYR C 1 1 9 6382 1 1 14 TYR CA C 5.849 -1.468 5.848 1.00 . A A . 14 TYR CA 1 1 9 6383 1 1 14 TYR CB C 6.382 -0.535 6.938 1.00 . A A . 14 TYR CB 1 1 9 6384 1 1 14 TYR CD1 C 7.349 -2.236 8.529 1.00 . A A . 14 TYR CD1 1 1 9 6385 1 1 14 TYR CD2 C 5.417 -0.945 9.233 1.00 . A A . 14 TYR CD2 1 1 9 6386 1 1 14 TYR CE1 C 7.350 -2.905 9.761 1.00 . A A . 14 TYR CE1 1 1 9 6387 1 1 14 TYR CE2 C 5.419 -1.613 10.464 1.00 . A A . 14 TYR CE2 1 1 9 6388 1 1 14 TYR CG C 6.382 -1.256 8.265 1.00 . A A . 14 TYR CG 1 1 9 6389 1 1 14 TYR CZ C 6.385 -2.593 10.728 1.00 . A A . 14 TYR CZ 1 1 9 6390 1 1 14 TYR H H 7.710 -1.118 4.824 1.00 . A A . 14 TYR H 1 1 9 6391 1 1 14 TYR HA H 5.690 -2.453 6.263 1.00 . A A . 14 TYR HA 1 1 9 6392 1 1 14 TYR HB2 H 7.390 -0.236 6.692 1.00 . A A . 14 TYR HB2 1 1 9 6393 1 1 14 TYR HB3 H 5.753 0.340 7.005 1.00 . A A . 14 TYR HB3 1 1 9 6394 1 1 14 TYR HD1 H 8.092 -2.477 7.784 1.00 . A A . 14 TYR HD1 1 1 9 6395 1 1 14 TYR HD2 H 4.672 -0.190 9.028 1.00 . A A . 14 TYR HD2 1 1 9 6396 1 1 14 TYR HE1 H 8.094 -3.660 9.965 1.00 . A A . 14 TYR HE1 1 1 9 6397 1 1 14 TYR HE2 H 4.675 -1.373 11.210 1.00 . A A . 14 TYR HE2 1 1 9 6398 1 1 14 TYR HH H 5.510 -3.176 12.322 1.00 . A A . 14 TYR HH 1 1 9 6399 1 1 14 TYR N N 6.836 -1.550 4.737 1.00 . A A . 14 TYR N 1 1 9 6400 1 1 14 TYR O O 3.522 -1.611 5.287 1.00 . A A . 14 TYR O 1 1 9 6401 1 1 14 TYR OH O 6.389 -3.251 11.941 1.00 . A A . 14 TYR OH 1 1 9 6402 1 1 15 GLN C C 2.677 -0.089 3.286 1.00 . A A . 15 GLN C 1 1 9 6403 1 1 15 GLN CA C 3.258 0.881 4.311 1.00 . A A . 15 GLN CA 1 1 9 6404 1 1 15 GLN CB C 3.561 2.223 3.643 1.00 . A A . 15 GLN CB 1 1 9 6405 1 1 15 GLN CD C 4.996 3.592 5.160 1.00 . A A . 15 GLN CD 1 1 9 6406 1 1 15 GLN CG C 3.561 3.326 4.703 1.00 . A A . 15 GLN CG 1 1 9 6407 1 1 15 GLN H H 5.334 0.834 4.866 1.00 . A A . 15 GLN H 1 1 9 6408 1 1 15 GLN HA H 2.549 1.027 5.113 1.00 . A A . 15 GLN HA 1 1 9 6409 1 1 15 GLN HB2 H 4.531 2.178 3.168 1.00 . A A . 15 GLN HB2 1 1 9 6410 1 1 15 GLN HB3 H 2.806 2.439 2.902 1.00 . A A . 15 GLN HB3 1 1 9 6411 1 1 15 GLN HE21 H 4.653 3.039 7.035 1.00 . A A . 15 GLN HE21 1 1 9 6412 1 1 15 GLN HE22 H 6.242 3.537 6.705 1.00 . A A . 15 GLN HE22 1 1 9 6413 1 1 15 GLN HG2 H 3.141 4.230 4.285 1.00 . A A . 15 GLN HG2 1 1 9 6414 1 1 15 GLN HG3 H 2.970 3.013 5.550 1.00 . A A . 15 GLN HG3 1 1 9 6415 1 1 15 GLN N N 4.514 0.302 4.856 1.00 . A A . 15 GLN N 1 1 9 6416 1 1 15 GLN NE2 N 5.324 3.371 6.404 1.00 . A A . 15 GLN NE2 1 1 9 6417 1 1 15 GLN O O 1.481 -0.299 3.219 1.00 . A A . 15 GLN O 1 1 9 6418 1 1 15 GLN OE1 O 5.830 4.004 4.376 1.00 . A A . 15 GLN OE1 1 1 9 6419 1 1 16 LEU C C 2.299 -2.804 2.184 1.00 . A A . 16 LEU C 1 1 9 6420 1 1 16 LEU CA C 3.023 -1.659 1.477 1.00 . A A . 16 LEU CA 1 1 9 6421 1 1 16 LEU CB C 4.199 -2.225 0.701 1.00 . A A . 16 LEU CB 1 1 9 6422 1 1 16 LEU CD1 C 6.169 -0.808 0.143 1.00 . A A . 16 LEU CD1 1 1 9 6423 1 1 16 LEU CD2 C 4.698 -1.664 -1.665 1.00 . A A . 16 LEU CD2 1 1 9 6424 1 1 16 LEU CG C 4.734 -1.148 -0.234 1.00 . A A . 16 LEU CG 1 1 9 6425 1 1 16 LEU H H 4.480 -0.507 2.573 1.00 . A A . 16 LEU H 1 1 9 6426 1 1 16 LEU HA H 2.354 -1.160 0.796 1.00 . A A . 16 LEU HA 1 1 9 6427 1 1 16 LEU HB2 H 4.967 -2.529 1.390 1.00 . A A . 16 LEU HB2 1 1 9 6428 1 1 16 LEU HB3 H 3.877 -3.075 0.121 1.00 . A A . 16 LEU HB3 1 1 9 6429 1 1 16 LEU HD11 H 6.817 -1.618 -0.154 1.00 . A A . 16 LEU HD11 1 1 9 6430 1 1 16 LEU HD12 H 6.234 -0.666 1.210 1.00 . A A . 16 LEU HD12 1 1 9 6431 1 1 16 LEU HD13 H 6.465 0.097 -0.362 1.00 . A A . 16 LEU HD13 1 1 9 6432 1 1 16 LEU HD21 H 5.270 -1.004 -2.298 1.00 . A A . 16 LEU HD21 1 1 9 6433 1 1 16 LEU HD22 H 3.676 -1.700 -2.007 1.00 . A A . 16 LEU HD22 1 1 9 6434 1 1 16 LEU HD23 H 5.126 -2.656 -1.697 1.00 . A A . 16 LEU HD23 1 1 9 6435 1 1 16 LEU HG H 4.121 -0.263 -0.149 1.00 . A A . 16 LEU HG 1 1 9 6436 1 1 16 LEU N N 3.520 -0.689 2.494 1.00 . A A . 16 LEU N 1 1 9 6437 1 1 16 LEU O O 1.140 -3.071 1.936 1.00 . A A . 16 LEU O 1 1 9 6438 1 1 17 GLU C C 1.014 -4.178 4.399 1.00 . A A . 17 GLU C 1 1 9 6439 1 1 17 GLU CA C 2.348 -4.621 3.794 1.00 . A A . 17 GLU CA 1 1 9 6440 1 1 17 GLU CB C 3.281 -5.092 4.914 1.00 . A A . 17 GLU CB 1 1 9 6441 1 1 17 GLU CD C 4.242 -7.120 6.015 1.00 . A A . 17 GLU CD 1 1 9 6442 1 1 17 GLU CG C 3.567 -6.585 4.749 1.00 . A A . 17 GLU CG 1 1 9 6443 1 1 17 GLU H H 3.921 -3.251 3.242 1.00 . A A . 17 GLU H 1 1 9 6444 1 1 17 GLU HA H 2.175 -5.433 3.109 1.00 . A A . 17 GLU HA 1 1 9 6445 1 1 17 GLU HB2 H 4.208 -4.539 4.867 1.00 . A A . 17 GLU HB2 1 1 9 6446 1 1 17 GLU HB3 H 2.809 -4.922 5.871 1.00 . A A . 17 GLU HB3 1 1 9 6447 1 1 17 GLU HG2 H 2.640 -7.114 4.583 1.00 . A A . 17 GLU HG2 1 1 9 6448 1 1 17 GLU HG3 H 4.224 -6.734 3.905 1.00 . A A . 17 GLU HG3 1 1 9 6449 1 1 17 GLU N N 2.983 -3.485 3.063 1.00 . A A . 17 GLU N 1 1 9 6450 1 1 17 GLU O O 0.173 -4.990 4.727 1.00 . A A . 17 GLU O 1 1 9 6451 1 1 17 GLU OE1 O 4.329 -6.374 6.976 1.00 . A A . 17 GLU OE1 1 1 9 6452 1 1 17 GLU OE2 O 4.659 -8.266 6.001 1.00 . A A . 17 GLU OE2 1 1 9 6453 1 1 18 ASN C C -1.517 -2.252 4.047 1.00 . A A . 18 ASN C 1 1 9 6454 1 1 18 ASN CA C -0.468 -2.419 5.148 1.00 . A A . 18 ASN CA 1 1 9 6455 1 1 18 ASN CB C -0.237 -1.075 5.844 1.00 . A A . 18 ASN CB 1 1 9 6456 1 1 18 ASN CG C -0.775 -1.143 7.274 1.00 . A A . 18 ASN CG 1 1 9 6457 1 1 18 ASN H H 1.503 -2.257 4.293 1.00 . A A . 18 ASN H 1 1 9 6458 1 1 18 ASN HA H -0.820 -3.139 5.871 1.00 . A A . 18 ASN HA 1 1 9 6459 1 1 18 ASN HB2 H 0.820 -0.858 5.865 1.00 . A A . 18 ASN HB2 1 1 9 6460 1 1 18 ASN HB3 H -0.754 -0.296 5.303 1.00 . A A . 18 ASN HB3 1 1 9 6461 1 1 18 ASN HD21 H -2.554 -0.407 6.790 1.00 . A A . 18 ASN HD21 1 1 9 6462 1 1 18 ASN HD22 H -2.347 -0.784 8.432 1.00 . A A . 18 ASN HD22 1 1 9 6463 1 1 18 ASN N N 0.812 -2.900 4.557 1.00 . A A . 18 ASN N 1 1 9 6464 1 1 18 ASN ND2 N -1.993 -0.745 7.518 1.00 . A A . 18 ASN ND2 1 1 9 6465 1 1 18 ASN O O -2.563 -1.672 4.259 1.00 . A A . 18 ASN O 1 1 9 6466 1 1 18 ASN OD1 O -0.080 -1.563 8.177 1.00 . A A . 18 ASN OD1 1 1 9 6467 1 1 19 TYR C C -2.315 -3.945 0.993 1.00 . A A . 19 TYR C 1 1 9 6468 1 1 19 TYR CA C -2.244 -2.630 1.769 1.00 . A A . 19 TYR CA 1 1 9 6469 1 1 19 TYR CB C -1.817 -1.503 0.827 1.00 . A A . 19 TYR CB 1 1 9 6470 1 1 19 TYR CD1 C -2.828 0.271 2.311 1.00 . A A . 19 TYR CD1 1 1 9 6471 1 1 19 TYR CD2 C -0.513 0.502 1.620 1.00 . A A . 19 TYR CD2 1 1 9 6472 1 1 19 TYR CE1 C -2.731 1.467 3.033 1.00 . A A . 19 TYR CE1 1 1 9 6473 1 1 19 TYR CE2 C -0.416 1.698 2.342 1.00 . A A . 19 TYR CE2 1 1 9 6474 1 1 19 TYR CG C -1.718 -0.212 1.604 1.00 . A A . 19 TYR CG 1 1 9 6475 1 1 19 TYR CZ C -1.525 2.181 3.049 1.00 . A A . 19 TYR CZ 1 1 9 6476 1 1 19 TYR H H -0.404 -3.229 2.722 1.00 . A A . 19 TYR H 1 1 9 6477 1 1 19 TYR HA H -3.215 -2.404 2.183 1.00 . A A . 19 TYR HA 1 1 9 6478 1 1 19 TYR HB2 H -0.854 -1.740 0.397 1.00 . A A . 19 TYR HB2 1 1 9 6479 1 1 19 TYR HB3 H -2.547 -1.396 0.039 1.00 . A A . 19 TYR HB3 1 1 9 6480 1 1 19 TYR HD1 H -3.759 -0.278 2.298 1.00 . A A . 19 TYR HD1 1 1 9 6481 1 1 19 TYR HD2 H 0.341 0.130 1.074 1.00 . A A . 19 TYR HD2 1 1 9 6482 1 1 19 TYR HE1 H -3.586 1.839 3.579 1.00 . A A . 19 TYR HE1 1 1 9 6483 1 1 19 TYR HE2 H 0.514 2.247 2.354 1.00 . A A . 19 TYR HE2 1 1 9 6484 1 1 19 TYR HH H -1.081 4.035 3.170 1.00 . A A . 19 TYR HH 1 1 9 6485 1 1 19 TYR N N -1.253 -2.760 2.875 1.00 . A A . 19 TYR N 1 1 9 6486 1 1 19 TYR O O -2.304 -3.962 -0.221 1.00 . A A . 19 TYR O 1 1 9 6487 1 1 19 TYR OH O -1.429 3.361 3.759 1.00 . A A . 19 TYR OH 1 1 9 6488 1 1 20 CYS C C -2.846 -7.447 1.992 1.00 . A A . 20 CYS C 1 1 9 6489 1 1 20 CYS CA C -2.456 -6.361 0.989 1.00 . A A . 20 CYS CA 1 1 9 6490 1 1 20 CYS CB C -1.089 -6.683 0.387 1.00 . A A . 20 CYS CB 1 1 9 6491 1 1 20 CYS H H -2.391 -5.010 2.667 1.00 . A A . 20 CYS H 1 1 9 6492 1 1 20 CYS HA H -3.194 -6.313 0.202 1.00 . A A . 20 CYS HA 1 1 9 6493 1 1 20 CYS HB2 H -0.877 -5.991 -0.413 1.00 . A A . 20 CYS HB2 1 1 9 6494 1 1 20 CYS HB3 H -0.330 -6.593 1.151 1.00 . A A . 20 CYS HB3 1 1 9 6495 1 1 20 CYS N N -2.386 -5.047 1.687 1.00 . A A . 20 CYS N 1 1 9 6496 1 1 20 CYS O O -2.704 -7.282 3.187 1.00 . A A . 20 CYS O 1 1 9 6497 1 1 20 CYS SG S -1.093 -8.373 -0.262 1.00 . A A . 20 CYS SG 1 1 9 6498 1 1 21 ASN C C -2.488 -10.294 3.050 1.00 . A A . 21 ASN C 1 1 9 6499 1 1 21 ASN CA C -3.740 -9.652 2.448 1.00 . A A . 21 ASN CA 1 1 9 6500 1 1 21 ASN CB C -4.540 -10.709 1.684 1.00 . A A . 21 ASN CB 1 1 9 6501 1 1 21 ASN CG C -6.025 -10.573 2.030 1.00 . A A . 21 ASN CG 1 1 9 6502 1 1 21 ASN H H -3.448 -8.673 0.550 1.00 . A A . 21 ASN H 1 1 9 6503 1 1 21 ASN HA H -4.350 -9.243 3.240 1.00 . A A . 21 ASN HA 1 1 9 6504 1 1 21 ASN HB2 H -4.402 -10.565 0.621 1.00 . A A . 21 ASN HB2 1 1 9 6505 1 1 21 ASN HB3 H -4.196 -11.693 1.962 1.00 . A A . 21 ASN HB3 1 1 9 6506 1 1 21 ASN HD21 H -6.617 -11.858 0.636 1.00 . A A . 21 ASN HD21 1 1 9 6507 1 1 21 ASN HD22 H -7.860 -11.179 1.573 1.00 . A A . 21 ASN HD22 1 1 9 6508 1 1 21 ASN N N -3.340 -8.559 1.517 1.00 . A A . 21 ASN N 1 1 9 6509 1 1 21 ASN ND2 N -6.907 -11.260 1.357 1.00 . A A . 21 ASN ND2 1 1 9 6510 1 1 21 ASN O O -1.519 -10.447 2.326 1.00 . A A . 21 ASN O 1 1 9 6511 1 1 21 ASN OXT O -2.521 -10.621 4.225 1.00 . A A . 21 ASN OXT 1 1 9 6512 1 1 21 ASN OD1 O -6.386 -9.834 2.923 1.00 . A A . 21 ASN OD1 1 1 9 6513 2 2 1 PHE C C 11.039 -0.101 0.229 1.00 . B B . 1 PHE C 1 1 9 6514 2 2 1 PHE CA C 10.226 -0.475 -1.015 1.00 . B B . 1 PHE CA 1 1 9 6515 2 2 1 PHE CB C 11.131 -1.168 -2.035 1.00 . B B . 1 PHE CB 1 1 9 6516 2 2 1 PHE CD1 C 9.986 -3.417 -1.942 1.00 . B B . 1 PHE CD1 1 1 9 6517 2 2 1 PHE CD2 C 12.336 -3.273 -1.350 1.00 . B B . 1 PHE CD2 1 1 9 6518 2 2 1 PHE CE1 C 10.009 -4.798 -1.697 1.00 . B B . 1 PHE CE1 1 1 9 6519 2 2 1 PHE CE2 C 12.358 -4.653 -1.106 1.00 . B B . 1 PHE CE2 1 1 9 6520 2 2 1 PHE CG C 11.150 -2.655 -1.768 1.00 . B B . 1 PHE CG 1 1 9 6521 2 2 1 PHE CZ C 11.195 -5.415 -1.279 1.00 . B B . 1 PHE CZ 1 1 9 6522 2 2 1 PHE H1 H 9.735 1.547 -0.954 1.00 . B B . 1 PHE H1 1 1 9 6523 2 2 1 PHE H2 H 8.653 0.598 -1.857 1.00 . B B . 1 PHE H2 1 1 9 6524 2 2 1 PHE H3 H 10.179 0.990 -2.492 1.00 . B B . 1 PHE H3 1 1 9 6525 2 2 1 PHE HA H 9.423 -1.142 -0.735 1.00 . B B . 1 PHE HA 1 1 9 6526 2 2 1 PHE HB2 H 10.754 -0.986 -3.030 1.00 . B B . 1 PHE HB2 1 1 9 6527 2 2 1 PHE HB3 H 12.133 -0.775 -1.953 1.00 . B B . 1 PHE HB3 1 1 9 6528 2 2 1 PHE HD1 H 9.072 -2.941 -2.263 1.00 . B B . 1 PHE HD1 1 1 9 6529 2 2 1 PHE HD2 H 13.233 -2.687 -1.217 1.00 . B B . 1 PHE HD2 1 1 9 6530 2 2 1 PHE HE1 H 9.112 -5.385 -1.831 1.00 . B B . 1 PHE HE1 1 1 9 6531 2 2 1 PHE HE2 H 13.272 -5.130 -0.784 1.00 . B B . 1 PHE HE2 1 1 9 6532 2 2 1 PHE HZ H 11.213 -6.478 -1.091 1.00 . B B . 1 PHE HZ 1 1 9 6533 2 2 1 PHE N N 9.655 0.759 -1.625 1.00 . B B . 1 PHE N 1 1 9 6534 2 2 1 PHE O O 10.631 -0.350 1.345 1.00 . B B . 1 PHE O 1 1 9 6535 2 2 2 VAL C C 12.839 2.381 1.489 1.00 . B B . 2 VAL C 1 1 9 6536 2 2 2 VAL CA C 13.023 0.888 1.215 1.00 . B B . 2 VAL CA 1 1 9 6537 2 2 2 VAL CB C 14.494 0.599 0.907 1.00 . B B . 2 VAL CB 1 1 9 6538 2 2 2 VAL CG1 C 15.348 0.898 2.140 1.00 . B B . 2 VAL CG1 1 1 9 6539 2 2 2 VAL CG2 C 14.653 -0.874 0.525 1.00 . B B . 2 VAL CG2 1 1 9 6540 2 2 2 VAL H H 12.496 0.690 -0.863 1.00 . B B . 2 VAL H 1 1 9 6541 2 2 2 VAL HA H 12.718 0.327 2.083 1.00 . B B . 2 VAL HA 1 1 9 6542 2 2 2 VAL HB H 14.817 1.223 0.087 1.00 . B B . 2 VAL HB 1 1 9 6543 2 2 2 VAL HG11 H 15.730 -0.027 2.545 1.00 . B B . 2 VAL HG11 1 1 9 6544 2 2 2 VAL HG12 H 14.747 1.397 2.885 1.00 . B B . 2 VAL HG12 1 1 9 6545 2 2 2 VAL HG13 H 16.174 1.536 1.859 1.00 . B B . 2 VAL HG13 1 1 9 6546 2 2 2 VAL HG21 H 13.703 -1.263 0.187 1.00 . B B . 2 VAL HG21 1 1 9 6547 2 2 2 VAL HG22 H 14.985 -1.434 1.385 1.00 . B B . 2 VAL HG22 1 1 9 6548 2 2 2 VAL HG23 H 15.380 -0.963 -0.268 1.00 . B B . 2 VAL HG23 1 1 9 6549 2 2 2 VAL N N 12.185 0.496 0.045 1.00 . B B . 2 VAL N 1 1 9 6550 2 2 2 VAL O O 12.890 2.829 2.618 1.00 . B B . 2 VAL O 1 1 9 6551 2 2 3 ASN C C 12.281 5.270 -0.725 1.00 . B B . 3 ASN C 1 1 9 6552 2 2 3 ASN CA C 12.447 4.616 0.646 1.00 . B B . 3 ASN CA 1 1 9 6553 2 2 3 ASN CB C 13.676 5.193 1.348 1.00 . B B . 3 ASN CB 1 1 9 6554 2 2 3 ASN CG C 14.941 4.748 0.614 1.00 . B B . 3 ASN CG 1 1 9 6555 2 2 3 ASN H H 12.596 2.766 -0.440 1.00 . B B . 3 ASN H 1 1 9 6556 2 2 3 ASN HA H 11.566 4.798 1.245 1.00 . B B . 3 ASN HA 1 1 9 6557 2 2 3 ASN HB2 H 13.619 6.269 1.344 1.00 . B B . 3 ASN HB2 1 1 9 6558 2 2 3 ASN HB3 H 13.710 4.838 2.367 1.00 . B B . 3 ASN HB3 1 1 9 6559 2 2 3 ASN HD21 H 15.321 6.554 -0.118 1.00 . B B . 3 ASN HD21 1 1 9 6560 2 2 3 ASN HD22 H 16.435 5.348 -0.547 1.00 . B B . 3 ASN HD22 1 1 9 6561 2 2 3 ASN N N 12.631 3.151 0.460 1.00 . B B . 3 ASN N 1 1 9 6562 2 2 3 ASN ND2 N 15.622 5.622 -0.074 1.00 . B B . 3 ASN ND2 1 1 9 6563 2 2 3 ASN O O 12.732 6.374 -0.960 1.00 . B B . 3 ASN O 1 1 9 6564 2 2 3 ASN OD1 O 15.312 3.592 0.667 1.00 . B B . 3 ASN OD1 1 1 9 6565 2 2 4 GLN C C 10.032 5.724 -3.132 1.00 . B B . 4 GLN C 1 1 9 6566 2 2 4 GLN CA C 11.445 5.152 -2.999 1.00 . B B . 4 GLN CA 1 1 9 6567 2 2 4 GLN CB C 11.646 4.046 -4.038 1.00 . B B . 4 GLN CB 1 1 9 6568 2 2 4 GLN CD C 12.534 3.848 -6.364 1.00 . B B . 4 GLN CD 1 1 9 6569 2 2 4 GLN CG C 12.795 4.428 -4.973 1.00 . B B . 4 GLN CG 1 1 9 6570 2 2 4 GLN H H 11.293 3.698 -1.421 1.00 . B B . 4 GLN H 1 1 9 6571 2 2 4 GLN HA H 12.166 5.937 -3.170 1.00 . B B . 4 GLN HA 1 1 9 6572 2 2 4 GLN HB2 H 11.883 3.119 -3.535 1.00 . B B . 4 GLN HB2 1 1 9 6573 2 2 4 GLN HB3 H 10.741 3.922 -4.614 1.00 . B B . 4 GLN HB3 1 1 9 6574 2 2 4 GLN HE21 H 13.569 5.260 -7.302 1.00 . B B . 4 GLN HE21 1 1 9 6575 2 2 4 GLN HE22 H 12.873 4.082 -8.307 1.00 . B B . 4 GLN HE22 1 1 9 6576 2 2 4 GLN HG2 H 12.863 5.504 -5.037 1.00 . B B . 4 GLN HG2 1 1 9 6577 2 2 4 GLN HG3 H 13.721 4.031 -4.586 1.00 . B B . 4 GLN HG3 1 1 9 6578 2 2 4 GLN N N 11.640 4.588 -1.635 1.00 . B B . 4 GLN N 1 1 9 6579 2 2 4 GLN NE2 N 13.034 4.446 -7.411 1.00 . B B . 4 GLN NE2 1 1 9 6580 2 2 4 GLN O O 9.296 5.838 -2.165 1.00 . B B . 4 GLN O 1 1 9 6581 2 2 4 GLN OE1 O 11.869 2.841 -6.501 1.00 . B B . 4 GLN OE1 1 1 9 6582 2 2 5 HIS C C 7.395 5.604 -5.204 1.00 . B B . 5 HIS C 1 1 9 6583 2 2 5 HIS CA C 8.290 6.653 -4.543 1.00 . B B . 5 HIS CA 1 1 9 6584 2 2 5 HIS CB C 8.389 7.879 -5.453 1.00 . B B . 5 HIS CB 1 1 9 6585 2 2 5 HIS CD2 C 10.081 9.725 -4.699 1.00 . B B . 5 HIS CD2 1 1 9 6586 2 2 5 HIS CE1 C 8.828 10.679 -3.204 1.00 . B B . 5 HIS CE1 1 1 9 6587 2 2 5 HIS CG C 8.887 9.059 -4.664 1.00 . B B . 5 HIS CG 1 1 9 6588 2 2 5 HIS H H 10.259 5.980 -5.089 1.00 . B B . 5 HIS H 1 1 9 6589 2 2 5 HIS HA H 7.866 6.942 -3.593 1.00 . B B . 5 HIS HA 1 1 9 6590 2 2 5 HIS HB2 H 9.075 7.673 -6.261 1.00 . B B . 5 HIS HB2 1 1 9 6591 2 2 5 HIS HB3 H 7.413 8.106 -5.860 1.00 . B B . 5 HIS HB3 1 1 9 6592 2 2 5 HIS HD2 H 10.915 9.486 -5.343 1.00 . B B . 5 HIS HD2 1 1 9 6593 2 2 5 HIS HE1 H 8.482 11.347 -2.429 1.00 . B B . 5 HIS HE1 1 1 9 6594 2 2 5 HIS HE2 H 10.759 11.394 -3.581 1.00 . B B . 5 HIS HE2 1 1 9 6595 2 2 5 HIS N N 9.648 6.084 -4.329 1.00 . B B . 5 HIS N 1 1 9 6596 2 2 5 HIS ND1 N 8.100 9.673 -3.712 1.00 . B B . 5 HIS ND1 1 1 9 6597 2 2 5 HIS NE2 N 10.047 10.749 -3.777 1.00 . B B . 5 HIS NE2 1 1 9 6598 2 2 5 HIS O O 7.722 5.052 -6.236 1.00 . B B . 5 HIS O 1 1 9 6599 2 2 6 LEU C C 4.229 5.076 -5.962 1.00 . B B . 6 LEU C 1 1 9 6600 2 2 6 LEU CA C 5.335 4.332 -5.210 1.00 . B B . 6 LEU CA 1 1 9 6601 2 2 6 LEU CB C 4.740 3.480 -4.088 1.00 . B B . 6 LEU CB 1 1 9 6602 2 2 6 LEU CD1 C 5.310 2.123 -2.071 1.00 . B B . 6 LEU CD1 1 1 9 6603 2 2 6 LEU CD2 C 7.065 2.627 -3.776 1.00 . B B . 6 LEU CD2 1 1 9 6604 2 2 6 LEU CG C 5.827 3.170 -3.060 1.00 . B B . 6 LEU CG 1 1 9 6605 2 2 6 LEU H H 6.018 5.797 -3.792 1.00 . B B . 6 LEU H 1 1 9 6606 2 2 6 LEU HA H 5.869 3.700 -5.901 1.00 . B B . 6 LEU HA 1 1 9 6607 2 2 6 LEU HB2 H 3.937 4.022 -3.612 1.00 . B B . 6 LEU HB2 1 1 9 6608 2 2 6 LEU HB3 H 4.361 2.557 -4.499 1.00 . B B . 6 LEU HB3 1 1 9 6609 2 2 6 LEU HD11 H 5.288 2.547 -1.078 1.00 . B B . 6 LEU HD11 1 1 9 6610 2 2 6 LEU HD12 H 5.965 1.264 -2.081 1.00 . B B . 6 LEU HD12 1 1 9 6611 2 2 6 LEU HD13 H 4.314 1.820 -2.356 1.00 . B B . 6 LEU HD13 1 1 9 6612 2 2 6 LEU HD21 H 7.716 3.449 -4.040 1.00 . B B . 6 LEU HD21 1 1 9 6613 2 2 6 LEU HD22 H 6.763 2.106 -4.673 1.00 . B B . 6 LEU HD22 1 1 9 6614 2 2 6 LEU HD23 H 7.592 1.947 -3.124 1.00 . B B . 6 LEU HD23 1 1 9 6615 2 2 6 LEU HG H 6.084 4.073 -2.525 1.00 . B B . 6 LEU HG 1 1 9 6616 2 2 6 LEU N N 6.263 5.334 -4.620 1.00 . B B . 6 LEU N 1 1 9 6617 2 2 6 LEU O O 3.291 5.576 -5.372 1.00 . B B . 6 LEU O 1 1 9 6618 2 2 7 CYS C C 2.570 4.961 -8.987 1.00 . B B . 7 CYS C 1 1 9 6619 2 2 7 CYS CA C 3.320 5.915 -8.051 1.00 . B B . 7 CYS CA 1 1 9 6620 2 2 7 CYS CB C 4.008 6.994 -8.892 1.00 . B B . 7 CYS CB 1 1 9 6621 2 2 7 CYS H H 5.124 4.784 -7.712 1.00 . B B . 7 CYS H 1 1 9 6622 2 2 7 CYS HA H 2.618 6.383 -7.378 1.00 . B B . 7 CYS HA 1 1 9 6623 2 2 7 CYS HB2 H 4.819 6.550 -9.451 1.00 . B B . 7 CYS HB2 1 1 9 6624 2 2 7 CYS HB3 H 3.293 7.425 -9.576 1.00 . B B . 7 CYS HB3 1 1 9 6625 2 2 7 CYS N N 4.348 5.177 -7.260 1.00 . B B . 7 CYS N 1 1 9 6626 2 2 7 CYS O O 3.161 4.312 -9.826 1.00 . B B . 7 CYS O 1 1 9 6627 2 2 7 CYS SG S 4.663 8.288 -7.812 1.00 . B B . 7 CYS SG 1 1 9 6628 2 2 8 GLY C C 1.199 2.774 -10.168 1.00 . B B . 8 GLY C 1 1 9 6629 2 2 8 GLY CA C 0.431 4.026 -9.737 1.00 . B B . 8 GLY CA 1 1 9 6630 2 2 8 GLY H H 0.830 5.459 -8.180 1.00 . B B . 8 GLY H 1 1 9 6631 2 2 8 GLY HA2 H -0.458 3.729 -9.200 1.00 . B B . 8 GLY HA2 1 1 9 6632 2 2 8 GLY HA3 H 0.143 4.581 -10.617 1.00 . B B . 8 GLY HA3 1 1 9 6633 2 2 8 GLY N N 1.267 4.903 -8.857 1.00 . B B . 8 GLY N 1 1 9 6634 2 2 8 GLY O O 1.408 1.863 -9.392 1.00 . B B . 8 GLY O 1 1 9 6635 2 2 9 SER C C 3.293 1.006 -10.852 1.00 . B B . 9 SER C 1 1 9 6636 2 2 9 SER CA C 2.352 1.539 -11.930 1.00 . B B . 9 SER CA 1 1 9 6637 2 2 9 SER CB C 3.168 1.947 -13.155 1.00 . B B . 9 SER CB 1 1 9 6638 2 2 9 SER H H 1.409 3.474 -12.014 1.00 . B B . 9 SER H 1 1 9 6639 2 2 9 SER HA H 1.651 0.766 -12.208 1.00 . B B . 9 SER HA 1 1 9 6640 2 2 9 SER HB2 H 4.191 1.636 -13.028 1.00 . B B . 9 SER HB2 1 1 9 6641 2 2 9 SER HB3 H 2.754 1.474 -14.035 1.00 . B B . 9 SER HB3 1 1 9 6642 2 2 9 SER HG H 2.364 3.581 -13.840 1.00 . B B . 9 SER HG 1 1 9 6643 2 2 9 SER N N 1.605 2.725 -11.413 1.00 . B B . 9 SER N 1 1 9 6644 2 2 9 SER O O 3.062 -0.035 -10.273 1.00 . B B . 9 SER O 1 1 9 6645 2 2 9 SER OG O 3.124 3.361 -13.297 1.00 . B B . 9 SER OG 1 1 9 6646 2 2 10 ASP C C 4.479 0.831 -8.302 1.00 . B B . 10 ASP C 1 1 9 6647 2 2 10 ASP CA C 5.292 1.247 -9.518 1.00 . B B . 10 ASP CA 1 1 9 6648 2 2 10 ASP CB C 6.226 2.389 -9.125 1.00 . B B . 10 ASP CB 1 1 9 6649 2 2 10 ASP CG C 7.015 2.855 -10.352 1.00 . B B . 10 ASP CG 1 1 9 6650 2 2 10 ASP H H 4.515 2.559 -11.036 1.00 . B B . 10 ASP H 1 1 9 6651 2 2 10 ASP HA H 5.862 0.407 -9.884 1.00 . B B . 10 ASP HA 1 1 9 6652 2 2 10 ASP HB2 H 5.641 3.213 -8.734 1.00 . B B . 10 ASP HB2 1 1 9 6653 2 2 10 ASP HB3 H 6.914 2.045 -8.366 1.00 . B B . 10 ASP HB3 1 1 9 6654 2 2 10 ASP N N 4.350 1.716 -10.568 1.00 . B B . 10 ASP N 1 1 9 6655 2 2 10 ASP O O 4.708 -0.200 -7.701 1.00 . B B . 10 ASP O 1 1 9 6656 2 2 10 ASP OD1 O 6.392 3.099 -11.373 1.00 . B B . 10 ASP OD1 1 1 9 6657 2 2 10 ASP OD2 O 8.225 2.959 -10.249 1.00 . B B . 10 ASP OD2 1 1 9 6658 2 2 11 LEU C C 2.265 -0.157 -6.849 1.00 . B B . 11 LEU C 1 1 9 6659 2 2 11 LEU CA C 2.666 1.314 -6.780 1.00 . B B . 11 LEU CA 1 1 9 6660 2 2 11 LEU CB C 1.418 2.197 -6.849 1.00 . B B . 11 LEU CB 1 1 9 6661 2 2 11 LEU CD1 C 2.018 2.898 -4.495 1.00 . B B . 11 LEU CD1 1 1 9 6662 2 2 11 LEU CD2 C -0.013 3.779 -5.582 1.00 . B B . 11 LEU CD2 1 1 9 6663 2 2 11 LEU CG C 0.882 2.552 -5.454 1.00 . B B . 11 LEU CG 1 1 9 6664 2 2 11 LEU H H 3.361 2.453 -8.460 1.00 . B B . 11 LEU H 1 1 9 6665 2 2 11 LEU HA H 3.212 1.500 -5.876 1.00 . B B . 11 LEU HA 1 1 9 6666 2 2 11 LEU HB2 H 1.664 3.107 -7.374 1.00 . B B . 11 LEU HB2 1 1 9 6667 2 2 11 LEU HB3 H 0.651 1.672 -7.398 1.00 . B B . 11 LEU HB3 1 1 9 6668 2 2 11 LEU HD11 H 2.572 2.007 -4.247 1.00 . B B . 11 LEU HD11 1 1 9 6669 2 2 11 LEU HD12 H 1.605 3.328 -3.592 1.00 . B B . 11 LEU HD12 1 1 9 6670 2 2 11 LEU HD13 H 2.668 3.615 -4.966 1.00 . B B . 11 LEU HD13 1 1 9 6671 2 2 11 LEU HD21 H -0.859 3.546 -6.208 1.00 . B B . 11 LEU HD21 1 1 9 6672 2 2 11 LEU HD22 H 0.553 4.587 -6.028 1.00 . B B . 11 LEU HD22 1 1 9 6673 2 2 11 LEU HD23 H -0.355 4.078 -4.604 1.00 . B B . 11 LEU HD23 1 1 9 6674 2 2 11 LEU HG H 0.310 1.726 -5.062 1.00 . B B . 11 LEU HG 1 1 9 6675 2 2 11 LEU N N 3.522 1.633 -7.947 1.00 . B B . 11 LEU N 1 1 9 6676 2 2 11 LEU O O 2.556 -0.935 -5.962 1.00 . B B . 11 LEU O 1 1 9 6677 2 2 12 ALA C C 2.461 -2.823 -8.213 1.00 . B B . 12 ALA C 1 1 9 6678 2 2 12 ALA CA C 1.207 -1.973 -8.036 1.00 . B B . 12 ALA CA 1 1 9 6679 2 2 12 ALA CB C 0.301 -2.147 -9.256 1.00 . B B . 12 ALA CB 1 1 9 6680 2 2 12 ALA H H 1.394 0.090 -8.616 1.00 . B B . 12 ALA H 1 1 9 6681 2 2 12 ALA HA H 0.681 -2.283 -7.144 1.00 . B B . 12 ALA HA 1 1 9 6682 2 2 12 ALA HB1 H -0.402 -1.330 -9.300 1.00 . B B . 12 ALA HB1 1 1 9 6683 2 2 12 ALA HB2 H -0.235 -3.081 -9.176 1.00 . B B . 12 ALA HB2 1 1 9 6684 2 2 12 ALA HB3 H 0.903 -2.152 -10.152 1.00 . B B . 12 ALA HB3 1 1 9 6685 2 2 12 ALA N N 1.610 -0.550 -7.906 1.00 . B B . 12 ALA N 1 1 9 6686 2 2 12 ALA O O 2.666 -3.793 -7.514 1.00 . B B . 12 ALA O 1 1 9 6687 2 2 13 GLU C C 5.251 -3.462 -8.013 1.00 . B B . 13 GLU C 1 1 9 6688 2 2 13 GLU CA C 4.553 -3.249 -9.355 1.00 . B B . 13 GLU CA 1 1 9 6689 2 2 13 GLU CB C 5.484 -2.485 -10.299 1.00 . B B . 13 GLU CB 1 1 9 6690 2 2 13 GLU CD C 7.228 -3.018 -12.005 1.00 . B B . 13 GLU CD 1 1 9 6691 2 2 13 GLU CG C 5.826 -3.365 -11.502 1.00 . B B . 13 GLU CG 1 1 9 6692 2 2 13 GLU H H 3.130 -1.669 -9.688 1.00 . B B . 13 GLU H 1 1 9 6693 2 2 13 GLU HA H 4.305 -4.207 -9.788 1.00 . B B . 13 GLU HA 1 1 9 6694 2 2 13 GLU HB2 H 4.993 -1.586 -10.638 1.00 . B B . 13 GLU HB2 1 1 9 6695 2 2 13 GLU HB3 H 6.393 -2.225 -9.777 1.00 . B B . 13 GLU HB3 1 1 9 6696 2 2 13 GLU HG2 H 5.794 -4.405 -11.208 1.00 . B B . 13 GLU HG2 1 1 9 6697 2 2 13 GLU HG3 H 5.109 -3.192 -12.291 1.00 . B B . 13 GLU HG3 1 1 9 6698 2 2 13 GLU N N 3.310 -2.462 -9.139 1.00 . B B . 13 GLU N 1 1 9 6699 2 2 13 GLU O O 5.867 -4.482 -7.779 1.00 . B B . 13 GLU O 1 1 9 6700 2 2 13 GLU OE1 O 8.089 -2.771 -11.177 1.00 . B B . 13 GLU OE1 1 1 9 6701 2 2 13 GLU OE2 O 7.417 -3.004 -13.210 1.00 . B B . 13 GLU OE2 1 1 9 6702 2 2 14 ALA C C 5.029 -3.725 -4.997 1.00 . B B . 14 ALA C 1 1 9 6703 2 2 14 ALA CA C 5.803 -2.679 -5.794 1.00 . B B . 14 ALA CA 1 1 9 6704 2 2 14 ALA CB C 5.792 -1.348 -5.039 1.00 . B B . 14 ALA CB 1 1 9 6705 2 2 14 ALA H H 4.641 -1.697 -7.324 1.00 . B B . 14 ALA H 1 1 9 6706 2 2 14 ALA HA H 6.824 -3.014 -5.929 1.00 . B B . 14 ALA HA 1 1 9 6707 2 2 14 ALA HB1 H 4.825 -0.880 -5.145 1.00 . B B . 14 ALA HB1 1 1 9 6708 2 2 14 ALA HB2 H 6.553 -0.699 -5.445 1.00 . B B . 14 ALA HB2 1 1 9 6709 2 2 14 ALA HB3 H 5.992 -1.527 -3.992 1.00 . B B . 14 ALA HB3 1 1 9 6710 2 2 14 ALA N N 5.151 -2.512 -7.122 1.00 . B B . 14 ALA N 1 1 9 6711 2 2 14 ALA O O 5.594 -4.676 -4.493 1.00 . B B . 14 ALA O 1 1 9 6712 2 2 15 LEU C C 2.966 -5.892 -4.929 1.00 . B B . 15 LEU C 1 1 9 6713 2 2 15 LEU CA C 2.943 -4.581 -4.139 1.00 . B B . 15 LEU CA 1 1 9 6714 2 2 15 LEU CB C 1.500 -4.097 -3.994 1.00 . B B . 15 LEU CB 1 1 9 6715 2 2 15 LEU CD1 C 0.229 -2.029 -3.413 1.00 . B B . 15 LEU CD1 1 1 9 6716 2 2 15 LEU CD2 C 1.399 -3.315 -1.624 1.00 . B B . 15 LEU CD2 1 1 9 6717 2 2 15 LEU CG C 1.463 -2.869 -3.086 1.00 . B B . 15 LEU CG 1 1 9 6718 2 2 15 LEU H H 3.289 -2.809 -5.317 1.00 . B B . 15 LEU H 1 1 9 6719 2 2 15 LEU HA H 3.382 -4.728 -3.160 1.00 . B B . 15 LEU HA 1 1 9 6720 2 2 15 LEU HB2 H 1.106 -3.838 -4.966 1.00 . B B . 15 LEU HB2 1 1 9 6721 2 2 15 LEU HB3 H 0.898 -4.881 -3.559 1.00 . B B . 15 LEU HB3 1 1 9 6722 2 2 15 LEU HD11 H 0.320 -1.059 -2.945 1.00 . B B . 15 LEU HD11 1 1 9 6723 2 2 15 LEU HD12 H -0.653 -2.527 -3.040 1.00 . B B . 15 LEU HD12 1 1 9 6724 2 2 15 LEU HD13 H 0.150 -1.906 -4.482 1.00 . B B . 15 LEU HD13 1 1 9 6725 2 2 15 LEU HD21 H 0.455 -3.808 -1.440 1.00 . B B . 15 LEU HD21 1 1 9 6726 2 2 15 LEU HD22 H 1.485 -2.451 -0.981 1.00 . B B . 15 LEU HD22 1 1 9 6727 2 2 15 LEU HD23 H 2.209 -3.998 -1.420 1.00 . B B . 15 LEU HD23 1 1 9 6728 2 2 15 LEU HG H 2.353 -2.278 -3.245 1.00 . B B . 15 LEU HG 1 1 9 6729 2 2 15 LEU N N 3.737 -3.574 -4.892 1.00 . B B . 15 LEU N 1 1 9 6730 2 2 15 LEU O O 2.889 -6.972 -4.379 1.00 . B B . 15 LEU O 1 1 9 6731 2 2 16 TYR C C 4.370 -7.811 -6.769 1.00 . B B . 16 TYR C 1 1 9 6732 2 2 16 TYR CA C 3.123 -6.998 -7.093 1.00 . B B . 16 TYR CA 1 1 9 6733 2 2 16 TYR CB C 3.206 -6.561 -8.557 1.00 . B B . 16 TYR CB 1 1 9 6734 2 2 16 TYR CD1 C 2.335 -8.608 -9.725 1.00 . B B . 16 TYR CD1 1 1 9 6735 2 2 16 TYR CD2 C 0.993 -6.589 -9.740 1.00 . B B . 16 TYR CD2 1 1 9 6736 2 2 16 TYR CE1 C 1.351 -9.268 -10.475 1.00 . B B . 16 TYR CE1 1 1 9 6737 2 2 16 TYR CE2 C 0.008 -7.244 -10.490 1.00 . B B . 16 TYR CE2 1 1 9 6738 2 2 16 TYR CG C 2.152 -7.270 -9.359 1.00 . B B . 16 TYR CG 1 1 9 6739 2 2 16 TYR CZ C 0.186 -8.585 -10.859 1.00 . B B . 16 TYR CZ 1 1 9 6740 2 2 16 TYR H H 3.146 -4.899 -6.635 1.00 . B B . 16 TYR H 1 1 9 6741 2 2 16 TYR HA H 2.239 -7.598 -6.939 1.00 . B B . 16 TYR HA 1 1 9 6742 2 2 16 TYR HB2 H 3.055 -5.495 -8.626 1.00 . B B . 16 TYR HB2 1 1 9 6743 2 2 16 TYR HB3 H 4.179 -6.807 -8.950 1.00 . B B . 16 TYR HB3 1 1 9 6744 2 2 16 TYR HD1 H 3.236 -9.132 -9.429 1.00 . B B . 16 TYR HD1 1 1 9 6745 2 2 16 TYR HD2 H 0.861 -5.555 -9.454 1.00 . B B . 16 TYR HD2 1 1 9 6746 2 2 16 TYR HE1 H 1.490 -10.300 -10.759 1.00 . B B . 16 TYR HE1 1 1 9 6747 2 2 16 TYR HE2 H -0.887 -6.716 -10.783 1.00 . B B . 16 TYR HE2 1 1 9 6748 2 2 16 TYR HH H -0.346 -9.723 -12.297 1.00 . B B . 16 TYR HH 1 1 9 6749 2 2 16 TYR N N 3.081 -5.788 -6.226 1.00 . B B . 16 TYR N 1 1 9 6750 2 2 16 TYR O O 4.465 -8.983 -7.074 1.00 . B B . 16 TYR O 1 1 9 6751 2 2 16 TYR OH O -0.783 -9.233 -11.598 1.00 . B B . 16 TYR OH 1 1 9 6752 2 2 17 LEU C C 6.663 -8.204 -4.372 1.00 . B B . 17 LEU C 1 1 9 6753 2 2 17 LEU CA C 6.601 -7.876 -5.867 1.00 . B B . 17 LEU CA 1 1 9 6754 2 2 17 LEU CB C 7.737 -6.948 -6.256 1.00 . B B . 17 LEU CB 1 1 9 6755 2 2 17 LEU CD1 C 9.039 -9.105 -6.259 1.00 . B B . 17 LEU CD1 1 1 9 6756 2 2 17 LEU CD2 C 10.115 -6.950 -6.875 1.00 . B B . 17 LEU CD2 1 1 9 6757 2 2 17 LEU CG C 9.081 -7.596 -5.969 1.00 . B B . 17 LEU CG 1 1 9 6758 2 2 17 LEU H H 5.254 -6.229 -5.971 1.00 . B B . 17 LEU H 1 1 9 6759 2 2 17 LEU HA H 6.674 -8.784 -6.445 1.00 . B B . 17 LEU HA 1 1 9 6760 2 2 17 LEU HB2 H 7.668 -6.722 -7.310 1.00 . B B . 17 LEU HB2 1 1 9 6761 2 2 17 LEU HB3 H 7.657 -6.031 -5.690 1.00 . B B . 17 LEU HB3 1 1 9 6762 2 2 17 LEU HD11 H 9.960 -9.561 -5.926 1.00 . B B . 17 LEU HD11 1 1 9 6763 2 2 17 LEU HD12 H 8.925 -9.263 -7.321 1.00 . B B . 17 LEU HD12 1 1 9 6764 2 2 17 LEU HD13 H 8.208 -9.556 -5.740 1.00 . B B . 17 LEU HD13 1 1 9 6765 2 2 17 LEU HD21 H 9.661 -6.735 -7.832 1.00 . B B . 17 LEU HD21 1 1 9 6766 2 2 17 LEU HD22 H 10.943 -7.626 -7.013 1.00 . B B . 17 LEU HD22 1 1 9 6767 2 2 17 LEU HD23 H 10.461 -6.033 -6.427 1.00 . B B . 17 LEU HD23 1 1 9 6768 2 2 17 LEU HG H 9.337 -7.423 -4.940 1.00 . B B . 17 LEU HG 1 1 9 6769 2 2 17 LEU N N 5.342 -7.179 -6.183 1.00 . B B . 17 LEU N 1 1 9 6770 2 2 17 LEU O O 7.548 -8.896 -3.912 1.00 . B B . 17 LEU O 1 1 9 6771 2 2 18 VAL C C 4.695 -9.095 -1.858 1.00 . B B . 18 VAL C 1 1 9 6772 2 2 18 VAL CA C 5.739 -8.020 -2.149 1.00 . B B . 18 VAL CA 1 1 9 6773 2 2 18 VAL CB C 5.423 -6.745 -1.359 1.00 . B B . 18 VAL CB 1 1 9 6774 2 2 18 VAL CG1 C 6.092 -5.558 -2.038 1.00 . B B . 18 VAL CG1 1 1 9 6775 2 2 18 VAL CG2 C 3.911 -6.506 -1.314 1.00 . B B . 18 VAL CG2 1 1 9 6776 2 2 18 VAL H H 5.014 -7.167 -3.988 1.00 . B B . 18 VAL H 1 1 9 6777 2 2 18 VAL HA H 6.716 -8.385 -1.867 1.00 . B B . 18 VAL HA 1 1 9 6778 2 2 18 VAL HB H 5.804 -6.843 -0.354 1.00 . B B . 18 VAL HB 1 1 9 6779 2 2 18 VAL HG11 H 6.709 -5.913 -2.851 1.00 . B B . 18 VAL HG11 1 1 9 6780 2 2 18 VAL HG12 H 6.703 -5.035 -1.322 1.00 . B B . 18 VAL HG12 1 1 9 6781 2 2 18 VAL HG13 H 5.334 -4.894 -2.423 1.00 . B B . 18 VAL HG13 1 1 9 6782 2 2 18 VAL HG21 H 3.439 -7.293 -0.747 1.00 . B B . 18 VAL HG21 1 1 9 6783 2 2 18 VAL HG22 H 3.518 -6.499 -2.319 1.00 . B B . 18 VAL HG22 1 1 9 6784 2 2 18 VAL HG23 H 3.713 -5.554 -0.842 1.00 . B B . 18 VAL HG23 1 1 9 6785 2 2 18 VAL N N 5.726 -7.720 -3.606 1.00 . B B . 18 VAL N 1 1 9 6786 2 2 18 VAL O O 4.926 -10.014 -1.097 1.00 . B B . 18 VAL O 1 1 9 6787 2 2 19 CYS C C 2.443 -10.977 -3.405 1.00 . B B . 19 CYS C 1 1 9 6788 2 2 19 CYS CA C 2.489 -10.003 -2.225 1.00 . B B . 19 CYS CA 1 1 9 6789 2 2 19 CYS CB C 1.134 -9.310 -2.083 1.00 . B B . 19 CYS CB 1 1 9 6790 2 2 19 CYS H H 3.378 -8.242 -3.075 1.00 . B B . 19 CYS H 1 1 9 6791 2 2 19 CYS HA H 2.715 -10.541 -1.320 1.00 . B B . 19 CYS HA 1 1 9 6792 2 2 19 CYS HB2 H 1.121 -8.418 -2.690 1.00 . B B . 19 CYS HB2 1 1 9 6793 2 2 19 CYS HB3 H 0.351 -9.980 -2.410 1.00 . B B . 19 CYS HB3 1 1 9 6794 2 2 19 CYS N N 3.544 -8.989 -2.463 1.00 . B B . 19 CYS N 1 1 9 6795 2 2 19 CYS O O 2.508 -12.177 -3.234 1.00 . B B . 19 CYS O 1 1 9 6796 2 2 19 CYS SG S 0.863 -8.869 -0.350 1.00 . B B . 19 CYS SG 1 1 9 6797 2 2 20 GLY C C 0.832 -11.798 -6.037 1.00 . B B . 20 GLY C 1 1 9 6798 2 2 20 GLY CA C 2.278 -11.362 -5.793 1.00 . B B . 20 GLY CA 1 1 9 6799 2 2 20 GLY H H 2.279 -9.494 -4.718 1.00 . B B . 20 GLY H 1 1 9 6800 2 2 20 GLY HA2 H 2.649 -10.831 -6.659 1.00 . B B . 20 GLY HA2 1 1 9 6801 2 2 20 GLY HA3 H 2.889 -12.234 -5.615 1.00 . B B . 20 GLY HA3 1 1 9 6802 2 2 20 GLY N N 2.330 -10.466 -4.603 1.00 . B B . 20 GLY N 1 1 9 6803 2 2 20 GLY O O 0.020 -11.040 -6.528 1.00 . B B . 20 GLY O 1 1 9 6804 2 2 21 GLU C C -1.665 -13.379 -4.580 1.00 . B B . 21 GLU C 1 1 9 6805 2 2 21 GLU CA C -0.892 -13.491 -5.898 1.00 . B B . 21 GLU CA 1 1 9 6806 2 2 21 GLU CB C -0.873 -14.951 -6.360 1.00 . B B . 21 GLU CB 1 1 9 6807 2 2 21 GLU CD C 0.009 -17.231 -5.842 1.00 . B B . 21 GLU CD 1 1 9 6808 2 2 21 GLU CG C 0.148 -15.738 -5.536 1.00 . B B . 21 GLU CG 1 1 9 6809 2 2 21 GLU H H 1.171 -13.607 -5.293 1.00 . B B . 21 GLU H 1 1 9 6810 2 2 21 GLU HA H -1.373 -12.882 -6.648 1.00 . B B . 21 GLU HA 1 1 9 6811 2 2 21 GLU HB2 H -1.855 -15.382 -6.229 1.00 . B B . 21 GLU HB2 1 1 9 6812 2 2 21 GLU HB3 H -0.598 -14.992 -7.405 1.00 . B B . 21 GLU HB3 1 1 9 6813 2 2 21 GLU HG2 H 1.146 -15.409 -5.788 1.00 . B B . 21 GLU HG2 1 1 9 6814 2 2 21 GLU HG3 H -0.032 -15.569 -4.485 1.00 . B B . 21 GLU HG3 1 1 9 6815 2 2 21 GLU N N 0.503 -13.012 -5.691 1.00 . B B . 21 GLU N 1 1 9 6816 2 2 21 GLU O O -2.813 -13.764 -4.487 1.00 . B B . 21 GLU O 1 1 9 6817 2 2 21 GLU OE1 O -1.106 -17.665 -6.083 1.00 . B B . 21 GLU OE1 1 1 9 6818 2 2 21 GLU OE2 O 1.020 -17.914 -5.831 1.00 . B B . 21 GLU OE2 1 1 9 6819 2 2 22 ARG C C -2.917 -11.747 -2.413 1.00 . B B . 22 ARG C 1 1 9 6820 2 2 22 ARG CA C -1.741 -12.709 -2.253 1.00 . B B . 22 ARG CA 1 1 9 6821 2 2 22 ARG CB C -0.763 -12.144 -1.220 1.00 . B B . 22 ARG CB 1 1 9 6822 2 2 22 ARG CD C -1.670 -13.872 0.336 1.00 . B B . 22 ARG CD 1 1 9 6823 2 2 22 ARG CG C -0.394 -13.229 -0.207 1.00 . B B . 22 ARG CG 1 1 9 6824 2 2 22 ARG CZ C -0.621 -15.480 1.814 1.00 . B B . 22 ARG CZ 1 1 9 6825 2 2 22 ARG H H -0.120 -12.546 -3.651 1.00 . B B . 22 ARG H 1 1 9 6826 2 2 22 ARG HA H -2.101 -13.672 -1.927 1.00 . B B . 22 ARG HA 1 1 9 6827 2 2 22 ARG HB2 H 0.130 -11.803 -1.724 1.00 . B B . 22 ARG HB2 1 1 9 6828 2 2 22 ARG HB3 H -1.222 -11.314 -0.704 1.00 . B B . 22 ARG HB3 1 1 9 6829 2 2 22 ARG HD2 H -2.445 -13.123 0.407 1.00 . B B . 22 ARG HD2 1 1 9 6830 2 2 22 ARG HD3 H -1.990 -14.655 -0.336 1.00 . B B . 22 ARG HD3 1 1 9 6831 2 2 22 ARG HE H -1.833 -14.053 2.476 1.00 . B B . 22 ARG HE 1 1 9 6832 2 2 22 ARG HG2 H 0.213 -13.981 -0.691 1.00 . B B . 22 ARG HG2 1 1 9 6833 2 2 22 ARG HG3 H 0.160 -12.789 0.607 1.00 . B B . 22 ARG HG3 1 1 9 6834 2 2 22 ARG HH11 H -1.038 -16.224 0.002 1.00 . B B . 22 ARG HH11 1 1 9 6835 2 2 22 ARG HH12 H 0.093 -17.137 0.945 1.00 . B B . 22 ARG HH12 1 1 9 6836 2 2 22 ARG HH21 H -0.027 -14.982 3.659 1.00 . B B . 22 ARG HH21 1 1 9 6837 2 2 22 ARG HH22 H 0.661 -16.437 3.017 1.00 . B B . 22 ARG HH22 1 1 9 6838 2 2 22 ARG N N -1.044 -12.851 -3.559 1.00 . B B . 22 ARG N 1 1 9 6839 2 2 22 ARG NE N -1.410 -14.448 1.685 1.00 . B B . 22 ARG NE 1 1 9 6840 2 2 22 ARG NH1 N -0.514 -16.348 0.845 1.00 . B B . 22 ARG NH1 1 1 9 6841 2 2 22 ARG NH2 N 0.058 -15.646 2.916 1.00 . B B . 22 ARG NH2 1 1 9 6842 2 2 22 ARG O O -3.804 -11.686 -1.585 1.00 . B B . 22 ARG O 1 1 9 6843 2 2 23 GLY C C -3.774 -8.767 -2.862 1.00 . B B . 23 GLY C 1 1 9 6844 2 2 23 GLY CA C -4.035 -10.023 -3.691 1.00 . B B . 23 GLY CA 1 1 9 6845 2 2 23 GLY H H -2.194 -11.055 -4.122 1.00 . B B . 23 GLY H 1 1 9 6846 2 2 23 GLY HA2 H -4.086 -9.764 -4.739 1.00 . B B . 23 GLY HA2 1 1 9 6847 2 2 23 GLY HA3 H -4.969 -10.467 -3.382 1.00 . B B . 23 GLY HA3 1 1 9 6848 2 2 23 GLY N N -2.925 -10.990 -3.473 1.00 . B B . 23 GLY N 1 1 9 6849 2 2 23 GLY O O -4.035 -8.728 -1.676 1.00 . B B . 23 GLY O 1 1 9 6850 2 2 24 PHE C C -3.892 -5.374 -3.183 1.00 . B B . 24 PHE C 1 1 9 6851 2 2 24 PHE CA C -2.966 -6.492 -2.711 1.00 . B B . 24 PHE CA 1 1 9 6852 2 2 24 PHE CB C -1.514 -6.075 -2.944 1.00 . B B . 24 PHE CB 1 1 9 6853 2 2 24 PHE CD1 C -0.904 -7.054 -5.184 1.00 . B B . 24 PHE CD1 1 1 9 6854 2 2 24 PHE CD2 C -1.412 -4.686 -5.043 1.00 . B B . 24 PHE CD2 1 1 9 6855 2 2 24 PHE CE1 C -0.680 -6.924 -6.561 1.00 . B B . 24 PHE CE1 1 1 9 6856 2 2 24 PHE CE2 C -1.187 -4.555 -6.420 1.00 . B B . 24 PHE CE2 1 1 9 6857 2 2 24 PHE CG C -1.269 -5.935 -4.426 1.00 . B B . 24 PHE CG 1 1 9 6858 2 2 24 PHE CZ C -0.821 -5.674 -7.179 1.00 . B B . 24 PHE CZ 1 1 9 6859 2 2 24 PHE H H -3.042 -7.791 -4.428 1.00 . B B . 24 PHE H 1 1 9 6860 2 2 24 PHE HA H -3.125 -6.669 -1.660 1.00 . B B . 24 PHE HA 1 1 9 6861 2 2 24 PHE HB2 H -1.329 -5.129 -2.456 1.00 . B B . 24 PHE HB2 1 1 9 6862 2 2 24 PHE HB3 H -0.852 -6.827 -2.539 1.00 . B B . 24 PHE HB3 1 1 9 6863 2 2 24 PHE HD1 H -0.795 -8.017 -4.708 1.00 . B B . 24 PHE HD1 1 1 9 6864 2 2 24 PHE HD2 H -1.694 -3.823 -4.458 1.00 . B B . 24 PHE HD2 1 1 9 6865 2 2 24 PHE HE1 H -0.400 -7.788 -7.146 1.00 . B B . 24 PHE HE1 1 1 9 6866 2 2 24 PHE HE2 H -1.301 -3.591 -6.896 1.00 . B B . 24 PHE HE2 1 1 9 6867 2 2 24 PHE HZ H -0.645 -5.573 -8.240 1.00 . B B . 24 PHE HZ 1 1 9 6868 2 2 24 PHE N N -3.251 -7.740 -3.472 1.00 . B B . 24 PHE N 1 1 9 6869 2 2 24 PHE O O -4.004 -5.100 -4.361 1.00 . B B . 24 PHE O 1 1 9 6870 2 2 25 PHE C C -4.747 -2.279 -2.436 1.00 . B B . 25 PHE C 1 1 9 6871 2 2 25 PHE CA C -5.461 -3.611 -2.659 1.00 . B B . 25 PHE CA 1 1 9 6872 2 2 25 PHE CB C -6.724 -3.663 -1.801 1.00 . B B . 25 PHE CB 1 1 9 6873 2 2 25 PHE CD1 C -6.262 -2.250 0.234 1.00 . B B . 25 PHE CD1 1 1 9 6874 2 2 25 PHE CD2 C -6.077 -4.662 0.423 1.00 . B B . 25 PHE CD2 1 1 9 6875 2 2 25 PHE CE1 C -5.910 -2.116 1.583 1.00 . B B . 25 PHE CE1 1 1 9 6876 2 2 25 PHE CE2 C -5.725 -4.529 1.773 1.00 . B B . 25 PHE CE2 1 1 9 6877 2 2 25 PHE CG C -6.346 -3.522 -0.347 1.00 . B B . 25 PHE CG 1 1 9 6878 2 2 25 PHE CZ C -5.642 -3.255 2.353 1.00 . B B . 25 PHE CZ 1 1 9 6879 2 2 25 PHE H H -4.439 -4.952 -1.323 1.00 . B B . 25 PHE H 1 1 9 6880 2 2 25 PHE HA H -5.724 -3.711 -3.701 1.00 . B B . 25 PHE HA 1 1 9 6881 2 2 25 PHE HB2 H -7.384 -2.855 -2.083 1.00 . B B . 25 PHE HB2 1 1 9 6882 2 2 25 PHE HB3 H -7.226 -4.608 -1.952 1.00 . B B . 25 PHE HB3 1 1 9 6883 2 2 25 PHE HD1 H -6.468 -1.372 -0.360 1.00 . B B . 25 PHE HD1 1 1 9 6884 2 2 25 PHE HD2 H -6.140 -5.644 -0.024 1.00 . B B . 25 PHE HD2 1 1 9 6885 2 2 25 PHE HE1 H -5.845 -1.136 2.030 1.00 . B B . 25 PHE HE1 1 1 9 6886 2 2 25 PHE HE2 H -5.518 -5.407 2.367 1.00 . B B . 25 PHE HE2 1 1 9 6887 2 2 25 PHE HZ H -5.369 -3.152 3.393 1.00 . B B . 25 PHE HZ 1 1 9 6888 2 2 25 PHE N N -4.550 -4.719 -2.269 1.00 . B B . 25 PHE N 1 1 9 6889 2 2 25 PHE O O -4.182 -2.037 -1.387 1.00 . B B . 25 PHE O 1 1 9 6890 2 2 26 TYR C C -5.102 1.032 -3.259 1.00 . B B . 26 TYR C 1 1 9 6891 2 2 26 TYR CA C -4.071 -0.102 -3.240 1.00 . B B . 26 TYR CA 1 1 9 6892 2 2 26 TYR CB C -3.058 0.098 -4.375 1.00 . B B . 26 TYR CB 1 1 9 6893 2 2 26 TYR CD1 C -4.055 1.826 -5.916 1.00 . B B . 26 TYR CD1 1 1 9 6894 2 2 26 TYR CD2 C -4.178 -0.514 -6.551 1.00 . B B . 26 TYR CD2 1 1 9 6895 2 2 26 TYR CE1 C -4.728 2.180 -7.092 1.00 . B B . 26 TYR CE1 1 1 9 6896 2 2 26 TYR CE2 C -4.850 -0.159 -7.727 1.00 . B B . 26 TYR CE2 1 1 9 6897 2 2 26 TYR CG C -3.781 0.478 -5.645 1.00 . B B . 26 TYR CG 1 1 9 6898 2 2 26 TYR CZ C -5.126 1.187 -7.998 1.00 . B B . 26 TYR CZ 1 1 9 6899 2 2 26 TYR H H -5.216 -1.626 -4.250 1.00 . B B . 26 TYR H 1 1 9 6900 2 2 26 TYR HA H -3.551 -0.094 -2.293 1.00 . B B . 26 TYR HA 1 1 9 6901 2 2 26 TYR HB2 H -2.369 0.884 -4.104 1.00 . B B . 26 TYR HB2 1 1 9 6902 2 2 26 TYR HB3 H -2.511 -0.819 -4.535 1.00 . B B . 26 TYR HB3 1 1 9 6903 2 2 26 TYR HD1 H -3.748 2.591 -5.219 1.00 . B B . 26 TYR HD1 1 1 9 6904 2 2 26 TYR HD2 H -3.965 -1.550 -6.342 1.00 . B B . 26 TYR HD2 1 1 9 6905 2 2 26 TYR HE1 H -4.941 3.217 -7.301 1.00 . B B . 26 TYR HE1 1 1 9 6906 2 2 26 TYR HE2 H -5.156 -0.924 -8.425 1.00 . B B . 26 TYR HE2 1 1 9 6907 2 2 26 TYR HH H -5.379 2.331 -9.505 1.00 . B B . 26 TYR HH 1 1 9 6908 2 2 26 TYR N N -4.759 -1.414 -3.410 1.00 . B B . 26 TYR N 1 1 9 6909 2 2 26 TYR O O -4.763 2.187 -3.417 1.00 . B B . 26 TYR O 1 1 9 6910 2 2 26 TYR OH O -5.789 1.536 -9.157 1.00 . B B . 26 TYR OH 1 1 9 6911 2 2 27 THR C C -7.464 2.432 -1.718 1.00 . B B . 27 THR C 1 1 9 6912 2 2 27 THR CA C -7.398 1.782 -3.101 1.00 . B B . 27 THR CA 1 1 9 6913 2 2 27 THR CB C -8.760 1.176 -3.451 1.00 . B B . 27 THR CB 1 1 9 6914 2 2 27 THR CG2 C -9.183 0.195 -2.359 1.00 . B B . 27 THR CG2 1 1 9 6915 2 2 27 THR H H -6.616 -0.222 -2.965 1.00 . B B . 27 THR H 1 1 9 6916 2 2 27 THR HA H -7.138 2.531 -3.836 1.00 . B B . 27 THR HA 1 1 9 6917 2 2 27 THR HB H -8.691 0.652 -4.392 1.00 . B B . 27 THR HB 1 1 9 6918 2 2 27 THR HG1 H -10.519 1.841 -3.940 1.00 . B B . 27 THR HG1 1 1 9 6919 2 2 27 THR HG21 H -8.405 0.126 -1.615 1.00 . B B . 27 THR HG21 1 1 9 6920 2 2 27 THR HG22 H -9.353 -0.778 -2.796 1.00 . B B . 27 THR HG22 1 1 9 6921 2 2 27 THR HG23 H -10.095 0.545 -1.895 1.00 . B B . 27 THR HG23 1 1 9 6922 2 2 27 THR N N -6.358 0.715 -3.095 1.00 . B B . 27 THR N 1 1 9 6923 2 2 27 THR O O -6.492 2.453 -0.990 1.00 . B B . 27 THR O 1 1 9 6924 2 2 27 THR OG1 O -9.723 2.214 -3.555 1.00 . B B . 27 THR OG1 1 1 9 6925 2 2 28 LYS C C -7.980 2.794 1.036 1.00 . B B . 28 LYS C 1 1 9 6926 2 2 28 LYS CA C -8.733 3.621 -0.017 1.00 . B B . 28 LYS CA 1 1 9 6927 2 2 28 LYS CB C -10.217 3.706 0.364 1.00 . B B . 28 LYS CB 1 1 9 6928 2 2 28 LYS CD C -12.253 2.297 0.717 1.00 . B B . 28 LYS CD 1 1 9 6929 2 2 28 LYS CE C -12.816 1.561 1.936 1.00 . B B . 28 LYS CE 1 1 9 6930 2 2 28 LYS CG C -10.724 2.326 0.794 1.00 . B B . 28 LYS CG 1 1 9 6931 2 2 28 LYS H H -9.369 2.942 -1.961 1.00 . B B . 28 LYS H 1 1 9 6932 2 2 28 LYS HA H -8.320 4.616 -0.068 1.00 . B B . 28 LYS HA 1 1 9 6933 2 2 28 LYS HB2 H -10.338 4.404 1.180 1.00 . B B . 28 LYS HB2 1 1 9 6934 2 2 28 LYS HB3 H -10.786 4.046 -0.487 1.00 . B B . 28 LYS HB3 1 1 9 6935 2 2 28 LYS HD2 H -12.631 3.309 0.702 1.00 . B B . 28 LYS HD2 1 1 9 6936 2 2 28 LYS HD3 H -12.557 1.785 -0.182 1.00 . B B . 28 LYS HD3 1 1 9 6937 2 2 28 LYS HE2 H -12.571 2.109 2.833 1.00 . B B . 28 LYS HE2 1 1 9 6938 2 2 28 LYS HE3 H -13.889 1.482 1.842 1.00 . B B . 28 LYS HE3 1 1 9 6939 2 2 28 LYS HG2 H -10.315 1.572 0.138 1.00 . B B . 28 LYS HG2 1 1 9 6940 2 2 28 LYS HG3 H -10.412 2.129 1.809 1.00 . B B . 28 LYS HG3 1 1 9 6941 2 2 28 LYS HZ1 H -12.218 -0.234 1.064 1.00 . B B . 28 LYS HZ1 1 1 9 6942 2 2 28 LYS HZ2 H -12.789 -0.392 2.657 1.00 . B B . 28 LYS HZ2 1 1 9 6943 2 2 28 LYS HZ3 H -11.247 0.260 2.364 1.00 . B B . 28 LYS HZ3 1 1 9 6944 2 2 28 LYS N N -8.602 2.967 -1.353 1.00 . B B . 28 LYS N 1 1 9 6945 2 2 28 LYS NZ N -12.223 0.196 2.011 1.00 . B B . 28 LYS NZ 1 1 9 6946 2 2 28 LYS O O -8.229 1.615 1.181 1.00 . B B . 28 LYS O 1 1 9 6947 2 2 29 PRO C C -7.082 2.621 4.063 1.00 . B B . 29 PRO C 1 1 9 6948 2 2 29 PRO CA C -6.268 2.770 2.776 1.00 . B B . 29 PRO CA 1 1 9 6949 2 2 29 PRO CB C -5.091 3.727 2.984 1.00 . B B . 29 PRO CB 1 1 9 6950 2 2 29 PRO CD C -6.769 4.870 1.564 1.00 . B B . 29 PRO CD 1 1 9 6951 2 2 29 PRO CG C -5.567 5.116 2.497 1.00 . B B . 29 PRO CG 1 1 9 6952 2 2 29 PRO HA H -5.911 1.813 2.432 1.00 . B B . 29 PRO HA 1 1 9 6953 2 2 29 PRO HB2 H -4.828 3.766 4.034 1.00 . B B . 29 PRO HB2 1 1 9 6954 2 2 29 PRO HB3 H -4.244 3.407 2.399 1.00 . B B . 29 PRO HB3 1 1 9 6955 2 2 29 PRO HD2 H -7.611 5.478 1.867 1.00 . B B . 29 PRO HD2 1 1 9 6956 2 2 29 PRO HD3 H -6.502 5.075 0.539 1.00 . B B . 29 PRO HD3 1 1 9 6957 2 2 29 PRO HG2 H -5.867 5.719 3.342 1.00 . B B . 29 PRO HG2 1 1 9 6958 2 2 29 PRO HG3 H -4.777 5.608 1.951 1.00 . B B . 29 PRO HG3 1 1 9 6959 2 2 29 PRO N N -7.074 3.434 1.737 1.00 . B B . 29 PRO N 1 1 9 6960 2 2 29 PRO O O -8.115 3.239 4.230 1.00 . B B . 29 PRO O 1 1 9 6961 2 2 30 THR C C -8.867 1.471 5.941 1.00 . B B . 30 THR C 1 1 9 6962 2 2 30 THR CA C -7.375 1.624 6.247 1.00 . B B . 30 THR CA 1 1 9 6963 2 2 30 THR CB C -7.158 2.846 7.143 1.00 . B B . 30 THR CB 1 1 9 6964 2 2 30 THR CG2 C -6.796 2.388 8.556 1.00 . B B . 30 THR CG2 1 1 9 6965 2 2 30 THR H H -5.790 1.318 4.822 1.00 . B B . 30 THR H 1 1 9 6966 2 2 30 THR HA H -7.019 0.739 6.752 1.00 . B B . 30 THR HA 1 1 9 6967 2 2 30 THR HB H -8.062 3.434 7.179 1.00 . B B . 30 THR HB 1 1 9 6968 2 2 30 THR HG1 H -6.004 4.412 7.166 1.00 . B B . 30 THR HG1 1 1 9 6969 2 2 30 THR HG21 H -5.738 2.527 8.720 1.00 . B B . 30 THR HG21 1 1 9 6970 2 2 30 THR HG22 H -7.044 1.343 8.670 1.00 . B B . 30 THR HG22 1 1 9 6971 2 2 30 THR HG23 H -7.352 2.970 9.277 1.00 . B B . 30 THR HG23 1 1 9 6972 2 2 30 THR N N -6.626 1.806 4.974 1.00 . B B . 30 THR N 1 1 9 6973 2 2 30 THR O O -9.247 0.419 5.454 1.00 . B B . 30 THR O 1 1 9 6974 2 2 30 THR OXT O -9.605 2.409 6.196 1.00 . B B . 30 THR OXT 1 1 9 6975 2 2 30 THR OG1 O -6.100 3.633 6.612 1.00 . B B . 30 THR OG1 1 1 10 6976 1 1 1 GLY C C -3.310 7.533 0.737 1.00 . A A . 1 GLY C 1 1 10 6977 1 1 1 GLY CA C -4.719 7.926 1.037 1.00 . A A . 1 GLY CA 1 1 10 6978 1 1 1 GLY H1 H -6.245 6.506 1.402 1.00 . A A . 1 GLY H1 1 1 10 6979 1 1 1 GLY H2 H -6.080 7.662 2.635 1.00 . A A . 1 GLY H2 1 1 10 6980 1 1 1 GLY H3 H -4.946 6.405 2.491 1.00 . A A . 1 GLY H3 1 1 10 6981 1 1 1 GLY HA2 H -4.875 7.699 0.102 1.00 . A A . 1 GLY HA2 1 1 10 6982 1 1 1 GLY HA3 H -4.983 9.037 1.284 1.00 . A A . 1 GLY HA3 1 1 10 6983 1 1 1 GLY N N -5.565 7.055 1.966 1.00 . A A . 1 GLY N 1 1 10 6984 1 1 1 GLY O O -2.374 8.205 1.121 1.00 . A A . 1 GLY O 1 1 10 6985 1 1 2 ILE C C -1.469 6.326 -1.765 1.00 . A A . 2 ILE C 1 1 10 6986 1 1 2 ILE CA C -1.734 6.011 -0.295 1.00 . A A . 2 ILE CA 1 1 10 6987 1 1 2 ILE CB C -1.597 4.510 -0.049 1.00 . A A . 2 ILE CB 1 1 10 6988 1 1 2 ILE CD1 C -0.141 3.523 -1.870 1.00 . A A . 2 ILE CD1 1 1 10 6989 1 1 2 ILE CG1 C -0.175 4.056 -0.432 1.00 . A A . 2 ILE CG1 1 1 10 6990 1 1 2 ILE CG2 C -2.650 3.764 -0.874 1.00 . A A . 2 ILE CG2 1 1 10 6991 1 1 2 ILE H H -3.884 5.920 -0.270 1.00 . A A . 2 ILE H 1 1 10 6992 1 1 2 ILE HA H -1.029 6.544 0.321 1.00 . A A . 2 ILE HA 1 1 10 6993 1 1 2 ILE HB H -1.766 4.309 1.000 1.00 . A A . 2 ILE HB 1 1 10 6994 1 1 2 ILE HD11 H 0.885 3.412 -2.188 1.00 . A A . 2 ILE HD11 1 1 10 6995 1 1 2 ILE HD12 H -0.646 4.219 -2.523 1.00 . A A . 2 ILE HD12 1 1 10 6996 1 1 2 ILE HD13 H -0.636 2.565 -1.912 1.00 . A A . 2 ILE HD13 1 1 10 6997 1 1 2 ILE HG12 H 0.499 4.897 -0.351 1.00 . A A . 2 ILE HG12 1 1 10 6998 1 1 2 ILE HG13 H 0.146 3.278 0.244 1.00 . A A . 2 ILE HG13 1 1 10 6999 1 1 2 ILE HG21 H -3.566 3.696 -0.308 1.00 . A A . 2 ILE HG21 1 1 10 7000 1 1 2 ILE HG22 H -2.292 2.774 -1.103 1.00 . A A . 2 ILE HG22 1 1 10 7001 1 1 2 ILE HG23 H -2.832 4.304 -1.792 1.00 . A A . 2 ILE HG23 1 1 10 7002 1 1 2 ILE N N -3.118 6.445 0.041 1.00 . A A . 2 ILE N 1 1 10 7003 1 1 2 ILE O O -0.349 6.558 -2.175 1.00 . A A . 2 ILE O 1 1 10 7004 1 1 3 VAL C C -1.562 7.977 -4.143 1.00 . A A . 3 VAL C 1 1 10 7005 1 1 3 VAL CA C -2.338 6.663 -4.002 1.00 . A A . 3 VAL CA 1 1 10 7006 1 1 3 VAL CB C -3.731 6.798 -4.635 1.00 . A A . 3 VAL CB 1 1 10 7007 1 1 3 VAL CG1 C -3.667 7.667 -5.894 1.00 . A A . 3 VAL CG1 1 1 10 7008 1 1 3 VAL CG2 C -4.253 5.408 -5.004 1.00 . A A . 3 VAL CG2 1 1 10 7009 1 1 3 VAL H H -3.396 6.170 -2.198 1.00 . A A . 3 VAL H 1 1 10 7010 1 1 3 VAL HA H -1.794 5.865 -4.488 1.00 . A A . 3 VAL HA 1 1 10 7011 1 1 3 VAL HB H -4.402 7.254 -3.920 1.00 . A A . 3 VAL HB 1 1 10 7012 1 1 3 VAL HG11 H -4.516 7.449 -6.524 1.00 . A A . 3 VAL HG11 1 1 10 7013 1 1 3 VAL HG12 H -2.755 7.457 -6.432 1.00 . A A . 3 VAL HG12 1 1 10 7014 1 1 3 VAL HG13 H -3.687 8.710 -5.612 1.00 . A A . 3 VAL HG13 1 1 10 7015 1 1 3 VAL HG21 H -5.294 5.330 -4.725 1.00 . A A . 3 VAL HG21 1 1 10 7016 1 1 3 VAL HG22 H -3.683 4.657 -4.478 1.00 . A A . 3 VAL HG22 1 1 10 7017 1 1 3 VAL HG23 H -4.153 5.257 -6.068 1.00 . A A . 3 VAL HG23 1 1 10 7018 1 1 3 VAL N N -2.503 6.350 -2.558 1.00 . A A . 3 VAL N 1 1 10 7019 1 1 3 VAL O O -0.803 8.166 -5.074 1.00 . A A . 3 VAL O 1 1 10 7020 1 1 4 GLU C C 0.175 10.170 -2.373 1.00 . A A . 4 GLU C 1 1 10 7021 1 1 4 GLU CA C -1.034 10.193 -3.311 1.00 . A A . 4 GLU CA 1 1 10 7022 1 1 4 GLU CB C -1.983 11.321 -2.901 1.00 . A A . 4 GLU CB 1 1 10 7023 1 1 4 GLU CD C -2.162 13.784 -2.517 1.00 . A A . 4 GLU CD 1 1 10 7024 1 1 4 GLU CG C -1.191 12.616 -2.711 1.00 . A A . 4 GLU CG 1 1 10 7025 1 1 4 GLU H H -2.372 8.718 -2.490 1.00 . A A . 4 GLU H 1 1 10 7026 1 1 4 GLU HA H -0.699 10.356 -4.325 1.00 . A A . 4 GLU HA 1 1 10 7027 1 1 4 GLU HB2 H -2.725 11.462 -3.671 1.00 . A A . 4 GLU HB2 1 1 10 7028 1 1 4 GLU HB3 H -2.472 11.061 -1.974 1.00 . A A . 4 GLU HB3 1 1 10 7029 1 1 4 GLU HG2 H -0.557 12.526 -1.841 1.00 . A A . 4 GLU HG2 1 1 10 7030 1 1 4 GLU HG3 H -0.582 12.798 -3.583 1.00 . A A . 4 GLU HG3 1 1 10 7031 1 1 4 GLU N N -1.753 8.890 -3.229 1.00 . A A . 4 GLU N 1 1 10 7032 1 1 4 GLU O O 1.234 10.671 -2.695 1.00 . A A . 4 GLU O 1 1 10 7033 1 1 4 GLU OE1 O -2.566 14.012 -1.389 1.00 . A A . 4 GLU OE1 1 1 10 7034 1 1 4 GLU OE2 O -2.487 14.429 -3.501 1.00 . A A . 4 GLU OE2 1 1 10 7035 1 1 5 GLN C C 2.278 8.654 -0.825 1.00 . A A . 5 GLN C 1 1 10 7036 1 1 5 GLN CA C 1.167 9.538 -0.253 1.00 . A A . 5 GLN CA 1 1 10 7037 1 1 5 GLN CB C 0.687 8.958 1.079 1.00 . A A . 5 GLN CB 1 1 10 7038 1 1 5 GLN CD C 1.255 9.528 3.447 1.00 . A A . 5 GLN CD 1 1 10 7039 1 1 5 GLN CG C 0.667 10.061 2.139 1.00 . A A . 5 GLN CG 1 1 10 7040 1 1 5 GLN H H -0.836 9.194 -0.972 1.00 . A A . 5 GLN H 1 1 10 7041 1 1 5 GLN HA H 1.549 10.535 -0.093 1.00 . A A . 5 GLN HA 1 1 10 7042 1 1 5 GLN HB2 H -0.308 8.555 0.960 1.00 . A A . 5 GLN HB2 1 1 10 7043 1 1 5 GLN HB3 H 1.358 8.172 1.393 1.00 . A A . 5 GLN HB3 1 1 10 7044 1 1 5 GLN HE21 H -0.503 8.945 4.163 1.00 . A A . 5 GLN HE21 1 1 10 7045 1 1 5 GLN HE22 H 0.827 8.655 5.178 1.00 . A A . 5 GLN HE22 1 1 10 7046 1 1 5 GLN HG2 H 1.256 10.900 1.795 1.00 . A A . 