NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
394998 | 1rmk | 6135 | cing | 4-filtered-FRED | STAR | entry | full | 187 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1rmk # This FRED archive file contains, for PDB entry <1rmk>: # # - 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_1rmk _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1rmk _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3407.16 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 $Mu_O_conotoxin_MrVIB A . 1 1 stop_ save_ save_Mu_O_conotoxin_MrVIB _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Mu O conotoxin MrVIB" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ACSKKWEYCIVPILGFVYCCPGLICGPFVCV _Entity.Number_of_monomers 31 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 ALA . 1 1 2 CYS . 1 1 3 SER . 1 1 4 LYS . 1 1 5 LYS . 1 1 6 TRP . 1 1 7 GLU . 1 1 8 TYR . 1 1 9 CYS . 1 1 10 ILE . 1 1 11 VAL . 1 1 12 PRO . 1 1 13 ILE . 1 1 14 LEU . 1 1 15 GLY . 1 1 16 PHE . 1 1 17 VAL . 1 1 18 TYR . 1 1 19 CYS . 1 1 20 CYS . 1 1 21 PRO . 1 1 22 GLY . 1 1 23 LEU . 1 1 24 ILE . 1 1 25 CYS . 1 1 26 GLY . 1 1 27 PRO . 1 1 28 PHE . 1 1 29 VAL . 1 1 30 CYS . 1 1 31 VAL . 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 ALA 1 1 1 1 CYS 2 2 1 1 SER 3 3 1 1 LYS 4 4 1 1 LYS 5 5 1 1 TRP 6 6 1 1 GLU 7 7 1 1 TYR 8 8 1 1 CYS 9 9 1 1 ILE 10 10 1 1 VAL 11 11 1 1 PRO 12 12 1 1 ILE 13 13 1 1 LEU 14 14 1 1 GLY 15 15 1 1 PHE 16 16 1 1 VAL 17 17 1 1 TYR 18 18 1 1 CYS 19 19 1 1 CYS 20 20 1 1 PRO 21 21 1 1 GLY 22 22 1 1 LEU 23 23 1 1 ILE 24 24 1 1 CYS 25 25 1 1 GLY 26 26 1 1 PRO 27 27 1 1 PHE 28 28 1 1 VAL 29 29 1 1 CYS 30 30 1 1 VAL 31 31 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ALA MB . 1 . HB# 1 1 1 1 2 1 1 2 CYS H . 2 . HN 1 1 2 1 1 1 1 2 CYS HA . 2 . HA 1 1 2 1 2 1 1 19 CYS HA . 19 . HA 1 1 3 1 1 1 1 2 CYS HA . 2 . HA 1 1 3 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 4 1 1 1 1 2 CYS HB2 . 2 . HB2 1 1 4 1 2 1 1 18 TYR QE . 18 . HE# 1 1 5 1 1 1 1 2 CYS HB2 . 2 . HB2 1 1 5 1 2 1 1 20 CYS HA . 20 . HA 1 1 6 1 1 1 1 2 CYS HB2 . 2 . HB2 1 1 6 1 2 1 1 21 PRO QD . 21 . HD# 1 1 7 1 1 1 1 2 CYS HB3 . 2 . HB1 1 1 7 1 2 1 1 3 SER QB . 3 . HB# 1 1 8 1 1 1 1 2 CYS HB3 . 2 . HB1 1 1 8 1 2 1 1 20 CYS HA . 20 . HA 1 1 9 1 1 1 1 2 CYS HB3 . 2 . HB1 1 1 9 1 2 1 1 21 PRO QD . 21 . HD# 1 1 10 1 1 1 1 3 SER QB . 3 . HB# 1 1 10 1 2 1 1 4 LYS H . 4 . HN 1 1 11 1 1 1 1 3 SER QB . 3 . HB# 1 1 11 1 2 1 1 7 GLU QG . 7 . HG# 1 1 12 1 1 1 1 3 SER QB . 3 . HB# 1 1 12 1 2 1 1 19 CYS HA . 19 . HA 1 1 13 1 1 1 1 4 LYS H . 4 . HN 1 1 13 1 2 1 1 7 GLU QB . 7 . HB# 1 1 14 1 1 1 1 4 LYS H . 4 . HN 1 1 14 1 2 1 1 7 GLU QG . 7 . HG# 1 1 15 1 1 1 1 4 LYS H . 4 . HN 1 1 15 1 2 1 1 23 LEU QD . 23 . HD# 1 1 16 1 1 1 1 4 LYS O . 4 . O 1 1 16 1 2 1 1 7 GLU H . 7 . HN 1 1 17 1 1 1 1 4 LYS O . 4 . O 1 1 17 1 2 1 1 7 GLU N . 7 . N 1 1 18 1 1 1 1 5 LYS H . 5 . HN 1 1 18 1 2 1 1 6 TRP H . 6 . HN 1 1 19 1 1 1 1 5 LYS H . 5 . HN 1 1 19 1 2 1 1 23 LEU QD . 23 . HD# 1 1 20 1 1 1 1 5 LYS HA . 5 . HA 1 1 20 1 2 1 1 6 TRP H . 6 . HN 1 1 21 1 1 1 1 5 LYS HA . 5 . HA 1 1 21 1 2 1 1 7 GLU H . 7 . HN 1 1 22 1 1 1 1 5 LYS HA . 5 . HA 1 1 22 1 2 1 1 23 LEU QB . 23 . HB# 1 1 23 1 1 1 1 5 LYS HA . 5 . HA 1 1 23 1 2 1 1 23 LEU QD . 23 . HD# 1 1 24 1 1 1 1 5 LYS HA . 5 . HA 1 1 24 1 2 1 1 30 CYS H . 30 . HN 1 1 25 1 1 1 1 5 LYS HA . 5 . HA 1 1 25 1 2 1 1 31 VAL HA . 31 . HA 1 1 26 1 1 1 1 5 LYS QB . 5 . HB# 1 1 26 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 27 1 1 1 1 5 LYS QB . 5 . HB# 1 1 27 1 2 1 1 7 GLU H . 7 . HN 1 1 28 1 1 1 1 5 LYS QD . 5 . HD# 1 1 28 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 29 1 1 1 1 5 LYS QD . 5 . HD# 1 1 29 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 30 1 1 1 1 5 LYS QE . 5 . HE# 1 1 30 1 2 1 1 31 VAL HA . 31 . HA 1 1 31 1 1 1 1 5 LYS HE2 . 5 . HE2 1 1 31 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 32 1 1 1 1 5 LYS HE3 . 5 . HE1 1 1 32 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 33 1 1 1 1 5 LYS QG . 5 . HG# 1 1 33 1 2 1 1 6 TRP H . 6 . HN 1 1 34 1 1 1 1 5 LYS QG . 5 . HG# 1 1 34 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 35 1 1 1 1 5 LYS QG . 5 . HG# 1 1 35 1 2 1 1 7 GLU H . 7 . HN 1 1 36 1 1 1 1 5 LYS QG . 5 . HG# 1 1 36 1 2 1 1 31 VAL HA . 31 . HA 1 1 37 1 1 1 1 5 LYS HG2 . 5 . HG2 1 1 37 1 2 1 1 6 TRP H . 6 . HN 1 1 38 1 1 1 1 5 LYS HG2 . 5 . HG2 1 1 38 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 39 1 1 1 1 5 LYS HG2 . 5 . HG2 1 1 39 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 40 1 1 1 1 5 LYS HG2 . 5 . HG2 1 1 40 1 2 1 1 31 VAL HA . 31 . HA 1 1 41 1 1 1 1 5 LYS HG3 . 5 . HG1 1 1 41 1 2 1 1 6 TRP H . 6 . HN 1 1 42 1 1 1 1 5 LYS HG3 . 5 . HG1 1 1 42 1 2 1 1 6 TRP HD1 . 6 . HD1 1 1 43 1 1 1 1 5 LYS HG3 . 5 . HG1 1 1 43 1 2 1 1 6 TRP HE3 . 6 . HE3 1 1 44 1 1 1 1 5 LYS HG3 . 5 . HG1 1 1 44 1 2 1 1 31 VAL HA . 31 . HA 1 1 45 1 1 1 1 6 TRP H . 6 . HN 1 1 45 1 2 1 1 7 GLU H . 7 . HN 1 1 46 1 1 1 1 6 TRP H . 6 . HN 1 1 46 1 2 1 1 30 CYS H . 30 . HN 1 1 47 1 1 1 1 6 TRP HA . 6 . HA 1 1 47 1 2 1 1 29 VAL HB . 29 . HB 1 1 48 1 1 1 1 6 TRP HA . 6 . HA 1 1 48 1 2 1 1 29 VAL QG . 29 . HG* 1 1 49 1 1 1 1 6 TRP HA . 6 . HA 1 1 49 1 2 1 1 30 CYS H . 30 . HN 1 1 50 1 1 1 1 6 TRP HB2 . 6 . HB2 1 1 50 1 2 1 1 7 GLU H . 7 . HN 1 1 51 1 1 1 1 6 TRP HB3 . 6 . HB1 1 1 51 1 2 1 1 7 GLU H . 7 . HN 1 1 52 1 1 1 1 6 TRP HD1 . 6 . HD1 1 1 52 1 2 1 1 29 VAL QG . 29 . HG* 1 1 53 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 53 1 2 1 1 29 VAL HB . 29 . HB 1 1 54 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 54 1 2 1 1 29 VAL MG1 . 29 . HG1# 1 1 55 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 55 1 2 1 1 29 VAL QG . 29 . HG* 1 1 56 1 1 1 1 6 TRP HE3 . 6 . HE3 1 1 56 1 2 1 1 29 VAL MG2 . 29 . HG2# 1 1 57 1 1 1 1 7 GLU H . 7 . HN 1 1 57 1 2 1 1 29 VAL HB . 29 . HB 1 1 58 1 1 1 1 7 GLU H . 7 . HN 1 1 58 1 2 1 1 29 VAL MG1 . 29 . HG1# 1 1 59 1 1 1 1 7 GLU H . 7 . HN 1 1 59 1 2 1 1 29 VAL MG2 . 29 . HG2# 1 1 60 1 1 1 1 7 GLU H . 7 . HN 1 1 60 1 2 1 1 30 CYS H . 30 . HN 1 1 61 1 1 1 1 7 GLU H . 7 . HN 1 1 61 1 2 1 1 30 CYS HB2 . 30 . HB2 1 1 62 1 1 1 1 8 TYR HA . 8 . HA 1 1 62 1 2 1 1 29 VAL HA . 29 . HA 1 1 63 1 1 1 1 8 TYR HA . 8 . HA 1 1 63 1 2 1 1 29 VAL HB . 29 . HB 1 1 64 1 1 1 1 8 TYR HA . 8 . HA 1 1 64 1 2 1 1 29 VAL MG1 . 29 . HG1# 1 1 65 1 1 1 1 8 TYR HA . 8 . HA 1 1 65 1 2 1 1 29 VAL QG . 29 . HG* 1 1 66 1 1 1 1 8 TYR HA . 8 . HA 1 1 66 1 2 1 1 29 VAL MG2 . 29 . HG2# 1 1 67 1 1 1 1 8 TYR HA . 8 . HA 1 1 67 1 2 1 1 30 CYS H . 30 . HN 1 1 68 1 1 1 1 8 TYR QD . 8 . HD# 1 1 68 1 2 1 1 28 PHE QB . 28 . HB# 1 1 69 1 1 1 1 8 TYR QD . 8 . HD# 1 1 69 1 2 1 1 29 VAL HA . 29 . HA 1 1 70 1 1 1 1 8 TYR QD . 8 . HD# 1 1 70 1 2 1 1 29 VAL MG1 . 29 . HG1# 1 1 71 1 1 1 1 8 TYR QD . 8 . HD# 1 1 71 1 2 1 1 29 VAL QG . 29 . HG* 1 1 72 1 1 1 1 8 TYR QD . 8 . HD# 1 1 72 1 2 1 1 29 VAL MG2 . 29 . HG2# 1 1 73 1 1 1 1 8 TYR QE . 8 . HE# 1 1 73 1 2 1 1 11 VAL QG . 11 . HG* 1 1 74 1 1 1 1 8 TYR QE . 8 . HE# 1 1 74 1 2 1 1 28 PHE QB . 28 . HB# 1 1 75 1 1 1 1 8 TYR QE . 8 . HE# 1 1 75 1 2 1 1 29 VAL MG1 . 29 . HG1# 1 1 76 1 1 1 1 8 TYR QE . 8 . HE# 1 1 76 1 2 1 1 29 VAL QG . 29 . HG* 1 1 77 1 1 1 1 8 TYR QE . 8 . HE# 1 1 77 1 2 1 1 29 VAL MG2 . 29 . HG2# 1 1 78 1 1 1 1 11 VAL HB . 11 . HB 1 1 78 1 2 1 1 16 PHE HB2 . 16 . HB2 1 1 79 1 1 1 1 11 VAL HB . 11 . HB 1 1 79 1 2 1 1 16 PHE QB . 16 . HB# 1 1 80 1 1 1 1 11 VAL HB . 11 . HB 1 1 80 1 2 1 1 16 PHE HB3 . 