5 GLN HG2 1 1 10 7047 1 1 5 GLN HG3 H -0.349 10.381 2.308 1.00 . A A . 5 GLN HG3 1 1 10 7048 1 1 5 GLN N N 0.026 9.592 -1.212 1.00 . A A . 5 GLN N 1 1 10 7049 1 1 5 GLN NE2 N 0.461 8.998 4.336 1.00 . A A . 5 GLN NE2 1 1 10 7050 1 1 5 GLN O O 3.445 8.982 -0.747 1.00 . A A . 5 GLN O 1 1 10 7051 1 1 5 GLN OE1 O 2.449 9.593 3.662 1.00 . A A . 5 GLN OE1 1 1 10 7052 1 1 6 CYS C C 3.387 7.167 -3.348 1.00 . A A . 6 CYS C 1 1 10 7053 1 1 6 CYS CA C 2.967 6.640 -1.978 1.00 . A A . 6 CYS CA 1 1 10 7054 1 1 6 CYS CB C 2.396 5.233 -2.138 1.00 . A A . 6 CYS CB 1 1 10 7055 1 1 6 CYS H H 0.980 7.292 -1.455 1.00 . A A . 6 CYS H 1 1 10 7056 1 1 6 CYS HA H 3.825 6.609 -1.323 1.00 . A A . 6 CYS HA 1 1 10 7057 1 1 6 CYS HB2 H 1.321 5.288 -2.181 1.00 . A A . 6 CYS HB2 1 1 10 7058 1 1 6 CYS HB3 H 2.770 4.796 -3.051 1.00 . A A . 6 CYS HB3 1 1 10 7059 1 1 6 CYS N N 1.927 7.538 -1.401 1.00 . A A . 6 CYS N 1 1 10 7060 1 1 6 CYS O O 4.482 6.917 -3.810 1.00 . A A . 6 CYS O 1 1 10 7061 1 1 6 CYS SG S 2.893 4.211 -0.730 1.00 . A A . 6 CYS SG 1 1 10 7062 1 1 7 CYS C C 3.634 9.746 -5.173 1.00 . A A . 7 CYS C 1 1 10 7063 1 1 7 CYS CA C 2.888 8.421 -5.346 1.00 . A A . 7 CYS CA 1 1 10 7064 1 1 7 CYS CB C 1.615 8.640 -6.172 1.00 . A A . 7 CYS CB 1 1 10 7065 1 1 7 CYS H H 1.644 8.079 -3.623 1.00 . A A . 7 CYS H 1 1 10 7066 1 1 7 CYS HA H 3.525 7.708 -5.843 1.00 . A A . 7 CYS HA 1 1 10 7067 1 1 7 CYS HB2 H 1.004 7.752 -6.126 1.00 . A A . 7 CYS HB2 1 1 10 7068 1 1 7 CYS HB3 H 1.062 9.473 -5.761 1.00 . A A . 7 CYS HB3 1 1 10 7069 1 1 7 CYS N N 2.525 7.889 -4.007 1.00 . A A . 7 CYS N 1 1 10 7070 1 1 7 CYS O O 4.505 10.087 -5.948 1.00 . A A . 7 CYS O 1 1 10 7071 1 1 7 CYS SG S 2.034 8.990 -7.905 1.00 . A A . 7 CYS SG 1 1 10 7072 1 1 8 THR C C 4.994 11.625 -2.768 1.00 . A A . 8 THR C 1 1 10 7073 1 1 8 THR CA C 4.004 11.788 -3.923 1.00 . A A . 8 THR CA 1 1 10 7074 1 1 8 THR CB C 2.974 12.866 -3.571 1.00 . A A . 8 THR CB 1 1 10 7075 1 1 8 THR CG2 C 3.692 14.100 -3.023 1.00 . A A . 8 THR CG2 1 1 10 7076 1 1 8 THR H H 2.607 10.196 -3.534 1.00 . A A . 8 THR H 1 1 10 7077 1 1 8 THR HA H 4.537 12.075 -4.817 1.00 . A A . 8 THR HA 1 1 10 7078 1 1 8 THR HB H 2.297 12.488 -2.820 1.00 . A A . 8 THR HB 1 1 10 7079 1 1 8 THR HG1 H 2.339 12.516 -5.378 1.00 . A A . 8 THR HG1 1 1 10 7080 1 1 8 THR HG21 H 4.070 13.890 -2.034 1.00 . A A . 8 THR HG21 1 1 10 7081 1 1 8 THR HG22 H 2.999 14.927 -2.975 1.00 . A A . 8 THR HG22 1 1 10 7082 1 1 8 THR HG23 H 4.514 14.358 -3.676 1.00 . A A . 8 THR HG23 1 1 10 7083 1 1 8 THR N N 3.306 10.492 -4.154 1.00 . A A . 8 THR N 1 1 10 7084 1 1 8 THR O O 6.014 12.281 -2.712 1.00 . A A . 8 THR O 1 1 10 7085 1 1 8 THR OG1 O 2.241 13.222 -4.735 1.00 . A A . 8 THR OG1 1 1 10 7086 1 1 9 SER C C 6.211 9.118 -0.787 1.00 . A A . 9 SER C 1 1 10 7087 1 1 9 SER CA C 5.619 10.528 -0.696 1.00 . A A . 9 SER CA 1 1 10 7088 1 1 9 SER CB C 4.836 10.669 0.610 1.00 . A A . 9 SER CB 1 1 10 7089 1 1 9 SER H H 3.873 10.226 -1.919 1.00 . A A . 9 SER H 1 1 10 7090 1 1 9 SER HA H 6.415 11.257 -0.723 1.00 . A A . 9 SER HA 1 1 10 7091 1 1 9 SER HB2 H 3.794 10.834 0.389 1.00 . A A . 9 SER HB2 1 1 10 7092 1 1 9 SER HB3 H 4.939 9.763 1.190 1.00 . A A . 9 SER HB3 1 1 10 7093 1 1 9 SER HG H 4.589 12.273 1.683 1.00 . A A . 9 SER HG 1 1 10 7094 1 1 9 SER N N 4.700 10.746 -1.848 1.00 . A A . 9 SER N 1 1 10 7095 1 1 9 SER O O 5.582 8.202 -1.276 1.00 . A A . 9 SER O 1 1 10 7096 1 1 9 SER OG O 5.338 11.778 1.343 1.00 . A A . 9 SER OG 1 1 10 7097 1 1 10 ILE C C 7.455 6.692 0.703 1.00 . A A . 10 ILE C 1 1 10 7098 1 1 10 ILE CA C 8.040 7.585 -0.391 1.00 . A A . 10 ILE CA 1 1 10 7099 1 1 10 ILE CB C 9.547 7.714 -0.189 1.00 . A A . 10 ILE CB 1 1 10 7100 1 1 10 ILE CD1 C 11.444 7.950 -1.861 1.00 . A A . 10 ILE CD1 1 1 10 7101 1 1 10 ILE CG1 C 10.127 8.547 -1.349 1.00 . A A . 10 ILE CG1 1 1 10 7102 1 1 10 ILE CG2 C 10.164 6.311 -0.144 1.00 . A A . 10 ILE CG2 1 1 10 7103 1 1 10 ILE H H 7.913 9.685 0.066 1.00 . A A . 10 ILE H 1 1 10 7104 1 1 10 ILE HA H 7.844 7.146 -1.359 1.00 . A A . 10 ILE HA 1 1 10 7105 1 1 10 ILE HB H 9.739 8.217 0.749 1.00 . A A . 10 ILE HB 1 1 10 7106 1 1 10 ILE HD11 H 11.860 8.593 -2.622 1.00 . A A . 10 ILE HD11 1 1 10 7107 1 1 10 ILE HD12 H 11.257 6.972 -2.280 1.00 . A A . 10 ILE HD12 1 1 10 7108 1 1 10 ILE HD13 H 12.143 7.863 -1.043 1.00 . A A . 10 ILE HD13 1 1 10 7109 1 1 10 ILE HG12 H 9.411 8.573 -2.155 1.00 . A A . 10 ILE HG12 1 1 10 7110 1 1 10 ILE HG13 H 10.306 9.555 -1.004 1.00 . A A . 10 ILE HG13 1 1 10 7111 1 1 10 ILE HG21 H 11.159 6.369 0.270 1.00 . A A . 10 ILE HG21 1 1 10 7112 1 1 10 ILE HG22 H 10.214 5.907 -1.145 1.00 . A A . 10 ILE HG22 1 1 10 7113 1 1 10 ILE HG23 H 9.554 5.669 0.473 1.00 . A A . 10 ILE HG23 1 1 10 7114 1 1 10 ILE N N 7.416 8.936 -0.323 1.00 . A A . 10 ILE N 1 1 10 7115 1 1 10 ILE O O 7.170 7.144 1.795 1.00 . A A . 10 ILE O 1 1 10 7116 1 1 11 CYS C C 7.595 3.278 1.609 1.00 . A A . 11 CYS C 1 1 10 7117 1 1 11 CYS CA C 6.715 4.522 1.474 1.00 . A A . 11 CYS CA 1 1 10 7118 1 1 11 CYS CB C 5.277 4.100 1.122 1.00 . A A . 11 CYS CB 1 1 10 7119 1 1 11 CYS H H 7.517 5.076 -0.455 1.00 . A A . 11 CYS H 1 1 10 7120 1 1 11 CYS HA H 6.705 5.046 2.418 1.00 . A A . 11 CYS HA 1 1 10 7121 1 1 11 CYS HB2 H 5.163 3.041 1.303 1.00 . A A . 11 CYS HB2 1 1 10 7122 1 1 11 CYS HB3 H 4.585 4.642 1.752 1.00 . A A . 11 CYS HB3 1 1 10 7123 1 1 11 CYS N N 7.278 5.428 0.429 1.00 . A A . 11 CYS N 1 1 10 7124 1 1 11 CYS O O 8.185 2.813 0.654 1.00 . A A . 11 CYS O 1 1 10 7125 1 1 11 CYS SG S 4.898 4.446 -0.617 1.00 . A A . 11 CYS SG 1 1 10 7126 1 1 12 SER C C 7.655 0.281 3.048 1.00 . A A . 12 SER C 1 1 10 7127 1 1 12 SER CA C 8.538 1.531 3.003 1.00 . A A . 12 SER CA 1 1 10 7128 1 1 12 SER CB C 9.303 1.661 4.321 1.00 . A A . 12 SER CB 1 1 10 7129 1 1 12 SER H H 7.212 3.136 3.553 1.00 . A A . 12 SER H 1 1 10 7130 1 1 12 SER HA H 9.241 1.442 2.188 1.00 . A A . 12 SER HA 1 1 10 7131 1 1 12 SER HB2 H 9.763 0.719 4.568 1.00 . A A . 12 SER HB2 1 1 10 7132 1 1 12 SER HB3 H 10.071 2.417 4.218 1.00 . A A . 12 SER HB3 1 1 10 7133 1 1 12 SER HG H 8.879 2.552 5.999 1.00 . A A . 12 SER HG 1 1 10 7134 1 1 12 SER N N 7.693 2.740 2.797 1.00 . A A . 12 SER N 1 1 10 7135 1 1 12 SER O O 6.473 0.356 3.327 1.00 . A A . 12 SER O 1 1 10 7136 1 1 12 SER OG O 8.399 2.024 5.356 1.00 . A A . 12 SER OG 1 1 10 7137 1 1 13 LEU C C 6.390 -2.104 3.876 1.00 . A A . 13 LEU C 1 1 10 7138 1 1 13 LEU CA C 7.451 -2.133 2.780 1.00 . A A . 13 LEU CA 1 1 10 7139 1 1 13 LEU CB C 8.394 -3.307 3.030 1.00 . A A . 13 LEU CB 1 1 10 7140 1 1 13 LEU CD1 C 6.777 -4.774 1.816 1.00 . A A . 13 LEU CD1 1 1 10 7141 1 1 13 LEU CD2 C 8.538 -5.780 3.271 1.00 . A A . 13 LEU CD2 1 1 10 7142 1 1 13 LEU CG C 7.584 -4.600 3.104 1.00 . A A . 13 LEU CG 1 1 10 7143 1 1 13 LEU H H 9.175 -0.882 2.532 1.00 . A A . 13 LEU H 1 1 10 7144 1 1 13 LEU HA H 6.980 -2.262 1.833 1.00 . A A . 13 LEU HA 1 1 10 7145 1 1 13 LEU HB2 H 9.104 -3.374 2.223 1.00 . A A . 13 LEU HB2 1 1 10 7146 1 1 13 LEU HB3 H 8.914 -3.159 3.961 1.00 . A A . 13 LEU HB3 1 1 10 7147 1 1 13 LEU HD11 H 7.450 -4.800 0.971 1.00 . A A . 13 LEU HD11 1 1 10 7148 1 1 13 LEU HD12 H 6.093 -3.947 1.705 1.00 . A A . 13 LEU HD12 1 1 10 7149 1 1 13 LEU HD13 H 6.221 -5.698 1.863 1.00 . A A . 13 LEU HD13 1 1 10 7150 1 1 13 LEU HD21 H 9.302 -5.734 2.510 1.00 . A A . 13 LEU HD21 1 1 10 7151 1 1 13 LEU HD22 H 7.987 -6.704 3.173 1.00 . A A . 13 LEU HD22 1 1 10 7152 1 1 13 LEU HD23 H 8.996 -5.735 4.247 1.00 . A A . 13 LEU HD23 1 1 10 7153 1 1 13 LEU HG H 6.910 -4.555 3.948 1.00 . A A . 13 LEU HG 1 1 10 7154 1 1 13 LEU N N 8.227 -0.861 2.766 1.00 . A A . 13 LEU N 1 1 10 7155 1 1 13 LEU O O 5.266 -2.521 3.675 1.00 . A A . 13 LEU O 1 1 10 7156 1 1 14 TYR C C 4.405 -1.053 5.595 1.00 . A A . 14 TYR C 1 1 10 7157 1 1 14 TYR CA C 5.740 -1.567 6.136 1.00 . A A . 14 TYR CA 1 1 10 7158 1 1 14 TYR CB C 6.241 -0.631 7.236 1.00 . A A . 14 TYR CB 1 1 10 7159 1 1 14 TYR CD1 C 5.658 -2.036 9.244 1.00 . A A . 14 TYR CD1 1 1 10 7160 1 1 14 TYR CD2 C 7.998 -1.622 8.750 1.00 . A A . 14 TYR CD2 1 1 10 7161 1 1 14 TYR CE1 C 6.029 -2.798 10.361 1.00 . A A . 14 TYR CE1 1 1 10 7162 1 1 14 TYR CE2 C 8.368 -2.384 9.866 1.00 . A A . 14 TYR CE2 1 1 10 7163 1 1 14 TYR CG C 6.643 -1.448 8.440 1.00 . A A . 14 TYR CG 1 1 10 7164 1 1 14 TYR CZ C 7.384 -2.972 10.672 1.00 . A A . 14 TYR CZ 1 1 10 7165 1 1 14 TYR H H 7.645 -1.289 5.172 1.00 . A A . 14 TYR H 1 1 10 7166 1 1 14 TYR HA H 5.604 -2.559 6.542 1.00 . A A . 14 TYR HA 1 1 10 7167 1 1 14 TYR HB2 H 7.094 -0.075 6.875 1.00 . A A . 14 TYR HB2 1 1 10 7168 1 1 14 TYR HB3 H 5.454 0.053 7.513 1.00 . A A . 14 TYR HB3 1 1 10 7169 1 1 14 TYR HD1 H 4.614 -1.902 9.004 1.00 . A A . 14 TYR HD1 1 1 10 7170 1 1 14 TYR HD2 H 8.756 -1.168 8.129 1.00 . A A . 14 TYR HD2 1 1 10 7171 1 1 14 TYR HE1 H 5.270 -3.252 10.981 1.00 . A A . 14 TYR HE1 1 1 10 7172 1 1 14 TYR HE2 H 9.412 -2.516 10.105 1.00 . A A . 14 TYR HE2 1 1 10 7173 1 1 14 TYR HH H 7.754 -3.149 12.536 1.00 . A A . 14 TYR HH 1 1 10 7174 1 1 14 TYR N N 6.733 -1.618 5.031 1.00 . A A . 14 TYR N 1 1 10 7175 1 1 14 TYR O O 3.406 -1.743 5.625 1.00 . A A . 14 TYR O 1 1 10 7176 1 1 14 TYR OH O 7.749 -3.725 11.769 1.00 . A A . 14 TYR OH 1 1 10 7177 1 1 15 GLN C C 2.566 -0.263 3.495 1.00 . A A . 15 GLN C 1 1 10 7178 1 1 15 GLN CA C 3.113 0.700 4.542 1.00 . A A . 15 GLN CA 1 1 10 7179 1 1 15 GLN CB C 3.381 2.061 3.897 1.00 . A A . 15 GLN CB 1 1 10 7180 1 1 15 GLN CD C 4.721 3.504 5.434 1.00 . A A . 15 GLN CD 1 1 10 7181 1 1 15 GLN CG C 3.308 3.156 4.963 1.00 . A A . 15 GLN CG 1 1 10 7182 1 1 15 GLN H H 5.201 0.685 5.060 1.00 . A A . 15 GLN H 1 1 10 7183 1 1 15 GLN HA H 2.395 0.813 5.341 1.00 . A A . 15 GLN HA 1 1 10 7184 1 1 15 GLN HB2 H 4.365 2.059 3.449 1.00 . A A . 15 GLN HB2 1 1 10 7185 1 1 15 GLN HB3 H 2.639 2.251 3.136 1.00 . A A . 15 GLN HB3 1 1 10 7186 1 1 15 GLN HE21 H 4.098 4.433 7.074 1.00 . A A . 15 GLN HE21 1 1 10 7187 1 1 15 GLN HE22 H 5.781 4.391 6.860 1.00 . A A . 15 GLN HE22 1 1 10 7188 1 1 15 GLN HG2 H 2.842 4.035 4.545 1.00 . A A . 15 GLN HG2 1 1 10 7189 1 1 15 GLN HG3 H 2.726 2.804 5.801 1.00 . A A . 15 GLN HG3 1 1 10 7190 1 1 15 GLN N N 4.382 0.150 5.088 1.00 . A A . 15 GLN N 1 1 10 7191 1 1 15 GLN NE2 N 4.881 4.165 6.549 1.00 . A A . 15 GLN NE2 1 1 10 7192 1 1 15 GLN O O 1.395 -0.585 3.482 1.00 . A A . 15 GLN O 1 1 10 7193 1 1 15 GLN OE1 O 5.691 3.168 4.785 1.00 . A A . 15 GLN OE1 1 1 10 7194 1 1 16 LEU C C 2.224 -2.854 2.249 1.00 . A A . 16 LEU C 1 1 10 7195 1 1 16 LEU CA C 2.940 -1.685 1.575 1.00 . A A . 16 LEU CA 1 1 10 7196 1 1 16 LEU CB C 4.132 -2.215 0.792 1.00 . A A . 16 LEU CB 1 1 10 7197 1 1 16 LEU CD1 C 6.097 -0.765 0.307 1.00 . A A . 16 LEU CD1 1 1 10 7198 1 1 16 LEU CD2 C 4.682 -1.589 -1.550 1.00 . A A . 16 LEU CD2 1 1 10 7199 1 1 16 LEU CG C 4.675 -1.108 -0.106 1.00 . A A . 16 LEU CG 1 1 10 7200 1 1 16 LEU H H 4.354 -0.463 2.657 1.00 . A A . 16 LEU H 1 1 10 7201 1 1 16 LEU HA H 2.270 -1.181 0.901 1.00 . A A . 16 LEU HA 1 1 10 7202 1 1 16 LEU HB2 H 4.891 -2.537 1.479 1.00 . A A . 16 LEU HB2 1 1 10 7203 1 1 16 LEU HB3 H 3.823 -3.050 0.183 1.00 . A A . 16 LEU HB3 1 1 10 7204 1 1 16 LEU HD11 H 6.131 -0.602 1.372 1.00 . A A . 16 LEU HD11 1 1 10 7205 1 1 16 LEU HD12 H 6.414 0.129 -0.208 1.00 . A A . 16 LEU HD12 1 1 10 7206 1 1 16 LEU HD13 H 6.752 -1.583 0.045 1.00 . A A . 16 LEU HD13 1 1 10 7207 1 1 16 LEU HD21 H 5.649 -1.391 -1.987 1.00 . A A . 16 LEU HD21 1 1 10 7208 1 1 16 LEU HD22 H 3.920 -1.066 -2.106 1.00 . A A . 16 LEU HD22 1 1 10 7209 1 1 16 LEU HD23 H 4.486 -2.649 -1.574 1.00 . A A . 16 LEU HD23 1 1 10 7210 1 1 16 LEU HG H 4.051 -0.231 -0.019 1.00 . A A . 16 LEU HG 1 1 10 7211 1 1 16 LEU N N 3.410 -0.733 2.620 1.00 . A A . 16 LEU N 1 1 10 7212 1 1 16 LEU O O 1.102 -3.185 1.923 1.00 . A A . 16 LEU O 1 1 10 7213 1 1 17 GLU C C 0.890 -4.229 4.480 1.00 . A A . 17 GLU C 1 1 10 7214 1 1 17 GLU CA C 2.249 -4.636 3.897 1.00 . A A . 17 GLU CA 1 1 10 7215 1 1 17 GLU CB C 3.167 -5.096 5.031 1.00 . A A . 17 GLU CB 1 1 10 7216 1 1 17 GLU CD C 5.110 -6.550 5.621 1.00 . A A . 17 GLU CD 1 1 10 7217 1 1 17 GLU CG C 4.141 -6.152 4.506 1.00 . A A . 17 GLU CG 1 1 10 7218 1 1 17 GLU H H 3.784 -3.193 3.432 1.00 . A A . 17 GLU H 1 1 10 7219 1 1 17 GLU HA H 2.108 -5.445 3.200 1.00 . A A . 17 GLU HA 1 1 10 7220 1 1 17 GLU HB2 H 3.722 -4.250 5.410 1.00 . A A . 17 GLU HB2 1 1 10 7221 1 1 17 GLU HB3 H 2.573 -5.521 5.825 1.00 . A A . 17 GLU HB3 1 1 10 7222 1 1 17 GLU HG2 H 3.588 -7.020 4.179 1.00 . A A . 17 GLU HG2 1 1 10 7223 1 1 17 GLU HG3 H 4.700 -5.746 3.675 1.00 . A A . 17 GLU HG3 1 1 10 7224 1 1 17 GLU N N 2.874 -3.480 3.192 1.00 . A A . 17 GLU N 1 1 10 7225 1 1 17 GLU O O 0.090 -5.068 4.843 1.00 . A A . 17 GLU O 1 1 10 7226 1 1 17 GLU OE1 O 5.553 -5.667 6.338 1.00 . A A . 17 GLU OE1 1 1 10 7227 1 1 17 GLU OE2 O 5.392 -7.731 5.740 1.00 . A A . 17 GLU OE2 1 1 10 7228 1 1 18 ASN C C -1.689 -2.283 4.021 1.00 . A A . 18 ASN C 1 1 10 7229 1 1 18 ASN CA C -0.684 -2.518 5.150 1.00 . A A . 18 ASN CA 1 1 10 7230 1 1 18 ASN CB C -0.490 -1.221 5.936 1.00 . A A . 18 ASN CB 1 1 10 7231 1 1 18 ASN CG C -1.334 -1.267 7.211 1.00 . A A . 18 ASN CG 1 1 10 7232 1 1 18 ASN H H 1.279 -2.290 4.291 1.00 . A A . 18 ASN H 1 1 10 7233 1 1 18 ASN HA H -1.062 -3.284 5.811 1.00 . A A . 18 ASN HA 1 1 10 7234 1 1 18 ASN HB2 H 0.553 -1.110 6.196 1.00 . A A . 18 ASN HB2 1 1 10 7235 1 1 18 ASN HB3 H -0.802 -0.383 5.330 1.00 . A A . 18 ASN HB3 1 1 10 7236 1 1 18 ASN HD21 H 0.240 -1.349 8.418 1.00 . A A . 18 ASN HD21 1 1 10 7237 1 1 18 ASN HD22 H -1.270 -1.359 9.193 1.00 . A A . 18 ASN HD22 1 1 10 7238 1 1 18 ASN N N 0.623 -2.956 4.582 1.00 . A A . 18 ASN N 1 1 10 7239 1 1 18 ASN ND2 N -0.738 -1.331 8.370 1.00 . A A . 18 ASN ND2 1 1 10 7240 1 1 18 ASN O O -2.705 -1.644 4.208 1.00 . A A . 18 ASN O 1 1 10 7241 1 1 18 ASN OD1 O -2.547 -1.247 7.152 1.00 . A A . 18 ASN OD1 1 1 10 7242 1 1 19 TYR C C -2.463 -3.889 0.905 1.00 . A A . 19 TYR C 1 1 10 7243 1 1 19 TYR CA C -2.366 -2.598 1.719 1.00 . A A . 19 TYR CA 1 1 10 7244 1 1 19 TYR CB C -1.864 -1.466 0.821 1.00 . A A . 19 TYR CB 1 1 10 7245 1 1 19 TYR CD1 C -2.989 0.481 1.968 1.00 . A A . 19 TYR CD1 1 1 10 7246 1 1 19 TYR CD2 C -0.565 0.346 1.993 1.00 . A A . 19 TYR CD2 1 1 10 7247 1 1 19 TYR CE1 C -2.929 1.673 2.703 1.00 . A A . 19 TYR CE1 1 1 10 7248 1 1 19 TYR CE2 C -0.505 1.537 2.727 1.00 . A A . 19 TYR CE2 1 1 10 7249 1 1 19 TYR CG C -1.805 -0.182 1.613 1.00 . A A . 19 TYR CG 1 1 10 7250 1 1 19 TYR CZ C -1.687 2.202 3.083 1.00 . A A . 19 TYR CZ 1 1 10 7251 1 1 19 TYR H H -0.596 -3.309 2.720 1.00 . A A . 19 TYR H 1 1 10 7252 1 1 19 TYR HA H -3.343 -2.344 2.105 1.00 . A A . 19 TYR HA 1 1 10 7253 1 1 19 TYR HB2 H -0.878 -1.708 0.455 1.00 . A A . 19 TYR HB2 1 1 10 7254 1 1 19 TYR HB3 H -2.538 -1.341 -0.014 1.00 . A A . 19 TYR HB3 1 1 10 7255 1 1 19 TYR HD1 H -3.946 0.074 1.675 1.00 . A A . 19 TYR HD1 1 1 10 7256 1 1 19 TYR HD2 H 0.343 -0.165 1.718 1.00 . A A . 19 TYR HD2 1 1 10 7257 1 1 19 TYR HE1 H -3.839 2.184 2.977 1.00 . A A . 19 TYR HE1 1 1 10 7258 1 1 19 TYR HE2 H 0.453 1.943 3.020 1.00 . A A . 19 TYR HE2 1 1 10 7259 1 1 19 TYR HH H -1.612 3.151 4.739 1.00 . A A . 19 TYR HH 1 1 10 7260 1 1 19 TYR N N -1.420 -2.794 2.852 1.00 . A A . 19 TYR N 1 1 10 7261 1 1 19 TYR O O -2.537 -3.865 -0.308 1.00 . A A . 19 TYR O 1 1 10 7262 1 1 19 TYR OH O -1.628 3.376 3.805 1.00 . A A . 19 TYR OH 1 1 10 7263 1 1 20 CYS C C -3.061 -7.401 1.763 1.00 . A A . 20 CYS C 1 1 10 7264 1 1 20 CYS CA C -2.550 -6.309 0.821 1.00 . A A . 20 CYS CA 1 1 10 7265 1 1 20 CYS CB C -1.166 -6.694 0.295 1.00 . A A . 20 CYS CB 1 1 10 7266 1 1 20 CYS H H -2.398 -5.016 2.538 1.00 . A A . 20 CYS H 1 1 10 7267 1 1 20 CYS HA H -3.234 -6.201 -0.008 1.00 . A A . 20 CYS HA 1 1 10 7268 1 1 20 CYS HB2 H -0.867 -5.996 -0.474 1.00 . A A . 20 CYS HB2 1 1 10 7269 1 1 20 CYS HB3 H -0.453 -6.664 1.104 1.00 . A A . 20 CYS HB3 1 1 10 7270 1 1 20 CYS N N -2.459 -5.018 1.560 1.00 . A A . 20 CYS N 1 1 10 7271 1 1 20 CYS O O -2.975 -7.284 2.969 1.00 . A A . 20 CYS O 1 1 10 7272 1 1 20 CYS SG S -1.229 -8.366 -0.396 1.00 . A A . 20 CYS SG 1 1 10 7273 1 1 21 ASN C C -2.944 -10.443 2.546 1.00 . A A . 21 ASN C 1 1 10 7274 1 1 21 ASN CA C -4.110 -9.561 2.093 1.00 . A A . 21 ASN CA 1 1 10 7275 1 1 21 ASN CB C -5.112 -10.411 1.309 1.00 . A A . 21 ASN CB 1 1 10 7276 1 1 21 ASN CG C -6.516 -10.210 1.885 1.00 . A A . 21 ASN CG 1 1 10 7277 1 1 21 ASN H H -3.654 -8.540 0.248 1.00 . A A . 21 ASN H 1 1 10 7278 1 1 21 ASN HA H -4.596 -9.137 2.958 1.00 . A A . 21 ASN HA 1 1 10 7279 1 1 21 ASN HB2 H -5.103 -10.113 0.271 1.00 . A A . 21 ASN HB2 1 1 10 7280 1 1 21 ASN HB3 H -4.840 -11.452 1.386 1.00 . A A . 21 ASN HB3 1 1 10 7281 1 1 21 ASN HD21 H -7.060 -12.097 1.589 1.00 . A A . 21 ASN HD21 1 1 10 7282 1 1 21 ASN HD22 H -8.242 -11.104 2.293 1.00 . A A . 21 ASN HD22 1 1 10 7283 1 1 21 ASN N N -3.594 -8.465 1.223 1.00 . A A . 21 ASN N 1 1 10 7284 1 1 21 ASN ND2 N -7.341 -11.220 1.926 1.00 . A A . 21 ASN ND2 1 1 10 7285 1 1 21 ASN O O -1.886 -10.347 1.945 1.00 . A A . 21 ASN O 1 1 10 7286 1 1 21 ASN OXT O -3.128 -11.199 3.485 1.00 . A A . 21 ASN OXT 1 1 10 7287 1 1 21 ASN OD1 O -6.865 -9.125 2.305 1.00 . A A . 21 ASN OD1 1 1 10 7288 2 2 1 PHE C C 11.568 -0.992 -2.113 1.00 . B B . 1 PHE C 1 1 10 7289 2 2 1 PHE CA C 11.695 -0.979 -3.637 1.00 . B B . 1 PHE CA 1 1 10 7290 2 2 1 PHE CB C 12.552 -2.162 -4.090 1.00 . B B . 1 PHE CB 1 1 10 7291 2 2 1 PHE CD1 C 10.626 -3.705 -3.554 1.00 . B B . 1 PHE CD1 1 1 10 7292 2 2 1 PHE CD2 C 12.870 -4.369 -2.911 1.00 . B B . 1 PHE CD2 1 1 10 7293 2 2 1 PHE CE1 C 10.119 -4.894 -3.013 1.00 . B B . 1 PHE CE1 1 1 10 7294 2 2 1 PHE CE2 C 12.363 -5.557 -2.370 1.00 . B B . 1 PHE CE2 1 1 10 7295 2 2 1 PHE CG C 12.003 -3.442 -3.504 1.00 . B B . 1 PHE CG 1 1 10 7296 2 2 1 PHE CZ C 10.988 -5.820 -2.420 1.00 . B B . 1 PHE CZ 1 1 10 7297 2 2 1 PHE H1 H 13.325 0.110 -4.338 1.00 . B B . 1 PHE H1 1 1 10 7298 2 2 1 PHE H2 H 12.311 0.980 -3.289 1.00 . B B . 1 PHE H2 1 1 10 7299 2 2 1 PHE H3 H 11.827 0.680 -4.891 1.00 . B B . 1 PHE H3 1 1 10 7300 2 2 1 PHE HA H 10.713 -1.055 -4.079 1.00 . B B . 1 PHE HA 1 1 10 7301 2 2 1 PHE HB2 H 12.537 -2.224 -5.168 1.00 . B B . 1 PHE HB2 1 1 10 7302 2 2 1 PHE HB3 H 13.569 -2.020 -3.752 1.00 . B B . 1 PHE HB3 1 1 10 7303 2 2 1 PHE HD1 H 9.956 -2.991 -4.011 1.00 . B B . 1 PHE HD1 1 1 10 7304 2 2 1 PHE HD2 H 13.931 -4.167 -2.872 1.00 . B B . 1 PHE HD2 1 1 10 7305 2 2 1 PHE HE1 H 9.059 -5.098 -3.051 1.00 . B B . 1 PHE HE1 1 1 10 7306 2 2 1 PHE HE2 H 13.034 -6.271 -1.914 1.00 . B B . 1 PHE HE2 1 1 10 7307 2 2 1 PHE HZ H 10.599 -6.737 -2.003 1.00 . B B . 1 PHE HZ 1 1 10 7308 2 2 1 PHE N N 12.337 0.294 -4.071 1.00 . B B . 1 PHE N 1 1 10 7309 2 2 1 PHE O O 10.533 -1.320 -1.569 1.00 . B B . 1 PHE O 1 1 10 7310 2 2 2 VAL C C 12.021 0.735 0.535 1.00 . B B . 2 VAL C 1 1 10 7311 2 2 2 VAL CA C 12.547 -0.620 0.068 1.00 . B B . 2 VAL CA 1 1 10 7312 2 2 2 VAL CB C 13.945 -0.858 0.646 1.00 . B B . 2 VAL CB 1 1 10 7313 2 2 2 VAL CG1 C 13.833 -1.172 2.139 1.00 . B B . 2 VAL CG1 1 1 10 7314 2 2 2 VAL CG2 C 14.598 -2.040 -0.073 1.00 . B B . 2 VAL CG2 1 1 10 7315 2 2 2 VAL H H 13.438 -0.368 -1.876 1.00 . B B . 2 VAL H 1 1 10 7316 2 2 2 VAL HA H 11.882 -1.396 0.407 1.00 . B B . 2 VAL HA 1 1 10 7317 2 2 2 VAL HB H 14.547 0.029 0.507 1.00 . B B . 2 VAL HB 1 1 10 7318 2 2 2 VAL HG11 H 14.274 -2.137 2.336 1.00 . B B . 2 VAL HG11 1 1 10 7319 2 2 2 VAL HG12 H 12.791 -1.185 2.426 1.00 . B B . 2 VAL HG12 1 1 10 7320 2 2 2 VAL HG13 H 14.354 -0.415 2.706 1.00 . B B . 2 VAL HG13 1 1 10 7321 2 2 2 VAL HG21 H 15.672 -1.934 -0.036 1.00 . B B . 2 VAL HG21 1 1 10 7322 2 2 2 VAL HG22 H 14.274 -2.059 -1.104 1.00 . B B . 2 VAL HG22 1 1 10 7323 2 2 2 VAL HG23 H 14.308 -2.960 0.412 1.00 . B B . 2 VAL HG23 1 1 10 7324 2 2 2 VAL N N 12.613 -0.633 -1.419 1.00 . B B . 2 VAL N 1 1 10 7325 2 2 2 VAL O O 11.387 0.847 1.565 1.00 . B B . 2 VAL O 1 1 10 7326 2 2 3 ASN C C 11.722 4.009 -1.072 1.00 . B B . 3 ASN C 1 1 10 7327 2 2 3 ASN CA C 11.786 3.119 0.172 1.00 . B B . 3 ASN CA 1 1 10 7328 2 2 3 ASN CB C 12.746 3.749 1.190 1.00 . B B . 3 ASN CB 1 1 10 7329 2 2 3 ASN CG C 13.651 2.680 1.810 1.00 . B B . 3 ASN CG 1 1 10 7330 2 2 3 ASN H H 12.783 1.652 -1.051 1.00 . B B . 3 ASN H 1 1 10 7331 2 2 3 ASN HA H 10.801 3.034 0.606 1.00 . B B . 3 ASN HA 1 1 10 7332 2 2 3 ASN HB2 H 13.358 4.483 0.692 1.00 . B B . 3 ASN HB2 1 1 10 7333 2 2 3 ASN HB3 H 12.176 4.230 1.972 1.00 . B B . 3 ASN HB3 1 1 10 7334 2 2 3 ASN HD21 H 15.276 3.298 0.849 1.00 . B B . 3 ASN HD21 1 1 10 7335 2 2 3 ASN HD22 H 15.502 1.964 1.873 1.00 . B B . 3 ASN HD22 1 1 10 7336 2 2 3 ASN N N 12.273 1.767 -0.222 1.00 . B B . 3 ASN N 1 1 10 7337 2 2 3 ASN ND2 N 14.914 2.644 1.484 1.00 . B B . 3 ASN ND2 1 1 10 7338 2 2 3 ASN O O 12.229 5.113 -1.082 1.00 . B B . 3 ASN O 1 1 10 7339 2 2 3 ASN OD1 O 13.205 1.871 2.599 1.00 . B B . 3 ASN OD1 1 1 10 7340 2 2 4 GLN C C 9.657 5.005 -3.492 1.00 . B B . 4 GLN C 1 1 10 7341 2 2 4 GLN CA C 11.038 4.354 -3.370 1.00 . B B . 4 GLN CA 1 1 10 7342 2 2 4 GLN CB C 11.278 3.453 -4.585 1.00 . B B . 4 GLN CB 1 1 10 7343 2 2 4 GLN CD C 12.376 4.895 -6.306 1.00 . B B . 4 GLN CD 1 1 10 7344 2 2 4 GLN CG C 12.610 3.822 -5.241 1.00 . B B . 4 GLN CG 1 1 10 7345 2 2 4 GLN H H 10.723 2.637 -2.105 1.00 . B B . 4 GLN H 1 1 10 7346 2 2 4 GLN HA H 11.795 5.122 -3.341 1.00 . B B . 4 GLN HA 1 1 10 7347 2 2 4 GLN HB2 H 11.306 2.422 -4.267 1.00 . B B . 4 GLN HB2 1 1 10 7348 2 2 4 GLN HB3 H 10.479 3.591 -5.296 1.00 . B B . 4 GLN HB3 1 1 10 7349 2 2 4 GLN HE21 H 13.065 6.371 -5.171 1.00 . B B . 4 GLN HE21 1 1 10 7350 2 2 4 GLN HE22 H 12.539 6.831 -6.717 1.00 . B B . 4 GLN HE22 1 1 10 7351 2 2 4 GLN HG2 H 13.289 4.200 -4.491 1.00 . B B . 4 GLN HG2 1 1 10 7352 2 2 4 GLN HG3 H 13.037 2.946 -5.705 1.00 . B B . 4 GLN HG3 1 1 10 7353 2 2 4 GLN N N 11.117 3.534 -2.127 1.00 . B B . 4 GLN N 1 1 10 7354 2 2 4 GLN NE2 N 12.686 6.135 -6.043 1.00 . B B . 4 GLN NE2 1 1 10 7355 2 2 4 GLN O O 8.891 5.065 -2.543 1.00 . B B . 4 GLN O 1 1 10 7356 2 2 4 GLN OE1 O 11.907 4.603 -7.388 1.00 . B B . 4 GLN OE1 1 1 10 7357 2 2 5 HIS C C 7.088 5.140 -5.598 1.00 . B B . 5 HIS C 1 1 10 7358 2 2 5 HIS CA C 8.011 6.131 -4.887 1.00 . B B . 5 HIS CA 1 1 10 7359 2 2 5 HIS CB C 8.184 7.369 -5.773 1.00 . B B . 5 HIS CB 1 1 10 7360 2 2 5 HIS CD2 C 10.057 8.554 -4.383 1.00 . B B . 5 HIS CD2 1 1 10 7361 2 2 5 HIS CE1 C 9.035 10.447 -4.079 1.00 . B B . 5 HIS CE1 1 1 10 7362 2 2 5 HIS CG C 8.834 8.476 -4.991 1.00 . B B . 5 HIS CG 1 1 10 7363 2 2 5 HIS H H 9.972 5.418 -5.409 1.00 . B B . 5 HIS H 1 1 10 7364 2 2 5 HIS HA H 7.581 6.417 -3.939 1.00 . B B . 5 HIS HA 1 1 10 7365 2 2 5 HIS HB2 H 8.803 7.119 -6.622 1.00 . B B . 5 HIS HB2 1 1 10 7366 2 2 5 HIS HB3 H 7.215 7.697 -6.119 1.00 . B B . 5 HIS HB3 1 1 10 7367 2 2 5 HIS HD2 H 10.798 7.769 -4.358 1.00 . B B . 5 HIS HD2 1 1 10 7368 2 2 5 HIS HE1 H 8.816 11.458 -3.765 1.00 . B B . 5 HIS HE1 1 1 10 7369 2 2 5 HIS HE2 H 10.952 10.142 -3.298 1.00 . B B . 5 HIS HE2 1 1 10 7370 2 2 5 HIS N N 9.336 5.486 -4.666 1.00 . B B . 5 HIS N 1 1 10 7371 2 2 5 HIS ND1 N 8.196 9.682 -4.790 1.00 . B B . 5 HIS ND1 1 1 10 7372 2 2 5 HIS NE2 N 10.186 9.800 -3.805 1.00 . B B . 5 HIS NE2 1 1 10 7373 2 2 5 HIS O O 7.400 4.641 -6.661 1.00 . B B . 5 HIS O 1 1 10 7374 2 2 6 LEU C C 3.949 4.686 -6.450 1.00 . B B . 6 LEU C 1 1 10 7375 2 2 6 LEU CA C 5.013 3.897 -5.677 1.00 . B B . 6 LEU CA 1 1 10 7376 2 2 6 LEU CB C 4.348 3.034 -4.602 1.00 . B B . 6 LEU CB 1 1 10 7377 2 2 6 LEU CD1 C 4.713 1.815 -2.453 1.00 . B B . 6 LEU CD1 1 1 10 7378 2 2 6 LEU CD2 C 6.608 2.130 -4.048 1.00 . B B . 6 LEU CD2 1 1 10 7379 2 2 6 LEU CG C 5.343 2.768 -3.472 1.00 . B B . 6 LEU CG 1 1 10 7380 2 2 6 LEU H H 5.717 5.268 -4.170 1.00 . B B . 6 LEU H 1 1 10 7381 2 2 6 LEU HA H 5.556 3.265 -6.362 1.00 . B B . 6 LEU HA 1 1 10 7382 2 2 6 LEU HB2 H 3.485 3.547 -4.210 1.00 . B B . 6 LEU HB2 1 1 10 7383 2 2 6 LEU HB3 H 4.044 2.093 -5.031 1.00 . B B . 6 LEU HB3 1 1 10 7384 2 2 6 LEU HD11 H 3.744 2.190 -2.158 1.00 . B B . 6 LEU HD11 1 1 10 7385 2 2 6 LEU HD12 H 5.351 1.743 -1.585 1.00 . B B . 6 LEU HD12 1 1 10 7386 2 2 6 LEU HD13 H 4.600 0.837 -2.898 1.00 . B B . 6 LEU HD13 1 1 10 7387 2 2 6 LEU HD21 H 6.596 2.216 -5.124 1.00 . B B . 6 LEU HD21 1 1 10 7388 2 2 6 LEU HD22 H 6.642 1.087 -3.770 1.00 . B B . 6 LEU HD22 1 1 10 7389 2 2 6 LEU HD23 H 7.479 2.636 -3.655 1.00 . B B . 6 LEU HD23 1 1 10 7390 2 2 6 LEU HG H 5.594 3.701 -2.985 1.00 . B B . 6 LEU HG 1 1 10 7391 2 2 6 LEU N N 5.953 4.854 -5.026 1.00 . B B . 6 LEU N 1 1 10 7392 2 2 6 LEU O O 2.870 4.941 -5.952 1.00 . B B . 6 LEU O 1 1 10 7393 2 2 7 CYS C C 2.601 4.983 -9.518 1.00 . B B . 7 CYS C 1 1 10 7394 2 2 7 CYS CA C 3.261 5.871 -8.459 1.00 . B B . 7 CYS CA 1 1 10 7395 2 2 7 CYS CB C 3.977 7.027 -9.165 1.00 . B B . 7 CYS CB 1 1 10 7396 2 2 7 CYS H H 5.130 4.877 -8.038 1.00 . B B . 7 CYS H 1 1 10 7397 2 2 7 CYS HA H 2.504 6.267 -7.800 1.00 . B B . 7 CYS HA 1 1 10 7398 2 2 7 CYS HB2 H 4.994 6.738 -9.384 1.00 . B B . 7 CYS HB2 1 1 10 7399 2 2 7 CYS HB3 H 3.462 7.255 -10.088 1.00 . B B . 7 CYS HB3 1 1 10 7400 2 2 7 CYS N N 4.251 5.085 -7.660 1.00 . B B . 7 CYS N 1 1 10 7401 2 2 7 CYS O O 3.265 4.293 -10.265 1.00 . B B . 7 CYS O 1 1 10 7402 2 2 7 CYS SG S 3.985 8.493 -8.104 1.00 . B B . 7 CYS SG 1 1 10 7403 2 2 8 GLY C C 1.254 2.875 -10.866 1.00 . B B . 8 GLY C 1 1 10 7404 2 2 8 GLY CA C 0.550 4.211 -10.609 1.00 . B B . 8 GLY CA 1 1 10 7405 2 2 8 GLY H H 0.795 5.605 -8.984 1.00 . B B . 8 GLY H 1 1 10 7406 2 2 8 GLY HA2 H -0.449 4.022 -10.246 1.00 . B B . 8 GLY HA2 1 1 10 7407 2 2 8 GLY HA3 H 0.493 4.765 -11.535 1.00 . B B . 8 GLY HA3 1 1 10 7408 2 2 8 GLY N N 1.294 5.022 -9.594 1.00 . B B . 8 GLY N 1 1 10 7409 2 2 8 GLY O O 1.395 2.056 -9.982 1.00 . B B . 8 GLY O 1 1 10 7410 2 2 9 SER C C 3.286 0.954 -11.268 1.00 . B B . 9 SER C 1 1 10 7411 2 2 9 SER CA C 2.374 1.372 -12.422 1.00 . B B . 9 SER CA 1 1 10 7412 2 2 9 SER CB C 3.212 1.566 -13.687 1.00 . B B . 9 SER CB 1 1 10 7413 2 2 9 SER H H 1.550 3.330 -12.777 1.00 . B B . 9 SER H 1 1 10 7414 2 2 9 SER HA H 1.637 0.603 -12.594 1.00 . B B . 9 SER HA 1 1 10 7415 2 2 9 SER HB2 H 4.109 0.975 -13.622 1.00 . B B . 9 SER HB2 1 1 10 7416 2 2 9 SER HB3 H 2.638 1.253 -14.549 1.00 . B B . 9 SER HB3 1 1 10 7417 2 2 9 SER HG H 4.471 3.039 -13.514 1.00 . B B . 9 SER HG 1 1 10 7418 2 2 9 SER N N 1.686 2.653 -12.082 1.00 . B B . 9 SER N 1 1 10 7419 2 2 9 SER O O 3.087 -0.073 -10.649 1.00 . B B . 9 SER O 1 1 10 7420 2 2 9 SER OG O 3.563 2.938 -13.809 1.00 . B B . 9 SER OG 1 1 10 7421 2 2 10 ASP C C 4.337 1.005 -8.638 1.00 . B B . 10 ASP C 1 1 10 7422 2 2 10 ASP CA C 5.188 1.392 -9.844 1.00 . B B . 10 ASP CA 1 1 10 7423 2 2 10 ASP CB C 6.047 2.606 -9.485 1.00 . B B . 10 ASP CB 1 1 10 7424 2 2 10 ASP CG C 6.874 3.028 -10.702 1.00 . B B . 10 ASP CG 1 1 10 7425 2 2 10 ASP H H 4.416 2.572 -11.469 1.00 . B B . 10 ASP H 1 1 10 7426 2 2 10 ASP HA H 5.818 0.562 -10.129 1.00 . B B . 10 ASP HA 1 1 10 7427 2 2 10 ASP HB2 H 5.403 3.422 -9.182 1.00 . B B . 10 ASP HB2 1 1 10 7428 2 2 10 ASP HB3 H 6.710 2.349 -8.672 1.00 . B B . 10 ASP HB3 1 1 10 7429 2 2 10 ASP N N 4.278 1.745 -10.966 1.00 . B B . 10 ASP N 1 1 10 7430 2 2 10 ASP O O 4.618 0.053 -7.939 1.00 . B B . 10 ASP O 1 1 10 7431 2 2 10 ASP OD1 O 7.404 2.152 -11.366 1.00 . B B . 10 ASP OD1 1 1 10 7432 2 2 10 ASP OD2 O 6.965 4.219 -10.947 1.00 . B B . 10 ASP OD2 1 1 10 7433 2 2 11 LEU C C 2.137 -0.065 -7.229 1.00 . B B . 11 LEU C 1 1 10 7434 2 2 11 LEU CA C 2.403 1.434 -7.251 1.00 . B B . 11 LEU CA 1 1 10 7435 2 2 11 LEU CB C 1.083 2.188 -7.433 1.00 . B B . 11 LEU CB 1 1 10 7436 2 2 11 LEU CD1 C 1.156 2.087 -4.878 1.00 . B B . 11 LEU CD1 1 1 10 7437 2 2 11 LEU CD2 C -0.295 3.733 -6.044 1.00 . B B . 11 LEU CD2 1 1 10 7438 2 2 11 LEU CG C 0.283 2.322 -6.116 1.00 . B B . 11 LEU CG 1 1 10 7439 2 2 11 LEU H H 3.088 2.504 -8.985 1.00 . B B . 11 LEU H 1 1 10 7440 2 2 11 LEU HA H 2.885 1.736 -6.343 1.00 . B B . 11 LEU HA 1 1 10 7441 2 2 11 LEU HB2 H 1.296 3.173 -7.815 1.00 . B B . 11 LEU HB2 1 1 10 7442 2 2 11 LEU HB3 H 0.480 1.656 -8.153 1.00 . B B . 11 LEU HB3 1 1 10 7443 2 2 11 LEU HD11 H 1.842 2.911 -4.762 1.00 . B B . 11 LEU HD11 1 1 10 7444 2 2 11 LEU HD12 H 1.708 1.168 -4.992 1.00 . B B . 11 LEU HD12 1 1 10 7445 2 2 11 LEU HD13 H 0.524 2.022 -4.002 1.00 . B B . 11 LEU HD13 1 1 10 7446 2 2 11 LEU HD21 H -1.276 3.745 -6.495 1.00 . B B . 11 LEU HD21 1 1 10 7447 2 2 11 LEU HD22 H 0.355 4.415 -6.574 1.00 . B B . 11 LEU HD22 1 1 10 7448 2 2 11 LEU HD23 H -0.371 4.039 -5.010 1.00 . B B . 11 LEU HD23 1 1 10 7449 2 2 11 LEU HG H -0.527 1.609 -6.119 1.00 . B B . 11 LEU HG 1 1 10 7450 2 2 11 LEU N N 3.292 1.744 -8.400 1.00 . B B . 11 LEU N 1 1 10 7451 2 2 11 LEU O O 2.503 -0.761 -6.303 1.00 . B B . 11 LEU O 1 1 10 7452 2 2 12 ALA C C 2.570 -2.769 -8.384 1.00 . B B . 12 ALA C 1 1 10 7453 2 2 12 ALA CA C 1.238 -2.029 -8.300 1.00 . B B . 12 ALA CA 1 1 10 7454 2 2 12 ALA CB C 0.394 -2.360 -9.532 1.00 . B B . 12 ALA CB 1 1 10 7455 2 2 12 ALA H H 1.234 0.005 -8.996 1.00 . B B . 12 ALA H 1 1 10 7456 2 2 12 ALA HA H 0.711 -2.328 -7.404 1.00 . B B . 12 ALA HA 1 1 10 7457 2 2 12 ALA HB1 H -0.340 -1.584 -9.686 1.00 . B B . 12 ALA HB1 1 1 10 7458 2 2 12 ALA HB2 H -0.107 -3.306 -9.381 1.00 . B B . 12 ALA HB2 1 1 10 7459 2 2 12 ALA HB3 H 1.036 -2.428 -10.399 1.00 . B B . 12 ALA HB3 1 1 10 7460 2 2 12 ALA N N 1.512 -0.572 -8.254 1.00 . B B . 12 ALA N 1 1 10 7461 2 2 12 ALA O O 2.839 -3.664 -7.614 1.00 . B B . 12 ALA O 1 1 10 7462 2 2 13 GLU C C 5.341 -3.231 -8.034 1.00 . B B . 13 GLU C 1 1 10 7463 2 2 13 GLU CA C 4.733 -3.073 -9.427 1.00 . B B . 13 GLU CA 1 1 10 7464 2 2 13 GLU CB C 5.668 -2.236 -10.305 1.00 . B B . 13 GLU CB 1 1 10 7465 2 2 13 GLU CD C 6.868 -2.725 -12.443 1.00 . B B . 13 GLU CD 1 1 10 7466 2 2 13 GLU CG C 6.687 -3.154 -10.986 1.00 . B B . 13 GLU CG 1 1 10 7467 2 2 13 GLU H H 3.186 -1.657 -9.915 1.00 . B B . 13 GLU H 1 1 10 7468 2 2 13 GLU HA H 4.596 -4.048 -9.872 1.00 . B B . 13 GLU HA 1 1 10 7469 2 2 13 GLU HB2 H 5.090 -1.717 -11.055 1.00 . B B . 13 GLU HB2 1 1 10 7470 2 2 13 GLU HB3 H 6.190 -1.517 -9.692 1.00 . B B . 13 GLU HB3 1 1 10 7471 2 2 13 GLU HG2 H 7.633 -3.086 -10.469 1.00 . B B . 13 GLU HG2 1 1 10 7472 2 2 13 GLU HG3 H 6.330 -4.172 -10.954 1.00 . B B . 13 GLU HG3 1 1 10 7473 2 2 13 GLU N N 3.416 -2.392 -9.307 1.00 . B B . 13 GLU N 1 1 10 7474 2 2 13 GLU O O 5.981 -4.220 -7.736 1.00 . B B . 13 GLU O 1 1 10 7475 2 2 13 GLU OE1 O 6.783 -1.536 -12.705 1.00 . B B . 13 GLU OE1 1 1 10 7476 2 2 13 GLU OE2 O 7.090 -3.593 -13.272 1.00 . B B . 13 GLU OE2 1 1 10 7477 2 2 14 ALA C C 4.926 -3.448 -5.028 1.00 . B B . 14 ALA C 1 1 10 7478 2 2 14 ALA CA C 5.705 -2.384 -5.797 1.00 . B B . 14 ALA CA 1 1 10 7479 2 2 14 ALA CB C 5.588 -1.040 -5.076 1.00 . B B . 14 ALA CB 1 1 10 7480 2 2 14 ALA H H 4.611 -1.477 -7.427 1.00 . B B . 14 ALA H 1 1 10 7481 2 2 14 ALA HA H 6.747 -2.678 -5.855 1.00 . B B . 14 ALA HA 1 1 10 7482 2 2 14 ALA HB1 H 5.320 -0.273 -5.788 1.00 . B B . 14 ALA HB1 1 1 10 7483 2 2 14 ALA HB2 H 6.535 -0.792 -4.619 1.00 . B B . 14 ALA HB2 1 1 10 7484 2 2 14 ALA HB3 H 4.826 -1.106 -4.314 1.00 . B B . 14 ALA HB3 1 1 10 7485 2 2 14 ALA N N 5.141 -2.269 -7.172 1.00 . B B . 14 ALA N 1 1 10 7486 2 2 14 ALA O O 5.495 -4.383 -4.501 1.00 . B B . 14 ALA O 1 1 10 7487 2 2 15 LEU C C 2.974 -5.684 -4.987 1.00 . B B . 15 LEU C 1 1 10 7488 2 2 15 LEU CA C 2.836 -4.357 -4.238 1.00 . B B . 15 LEU CA 1 1 10 7489 2 2 15 LEU CB C 1.359 -3.950 -4.200 1.00 . B B . 15 LEU CB 1 1 10 7490 2 2 15 LEU CD1 C -0.190 -2.110 -3.531 1.00 . B B . 15 LEU CD1 1 1 10 7491 2 2 15 LEU CD2 C 1.269 -3.195 -1.826 1.00 . B B . 15 LEU CD2 1 1 10 7492 2 2 15 LEU CG C 1.180 -2.742 -3.282 1.00 . B B . 15 LEU CG 1 1 10 7493 2 2 15 LEU H H 3.174 -2.576 -5.409 1.00 . B B . 15 LEU H 1 1 10 7494 2 2 15 LEU HA H 3.217 -4.456 -3.227 1.00 . B B . 15 LEU HA 1 1 10 7495 2 2 15 LEU HB2 H 1.031 -3.697 -5.198 1.00 . B B . 15 LEU HB2 1 1 10 7496 2 2 15 LEU HB3 H 0.771 -4.774 -3.825 1.00 . B B . 15 LEU HB3 1 1 10 7497 2 2 15 LEU HD11 H -0.375 -1.353 -2.785 1.00 . B B . 15 LEU HD11 1 1 10 7498 2 2 15 LEU HD12 H -0.953 -2.872 -3.469 1.00 . B B . 15 LEU HD12 1 1 10 7499 2 2 15 LEU HD13 H -0.206 -1.662 -4.512 1.00 . B B . 15 LEU HD13 1 1 10 7500 2 2 15 LEU HD21 H 1.594 -4.224 -1.791 1.00 . B B . 15 LEU HD21 1 1 10 7501 2 2 15 LEU HD22 H 0.297 -3.108 -1.364 1.00 . B B . 15 LEU HD22 1 1 10 7502 2 2 15 LEU HD23 H 1.976 -2.575 -1.299 1.00 . B B . 15 LEU HD23 1 1 10 7503 2 2 15 LEU HG H 1.955 -2.017 -3.484 1.00 . B B . 15 LEU HG 1 1 10 7504 2 2 15 LEU N N 3.627 -3.328 -4.966 1.00 . B B . 15 LEU N 1 1 10 7505 2 2 15 LEU O O 2.853 -6.752 -4.423 1.00 . B B . 15 LEU O 1 1 10 7506 2 2 16 TYR C C 4.662 -7.563 -6.686 1.00 . B B . 16 TYR C 1 1 10 7507 2 2 16 TYR CA C 3.386 -6.837 -7.093 1.00 . B B . 16 TYR CA 1 1 10 7508 2 2 16 TYR CB C 3.509 -6.435 -8.565 1.00 . B B . 16 TYR CB 1 1 10 7509 2 2 16 TYR CD1 C 2.977 -8.574 -9.781 1.00 . B B . 16 TYR CD1 1 1 10 7510 2 2 16 TYR CD2 C 1.360 -6.767 -9.821 1.00 . B B . 16 TYR CD2 1 1 10 7511 2 2 16 TYR CE1 C 2.123 -9.356 -10.568 1.00 . B B . 16 TYR CE1 1 1 10 7512 2 2 16 TYR CE2 C 0.504 -7.547 -10.609 1.00 . B B . 16 TYR CE2 1 1 10 7513 2 2 16 TYR CG C 2.592 -7.280 -9.408 1.00 . B B . 16 TYR CG 1 1 10 7514 2 2 16 TYR CZ C 0.885 -8.843 -10.983 1.00 . B B . 16 TYR CZ 1 1 10 7515 2 2 16 TYR H H 3.322 -4.728 -6.689 1.00 . B B . 16 TYR H 1 1 10 7516 2 2 16 TYR HA H 2.533 -7.485 -6.960 1.00 . B B . 16 TYR HA 1 1 10 7517 2 2 16 TYR HB2 H 3.243 -5.395 -8.679 1.00 . B B . 16 TYR HB2 1 1 10 7518 2 2 16 TYR HB3 H 4.527 -6.577 -8.891 1.00 . B B . 16 TYR HB3 1 1 10 7519 2 2 16 TYR HD1 H 3.932 -8.968 -9.460 1.00 . B B . 16 TYR HD1 1 1 10 7520 2 2 16 TYR HD2 H 1.070 -5.768 -9.532 1.00 . B B . 16 TYR HD2 1 1 10 7521 2 2 16 TYR HE1 H 2.417 -10.353 -10.857 1.00 . B B . 16 TYR HE1 1 1 10 7522 2 2 16 TYR HE2 H -0.449 -7.149 -10.928 1.00 . B B . 16 TYR HE2 1 1 10 7523 2 2 16 TYR HH H -0.764 -9.117 -11.907 1.00 . B B . 16 TYR HH 1 1 10 7524 2 2 16 TYR N N 3.230 -5.608 -6.266 1.00 . B B . 16 TYR N 1 1 10 7525 2 2 16 TYR O O 4.847 -8.730 -6.972 1.00 . B B . 16 TYR O 1 1 10 7526 2 2 16 TYR OH O 0.044 -9.615 -11.759 1.00 . B B . 16 TYR OH 1 1 10 7527 2 2 17 LEU C C 6.837 -7.777 -4.151 1.00 . B B . 17 LEU C 1 1 10 7528 2 2 17 LEU CA C 6.835 -7.495 -5.660 1.00 . B B . 17 LEU CA 1 1 10 7529 2 2 17 LEU CB C 7.944 -6.525 -6.038 1.00 . B B . 17 LEU CB 1 1 10 7530 2 2 17 LEU CD1 C 9.332 -8.621 -5.949 1.00 . B B . 17 LEU CD1 1 1 10 7531 2 2 17 LEU CD2 C 10.349 -6.438 -6.571 1.00 . B B . 17 LEU CD2 1 1 10 7532 2 2 17 LEU CG C 9.304 -7.107 -5.690 1.00 . B B . 17 LEU CG 1 1 10 7533 2 2 17 LEU H H 5.407 -5.927 -5.854 1.00 . B B . 17 LEU H 1 1 10 7534 2 2 17 LEU HA H 6.975 -8.418 -6.202 1.00 . B B . 17 LEU HA 1 1 10 7535 2 2 17 LEU HB2 H 7.902 -6.330 -7.099 1.00 . B B . 17 LEU HB2 1 1 10 7536 2 2 17 LEU HB3 H 7.805 -5.597 -5.500 1.00 . B B . 17 LEU HB3 1 1 10 7537 2 2 17 LEU HD11 H 8.744 -8.846 -6.826 1.00 . B B . 17 LEU HD11 1 1 10 7538 2 2 17 LEU HD12 H 8.925 -9.145 -5.100 1.00 . B B . 17 LEU HD12 1 1 10 7539 2 2 17 LEU HD13 H 10.352 -8.938 -6.109 1.00 . B B . 17 LEU HD13 1 1 10 7540 2 2 17 LEU HD21 H 9.909 -6.215 -7.533 1.00 . B B . 17 LEU HD21 1 1 10 7541 2 2 17 LEU HD22 H 11.184 -7.108 -6.704 1.00 . B B . 17 LEU HD22 1 1 10 7542 2 2 17 LEU HD23 H 10.682 -5.526 -6.105 1.00 . B B . 17 LEU HD23 1 1 10 7543 2 2 17 LEU HG H 9.512 -6.902 -4.655 1.00 . B B . 17 LEU HG 1 1 10 7544 2 2 17 LEU N N 5.560 -6.872 -6.053 1.00 . B B . 17 LEU N 1 1 10 7545 2 2 17 LEU O O 7.751 -8.376 -3.623 1.00 . B B . 17 LEU O 1 1 10 7546 2 2 18 VAL C C 4.761 -8.741 -1.698 1.00 . B B . 18 VAL C 1 1 10 7547 2 2 18 VAL CA C 5.769 -7.625 -1.983 1.00 . B B . 18 VAL CA 1 1 10 7548 2 2 18 VAL CB C 5.371 -6.343 -1.240 1.00 . B B . 18 VAL CB 1 1 10 7549 2 2 18 VAL CG1 C 5.955 -5.143 -1.974 1.00 . B B . 18 VAL CG1 1 1 10 7550 2 2 18 VAL CG2 C 3.846 -6.196 -1.187 1.00 . B B . 18 VAL CG2 1 1 10 7551 2 2 18 VAL H H 5.080 -6.884 -3.885 1.00 . B B . 18 VAL H 1 1 10 7552 2 2 18 VAL HA H 6.747 -7.939 -1.648 1.00 . B B . 18 VAL HA 1 1 10 7553 2 2 18 VAL HB H 5.766 -6.374 -0.236 1.00 . B B . 18 VAL HB 1 1 10 7554 2 2 18 VAL HG11 H 5.156 -4.593 -2.449 1.00 . B B . 18 VAL HG11 1 1 10 7555 2 2 18 VAL HG12 H 6.653 -5.487 -2.723 1.00 . B B . 18 VAL HG12 1 1 10 7556 2 2 18 VAL HG13 H 6.464 -4.506 -1.269 1.00 . B B . 18 VAL HG13 1 1 10 7557 2 2 18 VAL HG21 H 3.420 -7.047 -0.677 1.00 . B B . 18 VAL HG21 1 1 10 7558 2 2 18 VAL HG22 H 3.454 -6.143 -2.191 1.00 . B B . 18 VAL HG22 1 1 10 7559 2 2 18 VAL HG23 H 3.592 -5.292 -0.653 1.00 . B B . 18 VAL HG23 1 1 10 7560 2 2 18 VAL N N 5.816 -7.362 -3.450 1.00 . B B . 18 VAL N 1 1 10 7561 2 2 18 VAL O O 5.010 -9.634 -0.913 1.00 . B B . 18 VAL O 1 1 10 7562 2 2 19 CYS C C 2.620 -10.748 -3.262 1.00 . B B . 19 CYS C 1 1 10 7563 2 2 19 CYS CA C 2.597 -9.749 -2.101 1.00 . B B . 19 CYS CA 1 1 10 7564 2 2 19 CYS CB C 1.214 -9.102 -2.016 1.00 . B B . 19 CYS CB 1 1 10 7565 2 2 19 CYS H H 3.440 -7.966 -2.961 1.00 . B B . 19 CYS H 1 1 10 7566 2 2 19 CYS HA H 2.815 -10.260 -1.177 1.00 . B B . 19 CYS HA 1 1 10 7567 2 2 19 CYS HB2 H 1.259 -8.102 -2.420 1.00 . B B . 19 CYS HB2 1 1 10 7568 2 2 19 CYS HB3 H 0.506 -9.688 -2.586 1.00 . B B . 19 CYS HB3 1 1 10 7569 2 2 19 CYS N N 3.622 -8.695 -2.332 1.00 . B B . 19 CYS N 1 1 10 7570 2 2 19 CYS O O 2.599 -11.948 -3.064 1.00 . B B . 19 CYS O 1 1 10 7571 2 2 19 CYS SG S 0.679 -9.026 -0.289 1.00 . B B . 19 CYS SG 1 1 10 7572 2 2 20 GLY C C 1.389 -11.978 -5.709 1.00 . B B . 20 GLY C 1 1 10 7573 2 2 20 GLY CA C 2.689 -11.175 -5.651 1.00 . B B . 20 GLY CA 1 1 10 7574 2 2 20 GLY H H 2.680 -9.291 -4.608 1.00 . B B . 20 GLY H 1 1 10 7575 2 2 20 GLY HA2 H 2.792 -10.592 -6.555 1.00 . B B . 20 GLY HA2 1 1 10 7576 2 2 20 GLY HA3 H 3.524 -11.854 -5.564 1.00 . B B . 20 GLY HA3 1 1 10 7577 2 2 20 GLY N N 2.663 -10.261 -4.473 1.00 . B B . 20 GLY N 1 1 10 7578 2 2 20 GLY O O 0.387 -11.521 -6.220 1.00 . B B . 20 GLY O 1 1 10 7579 2 2 21 GLU C C -0.674 -13.714 -3.972 1.00 . B B . 21 GLU C 1 1 10 7580 2 2 21 GLU CA C 0.161 -14.006 -5.219 1.00 . B B . 21 GLU CA 1 1 10 7581 2 2 21 GLU CB C 0.544 -15.487 -5.246 1.00 . B B . 21 GLU CB 1 1 10 7582 2 2 21 GLU CD C 2.911 -15.847 -4.531 1.00 . B B . 21 GLU CD 1 1 10 7583 2 2 21 GLU CG C 1.458 -15.801 -4.059 1.00 . B B . 21 GLU CG 1 1 10 7584 2 2 21 GLU H H 2.216 -13.528 -4.783 1.00 . B B . 21 GLU H 1 1 10 7585 2 2 21 GLU HA H -0.414 -13.766 -6.101 1.00 . B B . 21 GLU HA 1 1 10 7586 2 2 21 GLU HB2 H -0.349 -16.091 -5.184 1.00 . B B . 21 GLU HB2 1 1 10 7587 2 2 21 GLU HB3 H 1.065 -15.706 -6.165 1.00 . B B . 21 GLU HB3 1 1 10 7588 2 2 21 GLU HG2 H 1.346 -15.033 -3.307 1.00 . B B . 21 GLU HG2 1 1 10 7589 2 2 21 GLU HG3 H 1.186 -16.758 -3.639 1.00 . B B . 21 GLU HG3 1 1 10 7590 2 2 21 GLU N N 1.397 -13.174 -5.190 1.00 . B B . 21 GLU N 1 1 10 7591 2 2 21 GLU O O -1.842 -14.042 -3.902 1.00 . B B . 21 GLU O 1 1 10 7592 2 2 21 GLU OE1 O 3.200 -16.628 -5.421 1.00 . B B . 21 GLU OE1 1 1 10 7593 2 2 21 GLU OE2 O 3.713 -15.099 -3.993 1.00 . B B . 21 GLU OE2 1 1 10 7594 2 2 22 ARG C C -2.118 -12.025 -2.115 1.00 . B B . 22 ARG C 1 1 10 7595 2 2 22 ARG CA C -0.842 -12.778 -1.745 1.00 . B B . 22 ARG CA 1 1 10 7596 2 2 22 ARG CB C 0.025 -11.911 -0.829 1.00 . B B . 22 ARG CB 1 1 10 7597 2 2 22 ARG CD C -0.118 -13.623 0.985 1.00 . B B . 22 ARG CD 1 1 10 7598 2 2 22 ARG CG C 0.835 -12.813 0.106 1.00 . B B . 22 ARG CG 1 1 10 7599 2 2 22 ARG CZ C 0.051 -14.785 3.103 1.00 . B B . 22 ARG CZ 1 1 10 7600 2 2 22 ARG H H 0.857 -12.837 -3.064 1.00 . B B . 22 ARG H 1 1 10 7601 2 2 22 ARG HA H -1.100 -13.693 -1.239 1.00 . B B . 22 ARG HA 1 1 10 7602 2 2 22 ARG HB2 H 0.698 -11.317 -1.429 1.00 . B B . 22 ARG HB2 1 1 10 7603 2 2 22 ARG HB3 H -0.607 -11.262 -0.242 1.00 . B B . 22 ARG HB3 1 1 10 7604 2 2 22 ARG HD2 H -1.045 -13.081 1.107 1.00 . B B . 22 ARG HD2 1 1 10 7605 2 2 22 ARG HD3 H -0.317 -14.576 0.518 1.00 . B B . 22 ARG HD3 1 1 10 7606 2 2 22 ARG HE H 1.256 -13.287 2.609 1.00 . B B . 22 ARG HE 1 1 10 7607 2 2 22 ARG HG2 H 1.445 -13.484 -0.481 1.00 . B B . 22 ARG HG2 1 1 10 7608 2 2 22 ARG HG3 H 1.469 -12.205 0.732 1.00 . B B . 22 ARG HG3 1 1 10 7609 2 2 22 ARG HH11 H -1.611 -13.781 3.590 1.00 . B B . 22 ARG HH11 1 1 10 7610 2 2 22 ARG HH12 H -1.437 -15.342 4.319 1.00 . B B . 22 ARG HH12 1 1 10 7611 2 2 22 ARG HH21 H 1.603 -16.009 2.792 1.00 . B B . 22 ARG HH21 1 1 10 7612 2 2 22 ARG HH22 H 0.385 -16.603 3.870 1.00 . B B . 22 ARG HH22 1 1 10 7613 2 2 22 ARG N N -0.084 -13.094 -2.986 1.00 . B B . 22 ARG N 1 1 10 7614 2 2 22 ARG NE N 0.505 -13.846 2.320 1.00 . B B . 22 ARG NE 1 1 10 7615 2 2 22 ARG NH1 N -1.088 -14.624 3.718 1.00 . B B . 22 ARG NH1 1 1 10 7616 2 2 22 ARG NH2 N 0.733 -15.885 3.267 1.00 . B B . 22 ARG NH2 1 1 10 7617 2 2 22 ARG O O -3.080 -12.003 -1.374 1.00 . B B . 22 ARG O 1 1 10 7618 2 2 23 GLY C C -3.424 -9.331 -2.966 1.00 . B B . 23 GLY C 1 1 10 7619 2 2 23 GLY CA C -3.344 -10.668 -3.703 1.00 . B B . 23 GLY CA 1 1 10 7620 2 2 23 GLY H H -1.344 -11.455 -3.847 1.00 . B B . 23 GLY H 1 1 10 7621 2 2 23 GLY HA2 H -3.288 -10.488 -4.767 1.00 . B B . 23 GLY HA2 1 1 10 7622 2 2 23 GLY HA3 H -4.225 -11.250 -3.482 1.00 . B B . 23 GLY HA3 1 1 10 7623 2 2 23 GLY N N -2.132 -11.415 -3.266 1.00 . B B . 23 GLY N 1 1 10 7624 2 2 23 GLY O O -4.118 -9.196 -1.977 1.00 . B B . 23 GLY O 1 1 10 7625 2 2 24 PHE C C -3.880 -6.175 -3.418 1.00 . B B . 24 PHE C 1 1 10 7626 2 2 24 PHE CA C -2.777 -7.009 -2.776 1.00 . B B . 24 PHE CA 1 1 10 7627 2 2 24 PHE CB C -1.434 -6.299 -2.938 1.00 . B B . 24 PHE CB 1 1 10 7628 2 2 24 PHE CD1 C -1.572 -4.961 -5.069 1.00 . B B . 24 PHE CD1 1 1 10 7629 2 2 24 PHE CD2 C -0.435 -7.104 -5.104 1.00 . B B . 24 PHE CD2 1 1 10 7630 2 2 24 PHE CE1 C -1.297 -4.792 -6.432 1.00 . B B . 24 PHE CE1 1 1 10 7631 2 2 24 PHE CE2 C -0.160 -6.936 -6.467 1.00 . B B . 24 PHE CE2 1 1 10 7632 2 2 24 PHE CG C -1.140 -6.117 -4.406 1.00 . B B . 24 PHE CG 1 1 10 7633 2 2 24 PHE CZ C -0.591 -5.781 -7.132 1.00 . B B . 24 PHE CZ 1 1 10 7634 2 2 24 PHE H H -2.180 -8.464 -4.248 1.00 . B B . 24 PHE H 1 1 10 7635 2 2 24 PHE HA H -2.995 -7.142 -1.729 1.00 . B B . 24 PHE HA 1 1 10 7636 2 2 24 PHE HB2 H -1.476 -5.333 -2.455 1.00 . B B . 24 PHE HB2 1 1 10 7637 2 2 24 PHE HB3 H -0.654 -6.893 -2.487 1.00 . B B . 24 PHE HB3 1 1 10 7638 2 2 24 PHE HD1 H -2.117 -4.200 -4.529 1.00 . B B . 24 PHE HD1 1 1 10 7639 2 2 24 PHE HD2 H -0.104 -7.995 -4.592 1.00 . B B . 24 PHE HD2 1 1 10 7640 2 2 24 PHE HE1 H -1.632 -3.902 -6.944 1.00 . B B . 24 PHE HE1 1 1 10 7641 2 2 24 PHE HE2 H 0.382 -7.698 -7.006 1.00 . B B . 24 PHE HE2 1 1 10 7642 2 2 24 PHE HZ H -0.376 -5.651 -8.183 1.00 . B B . 24 PHE HZ 1 1 10 7643 2 2 24 PHE N N -2.728 -8.338 -3.445 1.00 . B B . 24 PHE N 1 1 10 7644 2 2 24 PHE O O -4.112 -6.246 -4.609 1.00 . B B . 24 PHE O 1 1 10 7645 2 2 25 PHE C C -5.230 -3.131 -3.420 1.00 . B B . 25 PHE C 1 1 10 7646 2 2 25 PHE CA C -5.678 -4.580 -3.215 1.00 . B B . 25 PHE CA 1 1 10 7647 2 2 25 PHE CB C -6.886 -4.612 -2.277 1.00 . B B . 25 PHE CB 1 1 10 7648 2 2 25 PHE CD1 C -5.910 -4.918 0.026 1.00 . B B . 25 PHE CD1 1 1 10 7649 2 2 25 PHE CD2 C -6.720 -2.722 -0.616 1.00 . B B . 25 PHE CD2 1 1 10 7650 2 2 25 PHE CE1 C -5.550 -4.417 1.284 1.00 . B B . 25 PHE CE1 1 1 10 7651 2 2 25 PHE CE2 C -6.360 -2.221 0.642 1.00 . B B . 25 PHE CE2 1 1 10 7652 2 2 25 PHE CG C -6.495 -4.071 -0.924 1.00 . B B . 25 PHE CG 1 1 10 7653 2 2 25 PHE CZ C -5.774 -3.069 1.592 1.00 . B B . 25 PHE CZ 1 1 10 7654 2 2 25 PHE H H -4.387 -5.362 -1.680 1.00 . B B . 25 PHE H 1 1 10 7655 2 2 25 PHE HA H -5.961 -4.999 -4.167 1.00 . B B . 25 PHE HA 1 1 10 7656 2 2 25 PHE HB2 H -7.678 -4.005 -2.691 1.00 . B B . 25 PHE HB2 1 1 10 7657 2 2 25 PHE HB3 H -7.232 -5.629 -2.170 1.00 . B B . 25 PHE HB3 1 1 10 7658 2 2 25 PHE HD1 H -5.736 -5.957 -0.212 1.00 . B B . 25 PHE HD1 1 1 10 7659 2 2 25 PHE HD2 H -7.170 -2.069 -1.349 1.00 . B B . 25 PHE HD2 1 1 10 7660 2 2 25 PHE HE1 H -5.099 -5.071 2.015 1.00 . B B . 25 PHE HE1 1 1 10 7661 2 2 25 PHE HE2 H -6.533 -1.181 0.880 1.00 . B B . 25 PHE HE2 1 1 10 7662 2 2 25 PHE HZ H -5.498 -2.684 2.562 1.00 . B B . 25 PHE HZ 1 1 10 7663 2 2 25 PHE N N -4.578 -5.398 -2.640 1.00 . B B . 25 PHE N 1 1 10 7664 2 2 25 PHE O O -4.976 -2.407 -2.478 1.00 . B B . 25 PHE O 1 1 10 7665 2 2 26 TYR C C -5.996 -0.549 -5.461 1.00 . B B . 26 TYR C 1 1 10 7666 2 2 26 TYR CA C -4.762 -1.291 -4.928 1.00 . B B . 26 TYR CA 1 1 10 7667 2 2 26 TYR CB C -3.633 -1.264 -5.972 1.00 . B B . 26 TYR CB 1 1 10 7668 2 2 26 TYR CD1 C -3.630 1.249 -5.967 1.00 . B B . 26 TYR CD1 1 1 10 7669 2 2 26 TYR CD2 C -3.762 0.094 -8.096 1.00 . B B . 26 TYR CD2 1 1 10 7670 2 2 26 TYR CE1 C -3.690 2.480 -6.627 1.00 . B B . 26 TYR CE1 1 1 10 7671 2 2 26 TYR CE2 C -3.828 1.325 -8.759 1.00 . B B . 26 TYR CE2 1 1 10 7672 2 2 26 TYR CG C -3.663 0.059 -6.700 1.00 . B B . 26 TYR CG 1 1 10 7673 2 2 26 TYR CZ C -3.791 2.519 -8.025 1.00 . B B . 26 TYR CZ 1 1 10 7674 2 2 26 TYR H H -5.388 -3.295 -5.390 1.00 . B B . 26 TYR H 1 1 10 7675 2 2 26 TYR HA H -4.424 -0.821 -4.014 1.00 . B B . 26 TYR HA 1 1 10 7676 2 2 26 TYR HB2 H -2.681 -1.383 -5.477 1.00 . B B . 26 TYR HB2 1 1 10 7677 2 2 26 TYR HB3 H -3.776 -2.066 -6.679 1.00 . B B . 26 TYR HB3 1 1 10 7678 2 2 26 TYR HD1 H -3.549 1.217 -4.891 1.00 . B B . 26 TYR HD1 1 1 10 7679 2 2 26 TYR HD2 H -3.785 -0.826 -8.662 1.00 . B B . 26 TYR HD2 1 1 10 7680 2 2 26 TYR HE1 H -3.667 3.397 -6.059 1.00 . B B . 26 TYR HE1 1 1 10 7681 2 2 26 TYR HE2 H -3.910 1.353 -9.833 1.00 . B B . 26 TYR HE2 1 1 10 7682 2 2 26 TYR HH H -4.529 4.265 -8.246 1.00 . B B . 26 TYR HH 1 1 10 7683 2 2 26 TYR N N -5.158 -2.698 -4.649 1.00 . B B . 26 TYR N 1 1 10 7684 2 2 26 TYR O O -6.449 -0.797 -6.560 1.00 . B B . 26 TYR O 1 1 10 7685 2 2 26 TYR OH O -3.857 3.732 -8.678 1.00 . B B . 26 TYR OH 1 1 10 7686 2 2 27 THR C C -7.403 2.204 -6.104 1.00 . B B . 27 THR C 1 1 10 7687 2 2 27 THR CA C -7.766 1.069 -5.146 1.00 . B B . 27 THR CA 1 1 10 7688 2 2 27 THR CB C -8.483 1.650 -3.928 1.00 . B B . 27 THR CB 1 1 10 7689 2 2 27 THR CG2 C -8.702 0.554 -2.884 1.00 . B B . 27 THR CG2 1 1 10 7690 2 2 27 THR H H -6.195 0.516 -3.795 1.00 . B B . 27 THR H 1 1 10 7691 2 2 27 THR HA H -8.420 0.381 -5.652 1.00 . B B . 27 THR HA 1 1 10 7692 2 2 27 THR HB H -9.434 2.047 -4.231 1.00 . B B . 27 THR HB 1 1 10 7693 2 2 27 THR HG1 H -7.776 3.463 -3.927 1.00 . B B . 27 THR HG1 1 1 10 7694 2 2 27 THR HG21 H -8.474 -0.409 -3.319 1.00 . B B . 27 THR HG21 1 1 10 7695 2 2 27 THR HG22 H -9.732 0.568 -2.560 1.00 . B B . 27 THR HG22 1 1 10 7696 2 2 27 THR HG23 H -8.055 0.730 -2.038 1.00 . B B . 27 THR HG23 1 1 10 7697 2 2 27 THR N N -6.556 0.341 -4.687 1.00 . B B . 27 THR N 1 1 10 7698 2 2 27 THR O O -6.304 2.723 -6.098 1.00 . B B . 27 THR O 1 1 10 7699 2 2 27 THR OG1 O -7.692 2.687 -3.366 1.00 . B B . 27 THR OG1 1 1 10 7700 2 2 28 LYS C C -9.475 4.163 -8.419 1.00 . B B . 28 LYS C 1 1 10 7701 2 2 28 LYS CA C -8.114 3.698 -7.891 1.00 . B B . 28 LYS CA 1 1 10 7702 2 2 28 LYS CB C -7.252 3.190 -9.053 1.00 . B B . 28 LYS CB 1 1 10 7703 2 2 28 LYS CD C -5.949 4.655 -10.609 1.00 . B B . 28 LYS CD 1 1 10 7704 2 2 28 LYS CE C -5.694 6.008 -9.944 1.00 . B B . 