16 . HB1 1 1 81 1 1 1 1 11 VAL HB . 11 . HB 1 1 81 1 2 1 1 16 PHE QD . 16 . HD# 1 1 82 1 1 1 1 11 VAL QG . 11 . HG* 1 1 82 1 2 1 1 12 PRO HD2 . 12 . HD2 1 1 83 1 1 1 1 11 VAL QG . 11 . HG* 1 1 83 1 2 1 1 12 PRO QD . 12 . HD# 1 1 84 1 1 1 1 11 VAL QG . 11 . HG* 1 1 84 1 2 1 1 12 PRO HD3 . 12 . HD1 1 1 85 1 1 1 1 11 VAL QG . 11 . HG* 1 1 85 1 2 1 1 16 PHE QD . 16 . HD# 1 1 86 1 1 1 1 11 VAL QG . 11 . HG* 1 1 86 1 2 1 1 18 TYR H . 18 . HN 1 1 87 1 1 1 1 11 VAL QG . 11 . HG* 1 1 87 1 2 1 1 28 PHE QD . 28 . HD# 1 1 88 1 1 1 1 12 PRO HA . 12 . HA 1 1 88 1 2 1 1 13 ILE H . 13 . HN 1 1 89 1 1 1 1 12 PRO O . 12 . O 1 1 89 1 2 1 1 15 GLY H . 15 . HN 1 1 90 1 1 1 1 12 PRO O . 12 . O 1 1 90 1 2 1 1 15 GLY N . 15 . N 1 1 91 1 1 1 1 13 ILE HA . 13 . HA 1 1 91 1 2 1 1 15 GLY H . 15 . HN 1 1 92 1 1 1 1 17 VAL HA . 17 . HA 1 1 92 1 2 1 1 18 TYR H . 18 . HN 1 1 93 1 1 1 1 17 VAL HA . 17 . HA 1 1 93 1 2 1 1 18 TYR QD . 18 . HD# 1 1 94 1 1 1 1 17 VAL HB . 17 . HB 1 1 94 1 2 1 1 18 TYR H . 18 . HN 1 1 95 1 1 1 1 17 VAL HB . 17 . HB 1 1 95 1 2 1 1 18 TYR QD . 18 . HD# 1 1 96 1 1 1 1 17 VAL QG . 17 . HG* 1 1 96 1 2 1 1 18 TYR H . 18 . HN 1 1 97 1 1 1 1 17 VAL QG . 17 . HG* 1 1 97 1 2 1 1 18 TYR QD . 18 . HD# 1 1 98 1 1 1 1 18 TYR QB . 18 . HB# 1 1 98 1 2 1 1 19 CYS H . 19 . HN 1 1 99 1 1 1 1 19 CYS H . 19 . HN 1 1 99 1 2 1 1 25 CYS H . 25 . HN 1 1 100 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 100 1 2 1 1 23 LEU H . 23 . HN 1 1 101 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 101 1 2 1 1 23 LEU QB . 23 . HB# 1 1 102 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 102 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1 103 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 103 1 2 1 1 23 LEU QD . 23 . HD# 1 1 104 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 104 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1 105 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 105 1 2 1 1 23 LEU H . 23 . HN 1 1 106 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 106 1 2 1 1 23 LEU HB3 . 23 . HB1 1 1 107 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 107 1 2 1 1 23 LEU QD . 23 . HD# 1 1 108 1 1 1 1 20 CYS HA . 20 . HA 1 1 108 1 2 1 1 21 PRO HD2 . 21 . HD2 1 1 109 1 1 1 1 20 CYS HA . 20 . HA 1 1 109 1 2 1 1 21 PRO HD3 . 21 . HD1 1 1 110 1 1 1 1 20 CYS QB . 20 . HB# 1 1 110 1 2 1 1 21 PRO HB3 . 21 . HB1 1 1 111 1 1 1 1 20 CYS QB . 20 . HB# 1 1 111 1 2 1 1 21 PRO QD . 21 . HD# 1 1 112 1 1 1 1 20 CYS QB . 20 . HB# 1 1 112 1 2 1 1 21 PRO QG . 21 . HG# 1 1 113 1 1 1 1 20 CYS QB . 20 . HB# 1 1 113 1 2 1 1 22 GLY H . 22 . HN 1 1 114 1 1 1 1 20 CYS QB . 20 . HB# 1 1 114 1 2 1 1 23 LEU QD . 23 . HD# 1 1 115 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 115 1 2 1 1 21 PRO HD2 . 21 . HD2 1 1 116 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 116 1 2 1 1 21 PRO HD3 . 21 . HD1 1 1 117 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 117 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1 118 1 1 1 1 20 CYS HB2 . 20 . HB2 1 1 118 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1 119 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 119 1 2 1 1 21 PRO HD2 . 21 . HD2 1 1 120 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 120 1 2 1 1 21 PRO HD3 . 21 . HD1 1 1 121 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 121 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 1 122 1 1 1 1 20 CYS HB3 . 20 . HB1 1 1 122 1 2 1 1 23 LEU MD2 . 23 . HD2# 1 1 123 1 1 1 1 20 CYS O . 20 . O 1 1 123 1 2 1 1 23 LEU H . 23 . HN 1 1 124 1 1 1 1 20 CYS O . 20 . O 1 1 124 1 2 1 1 23 LEU N . 23 . N 1 1 125 1 1 1 1 21 PRO HA . 21 . HA 1 1 125 1 2 1 1 22 GLY H . 22 . HN 1 1 126 1 1 1 1 21 PRO HB2 . 21 . HB2 1 1 126 1 2 1 1 22 GLY H . 22 . HN 1 1 127 1 1 1 1 21 PRO HB3 . 21 . HB1 1 1 127 1 2 1 1 22 GLY H . 22 . HN 1 1 128 1 1 1 1 22 GLY H . 22 . HN 1 1 128 1 2 1 1 23 LEU H . 23 . HN 1 1 129 1 1 1 1 22 GLY H . 22 . HN 1 1 129 1 2 1 1 24 ILE MG . 24 . HG2# 1 1 130 1 1 1 1 22 GLY HA2 . 22 . HA2 1 1 130 1 2 1 1 23 LEU H . 23 . HN 1 1 131 1 1 1 1 22 GLY HA3 . 22 . HA1 1 1 131 1 2 1 1 23 LEU H . 23 . HN 1 1 132 1 1 1 1 23 LEU H . 23 . HN 1 1 132 1 2 1 1 24 ILE H . 24 . HN 1 1 133 1 1 1 1 23 LEU HA . 23 . HA 1 1 133 1 2 1 1 24 ILE H . 24 . HN 1 1 134 1 1 1 1 23 LEU HA . 23 . HA 1 1 134 1 2 1 1 31 VAL QG . 31 . HG* 1 1 135 1 1 1 1 23 LEU QB . 23 . HB# 1 1 135 1 2 1 1 24 ILE H . 24 . HN 1 1 136 1 1 1 1 23 LEU QB . 23 . HB# 1 1 136 1 2 1 1 30 CYS HA . 30 . HA 1 1 137 1 1 1 1 23 LEU QB . 23 . HB# 1 1 137 1 2 1 1 30 CYS HB3 . 30 . HB1 1 1 138 1 1 1 1 23 LEU QD . 23 . HD# 1 1 138 1 2 1 1 24 ILE H . 24 . HN 1 1 139 1 1 1 1 23 LEU QD . 23 . HD# 1 1 139 1 2 1 1 30 CYS HB3 . 30 . HB1 1 1 140 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 140 1 2 1 1 24 ILE H . 24 . HN 1 1 141 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 1 141 1 2 1 1 30 CYS HB3 . 30 . HB1 1 1 142 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 142 1 2 1 1 24 ILE H . 24 . HN 1 1 143 1 1 1 1 23 LEU MD2 . 23 . HD2# 1 1 143 1 2 1 1 30 CYS HB3 . 30 . HB1 1 1 144 1 1 1 1 24 ILE H . 24 . HN 1 1 144 1 2 1 1 31 VAL H . 31 . HN 1 1 145 1 1 1 1 24 ILE H . 24 . HN 1 1 145 1 2 1 1 31 VAL QG . 31 . HG* 1 1 146 1 1 1 1 24 ILE H . 24 . HN 1 1 146 1 2 1 1 31 VAL O . 31 . OT1 1 1 147 1 1 1 1 24 ILE HA . 24 . HA 1 1 147 1 2 1 1 25 CYS H . 25 . HN 1 1 148 1 1 1 1 24 ILE HB . 24 . HB 1 1 148 1 2 1 1 25 CYS H . 25 . HN 1 1 149 1 1 1 1 24 ILE MG . 24 . HG2# 1 1 149 1 2 1 1 25 CYS H . 25 . HN 1 1 150 1 1 1 1 24 ILE N . 24 . N 1 1 150 1 2 1 1 31 VAL O . 31 . OT1 1 1 151 1 1 1 1 25 CYS H . 25 . HN 1 1 151 1 2 1 1 26 GLY H . 26 . HN 1 1 152 1 1 1 1 25 CYS HA . 25 . HA 1 1 152 1 2 1 1 26 GLY H . 26 . HN 1 1 153 1 1 1 1 25 CYS HA . 25 . HA 1 1 153 1 2 1 1 30 CYS HA . 30 . HA 1 1 154 1 1 1 1 25 CYS QB . 25 . HB# 1 1 154 1 2 1 1 26 GLY H . 26 . HN 1 1 155 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 155 1 2 1 1 26 GLY H . 26 . HN 1 1 156 1 1 1 1 25 CYS HB3 . 25 . HB1 1 1 156 1 2 1 1 26 GLY H . 26 . HN 1 1 157 1 1 1 1 26 GLY H . 26 . HN 1 1 157 1 2 1 1 29 VAL H . 29 . HN 1 1 158 1 1 1 1 26 GLY H . 26 . HN 1 1 158 1 2 1 1 29 VAL O . 29 . O 1 1 159 1 1 1 1 26 GLY H . 26 . HN 1 1 159 1 2 1 1 30 CYS HA . 30 . HA 1 1 160 1 1 1 1 26 GLY H . 26 . HN 1 1 160 1 2 1 1 31 VAL H . 31 . HN 1 1 161 1 1 1 1 26 GLY H . 26 . HN 1 1 161 1 2 1 1 31 VAL MG1 . 31 . HG1# 1 1 162 1 1 1 1 26 GLY H . 26 . HN 1 1 162 1 2 1 1 31 VAL QG . 31 . HG* 1 1 163 1 1 1 1 26 GLY H . 26 . HN 1 1 163 1 2 1 1 31 VAL MG2 . 31 . HG2# 1 1 164 1 1 1 1 26 GLY HA2 . 26 . HA2 1 1 164 1 2 1 1 31 VAL MG1 . 31 . HG1# 1 1 165 1 1 1 1 26 GLY HA2 . 26 . HA2 1 1 165 1 2 1 1 31 VAL MG2 . 31 . HG2# 1 1 166 1 1 1 1 26 GLY HA3 . 26 . HA1 1 1 166 1 2 1 1 31 VAL MG1 . 31 . HG1# 1 1 167 1 1 1 1 26 GLY HA3 . 26 . HA1 1 1 167 1 2 1 1 31 VAL MG2 . 31 . HG2# 1 1 168 1 1 1 1 26 GLY N . 26 . N 1 1 168 1 2 1 1 29 VAL O . 29 . O 1 1 169 1 1 1 1 27 PRO HA . 27 . HA 1 1 169 1 2 1 1 28 PHE H . 28 . HN 1 1 170 1 1 1 1 27 PRO HA . 27 . HA 1 1 170 1 2 1 1 29 VAL H . 29 . HN 1 1 171 1 1 1 1 27 PRO QD . 27 . HD# 1 1 171 1 2 1 1 28 PHE H . 28 . HN 1 1 172 1 1 1 1 27 PRO QD . 27 . HD# 1 1 172 1 2 1 1 29 VAL H . 29 . HN 1 1 173 1 1 1 1 27 PRO QG . 27 . HG# 1 1 173 1 2 1 1 29 VAL H . 29 . HN 1 1 174 1 1 1 1 27 PRO HG2 . 27 . HG2 1 1 174 1 2 1 1 29 VAL H . 29 . HN 1 1 175 1 1 1 1 27 PRO HG3 . 27 . HG1 1 1 175 1 2 1 1 29 VAL H . 29 . HN 1 1 176 1 1 1 1 28 PHE H . 