28 LYS CE 1 1 10 7705 2 2 28 LYS CG C -7.348 4.161 -10.237 1.00 . B B . 28 LYS CG 1 1 10 7706 2 2 28 LYS H H -9.220 2.154 -6.889 1.00 . B B . 28 LYS H 1 1 10 7707 2 2 28 LYS HA H -7.614 4.519 -7.396 1.00 . B B . 28 LYS HA 1 1 10 7708 2 2 28 LYS HB2 H -6.224 3.117 -8.731 1.00 . B B . 28 LYS HB2 1 1 10 7709 2 2 28 LYS HB3 H -7.602 2.216 -9.360 1.00 . B B . 28 LYS HB3 1 1 10 7710 2 2 28 LYS HD2 H -5.213 3.941 -10.271 1.00 . B B . 28 LYS HD2 1 1 10 7711 2 2 28 LYS HD3 H -5.879 4.765 -11.681 1.00 . B B . 28 LYS HD3 1 1 10 7712 2 2 28 LYS HE2 H -6.524 6.254 -9.298 1.00 . B B . 28 LYS HE2 1 1 10 7713 2 2 28 LYS HE3 H -4.786 5.957 -9.359 1.00 . B B . 28 LYS HE3 1 1 10 7714 2 2 28 LYS HG2 H -7.788 3.652 -11.082 1.00 . B B . 28 LYS HG2 1 1 10 7715 2 2 28 LYS HG3 H -7.963 5.005 -9.965 1.00 . B B . 28 LYS HG3 1 1 10 7716 2 2 28 LYS HZ1 H -5.856 7.978 -10.605 1.00 . B B . 28 LYS HZ1 1 1 10 7717 2 2 28 LYS HZ2 H -6.144 6.815 -11.811 1.00 . B B . 28 LYS HZ2 1 1 10 7718 2 2 28 LYS HZ3 H -4.558 7.125 -11.287 1.00 . B B . 28 LYS HZ3 1 1 10 7719 2 2 28 LYS N N -8.344 2.592 -6.921 1.00 . B B . 28 LYS N 1 1 10 7720 2 2 28 LYS NZ N -5.552 7.060 -10.991 1.00 . B B . 28 LYS NZ 1 1 10 7721 2 2 28 LYS O O -9.914 3.727 -9.464 1.00 . B B . 28 LYS O 1 1 10 7722 2 2 29 PRO C C -11.331 6.619 -9.120 1.00 . B B . 29 PRO C 1 1 10 7723 2 2 29 PRO CA C -11.438 5.562 -8.019 1.00 . B B . 29 PRO CA 1 1 10 7724 2 2 29 PRO CB C -11.934 6.181 -6.711 1.00 . B B . 29 PRO CB 1 1 10 7725 2 2 29 PRO CD C -9.562 5.552 -6.399 1.00 . B B . 29 PRO CD 1 1 10 7726 2 2 29 PRO CG C -10.677 6.468 -5.858 1.00 . B B . 29 PRO CG 1 1 10 7727 2 2 29 PRO HA H -12.098 4.766 -8.320 1.00 . B B . 29 PRO HA 1 1 10 7728 2 2 29 PRO HB2 H -12.467 7.100 -6.914 1.00 . B B . 29 PRO HB2 1 1 10 7729 2 2 29 PRO HB3 H -12.576 5.487 -6.190 1.00 . B B . 29 PRO HB3 1 1 10 7730 2 2 29 PRO HD2 H -8.660 6.120 -6.579 1.00 . B B . 29 PRO HD2 1 1 10 7731 2 2 29 PRO HD3 H -9.370 4.742 -5.713 1.00 . B B . 29 PRO HD3 1 1 10 7732 2 2 29 PRO HG2 H -10.391 7.507 -5.960 1.00 . B B . 29 PRO HG2 1 1 10 7733 2 2 29 PRO HG3 H -10.869 6.235 -4.822 1.00 . B B . 29 PRO HG3 1 1 10 7734 2 2 29 PRO N N -10.110 5.027 -7.667 1.00 . B B . 29 PRO N 1 1 10 7735 2 2 29 PRO O O -10.536 7.536 -9.043 1.00 . B B . 29 PRO O 1 1 10 7736 2 2 30 THR C C -13.096 8.607 -10.975 1.00 . B B . 30 THR C 1 1 10 7737 2 2 30 THR CA C -12.087 7.492 -11.252 1.00 . B B . 30 THR CA 1 1 10 7738 2 2 30 THR CB C -12.439 6.803 -12.573 1.00 . B B . 30 THR CB 1 1 10 7739 2 2 30 THR CG2 C -11.629 7.429 -13.709 1.00 . B B . 30 THR CG2 1 1 10 7740 2 2 30 THR H H -12.765 5.751 -10.183 1.00 . B B . 30 THR H 1 1 10 7741 2 2 30 THR HA H -11.095 7.914 -11.319 1.00 . B B . 30 THR HA 1 1 10 7742 2 2 30 THR HB H -13.492 6.929 -12.775 1.00 . B B . 30 THR HB 1 1 10 7743 2 2 30 THR HG1 H -12.511 4.981 -13.246 1.00 . B B . 30 THR HG1 1 1 10 7744 2 2 30 THR HG21 H -11.284 6.651 -14.375 1.00 . B B . 30 THR HG21 1 1 10 7745 2 2 30 THR HG22 H -10.782 7.955 -13.299 1.00 . B B . 30 THR HG22 1 1 10 7746 2 2 30 THR HG23 H -12.253 8.121 -14.258 1.00 . B B . 30 THR HG23 1 1 10 7747 2 2 30 THR N N -12.131 6.497 -10.144 1.00 . B B . 30 THR N 1 1 10 7748 2 2 30 THR O O -13.667 9.113 -11.927 1.00 . B B . 30 THR O 1 1 10 7749 2 2 30 THR OXT O -13.284 8.933 -9.815 1.00 . B B . 30 THR OXT 1 1 10 7750 2 2 30 THR OG1 O -12.137 5.420 -12.479 1.00 . B B . 30 THR OG1 1 1 11 7751 1 1 1 GLY C C -3.863 7.049 0.033 1.00 . A A . 1 GLY C 1 1 11 7752 1 1 1 GLY CA C -5.320 7.380 0.063 1.00 . A A . 1 GLY CA 1 1 11 7753 1 1 1 GLY H1 H -6.955 8.105 1.194 1.00 . A A . 1 GLY H1 1 1 11 7754 1 1 1 GLY H2 H -5.467 8.803 1.622 1.00 . A A . 1 GLY H2 1 1 11 7755 1 1 1 GLY H3 H -5.834 7.218 2.109 1.00 . A A . 1 GLY H3 1 1 11 7756 1 1 1 GLY HA2 H -5.439 6.416 -0.005 1.00 . A A . 1 GLY HA2 1 1 11 7757 1 1 1 GLY HA3 H -5.810 7.966 -0.821 1.00 . A A . 1 GLY HA3 1 1 11 7758 1 1 1 GLY N N -5.943 7.919 1.350 1.00 . A A . 1 GLY N 1 1 11 7759 1 1 1 GLY O O -3.067 7.661 0.715 1.00 . A A . 1 GLY O 1 1 11 7760 1 1 2 ILE C C -1.476 6.225 -2.161 1.00 . A A . 2 ILE C 1 1 11 7761 1 1 2 ILE CA C -2.034 5.720 -0.836 1.00 . A A . 2 ILE CA 1 1 11 7762 1 1 2 ILE CB C -1.889 4.200 -0.759 1.00 . A A . 2 ILE CB 1 1 11 7763 1 1 2 ILE CD1 C -0.221 2.334 -0.821 1.00 . A A . 2 ILE CD1 1 1 11 7764 1 1 2 ILE CG1 C -0.414 3.830 -0.565 1.00 . A A . 2 ILE CG1 1 1 11 7765 1 1 2 ILE CG2 C -2.404 3.577 -2.056 1.00 . A A . 2 ILE CG2 1 1 11 7766 1 1 2 ILE H H -4.129 5.607 -1.312 1.00 . A A . 2 ILE H 1 1 11 7767 1 1 2 ILE HA H -1.499 6.176 -0.018 1.00 . A A . 2 ILE HA 1 1 11 7768 1 1 2 ILE HB H -2.470 3.830 0.071 1.00 . A A . 2 ILE HB 1 1 11 7769 1 1 2 ILE HD11 H -1.121 1.803 -0.546 1.00 . A A . 2 ILE HD11 1 1 11 7770 1 1 2 ILE HD12 H 0.607 1.971 -0.230 1.00 . A A . 2 ILE HD12 1 1 11 7771 1 1 2 ILE HD13 H -0.014 2.173 -1.869 1.00 . A A . 2 ILE HD13 1 1 11 7772 1 1 2 ILE HG12 H 0.194 4.393 -1.257 1.00 . A A . 2 ILE HG12 1 1 11 7773 1 1 2 ILE HG13 H -0.115 4.059 0.448 1.00 . A A . 2 ILE HG13 1 1 11 7774 1 1 2 ILE HG21 H -2.378 2.502 -1.973 1.00 . A A . 2 ILE HG21 1 1 11 7775 1 1 2 ILE HG22 H -1.777 3.891 -2.878 1.00 . A A . 2 ILE HG22 1 1 11 7776 1 1 2 ILE HG23 H -3.418 3.902 -2.234 1.00 . A A . 2 ILE HG23 1 1 11 7777 1 1 2 ILE N N -3.474 6.084 -0.758 1.00 . A A . 2 ILE N 1 1 11 7778 1 1 2 ILE O O -0.328 6.606 -2.266 1.00 . A A . 2 ILE O 1 1 11 7779 1 1 3 VAL C C -1.187 8.082 -4.376 1.00 . A A . 3 VAL C 1 1 11 7780 1 1 3 VAL CA C -1.834 6.702 -4.507 1.00 . A A . 3 VAL CA 1 1 11 7781 1 1 3 VAL CB C -3.038 6.788 -5.444 1.00 . A A . 3 VAL CB 1 1 11 7782 1 1 3 VAL CG1 C -2.553 6.882 -6.888 1.00 . A A . 3 VAL CG1 1 1 11 7783 1 1 3 VAL CG2 C -3.900 5.534 -5.280 1.00 . A A . 3 VAL CG2 1 1 11 7784 1 1 3 VAL H H -3.213 5.915 -3.061 1.00 . A A . 3 VAL H 1 1 11 7785 1 1 3 VAL HA H -1.116 6.005 -4.910 1.00 . A A . 3 VAL HA 1 1 11 7786 1 1 3 VAL HB H -3.623 7.663 -5.202 1.00 . A A . 3 VAL HB 1 1 11 7787 1 1 3 VAL HG11 H -3.375 6.676 -7.556 1.00 . A A . 3 VAL HG11 1 1 11 7788 1 1 3 VAL HG12 H -1.767 6.160 -7.049 1.00 . A A . 3 VAL HG12 1 1 11 7789 1 1 3 VAL HG13 H -2.175 7.876 -7.074 1.00 . A A . 3 VAL HG13 1 1 11 7790 1 1 3 VAL HG21 H -4.442 5.347 -6.195 1.00 . A A . 3 VAL HG21 1 1 11 7791 1 1 3 VAL HG22 H -4.599 5.681 -4.470 1.00 . A A . 3 VAL HG22 1 1 11 7792 1 1 3 VAL HG23 H -3.265 4.689 -5.058 1.00 . A A . 3 VAL HG23 1 1 11 7793 1 1 3 VAL N N -2.291 6.228 -3.176 1.00 . A A . 3 VAL N 1 1 11 7794 1 1 3 VAL O O -0.106 8.318 -4.874 1.00 . A A . 3 VAL O 1 1 11 7795 1 1 4 GLU C C -0.250 10.368 -2.412 1.00 . A A . 4 GLU C 1 1 11 7796 1 1 4 GLU CA C -1.259 10.363 -3.561 1.00 . A A . 4 GLU CA 1 1 11 7797 1 1 4 GLU CB C -2.377 11.364 -3.259 1.00 . A A . 4 GLU CB 1 1 11 7798 1 1 4 GLU CD C -2.795 13.594 -2.209 1.00 . A A . 4 GLU CD 1 1 11 7799 1 1 4 GLU CG C -1.770 12.735 -2.955 1.00 . A A . 4 GLU CG 1 1 11 7800 1 1 4 GLU H H -2.715 8.792 -3.322 1.00 . A A . 4 GLU H 1 1 11 7801 1 1 4 GLU HA H -0.760 10.648 -4.476 1.00 . A A . 4 GLU HA 1 1 11 7802 1 1 4 GLU HB2 H -3.032 11.441 -4.114 1.00 . A A . 4 GLU HB2 1 1 11 7803 1 1 4 GLU HB3 H -2.941 11.025 -2.402 1.00 . A A . 4 GLU HB3 1 1 11 7804 1 1 4 GLU HG2 H -0.889 12.613 -2.342 1.00 . A A . 4 GLU HG2 1 1 11 7805 1 1 4 GLU HG3 H -1.501 13.222 -3.880 1.00 . A A . 4 GLU HG3 1 1 11 7806 1 1 4 GLU N N -1.840 8.999 -3.715 1.00 . A A . 4 GLU N 1 1 11 7807 1 1 4 GLU O O 0.810 10.953 -2.507 1.00 . A A . 4 GLU O 1 1 11 7808 1 1 4 GLU OE1 O -3.928 13.158 -2.091 1.00 . A A . 4 GLU OE1 1 1 11 7809 1 1 4 GLU OE2 O -2.428 14.671 -1.770 1.00 . A A . 4 GLU OE2 1 1 11 7810 1 1 5 GLN C C 1.688 9.056 -0.586 1.00 . A A . 5 GLN C 1 1 11 7811 1 1 5 GLN CA C 0.365 9.702 -0.170 1.00 . A A . 5 GLN CA 1 1 11 7812 1 1 5 GLN CB C -0.258 8.899 0.973 1.00 . A A . 5 GLN CB 1 1 11 7813 1 1 5 GLN CD C -0.680 10.405 2.920 1.00 . A A . 5 GLN CD 1 1 11 7814 1 1 5 GLN CG C -1.307 9.753 1.687 1.00 . A A . 5 GLN CG 1 1 11 7815 1 1 5 GLN H H -1.436 9.265 -1.266 1.00 . A A . 5 GLN H 1 1 11 7816 1 1 5 GLN HA H 0.552 10.712 0.161 1.00 . A A . 5 GLN HA 1 1 11 7817 1 1 5 GLN HB2 H -0.726 8.010 0.574 1.00 . A A . 5 GLN HB2 1 1 11 7818 1 1 5 GLN HB3 H 0.512 8.615 1.676 1.00 . A A . 5 GLN HB3 1 1 11 7819 1 1 5 GLN HE21 H -1.660 12.116 2.692 1.00 . A A . 5 GLN HE21 1 1 11 7820 1 1 5 GLN HE22 H -0.614 12.052 4.026 1.00 . A A . 5 GLN HE22 1 1 11 7821 1 1 5 GLN HG2 H -1.665 10.520 1.014 1.00 . A A . 5 GLN HG2 1 1 11 7822 1 1 5 GLN HG3 H -2.132 9.128 1.992 1.00 . A A . 5 GLN HG3 1 1 11 7823 1 1 5 GLN N N -0.573 9.727 -1.325 1.00 . A A . 5 GLN N 1 1 11 7824 1 1 5 GLN NE2 N -1.013 11.626 3.240 1.00 . A A . 5 GLN NE2 1 1 11 7825 1 1 5 GLN O O 2.747 9.462 -0.153 1.00 . A A . 5 GLN O 1 1 11 7826 1 1 5 GLN OE1 O 0.123 9.797 3.599 1.00 . A A . 5 GLN OE1 1 1 11 7827 1 1 6 CYS C C 3.493 8.155 -3.043 1.00 . A A . 6 CYS C 1 1 11 7828 1 1 6 CYS CA C 2.905 7.398 -1.852 1.00 . A A . 6 CYS CA 1 1 11 7829 1 1 6 CYS CB C 2.631 5.945 -2.246 1.00 . A A . 6 CYS CB 1 1 11 7830 1 1 6 CYS H H 0.780 7.738 -1.764 1.00 . A A . 6 CYS H 1 1 11 7831 1 1 6 CYS HA H 3.610 7.421 -1.036 1.00 . A A . 6 CYS HA 1 1 11 7832 1 1 6 CYS HB2 H 1.590 5.830 -2.503 1.00 . A A . 6 CYS HB2 1 1 11 7833 1 1 6 CYS HB3 H 3.243 5.681 -3.094 1.00 . A A . 6 CYS HB3 1 1 11 7834 1 1 6 CYS N N 1.641 8.055 -1.422 1.00 . A A . 6 CYS N 1 1 11 7835 1 1 6 CYS O O 4.690 8.165 -3.253 1.00 . A A . 6 CYS O 1 1 11 7836 1 1 6 CYS SG S 3.033 4.861 -0.855 1.00 . A A . 6 CYS SG 1 1 11 7837 1 1 7 CYS C C 3.765 10.889 -4.473 1.00 . A A . 7 CYS C 1 1 11 7838 1 1 7 CYS CA C 3.188 9.566 -4.981 1.00 . A A . 7 CYS CA 1 1 11 7839 1 1 7 CYS CB C 2.053 9.857 -5.965 1.00 . A A . 7 CYS CB 1 1 11 7840 1 1 7 CYS H H 1.703 8.788 -3.627 1.00 . A A . 7 CYS H 1 1 11 7841 1 1 7 CYS HA H 3.962 8.995 -5.470 1.00 . A A . 7 CYS HA 1 1 11 7842 1 1 7 CYS HB2 H 1.121 9.921 -5.426 1.00 . A A . 7 CYS HB2 1 1 11 7843 1 1 7 CYS HB3 H 2.245 10.795 -6.463 1.00 . A A . 7 CYS HB3 1 1 11 7844 1 1 7 CYS N N 2.665 8.800 -3.817 1.00 . A A . 7 CYS N 1 1 11 7845 1 1 7 CYS O O 4.644 11.469 -5.079 1.00 . A A . 7 CYS O 1 1 11 7846 1 1 7 CYS SG S 1.939 8.537 -7.198 1.00 . A A . 7 CYS SG 1 1 11 7847 1 1 8 THR C C 4.765 12.347 -1.667 1.00 . A A . 8 THR C 1 1 11 7848 1 1 8 THR CA C 3.789 12.650 -2.807 1.00 . A A . 8 THR CA 1 1 11 7849 1 1 8 THR CB C 2.611 13.480 -2.282 1.00 . A A . 8 THR CB 1 1 11 7850 1 1 8 THR CG2 C 3.125 14.581 -1.350 1.00 . A A . 8 THR CG2 1 1 11 7851 1 1 8 THR H H 2.565 10.881 -2.887 1.00 . A A . 8 THR H 1 1 11 7852 1 1 8 THR HA H 4.300 13.199 -3.585 1.00 . A A . 8 THR HA 1 1 11 7853 1 1 8 THR HB H 1.935 12.840 -1.737 1.00 . A A . 8 THR HB 1 1 11 7854 1 1 8 THR HG1 H 2.045 13.503 -4.142 1.00 . A A . 8 THR HG1 1 1 11 7855 1 1 8 THR HG21 H 3.303 14.168 -0.368 1.00 . A A . 8 THR HG21 1 1 11 7856 1 1 8 THR HG22 H 2.388 15.367 -1.282 1.00 . A A . 8 THR HG22 1 1 11 7857 1 1 8 THR HG23 H 4.046 14.984 -1.743 1.00 . A A . 8 THR HG23 1 1 11 7858 1 1 8 THR N N 3.274 11.368 -3.361 1.00 . A A . 8 THR N 1 1 11 7859 1 1 8 THR O O 5.586 13.166 -1.305 1.00 . A A . 8 THR O 1 1 11 7860 1 1 8 THR OG1 O 1.927 14.070 -3.377 1.00 . A A . 8 THR OG1 1 1 11 7861 1 1 9 SER C C 6.260 9.468 -0.276 1.00 . A A . 9 SER C 1 1 11 7862 1 1 9 SER CA C 5.597 10.817 0.018 1.00 . A A . 9 SER CA 1 1 11 7863 1 1 9 SER CB C 4.802 10.721 1.319 1.00 . A A . 9 SER CB 1 1 11 7864 1 1 9 SER H H 4.008 10.531 -1.407 1.00 . A A . 9 SER H 1 1 11 7865 1 1 9 SER HA H 6.358 11.578 0.115 1.00 . A A . 9 SER HA 1 1 11 7866 1 1 9 SER HB2 H 4.339 9.751 1.390 1.00 . A A . 9 SER HB2 1 1 11 7867 1 1 9 SER HB3 H 5.470 10.861 2.159 1.00 . A A . 9 SER HB3 1 1 11 7868 1 1 9 SER HG H 3.118 11.459 1.956 1.00 . A A . 9 SER HG 1 1 11 7869 1 1 9 SER N N 4.678 11.175 -1.099 1.00 . A A . 9 SER N 1 1 11 7870 1 1 9 SER O O 5.801 8.706 -1.103 1.00 . A A . 9 SER O 1 1 11 7871 1 1 9 SER OG O 3.793 11.722 1.327 1.00 . A A . 9 SER OG 1 1 11 7872 1 1 10 ILE C C 7.342 6.772 0.976 1.00 . A A . 10 ILE C 1 1 11 7873 1 1 10 ILE CA C 8.033 7.873 0.165 1.00 . A A . 10 ILE CA 1 1 11 7874 1 1 10 ILE CB C 9.488 8.001 0.618 1.00 . A A . 10 ILE CB 1 1 11 7875 1 1 10 ILE CD1 C 10.435 8.653 -1.601 1.00 . A A . 10 ILE CD1 1 1 11 7876 1 1 10 ILE CG1 C 10.171 9.120 -0.170 1.00 . A A . 10 ILE CG1 1 1 11 7877 1 1 10 ILE CG2 C 10.217 6.681 0.369 1.00 . A A . 10 ILE CG2 1 1 11 7878 1 1 10 ILE H H 7.688 9.798 1.061 1.00 . A A . 10 ILE H 1 1 11 7879 1 1 10 ILE HA H 7.999 7.625 -0.885 1.00 . A A . 10 ILE HA 1 1 11 7880 1 1 10 ILE HB H 9.516 8.232 1.670 1.00 . A A . 10 ILE HB 1 1 11 7881 1 1 10 ILE HD11 H 10.928 9.440 -2.151 1.00 . A A . 10 ILE HD11 1 1 11 7882 1 1 10 ILE HD12 H 9.498 8.411 -2.079 1.00 . A A . 10 ILE HD12 1 1 11 7883 1 1 10 ILE HD13 H 11.066 7.777 -1.581 1.00 . A A . 10 ILE HD13 1 1 11 7884 1 1 10 ILE HG12 H 9.532 9.991 -0.188 1.00 . A A . 10 ILE HG12 1 1 11 7885 1 1 10 ILE HG13 H 11.110 9.373 0.302 1.00 . A A . 10 ILE HG13 1 1 11 7886 1 1 10 ILE HG21 H 11.269 6.876 0.221 1.00 . A A . 10 ILE HG21 1 1 11 7887 1 1 10 ILE HG22 H 9.811 6.208 -0.511 1.00 . A A . 10 ILE HG22 1 1 11 7888 1 1 10 ILE HG23 H 10.086 6.032 1.222 1.00 . A A . 10 ILE HG23 1 1 11 7889 1 1 10 ILE N N 7.336 9.168 0.399 1.00 . A A . 10 ILE N 1 1 11 7890 1 1 10 ILE O O 6.664 7.044 1.947 1.00 . A A . 10 ILE O 1 1 11 7891 1 1 11 CYS C C 7.711 3.173 1.310 1.00 . A A . 11 CYS C 1 1 11 7892 1 1 11 CYS CA C 6.847 4.432 1.368 1.00 . A A . 11 CYS CA 1 1 11 7893 1 1 11 CYS CB C 5.458 4.106 0.788 1.00 . A A . 11 CYS CB 1 1 11 7894 1 1 11 CYS H H 8.054 5.324 -0.188 1.00 . A A . 11 CYS H 1 1 11 7895 1 1 11 CYS HA H 6.737 4.740 2.397 1.00 . A A . 11 CYS HA 1 1 11 7896 1 1 11 CYS HB2 H 5.510 3.179 0.238 1.00 . A A . 11 CYS HB2 1 1 11 7897 1 1 11 CYS HB3 H 4.752 3.997 1.599 1.00 . A A . 11 CYS HB3 1 1 11 7898 1 1 11 CYS N N 7.504 5.532 0.596 1.00 . A A . 11 CYS N 1 1 11 7899 1 1 11 CYS O O 8.114 2.731 0.253 1.00 . A A . 11 CYS O 1 1 11 7900 1 1 11 CYS SG S 4.898 5.424 -0.320 1.00 . A A . 11 CYS SG 1 1 11 7901 1 1 12 SER C C 7.904 0.131 2.601 1.00 . A A . 12 SER C 1 1 11 7902 1 1 12 SER CA C 8.821 1.347 2.454 1.00 . A A . 12 SER CA 1 1 11 7903 1 1 12 SER CB C 9.798 1.398 3.628 1.00 . A A . 12 SER CB 1 1 11 7904 1 1 12 SER H H 7.651 2.954 3.284 1.00 . A A . 12 SER H 1 1 11 7905 1 1 12 SER HA H 9.371 1.273 1.527 1.00 . A A . 12 SER HA 1 1 11 7906 1 1 12 SER HB2 H 9.988 0.399 3.985 1.00 . A A . 12 SER HB2 1 1 11 7907 1 1 12 SER HB3 H 10.729 1.842 3.300 1.00 . A A . 12 SER HB3 1 1 11 7908 1 1 12 SER HG H 9.541 3.074 4.578 1.00 . A A . 12 SER HG 1 1 11 7909 1 1 12 SER N N 7.991 2.585 2.442 1.00 . A A . 12 SER N 1 1 11 7910 1 1 12 SER O O 6.726 0.267 2.868 1.00 . A A . 12 SER O 1 1 11 7911 1 1 12 SER OG O 9.233 2.171 4.677 1.00 . A A . 12 SER OG 1 1 11 7912 1 1 13 LEU C C 6.529 -2.124 3.586 1.00 . A A . 13 LEU C 1 1 11 7913 1 1 13 LEU CA C 7.609 -2.291 2.521 1.00 . A A . 13 LEU CA 1 1 11 7914 1 1 13 LEU CB C 8.497 -3.480 2.891 1.00 . A A . 13 LEU CB 1 1 11 7915 1 1 13 LEU CD1 C 6.769 -4.884 1.755 1.00 . A A . 13 LEU CD1 1 1 11 7916 1 1 13 LEU CD2 C 8.533 -5.965 3.149 1.00 . A A . 13 LEU CD2 1 1 11 7917 1 1 13 LEU CG C 7.633 -4.738 3.008 1.00 . A A . 13 LEU CG 1 1 11 7918 1 1 13 LEU H H 9.383 -1.123 2.179 1.00 . A A . 13 LEU H 1 1 11 7919 1 1 13 LEU HA H 7.147 -2.481 1.577 1.00 . A A . 13 LEU HA 1 1 11 7920 1 1 13 LEU HB2 H 9.244 -3.625 2.125 1.00 . A A . 13 LEU HB2 1 1 11 7921 1 1 13 LEU HB3 H 8.979 -3.290 3.836 1.00 . A A . 13 LEU HB3 1 1 11 7922 1 1 13 LEU HD11 H 6.750 -5.919 1.450 1.00 . A A . 13 LEU HD11 1 1 11 7923 1 1 13 LEU HD12 H 7.182 -4.281 0.960 1.00 . A A . 13 LEU HD12 1 1 11 7924 1 1 13 LEU HD13 H 5.763 -4.554 1.971 1.00 . A A . 13 LEU HD13 1 1 11 7925 1 1 13 LEU HD21 H 7.923 -6.846 3.289 1.00 . A A . 13 LEU HD21 1 1 11 7926 1 1 13 LEU HD22 H 9.185 -5.839 4.001 1.00 . A A . 13 LEU HD22 1 1 11 7927 1 1 13 LEU HD23 H 9.128 -6.078 2.255 1.00 . A A . 13 LEU HD23 1 1 11 7928 1 1 13 LEU HG H 6.995 -4.655 3.878 1.00 . A A . 13 LEU HG 1 1 11 7929 1 1 13 LEU N N 8.436 -1.051 2.410 1.00 . A A . 13 LEU N 1 1 11 7930 1 1 13 LEU O O 5.404 -2.552 3.414 1.00 . A A . 13 LEU O 1 1 11 7931 1 1 14 TYR C C 4.550 -0.768 5.123 1.00 . A A . 14 TYR C 1 1 11 7932 1 1 14 TYR CA C 5.837 -1.309 5.747 1.00 . A A . 14 TYR CA 1 1 11 7933 1 1 14 TYR CB C 6.365 -0.304 6.772 1.00 . A A . 14 TYR CB 1 1 11 7934 1 1 14 TYR CD1 C 5.494 -1.397 8.869 1.00 . A A . 14 TYR CD1 1 1 11 7935 1 1 14 TYR CD2 C 7.893 -1.249 8.541 1.00 . A A . 14 TYR CD2 1 1 11 7936 1 1 14 TYR CE1 C 5.702 -2.045 10.095 1.00 . A A . 14 TYR CE1 1 1 11 7937 1 1 14 TYR CE2 C 8.102 -1.895 9.765 1.00 . A A . 14 TYR CE2 1 1 11 7938 1 1 14 TYR CG C 6.589 -1.000 8.092 1.00 . A A . 14 TYR CG 1 1 11 7939 1 1 14 TYR CZ C 7.006 -2.293 10.543 1.00 . A A . 14 TYR CZ 1 1 11 7940 1 1 14 TYR H H 7.765 -1.163 4.798 1.00 . A A . 14 TYR H 1 1 11 7941 1 1 14 TYR HA H 5.638 -2.252 6.234 1.00 . A A . 14 TYR HA 1 1 11 7942 1 1 14 TYR HB2 H 7.298 0.111 6.421 1.00 . A A . 14 TYR HB2 1 1 11 7943 1 1 14 TYR HB3 H 5.644 0.490 6.902 1.00 . A A . 14 TYR HB3 1 1 11 7944 1 1 14 TYR HD1 H 4.488 -1.206 8.523 1.00 . A A . 14 TYR HD1 1 1 11 7945 1 1 14 TYR HD2 H 8.738 -0.942 7.940 1.00 . A A . 14 TYR HD2 1 1 11 7946 1 1 14 TYR HE1 H 4.857 -2.351 10.695 1.00 . A A . 14 TYR HE1 1 1 11 7947 1 1 14 TYR HE2 H 9.107 -2.087 10.111 1.00 . A A . 14 TYR HE2 1 1 11 7948 1 1 14 TYR HH H 8.149 -2.883 11.953 1.00 . A A . 14 TYR HH 1 1 11 7949 1 1 14 TYR N N 6.854 -1.504 4.680 1.00 . A A . 14 TYR N 1 1 11 7950 1 1 14 TYR O O 3.523 -1.419 5.129 1.00 . A A . 14 TYR O 1 1 11 7951 1 1 14 TYR OH O 7.212 -2.929 11.750 1.00 . A A . 14 TYR OH 1 1 11 7952 1 1 15 GLN C C 2.796 0.018 2.959 1.00 . A A . 15 GLN C 1 1 11 7953 1 1 15 GLN CA C 3.394 1.013 3.952 1.00 . A A . 15 GLN CA 1 1 11 7954 1 1 15 GLN CB C 3.792 2.296 3.219 1.00 . A A . 15 GLN CB 1 1 11 7955 1 1 15 GLN CD C 5.321 3.375 4.878 1.00 . A A . 15 GLN CD 1 1 11 7956 1 1 15 GLN CG C 3.936 3.437 4.229 1.00 . A A . 15 GLN CG 1 1 11 7957 1 1 15 GLN H H 5.446 0.914 4.582 1.00 . A A . 15 GLN H 1 1 11 7958 1 1 15 GLN HA H 2.666 1.244 4.715 1.00 . A A . 15 GLN HA 1 1 11 7959 1 1 15 GLN HB2 H 4.734 2.143 2.711 1.00 . A A . 15 GLN HB2 1 1 11 7960 1 1 15 GLN HB3 H 3.031 2.551 2.497 1.00 . A A . 15 GLN HB3 1 1 11 7961 1 1 15 GLN HE21 H 5.161 5.165 5.726 1.00 . A A . 15 GLN HE21 1 1 11 7962 1 1 15 GLN HE22 H 6.621 4.349 6.021 1.00 . A A . 15 GLN HE22 1 1 11 7963 1 1 15 GLN HG2 H 3.818 4.384 3.720 1.00 . A A . 15 GLN HG2 1 1 11 7964 1 1 15 GLN HG3 H 3.178 3.340 4.991 1.00 . A A . 15 GLN HG3 1 1 11 7965 1 1 15 GLN N N 4.604 0.416 4.580 1.00 . A A . 15 GLN N 1 1 11 7966 1 1 15 GLN NE2 N 5.736 4.380 5.602 1.00 . A A . 15 GLN NE2 1 1 11 7967 1 1 15 GLN O O 1.596 -0.064 2.790 1.00 . A A . 15 GLN O 1 1 11 7968 1 1 15 GLN OE1 O 6.035 2.404 4.724 1.00 . A A . 15 GLN OE1 1 1 11 7969 1 1 16 LEU C C 2.385 -2.856 2.042 1.00 . A A . 16 LEU C 1 1 11 7970 1 1 16 LEU CA C 3.114 -1.728 1.313 1.00 . A A . 16 LEU CA 1 1 11 7971 1 1 16 LEU CB C 4.283 -2.311 0.536 1.00 . A A . 16 LEU CB 1 1 11 7972 1 1 16 LEU CD1 C 6.303 -0.942 0.052 1.00 . A A . 16 LEU CD1 1 1 11 7973 1 1 16 LEU CD2 C 4.840 -1.697 -1.809 1.00 . A A . 16 LEU CD2 1 1 11 7974 1 1 16 LEU CG C 4.867 -1.225 -0.359 1.00 . A A . 16 LEU CG 1 1 11 7975 1 1 16 LEU H H 4.592 -0.649 2.453 1.00 . A A . 16 LEU H 1 1 11 7976 1 1 16 LEU HA H 2.444 -1.240 0.627 1.00 . A A . 16 LEU HA 1 1 11 7977 1 1 16 LEU HB2 H 5.030 -2.659 1.227 1.00 . A A . 16 LEU HB2 1 1 11 7978 1 1 16 LEU HB3 H 3.944 -3.133 -0.072 1.00 . A A . 16 LEU HB3 1 1 11 7979 1 1 16 LEU HD11 H 6.353 -0.840 1.125 1.00 . A A . 16 LEU HD11 1 1 11 7980 1 1 16 LEU HD12 H 6.634 -0.028 -0.415 1.00 . A A . 16 LEU HD12 1 1 11 7981 1 1 16 LEU HD13 H 6.933 -1.760 -0.263 1.00 . A A . 16 LEU HD13 1 1 11 7982 1 1 16 LEU HD21 H 3.816 -1.787 -2.137 1.00 . A A . 16 LEU HD21 1 1 11 7983 1 1 16 LEU HD22 H 5.329 -2.657 -1.880 1.00 . A A . 16 LEU HD22 1 1 11 7984 1 1 16 LEU HD23 H 5.356 -0.981 -2.428 1.00 . A A . 16 LEU HD23 1 1 11 7985 1 1 16 LEU HG H 4.279 -0.324 -0.259 1.00 . A A . 16 LEU HG 1 1 11 7986 1 1 16 LEU N N 3.626 -0.736 2.300 1.00 . A A . 16 LEU N 1 1 11 7987 1 1 16 LEU O O 1.250 -3.174 1.743 1.00 . A A . 16 LEU O 1 1 11 7988 1 1 17 GLU C C 1.070 -4.125 4.347 1.00 . A A . 17 GLU C 1 1 11 7989 1 1 17 GLU CA C 2.395 -4.591 3.738 1.00 . A A . 17 GLU CA 1 1 11 7990 1 1 17 GLU CB C 3.332 -5.059 4.853 1.00 . A A . 17 GLU CB 1 1 11 7991 1 1 17 GLU CD C 4.695 -7.076 5.414 1.00 . A A . 17 GLU CD 1 1 11 7992 1 1 17 GLU CG C 3.339 -6.589 4.905 1.00 . A A . 17 GLU CG 1 1 11 7993 1 1 17 GLU H H 3.954 -3.201 3.205 1.00 . A A . 17 GLU H 1 1 11 7994 1 1 17 GLU HA H 2.206 -5.409 3.062 1.00 . A A . 17 GLU HA 1 1 11 7995 1 1 17 GLU HB2 H 4.332 -4.701 4.657 1.00 . A A . 17 GLU HB2 1 1 11 7996 1 1 17 GLU HB3 H 2.989 -4.671 5.800 1.00 . A A . 17 GLU HB3 1 1 11 7997 1 1 17 GLU HG2 H 2.559 -6.929 5.571 1.00 . A A . 17 GLU HG2 1 1 11 7998 1 1 17 GLU HG3 H 3.164 -6.983 3.914 1.00 . A A . 17 GLU HG3 1 1 11 7999 1 1 17 GLU N N 3.036 -3.471 2.990 1.00 . A A . 17 GLU N 1 1 11 8000 1 1 17 GLU O O 0.247 -4.927 4.746 1.00 . A A . 17 GLU O 1 1 11 8001 1 1 17 GLU OE1 O 4.925 -6.984 6.608 1.00 . A A . 17 GLU OE1 1 1 11 8002 1 1 17 GLU OE2 O 5.482 -7.535 4.600 1.00 . A A . 17 GLU OE2 1 1 11 8003 1 1 18 ASN C C -1.467 -2.168 3.915 1.00 . A A . 18 ASN C 1 1 11 8004 1 1 18 ASN CA C -0.421 -2.343 5.019 1.00 . A A . 18 ASN CA 1 1 11 8005 1 1 18 ASN CB C -0.174 -0.998 5.707 1.00 . A A . 18 ASN CB 1 1 11 8006 1 1 18 ASN CG C -0.862 -0.989 7.073 1.00 . A A . 18 ASN CG 1 1 11 8007 1 1 18 ASN H H 1.528 -2.210 4.108 1.00 . A A . 18 ASN H 1 1 11 8008 1 1 18 ASN HA H -0.784 -3.056 5.744 1.00 . A A . 18 ASN HA 1 1 11 8009 1 1 18 ASN HB2 H 0.888 -0.851 5.837 1.00 . A A . 18 ASN HB2 1 1 11 8010 1 1 18 ASN HB3 H -0.577 -0.202 5.098 1.00 . A A . 18 ASN HB3 1 1 11 8011 1 1 18 ASN HD21 H 0.805 -1.391 8.074 1.00 . A A . 18 ASN HD21 1 1 11 8012 1 1 18 ASN HD22 H -0.588 -1.213 9.027 1.00 . A A . 18 ASN HD22 1 1 11 8013 1 1 18 ASN N N 0.853 -2.842 4.429 1.00 . A A . 18 ASN N 1 1 11 8014 1 1 18 ASN ND2 N -0.157 -1.216 8.148 1.00 . A A . 18 ASN ND2 1 1 11 8015 1 1 18 ASN O O -2.478 -1.522 4.107 1.00 . A A . 18 ASN O 1 1 11 8016 1 1 18 ASN OD1 O -2.055 -0.774 7.164 1.00 . A A . 18 ASN OD1 1 1 11 8017 1 1 19 TYR C C -2.379 -3.926 0.926 1.00 . A A . 19 TYR C 1 1 11 8018 1 1 19 TYR CA C -2.226 -2.595 1.660 1.00 . A A . 19 TYR CA 1 1 11 8019 1 1 19 TYR CB C -1.744 -1.529 0.677 1.00 . A A . 19 TYR CB 1 1 11 8020 1 1 19 TYR CD1 C -2.691 0.281 2.150 1.00 . A A . 19 TYR CD1 1 1 11 8021 1 1 19 TYR CD2 C -0.424 0.516 1.317 1.00 . A A . 19 TYR CD2 1 1 11 8022 1 1 19 TYR CE1 C -2.571 1.505 2.821 1.00 . A A . 19 TYR CE1 1 1 11 8023 1 1 19 TYR CE2 C -0.304 1.740 1.987 1.00 . A A . 19 TYR CE2 1 1 11 8024 1 1 19 TYR CG C -1.616 -0.212 1.399 1.00 . A A . 19 TYR CG 1 1 11 8025 1 1 19 TYR CZ C -1.377 2.236 2.738 1.00 . A A . 19 TYR CZ 1 1 11 8026 1 1 19 TYR H H -0.414 -3.253 2.625 1.00 . A A . 19 TYR H 1 1 11 8027 1 1 19 TYR HA H -3.179 -2.299 2.069 1.00 . A A . 19 TYR HA 1 1 11 8028 1 1 19 TYR HB2 H -0.783 -1.816 0.276 1.00 . A A . 19 TYR HB2 1 1 11 8029 1 1 19 TYR HB3 H -2.456 -1.431 -0.127 1.00 . A A . 19 TYR HB3 1 1 11 8030 1 1 19 TYR HD1 H -3.610 -0.283 2.214 1.00 . A A . 19 TYR HD1 1 1 11 8031 1 1 19 TYR HD2 H 0.403 0.132 0.738 1.00 . A A . 19 TYR HD2 1 1 11 8032 1 1 19 TYR HE1 H -3.399 1.887 3.400 1.00 . A A . 19 TYR HE1 1 1 11 8033 1 1 19 TYR HE2 H 0.616 2.302 1.924 1.00 . A A . 19 TYR HE2 1 1 11 8034 1 1 19 TYR HH H -0.629 3.982 2.915 1.00 . A A . 19 TYR HH 1 1 11 8035 1 1 19 TYR N N -1.235 -2.736 2.764 1.00 . A A . 19 TYR N 1 1 11 8036 1 1 19 TYR O O -2.376 -3.979 -0.288 1.00 . A A . 19 TYR O 1 1 11 8037 1 1 19 TYR OH O -1.259 3.441 3.397 1.00 . A A . 19 TYR OH 1 1 11 8038 1 1 20 CYS C C -3.042 -7.387 2.011 1.00 . A A . 20 CYS C 1 1 11 8039 1 1 20 CYS CA C -2.682 -6.321 0.977 1.00 . A A . 20 CYS CA 1 1 11 8040 1 1 20 CYS CB C -1.377 -6.706 0.275 1.00 . A A . 20 CYS CB 1 1 11 8041 1 1 20 CYS H H -2.526 -4.942 2.627 1.00 . A A . 20 CYS H 1 1 11 8042 1 1 20 CYS HA H -3.474 -6.255 0.249 1.00 . A A . 20 CYS HA 1 1 11 8043 1 1 20 CYS HB2 H -1.080 -5.909 -0.391 1.00 . A A . 20 CYS HB2 1 1 11 8044 1 1 20 CYS HB3 H -0.605 -6.864 1.013 1.00 . A A . 20 CYS HB3 1 1 11 8045 1 1 20 CYS N N -2.521 -5.003 1.647 1.00 . A A . 20 CYS N 1 1 11 8046 1 1 20 CYS O O -2.799 -7.230 3.191 1.00 . A A . 20 CYS O 1 1 11 8047 1 1 20 CYS SG S -1.628 -8.227 -0.676 1.00 . A A . 20 CYS SG 1 1 11 8048 1 1 21 ASN C C -2.785 -9.943 3.364 1.00 . A A . 21 ASN C 1 1 11 8049 1 1 21 ASN CA C -4.005 -9.546 2.529 1.00 . A A . 21 ASN CA 1 1 11 8050 1 1 21 ASN CB C -4.509 -10.764 1.749 1.00 . A A . 21 ASN CB 1 1 11 8051 1 1 21 ASN CG C -5.564 -11.500 2.576 1.00 . A A . 21 ASN CG 1 1 11 8052 1 1 21 ASN H H -3.811 -8.573 0.618 1.00 . A A . 21 ASN H 1 1 11 8053 1 1 21 ASN HA H -4.786 -9.187 3.181 1.00 . A A . 21 ASN HA 1 1 11 8054 1 1 21 ASN HB2 H -4.945 -10.438 0.816 1.00 . A A . 21 ASN HB2 1 1 11 8055 1 1 21 ASN HB3 H -3.683 -11.428 1.547 1.00 . A A . 21 ASN HB3 1 1 11 8056 1 1 21 ASN HD21 H -5.788 -12.960 1.250 1.00 . A A . 21 ASN HD21 1 1 11 8057 1 1 21 ASN HD22 H -6.754 -13.089 2.640 1.00 . A A . 21 ASN HD22 1 1 11 8058 1 1 21 ASN N N -3.624 -8.470 1.574 1.00 . A A . 21 ASN N 1 1 11 8059 1 1 21 ASN ND2 N -6.078 -12.608 2.117 1.00 . A A . 21 ASN ND2 1 1 11 8060 1 1 21 ASN O O -1.725 -10.112 2.785 1.00 . A A . 21 ASN O 1 1 11 8061 1 1 21 ASN OXT O -2.933 -10.072 4.568 1.00 . A A . 21 ASN OXT 1 1 11 8062 1 1 21 ASN OD1 O -5.922 -11.065 3.652 1.00 . A A . 21 ASN OD1 1 1 11 8063 2 2 1 PHE C C 13.172 -2.568 0.745 1.00 . B B . 1 PHE C 1 1 11 8064 2 2 1 PHE CA C 12.591 -3.942 1.087 1.00 . B B . 1 PHE CA 1 1 11 8065 2 2 1 PHE CB C 11.281 -4.143 0.318 1.00 . B B . 1 PHE CB 1 1 11 8066 2 2 1 PHE CD1 C 12.863 -4.873 -1.526 1.00 . B B . 1 PHE CD1 1 1 11 8067 2 2 1 PHE CD2 C 10.488 -5.313 -1.769 1.00 . B B . 1 PHE CD2 1 1 11 8068 2 2 1 PHE CE1 C 13.101 -5.476 -2.769 1.00 . B B . 1 PHE CE1 1 1 11 8069 2 2 1 PHE CE2 C 10.727 -5.914 -3.012 1.00 . B B . 1 PHE CE2 1 1 11 8070 2 2 1 PHE CG C 11.554 -4.792 -1.024 1.00 . B B . 1 PHE CG 1 1 11 8071 2 2 1 PHE CZ C 12.033 -5.996 -3.510 1.00 . B B . 1 PHE CZ 1 1 11 8072 2 2 1 PHE H1 H 13.123 -3.601 3.071 1.00 . B B . 1 PHE H1 1 1 11 8073 2 2 1 PHE H2 H 12.203 -5.009 2.833 1.00 . B B . 1 PHE H2 1 1 11 8074 2 2 1 PHE H3 H 11.458 -3.483 2.772 1.00 . B B . 1 PHE H3 1 1 11 8075 2 2 1 PHE HA H 13.293 -4.713 0.812 1.00 . B B . 1 PHE HA 1 1 11 8076 2 2 1 PHE HB2 H 10.622 -4.775 0.894 1.00 . B B . 1 PHE HB2 1 1 11 8077 2 2 1 PHE HB3 H 10.810 -3.183 0.162 1.00 . B B . 1 PHE HB3 1 1 11 8078 2 2 1 PHE HD1 H 13.687 -4.472 -0.957 1.00 . B B . 1 PHE HD1 1 1 11 8079 2 2 1 PHE HD2 H 9.480 -5.250 -1.385 1.00 . B B . 1 PHE HD2 1 1 11 8080 2 2 1 PHE HE1 H 14.108 -5.539 -3.155 1.00 . B B . 1 PHE HE1 1 1 11 8081 2 2 1 PHE HE2 H 9.904 -6.314 -3.584 1.00 . B B . 1 PHE HE2 1 1 11 8082 2 2 1 PHE HZ H 12.217 -6.460 -4.468 1.00 . B B . 1 PHE HZ 1 1 11 8083 2 2 1 PHE N N 12.323 -4.015 2.551 1.00 . B B . 1 PHE N 1 1 11 8084 2 2 1 PHE O O 13.849 -1.953 1.544 1.00 . B B . 1 PHE O 1 1 11 8085 2 2 2 VAL C C 12.629 0.340 -0.141 1.00 . B B . 2 VAL C 1 1 11 8086 2 2 2 VAL CA C 13.436 -0.759 -0.840 1.00 . B B . 2 VAL CA 1 1 11 8087 2 2 2 VAL CB C 13.298 -0.623 -2.353 1.00 . B B . 2 VAL CB 1 1 11 8088 2 2 2 VAL CG1 C 14.134 -1.701 -3.041 1.00 . B B . 2 VAL CG1 1 1 11 8089 2 2 2 VAL CG2 C 11.828 -0.792 -2.748 1.00 . B B . 2 VAL CG2 1 1 11 8090 2 2 2 VAL H H 12.362 -2.592 -1.068 1.00 . B B . 2 VAL H 1 1 11 8091 2 2 2 VAL HA H 14.476 -0.680 -0.562 1.00 . B B . 2 VAL HA 1 1 11 8092 2 2 2 VAL HB H 13.643 0.345 -2.658 1.00 . B B . 2 VAL HB 1 1 11 8093 2 2 2 VAL HG11 H 13.838 -1.781 -4.077 1.00 . B B . 2 VAL HG11 1 1 11 8094 2 2 2 VAL HG12 H 13.976 -2.648 -2.548 1.00 . B B . 2 VAL HG12 1 1 11 8095 2 2 2 VAL HG13 H 15.179 -1.437 -2.986 1.00 . B B . 2 VAL HG13 1 1 11 8096 2 2 2 VAL HG21 H 11.749 -1.526 -3.535 1.00 . B B . 2 VAL HG21 1 1 11 8097 2 2 2 VAL HG22 H 11.438 0.153 -3.095 1.00 . B B . 2 VAL HG22 1 1 11 8098 2 2 2 VAL HG23 H 11.262 -1.120 -1.889 1.00 . B B . 2 VAL HG23 1 1 11 8099 2 2 2 VAL N N 12.910 -2.084 -0.439 1.00 . B B . 2 VAL N 1 1 11 8100 2 2 2 VAL O O 12.043 0.122 0.900 1.00 . B B . 2 VAL O 1 1 11 8101 2 2 3 ASN C C 11.828 3.850 -0.978 1.00 . B B . 3 ASN C 1 1 11 8102 2 2 3 ASN CA C 11.825 2.623 -0.059 1.00 . B B . 3 ASN CA 1 1 11 8103 2 2 3 ASN CB C 12.476 2.983 1.280 1.00 . B B . 3 ASN CB 1 1 11 8104 2 2 3 ASN CG C 13.978 3.188 1.078 1.00 . B B . 3 ASN CG 1 1 11 8105 2 2 3 ASN H H 13.074 1.682 -1.538 1.00 . B B . 3 ASN H 1 1 11 8106 2 2 3 ASN HA H 10.808 2.303 0.110 1.00 . B B . 3 ASN HA 1 1 11 8107 2 2 3 ASN HB2 H 12.035 3.891 1.662 1.00 . B B . 3 ASN HB2 1 1 11 8108 2 2 3 ASN HB3 H 12.316 2.181 1.985 1.00 . B B . 3 ASN HB3 1 1 11 8109 2 2 3 ASN HD21 H 13.777 5.042 0.398 1.00 . B B . 3 ASN HD21 1 1 11 8110 2 2 3 ASN HD22 H 15.372 4.469 0.481 1.00 . B B . 3 ASN HD22 1 1 11 8111 2 2 3 ASN N N 12.594 1.521 -0.699 1.00 . B B . 3 ASN N 1 1 11 8112 2 2 3 ASN ND2 N 14.412 4.327 0.614 1.00 . B B . 3 ASN ND2 1 1 11 8113 2 2 3 ASN O O 12.217 4.930 -0.583 1.00 . B B . 3 ASN O 1 1 11 8114 2 2 3 ASN OD1 O 14.766 2.302 1.348 1.00 . B B . 3 ASN OD1 1 1 11 8115 2 2 4 GLN C C 9.973 5.434 -3.243 1.00 . B B . 4 GLN C 1 1 11 8116 2 2 4 GLN CA C 11.388 4.849 -3.143 1.00 . B B . 4 GLN CA 1 1 11 8117 2 2 4 GLN CB C 11.867 4.395 -4.532 1.00 . B B . 4 GLN CB 1 1 11 8118 2 2 4 GLN CD C 11.157 2.412 -5.891 1.00 . B B . 4 GLN CD 1 1 11 8119 2 2 4 GLN CG C 10.712 3.759 -5.319 1.00 . B B . 4 GLN CG 1 1 11 8120 2 2 4 GLN H H 11.095 2.808 -2.504 1.00 . B B . 4 GLN H 1 1 11 8121 2 2 4 GLN HA H 12.056 5.611 -2.770 1.00 . B B . 4 GLN HA 1 1 11 8122 2 2 4 GLN HB2 H 12.240 5.251 -5.075 1.00 . B B . 4 GLN HB2 1 1 11 8123 2 2 4 GLN HB3 H 12.661 3.672 -4.417 1.00 . B B . 4 GLN HB3 1 1 11 8124 2 2 4 GLN HE21 H 11.017 3.010 -7.780 1.00 . B B . 4 GLN HE21 1 1 11 8125 2 2 4 GLN HE22 H 11.519 1.403 -7.562 1.00 . B B . 4 GLN HE22 1 1 11 8126 2 2 4 GLN HG2 H 9.866 3.609 -4.665 1.00 . B B . 4 GLN HG2 1 1 11 8127 2 2 4 GLN HG3 H 10.426 4.413 -6.131 1.00 . B B . 4 GLN HG3 1 1 11 8128 2 2 4 GLN N N 11.400 3.689 -2.203 1.00 . B B . 4 GLN N 1 1 11 8129 2 2 4 GLN NE2 N 11.239 2.263 -7.185 1.00 . B B . 4 GLN NE2 1 1 11 8130 2 2 4 GLN O O 9.182 5.349 -2.320 1.00 . B B . 4 GLN O 1 1 11 8131 2 2 4 GLN OE1 O 11.432 1.486 -5.153 1.00 . B B . 4 GLN OE1 1 1 11 8132 2 2 5 HIS C C 7.329 5.555 -5.042 1.00 . B B . 5 HIS C 1 1 11 8133 2 2 5 HIS CA C 8.304 6.627 -4.548 1.00 . B B . 5 HIS CA 1 1 11 8134 2 2 5 HIS CB C 8.380 7.751 -5.584 1.00 . B B . 5 HIS CB 1 1 11 8135 2 2 5 HIS CD2 C 10.324 9.134 -4.511 1.00 . B B . 5 HIS CD2 1 1 11 8136 2 2 5 HIS CE1 C 9.249 11.007 -4.268 1.00 . B B . 5 HIS CE1 1 1 11 8137 2 2 5 HIS CG C 9.052 8.955 -4.981 1.00 . B B . 5 HIS CG 1 1 11 8138 2 2 5 HIS H H 10.316 6.082 -5.089 1.00 . B B . 5 HIS H 1 1 11 8139 2 2 5 HIS HA H 7.955 7.025 -3.607 1.00 . B B . 5 HIS HA 1 1 11 8140 2 2 5 HIS HB2 H 8.950 7.414 -6.438 1.00 . B B . 5 HIS HB2 1 1 11 8141 2 2 5 HIS HB3 H 7.383 8.018 -5.899 1.00 . B B . 5 HIS HB3 1 1 11 8142 2 2 5 HIS HD2 H 11.100 8.384 -4.497 1.00 . B B . 5 HIS HD2 1 1 11 8143 2 2 5 HIS HE1 H 9.016 12.032 -4.019 1.00 . B B . 5 HIS HE1 1 1 11 8144 2 2 5 HIS HE2 H 11.247 10.846 -3.669 1.00 . B B . 5 HIS HE2 1 1 11 8145 2 2 5 HIS N N 9.657 6.028 -4.365 1.00 . B B . 5 HIS N 1 1 11 8146 2 2 5 HIS ND1 N 8.380 10.148 -4.821 1.00 . B B . 5 HIS ND1 1 1 11 8147 2 2 5 HIS NE2 N 10.451 10.431 -4.060 1.00 . B B . 5 HIS NE2 1 1 11 8148 2 2 5 HIS O O 7.604 4.835 -5.982 1.00 . B B . 5 HIS O 1 1 11 8149 2 2 6 LEU C C 4.106 5.112 -5.693 1.00 . B B . 6 LEU C 1 1 11 8150 2 2 6 LEU CA C 5.189 4.431 -4.854 1.00 . B B . 6 LEU CA 1 1 11 8151 2 2 6 LEU CB C 4.553 3.795 -3.618 1.00 . B B . 6 LEU CB 1 1 11 8152 2 2 6 LEU CD1 C 6.353 2.125 -3.165 1.00 . B B . 6 LEU CD1 1 1 11 8153 2 2 6 LEU CD2 C 3.984 1.601 -2.570 1.00 . B B . 6 LEU CD2 1 1 11 8154 2 2 6 LEU CG C 4.892 2.305 -3.581 1.00 . B B . 6 LEU CG 1 1 11 8155 2 2 6 LEU H H 5.982 6.042 -3.669 1.00 . B B . 6 LEU H 1 1 11 8156 2 2 6 LEU HA H 5.678 3.669 -5.442 1.00 . B B . 6 LEU HA 1 1 11 8157 2 2 6 LEU HB2 H 4.938 4.274 -2.730 1.00 . B B . 6 LEU HB2 1 1 11 8158 2 2 6 LEU HB3 H 3.483 3.919 -3.658 1.00 . B B . 6 LEU HB3 1 1 11 8159 2 2 6 LEU HD11 H 6.514 2.592 -2.204 1.00 . B B . 6 LEU HD11 1 1 11 8160 2 2 6 LEU HD12 H 6.995 2.585 -3.900 1.00 . B B . 6 LEU HD12 1 1 11 8161 2 2 6 LEU HD13 H 6.582 1.071 -3.096 1.00 . B B . 6 LEU HD13 1 1 11 8162 2 2 6 LEU HD21 H 3.749 0.608 -2.925 1.00 . B B . 6 LEU HD21 1 1 11 8163 2 2 6 LEU HD22 H 3.071 2.166 -2.452 1.00 . B B . 6 LEU HD22 1 1 11 8164 2 2 6 LEU HD23 H 4.490 1.532 -1.618 1.00 . B B . 6 LEU HD23 1 1 11 8165 2 2 6 LEU HG H 4.742 1.877 -4.561 1.00 . B B . 6 LEU HG 1 1 11 8166 2 2 6 LEU N N 6.187 5.448 -4.420 1.00 . B B . 6 LEU N 1 1 11 8167 2 2 6 LEU O O 3.223 5.762 -5.173 1.00 . B B . 6 LEU O 1 1 11 8168 2 2 7 CYS C C 2.435 4.597 -8.723 1.00 . B B . 7 CYS C 1 1 11 8169 2 2 7 CYS CA C 3.132 5.636 -7.838 1.00 . B B . 7 CYS CA 1 1 11 8170 2 2 7 CYS CB C 3.795 6.692 -8.725 1.00 . B B . 7 CYS CB 1 1 11 8171 2 2 7 CYS H H 4.884 4.459 -7.402 1.00 . B B . 7 CYS H 1 1 11 8172 2 2 7 CYS HA H 2.402 6.113 -7.201 1.00 . B B . 7 CYS HA 1 1 11 8173 2 2 7 CYS HB2 H 4.804 6.384 -8.957 1.00 . B B . 7 CYS HB2 1 1 11 8174 2 2 7 CYS HB3 H 3.232 6.798 -9.640 1.00 . B B . 7 CYS HB3 1 1 11 8175 2 2 7 CYS N N 4.164 4.980 -6.990 1.00 . B B . 7 CYS N 1 1 11 8176 2 2 7 CYS O O 3.055 3.664 -9.191 1.00 . B B . 7 CYS O 1 1 11 8177 2 2 7 CYS SG S 3.834 8.280 -7.854 1.00 . B B . 7 CYS SG 1 1 11 8178 2 2 8 GLY C C 1.123 2.618 -10.244 1.00 . B B . 8 GLY C 1 1 11 8179 2 2 8 GLY CA C 0.332 3.853 -9.798 1.00 . B B . 8 GLY CA 1 1 11 8180 2 2 8 GLY H H 0.712 5.559 -8.542 1.00 . B B . 8 GLY H 1 1 11 8181 2 2 8 GLY HA2 H -0.531 3.529 -9.235 1.00 . B B . 8 GLY HA2 1 1 11 8182 2 2 8 GLY HA3 H -0.004 4.387 -10.674 1.00 . B B . 8 GLY HA3 1 1 11 8183 2 2 8 GLY N N 1.152 4.781 -8.944 1.00 . B B . 8 GLY N 1 1 11 8184 2 2 8 GLY O O 1.313 1.686 -9.487 1.00 . B B . 8 GLY O 1 1 11 8185 2 2 9 SER C C 3.274 0.898 -10.910 1.00 . B B . 9 SER C 1 1 11 8186 2 2 9 SER CA C 2.329 1.428 -11.990 1.00 . B B . 9 SER CA 1 1 11 8187 2 2 9 SER CB C 3.140 1.843 -13.217 1.00 . B B . 9 SER CB 1 1 11 8188 2 2 9 SER H H 1.385 3.363 -12.066 1.00 . B B . 9 SER H 1 1 11 8189 2 2 9 SER HA H 1.636 0.649 -12.269 1.00 . B B . 9 SER HA 1 1 11 8190 2 2 9 SER HB2 H 4.190 1.831 -12.978 1.00 . B B . 9 SER HB2 1 1 11 8191 2 2 9 SER HB3 H 2.949 1.147 -14.023 1.00 . B B . 9 SER HB3 1 1 11 8192 2 2 9 SER HG H 3.183 3.348 -14.449 1.00 . B B . 9 SER HG 1 1 11 8193 2 2 9 SER N N 1.565 2.603 -11.474 1.00 . B B . 9 SER N 1 1 11 8194 2 2 9 SER O O 3.049 -0.153 -10.342 1.00 . B B . 9 SER O 1 1 11 8195 2 2 9 SER OG O 2.761 3.156 -13.607 1.00 . B B . 9 SER OG 1 1 11 8196 2 2 10 ASP C C 4.461 0.682 -8.364 1.00 . B B . 10 ASP C 1 1 11 8197 2 2 10 ASP CA C 5.268 1.141 -9.567 1.00 . B B . 10 ASP CA 1 1 11 8198 2 2 10 ASP CB C 6.179 2.294 -9.145 1.00 . B B . 10 ASP CB 1 1 11 8199 2 2 10 ASP CG C 6.978 2.786 -10.354 1.00 . B B . 10 ASP CG 1 1 11 8200 2 2 10 ASP H H 4.484 2.461 -11.078 1.00 . B B . 10 ASP H 1 1 11 8201 2 2 10 ASP HA H 5.858 0.321 -9.947 1.00 . B B . 10 ASP HA 1 1 11 8202 2 2 10 ASP HB2 H 5.573 3.102 -8.753 1.00 . B B . 10 ASP HB2 1 1 11 8203 2 2 10 ASP HB3 H 6.860 1.951 -8.379 1.00 . B B . 10 ASP HB3 1 1 11 8204 2 2 10 ASP N N 4.323 1.614 -10.617 1.00 . B B . 10 ASP N 1 1 11 8205 2 2 10 ASP O O 4.728 -0.342 -7.768 1.00 . B B . 10 ASP O 1 1 11 8206 2 2 10 ASP OD1 O 6.466 3.625 -11.077 1.00 . B B . 10 ASP OD1 1 1 11 8207 2 2 10 ASP OD2 O 8.090 2.314 -10.536 1.00 . B B . 10 ASP OD2 1 1 11 8208 2 2 11 LEU C C 2.268 -0.408 -6.952 1.00 . B B . 11 LEU C 1 1 11 8209 2 2 11 LEU CA C 2.615 1.075 -6.859 1.00 . B B . 11 LEU CA 1 1 11 8210 2 2 11 LEU CB C 1.339 1.915 -6.924 1.00 . B B . 11 LEU CB 1 1 11 8211 2 2 11 LEU CD1 C 1.873 2.490 -4.513 1.00 . B B . 11 LEU CD1 1 1 11 8212 2 2 11 LEU CD2 C -0.125 3.444 -5.630 1.00 . B B . 11 LEU CD2 1 1 11 8213 2 2 11 LEU CG C 0.764 2.207 -5.528 1.00 . B B . 11 LEU CG 1 1 11 8214 2 2 11 LEU H H 3.278 2.256 -8.523 1.00 . B B . 11 LEU H 1 1 11 8215 2 2 11 LEU HA H 3.150 1.265 -5.950 1.00 . B B . 11 LEU HA 1 1 11 8216 2 2 11 LEU HB2 H 1.561 2.849 -7.415 1.00 . B B . 11 LEU HB2 1 1 11 8217 2 2 11 LEU HB3 H 0.601 1.381 -7.504 1.00 . B B . 11 LEU HB3 1 1 11 8218 2 2 11 LEU HD11 H 2.755 2.839 -5.026 1.00 . B B . 11 LEU HD11 1 1 11 8219 2 2 11 LEU HD12 H 2.103 1.587 -3.968 1.00 . B B . 11 LEU HD12 1 1 11 8220 2 2 11 LEU HD13 H 1.537 3.250 -3.819 1.00 . B B . 11 LEU HD13 1 1 11 8221 2 2 11 LEU HD21 H -0.924 3.375 -4.909 1.00 . B B . 11 LEU HD21 1 1 11 8222 2 2 11 LEU HD22 H -0.538 3.507 -6.625 1.00 . B B . 11 LEU HD22 1 1 11 8223 2 2 11 LEU HD23 H 0.467 4.326 -5.431 1.00 . B B . 11 LEU HD23 1 1 11 8224 2 2 11 LEU HG H 0.174 1.366 -5.197 1.00 . B B . 11 LEU HG 1 1 11 8225 2 2 11 LEU N N 3.468 1.440 -8.015 1.00 . B B . 11 LEU N 1 1 11 8226 2 2 11 LEU O O 2.567 -1.182 -6.067 1.00 . B B . 11 LEU O 1 1 11 8227 2 2 12 ALA C C 2.602 -3.048 -8.288 1.00 . B B . 12 ALA C 1 1 11 8228 2 2 12 ALA CA C 1.308 -2.252 -8.172 1.00 . B B . 12 ALA CA 1 1 11 8229 2 2 12 ALA CB C 0.470 -2.469 -9.435 1.00 . B B . 12 ALA CB 1 1 11 8230 2 2 12 ALA H H 1.427 -0.179 -8.738 1.00 . B B . 12 ALA H 1 1 11 8231 2 2 12 ALA HA H 0.754 -2.581 -7.305 1.00 . B B . 12 ALA HA 1 1 11 8232 2 2 12 ALA HB1 H -0.408 -1.843 -9.396 1.00 . B B . 12 ALA HB1 1 1 11 8233 2 2 12 ALA HB2 H 0.170 -3.506 -9.492 1.00 . B B . 12 ALA HB2 1 1 11 8234 2 2 12 ALA HB3 H 1.057 -2.216 -10.305 1.00 . B B . 12 ALA HB3 1 1 11 8235 2 2 12 ALA N N 1.651 -0.814 -8.026 1.00 . B B . 12 ALA N 1 1 11 8236 2 2 12 ALA O O 2.842 -3.965 -7.536 1.00 . B B . 12 ALA O 1 1 11 8237 2 2 13 GLU C C 5.379 -3.629 -8.016 1.00 . B B . 13 GLU C 1 1 11 8238 2 2 13 GLU CA C 4.725 -3.440 -9.382 1.00 . B B . 13 GLU CA 1 1 11 8239 2 2 13 GLU CB C 5.664 -2.651 -10.295 1.00 . B B . 13 GLU CB 1 1 11 8240 2 2 13 GLU CD C 7.086 -4.268 -11.559 1.00 . B B . 13 GLU CD 1 1 11 8241 2 2 13 GLU CG C 5.829 -3.401 -11.618 1.00 . B B . 13 GLU CG 1 1 11 8242 2 2 13 GLU H H 3.236 -1.946 -9.817 1.00 . B B . 13 GLU H 1 1 11 8243 2 2 13 GLU HA H 4.526 -4.408 -9.821 1.00 . B B . 13 GLU HA 1 1 11 8244 2 2 13 GLU HB2 H 5.245 -1.673 -10.484 1.00 . B B . 13 GLU HB2 1 1 11 8245 2 2 13 GLU HB3 H 6.627 -2.547 -9.820 1.00 . B B . 13 GLU HB3 1 1 11 8246 2 2 13 GLU HG2 H 4.964 -4.028 -11.783 1.00 . B B . 13 GLU HG2 1 1 11 8247 2 2 13 GLU HG3 H 5.919 -2.691 -12.424 1.00 . B B . 13 GLU HG3 1 1 11 8248 2 2 13 GLU N N 3.445 -2.699 -9.223 1.00 . B B . 13 GLU N 1 1 11 8249 2 2 13 GLU O O 5.993 -4.643 -7.749 1.00 . B B . 13 GLU O 1 1 11 8250 2 2 13 GLU OE1 O 8.042 -3.849 -10.927 1.00 . B B . 13 GLU OE1 1 1 11 8251 2 2 13 GLU OE2 O 7.072 -5.338 -12.145 1.00 . B B . 13 GLU OE2 1 1 11 8252 2 2 14 ALA C C 5.063 -3.837 -4.993 1.00 . B B . 14 ALA C 1 1 11 8253 2 2 14 ALA CA C 5.870 -2.818 -5.795 1.00 . B B . 14 ALA CA 1 1 11 8254 2 2 14 ALA CB C 5.860 -1.470 -5.072 1.00 . B B . 14 ALA CB 1 1 11 8255 2 2 14 ALA H H 4.748 -1.854 -7.366 1.00 . B B . 14 ALA H 1 1 11 8256 2 2 14 ALA HA H 6.889 -3.171 -5.897 1.00 . B B . 14 ALA HA 1 1 11 8257 2 2 14 ALA HB1 H 6.428 -1.546 -4.158 1.00 . B B . 14 ALA HB1 1 1 11 8258 2 2 14 ALA HB2 H 4.841 -1.193 -4.841 1.00 . B B . 14 ALA HB2 1 1 11 8259 2 2 14 ALA HB3 H 6.302 -0.718 -5.708 1.00 . B B . 14 ALA HB3 1 1 11 8260 2 2 14 ALA N N 5.253 -2.668 -7.141 1.00 . B B . 14 ALA N 1 1 11 8261 2 2 14 ALA O O 5.602 -4.776 -4.442 1.00 . B B . 14 ALA O 1 1 11 8262 2 2 15 LEU C C 2.951 -5.981 -4.926 1.00 . B B . 15 LEU C 1 1 11 8263 2 2 15 LEU CA C 2.934 -4.644 -4.181 1.00 . B B . 15 LEU CA 1 1 11 8264 2 2 15 LEU CB C 1.498 -4.125 -4.097 1.00 . B B . 15 LEU CB 1 1 11 8265 2 2 15 LEU CD1 C 0.236 -2.049 -3.523 1.00 . B B . 15 LEU CD1 1 1 11 8266 2 2 15 LEU CD2 C 1.304 -3.403 -1.716 1.00 . B B . 15 LEU CD2 1 1 11 8267 2 2 15 LEU CG C 1.442 -2.918 -3.160 1.00 . B B . 15 LEU CG 1 1 11 8268 2 2 15 LEU H H 3.347 -2.915 -5.404 1.00 . B B . 15 LEU H 1 1 11 8269 2 2 15 LEU HA H 3.339 -4.770 -3.184 1.00 . B B . 15 LEU HA 1 1 11 8270 2 2 15 LEU HB2 H 1.164 -3.833 -5.081 1.00 . B B . 15 LEU HB2 1 1 11 8271 2 2 15 LEU HB3 H 0.855 -4.905 -3.715 1.00 . B B . 15 LEU HB3 1 1 11 8272 2 2 15 LEU HD11 H 0.339 -1.700 -4.539 1.00 . B B . 15 LEU HD11 1 1 11 8273 2 2 15 LEU HD12 H 0.188 -1.203 -2.854 1.00 . B B . 15 LEU HD12 1 1 11 8274 2 2 15 LEU HD13 H -0.669 -2.632 -3.433 1.00 . B B . 15 LEU HD13 1 1 11 8275 2 2 15 LEU HD21 H 2.263 -3.748 -1.360 1.00 . B B . 15 LEU HD21 1 1 11 8276 2 2 15 LEU HD22 H 0.592 -4.215 -1.677 1.00 . B B . 15 LEU HD22 1 1 11 8277 2 2 15 LEU HD23 H 0.959 -2.590 -1.096 1.00 . B B . 15 LEU HD23 1 1 11 8278 2 2 15 LEU HG H 2.348 -2.339 -3.264 1.00 . B B . 15 LEU HG 1 1 11 8279 2 2 15 LEU N N 3.770 -3.671 -4.937 1.00 . B B . 15 LEU N 1 1 11 8280 2 2 15 LEU O O 2.813 -7.040 -4.347 1.00 . B B . 15 LEU O 1 1 11 8281 2 2 16 TYR C C 4.380 -7.985 -6.673 1.00 . B B . 16 TYR C 1 1 11 8282 2 2 16 TYR CA C 3.160 -7.158 -7.050 1.00 . B B . 16 TYR CA 1 1 11 8283 2 2 16 TYR CB C 3.285 -6.754 -8.520 1.00 . B B . 16 TYR CB 1 1 11 8284 2 2 16 TYR CD1 C 1.027 -7.786 -8.892 1.00 . B B . 16 TYR CD1 1 1 11 8285 2 2 16 TYR CD2 C 2.719 -8.026 -10.611 1.00 . B B . 16 TYR CD2 1 1 11 8286 2 2 16 TYR CE1 C 0.122 -8.511 -9.677 1.00 . B B . 16 TYR CE1 1 1 11 8287 2 2 16 TYR CE2 C 1.817 -8.749 -11.401 1.00 . B B . 16 TYR CE2 1 1 11 8288 2 2 16 TYR CG C 2.322 -7.546 -9.359 1.00 . B B . 16 TYR CG 1 1 11 8289 2 2 16 TYR CZ C 0.517 -8.993 -10.935 1.00 . B B . 16 TYR CZ 1 1 11 8290 2 2 16 TYR H H 3.232 -5.048 -6.649 1.00 . B B . 16 TYR H 1 1 11 8291 2 2 16 TYR HA H 2.260 -7.734 -6.902 1.00 . B B . 16 TYR HA 1 1 11 8292 2 2 16 TYR HB2 H 3.066 -5.704 -8.624 1.00 . B B . 16 TYR HB2 1 1 11 8293 2 2 16 TYR HB3 H 4.292 -6.942 -8.859 1.00 . B B . 16 TYR HB3 1 1 11 8294 2 2 16 TYR HD1 H 0.728 -7.416 -7.924 1.00 . B B . 16 TYR HD1 1 1 11 8295 2 2 16 TYR HD2 H 3.724 -7.839 -10.967 1.00 . B B . 16 TYR HD2 1 1 11 8296 2 2 16 TYR HE1 H -0.879 -8.695 -9.317 1.00 . B B . 16 TYR HE1 1 1 11 8297 2 2 16 TYR HE2 H 2.122 -9.116 -12.369 1.00 . B B . 16 TYR HE2 1 1 11 8298 2 2 16 TYR HH H -1.255 -9.376 -11.533 1.00 . B B . 16 TYR HH 1 1 11 8299 2 2 16 TYR N N 3.123 -5.922 -6.218 1.00 . B B . 16 TYR N 1 1 11 8300 2 2 16 TYR O O 4.437 -9.178 -6.902 1.00 . B B . 16 TYR O 1 1 11 8301 2 2 16 TYR OH O -0.373 -9.707 -11.712 1.00 . B B . 16 TYR OH 1 1 11 8302 2 2 17 LEU C C 6.626 -8.341 -4.251 1.00 . B B . 17 LEU C 1 1 11 8303 2 2 17 LEU CA C 6.606 -8.063 -5.759 1.00 . B B . 17 LEU CA 1 1 11 8304 2 2 17 LEU CB C 7.770 -7.173 -6.155 1.00 . B B . 17 LEU CB 1 1 11 8305 2 2 17 LEU CD1 C 9.037 -9.347 -6.037 1.00 . B B . 17 LEU CD1 1 1 11 8306 2 2 17 LEU CD2 C 10.174 -7.230 -6.676 1.00 . B B . 17 LEU CD2 1 1 11 8307 2 2 17 LEU CG C 9.092 -7.830 -5.795 1.00 . B B . 17 LEU CG 1 1 11 8308 2 2 17 LEU H H 5.310 -6.386 -5.973 1.00 . B B . 17 LEU H 1 1 11 8309 2 2 17 LEU HA H 6.671 -8.991 -6.304 1.00 . B B . 17 LEU HA 1 1 11 8310 2 2 17 LEU HB2 H 7.738 -6.997 -7.220 1.00 . B B . 17 LEU HB2 1 1 11 8311 2 2 17 LEU HB3 H 7.689 -6.228 -5.635 1.00 . B B . 17 LEU HB3 1 1 11 8312 2 2 17 LEU HD11 H 8.970 -9.538 -7.097 1.00 . B B . 17 LEU HD11 1 1 11 8313 2 2 17 LEU HD12 H 8.177 -9.766 -5.542 1.00 . B B . 17 LEU HD12 1 1 11 8314 2 2 17 LEU HD13 H 9.934 -9.804 -5.648 1.00 . B B . 17 LEU HD13 1 1 11 8315 2 2 17 LEU HD21 H 11.142 -7.493 -6.284 1.00 . B B . 17 LEU HD21 1 1 11 8316 2 2 17 LEU HD22 H 10.065 -6.156 -6.691 1.00 . B B . 17 LEU HD22 1 1 11 8317 2 2 17 LEU HD23 H 10.070 -7.617 -7.679 1.00 . B B . 17 LEU HD23 1 1 11 8318 2 2 17 LEU HG H 9.309 -7.628 -4.762 1.00 . B B . 17 LEU HG 1 1 11 8319 2 2 17 LEU N N 5.369 -7.350 -6.125 1.00 . B B . 17 LEU N 1 1 11 8320 2 2 17 LEU O O 7.492 -9.026 -3.746 1.00 . B B . 17 LEU O 1 1 11 8321 2 2 18 VAL C C 4.542 -9.077 -1.741 1.00 . B B . 18 VAL C 1 1 11 8322 2 2 18 VAL CA C 5.647 -8.068 -2.058 1.00 . B B . 18 VAL CA 1 1 11 8323 2 2 18 VAL CB C 5.393 -6.749 -1.314 1.00 . B B . 18 VAL CB 1 1 11 8324 2 2 18 VAL CG1 C 6.088 -5.609 -2.052 1.00 . B B . 18 VAL CG1 1 1 11 8325 2 2 18 VAL CG2 C 3.892 -6.453 -1.243 1.00 . B B . 18 VAL CG2 1 1 11 8326 2 2 18 VAL H H 4.980 -7.271 -3.943 1.00 . B B . 18 VAL H 1 1 11 8327 2 2 18 VAL HA H 6.600 -8.476 -1.749 1.00 . B B . 18 VAL HA 1 1 11 8328 2 2 18 VAL HB H 5.793 -6.821 -0.316 1.00 . B B . 18 VAL HB 1 1 11 8329 2 2 18 VAL HG11 H 6.622 -5.999 -2.905 1.00 . B B . 18 VAL HG11 1 1 11 8330 2 2 18 VAL HG12 H 6.781 -5.123 -1.385 1.00 . B B . 18 VAL HG12 1 1 11 8331 2 2 18 VAL HG13 H 5.347 -4.898 -2.383 1.00 . B B . 18 VAL HG13 1 1 11 8332 2 2 18 VAL HG21 H 3.393 -7.251 -0.713 1.00 . B B . 18 VAL HG21 1 1 11 8333 2 2 18 VAL HG22 H 3.492 -6.380 -2.244 1.00 . B B . 18 VAL HG22 1 1 11 8334 2 2 18 VAL HG23 H 3.734 -5.520 -0.723 1.00 . B B . 18 VAL HG23 1 1 11 8335 2 2 18 VAL N N 5.675 -7.821 -3.526 1.00 . B B . 18 VAL N 1 1 11 8336 2 2 18 VAL O O 4.737 -10.017 -0.996 1.00 . B B . 18 VAL O 1 1 11 8337 2 2 19 CYS C C 2.259 -10.921 -3.111 1.00 . B B . 19 CYS C 1 1 11 8338 2 2 19 CYS CA C 2.263 -9.825 -2.039 1.00 . B B . 19 CYS CA 1 1 11 8339 2 2 19 CYS CB C 0.942 -9.053 -2.065 1.00 . B B . 19 CYS CB 1 1 11 8340 2 2 19 CYS H H 3.242 -8.122 -2.899 1.00 . B B . 19 CYS H 1 1 11 8341 2 2 19 CYS HA H 2.400 -10.272 -1.066 1.00 . B B . 19 CYS HA 1 1 11 8342 2 2 19 CYS HB2 H 1.141 -8.006 -2.242 1.00 . B B . 19 CYS HB2 1 1 11 8343 2 2 19 CYS HB3 H 0.313 -9.436 -2.854 1.00 . B B . 19 CYS HB3 1 1 11 8344 2 2 19 CYS N N 3.380 -8.885 -2.303 1.00 . B B . 19 CYS N 1 1 11 8345 2 2 19 CYS O O 2.142 -12.093 -2.813 1.00 . B B . 19 CYS O 1 1 11 8346 2 2 19 CYS SG S 0.105 -9.246 -0.470 1.00 . B B . 19 CYS SG 1 1 11 8347 2 2 20 GLY C C 1.118 -12.392 -5.404 1.00 . B B . 20 GLY C 1 1 11 8348 2 2 20 GLY CA C 2.411 -11.573 -5.444 1.00 . B B . 20 GLY CA 1 1 11 8349 2 2 20 GLY H H 2.498 -9.602 -4.576 1.00 . B B . 20 GLY H 1 1 11 8350 2 2 20 GLY HA2 H 2.492 -11.076 -6.400 1.00 . B B . 20 GLY HA2 1 1 11 8351 2 2 20 GLY HA3 H 3.254 -12.232 -5.309 1.00 . B B . 20 GLY HA3 1 1 11 8352 2 2 20 GLY N N 2.397 -10.551 -4.356 1.00 . B B . 20 GLY N 1 1 11 8353 2 2 20 GLY O O 0.879 -13.143 -4.481 1.00 . B B . 20 GLY O 1 1 11 8354 2 2 21 GLU C C -1.654 -13.112 -5.080 1.00 . B B . 21 GLU C 1 1 11 8355 2 2 21 GLU CA C -1.012 -12.994 -6.467 1.00 . B B . 21 GLU CA 1 1 11 8356 2 2 21 GLU CB C -0.789 -14.394 -7.054 1.00 . B B . 21 GLU CB 1 1 11 8357 2 2 21 GLU CD C -0.530 -15.667 -4.907 1.00 . B B . 21 GLU CD 1 1 11 8358 2 2 21 GLU CG C 0.178 -15.206 -6.183 1.00 . B B . 21 GLU CG 1 1 11 8359 2 2 21 GLU H H 0.517 -11.625 -7.129 1.00 . B B . 21 GLU H 1 1 11 8360 2 2 21 GLU HA H -1.689 -12.453 -7.113 1.00 . B B . 21 GLU HA 1 1 11 8361 2 2 21 GLU HB2 H -1.735 -14.911 -7.109 1.00 . B B . 21 GLU HB2 1 1 11 8362 2 2 21 GLU HB3 H -0.377 -14.300 -8.048 1.00 . B B . 21 GLU HB3 1 1 11 8363 2 2 21 GLU HG2 H 0.511 -16.069 -6.736 1.00 . B B . 21 GLU HG2 1 1 11 8364 2 2 21 GLU HG3 H 1.029 -14.602 -5.924 1.00 . B B . 21 GLU HG3 1 1 11 8365 2 2 21 GLU N N 0.287 -12.243 -6.405 1.00 . B B . 21 GLU N 1 1 11 8366 2 2 21 GLU O O -2.459 -13.988 -4.834 1.00 . B B . 21 GLU O 1 1 11 8367 2 2 21 GLU OE1 O -1.215 -16.675 -4.965 1.00 . B B . 21 GLU OE1 1 1 11 8368 2 2 21 GLU OE2 O -0.376 -15.005 -3.894 1.00 . B B . 21 GLU OE2 1 1 11 8369 2 2 22 ARG C C -3.124 -11.370 -2.767 1.00 . B B . 22 ARG C 1 1 11 8370 2 2 22 ARG CA C -1.913 -12.299 -2.821 1.00 . B B . 22 ARG CA 1 1 11 8371 2 2 22 ARG CB C -0.869 -11.844 -1.798 1.00 . B B . 22 ARG CB 1 1 11 8372 2 2 22 ARG CD C -0.644 -14.128 -0.803 1.00 . B B . 22 ARG CD 1 1 11 8373 2 2 22 ARG CG C 0.099 -12.992 -1.502 1.00 . B B . 22 ARG CG 1 1 11 8374 2 2 22 ARG CZ C -0.761 -14.772 1.528 1.00 . B B . 22 ARG CZ 1 1 11 8375 2 2 22 ARG H H -0.677 -11.541 -4.390 1.00 . B B . 22 ARG H 1 1 11 8376 2 2 22 ARG HA H -2.222 -13.308 -2.608 1.00 . B B . 22 ARG HA 1 1 11 8377 2 2 22 ARG HB2 H -0.317 -11.013 -2.204 1.00 . B B . 22 ARG HB2 1 1 11 8378 2 2 22 ARG HB3 H -1.356 -11.537 -0.889 1.00 . B B . 22 ARG HB3 1 1 11 8379 2 2 22 ARG HD2 H -1.620 -14.247 -1.246 1.00 . B B . 22 ARG HD2 1 1 11 8380 2 2 22 ARG HD3 H -0.085 -15.042 -0.918 1.00 . B B . 22 ARG HD3 1 1 11 8381 2 2 22 ARG HE H -0.913 -12.884 0.934 1.00 . B B . 22 ARG HE 1 1 11 8382 2 2 22 ARG HG2 H 0.517 -13.356 -2.428 1.00 . B B . 22 ARG HG2 1 1 11 8383 2 2 22 ARG HG3 H 0.892 -12.637 -0.863 1.00 . B B . 22 ARG HG3 1 1 11 8384 2 2 22 ARG HH11 H -2.533 -15.534 0.988 1.00 . B B . 22 ARG HH11 1 1 11 8385 2 2 22 ARG HH12 H -1.729 -16.355 2.283 1.00 . B B . 22 ARG HH12 1 1 11 8386 2 2 22 ARG HH21 H 1.016 -14.235 2.275 1.00 . B B . 22 ARG HH21 1 1 11 8387 2 2 22 ARG HH22 H 0.281 -15.618 3.012 1.00 . B B . 22 ARG HH22 1 1 11 8388 2 2 22 ARG N N -1.318 -12.238 -4.177 1.00 . B B . 22 ARG N 1 1 11 8389 2 2 22 ARG NE N -0.792 -13.812 0.645 1.00 . B B . 22 ARG NE 1 1 11 8390 2 2 22 ARG NH1 N -1.751 -15.620 1.606 1.00 . B B . 22 ARG NH1 1 1 11 8391 2 2 22 ARG NH2 N 0.258 -14.884 2.335 1.00 . B B . 22 ARG NH2 1 1 11 8392 2 2 22 ARG O O -3.927 -11.429 -1.858 1.00 . B B . 22 ARG O 1 1 11 8393 2 2 23 GLY C C -4.113 -8.377 -2.860 1.00 . B B . 23 GLY C 1 1 11 8394 2 2 23 GLY CA C -4.416 -9.580 -3.753 1.00 . B B . 23 GLY CA 1 1 11 8395 2 2 23 GLY H H -2.599 -10.484 -4.464 1.00 . B B . 23 GLY H 1 1 11 8396 2 2 23 GLY HA2 H -4.594 -9.244 -4.765 1.00 . B B . 23 GLY HA2 1 1 11 8397 2 2 23 GLY HA3 H -5.293 -10.087 -3.380 1.00 . B B . 23 GLY HA3 1 1 11 8398 2 2 23 GLY N N -3.259 -10.513 -3.740 1.00 . B B . 23 GLY N 1 1 11 8399 2 2 23 GLY O O -4.359 -8.398 -1.669 1.00 . B B . 23 GLY O 1 1 11 8400 2 2 24 PHE C C -4.226 -4.994 -3.004 1.00 . B B . 24 PHE C 1 1 11 8401 2 2 24 PHE CA C -3.283 -6.123 -2.602 1.00 . B B . 24 PHE CA 1 1 11 8402 2 2 24 PHE CB C -1.827 -5.692 -2.811 1.00 . B B . 24 PHE CB 1 1 11 8403 2 2 24 PHE CD1 C -1.138 -6.996 -4.853 1.00 . B B . 24 PHE CD1 1 1 11 8404 2 2 24 PHE CD2 C -1.475 -4.602 -5.057 1.00 . B B . 24 PHE CD2 1 1 11 8405 2 2 24 PHE CE1 C -0.805 -7.066 -6.211 1.00 . B B . 24 PHE CE1 1 1 11 8406 2 2 24 PHE CE2 C -1.140 -4.671 -6.416 1.00 . B B . 24 PHE CE2 1 1 11 8407 2 2 24 PHE CG C -1.473 -5.765 -4.276 1.00 . B B . 24 PHE CG 1 1 11 8408 2 2 24 PHE CZ C -0.806 -5.903 -6.993 1.00 . B B . 24 PHE CZ 1 1 11 8409 2 2 24 PHE H H -3.402 -7.323 -4.387 1.00 . B B . 24 PHE H 1 1 11 8410 2 2 24 PHE HA H -3.444 -6.359 -1.566 1.00 . B B . 24 PHE HA 1 1 11 8411 2 2 24 PHE HB2 H -1.699 -4.681 -2.459 1.00 . B B . 24 PHE HB2 1 1 11 8412 2 2 24 PHE HB3 H -1.175 -6.347 -2.253 1.00 . B B . 24 PHE HB3 1 1 11 8413 2 2 24 PHE HD1 H -1.137 -7.893 -4.250 1.00 . B B . 24 PHE HD1 1 1 11 8414 2 2 24 PHE HD2 H -1.732 -3.652 -4.611 1.00 . B B . 24 PHE HD2 1 1 11 8415 2 2 24 PHE HE1 H -0.547 -8.016 -6.656 1.00 . B B . 24 PHE HE1 1 1 11 8416 2 2 24 PHE HE2 H -1.141 -3.775 -7.019 1.00 . B B . 24 PHE HE2 1 1 11 8417 2 2 24 PHE HZ H -0.548 -5.957 -8.040 1.00 . B B . 24 PHE HZ 1 1 11 8418 2 2 24 PHE N N -3.588 -7.324 -3.424 1.00 . B B . 24 PHE N 1 1 11 8419 2 2 24 PHE O O -4.427 -4.724 -4.171 1.00 . B B . 24 PHE O 1 1 11 8420 2 2 25 PHE C C -5.073 -1.891 -2.257 1.00 . B B . 25 PHE C 1 1 11 8421 2 2 25 PHE CA C -5.769 -3.246 -2.383 1.00 . B B . 25 PHE CA 1 1 11 8422 2 2 25 PHE CB C -6.966 -3.293 -1.431 1.00 . B B . 25 PHE CB 1 1 11 8423 2 2 25 PHE CD1 C -6.366 -1.810 0.513 1.00 . B B . 25 PHE CD1 1 1 11 8424 2 2 25 PHE CD2 C -6.155 -4.213 0.773 1.00 . B B . 25 PHE CD2 1 1 11 8425 2 2 25 PHE CE1 C -5.917 -1.626 1.826 1.00 . B B . 25 PHE CE1 1 1 11 8426 2 2 25 PHE CE2 C -5.707 -4.029 2.088 1.00 . B B . 25 PHE CE2 1 1 11 8427 2 2 25 PHE CG C -6.485 -3.101 -0.013 1.00 . B B . 25 PHE CG 1 1 11 8428 2 2 25 PHE CZ C -5.587 -2.737 2.614 1.00 . B B . 25 PHE CZ 1 1 11 8429 2 2 25 PHE H H -4.660 -4.582 -1.110 1.00 . B B . 25 PHE H 1 1 11 8430 2 2 25 PHE HA H -6.111 -3.379 -3.394 1.00 . B B . 25 PHE HA 1 1 11 8431 2 2 25 PHE HB2 H -7.659 -2.504 -1.687 1.00 . B B . 25 PHE HB2 1 1 11 8432 2 2 25 PHE HB3 H -7.459 -4.249 -1.518 1.00 . B B . 25 PHE HB3 1 1 11 8433 2 2 25 PHE HD1 H -6.621 -0.954 -0.093 1.00 . B B . 25 PHE HD1 1 1 11 8434 2 2 25 PHE HD2 H -6.248 -5.210 0.369 1.00 . B B . 25 PHE HD2 1 1 11 8435 2 2 25 PHE HE1 H -5.825 -0.629 2.231 1.00 . B B . 25 PHE HE1 1 1 11 8436 2 2 25 PHE HE2 H -5.452 -4.885 2.695 1.00 . B B . 25 PHE HE2 1 1 11 8437 2 2 25 PHE HZ H -5.240 -2.595 3.627 1.00 . B B . 25 PHE HZ 1 1 11 8438 2 2 25 PHE N N -4.823 -4.340 -2.046 1.00 . B B . 25 PHE N 1 1 11 8439 2 2 25 PHE O O -4.416 -1.602 -1.276 1.00 . B B . 25 PHE O 1 1 11 8440 2 2 26 TYR C C -5.653 1.333 -3.596 1.00 . B B . 26 TYR C 1 1 11 8441 2 2 26 TYR CA C -4.597 0.292 -3.200 1.00 . B B . 26 TYR CA 1 1 11 8442 2 2 26 TYR CB C -3.411 0.329 -4.177 1.00 . B B . 26 TYR CB 1 1 11 8443 2 2 26 TYR CD1 C -4.711 -0.421 -6.204 1.00 . B B . 26 TYR CD1 1 1 11 8444 2 2 26 TYR CD2 C -3.608 1.739 -6.255 1.00 . B B . 26 TYR CD2 1 1 11 8445 2 2 26 TYR CE1 C -5.198 -0.205 -7.497 1.00 . B B . 26 TYR CE1 1 1 11 8446 2 2 26 TYR CE2 C -4.091 1.955 -7.550 1.00 . B B . 26 TYR CE2 1 1 11 8447 2 2 26 TYR CG C -3.916 0.551 -5.583 1.00 . B B . 26 TYR CG 1 1 11 8448 2 2 26 TYR CZ C -4.888 0.984 -8.173 1.00 . B B . 26 TYR CZ 1 1 11 8449 2 2 26 TYR H H -5.770 -1.312 -4.020 1.00 . B B . 26 TYR H 1 1 11 8450 2 2 26 TYR HA H -4.247 0.494 -2.198 1.00 . B B . 26 TYR HA 1 1 11 8451 2 2 26 TYR HB2 H -2.747 1.132 -3.901 1.00 . B B . 26 TYR HB2 1 1 11 8452 2 2 26 TYR HB3 H -2.879 -0.610 -4.131 1.00 . B B . 26 TYR HB3 1 1 11 8453 2 2 26 TYR HD1 H -4.947 -1.337 -5.684 1.00 . B B . 26 TYR HD1 1 1 11 8454 2 2 26 TYR HD2 H -2.994 2.487 -5.775 1.00 . B B . 26 TYR HD2 1 1 11 8455 2 2 26 TYR HE1 H -5.814 -0.953 -7.973 1.00 . B B . 26 TYR HE1 1 1 11 8456 2 2 26 TYR HE2 H -3.854 2.872 -8.067 1.00 . B B . 26 TYR HE2 1 1 11 8457 2 2 26 TYR HH H -5.832 2.038 -9.455 1.00 . B B . 26 TYR HH 1 1 11 8458 2 2 26 TYR N N -5.227 -1.055 -3.245 1.00 . B B . 26 TYR N 1 1 11 8459 2 2 26 TYR O O -5.401 2.219 -4.389 1.00 . B B . 26 TYR O 1 1 11 8460 2 2 26 TYR OH O -5.367 1.198 -9.450 1.00 . B B . 26 TYR OH 1 1 11 8461 2 2 27 THR C C -7.447 3.517 -3.778 1.00 . B B . 27 THR C 1 1 11 8462 2 2 27 THR CA C -7.964 2.135 -3.375 1.00 . B B . 27 THR CA 1 1 11 8463 2 2 27 THR CB C -8.888 2.281 -2.157 1.00 . B B . 27 THR CB 1 1 11 8464 2 2 27 THR CG2 C -8.189 1.754 -0.903 1.00 . B B . 27 THR CG2 1 1 11 8465 2 2 27 THR H H -6.995 0.457 -2.434 1.00 . B B . 27 THR H 1 1 11 8466 2 2 27 THR HA H -8.532 1.723 -4.194 1.00 . B B . 27 THR HA 1 1 11 8467 2 2 27 THR HB H -9.789 1.715 -2.327 1.00 . B B . 27 THR HB 1 1 11 8468 2 2 27 THR HG1 H -10.099 3.795 -2.334 1.00 . B B . 27 THR HG1 1 1 11 8469 2 2 27 THR HG21 H -7.178 2.135 -0.871 1.00 . B B . 27 THR HG21 1 1 11 8470 2 2 27 THR HG22 H -8.165 0.675 -0.932 1.00 . B B . 27 THR HG22 1 1 11 8471 2 2 27 THR HG23 H -8.725 2.081 -0.027 1.00 . B B . 27 THR HG23 1 1 11 8472 2 2 27 THR N N -6.836 1.198 -3.054 1.00 . B B . 27 THR N 1 1 11 8473 2 2 27 THR O O -6.428 3.982 -3.307 1.00 . B B . 27 THR O 1 1 11 8474 2 2 27 THR OG1 O -9.222 3.651 -1.969 1.00 . B B . 27 THR OG1 1 1 11 8475 2 2 28 LYS C C -8.315 6.582 -4.139 1.00 . B B . 28 LYS C 1 1 11 8476 2 2 28 LYS CA C -7.739 5.532 -5.097 1.00 . B B . 28 LYS CA 1 1 11 8477 2 2 28 LYS CB C -8.227 5.764 -6.544 1.00 . B B . 28 LYS CB 1 1 11 8478 2 2 28 LYS CD C -9.777 7.287 -7.784 1.00 . B B . 28 LYS CD 1 1 11 8479 2 2 28 LYS CE C -10.399 6.534 -8.962 1.00 . B B . 28 LYS CE 1 1 11 8480 2 2 28 LYS CG C -9.651 6.349 -6.582 1.00 . B B . 28 LYS CG 1 1 11 8481 2 2 28 LYS H H -8.982 3.773 -5.000 1.00 . B B . 28 LYS H 1 1 11 8482 2 2 28 LYS HA H -6.660 5.590 -5.073 1.00 . B B . 28 LYS HA 1 1 11 8483 2 2 28 LYS HB2 H -7.553 6.443 -7.041 1.00 . B B . 28 LYS HB2 1 1 11 8484 2 2 28 LYS HB3 H -8.222 4.821 -7.068 1.00 . B B . 28 LYS HB3 1 1 11 8485 2 2 28 LYS HD2 H -10.406 8.125 -7.520 1.00 . B B . 28 LYS HD2 1 1 11 8486 2 2 28 LYS HD3 H -8.799 7.646 -8.065 1.00 . B B . 28 LYS HD3 1 1 11 8487 2 2 28 LYS HE2 H -10.325 5.470 -8.788 1.00 . B B . 28 LYS HE2 1 1 11 8488 2 2 28 LYS HE3 H -11.439 6.811 -9.056 1.00 . B B . 28 LYS HE3 1 1 11 8489 2 2 28 LYS HG2 H -10.367 5.547 -6.679 1.00 . B B . 28 LYS HG2 1 1 11 8490 2 2 28 LYS HG3 H -9.855 6.903 -5.683 1.00 . B B . 28 LYS HG3 1 1 11 8491 2 2 28 LYS HZ1 H -10.322 6.800 -11.026 1.00 . B B . 28 LYS HZ1 1 1 11 8492 2 2 28 LYS HZ2 H -8.870 6.239 -10.343 1.00 . B B . 28 LYS HZ2 1 1 11 8493 2 2 28 LYS HZ3 H -9.329 7.864 -10.154 1.00 . B B . 28 LYS HZ3 1 1 11 8494 2 2 28 LYS N N -8.161 4.175 -4.647 1.00 . B B . 28 LYS N 1 1 11 8495 2 2 28 LYS NZ N -9.675 6.886 -10.215 1.00 . B B . 28 LYS NZ 1 1 11 8496 2 2 28 LYS O O -9.129 6.264 -3.295 1.00 . B B . 28 LYS O 1 1 11 8497 2 2 29 PRO C C -9.698 9.419 -3.934 1.00 . B B . 29 PRO C 1 1 11 8498 2 2 29 PRO CA C -8.331 8.924 -3.458 1.00 . B B . 29 PRO CA 1 1 11 8499 2 2 29 PRO CB C -7.255 9.992 -3.671 1.00 . B B . 29 PRO CB 1 1 11 8500 2 2 29 PRO CD C -6.883 8.185 -5.324 1.00 . B B . 29 PRO CD 1 1 11 8501 2 2 29 PRO CG C -6.572 9.662 -5.019 1.00 . B B . 29 PRO CG 1 1 11 8502 2 2 29 PRO HA H -8.367 8.635 -2.421 1.00 . B B . 29 PRO HA 1 1 11 8503 2 2 29 PRO HB2 H -7.711 10.972 -3.711 1.00 . B B . 29 PRO HB2 1 1 11 8504 2 2 29 PRO HB3 H -6.529 9.951 -2.875 1.00 . B B . 29 PRO HB3 1 1 11 8505 2 2 29 PRO HD2 H -7.304 8.091 -6.314 1.00 . B B . 29 PRO HD2 1 1 11 8506 2 2 29 PRO HD3 H -5.995 7.581 -5.227 1.00 . B B . 29 PRO HD3 1 1 11 8507 2 2 29 PRO HG2 H -6.971 10.297 -5.799 1.00 . B B . 29 PRO HG2 1 1 11 8508 2 2 29 PRO HG3 H -5.505 9.801 -4.937 1.00 . B B . 29 PRO HG3 1 1 11 8509 2 2 29 PRO N N -7.874 7.805 -4.298 1.00 . B B . 29 PRO N 1 1 11 8510 2 2 29 PRO O O -10.315 8.833 -4.802 1.00 . B B . 29 PRO O 1 1 11 8511 2 2 30 THR C C -11.499 12.550 -3.716 1.00 . B B . 30 THR C 1 1 11 8512 2 2 30 THR CA C -11.507 11.022 -3.797 1.00 . B B . 30 THR CA 1 1 11 8513 2 2 30 THR CB C -12.592 10.465 -2.874 1.00 . B B . 30 THR CB 1 1 11 8514 2 2 30 THR CG2 C -13.896 10.301 -3.657 1.00 . B B . 30 THR CG2 1 1 11 8515 2 2 30 THR H H -9.667 10.954 -2.676 1.00 . B B . 30 THR H 1 1 11 8516 2 2 30 THR HA H -11.707 10.717 -4.813 1.00 . B B . 30 THR HA 1 1 11 8517 2 2 30 THR HB H -12.753 11.148 -2.054 1.00 . B B . 30 THR HB 1 1 11 8518 2 2 30 THR HG1 H -12.665 9.035 -1.556 1.00 . B B . 30 THR HG1 1 1 11 8519 2 2 30 THR HG21 H -13.880 9.361 -4.189 1.00 . B B . 30 THR HG21 1 1 11 8520 2 2 30 THR HG22 H -13.997 11.113 -4.362 1.00 . B B . 30 THR HG22 1 1 11 8521 2 2 30 THR HG23 H -14.730 10.312 -2.972 1.00 . B B . 30 THR HG23 1 1 11 8522 2 2 30 THR N N -10.179 10.495 -3.375 1.00 . B B . 30 THR N 1 1 11 8523 2 2 30 THR O O -12.109 13.172 -4.570 1.00 . B B . 30 THR O 1 1 11 8524 2 2 30 THR OXT O -10.883 13.072 -2.801 1.00 . B B . 30 THR OXT 1 1 11 8525 2 2 30 THR OG1 O -12.178 9.204 -2.367 1.00 . B B . 30 THR OG1 1 1 12 8526 1 1 1 GLY C C -3.431 7.673 0.317 1.00 . A A . 1 GLY C 1 1 12 8527 1 1 1 GLY CA C -4.842 8.123 0.478 1.00 . A A . 1 GLY CA 1 1 12 8528 1 1 1 GLY H1 H -4.456 9.826 1.672 1.00 . A A . 1 GLY H1 1 1 12 8529 1 1 1 GLY H2 H -5.270 8.584 2.498 1.00 . A A . 1 GLY H2 1 1 12 8530 1 1 1 GLY H3 H -6.107 9.556 1.384 1.00 . A A . 1 GLY H3 1 1 12 8531 1 1 1 GLY HA2 H -4.991 7.200 0.753 1.00 . A A . 1 GLY HA2 1 1 12 8532 1 1 1 GLY HA3 H -5.474 8.429 -0.455 1.00 . A A . 1 GLY HA3 1 1 12 8533 1 1 1 GLY N N -5.197 9.101 1.597 1.00 . A A . 1 GLY N 1 1 12 8534 1 1 1 GLY O O -2.516 8.256 0.864 1.00 . A A . 1 GLY O 1 1 12 8535 1 1 2 ILE C C -1.390 6.516 -2.063 1.00 . A A . 2 ILE C 1 1 12 8536 1 1 2 ILE CA C -1.829 6.137 -0.652 1.00 . A A . 2 ILE CA 1 1 12 8537 1 1 2 ILE CB C -1.808 4.614 -0.485 1.00 . A A . 2 ILE CB 1 1 12 8538 1 1 2 ILE CD1 C 0.225 3.584 -1.606 1.00 . A A . 2 ILE CD1 1 1 12 8539 1 1 2 ILE CG1 C -0.351 4.138 -0.296 1.00 . A A . 2 ILE CG1 1 1 12 8540 1 1 2 ILE CG2 C -2.445 3.957 -1.715 1.00 . A A . 2 ILE CG2 1 1 12 8541 1 1 2 ILE H H -3.967 6.185 -0.884 1.00 . A A . 2 ILE H 1 1 12 8542 1 1 2 ILE HA H -1.168 6.589 0.066 1.00 . A A . 2 ILE HA 1 1 12 8543 1 1 2 ILE HB H -2.386 4.352 0.391 1.00 . A A . 2 ILE HB 1 1 12 8544 1 1 2 ILE HD11 H -0.286 2.668 -1.864 1.00 . A A . 2 ILE HD11 1 1 12 8545 1 1 2 ILE HD12 H 1.279 3.385 -1.480 1.00 . A A . 2 ILE HD12 1 1 12 8546 1 1 2 ILE HD13 H 0.086 4.308 -2.395 1.00 . A A . 2 ILE HD13 1 1 12 8547 1 1 2 ILE HG12 H 0.253 4.971 0.034 1.00 . A A . 2 ILE HG12 1 1 12 8548 1 1 2 ILE HG13 H -0.329 3.364 0.459 1.00 . A A . 2 ILE HG13 1 1 12 8549 1 1 2 ILE HG21 H -3.468 4.290 -1.813 1.00 . A A . 2 ILE HG21 1 1 12 8550 1 1 2 ILE HG22 H -2.424 2.883 -1.599 1.00 . A A . 2 ILE HG22 1 1 12 8551 1 1 2 ILE HG23 H -1.890 4.234 -2.598 1.00 . A A . 2 ILE HG23 1 1 12 8552 1 1 2 ILE N N -3.215 6.634 -0.441 1.00 . A A . 2 ILE N 1 1 12 8553 1 1 2 ILE O O -0.265 6.906 -2.302 1.00 . A A . 2 ILE O 1 1 12 8554 1 1 3 VAL C C -1.376 8.169 -4.465 1.00 . A A . 3 VAL C 1 1 12 8555 1 1 3 VAL CA C -1.966 6.758 -4.401 1.00 . A A . 3 VAL CA 1 1 12 8556 1 1 3 VAL CB C -3.251 6.706 -5.223 1.00 . A A . 3 VAL CB 1 1 12 8557 1 1 3 VAL CG1 C -2.905 6.772 -6.706 1.00 . A A . 3 VAL CG1 1 1 12 8558 1 1 3 VAL CG2 C -3.991 5.398 -4.927 1.00 . A A . 3 VAL CG2 1 1 12 8559 1 1 3 VAL H H -3.188 6.095 -2.767 1.00 . A A . 3 VAL H 1 1 12 8560 1 1 3 VAL HA H -1.256 6.048 -4.797 1.00 . A A . 3 VAL HA 1 1 12 8561 1 1 3 VAL HB H -3.878 7.545 -4.961 1.00 . A A . 3 VAL HB 1 1 12 8562 1 1 3 VAL HG11 H -3.796 6.995 -7.272 1.00 . A A . 3 VAL HG11 1 1 12 8563 1 1 3 VAL HG12 H -2.503 5.821 -7.023 1.00 . A A . 3 VAL HG12 1 1 12 8564 1 1 3 VAL HG13 H -2.170 7.547 -6.867 1.00 . A A . 3 VAL HG13 1 1 12 8565 1 1 3 VAL HG21 H -4.222 4.897 -5.855 1.00 . A A . 3 VAL HG21 1 1 12 8566 1 1 3 VAL HG22 H -4.908 5.614 -4.398 1.00 . A A . 3 VAL HG22 1 1 12 8567 1 1 3 VAL HG23 H -3.367 4.760 -4.319 1.00 . A A . 3 VAL HG23 1 1 12 8568 1 1 3 VAL N N -2.288 6.407 -2.996 1.00 . A A . 3 VAL N 1 1 12 8569 1 1 3 VAL O O -0.608 8.490 -5.350 1.00 . A A . 3 VAL O 1 1 12 8570 1 1 4 GLU C C -0.119 10.562 -2.473 1.00 . A A . 4 GLU C 1 1 12 8571 1 1 4 GLU CA C -1.191 10.408 -3.555 1.00 . A A . 4 GLU CA 1 1 12 8572 1 1 4 GLU CB C -2.329 11.397 -3.290 1.00 . A A . 4 GLU CB 1 1 12 8573 1 1 4 GLU CD C -2.000 13.582 -4.458 1.00 . A A . 4 GLU CD 1 1 12 8574 1 1 4 GLU CG C -1.762 12.813 -3.157 1.00 . A A . 4 GLU CG 1 1 12 8575 1 1 4 GLU H H -2.354 8.741 -2.834 1.00 . A A . 4 GLU H 1 1 12 8576 1 1 4 GLU HA H -0.755 10.613 -4.520 1.00 . A A . 4 GLU HA 1 1 12 8577 1 1 4 GLU HB2 H -3.030 11.366 -4.112 1.00 . A A . 4 GLU HB2 1 1 12 8578 1 1 4 GLU HB3 H -2.835 11.128 -2.375 1.00 . A A . 4 GLU HB3 1 1 12 8579 1 1 4 GLU HG2 H -2.256 13.322 -2.342 1.00 . A A . 4 GLU HG2 1 1 12 8580 1 1 4 GLU HG3 H -0.703 12.762 -2.961 1.00 . A A . 4 GLU HG3 1 1 12 8581 1 1 4 GLU N N -1.730 9.017 -3.537 1.00 . A A . 4 GLU N 1 1 12 8582 1 1 4 GLU O O 0.872 11.239 -2.662 1.00 . A A . 4 GLU O 1 1 12 8583 1 1 4 GLU OE1 O -2.478 12.976 -5.401 1.00 . A A . 4 GLU OE1 1 1 12 8584 1 1 4 GLU OE2 O -1.699 14.764 -4.487 1.00 . A A . 4 GLU OE2 1 1 12 8585 1 1 5 GLN C C 1.903 9.173 -0.569 1.00 . A A . 5 GLN C 1 1 12 8586 1 1 5 GLN CA C 0.705 10.070 -0.254 1.00 . A A . 5 GLN CA 1 1 12 8587 1 1 5 GLN CB C 0.085 9.650 1.080 1.00 . A A . 5 GLN CB 1 1 12 8588 1 1 5 GLN CD C 0.859 9.757 3.456 1.00 . A A . 5 GLN CD 1 1 12 8589 1 1 5 GLN CG C 0.588 10.575 2.190 1.00 . A A . 5 GLN CG 1 1 12 8590 1 1 5 GLN H H -1.116 9.405 -1.202 1.00 . A A . 5 GLN H 1 1 12 8591 1 1 5 GLN HA H 1.036 11.096 -0.191 1.00 . A A . 5 GLN HA 1 1 12 8592 1 1 5 GLN HB2 H -0.992 9.719 1.014 1.00 . A A . 5 GLN HB2 1 1 12 8593 1 1 5 GLN HB3 H 0.368 8.633 1.306 1.00 . A A . 5 GLN HB3 1 1 12 8594 1 1 5 GLN HE21 H 0.901 11.347 4.646 1.00 . A A . 5 GLN HE21 1 1 12 8595 1 1 5 GLN HE22 H 1.155 9.856 5.417 1.00 . A A . 5 GLN HE22 1 1 12 8596 1 1 5 GLN HG2 H 1.502 11.056 1.871 1.00 . A A . 5 GLN HG2 1 1 12 8597 1 1 5 GLN HG3 H -0.158 11.325 2.401 1.00 . A A . 5 GLN HG3 1 1 12 8598 1 1 5 GLN N N -0.309 9.946 -1.339 1.00 . A A . 5 GLN N 1 1 12 8599 1 1 5 GLN NE2 N 0.982 10.371 4.601 1.00 . A A . 5 GLN NE2 1 1 12 8600 1 1 5 GLN O O 3.037 9.523 -0.310 1.00 . A A . 5 GLN O 1 1 12 8601 1 1 5 GLN OE1 O 0.959 8.549 3.401 1.00 . A A . 5 GLN OE1 1 1 12 8602 1 1 6 CYS C C 3.377 7.498 -2.816 1.00 . A A . 6 CYS C 1 1 12 8603 1 1 6 CYS CA C 2.790 7.105 -1.460 1.00 . A A . 6 CYS CA 1 1 12 8604 1 1 6 CYS CB C 2.275 5.670 -1.528 1.00 . A A . 6 CYS CB 1 1 12 8605 1 1 6 CYS H H 0.741 7.756 -1.331 1.00 . A A . 6 CYS H 1 1 12 8606 1 1 6 CYS HA H 3.552 7.181 -0.700 1.00 . A A . 6 CYS HA 1 1 12 8607 1 1 6 CYS HB2 H 1.197 5.675 -1.486 1.00 . A A . 6 CYS HB2 1 1 12 8608 1 1 6 CYS HB3 H 2.597 5.213 -2.452 1.00 . A A . 6 CYS HB3 1 1 12 8609 1 1 6 CYS N N 1.662 8.019 -1.128 1.00 . A A . 6 CYS N 1 1 12 8610 1 1 6 CYS O O 4.523 7.219 -3.112 1.00 . A A . 6 CYS O 1 1 12 8611 1 1 6 CYS SG S 2.928 4.726 -0.130 1.00 . A A . 6 CYS SG 1 1 12 8612 1 1 7 CYS C C 3.832 9.897 -4.850 1.00 . A A . 7 CYS C 1 1 12 8613 1 1 7 CYS CA C 3.120 8.550 -4.978 1.00 . A A . 7 CYS CA 1 1 12 8614 1 1 7 CYS CB C 1.957 8.673 -5.966 1.00 . A A . 7 CYS CB 1 1 12 8615 1 1 7 CYS H H 1.680 8.356 -3.389 1.00 . A A . 7 CYS H 1 1 12 8616 1 1 7 CYS HA H 3.817 7.806 -5.332 1.00 . A A . 7 CYS HA 1 1 12 8617 1 1 7 CYS HB2 H 1.436 7.729 -6.027 1.00 . A A . 7 CYS HB2 1 1 12 8618 1 1 7 CYS HB3 H 1.275 9.438 -5.625 1.00 . A A . 7 CYS HB3 1 1 12 8619 1 1 7 CYS N N 2.601 8.141 -3.645 1.00 . A A . 7 CYS N 1 1 12 8620 1 1 7 CYS O O 4.798 10.166 -5.534 1.00 . A A . 7 CYS O 1 1 12 8621 1 1 7 CYS SG S 2.592 9.117 -7.604 1.00 . A A . 7 CYS SG 1 1 12 8622 1 1 8 THR C C 5.106 11.943 -2.713 1.00 . A A . 8 THR C 1 1 12 8623 1 1 8 THR CA C 4.029 12.066 -3.792 1.00 . A A . 8 THR CA 1 1 12 8624 1 1 8 THR CB C 2.992 13.107 -3.364 1.00 . A A . 8 THR CB 1 1 12 8625 1 1 8 THR CG2 C 3.689 14.443 -3.103 1.00 . A A . 8 THR CG2 1 1 12 8626 1 1 8 THR H H 2.591 10.504 -3.419 1.00 . A A . 8 THR H 1 1 12 8627 1 1 8 THR HA H 4.483 12.369 -4.723 1.00 . A A . 8 THR HA 1 1 12 8628 1 1 8 THR HB H 2.501 12.779 -2.461 1.00 . A A . 8 THR HB 1 1 12 8629 1 1 8 THR HG1 H 1.604 12.416 -4.539 1.00 . A A . 8 THR HG1 1 1 12 8630 1 1 8 THR HG21 H 4.560 14.525 -3.737 1.00 . A A . 8 THR HG21 1 1 12 8631 1 1 8 THR HG22 H 3.991 14.497 -2.068 1.00 . A A . 8 THR HG22 1 1 12 8632 1 1 8 THR HG23 H 3.009 15.254 -3.321 1.00 . A A . 8 THR HG23 1 1 12 8633 1 1 8 THR N N 3.369 10.742 -3.969 1.00 . A A . 8 THR N 1 1 12 8634 1 1 8 THR O O 5.972 12.785 -2.583 1.00 . A A . 8 THR O 1 1 12 8635 1 1 8 THR OG1 O 2.028 13.265 -4.397 1.00 . A A . 8 THR OG1 1 1 12 8636 1 1 9 SER C C 6.645 9.282 -0.974 1.00 . A A . 9 SER C 1 1 12 8637 1 1 9 SER CA C 6.077 10.699 -0.873 1.00 . A A . 9 SER CA 1 1 12 8638 1 1 9 SER CB C 5.427 10.894 0.497 1.00 . A A . 9 SER CB 1 1 12 8639 1 1 9 SER H H 4.353 10.223 -2.069 1.00 . A A . 9 SER H 1 1 12 8640 1 1 9 SER HA H 6.874 11.417 -1.001 1.00 . A A . 9 SER HA 1 1 12 8641 1 1 9 SER HB2 H 4.653 11.641 0.427 1.00 . A A . 9 SER HB2 1 1 12 8642 1 1 9 SER HB3 H 4.991 9.959 0.824 1.00 . A A . 9 SER HB3 1 1 12 8643 1 1 9 SER HG H 6.399 10.721 2.173 1.00 . A A . 9 SER HG 1 1 12 8644 1 1 9 SER N N 5.059 10.891 -1.941 1.00 . A A . 9 SER N 1 1 12 8645 1 1 9 SER O O 6.108 8.436 -1.661 1.00 . A A . 9 SER O 1 1 12 8646 1 1 9 SER OG O 6.411 11.326 1.428 1.00 . A A . 9 SER OG 1 1 12 8647 1 1 10 ILE C C 7.784 6.796 0.776 1.00 . A A . 10 ILE C 1 1 12 8648 1 1 10 ILE CA C 8.331 7.654 -0.367 1.00 . A A . 10 ILE CA 1 1 12 8649 1 1 10 ILE CB C 9.849 7.778 -0.243 1.00 . A A . 10 ILE CB 1 1 12 8650 1 1 10 ILE CD1 C 11.719 7.961 -1.950 1.00 . A A . 10 ILE CD1 1 1 12 8651 1 1 10 ILE CG1 C 10.379 8.539 -1.476 1.00 . A A . 10 ILE CG1 1 1 12 8652 1 1 10 ILE CG2 C 10.460 6.374 -0.163 1.00 . A A . 10 ILE CG2 1 1 12 8653 1 1 10 ILE H H 8.152 9.709 0.245 1.00 . A A . 10 ILE H 1 1 12 8654 1 1 10 ILE HA H 8.083 7.196 -1.313 1.00 . A A . 10 ILE HA 1 1 12 8655 1 1 10 ILE HB H 10.093 8.328 0.655 1.00 . A A . 10 ILE HB 1 1 12 8656 1 1 10 ILE HD11 H 12.128 8.592 -2.725 1.00 . A A . 10 ILE HD11 1 1 12 8657 1 1 10 ILE HD12 H 11.565 6.966 -2.338 1.00 . A A . 10 ILE HD12 1 1 12 8658 1 1 10 ILE HD13 H 12.406 7.921 -1.118 1.00 . A A . 10 ILE HD13 1 1 12 8659 1 1 10 ILE HG12 H 9.657 8.457 -2.275 1.00 . A A . 10 ILE HG12 1 1 12 8660 1 1 10 ILE HG13 H 10.509 9.580 -1.221 1.00 . A A . 10 ILE HG13 1 1 12 8661 1 1 10 ILE HG21 H 10.374 5.893 -1.124 1.00 . A A . 10 ILE HG21 1 1 12 8662 1 1 10 ILE HG22 H 9.934 5.794 0.580 1.00 . A A . 10 ILE HG22 1 1 12 8663 1 1 10 ILE HG23 H 11.502 6.451 0.109 1.00 . A A . 10 ILE HG23 1 1 12 8664 1 1 10 ILE N N 7.729 9.014 -0.301 1.00 . A A . 10 ILE N 1 1 12 8665 1 1 10 ILE O O 7.575 7.268 1.876 1.00 . A A . 10 ILE O 1 1 12 8666 1 1 11 CYS C C 7.827 3.372 1.669 1.00 . A A . 11 CYS C 1 1 12 8667 1 1 11 CYS CA C 7.004 4.656 1.603 1.00 . A A . 11 CYS CA 1 1 12 8668 1 1 11 CYS CB C 5.534 4.290 1.335 1.00 . A A . 11 CYS CB 1 1 12 8669 1 1 11 CYS H H 7.714 5.173 -0.370 1.00 . A A . 11 CYS H 1 1 12 8670 1 1 11 CYS HA H 7.076 5.172 2.550 1.00 . A A . 11 CYS HA 1 1 12 8671 1 1 11 CYS HB2 H 5.457 3.225 1.181 1.00 . A A . 11 CYS HB2 1 1 12 8672 1 1 11 CYS HB3 H 4.938 4.566 2.193 1.00 . A A . 11 CYS HB3 1 1 12 8673 1 1 11 CYS N N 7.544 5.537 0.524 1.00 . A A . 11 CYS N 1 1 12 8674 1 1 11 CYS O O 8.392 2.931 0.688 1.00 . A A . 11 CYS O 1 1 12 8675 1 1 11 CYS SG S 4.902 5.147 -0.133 1.00 . A A . 11 CYS SG 1 1 12 8676 1 1 12 SER C C 7.744 0.299 2.945 1.00 . A A . 12 SER C 1 1 12 8677 1 1 12 SER CA C 8.683 1.510 2.957 1.00 . A A . 12 SER CA 1 1 12 8678 1 1 12 SER CB C 9.463 1.536 4.272 1.00 . A A . 12 SER CB 1 1 12 8679 1 1 12 SER H H 7.434 3.140 3.602 1.00 . A A . 12 SER H 1 1 12 8680 1 1 12 SER HA H 9.377 1.433 2.132 1.00 . A A . 12 SER HA 1 1 12 8681 1 1 12 SER HB2 H 9.874 0.560 4.470 1.00 . A A . 12 SER HB2 1 1 12 8682 1 1 12 SER HB3 H 10.270 2.253 4.198 1.00 . A A . 12 SER HB3 1 1 12 8683 1 1 12 SER HG H 8.670 2.843 5.474 1.00 . A A . 12 SER HG 1 1 12 8684 1 1 12 SER N N 7.898 2.767 2.823 1.00 . A A . 12 SER N 1 1 12 8685 1 1 12 SER O O 6.569 0.401 3.255 1.00 . A A . 12 SER O 1 1 12 8686 1 1 12 SER OG O 8.587 1.898 5.331 1.00 . A A . 12 SER OG 1 1 12 8687 1 1 13 LEU C C 6.417 -2.091 3.664 1.00 . A A . 13 LEU C 1 1 12 8688 1 1 13 LEU CA C 7.439 -2.081 2.530 1.00 . A A . 13 LEU CA 1 1 12 8689 1 1 13 LEU CB C 8.343 -3.302 2.656 1.00 . A A . 13 LEU CB 1 1 12 8690 1 1 13 LEU CD1 C 7.631 -5.214 1.219 1.00 . A A . 13 LEU CD1 1 1 12 8691 1 1 13 LEU CD2 C 7.961 -5.543 3.672 1.00 . A A . 13 LEU CD2 1 1 12 8692 1 1 13 LEU CG C 7.489 -4.567 2.598 1.00 . A A . 13 LEU CG 1 1 12 8693 1 1 13 LEU H H 9.202 -0.886 2.320 1.00 . A A . 13 LEU H 1 1 12 8694 1 1 13 LEU HA H 6.930 -2.123 1.597 1.00 . A A . 13 LEU HA 1 1 12 8695 1 1 13 LEU HB2 H 9.053 -3.308 1.845 1.00 . A A . 13 LEU HB2 1 1 12 8696 1 1 13 LEU HB3 H 8.868 -3.268 3.598 1.00 . A A . 13 LEU HB3 1 1 12 8697 1 1 13 LEU HD11 H 8.598 -5.688 1.142 1.00 . A A . 13 LEU HD11 1 1 12 8698 1 1 13 LEU HD12 H 7.539 -4.457 0.454 1.00 . A A . 13 LEU HD12 1 1 12 8699 1 1 13 LEU HD13 H 6.856 -5.954 1.088 1.00 . A A . 13 LEU HD13 1 1 12 8700 1 1 13 LEU HD21 H 7.516 -6.511 3.499 1.00 . A A . 13 LEU HD21 1 1 12 8701 1 1 13 LEU HD22 H 7.662 -5.177 4.644 1.00 . A A . 13 LEU HD22 1 1 12 8702 1 1 13 LEU HD23 H 9.036 -5.627 3.633 1.00 . A A . 13 LEU HD23 1 1 12 8703 1 1 13 LEU HG H 6.454 -4.310 2.770 1.00 . A A . 13 LEU HG 1 1 12 8704 1 1 13 LEU N N 8.263 -0.844 2.577 1.00 . A A . 13 LEU N 1 1 12 8705 1 1 13 LEU O O 5.284 -2.491 3.486 1.00 . A A . 13 LEU O 1 1 12 8706 1 1 14 TYR C C 4.502 -1.102 5.491 1.00 . A A . 14 TYR C 1 1 12 8707 1 1 14 TYR CA C 5.850 -1.642 5.969 1.00 . A A . 14 TYR CA 1 1 12 8708 1 1 14 TYR CB C 6.395 -0.742 7.080 1.00 . A A . 14 TYR CB 1 1 12 8709 1 1 14 TYR CD1 C 5.847 -2.223 9.047 1.00 . A A . 14 TYR CD1 1 1 12 8710 1 1 14 TYR CD2 C 8.175 -1.741 8.561 1.00 . A A . 14 TYR CD2 1 1 12 8711 1 1 14 TYR CE1 C 6.237 -3.007 10.141 1.00 . A A . 14 TYR CE1 1 1 12 8712 1 1 14 TYR CE2 C 8.566 -2.526 9.655 1.00 . A A . 14 TYR CE2 1 1 12 8713 1 1 14 TYR CG C 6.816 -1.590 8.258 1.00 . A A . 14 TYR CG 1 1 12 8714 1 1 14 TYR CZ C 7.597 -3.159 10.445 1.00 . A A . 14 TYR CZ 1 1 12 8715 1 1 14 TYR H H 7.724 -1.337 4.950 1.00 . A A . 14 TYR H 1 1 12 8716 1 1 14 TYR HA H 5.725 -2.646 6.346 1.00 . A A . 14 TYR HA 1 1 12 8717 1 1 14 TYR HB2 H 7.247 -0.191 6.711 1.00 . A A . 14 TYR HB2 1 1 12 8718 1 1 14 TYR HB3 H 5.627 -0.051 7.393 1.00 . A A . 14 TYR HB3 1 1 12 8719 1 1 14 TYR HD1 H 4.799 -2.106 8.813 1.00 . A A . 14 TYR HD1 1 1 12 8720 1 1 14 TYR HD2 H 8.923 -1.253 7.953 1.00 . A A . 14 TYR HD2 1 1 12 8721 1 1 14 TYR HE1 H 5.490 -3.495 10.750 1.00 . A A . 14 TYR HE1 1 1 12 8722 1 1 14 TYR HE2 H 9.615 -2.643 9.889 1.00 . A A . 14 TYR HE2 1 1 12 8723 1 1 14 TYR HH H 7.991 -4.849 11.240 1.00 . A A . 14 TYR HH 1 1 12 8724 1 1 14 TYR N N 6.805 -1.656 4.828 1.00 . A A . 14 TYR N 1 1 12 8725 1 1 14 TYR O O 3.498 -1.788 5.528 1.00 . A A . 14 TYR O 1 1 12 8726 1 1 14 TYR OH O 7.981 -3.932 11.522 1.00 . A A . 14 TYR OH 1 1 12 8727 1 1 15 GLN C C 2.600 -0.211 3.479 1.00 . A A . 15 GLN C 1 1 12 8728 1 1 15 GLN CA C 3.195 0.705 4.546 1.00 . A A . 15 GLN CA 1 1 12 8729 1 1 15 GLN CB C 3.463 2.086 3.944 1.00 . A A . 15 GLN CB 1 1 12 8730 1 1 15 GLN CD C 4.416 3.973 5.276 1.00 . A A . 15 GLN CD 1 1 12 8731 1 1 15 GLN CG C 3.151 3.163 4.984 1.00 . A A . 15 GLN CG 1 1 12 8732 1 1 15 GLN H H 5.295 0.649 5.000 1.00 . A A . 15 GLN H 1 1 12 8733 1 1 15 GLN HA H 2.503 0.798 5.370 1.00 . A A . 15 GLN HA 1 1 12 8734 1 1 15 GLN HB2 H 4.500 2.155 3.652 1.00 . A A . 15 GLN HB2 1 1 12 8735 1 1 15 GLN HB3 H 2.834 2.230 3.079 1.00 . A A . 15 GLN HB3 1 1 12 8736 1 1 15 GLN HE21 H 3.463 5.338 6.359 1.00 . A A . 15 GLN HE21 1 1 12 8737 1 1 15 GLN HE22 H 5.135 5.577 6.199 1.00 . A A . 15 GLN HE22 1 1 12 8738 1 1 15 GLN HG2 H 2.382 3.820 4.603 1.00 . A A . 15 GLN HG2 1 1 12 8739 1 1 15 GLN HG3 H 2.807 2.696 5.894 1.00 . A A . 15 GLN HG3 1 1 12 8740 1 1 15 GLN N N 4.473 0.119 5.032 1.00 . A A . 15 GLN N 1 1 12 8741 1 1 15 GLN NE2 N 4.331 5.052 6.005 1.00 . A A . 15 GLN NE2 1 1 12 8742 1 1 15 GLN O O 1.406 -0.437 3.434 1.00 . A A . 15 GLN O 1 1 12 8743 1 1 15 GLN OE1 O 5.492 3.620 4.836 1.00 . A A . 15 GLN OE1 1 1 12 8744 1 1 16 LEU C C 2.236 -2.863 2.183 1.00 . A A . 16 LEU C 1 1 12 8745 1 1 16 LEU CA C 2.905 -1.644 1.551 1.00 . A A . 16 LEU CA 1 1 12 8746 1 1 16 LEU CB C 4.058 -2.107 0.677 1.00 . A A . 16 LEU CB 1 1 12 8747 1 1 16 LEU CD1 C 5.964 -0.574 0.215 1.00 . A A . 16 LEU CD1 1 1 12 8748 1 1 16 LEU CD2 C 4.505 -1.319 -1.636 1.00 . A A . 16 LEU CD2 1 1 12 8749 1 1 16 LEU CG C 4.538 -0.931 -0.167 1.00 . A A . 16 LEU CG 1 1 12 8750 1 1 16 LEU H H 4.383 -0.542 2.673 1.00 . A A . 16 LEU H 1 1 12 8751 1 1 16 LEU HA H 2.195 -1.113 0.942 1.00 . A A . 16 LEU HA 1 1 12 8752 1 1 16 LEU HB2 H 4.856 -2.466 1.301 1.00 . A A . 16 LEU HB2 1 1 12 8753 1 1 16 LEU HB3 H 3.726 -2.901 0.028 1.00 . A A . 16 LEU HB3 1 1 12 8754 1 1 16 LEU HD11 H 6.034 -0.472 1.286 1.00 . A A . 16 LEU HD11 1 1 12 8755 1 1 16 LEU HD12 H 6.236 0.358 -0.258 1.00 . A A . 16 LEU HD12 1 1 12 8756 1 1 16 LEU HD13 H 6.628 -1.358 -0.119 1.00 . A A . 16 LEU HD13 1 1 12 8757 1 1 16 LEU HD21 H 4.885 -2.323 -1.748 1.00 . A A . 16 LEU HD21 1 1 12 8758 1 1 16 LEU HD22 H 5.123 -0.635 -2.198 1.00 . A A . 16 LEU HD22 1 1 12 8759 1 1 16 LEU HD23 H 3.490 -1.273 -1.996 1.00 . A A . 16 LEU HD23 1 1 12 8760 1 1 16 LEU HG H 3.895 -0.081 0.003 1.00 . A A . 16 LEU HG 1 1 12 8761 1 1 16 LEU N N 3.425 -0.740 2.618 1.00 . A A . 16 LEU N 1 1 12 8762 1 1 16 LEU O O 1.118 -3.211 1.857 1.00 . A A . 16 LEU O 1 1 12 8763 1 1 17 GLU C C 1.001 -4.378 4.405 1.00 . A A . 17 GLU C 1 1 12 8764 1 1 17 GLU CA C 2.334 -4.727 3.732 1.00 . A A . 17 GLU CA 1 1 12 8765 1 1 17 GLU CB C 3.310 -5.257 4.784 1.00 . A A . 17 GLU CB 1 1 12 8766 1 1 17 GLU CD C 3.959 -7.589 4.166 1.00 . A A . 17 GLU CD 1 1 12 8767 1 1 17 GLU CG C 4.375 -6.119 4.105 1.00 . A A . 17 GLU CG 1 1 12 8768 1 1 17 GLU H H 3.823 -3.224 3.319 1.00 . A A . 17 GLU H 1 1 12 8769 1 1 17 GLU HA H 2.167 -5.489 2.986 1.00 . A A . 17 GLU HA 1 1 12 8770 1 1 17 GLU HB2 H 3.784 -4.425 5.285 1.00 . A A . 17 GLU HB2 1 1 12 8771 1 1 17 GLU HB3 H 2.773 -5.853 5.506 1.00 . A A . 17 GLU HB3 1 1 12 8772 1 1 17 GLU HG2 H 4.479 -5.815 3.073 1.00 . A A . 17 GLU HG2 1 1 12 8773 1 1 17 GLU HG3 H 5.318 -5.992 4.614 1.00 . A A . 17 GLU HG3 1 1 12 8774 1 1 17 GLU N N 2.918 -3.521 3.080 1.00 . A A . 17 GLU N 1 1 12 8775 1 1 17 GLU O O 0.241 -5.251 4.778 1.00 . A A . 17 GLU O 1 1 12 8776 1 1 17 GLU OE1 O 2.847 -7.887 3.763 1.00 . A A . 17 GLU OE1 1 1 12 8777 1 1 17 GLU OE2 O 4.759 -8.393 4.614 1.00 . A A . 17 GLU OE2 1 1 12 8778 1 1 18 ASN C C -1.686 -2.631 4.185 1.00 . A A . 18 ASN C 1 1 12 8779 1 1 18 ASN CA C -0.572 -2.732 5.230 1.00 . A A . 18 ASN CA 1 1 12 8780 1 1 18 ASN CB C -0.400 -1.380 5.922 1.00 . A A . 18 ASN CB 1 1 12 8781 1 1 18 ASN CG C -0.563 -1.557 7.432 1.00 . A A . 18 ASN CG 1 1 12 8782 1 1 18 ASN H H 1.334 -2.425 4.272 1.00 . A A . 18 ASN H 1 1 12 8783 1 1 18 ASN HA H -0.836 -3.479 5.963 1.00 . A A . 18 ASN HA 1 1 12 8784 1 1 18 ASN HB2 H 0.584 -0.989 5.708 1.00 . A A . 18 ASN HB2 1 1 12 8785 1 1 18 ASN HB3 H -1.149 -0.692 5.559 1.00 . A A . 18 ASN HB3 1 1 12 8786 1 1 18 ASN HD21 H 0.993 -0.409 7.876 1.00 . A A . 18 ASN HD21 1 1 12 8787 1 1 18 ASN HD22 H 0.176 -1.069 9.209 1.00 . A A . 18 ASN HD22 1 1 12 8788 1 1 18 ASN N N 0.710 -3.117 4.572 1.00 . A A . 18 ASN N 1 1 12 8789 1 1 18 ASN ND2 N 0.271 -0.962 8.240 1.00 . A A . 18 ASN ND2 1 1 12 8790 1 1 18 ASN O O -2.830 -2.380 4.509 1.00 . A A . 18 ASN O 1 1 12 8791 1 1 18 ASN OD1 O -1.458 -2.245 7.882 1.00 . A A . 18 ASN OD1 1 1 12 8792 1 1 19 TYR C C -2.453 -4.056 1.100 1.00 . A A . 19 TYR C 1 1 12 8793 1 1 19 TYR CA C -2.416 -2.743 1.882 1.00 . A A . 19 TYR CA 1 1 12 8794 1 1 19 TYR CB C -2.095 -1.584 0.933 1.00 . A A . 19 TYR CB 1 1 12 8795 1 1 19 TYR CD1 C -3.087 0.255 2.343 1.00 . A A . 19 TYR CD1 1 1 12 8796 1 1 19 TYR CD2 C -0.708 0.303 1.867 1.00 . A A . 19 TYR CD2 1 1 12 8797 1 1 19 TYR CE1 C -2.962 1.435 3.088 1.00 . A A . 19 TYR CE1 1 1 12 8798 1 1 19 TYR CE2 C -0.582 1.482 2.615 1.00 . A A . 19 TYR CE2 1 1 12 8799 1 1 19 TYR CG C -1.960 -0.310 1.732 1.00 . A A . 19 TYR CG 1 1 12 8800 1 1 19 TYR CZ C -1.710 2.049 3.225 1.00 . A A . 19 TYR CZ 1 1 12 8801 1 1 19 TYR H H -0.440 -3.030 2.693 1.00 . A A . 19 TYR H 1 1 12 8802 1 1 19 TYR HA H -3.377 -2.573 2.344 1.00 . A A . 19 TYR HA 1 1 12 8803 1 1 19 TYR HB2 H -1.168 -1.787 0.417 1.00 . A A . 19 TYR HB2 1 1 12 8804 1 1 19 TYR HB3 H -2.893 -1.476 0.214 1.00 . A A . 19 TYR HB3 1 1 12 8805 1 1 19 TYR HD1 H -4.053 -0.217 2.236 1.00 . A A . 19 TYR HD1 1 1 12 8806 1 1 19 TYR HD2 H 0.160 -0.131 1.396 1.00 . A A . 19 TYR HD2 1 1 12 8807 1 1 19 TYR HE1 H -3.831 1.870 3.560 1.00 . A A . 19 TYR HE1 1 1 12 8808 1 1 19 TYR HE2 H 0.383 1.954 2.720 1.00 . A A . 19 TYR HE2 1 1 12 8809 1 1 19 TYR HH H -1.318 3.912 3.365 1.00 . A A . 19 TYR HH 1 1 12 8810 1 1 19 TYR N N -1.367 -2.827 2.937 1.00 . A A . 19 TYR N 1 1 12 8811 1 1 19 TYR O O -2.387 -4.071 -0.113 1.00 . A A . 19 TYR O 1 1 12 8812 1 1 19 TYR OH O -1.587 3.209 3.962 1.00 . A A . 19 TYR OH 1 1 12 8813 1 1 20 CYS C C -2.934 -7.581 2.084 1.00 . A A . 20 CYS C 1 1 12 8814 1 1 20 CYS CA C -2.597 -6.474 1.083 1.00 . A A . 20 CYS CA 1 1 12 8815 1 1 20 CYS CB C -1.230 -6.753 0.455 1.00 . A A . 20 CYS CB 1 1 12 8816 1 1 20 CYS H H -2.608 -5.127 2.765 1.00 . A A . 20 CYS H 1 1 12 8817 1 1 20 CYS HA H -3.350 -6.446 0.310 1.00 . A A . 20 CYS HA 1 1 12 8818 1 1 20 CYS HB2 H -1.048 -6.043 -0.338 1.00 . A A . 20 CYS HB2 1 1 12 8819 1 1 20 CYS HB3 H -0.462 -6.655 1.208 1.00 . A A . 20 CYS HB3 1 1 12 8820 1 1 20 CYS N N -2.557 -5.161 1.786 1.00 . A A . 20 CYS N 1 1 12 8821 1 1 20 CYS O O -2.768 -7.423 3.278 1.00 . A A . 20 CYS O 1 1 12 8822 1 1 20 CYS SG S -1.209 -8.433 -0.217 1.00 . A A . 20 CYS SG 1 1 12 8823 1 1 21 ASN C C -2.465 -10.480 3.036 1.00 . A A . 21 ASN C 1 1 12 8824 1 1 21 ASN CA C -3.750 -9.816 2.535 1.00 . A A . 21 ASN CA 1 1 12 8825 1 1 21 ASN CB C -4.603 -10.850 1.797 1.00 . A A . 21 ASN CB 1 1 12 8826 1 1 21 ASN CG C -5.849 -11.164 2.625 1.00 . A A . 21 ASN CG 1 1 12 8827 1 1 21 ASN H H -3.531 -8.810 0.644 1.00 . A A . 21 ASN H 1 1 12 8828 1 1 21 ASN HA H -4.304 -9.427 3.376 1.00 . A A . 21 ASN HA 1 1 12 8829 1 1 21 ASN HB2 H -4.898 -10.453 0.836 1.00 . A A . 21 ASN HB2 1 1 12 8830 1 1 21 ASN HB3 H -4.032 -11.755 1.653 1.00 . A A . 21 ASN HB3 1 1 12 8831 1 1 21 ASN HD21 H -6.851 -11.933 1.094 1.00 . A A . 21 ASN HD21 1 1 12 8832 1 1 21 ASN HD22 H -7.683 -11.923 2.574 1.00 . A A . 21 ASN HD22 1 1 12 8833 1 1 21 ASN N N -3.405 -8.701 1.609 1.00 . A A . 21 ASN N 1 1 12 8834 1 1 21 ASN ND2 N -6.880 -11.719 2.050 1.00 . A A . 21 ASN ND2 1 1 12 8835 1 1 21 ASN O O -2.563 -11.352 3.883 1.00 . A A . 21 ASN O 1 1 12 8836 1 1 21 ASN OXT O -1.405 -10.105 2.562 1.00 . A A . 21 ASN OXT 1 1 12 8837 1 1 21 ASN OD1 O -5.887 -10.898 3.810 1.00 . A A . 21 ASN OD1 1 1 12 8838 2 2 1 PHE C C 12.061 -1.682 -1.964 1.00 . B B . 1 PHE C 1 1 12 8839 2 2 1 PHE CA C 12.330 -2.080 -3.416 1.00 . B B . 1 PHE CA 1 1 12 8840 2 2 1 PHE CB C 12.839 -3.523 -3.461 1.00 . B B . 1 PHE CB 1 1 12 8841 2 2 1 PHE CD1 C 10.463 -4.245 -3.026 1.00 . B B . 1 PHE CD1 1 1 12 8842 2 2 1 PHE CD2 C 12.268 -5.467 -1.960 1.00 . B B . 1 PHE CD2 1 1 12 8843 2 2 1 PHE CE1 C 9.529 -5.089 -2.413 1.00 . B B . 1 PHE CE1 1 1 12 8844 2 2 1 PHE CE2 C 11.334 -6.312 -1.346 1.00 . B B . 1 PHE CE2 1 1 12 8845 2 2 1 PHE CG C 11.833 -4.433 -2.800 1.00 . B B . 1 PHE CG 1 1 12 8846 2 2 1 PHE CZ C 9.964 -6.123 -1.573 1.00 . B B . 1 PHE CZ 1 1 12 8847 2 2 1 PHE H1 H 14.308 -1.506 -3.726 1.00 . B B . 1 PHE H1 1 1 12 8848 2 2 1 PHE H2 H 13.216 -0.209 -3.638 1.00 . B B . 1 PHE H2 1 1 12 8849 2 2 1 PHE H3 H 13.280 -1.175 -5.034 1.00 . B B . 1 PHE H3 1 1 12 8850 2 2 1 PHE HA H 11.417 -2.000 -3.987 1.00 . B B . 1 PHE HA 1 1 12 8851 2 2 1 PHE HB2 H 12.977 -3.824 -4.490 1.00 . B B . 1 PHE HB2 1 1 12 8852 2 2 1 PHE HB3 H 13.781 -3.588 -2.938 1.00 . B B . 1 PHE HB3 1 1 12 8853 2 2 1 PHE HD1 H 10.128 -3.448 -3.673 1.00 . B B . 1 PHE HD1 1 1 12 8854 2 2 1 PHE HD2 H 13.325 -5.612 -1.784 1.00 . B B . 1 PHE HD2 1 1 12 8855 2 2 1 PHE HE1 H 8.473 -4.943 -2.588 1.00 . B B . 1 PHE HE1 1 1 12 8856 2 2 1 PHE HE2 H 11.670 -7.108 -0.699 1.00 . B B . 1 PHE HE2 1 1 12 8857 2 2 1 PHE HZ H 9.244 -6.774 -1.100 1.00 . B B . 1 PHE HZ 1 1 12 8858 2 2 1 PHE N N 13.362 -1.173 -3.997 1.00 . B B . 1 PHE N 1 1 12 8859 2 2 1 PHE O O 10.933 -1.476 -1.564 1.00 . B B . 1 PHE O 1 1 12 8860 2 2 2 VAL C C 11.948 -0.010 0.363 1.00 . B B . 2 VAL C 1 1 12 8861 2 2 2 VAL CA C 12.905 -1.201 0.252 1.00 . B B . 2 VAL CA 1 1 12 8862 2 2 2 VAL CB C 14.262 -0.835 0.856 1.00 . B B . 2 VAL CB 1 1 12 8863 2 2 2 VAL CG1 C 14.936 -2.099 1.392 1.00 . B B . 2 VAL CG1 1 1 12 8864 2 2 2 VAL CG2 C 15.158 -0.197 -0.210 1.00 . B B . 2 VAL CG2 1 1 12 8865 2 2 2 VAL H H 13.989 -1.750 -1.511 1.00 . B B . 2 VAL H 1 1 12 8866 2 2 2 VAL HA H 12.491 -2.035 0.792 1.00 . B B . 2 VAL HA 1 1 12 8867 2 2 2 VAL HB H 14.114 -0.142 1.661 1.00 . B B . 2 VAL HB 1 1 12 8868 2 2 2 VAL HG11 H 15.483 -1.861 2.292 1.00 . B B . 2 VAL HG11 1 1 12 8869 2 2 2 VAL HG12 H 15.616 -2.486 0.649 1.00 . B B . 2 VAL HG12 1 1 12 8870 2 2 2 VAL HG13 H 14.185 -2.842 1.614 1.00 . B B . 2 VAL HG13 1 1 12 8871 2 2 2 VAL HG21 H 14.551 0.368 -0.902 1.00 . B B . 2 VAL HG21 1 1 12 8872 2 2 2 VAL HG22 H 15.689 -0.971 -0.745 1.00 . B B . 2 VAL HG22 1 1 12 8873 2 2 2 VAL HG23 H 15.869 0.462 0.266 1.00 . B B . 2 VAL HG23 1 1 12 8874 2 2 2 VAL N N 13.090 -1.577 -1.172 1.00 . B B . 2 VAL N 1 1 12 8875 2 2 2 VAL O O 10.750 -0.175 0.466 1.00 . B B . 2 VAL O 1 1 12 8876 2 2 3 ASN C C 11.706 3.256 -0.770 1.00 . B B . 3 ASN C 1 1 12 8877 2 2 3 ASN CA C 11.585 2.381 0.484 1.00 . B B . 3 ASN CA 1 1 12 8878 2 2 3 ASN CB C 12.000 3.189 1.722 1.00 . B B . 3 ASN CB 1 1 12 8879 2 2 3 ASN CG C 12.774 2.295 2.698 1.00 . B B . 3 ASN CG 1 1 12 8880 2 2 3 ASN H H 13.438 1.297 0.287 1.00 . B B . 3 ASN H 1 1 12 8881 2 2 3 ASN HA H 10.561 2.059 0.596 1.00 . B B . 3 ASN HA 1 1 12 8882 2 2 3 ASN HB2 H 12.631 4.006 1.415 1.00 . B B . 3 ASN HB2 1 1 12 8883 2 2 3 ASN HB3 H 11.120 3.576 2.212 1.00 . B B . 3 ASN HB3 1 1 12 8884 2 2 3 ASN HD21 H 14.210 3.630 3.007 1.00 . B B . 3 ASN HD21 1 1 12 8885 2 2 3 ASN HD22 H 14.383 2.169 3.855 1.00 . B B . 3 ASN HD22 1 1 12 8886 2 2 3 ASN N N 12.467 1.185 0.358 1.00 . B B . 3 ASN N 1 1 12 8887 2 2 3 ASN ND2 N 13.880 2.735 3.232 1.00 . B B . 3 ASN ND2 1 1 12 8888 2 2 3 ASN O O 12.362 4.279 -0.765 1.00 . B B . 3 ASN O 1 1 12 8889 2 2 3 ASN OD1 O 12.366 1.185 2.976 1.00 . B B . 3 ASN OD1 1 1 12 8890 2 2 4 GLN C C 9.868 4.484 -3.273 1.00 . B B . 4 GLN C 1 1 12 8891 2 2 4 GLN CA C 11.148 3.658 -3.102 1.00 . B B . 4 GLN CA 1 1 12 8892 2 2 4 GLN CB C 11.300 2.712 -4.296 1.00 . B B . 4 GLN CB 1 1 12 8893 2 2 4 GLN CD C 12.809 2.039 -6.169 1.00 . B B . 4 GLN CD 1 1 12 8894 2 2 4 GLN CG C 12.504 3.133 -5.143 1.00 . B B . 4 GLN CG 1 1 12 8895 2 2 4 GLN H H 10.552 2.030 -1.823 1.00 . B B . 4 GLN H 1 1 12 8896 2 2 4 GLN HA H 12.000 4.320 -3.058 1.00 . B B . 4 GLN HA 1 1 12 8897 2 2 4 GLN HB2 H 11.447 1.704 -3.937 1.00 . B B . 4 GLN HB2 1 1 12 8898 2 2 4 GLN HB3 H 10.406 2.751 -4.900 1.00 . B B . 4 GLN HB3 1 1 12 8899 2 2 4 GLN HE21 H 14.769 2.359 -6.144 1.00 . B B . 4 GLN HE21 1 1 12 8900 2 2 4 GLN HE22 H 14.248 1.123 -7.185 1.00 . B B . 4 GLN HE22 1 1 12 8901 2 2 4 GLN HG2 H 12.277 4.057 -5.657 1.00 . B B . 4 GLN HG2 1 1 12 8902 2 2 4 GLN HG3 H 13.362 3.275 -4.505 1.00 . B B . 4 GLN HG3 1 1 12 8903 2 2 4 GLN N N 11.075 2.857 -1.843 1.00 . B B . 4 GLN N 1 1 12 8904 2 2 4 GLN NE2 N 14.045 1.823 -6.529 1.00 . B B . 4 GLN NE2 1 1 12 8905 2 2 4 GLN O O 9.141 4.737 -2.329 1.00 . B B . 4 GLN O 1 1 12 8906 2 2 4 GLN OE1 O 11.913 1.373 -6.648 1.00 . B B . 4 GLN OE1 1 1 12 8907 2 2 5 HIS C C 7.271 4.806 -5.320 1.00 . B B . 5 HIS C 1 1 12 8908 2 2 5 HIS CA C 8.361 5.709 -4.735 1.00 . B B . 5 HIS CA 1 1 12 8909 2 2 5 HIS CB C 8.685 6.821 -5.737 1.00 . B B . 5 HIS CB 1 1 12 8910 2 2 5 HIS CD2 C 10.507 8.317 -4.603 1.00 . B B . 5 HIS CD2 1 1 12 8911 2 2 5 HIS CE1 C 9.213 9.966 -4.030 1.00 . B B . 5 HIS CE1 1 1 12 8912 2 2 5 HIS CG C 9.235 8.016 -5.008 1.00 . B B . 5 HIS CG 1 1 12 8913 2 2 5 HIS H H 10.189 4.680 -5.223 1.00 . B B . 5 HIS H 1 1 12 8914 2 2 5 HIS HA H 8.014 6.144 -3.810 1.00 . B B . 5 HIS HA 1 1 12 8915 2 2 5 HIS HB2 H 9.418 6.463 -6.444 1.00 . B B . 5 HIS HB2 1 1 12 8916 2 2 5 HIS HB3 H 7.786 7.103 -6.263 1.00 . B B . 5 HIS HB3 1 1 12 8917 2 2 5 HIS HD2 H 11.376 7.692 -4.744 1.00 . B B . 5 HIS HD2 1 1 12 8918 2 2 5 HIS HE1 H 8.865 10.905 -3.627 1.00 . B B . 5 HIS HE1 1 1 12 8919 2 2 5 HIS HE2 H 11.259 10.023 -3.594 1.00 . B B . 5 HIS HE2 1 1 12 8920 2 2 5 HIS N N 9.588 4.901 -4.480 1.00 . B B . 5 HIS N 1 1 12 8921 2 2 5 HIS ND1 N 8.424 9.069 -4.639 1.00 . B B . 5 HIS ND1 1 1 12 8922 2 2 5 HIS NE2 N 10.495 9.549 -3.984 1.00 . B B . 5 HIS NE2 1 1 12 8923 2 2 5 HIS O O 7.481 4.119 -6.301 1.00 . B B . 5 HIS O 1 1 12 8924 2 2 6 LEU C C 4.030 4.793 -6.068 1.00 . B B . 6 LEU C 1 1 12 8925 2 2 6 LEU CA C 5.010 3.939 -5.254 1.00 . B B . 6 LEU CA 1 1 12 8926 2 2 6 LEU CB C 4.275 3.286 -4.082 1.00 . B B . 6 LEU CB 1 1 12 8927 2 2 6 LEU CD1 C 4.553 2.276 -1.813 1.00 . B B . 6 LEU CD1 1 1 12 8928 2 2 6 LEU CD2 C 6.404 2.128 -3.479 1.00 . B B . 6 LEU CD2 1 1 12 8929 2 2 6 LEU CG C 5.268 3.005 -2.952 1.00 . B B . 6 LEU CG 1 1 12 8930 2 2 6 LEU H H 5.956 5.360 -3.940 1.00 . B B . 6 LEU H 1 1 12 8931 2 2 6 LEU HA H 5.428 3.172 -5.888 1.00 . B B . 6 LEU HA 1 1 12 8932 2 2 6 LEU HB2 H 3.502 3.951 -3.726 1.00 . B B . 6 LEU HB2 1 1 12 8933 2 2 6 LEU HB3 H 3.832 2.358 -4.407 1.00 . B B . 6 LEU HB3 1 1 12 8934 2 2 6 LEU HD11 H 5.125 2.382 -0.904 1.00 . B B . 6 LEU HD11 1 1 12 8935 2 2 6 LEU HD12 H 4.459 1.230 -2.059 1.00 . B B . 6 LEU HD12 1 1 12 8936 2 2 6 LEU HD13 H 3.571 2.704 -1.672 1.00 . B B . 6 LEU HD13 1 1 12 8937 2 2 6 LEU HD21 H 6.087 1.096 -3.489 1.00 . B B . 6 LEU HD21 1 1 12 8938 2 2 6 LEU HD22 H 7.268 2.233 -2.838 1.00 . B B . 6 LEU HD22 1 1 12 8939 2 2 6 LEU HD23 H 6.661 2.435 -4.482 1.00 . B B . 6 LEU HD23 1 1 12 8940 2 2 6 LEU HG H 5.670 3.938 -2.585 1.00 . B B . 6 LEU HG 1 1 12 8941 2 2 6 LEU N N 6.107 4.800 -4.729 1.00 . B B . 6 LEU N 1 1 12 8942 2 2 6 LEU O O 3.095 5.357 -5.536 1.00 . B B . 6 LEU O 1 1 12 8943 2 2 7 CYS C C 2.659 4.861 -9.275 1.00 . B B . 7 CYS C 1 1 12 8944 2 2 7 CYS CA C 3.326 5.725 -8.195 1.00 . B B . 7 CYS CA 1 1 12 8945 2 2 7 CYS CB C 4.125 6.836 -8.880 1.00 . B B . 7 CYS CB 1 1 12 8946 2 2 7 CYS H H 5.005 4.444 -7.760 1.00 . B B . 7 CYS H 1 1 12 8947 2 2 7 CYS HA H 2.566 6.166 -7.568 1.00 . B B . 7 CYS HA 1 1 12 8948 2 2 7 CYS HB2 H 5.079 6.447 -9.202 1.00 . B B . 7 CYS HB2 1 1 12 8949 2 2 7 CYS HB3 H 3.576 7.195 -9.739 1.00 . B B . 7 CYS HB3 1 1 12 8950 2 2 7 CYS N N 4.241 4.899 -7.353 1.00 . B B . 7 CYS N 1 1 12 8951 2 2 7 CYS O O 3.319 4.212 -10.062 1.00 . B B . 7 CYS O 1 1 12 8952 2 2 7 CYS SG S 4.389 8.201 -7.720 1.00 . B B . 7 CYS SG 1 1 12 8953 2 2 8 GLY C C 1.303 2.764 -10.664 1.00 . B B . 8 GLY C 1 1 12 8954 2 2 8 GLY CA C 0.609 4.096 -10.363 1.00 . B B . 8 GLY CA 1 1 12 8955 2 2 8 GLY H H 0.855 5.431 -8.690 1.00 . B B . 8 GLY H 1 1 12 8956 2 2 8 GLY HA2 H -0.392 3.901 -10.006 1.00 . B B . 8 GLY HA2 1 1 12 8957 2 2 8 GLY HA3 H 0.553 4.676 -11.271 1.00 . B B . 8 GLY HA3 1 1 12 8958 2 2 8 GLY N N 1.354 4.879 -9.328 1.00 . B B . 8 GLY N 1 1 12 8959 2 2 8 GLY O O 1.495 1.942 -9.792 1.00 . B B . 8 GLY O 1 1 12 8960 2 2 9 SER C C 3.273 0.812 -11.190 1.00 . B B . 9 SER C 1 1 12 8961 2 2 9 SER CA C 2.331 1.270 -12.301 1.00 . B B . 9 SER CA 1 1 12 8962 2 2 9 SER CB C 3.133 1.490 -13.584 1.00 . B B . 9 SER CB 1 1 12 8963 2 2 9 SER H H 1.482 3.231 -12.586 1.00 . B B . 9 SER H 1 1 12 8964 2 2 9 SER HA H 1.582 0.511 -12.472 1.00 . B B . 9 SER HA 1 1 12 8965 2 2 9 SER HB2 H 4.065 0.955 -13.524 1.00 . B B . 9 SER HB2 1 1 12 8966 2 2 9 SER HB3 H 2.564 1.127 -14.430 1.00 . B B . 9 SER HB3 1 1 12 8967 2 2 9 SER HG H 2.811 3.219 -14.415 1.00 . B B . 9 SER HG 1 1 12 8968 2 2 9 SER N N 1.662 2.549 -11.906 1.00 . B B . 9 SER N 1 1 12 8969 2 2 9 SER O O 3.121 -0.257 -10.634 1.00 . B B . 9 SER O 1 1 12 8970 2 2 9 SER OG O 3.399 2.878 -13.737 1.00 . B B . 9 SER OG 1 1 12 8971 2 2 10 ASP C C 4.360 0.809 -8.556 1.00 . B B . 10 ASP C 1 1 12 8972 2 2 10 ASP CA C 5.176 1.237 -9.767 1.00 . B B . 10 ASP CA 1 1 12 8973 2 2 10 ASP CB C 6.017 2.449 -9.388 1.00 . B B . 10 ASP CB 1 1 12 8974 2 2 10 ASP CG C 6.800 2.934 -10.610 1.00 . B B . 10 ASP CG 1 1 12 8975 2 2 10 ASP H H 4.335 2.481 -11.303 1.00 . B B . 10 ASP H 1 1 12 8976 2 2 10 ASP HA H 5.811 0.426 -10.091 1.00 . B B . 10 ASP HA 1 1 12 8977 2 2 10 ASP HB2 H 5.358 3.235 -9.039 1.00 . B B . 10 ASP HB2 1 1 12 8978 2 2 10 ASP HB3 H 6.706 2.180 -8.601 1.00 . B B . 10 ASP HB3 1 1 12 8979 2 2 10 ASP N N 4.237 1.619 -10.852 1.00 . B B . 10 ASP N 1 1 12 8980 2 2 10 ASP O O 4.601 -0.216 -7.953 1.00 . B B . 10 ASP O 1 1 12 8981 2 2 10 ASP OD1 O 6.168 3.353 -11.567 1.00 . B B . 10 ASP OD1 1 1 12 8982 2 2 10 ASP OD2 O 8.017 2.877 -10.570 1.00 . B B . 10 ASP OD2 1 1 12 8983 2 2 11 LEU C C 2.185 -0.219 -7.094 1.00 . B B . 11 LEU C 1 1 12 8984 2 2 11 LEU CA C 2.536 1.265 -7.038 1.00 . B B . 11 LEU CA 1 1 12 8985 2 2 11 LEU CB C 1.264 2.107 -7.123 1.00 . B B . 11 LEU CB 1 1 12 8986 2 2 11 LEU CD1 C 1.411 2.016 -4.596 1.00 . B B . 11 LEU CD1 1 1 12 8987 2 2 11 LEU CD2 C -0.344 3.368 -5.723 1.00 . B B . 11 LEU CD2 1 1 12 8988 2 2 11 LEU CG C 0.474 2.084 -5.806 1.00 . B B . 11 LEU CG 1 1 12 8989 2 2 11 LEU H H 3.221 2.418 -8.714 1.00 . B B . 11 LEU H 1 1 12 8990 2 2 11 LEU HA H 3.069 1.484 -6.132 1.00 . B B . 11 LEU HA 1 1 12 8991 2 2 11 LEU HB2 H 1.533 3.125 -7.356 1.00 . B B . 11 LEU HB2 1 1 12 8992 2 2 11 LEU HB3 H 0.640 1.716 -7.912 1.00 . B B . 11 LEU HB3 1 1 12 8993 2 2 11 LEU HD11 H 2.052 2.882 -4.591 1.00 . B B . 11 LEU HD11 1 1 12 8994 2 2 11 LEU HD12 H 2.009 1.121 -4.651 1.00 . B B . 11 LEU HD12 1 1 12 8995 2 2 11 LEU HD13 H 0.822 2.000 -3.689 1.00 . B B . 11 LEU HD13 1 1 12 8996 2 2 11 LEU HD21 H -1.133 3.338 -6.459 1.00 . B B . 11 LEU HD21 1 1 12 8997 2 2 11 LEU HD22 H 0.299 4.214 -5.918 1.00 . B B . 11 LEU HD22 1 1 12 8998 2 2 11 LEU HD23 H -0.771 3.459 -4.737 1.00 . B B . 11 LEU HD23 1 1 12 8999 2 2 11 LEU HG H -0.190 1.234 -5.797 1.00 . B B . 11 LEU HG 1 1 12 9000 2 2 11 LEU N N 3.390 1.599 -8.204 1.00 . B B . 11 LEU N 1 1 12 9001 2 2 11 LEU O O 2.452 -0.966 -6.173 1.00 . B B . 11 LEU O 1 1 12 9002 2 2 12 ALA C C 2.554 -2.896 -8.400 1.00 . B B . 12 ALA C 1 1 12 9003 2 2 12 ALA CA C 1.259 -2.097 -8.291 1.00 . B B . 12 ALA CA 1 1 12 9004 2 2 12 ALA CB C 0.409 -2.337 -9.539 1.00 . B B . 12 ALA CB 1 1 12 9005 2 2 12 ALA H H 1.408 -0.044 -8.914 1.00 . B B . 12 ALA H 1 1 12 9006 2 2 12 ALA HA H 0.714 -2.411 -7.412 1.00 . B B . 12 ALA HA 1 1 12 9007 2 2 12 ALA HB1 H 0.226 -3.396 -9.651 1.00 . B B . 12 ALA HB1 1 1 12 9008 2 2 12 ALA HB2 H 0.933 -1.969 -10.408 1.00 . B B . 12 ALA HB2 1 1 12 9009 2 2 12 ALA HB3 H -0.532 -1.819 -9.438 1.00 . B B . 12 ALA HB3 1 1 12 9010 2 2 12 ALA N N 1.603 -0.659 -8.176 1.00 . B B . 12 ALA N 1 1 12 9011 2 2 12 ALA O O 2.796 -3.800 -7.632 1.00 . B B . 12 ALA O 1 1 12 9012 2 2 13 GLU C C 5.329 -3.431 -8.107 1.00 . B B . 13 GLU C 1 1 12 9013 2 2 13 GLU CA C 4.681 -3.299 -9.482 1.00 . B B . 13 GLU CA 1 1 12 9014 2 2 13 GLU CB C 5.615 -2.536 -10.422 1.00 . B B . 13 GLU CB 1 1 12 9015 2 2 13 GLU CD C 6.039 -3.537 -12.672 1.00 . B B . 13 GLU CD 1 1 12 9016 2 2 13 GLU CG C 5.096 -2.650 -11.857 1.00 . B B . 13 GLU CG 1 1 12 9017 2 2 13 GLU H H 3.191 -1.813 -9.944 1.00 . B B . 13 GLU H 1 1 12 9018 2 2 13 GLU HA H 4.487 -4.283 -9.884 1.00 . B B . 13 GLU HA 1 1 12 9019 2 2 13 GLU HB2 H 5.648 -1.495 -10.132 1.00 . B B . 13 GLU HB2 1 1 12 9020 2 2 13 GLU HB3 H 6.607 -2.958 -10.366 1.00 . B B . 13 GLU HB3 1 1 12 9021 2 2 13 GLU HG2 H 4.108 -3.088 -11.847 1.00 . B B . 13 GLU HG2 1 1 12 9022 2 2 13 GLU HG3 H 5.051 -1.669 -12.303 1.00 . B B . 13 GLU HG3 1 1 12 9023 2 2 13 GLU N N 3.398 -2.558 -9.340 1.00 . B B . 