28 . HN 1 1 176 1 2 1 1 28 PHE HA . 28 . HA 1 1 177 1 1 1 1 28 PHE H . 28 . HN 1 1 177 1 2 1 1 29 VAL H . 29 . HN 1 1 178 1 1 1 1 28 PHE HA . 28 . HA 1 1 178 1 2 1 1 29 VAL H . 29 . HN 1 1 179 1 1 1 1 28 PHE QB . 28 . HB# 1 1 179 1 2 1 1 29 VAL H . 29 . HN 1 1 180 1 1 1 1 28 PHE QB . 28 . HB# 1 1 180 1 2 1 1 29 VAL QG . 29 . HG* 1 1 181 1 1 1 1 29 VAL H . 29 . HN 1 1 181 1 2 1 1 30 CYS H . 30 . HN 1 1 182 1 1 1 1 29 VAL HA . 29 . HA 1 1 182 1 2 1 1 30 CYS H . 30 . HN 1 1 183 1 1 1 1 29 VAL HB . 29 . HB 1 1 183 1 2 1 1 30 CYS H . 30 . HN 1 1 184 1 1 1 1 29 VAL MG1 . 29 . HG1# 1 1 184 1 2 1 1 30 CYS H . 30 . HN 1 1 185 1 1 1 1 29 VAL MG2 . 29 . HG2# 1 1 185 1 2 1 1 30 CYS H . 30 . HN 1 1 186 1 1 1 1 30 CYS HA . 30 . HA 1 1 186 1 2 1 1 31 VAL H . 31 . HN 1 1 187 1 1 1 1 30 CYS HA . 30 . HA 1 1 187 1 2 1 1 31 VAL QG . 31 . HG* 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.83 1.8 3.86 1 1 2 1 . . . . . 2.89 1.8 3.98 1 1 3 1 . . . . . 3.65 1.8 5.5 1 1 4 1 . . . . . 4.47 1.8 7.14 1 1 5 1 . . . . . 2.225 1.8 2.65 1 1 6 1 . . . . . 3.59 1.8 5.38 1 1 7 1 . . . . . 4.09 1.8 6.38 1 1 8 1 . . . . . 2.1 1.8 2.4 1 1 9 1 . . . . . 3.435 1.8 5.07 1 1 10 1 . . . . . 2.94 1.8 4.08 1 1 11 1 . . . . . 3.225 1.8 4.65 1 1 12 1 . . . . . 2.85 1.8 3.9 1 1 13 1 . . . . . 3.095 1.8 4.39 1 1 14 1 . . . . . 2.88 1.8 3.96 1 1 15 1 . . . . . 4.25 1.8 6.7 1 1 16 1 . . . . . 1.9 1.8 2.0 1 1 17 1 . . . . . 2.4 1.8 3.0 1 1 18 1 . . . . . 2.78 1.8 3.76 1 1 19 1 . . . . . 3.525 1.8 5.25 1 1 20 1 . . . . . 2.65 1.8 3.5 1 1 21 1 . . . . . 2.65 1.8 3.5 1 1 22 1 . . . . . 3.98 1.8 6.16 1 1 23 1 . . . . . 3.71 1.8 5.62 1 1 24 1 . . . . . 3.4 1.8 5.0 1 1 25 1 . . . . . 3.4 1.8 5.0 1 1 26 1 . . . . . 3.345 1.8 4.89 1 1 27 1 . . . . . 3.92 1.8 6.04 1 1 28 1 . . . . . 3.73 1.8 5.66 1 1 29 1 . . . . . 3.95 1.8 6.1 1 1 30 1 . . . . . 3.22 1.8 4.64 1 1 31 1 . . . . . 3.435 1.8 5.07 1 1 32 1 . . . . . 3.435 1.8 5.07 1 1 33 1 . . . . . 3.375 1.8 4.95 1 1 34 1 . . . . . 2.91 1.8 4.02 1 1 35 1 . . . . . 4.09 1.8 6.38 1 1 36 1 . . . . . 2.295 1.8 2.79 1 1 37 1 . . . . . 3.555 1.8 5.31 1 1 38 1 . . . . . 3.23 1.8 4.66 1 1 39 1 . . . . . 3.65 1.8 5.5 1 1 40 1 . . . . . 2.58 1.8 3.36 1 1 41 1 . . . . . 3.555 1.8 5.31 1 1 42 1 . . . . . 3.23 1.8 4.66 1 1 43 1 . . . . . 3.65 1.8 5.5 1 1 44 1 . . . . . 2.58 1.8 3.36 1 1 45 1 . . . . . 2.285 1.8 2.77 1 1 46 1 . . . . . 3.4 1.8 5.0 1 1 47 1 . . . . . 2.255 1.8 2.71 1 1 48 1 . . . . . 3.765 1.8 5.73 1 1 49 1 . . . . . 2.86 1.8 3.92 1 1 50 1 . . . . . 3.4 1.8 5.0 1 1 51 1 . . . . . 3.4 1.8 5.0 1 1 52 1 . . . . . 4.945 1.8 8.09 1 1 53 1 . . . . . 3.525 1.8 5.25 1 1 54 1 . . . . . 3.295 1.8 4.79 1 1 55 1 . . . . . 2.89 1.8 3.98 1 1 56 1 . . . . . 3.295 1.8 4.79 1 1 57 1 . . . . . 3.155 1.8 4.51 1 1 58 1 . . . . . 4.165 1.8 6.53 1 1 59 1 . . . . . 4.165 1.8 6.53 1 1 60 1 . . . . . 2.55 1.8 3.3 1 1 61 1 . . . . . 2.795 1.8 3.79 1 1 62 1 . . . . . 2.21 1.8 2.62 1 1 63 1 . . . . . 3.215 1.8 4.63 1 1 64 1 . . . . . 4.165 1.8 6.53 1 1 65 1 . . . . . 3.53 1.8 5.26 1 1 66 1 . . . . . 4.165 1.8 6.53 1 1 67 1 . . . . . 3.4 1.8 5.0 1 1 68 1 . . . . . 5.02 1.8 8.24 1 1 69 1 . . . . . 4.72 1.8 7.64 1 1 70 1 . . . . . 4.895 1.8 7.99 1 1 71 1 . . . . . 4.51 1.8 7.22 1 1 72 1 . . . . . 4.895 1.8 7.99 1 1 73 1 . . . . . 5.775 1.8 9.75 1 1 74 1 . . . . . 5.155 1.8 8.51 1 1 75 1 . . . . . 5.2 1.8 8.6 1 1 76 1 . . . . . 4.87 1.8 7.94 1 1 77 1 . . . . . 5.2 1.8 8.6 1 1 78 1 . . . . . 2.735 1.8 3.67 1 1 79 1 . . . . . 2.575 1.8 3.35 1 1 80 1 . . . . . 2.735 1.8 3.67 1 1 81 1 . . . . . 4.29 1.8 6.78 1 1 82 1 . . . . . 4.295 1.8 6.79 1 1 83 1 . . . . . 4.18 1.8 6.56 1 1 84 1 . . . . . 4.295 1.8 6.79 1 1 85 1 . . . . . 5.445 1.8 9.09 1 1 86 1 . . . . . 4.71 1.8 7.62 1 1 87 1 . . . . . 5.275 1.8 8.75 1 1 88 1 . . . . . 2.255 1.8 2.71 1 1 89 1 . . . . . 1.9 1.8 2.0 1 1 90 1 . . . . . 2.4 1.8 3.0 1 1 91 1 . . . . . 2.815 1.8 3.83 1 1 92 1 . . . . . 2.225 1.8 2.65 1 1 93 1 . . . . . 4.72 1.8 7.64 1 1 94 1 . . . . . 2.18 1.8 2.56 1 1 95 1 . . . . . 4.72 1.8 7.64 1 1 96 1 . . . . . 3.965 1.8 6.13 1 1 97 1 . . . . . 5.425 1.8 9.05 1 1 98 1 . . . . . 3.065 1.8 4.33 1 1 99 1 . . . . . 2.705 1.8 3.61 1 1 100 1 . . . . . 3.4 1.8 5.0 1 1 101 1 . . . . . 2.755 1.8 3.71 1 1 102 1 . . . . . 4.165 1.8 6.53 1 1 103 1 . . . . . 3.49 1.8 5.18 1 1 104 1 . . . . . 4.165 1.8 6.53 1 1 105 1 . . . . . 0.0 0.0 3.5 1 1 106 1 . . . . . 2.615 1.8 3.43 1 1 107 1 . . . . . 3.46 1.8 5.12 1 1 108 1 . . . . . 2.315 1.8 2.83 1 1 109 1 . . . . . 2.315 1.8 2.83 1 1 110 1 . . . . . 4.09 1.8 6.38 1 1 111 1 . . . . . 2.35 1.8 2.9 1 1 112 1 . . . . . 4.435 1.8 7.07 1 1 113 1 . . . . . 4.0 4.0 5.0 1 1 114 1 . . . . . 3.63 1.8 5.46 1 1 115 1 . . . . . 3.005 1.8 4.21 1 1 116 1 . . . . . 3.005 1.8 4.21 1 1 117 1 . . . . . 4.615 1.8 7.43 1 1 118 1 . . . . . 4.615 1.8 7.43 1 1 119 1 . . . . . 3.005 1.8 4.21 1 1 120 1 . . . . . 3.005 1.8 4.21 1 1 121 1 . . . . . 4.615 1.8 7.43 1 1 122 1 . . . . . 4.615 1.8 7.43 1 1 123 1 . . . . . 1.9 1.8 2.0 1 1 124 1 . . . . . 2.4 1.8 3.0 1 1 125 1 . . . . . 0.0 0.0 3.5 1 1 126 1 . . . . . 3.5 3.5 5.0 1 1 127 1 . . . . . 3.0 3.0 3.5 1 1 128 1 . . . . . 2.365 1.8 2.93 1 1 129 1 . . . . . 4.165 1.8 6.53 1 1 130 1 . . . . . 2.65 1.8 3.5 1 1 131 1 . . . . . 2.65 1.8 3.5 1 1 132 1 . . . . . 3.2 1.8 4.6 1 1 133 1 . . . . . 2.1 1.8 2.4 1 1 134 1 . . . . . 4.215 1.8 6.63 1 1 135 1 . . . . . 2.645 1.8 3.49 1 1 136 1 . . . . . 4.09 1.8 6.38 1 1 137 1 . . . . . 3.05 1.8 4.3 1 1 138 1 . . . . . 3.25 1.8 4.7 1 1 139 1 . . . . . 3.25 1.8 4.7 1 1 140 1 . . . . . 3.605 1.8 5.41 1 1 141 1 . . . . . 3.715 1.8 5.63 1 1 142 1 . . . . . 3.605 1.8 5.41 1 1 143 1 . . . . . 3.715 1.8 5.63 1 1 144 1 . . . . . 2.27 1.8 2.74 1 1 145 1 . . . . . 3.86 1.8 5.92 1 1 146 1 . . . . . 1.9 1.8 2.0 1 1 147 1 . . . . . 2.18 1.8 2.56 1 1 148 1 . . . . . 2.455 1.8 3.11 1 1 149 1 . . . . . 3.31 1.8 4.82 1 1 150 1 . . . . . 2.4 1.8 3.0 1 1 151 1 . . . . . 3.4 1.8 5.0 1 1 152 1 . . . . . 2.1 1.8 2.4 1 1 153 1 . . . . . 2.25 1.8 2.7 1 1 154 1 . . . . . 3.13 1.8 4.46 1 1 155 1 . . . . . 3.37 1.8 4.94 1 1 156 1 . . . . . 3.37 1.8 4.94 1 1 157 1 . . . . . 2.6 1.8 3.4 1 1 158 1 . . . . . 1.9 1.8 2.0 1 1 159 1 . . . . . 2.65 1.8 3.5 1 1 160 1 . . . . . 3.4 1.8 5.0 1 1 161 1 . . . . . 3.22 1.8 4.64 1 1 162 1 . . . . . 3.05 1.8 4.3 1 1 163 1 . . . . . 3.22 1.8 4.64 1 1 164 1 . . . . . 3.52 1.8 5.24 1 1 165 1 . . . . . 3.52 1.8 5.24 1 1 166 1 . . . . . 3.52 1.8 5.24 1 1 167 1 . . . . . 3.52 1.8 5.24 1 1 168 1 . . . . . 2.4 1.8 3.0 1 1 169 1 . . . . . 2.15 1.8 2.5 1 1 170 1 . . . . . 3.06 1.8 4.32 1 1 171 1 . . . . . 3.4 1.8 5.0 1 1 172 1 . . . . . 2.865 1.8 3.93 1 1 173 1 . . . . . 3.395 1.8 4.99 1 1 174 1 . . . . . 3.65 1.8 5.5 1 1 175 1 . . . . . 3.65 1.8 5.5 1 1 176 1 . . . . . 2.115 1.8 2.43 1 1 177 1 . . . . . 2.15 1.8 2.5 1 1 178 1 . . . . . 2.65 1.8 3.5 1 1 179 1 . . . . . 4.0 4.0 5.0 1 1 180 1 . . . . . 4.995 1.8 8.19 1 1 181 1 . . . . . 3.465 1.8 5.13 1 1 182 1 . . . . . 2.25 1.8 2.7 1 1 183 1 . . . . . 2.4 1.8 3.0 1 1 184 1 . . . . . 3.405 1.8 5.01 1 1 185 1 . . . . . 3.405 1.8 5.01 1 1 186 1 . . . . . 2.535 1.8 3.27 1 1 187 1 . . . . . 4.355 1.8 6.91 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 ALA C C 3.571 -8.418 -0.613 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C 3.571 -9.914 -0.873 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C 3.081 -10.209 -2.284 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H 2.633 -11.606 -0.105 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H 1.772 -10.170 0.132 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA H3 H 3.136 -10.501 1.078 1.00 . A A . 