13 GLU N 1 1 12 9024 2 2 13 GLU O O 5.991 -4.407 -7.812 1.00 . B B . 13 GLU O 1 1 12 9025 2 2 13 GLU OE1 O 7.021 -3.017 -13.176 1.00 . B B . 13 GLU OE1 1 1 12 9026 2 2 13 GLU OE2 O 5.763 -4.720 -12.779 1.00 . B B . 13 GLU OE2 1 1 12 9027 2 2 14 ALA C C 4.927 -3.569 -5.085 1.00 . B B . 14 ALA C 1 1 12 9028 2 2 14 ALA CA C 5.724 -2.549 -5.891 1.00 . B B . 14 ALA CA 1 1 12 9029 2 2 14 ALA CB C 5.651 -1.180 -5.212 1.00 . B B . 14 ALA CB 1 1 12 9030 2 2 14 ALA H H 4.581 -1.687 -7.505 1.00 . B B . 14 ALA H 1 1 12 9031 2 2 14 ALA HA H 6.757 -2.870 -5.960 1.00 . B B . 14 ALA HA 1 1 12 9032 2 2 14 ALA HB1 H 6.645 -0.763 -5.135 1.00 . B B . 14 ALA HB1 1 1 12 9033 2 2 14 ALA HB2 H 5.230 -1.290 -4.224 1.00 . B B . 14 ALA HB2 1 1 12 9034 2 2 14 ALA HB3 H 5.028 -0.520 -5.797 1.00 . B B . 14 ALA HB3 1 1 12 9035 2 2 14 ALA N N 5.131 -2.464 -7.253 1.00 . B B . 14 ALA N 1 1 12 9036 2 2 14 ALA O O 5.471 -4.525 -4.569 1.00 . B B . 14 ALA O 1 1 12 9037 2 2 15 LEU C C 2.942 -5.731 -4.952 1.00 . B B . 15 LEU C 1 1 12 9038 2 2 15 LEU CA C 2.819 -4.381 -4.237 1.00 . B B . 15 LEU CA 1 1 12 9039 2 2 15 LEU CB C 1.350 -3.946 -4.234 1.00 . B B . 15 LEU CB 1 1 12 9040 2 2 15 LEU CD1 C -0.260 -2.204 -3.453 1.00 . B B . 15 LEU CD1 1 1 12 9041 2 2 15 LEU CD2 C 1.364 -3.201 -1.850 1.00 . B B . 15 LEU CD2 1 1 12 9042 2 2 15 LEU CG C 1.159 -2.753 -3.295 1.00 . B B . 15 LEU CG 1 1 12 9043 2 2 15 LEU H H 3.205 -2.627 -5.433 1.00 . B B . 15 LEU H 1 1 12 9044 2 2 15 LEU HA H 3.188 -4.457 -3.219 1.00 . B B . 15 LEU HA 1 1 12 9045 2 2 15 LEU HB2 H 1.058 -3.664 -5.235 1.00 . B B . 15 LEU HB2 1 1 12 9046 2 2 15 LEU HB3 H 0.734 -4.766 -3.898 1.00 . B B . 15 LEU HB3 1 1 12 9047 2 2 15 LEU HD11 H -0.438 -1.447 -2.704 1.00 . B B . 15 LEU HD11 1 1 12 9048 2 2 15 LEU HD12 H -0.971 -3.007 -3.330 1.00 . B B . 15 LEU HD12 1 1 12 9049 2 2 15 LEU HD13 H -0.371 -1.772 -4.436 1.00 . B B . 15 LEU HD13 1 1 12 9050 2 2 15 LEU HD21 H 2.313 -2.836 -1.489 1.00 . B B . 15 LEU HD21 1 1 12 9051 2 2 15 LEU HD22 H 1.352 -4.281 -1.804 1.00 . B B . 15 LEU HD22 1 1 12 9052 2 2 15 LEU HD23 H 0.569 -2.806 -1.235 1.00 . B B . 15 LEU HD23 1 1 12 9053 2 2 15 LEU HG H 1.874 -1.981 -3.541 1.00 . B B . 15 LEU HG 1 1 12 9054 2 2 15 LEU N N 3.636 -3.393 -4.991 1.00 . B B . 15 LEU N 1 1 12 9055 2 2 15 LEU O O 2.764 -6.784 -4.373 1.00 . B B . 15 LEU O 1 1 12 9056 2 2 16 TYR C C 4.619 -7.707 -6.535 1.00 . B B . 16 TYR C 1 1 12 9057 2 2 16 TYR CA C 3.403 -6.931 -7.027 1.00 . B B . 16 TYR CA 1 1 12 9058 2 2 16 TYR CB C 3.646 -6.541 -8.487 1.00 . B B . 16 TYR CB 1 1 12 9059 2 2 16 TYR CD1 C 1.416 -7.565 -9.023 1.00 . B B . 16 TYR CD1 1 1 12 9060 2 2 16 TYR CD2 C 3.224 -7.801 -10.621 1.00 . B B . 16 TYR CD2 1 1 12 9061 2 2 16 TYR CE1 C 0.566 -8.284 -9.875 1.00 . B B . 16 TYR CE1 1 1 12 9062 2 2 16 TYR CE2 C 2.378 -8.521 -11.474 1.00 . B B . 16 TYR CE2 1 1 12 9063 2 2 16 TYR CG C 2.740 -7.326 -9.396 1.00 . B B . 16 TYR CG 1 1 12 9064 2 2 16 TYR CZ C 1.048 -8.762 -11.102 1.00 . B B . 16 TYR CZ 1 1 12 9065 2 2 16 TYR H H 3.387 -4.816 -6.651 1.00 . B B . 16 TYR H 1 1 12 9066 2 2 16 TYR HA H 2.514 -7.539 -6.949 1.00 . B B . 16 TYR HA 1 1 12 9067 2 2 16 TYR HB2 H 3.450 -5.489 -8.615 1.00 . B B . 16 TYR HB2 1 1 12 9068 2 2 16 TYR HB3 H 4.673 -6.745 -8.745 1.00 . B B . 16 TYR HB3 1 1 12 9069 2 2 16 TYR HD1 H 1.052 -7.198 -8.078 1.00 . B B . 16 TYR HD1 1 1 12 9070 2 2 16 TYR HD2 H 4.252 -7.615 -10.905 1.00 . B B . 16 TYR HD2 1 1 12 9071 2 2 16 TYR HE1 H -0.458 -8.467 -9.587 1.00 . B B . 16 TYR HE1 1 1 12 9072 2 2 16 TYR HE2 H 2.749 -8.888 -12.419 1.00 . B B . 16 TYR HE2 1 1 12 9073 2 2 16 TYR HH H 0.221 -10.389 -11.664 1.00 . B B . 16 TYR HH 1 1 12 9074 2 2 16 TYR N N 3.250 -5.686 -6.221 1.00 . B B . 16 TYR N 1 1 12 9075 2 2 16 TYR O O 4.634 -8.922 -6.508 1.00 . B B . 16 TYR O 1 1 12 9076 2 2 16 TYR OH O 0.213 -9.470 -11.942 1.00 . B B . 16 TYR OH 1 1 12 9077 2 2 17 LEU C C 6.838 -7.914 -4.211 1.00 . B B . 17 LEU C 1 1 12 9078 2 2 17 LEU CA C 6.892 -7.653 -5.721 1.00 . B B . 17 LEU CA 1 1 12 9079 2 2 17 LEU CB C 8.036 -6.712 -6.061 1.00 . B B . 17 LEU CB 1 1 12 9080 2 2 17 LEU CD1 C 9.397 -8.816 -5.814 1.00 . B B . 17 LEU CD1 1 1 12 9081 2 2 17 LEU CD2 C 10.470 -6.658 -6.421 1.00 . B B . 17 LEU CD2 1 1 12 9082 2 2 17 LEU CG C 9.361 -7.295 -5.601 1.00 . B B . 17 LEU CG 1 1 12 9083 2 2 17 LEU H H 5.616 -6.026 -6.233 1.00 . B B . 17 LEU H 1 1 12 9084 2 2 17 LEU HA H 7.034 -8.583 -6.248 1.00 . B B . 17 LEU HA 1 1 12 9085 2 2 17 LEU HB2 H 8.067 -6.562 -7.130 1.00 . B B . 17 LEU HB2 1 1 12 9086 2 2 17 LEU HB3 H 7.876 -5.764 -5.572 1.00 . B B . 17 LEU HB3 1 1 12 9087 2 2 17 LEU HD11 H 9.416 -9.028 -6.871 1.00 . B B . 17 LEU HD11 1 1 12 9088 2 2 17 LEU HD12 H 8.523 -9.268 -5.374 1.00 . B B . 17 LEU HD12 1 1 12 9089 2 2 17 LEU HD13 H 10.282 -9.223 -5.350 1.00 . B B . 17 LEU HD13 1 1 12 9090 2 2 17 LEU HD21 H 10.202 -5.636 -6.646 1.00 . B B . 17 LEU HD21 1 1 12 9091 2 2 17 LEU HD22 H 10.590 -7.209 -7.343 1.00 . B B . 17 LEU HD22 1 1 12 9092 2 2 17 LEU HD23 H 11.389 -6.679 -5.862 1.00 . B B . 17 LEU HD23 1 1 12 9093 2 2 17 LEU HG H 9.498 -7.062 -4.559 1.00 . B B . 17 LEU HG 1 1 12 9094 2 2 17 LEU N N 5.649 -7.002 -6.178 1.00 . B B . 17 LEU N 1 1 12 9095 2 2 17 LEU O O 7.733 -8.503 -3.639 1.00 . B B . 17 LEU O 1 1 12 9096 2 2 18 VAL C C 4.674 -8.812 -1.812 1.00 . B B . 18 VAL C 1 1 12 9097 2 2 18 VAL CA C 5.704 -7.718 -2.086 1.00 . B B . 18 VAL CA 1 1 12 9098 2 2 18 VAL CB C 5.289 -6.421 -1.385 1.00 . B B . 18 VAL CB 1 1 12 9099 2 2 18 VAL CG1 C 5.979 -5.246 -2.065 1.00 . B B . 18 VAL CG1 1 1 12 9100 2 2 18 VAL CG2 C 3.771 -6.230 -1.470 1.00 . B B . 18 VAL CG2 1 1 12 9101 2 2 18 VAL H H 5.080 -7.009 -4.021 1.00 . B B . 18 VAL H 1 1 12 9102 2 2 18 VAL HA H 6.667 -8.033 -1.714 1.00 . B B . 18 VAL HA 1 1 12 9103 2 2 18 VAL HB H 5.591 -6.461 -0.351 1.00 . B B . 18 VAL HB 1 1 12 9104 2 2 18 VAL HG11 H 5.234 -4.595 -2.494 1.00 . B B . 18 VAL HG11 1 1 12 9105 2 2 18 VAL HG12 H 6.629 -5.613 -2.846 1.00 . B B . 18 VAL HG12 1 1 12 9106 2 2 18 VAL HG13 H 6.560 -4.704 -1.338 1.00 . B B . 18 VAL HG13 1 1 12 9107 2 2 18 VAL HG21 H 3.471 -6.190 -2.506 1.00 . B B . 18 VAL HG21 1 1 12 9108 2 2 18 VAL HG22 H 3.497 -5.307 -0.981 1.00 . B B . 18 VAL HG22 1 1 12 9109 2 2 18 VAL HG23 H 3.277 -7.056 -0.984 1.00 . B B . 18 VAL HG23 1 1 12 9110 2 2 18 VAL N N 5.797 -7.483 -3.553 1.00 . B B . 18 VAL N 1 1 12 9111 2 2 18 VAL O O 4.907 -9.723 -1.042 1.00 . B B . 18 VAL O 1 1 12 9112 2 2 19 CYS C C 2.416 -10.691 -3.406 1.00 . B B . 19 CYS C 1 1 12 9113 2 2 19 CYS CA C 2.483 -9.745 -2.206 1.00 . B B . 19 CYS CA 1 1 12 9114 2 2 19 CYS CB C 1.130 -9.054 -2.027 1.00 . B B . 19 CYS CB 1 1 12 9115 2 2 19 CYS H H 3.365 -7.974 -3.044 1.00 . B B . 19 CYS H 1 1 12 9116 2 2 19 CYS HA H 2.722 -10.304 -1.315 1.00 . B B . 19 CYS HA 1 1 12 9117 2 2 19 CYS HB2 H 1.171 -8.065 -2.459 1.00 . B B . 19 CYS HB2 1 1 12 9118 2 2 19 CYS HB3 H 0.362 -9.631 -2.521 1.00 . B B . 19 CYS HB3 1 1 12 9119 2 2 19 CYS N N 3.532 -8.721 -2.433 1.00 . B B . 19 CYS N 1 1 12 9120 2 2 19 CYS O O 2.417 -11.897 -3.259 1.00 . B B . 19 CYS O 1 1 12 9121 2 2 19 CYS SG S 0.749 -8.925 -0.262 1.00 . B B . 19 CYS SG 1 1 12 9122 2 2 20 GLY C C 1.004 -11.866 -5.736 1.00 . B B . 20 GLY C 1 1 12 9123 2 2 20 GLY CA C 2.279 -11.025 -5.800 1.00 . B B . 20 GLY CA 1 1 12 9124 2 2 20 GLY H H 2.348 -9.179 -4.692 1.00 . B B . 20 GLY H 1 1 12 9125 2 2 20 GLY HA2 H 2.264 -10.410 -6.689 1.00 . B B . 20 GLY HA2 1 1 12 9126 2 2 20 GLY HA3 H 3.137 -11.679 -5.827 1.00 . B B . 20 GLY HA3 1 1 12 9127 2 2 20 GLY N N 2.353 -10.154 -4.593 1.00 . B B . 20 GLY N 1 1 12 9128 2 2 20 GLY O O -0.082 -11.384 -5.988 1.00 . B B . 20 GLY O 1 1 12 9129 2 2 21 GLU C C -0.835 -13.687 -4.021 1.00 . B B . 21 GLU C 1 1 12 9130 2 2 21 GLU CA C -0.081 -13.989 -5.316 1.00 . B B . 21 GLU CA 1 1 12 9131 2 2 21 GLU CB C 0.345 -15.458 -5.327 1.00 . B B . 21 GLU CB 1 1 12 9132 2 2 21 GLU CD C 1.659 -17.141 -4.031 1.00 . B B . 21 GLU CD 1 1 12 9133 2 2 21 GLU CG C 1.522 -15.656 -4.370 1.00 . B B . 21 GLU CG 1 1 12 9134 2 2 21 GLU H H 2.012 -13.490 -5.197 1.00 . B B . 21 GLU H 1 1 12 9135 2 2 21 GLU HA H -0.724 -13.794 -6.162 1.00 . B B . 21 GLU HA 1 1 12 9136 2 2 21 GLU HB2 H -0.483 -16.075 -5.013 1.00 . B B . 21 GLU HB2 1 1 12 9137 2 2 21 GLU HB3 H 0.647 -15.738 -6.326 1.00 . B B . 21 GLU HB3 1 1 12 9138 2 2 21 GLU HG2 H 2.430 -15.306 -4.838 1.00 . B B . 21 GLU HG2 1 1 12 9139 2 2 21 GLU HG3 H 1.346 -15.097 -3.463 1.00 . B B . 21 GLU HG3 1 1 12 9140 2 2 21 GLU N N 1.126 -13.120 -5.399 1.00 . B B . 21 GLU N 1 1 12 9141 2 2 21 GLU O O -2.001 -14.002 -3.882 1.00 . B B . 21 GLU O 1 1 12 9142 2 2 21 GLU OE1 O 2.030 -17.897 -4.914 1.00 . B B . 21 GLU OE1 1 1 12 9143 2 2 21 GLU OE2 O 1.392 -17.496 -2.894 1.00 . B B . 21 GLU OE2 1 1 12 9144 2 2 22 ARG C C -2.129 -11.944 -2.077 1.00 . B B . 22 ARG C 1 1 12 9145 2 2 22 ARG CA C -0.865 -12.753 -1.786 1.00 . B B . 22 ARG CA 1 1 12 9146 2 2 22 ARG CB C 0.073 -11.933 -0.899 1.00 . B B . 22 ARG CB 1 1 12 9147 2 2 22 ARG CD C -0.040 -13.629 0.935 1.00 . B B . 22 ARG CD 1 1 12 9148 2 2 22 ARG CG C 0.893 -12.874 -0.013 1.00 . B B . 22 ARG CG 1 1 12 9149 2 2 22 ARG CZ C 0.328 -14.343 3.221 1.00 . B B . 22 ARG CZ 1 1 12 9150 2 2 22 ARG H H 0.757 -12.829 -3.202 1.00 . B B . 22 ARG H 1 1 12 9151 2 2 22 ARG HA H -1.133 -13.667 -1.281 1.00 . B B . 22 ARG HA 1 1 12 9152 2 2 22 ARG HB2 H 0.739 -11.351 -1.520 1.00 . B B . 22 ARG HB2 1 1 12 9153 2 2 22 ARG HB3 H -0.508 -11.271 -0.275 1.00 . B B . 22 ARG HB3 1 1 12 9154 2 2 22 ARG HD2 H -0.727 -12.934 1.393 1.00 . B B . 22 ARG HD2 1 1 12 9155 2 2 22 ARG HD3 H -0.594 -14.371 0.379 1.00 . B B . 22 ARG HD3 1 1 12 9156 2 2 22 ARG HE H 1.629 -14.708 1.766 1.00 . B B . 22 ARG HE 1 1 12 9157 2 2 22 ARG HG2 H 1.425 -13.581 -0.634 1.00 . B B . 22 ARG HG2 1 1 12 9158 2 2 22 ARG HG3 H 1.601 -12.299 0.564 1.00 . B B . 22 ARG HG3 1 1 12 9159 2 2 22 ARG HH11 H 0.995 -12.514 3.686 1.00 . B B . 22 ARG HH11 1 1 12 9160 2 2 22 ARG HH12 H 0.179 -13.360 4.958 1.00 . B B . 22 ARG HH12 1 1 12 9161 2 2 22 ARG HH21 H -0.436 -16.185 3.044 1.00 . B B . 22 ARG HH21 1 1 12 9162 2 2 22 ARG HH22 H -0.630 -15.438 4.595 1.00 . B B . 22 ARG HH22 1 1 12 9163 2 2 22 ARG N N -0.182 -13.076 -3.070 1.00 . B B . 22 ARG N 1 1 12 9164 2 2 22 ARG NE N 0.768 -14.299 1.993 1.00 . B B . 22 ARG NE 1 1 12 9165 2 2 22 ARG NH1 N 0.515 -13.326 4.016 1.00 . B B . 22 ARG NH1 1 1 12 9166 2 2 22 ARG NH2 N -0.294 -15.405 3.654 1.00 . B B . 22 ARG NH2 1 1 12 9167 2 2 22 ARG O O -3.032 -11.868 -1.269 1.00 . B B . 22 ARG O 1 1 12 9168 2 2 23 GLY C C -3.449 -9.268 -2.741 1.00 . B B . 23 GLY C 1 1 12 9169 2 2 23 GLY CA C -3.402 -10.540 -3.588 1.00 . B B . 23 GLY CA 1 1 12 9170 2 2 23 GLY H H -1.457 -11.424 -3.868 1.00 . B B . 23 GLY H 1 1 12 9171 2 2 23 GLY HA2 H -3.359 -10.275 -4.635 1.00 . B B . 23 GLY HA2 1 1 12 9172 2 2 23 GLY HA3 H -4.292 -11.124 -3.403 1.00 . B B . 23 GLY HA3 1 1 12 9173 2 2 23 GLY N N -2.198 -11.343 -3.232 1.00 . B B . 23 GLY N 1 1 12 9174 2 2 23 GLY O O -3.896 -9.279 -1.611 1.00 . B B . 23 GLY O 1 1 12 9175 2 2 24 PHE C C -4.128 -5.992 -3.077 1.00 . B B . 24 PHE C 1 1 12 9176 2 2 24 PHE CA C -3.033 -6.892 -2.508 1.00 . B B . 24 PHE CA 1 1 12 9177 2 2 24 PHE CB C -1.677 -6.188 -2.610 1.00 . B B . 24 PHE CB 1 1 12 9178 2 2 24 PHE CD1 C -1.676 -5.009 -4.839 1.00 . B B . 24 PHE CD1 1 1 12 9179 2 2 24 PHE CD2 C -0.453 -7.094 -4.618 1.00 . B B . 24 PHE CD2 1 1 12 9180 2 2 24 PHE CE1 C -1.285 -4.922 -6.180 1.00 . B B . 24 PHE CE1 1 1 12 9181 2 2 24 PHE CE2 C -0.062 -7.008 -5.960 1.00 . B B . 24 PHE CE2 1 1 12 9182 2 2 24 PHE CG C -1.260 -6.095 -4.057 1.00 . B B . 24 PHE CG 1 1 12 9183 2 2 24 PHE CZ C -0.478 -5.921 -6.742 1.00 . B B . 24 PHE CZ 1 1 12 9184 2 2 24 PHE H H -2.652 -8.175 -4.196 1.00 . B B . 24 PHE H 1 1 12 9185 2 2 24 PHE HA H -3.251 -7.106 -1.474 1.00 . B B . 24 PHE HA 1 1 12 9186 2 2 24 PHE HB2 H -1.755 -5.196 -2.194 1.00 . B B . 24 PHE HB2 1 1 12 9187 2 2 24 PHE HB3 H -0.938 -6.752 -2.061 1.00 . B B . 24 PHE HB3 1 1 12 9188 2 2 24 PHE HD1 H -2.297 -4.240 -4.405 1.00 . B B . 24 PHE HD1 1 1 12 9189 2 2 24 PHE HD2 H -0.133 -7.931 -4.016 1.00 . B B . 24 PHE HD2 1 1 12 9190 2 2 24 PHE HE1 H -1.605 -4.085 -6.782 1.00 . B B . 24 PHE HE1 1 1 12 9191 2 2 24 PHE HE2 H 0.558 -7.778 -6.391 1.00 . B B . 24 PHE HE2 1 1 12 9192 2 2 24 PHE HZ H -0.176 -5.852 -7.776 1.00 . B B . 24 PHE HZ 1 1 12 9193 2 2 24 PHE N N -3.001 -8.166 -3.281 1.00 . B B . 24 PHE N 1 1 12 9194 2 2 24 PHE O O -4.312 -5.906 -4.274 1.00 . B B . 24 PHE O 1 1 12 9195 2 2 25 PHE C C -5.515 -2.996 -2.734 1.00 . B B . 25 PHE C 1 1 12 9196 2 2 25 PHE CA C -5.961 -4.459 -2.734 1.00 . B B . 25 PHE CA 1 1 12 9197 2 2 25 PHE CB C -7.195 -4.618 -1.843 1.00 . B B . 25 PHE CB 1 1 12 9198 2 2 25 PHE CD1 C -6.321 -5.189 0.452 1.00 . B B . 25 PHE CD1 1 1 12 9199 2 2 25 PHE CD2 C -7.059 -2.919 0.015 1.00 . B B . 25 PHE CD2 1 1 12 9200 2 2 25 PHE CE1 C -6.002 -4.831 1.769 1.00 . B B . 25 PHE CE1 1 1 12 9201 2 2 25 PHE CE2 C -6.742 -2.561 1.331 1.00 . B B . 25 PHE CE2 1 1 12 9202 2 2 25 PHE CG C -6.848 -4.233 -0.425 1.00 . B B . 25 PHE CG 1 1 12 9203 2 2 25 PHE CZ C -6.213 -3.517 2.209 1.00 . B B . 25 PHE CZ 1 1 12 9204 2 2 25 PHE H H -4.715 -5.424 -1.267 1.00 . B B . 25 PHE H 1 1 12 9205 2 2 25 PHE HA H -6.210 -4.754 -3.741 1.00 . B B . 25 PHE HA 1 1 12 9206 2 2 25 PHE HB2 H -7.986 -3.981 -2.208 1.00 . B B . 25 PHE HB2 1 1 12 9207 2 2 25 PHE HB3 H -7.523 -5.647 -1.864 1.00 . B B . 25 PHE HB3 1 1 12 9208 2 2 25 PHE HD1 H -6.157 -6.201 0.114 1.00 . B B . 25 PHE HD1 1 1 12 9209 2 2 25 PHE HD2 H -7.466 -2.183 -0.662 1.00 . B B . 25 PHE HD2 1 1 12 9210 2 2 25 PHE HE1 H -5.595 -5.567 2.445 1.00 . B B . 25 PHE HE1 1 1 12 9211 2 2 25 PHE HE2 H -6.904 -1.548 1.670 1.00 . B B . 25 PHE HE2 1 1 12 9212 2 2 25 PHE HZ H -5.970 -3.241 3.224 1.00 . B B . 25 PHE HZ 1 1 12 9213 2 2 25 PHE N N -4.868 -5.334 -2.230 1.00 . B B . 25 PHE N 1 1 12 9214 2 2 25 PHE O O -5.202 -2.428 -1.706 1.00 . B B . 25 PHE O 1 1 12 9215 2 2 26 TYR C C -6.289 -0.144 -4.514 1.00 . B B . 26 TYR C 1 1 12 9216 2 2 26 TYR CA C -5.097 -0.950 -3.969 1.00 . B B . 26 TYR CA 1 1 12 9217 2 2 26 TYR CB C -3.846 -0.832 -4.872 1.00 . B B . 26 TYR CB 1 1 12 9218 2 2 26 TYR CD1 C -4.287 1.382 -5.998 1.00 . B B . 26 TYR CD1 1 1 12 9219 2 2 26 TYR CD2 C -4.219 -0.626 -7.359 1.00 . B B . 26 TYR CD2 1 1 12 9220 2 2 26 TYR CE1 C -4.549 2.149 -7.139 1.00 . B B . 26 TYR CE1 1 1 12 9221 2 2 26 TYR CE2 C -4.480 0.140 -8.503 1.00 . B B . 26 TYR CE2 1 1 12 9222 2 2 26 TYR CG C -4.123 -0.004 -6.108 1.00 . B B . 26 TYR CG 1 1 12 9223 2 2 26 TYR CZ C -4.646 1.528 -8.393 1.00 . B B . 26 TYR CZ 1 1 12 9224 2 2 26 TYR H H -5.771 -2.859 -4.696 1.00 . B B . 26 TYR H 1 1 12 9225 2 2 26 TYR HA H -4.855 -0.588 -2.979 1.00 . B B . 26 TYR HA 1 1 12 9226 2 2 26 TYR HB2 H -3.049 -0.369 -4.311 1.00 . B B . 26 TYR HB2 1 1 12 9227 2 2 26 TYR HB3 H -3.535 -1.822 -5.172 1.00 . B B . 26 TYR HB3 1 1 12 9228 2 2 26 TYR HD1 H -4.212 1.859 -5.030 1.00 . B B . 26 TYR HD1 1 1 12 9229 2 2 26 TYR HD2 H -4.090 -1.695 -7.441 1.00 . B B . 26 TYR HD2 1 1 12 9230 2 2 26 TYR HE1 H -4.678 3.217 -7.055 1.00 . B B . 26 TYR HE1 1 1 12 9231 2 2 26 TYR HE2 H -4.555 -0.339 -9.468 1.00 . B B . 26 TYR HE2 1 1 12 9232 2 2 26 TYR HH H -5.507 1.791 -10.077 1.00 . B B . 26 TYR HH 1 1 12 9233 2 2 26 TYR N N -5.502 -2.380 -3.884 1.00 . B B . 26 TYR N 1 1 12 9234 2 2 26 TYR O O -6.607 -0.191 -5.686 1.00 . B B . 26 TYR O 1 1 12 9235 2 2 26 TYR OH O -4.903 2.285 -9.518 1.00 . B B . 26 TYR OH 1 1 12 9236 2 2 27 THR C C -7.678 2.669 -4.757 1.00 . B B . 27 THR C 1 1 12 9237 2 2 27 THR CA C -8.143 1.361 -4.116 1.00 . B B . 27 THR CA 1 1 12 9238 2 2 27 THR CB C -9.023 1.670 -2.907 1.00 . B B . 27 THR CB 1 1 12 9239 2 2 27 THR CG2 C -9.370 0.369 -2.183 1.00 . B B . 27 THR CG2 1 1 12 9240 2 2 27 THR H H -6.714 0.586 -2.718 1.00 . B B . 27 THR H 1 1 12 9241 2 2 27 THR HA H -8.707 0.786 -4.834 1.00 . B B . 27 THR HA 1 1 12 9242 2 2 27 THR HB H -9.928 2.145 -3.236 1.00 . B B . 27 THR HB 1 1 12 9243 2 2 27 THR HG1 H -8.638 3.431 -2.176 1.00 . B B . 27 THR HG1 1 1 12 9244 2 2 27 THR HG21 H -9.534 0.573 -1.135 1.00 . B B . 27 THR HG21 1 1 12 9245 2 2 27 THR HG22 H -8.555 -0.330 -2.291 1.00 . B B . 27 THR HG22 1 1 12 9246 2 2 27 THR HG23 H -10.266 -0.054 -2.612 1.00 . B B . 27 THR HG23 1 1 12 9247 2 2 27 THR N N -6.967 0.575 -3.662 1.00 . B B . 27 THR N 1 1 12 9248 2 2 27 THR O O -6.555 3.098 -4.575 1.00 . B B . 27 THR O 1 1 12 9249 2 2 27 THR OG1 O -8.325 2.536 -2.023 1.00 . B B . 27 THR OG1 1 1 12 9250 2 2 28 LYS C C -9.396 5.466 -6.332 1.00 . B B . 28 LYS C 1 1 12 9251 2 2 28 LYS CA C -8.150 4.592 -6.155 1.00 . B B . 28 LYS CA 1 1 12 9252 2 2 28 LYS CB C -7.530 4.307 -7.525 1.00 . B B . 28 LYS CB 1 1 12 9253 2 2 28 LYS CD C -5.910 5.325 -9.135 1.00 . B B . 28 LYS CD 1 1 12 9254 2 2 28 LYS CE C -5.857 6.430 -10.192 1.00 . B B . 28 LYS CE 1 1 12 9255 2 2 28 LYS CG C -7.040 5.617 -8.146 1.00 . B B . 28 LYS CG 1 1 12 9256 2 2 28 LYS H H -9.438 2.947 -5.634 1.00 . B B . 28 LYS H 1 1 12 9257 2 2 28 LYS HA H -7.433 5.109 -5.535 1.00 . B B . 28 LYS HA 1 1 12 9258 2 2 28 LYS HB2 H -6.698 3.629 -7.410 1.00 . B B . 28 LYS HB2 1 1 12 9259 2 2 28 LYS HB3 H -8.273 3.862 -8.171 1.00 . B B . 28 LYS HB3 1 1 12 9260 2 2 28 LYS HD2 H -4.970 5.286 -8.605 1.00 . B B . 28 LYS HD2 1 1 12 9261 2 2 28 LYS HD3 H -6.092 4.377 -9.619 1.00 . B B . 28 LYS HD3 1 1 12 9262 2 2 28 LYS HE2 H -6.458 7.267 -9.868 1.00 . B B . 28 LYS HE2 1 1 12 9263 2 2 28 LYS HE3 H -4.833 6.750 -10.323 1.00 . B B . 28 LYS HE3 1 1 12 9264 2 2 28 LYS HG2 H -7.858 6.099 -8.662 1.00 . B B . 28 LYS HG2 1 1 12 9265 2 2 28 LYS HG3 H -6.673 6.270 -7.367 1.00 . B B . 28 LYS HG3 1 1 12 9266 2 2 28 LYS HZ1 H -6.511 6.695 -12.150 1.00 . B B . 28 LYS HZ1 1 1 12 9267 2 2 28 LYS HZ2 H -7.300 5.441 -11.320 1.00 . B B . 28 LYS HZ2 1 1 12 9268 2 2 28 LYS HZ3 H -5.711 5.224 -11.883 1.00 . B B . 28 LYS HZ3 1 1 12 9269 2 2 28 LYS N N -8.536 3.309 -5.503 1.00 . B B . 28 LYS N 1 1 12 9270 2 2 28 LYS NZ N -6.384 5.908 -11.483 1.00 . B B . 28 LYS NZ 1 1 12 9271 2 2 28 LYS O O -9.854 5.672 -7.438 1.00 . B B . 28 LYS O 1 1 12 9272 2 2 29 PRO C C -10.737 8.241 -5.638 1.00 . B B . 29 PRO C 1 1 12 9273 2 2 29 PRO CA C -11.102 6.813 -5.221 1.00 . B B . 29 PRO CA 1 1 12 9274 2 2 29 PRO CB C -11.563 6.769 -3.762 1.00 . B B . 29 PRO CB 1 1 12 9275 2 2 29 PRO CD C -9.337 5.695 -3.891 1.00 . B B . 29 PRO CD 1 1 12 9276 2 2 29 PRO CG C -10.324 6.374 -2.924 1.00 . B B . 29 PRO CG 1 1 12 9277 2 2 29 PRO HA H -11.868 6.409 -5.864 1.00 . B B . 29 PRO HA 1 1 12 9278 2 2 29 PRO HB2 H -11.925 7.743 -3.460 1.00 . B B . 29 PRO HB2 1 1 12 9279 2 2 29 PRO HB3 H -12.338 6.029 -3.638 1.00 . B B . 29 PRO HB3 1 1 12 9280 2 2 29 PRO HD2 H -8.355 6.139 -3.801 1.00 . B B . 29 PRO HD2 1 1 12 9281 2 2 29 PRO HD3 H -9.292 4.633 -3.705 1.00 . B B . 29 PRO HD3 1 1 12 9282 2 2 29 PRO HG2 H -9.874 7.256 -2.490 1.00 . B B . 29 PRO HG2 1 1 12 9283 2 2 29 PRO HG3 H -10.607 5.681 -2.147 1.00 . B B . 29 PRO HG3 1 1 12 9284 2 2 29 PRO N N -9.905 5.954 -5.229 1.00 . B B . 29 PRO N 1 1 12 9285 2 2 29 PRO O O -9.598 8.655 -5.536 1.00 . B B . 29 PRO O 1 1 12 9286 2 2 30 THR C C -12.140 11.370 -5.611 1.00 . B B . 30 THR C 1 1 12 9287 2 2 30 THR CA C -11.396 10.395 -6.525 1.00 . B B . 30 THR CA 1 1 12 9288 2 2 30 THR CB C -11.853 10.601 -7.971 1.00 . B B . 30 THR CB 1 1 12 9289 2 2 30 THR CG2 C -10.999 11.686 -8.628 1.00 . B B . 30 THR CG2 1 1 12 9290 2 2 30 THR H H -12.604 8.644 -6.178 1.00 . B B . 30 THR H 1 1 12 9291 2 2 30 THR HA H -10.334 10.574 -6.454 1.00 . B B . 30 THR HA 1 1 12 9292 2 2 30 THR HB H -12.887 10.908 -7.981 1.00 . B B . 30 THR HB 1 1 12 9293 2 2 30 THR HG1 H -10.948 8.919 -8.340 1.00 . B B . 30 THR HG1 1 1 12 9294 2 2 30 THR HG21 H -11.626 12.526 -8.892 1.00 . B B . 30 THR HG21 1 1 12 9295 2 2 30 THR HG22 H -10.535 11.290 -9.519 1.00 . B B . 30 THR HG22 1 1 12 9296 2 2 30 THR HG23 H -10.233 12.010 -7.939 1.00 . B B . 30 THR HG23 1 1 12 9297 2 2 30 THR N N -11.692 8.996 -6.105 1.00 . B B . 30 THR N 1 1 12 9298 2 2 30 THR O O -12.915 12.160 -6.125 1.00 . B B . 30 THR O 1 1 12 9299 2 2 30 THR OXT O -11.924 11.309 -4.411 1.00 . B B . 30 THR OXT 1 1 12 9300 2 2 30 THR OG1 O -11.712 9.383 -8.690 1.00 . B B . 30 THR OG1 1 1 13 9301 1 1 1 GLY C C -3.365 7.204 0.176 1.00 . A A . 1 GLY C 1 1 13 9302 1 1 1 GLY CA C -4.823 7.505 0.271 1.00 . A A . 1 GLY CA 1 1 13 9303 1 1 1 GLY H1 H -5.400 9.496 0.696 1.00 . A A . 1 GLY H1 1 1 13 9304 1 1 1 GLY H2 H -4.615 8.722 1.988 1.00 . A A . 1 GLY H2 1 1 13 9305 1 1 1 GLY H3 H -6.227 8.336 1.619 1.00 . A A . 1 GLY H3 1 1 13 9306 1 1 1 GLY HA2 H -4.867 6.627 0.692 1.00 . A A . 1 GLY HA2 1 1 13 9307 1 1 1 GLY HA3 H -5.475 7.579 -0.696 1.00 . A A . 1 GLY HA3 1 1 13 9308 1 1 1 GLY N N -5.305 8.602 1.219 1.00 . A A . 1 GLY N 1 1 13 9309 1 1 1 GLY O O -2.540 7.902 0.729 1.00 . A A . 1 GLY O 1 1 13 9310 1 1 2 ILE C C -1.133 6.196 -2.087 1.00 . A A . 2 ILE C 1 1 13 9311 1 1 2 ILE CA C -1.575 5.813 -0.683 1.00 . A A . 2 ILE CA 1 1 13 9312 1 1 2 ILE CB C -1.401 4.308 -0.486 1.00 . A A . 2 ILE CB 1 1 13 9313 1 1 2 ILE CD1 C 0.282 2.483 -0.207 1.00 . A A . 2 ILE CD1 1 1 13 9314 1 1 2 ILE CG1 C 0.080 3.944 -0.610 1.00 . A A . 2 ILE CG1 1 1 13 9315 1 1 2 ILE CG2 C -2.195 3.561 -1.560 1.00 . A A . 2 ILE CG2 1 1 13 9316 1 1 2 ILE H H -3.688 5.626 -0.982 1.00 . A A . 2 ILE H 1 1 13 9317 1 1 2 ILE HA H -0.989 6.347 0.045 1.00 . A A . 2 ILE HA 1 1 13 9318 1 1 2 ILE HB H -1.763 4.027 0.492 1.00 . A A . 2 ILE HB 1 1 13 9319 1 1 2 ILE HD11 H 0.882 1.983 -0.953 1.00 . A A . 2 ILE HD11 1 1 13 9320 1 1 2 ILE HD12 H -0.678 1.994 -0.129 1.00 . A A . 2 ILE HD12 1 1 13 9321 1 1 2 ILE HD13 H 0.786 2.439 0.747 1.00 . A A . 2 ILE HD13 1 1 13 9322 1 1 2 ILE HG12 H 0.400 4.085 -1.633 1.00 . A A . 2 ILE HG12 1 1 13 9323 1 1 2 ILE HG13 H 0.663 4.580 0.039 1.00 . A A . 2 ILE HG13 1 1 13 9324 1 1 2 ILE HG21 H -3.209 3.932 -1.581 1.00 . A A . 2 ILE HG21 1 1 13 9325 1 1 2 ILE HG22 H -2.202 2.506 -1.334 1.00 . A A . 2 ILE HG22 1 1 13 9326 1 1 2 ILE HG23 H -1.734 3.721 -2.524 1.00 . A A . 2 ILE HG23 1 1 13 9327 1 1 2 ILE N N -3.009 6.168 -0.534 1.00 . A A . 2 ILE N 1 1 13 9328 1 1 2 ILE O O -0.080 6.763 -2.295 1.00 . A A . 2 ILE O 1 1 13 9329 1 1 3 VAL C C -1.049 7.644 -4.531 1.00 . A A . 3 VAL C 1 1 13 9330 1 1 3 VAL CA C -1.607 6.219 -4.459 1.00 . A A . 3 VAL CA 1 1 13 9331 1 1 3 VAL CB C -2.872 6.118 -5.309 1.00 . A A . 3 VAL CB 1 1 13 9332 1 1 3 VAL CG1 C -2.493 6.149 -6.785 1.00 . A A . 3 VAL CG1 1 1 13 9333 1 1 3 VAL CG2 C -3.595 4.805 -4.997 1.00 . A A . 3 VAL CG2 1 1 13 9334 1 1 3 VAL H H -2.789 5.434 -2.848 1.00 . A A . 3 VAL H 1 1 13 9335 1 1 3 VAL HA H -0.867 5.521 -4.826 1.00 . A A . 3 VAL HA 1 1 13 9336 1 1 3 VAL HB H -3.524 6.952 -5.087 1.00 . A A . 3 VAL HB 1 1 13 9337 1 1 3 VAL HG11 H -2.860 5.255 -7.267 1.00 . A A . 3 VAL HG11 1 1 13 9338 1 1 3 VAL HG12 H -1.419 6.194 -6.877 1.00 . A A . 3 VAL HG12 1 1 13 9339 1 1 3 VAL HG13 H -2.934 7.017 -7.251 1.00 . A A . 3 VAL HG13 1 1 13 9340 1 1 3 VAL HG21 H -3.011 4.231 -4.295 1.00 . A A . 3 VAL HG21 1 1 13 9341 1 1 3 VAL HG22 H -3.721 4.238 -5.909 1.00 . A A . 3 VAL HG22 1 1 13 9342 1 1 3 VAL HG23 H -4.563 5.018 -4.571 1.00 . A A . 3 VAL HG23 1 1 13 9343 1 1 3 VAL N N -1.945 5.887 -3.052 1.00 . A A . 3 VAL N 1 1 13 9344 1 1 3 VAL O O -0.167 7.936 -5.315 1.00 . A A . 3 VAL O 1 1 13 9345 1 1 4 GLU C C -0.070 10.150 -2.594 1.00 . A A . 4 GLU C 1 1 13 9346 1 1 4 GLU CA C -1.051 9.938 -3.747 1.00 . A A . 4 GLU CA 1 1 13 9347 1 1 4 GLU CB C -2.228 10.907 -3.598 1.00 . A A . 4 GLU CB 1 1 13 9348 1 1 4 GLU CD C -1.967 13.126 -4.715 1.00 . A A . 4 GLU CD 1 1 13 9349 1 1 4 GLU CG C -1.704 12.336 -3.432 1.00 . A A . 4 GLU CG 1 1 13 9350 1 1 4 GLU H H -2.266 8.281 -3.096 1.00 . A A . 4 GLU H 1 1 13 9351 1 1 4 GLU HA H -0.549 10.125 -4.685 1.00 . A A . 4 GLU HA 1 1 13 9352 1 1 4 GLU HB2 H -2.852 10.851 -4.478 1.00 . A A . 4 GLU HB2 1 1 13 9353 1 1 4 GLU HB3 H -2.808 10.635 -2.728 1.00 . A A . 4 GLU HB3 1 1 13 9354 1 1 4 GLU HG2 H -2.211 12.812 -2.605 1.00 . A A . 4 GLU HG2 1 1 13 9355 1 1 4 GLU HG3 H -0.642 12.313 -3.238 1.00 . A A . 4 GLU HG3 1 1 13 9356 1 1 4 GLU N N -1.555 8.535 -3.721 1.00 . A A . 4 GLU N 1 1 13 9357 1 1 4 GLU O O 0.970 10.757 -2.753 1.00 . A A . 4 GLU O 1 1 13 9358 1 1 4 GLU OE1 O -3.008 12.916 -5.315 1.00 . A A . 4 GLU OE1 1 1 13 9359 1 1 4 GLU OE2 O -1.122 13.930 -5.075 1.00 . A A . 4 GLU OE2 1 1 13 9360 1 1 5 GLN C C 1.842 9.116 -0.540 1.00 . A A . 5 GLN C 1 1 13 9361 1 1 5 GLN CA C 0.519 9.833 -0.269 1.00 . A A . 5 GLN CA 1 1 13 9362 1 1 5 GLN CB C -0.141 9.257 0.986 1.00 . A A . 5 GLN CB 1 1 13 9363 1 1 5 GLN CD C -1.827 9.752 2.774 1.00 . A A . 5 GLN CD 1 1 13 9364 1 1 5 GLN CG C -1.344 10.124 1.369 1.00 . A A . 5 GLN CG 1 1 13 9365 1 1 5 GLN H H -1.239 9.172 -1.322 1.00 . A A . 5 GLN H 1 1 13 9366 1 1 5 GLN HA H 0.709 10.886 -0.122 1.00 . A A . 5 GLN HA 1 1 13 9367 1 1 5 GLN HB2 H -0.470 8.247 0.787 1.00 . A A . 5 GLN HB2 1 1 13 9368 1 1 5 GLN HB3 H 0.571 9.251 1.798 1.00 . A A . 5 GLN HB3 1 1 13 9369 1 1 5 GLN HE21 H -0.899 7.996 2.792 1.00 . A A . 5 GLN HE21 1 1 13 9370 1 1 5 GLN HE22 H -1.779 8.367 4.195 1.00 . A A . 5 GLN HE22 1 1 13 9371 1 1 5 GLN HG2 H -1.054 11.166 1.352 1.00 . A A . 5 GLN HG2 1 1 13 9372 1 1 5 GLN HG3 H -2.142 9.964 0.661 1.00 . A A . 5 GLN HG3 1 1 13 9373 1 1 5 GLN N N -0.394 9.656 -1.431 1.00 . A A . 5 GLN N 1 1 13 9374 1 1 5 GLN NE2 N -1.472 8.610 3.297 1.00 . A A . 5 GLN NE2 1 1 13 9375 1 1 5 GLN O O 2.900 9.589 -0.176 1.00 . A A . 5 GLN O 1 1 13 9376 1 1 5 GLN OE1 O -2.541 10.510 3.401 1.00 . A A . 5 GLN OE1 1 1 13 9377 1 1 6 CYS C C 3.768 7.910 -2.655 1.00 . A A . 6 CYS C 1 1 13 9378 1 1 6 CYS CA C 3.059 7.246 -1.472 1.00 . A A . 6 CYS CA 1 1 13 9379 1 1 6 CYS CB C 2.739 5.792 -1.823 1.00 . A A . 6 CYS CB 1 1 13 9380 1 1 6 CYS H H 0.935 7.614 -1.470 1.00 . A A . 6 CYS H 1 1 13 9381 1 1 6 CYS HA H 3.700 7.275 -0.604 1.00 . A A . 6 CYS HA 1 1 13 9382 1 1 6 CYS HB2 H 1.677 5.684 -1.980 1.00 . A A . 6 CYS HB2 1 1 13 9383 1 1 6 CYS HB3 H 3.265 5.518 -2.724 1.00 . A A . 6 CYS HB3 1 1 13 9384 1 1 6 CYS N N 1.796 7.980 -1.179 1.00 . A A . 6 CYS N 1 1 13 9385 1 1 6 CYS O O 4.980 7.953 -2.718 1.00 . A A . 6 CYS O 1 1 13 9386 1 1 6 CYS SG S 3.261 4.713 -0.468 1.00 . A A . 6 CYS SG 1 1 13 9387 1 1 7 CYS C C 4.063 10.514 -4.388 1.00 . A A . 7 CYS C 1 1 13 9388 1 1 7 CYS CA C 3.656 9.092 -4.769 1.00 . A A . 7 CYS CA 1 1 13 9389 1 1 7 CYS CB C 2.661 9.136 -5.930 1.00 . A A . 7 CYS CB 1 1 13 9390 1 1 7 CYS H H 2.045 8.386 -3.521 1.00 . A A . 7 CYS H 1 1 13 9391 1 1 7 CYS HA H 4.531 8.533 -5.065 1.00 . A A . 7 CYS HA 1 1 13 9392 1 1 7 CYS HB2 H 2.086 8.222 -5.948 1.00 . A A . 7 CYS HB2 1 1 13 9393 1 1 7 CYS HB3 H 1.995 9.977 -5.802 1.00 . A A . 7 CYS HB3 1 1 13 9394 1 1 7 CYS N N 3.021 8.430 -3.592 1.00 . A A . 7 CYS N 1 1 13 9395 1 1 7 CYS O O 5.078 11.019 -4.827 1.00 . A A . 7 CYS O 1 1 13 9396 1 1 7 CYS SG S 3.562 9.311 -7.492 1.00 . A A . 7 CYS SG 1 1 13 9397 1 1 8 THR C C 4.527 12.489 -1.908 1.00 . A A . 8 THR C 1 1 13 9398 1 1 8 THR CA C 3.628 12.549 -3.148 1.00 . A A . 8 THR CA 1 1 13 9399 1 1 8 THR CB C 2.344 13.314 -2.818 1.00 . A A . 8 THR CB 1 1 13 9400 1 1 8 THR CG2 C 2.694 14.657 -2.171 1.00 . A A . 8 THR CG2 1 1 13 9401 1 1 8 THR H H 2.473 10.732 -3.220 1.00 . A A . 8 THR H 1 1 13 9402 1 1 8 THR HA H 4.152 13.048 -3.950 1.00 . A A . 8 THR HA 1 1 13 9403 1 1 8 THR HB H 1.744 12.735 -2.132 1.00 . A A . 8 THR HB 1 1 13 9404 1 1 8 THR HG1 H 0.692 13.688 -3.777 1.00 . A A . 8 THR HG1 1 1 13 9405 1 1 8 THR HG21 H 3.722 14.907 -2.393 1.00 . A A . 8 THR HG21 1 1 13 9406 1 1 8 THR HG22 H 2.564 14.585 -1.101 1.00 . A A . 8 THR HG22 1 1 13 9407 1 1 8 THR HG23 H 2.044 15.426 -2.562 1.00 . A A . 8 THR HG23 1 1 13 9408 1 1 8 THR N N 3.284 11.161 -3.566 1.00 . A A . 8 THR N 1 1 13 9409 1 1 8 THR O O 5.006 13.497 -1.428 1.00 . A A . 8 THR O 1 1 13 9410 1 1 8 THR OG1 O 1.611 13.542 -4.014 1.00 . A A . 8 THR OG1 1 1 13 9411 1 1 9 SER C C 6.412 9.874 -0.267 1.00 . A A . 9 SER C 1 1 13 9412 1 1 9 SER CA C 5.623 11.182 -0.182 1.00 . A A . 9 SER CA 1 1 13 9413 1 1 9 SER CB C 4.748 11.168 1.072 1.00 . A A . 9 SER CB 1 1 13 9414 1 1 9 SER H H 4.362 10.512 -1.790 1.00 . A A . 9 SER H 1 1 13 9415 1 1 9 SER HA H 6.309 12.015 -0.136 1.00 . A A . 9 SER HA 1 1 13 9416 1 1 9 SER HB2 H 4.523 10.150 1.344 1.00 . A A . 9 SER HB2 1 1 13 9417 1 1 9 SER HB3 H 5.278 11.647 1.885 1.00 . A A . 9 SER HB3 1 1 13 9418 1 1 9 SER HG H 3.493 12.618 1.391 1.00 . A A . 9 SER HG 1 1 13 9419 1 1 9 SER N N 4.757 11.312 -1.387 1.00 . A A . 9 SER N 1 1 13 9420 1 1 9 SER O O 6.363 9.173 -1.258 1.00 . A A . 9 SER O 1 1 13 9421 1 1 9 SER OG O 3.536 11.859 0.805 1.00 . A A . 9 SER OG 1 1 13 9422 1 1 10 ILE C C 7.207 7.194 1.514 1.00 . A A . 10 ILE C 1 1 13 9423 1 1 10 ILE CA C 7.937 8.286 0.734 1.00 . A A . 10 ILE CA 1 1 13 9424 1 1 10 ILE CB C 9.291 8.537 1.391 1.00 . A A . 10 ILE CB 1 1 13 9425 1 1 10 ILE CD1 C 10.441 9.146 -0.740 1.00 . A A . 10 ILE CD1 1 1 13 9426 1 1 10 ILE CG1 C 10.028 9.647 0.641 1.00 . A A . 10 ILE CG1 1 1 13 9427 1 1 10 ILE CG2 C 10.113 7.253 1.349 1.00 . A A . 10 ILE CG2 1 1 13 9428 1 1 10 ILE H H 7.175 10.122 1.548 1.00 . A A . 10 ILE H 1 1 13 9429 1 1 10 ILE HA H 8.084 7.968 -0.288 1.00 . A A . 10 ILE HA 1 1 13 9430 1 1 10 ILE HB H 9.141 8.834 2.416 1.00 . A A . 10 ILE HB 1 1 13 9431 1 1 10 ILE HD11 H 9.572 9.096 -1.379 1.00 . A A . 10 ILE HD11 1 1 13 9432 1 1 10 ILE HD12 H 10.882 8.164 -0.652 1.00 . A A . 10 ILE HD12 1 1 13 9433 1 1 10 ILE HD13 H 11.162 9.828 -1.163 1.00 . A A . 10 ILE HD13 1 1 13 9434 1 1 10 ILE HG12 H 9.378 10.502 0.535 1.00 . A A . 10 ILE HG12 1 1 13 9435 1 1 10 ILE HG13 H 10.909 9.932 1.196 1.00 . A A . 10 ILE HG13 1 1 13 9436 1 1 10 ILE HG21 H 11.145 7.480 1.569 1.00 . A A . 10 ILE HG21 1 1 13 9437 1 1 10 ILE HG22 H 10.041 6.813 0.365 1.00 . A A . 10 ILE HG22 1 1 13 9438 1 1 10 ILE HG23 H 9.732 6.560 2.083 1.00 . A A . 10 ILE HG23 1 1 13 9439 1 1 10 ILE N N 7.144 9.542 0.760 1.00 . A A . 10 ILE N 1 1 13 9440 1 1 10 ILE O O 6.354 7.467 2.334 1.00 . A A . 10 ILE O 1 1 13 9441 1 1 11 CYS C C 7.590 3.525 1.701 1.00 . A A . 11 CYS C 1 1 13 9442 1 1 11 CYS CA C 6.890 4.844 2.028 1.00 . A A . 11 CYS CA 1 1 13 9443 1 1 11 CYS CB C 5.407 4.750 1.654 1.00 . A A . 11 CYS CB 1 1 13 9444 1 1 11 CYS H H 8.253 5.756 0.626 1.00 . A A . 11 CYS H 1 1 13 9445 1 1 11 CYS HA H 6.978 5.035 3.089 1.00 . A A . 11 CYS HA 1 1 13 9446 1 1 11 CYS HB2 H 5.081 3.724 1.747 1.00 . A A . 11 CYS HB2 1 1 13 9447 1 1 11 CYS HB3 H 4.829 5.368 2.325 1.00 . A A . 11 CYS HB3 1 1 13 9448 1 1 11 CYS N N 7.551 5.955 1.280 1.00 . A A . 11 CYS N 1 1 13 9449 1 1 11 CYS O O 7.775 3.177 0.551 1.00 . A A . 11 CYS O 1 1 13 9450 1 1 11 CYS SG S 5.148 5.304 -0.049 1.00 . A A . 11 CYS SG 1 1 13 9451 1 1 12 SER C C 7.723 0.330 2.614 1.00 . A A . 12 SER C 1 1 13 9452 1 1 12 SER CA C 8.692 1.505 2.452 1.00 . A A . 12 SER CA 1 1 13 9453 1 1 12 SER CB C 9.843 1.353 3.448 1.00 . A A . 12 SER CB 1 1 13 9454 1 1 12 SER H H 7.840 3.097 3.624 1.00 . A A . 12 SER H 1 1 13 9455 1 1 12 SER HA H 9.089 1.504 1.448 1.00 . A A . 12 SER HA 1 1 13 9456 1 1 12 SER HB2 H 9.867 0.344 3.824 1.00 . A A . 12 SER HB2 1 1 13 9457 1 1 12 SER HB3 H 10.779 1.573 2.951 1.00 . A A . 12 SER HB3 1 1 13 9458 1 1 12 SER HG H 9.082 1.820 5.177 1.00 . A A . 12 SER HG 1 1 13 9459 1 1 12 SER N N 7.991 2.794 2.704 1.00 . A A . 12 SER N 1 1 13 9460 1 1 12 SER O O 6.546 0.507 2.876 1.00 . A A . 12 SER O 1 1 13 9461 1 1 12 SER OG O 9.646 2.252 4.532 1.00 . A A . 12 SER OG 1 1 13 9462 1 1 13 LEU C C 6.293 -1.904 3.624 1.00 . A A . 13 LEU C 1 1 13 9463 1 1 13 LEU CA C 7.372 -2.084 2.557 1.00 . A A . 13 LEU CA 1 1 13 9464 1 1 13 LEU CB C 8.248 -3.284 2.926 1.00 . A A . 13 LEU CB 1 1 13 9465 1 1 13 LEU CD1 C 8.145 -5.767 2.674 1.00 . A A . 13 LEU CD1 1 1 13 9466 1 1 13 LEU CD2 C 6.969 -4.659 4.577 1.00 . A A . 13 LEU CD2 1 1 13 9467 1 1 13 LEU CG C 7.367 -4.523 3.105 1.00 . A A . 13 LEU CG 1 1 13 9468 1 1 13 LEU H H 9.167 -0.962 2.214 1.00 . A A . 13 LEU H 1 1 13 9469 1 1 13 LEU HA H 6.905 -2.269 1.615 1.00 . A A . 13 LEU HA 1 1 13 9470 1 1 13 LEU HB2 H 8.965 -3.461 2.138 1.00 . A A . 13 LEU HB2 1 1 13 9471 1 1 13 LEU HB3 H 8.768 -3.080 3.848 1.00 . A A . 13 LEU HB3 1 1 13 9472 1 1 13 LEU HD11 H 7.604 -6.276 1.890 1.00 . A A . 13 LEU HD11 1 1 13 9473 1 1 13 LEU HD12 H 8.262 -6.430 3.520 1.00 . A A . 13 LEU HD12 1 1 13 9474 1 1 13 LEU HD13 H 9.119 -5.476 2.310 1.00 . A A . 13 LEU HD13 1 1 13 9475 1 1 13 LEU HD21 H 7.277 -5.626 4.946 1.00 . A A . 13 LEU HD21 1 1 13 9476 1 1 13 LEU HD22 H 5.897 -4.562 4.671 1.00 . A A . 13 LEU HD22 1 1 13 9477 1 1 13 LEU HD23 H 7.451 -3.884 5.154 1.00 . A A . 13 LEU HD23 1 1 13 9478 1 1 13 LEU HG H 6.480 -4.425 2.497 1.00 . A A . 13 LEU HG 1 1 13 9479 1 1 13 LEU N N 8.222 -0.865 2.441 1.00 . A A . 13 LEU N 1 1 13 9480 1 1 13 LEU O O 5.149 -2.258 3.421 1.00 . A A . 13 LEU O 1 1 13 9481 1 1 14 TYR C C 4.339 -0.628 5.219 1.00 . A A . 14 TYR C 1 1 13 9482 1 1 14 TYR CA C 5.629 -1.182 5.829 1.00 . A A . 14 TYR CA 1 1 13 9483 1 1 14 TYR CB C 6.161 -0.205 6.881 1.00 . A A . 14 TYR CB 1 1 13 9484 1 1 14 TYR CD1 C 6.650 -2.143 8.417 1.00 . A A . 14 TYR CD1 1 1 13 9485 1 1 14 TYR CD2 C 5.531 -0.190 9.324 1.00 . A A . 14 TYR CD2 1 1 13 9486 1 1 14 TYR CE1 C 6.602 -2.757 9.676 1.00 . A A . 14 TYR CE1 1 1 13 9487 1 1 14 TYR CE2 C 5.486 -0.803 10.584 1.00 . A A . 14 TYR CE2 1 1 13 9488 1 1 14 TYR CG C 6.114 -0.861 8.240 1.00 . A A . 14 TYR CG 1 1 13 9489 1 1 14 TYR CZ C 6.021 -2.086 10.759 1.00 . A A . 14 TYR CZ 1 1 13 9490 1 1 14 TYR H H 7.573 -1.098 4.902 1.00 . A A . 14 TYR H 1 1 13 9491 1 1 14 TYR HA H 5.423 -2.134 6.295 1.00 . A A . 14 TYR HA 1 1 13 9492 1 1 14 TYR HB2 H 7.180 0.061 6.642 1.00 . A A . 14 TYR HB2 1 1 13 9493 1 1 14 TYR HB3 H 5.548 0.684 6.889 1.00 . A A . 14 TYR HB3 1 1 13 9494 1 1 14 TYR HD1 H 7.099 -2.660 7.581 1.00 . A A . 14 TYR HD1 1 1 13 9495 1 1 14 TYR HD2 H 5.119 0.798 9.189 1.00 . A A . 14 TYR HD2 1 1 13 9496 1 1 14 TYR HE1 H 7.015 -3.745 9.810 1.00 . A A . 14 TYR HE1 1 1 13 9497 1 1 14 TYR HE2 H 5.037 -0.286 11.420 1.00 . A A . 14 TYR HE2 1 1 13 9498 1 1 14 TYR HH H 6.573 -3.439 11.988 1.00 . A A . 14 TYR HH 1 1 13 9499 1 1 14 TYR N N 6.644 -1.369 4.755 1.00 . A A . 14 TYR N 1 1 13 9500 1 1 14 TYR O O 3.318 -1.287 5.199 1.00 . A A . 14 TYR O 1 1 13 9501 1 1 14 TYR OH O 5.973 -2.690 12.000 1.00 . A A . 14 TYR OH 1 1 13 9502 1 1 15 GLN C C 2.551 0.170 3.122 1.00 . A A . 15 GLN C 1 1 13 9503 1 1 15 GLN CA C 3.160 1.170 4.101 1.00 . A A . 15 GLN CA 1 1 13 9504 1 1 15 GLN CB C 3.533 2.454 3.356 1.00 . A A . 15 GLN CB 1 1 13 9505 1 1 15 GLN CD C 4.927 3.833 4.907 1.00 . A A . 15 GLN CD 1 1 13 9506 1 1 15 GLN CG C 3.523 3.632 4.333 1.00 . A A . 15 GLN CG 1 1 13 9507 1 1 15 GLN H H 5.216 1.081 4.725 1.00 . A A . 15 GLN H 1 1 13 9508 1 1 15 GLN HA H 2.444 1.397 4.877 1.00 . A A . 15 GLN HA 1 1 13 9509 1 1 15 GLN HB2 H 4.519 2.349 2.927 1.00 . A A . 15 GLN HB2 1 1 13 9510 1 1 15 GLN HB3 H 2.816 2.635 2.570 1.00 . A A . 15 GLN HB3 1 1 13 9511 1 1 15 GLN HE21 H 4.380 5.325 6.097 1.00 . A A . 15 GLN HE21 1 1 13 9512 1 1 15 GLN HE22 H 6.021 4.900 6.175 1.00 . A A . 15 GLN HE22 1 1 13 9513 1 1 15 GLN HG2 H 3.215 4.529 3.812 1.00 . A A . 15 GLN HG2 1 1 13 9514 1 1 15 GLN HG3 H 2.833 3.428 5.137 1.00 . A A . 15 GLN HG3 1 1 13 9515 1 1 15 GLN N N 4.381 0.574 4.711 1.00 . A A . 15 GLN N 1 1 13 9516 1 1 15 GLN NE2 N 5.125 4.763 5.801 1.00 . A A . 15 GLN NE2 1 1 13 9517 1 1 15 GLN O O 1.349 0.040 3.016 1.00 . A A . 15 GLN O 1 1 13 9518 1 1 15 GLN OE1 O 5.852 3.136 4.540 1.00 . A A . 15 GLN OE1 1 1 13 9519 1 1 16 LEU C C 2.141 -2.663 2.183 1.00 . A A . 16 LEU C 1 1 13 9520 1 1 16 LEU CA C 2.851 -1.537 1.434 1.00 . A A . 16 LEU CA 1 1 13 9521 1 1 16 LEU CB C 4.008 -2.120 0.639 1.00 . A A . 16 LEU CB 1 1 13 9522 1 1 16 LEU CD1 C 5.984 -0.699 0.148 1.00 . A A . 16 LEU CD1 1 1 13 9523 1 1 16 LEU CD2 C 4.572 -1.540 -1.714 1.00 . A A . 16 LEU CD2 1 1 13 9524 1 1 16 LEU CG C 4.565 -1.037 -0.274 1.00 . A A . 16 LEU CG 1 1 13 9525 1 1 16 LEU H H 4.346 -0.415 2.513 1.00 . A A . 16 LEU H 1 1 13 9526 1 1 16 LEU HA H 2.167 -1.057 0.759 1.00 . A A . 16 LEU HA 1 1 13 9527 1 1 16 LEU HB2 H 4.772 -2.457 1.318 1.00 . A A . 16 LEU HB2 1 1 13 9528 1 1 16 LEU HB3 H 3.664 -2.950 0.045 1.00 . A A . 16 LEU HB3 1 1 13 9529 1 1 16 LEU HD11 H 6.036 -0.668 1.224 1.00 . A A . 16 LEU HD11 1 1 13 9530 1 1 16 LEU HD12 H 6.257 0.264 -0.256 1.00 . A A . 16 LEU HD12 1 1 13 9531 1 1 16 LEU HD13 H 6.657 -1.455 -0.226 1.00 . A A . 16 LEU HD13 1 1 13 9532 1 1 16 LEU HD21 H 3.692 -1.178 -2.221 1.00 . A A . 16 LEU HD21 1 1 13 9533 1 1 16 LEU HD22 H 4.573 -2.619 -1.714 1.00 . A A . 16 LEU HD22 1 1 13 9534 1 1 16 LEU HD23 H 5.455 -1.177 -2.216 1.00 . A A . 16 LEU HD23 1 1 13 9535 1 1 16 LEU HG H 3.949 -0.154 -0.200 1.00 . A A . 16 LEU HG 1 1 13 9536 1 1 16 LEU N N 3.377 -0.539 2.408 1.00 . A A . 16 LEU N 1 1 13 9537 1 1 16 LEU O O 0.983 -2.951 1.953 1.00 . A A . 16 LEU O 1 1 13 9538 1 1 17 GLU C C 0.860 -4.027 4.396 1.00 . A A . 17 GLU C 1 1 13 9539 1 1 17 GLU CA C 2.233 -4.427 3.849 1.00 . A A . 17 GLU CA 1 1 13 9540 1 1 17 GLU CB C 3.152 -4.789 5.016 1.00 . A A . 17 GLU CB 1 1 13 9541 1 1 17 GLU CD C 4.471 -6.489 3.744 1.00 . A A . 17 GLU CD 1 1 13 9542 1 1 17 GLU CG C 3.533 -6.269 4.932 1.00 . A A . 17 GLU CG 1 1 13 9543 1 1 17 GLU H H 3.776 -3.056 3.229 1.00 . A A . 17 GLU H 1 1 13 9544 1 1 17 GLU HA H 2.122 -5.283 3.205 1.00 . A A . 17 GLU HA 1 1 13 9545 1 1 17 GLU HB2 H 4.047 -4.183 4.971 1.00 . A A . 17 GLU HB2 1 1 13 9546 1 1 17 GLU HB3 H 2.640 -4.604 5.948 1.00 . A A . 17 GLU HB3 1 1 13 9547 1 1 17 GLU HG2 H 4.032 -6.564 5.845 1.00 . A A . 17 GLU HG2 1 1 13 9548 1 1 17 GLU HG3 H 2.641 -6.862 4.799 1.00 . A A . 17 GLU HG3 1 1 13 9549 1 1 17 GLU N N 2.840 -3.306 3.075 1.00 . A A . 17 GLU N 1 1 13 9550 1 1 17 GLU O O 0.056 -4.870 4.742 1.00 . A A . 17 GLU O 1 1 13 9551 1 1 17 GLU OE1 O 4.082 -6.150 2.638 1.00 . A A . 17 GLU OE1 1 1 13 9552 1 1 17 GLU OE2 O 5.561 -6.992 3.960 1.00 . A A . 17 GLU OE2 1 1 13 9553 1 1 18 ASN C C -1.793 -2.342 3.925 1.00 . A A . 18 ASN C 1 1 13 9554 1 1 18 ASN CA C -0.740 -2.331 5.036 1.00 . A A . 18 ASN CA 1 1 13 9555 1 1 18 ASN CB C -0.624 -0.919 5.615 1.00 . A A . 18 ASN CB 1 1 13 9556 1 1 18 ASN CG C -1.269 -0.884 7.002 1.00 . A A . 18 ASN CG 1 1 13 9557 1 1 18 ASN H H 1.241 -2.087 4.223 1.00 . A A . 18 ASN H 1 1 13 9558 1 1 18 ASN HA H -1.040 -3.013 5.816 1.00 . A A . 18 ASN HA 1 1 13 9559 1 1 18 ASN HB2 H 0.420 -0.648 5.694 1.00 . A A . 18 ASN HB2 1 1 13 9560 1 1 18 ASN HB3 H -1.130 -0.221 4.967 1.00 . A A . 18 ASN HB3 1 1 13 9561 1 1 18 ASN HD21 H -0.193 0.665 7.621 1.00 . A A . 18 ASN HD21 1 1 13 9562 1 1 18 ASN HD22 H -1.295 0.048 8.754 1.00 . A A . 18 ASN HD22 1 1 13 9563 1 1 18 ASN N N 0.581 -2.757 4.494 1.00 . A A . 18 ASN N 1 1 13 9564 1 1 18 ASN ND2 N -0.887 0.018 7.864 1.00 . A A . 18 ASN ND2 1 1 13 9565 1 1 18 ASN O O -2.947 -2.037 4.154 1.00 . A A . 18 ASN O 1 1 13 9566 1 1 18 ASN OD1 O -2.130 -1.686 7.305 1.00 . A A . 18 ASN OD1 1 1 13 9567 1 1 19 TYR C C -2.391 -4.097 0.948 1.00 . A A . 19 TYR C 1 1 13 9568 1 1 19 TYR CA C -2.418 -2.727 1.619 1.00 . A A . 19 TYR CA 1 1 13 9569 1 1 19 TYR CB C -2.083 -1.642 0.594 1.00 . A A . 19 TYR CB 1 1 13 9570 1 1 19 TYR CD1 C -3.217 0.342 1.656 1.00 . A A . 19 TYR CD1 1 1 13 9571 1 1 19 TYR CD2 C -0.792 0.270 1.599 1.00 . A A . 19 TYR CD2 1 1 13 9572 1 1 19 TYR CE1 C -3.164 1.572 2.322 1.00 . A A . 19 TYR CE1 1 1 13 9573 1 1 19 TYR CE2 C -0.739 1.502 2.262 1.00 . A A . 19 TYR CE2 1 1 13 9574 1 1 19 TYR CG C -2.029 -0.309 1.295 1.00 . A A . 19 TYR CG 1 1 13 9575 1 1 19 TYR CZ C -1.925 2.153 2.625 1.00 . A A . 19 TYR CZ 1 1 13 9576 1 1 19 TYR H H -0.485 -2.946 2.553 1.00 . A A . 19 TYR H 1 1 13 9577 1 1 19 TYR HA H -3.404 -2.546 2.023 1.00 . A A . 19 TYR HA 1 1 13 9578 1 1 19 TYR HB2 H -1.124 -1.854 0.143 1.00 . A A . 19 TYR HB2 1 1 13 9579 1 1 19 TYR HB3 H -2.845 -1.618 -0.170 1.00 . A A . 19 TYR HB3 1 1 13 9580 1 1 19 TYR HD1 H -4.173 -0.105 1.419 1.00 . A A . 19 TYR HD1 1 1 13 9581 1 1 19 TYR HD2 H 0.121 -0.231 1.316 1.00 . A A . 19 TYR HD2 1 1 13 9582 1 1 19 TYR HE1 H -4.077 2.073 2.602 1.00 . A A . 19 TYR HE1 1 1 13 9583 1 1 19 TYR HE2 H 0.217 1.948 2.496 1.00 . A A . 19 TYR HE2 1 1 13 9584 1 1 19 TYR HH H -2.740 3.534 3.658 1.00 . A A . 19 TYR HH 1 1 13 9585 1 1 19 TYR N N -1.418 -2.697 2.725 1.00 . A A . 19 TYR N 1 1 13 9586 1 1 19 TYR O O -2.279 -4.210 -0.256 1.00 . A A . 19 TYR O 1 1 13 9587 1 1 19 TYR OH O -1.873 3.365 3.282 1.00 . A A . 19 TYR OH 1 1 13 9588 1 1 20 CYS C C -2.952 -7.525 2.167 1.00 . A A . 20 CYS C 1 1 13 9589 1 1 20 CYS CA C -2.471 -6.506 1.131 1.00 . A A . 20 CYS CA 1 1 13 9590 1 1 20 CYS CB C -1.045 -6.847 0.701 1.00 . A A . 20 CYS CB 1 1 13 9591 1 1 20 CYS H H -2.579 -5.028 2.693 1.00 . A A . 20 CYS H 1 1 13 9592 1 1 20 CYS HA H -3.122 -6.535 0.270 1.00 . A A . 20 CYS HA 1 1 13 9593 1 1 20 CYS HB2 H -0.689 -6.097 0.009 1.00 . A A . 20 CYS HB2 1 1 13 9594 1 1 20 CYS HB3 H -0.402 -6.869 1.569 1.00 . A A . 20 CYS HB3 1 1 13 9595 1 1 20 CYS N N -2.492 -5.142 1.722 1.00 . A A . 20 CYS N 1 1 13 9596 1 1 20 CYS O O -2.954 -7.264 3.354 1.00 . A A . 20 CYS O 1 1 13 9597 1 1 20 CYS SG S -1.031 -8.468 -0.103 1.00 . A A . 20 CYS SG 1 1 13 9598 1 1 21 ASN C C -2.660 -10.550 3.177 1.00 . A A . 21 ASN C 1 1 13 9599 1 1 21 ASN CA C -3.844 -9.720 2.680 1.00 . A A . 21 ASN CA 1 1 13 9600 1 1 21 ASN CB C -4.847 -10.634 1.974 1.00 . A A . 21 ASN CB 1 1 13 9601 1 1 21 ASN CG C -5.918 -9.784 1.290 1.00 . A A . 21 ASN CG 1 1 13 9602 1 1 21 ASN H H -3.352 -8.870 0.763 1.00 . A A . 21 ASN H 1 1 13 9603 1 1 21 ASN HA H -4.323 -9.239 3.520 1.00 . A A . 21 ASN HA 1 1 13 9604 1 1 21 ASN HB2 H -4.332 -11.229 1.234 1.00 . A A . 21 ASN HB2 1 1 13 9605 1 1 21 ASN HB3 H -5.314 -11.284 2.698 1.00 . A A . 21 ASN HB3 1 1 13 9606 1 1 21 ASN HD21 H -7.113 -9.759 2.875 1.00 . A A . 21 ASN HD21 1 1 13 9607 1 1 21 ASN HD22 H -7.687 -8.913 1.520 1.00 . A A . 21 ASN HD22 1 1 13 9608 1 1 21 ASN N N -3.361 -8.683 1.726 1.00 . A A . 21 ASN N 1 1 13 9609 1 1 21 ASN ND2 N -6.996 -9.458 1.949 1.00 . A A . 21 ASN ND2 1 1 13 9610 1 1 21 ASN O O -1.577 -9.998 3.281 1.00 . A A . 21 ASN O 1 1 13 9611 1 1 21 ASN OXT O -2.856 -11.723 3.448 1.00 . A A . 21 ASN OXT 1 1 13 9612 1 1 21 ASN OD1 O -5.772 -9.409 0.143 1.00 . A A . 21 ASN OD1 1 1 13 9613 2 2 1 PHE C C 13.219 -1.182 -0.001 1.00 . B B . 1 PHE C 1 1 13 9614 2 2 1 PHE CA C 12.583 -2.218 -0.931 1.00 . B B . 1 PHE CA 1 1 13 9615 2 2 1 PHE CB C 11.282 -2.731 -0.310 1.00 . B B . 1 PHE CB 1 1 13 9616 2 2 1 PHE CD1 C 9.573 -2.266 -2.102 1.00 . B B . 1 PHE CD1 1 1 13 9617 2 2 1 PHE CD2 C 10.271 -4.560 -1.722 1.00 . B B . 1 PHE CD2 1 1 13 9618 2 2 1 PHE CE1 C 8.709 -2.697 -3.117 1.00 . B B . 1 PHE CE1 1 1 13 9619 2 2 1 PHE CE2 C 9.406 -4.991 -2.738 1.00 . B B . 1 PHE CE2 1 1 13 9620 2 2 1 PHE CG C 10.354 -3.197 -1.404 1.00 . B B . 1 PHE CG 1 1 13 9621 2 2 1 PHE CZ C 8.625 -4.059 -3.435 1.00 . B B . 1 PHE CZ 1 1 13 9622 2 2 1 PHE H1 H 13.335 -4.088 -0.406 1.00 . B B . 1 PHE H1 1 1 13 9623 2 2 1 PHE H2 H 14.503 -3.020 -1.027 1.00 . B B . 1 PHE H2 1 1 13 9624 2 2 1 PHE H3 H 13.388 -3.764 -2.070 1.00 . B B . 1 PHE H3 1 1 13 9625 2 2 1 PHE HA H 12.369 -1.762 -1.887 1.00 . B B . 1 PHE HA 1 1 13 9626 2 2 1 PHE HB2 H 11.501 -3.556 0.352 1.00 . B B . 1 PHE HB2 1 1 13 9627 2 2 1 PHE HB3 H 10.811 -1.936 0.247 1.00 . B B . 1 PHE HB3 1 1 13 9628 2 2 1 PHE HD1 H 9.638 -1.217 -1.857 1.00 . B B . 1 PHE HD1 1 1 13 9629 2 2 1 PHE HD2 H 10.873 -5.278 -1.184 1.00 . B B . 1 PHE HD2 1 1 13 9630 2 2 1 PHE HE1 H 8.108 -1.979 -3.655 1.00 . B B . 1 PHE HE1 1 1 13 9631 2 2 1 PHE HE2 H 9.341 -6.041 -2.984 1.00 . B B . 1 PHE HE2 1 1 13 9632 2 2 1 PHE HZ H 7.961 -4.390 -4.218 1.00 . B B . 1 PHE HZ 1 1 13 9633 2 2 1 PHE N N 13.523 -3.359 -1.124 1.00 . B B . 1 PHE N 1 1 13 9634 2 2 1 PHE O O 13.160 -1.298 1.207 1.00 . B B . 1 PHE O 1 1 13 9635 2 2 2 VAL C C 13.535 2.079 0.418 1.00 . B B . 2 VAL C 1 1 13 9636 2 2 2 VAL CA C 14.470 0.875 0.297 1.00 . B B . 2 VAL CA 1 1 13 9637 2 2 2 VAL CB C 15.794 1.324 -0.335 1.00 . B B . 2 VAL CB 1 1 13 9638 2 2 2 VAL CG1 C 16.812 1.608 0.772 1.00 . B B . 2 VAL CG1 1 1 13 9639 2 2 2 VAL CG2 C 16.336 0.220 -1.249 1.00 . B B . 2 VAL CG2 1 1 13 9640 2 2 2 VAL H H 13.866 -0.095 -1.532 1.00 . B B . 2 VAL H 1 1 13 9641 2 2 2 VAL HA H 14.660 0.471 1.279 1.00 . B B . 2 VAL HA 1 1 13 9642 2 2 2 VAL HB H 15.630 2.223 -0.910 1.00 . B B . 2 VAL HB 1 1 13 9643 2 2 2 VAL HG11 H 17.568 0.837 0.771 1.00 . B B . 2 VAL HG11 1 1 13 9644 2 2 2 VAL HG12 H 16.311 1.620 1.728 1.00 . B B . 2 VAL HG12 1 1 13 9645 2 2 2 VAL HG13 H 17.276 2.567 0.596 1.00 . B B . 2 VAL HG13 1 1 13 9646 2 2 2 VAL HG21 H 16.109 -0.745 -0.822 1.00 . B B . 2 VAL HG21 1 1 13 9647 2 2 2 VAL HG22 H 17.406 0.327 -1.348 1.00 . B B . 2 VAL HG22 1 1 13 9648 2 2 2 VAL HG23 H 15.875 0.301 -2.222 1.00 . B B . 2 VAL HG23 1 1 13 9649 2 2 2 VAL N N 13.828 -0.169 -0.555 1.00 . B B . 2 VAL N 1 1 13 9650 2 2 2 VAL O O 12.415 2.057 -0.052 1.00 . B B . 2 VAL O 1 1 13 9651 2 2 3 ASN C C 12.850 4.949 -0.168 1.00 . B B . 3 ASN C 1 1 13 9652 2 2 3 ASN CA C 13.137 4.339 1.209 1.00 . B B . 3 ASN CA 1 1 13 9653 2 2 3 ASN CB C 13.873 5.363 2.081 1.00 . B B . 3 ASN CB 1 1 13 9654 2 2 3 ASN CG C 15.363 5.355 1.736 1.00 . B B . 3 ASN CG 1 1 13 9655 2 2 3 ASN H H 14.897 3.112 1.418 1.00 . B B . 3 ASN H 1 1 13 9656 2 2 3 ASN HA H 12.207 4.066 1.683 1.00 . B B . 3 ASN HA 1 1 13 9657 2 2 3 ASN HB2 H 13.469 6.347 1.902 1.00 . B B . 3 ASN HB2 1 1 13 9658 2 2 3 ASN HB3 H 13.747 5.106 3.122 1.00 . B B . 3 ASN HB3 1 1 13 9659 2 2 3 ASN HD21 H 15.197 6.767 0.349 1.00 . B B . 3 ASN HD21 1 1 13 9660 2 2 3 ASN HD22 H 16.766 6.165 0.586 1.00 . B B . 3 ASN HD22 1 1 13 9661 2 2 3 ASN N N 13.989 3.126 1.048 1.00 . B B . 3 ASN N 1 1 13 9662 2 2 3 ASN ND2 N 15.812 6.163 0.813 1.00 . B B . 3 ASN ND2 1 1 13 9663 2 2 3 ASN O O 13.330 6.016 -0.496 1.00 . B B . 3 ASN O 1 1 13 9664 2 2 3 ASN OD1 O 16.127 4.605 2.309 1.00 . B B . 3 ASN OD1 1 1 13 9665 2 2 4 GLN C C 10.383 5.446 -2.378 1.00 . B B . 4 GLN C 1 1 13 9666 2 2 4 GLN CA C 11.778 4.806 -2.341 1.00 . B B . 4 GLN CA 1 1 13 9667 2 2 4 GLN CB C 11.838 3.662 -3.357 1.00 . B B . 4 GLN CB 1 1 13 9668 2 2 4 GLN CD C 13.541 4.400 -5.034 1.00 . B B . 4 GLN CD 1 1 13 9669 2 2 4 GLN CG C 13.279 3.481 -3.839 1.00 . B B . 4 GLN CG 1 1 13 9670 2 2 4 GLN H H 11.712 3.409 -0.700 1.00 . B B . 4 GLN H 1 1 13 9671 2 2 4 GLN HA H 12.517 5.548 -2.602 1.00 . B B . 4 GLN HA 1 1 13 9672 2 2 4 GLN HB2 H 11.497 2.748 -2.890 1.00 . B B . 4 GLN HB2 1 1 13 9673 2 2 4 GLN HB3 H 11.205 3.894 -4.200 1.00 . B B . 4 GLN HB3 1 1 13 9674 2 2 4 GLN HE21 H 12.233 3.479 -6.210 1.00 . B B . 4 GLN HE21 1 1 13 9675 2 2 4 GLN HE22 H 13.047 4.789 -6.917 1.00 . B B . 4 GLN HE22 1 1 13 9676 2 2 4 GLN HG2 H 13.960 3.731 -3.037 1.00 . B B . 4 GLN HG2 1 1 13 9677 2 2 4 GLN HG3 H 13.434 2.454 -4.135 1.00 . B B . 4 GLN HG3 1 1 13 9678 2 2 4 GLN N N 12.082 4.273 -0.981 1.00 . B B . 4 GLN N 1 1 13 9679 2 2 4 GLN NE2 N 12.886 4.206 -6.146 1.00 . B B . 