1 ALA H3 1 1 1 7 1 1 1 ALA HA H 4.581 -10.288 -0.779 1.00 . A A . 1 ALA HA 1 1 1 8 1 1 1 ALA HB1 H 3.827 -9.892 -2.998 1.00 . A A . 1 ALA HB1 1 1 1 9 1 1 1 ALA HB2 H 2.160 -9.675 -2.463 1.00 . A A . 1 ALA HB2 1 1 1 10 1 1 1 ALA HB3 H 2.909 -11.270 -2.391 1.00 . A A . 1 ALA HB3 1 1 1 11 1 1 1 ALA N N 2.719 -10.599 0.125 1.00 . A A . 1 ALA N 1 1 1 12 1 1 1 ALA O O 2.566 -7.870 -0.168 1.00 . A A . 1 ALA O 1 1 1 13 1 1 2 CYS C C 4.403 -5.569 -1.913 1.00 . A A . 2 CYS C 1 1 1 14 1 1 2 CYS CA C 4.817 -6.336 -0.663 1.00 . A A . 2 CYS CA 1 1 1 15 1 1 2 CYS CB C 6.250 -5.985 -0.260 1.00 . A A . 2 CYS CB 1 1 1 16 1 1 2 CYS H H 5.466 -8.263 -1.226 1.00 . A A . 2 CYS H 1 1 1 17 1 1 2 CYS HA H 4.154 -6.051 0.145 1.00 . A A . 2 CYS HA 1 1 1 18 1 1 2 CYS HB2 H 6.291 -4.935 -0.020 1.00 . A A . 2 CYS HB2 1 1 1 19 1 1 2 CYS HB3 H 6.518 -6.552 0.619 1.00 . A A . 2 CYS HB3 1 1 1 20 1 1 2 CYS N N 4.695 -7.769 -0.877 1.00 . A A . 2 CYS N 1 1 1 21 1 1 2 CYS O O 4.816 -5.899 -3.028 1.00 . A A . 2 CYS O 1 1 1 22 1 1 2 CYS SG S 7.523 -6.297 -1.527 1.00 . A A . 2 CYS SG 1 1 1 23 1 1 3 SER C C 4.133 -2.752 -3.280 1.00 . A A . 3 SER C 1 1 1 24 1 1 3 SER CA C 3.073 -3.749 -2.816 1.00 . A A . 3 SER CA 1 1 1 25 1 1 3 SER CB C 1.806 -3.009 -2.384 1.00 . A A . 3 SER CB 1 1 1 26 1 1 3 SER H H 3.257 -4.368 -0.808 1.00 . A A . 3 SER H 1 1 1 27 1 1 3 SER HA H 2.831 -4.407 -3.636 1.00 . A A . 3 SER HA 1 1 1 28 1 1 3 SER HB2 H 2.047 -2.327 -1.582 1.00 . A A . 3 SER HB2 1 1 1 29 1 1 3 SER HB3 H 1.413 -2.453 -3.222 1.00 . A A . 3 SER HB3 1 1 1 30 1 1 3 SER HG H 0.134 -4.002 -2.603 1.00 . A A . 3 SER HG 1 1 1 31 1 1 3 SER N N 3.565 -4.564 -1.720 1.00 . A A . 3 SER N 1 1 1 32 1 1 3 SER O O 4.887 -2.202 -2.471 1.00 . A A . 3 SER O 1 1 1 33 1 1 3 SER OG O 0.816 -3.917 -1.930 1.00 . A A . 3 SER OG 1 1 1 34 1 1 4 LYS C C 4.592 -0.162 -4.989 1.00 . A A . 4 LYS C 1 1 1 35 1 1 4 LYS CA C 5.117 -1.580 -5.172 1.00 . A A . 4 LYS CA 1 1 1 36 1 1 4 LYS CB C 5.329 -1.908 -6.650 1.00 . A A . 4 LYS CB 1 1 1 37 1 1 4 LYS CD C 5.504 -3.801 -8.300 1.00 . A A . 4 LYS CD 1 1 1 38 1 1 4 LYS CE C 5.388 -5.315 -8.380 1.00 . A A . 4 LYS CE 1 1 1 39 1 1 4 LYS CG C 5.746 -3.352 -6.872 1.00 . A A . 4 LYS CG 1 1 1 40 1 1 4 LYS H H 3.534 -2.988 -5.175 1.00 . A A . 4 LYS H 1 1 1 41 1 1 4 LYS HA H 6.056 -1.678 -4.647 1.00 . A A . 4 LYS HA 1 1 1 42 1 1 4 LYS HB2 H 4.408 -1.730 -7.186 1.00 . A A . 4 LYS HB2 1 1 1 43 1 1 4 LYS HB3 H 6.101 -1.265 -7.046 1.00 . A A . 4 LYS HB3 1 1 1 44 1 1 4 LYS HD2 H 4.586 -3.358 -8.658 1.00 . A A . 4 LYS HD2 1 1 1 45 1 1 4 LYS HD3 H 6.331 -3.478 -8.916 1.00 . A A . 4 LYS HD3 1 1 1 46 1 1 4 LYS HE2 H 5.202 -5.597 -9.405 1.00 . A A . 4 LYS HE2 1 1 1 47 1 1 4 LYS HE3 H 6.318 -5.754 -8.048 1.00 . A A . 4 LYS HE3 1 1 1 48 1 1 4 LYS HG2 H 6.798 -3.449 -6.650 1.00 . A A . 4 LYS HG2 1 1 1 49 1 1 4 LYS HG3 H 5.178 -3.984 -6.204 1.00 . A A . 4 LYS HG3 1 1 1 50 1 1 4 LYS HZ1 H 4.253 -6.864 -7.550 1.00 . A A . 4 LYS HZ1 1 1 1 51 1 1 4 LYS HZ2 H 3.357 -5.461 -7.873 1.00 . A A . 4 LYS HZ2 1 1 1 52 1 1 4 LYS HZ3 H 4.404 -5.513 -6.544 1.00 . A A . 4 LYS HZ3 1 1 1 53 1 1 4 LYS N N 4.175 -2.519 -4.583 1.00 . A A . 4 LYS N 1 1 1 54 1 1 4 LYS NZ N 4.278 -5.828 -7.527 1.00 . A A . 4 LYS NZ 1 1 1 55 1 1 4 LYS O O 3.385 0.044 -4.857 1.00 . A A . 4 LYS O 1 1 1 56 1 1 5 LYS C C 3.975 2.672 -5.578 1.00 . A A . 5 LYS C 1 1 1 57 1 1 5 LYS CA C 5.130 2.194 -4.706 1.00 . A A . 5 LYS CA 1 1 1 58 1 1 5 LYS CB C 6.341 3.118 -4.881 1.00 . A A . 5 LYS CB 1 1 1 59 1 1 5 LYS CD C 7.130 5.433 -4.272 1.00 . A A . 5 LYS CD 1 1 1 60 1 1 5 LYS CE C 6.744 6.902 -4.221 1.00 . A A . 5 LYS CE 1 1 1 61 1 1 5 LYS CG C 5.985 4.592 -4.794 1.00 . A A . 5 LYS CG 1 1 1 62 1 1 5 LYS H H 6.446 0.567 -5.009 1.00 . A A . 5 LYS H 1 1 1 63 1 1 5 LYS HA H 4.803 2.263 -3.687 1.00 . A A . 5 LYS HA 1 1 1 64 1 1 5 LYS HB2 H 7.065 2.895 -4.111 1.00 . A A . 5 LYS HB2 1 1 1 65 1 1 5 LYS HB3 H 6.786 2.932 -5.848 1.00 . A A . 5 LYS HB3 1 1 1 66 1 1 5 LYS HD2 H 7.387 5.101 -3.276 1.00 . A A . 5 LYS HD2 1 1 1 67 1 1 5 LYS HD3 H 7.982 5.316 -4.926 1.00 . A A . 5 LYS HD3 1 1 1 68 1 1 5 LYS HE2 H 6.917 7.339 -5.194 1.00 . A A . 5 LYS HE2 1 1 1 69 1 1 5 LYS HE3 H 5.693 6.977 -3.979 1.00 . A A . 5 LYS HE3 1 1 1 70 1 1 5 LYS HG2 H 5.716 4.949 -5.771 1.00 . A A . 5 LYS HG2 1 1 1 71 1 1 5 LYS HG3 H 5.142 4.703 -4.137 1.00 . A A . 5 LYS HG3 1 1 1 72 1 1 5 LYS HZ1 H 8.541 7.651 -3.465 1.00 . A A . 5 LYS HZ1 1 1 1 73 1 1 5 LYS HZ2 H 7.436 7.184 -2.266 1.00 . A A . 5 LYS HZ2 1 1 1 74 1 1 5 LYS HZ3 H 7.199 8.624 -3.130 1.00 . A A . 5 LYS HZ3 1 1 1 75 1 1 5 LYS N N 5.500 0.802 -4.934 1.00 . A A . 5 LYS N 1 1 1 76 1 1 5 LYS NZ N 7.537 7.646 -3.205 1.00 . A A . 5 LYS NZ 1 1 1 77 1 1 5 LYS O O 2.869 2.869 -5.101 1.00 . A A . 5 LYS O 1 1 1 78 1 1 6 TRP C C 2.271 2.192 -8.160 1.00 . A A . 6 TRP C 1 1 1 79 1 1 6 TRP CA C 3.156 3.342 -7.708 1.00 . A A . 6 TRP CA 1 1 1 80 1 1 6 TRP CB C 3.754 4.093 -8.898 1.00 . A A . 6 TRP CB 1 1 1 81 1 1 6 TRP CD1 C 6.225 4.600 -8.421 1.00 . A A . 6 TRP CD1 1 1 1 82 1 1 6 TRP CD2 C 4.878 6.371 -8.187 1.00 . A A . 6 TRP CD2 1 1 1 83 1 1 6 TRP CE2 C 6.202 6.775 -7.924 1.00 . A A . 6 TRP CE2 1 1 1 84 1 1 6 TRP CE3 C 3.859 7.321 -8.093 1.00 . A A . 6 TRP CE3 1 1 1 85 1 1 6 TRP CG C 4.918 4.977 -8.527 1.00 . A A . 6 TRP CG 1 1 1 86 1 1 6 TRP CH2 C 5.508 8.988 -7.490 1.00 . A A . 6 TRP CH2 1 1 1 87 1 1 6 TRP CZ2 C 6.528 8.082 -7.574 1.00 . A A . 6 TRP CZ2 1 1 1 88 1 1 6 TRP CZ3 C 4.183 8.617 -7.742 1.00 . A A . 6 TRP CZ3 1 1 1 89 1 1 6 TRP H H 5.091 2.697 -7.195 1.00 . A A . 6 TRP H 1 1 1 90 1 1 6 TRP HA H 2.545 4.029 -7.131 1.00 . A A . 6 TRP HA 1 1 1 91 1 1 6 TRP HB2 H 4.100 3.378 -9.630 1.00 . A A . 6 TRP HB2 1 1 1 92 1 1 6 TRP HB3 H 2.991 4.715 -9.343 1.00 . A A . 6 TRP HB3 1 1 1 93 1 1 6 TRP HD1 H 6.582 3.600 -8.594 1.00 . A A . 6 TRP HD1 1 1 1 94 1 1 6 TRP HE1 H 7.978 5.660 -7.959 1.00 . A A . 6 TRP HE1 1 1 1 95 1 1 6 TRP HE3 H 2.834 7.053 -8.275 1.00 . A A . 6 TRP HE3 1 1 1 96 1 1 6 TRP HH2 H 5.715 10.014 -7.218 1.00 . A A . 6 TRP HH2 1 1 1 97 1 1 6 TRP HZ2 H 7.546 8.385 -7.377 1.00 . A A . 6 TRP HZ2 1 1 1 98 1 1 6 TRP HZ3 H 3.405 9.362 -7.665 1.00 . A A . 6 TRP HZ3 1 1 1 99 1 1 6 TRP N N 4.210 2.866 -6.839 1.00 . A A . 6 TRP N 1 1 1 100 1 1 6 TRP NE1 N 7.004 5.677 -8.076 1.00 . A A . 6 TRP NE1 1 1 1 101 1 1 6 TRP O O 1.747 2.199 -9.272 1.00 . A A . 6 TRP O 1 1 1 102 1 1 7 GLU C C -0.156 0.277 -7.054 1.00 . A A . 7 GLU C 1 1 1 103 1 1 7 GLU CA C 1.250 0.065 -7.620 1.00 . A A . 7 GLU CA 1 1 1 104 1 1 7 GLU CB C 1.851 -1.251 -7.118 1.00 . A A . 7 GLU CB 1 1 1 105 1 1 7 GLU CD C 2.042 -3.755 -7.444 1.00 . A A . 7 GLU CD 1 1 1 106 1 1 7 GLU CG C 1.404 -2.467 -7.921 1.00 . A A . 7 GLU CG 1 1 1 107 1 1 7 GLU H H 2.545 1.257 -6.390 1.00 . A A . 7 GLU H 1 1 1 108 1 1 7 GLU HA H 1.177 0.025 -8.698 1.00 . A A . 7 GLU HA 1 1 1 109 1 1 7 GLU HB2 H 2.928 -1.186 -7.172 1.00 . A A . 7 GLU HB2 1 1 1 110 1 1 7 GLU HB3 H 1.560 -1.398 -6.089 1.00 . A A . 7 GLU HB3 1 1 1 111 1 1 7 GLU HG2 H 0.332 -2.563 -7.835 1.00 . A A . 7 GLU HG2 1 1 1 112 1 1 7 GLU HG3 H 1.667 -2.314 -8.957 1.00 . A A . 7 GLU HG3 1 1 1 113 1 1 7 GLU N N 2.098 1.204 -7.286 1.00 . A A . 7 GLU N 1 1 1 114 1 1 7 GLU O O -0.786 1.299 -7.316 1.00 . A A . 7 GLU O 1 1 1 115 1 1 7 GLU OE1 O 2.639 -3.765 -6.351 1.00 . A A . 7 GLU OE1 1 1 1 116 1 1 7 GLU OE2 O 1.963 -4.769 -8.169 1.00 . A A . 7 GLU OE2 1 1 1 117 1 1 8 TYR C C -1.979 -1.150 -4.285 1.00 . A A . 8 TYR C 1 1 1 118 1 1 8 TYR CA C -1.972 -0.578 -5.695 1.00 . A A . 8 TYR CA 1 1 1 119 1 1 8 TYR CB C -2.993 -1.324 -6.564 1.00 . A A . 8 TYR CB 1 1 1 120 1 1 8 TYR CD1 C -5.079 -0.161 -5.732 1.00 . A A . 8 TYR CD1 1 1 1 121 1 1 8 TYR CD2 C -5.037 -2.544 -5.712 1.00 . A A . 8 TYR CD2 1 1 1 122 1 1 8 TYR CE1 C -6.357 -0.175 -5.208 1.00 . A A . 8 TYR CE1 1 1 1 123 1 1 8 TYR CE2 C -6.315 -2.564 -5.187 1.00 . A A . 8 TYR CE2 1 1 1 124 1 1 8 TYR CG C -4.396 -1.342 -5.992 1.00 . A A . 8 TYR CG 1 1 1 125 1 1 8 TYR CZ C -6.971 -1.378 -4.937 1.00 . A A . 8 TYR CZ 1 1 1 126 1 1 8 TYR H H -0.103 -1.476 -6.098 1.00 . A A . 8 TYR H 1 1 1 127 1 1 8 TYR HA H -2.240 0.466 -5.653 1.00 . A A . 8 TYR HA 1 1 1 128 1 1 8 TYR HB2 H -3.039 -0.853 -7.535 1.00 . A A . 8 TYR HB2 1 1 1 129 1 1 8 TYR HB3 H -2.670 -2.349 -6.684 1.00 . A A . 8 TYR HB3 1 1 1 130 1 1 8 TYR HD1 H -4.596 0.782 -5.946 1.00 . A A . 8 TYR HD1 1 1 1 131 1 1 8 TYR HD2 H -4.520 -3.471 -5.908 1.00 . A A . 8 TYR HD2 1 1 1 132 1 1 8 TYR HE1 H -6.870 0.756 -5.012 1.00 . A A . 8 TYR HE1 1 1 1 133 1 1 8 TYR HE2 H -6.796 -3.509 -4.977 1.00 . A A . 8 TYR HE2 1 1 1 134 1 1 8 TYR HH H -8.883 -1.453 -5.126 1.00 . A A . 8 TYR HH 1 1 1 135 1 1 8 TYR N N -0.646 -0.681 -6.281 1.00 . A A . 8 TYR N 1 1 1 136 1 1 8 TYR O O -1.490 -2.254 -4.049 1.00 . A A . 8 TYR O 1 1 1 137 1 1 8 TYR OH O -8.242 -1.395 -4.412 1.00 . A A . 8 TYR OH 1 1 1 138 1 1 9 CYS C C -3.631 0.031 -1.205 1.00 . A A . 9 CYS C 1 1 1 139 1 1 9 CYS CA C -2.633 -0.829 -1.968 1.00 . A A . 9 CYS CA 1 1 1 140 1 1 9 CYS CB C -1.263 -0.768 -1.283 1.00 . A A . 9 CYS CB 1 1 1 141 1 1 9 CYS H H -2.925 0.474 -3.606 1.00 . A A . 9 CYS H 1 1 1 142 1 1 9 CYS HA H -2.982 -1.852 -1.963 1.00 . A A . 9 CYS HA 1 1 1 143 1 1 9 CYS HB2 H -0.557 -1.358 -1.849 1.00 . A A . 9 CYS HB2 1 1 1 144 1 1 9 CYS HB3 H -0.928 0.258 -1.253 1.00 . A A . 9 CYS HB3 1 1 1 145 1 1 9 CYS N N -2.545 -0.396 -3.353 1.00 . A A . 9 CYS N 1 1 1 146 1 1 9 CYS O O -3.498 1.252 -1.143 1.00 . A A . 9 CYS O 1 1 1 147 1 1 9 CYS SG S -1.271 -1.401 0.429 1.00 . A A . 9 CYS SG 1 1 1 148 1 1 10 ILE C C -5.424 -0.221 1.638 1.00 . A A . 10 ILE C 1 1 1 149 1 1 10 ILE CA C -5.640 0.070 0.155 1.00 . A A . 10 ILE CA 1 1 1 150 1 1 10 ILE CB C -7.066 -0.348 -0.286 1.00 . A A . 10 ILE CB 1 1 1 151 1 1 10 ILE CD1 C -9.547 0.161 0.036 1.00 . A A . 10 ILE CD1 1 1 1 152 1 1 10 ILE CG1 C -8.127 0.454 0.476 1.00 . A A . 10 ILE CG1 1 1 1 153 1 1 10 ILE CG2 C -7.275 -1.846 -0.092 1.00 . A A . 10 ILE CG2 1 1 1 154 1 1 10 ILE H H -4.667 -1.594 -0.698 1.00 . A A . 10 ILE H 1 1 1 155 1 1 10 ILE HA H -5.526 1.132 -0.014 1.00 . A A . 10 ILE HA 1 1 1 156 1 1 10 ILE HB H -7.161 -0.138 -1.341 1.00 . A A . 10 ILE HB 1 1 1 157 1 1 10 ILE HD11 H -9.869 0.916 -0.666 1.00 . A A . 10 ILE HD11 1 1 1 158 1 1 10 ILE HD12 H -10.198 0.168 0.898 1.00 . A A . 10 ILE HD12 1 1 1 159 1 1 10 ILE HD13 H -9.584 -0.809 -0.435 1.00 . A A . 10 ILE HD13 1 1 1 160 1 1 10 ILE HG12 H -8.053 0.226 1.529 1.00 . A A . 10 ILE HG12 1 1 1 161 1 1 10 ILE HG13 H -7.944 1.509 0.328 1.00 . A A . 10 ILE HG13 1 1 1 162 1 1 10 ILE HG21 H -6.552 -2.390 -0.680 1.00 . A A . 10 ILE HG21 1 1 1 163 1 1 10 ILE HG22 H -8.272 -2.114 -0.410 1.00 . A A . 10 ILE HG22 1 1 1 164 1 1 10 ILE HG23 H -7.152 -2.094 0.952 1.00 . A A . 10 ILE HG23 1 1 1 165 1 1 10 ILE N N -4.623 -0.618 -0.620 1.00 . A A . 10 ILE N 1 1 1 166 1 1 10 ILE O O -4.998 -1.320 1.999 1.00 . A A . 10 ILE O 1 1 1 167 1 1 11 VAL C C -6.763 0.788 4.746 1.00 . A A . 11 VAL C 1 1 1 168 1 1 11 VAL CA C -5.478 0.590 3.928 1.00 . A A . 11 VAL CA 1 1 1 169 1 1 11 VAL CB C -4.373 1.533 4.457 1.00 . A A . 11 VAL CB 1 1 1 170 1 1 11 VAL CG1 C -2.999 1.031 4.040 1.00 . A A . 11 VAL CG1 1 1 1 171 1 1 11 VAL CG2 C -4.585 2.960 3.964 1.00 . A A . 11 VAL CG2 1 1 1 172 1 1 11 VAL H H -5.995 1.626 2.153 1.00 . A A . 11 VAL H 1 1 1 173 1 1 11 VAL HA H -5.138 -0.425 4.079 1.00 . A A . 11 VAL HA 1 1 1 174 1 1 11 VAL HB H -4.416 1.535 5.536 1.00 . A A . 11 VAL HB 1 1 1 175 1 1 11 VAL HG11 H -3.082 0.018 3.676 1.00 . A A . 11 VAL HG11 1 1 1 176 1 1 11 VAL HG12 H -2.334 1.056 4.890 1.00 . A A . 11 VAL HG12 1 1 1 177 1 1 11 VAL HG13 H -2.607 1.665 3.257 1.00 . A A . 11 VAL HG13 1 1 1 178 1 1 11 VAL HG21 H -3.777 3.586 4.312 1.00 . A A . 11 VAL HG21 1 1 1 179 1 1 11 VAL HG22 H -5.523 3.336 4.347 1.00 . A A . 11 VAL HG22 1 1 1 180 1 1 11 VAL HG23 H -4.608 2.968 2.884 1.00 . A A . 11 VAL HG23 1 1 1 181 1 1 11 VAL N N -5.681 0.763 2.492 1.00 . A A . 11 VAL N 1 1 1 182 1 1 11 VAL O O -6.874 1.735 5.524 1.00 . A A . 11 VAL O 1 1 1 183 1 1 12 PRO C C -8.784 -0.318 6.841 1.00 . A A . 12 PRO C 1 1 1 184 1 1 12 PRO CA C -9.005 -0.032 5.356 1.00 . A A . 12 PRO CA 1 1 1 185 1 1 12 PRO CB C -9.892 -1.119 4.730 1.00 . A A . 12 PRO CB 1 1 1 186 1 1 12 PRO CD C -7.727 -1.293 3.733 1.00 . A A . 12 PRO CD 1 1 1 187 1 1 12 PRO CG C -9.184 -1.553 3.491 1.00 . A A . 12 PRO CG 1 1 1 188 1 1 12 PRO HA H -9.472 0.934 5.241 1.00 . A A . 12 PRO HA 1 1 1 189 1 1 12 PRO HB2 H -10.003 -1.937 5.425 1.00 . A A . 12 PRO HB2 1 1 1 190 1 1 12 PRO HB3 H -10.863 -0.704 4.502 1.00 . A A . 12 PRO HB3 1 1 1 191 1 1 12 PRO HD2 H -7.268 -2.135 4.231 1.00 . A A . 12 PRO HD2 1 1 1 192 1 1 12 PRO HD3 H -7.219 -1.076 2.804 1.00 . A A . 12 PRO HD3 1 1 1 193 1 1 12 PRO HG2 H -9.353 -2.606 3.321 1.00 . A A . 12 PRO HG2 1 1 1 194 1 1 12 PRO HG3 H -9.532 -0.976 2.648 1.00 . A A . 12 PRO HG3 1 1 1 195 1 1 12 PRO N N -7.751 -0.114 4.604 1.00 . A A . 12 PRO N 1 1 1 196 1 1 12 PRO O O -8.036 -1.234 7.199 1.00 . A A . 12 PRO O 1 1 1 197 1 1 13 ILE C C -9.982 -0.955 9.654 1.00 . A A . 13 ILE C 1 1 1 198 1 1 13 ILE CA C -9.311 0.324 9.148 1.00 . A A . 13 ILE CA 1 1 1 199 1 1 13 ILE CB C -9.887 1.551 9.890 1.00 . A A . 13 ILE CB 1 1 1 200 1 1 13 ILE CD1 C -11.940 3.059 10.079 1.00 . A A . 13 ILE CD1 1 1 1 201 1 1 13 ILE CG1 C -11.271 1.920 9.339 1.00 . A A . 13 ILE CG1 1 1 1 202 1 1 13 ILE CG2 C -8.929 2.730 9.776 1.00 . A A . 13 ILE CG2 1 1 1 203 1 1 13 ILE H H -10.001 1.182 7.340 1.00 . A A . 13 ILE H 1 1 1 204 1 1 13 ILE HA H -8.258 0.260 9.375 1.00 . A A . 13 ILE HA 1 1 1 205 1 1 13 ILE HB H -9.979 1.298 10.936 1.00 . A A . 13 ILE HB 1 1 1 206 1 1 13 ILE HD11 H -12.973 2.809 10.267 1.00 . A A . 13 ILE HD11 1 1 1 207 1 1 13 ILE HD12 H -11.890 3.956 9.480 1.00 . A A . 13 ILE HD12 1 1 1 208 1 1 13 ILE HD13 H -11.434 3.225 11.019 1.00 . A A . 13 ILE HD13 1 1 1 209 1 1 13 ILE HG12 H -11.173 2.212 8.304 1.00 . A A . 13 ILE HG12 1 1 1 210 1 1 13 ILE HG13 H -11.917 1.057 9.403 1.00 . A A . 13 ILE HG13 1 1 1 211 1 1 13 ILE HG21 H -8.423 2.875 10.718 1.00 . A A . 13 ILE HG21 1 1 1 212 1 1 13 ILE HG22 H -9.484 3.621 9.524 1.00 . A A . 13 ILE HG22 1 1 1 213 1 1 13 ILE HG23 H -8.201 2.529 9.003 1.00 . A A . 13 ILE HG23 1 1 1 214 1 1 13 ILE N N -9.430 0.472 7.695 1.00 . A A . 13 ILE N 1 1 1 215 1 1 13 ILE O O -10.986 -0.919 10.364 1.00 . A A . 13 ILE O 1 1 1 216 1 1 14 LEU C C -8.869 -4.422 9.149 1.00 . A A . 14 LEU C 1 1 1 217 1 1 14 LEU CA C -9.886 -3.398 9.639 1.00 . A A . 14 LEU CA 1 1 1 218 1 1 14 LEU CB C -11.269 -3.655 9.011 1.00 . A A . 14 LEU CB 1 1 1 219 1 1 14 LEU CD1 C -11.651 -6.136 9.314 1.00 . A A . 14 LEU CD1 1 1 1 220 1 1 14 LEU CD2 C -12.154 -4.557 11.187 1.00 . A A . 14 LEU CD2 1 1 1 221 1 1 14 LEU CG C -12.135 -4.739 9.675 1.00 . A A . 14 LEU CG 1 1 1 222 1 1 14 LEU H H -8.602 -2.015 8.702 1.00 . A A . 