4 GLN NE2 1 1 13 9680 2 2 4 GLN O O 9.703 5.568 -1.369 1.00 . B B . 4 GLN O 1 1 13 9681 2 2 4 GLN OE1 O 14.352 5.301 -4.956 1.00 . B B . 4 GLN OE1 1 1 13 9682 2 2 5 HIS C C 7.644 5.484 -4.325 1.00 . B B . 5 HIS C 1 1 13 9683 2 2 5 HIS CA C 8.615 6.488 -3.696 1.00 . B B . 5 HIS CA 1 1 13 9684 2 2 5 HIS CB C 8.722 7.701 -4.622 1.00 . B B . 5 HIS CB 1 1 13 9685 2 2 5 HIS CD2 C 11.029 8.591 -3.770 1.00 . B B . 5 HIS CD2 1 1 13 9686 2 2 5 HIS CE1 C 10.410 10.627 -3.333 1.00 . B B . 5 HIS CE1 1 1 13 9687 2 2 5 HIS CG C 9.697 8.699 -4.062 1.00 . B B . 5 HIS CG 1 1 13 9688 2 2 5 HIS H H 10.527 5.739 -4.339 1.00 . B B . 5 HIS H 1 1 13 9689 2 2 5 HIS HA H 8.246 6.798 -2.729 1.00 . B B . 5 HIS HA 1 1 13 9690 2 2 5 HIS HB2 H 9.058 7.379 -5.596 1.00 . B B . 5 HIS HB2 1 1 13 9691 2 2 5 HIS HB3 H 7.750 8.164 -4.716 1.00 . B B . 5 HIS HB3 1 1 13 9692 2 2 5 HIS HD2 H 11.628 7.699 -3.882 1.00 . B B . 5 HIS HD2 1 1 13 9693 2 2 5 HIS HE1 H 10.431 11.664 -3.035 1.00 . B B . 5 HIS HE1 1 1 13 9694 2 2 5 HIS HE2 H 12.392 10.034 -3.025 1.00 . B B . 5 HIS HE2 1 1 13 9695 2 2 5 HIS N N 9.957 5.853 -3.549 1.00 . B B . 5 HIS N 1 1 13 9696 2 2 5 HIS ND1 N 9.317 9.993 -3.779 1.00 . B B . 5 HIS ND1 1 1 13 9697 2 2 5 HIS NE2 N 11.482 9.809 -3.310 1.00 . B B . 5 HIS NE2 1 1 13 9698 2 2 5 HIS O O 7.971 4.804 -5.277 1.00 . B B . 5 HIS O 1 1 13 9699 2 2 6 LEU C C 4.475 5.241 -5.263 1.00 . B B . 6 LEU C 1 1 13 9700 2 2 6 LEU CA C 5.455 4.455 -4.390 1.00 . B B . 6 LEU CA 1 1 13 9701 2 2 6 LEU CB C 4.698 3.772 -3.253 1.00 . B B . 6 LEU CB 1 1 13 9702 2 2 6 LEU CD1 C 6.668 2.251 -3.005 1.00 . B B . 6 LEU CD1 1 1 13 9703 2 2 6 LEU CD2 C 4.504 1.687 -1.898 1.00 . B B . 6 LEU CD2 1 1 13 9704 2 2 6 LEU CG C 5.144 2.314 -3.137 1.00 . B B . 6 LEU CG 1 1 13 9705 2 2 6 LEU H H 6.200 5.966 -3.056 1.00 . B B . 6 LEU H 1 1 13 9706 2 2 6 LEU HA H 5.962 3.712 -4.988 1.00 . B B . 6 LEU HA 1 1 13 9707 2 2 6 LEU HB2 H 4.906 4.286 -2.325 1.00 . B B . 6 LEU HB2 1 1 13 9708 2 2 6 LEU HB3 H 3.639 3.809 -3.452 1.00 . B B . 6 LEU HB3 1 1 13 9709 2 2 6 LEU HD11 H 6.932 2.100 -1.968 1.00 . B B . 6 LEU HD11 1 1 13 9710 2 2 6 LEU HD12 H 7.102 3.176 -3.354 1.00 . B B . 6 LEU HD12 1 1 13 9711 2 2 6 LEU HD13 H 7.046 1.430 -3.595 1.00 . B B . 6 LEU HD13 1 1 13 9712 2 2 6 LEU HD21 H 4.531 2.395 -1.084 1.00 . B B . 6 LEU HD21 1 1 13 9713 2 2 6 LEU HD22 H 5.052 0.799 -1.621 1.00 . B B . 6 LEU HD22 1 1 13 9714 2 2 6 LEU HD23 H 3.479 1.424 -2.114 1.00 . B B . 6 LEU HD23 1 1 13 9715 2 2 6 LEU HG H 4.836 1.771 -4.020 1.00 . B B . 6 LEU HG 1 1 13 9716 2 2 6 LEU N N 6.450 5.399 -3.813 1.00 . B B . 6 LEU N 1 1 13 9717 2 2 6 LEU O O 3.880 6.204 -4.822 1.00 . B B . 6 LEU O 1 1 13 9718 2 2 7 CYS C C 2.479 4.616 -8.158 1.00 . B B . 7 CYS C 1 1 13 9719 2 2 7 CYS CA C 3.355 5.597 -7.371 1.00 . B B . 7 CYS CA 1 1 13 9720 2 2 7 CYS CB C 4.146 6.467 -8.349 1.00 . B B . 7 CYS CB 1 1 13 9721 2 2 7 CYS H H 4.788 4.073 -6.841 1.00 . B B . 7 CYS H 1 1 13 9722 2 2 7 CYS HA H 2.730 6.226 -6.755 1.00 . B B . 7 CYS HA 1 1 13 9723 2 2 7 CYS HB2 H 4.904 5.869 -8.832 1.00 . B B . 7 CYS HB2 1 1 13 9724 2 2 7 CYS HB3 H 3.476 6.870 -9.094 1.00 . B B . 7 CYS HB3 1 1 13 9725 2 2 7 CYS N N 4.300 4.849 -6.495 1.00 . B B . 7 CYS N 1 1 13 9726 2 2 7 CYS O O 2.952 3.605 -8.627 1.00 . B B . 7 CYS O 1 1 13 9727 2 2 7 CYS SG S 4.932 7.826 -7.446 1.00 . B B . 7 CYS SG 1 1 13 9728 2 2 8 GLY C C 0.915 2.870 -9.717 1.00 . B B . 8 GLY C 1 1 13 9729 2 2 8 GLY CA C 0.231 4.064 -9.040 1.00 . B B . 8 GLY CA 1 1 13 9730 2 2 8 GLY H H 0.886 5.767 -7.892 1.00 . B B . 8 GLY H 1 1 13 9731 2 2 8 GLY HA2 H -0.510 3.696 -8.347 1.00 . B B . 8 GLY HA2 1 1 13 9732 2 2 8 GLY HA3 H -0.260 4.661 -9.794 1.00 . B B . 8 GLY HA3 1 1 13 9733 2 2 8 GLY N N 1.209 4.934 -8.292 1.00 . B B . 8 GLY N 1 1 13 9734 2 2 8 GLY O O 1.197 1.869 -9.088 1.00 . B B . 8 GLY O 1 1 13 9735 2 2 9 SER C C 2.873 1.171 -10.858 1.00 . B B . 9 SER C 1 1 13 9736 2 2 9 SER CA C 1.815 1.843 -11.738 1.00 . B B . 9 SER CA 1 1 13 9737 2 2 9 SER CB C 2.477 2.383 -13.006 1.00 . B B . 9 SER CB 1 1 13 9738 2 2 9 SER H H 0.915 3.784 -11.481 1.00 . B B . 9 SER H 1 1 13 9739 2 2 9 SER HA H 1.066 1.115 -12.011 1.00 . B B . 9 SER HA 1 1 13 9740 2 2 9 SER HB2 H 3.452 2.773 -12.769 1.00 . B B . 9 SER HB2 1 1 13 9741 2 2 9 SER HB3 H 2.577 1.583 -13.727 1.00 . B B . 9 SER HB3 1 1 13 9742 2 2 9 SER HG H 0.778 3.096 -13.631 1.00 . B B . 9 SER HG 1 1 13 9743 2 2 9 SER N N 1.165 2.968 -10.999 1.00 . B B . 9 SER N 1 1 13 9744 2 2 9 SER O O 2.711 0.047 -10.425 1.00 . B B . 9 SER O 1 1 13 9745 2 2 9 SER OG O 1.675 3.426 -13.545 1.00 . B B . 9 SER OG 1 1 13 9746 2 2 10 ASP C C 4.354 0.651 -8.491 1.00 . B B . 10 ASP C 1 1 13 9747 2 2 10 ASP CA C 5.011 1.252 -9.726 1.00 . B B . 10 ASP CA 1 1 13 9748 2 2 10 ASP CB C 5.976 2.353 -9.285 1.00 . B B . 10 ASP CB 1 1 13 9749 2 2 10 ASP CG C 6.604 3.007 -10.518 1.00 . B B . 10 ASP CG 1 1 13 9750 2 2 10 ASP H H 4.061 2.757 -10.935 1.00 . B B . 10 ASP H 1 1 13 9751 2 2 10 ASP HA H 5.542 0.486 -10.271 1.00 . B B . 10 ASP HA 1 1 13 9752 2 2 10 ASP HB2 H 5.430 3.096 -8.716 1.00 . B B . 10 ASP HB2 1 1 13 9753 2 2 10 ASP HB3 H 6.753 1.926 -8.671 1.00 . B B . 10 ASP HB3 1 1 13 9754 2 2 10 ASP N N 3.951 1.851 -10.584 1.00 . B B . 10 ASP N 1 1 13 9755 2 2 10 ASP O O 4.665 -0.441 -8.067 1.00 . B B . 10 ASP O 1 1 13 9756 2 2 10 ASP OD1 O 7.284 2.310 -11.253 1.00 . B B . 10 ASP OD1 1 1 13 9757 2 2 10 ASP OD2 O 6.392 4.194 -10.708 1.00 . B B . 10 ASP OD2 1 1 13 9758 2 2 11 LEU C C 2.277 -0.551 -6.926 1.00 . B B . 11 LEU C 1 1 13 9759 2 2 11 LEU CA C 2.735 0.891 -6.708 1.00 . B B . 11 LEU CA 1 1 13 9760 2 2 11 LEU CB C 1.523 1.795 -6.479 1.00 . B B . 11 LEU CB 1 1 13 9761 2 2 11 LEU CD1 C 2.355 1.989 -4.102 1.00 . B B . 11 LEU CD1 1 1 13 9762 2 2 11 LEU CD2 C 0.236 3.077 -4.791 1.00 . B B . 11 LEU CD2 1 1 13 9763 2 2 11 LEU CG C 1.124 1.854 -4.999 1.00 . B B . 11 LEU CG 1 1 13 9764 2 2 11 LEU H H 3.219 2.252 -8.292 1.00 . B B . 11 LEU H 1 1 13 9765 2 2 11 LEU HA H 3.400 0.937 -5.865 1.00 . B B . 11 LEU HA 1 1 13 9766 2 2 11 LEU HB2 H 1.760 2.790 -6.821 1.00 . B B . 11 LEU HB2 1 1 13 9767 2 2 11 LEU HB3 H 0.692 1.414 -7.054 1.00 . B B . 11 LEU HB3 1 1 13 9768 2 2 11 LEU HD11 H 3.164 2.432 -4.663 1.00 . B B . 11 LEU HD11 1 1 13 9769 2 2 11 LEU HD12 H 2.652 1.015 -3.746 1.00 . B B . 11 LEU HD12 1 1 13 9770 2 2 11 LEU HD13 H 2.114 2.622 -3.258 1.00 . B B . 11 LEU HD13 1 1 13 9771 2 2 11 LEU HD21 H 0.846 3.910 -4.476 1.00 . B B . 11 LEU HD21 1 1 13 9772 2 2 11 LEU HD22 H -0.502 2.862 -4.036 1.00 . B B . 11 LEU HD22 1 1 13 9773 2 2 11 LEU HD23 H -0.256 3.325 -5.721 1.00 . B B . 11 LEU HD23 1 1 13 9774 2 2 11 LEU HG H 0.578 0.963 -4.735 1.00 . B B . 11 LEU HG 1 1 13 9775 2 2 11 LEU N N 3.443 1.373 -7.918 1.00 . B B . 11 LEU N 1 1 13 9776 2 2 11 LEU O O 2.517 -1.418 -6.110 1.00 . B B . 11 LEU O 1 1 13 9777 2 2 12 ALA C C 2.386 -3.103 -8.476 1.00 . B B . 12 ALA C 1 1 13 9778 2 2 12 ALA CA C 1.166 -2.209 -8.279 1.00 . B B . 12 ALA CA 1 1 13 9779 2 2 12 ALA CB C 0.297 -2.254 -9.536 1.00 . B B . 12 ALA CB 1 1 13 9780 2 2 12 ALA H H 1.442 -0.111 -8.675 1.00 . B B . 12 ALA H 1 1 13 9781 2 2 12 ALA HA H 0.596 -2.562 -7.430 1.00 . B B . 12 ALA HA 1 1 13 9782 2 2 12 ALA HB1 H 0.916 -2.103 -10.407 1.00 . B B . 12 ALA HB1 1 1 13 9783 2 2 12 ALA HB2 H -0.452 -1.480 -9.485 1.00 . B B . 12 ALA HB2 1 1 13 9784 2 2 12 ALA HB3 H -0.186 -3.220 -9.603 1.00 . B B . 12 ALA HB3 1 1 13 9785 2 2 12 ALA N N 1.624 -0.819 -8.022 1.00 . B B . 12 ALA N 1 1 13 9786 2 2 12 ALA O O 2.553 -4.090 -7.792 1.00 . B B . 12 ALA O 1 1 13 9787 2 2 13 GLU C C 5.218 -3.734 -8.305 1.00 . B B . 13 GLU C 1 1 13 9788 2 2 13 GLU CA C 4.455 -3.604 -9.623 1.00 . B B . 13 GLU CA 1 1 13 9789 2 2 13 GLU CB C 5.349 -2.951 -10.680 1.00 . B B . 13 GLU CB 1 1 13 9790 2 2 13 GLU CD C 6.227 -3.226 -13.005 1.00 . B B . 13 GLU CD 1 1 13 9791 2 2 13 GLU CG C 5.129 -3.644 -12.027 1.00 . B B . 13 GLU CG 1 1 13 9792 2 2 13 GLU H H 3.101 -1.956 -9.940 1.00 . B B . 13 GLU H 1 1 13 9793 2 2 13 GLU HA H 4.154 -4.586 -9.960 1.00 . B B . 13 GLU HA 1 1 13 9794 2 2 13 GLU HB2 H 5.099 -1.903 -10.768 1.00 . B B . 13 GLU HB2 1 1 13 9795 2 2 13 GLU HB3 H 6.384 -3.052 -10.391 1.00 . B B . 13 GLU HB3 1 1 13 9796 2 2 13 GLU HG2 H 5.159 -4.716 -11.887 1.00 . B B . 13 GLU HG2 1 1 13 9797 2 2 13 GLU HG3 H 4.167 -3.360 -12.425 1.00 . B B . 13 GLU HG3 1 1 13 9798 2 2 13 GLU N N 3.247 -2.764 -9.400 1.00 . B B . 13 GLU N 1 1 13 9799 2 2 13 GLU O O 5.806 -4.757 -8.015 1.00 . B B . 13 GLU O 1 1 13 9800 2 2 13 GLU OE1 O 7.375 -3.557 -12.755 1.00 . B B . 13 GLU OE1 1 1 13 9801 2 2 13 GLU OE2 O 5.902 -2.584 -13.990 1.00 . B B . 13 GLU OE2 1 1 13 9802 2 2 14 ALA C C 5.149 -3.760 -5.288 1.00 . B B . 14 ALA C 1 1 13 9803 2 2 14 ALA CA C 5.904 -2.784 -6.186 1.00 . B B . 14 ALA CA 1 1 13 9804 2 2 14 ALA CB C 5.932 -1.401 -5.532 1.00 . B B . 14 ALA CB 1 1 13 9805 2 2 14 ALA H H 4.705 -1.896 -7.739 1.00 . B B . 14 ALA H 1 1 13 9806 2 2 14 ALA HA H 6.916 -3.140 -6.336 1.00 . B B . 14 ALA HA 1 1 13 9807 2 2 14 ALA HB1 H 5.112 -1.315 -4.835 1.00 . B B . 14 ALA HB1 1 1 13 9808 2 2 14 ALA HB2 H 5.838 -0.640 -6.293 1.00 . B B . 14 ALA HB2 1 1 13 9809 2 2 14 ALA HB3 H 6.867 -1.269 -5.006 1.00 . B B . 14 ALA HB3 1 1 13 9810 2 2 14 ALA N N 5.198 -2.709 -7.494 1.00 . B B . 14 ALA N 1 1 13 9811 2 2 14 ALA O O 5.727 -4.648 -4.697 1.00 . B B . 14 ALA O 1 1 13 9812 2 2 15 LEU C C 3.113 -5.929 -5.055 1.00 . B B . 15 LEU C 1 1 13 9813 2 2 15 LEU CA C 3.071 -4.567 -4.367 1.00 . B B . 15 LEU CA 1 1 13 9814 2 2 15 LEU CB C 1.620 -4.094 -4.265 1.00 . B B . 15 LEU CB 1 1 13 9815 2 2 15 LEU CD1 C 0.212 -2.162 -3.555 1.00 . B B . 15 LEU CD1 1 1 13 9816 2 2 15 LEU CD2 C 1.633 -3.352 -1.888 1.00 . B B . 15 LEU CD2 1 1 13 9817 2 2 15 LEU CG C 1.542 -2.882 -3.339 1.00 . B B . 15 LEU CG 1 1 13 9818 2 2 15 LEU H H 3.395 -2.910 -5.708 1.00 . B B . 15 LEU H 1 1 13 9819 2 2 15 LEU HA H 3.511 -4.632 -3.379 1.00 . B B . 15 LEU HA 1 1 13 9820 2 2 15 LEU HB2 H 1.261 -3.821 -5.248 1.00 . B B . 15 LEU HB2 1 1 13 9821 2 2 15 LEU HB3 H 1.010 -4.890 -3.867 1.00 . B B . 15 LEU HB3 1 1 13 9822 2 2 15 LEU HD11 H 0.366 -1.095 -3.485 1.00 . B B . 15 LEU HD11 1 1 13 9823 2 2 15 LEU HD12 H -0.493 -2.475 -2.799 1.00 . B B . 15 LEU HD12 1 1 13 9824 2 2 15 LEU HD13 H -0.176 -2.407 -4.532 1.00 . B B . 15 LEU HD13 1 1 13 9825 2 2 15 LEU HD21 H 1.864 -4.407 -1.866 1.00 . B B . 15 LEU HD21 1 1 13 9826 2 2 15 LEU HD22 H 0.689 -3.180 -1.395 1.00 . B B . 15 LEU HD22 1 1 13 9827 2 2 15 LEU HD23 H 2.412 -2.802 -1.379 1.00 . B B . 15 LEU HD23 1 1 13 9828 2 2 15 LEU HG H 2.357 -2.209 -3.554 1.00 . B B . 15 LEU HG 1 1 13 9829 2 2 15 LEU N N 3.853 -3.621 -5.204 1.00 . B B . 15 LEU N 1 1 13 9830 2 2 15 LEU O O 3.057 -6.969 -4.430 1.00 . B B . 15 LEU O 1 1 13 9831 2 2 16 TYR C C 4.533 -7.949 -6.740 1.00 . B B . 16 TYR C 1 1 13 9832 2 2 16 TYR CA C 3.286 -7.172 -7.141 1.00 . B B . 16 TYR CA 1 1 13 9833 2 2 16 TYR CB C 3.393 -6.821 -8.627 1.00 . B B . 16 TYR CB 1 1 13 9834 2 2 16 TYR CD1 C 2.203 -8.887 -9.427 1.00 . B B . 16 TYR CD1 1 1 13 9835 2 2 16 TYR CD2 C 1.345 -6.712 -10.070 1.00 . B B . 16 TYR CD2 1 1 13 9836 2 2 16 TYR CE1 C 1.169 -9.506 -10.143 1.00 . B B . 16 TYR CE1 1 1 13 9837 2 2 16 TYR CE2 C 0.311 -7.327 -10.786 1.00 . B B . 16 TYR CE2 1 1 13 9838 2 2 16 TYR CG C 2.287 -7.491 -9.392 1.00 . B B . 16 TYR CG 1 1 13 9839 2 2 16 TYR CZ C 0.222 -8.726 -10.823 1.00 . B B . 16 TYR CZ 1 1 13 9840 2 2 16 TYR H H 3.272 -5.050 -6.822 1.00 . B B . 16 TYR H 1 1 13 9841 2 2 16 TYR HA H 2.403 -7.767 -6.964 1.00 . B B . 16 TYR HA 1 1 13 9842 2 2 16 TYR HB2 H 3.314 -5.754 -8.750 1.00 . B B . 16 TYR HB2 1 1 13 9843 2 2 16 TYR HB3 H 4.345 -7.153 -9.009 1.00 . B B . 16 TYR HB3 1 1 13 9844 2 2 16 TYR HD1 H 2.936 -9.487 -8.902 1.00 . B B . 16 TYR HD1 1 1 13 9845 2 2 16 TYR HD2 H 1.420 -5.635 -10.040 1.00 . B B . 16 TYR HD2 1 1 13 9846 2 2 16 TYR HE1 H 1.101 -10.583 -10.171 1.00 . B B . 16 TYR HE1 1 1 13 9847 2 2 16 TYR HE2 H -0.417 -6.723 -11.309 1.00 . B B . 16 TYR HE2 1 1 13 9848 2 2 16 TYR HH H -1.507 -9.530 -10.913 1.00 . B B . 16 TYR HH 1 1 13 9849 2 2 16 TYR N N 3.222 -5.911 -6.356 1.00 . B B . 16 TYR N 1 1 13 9850 2 2 16 TYR O O 4.649 -9.134 -6.982 1.00 . B B . 16 TYR O 1 1 13 9851 2 2 16 TYR OH O -0.796 -9.335 -11.528 1.00 . B B . 16 TYR OH 1 1 13 9852 2 2 17 LEU C C 6.776 -8.153 -4.261 1.00 . B B . 17 LEU C 1 1 13 9853 2 2 17 LEU CA C 6.742 -7.936 -5.779 1.00 . B B . 17 LEU CA 1 1 13 9854 2 2 17 LEU CB C 7.869 -7.019 -6.226 1.00 . B B . 17 LEU CB 1 1 13 9855 2 2 17 LEU CD1 C 9.196 -9.153 -6.087 1.00 . B B . 17 LEU CD1 1 1 13 9856 2 2 17 LEU CD2 C 10.237 -7.043 -6.886 1.00 . B B . 17 LEU CD2 1 1 13 9857 2 2 17 LEU CG C 9.225 -7.629 -5.913 1.00 . B B . 17 LEU CG 1 1 13 9858 2 2 17 LEU H H 5.380 -6.316 -6.005 1.00 . B B . 17 LEU H 1 1 13 9859 2 2 17 LEU HA H 6.830 -8.882 -6.287 1.00 . B B . 17 LEU HA 1 1 13 9860 2 2 17 LEU HB2 H 7.793 -6.854 -7.290 1.00 . B B . 17 LEU HB2 1 1 13 9861 2 2 17 LEU HB3 H 7.780 -6.073 -5.714 1.00 . B B . 17 LEU HB3 1 1 13 9862 2 2 17 LEU HD11 H 8.498 -9.414 -6.869 1.00 . B B . 17 LEU HD11 1 1 13 9863 2 2 17 LEU HD12 H 8.894 -9.619 -5.163 1.00 . B B . 17 LEU HD12 1 1 13 9864 2 2 17 LEU HD13 H 10.181 -9.501 -6.358 1.00 . B B . 17 LEU HD13 1 1 13 9865 2 2 17 LEU HD21 H 11.206 -7.005 -6.419 1.00 . B B . 17 LEU HD21 1 1 13 9866 2 2 17 LEU HD22 H 9.925 -6.047 -7.165 1.00 . B B . 17 LEU HD22 1 1 13 9867 2 2 17 LEU HD23 H 10.282 -7.665 -7.768 1.00 . B B . 17 LEU HD23 1 1 13 9868 2 2 17 LEU HG H 9.497 -7.375 -4.905 1.00 . B B . 17 LEU HG 1 1 13 9869 2 2 17 LEU N N 5.482 -7.275 -6.163 1.00 . B B . 17 LEU N 1 1 13 9870 2 2 17 LEU O O 7.622 -8.852 -3.742 1.00 . B B . 17 LEU O 1 1 13 9871 2 2 18 VAL C C 4.807 -8.846 -1.726 1.00 . B B . 18 VAL C 1 1 13 9872 2 2 18 VAL CA C 5.833 -7.770 -2.064 1.00 . B B . 18 VAL CA 1 1 13 9873 2 2 18 VAL CB C 5.453 -6.457 -1.366 1.00 . B B . 18 VAL CB 1 1 13 9874 2 2 18 VAL CG1 C 6.089 -5.294 -2.109 1.00 . B B . 18 VAL CG1 1 1 13 9875 2 2 18 VAL CG2 C 3.931 -6.269 -1.366 1.00 . B B . 18 VAL CG2 1 1 13 9876 2 2 18 VAL H H 5.169 -7.021 -3.972 1.00 . B B . 18 VAL H 1 1 13 9877 2 2 18 VAL HA H 6.812 -8.087 -1.730 1.00 . B B . 18 VAL HA 1 1 13 9878 2 2 18 VAL HB H 5.816 -6.474 -0.350 1.00 . B B . 18 VAL HB 1 1 13 9879 2 2 18 VAL HG11 H 6.661 -4.698 -1.416 1.00 . B B . 18 VAL HG11 1 1 13 9880 2 2 18 VAL HG12 H 5.313 -4.690 -2.554 1.00 . B B . 18 VAL HG12 1 1 13 9881 2 2 18 VAL HG13 H 6.739 -5.676 -2.881 1.00 . B B . 18 VAL HG13 1 1 13 9882 2 2 18 VAL HG21 H 3.552 -6.392 -2.370 1.00 . B B . 18 VAL HG21 1 1 13 9883 2 2 18 VAL HG22 H 3.691 -5.279 -1.010 1.00 . B B . 18 VAL HG22 1 1 13 9884 2 2 18 VAL HG23 H 3.477 -7.005 -0.718 1.00 . B B . 18 VAL HG23 1 1 13 9885 2 2 18 VAL N N 5.853 -7.573 -3.541 1.00 . B B . 18 VAL N 1 1 13 9886 2 2 18 VAL O O 5.024 -9.688 -0.878 1.00 . B B . 18 VAL O 1 1 13 9887 2 2 19 CYS C C 2.544 -10.798 -3.285 1.00 . B B . 19 CYS C 1 1 13 9888 2 2 19 CYS CA C 2.635 -9.823 -2.110 1.00 . B B . 19 CYS CA 1 1 13 9889 2 2 19 CYS CB C 1.291 -9.116 -1.924 1.00 . B B . 19 CYS CB 1 1 13 9890 2 2 19 CYS H H 3.534 -8.121 -3.063 1.00 . B B . 19 CYS H 1 1 13 9891 2 2 19 CYS HA H 2.887 -10.358 -1.210 1.00 . B B . 19 CYS HA 1 1 13 9892 2 2 19 CYS HB2 H 1.340 -8.129 -2.360 1.00 . B B . 19 CYS HB2 1 1 13 9893 2 2 19 CYS HB3 H 0.514 -9.686 -2.411 1.00 . B B . 19 CYS HB3 1 1 13 9894 2 2 19 CYS N N 3.685 -8.815 -2.387 1.00 . B B . 19 CYS N 1 1 13 9895 2 2 19 CYS O O 2.207 -11.954 -3.120 1.00 . B B . 19 CYS O 1 1 13 9896 2 2 19 CYS SG S 0.922 -8.978 -0.158 1.00 . B B . 19 CYS SG 1 1 13 9897 2 2 20 GLY C C 1.380 -11.882 -5.711 1.00 . B B . 20 GLY C 1 1 13 9898 2 2 20 GLY CA C 2.766 -11.239 -5.655 1.00 . B B . 20 GLY CA 1 1 13 9899 2 2 20 GLY H H 3.106 -9.403 -4.581 1.00 . B B . 20 GLY H 1 1 13 9900 2 2 20 GLY HA2 H 2.937 -10.665 -6.555 1.00 . B B . 20 GLY HA2 1 1 13 9901 2 2 20 GLY HA3 H 3.515 -12.011 -5.571 1.00 . B B . 20 GLY HA3 1 1 13 9902 2 2 20 GLY N N 2.839 -10.339 -4.471 1.00 . B B . 20 GLY N 1 1 13 9903 2 2 20 GLY O O 0.397 -11.237 -6.015 1.00 . B B . 20 GLY O 1 1 13 9904 2 2 21 GLU C C -0.697 -13.698 -4.068 1.00 . B B . 21 GLU C 1 1 13 9905 2 2 21 GLU CA C -0.035 -13.825 -5.443 1.00 . B B . 21 GLU CA 1 1 13 9906 2 2 21 GLU CB C 0.150 -15.304 -5.791 1.00 . B B . 21 GLU CB 1 1 13 9907 2 2 21 GLU CD C 1.249 -17.444 -5.117 1.00 . B B . 21 GLU CD 1 1 13 9908 2 2 21 GLU CG C 1.068 -15.966 -4.761 1.00 . B B . 21 GLU CG 1 1 13 9909 2 2 21 GLU H H 2.094 -13.652 -5.165 1.00 . B B . 21 GLU H 1 1 13 9910 2 2 21 GLU HA H -0.660 -13.356 -6.187 1.00 . B B . 21 GLU HA 1 1 13 9911 2 2 21 GLU HB2 H -0.811 -15.797 -5.785 1.00 . B B . 21 GLU HB2 1 1 13 9912 2 2 21 GLU HB3 H 0.592 -15.390 -6.772 1.00 . B B . 21 GLU HB3 1 1 13 9913 2 2 21 GLU HG2 H 2.030 -15.473 -4.767 1.00 . B B . 21 GLU HG2 1 1 13 9914 2 2 21 GLU HG3 H 0.627 -15.886 -3.779 1.00 . B B . 21 GLU HG3 1 1 13 9915 2 2 21 GLU N N 1.291 -13.149 -5.413 1.00 . B B . 21 GLU N 1 1 13 9916 2 2 21 GLU O O -1.764 -14.229 -3.831 1.00 . B B . 21 GLU O 1 1 13 9917 2 2 21 GLU OE1 O 1.034 -17.786 -6.268 1.00 . B B . 21 GLU OE1 1 1 13 9918 2 2 21 GLU OE2 O 1.599 -18.207 -4.233 1.00 . B B . 21 GLU OE2 1 1 13 9919 2 2 22 ARG C C -1.962 -12.016 -1.912 1.00 . B B . 22 ARG C 1 1 13 9920 2 2 22 ARG CA C -0.673 -12.829 -1.804 1.00 . B B . 22 ARG CA 1 1 13 9921 2 2 22 ARG CB C 0.317 -12.096 -0.896 1.00 . B B . 22 ARG CB 1 1 13 9922 2 2 22 ARG CD C 0.562 -14.007 0.694 1.00 . B B . 22 ARG CD 1 1 13 9923 2 2 22 ARG CG C 1.300 -13.102 -0.294 1.00 . B B . 22 ARG CG 1 1 13 9924 2 2 22 ARG CZ C 0.962 -14.928 2.899 1.00 . B B . 22 ARG CZ 1 1 13 9925 2 2 22 ARG H H 0.782 -12.570 -3.369 1.00 . B B . 22 ARG H 1 1 13 9926 2 2 22 ARG HA H -0.894 -13.800 -1.387 1.00 . B B . 22 ARG HA 1 1 13 9927 2 2 22 ARG HB2 H 0.860 -11.365 -1.475 1.00 . B B . 22 ARG HB2 1 1 13 9928 2 2 22 ARG HB3 H -0.221 -11.601 -0.102 1.00 . B B . 22 ARG HB3 1 1 13 9929 2 2 22 ARG HD2 H -0.399 -13.575 0.929 1.00 . B B . 22 ARG HD2 1 1 13 9930 2 2 22 ARG HD3 H 0.421 -14.984 0.253 1.00 . B B . 22 ARG HD3 1 1 13 9931 2 2 22 ARG HE H 2.195 -13.626 2.048 1.00 . B B . 22 ARG HE 1 1 13 9932 2 2 22 ARG HG2 H 1.729 -13.703 -1.083 1.00 . B B . 22 ARG HG2 1 1 13 9933 2 2 22 ARG HG3 H 2.085 -12.572 0.223 1.00 . B B . 22 ARG HG3 1 1 13 9934 2 2 22 ARG HH11 H -0.963 -14.407 2.723 1.00 . B B . 22 ARG HH11 1 1 13 9935 2 2 22 ARG HH12 H -0.614 -15.582 3.947 1.00 . B B . 22 ARG HH12 1 1 13 9936 2 2 22 ARG HH21 H 2.794 -15.635 3.296 1.00 . B B . 22 ARG HH21 1 1 13 9937 2 2 22 ARG HH22 H 1.515 -16.277 4.272 1.00 . B B . 22 ARG HH22 1 1 13 9938 2 2 22 ARG N N -0.076 -12.994 -3.160 1.00 . B B . 22 ARG N 1 1 13 9939 2 2 22 ARG NE N 1.366 -14.137 1.943 1.00 . B B . 22 ARG NE 1 1 13 9940 2 2 22 ARG NH1 N -0.304 -14.976 3.214 1.00 . B B . 22 ARG NH1 1 1 13 9941 2 2 22 ARG NH2 N 1.824 -15.671 3.539 1.00 . B B . 22 ARG NH2 1 1 13 9942 2 2 22 ARG O O -2.765 -11.980 -1.001 1.00 . B B . 22 ARG O 1 1 13 9943 2 2 23 GLY C C -3.243 -9.206 -2.487 1.00 . B B . 23 GLY C 1 1 13 9944 2 2 23 GLY CA C -3.408 -10.553 -3.191 1.00 . B B . 23 GLY CA 1 1 13 9945 2 2 23 GLY H H -1.509 -11.407 -3.745 1.00 . B B . 23 GLY H 1 1 13 9946 2 2 23 GLY HA2 H -3.590 -10.391 -4.244 1.00 . B B . 23 GLY HA2 1 1 13 9947 2 2 23 GLY HA3 H -4.244 -11.081 -2.758 1.00 . B B . 23 GLY HA3 1 1 13 9948 2 2 23 GLY N N -2.169 -11.362 -3.022 1.00 . B B . 23 GLY N 1 1 13 9949 2 2 23 GLY O O -3.577 -9.055 -1.329 1.00 . B B . 23 GLY O 1 1 13 9950 2 2 24 PHE C C -3.604 -5.923 -3.114 1.00 . B B . 24 PHE C 1 1 13 9951 2 2 24 PHE CA C -2.564 -6.885 -2.547 1.00 . B B . 24 PHE CA 1 1 13 9952 2 2 24 PHE CB C -1.156 -6.355 -2.829 1.00 . B B . 24 PHE CB 1 1 13 9953 2 2 24 PHE CD1 C -0.605 -7.370 -5.069 1.00 . B B . 24 PHE CD1 1 1 13 9954 2 2 24 PHE CD2 C -1.086 -4.994 -4.952 1.00 . B B . 24 PHE CD2 1 1 13 9955 2 2 24 PHE CE1 C -0.407 -7.262 -6.452 1.00 . B B . 24 PHE CE1 1 1 13 9956 2 2 24 PHE CE2 C -0.886 -4.885 -6.335 1.00 . B B . 24 PHE CE2 1 1 13 9957 2 2 24 PHE CG C -0.945 -6.237 -4.319 1.00 . B B . 24 PHE CG 1 1 13 9958 2 2 24 PHE CZ C -0.547 -6.020 -7.085 1.00 . B B . 24 PHE CZ 1 1 13 9959 2 2 24 PHE H H -2.483 -8.361 -4.114 1.00 . B B . 24 PHE H 1 1 13 9960 2 2 24 PHE HA H -2.711 -6.975 -1.486 1.00 . B B . 24 PHE HA 1 1 13 9961 2 2 24 PHE HB2 H -1.039 -5.383 -2.371 1.00 . B B . 24 PHE HB2 1 1 13 9962 2 2 24 PHE HB3 H -0.427 -7.036 -2.417 1.00 . B B . 24 PHE HB3 1 1 13 9963 2 2 24 PHE HD1 H -0.498 -8.327 -4.582 1.00 . B B . 24 PHE HD1 1 1 13 9964 2 2 24 PHE HD2 H -1.347 -4.120 -4.374 1.00 . B B . 24 PHE HD2 1 1 13 9965 2 2 24 PHE HE1 H -0.145 -8.137 -7.030 1.00 . B B . 24 PHE HE1 1 1 13 9966 2 2 24 PHE HE2 H -0.994 -3.928 -6.823 1.00 . B B . 24 PHE HE2 1 1 13 9967 2 2 24 PHE HZ H -0.392 -5.937 -8.151 1.00 . B B . 24 PHE HZ 1 1 13 9968 2 2 24 PHE N N -2.739 -8.222 -3.180 1.00 . B B . 24 PHE N 1 1 13 9969 2 2 24 PHE O O -3.620 -5.638 -4.295 1.00 . B B . 24 PHE O 1 1 13 9970 2 2 25 PHE C C -5.198 -3.062 -2.479 1.00 . B B . 25 PHE C 1 1 13 9971 2 2 25 PHE CA C -5.539 -4.520 -2.798 1.00 . B B . 25 PHE CA 1 1 13 9972 2 2 25 PHE CB C -6.884 -4.873 -2.159 1.00 . B B . 25 PHE CB 1 1 13 9973 2 2 25 PHE CD1 C -6.310 -5.759 0.132 1.00 . B B . 25 PHE CD1 1 1 13 9974 2 2 25 PHE CD2 C -7.188 -3.505 -0.064 1.00 . B B . 25 PHE CD2 1 1 13 9975 2 2 25 PHE CE1 C -6.226 -5.604 1.523 1.00 . B B . 25 PHE CE1 1 1 13 9976 2 2 25 PHE CE2 C -7.104 -3.350 1.325 1.00 . B B . 25 PHE CE2 1 1 13 9977 2 2 25 PHE CG C -6.791 -4.709 -0.661 1.00 . B B . 25 PHE CG 1 1 13 9978 2 2 25 PHE CZ C -6.623 -4.399 2.119 1.00 . B B . 25 PHE CZ 1 1 13 9979 2 2 25 PHE H H -4.473 -5.693 -1.342 1.00 . B B . 25 PHE H 1 1 13 9980 2 2 25 PHE HA H -5.612 -4.640 -3.865 1.00 . B B . 25 PHE HA 1 1 13 9981 2 2 25 PHE HB2 H -7.650 -4.216 -2.547 1.00 . B B . 25 PHE HB2 1 1 13 9982 2 2 25 PHE HB3 H -7.136 -5.896 -2.393 1.00 . B B . 25 PHE HB3 1 1 13 9983 2 2 25 PHE HD1 H -6.005 -6.686 -0.326 1.00 . B B . 25 PHE HD1 1 1 13 9984 2 2 25 PHE HD2 H -7.559 -2.695 -0.676 1.00 . B B . 25 PHE HD2 1 1 13 9985 2 2 25 PHE HE1 H -5.857 -6.413 2.135 1.00 . B B . 25 PHE HE1 1 1 13 9986 2 2 25 PHE HE2 H -7.411 -2.421 1.785 1.00 . B B . 25 PHE HE2 1 1 13 9987 2 2 25 PHE HZ H -6.560 -4.280 3.191 1.00 . B B . 25 PHE HZ 1 1 13 9988 2 2 25 PHE N N -4.490 -5.439 -2.288 1.00 . B B . 25 PHE N 1 1 13 9989 2 2 25 PHE O O -5.071 -2.676 -1.334 1.00 . B B . 25 PHE O 1 1 13 9990 2 2 26 TYR C C -6.057 -0.008 -3.670 1.00 . B B . 26 TYR C 1 1 13 9991 2 2 26 TYR CA C -4.803 -0.797 -3.268 1.00 . B B . 26 TYR CA 1 1 13 9992 2 2 26 TYR CB C -3.599 -0.370 -4.128 1.00 . B B . 26 TYR CB 1 1 13 9993 2 2 26 TYR CD1 C -4.506 -0.885 -6.425 1.00 . B B . 26 TYR CD1 1 1 13 9994 2 2 26 TYR CD2 C -4.065 1.427 -5.837 1.00 . B B . 26 TYR CD2 1 1 13 9995 2 2 26 TYR CE1 C -4.950 -0.479 -7.690 1.00 . B B . 26 TYR CE1 1 1 13 9996 2 2 26 TYR CE2 C -4.508 1.834 -7.101 1.00 . B B . 26 TYR CE2 1 1 13 9997 2 2 26 TYR CG C -4.064 0.067 -5.500 1.00 . B B . 26 TYR CG 1 1 13 9998 2 2 26 TYR CZ C -4.951 0.881 -8.028 1.00 . B B . 26 TYR CZ 1 1 13 9999 2 2 26 TYR H H -5.225 -2.576 -4.402 1.00 . B B . 26 TYR H 1 1 13 10000 2 2 26 TYR HA H -4.586 -0.625 -2.223 1.00 . B B . 26 TYR HA 1 1 13 10001 2 2 26 TYR HB2 H -3.086 0.449 -3.646 1.00 . B B . 26 TYR HB2 1 1 13 10002 2 2 26 TYR HB3 H -2.921 -1.204 -4.230 1.00 . B B . 26 TYR HB3 1 1 13 10003 2 2 26 TYR HD1 H -4.506 -1.933 -6.164 1.00 . B B . 26 TYR HD1 1 1 13 10004 2 2 26 TYR HD2 H -3.725 2.160 -5.122 1.00 . B B . 26 TYR HD2 1 1 13 10005 2 2 26 TYR HE1 H -5.293 -1.214 -8.402 1.00 . B B . 26 TYR HE1 1 1 13 10006 2 2 26 TYR HE2 H -4.509 2.882 -7.359 1.00 . B B . 26 TYR HE2 1 1 13 10007 2 2 26 TYR HH H -5.362 0.519 -9.858 1.00 . B B . 26 TYR HH 1 1 13 10008 2 2 26 TYR N N -5.088 -2.243 -3.490 1.00 . B B . 26 TYR N 1 1 13 10009 2 2 26 TYR O O -6.001 1.167 -3.977 1.00 . B B . 26 TYR O 1 1 13 10010 2 2 26 TYR OH O -5.388 1.281 -9.275 1.00 . B B . 26 TYR OH 1 1 13 10011 2 2 27 THR C C -8.505 1.435 -3.756 1.00 . B B . 27 THR C 1 1 13 10012 2 2 27 THR CA C -8.472 -0.057 -4.088 1.00 . B B . 27 THR CA 1 1 13 10013 2 2 27 THR CB C -9.604 -0.794 -3.356 1.00 . B B . 27 THR CB 1 1 13 10014 2 2 27 THR CG2 C -9.964 -0.098 -2.037 1.00 . B B . 27 THR CG2 1 1 13 10015 2 2 27 THR H H -7.166 -1.632 -3.454 1.00 . B B . 27 THR H 1 1 13 10016 2 2 27 THR HA H -8.608 -0.182 -5.151 1.00 . B B . 27 THR HA 1 1 13 10017 2 2 27 THR HB H -9.275 -1.793 -3.138 1.00 . B B . 27 THR HB 1 1 13 10018 2 2 27 THR HG1 H -11.520 -0.997 -3.632 1.00 . B B . 27 THR HG1 1 1 13 10019 2 2 27 THR HG21 H -10.290 0.911 -2.238 1.00 . B B . 27 THR HG21 1 1 13 10020 2 2 27 THR HG22 H -9.097 -0.077 -1.394 1.00 . B B . 27 THR HG22 1 1 13 10021 2 2 27 THR HG23 H -10.760 -0.644 -1.549 1.00 . B B . 27 THR HG23 1 1 13 10022 2 2 27 THR N N -7.177 -0.683 -3.690 1.00 . B B . 27 THR N 1 1 13 10023 2 2 27 THR O O -9.058 2.213 -4.503 1.00 . B B . 27 THR O 1 1 13 10024 2 2 27 THR OG1 O -10.753 -0.846 -4.190 1.00 . B B . 27 THR OG1 1 1 13 10025 2 2 28 LYS C C -8.962 4.078 -2.972 1.00 . B B . 28 LYS C 1 1 13 10026 2 2 28 LYS CA C -7.915 3.256 -2.204 1.00 . B B . 28 LYS CA 1 1 13 10027 2 2 28 LYS CB C -6.533 3.858 -2.449 1.00 . B B . 28 LYS CB 1 1 13 10028 2 2 28 LYS CD C -6.876 6.340 -2.553 1.00 . B B . 28 LYS CD 1 1 13 10029 2 2 28 LYS CE C -5.760 6.722 -3.523 1.00 . B B . 28 LYS CE 1 1 13 10030 2 2 28 LYS CG C -6.417 5.174 -1.675 1.00 . B B . 28 LYS CG 1 1 13 10031 2 2 28 LYS H H -7.494 1.137 -2.076 1.00 . B B . 28 LYS H 1 1 13 10032 2 2 28 LYS HA H -8.132 3.301 -1.147 1.00 . B B . 28 LYS HA 1 1 13 10033 2 2 28 LYS HB2 H -5.775 3.168 -2.107 1.00 . B B . 28 LYS HB2 1 1 13 10034 2 2 28 LYS HB3 H -6.400 4.049 -3.503 1.00 . B B . 28 LYS HB3 1 1 13 10035 2 2 28 LYS HD2 H -7.754 6.053 -3.110 1.00 . B B . 28 LYS HD2 1 1 13 10036 2 2 28 LYS HD3 H -7.110 7.190 -1.928 1.00 . B B . 28 LYS HD3 1 1 13 10037 2 2 28 LYS HE2 H -4.822 6.323 -3.168 1.00 . B B . 28 LYS HE2 1 1 13 10038 2 2 28 LYS HE3 H -5.978 6.316 -4.501 1.00 . B B . 28 LYS HE3 1 1 13 10039 2 2 28 LYS HG2 H -7.034 5.124 -0.790 1.00 . B B . 28 LYS HG2 1 1 13 10040 2 2 28 LYS HG3 H -5.393 5.328 -1.387 1.00 . B B . 28 LYS HG3 1 1 13 10041 2 2 28 LYS HZ1 H -4.896 8.543 -3.003 1.00 . B B . 28 LYS HZ1 1 1 13 10042 2 2 28 LYS HZ2 H -6.568 8.626 -3.291 1.00 . B B . 28 LYS HZ2 1 1 13 10043 2 2 28 LYS HZ3 H -5.485 8.488 -4.593 1.00 . B B . 28 LYS HZ3 1 1 13 10044 2 2 28 LYS N N -7.927 1.815 -2.641 1.00 . B B . 28 LYS N 1 1 13 10045 2 2 28 LYS NZ N -5.671 8.207 -3.609 1.00 . B B . 28 LYS NZ 1 1 13 10046 2 2 28 LYS O O -8.731 4.465 -4.101 1.00 . B B . 28 LYS O 1 1 13 10047 2 2 29 PRO C C -10.868 6.581 -2.964 1.00 . B B . 29 PRO C 1 1 13 10048 2 2 29 PRO CA C -11.187 5.082 -2.957 1.00 . B B . 29 PRO CA 1 1 13 10049 2 2 29 PRO CB C -12.383 4.774 -2.052 1.00 . B B . 29 PRO CB 1 1 13 10050 2 2 29 PRO CD C -10.358 3.855 -0.967 1.00 . B B . 29 PRO CD 1 1 13 10051 2 2 29 PRO CG C -11.796 4.334 -0.690 1.00 . B B . 29 PRO CG 1 1 13 10052 2 2 29 PRO HA H -11.382 4.730 -3.957 1.00 . B B . 29 PRO HA 1 1 13 10053 2 2 29 PRO HB2 H -12.992 5.660 -1.930 1.00 . B B . 29 PRO HB2 1 1 13 10054 2 2 29 PRO HB3 H -12.970 3.972 -2.471 1.00 . B B . 29 PRO HB3 1 1 13 10055 2 2 29 PRO HD2 H -9.668 4.309 -0.269 1.00 . B B . 29 PRO HD2 1 1 13 10056 2 2 29 PRO HD3 H -10.299 2.779 -0.916 1.00 . B B . 29 PRO HD3 1 1 13 10057 2 2 29 PRO HG2 H -11.785 5.170 -0.006 1.00 . B B . 29 PRO HG2 1 1 13 10058 2 2 29 PRO HG3 H -12.377 3.523 -0.279 1.00 . B B . 29 PRO HG3 1 1 13 10059 2 2 29 PRO N N -10.084 4.317 -2.344 1.00 . B B . 29 PRO N 1 1 13 10060 2 2 29 PRO O O -11.549 7.373 -2.343 1.00 . B B . 29 PRO O 1 1 13 10061 2 2 30 THR C C -9.616 9.046 -2.341 1.00 . B B . 30 THR C 1 1 13 10062 2 2 30 THR CA C -9.468 8.416 -3.727 1.00 . B B . 30 THR CA 1 1 13 10063 2 2 30 THR CB C -10.384 9.140 -4.719 1.00 . B B . 30 THR CB 1 1 13 10064 2 2 30 THR CG2 C -9.537 10.003 -5.656 1.00 . B B . 30 THR CG2 1 1 13 10065 2 2 30 THR H H -9.309 6.312 -4.163 1.00 . B B . 30 THR H 1 1 13 10066 2 2 30 THR HA H -8.444 8.507 -4.054 1.00 . B B . 30 THR HA 1 1 13 10067 2 2 30 THR HB H -11.074 9.771 -4.180 1.00 . B B . 30 THR HB 1 1 13 10068 2 2 30 THR HG1 H -10.492 7.507 -5.772 1.00 . B B . 30 THR HG1 1 1 13 10069 2 2 30 THR HG21 H -9.115 9.383 -6.433 1.00 . B B . 30 THR HG21 1 1 13 10070 2 2 30 THR HG22 H -8.741 10.470 -5.095 1.00 . B B . 30 THR HG22 1 1 13 10071 2 2 30 THR HG23 H -10.158 10.766 -6.102 1.00 . B B . 30 THR HG23 1 1 13 10072 2 2 30 THR N N -9.839 6.972 -3.668 1.00 . B B . 30 THR N 1 1 13 10073 2 2 30 THR O O -10.672 9.594 -2.071 1.00 . B B . 30 THR O 1 1 13 10074 2 2 30 THR OXT O -8.671 8.970 -1.574 1.00 . B B . 30 THR OXT 1 1 13 10075 2 2 30 THR OG1 O -11.108 8.182 -5.478 1.00 . B B . 30 THR OG1 1 1 14 10076 1 1 1 GLY C C -3.628 7.433 0.441 1.00 . A A . 1 GLY C 1 1 14 10077 1 1 1 GLY CA C -5.066 7.806 0.562 1.00 . A A . 1 GLY CA 1 1 14 10078 1 1 1 GLY H1 H -6.410 9.311 1.201 1.00 . A A . 1 GLY H1 1 1 14 10079 1 1 1 GLY H2 H -4.775 9.726 1.406 1.00 . A A . 1 GLY H2 1 1 14 10080 1 1 1 GLY H3 H -5.511 8.620 2.465 1.00 . A A . 1 GLY H3 1 1 14 10081 1 1 1 GLY HA2 H -5.141 6.947 1.016 1.00 . A A . 1 GLY HA2 1 1 14 10082 1 1 1 GLY HA3 H -5.736 7.880 -0.391 1.00 . A A . 1 GLY HA3 1 1 14 10083 1 1 1 GLY N N -5.473 8.958 1.482 1.00 . A A . 1 GLY N 1 1 14 10084 1 1 1 GLY O O -2.758 8.087 0.983 1.00 . A A . 1 GLY O 1 1 14 10085 1 1 2 ILE C C -1.482 6.332 -1.864 1.00 . A A . 2 ILE C 1 1 14 10086 1 1 2 ILE CA C -1.922 5.963 -0.452 1.00 . A A . 2 ILE CA 1 1 14 10087 1 1 2 ILE CB C -1.809 4.451 -0.257 1.00 . A A . 2 ILE CB 1 1 14 10088 1 1 2 ILE CD1 C -0.223 2.527 -0.499 1.00 . A A . 2 ILE CD1 1 1 14 10089 1 1 2 ILE CG1 C -0.333 4.038 -0.291 1.00 . A A . 2 ILE CG1 1 1 14 10090 1 1 2 ILE CG2 C -2.570 3.745 -1.378 1.00 . A A . 2 ILE CG2 1 1 14 10091 1 1 2 ILE H H -4.056 5.878 -0.717 1.00 . A A . 2 ILE H 1 1 14 10092 1 1 2 ILE HA H -1.300 6.470 0.268 1.00 . A A . 2 ILE HA 1 1 14 10093 1 1 2 ILE HB H -2.240 4.179 0.696 1.00 . A A . 2 ILE HB 1 1 14 10094 1 1 2 ILE HD11 H -0.965 2.027 0.106 1.00 . A A . 2 ILE HD11 1 1 14 10095 1 1 2 ILE HD12 H 0.762 2.193 -0.209 1.00 . A A . 2 ILE HD12 1 1 14 10096 1 1 2 ILE HD13 H -0.391 2.293 -1.540 1.00 . A A . 2 ILE HD13 1 1 14 10097 1 1 2 ILE HG12 H 0.167 4.549 -1.101 1.00 . A A . 2 ILE HG12 1 1 14 10098 1 1 2 ILE HG13 H 0.136 4.303 0.644 1.00 . A A . 2 ILE HG13 1 1 14 10099 1 1 2 ILE HG21 H -2.036 3.870 -2.309 1.00 . A A . 2 ILE HG21 1 1 14 10100 1 1 2 ILE HG22 H -3.557 4.175 -1.468 1.00 . A A . 2 ILE HG22 1 1 14 10101 1 1 2 ILE HG23 H -2.655 2.694 -1.149 1.00 . A A . 2 ILE HG23 1 1 14 10102 1 1 2 ILE N N -3.339 6.384 -0.279 1.00 . A A . 2 ILE N 1 1 14 10103 1 1 2 ILE O O -0.347 6.690 -2.107 1.00 . A A . 2 ILE O 1 1 14 10104 1 1 3 VAL C C -1.385 7.972 -4.249 1.00 . A A . 3 VAL C 1 1 14 10105 1 1 3 VAL CA C -2.062 6.600 -4.202 1.00 . A A . 3 VAL CA 1 1 14 10106 1 1 3 VAL CB C -3.357 6.651 -5.009 1.00 . A A . 3 VAL CB 1 1 14 10107 1 1 3 VAL CG1 C -3.059 7.164 -6.415 1.00 . A A . 3 VAL CG1 1 1 14 10108 1 1 3 VAL CG2 C -3.965 5.248 -5.090 1.00 . A A . 3 VAL CG2 1 1 14 10109 1 1 3 VAL H H -3.297 5.966 -2.563 1.00 . A A . 3 VAL H 1 1 14 10110 1 1 3 VAL HA H -1.403 5.852 -4.619 1.00 . A A . 3 VAL HA 1 1 14 10111 1 1 3 VAL HB H -4.055 7.319 -4.525 1.00 . A A . 3 VAL HB 1 1 14 10112 1 1 3 VAL HG11 H -2.077 6.831 -6.718 1.00 . A A . 3 VAL HG11 1 1 14 10113 1 1 3 VAL HG12 H -3.090 8.243 -6.417 1.00 . A A . 3 VAL HG12 1 1 14 10114 1 1 3 VAL HG13 H -3.798 6.780 -7.101 1.00 . A A . 3 VAL HG13 1 1 14 10115 1 1 3 VAL HG21 H -4.893 5.225 -4.539 1.00 . A A . 3 VAL HG21 1 1 14 10116 1 1 3 VAL HG22 H -3.277 4.532 -4.665 1.00 . A A . 3 VAL HG22 1 1 14 10117 1 1 3 VAL HG23 H -4.155 4.995 -6.123 1.00 . A A . 3 VAL HG23 1 1 14 10118 1 1 3 VAL N N -2.389 6.254 -2.794 1.00 . A A . 3 VAL N 1 1 14 10119 1 1 3 VAL O O -0.521 8.221 -5.066 1.00 . A A . 3 VAL O 1 1 14 10120 1 1 4 GLU C C -0.016 10.273 -2.373 1.00 . A A . 4 GLU C 1 1 14 10121 1 1 4 GLU CA C -1.165 10.225 -3.384 1.00 . A A . 4 GLU CA 1 1 14 10122 1 1 4 GLU CB C -2.223 11.261 -3.002 1.00 . A A . 4 GLU CB 1 1 14 10123 1 1 4 GLU CD C -2.218 13.515 -4.083 1.00 . A A . 4 GLU CD 1 1 14 10124 1 1 4 GLU CG C -1.594 12.655 -2.984 1.00 . A A . 4 GLU CG 1 1 14 10125 1 1 4 GLU H H -2.481 8.648 -2.735 1.00 . A A . 4 GLU H 1 1 14 10126 1 1 4 GLU HA H -0.784 10.447 -4.370 1.00 . A A . 4 GLU HA 1 1 14 10127 1 1 4 GLU HB2 H -3.026 11.237 -3.725 1.00 . A A . 4 GLU HB2 1 1 14 10128 1 1 4 GLU HB3 H -2.614 11.032 -2.021 1.00 . A A . 4 GLU HB3 1 1 14 10129 1 1 4 GLU HG2 H -1.769 13.116 -2.022 1.00 . A A . 4 GLU HG2 1 1 14 10130 1 1 4 GLU HG3 H -0.532 12.571 -3.155 1.00 . A A . 4 GLU HG3 1 1 14 10131 1 1 4 GLU N N -1.778 8.867 -3.383 1.00 . A A . 4 GLU N 1 1 14 10132 1 1 4 GLU O O 0.984 10.927 -2.587 1.00 . A A . 4 GLU O 1 1 14 10133 1 1 4 GLU OE1 O -3.274 13.146 -4.572 1.00 . A A . 4 GLU OE1 1 1 14 10134 1 1 4 GLU OE2 O -1.631 14.531 -4.419 1.00 . A A . 4 GLU OE2 1 1 14 10135 1 1 5 GLN C C 2.109 8.765 -0.730 1.00 . A A . 5 GLN C 1 1 14 10136 1 1 5 GLN CA C 0.924 9.603 -0.244 1.00 . A A . 5 GLN CA 1 1 14 10137 1 1 5 GLN CB C 0.389 9.016 1.065 1.00 . A A . 5 GLN CB 1 1 14 10138 1 1 5 GLN CD C -0.533 9.565 3.321 1.00 . A A . 5 GLN CD 1 1 14 10139 1 1 5 GLN CG C -0.066 10.149 1.986 1.00 . A A . 5 GLN CG 1 1 14 10140 1 1 5 GLN H H -0.974 9.073 -1.114 1.00 . A A . 5 GLN H 1 1 14 10141 1 1 5 GLN HA H 1.248 10.620 -0.077 1.00 . A A . 5 GLN HA 1 1 14 10142 1 1 5 GLN HB2 H -0.446 8.366 0.852 1.00 . A A . 5 GLN HB2 1 1 14 10143 1 1 5 GLN HB3 H 1.171 8.452 1.551 1.00 . A A . 5 GLN HB3 1 1 14 10144 1 1 5 GLN HE21 H 0.973 8.278 3.446 1.00 . A A . 5 GLN HE21 1 1 14 10145 1 1 5 GLN HE22 H -0.130 8.232 4.735 1.00 . A A . 5 GLN HE22 1 1 14 10146 1 1 5 GLN HG2 H 0.758 10.827 2.158 1.00 . A A . 5 GLN HG2 1 1 14 10147 1 1 5 GLN HG3 H -0.882 10.683 1.523 1.00 . A A . 5 GLN HG3 1 1 14 10148 1 1 5 GLN N N -0.157 9.591 -1.269 1.00 . A A . 5 GLN N 1 1 14 10149 1 1 5 GLN NE2 N 0.162 8.613 3.880 1.00 . A A . 5 GLN NE2 1 1 14 10150 1 1 5 GLN O O 3.254 9.138 -0.561 1.00 . A A . 5 GLN O 1 1 14 10151 1 1 5 GLN OE1 O -1.540 9.980 3.858 1.00 . A A . 5 GLN OE1 1 1 14 10152 1 1 6 CYS C C 3.671 7.483 -2.980 1.00 . A A . 6 CYS C 1 1 14 10153 1 1 6 CYS CA C 2.967 6.782 -1.820 1.00 . A A . 6 CYS CA 1 1 14 10154 1 1 6 CYS CB C 2.418 5.438 -2.301 1.00 . A A . 6 CYS CB 1 1 14 10155 1 1 6 CYS H H 0.920 7.350 -1.455 1.00 . A A . 6 CYS H 1 1 14 10156 1 1 6 CYS HA H 3.671 6.618 -1.018 1.00 . A A . 6 CYS HA 1 1 14 10157 1 1 6 CYS HB2 H 1.350 5.510 -2.432 1.00 . A A . 6 CYS HB2 1 1 14 10158 1 1 6 CYS HB3 H 2.879 5.179 -3.241 1.00 . A A . 6 CYS HB3 1 1 14 10159 1 1 6 CYS N N 1.849 7.636 -1.329 1.00 . A A . 6 CYS N 1 1 14 10160 1 1 6 CYS O O 4.855 7.313 -3.195 1.00 . A A . 6 CYS O 1 1 14 10161 1 1 6 CYS SG S 2.789 4.156 -1.076 1.00 . A A . 6 CYS SG 1 1 14 10162 1 1 7 CYS C C 4.117 10.333 -4.413 1.00 . A A . 7 CYS C 1 1 14 10163 1 1 7 CYS CA C 3.588 8.975 -4.881 1.00 . A A . 7 CYS CA 1 1 14 10164 1 1 7 CYS CB C 2.557 9.180 -5.994 1.00 . A A . 7 CYS CB 1 1 14 10165 1 1 7 CYS H H 2.000 8.394 -3.549 1.00 . A A . 7 CYS H 1 1 14 10166 1 1 7 CYS HA H 4.407 8.379 -5.254 1.00 . A A . 7 CYS HA 1 1 14 10167 1 1 7 CYS HB2 H 1.917 8.313 -6.057 1.00 . A A . 7 CYS HB2 1 1 14 10168 1 1 7 CYS HB3 H 1.960 10.053 -5.776 1.00 . A A . 7 CYS HB3 1 1 14 10169 1 1 7 CYS N N 2.953 8.269 -3.735 1.00 . A A . 7 CYS N 1 1 14 10170 1 1 7 CYS O O 5.249 10.690 -4.676 1.00 . A A . 7 CYS O 1 1 14 10171 1 1 7 CYS SG S 3.413 9.414 -7.574 1.00 . A A . 7 CYS SG 1 1 14 10172 1 1 8 THR C C 4.757 12.202 -2.070 1.00 . A A . 8 THR C 1 1 14 10173 1 1 8 THR CA C 3.789 12.418 -3.231 1.00 . A A . 8 THR CA 1 1 14 10174 1 1 8 THR CB C 2.598 13.251 -2.755 1.00 . A A . 8 THR CB 1 1 14 10175 1 1 8 THR CG2 C 3.097 14.588 -2.207 1.00 . A A . 8 THR CG2 1 1 14 10176 1 1 8 THR H H 2.407 10.788 -3.506 1.00 . A A . 8 THR H 1 1 14 10177 1 1 8 THR HA H 4.296 12.936 -4.033 1.00 . A A . 8 THR HA 1 1 14 10178 1 1 8 THR HB H 2.075 12.720 -1.975 1.00 . A A . 8 THR HB 1 1 14 10179 1 1 8 THR HG1 H 1.302 14.338 -3.715 1.00 . A A . 8 THR HG1 1 1 14 10180 1 1 8 THR HG21 H 2.307 15.065 -1.648 1.00 . A A . 8 THR HG21 1 1 14 10181 1 1 8 THR HG22 H 3.394 15.224 -3.027 1.00 . A A . 8 THR HG22 1 1 14 10182 1 1 8 THR HG23 H 3.944 14.416 -1.558 1.00 . A A . 8 THR HG23 1 1 14 10183 1 1 8 THR N N 3.315 11.091 -3.716 1.00 . A A . 8 THR N 1 1 14 10184 1 1 8 THR O O 5.565 13.053 -1.750 1.00 . A A . 8 THR O 1 1 14 10185 1 1 8 THR OG1 O 1.717 13.482 -3.845 1.00 . A A . 8 THR OG1 1 1 14 10186 1 1 9 SER C C 6.232 9.395 -0.510 1.00 . A A . 9 SER C 1 1 14 10187 1 1 9 SER CA C 5.600 10.772 -0.303 1.00 . A A . 9 SER CA 1 1 14 10188 1 1 9 SER CB C 4.814 10.783 1.008 1.00 . A A . 9 SER CB 1 1 14 10189 1 1 9 SER H H 4.028 10.391 -1.723 1.00 . A A . 9 SER H 1 1 14 10190 1 1 9 SER HA H 6.376 11.522 -0.266 1.00 . A A . 9 SER HA 1 1 14 10191 1 1 9 SER HB2 H 3.774 10.979 0.805 1.00 . A A . 9 SER HB2 1 1 14 10192 1 1 9 SER HB3 H 4.907 9.819 1.490 1.00 . A A . 9 SER HB3 1 1 14 10193 1 1 9 SER HG H 6.182 11.517 2.181 1.00 . A A . 9 SER HG 1 1 14 10194 1 1 9 SER N N 4.684 11.062 -1.441 1.00 . A A . 9 SER N 1 1 14 10195 1 1 9 SER O O 5.935 8.700 -1.461 1.00 . A A . 9 SER O 1 1 14 10196 1 1 9 SER OG O 5.326 11.803 1.855 1.00 . A A . 9 SER OG 1 1 14 10197 1 1 10 ILE C C 7.090 6.655 1.152 1.00 . A A . 10 ILE C 1 1 14 10198 1 1 10 ILE CA C 7.761 7.669 0.223 1.00 . A A . 10 ILE CA 1 1 14 10199 1 1 10 ILE CB C 9.238 7.793 0.592 1.00 . A A . 10 ILE CB 1 1 14 10200 1 1 10 ILE CD1 C 10.038 7.775 -1.773 1.00 . A A . 10 ILE CD1 1 1 14 10201 1 1 10 ILE CG1 C 9.966 8.597 -0.485 1.00 . A A . 10 ILE CG1 1 1 14 10202 1 1 10 ILE CG2 C 9.857 6.401 0.696 1.00 . A A . 10 ILE CG2 1 1 14 10203 1 1 10 ILE H H 7.336 9.573 1.130 1.00 . A A . 10 ILE H 1 1 14 10204 1 1 10 ILE HA H 7.673 7.334 -0.799 1.00 . A A . 10 ILE HA 1 1 14 10205 1 1 10 ILE HB H 9.330 8.298 1.541 1.00 . A A . 10 ILE HB 1 1 14 10206 1 1 10 ILE HD11 H 10.380 6.776 -1.544 1.00 . A A . 10 ILE HD11 1 1 14 10207 1 1 10 ILE HD12 H 10.727 8.244 -2.459 1.00 . A A . 10 ILE HD12 1 1 14 10208 1 1 10 ILE HD13 H 9.058 7.726 -2.223 1.00 . A A . 10 ILE HD13 1 1 14 10209 1 1 10 ILE HG12 H 9.429 9.515 -0.673 1.00 . A A . 10 ILE HG12 1 1 14 10210 1 1 10 ILE HG13 H 10.966 8.826 -0.150 1.00 . A A . 10 ILE HG13 1 1 14 10211 1 1 10 ILE HG21 H 9.422 5.758 -0.054 1.00 . A A . 10 ILE HG21 1 1 14 10212 1 1 10 ILE HG22 H 9.664 5.993 1.677 1.00 . A A . 10 ILE HG22 1 1 14 10213 1 1 10 ILE HG23 H 10.921 6.473 0.538 1.00 . A A . 10 ILE HG23 1 1 14 10214 1 1 10 ILE N N 7.106 8.997 0.371 1.00 . A A . 10 ILE N 1 1 14 10215 1 1 10 ILE O O 6.713 6.974 2.263 1.00 . A A . 10 ILE O 1 1 14 10216 1 1 11 CYS C C 7.167 3.136 1.580 1.00 . A A . 11 CYS C 1 1 14 10217 1 1 11 CYS CA C 6.311 4.402 1.588 1.00 . A A . 11 CYS CA 1 1 14 10218 1 1 11 CYS CB C 4.897 4.066 1.090 1.00 . A A . 11 CYS CB 1 1 14 10219 1 1 11 CYS H H 7.265 5.191 -0.181 1.00 . A A . 11 CYS H 1 1 14 10220 1 1 11 CYS HA H 6.252 4.782 2.598 1.00 . A A . 11 CYS HA 1 1 14 10221 1 1 11 CYS HB2 H 4.690 3.024 1.281 1.00 . A A . 11 CYS HB2 1 1 14 10222 1 1 11 CYS HB3 H 4.178 4.675 1.621 1.00 . A A . 11 CYS HB3 1 1 14 10223 1 1 11 CYS N N 6.947 5.433 0.715 1.00 . A A . 11 CYS N 1 1 14 10224 1 1 11 CYS O O 7.346 2.500 0.559 1.00 . A A . 11 CYS O 1 1 14 10225 1 1 11 CYS SG S 4.759 4.384 -0.689 1.00 . A A . 11 CYS SG 1 1 14 10226 1 1 12 SER C C 7.672 0.303 2.884 1.00 . A A . 12 SER C 1 1 14 10227 1 1 12 SER CA C 8.556 1.546 2.773 1.00 . A A . 12 SER CA 1 1 14 10228 1 1 12 SER CB C 9.470 1.631 3.995 1.00 . A A . 12 SER CB 1 1 14 10229 1 1 12 SER H H 7.551 3.297 3.520 1.00 . A A . 12 SER H 1 1 14 10230 1 1 12 SER HA H 9.157 1.482 1.878 1.00 . A A . 12 SER HA 1 1 14 10231 1 1 12 SER HB2 H 9.261 0.811 4.661 1.00 . A A . 12 SER HB2 1 1 14 10232 1 1 12 SER HB3 H 10.501 1.578 3.675 1.00 . A A . 12 SER HB3 1 1 14 10233 1 1 12 SER HG H 9.895 3.490 4.381 1.00 . A A . 12 SER HG 1 1 14 10234 1 1 12 SER N N 7.705 2.767 2.711 1.00 . A A . 12 SER N 1 1 14 10235 1 1 12 SER O O 6.497 0.393 3.172 1.00 . A A . 12 SER O 1 1 14 10236 1 1 12 SER OG O 9.234 2.858 4.672 1.00 . A A . 12 SER OG 1 1 14 10237 1 1 13 LEU C C 6.357 -2.042 3.757 1.00 . A A . 13 LEU C 1 1 14 10238 1 1 13 LEU CA C 7.466 -2.127 2.709 1.00 . A A . 13 LEU CA 1 1 14 10239 1 1 13 LEU CB C 8.404 -3.277 3.066 1.00 . A A . 13 LEU CB 1 1 14 10240 1 1 13 LEU CD1 C 6.802 -4.775 1.876 1.00 . A A . 13 LEU CD1 1 1 14 10241 1 1 13 LEU CD2 C 8.563 -5.751 3.352 1.00 . A A . 13 LEU CD2 1 1 14 10242 1 1 13 LEU CG C 7.603 -4.575 3.163 1.00 . A A . 13 LEU CG 1 1 14 10243 1 1 13 LEU H H 9.185 -0.881 2.393 1.00 . A A . 13 LEU H 1 1 14 10244 1 1 13 LEU HA H 7.030 -2.318 1.753 1.00 . A A . 13 LEU HA 1 1 14 10245 1 1 13 LEU HB2 H 9.157 -3.375 2.299 1.00 . A A . 13 LEU HB2 1 1 14 10246 1 1 13 LEU HB3 H 8.877 -3.077 4.014 1.00 . A A . 13 LEU HB3 1 1 14 10247 1 1 13 LEU HD11 H 6.327 -5.745 1.894 1.00 . A A . 13 LEU HD11 1 1 14 10248 1 1 13 LEU HD12 H 7.466 -4.713 1.026 1.00 . A A . 13 LEU HD12 1 1 14 10249 1 1 13 LEU HD13 H 6.047 -4.006 1.799 1.00 . A A . 13 LEU HD13 1 1 14 10250 1 1 13 LEU HD21 H 9.386 -5.659 2.659 1.00 . A A . 13 LEU HD21 1 1 14 10251 1 1 13 LEU HD22 H 8.038 -6.676 3.168 1.00 . A A . 13 LEU HD22 1 1 14 10252 1 1 13 LEU HD23 H 8.942 -5.747 4.364 1.00 . A A . 13 LEU HD23 1 1 14 10253 1 1 13 LEU HG H 6.927 -4.519 4.004 1.00 . A A . 13 LEU HG 1 1 14 10254 1 1 13 LEU N N 8.239 -0.852 2.639 1.00 . A A . 13 LEU N 1 1 14 10255 1 1 13 LEU O O 5.226 -2.402 3.503 1.00 . A A . 13 LEU O 1 1 14 10256 1 1 14 TYR C C 4.343 -0.916 5.383 1.00 . A A . 14 TYR C 1 1 14 10257 1 1 14 TYR CA C 5.630 -1.477 5.989 1.00 . A A . 14 TYR CA 1 1 14 10258 1 1 14 TYR CB C 6.118 -0.549 7.106 1.00 . A A . 14 TYR CB 1 1 14 10259 1 1 14 TYR CD1 C 7.190 -2.594 8.143 1.00 . A A . 14 TYR CD1 1 1 14 10260 1 1 14 TYR CD2 C 8.316 -0.451 8.335 1.00 . A A . 14 TYR CD2 1 1 14 10261 1 1 14 TYR CE1 C 8.229 -3.202 8.863 1.00 . A A . 14 TYR CE1 1 1 14 10262 1 1 14 TYR CE2 C 9.353 -1.061 9.054 1.00 . A A . 14 TYR CE2 1 1 14 10263 1 1 14 TYR CG C 7.234 -1.215 7.879 1.00 . A A . 14 TYR CG 1 1 14 10264 1 1 14 TYR CZ C 9.309 -2.436 9.317 1.00 . A A . 14 TYR CZ 1 1 14 10265 1 1 14 TYR H H 7.590 -1.296 5.116 1.00 . A A . 14 TYR H 1 1 14 10266 1 1 14 TYR HA H 5.435 -2.458 6.394 1.00 . A A . 14 TYR HA 1 1 14 10267 1 1 14 TYR HB2 H 6.480 0.371 6.673 1.00 . A A . 14 TYR HB2 1 1 14 10268 1 1 14 TYR HB3 H 5.299 -0.333 7.775 1.00 . A A . 14 TYR HB3 1 1 14 10269 1 1 14 TYR HD1 H 6.360 -3.186 7.794 1.00 . A A . 14 TYR HD1 1 1 14 10270 1 1 14 TYR HD2 H 8.351 0.609 8.133 1.00 . A A . 14 TYR HD2 1 1 14 10271 1 1 14 TYR HE1 H 8.195 -4.263 9.065 1.00 . A A . 14 TYR HE1 1 1 14 10272 1 1 14 TYR HE2 H 10.186 -0.470 9.406 1.00 . A A . 14 TYR HE2 1 1 14 10273 1 1 14 TYR HH H 10.878 -2.344 10.399 1.00 . A A . 14 TYR HH 1 1 14 10274 1 1 14 TYR N N 6.671 -1.577 4.931 1.00 . A A . 14 TYR N 1 1 14 10275 1 1 14 TYR O O 3.329 -1.586 5.325 1.00 . A A . 14 TYR O 1 1 14 10276 1 1 14 TYR OH O 10.330 -3.036 10.025 1.00 . A A . 14 TYR OH 1 1 14 10277 1 1 15 GLN C C 2.594 -0.074 3.282 1.00 . A A . 15 GLN C 1 1 14 10278 1 1 15 GLN CA C 3.156 0.899 4.311 1.00 . A A . 15 GLN CA 1 1 14 10279 1 1 15 GLN CB C 3.517 2.219 3.625 1.00 . A A . 15 GLN CB 1 1 14 10280 1 1 15 GLN CD C 4.324 3.797 5.388 1.00 . A A . 15 GLN CD 1 1 14 10281 1 1 15 GLN CG C 3.125 3.391 4.529 1.00 . A A . 15 GLN CG 1 1 14 10282 1 1 15 GLN H H 5.203 0.821 4.957 1.00 . A A . 15 GLN H 1 1 14 10283 1 1 15 GLN HA H 2.419 1.080 5.080 1.00 . A A . 15 GLN HA 1 1 14 10284 1 1 15 GLN HB2 H 4.581 2.247 3.439 1.00 . A A . 15 GLN HB2 1 1 14 10285 1 1 15 GLN HB3 H 2.984 2.296 2.689 1.00 . A A . 15 GLN HB3 1 1 14 10286 1 1 15 GLN HE21 H 3.203 4.487 6.877 1.00 . A A . 15 GLN HE21 1 1 14 10287 1 1 15 GLN HE22 H 4.879 4.607 7.115 1.00 . A A . 15 GLN HE22 1 1 14 10288 1 1 15 GLN HG2 H 2.819 4.228 3.919 1.00 . A A . 15 GLN HG2 1 1 14 10289 1 1 15 GLN HG3 H 2.308 3.095 5.169 1.00 . A A . 15 GLN HG3 1 1 14 10290 1 1 15 GLN N N 4.376 0.303 4.918 1.00 . A A . 15 GLN N 1 1 14 10291 1 1 15 GLN NE2 N 4.119 4.342 6.557 1.00 . A A . 15 GLN NE2 1 1 14 10292 1 1 15 GLN O O 1.402 -0.295 3.203 1.00 . A A . 15 GLN O 1 1 14 10293 1 1 15 GLN OE1 O 5.459 3.618 4.993 1.00 . A A . 15 GLN OE1 1 1 14 10294 1 1 16 LEU C C 2.209 -2.763 2.162 1.00 . A A . 16 LEU C 1 1 14 10295 1 1 16 LEU CA C 2.968 -1.633 1.471 1.00 . A A . 16 LEU CA 1 1 14 10296 1 1 16 LEU CB C 4.157 -2.215 0.723 1.00 . A A . 16 LEU CB 1 1 14 10297 1 1 16 LEU CD1 C 6.158 -0.837 0.195 1.00 . A A . 16 LEU CD1 1 1 14 10298 1 1 16 LEU CD2 C 4.703 -1.662 -1.640 1.00 . A A . 16 LEU CD2 1 1 14 10299 1 1 16 LEU CG C 4.724 -1.149 -0.204 1.00 . A A . 16 LEU CG 1 1 14 10300 1 1 16 LEU H H 4.407 -0.471 2.585 1.00 . A A . 16 LEU H 1 1 14 10301 1 1 16 LEU HA H 2.323 -1.127 0.772 1.00 . A A . 16 LEU HA 1 1 14 10302 1 1 16 LEU HB2 H 4.905 -2.522 1.431 1.00 . A A . 16 LEU HB2 1 1 14 10303 1 1 16 LEU HB3 H 3.840 -3.066 0.142 1.00 . A A . 16 LEU HB3 1 1 14 10304 1 1 16 LEU HD11 H 6.783 -1.688 -0.029 1.00 . A A . 16 LEU HD11 1 1 14 10305 1 1 16 LEU HD12 H 6.197 -0.628 1.253 1.00 . A A . 16 LEU HD12 1 1 14 10306 1 1 16 LEU HD13 H 6.504 0.021 -0.359 1.00 . A A . 16 LEU HD13 1 1 14 10307 1 1 16 LEU HD21 H 3.854 -1.242 -2.158 1.00 . A A . 16 LEU HD21 1 1 14 10308 1 1 16 LEU HD22 H 4.627 -2.739 -1.634 1.00 . A A . 16 LEU HD22 1 1 14 10309 1 1 16 LEU HD23 H 5.614 -1.367 -2.139 1.00 . A A . 16 LEU HD23 1 1 14 10310 1 1 16 LEU HG H 4.126 -0.253 -0.129 1.00 . A A . 16 LEU HG 1 1 14 10311 1 1 16 LEU N N 3.448 -0.663 2.496 1.00 . A A . 16 LEU N 1 1 14 10312 1 1 16 LEU O O 1.053 -3.015 1.883 1.00 . A A . 16 LEU O 1 1 14 10313 1 1 17 GLU C C 0.840 -4.100 4.346 1.00 . A A . 17 GLU C 1 1 14 10314 1 1 17 GLU CA C 2.187 -4.565 3.787 1.00 . A A . 17 GLU CA 1 1 14 10315 1 1 17 GLU CB C 3.077 -5.029 4.941 1.00 . A A . 17 GLU CB 1 1 14 10316 1 1 17 GLU CD C 4.949 -6.552 5.592 1.00 . A A . 17 GLU CD 1 1 14 10317 1 1 17 GLU CG C 4.030 -6.119 4.447 1.00 . A A . 17 GLU CG 1 1 14 10318 1 1 17 GLU H H 3.793 -3.220 3.269 1.00 . A A . 17 GLU H 1 1 14 10319 1 1 17 GLU HA H 2.026 -5.385 3.106 1.00 . A A . 17 GLU HA 1 1 14 10320 1 1 17 GLU HB2 H 3.649 -4.191 5.313 1.00 . A A . 17 GLU HB2 1 1 14 10321 1 1 17 GLU HB3 H 2.461 -5.425 5.735 1.00 . A A . 17 GLU HB3 1 1 14 10322 1 1 17 GLU HG2 H 3.459 -6.969 4.102 1.00 . A A . 17 GLU HG2 1 1 14 10323 1 1 17 GLU HG3 H 4.628 -5.733 3.635 1.00 . A A . 17 GLU HG3 1 1 14 10324 1 1 17 GLU N N 2.857 -3.445 3.066 1.00 . A A . 17 GLU N 1 1 14 10325 1 1 17 GLU O O -0.021 -4.899 4.657 1.00 . A A . 17 GLU O 1 1 14 10326 1 1 17 GLU OE1 O 5.693 -5.716 6.076 1.00 . A A . 17 GLU OE1 1 1 14 10327 1 1 17 GLU OE2 O 4.890 -7.712 5.966 1.00 . A A . 17 GLU OE2 1 1 14 10328 1 1 18 ASN C C -1.688 -2.220 3.933 1.00 . A A . 18 ASN C 1 1 14 10329 1 1 18 ASN CA C -0.638 -2.312 5.042 1.00 . A A . 18 ASN CA 1 1 14 10330 1 1 18 ASN CB C -0.419 -0.929 5.660 1.00 . A A . 18 ASN CB 1 1 14 10331 1 1 18 ASN CG C -0.947 -0.923 7.096 1.00 . A A . 18 ASN CG 1 1 14 10332 1 1 18 ASN H H 1.358 -2.187 4.242 1.00 . A A . 18 ASN H 1 1 14 10333 1 1 18 ASN HA H -0.986 -2.992 5.805 1.00 . A A . 18 ASN HA 1 1 14 10334 1 1 18 ASN HB2 H 0.637 -0.700 5.662 1.00 . A A . 18 ASN HB2 1 1 14 10335 1 1 18 ASN HB3 H -0.948 -0.187 5.081 1.00 . A A . 18 ASN HB3 1 1 14 10336 1 1 18 ASN HD21 H -2.654 -0.030 6.618 1.00 . A A . 18 ASN HD21 1 1 14 10337 1 1 18 ASN HD22 H -2.466 -0.400 8.264 1.00 . A A . 18 ASN HD22 1 1 14 10338 1 1 18 ASN N N 0.651 -2.817 4.489 1.00 . A A . 18 ASN N 1 1 14 10339 1 1 18 ASN ND2 N -2.120 -0.408 7.347 1.00 . A A . 18 ASN ND2 1 1 14 10340 1 1 18 ASN O O -2.799 -1.782 4.156 1.00 . A A . 18 ASN O 1 1 14 10341 1 1 18 ASN OD1 O -0.285 -1.393 8.000 1.00 . A A . 18 ASN OD1 1 1 14 10342 1 1 19 TYR C C -2.398 -3.918 0.913 1.00 . A A . 19 TYR C 1 1 14 10343 1 1 19 TYR CA C -2.354 -2.571 1.635 1.00 . A A . 19 TYR CA 1 1 14 10344 1 1 19 TYR CB C -1.965 -1.473 0.645 1.00 . A A . 19 TYR CB 1 1 14 10345 1 1 19 TYR CD1 C -2.940 0.558 1.785 1.00 . A A . 19 TYR CD1 1 1 14 10346 1 1 19 TYR CD2 C -0.529 0.335 1.649 1.00 . A A . 19 TYR CD2 1 1 14 10347 1 1 19 TYR CE1 C -2.789 1.776 2.465 1.00 . A A . 19 TYR CE1 1 1 14 10348 1 1 19 TYR CE2 C -0.376 1.551 2.328 1.00 . A A . 19 TYR CE2 1 1 14 10349 1 1 19 TYR CG C -1.808 -0.161 1.377 1.00 . A A . 19 TYR CG 1 1 14 10350 1 1 19 TYR CZ C -1.505 2.271 2.737 1.00 . A A . 19 TYR CZ 1 1 14 10351 1 1 19 TYR H H -0.459 -2.991 2.574 1.00 . A A . 19 TYR H 1 1 14 10352 1 1 19 TYR HA H -3.329 -2.354 2.047 1.00 . A A . 19 TYR HA 1 1 14 10353 1 1 19 TYR HB2 H -1.032 -1.733 0.168 1.00 . A A . 19 TYR HB2 1 1 14 10354 1 1 19 TYR HB3 H -2.737 -1.375 -0.105 1.00 . A A . 19 TYR HB3 1 1 14 10355 1 1 19 TYR HD1 H -3.930 0.177 1.575 1.00 . A A . 19 TYR HD1 1 1 14 10356 1 1 19 TYR HD2 H 0.342 -0.221 1.334 1.00 . A A . 19 TYR HD2 1 1 14 10357 1 1 19 TYR HE1 H -3.659 2.330 2.780 1.00 . A A . 19 TYR HE1 1 1 14 10358 1 1 19 TYR HE2 H 0.613 1.931 2.537 1.00 . A A . 19 TYR HE2 1 1 14 10359 1 1 19 TYR HH H -2.065 3.541 4.049 1.00 . A A . 19 TYR HH 1 1 14 10360 1 1 19 TYR N N -1.357 -2.634 2.741 1.00 . A A . 19 TYR N 1 1 14 10361 1 1 19 TYR O O -2.350 -3.985 -0.299 1.00 . A A . 19 TYR O 1 1 14 10362 1 1 19 TYR OH O -1.355 3.468 3.406 1.00 . A A . 19 TYR OH 1 1 14 10363 1 1 20 CYS C C -2.982 -7.386 2.018 1.00 . A A . 20 CYS C 1 1 14 10364 1 1 20 CYS CA C -2.538 -6.334 0.998 1.00 . A A . 20 CYS CA 1 1 14 10365 1 1 20 CYS CB C -1.150 -6.691 0.459 1.00 . A A . 20 CYS CB 1 1 14 10366 1 1 20 CYS H H -2.527 -4.919 2.625 1.00 . A A . 20 CYS H 1 1 14 10367 1 1 20 CYS HA H -3.243 -6.309 0.182 1.00 . A A . 20 CYS HA 1 1 14 10368 1 1 20 CYS HB2 H -0.876 -5.987 -0.314 1.00 . A A . 20 CYS HB2 1 1 14 10369 1 1 20 CYS HB3 H -0.428 -6.643 1.260 1.00 . A A . 20 CYS HB3 1 1 14 10370 1 1 20 CYS N N -2.488 -4.993 1.648 1.00 . A A . 20 CYS N 1 1 14 10371 1 1 20 CYS O O -2.887 -7.187 3.213 1.00 . A A . 20 CYS O 1 1 14 10372 1 1 20 CYS SG S -1.183 -8.366 -0.231 1.00 . A A . 20 CYS SG 1 1 14 10373 1 1 21 ASN C C -2.714 -10.201 3.180 1.00 . A A . 21 ASN C 1 1 14 10374 1 1 21 ASN CA C -3.927 -9.569 2.492 1.00 . A A . 21 ASN CA 1 1 14 10375 1 1 21 ASN CB C -4.685 -10.642 1.710 1.00 . A A . 21 ASN CB 1 1 14 10376 1 1 21 ASN CG C -6.174 -10.577 2.059 1.00 . A A . 21 ASN CG 1 1 14 10377 1 1 21 ASN H H -3.540 -8.642 0.586 1.00 . A A . 21 ASN H 1 1 14 10378 1 1 21 ASN HA H -4.580 -9.137 3.237 1.00 . A A . 21 ASN HA 1 1 14 10379 1 1 21 ASN HB2 H -4.556 -10.474 0.650 1.00 . A A . 21 ASN HB2 1 1 14 10380 1 1 21 ASN HB3 H -4.300 -11.617 1.969 1.00 . A A . 21 ASN HB3 1 1 14 10381 1 1 21 ASN HD21 H -6.725 -10.038 0.229 1.00 . A A . 21 ASN HD21 1 1 14 10382 1 1 21 ASN HD22 H -7.990 -10.201 1.349 1.00 . A A . 21 ASN HD22 1 1 14 10383 1 1 21 ASN N N -3.470 -8.503 1.553 1.00 . A A . 21 ASN N 1 1 14 10384 1 1 21 ASN ND2 N -7.035 -10.244 1.136 1.00 . A A . 21 ASN ND2 1 1 14 10385 1 1 21 ASN O O -1.648 -9.612 3.115 1.00 . A A . 21 ASN O 1 1 14 10386 1 1 21 ASN OXT O -2.874 -11.262 3.760 1.00 . A A . 21 ASN OXT 1 1 14 10387 1 1 21 ASN OD1 O -6.559 -10.833 3.183 1.00 . A A . 21 ASN OD1 1 1 14 10388 2 2 1 PHE C C 13.576 0.102 -0.625 1.00 . B B . 1 PHE C 1 1 14 10389 2 2 1 PHE CA C 13.464 -1.103 -1.563 1.00 . B B . 1 PHE CA 1 1 14 10390 2 2 1 PHE CB C 12.513 -2.135 -0.955 1.00 . B B . 1 PHE CB 1 1 14 10391 2 2 1 PHE CD1 C 11.550 -2.991 -3.125 1.00 . B B . 1 PHE CD1 1 1 14 10392 2 2 1 PHE CD2 C 10.060 -1.949 -1.517 1.00 . B B . 1 PHE CD2 1 1 14 10393 2 2 1 PHE CE1 C 10.467 -3.206 -3.988 1.00 . B B . 1 PHE CE1 1 1 14 10394 2 2 1 PHE CE2 C 8.977 -2.164 -2.382 1.00 . B B . 1 PHE CE2 1 1 14 10395 2 2 1 PHE CG C 11.346 -2.363 -1.888 1.00 . B B . 1 PHE CG 1 1 14 10396 2 2 1 PHE CZ C 9.181 -2.792 -3.617 1.00 . B B . 1 PHE CZ 1 1 14 10397 2 2 1 PHE H1 H 15.215 -1.945 -0.813 1.00 . B B . 1 PHE H1 1 1 14 10398 2 2 1 PHE H2 H 15.434 -1.046 -2.239 1.00 . B B . 1 PHE H2 1 1 14 10399 2 2 1 PHE H3 H 14.723 -2.587 -2.304 1.00 . B B . 1 PHE H3 1 1 14 10400 2 2 1 PHE HA H 13.084 -0.781 -2.521 1.00 . B B . 1 PHE HA 1 1 14 10401 2 2 1 PHE HB2 H 13.041 -3.065 -0.804 1.00 . B B . 1 PHE HB2 1 1 14 10402 2 2 1 PHE HB3 H 12.147 -1.771 -0.006 1.00 . B B . 1 PHE HB3 1 1 14 10403 2 2 1 PHE HD1 H 12.542 -3.310 -3.411 1.00 . B B . 1 PHE HD1 1 1 14 10404 2 2 1 PHE HD2 H 9.902 -1.465 -0.565 1.00 . B B . 1 PHE HD2 1 1 14 10405 2 2 1 PHE HE1 H 10.625 -3.690 -4.941 1.00 . B B . 1 PHE HE1 1 1 14 10406 2 2 1 PHE HE2 H 7.985 -1.845 -2.095 1.00 . B B . 1 PHE HE2 1 1 14 10407 2 2 1 PHE HZ H 8.347 -2.959 -4.283 1.00 . B B . 1 PHE HZ 1 1 14 10408 2 2 1 PHE N N 14.810 -1.717 -1.743 1.00 . B B . 1 PHE N 1 1 14 10409 2 2 1 PHE O O 12.590 0.720 -0.275 1.00 . B B . 1 PHE O 1 1 14 10410 2 2 2 VAL C C 14.406 2.865 0.018 1.00 . B B . 2 VAL C 1 1 14 10411 2 2 2 VAL CA C 14.949 1.602 0.690 1.00 . B B . 2 VAL CA 1 1 14 10412 2 2 2 VAL CB C 16.437 1.778 0.977 1.00 . B B . 2 VAL CB 1 1 14 10413 2 2 2 VAL CG1 C 16.890 0.737 2.000 1.00 . B B . 2 VAL CG1 1 1 14 10414 2 2 2 VAL CG2 C 17.233 1.599 -0.319 1.00 . B B . 2 VAL CG2 1 1 14 10415 2 2 2 VAL H H 15.552 -0.064 -0.510 1.00 . B B . 2 VAL H 1 1 14 10416 2 2 2 VAL HA H 14.421 1.426 1.615 1.00 . B B . 2 VAL HA 1 1 14 10417 2 2 2 VAL HB H 16.609 2.763 1.369 1.00 . B B . 2 VAL HB 1 1 14 10418 2 2 2 VAL HG11 H 17.634 1.171 2.651 1.00 . B B . 2 VAL HG11 1 1 14 10419 2 2 2 VAL HG12 H 17.315 -0.113 1.485 1.00 . B B . 2 VAL HG12 1 1 14 10420 2 2 2 VAL HG13 H 16.041 0.415 2.586 1.00 . B B . 2 VAL HG13 1 1 14 10421 2 2 2 VAL HG21 H 17.984 2.373 -0.389 1.00 . B B . 2 VAL HG21 1 1 14 10422 2 2 2 VAL HG22 H 16.565 1.669 -1.164 1.00 . B B . 2 VAL HG22 1 1 14 10423 2 2 2 VAL HG23 H 17.713 0.631 -0.316 1.00 . B B . 2 VAL HG23 1 1 14 10424 2 2 2 VAL N N 14.770 0.442 -0.218 1.00 . B B . 2 VAL N 1 1 14 10425 2 2 2 VAL O O 14.689 3.138 -1.131 1.00 . B B . 2 VAL O 1 1 14 10426 2 2 3 ASN C C 12.473 4.553 -1.241 1.00 . B B . 3 ASN C 1 1 14 10427 2 2 3 ASN CA C 13.076 4.886 0.124 1.00 . B B . 3 ASN CA 1 1 14 10428 2 2 3 ASN CB C 14.188 5.930 -0.057 1.00 . B B . 3 ASN CB 1 1 14 10429 2 2 3 ASN CG C 15.459 5.488 0.676 1.00 . B B . 3 ASN CG 1 1 14 10430 2 2 3 ASN H H 13.417 3.404 1.653 1.00 . B B . 3 ASN H 1 1 14 10431 2 2 3 ASN HA H 12.309 5.284 0.770 1.00 . B B . 3 ASN HA 1 1 14 10432 2 2 3 ASN HB2 H 14.405 6.042 -1.110 1.00 . B B . 3 ASN HB2 1 1 14 10433 2 2 3 ASN HB3 H 13.858 6.878 0.342 1.00 . B B . 3 ASN HB3 1 1 14 10434 2 2 3 ASN HD21 H 16.447 5.074 -0.996 1.00 . B B . 3 ASN HD21 1 1 14 10435 2 2 3 ASN HD22 H 17.308 4.804 0.443 1.00 . B B . 3 ASN HD22 1 1 14 10436 2 2 3 ASN N N 13.632 3.640 0.727 1.00 . B B . 3 ASN N 1 1 14 10437 2 2 3 ASN ND2 N 16.491 5.089 -0.016 1.00 . B B . 3 ASN ND2 1 1 14 10438 2 2 3 ASN O O 13.004 4.920 -2.269 1.00 . B B . 3 ASN O 1 1 14 10439 2 2 3 ASN OD1 O 15.511 5.502 1.890 1.00 . B B . 3 ASN OD1 1 1 14 10440 2 2 4 GLN C C 9.574 4.402 -2.881 1.00 . B B . 4 GLN C 1 1 14 10441 2 2 4 GLN CA C 10.756 3.480 -2.565 1.00 . B B . 4 GLN CA 1 1 14 10442 2 2 4 GLN CB C 10.267 2.033 -2.494 1.00 . B B . 4 GLN CB 1 1 14 10443 2 2 4 GLN CD C 10.710 0.648 -4.526 1.00 . B B . 4 GLN CD 1 1 14 10444 2 2 4 GLN CG C 11.279 1.118 -3.187 1.00 . B B . 4 GLN CG 1 1 14 10445 2 2 4 GLN H H 10.967 3.551 -0.422 1.00 . B B . 4 GLN H 1 1 14 10446 2 2 4 GLN HA H 11.495 3.566 -3.347 1.00 . B B . 4 GLN HA 1 1 14 10447 2 2 4 GLN HB2 H 10.164 1.739 -1.460 1.00 . B B . 4 GLN HB2 1 1 14 10448 2 2 4 GLN HB3 H 9.311 1.951 -2.990 1.00 . B B . 4 GLN HB3 1 1 14 10449 2 2 4 GLN HE21 H 12.314 1.198 -5.561 1.00 . B B . 4 GLN HE21 1 1 14 10450 2 2 4 GLN HE22 H 11.068 0.495 -6.474 1.00 . B B . 4 GLN HE22 1 1 14 10451 2 2 4 GLN HG2 H 12.199 1.662 -3.356 1.00 . B B . 4 GLN HG2 1 1 14 10452 2 2 4 GLN HG3 H 11.477 0.260 -2.562 1.00 . B B . 4 GLN HG3 1 1 14 10453 2 2 4 GLN N N 11.376 3.848 -1.261 1.00 . B B . 4 GLN N 1 1 14 10454 2 2 4 GLN NE2 N 11.423 0.791 -5.610 1.00 . B B . 4 GLN NE2 1 1 14 10455 2 2 4 GLN O O 8.776 4.733 -2.022 1.00 . B B . 4 GLN O 1 1 14 10456 2 2 4 GLN OE1 O 9.606 0.147 -4.588 1.00 . B B . 4 GLN OE1 1 1 14 10457 2 2 5 HIS C C 7.306 4.834 -5.299 1.00 . B B . 5 HIS C 1 1 14 10458 2 2 5 HIS CA C 8.319 5.678 -4.527 1.00 . B B . 5 HIS CA 1 1 14 10459 2 2 5 HIS CB C 8.828 6.802 -5.433 1.00 . B B . 5 HIS CB 1 1 14 10460 2 2 5 HIS CD2 C 9.941 8.992 -4.536 1.00 . B B . 5 HIS CD2 1 1 14 10461 2 2 5 HIS CE1 C 8.273 9.697 -3.337 1.00 . B B . 5 HIS CE1 1 1 14 10462 2 2 5 HIS CG C 8.925 8.083 -4.652 1.00 . B B . 5 HIS CG 1 1 14 10463 2 2 5 HIS H H 10.102 4.505 -4.792 1.00 . B B . 5 HIS H 1 1 14 10464 2 2 5 HIS HA H 7.851 6.101 -3.649 1.00 . B B . 5 HIS HA 1 1 14 10465 2 2 5 HIS HB2 H 9.801 6.539 -5.816 1.00 . B B . 5 HIS HB2 1 1 14 10466 2 2 5 HIS HB3 H 8.142 6.935 -6.256 1.00 . B B . 5 HIS HB3 1 1 14 10467 2 2 5 HIS HD2 H 10.906 8.921 -5.016 1.00 . B B . 5 HIS HD2 1 1 14 10468 2 2 5 HIS HE1 H 7.662 10.299 -2.683 1.00 . B B . 5 HIS HE1 1 1 14 10469 2 2 5 HIS HE2 H 10.047 10.802 -3.440 1.00 . B B . 5 HIS HE2 1 1 14 10470 2 2 5 HIS N N 9.452 4.800 -4.121 1.00 . B B . 5 HIS N 1 1 14 10471 2 2 5 HIS ND1 N 7.873 8.540 -3.888 1.00 . B B . 5 HIS ND1 1 1 14 10472 2 2 5 HIS NE2 N 9.531 10.012 -3.706 1.00 . B B . 5 HIS NE2 1 1 14 10473 2 2 5 HIS O O 7.600 4.304 -6.353 1.00 . B B . 5 HIS O 1 1 14 10474 2 2 6 LEU C C 4.119 4.794 -6.210 1.00 . B B . 6 LEU C 1 1 14 10475 2 2 6 LEU CA C 5.096 3.872 -5.481 1.00 . B B . 6 LEU CA 1 1 14 10476 2 2 6 LEU CB C 4.351 3.024 -4.452 1.00 . B B . 6 LEU CB 1 1 14 10477 2 2 6 LEU CD1 C 4.664 1.425 -2.554 1.00 . B B . 6 LEU CD1 1 1 14 10478 2 2 6 LEU CD2 C 6.527 1.837 -4.163 1.00 . B B . 6 LEU CD2 1 1 14 10479 2 2 6 LEU CG C 5.348 2.477 -3.429 1.00 . B B . 6 LEU CG 1 1 14 10480 2 2 6 LEU H H 5.905 5.124 -3.933 1.00 . B B . 6 LEU H 1 1 14 10481 2 2 6 LEU HA H 5.580 3.225 -6.196 1.00 . B B . 6 LEU HA 1 1 14 10482 2 2 6 LEU HB2 H 3.614 3.632 -3.950 1.00 . B B . 6 LEU HB2 1 1 14 10483 2 2 6 LEU HB3 H 3.861 2.202 -4.949 1.00 . B B . 6 LEU HB3 1 1 14 10484 2 2 6 LEU HD11 H 4.236 1.901 -1.685 1.00 . B B . 6 LEU HD11 1 1 14 10485 2 2 6 LEU HD12 H 5.391 0.690 -2.242 1.00 . B B . 6 LEU HD12 1 1 14 10486 2 2 6 LEU HD13 H 3.882 0.939 -3.120 1.00 . B B . 6 LEU HD13 1 1 14 10487 2 2 6 LEU HD21 H 7.079 1.209 -3.479 1.00 . B B . 6 LEU HD21 1 1 14 10488 2 2 6 LEU HD22 H 7.177 2.611 -4.544 1.00 . B B . 6 LEU HD22 1 1 14 10489 2 2 6 LEU HD23 H 6.159 1.240 -4.984 1.00 . B B . 6 LEU HD23 1 1 14 10490 2 2 6 LEU HG H 5.705 3.285 -2.806 1.00 . B B . 6 LEU HG 1 1 14 10491 2 2 6 LEU N N 6.121 4.692 -4.781 1.00 . B B . 6 LEU N 1 1 14 10492 2 2 6 LEU O O 3.365 5.523 -5.597 1.00 . B B . 6 LEU O 1 1 14 10493 2 2 7 CYS C C 2.451 4.878 -9.349 1.00 . B B . 7 CYS C 1 1 14 10494 2 2 7 CYS CA C 3.208 5.668 -8.270 1.00 . B B . 7 CYS CA 1 1 14 10495 2 2 7 CYS CB C 4.014 6.780 -8.942 1.00 . B B . 7 CYS CB 1 1 14 10496 2 2 7 CYS H H 4.751 4.193 -7.991 1.00 . B B . 7 CYS H 1 1 14 10497 2 2 7 CYS HA H 2.503 6.106 -7.582 1.00 . B B . 7 CYS HA 1 1 14 10498 2 2 7 CYS HB2 H 4.814 6.342 -9.522 1.00 . B B . 7 CYS HB2 1 1 14 10499 2 2 7 CYS HB3 H 3.368 7.350 -9.593 1.00 . B B . 7 CYS HB3 1 1 14 10500 2 2 7 CYS N N 4.131 4.778 -7.515 1.00 . B B . 7 CYS N 1 1 14 10501 2 2 7 CYS O O 3.041 4.265 -10.217 1.00 . B B . 7 CYS O 1 1 14 10502 2 2 7 CYS SG S 4.712 7.869 -7.675 1.00 . B B . 7 CYS SG 1 1 14 10503 2 2 8 GLY C C 0.947 2.856 -10.701 1.00 . B B . 8 GLY C 1 1 14 10504 2 2 8 GLY CA C 0.320 4.202 -10.329 1.00 . B B . 8 GLY CA 1 1 14 10505 2 2 8 GLY H H 0.700 5.435 -8.604 1.00 . B B . 8 GLY H 1 1 14 10506 2 2 8 GLY HA2 H -0.671 4.035 -9.931 1.00 . B B . 8 GLY HA2 1 1 14 10507 2 2 8 GLY HA3 H 0.247 4.815 -11.214 1.00 . B B . 8 GLY HA3 1 1 14 10508 2 2 8 GLY N N 1.145 4.916 -9.306 1.00 . B B . 8 GLY N 1 1 14 10509 2 2 8 GLY O O 1.146 2.000 -9.867 1.00 . B B . 8 GLY O 1 1 14 10510 2 2 9 SER C C 2.885 0.911 -11.381 1.00 . B B . 9 SER C 1 1 14 10511 2 2 9 SER CA C 1.845 1.371 -12.403 1.00 . B B . 9 SER CA 1 1 14 10512 2 2 9 SER CB C 2.515 1.564 -13.762 1.00 . B B . 9 SER CB 1 1 14 10513 2 2 9 SER H H 1.063 3.368 -12.615 1.00 . B B . 9 SER H 1 1 14 10514 2 2 9 SER HA H 1.069 0.623 -12.487 1.00 . B B . 9 SER HA 1 1 14 10515 2 2 9 SER HB2 H 3.219 0.768 -13.936 1.00 . B B . 9 SER HB2 1 1 14 10516 2 2 9 SER HB3 H 1.759 1.549 -14.539 1.00 . B B . 9 SER HB3 1 1 14 10517 2 2 9 SER HG H 4.048 2.678 -14.205 1.00 . B B . 9 SER HG 1 1 14 10518 2 2 9 SER N N 1.244 2.663 -11.959 1.00 . B B . 9 SER N 1 1 14 10519 2 2 9 SER O O 2.751 -0.129 -10.767 1.00 . B B . 9 SER O 1 1 14 10520 2 2 9 SER OG O 3.200 2.808 -13.774 1.00 . B B . 9 SER OG 1 1 14 10521 2 2 10 ASP C C 4.266 0.860 -8.908 1.00 . B B . 10 ASP C 1 1 14 10522 2 2 10 ASP CA C 4.955 1.302 -10.195 1.00 . B B . 10 ASP CA 1 1 14 10523 2 2 10 ASP CB C 5.833 2.517 -9.907 1.00 . B B . 10 ASP CB 1 1 14 10524 2 2 10 ASP CG C 6.492 2.989 -11.206 1.00 . B B . 10 ASP CG 1 1 14 10525 2 2 10 ASP H H 3.997 2.524 -11.683 1.00 . B B . 10 ASP H 1 1 14 10526 2 2 10 ASP HA H 5.559 0.495 -10.585 1.00 . B B . 10 ASP HA 1 1 14 10527 2 2 10 ASP HB2 H 5.217 3.310 -9.503 1.00 . B B . 10 ASP HB2 1 1 14 10528 2 2 10 ASP HB3 H 6.597 2.252 -9.191 1.00 . B B . 10 ASP HB3 1 1 14 10529 2 2 10 ASP N N 3.914 1.685 -11.186 1.00 . B B . 10 ASP N 1 1 14 10530 2 2 10 ASP O O 4.671 -0.083 -8.258 1.00 . B B . 10 ASP O 1 1 14 10531 2 2 10 ASP OD1 O 7.031 2.152 -11.910 1.00 . B B . 10 ASP OD1 1 1 14 10532 2 2 10 ASP OD2 O 6.443 4.178 -11.473 1.00 . B B . 10 ASP OD2 1 1 14 10533 2 2 11 LEU C C 2.260 -0.330 -7.285 1.00 . B B . 11 LEU C 1 1 14 10534 2 2 11 LEU CA C 2.476 1.181 -7.307 1.00 . B B . 11 LEU CA 1 1 14 10535 2 2 11 LEU CB C 1.126 1.901 -7.331 1.00 . B B . 11 LEU CB 1 1 14 10536 2 2 11 LEU CD1 C 1.495 1.938 -4.807 1.00 . B B . 11 LEU CD1 1 1 14 10537 2 2 11 LEU CD2 C -0.250 3.347 -5.862 1.00 . B B . 11 LEU CD2 1 1 14 10538 2 2 11 LEU CG C 0.469 2.005 -5.941 1.00 . B B . 11 LEU CG 1 1 14 10539 2 2 11 LEU H H 2.913 2.295 -9.093 1.00 . B B . 11 LEU H 1 1 14 10540 2 2 11 LEU HA H 3.050 1.485 -6.453 1.00 . B B . 11 LEU HA 1 1 14 10541 2 2 11 LEU HB2 H 1.273 2.895 -7.720 1.00 . B B . 11 LEU HB2 1 1 14 10542 2 2 11 LEU HB3 H 0.462 1.363 -7.992 1.00 . B B . 11 LEU HB3 1 1 14 10543 2 2 11 LEU HD11 H 2.086 2.839 -4.808 1.00 . B B . 11 LEU HD11 1 1 14 10544 2 2 11 LEU HD12 H 2.133 1.081 -4.941 1.00 . B B . 11 LEU HD12 1 1 14 10545 2 2 11 LEU HD13 H 0.976 1.853 -3.860 1.00 . B B . 11 LEU HD13 1 1 14 10546 2 2 11 LEU HD21 H -0.596 3.513 -4.854 1.00 . B B . 11 LEU HD21 1 1 14 10547 2 2 11 LEU HD22 H -1.090 3.346 -6.540 1.00 . B B . 11 LEU HD22 1 1 14 10548 2 2 11 LEU HD23 H 0.436 4.136 -6.142 1.00 . B B . 11 LEU HD23 1 1 14 10549 2 2 11 LEU HG H -0.250 1.210 -5.823 1.00 . B B . 11 LEU HG 1 1 14 10550 2 2 11 LEU N N 3.217 1.541 -8.545 1.00 . B B . 11 LEU N 1 1 14 10551 2 2 11 LEU O O 2.714 -1.022 -6.395 1.00 . B B . 11 LEU O 1 1 14 10552 2 2 12 ALA C C 2.708 -3.015 -8.377 1.00 . B B . 12 ALA C 1 1 14 10553 2 2 12 ALA CA C 1.353 -2.320 -8.308 1.00 . B B . 12 ALA CA 1 1 14 10554 2 2 12 ALA CB C 0.532 -2.691 -9.546 1.00 . B B . 12 ALA CB 1 1 14 10555 2 2 12 ALA H H 1.230 -0.281 -8.984 1.00 . B B . 12 ALA H 1 1 14 10556 2 2 12 ALA HA H 0.829 -2.632 -7.417 1.00 . B B . 12 ALA HA 1 1 14 10557 2 2 12 ALA HB1 H 1.190 -2.782 -10.398 1.00 . B B . 12 ALA HB1 1 1 14 10558 2 2 12 ALA HB2 H -0.201 -1.924 -9.735 1.00 . B B . 12 ALA HB2 1 1 14 10559 2 2 12 ALA HB3 H 0.035 -3.635 -9.376 1.00 . B B . 12 ALA HB3 1 1 14 10560 2 2 12 ALA N N 1.579 -0.853 -8.269 1.00 . B B . 12 ALA N 1 1 14 10561 2 2 12 ALA O O 3.015 -3.863 -7.569 1.00 . B B . 12 ALA O 1 1 14 10562 2 2 13 GLU C C 5.476 -3.428 -8.055 1.00 . B B . 13 GLU C 1 1 14 10563 2 2 13 GLU CA C 4.863 -3.295 -9.446 1.00 . B B . 13 GLU CA 1 1 14 10564 2 2 13 GLU CB C 5.776 -2.442 -10.329 1.00 . B B . 13 GLU CB 1 1 14 10565 2 2 13 GLU CD C 8.220 -2.450 -10.859 1.00 . B B . 13 GLU CD 1 1 14 10566 2 2 13 GLU CG C 6.946 -3.296 -10.816 1.00 . B B . 13 GLU CG 1 1 14 10567 2 2 13 GLU H H 3.256 -1.960 -9.973 1.00 . B B . 13 GLU H 1 1 14 10568 2 2 13 GLU HA H 4.754 -4.277 -9.884 1.00 . B B . 13 GLU HA 1 1 14 10569 2 2 13 GLU HB2 H 5.217 -2.075 -11.178 1.00 . B B . 13 GLU HB2 1 1 14 10570 2 2 13 GLU HB3 H 6.154 -1.608 -9.757 1.00 . B B . 13 GLU HB3 1 1 14 10571 2 2 13 GLU HG2 H 7.089 -4.127 -10.140 1.00 . B B . 13 GLU HG2 1 1 14 10572 2 2 13 GLU HG3 H 6.732 -3.670 -11.806 1.00 . B B . 13 GLU HG3 1 1 14 10573 2 2 13 GLU N N 3.524 -2.654 -9.333 1.00 . B B . 13 GLU N 1 1 14 10574 2 2 13 GLU O O 6.199 -4.363 -7.770 1.00 . B B . 13 GLU O 1 1 14 10575 2 2 13 GLU OE1 O 8.789 -2.217 -9.805 1.00 . B B . 13 GLU OE1 1 1 14 10576 2 2 13 GLU OE2 O 8.606 -2.051 -11.946 1.00 . B B . 13 GLU OE2 1 1 14 10577 2 2 14 ALA C C 4.982 -3.666 -5.026 1.00 . B B . 14 ALA C 1 1 14 10578 2 2 14 ALA CA C 5.749 -2.600 -5.803 1.00 . B B . 14 ALA CA 1 1 14 10579 2 2 14 ALA CB C 5.611 -1.249 -5.099 1.00 . B B . 14 ALA CB 1 1 14 10580 2 2 14 ALA H H 4.592 -1.761 -7.420 1.00 . B B . 14 ALA H 1 1 14 10581 2 2 14 ALA HA H 6.794 -2.879 -5.856 1.00 . B B . 14 ALA HA 1 1 14 10582 2 2 14 ALA HB1 H 5.516 -0.467 -5.838 1.00 . B B . 14 ALA HB1 1 1 14 10583 2 2 14 ALA HB2 H 6.485 -1.068 -4.493 1.00 . B B . 14 ALA HB2 1 1 14 10584 2 2 14 ALA HB3 H 4.732 -1.259 -4.470 1.00 . B B . 14 ALA HB3 1 1 14 10585 2 2 14 ALA N N 5.186 -2.507 -7.177 1.00 . B B . 14 ALA N 1 1 14 10586 2 2 14 ALA O O 5.556 -4.613 -4.527 1.00 . B B . 14 ALA O 1 1 14 10587 2 2 15 LEU C C 3.044 -5.895 -4.926 1.00 . B B . 15 LEU C 1 1 14 10588 2 2 15 LEU CA C 2.901 -4.562 -4.191 1.00 . B B . 15 LEU CA 1 1 14 10589 2 2 15 LEU CB C 1.425 -4.159 -4.156 1.00 . B B . 15 LEU CB 1 1 14 10590 2 2 15 LEU CD1 C -0.130 -2.295 -3.597 1.00 . B B . 15 LEU CD1 1 1 14 10591 2 2 15 LEU CD2 C 1.397 -3.200 -1.851 1.00 . B B . 15 LEU CD2 1 1 14 10592 2 2 15 LEU CG C 1.257 -2.879 -3.339 1.00 . B B . 15 LEU CG 1 1 14 10593 2 2 15 LEU H H 3.230 -2.774 -5.352 1.00 . B B . 15 LEU H 1 1 14 10594 2 2 15 LEU HA H 3.283 -4.651 -3.181 1.00 . B B . 15 LEU HA 1 1 14 10595 2 2 15 LEU HB2 H 1.075 -3.991 -5.165 1.00 . B B . 15 LEU HB2 1 1 14 10596 2 2 15 LEU HB3 H 0.848 -4.951 -3.703 1.00 . B B . 15 LEU HB3 1 1 14 10597 2 2 15 LEU HD11 H -0.727 -3.015 -4.138 1.00 . B B . 15 LEU HD11 1 1 14 10598 2 2 15 LEU HD12 H -0.039 -1.393 -4.181 1.00 . B B . 15 LEU HD12 1 1 14 10599 2 2 15 LEU HD13 H -0.607 -2.069 -2.655 1.00 . B B . 15 LEU HD13 1 1 14 10600 2 2 15 LEU HD21 H 0.581 -3.838 -1.544 1.00 . B B . 15 LEU HD21 1 1 14 10601 2 2 15 LEU HD22 H 1.370 -2.283 -1.282 1.00 . B B . 15 LEU HD22 1 1 14 10602 2 2 15 LEU HD23 H 2.335 -3.706 -1.679 1.00 . B B . 15 LEU HD23 1 1 14 10603 2 2 15 LEU HG H 2.012 -2.162 -3.630 1.00 . B B . 15 LEU HG 1 1 14 10604 2 2 15 LEU N N 3.686 -3.535 -4.929 1.00 . B B . 15 LEU N 1 1 14 10605 2 2 15 LEU O O 3.006 -6.958 -4.339 1.00 . B B . 15 LEU O 1 1 14 10606 2 2 16 TYR C C 4.621 -7.812 -6.615 1.00 . B B . 16 TYR C 1 1 14 10607 2 2 16 TYR CA C 3.361 -7.064 -7.039 1.00 . B B . 16 TYR CA 1 1 14 10608 2 2 16 TYR CB C 3.509 -6.658 -8.507 1.00 . B B . 16 TYR CB 1 1 14 10609 2 2 16 TYR CD1 C 1.308 -7.698 -9.130 1.00 . B B . 16 TYR CD1 1 1 14 10610 2 2 16 TYR CD2 C 3.265 -8.223 -10.463 1.00 . B B . 16 TYR CD2 1 1 14 10611 2 2 16 TYR CE1 C 0.525 -8.516 -9.954 1.00 . B B . 16 TYR CE1 1 1 14 10612 2 2 16 TYR CE2 C 2.483 -9.043 -11.287 1.00 . B B . 16 TYR CE2 1 1 14 10613 2 2 16 TYR CG C 2.674 -7.553 -9.385 1.00 . B B . 16 TYR CG 1 1 14 10614 2 2 16 TYR CZ C 1.113 -9.189 -11.034 1.00 . B B . 16 TYR CZ 1 1 14 10615 2 2 16 TYR H H 3.236 -4.953 -6.656 1.00 . B B . 16 TYR H 1 1 14 10616 2 2 16 TYR HA H 2.495 -7.695 -6.920 1.00 . B B . 16 TYR HA 1 1 14 10617 2 2 16 TYR HB2 H 3.187 -5.637 -8.632 1.00 . B B . 16 TYR HB2 1 1 14 10618 2 2 16 TYR HB3 H 4.545 -6.741 -8.796 1.00 . B B . 16 TYR HB3 1 1 14 10619 2 2 16 TYR HD1 H 0.860 -7.182 -8.297 1.00 . B B . 16 TYR HD1 1 1 14 10620 2 2 16 TYR HD2 H 4.324 -8.110 -10.656 1.00 . B B . 16 TYR HD2 1 1 14 10621 2 2 16 TYR HE1 H -0.532 -8.625 -9.758 1.00 . B B . 16 TYR HE1 1 1 14 10622 2 2 16 TYR HE2 H 2.936 -9.560 -12.120 1.00 . B B . 16 TYR HE2 1 1 14 10623 2 2 16 TYR HH H 0.610 -9.839 -12.756 1.00 . B B . 16 TYR HH 1 1 14 10624 2 2 16 TYR N N 3.209 -5.830 -6.219 1.00 . B B . 16 TYR N 1 1 14 10625 2 2 16 TYR O O 4.736 -9.010 -6.786 1.00 . B B . 16 TYR O 1 1 14 10626 2 2 16 TYR OH O 0.342 -9.994 -11.848 1.00 . B B . 16 TYR OH 1 1 14 10627 2 2 17 LEU C C 6.880 -7.992 -4.179 1.00 . B B . 17 LEU C 1 1 14 10628 2 2 17 LEU CA C 6.852 -7.749 -5.696 1.00 . B B . 17 LEU CA 1 1 14 10629 2 2 17 LEU CB C 7.982 -6.822 -6.115 1.00 . B B . 17 LEU CB 1 1 14 10630 2 2 17 LEU CD1 C 9.371 -8.909 -5.897 1.00 . B B . 17 LEU CD1 1 1 14 10631 2 2 17 LEU CD2 C 10.411 -6.745 -6.529 1.00 . B B . 17 LEU CD2 1 1 14 10632 2 2 17 LEU CG C 9.324 -7.389 -5.683 1.00 . B B . 17 LEU CG 1 1 14 10633 2 2 17 LEU H H 5.480 -6.137 -5.992 1.00 . B B . 17 LEU H 1 1 14 10634 2 2 17 LEU HA H 6.962 -8.687 -6.212 1.00 . B B . 17 LEU HA 1 1 14 10635 2 2 17 LEU HB2 H 7.969 -6.713 -7.190 1.00 . B B . 17 LEU HB2 1 1 14 10636 2 2 17 LEU HB3 H 7.838 -5.854 -5.658 1.00 . B B . 17 LEU HB3 1 1 14 10637 2 2 17 LEU HD11 H 10.366 -9.193 -6.210 1.00 . B B . 17 LEU HD11 1 1 14 10638 2 2 17 LEU HD12 H 8.663 -9.189 -6.661 1.00 . B B . 17 LEU HD12 1 1 14 10639 2 2 17 LEU HD13 H 9.129 -9.415 -4.976 1.00 . B B . 17 LEU HD13 1 1 14 10640 2 2 17 LEU HD21 H 10.021 -6.552 -7.518 1.00 . B B . 17 LEU HD21 1 1 14 10641 2 2 17 LEU HD22 H 11.252 -7.416 -6.597 1.00 . B B . 17 LEU HD22 1 1 14 10642 2 2 17 LEU HD23 H 10.717 -5.818 -6.073 1.00 . B B . 17 LEU HD23 1 1 14 10643 2 2 17 LEU HG H 9.482 -7.154 -4.646 1.00 . B B . 17 LEU HG 1 1 14 10644 2 2 17 LEU N N 5.582 -7.106 -6.096 1.00 . B B . 17 LEU N 1 1 14 10645 2 2 17 LEU O O 7.797 -8.590 -3.655 1.00 . B B . 17 LEU O 1 1 14 10646 2 2 18 VAL C C 4.837 -8.861 -1.669 1.00 . B B . 18 VAL C 1 1 14 10647 2 2 18 VAL CA C 5.868 -7.782 -1.995 1.00 . B B . 18 VAL CA 1 1 14 10648 2 2 18 VAL CB C 5.516 -6.480 -1.267 1.00 . B B . 18 VAL CB 1 1 14 10649 2 2 18 VAL CG1 C 6.137 -5.310 -2.017 1.00 . B B . 18 VAL CG1 1 1 14 10650 2 2 18 VAL CG2 C 3.996 -6.289 -1.208 1.00 . B B . 18 VAL CG2 1 1 14 10651 2 2 18 VAL H H 5.141 -7.074 -3.895 1.00 . B B . 18 VAL H 1 1 14 10652 2 2 18 VAL HA H 6.845 -8.115 -1.678 1.00 . B B . 18 VAL HA 1 1 14 10653 2 2 18 VAL HB H 5.916 -6.514 -0.267 1.00 . B B . 18 VAL HB 1 1 14 10654 2 2 18 VAL HG11 H 5.354 -4.717 -2.463 1.00 . B B . 18 VAL HG11 1 1 14 10655 2 2 18 VAL HG12 H 6.793 -5.686 -2.789 1.00 . B B . 18 VAL HG12 1 1 14 10656 2 2 18 VAL HG13 H 6.702 -4.704 -1.328 1.00 . B B . 18 VAL HG13 1 1 14 10657 2 2 18 VAL HG21 H 3.547 -7.136 -0.709 1.00 . B B . 18 VAL HG21 1 1 14 10658 2 2 18 VAL HG22 H 3.603 -6.213 -2.210 1.00 . B B . 18 VAL HG22 1 1 14 10659 2 2 18 VAL HG23 H 3.767 -5.386 -0.660 1.00 . B B . 18 VAL HG23 1 1 14 10660 2 2 18 VAL N N 5.881 -7.548 -3.467 1.00 . B B . 18 VAL N 1 1 14 10661 2 2 18 VAL O O 5.092 -9.771 -0.905 1.00 . B B . 18 VAL O 1 1 14 10662 2 2 19 CYS C C 2.592 -10.781 -3.117 1.00 . B B . 19 CYS C 1 1 14 10663 2 2 19 CYS CA C 2.619 -9.767 -1.974 1.00 . B B . 19 CYS CA 1 1 14 10664 2 2 19 CYS CB C 1.262 -9.068 -1.880 1.00 . B B . 19 CYS CB 1 1 14 10665 2 2 19 CYS H H 3.493 -8.012 -2.853 1.00 . B B . 19 CYS H 1 1 14 10666 2 2 19 CYS HA H 2.834 -10.269 -1.044 1.00 . B B . 19 CYS HA 1 1 14 10667 2 2 19 CYS HB2 H 1.345 -8.067 -2.279 1.00 . B B . 19 CYS HB2 1 1 14 10668 2 2 19 CYS HB3 H 0.532 -9.623 -2.450 1.00 . B B . 19 CYS HB3 1 1 14 10669 2 2 19 CYS N N 3.674 -8.757 -2.243 1.00 . B B . 19 CYS N 1 1 14 10670 2 2 19 CYS O O 2.181 -11.912 -2.951 1.00 . B B . 19 CYS O 1 1 14 10671 2 2 19 CYS SG S 0.740 -8.984 -0.147 1.00 . B B . 19 CYS SG 1 1 14 10672 2 2 20 GLY C C 1.617 -11.865 -5.641 1.00 . B B . 20 GLY C 1 1 14 10673 2 2 20 GLY CA C 3.027 -11.311 -5.440 1.00 . B B . 20 GLY CA 1 1 14 10674 2 2 20 GLY H H 3.349 -9.460 -4.389 1.00 . B B . 20 GLY H 1 1 14 10675 2 2 20 GLY HA2 H 3.337 -10.780 -6.329 1.00 . B B . 20 GLY HA2 1 1 14 10676 2 2 20 GLY HA3 H 3.706 -12.127 -5.249 1.00 . B B . 20 GLY HA3 1 1 14 10677 2 2 20 GLY N N 3.026 -10.378 -4.280 1.00 . B B . 20 GLY N 1 1 14 10678 2 2 20 GLY O O 0.697 -11.141 -5.968 1.00 . B B . 20 GLY O 1 1 14 10679 2 2 21 GLU C C -0.689 -13.622 -4.293 1.00 . B B . 21 GLU C 1 1 14 10680 2 2 21 GLU CA C 0.079 -13.728 -5.612 1.00 . B B . 21 GLU CA 1 1 14 10681 2 2 21 GLU CB C 0.206 -15.196 -6.019 1.00 . B B . 21 GLU CB 1 1 14 10682 2 2 21 GLU CD C 0.323 -17.335 -4.737 1.00 . B B . 21 GLU CD 1 1 14 10683 2 2 21 GLU CG C 0.967 -15.963 -4.937 1.00 . B B . 21 GLU CG 1 1 14 10684 2 2 21 GLU H H 2.186 -13.707 -5.168 1.00 . B B . 21 GLU H 1 1 14 10685 2 2 21 GLU HA H -0.452 -13.186 -6.381 1.00 . B B . 21 GLU HA 1 1 14 10686 2 2 21 GLU HB2 H -0.780 -15.623 -6.138 1.00 . B B . 21 GLU HB2 1 1 14 10687 2 2 21 GLU HB3 H 0.744 -15.268 -6.953 1.00 . B B . 21 GLU HB3 1 1 14 10688 2 2 21 GLU HG2 H 1.996 -16.087 -5.240 1.00 . B B . 21 GLU HG2 1 1 14 10689 2 2 21 GLU HG3 H 0.928 -15.410 -4.009 1.00 . B B . 21 GLU HG3 1 1 14 10690 2 2 21 GLU N N 1.434 -13.139 -5.439 1.00 . B B . 21 GLU N 1 1 14 10691 2 2 21 GLU O O -1.798 -14.101 -4.169 1.00 . B B . 21 GLU O 1 1 14 10692 2 2 21 GLU OE1 O -0.814 -17.376 -4.295 1.00 . B B . 21 GLU OE1 1 1 14 10693 2 2 21 GLU OE2 O 0.976 -18.323 -5.030 1.00 . B B . 21 GLU OE2 1 1 14 10694 2 2 22 ARG C C -2.113 -12.096 -2.204 1.00 . B B . 22 ARG C 1 1 14 10695 2 2 22 ARG CA C -0.805 -12.858 -1.996 1.00 . B B . 22 ARG CA 1 1 14 10696 2 2 22 ARG CB C 0.089 -12.093 -1.018 1.00 . B B . 22 ARG CB 1 1 14 10697 2 2 22 ARG CD C 1.905 -12.323 0.690 1.00 . B B . 22 ARG CD 1 1 14 10698 2 2 22 ARG CG C 1.037 -13.073 -0.322 1.00 . B B . 22 ARG CG 1 1 14 10699 2 2 22 ARG CZ C 3.661 -13.310 2.037 1.00 . B B . 22 ARG CZ 1 1 14 10700 2 2 22 ARG H H 0.788 -12.614 -3.423 1.00 . B B . 22 ARG H 1 1 14 10701 2 2 22 ARG HA H -1.020 -13.837 -1.599 1.00 . B B . 22 ARG HA 1 1 14 10702 2 2 22 ARG HB2 H 0.664 -11.355 -1.559 1.00 . B B . 22 ARG HB2 1 1 14 10703 2 2 22 ARG HB3 H -0.524 -11.600 -0.278 1.00 . B B . 22 ARG HB3 1 1 14 10704 2 2 22 ARG HD2 H 2.748 -11.878 0.183 1.00 . B B . 22 ARG HD2 1 1 14 10705 2 2 22 ARG HD3 H 1.318 -11.548 1.164 1.00 . B B . 22 ARG HD3 1 1 14 10706 2 2 22 ARG HE H 1.765 -13.880 2.172 1.00 . B B . 22 ARG HE 1 1 14 10707 2 2 22 ARG HG2 H 0.459 -13.829 0.190 1.00 . B B . 22 ARG HG2 1 1 14 10708 2 2 22 ARG HG3 H 1.672 -13.543 -1.058 1.00 . B B . 22 ARG HG3 1 1 14 10709 2 2 22 ARG HH11 H 4.288 -13.332 0.136 1.00 . B B . 22 ARG HH11 1 1 14 10710 2 2 22 ARG HH12 H 5.536 -13.360 1.337 1.00 . B B . 22 ARG HH12 1 1 14 10711 2 2 22 ARG HH21 H 3.331 -13.299 4.011 1.00 . B B . 22 ARG HH21 1 1 14 10712 2 2 22 ARG HH22 H 4.995 -13.344 3.530 1.00 . B B . 22 ARG HH22 1 1 14 10713 2 2 22 ARG N N -0.106 -12.996 -3.304 1.00 . B B . 22 ARG N 1 1 14 10714 2 2 22 ARG NE N 2.394 -13.277 1.725 1.00 . B B . 22 ARG NE 1 1 14 10715 2 2 22 ARG NH1 N 4.565 -13.336 1.097 1.00 . B B . 22 ARG NH1 1 1 14 10716 2 2 22 ARG NH2 N 4.024 -13.318 3.291 1.00 . B B . 22 ARG NH2 1 1 14 10717 2 2 22 ARG O O -3.026 -12.175 -1.407 1.00 . B B . 22 ARG O 1 1 14 10718 2 2 23 GLY C C -3.480 -9.314 -2.737 1.00 . B B . 23 GLY C 1 1 14 10719 2 2 23 GLY CA C -3.462 -10.607 -3.556 1.00 . B B . 23 GLY CA 1 1 14 10720 2 2 23 GLY H H -1.465 -11.330 -3.912 1.00 . B B . 23 GLY H 1 1 14 10721 2 2 23 GLY HA2 H -3.507 -10.365 -4.608 1.00 . B B . 23 GLY HA2 1 1 14 10722 2 2 23 GLY HA3 H -4.316 -11.210 -3.288 1.00 . B B . 23 GLY HA3 1 1 14 10723 2 2 23 GLY N N -2.212 -11.369 -3.280 1.00 . B B . 23 GLY N 1 1 14 10724 2 2 23 GLY O O -4.007 -9.269 -1.642 1.00 . B B . 23 GLY O 1 1 14 10725 2 2 24 PHE C C -4.024 -6.073 -3.064 1.00 . B B . 24 PHE C 1 1 14 10726 2 2 24 PHE CA C -2.917 -6.969 -2.514 1.00 . B B . 24 PHE CA 1 1 14 10727 2 2 24 PHE CB C -1.563 -6.274 -2.677 1.00 . B B . 24 PHE CB 1 1 14 10728 2 2 24 PHE CD1 C -1.645 -5.033 -4.868 1.00 . B B . 24 PHE CD1 1 1 14 10729 2 2 24 PHE CD2 C -0.488 -7.163 -4.774 1.00 . B B . 24 PHE CD2 1 1 14 10730 2 2 24 PHE CE1 C -1.328 -4.920 -6.228 1.00 . B B . 24 PHE CE1 1 1 14 10731 2 2 24 PHE CE2 C -0.168 -7.050 -6.133 1.00 . B B . 24 PHE CE2 1 1 14 10732 2 2 24 PHE CG C -1.226 -6.154 -4.143 1.00 . B B . 24 PHE CG 1 1 14 10733 2 2 24 PHE CZ C -0.589 -5.928 -6.861 1.00 . B B . 24 PHE CZ 1 1 14 10734 2 2 24 PHE H H -2.504 -8.312 -4.147 1.00 . B B . 24 PHE H 1 1 14 10735 2 2 24 PHE HA H -3.101 -7.158 -1.470 1.00 . B B . 24 PHE HA 1 1 14 10736 2 2 24 PHE HB2 H -1.611 -5.288 -2.237 1.00 . B B . 24 PHE HB2 1 1 14 10737 2 2 24 PHE HB3 H -0.801 -6.851 -2.181 1.00 . B B . 24 PHE HB3 1 1 14 10738 2 2 24 PHE HD1 H -2.216 -4.256 -4.381 1.00 . B B . 24 PHE HD1 1 1 14 10739 2 2 24 PHE HD2 H -0.165 -8.027 -4.213 1.00 . B B . 24 PHE HD2 1 1 14 10740 2 2 24 PHE HE1 H -1.652 -4.055 -6.788 1.00 . B B . 24 PHE HE1 1 1 14 10741 2 2 24 PHE HE2 H 0.400 -7.828 -6.620 1.00 . B B . 24 PHE HE2 1 1 14 10742 2 2 24 PHE HZ H -0.339 -5.840 -7.908 1.00 . B B . 24 PHE HZ 1 1 14 10743 2 2 24 PHE N N -2.918 -8.258 -3.261 1.00 . B B . 24 PHE N 1 1 14 10744 2 2 24 PHE O O -4.193 -5.945 -4.260 1.00 . B B . 24 PHE O 1 1 14 10745 2 2 25 PHE C C -5.352 -3.172 -2.930 1.00 . B B . 25 PHE C 1 1 14 10746 2 2 25 PHE CA C -5.885 -4.586 -2.697 1.00 . B B . 25 PHE CA 1 1 14 10747 2 2 25 PHE CB C -7.023 -4.547 -1.674 1.00 . B B . 25 PHE CB 1 1 14 10748 2 2 25 PHE CD1 C -5.940 -4.839 0.586 1.00 . B B . 25 PHE CD1 1 1 14 10749 2 2 25 PHE CD2 C -6.631 -2.617 -0.105 1.00 . B B . 25 PHE CD2 1 1 14 10750 2 2 25 PHE CE1 C -5.476 -4.317 1.801 1.00 . B B . 25 PHE CE1 1 1 14 10751 2 2 25 PHE CE2 C -6.168 -2.095 1.111 1.00 . B B . 25 PHE CE2 1 1 14 10752 2 2 25 PHE CG C -6.517 -3.988 -0.367 1.00 . B B . 25 PHE CG 1 1 14 10753 2 2 25 PHE CZ C -5.591 -2.945 2.063 1.00 . B B . 25 PHE CZ 1 1 14 10754 2 2 25 PHE H H -4.646 -5.576 -1.243 1.00 . B B . 25 PHE H 1 1 14 10755 2 2 25 PHE HA H -6.256 -4.982 -3.629 1.00 . B B . 25 PHE HA 1 1 14 10756 2 2 25 PHE HB2 H -7.820 -3.923 -2.048 1.00 . B B . 25 PHE HB2 1 1 14 10757 2 2 25 PHE HB3 H -7.395 -5.549 -1.515 1.00 . B B . 25 PHE HB3 1 1 14 10758 2 2 25 PHE HD1 H -5.852 -5.895 0.384 1.00 . B B . 25 PHE HD1 1 1 14 10759 2 2 25 PHE HD2 H -7.076 -1.961 -0.838 1.00 . B B . 25 PHE HD2 1 1 14 10760 2 2 25 PHE HE1 H -5.031 -4.971 2.536 1.00 . B B . 25 PHE HE1 1 1 14 10761 2 2 25 PHE HE2 H -6.256 -1.038 1.313 1.00 . B B . 25 PHE HE2 1 1 14 10762 2 2 25 PHE HZ H -5.234 -2.542 3.000 1.00 . B B . 25 PHE HZ 1 1 14 10763 2 2 25 PHE N N -4.788 -5.459 -2.204 1.00 . B B . 25 PHE N 1 1 14 10764 2 2 25 PHE O O -4.902 -2.507 -2.018 1.00 . B B . 25 PHE O 1 1 14 10765 2 2 26 TYR C C -6.086 -0.473 -4.889 1.00 . B B . 26 TYR C 1 1 14 10766 2 2 26 TYR CA C -4.899 -1.346 -4.457 1.00 . B B . 26 TYR CA 1 1 14 10767 2 2 26 TYR CB C -3.838 -1.450 -5.571 1.00 . B B . 26 TYR CB 1 1 14 10768 2 2 26 TYR CD1 C -3.952 1.037 -5.997 1.00 . B B . 26 TYR CD1 1 1 14 10769 2 2 26 TYR CD2 C -3.939 -0.475 -7.895 1.00 . B B . 26 TYR CD2 1 1 14 10770 2 2 26 TYR CE1 C -4.023 2.131 -6.872 1.00 . B B . 26 TYR CE1 1 1 14 10771 2 2 26 TYR CE2 C -4.011 0.617 -8.769 1.00 . B B . 26 TYR CE2 1 1 14 10772 2 2 26 TYR CG C -3.910 -0.265 -6.511 1.00 . B B . 26 TYR CG 1 1 14 10773 2 2 26 TYR CZ C -4.052 1.921 -8.257 1.00 . B B . 26 TYR CZ 1 1 14 10774 2 2 26 TYR H H -5.767 -3.270 -4.865 1.00 . B B . 26 TYR H 1 1 14 10775 2 2 26 TYR HA H -4.449 -0.919 -3.572 1.00 . B B . 26 TYR HA 1 1 14 10776 2 2 26 TYR HB2 H -2.857 -1.484 -5.122 1.00 . B B . 26 TYR HB2 1 1 14 10777 2 2 26 TYR HB3 H -4.001 -2.357 -6.133 1.00 . B B . 26 TYR HB3 1 1 14 10778 2 2 26 TYR HD1 H -3.930 1.199 -4.930 1.00 . B B . 26 TYR HD1 1 1 14 10779 2 2 26 TYR HD2 H -3.907 -1.480 -8.290 1.00 . B B . 26 TYR HD2 1 1 14 10780 2 2 26 TYR HE1 H -4.056 3.135 -6.478 1.00 . B B . 26 TYR HE1 1 1 14 10781 2 2 26 TYR HE2 H -4.033 0.454 -9.836 1.00 . B B . 26 TYR HE2 1 1 14 10782 2 2 26 TYR HH H -4.097 2.663 -10.015 1.00 . B B . 26 TYR HH 1 1 14 10783 2 2 26 TYR N N -5.399 -2.713 -4.148 1.00 . B B . 26 TYR N 1 1 14 10784 2 2 26 TYR O O -6.415 -0.378 -6.056 1.00 . B B . 26 TYR O 1 1 14 10785 2 2 26 TYR OH O -4.123 2.999 -9.116 1.00 . B B . 26 TYR OH 1 1 14 10786 2 2 27 THR C C -7.405 2.465 -4.495 1.00 . B B . 27 THR C 1 1 14 10787 2 2 27 THR CA C -7.892 1.030 -4.297 1.00 . B B . 27 THR CA 1 1 14 10788 2 2 27 THR CB C -8.928 0.992 -3.167 1.00 . B B . 27 THR CB 1 1 14 10789 2 2 27 THR CG2 C -8.219 0.937 -1.811 1.00 . B B . 27 THR CG2 1 1 14 10790 2 2 27 THR H H -6.448 0.071 -3.018 1.00 . B B . 27 THR H 1 1 14 10791 2 2 27 THR HA H -8.344 0.675 -5.212 1.00 . B B . 27 THR HA 1 1 14 10792 2 2 27 THR HB H -9.549 0.119 -3.279 1.00 . B B . 27 THR HB 1 1 14 10793 2 2 27 THR HG1 H -10.427 2.079 -2.568 1.00 . B B . 27 THR HG1 1 1 14 10794 2 2 27 THR HG21 H -7.356 1.588 -1.830 1.00 . B B . 27 THR HG21 1 1 14 10795 2 2 27 THR HG22 H -7.901 -0.076 -1.614 1.00 . B B . 27 THR HG22 1 1 14 10796 2 2 27 THR HG23 H -8.898 1.259 -1.035 1.00 . B B . 27 THR HG23 1 1 14 10797 2 2 27 THR N N -6.730 0.164 -3.950 1.00 . B B . 27 THR N 1 1 14 10798 2 2 27 THR O O -6.231 2.754 -4.376 1.00 . B B . 27 THR O 1 1 14 10799 2 2 27 THR OG1 O -9.737 2.158 -3.231 1.00 . B B . 27 THR OG1 1 1 14 10800 2 2 28 LYS C C -9.081 5.629 -5.419 1.00 . B B . 28 LYS C 1 1 14 10801 2 2 28 LYS CA C -7.875 4.782 -5.005 1.00 . B B . 28 LYS CA 1 1 14 10802 2 2 28 LYS CB C -6.816 4.837 -6.106 1.00 . B B . 28 LYS CB 1 1 14 10803 2 2 28 LYS CD C -7.522 5.341 -8.449 1.00 . B B . 28 LYS CD 1 1 14 10804 2 2 28 LYS CE C -8.708 5.031 -9.363 1.00 . B B . 28 LYS CE 1 1 14 10805 2 2 28 LYS CG C -7.388 4.242 -7.394 1.00 . B B . 28 LYS CG 1 1 14 10806 2 2 28 LYS H H -9.239 3.116 -4.891 1.00 . B B . 28 LYS H 1 1 14 10807 2 2 28 LYS HA H -7.460 5.171 -4.087 1.00 . B B . 28 LYS HA 1 1 14 10808 2 2 28 LYS HB2 H -6.528 5.863 -6.278 1.00 . B B . 28 LYS HB2 1 1 14 10809 2 2 28 LYS HB3 H -5.952 4.266 -5.802 1.00 . B B . 28 LYS HB3 1 1 14 10810 2 2 28 LYS HD2 H -7.682 6.292 -7.960 1.00 . B B . 28 LYS HD2 1 1 14 10811 2 2 28 LYS HD3 H -6.618 5.386 -9.038 1.00 . B B . 28 LYS HD3 1 1 14 10812 2 2 28 LYS HE2 H -9.176 4.109 -9.047 1.00 . B B . 28 LYS HE2 1 1 14 10813 2 2 28 LYS HE3 H -9.427 5.835 -9.307 1.00 . B B . 28 LYS HE3 1 1 14 10814 2 2 28 LYS HG2 H -6.724 3.471 -7.760 1.00 . B B . 28 LYS HG2 1 1 14 10815 2 2 28 LYS HG3 H -8.360 3.816 -7.195 1.00 . B B . 28 LYS HG3 1 1 14 10816 2 2 28 LYS HZ1 H -8.946 5.268 -11.418 1.00 . B B . 28 LYS HZ1 1 1 14 10817 2 2 28 LYS HZ2 H -8.069 3.882 -10.978 1.00 . B B . 28 LYS HZ2 1 1 14 10818 2 2 28 LYS HZ3 H -7.343 5.415 -10.887 1.00 . B B . 28 LYS HZ3 1 1 14 10819 2 2 28 LYS N N -8.296 3.368 -4.798 1.00 . B B . 28 LYS N 1 1 14 10820 2 2 28 LYS NZ N -8.231 4.888 -10.768 1.00 . B B . 28 LYS NZ 1 1 14 10821 2 2 28 LYS O O -9.253 5.931 -6.582 1.00 . B B . 28 LYS O 1 1 14 10822 2 2 29 PRO C C -10.681 8.287 -4.855 1.00 . B B . 29 PRO C 1 1 14 10823 2 2 29 PRO CA C -11.077 6.819 -4.674 1.00 . B B . 29 PRO CA 1 1 14 10824 2 2 29 PRO CB C -11.893 6.624 -3.394 1.00 . B B . 29 PRO CB 1 1 14 10825 2 2 29 PRO CD C -9.658 5.619 -3.036 1.00 . B B . 29 PRO CD 1 1 14 10826 2 2 29 PRO CG C -10.889 6.181 -2.302 1.00 . B B . 29 PRO CG 1 1 14 10827 2 2 29 PRO HA H -11.632 6.462 -5.526 1.00 . B B . 29 PRO HA 1 1 14 10828 2 2 29 PRO HB2 H -12.368 7.555 -3.113 1.00 . B B . 29 PRO HB2 1 1 14 10829 2 2 29 PRO HB3 H -12.635 5.855 -3.539 1.00 . B B . 29 PRO HB3 1 1 14 10830 2 2 29 PRO HD2 H -8.752 6.072 -2.657 1.00 . B B . 29 PRO HD2 1 1 14 10831 2 2 29 PRO HD3 H -9.616 4.546 -2.939 1.00 . B B . 29 PRO HD3 1 1 14 10832 2 2 29 PRO HG2 H -10.606 7.031 -1.695 1.00 . B B . 29 PRO HG2 1 1 14 10833 2 2 29 PRO HG3 H -11.329 5.412 -1.685 1.00 . B B . 29 PRO HG3 1 1 14 10834 2 2 29 PRO N N -9.877 5.995 -4.448 1.00 . B B . 29 PRO N 1 1 14 10835 2 2 29 PRO O O -9.523 8.643 -4.770 1.00 . B B . 29 PRO O 1 1 14 10836 2 2 30 THR C C -12.590 11.413 -5.233 1.00 . B B . 30 THR C 1 1 14 10837 2 2 30 THR CA C -11.305 10.585 -5.288 1.00 . B B . 30 THR CA 1 1 14 10838 2 2 30 THR CB C -10.628 10.786 -6.647 1.00 . B B . 30 THR CB 1 1 14 10839 2 2 30 THR CG2 C -11.583 10.358 -7.764 1.00 . B B . 30 THR CG2 1 1 14 10840 2 2 30 THR H H -12.562 8.840 -5.167 1.00 . B B . 30 THR H 1 1 14 10841 2 2 30 THR HA H -10.637 10.907 -4.502 1.00 . B B . 30 THR HA 1 1 14 10842 2 2 30 THR HB H -9.734 10.185 -6.695 1.00 . B B . 30 THR HB 1 1 14 10843 2 2 30 THR HG1 H -9.365 12.205 -7.060 1.00 . B B . 30 THR HG1 1 1 14 10844 2 2 30 THR HG21 H -12.159 9.505 -7.439 1.00 . B B . 30 THR HG21 1 1 14 10845 2 2 30 THR HG22 H -11.012 10.094 -8.642 1.00 . B B . 30 THR HG22 1 1 14 10846 2 2 30 THR HG23 H -12.249 11.174 -8.000 1.00 . B B . 30 THR HG23 1 1 14 10847 2 2 30 THR N N -11.634 9.144 -5.103 1.00 . B B . 30 THR N 1 1 14 10848 2 2 30 THR O O -12.487 12.626 -5.148 1.00 . B B . 30 THR O 1 1 14 10849 2 2 30 THR OXT O -13.656 10.820 -5.274 1.00 . B B . 30 THR OXT 1 1 14 10850 2 2 30 THR OG1 O -10.290 12.156 -6.808 1.00 . B B . 30 THR OG1 1 1 15 10851 1 1 1 GLY C C -3.910 6.987 -0.005 1.00 . A A . 1 GLY C 1 1 15 10852 1 1 1 GLY CA C -5.379 7.226 0.070 1.00 . A A . 1 GLY CA 1 1 15 10853 1 1 1 GLY H1 H -7.175 6.284 0.676 1.00 . A A . 1 GLY H1 1 1 15 10854 1 1 1 GLY H2 H -5.853 5.223 0.566 1.00 . A A . 1 GLY H2 1 1 15 10855 1 1 1 GLY H3 H -6.620 5.776 -0.846 1.00 . A A . 1 GLY H3 1 1 15 10856 1 1 1 GLY HA2 H -5.266 7.550 -0.843 1.00 . A A . 1 GLY HA2 1 1 15 10857 1 1 1 GLY HA3 H -5.809 8.036 0.792 1.00 . A A . 1 GLY HA3 1 1 15 10858 1 1 1 GLY N N -6.333 6.032 0.120 1.00 . A A . 1 GLY N 1 1 15 10859 1 1 1 GLY O O -3.128 7.665 0.631 1.00 . A A . 1 GLY O 1 1 15 10860 1 1 2 ILE C C -1.561 6.254 -2.267 1.00 . A A . 2 ILE C 1 1 15 10861 1 1 2 ILE CA C -2.038 5.743 -0.913 1.00 . A A . 2 ILE CA 1 1 15 10862 1 1 2 ILE CB C -1.809 4.237 -0.820 1.00 . A A . 2 ILE CB 1 1 15 10863 1 1 2 ILE CD1 C -0.077 2.461 -0.485 1.00 . A A . 2 ILE CD1 1 1 15 10864 1 1 2 ILE CG1 C -0.304 3.941 -0.798 1.00 . A A . 2 ILE CG1 1 1 15 10865 1 1 2 ILE CG2 C -2.446 3.557 -2.030 1.00 . A A . 2 ILE CG2 1 1 15 10866 1 1 2 ILE H H -4.141 5.500 -1.303 1.00 . A A . 2 ILE H 1 1 15 10867 1 1 2 ILE HA H -1.500 6.243 -0.125 1.00 . A A . 2 ILE HA 1 1 15 10868 1 1 2 ILE HB H -2.266 3.865 0.083 1.00 . A A . 2 ILE HB 1 1 15 10869 1 1 2 ILE HD11 H 0.671 2.368 0.289 1.00 . A A . 2 ILE HD11 1 1 15 10870 1 1 2 ILE HD12 H 0.261 1.952 -1.376 1.00 . A A . 2 ILE HD12 1 1 15 10871 1 1 2 ILE HD13 H -1.002 2.018 -0.146 1.00 . A A . 2 ILE HD13 1 1 15 10872 1 1 2 ILE HG12 H 0.124 4.174 -1.761 1.00 . A A . 2 ILE HG12 1 1 15 10873 1 1 2 ILE HG13 H 0.170 4.543 -0.037 1.00 . A A . 2 ILE HG13 1 1 15 10874 1 1 2 ILE HG21 H -3.512 3.731 -2.019 1.00 . A A . 2 ILE HG21 1 1 15 10875 1 1 2 ILE HG22 H -2.254 2.494 -1.989 1.00 . A A . 2 ILE HG22 1 1 15 10876 1 1 2 ILE HG23 H -2.026 3.966 -2.936 1.00 . A A . 2 ILE HG23 1 1 15 10877 1 1 2 ILE N N -3.495 6.027 -0.788 1.00 . A A . 2 ILE N 1 1 15 10878 1 1 2 ILE O O -0.423 6.644 -2.439 1.00 . A A . 2 ILE O 1 1 15 10879 1 1 3 VAL C C -1.520 8.173 -4.468 1.00 . A A . 3 VAL C 1 1 15 10880 1 1 3 VAL CA C -2.066 6.749 -4.582 1.00 . A A . 3 VAL CA 1 1 15 10881 1 1 3 VAL CB C -3.309 6.745 -5.468 1.00 . A A . 3 VAL CB 1 1 15 10882 1 1 3 VAL CG1 C -2.911 7.057 -6.907 1.00 . A A . 3 VAL CG1 1 1 15 10883 1 1 3 VAL CG2 C -3.971 5.367 -5.410 1.00 . A A . 3 VAL CG2 1 1 15 10884 1 1 3 VAL H H -3.350 5.946 -3.060 1.00 . A A . 3 VAL H 1 1 15 10885 1 1 3 VAL HA H -1.312 6.103 -5.009 1.00 . A A . 3 VAL HA 1 1 15 10886 1 1 3 VAL HB H -4.001 7.493 -5.114 1.00 . A A . 3 VAL HB 1 1 15 10887 1 1 3 VAL HG11 H -3.678 6.697 -7.576 1.00 . A A . 3 VAL HG11 1 1 15 10888 1 1 3 VAL HG12 H -1.975 6.569 -7.134 1.00 . A A . 3 VAL HG12 1 1 15 10889 1 1 3 VAL HG13 H -2.799 8.124 -7.025 1.00 . A A . 3 VAL HG13 1 1 15 10890 1 1 3 VAL HG21 H -4.715 5.357 -4.628 1.00 . A A . 3 VAL HG21 1 1 15 10891 1 1 3 VAL HG22 H -3.221 4.616 -5.204 1.00 . A A . 3 VAL HG22 1 1 15 10892 1 1 3 VAL HG23 H -4.442 5.154 -6.359 1.00 . A A . 3 VAL HG23 1 1 15 10893 1 1 3 VAL N N -2.438 6.261 -3.231 1.00 . A A . 3 VAL N 1 1 15 10894 1 1 3 VAL O O -0.794 8.642 -5.321 1.00 . A A . 3 VAL O 1 1 15 10895 1 1 4 GLU C C -0.272 10.261 -2.169 1.00 . A A . 4 GLU C 1 1 15 10896 1 1 4 GLU CA C -1.361 10.255 -3.241 1.00 . A A . 4 GLU CA 1 1 15 10897 1 1 4 GLU CB C -2.510 11.158 -2.799 1.00 . A A . 4 GLU CB 1 1 15 10898 1 1 4 GLU CD C -2.794 13.550 -3.475 1.00 . A A . 4 GLU CD 1 1 15 10899 1 1 4 GLU CG C -1.990 12.583 -2.602 1.00 . A A . 4 GLU CG 1 1 15 10900 1 1 4 GLU H H -2.447 8.466 -2.740 1.00 . A A . 4 GLU H 1 1 15 10901 1 1 4 GLU HA H -0.955 10.614 -4.175 1.00 . A A . 4 GLU HA 1 1 15 10902 1 1 4 GLU HB2 H -3.284 11.156 -3.554 1.00 . A A . 4 GLU HB2 1 1 15 10903 1 1 4 GLU HB3 H -2.914 10.793 -1.866 1.00 . A A . 4 GLU HB3 1 1 15 10904 1 1 4 GLU HG2 H -2.093 12.864 -1.564 1.00 . A A . 4 GLU HG2 1 1 15 10905 1 1 4 GLU HG3 H -0.949 12.628 -2.885 1.00 . A A . 4 GLU HG3 1 1 15 10906 1 1 4 GLU N N -1.863 8.864 -3.417 1.00 . A A . 4 GLU N 1 1 15 10907 1 1 4 GLU O O 0.665 11.034 -2.223 1.00 . A A . 4 GLU O 1 1 15 10908 1 1 4 GLU OE1 O -2.855 13.326 -4.672 1.00 . A A . 4 GLU OE1 1 1 15 10909 1 1 4 GLU OE2 O -3.334 14.499 -2.930 1.00 . A A . 4 GLU OE2 1 1 15 10910 1 1 5 GLN C C 1.858 8.590 -0.574 1.00 . A A . 5 GLN C 1 1 15 10911 1 1 5 GLN CA C 0.623 9.360 -0.104 1.00 . A A . 5 GLN CA 1 1 15 10912 1 1 5 GLN CB C 0.030 8.657 1.119 1.00 . A A . 5 GLN CB 1 1 15 10913 1 1 5 GLN CD C -0.908 9.327 3.334 1.00 . A A . 5 GLN CD 1 1 15 10914 1 1 5 GLN CG C -0.945 9.596 1.828 1.00 . A A . 5 GLN CG 1 1 15 10915 1 1 5 GLN H H -1.166 8.799 -1.171 1.00 . A A . 5 GLN H 1 1 15 10916 1 1 5 GLN HA H 0.909 10.366 0.162 1.00 . A A . 5 GLN HA 1 1 15 10917 1 1 5 GLN HB2 H -0.492 7.766 0.802 1.00 . A A . 5 GLN HB2 1 1 15 10918 1 1 5 GLN HB3 H 0.825 8.387 1.799 1.00 . A A . 5 GLN HB3 1 1 15 10919 1 1 5 GLN HE21 H -1.282 7.386 3.139 1.00 . A A . 5 GLN HE21 1 1 15 10920 1 1 5 GLN HE22 H -1.085 7.931 4.735 1.00 . A A . 5 GLN HE22 1 1 15 10921 1 1 5 GLN HG2 H -0.661 10.621 1.637 1.00 . A A . 5 GLN HG2 1 1 15 10922 1 1 5 GLN HG3 H -1.945 9.424 1.458 1.00 . A A . 5 GLN HG3 1 1 15 10923 1 1 5 GLN N N -0.396 9.407 -1.192 1.00 . A A . 5 GLN N 1 1 15 10924 1 1 5 GLN NE2 N -1.109 8.114 3.772 1.00 . A A . 5 GLN NE2 1 1 15 10925 1 1 5 GLN O O 2.961 8.839 -0.126 1.00 . A A . 5 GLN O 1 1 15 10926 1 1 5 GLN OE1 O -0.693 10.228 4.118 1.00 . A A . 5 GLN OE1 1 1 15 10927 1 1 6 CYS C C 3.477 7.618 -3.146 1.00 . A A . 6 CYS C 1 1 15 10928 1 1 6 CYS CA C 2.866 6.886 -1.955 1.00 . A A . 6 CYS CA 1 1 15 10929 1 1 6 CYS CB C 2.426 5.485 -2.376 1.00 . A A . 6 CYS CB 1 1 15 10930 1 1 6 CYS H H 0.797 7.471 -1.825 1.00 . A A . 6 CYS H 1 1 15 10931 1 1 6 CYS HA H 3.599 6.812 -1.164 1.00 . A A . 6 CYS HA 1 1 15 10932 1 1 6 CYS HB2 H 1.347 5.445 -2.427 1.00 . A A . 6 CYS HB2 1 1 15 10933 1 1 6 CYS HB3 H 2.840 5.255 -3.344 1.00 . A A . 6 CYS HB3 1 1 15 10934 1 1 6 CYS N N 1.690 7.658 -1.470 1.00 . A A . 6 CYS N 1 1 15 10935 1 1 6 CYS O O 4.635 7.445 -3.472 1.00 . A A . 6 CYS O 1 1 15 10936 1 1 6 CYS SG S 3.018 4.276 -1.166 1.00 . A A . 6 CYS SG 1 1 15 10937 1 1 7 CYS C C 3.863 10.502 -4.456 1.00 . A A . 7 CYS C 1 1 15 10938 1 1 7 CYS CA C 3.232 9.203 -4.957 1.00 . A A . 7 CYS CA 1 1 15 10939 1 1 7 CYS CB C 2.083 9.535 -5.911 1.00 . A A . 7 CYS CB 1 1 15 10940 1 1 7 CYS H H 1.777 8.573 -3.506 1.00 . A A . 7 CYS H 1 1 15 10941 1 1 7 CYS HA H 3.975 8.612 -5.472 1.00 . A A . 7 CYS HA 1 1 15 10942 1 1 7 CYS HB2 H 1.278 9.989 -5.355 1.00 . A A . 7 CYS HB2 1 1 15 10943 1 1 7 CYS HB3 H 2.432 10.219 -6.669 1.00 . A A . 7 CYS HB3 1 1 15 10944 1 1 7 CYS N N 2.705 8.445 -3.793 1.00 . A A . 7 CYS N 1 1 15 10945 1 1 7 CYS O O 4.905 10.920 -4.921 1.00 . A A . 7 CYS O 1 1 15 10946 1 1 7 CYS SG S 1.484 8.025 -6.696 1.00 . A A . 7 CYS SG 1 1 15 10947 1 1 8 THR C C 4.860 12.075 -1.906 1.00 . A A . 8 THR C 1 1 15 10948 1 1 8 THR CA C 3.809 12.411 -2.963 1.00 . A A . 8 THR CA 1 1 15 10949 1 1 8 THR CB C 2.691 13.247 -2.333 1.00 . A A . 8 THR CB 1 1 15 10950 1 1 8 THR CG2 C 3.301 14.367 -1.490 1.00 . A A . 8 THR CG2 1 1 15 10951 1 1 8 THR H H 2.404 10.786 -3.133 1.00 . A A . 8 THR H 1 1 15 10952 1 1 8 THR HA H 4.270 12.968 -3.765 1.00 . A A . 8 THR HA 1 1 15 10953 1 1 8 THR HB H 2.082 12.618 -1.702 1.00 . A A . 8 THR HB 1 1 15 10954 1 1 8 THR HG1 H 1.995 13.276 -4.150 1.00 . A A . 8 THR HG1 1 1 15 10955 1 1 8 THR HG21 H 4.285 14.606 -1.866 1.00 . A A . 8 THR HG21 1 1 15 10956 1 1 8 THR HG22 H 3.379 14.044 -0.462 1.00 . A A . 8 THR HG22 1 1 15 10957 1 1 8 THR HG23 H 2.673 15.245 -1.544 1.00 . A A . 8 THR HG23 1 1 15 10958 1 1 8 THR N N 3.242 11.144 -3.500 1.00 . A A . 8 THR N 1 1 15 10959 1 1 8 THR O O 5.982 12.539 -1.960 1.00 . A A . 8 THR O 1 1 15 10960 1 1 8 THR OG1 O 1.886 13.809 -3.360 1.00 . A A . 8 THR OG1 1 1 15 10961 1 1 9 SER C C 6.053 9.505 -0.197 1.00 . A A . 9 SER C 1 1 15 10962 1 1 9 SER CA C 5.483 10.891 0.112 1.00 . A A . 9 SER CA 1 1 15 10963 1 1 9 SER CB C 4.779 10.863 1.468 1.00 . A A . 9 SER CB 1 1 15 10964 1 1 9 SER H H 3.598 10.898 -0.925 1.00 . A A . 9 SER H 1 1 15 10965 1 1 9 SER HA H 6.284 11.615 0.135 1.00 . A A . 9 SER HA 1 1 15 10966 1 1 9 SER HB2 H 3.822 10.381 1.367 1.00 . A A . 9 SER HB2 1 1 15 10967 1 1 9 SER HB3 H 5.385 10.313 2.175 1.00 . A A . 9 SER HB3 1 1 15 10968 1 1 9 SER HG H 3.950 12.619 1.342 1.00 . A A . 9 SER HG 1 1 15 10969 1 1 9 SER N N 4.506 11.265 -0.947 1.00 . A A . 9 SER N 1 1 15 10970 1 1 9 SER O O 5.334 8.595 -0.559 1.00 . A A . 9 SER O 1 1 15 10971 1 1 9 SER OG O 4.586 12.195 1.924 1.00 . A A . 9 SER OG 1 1 15 10972 1 1 10 ILE C C 7.387 6.979 0.625 1.00 . A A . 10 ILE C 1 1 15 10973 1 1 10 ILE CA C 7.952 8.012 -0.352 1.00 . A A . 10 ILE CA 1 1 15 10974 1 1 10 ILE CB C 9.467 8.108 -0.172 1.00 . A A . 10 ILE CB 1 1 15 10975 1 1 10 ILE CD1 C 11.136 8.679 -2.017 1.00 . A A . 10 ILE CD1 1 1 15 10976 1 1 10 ILE CG1 C 10.012 9.208 -1.113 1.00 . A A . 10 ILE CG1 1 1 15 10977 1 1 10 ILE CG2 C 10.090 6.743 -0.489 1.00 . A A . 10 ILE CG2 1 1 15 10978 1 1 10 ILE H H 7.903 10.085 0.227 1.00 . A A . 10 ILE H 1 1 15 10979 1 1 10 ILE HA H 7.724 7.718 -1.366 1.00 . A A . 10 ILE HA 1 1 15 10980 1 1 10 ILE HB H 9.687 8.370 0.854 1.00 . A A . 