14 LEU H 1 1 1 223 1 1 14 LEU HA H -9.957 -3.449 10.716 1.00 . A A . 14 LEU HA 1 1 1 224 1 1 14 LEU HB2 H -11.823 -2.727 9.034 1.00 . A A . 14 LEU HB2 1 1 1 225 1 1 14 LEU HB3 H -11.120 -3.933 7.978 1.00 . A A . 14 LEU HB3 1 1 1 226 1 1 14 LEU HD11 H -10.623 -6.252 9.621 1.00 . A A . 14 LEU HD11 1 1 1 227 1 1 14 LEU HD12 H -11.726 -6.278 8.246 1.00 . A A . 14 LEU HD12 1 1 1 228 1 1 14 LEU HD13 H -12.263 -6.871 9.818 1.00 . A A . 14 LEU HD13 1 1 1 229 1 1 14 LEU HD21 H -11.164 -4.728 11.582 1.00 . A A . 14 LEU HD21 1 1 1 230 1 1 14 LEU HD22 H -12.843 -5.262 11.626 1.00 . A A . 14 LEU HD22 1 1 1 231 1 1 14 LEU HD23 H -12.468 -3.551 11.423 1.00 . A A . 14 LEU HD23 1 1 1 232 1 1 14 LEU HG H -13.150 -4.641 9.319 1.00 . A A . 14 LEU HG 1 1 1 233 1 1 14 LEU N N -9.401 -2.078 9.269 1.00 . A A . 14 LEU N 1 1 1 234 1 1 14 LEU O O -8.654 -5.465 9.763 1.00 . A A . 14 LEU O 1 1 1 235 1 1 15 GLY C C -6.676 -4.321 6.188 1.00 . A A . 15 GLY C 1 1 1 236 1 1 15 GLY CA C -7.234 -4.948 7.441 1.00 . A A . 15 GLY CA 1 1 1 237 1 1 15 GLY H H -8.448 -3.226 7.601 1.00 . A A . 15 GLY H 1 1 1 238 1 1 15 GLY HA2 H -6.435 -5.105 8.151 1.00 . A A . 15 GLY HA2 1 1 1 239 1 1 15 GLY HA3 H -7.683 -5.899 7.192 1.00 . A A . 15 GLY HA3 1 1 1 240 1 1 15 GLY N N -8.237 -4.087 8.033 1.00 . A A . 15 GLY N 1 1 1 241 1 1 15 GLY O O -7.432 -3.785 5.382 1.00 . A A . 15 GLY O 1 1 1 242 1 1 16 PHE C C -3.494 -4.525 4.427 1.00 . A A . 16 PHE C 1 1 1 243 1 1 16 PHE CA C -4.732 -3.752 4.863 1.00 . A A . 16 PHE CA 1 1 1 244 1 1 16 PHE CB C -4.379 -2.287 5.160 1.00 . A A . 16 PHE CB 1 1 1 245 1 1 16 PHE CD1 C -2.486 -2.616 6.794 1.00 . A A . 16 PHE CD1 1 1 1 246 1 1 16 PHE CD2 C -4.337 -1.265 7.452 1.00 . A A . 16 PHE CD2 1 1 1 247 1 1 16 PHE CE1 C -1.885 -2.394 8.017 1.00 . A A . 16 PHE CE1 1 1 1 248 1 1 16 PHE CE2 C -3.741 -1.038 8.677 1.00 . A A . 16 PHE CE2 1 1 1 249 1 1 16 PHE CG C -3.719 -2.056 6.496 1.00 . A A . 16 PHE CG 1 1 1 250 1 1 16 PHE CZ C -2.513 -1.604 8.961 1.00 . A A . 16 PHE CZ 1 1 1 251 1 1 16 PHE H H -4.803 -4.784 6.708 1.00 . A A . 16 PHE H 1 1 1 252 1 1 16 PHE HA H -5.448 -3.776 4.057 1.00 . A A . 16 PHE HA 1 1 1 253 1 1 16 PHE HB2 H -3.707 -1.924 4.398 1.00 . A A . 16 PHE HB2 1 1 1 254 1 1 16 PHE HB3 H -5.286 -1.700 5.135 1.00 . A A . 16 PHE HB3 1 1 1 255 1 1 16 PHE HD1 H -1.993 -3.234 6.057 1.00 . A A . 16 PHE HD1 1 1 1 256 1 1 16 PHE HD2 H -5.298 -0.823 7.233 1.00 . A A . 16 PHE HD2 1 1 1 257 1 1 16 PHE HE1 H -0.925 -2.838 8.237 1.00 . A A . 16 PHE HE1 1 1 1 258 1 1 16 PHE HE2 H -4.233 -0.419 9.412 1.00 . A A . 16 PHE HE2 1 1 1 259 1 1 16 PHE HZ H -2.044 -1.429 9.918 1.00 . A A . 16 PHE HZ 1 1 1 260 1 1 16 PHE N N -5.363 -4.358 6.026 1.00 . A A . 16 PHE N 1 1 1 261 1 1 16 PHE O O -2.987 -5.374 5.163 1.00 . A A . 16 PHE O 1 1 1 262 1 1 17 VAL C C -0.579 -4.219 3.224 1.00 . A A . 17 VAL C 1 1 1 263 1 1 17 VAL CA C -1.845 -4.871 2.664 1.00 . A A . 17 VAL CA 1 1 1 264 1 1 17 VAL CB C -1.840 -4.787 1.115 1.00 . A A . 17 VAL CB 1 1 1 265 1 1 17 VAL CG1 C -1.054 -5.941 0.504 1.00 . A A . 17 VAL CG1 1 1 1 266 1 1 17 VAL CG2 C -3.261 -4.761 0.567 1.00 . A A . 17 VAL CG2 1 1 1 267 1 1 17 VAL H H -3.480 -3.534 2.696 1.00 . A A . 17 VAL H 1 1 1 268 1 1 17 VAL HA H -1.858 -5.911 2.951 1.00 . A A . 17 VAL HA 1 1 1 269 1 1 17 VAL HB H -1.353 -3.865 0.830 1.00 . A A . 17 VAL HB 1 1 1 270 1 1 17 VAL HG11 H -0.645 -6.556 1.292 1.00 . A A . 17 VAL HG11 1 1 1 271 1 1 17 VAL HG12 H -0.249 -5.549 -0.100 1.00 . A A . 17 VAL HG12 1 1 1 272 1 1 17 VAL HG13 H -1.710 -6.536 -0.115 1.00 . A A . 17 VAL HG13 1 1 1 273 1 1 17 VAL HG21 H -3.444 -5.661 -0.001 1.00 . A A . 17 VAL HG21 1 1 1 274 1 1 17 VAL HG22 H -3.384 -3.900 -0.072 1.00 . A A . 17 VAL HG22 1 1 1 275 1 1 17 VAL HG23 H -3.961 -4.704 1.387 1.00 . A A . 17 VAL HG23 1 1 1 276 1 1 17 VAL N N -3.023 -4.221 3.224 1.00 . A A . 17 VAL N 1 1 1 277 1 1 17 VAL O O -0.645 -3.421 4.160 1.00 . A A . 17 VAL O 1 1 1 278 1 1 18 TYR C C 2.814 -3.880 1.945 1.00 . A A . 18 TYR C 1 1 1 279 1 1 18 TYR CA C 1.829 -3.996 3.102 1.00 . A A . 18 TYR CA 1 1 1 280 1 1 18 TYR CB C 2.420 -4.856 4.233 1.00 . A A . 18 TYR CB 1 1 1 281 1 1 18 TYR CD1 C 3.926 -6.669 3.303 1.00 . A A . 18 TYR CD1 1 1 1 282 1 1 18 TYR CD2 C 1.733 -7.281 4.011 1.00 . A A . 18 TYR CD2 1 1 1 283 1 1 18 TYR CE1 C 4.178 -7.977 2.938 1.00 . A A . 18 TYR CE1 1 1 1 284 1 1 18 TYR CE2 C 1.979 -8.593 3.650 1.00 . A A . 18 TYR CE2 1 1 1 285 1 1 18 TYR CG C 2.699 -6.297 3.844 1.00 . A A . 18 TYR CG 1 1 1 286 1 1 18 TYR CZ C 3.202 -8.935 3.115 1.00 . A A . 18 TYR CZ 1 1 1 287 1 1 18 TYR H H 0.560 -5.187 1.908 1.00 . A A . 18 TYR H 1 1 1 288 1 1 18 TYR HA H 1.632 -3.005 3.487 1.00 . A A . 18 TYR HA 1 1 1 289 1 1 18 TYR HB2 H 3.352 -4.418 4.556 1.00 . A A . 18 TYR HB2 1 1 1 290 1 1 18 TYR HB3 H 1.729 -4.866 5.063 1.00 . A A . 18 TYR HB3 1 1 1 291 1 1 18 TYR HD1 H 4.689 -5.917 3.166 1.00 . A A . 18 TYR HD1 1 1 1 292 1 1 18 TYR HD2 H 0.775 -7.011 4.430 1.00 . A A . 18 TYR HD2 1 1 1 293 1 1 18 TYR HE1 H 5.136 -8.246 2.520 1.00 . A A . 18 TYR HE1 1 1 1 294 1 1 18 TYR HE2 H 1.215 -9.344 3.788 1.00 . A A . 18 TYR HE2 1 1 1 295 1 1 18 TYR HH H 3.743 -10.738 3.523 1.00 . A A . 18 TYR HH 1 1 1 296 1 1 18 TYR N N 0.566 -4.551 2.652 1.00 . A A . 18 TYR N 1 1 1 297 1 1 18 TYR O O 2.949 -4.793 1.131 1.00 . A A . 18 TYR O 1 1 1 298 1 1 18 TYR OH O 3.450 -10.242 2.747 1.00 . A A . 18 TYR OH 1 1 1 299 1 1 19 CYS C C 5.819 -3.087 1.194 1.00 . A A . 19 CYS C 1 1 1 300 1 1 19 CYS CA C 4.471 -2.492 0.833 1.00 . A A . 19 CYS CA 1 1 1 301 1 1 19 CYS CB C 4.628 -0.998 0.637 1.00 . A A . 19 CYS CB 1 1 1 302 1 1 19 CYS H H 3.329 -2.056 2.554 1.00 . A A . 19 CYS H 1 1 1 303 1 1 19 CYS HA H 4.117 -2.937 -0.084 1.00 . A A . 19 CYS HA 1 1 1 304 1 1 19 CYS HB2 H 4.711 -0.548 1.609 1.00 . A A . 19 CYS HB2 1 1 1 305 1 1 19 CYS HB3 H 5.535 -0.794 0.075 1.00 . A A . 19 CYS HB3 1 1 1 306 1 1 19 CYS N N 3.491 -2.748 1.878 1.00 . A A . 19 CYS N 1 1 1 307 1 1 19 CYS O O 6.024 -3.550 2.317 1.00 . A A . 19 CYS O 1 1 1 308 1 1 19 CYS SG S 3.229 -0.208 -0.214 1.00 . A A . 19 CYS SG 1 1 1 309 1 1 20 CYS C C 8.785 -2.669 1.459 1.00 . A A . 20 CYS C 1 1 1 310 1 1 20 CYS CA C 8.079 -3.574 0.468 1.00 . A A . 20 CYS CA 1 1 1 311 1 1 20 CYS CB C 8.864 -3.635 -0.839 1.00 . A A . 20 CYS CB 1 1 1 312 1 1 20 CYS H H 6.519 -2.666 -0.631 1.00 . A A . 20 CYS H 1 1 1 313 1 1 20 CYS HA H 7.993 -4.571 0.886 1.00 . A A . 20 CYS HA 1 1 1 314 1 1 20 CYS HB2 H 9.113 -2.630 -1.138 1.00 . A A . 20 CYS HB2 1 1 1 315 1 1 20 CYS HB3 H 9.778 -4.187 -0.672 1.00 . A A . 20 CYS HB3 1 1 1 316 1 1 20 CYS N N 6.741 -3.059 0.240 1.00 . A A . 20 CYS N 1 1 1 317 1 1 20 CYS O O 8.442 -1.490 1.561 1.00 . A A . 20 CYS O 1 1 1 318 1 1 20 CYS SG S 7.969 -4.434 -2.217 1.00 . A A . 20 CYS SG 1 1 1 319 1 1 21 PRO C C 11.017 -1.110 2.610 1.00 . A A . 21 PRO C 1 1 1 320 1 1 21 PRO CA C 10.477 -2.396 3.201 1.00 . A A . 21 PRO CA 1 1 1 321 1 1 21 PRO CB C 11.608 -3.304 3.652 1.00 . A A . 21 PRO CB 1 1 1 322 1 1 21 PRO CD C 10.228 -4.585 2.179 1.00 . A A . 21 PRO CD 1 1 1 323 1 1 21 PRO CG C 11.099 -4.684 3.405 1.00 . A A . 21 PRO CG 1 1 1 324 1 1 21 PRO HA H 9.846 -2.159 4.046 1.00 . A A . 21 PRO HA 1 1 1 325 1 1 21 PRO HB2 H 12.497 -3.094 3.074 1.00 . A A . 21 PRO HB2 1 1 1 326 1 1 21 PRO HB3 H 11.796 -3.127 4.697 1.00 . A A . 21 PRO HB3 1 1 1 327 1 1 21 PRO HD2 H 10.807 -4.773 1.287 1.00 . A A . 21 PRO HD2 1 1 1 328 1 1 21 PRO HD3 H 9.398 -5.270 2.241 1.00 . A A . 21 PRO HD3 1 1 1 329 1 1 21 PRO HG2 H 11.927 -5.355 3.226 1.00 . A A . 21 PRO HG2 1 1 1 330 1 1 21 PRO HG3 H 10.518 -5.020 4.251 1.00 . A A . 21 PRO HG3 1 1 1 331 1 1 21 PRO N N 9.759 -3.192 2.214 1.00 . A A . 21 PRO N 1 1 1 332 1 1 21 PRO O O 11.873 -1.115 1.725 1.00 . A A . 21 PRO O 1 1 1 333 1 1 22 GLY C C 9.683 2.074 2.091 1.00 . A A . 22 GLY C 1 1 1 334 1 1 22 GLY CA C 10.863 1.290 2.629 1.00 . A A . 22 GLY CA 1 1 1 335 1 1 22 GLY H H 9.791 -0.112 3.787 1.00 . A A . 22 GLY H 1 1 1 336 1 1 22 GLY HA2 H 11.306 1.839 3.445 1.00 . A A . 22 GLY HA2 1 1 1 337 1 1 22 GLY HA3 H 11.595 1.177 1.843 1.00 . A A . 22 GLY HA3 1 1 1 338 1 1 22 GLY N N 10.478 -0.020 3.101 1.00 . A A . 22 GLY N 1 1 1 339 1 1 22 GLY O O 9.658 3.299 2.183 1.00 . A A . 22 GLY O 1 1 1 340 1 1 23 LEU C C 6.326 1.808 1.882 1.00 . A A . 23 LEU C 1 1 1 341 1 1 23 LEU CA C 7.528 2.010 0.966 1.00 . A A . 23 LEU CA 1 1 1 342 1 1 23 LEU CB C 7.243 1.429 -0.420 1.00 . A A . 23 LEU CB 1 1 1 343 1 1 23 LEU CD1 C 8.089 0.720 -2.669 1.00 . A A . 23 LEU CD1 1 1 1 344 1 1 23 LEU CD2 C 8.730 2.951 -1.747 1.00 . A A . 23 LEU CD2 1 1 1 345 1 1 23 LEU CG C 8.410 1.503 -1.407 1.00 . A A . 23 LEU CG 1 1 1 346 1 1 23 LEU H H 8.775 0.389 1.479 1.00 . A A . 23 LEU H 1 1 1 347 1 1 23 LEU HA H 7.730 3.066 0.873 1.00 . A A . 23 LEU HA 1 1 1 348 1 1 23 LEU HB2 H 6.965 0.392 -0.300 1.00 . A A . 23 LEU HB2 1 1 1 349 1 1 23 LEU HB3 H 6.407 1.962 -0.845 1.00 . A A . 23 LEU HB3 1 1 1 350 1 1 23 LEU HD11 H 8.596 -0.233 -2.640 1.00 . A A . 23 LEU HD11 1 1 1 351 1 1 23 LEU HD12 H 8.418 1.277 -3.533 1.00 . A A . 23 LEU HD12 1 1 1 352 1 1 23 LEU HD13 H 7.023 0.557 -2.730 1.00 . A A . 23 LEU HD13 1 1 1 353 1 1 23 LEU HD21 H 8.259 3.215 -2.682 1.00 . A A . 23 LEU HD21 1 1 1 354 1 1 23 LEU HD22 H 9.800 3.073 -1.837 1.00 . A A . 23 LEU HD22 1 1 1 355 1 1 23 LEU HD23 H 8.360 3.595 -0.964 1.00 . A A . 23 LEU HD23 1 1 1 356 1 1 23 LEU HG H 9.286 1.063 -0.954 1.00 . A A . 23 LEU HG 1 1 1 357 1 1 23 LEU N N 8.706 1.370 1.526 1.00 . A A . 23 LEU N 1 1 1 358 1 1 23 LEU O O 6.230 0.790 2.574 1.00 . A A . 23 LEU O 1 1 1 359 1 1 24 ILE C C 2.954 2.969 1.905 1.00 . A A . 24 ILE C 1 1 1 360 1 1 24 ILE CA C 4.216 2.680 2.718 1.00 . A A . 24 ILE CA 1 1 1 361 1 1 24 ILE CB C 4.260 3.624 3.952 1.00 . A A . 24 ILE CB 1 1 1 362 1 1 24 ILE CD1 C 5.943 5.443 3.243 1.00 . A A . 24 ILE CD1 1 1 1 363 1 1 24 ILE CG1 C 4.499 5.093 3.549 1.00 . A A . 24 ILE CG1 1 1 1 364 1 1 24 ILE CG2 C 5.317 3.157 4.945 1.00 . A A . 24 ILE CG2 1 1 1 365 1 1 24 ILE H H 5.541 3.561 1.305 1.00 . A A . 24 ILE H 1 1 1 366 1 1 24 ILE HA H 4.155 1.663 3.083 1.00 . A A . 24 ILE HA 1 1 1 367 1 1 24 ILE HB H 3.302 3.554 4.446 1.00 . A A . 24 ILE HB 1 1 1 368 1 1 24 ILE HD11 H 5.976 6.196 2.471 1.00 . A A . 24 ILE HD11 1 1 1 369 1 1 24 ILE HD12 H 6.464 4.558 2.905 1.00 . A A . 24 ILE HD12 1 1 1 370 1 1 24 ILE HD13 H 6.418 5.820 4.136 1.00 . A A . 24 ILE HD13 1 1 1 371 1 1 24 ILE HG12 H 3.917 5.311 2.666 1.00 . A A . 24 ILE HG12 1 1 1 372 1 1 24 ILE HG13 H 4.167 5.732 4.353 1.00 . A A . 24 ILE HG13 1 1 1 373 1 1 24 ILE HG21 H 5.833 4.014 5.351 1.00 . A A . 24 ILE HG21 1 1 1 374 1 1 24 ILE HG22 H 6.025 2.516 4.441 1.00 . A A . 24 ILE HG22 1 1 1 375 1 1 24 ILE HG23 H 4.842 2.609 5.745 1.00 . A A . 24 ILE HG23 1 1 1 376 1 1 24 ILE N N 5.412 2.768 1.886 1.00 . A A . 24 ILE N 1 1 1 377 1 1 24 ILE O O 2.914 3.908 1.108 1.00 . A A . 24 ILE O 1 1 1 378 1 1 25 CYS C C -0.008 3.625 1.702 1.00 . A A . 25 CYS C 1 1 1 379 1 1 25 CYS CA C 0.663 2.288 1.390 1.00 . A A . 25 CYS CA 1 1 1 380 1 1 25 CYS CB C -0.284 1.143 1.752 1.00 . A A . 25 CYS CB 1 1 1 381 1 1 25 CYS H H 2.036 1.403 2.738 1.00 . A A . 25 CYS H 1 1 1 382 1 1 25 CYS HA H 0.873 2.244 0.332 1.00 . A A . 25 CYS HA 1 1 1 383 1 1 25 CYS HB2 H -0.451 1.148 2.818 1.00 . A A . 25 CYS HB2 1 1 1 384 1 1 25 CYS HB3 H -1.226 1.292 1.245 1.00 . A A . 25 CYS HB3 1 1 1 385 1 1 25 CYS N N 1.932 2.142 2.103 1.00 . A A . 25 CYS N 1 1 1 386 1 1 25 CYS O O 0.125 4.160 2.804 1.00 . A A . 25 CYS O 1 1 1 387 1 1 25 CYS SG S 0.333 -0.511 1.300 1.00 . A A . 25 CYS SG 1 1 1 388 1 1 26 GLY C C -2.731 5.486 0.145 1.00 . A A . 26 GLY C 1 1 1 389 1 1 26 GLY CA C -1.411 5.424 0.896 1.00 . A A . 26 GLY CA 1 1 1 390 1 1 26 GLY H H -0.797 3.683 -0.136 1.00 . A A . 26 GLY H 1 1 1 391 1 1 26 GLY HA2 H -1.599 5.575 1.949 1.00 . A A . 26 GLY HA2 1 1 1 392 1 1 26 GLY HA3 H -0.769 6.216 0.540 1.00 . A A . 26 GLY HA3 1 1 1 393 1 1 26 GLY N N -0.729 4.158 0.721 1.00 . A A . 26 GLY N 1 1 1 394 1 1 26 GLY O O -3.588 4.620 0.324 1.00 . A A . 26 GLY O 1 1 1 395 1 1 27 PRO C C -4.368 5.671 -2.583 1.00 . A A . 27 PRO C 1 1 1 396 1 1 27 PRO CA C -4.167 6.711 -1.475 1.00 . A A . 27 PRO CA 1 1 1 397 1 1 27 PRO CB C -3.994 8.109 -2.076 1.00 . A A . 27 PRO CB 1 1 1 398 1 1 27 PRO CD C -1.952 7.596 -0.946 1.00 . A A . 27 PRO CD 1 1 1 399 1 1 27 PRO CG C -2.521 8.321 -2.133 1.00 . A A . 27 PRO CG 1 1 1 400 1 1 27 PRO HA H -5.033 6.706 -0.830 1.00 . A A . 27 PRO HA 1 1 1 401 1 1 27 PRO HB2 H -4.436 8.136 -3.062 1.00 . A A . 27 PRO HB2 1 1 1 402 1 1 27 PRO HB3 H -4.472 8.838 -1.441 1.00 . A A . 27 PRO HB3 1 1 1 403 1 1 27 PRO HD2 H -0.980 7.189 -1.185 1.00 . A A . 27 PRO HD2 1 1 1 404 1 1 27 PRO HD3 H -1.885 8.259 -0.096 1.00 . A A . 27 PRO HD3 1 1 1 405 1 1 27 PRO HG2 H -2.126 7.908 -3.050 1.00 . A A . 27 PRO HG2 1 1 1 406 1 1 27 PRO HG3 H -2.300 9.377 -2.069 1.00 . A A . 27 PRO HG3 1 1 1 407 1 1 27 PRO N N -2.927 6.518 -0.697 1.00 . A A . 27 PRO N 1 1 1 408 1 1 27 PRO O O -4.299 5.994 -3.768 1.00 . A A . 27 PRO O 1 1 1 409 1 1 28 PHE C C -3.554 3.007 -3.892 1.00 . A A . 28 PHE C 1 1 1 410 1 1 28 PHE CA C -4.820 3.303 -3.093 1.00 . A A . 28 PHE CA 1 1 1 411 1 1 28 PHE CB C -6.024 3.545 -4.033 1.00 . A A . 28 PHE CB 1 1 1 412 1 1 28 PHE CD1 C -7.651 4.198 -2.223 1.00 . A A . 28 PHE CD1 1 1 1 413 1 1 28 PHE CD2 C -8.340 2.596 -3.849 1.00 . A A . 28 PHE CD2 1 1 1 414 1 1 28 PHE CE1 C -8.883 4.104 -1.604 1.00 . A A . 28 PHE CE1 1 1 1 415 1 1 28 PHE CE2 C -9.574 2.498 -3.235 1.00 . A A . 28 PHE CE2 1 1 1 416 1 1 28 PHE CG C -7.364 3.444 -3.351 1.00 . A A . 28 PHE CG 1 1 1 417 1 1 28 PHE CZ C -9.846 3.253 -2.111 1.00 . A A . 28 PHE CZ 1 1 1 418 1 1 28 PHE H H -4.632 4.253 -1.208 1.00 . A A . 28 PHE H 1 1 1 419 1 1 28 PHE HA H -5.035 2.437 -2.483 1.00 . A A . 28 PHE HA 1 1 1 420 1 1 28 PHE HB2 H -5.953 4.533 -4.466 1.00 . A A . 28 PHE HB2 1 1 1 421 1 1 28 PHE HB3 H -6.006 2.811 -4.829 1.00 . A A . 28 PHE HB3 1 1 1 422 1 1 28 PHE HD1 H -6.900 4.863 -1.825 1.00 . A A . 28 PHE HD1 1 1 1 423 1 1 28 PHE HD2 H -8.128 2.002 -4.726 1.00 . A A . 28 PHE HD2 1 1 1 424 1 1 28 PHE HE1 H -9.094 4.696 -0.726 1.00 . A A . 28 PHE HE1 1 1 1 425 1 1 28 PHE HE2 H -10.326 1.832 -3.634 1.00 . A A . 28 PHE HE2 1 1 1 426 1 1 28 PHE HZ H -10.809 3.179 -1.630 1.00 . A A . 28 PHE HZ 1 1 1 427 1 1 28 PHE N N -4.607 4.427 -2.174 1.00 . A A . 28 PHE N 1 1 1 428 1 1 28 PHE O O -3.600 2.369 -4.940 1.00 . A A . 28 PHE O 1 1 1 429 1 1 29 VAL C C -0.095 3.129 -2.837 1.00 . A A . 29 VAL C 1 1 1 430 1 1 29 VAL CA C -1.112 3.209 -3.957 1.00 . A A . 29 VAL CA 1 1 1 431 1 1 29 VAL CB C -0.696 4.337 -4.955 1.00 . A A . 29 VAL CB 1 1 1 432 1 1 29 VAL CG1 C -1.607 4.364 -6.174 1.00 . A A . 29 VAL CG1 1 1 1 433 1 1 29 VAL CG2 C -0.693 5.697 -4.267 1.00 . A A . 29 VAL CG2 1 1 1 434 1 1 29 VAL H H -2.450 3.903 -2.484 1.00 . A A . 29 VAL H 1 1 1 435 1 1 29 VAL HA H -1.132 2.266 -4.483 1.00 . A A . 29 VAL HA 1 1 1 436 1 1 29 VAL HB H 0.313 4.134 -5.304 1.00 . A A . 29 VAL HB 1 1 1 437 1 1 29 VAL HG11 H -2.159 5.293 -6.189 1.00 . A A . 