10 ILE HB 1 1 15 10981 1 1 10 ILE HD11 H 10.710 8.065 -2.796 1.00 . A A . 10 ILE HD11 1 1 15 10982 1 1 10 ILE HD12 H 11.824 8.089 -1.430 1.00 . A A . 10 ILE HD12 1 1 15 10983 1 1 10 ILE HD13 H 11.662 9.511 -2.462 1.00 . A A . 10 ILE HD13 1 1 15 10984 1 1 10 ILE HG12 H 9.207 9.572 -1.729 1.00 . A A . 10 ILE HG12 1 1 15 10985 1 1 10 ILE HG13 H 10.394 10.023 -0.517 1.00 . A A . 10 ILE HG13 1 1 15 10986 1 1 10 ILE HG21 H 11.079 6.691 -0.062 1.00 . A A . 10 ILE HG21 1 1 15 10987 1 1 10 ILE HG22 H 10.152 6.618 -1.559 1.00 . A A . 10 ILE HG22 1 1 15 10988 1 1 10 ILE HG23 H 9.473 5.961 -0.070 1.00 . A A . 10 ILE HG23 1 1 15 10989 1 1 10 ILE N N 7.339 9.338 -0.062 1.00 . A A . 10 ILE N 1 1 15 10990 1 1 10 ILE O O 7.022 7.305 1.737 1.00 . A A . 10 ILE O 1 1 15 10991 1 1 11 CYS C C 7.599 3.432 1.108 1.00 . A A . 11 CYS C 1 1 15 10992 1 1 11 CYS CA C 6.756 4.706 1.168 1.00 . A A . 11 CYS CA 1 1 15 10993 1 1 11 CYS CB C 5.300 4.375 0.810 1.00 . A A . 11 CYS CB 1 1 15 10994 1 1 11 CYS H H 7.601 5.478 -0.667 1.00 . A A . 11 CYS H 1 1 15 10995 1 1 11 CYS HA H 6.790 5.100 2.174 1.00 . A A . 11 CYS HA 1 1 15 10996 1 1 11 CYS HB2 H 5.114 3.330 1.008 1.00 . A A . 11 CYS HB2 1 1 15 10997 1 1 11 CYS HB3 H 4.638 4.974 1.419 1.00 . A A . 11 CYS HB3 1 1 15 10998 1 1 11 CYS N N 7.306 5.733 0.232 1.00 . A A . 11 CYS N 1 1 15 10999 1 1 11 CYS O O 7.994 2.982 0.051 1.00 . A A . 11 CYS O 1 1 15 11000 1 1 11 CYS SG S 4.977 4.715 -0.939 1.00 . A A . 11 CYS SG 1 1 15 11001 1 1 12 SER C C 7.794 0.383 2.440 1.00 . A A . 12 SER C 1 1 15 11002 1 1 12 SER CA C 8.700 1.607 2.271 1.00 . A A . 12 SER CA 1 1 15 11003 1 1 12 SER CB C 9.682 1.673 3.440 1.00 . A A . 12 SER CB 1 1 15 11004 1 1 12 SER H H 7.550 3.237 3.083 1.00 . A A . 12 SER H 1 1 15 11005 1 1 12 SER HA H 9.249 1.521 1.347 1.00 . A A . 12 SER HA 1 1 15 11006 1 1 12 SER HB2 H 9.854 0.683 3.826 1.00 . A A . 12 SER HB2 1 1 15 11007 1 1 12 SER HB3 H 10.619 2.092 3.097 1.00 . A A . 12 SER HB3 1 1 15 11008 1 1 12 SER HG H 9.293 2.052 5.310 1.00 . A A . 12 SER HG 1 1 15 11009 1 1 12 SER N N 7.879 2.850 2.245 1.00 . A A . 12 SER N 1 1 15 11010 1 1 12 SER O O 6.628 0.496 2.769 1.00 . A A . 12 SER O 1 1 15 11011 1 1 12 SER OG O 9.131 2.486 4.469 1.00 . A A . 12 SER OG 1 1 15 11012 1 1 13 LEU C C 6.525 -1.944 3.470 1.00 . A A . 13 LEU C 1 1 15 11013 1 1 13 LEU CA C 7.538 -2.041 2.331 1.00 . A A . 13 LEU CA 1 1 15 11014 1 1 13 LEU CB C 8.476 -3.215 2.596 1.00 . A A . 13 LEU CB 1 1 15 11015 1 1 13 LEU CD1 C 6.683 -4.729 1.742 1.00 . A A . 13 LEU CD1 1 1 15 11016 1 1 13 LEU CD2 C 8.585 -5.658 3.061 1.00 . A A . 13 LEU CD2 1 1 15 11017 1 1 13 LEU CG C 7.649 -4.464 2.897 1.00 . A A . 13 LEU CG 1 1 15 11018 1 1 13 LEU H H 9.268 -0.836 1.929 1.00 . A A . 13 LEU H 1 1 15 11019 1 1 13 LEU HA H 7.021 -2.213 1.417 1.00 . A A . 13 LEU HA 1 1 15 11020 1 1 13 LEU HB2 H 9.088 -3.390 1.723 1.00 . A A . 13 LEU HB2 1 1 15 11021 1 1 13 LEU HB3 H 9.105 -2.991 3.439 1.00 . A A . 13 LEU HB3 1 1 15 11022 1 1 13 LEU HD11 H 6.598 -5.794 1.582 1.00 . A A . 13 LEU HD11 1 1 15 11023 1 1 13 LEU HD12 H 7.058 -4.259 0.845 1.00 . A A . 13 LEU HD12 1 1 15 11024 1 1 13 LEU HD13 H 5.712 -4.323 1.984 1.00 . A A . 13 LEU HD13 1 1 15 11025 1 1 13 LEU HD21 H 9.037 -5.894 2.108 1.00 . A A . 13 LEU HD21 1 1 15 11026 1 1 13 LEU HD22 H 8.023 -6.509 3.414 1.00 . A A . 13 LEU HD22 1 1 15 11027 1 1 13 LEU HD23 H 9.357 -5.414 3.775 1.00 . A A . 13 LEU HD23 1 1 15 11028 1 1 13 LEU HG H 7.089 -4.314 3.809 1.00 . A A . 13 LEU HG 1 1 15 11029 1 1 13 LEU N N 8.332 -0.785 2.205 1.00 . A A . 13 LEU N 1 1 15 11030 1 1 13 LEU O O 5.373 -2.292 3.315 1.00 . A A . 13 LEU O 1 1 15 11031 1 1 14 TYR C C 4.659 -0.835 5.286 1.00 . A A . 14 TYR C 1 1 15 11032 1 1 14 TYR CA C 6.006 -1.388 5.764 1.00 . A A . 14 TYR CA 1 1 15 11033 1 1 14 TYR CB C 6.602 -0.460 6.825 1.00 . A A . 14 TYR CB 1 1 15 11034 1 1 14 TYR CD1 C 7.890 -2.106 8.240 1.00 . A A . 14 TYR CD1 1 1 15 11035 1 1 14 TYR CD2 C 9.124 -0.522 6.876 1.00 . A A . 14 TYR CD2 1 1 15 11036 1 1 14 TYR CE1 C 9.097 -2.647 8.702 1.00 . A A . 14 TYR CE1 1 1 15 11037 1 1 14 TYR CE2 C 10.331 -1.064 7.339 1.00 . A A . 14 TYR CE2 1 1 15 11038 1 1 14 TYR CG C 7.904 -1.043 7.326 1.00 . A A . 14 TYR CG 1 1 15 11039 1 1 14 TYR CZ C 10.317 -2.125 8.253 1.00 . A A . 14 TYR CZ 1 1 15 11040 1 1 14 TYR H H 7.883 -1.227 4.718 1.00 . A A . 14 TYR H 1 1 15 11041 1 1 14 TYR HA H 5.858 -2.369 6.192 1.00 . A A . 14 TYR HA 1 1 15 11042 1 1 14 TYR HB2 H 6.785 0.512 6.392 1.00 . A A . 14 TYR HB2 1 1 15 11043 1 1 14 TYR HB3 H 5.911 -0.364 7.649 1.00 . A A . 14 TYR HB3 1 1 15 11044 1 1 14 TYR HD1 H 6.950 -2.509 8.587 1.00 . A A . 14 TYR HD1 1 1 15 11045 1 1 14 TYR HD2 H 9.134 0.297 6.172 1.00 . A A . 14 TYR HD2 1 1 15 11046 1 1 14 TYR HE1 H 9.087 -3.467 9.406 1.00 . A A . 14 TYR HE1 1 1 15 11047 1 1 14 TYR HE2 H 11.272 -0.661 6.993 1.00 . A A . 14 TYR HE2 1 1 15 11048 1 1 14 TYR HH H 12.223 -2.250 8.218 1.00 . A A . 14 TYR HH 1 1 15 11049 1 1 14 TYR N N 6.946 -1.491 4.614 1.00 . A A . 14 TYR N 1 1 15 11050 1 1 14 TYR O O 3.645 -1.503 5.360 1.00 . A A . 14 TYR O 1 1 15 11051 1 1 14 TYR OH O 11.506 -2.659 8.709 1.00 . A A . 14 TYR OH 1 1 15 11052 1 1 15 GLN C C 2.715 -0.022 3.310 1.00 . A A . 15 GLN C 1 1 15 11053 1 1 15 GLN CA C 3.353 0.949 4.298 1.00 . A A . 15 GLN CA 1 1 15 11054 1 1 15 GLN CB C 3.622 2.284 3.599 1.00 . A A . 15 GLN CB 1 1 15 11055 1 1 15 GLN CD C 4.907 3.646 5.252 1.00 . A A . 15 GLN CD 1 1 15 11056 1 1 15 GLN CG C 3.534 3.423 4.617 1.00 . A A . 15 GLN CG 1 1 15 11057 1 1 15 GLN H H 5.465 0.889 4.718 1.00 . A A . 15 GLN H 1 1 15 11058 1 1 15 GLN HA H 2.687 1.105 5.134 1.00 . A A . 15 GLN HA 1 1 15 11059 1 1 15 GLN HB2 H 4.609 2.269 3.160 1.00 . A A . 15 GLN HB2 1 1 15 11060 1 1 15 GLN HB3 H 2.886 2.440 2.825 1.00 . A A . 15 GLN HB3 1 1 15 11061 1 1 15 GLN HE21 H 4.162 4.364 6.946 1.00 . A A . 15 GLN HE21 1 1 15 11062 1 1 15 GLN HE22 H 5.856 4.285 6.874 1.00 . A A . 15 GLN HE22 1 1 15 11063 1 1 15 GLN HG2 H 3.214 4.327 4.120 1.00 . A A . 15 GLN HG2 1 1 15 11064 1 1 15 GLN HG3 H 2.822 3.163 5.388 1.00 . A A . 15 GLN HG3 1 1 15 11065 1 1 15 GLN N N 4.638 0.370 4.784 1.00 . A A . 15 GLN N 1 1 15 11066 1 1 15 GLN NE2 N 4.982 4.140 6.458 1.00 . A A . 15 GLN NE2 1 1 15 11067 1 1 15 GLN O O 1.523 -0.254 3.329 1.00 . A A . 15 GLN O 1 1 15 11068 1 1 15 GLN OE1 O 5.923 3.368 4.646 1.00 . A A . 15 GLN OE1 1 1 15 11069 1 1 16 LEU C C 2.244 -2.698 2.183 1.00 . A A . 16 LEU C 1 1 15 11070 1 1 16 LEU CA C 2.952 -1.556 1.454 1.00 . A A . 16 LEU CA 1 1 15 11071 1 1 16 LEU CB C 4.088 -2.128 0.624 1.00 . A A . 16 LEU CB 1 1 15 11072 1 1 16 LEU CD1 C 6.026 -0.698 -0.014 1.00 . A A . 16 LEU CD1 1 1 15 11073 1 1 16 LEU CD2 C 4.503 -1.583 -1.765 1.00 . A A . 16 LEU CD2 1 1 15 11074 1 1 16 LEU CG C 4.582 -1.055 -0.338 1.00 . A A . 16 LEU CG 1 1 15 11075 1 1 16 LEU H H 4.466 -0.392 2.453 1.00 . A A . 16 LEU H 1 1 15 11076 1 1 16 LEU HA H 2.262 -1.047 0.804 1.00 . A A . 16 LEU HA 1 1 15 11077 1 1 16 LEU HB2 H 4.885 -2.434 1.277 1.00 . A A . 16 LEU HB2 1 1 15 11078 1 1 16 LEU HB3 H 3.736 -2.979 0.063 1.00 . A A . 16 LEU HB3 1 1 15 11079 1 1 16 LEU HD11 H 6.138 -0.601 1.054 1.00 . A A . 16 LEU HD11 1 1 15 11080 1 1 16 LEU HD12 H 6.280 0.236 -0.493 1.00 . A A . 16 LEU HD12 1 1 15 11081 1 1 16 LEU HD13 H 6.677 -1.480 -0.376 1.00 . A A . 16 LEU HD13 1 1 15 11082 1 1 16 LEU HD21 H 4.056 -2.566 -1.758 1.00 . A A . 16 LEU HD21 1 1 15 11083 1 1 16 LEU HD22 H 5.498 -1.642 -2.178 1.00 . A A . 16 LEU HD22 1 1 15 11084 1 1 16 LEU HD23 H 3.901 -0.917 -2.362 1.00 . A A . 16 LEU HD23 1 1 15 11085 1 1 16 LEU HG H 3.963 -0.174 -0.240 1.00 . A A . 16 LEU HG 1 1 15 11086 1 1 16 LEU N N 3.505 -0.595 2.447 1.00 . A A . 16 LEU N 1 1 15 11087 1 1 16 LEU O O 1.088 -2.984 1.941 1.00 . A A . 16 LEU O 1 1 15 11088 1 1 17 GLU C C 0.997 -4.051 4.440 1.00 . A A . 17 GLU C 1 1 15 11089 1 1 17 GLU CA C 2.322 -4.492 3.816 1.00 . A A . 17 GLU CA 1 1 15 11090 1 1 17 GLU CB C 3.276 -4.950 4.920 1.00 . A A . 17 GLU CB 1 1 15 11091 1 1 17 GLU CD C 4.341 -7.205 5.145 1.00 . A A . 17 GLU CD 1 1 15 11092 1 1 17 GLU CG C 4.316 -5.908 4.332 1.00 . A A . 17 GLU CG 1 1 15 11093 1 1 17 GLU H H 3.874 -3.111 3.239 1.00 . A A . 17 GLU H 1 1 15 11094 1 1 17 GLU HA H 2.140 -5.309 3.137 1.00 . A A . 17 GLU HA 1 1 15 11095 1 1 17 GLU HB2 H 3.776 -4.090 5.343 1.00 . A A . 17 GLU HB2 1 1 15 11096 1 1 17 GLU HB3 H 2.717 -5.458 5.691 1.00 . A A . 17 GLU HB3 1 1 15 11097 1 1 17 GLU HG2 H 4.060 -6.130 3.306 1.00 . A A . 17 GLU HG2 1 1 15 11098 1 1 17 GLU HG3 H 5.291 -5.445 4.368 1.00 . A A . 17 GLU HG3 1 1 15 11099 1 1 17 GLU N N 2.938 -3.358 3.069 1.00 . A A . 17 GLU N 1 1 15 11100 1 1 17 GLU O O 0.167 -4.865 4.793 1.00 . A A . 17 GLU O 1 1 15 11101 1 1 17 GLU OE1 O 3.653 -7.265 6.151 1.00 . A A . 17 GLU OE1 1 1 15 11102 1 1 17 GLU OE2 O 5.048 -8.115 4.747 1.00 . A A . 17 GLU OE2 1 1 15 11103 1 1 18 ASN C C -1.548 -2.126 4.111 1.00 . A A . 18 ASN C 1 1 15 11104 1 1 18 ASN CA C -0.482 -2.292 5.196 1.00 . A A . 18 ASN CA 1 1 15 11105 1 1 18 ASN CB C -0.244 -0.947 5.883 1.00 . A A . 18 ASN CB 1 1 15 11106 1 1 18 ASN CG C -0.711 -1.027 7.337 1.00 . A A . 18 ASN CG 1 1 15 11107 1 1 18 ASN H H 1.472 -2.130 4.302 1.00 . A A . 18 ASN H 1 1 15 11108 1 1 18 ASN HA H -0.824 -3.012 5.924 1.00 . A A . 18 ASN HA 1 1 15 11109 1 1 18 ASN HB2 H 0.809 -0.707 5.853 1.00 . A A . 18 ASN HB2 1 1 15 11110 1 1 18 ASN HB3 H -0.802 -0.177 5.371 1.00 . A A . 18 ASN HB3 1 1 15 11111 1 1 18 ASN HD21 H 0.827 0.018 8.035 1.00 . A A . 18 ASN HD21 1 1 15 11112 1 1 18 ASN HD22 H -0.288 -0.502 9.205 1.00 . A A . 18 ASN HD22 1 1 15 11113 1 1 18 ASN N N 0.790 -2.773 4.587 1.00 . A A . 18 ASN N 1 1 15 11114 1 1 18 ASN ND2 N 0.002 -0.457 8.269 1.00 . A A . 18 ASN ND2 1 1 15 11115 1 1 18 ASN O O -2.572 -1.508 4.326 1.00 . A A . 18 ASN O 1 1 15 11116 1 1 18 ASN OD1 O -1.733 -1.615 7.628 1.00 . A A . 18 ASN OD1 1 1 15 11117 1 1 19 TYR C C -2.428 -3.853 1.089 1.00 . A A . 19 TYR C 1 1 15 11118 1 1 19 TYR CA C -2.334 -2.540 1.863 1.00 . A A . 19 TYR CA 1 1 15 11119 1 1 19 TYR CB C -1.919 -1.414 0.917 1.00 . A A . 19 TYR CB 1 1 15 11120 1 1 19 TYR CD1 C -2.972 0.494 2.185 1.00 . A A . 19 TYR CD1 1 1 15 11121 1 1 19 TYR CD2 C -0.559 0.449 1.926 1.00 . A A . 19 TYR CD2 1 1 15 11122 1 1 19 TYR CE1 C -2.872 1.690 2.909 1.00 . A A . 19 TYR CE1 1 1 15 11123 1 1 19 TYR CE2 C -0.459 1.644 2.649 1.00 . A A . 19 TYR CE2 1 1 15 11124 1 1 19 TYR CG C -1.815 -0.125 1.694 1.00 . A A . 19 TYR CG 1 1 15 11125 1 1 19 TYR CZ C -1.615 2.266 3.140 1.00 . A A . 19 TYR CZ 1 1 15 11126 1 1 19 TYR H H -0.492 -3.169 2.789 1.00 . A A . 19 TYR H 1 1 15 11127 1 1 19 TYR HA H -3.298 -2.309 2.295 1.00 . A A . 19 TYR HA 1 1 15 11128 1 1 19 TYR HB2 H -0.961 -1.649 0.476 1.00 . A A . 19 TYR HB2 1 1 15 11129 1 1 19 TYR HB3 H -2.659 -1.305 0.138 1.00 . A A . 19 TYR HB3 1 1 15 11130 1 1 19 TYR HD1 H -3.941 0.048 2.007 1.00 . A A . 19 TYR HD1 1 1 15 11131 1 1 19 TYR HD2 H 0.330 -0.031 1.548 1.00 . A A . 19 TYR HD2 1 1 15 11132 1 1 19 TYR HE1 H -3.763 2.169 3.288 1.00 . A A . 19 TYR HE1 1 1 15 11133 1 1 19 TYR HE2 H 0.510 2.087 2.828 1.00 . A A . 19 TYR HE2 1 1 15 11134 1 1 19 TYR HH H -2.105 3.385 4.607 1.00 . A A . 19 TYR HH 1 1 15 11135 1 1 19 TYR N N -1.323 -2.672 2.948 1.00 . A A . 19 TYR N 1 1 15 11136 1 1 19 TYR O O -2.467 -3.869 -0.125 1.00 . A A . 19 TYR O 1 1 15 11137 1 1 19 TYR OH O -1.515 3.444 3.852 1.00 . A A . 19 TYR OH 1 1 15 11138 1 1 20 CYS C C -2.860 -7.368 2.099 1.00 . A A . 20 CYS C 1 1 15 11139 1 1 20 CYS CA C -2.558 -6.267 1.083 1.00 . A A . 20 CYS CA 1 1 15 11140 1 1 20 CYS CB C -1.232 -6.566 0.384 1.00 . A A . 20 CYS CB 1 1 15 11141 1 1 20 CYS H H -2.433 -4.921 2.761 1.00 . A A . 20 CYS H 1 1 15 11142 1 1 20 CYS HA H -3.349 -6.227 0.349 1.00 . A A . 20 CYS HA 1 1 15 11143 1 1 20 CYS HB2 H -1.099 -5.885 -0.444 1.00 . A A . 20 CYS HB2 1 1 15 11144 1 1 20 CYS HB3 H -0.419 -6.443 1.086 1.00 . A A . 20 CYS HB3 1 1 15 11145 1 1 20 CYS N N -2.466 -4.956 1.782 1.00 . A A . 20 CYS N 1 1 15 11146 1 1 20 CYS O O -2.626 -7.218 3.281 1.00 . A A . 20 CYS O 1 1 15 11147 1 1 20 CYS SG S -1.245 -8.268 -0.232 1.00 . A A . 20 CYS SG 1 1 15 11148 1 1 21 ASN C C -2.388 -10.143 3.171 1.00 . A A . 21 ASN C 1 1 15 11149 1 1 21 ASN CA C -3.690 -9.590 2.587 1.00 . A A . 21 ASN CA 1 1 15 11150 1 1 21 ASN CB C -4.427 -10.700 1.837 1.00 . A A . 21 ASN CB 1 1 15 11151 1 1 21 ASN CG C -5.817 -10.206 1.435 1.00 . A A . 21 ASN CG 1 1 15 11152 1 1 21 ASN H H -3.557 -8.581 0.689 1.00 . A A . 21 ASN H 1 1 15 11153 1 1 21 ASN HA H -4.315 -9.219 3.387 1.00 . A A . 21 ASN HA 1 1 15 11154 1 1 21 ASN HB2 H -3.868 -10.969 0.953 1.00 . A A . 21 ASN HB2 1 1 15 11155 1 1 21 ASN HB3 H -4.525 -11.564 2.478 1.00 . A A . 21 ASN HB3 1 1 15 11156 1 1 21 ASN HD21 H -6.210 -11.789 0.302 1.00 . A A . 21 ASN HD21 1 1 15 11157 1 1 21 ASN HD22 H -7.443 -10.624 0.374 1.00 . A A . 21 ASN HD22 1 1 15 11158 1 1 21 ASN N N -3.377 -8.478 1.646 1.00 . A A . 21 ASN N 1 1 15 11159 1 1 21 ASN ND2 N -6.551 -10.934 0.637 1.00 . A A . 21 ASN ND2 1 1 15 11160 1 1 21 ASN O O -2.370 -11.308 3.530 1.00 . A A . 21 ASN O 1 1 15 11161 1 1 21 ASN OXT O -1.430 -9.391 3.250 1.00 . A A . 21 ASN OXT 1 1 15 11162 1 1 21 ASN OD1 O -6.241 -9.147 1.851 1.00 . A A . 21 ASN OD1 1 1 15 11163 2 2 1 PHE C C 13.071 -1.262 -0.633 1.00 . B B . 1 PHE C 1 1 15 11164 2 2 1 PHE CA C 12.628 -2.562 -1.309 1.00 . B B . 1 PHE CA 1 1 15 11165 2 2 1 PHE CB C 11.119 -2.515 -1.566 1.00 . B B . 1 PHE CB 1 1 15 11166 2 2 1 PHE CD1 C 11.576 -1.583 -3.863 1.00 . B B . 1 PHE CD1 1 1 15 11167 2 2 1 PHE CD2 C 9.912 -3.334 -3.625 1.00 . B B . 1 PHE CD2 1 1 15 11168 2 2 1 PHE CE1 C 11.340 -1.546 -5.244 1.00 . B B . 1 PHE CE1 1 1 15 11169 2 2 1 PHE CE2 C 9.676 -3.297 -5.006 1.00 . B B . 1 PHE CE2 1 1 15 11170 2 2 1 PHE CG C 10.863 -2.476 -3.053 1.00 . B B . 1 PHE CG 1 1 15 11171 2 2 1 PHE CZ C 10.390 -2.402 -5.815 1.00 . B B . 1 PHE CZ 1 1 15 11172 2 2 1 PHE H1 H 12.633 -4.600 -0.875 1.00 . B B . 1 PHE H1 1 1 15 11173 2 2 1 PHE H2 H 12.456 -3.602 0.488 1.00 . B B . 1 PHE H2 1 1 15 11174 2 2 1 PHE H3 H 13.972 -3.760 -0.261 1.00 . B B . 1 PHE H3 1 1 15 11175 2 2 1 PHE HA H 13.149 -2.675 -2.248 1.00 . B B . 1 PHE HA 1 1 15 11176 2 2 1 PHE HB2 H 10.654 -3.392 -1.143 1.00 . B B . 1 PHE HB2 1 1 15 11177 2 2 1 PHE HB3 H 10.703 -1.630 -1.107 1.00 . B B . 1 PHE HB3 1 1 15 11178 2 2 1 PHE HD1 H 12.309 -0.923 -3.422 1.00 . B B . 1 PHE HD1 1 1 15 11179 2 2 1 PHE HD2 H 9.362 -4.023 -3.001 1.00 . B B . 1 PHE HD2 1 1 15 11180 2 2 1 PHE HE1 H 11.891 -0.857 -5.867 1.00 . B B . 1 PHE HE1 1 1 15 11181 2 2 1 PHE HE2 H 8.943 -3.956 -5.447 1.00 . B B . 1 PHE HE2 1 1 15 11182 2 2 1 PHE HZ H 10.207 -2.374 -6.879 1.00 . B B . 1 PHE HZ 1 1 15 11183 2 2 1 PHE N N 12.946 -3.718 -0.422 1.00 . B B . 1 PHE N 1 1 15 11184 2 2 1 PHE O O 12.592 -0.905 0.425 1.00 . B B . 1 PHE O 1 1 15 11185 2 2 2 VAL C C 13.297 1.693 -0.477 1.00 . B B . 2 VAL C 1 1 15 11186 2 2 2 VAL CA C 14.466 0.717 -0.640 1.00 . B B . 2 VAL CA 1 1 15 11187 2 2 2 VAL CB C 15.513 1.327 -1.568 1.00 . B B . 2 VAL CB 1 1 15 11188 2 2 2 VAL CG1 C 16.838 0.580 -1.406 1.00 . B B . 2 VAL CG1 1 1 15 11189 2 2 2 VAL CG2 C 15.039 1.214 -3.020 1.00 . B B . 2 VAL CG2 1 1 15 11190 2 2 2 VAL H H 14.360 -0.857 -2.087 1.00 . B B . 2 VAL H 1 1 15 11191 2 2 2 VAL HA H 14.910 0.520 0.323 1.00 . B B . 2 VAL HA 1 1 15 11192 2 2 2 VAL HB H 15.651 2.362 -1.316 1.00 . B B . 2 VAL HB 1 1 15 11193 2 2 2 VAL HG11 H 17.380 0.985 -0.564 1.00 . B B . 2 VAL HG11 1 1 15 11194 2 2 2 VAL HG12 H 17.429 0.694 -2.303 1.00 . B B . 2 VAL HG12 1 1 15 11195 2 2 2 VAL HG13 H 16.641 -0.468 -1.237 1.00 . B B . 2 VAL HG13 1 1 15 11196 2 2 2 VAL HG21 H 15.649 0.492 -3.542 1.00 . B B . 2 VAL HG21 1 1 15 11197 2 2 2 VAL HG22 H 15.130 2.176 -3.504 1.00 . B B . 2 VAL HG22 1 1 15 11198 2 2 2 VAL HG23 H 14.008 0.897 -3.039 1.00 . B B . 2 VAL HG23 1 1 15 11199 2 2 2 VAL N N 13.986 -0.554 -1.237 1.00 . B B . 2 VAL N 1 1 15 11200 2 2 2 VAL O O 12.159 1.367 -0.747 1.00 . B B . 2 VAL O 1 1 15 11201 2 2 3 ASN C C 12.236 4.595 -1.206 1.00 . B B . 3 ASN C 1 1 15 11202 2 2 3 ASN CA C 12.483 3.897 0.135 1.00 . B B . 3 ASN CA 1 1 15 11203 2 2 3 ASN CB C 12.893 4.937 1.192 1.00 . B B . 3 ASN CB 1 1 15 11204 2 2 3 ASN CG C 14.026 4.390 2.065 1.00 . B B . 3 ASN CG 1 1 15 11205 2 2 3 ASN H H 14.501 3.134 0.165 1.00 . B B . 3 ASN H 1 1 15 11206 2 2 3 ASN HA H 11.580 3.395 0.453 1.00 . B B . 3 ASN HA 1 1 15 11207 2 2 3 ASN HB2 H 13.224 5.838 0.698 1.00 . B B . 3 ASN HB2 1 1 15 11208 2 2 3 ASN HB3 H 12.043 5.164 1.818 1.00 . B B . 3 ASN HB3 1 1 15 11209 2 2 3 ASN HD21 H 12.811 3.806 3.523 1.00 . B B . 3 ASN HD21 1 1 15 11210 2 2 3 ASN HD22 H 14.460 3.501 3.787 1.00 . B B . 3 ASN HD22 1 1 15 11211 2 2 3 ASN N N 13.574 2.892 -0.042 1.00 . B B . 3 ASN N 1 1 15 11212 2 2 3 ASN ND2 N 13.742 3.855 3.221 1.00 . B B . 3 ASN ND2 1 1 15 11213 2 2 3 ASN O O 12.686 5.701 -1.434 1.00 . B B . 3 ASN O 1 1 15 11214 2 2 3 ASN OD1 O 15.180 4.450 1.692 1.00 . B B . 3 ASN OD1 1 1 15 11215 2 2 4 GLN C C 9.877 5.152 -3.525 1.00 . B B . 4 GLN C 1 1 15 11216 2 2 4 GLN CA C 11.291 4.558 -3.443 1.00 . B B . 4 GLN CA 1 1 15 11217 2 2 4 GLN CB C 11.446 3.482 -4.519 1.00 . B B . 4 GLN CB 1 1 15 11218 2 2 4 GLN CD C 12.787 3.371 -6.623 1.00 . B B . 4 GLN CD 1 1 15 11219 2 2 4 GLN CG C 12.857 3.544 -5.105 1.00 . B B . 4 GLN CG 1 1 15 11220 2 2 4 GLN H H 11.205 3.048 -1.907 1.00 . B B . 4 GLN H 1 1 15 11221 2 2 4 GLN HA H 12.015 5.338 -3.620 1.00 . B B . 4 GLN HA 1 1 15 11222 2 2 4 GLN HB2 H 11.280 2.509 -4.080 1.00 . B B . 4 GLN HB2 1 1 15 11223 2 2 4 GLN HB3 H 10.724 3.651 -5.304 1.00 . B B . 4 GLN HB3 1 1 15 11224 2 2 4 GLN HE21 H 11.668 1.734 -6.527 1.00 . B B . 4 GLN HE21 1 1 15 11225 2 2 4 GLN HE22 H 12.069 2.248 -8.094 1.00 . B B . 4 GLN HE22 1 1 15 11226 2 2 4 GLN HG2 H 13.300 4.501 -4.870 1.00 . B B . 4 GLN HG2 1 1 15 11227 2 2 4 GLN HG3 H 13.458 2.754 -4.682 1.00 . B B . 4 GLN HG3 1 1 15 11228 2 2 4 GLN N N 11.543 3.946 -2.105 1.00 . B B . 4 GLN N 1 1 15 11229 2 2 4 GLN NE2 N 12.119 2.368 -7.123 1.00 . B B . 4 GLN NE2 1 1 15 11230 2 2 4 GLN O O 9.113 5.127 -2.575 1.00 . B B . 4 GLN O 1 1 15 11231 2 2 4 GLN OE1 O 13.344 4.158 -7.362 1.00 . B B . 4 GLN OE1 1 1 15 11232 2 2 5 HIS C C 7.242 5.229 -5.464 1.00 . B B . 5 HIS C 1 1 15 11233 2 2 5 HIS CA C 8.181 6.282 -4.870 1.00 . B B . 5 HIS CA 1 1 15 11234 2 2 5 HIS CB C 8.278 7.454 -5.851 1.00 . B B . 5 HIS CB 1 1 15 11235 2 2 5 HIS CD2 C 8.256 9.225 -3.926 1.00 . B B . 5 HIS CD2 1 1 15 11236 2 2 5 HIS CE1 C 9.708 10.597 -4.782 1.00 . B B . 5 HIS CE1 1 1 15 11237 2 2 5 HIS CG C 8.671 8.709 -5.122 1.00 . B B . 5 HIS CG 1 1 15 11238 2 2 5 HIS H H 10.172 5.678 -5.418 1.00 . B B . 5 HIS H 1 1 15 11239 2 2 5 HIS HA H 7.793 6.628 -3.924 1.00 . B B . 5 HIS HA 1 1 15 11240 2 2 5 HIS HB2 H 9.019 7.231 -6.604 1.00 . B B . 5 HIS HB2 1 1 15 11241 2 2 5 HIS HB3 H 7.319 7.603 -6.326 1.00 . B B . 5 HIS HB3 1 1 15 11242 2 2 5 HIS HD2 H 7.537 8.772 -3.261 1.00 . B B . 5 HIS HD2 1 1 15 11243 2 2 5 HIS HE1 H 10.356 11.449 -4.922 1.00 . B B . 5 HIS HE1 1 1 15 11244 2 2 5 HIS HE2 H 8.815 11.017 -2.937 1.00 . B B . 5 HIS HE2 1 1 15 11245 2 2 5 HIS N N 9.533 5.681 -4.675 1.00 . B B . 5 HIS N 1 1 15 11246 2 2 5 HIS ND1 N 9.591 9.587 -5.654 1.00 . B B . 5 HIS ND1 1 1 15 11247 2 2 5 HIS NE2 N 8.909 10.420 -3.710 1.00 . B B . 5 HIS NE2 1 1 15 11248 2 2 5 HIS O O 7.507 4.672 -6.511 1.00 . B B . 5 HIS O 1 1 15 11249 2 2 6 LEU C C 4.027 4.670 -6.036 1.00 . B B . 6 LEU C 1 1 15 11250 2 2 6 LEU CA C 5.195 3.947 -5.359 1.00 . B B . 6 LEU CA 1 1 15 11251 2 2 6 LEU CB C 4.673 3.075 -4.215 1.00 . B B . 6 LEU CB 1 1 15 11252 2 2 6 LEU CD1 C 5.285 1.923 -2.086 1.00 . B B . 6 LEU CD1 1 1 15 11253 2 2 6 LEU CD2 C 6.913 1.992 -3.980 1.00 . B B . 6 LEU CD2 1 1 15 11254 2 2 6 LEU CG C 5.815 2.767 -3.246 1.00 . B B . 6 LEU CG 1 1 15 11255 2 2 6 LEU H H 5.942 5.422 -3.978 1.00 . B B . 6 LEU H 1 1 15 11256 2 2 6 LEU HA H 5.701 3.327 -6.083 1.00 . B B . 6 LEU HA 1 1 15 11257 2 2 6 LEU HB2 H 3.888 3.602 -3.692 1.00 . B B . 6 LEU HB2 1 1 15 11258 2 2 6 LEU HB3 H 4.284 2.151 -4.615 1.00 . B B . 6 LEU HB3 1 1 15 11259 2 2 6 LEU HD11 H 5.410 0.875 -2.317 1.00 . B B . 6 LEU HD11 1 1 15 11260 2 2 6 LEU HD12 H 4.236 2.136 -1.936 1.00 . B B . 6 LEU HD12 1 1 15 11261 2 2 6 LEU HD13 H 5.833 2.161 -1.186 1.00 . B B . 6 LEU HD13 1 1 15 11262 2 2 6 LEU HD21 H 7.614 2.687 -4.416 1.00 . B B . 6 LEU HD21 1 1 15 11263 2 2 6 LEU HD22 H 6.469 1.391 -4.759 1.00 . B B . 6 LEU HD22 1 1 15 11264 2 2 6 LEU HD23 H 7.429 1.350 -3.281 1.00 . B B . 6 LEU HD23 1 1 15 11265 2 2 6 LEU HG H 6.220 3.693 -2.862 1.00 . B B . 6 LEU HG 1 1 15 11266 2 2 6 LEU N N 6.146 4.957 -4.815 1.00 . B B . 6 LEU N 1 1 15 11267 2 2 6 LEU O O 3.089 5.086 -5.390 1.00 . B B . 6 LEU O 1 1 15 11268 2 2 7 CYS C C 2.357 4.673 -9.120 1.00 . B B . 7 CYS C 1 1 15 11269 2 2 7 CYS CA C 2.964 5.549 -8.019 1.00 . B B . 7 CYS CA 1 1 15 11270 2 2 7 CYS CB C 3.494 6.842 -8.641 1.00 . B B . 7 CYS CB 1 1 15 11271 2 2 7 CYS H H 4.844 4.506 -7.841 1.00 . B B . 7 CYS H 1 1 15 11272 2 2 7 CYS HA H 2.203 5.790 -7.297 1.00 . B B . 7 CYS HA 1 1 15 11273 2 2 7 CYS HB2 H 4.362 7.175 -8.093 1.00 . B B . 7 CYS HB2 1 1 15 11274 2 2 7 CYS HB3 H 3.769 6.657 -9.670 1.00 . B B . 7 CYS HB3 1 1 15 11275 2 2 7 CYS N N 4.077 4.837 -7.330 1.00 . B B . 7 CYS N 1 1 15 11276 2 2 7 CYS O O 3.048 4.175 -9.986 1.00 . B B . 7 CYS O 1 1 15 11277 2 2 7 CYS SG S 2.210 8.119 -8.580 1.00 . B B . 7 CYS SG 1 1 15 11278 2 2 8 GLY C C 1.220 2.484 -10.544 1.00 . B B . 8 GLY C 1 1 15 11279 2 2 8 GLY CA C 0.369 3.689 -10.136 1.00 . B B . 8 GLY CA 1 1 15 11280 2 2 8 GLY H H 0.533 4.936 -8.389 1.00 . B B . 8 GLY H 1 1 15 11281 2 2 8 GLY HA2 H -0.576 3.339 -9.744 1.00 . B B . 8 GLY HA2 1 1 15 11282 2 2 8 GLY HA3 H 0.187 4.303 -11.005 1.00 . B B . 8 GLY HA3 1 1 15 11283 2 2 8 GLY N N 1.060 4.506 -9.094 1.00 . B B . 8 GLY N 1 1 15 11284 2 2 8 GLY O O 1.352 1.525 -9.809 1.00 . B B . 8 GLY O 1 1 15 11285 2 2 9 SER C C 3.496 0.862 -11.062 1.00 . B B . 9 SER C 1 1 15 11286 2 2 9 SER CA C 2.611 1.375 -12.199 1.00 . B B . 9 SER CA 1 1 15 11287 2 2 9 SER CB C 3.492 1.829 -13.363 1.00 . B B . 9 SER CB 1 1 15 11288 2 2 9 SER H H 1.652 3.302 -12.300 1.00 . B B . 9 SER H 1 1 15 11289 2 2 9 SER HA H 1.962 0.579 -12.532 1.00 . B B . 9 SER HA 1 1 15 11290 2 2 9 SER HB2 H 4.270 2.477 -12.998 1.00 . B B . 9 SER HB2 1 1 15 11291 2 2 9 SER HB3 H 3.938 0.962 -13.834 1.00 . B B . 9 SER HB3 1 1 15 11292 2 2 9 SER HG H 2.643 2.011 -15.106 1.00 . B B . 9 SER HG 1 1 15 11293 2 2 9 SER N N 1.784 2.521 -11.723 1.00 . B B . 9 SER N 1 1 15 11294 2 2 9 SER O O 3.280 -0.210 -10.532 1.00 . B B . 9 SER O 1 1 15 11295 2 2 9 SER OG O 2.695 2.538 -14.304 1.00 . B B . 9 SER OG 1 1 15 11296 2 2 10 ASP C C 4.516 0.746 -8.399 1.00 . B B . 10 ASP C 1 1 15 11297 2 2 10 ASP CA C 5.377 1.169 -9.578 1.00 . B B . 10 ASP CA 1 1 15 11298 2 2 10 ASP CB C 6.274 2.329 -9.148 1.00 . B B . 10 ASP CB 1 1 15 11299 2 2 10 ASP CG C 7.116 2.797 -10.337 1.00 . B B . 10 ASP CG 1 1 15 11300 2 2 10 ASP H H 4.642 2.478 -11.117 1.00 . B B . 10 ASP H 1 1 15 11301 2 2 10 ASP HA H 5.979 0.336 -9.907 1.00 . B B . 10 ASP HA 1 1 15 11302 2 2 10 ASP HB2 H 5.656 3.144 -8.795 1.00 . B B . 10 ASP HB2 1 1 15 11303 2 2 10 ASP HB3 H 6.927 2.002 -8.354 1.00 . B B . 10 ASP HB3 1 1 15 11304 2 2 10 ASP N N 4.487 1.616 -10.682 1.00 . B B . 10 ASP N 1 1 15 11305 2 2 10 ASP O O 4.728 -0.286 -7.794 1.00 . B B . 10 ASP O 1 1 15 11306 2 2 10 ASP OD1 O 7.763 1.960 -10.946 1.00 . B B . 10 ASP OD1 1 1 15 11307 2 2 10 ASP OD2 O 7.098 3.984 -10.619 1.00 . B B . 10 ASP OD2 1 1 15 11308 2 2 11 LEU C C 2.280 -0.274 -7.036 1.00 . B B . 11 LEU C 1 1 15 11309 2 2 11 LEU CA C 2.648 1.203 -6.936 1.00 . B B . 11 LEU CA 1 1 15 11310 2 2 11 LEU CB C 1.388 2.065 -7.038 1.00 . B B . 11 LEU CB 1 1 15 11311 2 2 11 LEU CD1 C 1.711 2.359 -4.532 1.00 . B B . 11 LEU CD1 1 1 15 11312 2 2 11 LEU CD2 C -0.103 3.556 -5.736 1.00 . B B . 11 LEU CD2 1 1 15 11313 2 2 11 LEU CG C 0.696 2.257 -5.677 1.00 . B B . 11 LEU CG 1 1 15 11314 2 2 11 LEU H H 3.393 2.366 -8.581 1.00 . B B . 11 LEU H 1 1 15 11315 2 2 11 LEU HA H 3.164 1.391 -6.015 1.00 . B B . 11 LEU HA 1 1 15 11316 2 2 11 LEU HB2 H 1.657 3.030 -7.435 1.00 . B B . 11 LEU HB2 1 1 15 11317 2 2 11 LEU HB3 H 0.696 1.586 -7.719 1.00 . B B . 11 LEU HB3 1 1 15 11318 2 2 11 LEU HD11 H 1.188 2.571 -3.609 1.00 . B B . 11 LEU HD11 1 1 15 11319 2 2 11 LEU HD12 H 2.407 3.157 -4.739 1.00 . B B . 11 LEU HD12 1 1 15 11320 2 2 11 LEU HD13 H 2.245 1.427 -4.434 1.00 . B B . 11 LEU HD13 1 1 15 11321 2 2 11 LEU HD21 H 0.325 4.273 -5.051 1.00 . B B . 11 LEU HD21 1 1 15 11322 2 2 11 LEU HD22 H -1.129 3.363 -5.464 1.00 . B B . 11 LEU HD22 1 1 15 11323 2 2 11 LEU HD23 H -0.065 3.953 -6.741 1.00 . B B . 11 LEU HD23 1 1 15 11324 2 2 11 LEU HG H 0.024 1.432 -5.491 1.00 . B B . 11 LEU HG 1 1 15 11325 2 2 11 LEU N N 3.541 1.542 -8.072 1.00 . B B . 11 LEU N 1 1 15 11326 2 2 11 LEU O O 2.470 -1.040 -6.112 1.00 . B B . 11 LEU O 1 1 15 11327 2 2 12 ALA C C 2.689 -2.928 -8.397 1.00 . B B . 12 ALA C 1 1 15 11328 2 2 12 ALA CA C 1.409 -2.109 -8.346 1.00 . B B . 12 ALA CA 1 1 15 11329 2 2 12 ALA CB C 0.667 -2.289 -9.669 1.00 . B B . 12 ALA CB 1 1 15 11330 2 2 12 ALA H H 1.642 -0.045 -8.900 1.00 . B B . 12 ALA H 1 1 15 11331 2 2 12 ALA HA H 0.790 -2.441 -7.524 1.00 . B B . 12 ALA HA 1 1 15 11332 2 2 12 ALA HB1 H 1.190 -1.755 -10.448 1.00 . B B . 12 ALA HB1 1 1 15 11333 2 2 12 ALA HB2 H -0.335 -1.903 -9.576 1.00 . B B . 12 ALA HB2 1 1 15 11334 2 2 12 ALA HB3 H 0.630 -3.340 -9.917 1.00 . B B . 12 ALA HB3 1 1 15 11335 2 2 12 ALA N N 1.772 -0.680 -8.165 1.00 . B B . 12 ALA N 1 1 15 11336 2 2 12 ALA O O 2.909 -3.804 -7.590 1.00 . B B . 12 ALA O 1 1 15 11337 2 2 13 GLU C C 5.424 -3.541 -8.059 1.00 . B B . 13 GLU C 1 1 15 11338 2 2 13 GLU CA C 4.806 -3.401 -9.449 1.00 . B B . 13 GLU CA 1 1 15 11339 2 2 13 GLU CB C 5.763 -2.650 -10.370 1.00 . B B . 13 GLU CB 1 1 15 11340 2 2 13 GLU CD C 7.003 -4.307 -11.762 1.00 . B B . 13 GLU CD 1 1 15 11341 2 2 13 GLU CG C 7.053 -3.447 -10.498 1.00 . B B . 13 GLU CG 1 1 15 11342 2 2 13 GLU H H 3.346 -1.925 -9.979 1.00 . B B . 13 GLU H 1 1 15 11343 2 2 13 GLU HA H 4.607 -4.382 -9.855 1.00 . B B . 13 GLU HA 1 1 15 11344 2 2 13 GLU HB2 H 5.310 -2.534 -11.344 1.00 . B B . 13 GLU HB2 1 1 15 11345 2 2 13 GLU HB3 H 5.980 -1.679 -9.953 1.00 . B B . 13 GLU HB3 1 1 15 11346 2 2 13 GLU HG2 H 7.886 -2.765 -10.556 1.00 . B B . 13 GLU HG2 1 1 15 11347 2 2 13 GLU HG3 H 7.163 -4.084 -9.635 1.00 . B B . 13 GLU HG3 1 1 15 11348 2 2 13 GLU N N 3.540 -2.642 -9.342 1.00 . B B . 13 GLU N 1 1 15 11349 2 2 13 GLU O O 6.102 -4.506 -7.767 1.00 . B B . 13 GLU O 1 1 15 11350 2 2 13 GLU OE1 O 7.327 -3.792 -12.819 1.00 . B B . 13 GLU OE1 1 1 15 11351 2 2 13 GLU OE2 O 6.640 -5.467 -11.651 1.00 . B B . 13 GLU OE2 1 1 15 11352 2 2 14 ALA C C 4.929 -3.704 -5.026 1.00 . B B . 14 ALA C 1 1 15 11353 2 2 14 ALA CA C 5.753 -2.694 -5.820 1.00 . B B . 14 ALA CA 1 1 15 11354 2 2 14 ALA CB C 5.690 -1.328 -5.133 1.00 . B B . 14 ALA CB 1 1 15 11355 2 2 14 ALA H H 4.627 -1.824 -7.442 1.00 . B B . 14 ALA H 1 1 15 11356 2 2 14 ALA HA H 6.780 -3.031 -5.872 1.00 . B B . 14 ALA HA 1 1 15 11357 2 2 14 ALA HB1 H 4.688 -1.154 -4.770 1.00 . B B . 14 ALA HB1 1 1 15 11358 2 2 14 ALA HB2 H 5.957 -0.557 -5.840 1.00 . B B . 14 ALA HB2 1 1 15 11359 2 2 14 ALA HB3 H 6.381 -1.311 -4.302 1.00 . B B . 14 ALA HB3 1 1 15 11360 2 2 14 ALA N N 5.187 -2.594 -7.193 1.00 . B B . 14 ALA N 1 1 15 11361 2 2 14 ALA O O 5.454 -4.651 -4.476 1.00 . B B . 14 ALA O 1 1 15 11362 2 2 15 LEU C C 2.819 -5.831 -4.966 1.00 . B B . 15 LEU C 1 1 15 11363 2 2 15 LEU CA C 2.782 -4.488 -4.233 1.00 . B B . 15 LEU CA 1 1 15 11364 2 2 15 LEU CB C 1.343 -3.970 -4.193 1.00 . B B . 15 LEU CB 1 1 15 11365 2 2 15 LEU CD1 C -0.077 -2.015 -3.570 1.00 . B B . 15 LEU CD1 1 1 15 11366 2 2 15 LEU CD2 C 1.485 -3.004 -1.899 1.00 . B B . 15 LEU CD2 1 1 15 11367 2 2 15 LEU CG C 1.286 -2.678 -3.378 1.00 . B B . 15 LEU CG 1 1 15 11368 2 2 15 LEU H H 3.226 -2.760 -5.443 1.00 . B B . 15 LEU H 1 1 15 11369 2 2 15 LEU HA H 3.159 -4.604 -3.225 1.00 . B B . 15 LEU HA 1 1 15 11370 2 2 15 LEU HB2 H 1.005 -3.775 -5.201 1.00 . B B . 15 LEU HB2 1 1 15 11371 2 2 15 LEU HB3 H 0.705 -4.711 -3.736 1.00 . B B . 15 LEU HB3 1 1 15 11372 2 2 15 LEU HD11 H 0.036 -0.942 -3.521 1.00 . B B . 15 LEU HD11 1 1 15 11373 2 2 15 LEU HD12 H -0.749 -2.343 -2.790 1.00 . B B . 15 LEU HD12 1 1 15 11374 2 2 15 LEU HD13 H -0.480 -2.291 -4.533 1.00 . B B . 15 LEU HD13 1 1 15 11375 2 2 15 LEU HD21 H 0.695 -3.661 -1.567 1.00 . B B . 15 LEU HD21 1 1 15 11376 2 2 15 LEU HD22 H 1.459 -2.089 -1.325 1.00 . B B . 15 LEU HD22 1 1 15 11377 2 2 15 LEU HD23 H 2.439 -3.489 -1.762 1.00 . B B . 15 LEU HD23 1 1 15 11378 2 2 15 LEU HG H 2.064 -2.007 -3.711 1.00 . B B . 15 LEU HG 1 1 15 11379 2 2 15 LEU N N 3.636 -3.523 -4.978 1.00 . B B . 15 LEU N 1 1 15 11380 2 2 15 LEU O O 2.660 -6.883 -4.381 1.00 . B B . 15 LEU O 1 1 15 11381 2 2 16 TYR C C 4.330 -7.833 -6.686 1.00 . B B . 16 TYR C 1 1 15 11382 2 2 16 TYR CA C 3.092 -7.029 -7.067 1.00 . B B . 16 TYR CA 1 1 15 11383 2 2 16 TYR CB C 3.205 -6.648 -8.544 1.00 . B B . 16 TYR CB 1 1 15 11384 2 2 16 TYR CD1 C 2.148 -8.799 -9.304 1.00 . B B . 16 TYR CD1 1 1 15 11385 2 2 16 TYR CD2 C 1.251 -6.698 -10.120 1.00 . B B . 16 TYR CD2 1 1 15 11386 2 2 16 TYR CE1 C 1.189 -9.498 -10.048 1.00 . B B . 16 TYR CE1 1 1 15 11387 2 2 16 TYR CE2 C 0.290 -7.395 -10.865 1.00 . B B . 16 TYR CE2 1 1 15 11388 2 2 16 TYR CG C 2.176 -7.400 -9.341 1.00 . B B . 16 TYR CG 1 1 15 11389 2 2 16 TYR CZ C 0.258 -8.796 -10.829 1.00 . B B . 16 TYR CZ 1 1 15 11390 2 2 16 TYR H H 3.159 -4.916 -6.687 1.00 . B B . 16 TYR H 1 1 15 11391 2 2 16 TYR HA H 2.203 -7.620 -6.908 1.00 . B B . 16 TYR HA 1 1 15 11392 2 2 16 TYR HB2 H 3.044 -5.588 -8.659 1.00 . B B . 16 TYR HB2 1 1 15 11393 2 2 16 TYR HB3 H 4.189 -6.900 -8.906 1.00 . B B . 16 TYR HB3 1 1 15 11394 2 2 16 TYR HD1 H 2.868 -9.336 -8.701 1.00 . B B . 16 TYR HD1 1 1 15 11395 2 2 16 TYR HD2 H 1.280 -5.618 -10.145 1.00 . B B . 16 TYR HD2 1 1 15 11396 2 2 16 TYR HE1 H 1.165 -10.576 -10.020 1.00 . B B . 16 TYR HE1 1 1 15 11397 2 2 16 TYR HE2 H -0.425 -6.852 -11.466 1.00 . B B . 16 TYR HE2 1 1 15 11398 2 2 16 TYR HH H -0.363 -9.562 -12.463 1.00 . B B . 16 TYR HH 1 1 15 11399 2 2 16 TYR N N 3.034 -5.784 -6.251 1.00 . B B . 16 TYR N 1 1 15 11400 2 2 16 TYR O O 4.402 -9.027 -6.901 1.00 . B B . 16 TYR O 1 1 15 11401 2 2 16 TYR OH O -0.687 -9.483 -11.563 1.00 . B B . 16 TYR OH 1 1 15 11402 2 2 17 LEU C C 6.601 -8.154 -4.292 1.00 . B B . 17 LEU C 1 1 15 11403 2 2 17 LEU CA C 6.567 -7.873 -5.798 1.00 . B B . 17 LEU CA 1 1 15 11404 2 2 17 LEU CB C 7.714 -6.961 -6.201 1.00 . B B . 17 LEU CB 1 1 15 11405 2 2 17 LEU CD1 C 8.995 -9.126 -6.157 1.00 . B B . 17 LEU CD1 1 1 15 11406 2 2 17 LEU CD2 C 10.098 -6.994 -6.802 1.00 . B B . 17 LEU CD2 1 1 15 11407 2 2 17 LEU CG C 9.051 -7.614 -5.892 1.00 . B B . 17 LEU CG 1 1 15 11408 2 2 17 LEU H H 5.250 -6.212 -6.016 1.00 . B B . 17 LEU H 1 1 15 11409 2 2 17 LEU HA H 6.643 -8.799 -6.344 1.00 . B B . 17 LEU HA 1 1 15 11410 2 2 17 LEU HB2 H 7.654 -6.759 -7.260 1.00 . B B . 17 LEU HB2 1 1 15 11411 2 2 17 LEU HB3 H 7.639 -6.031 -5.656 1.00 . B B . 17 LEU HB3 1 1 15 11412 2 2 17 LEU HD11 H 8.311 -9.325 -6.969 1.00 . B B . 17 LEU HD11 1 1 15 11413 2 2 17 LEU HD12 H 8.658 -9.639 -5.270 1.00 . B B . 17 LEU HD12 1 1 15 11414 2 2 17 LEU HD13 H 9.979 -9.479 -6.423 1.00 . B B . 17 LEU HD13 1 1 15 11415 2 2 17 LEU HD21 H 9.773 -7.087 -7.830 1.00 . B B . 17 LEU HD21 1 1 15 11416 2 2 17 LEU HD22 H 11.036 -7.508 -6.671 1.00 . B B . 17 LEU HD22 1 1 15 11417 2 2 17 LEU HD23 H 10.214 -5.950 -6.555 1.00 . B B . 17 LEU HD23 1 1 15 11418 2 2 17 LEU HG H 9.300 -7.424 -4.864 1.00 . B B . 17 LEU HG 1 1 15 11419 2 2 17 LEU N N 5.318 -7.178 -6.156 1.00 . B B . 17 LEU N 1 1 15 11420 2 2 17 LEU O O 7.497 -8.804 -3.791 1.00 . B B . 17 LEU O 1 1 15 11421 2 2 18 VAL C C 4.563 -8.982 -1.772 1.00 . B B . 18 VAL C 1 1 15 11422 2 2 18 VAL CA C 5.622 -7.930 -2.093 1.00 . B B . 18 VAL CA 1 1 15 11423 2 2 18 VAL CB C 5.316 -6.627 -1.342 1.00 . B B . 18 VAL CB 1 1 15 11424 2 2 18 VAL CG1 C 5.957 -5.458 -2.076 1.00 . B B . 18 VAL CG1 1 1 15 11425 2 2 18 VAL CG2 C 3.804 -6.388 -1.264 1.00 . B B . 18 VAL CG2 1 1 15 11426 2 2 18 VAL H H 4.913 -7.154 -3.973 1.00 . B B . 18 VAL H 1 1 15 11427 2 2 18 VAL HA H 6.591 -8.297 -1.789 1.00 . B B . 18 VAL HA 1 1 15 11428 2 2 18 VAL HB H 5.723 -6.685 -0.346 1.00 . B B . 18 VAL HB 1 1 15 11429 2 2 18 VAL HG11 H 6.617 -4.936 -1.404 1.00 . B B . 18 VAL HG11 1 1 15 11430 2 2 18 VAL HG12 H 5.183 -4.788 -2.418 1.00 . B B . 18 VAL HG12 1 1 15 11431 2 2 18 VAL HG13 H 6.517 -5.826 -2.921 1.00 . B B . 18 VAL HG13 1 1 15 11432 2 2 18 VAL HG21 H 3.352 -7.146 -0.642 1.00 . B B . 18 VAL HG21 1 1 15 11433 2 2 18 VAL HG22 H 3.380 -6.432 -2.255 1.00 . B B . 18 VAL HG22 1 1 15 11434 2 2 18 VAL HG23 H 3.617 -5.413 -0.835 1.00 . B B . 18 VAL HG23 1 1 15 11435 2 2 18 VAL N N 5.632 -7.676 -3.560 1.00 . B B . 18 VAL N 1 1 15 11436 2 2 18 VAL O O 4.764 -9.853 -0.948 1.00 . B B . 18 VAL O 1 1 15 11437 2 2 19 CYS C C 2.271 -10.890 -3.297 1.00 . B B . 19 CYS C 1 1 15 11438 2 2 19 CYS CA C 2.356 -9.889 -2.144 1.00 . B B . 19 CYS CA 1 1 15 11439 2 2 19 CYS CB C 1.020 -9.159 -2.010 1.00 . B B . 19 CYS CB 1 1 15 11440 2 2 19 CYS H H 3.290 -8.188 -3.069 1.00 . B B . 19 CYS H 1 1 15 11441 2 2 19 CYS HA H 2.575 -10.409 -1.226 1.00 . B B . 19 CYS HA 1 1 15 11442 2 2 19 CYS HB2 H 1.059 -8.234 -2.567 1.00 . B B . 19 CYS HB2 1 1 15 11443 2 2 19 CYS HB3 H 0.228 -9.781 -2.399 1.00 . B B . 19 CYS HB3 1 1 15 11444 2 2 19 CYS N N 3.431 -8.902 -2.414 1.00 . B B . 19 CYS N 1 1 15 11445 2 2 19 CYS O O 2.007 -12.058 -3.098 1.00 . B B . 19 CYS O 1 1 15 11446 2 2 19 CYS SG S 0.701 -8.797 -0.267 1.00 . B B . 19 CYS SG 1 1 15 11447 2 2 20 GLY C C 0.951 -11.821 -5.842 1.00 . B B . 20 GLY C 1 1 15 11448 2 2 20 GLY CA C 2.401 -11.369 -5.667 1.00 . B B . 20 GLY CA 1 1 15 11449 2 2 20 GLY H H 2.687 -9.492 -4.646 1.00 . B B . 20 GLY H 1 1 15 11450 2 2 20 GLY HA2 H 2.735 -10.859 -6.560 1.00 . B B . 20 GLY HA2 1 1 15 11451 2 2 20 GLY HA3 H 3.025 -12.230 -5.487 1.00 . B B . 20 GLY HA3 1 1 15 11452 2 2 20 GLY N N 2.481 -10.440 -4.503 1.00 . B B . 20 GLY N 1 1 15 11453 2 2 20 GLY O O 0.056 -11.014 -6.000 1.00 . B B . 20 GLY O 1 1 15 11454 2 2 21 GLU C C -1.429 -13.444 -4.628 1.00 . B B . 21 GLU C 1 1 15 11455 2 2 21 GLU CA C -0.692 -13.593 -5.961 1.00 . B B . 21 GLU CA 1 1 15 11456 2 2 21 GLU CB C -0.676 -15.067 -6.371 1.00 . B B . 21 GLU CB 1 1 15 11457 2 2 21 GLU CD C 1.209 -16.653 -5.955 1.00 . B B . 21 GLU CD 1 1 15 11458 2 2 21 GLU CG C 0.055 -15.886 -5.306 1.00 . B B . 21 GLU CG 1 1 15 11459 2 2 21 GLU H H 1.439 -13.738 -5.670 1.00 . B B . 21 GLU H 1 1 15 11460 2 2 21 GLU HA H -1.196 -13.012 -6.719 1.00 . B B . 21 GLU HA 1 1 15 11461 2 2 21 GLU HB2 H -1.691 -15.424 -6.467 1.00 . B B . 21 GLU HB2 1 1 15 11462 2 2 21 GLU HB3 H -0.166 -15.172 -7.317 1.00 . B B . 21 GLU HB3 1 1 15 11463 2 2 21 GLU HG2 H 0.444 -15.222 -4.547 1.00 . B B . 21 GLU HG2 1 1 15 11464 2 2 21 GLU HG3 H -0.632 -16.586 -4.855 1.00 . B B . 21 GLU HG3 1 1 15 11465 2 2 21 GLU N N 0.706 -13.102 -5.806 1.00 . B B . 21 GLU N 1 1 15 11466 2 2 21 GLU O O -2.598 -13.755 -4.515 1.00 . B B . 21 GLU O 1 1 15 11467 2 2 21 GLU OE1 O 2.254 -16.055 -6.151 1.00 . B B . 21 GLU OE1 1 1 15 11468 2 2 21 GLU OE2 O 1.027 -17.824 -6.243 1.00 . B B . 21 GLU OE2 1 1 15 11469 2 2 22 ARG C C -2.615 -11.865 -2.432 1.00 . B B . 22 ARG C 1 1 15 11470 2 2 22 ARG CA C -1.413 -12.801 -2.290 1.00 . B B . 22 ARG CA 1 1 15 11471 2 2 22 ARG CB C -0.413 -12.203 -1.299 1.00 . B B . 22 ARG CB 1 1 15 11472 2 2 22 ARG CD C -0.631 -14.134 0.273 1.00 . B B . 22 ARG CD 1 1 15 11473 2 2 22 ARG CG C 0.342 -13.329 -0.590 1.00 . B B . 22 ARG CG 1 1 15 11474 2 2 22 ARG CZ C -1.009 -14.493 2.639 1.00 . B B . 22 ARG CZ 1 1 15 11475 2 2 22 ARG H H 0.188 -12.726 -3.725 1.00 . B B . 22 ARG H 1 1 15 11476 2 2 22 ARG HA H -1.747 -13.761 -1.930 1.00 . B B . 22 ARG HA 1 1 15 11477 2 2 22 ARG HB2 H 0.289 -11.577 -1.830 1.00 . B B . 22 ARG HB2 1 1 15 11478 2 2 22 ARG HB3 H -0.941 -11.610 -0.566 1.00 . B B . 22 ARG HB3 1 1 15 11479 2 2 22 ARG HD2 H -1.628 -13.734 0.160 1.00 . B B . 22 ARG HD2 1 1 15 11480 2 2 22 ARG HD3 H -0.621 -15.168 -0.040 1.00 . B B . 22 ARG HD3 1 1 15 11481 2 2 22 ARG HE H 0.647 -13.649 1.939 1.00 . B B . 22 ARG HE 1 1 15 11482 2 2 22 ARG HG2 H 0.793 -13.978 -1.327 1.00 . B B . 22 ARG HG2 1 1 15 11483 2 2 22 ARG HG3 H 1.112 -12.907 0.038 1.00 . B B . 22 ARG HG3 1 1 15 11484 2 2 22 ARG HH11 H -2.683 -13.859 1.744 1.00 . B B . 22 ARG HH11 1 1 15 11485 2 2 22 ARG HH12 H -2.905 -14.673 3.257 1.00 . B B . 22 ARG HH12 1 1 15 11486 2 2 22 ARG HH21 H 0.483 -15.230 3.755 1.00 . B B . 22 ARG HH21 1 1 15 11487 2 2 22 ARG HH22 H -1.112 -15.448 4.396 1.00 . B B . 22 ARG HH22 1 1 15 11488 2 2 22 ARG N N -0.755 -12.970 -3.614 1.00 . B B . 22 ARG N 1 1 15 11489 2 2 22 ARG NE N -0.218 -14.044 1.703 1.00 . B B . 22 ARG NE 1 1 15 11490 2 2 22 ARG NH1 N -2.299 -14.328 2.538 1.00 . B B . 22 ARG NH1 1 1 15 11491 2 2 22 ARG NH2 N -0.507 -15.105 3.678 1.00 . B B . 22 ARG NH2 1 1 15 11492 2 2 22 ARG O O -3.506 -11.854 -1.606 1.00 . B B . 22 ARG O 1 1 15 11493 2 2 23 GLY C C -3.565 -8.876 -2.859 1.00 . B B . 23 GLY C 1 1 15 11494 2 2 23 GLY CA C -3.790 -10.151 -3.674 1.00 . B B . 23 GLY CA 1 1 15 11495 2 2 23 GLY H H -1.917 -11.114 -4.127 1.00 . B B . 23 GLY H 1 1 15 11496 2 2 23 GLY HA2 H -3.870 -9.899 -4.722 1.00 . B B . 23 GLY HA2 1 1 15 11497 2 2 23 GLY HA3 H -4.702 -10.626 -3.347 1.00 . B B . 23 GLY HA3 1 1 15 11498 2 2 23 GLY N N -2.645 -11.084 -3.474 1.00 . B B . 23 GLY N 1 1 15 11499 2 2 23 GLY O O -3.641 -8.881 -1.645 1.00 . B B . 23 GLY O 1 1 15 11500 2 2 24 PHE C C -4.063 -5.455 -3.274 1.00 . B B . 24 PHE C 1 1 15 11501 2 2 24 PHE CA C -3.072 -6.506 -2.777 1.00 . B B . 24 PHE CA 1 1 15 11502 2 2 24 PHE CB C -1.641 -6.019 -3.011 1.00 . B B . 24 PHE CB 1 1 15 11503 2 2 24 PHE CD1 C -1.005 -7.105 -5.194 1.00 . B B . 24 PHE CD1 1 1 15 11504 2 2 24 PHE CD2 C -1.484 -4.726 -5.169 1.00 . B B . 24 PHE CD2 1 1 15 11505 2 2 24 PHE CE1 C -0.753 -7.041 -6.570 1.00 . B B . 24 PHE CE1 1 1 15 11506 2 2 24 PHE CE2 C -1.229 -4.661 -6.545 1.00 . B B . 24 PHE CE2 1 1 15 11507 2 2 24 PHE CG C -1.371 -5.948 -4.494 1.00 . B B . 24 PHE CG 1 1 15 11508 2 2 24 PHE CZ C -0.863 -5.817 -7.246 1.00 . B B . 24 PHE CZ 1 1 15 11509 2 2 24 PHE H H -3.241 -7.796 -4.494 1.00 . B B . 24 PHE H 1 1 15 11510 2 2 24 PHE HA H -3.229 -6.674 -1.723 1.00 . B B . 24 PHE HA 1 1 15 11511 2 2 24 PHE HB2 H -1.519 -5.037 -2.577 1.00 . B B . 24 PHE HB2 1 1 15 11512 2 2 24 PHE HB3 H -0.946 -6.705 -2.552 1.00 . B B . 24 PHE HB3 1 1 15 11513 2 2 24 PHE HD1 H -0.920 -8.047 -4.673 1.00 . B B . 24 PHE HD1 1 1 15 11514 2 2 24 PHE HD2 H -1.765 -3.835 -4.629 1.00 . B B . 24 PHE HD2 1 1 15 11515 2 2 24 PHE HE1 H -0.472 -7.933 -7.109 1.00 . B B . 24 PHE HE1 1 1 15 11516 2 2 24 PHE HE2 H -1.317 -3.719 -7.066 1.00 . B B . 24 PHE HE2 1 1 15 11517 2 2 24 PHE HZ H -0.664 -5.766 -8.306 1.00 . B B . 24 PHE HZ 1 1 15 11518 2 2 24 PHE N N -3.294 -7.780 -3.515 1.00 . B B . 24 PHE N 1 1 15 11519 2 2 24 PHE O O -4.215 -5.242 -4.460 1.00 . B B . 24 PHE O 1 1 15 11520 2 2 25 PHE C C -5.148 -2.371 -2.646 1.00 . B B . 25 PHE C 1 1 15 11521 2 2 25 PHE CA C -5.741 -3.775 -2.797 1.00 . B B . 25 PHE CA 1 1 15 11522 2 2 25 PHE CB C -6.992 -3.899 -1.927 1.00 . B B . 25 PHE CB 1 1 15 11523 2 2 25 PHE CD1 C -6.355 -2.504 0.072 1.00 . B B . 25 PHE CD1 1 1 15 11524 2 2 25 PHE CD2 C -6.502 -4.913 0.333 1.00 . B B . 25 PHE CD2 1 1 15 11525 2 2 25 PHE CE1 C -5.998 -2.379 1.419 1.00 . B B . 25 PHE CE1 1 1 15 11526 2 2 25 PHE CE2 C -6.145 -4.787 1.682 1.00 . B B . 25 PHE CE2 1 1 15 11527 2 2 25 PHE CG C -6.607 -3.769 -0.473 1.00 . B B . 25 PHE CG 1 1 15 11528 2 2 25 PHE CZ C -5.892 -3.520 2.225 1.00 . B B . 25 PHE CZ 1 1 15 11529 2 2 25 PHE H H -4.619 -4.996 -1.424 1.00 . B B . 25 PHE H 1 1 15 11530 2 2 25 PHE HA H -6.006 -3.941 -3.829 1.00 . B B . 25 PHE HA 1 1 15 11531 2 2 25 PHE HB2 H -7.690 -3.115 -2.187 1.00 . B B . 25 PHE HB2 1 1 15 11532 2 2 25 PHE HB3 H -7.453 -4.861 -2.093 1.00 . B B . 25 PHE HB3 1 1 15 11533 2 2 25 PHE HD1 H -6.436 -1.626 -0.547 1.00 . B B . 25 PHE HD1 1 1 15 11534 2 2 25 PHE HD2 H -6.696 -5.890 -0.084 1.00 . B B . 25 PHE HD2 1 1 15 11535 2 2 25 PHE HE1 H -5.804 -1.401 1.836 1.00 . B B . 25 PHE HE1 1 1 15 11536 2 2 25 PHE HE2 H -6.065 -5.666 2.302 1.00 . B B . 25 PHE HE2 1 1 15 11537 2 2 25 PHE HZ H -5.617 -3.423 3.265 1.00 . B B . 25 PHE HZ 1 1 15 11538 2 2 25 PHE N N -4.749 -4.803 -2.376 1.00 . B B . 25 PHE N 1 1 15 11539 2 2 25 PHE O O -4.470 -2.072 -1.682 1.00 . B B . 25 PHE O 1 1 15 11540 2 2 26 TYR C C -5.993 0.869 -3.890 1.00 . B B . 26 TYR C 1 1 15 11541 2 2 26 TYR CA C -4.877 -0.112 -3.499 1.00 . B B . 26 TYR CA 1 1 15 11542 2 2 26 TYR CB C -3.672 0.032 -4.445 1.00 . B B . 26 TYR CB 1 1 15 11543 2 2 26 TYR CD1 C -4.902 -0.716 -6.519 1.00 . B B . 26 TYR CD1 1 1 15 11544 2 2 26 TYR CD2 C -3.849 1.469 -6.505 1.00 . B B . 26 TYR CD2 1 1 15 11545 2 2 26 TYR CE1 C -5.355 -0.489 -7.824 1.00 . B B . 26 TYR CE1 1 1 15 11546 2 2 26 TYR CE2 C -4.304 1.699 -7.808 1.00 . B B . 26 TYR CE2 1 1 15 11547 2 2 26 TYR CG C -4.147 0.263 -5.861 1.00 . B B . 26 TYR CG 1 1 15 11548 2 2 26 TYR CZ C -5.057 0.718 -8.470 1.00 . B B . 26 TYR CZ 1 1 15 11549 2 2 26 TYR H H -5.966 -1.763 -4.353 1.00 . B B . 26 TYR H 1 1 15 11550 2 2 26 TYR HA H -4.565 0.088 -2.484 1.00 . B B . 26 TYR HA 1 1 15 11551 2 2 26 TYR HB2 H -3.068 0.871 -4.130 1.00 . B B . 26 TYR HB2 1 1 15 11552 2 2 26 TYR HB3 H -3.079 -0.870 -4.408 1.00 . B B . 26 TYR HB3 1 1 15 11553 2 2 26 TYR HD1 H -5.132 -1.647 -6.021 1.00 . B B . 26 TYR HD1 1 1 15 11554 2 2 26 TYR HD2 H -3.268 2.224 -5.996 1.00 . B B . 26 TYR HD2 1 1 15 11555 2 2 26 TYR HE1 H -5.937 -1.244 -8.331 1.00 . B B . 26 TYR HE1 1 1 15 11556 2 2 26 TYR HE2 H -4.075 2.630 -8.302 1.00 . B B . 26 TYR HE2 1 1 15 11557 2 2 26 TYR HH H -5.295 1.853 -9.986 1.00 . B B . 26 TYR HH 1 1 15 11558 2 2 26 TYR N N -5.410 -1.502 -3.587 1.00 . B B . 26 TYR N 1 1 15 11559 2 2 26 TYR O O -5.825 1.722 -4.738 1.00 . B B . 26 TYR O 1 1 15 11560 2 2 26 TYR OH O -5.505 0.946 -9.755 1.00 . B B . 26 TYR OH 1 1 15 11561 2 2 27 THR C C -7.832 3.034 -3.963 1.00 . B B . 27 THR C 1 1 15 11562 2 2 27 THR CA C -8.296 1.617 -3.606 1.00 . B B . 27 THR CA 1 1 15 11563 2 2 27 THR CB C -9.232 1.679 -2.401 1.00 . B B . 27 THR CB 1 1 15 11564 2 2 27 THR CG2 C -9.492 0.267 -1.881 1.00 . B B . 27 THR CG2 1 1 15 11565 2 2 27 THR H H -7.254 0.028 -2.611 1.00 . B B . 27 THR H 1 1 15 11566 2 2 27 THR HA H -8.829 1.198 -4.445 1.00 . B B . 27 THR HA 1 1 15 11567 2 2 27 THR HB H -10.164 2.125 -2.696 1.00 . B B . 27 THR HB 1 1 15 11568 2 2 27 THR HG1 H -9.099 2.281 -0.557 1.00 . B B . 27 THR HG1 1 1 15 11569 2 2 27 THR HG21 H -10.398 0.261 -1.293 1.00 . B B . 27 THR HG21 1 1 15 11570 2 2 27 THR HG22 H -8.662 -0.051 -1.268 1.00 . B B . 27 THR HG22 1 1 15 11571 2 2 27 THR HG23 H -9.601 -0.410 -2.716 1.00 . B B . 27 THR HG23 1 1 15 11572 2 2 27 THR N N -7.142 0.732 -3.281 1.00 . B B . 27 THR N 1 1 15 11573 2 2 27 THR O O -6.778 3.482 -3.557 1.00 . B B . 27 THR O 1 1 15 11574 2 2 27 THR OG1 O -8.634 2.462 -1.377 1.00 . B B . 27 THR OG1 1 1 15 11575 2 2 28 LYS C C -8.201 6.019 -3.878 1.00 . B B . 28 LYS C 1 1 15 11576 2 2 28 LYS CA C -8.270 5.129 -5.124 1.00 . B B . 28 LYS CA 1 1 15 11577 2 2 28 LYS CB C -9.342 5.664 -6.080 1.00 . B B . 28 LYS CB 1 1 15 11578 2 2 28 LYS CD C -10.878 4.005 -7.147 1.00 . B B . 28 LYS CD 1 1 15 11579 2 2 28 LYS CE C -11.955 4.905 -7.757 1.00 . B B . 28 LYS CE 1 1 15 11580 2 2 28 LYS CG C -9.516 4.694 -7.252 1.00 . B B . 28 LYS CG 1 1 15 11581 2 2 28 LYS H H -9.475 3.347 -5.030 1.00 . B B . 28 LYS H 1 1 15 11582 2 2 28 LYS HA H -7.311 5.126 -5.621 1.00 . B B . 28 LYS HA 1 1 15 11583 2 2 28 LYS HB2 H -10.279 5.760 -5.551 1.00 . B B . 28 LYS HB2 1 1 15 11584 2 2 28 LYS HB3 H -9.044 6.628 -6.458 1.00 . B B . 28 LYS HB3 1 1 15 11585 2 2 28 LYS HD2 H -10.848 3.066 -7.679 1.00 . B B . 28 LYS HD2 1 1 15 11586 2 2 28 LYS HD3 H -11.111 3.823 -6.108 1.00 . B B . 28 LYS HD3 1 1 15 11587 2 2 28 LYS HE2 H -12.927 4.593 -7.405 1.00 . B B . 28 LYS HE2 1 1 15 11588 2 2 28 LYS HE3 H -11.778 5.930 -7.464 1.00 . B B . 28 LYS HE3 1 1 15 11589 2 2 28 LYS HG2 H -9.458 5.241 -8.184 1.00 . B B . 28 LYS HG2 1 1 15 11590 2 2 28 LYS HG3 H -8.734 3.950 -7.223 1.00 . B B . 28 LYS HG3 1 1 15 11591 2 2 28 LYS HZ1 H -10.923 4.875 -9.565 1.00 . B B . 28 LYS HZ1 1 1 15 11592 2 2 28 LYS HZ2 H -12.472 5.566 -9.663 1.00 . B B . 28 LYS HZ2 1 1 15 11593 2 2 28 LYS HZ3 H -12.296 3.880 -9.538 1.00 . B B . 28 LYS HZ3 1 1 15 11594 2 2 28 LYS N N -8.630 3.738 -4.722 1.00 . B B . 28 LYS N 1 1 15 11595 2 2 28 LYS NZ N -11.908 4.798 -9.243 1.00 . B B . 28 LYS NZ 1 1 15 11596 2 2 28 LYS O O -8.728 5.668 -2.842 1.00 . B B . 28 LYS O 1 1 15 11597 2 2 29 PRO C C -8.687 8.907 -2.708 1.00 . B B . 29 PRO C 1 1 15 11598 2 2 29 PRO CA C -7.394 8.113 -2.915 1.00 . B B . 29 PRO CA 1 1 15 11599 2 2 29 PRO CB C -6.261 9.026 -3.395 1.00 . B B . 29 PRO CB 1 1 15 11600 2 2 29 PRO CD C -6.915 7.569 -5.285 1.00 . B B . 29 PRO CD 1 1 15 11601 2 2 29 PRO CG C -6.224 8.901 -4.935 1.00 . B B . 29 PRO CG 1 1 15 11602 2 2 29 PRO HA H -7.103 7.610 -2.006 1.00 . B B . 29 PRO HA 1 1 15 11603 2 2 29 PRO HB2 H -6.464 10.049 -3.105 1.00 . B B . 29 PRO HB2 1 1 15 11604 2 2 29 PRO HB3 H -5.320 8.700 -2.981 1.00 . B B . 29 PRO HB3 1 1 15 11605 2 2 29 PRO HD2 H -7.658 7.727 -6.053 1.00 . B B . 29 PRO HD2 1 1 15 11606 2 2 29 PRO HD3 H -6.189 6.836 -5.601 1.00 . B B . 29 PRO HD3 1 1 15 11607 2 2 29 PRO HG2 H -6.757 9.727 -5.385 1.00 . B B . 29 PRO HG2 1 1 15 11608 2 2 29 PRO HG3 H -5.204 8.885 -5.283 1.00 . B B . 29 PRO HG3 1 1 15 11609 2 2 29 PRO N N -7.552 7.148 -4.018 1.00 . B B . 29 PRO N 1 1 15 11610 2 2 29 PRO O O -9.219 9.498 -3.627 1.00 . B B . 29 PRO O 1 1 15 11611 2 2 30 THR C C -10.182 10.770 -0.202 1.00 . B B . 30 THR C 1 1 15 11612 2 2 30 THR CA C -10.453 9.678 -1.238 1.00 . B B . 30 THR CA 1 1 15 11613 2 2 30 THR CB C -11.519 8.719 -0.703 1.00 . B B . 30 THR CB 1 1 15 11614 2 2 30 THR CG2 C -12.588 8.492 -1.771 1.00 . B B . 30 THR CG2 1 1 15 11615 2 2 30 THR H H -8.751 8.441 -0.779 1.00 . B B . 30 THR H 1 1 15 11616 2 2 30 THR HA H -10.804 10.131 -2.154 1.00 . B B . 30 THR HA 1 1 15 11617 2 2 30 THR HB H -11.979 9.146 0.176 1.00 . B B . 30 THR HB 1 1 15 11618 2 2 30 THR HG1 H -10.533 7.566 0.514 1.00 . B B . 30 THR HG1 1 1 15 11619 2 2 30 THR HG21 H -12.115 8.370 -2.734 1.00 . B B . 30 THR HG21 1 1 15 11620 2 2 30 THR HG22 H -13.253 9.343 -1.803 1.00 . B B . 30 THR HG22 1 1 15 11621 2 2 30 THR HG23 H -13.153 7.602 -1.533 1.00 . B B . 30 THR HG23 1 1 15 11622 2 2 30 THR N N -9.196 8.925 -1.506 1.00 . B B . 30 THR N 1 1 15 11623 2 2 30 THR O O -9.182 10.668 0.489 1.00 . B B . 30 THR O 1 1 15 11624 2 2 30 THR OXT O -10.980 11.689 -0.115 1.00 . B B . 30 THR OXT 1 1 15 11625 2 2 30 THR OG1 O -10.912 7.480 -0.364 1.00 . B B . 30 THR OG1 1 1 stop_ save_
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