29 VAL HG11 1 1 1 438 1 1 29 VAL HG12 H -2.297 3.535 -6.125 1.00 . A A . 29 VAL HG12 1 1 1 439 1 1 29 VAL HG13 H -1.010 4.286 -7.070 1.00 . A A . 29 VAL HG13 1 1 1 440 1 1 29 VAL HG21 H -1.630 5.839 -3.748 1.00 . A A . 29 VAL HG21 1 1 1 441 1 1 29 VAL HG22 H -0.570 6.473 -5.007 1.00 . A A . 29 VAL HG22 1 1 1 442 1 1 29 VAL HG23 H 0.121 5.740 -3.559 1.00 . A A . 29 VAL HG23 1 1 1 443 1 1 29 VAL N N -2.417 3.436 -3.351 1.00 . A A . 29 VAL N 1 1 1 444 1 1 29 VAL O O -0.461 2.911 -1.683 1.00 . A A . 29 VAL O 1 1 1 445 1 1 30 CYS C C 3.139 4.464 -2.402 1.00 . A A . 30 CYS C 1 1 1 446 1 1 30 CYS CA C 2.213 3.273 -2.181 1.00 . A A . 30 CYS CA 1 1 1 447 1 1 30 CYS CB C 2.985 1.962 -2.307 1.00 . A A . 30 CYS CB 1 1 1 448 1 1 30 CYS H H 1.387 3.482 -4.105 1.00 . A A . 30 CYS H 1 1 1 449 1 1 30 CYS HA H 1.770 3.341 -1.198 1.00 . A A . 30 CYS HA 1 1 1 450 1 1 30 CYS HB2 H 2.290 1.152 -2.474 1.00 . A A . 30 CYS HB2 1 1 1 451 1 1 30 CYS HB3 H 3.648 2.031 -3.156 1.00 . A A . 30 CYS HB3 1 1 1 452 1 1 30 CYS N N 1.154 3.313 -3.164 1.00 . A A . 30 CYS N 1 1 1 453 1 1 30 CYS O O 3.193 5.014 -3.504 1.00 . A A . 30 CYS O 1 1 1 454 1 1 30 CYS SG S 3.995 1.551 -0.857 1.00 . A A . 30 CYS SG 1 1 1 455 1 1 31 VAL C C 6.059 5.704 -0.751 1.00 . A A . 31 VAL C 1 1 1 456 1 1 31 VAL CA C 4.767 5.996 -1.494 1.00 . A A . 31 VAL CA 1 1 1 457 1 1 31 VAL CB C 4.156 7.313 -0.957 1.00 . A A . 31 VAL CB 1 1 1 458 1 1 31 VAL CG1 C 3.016 7.791 -1.846 1.00 . A A . 31 VAL CG1 1 1 1 459 1 1 31 VAL CG2 C 3.674 7.143 0.478 1.00 . A A . 31 VAL CG2 1 1 1 460 1 1 31 VAL H H 3.781 4.405 -0.510 1.00 . A A . 31 VAL H 1 1 1 461 1 1 31 VAL HA H 4.994 6.127 -2.550 1.00 . A A . 31 VAL HA 1 1 1 462 1 1 31 VAL HB H 4.926 8.070 -0.964 1.00 . A A . 31 VAL HB 1 1 1 463 1 1 31 VAL HG11 H 2.442 8.541 -1.323 1.00 . A A . 31 VAL HG11 1 1 1 464 1 1 31 VAL HG12 H 2.378 6.956 -2.095 1.00 . A A . 31 VAL HG12 1 1 1 465 1 1 31 VAL HG13 H 3.422 8.216 -2.753 1.00 . A A . 31 VAL HG13 1 1 1 466 1 1 31 VAL HG21 H 4.349 6.487 1.007 1.00 . A A . 31 VAL HG21 1 1 1 467 1 1 31 VAL HG22 H 2.683 6.715 0.476 1.00 . A A . 31 VAL HG22 1 1 1 468 1 1 31 VAL HG23 H 3.651 8.105 0.966 1.00 . A A . 31 VAL HG23 1 1 1 469 1 1 31 VAL N N 3.858 4.872 -1.376 1.00 . A A . 31 VAL N 1 1 1 470 1 1 31 VAL O O 6.075 4.742 0.040 1.00 . A A . 31 VAL O 1 1 1 471 1 1 31 VAL OXT O 7.052 6.429 -0.988 1.00 . A A . 31 VAL OXT 1 1 2 472 1 1 1 ALA C C 5.074 -8.756 0.078 1.00 . A A . 1 ALA C 1 1 2 473 1 1 1 ALA CA C 5.035 -10.229 -0.291 1.00 . A A . 1 ALA CA 1 1 2 474 1 1 1 ALA CB C 3.610 -10.665 -0.597 1.00 . A A . 1 ALA CB 1 1 2 475 1 1 1 ALA H1 H 6.573 -11.314 0.594 1.00 . A A . 1 ALA H1 1 1 2 476 1 1 1 ALA H2 H 5.026 -11.886 0.967 1.00 . A A . 1 ALA H2 1 1 2 477 1 1 1 ALA H3 H 5.601 -10.469 1.692 1.00 . A A . 1 ALA H3 1 1 2 478 1 1 1 ALA HA H 5.638 -10.387 -1.174 1.00 . A A . 1 ALA HA 1 1 2 479 1 1 1 ALA HB1 H 3.307 -11.425 0.108 1.00 . A A . 1 ALA HB1 1 1 2 480 1 1 1 ALA HB2 H 3.564 -11.066 -1.599 1.00 . A A . 1 ALA HB2 1 1 2 481 1 1 1 ALA HB3 H 2.948 -9.815 -0.518 1.00 . A A . 1 ALA HB3 1 1 2 482 1 1 1 ALA N N 5.598 -11.033 0.815 1.00 . A A . 1 ALA N 1 1 2 483 1 1 1 ALA O O 4.955 -8.415 1.251 1.00 . A A . 1 ALA O 1 1 2 484 1 1 2 CYS C C 4.815 -5.720 -1.912 1.00 . A A . 2 CYS C 1 1 2 485 1 1 2 CYS CA C 5.317 -6.465 -0.685 1.00 . A A . 2 CYS CA 1 1 2 486 1 1 2 CYS CB C 6.746 -6.046 -0.336 1.00 . A A . 2 CYS CB 1 1 2 487 1 1 2 CYS H H 5.354 -8.233 -1.831 1.00 . A A . 2 CYS H 1 1 2 488 1 1 2 CYS HA H 4.671 -6.221 0.150 1.00 . A A . 2 CYS HA 1 1 2 489 1 1 2 CYS HB2 H 6.742 -5.002 -0.064 1.00 . A A . 2 CYS HB2 1 1 2 490 1 1 2 CYS HB3 H 7.084 -6.623 0.513 1.00 . A A . 2 CYS HB3 1 1 2 491 1 1 2 CYS N N 5.254 -7.899 -0.914 1.00 . A A . 2 CYS N 1 1 2 492 1 1 2 CYS O O 5.174 -6.050 -3.044 1.00 . A A . 2 CYS O 1 1 2 493 1 1 2 CYS SG S 7.978 -6.248 -1.666 1.00 . A A . 2 CYS SG 1 1 2 494 1 1 3 SER C C 4.385 -2.930 -3.288 1.00 . A A . 3 SER C 1 1 2 495 1 1 3 SER CA C 3.383 -3.953 -2.756 1.00 . A A . 3 SER CA 1 1 2 496 1 1 3 SER CB C 2.121 -3.249 -2.257 1.00 . A A . 3 SER CB 1 1 2 497 1 1 3 SER H H 3.693 -4.545 -0.757 1.00 . A A . 3 SER H 1 1 2 498 1 1 3 SER HA H 3.116 -4.627 -3.555 1.00 . A A . 3 SER HA 1 1 2 499 1 1 3 SER HB2 H 2.392 -2.505 -1.522 1.00 . A A . 3 SER HB2 1 1 2 500 1 1 3 SER HB3 H 1.623 -2.771 -3.088 1.00 . A A . 3 SER HB3 1 1 2 501 1 1 3 SER HG H 0.618 -4.501 -2.329 1.00 . A A . 3 SER HG 1 1 2 502 1 1 3 SER N N 3.960 -4.739 -1.681 1.00 . A A . 3 SER N 1 1 2 503 1 1 3 SER O O 5.174 -2.360 -2.526 1.00 . A A . 3 SER O 1 1 2 504 1 1 3 SER OG O 1.228 -4.178 -1.661 1.00 . A A . 3 SER OG 1 1 2 505 1 1 4 LYS C C 4.700 -0.333 -4.975 1.00 . A A . 4 LYS C 1 1 2 506 1 1 4 LYS CA C 5.224 -1.740 -5.237 1.00 . A A . 4 LYS CA 1 1 2 507 1 1 4 LYS CB C 5.306 -2.025 -6.737 1.00 . A A . 4 LYS CB 1 1 2 508 1 1 4 LYS CD C 5.318 -3.853 -8.467 1.00 . A A . 4 LYS CD 1 1 2 509 1 1 4 LYS CE C 5.180 -5.361 -8.603 1.00 . A A . 4 LYS CE 1 1 2 510 1 1 4 LYS CG C 5.678 -3.466 -7.043 1.00 . A A . 4 LYS CG 1 1 2 511 1 1 4 LYS H H 3.678 -3.186 -5.143 1.00 . A A . 4 LYS H 1 1 2 512 1 1 4 LYS HA H 6.206 -1.838 -4.798 1.00 . A A . 4 LYS HA 1 1 2 513 1 1 4 LYS HB2 H 4.346 -1.816 -7.188 1.00 . A A . 4 LYS HB2 1 1 2 514 1 1 4 LYS HB3 H 6.052 -1.379 -7.177 1.00 . A A . 4 LYS HB3 1 1 2 515 1 1 4 LYS HD2 H 4.381 -3.388 -8.731 1.00 . A A . 4 LYS HD2 1 1 2 516 1 1 4 LYS HD3 H 6.096 -3.509 -9.133 1.00 . A A . 4 LYS HD3 1 1 2 517 1 1 4 LYS HE2 H 4.910 -5.595 -9.623 1.00 . A A . 4 LYS HE2 1 1 2 518 1 1 4 LYS HE3 H 6.128 -5.821 -8.367 1.00 . A A . 4 LYS HE3 1 1 2 519 1 1 4 LYS HG2 H 6.742 -3.588 -6.908 1.00 . A A . 4 LYS HG2 1 1 2 520 1 1 4 LYS HG3 H 5.150 -4.115 -6.359 1.00 . A A . 4 LYS HG3 1 1 2 521 1 1 4 LYS HZ1 H 3.181 -5.607 -8.010 1.00 . A A . 4 LYS HZ1 1 1 2 522 1 1 4 LYS HZ2 H 4.278 -5.541 -6.724 1.00 . A A . 4 LYS HZ2 1 1 2 523 1 1 4 LYS HZ3 H 4.174 -6.940 -7.668 1.00 . A A . 4 LYS HZ3 1 1 2 524 1 1 4 LYS N N 4.342 -2.700 -4.592 1.00 . A A . 4 LYS N 1 1 2 525 1 1 4 LYS NZ N 4.136 -5.904 -7.689 1.00 . A A . 4 LYS NZ 1 1 2 526 1 1 4 LYS O O 3.501 -0.145 -4.777 1.00 . A A . 4 LYS O 1 1 2 527 1 1 5 LYS C C 4.045 2.504 -5.504 1.00 . A A . 5 LYS C 1 1 2 528 1 1 5 LYS CA C 5.207 2.017 -4.647 1.00 . A A . 5 LYS CA 1 1 2 529 1 1 5 LYS CB C 6.398 2.969 -4.796 1.00 . A A . 5 LYS CB 1 1 2 530 1 1 5 LYS CD C 7.126 5.320 -4.240 1.00 . A A . 5 LYS CD 1 1 2 531 1 1 5 LYS CE C 6.691 6.775 -4.206 1.00 . A A . 5 LYS CE 1 1 2 532 1 1 5 LYS CG C 5.996 4.432 -4.717 1.00 . A A . 5 LYS CG 1 1 2 533 1 1 5 LYS H H 6.540 0.428 -5.071 1.00 . A A . 5 LYS H 1 1 2 534 1 1 5 LYS HA H 4.883 2.039 -3.624 1.00 . A A . 5 LYS HA 1 1 2 535 1 1 5 LYS HB2 H 7.110 2.767 -4.008 1.00 . A A . 5 LYS HB2 1 1 2 536 1 1 5 LYS HB3 H 6.869 2.797 -5.753 1.00 . A A . 5 LYS HB3 1 1 2 537 1 1 5 LYS HD2 H 7.418 5.015 -3.246 1.00 . A A . 5 LYS HD2 1 1 2 538 1 1 5 LYS HD3 H 7.963 5.218 -4.914 1.00 . A A . 5 LYS HD3 1 1 2 539 1 1 5 LYS HE2 H 6.900 7.222 -5.167 1.00 . A A . 5 LYS HE2 1 1 2 540 1 1 5 LYS HE3 H 5.626 6.817 -4.018 1.00 . A A . 5 LYS HE3 1 1 2 541 1 1 5 LYS HG2 H 5.686 4.766 -5.690 1.00 . A A . 5 LYS HG2 1 1 2 542 1 1 5 LYS HG3 H 5.170 4.523 -4.037 1.00 . A A . 5 LYS HG3 1 1 2 543 1 1 5 LYS HZ1 H 7.320 7.036 -2.226 1.00 . A A . 5 LYS HZ1 1 1 2 544 1 1 5 LYS HZ2 H 6.998 8.485 -3.047 1.00 . A A . 5 LYS HZ2 1 1 2 545 1 1 5 LYS HZ3 H 8.413 7.626 -3.383 1.00 . A A . 5 LYS HZ3 1 1 2 546 1 1 5 LYS N N 5.596 0.641 -4.936 1.00 . A A . 5 LYS N 1 1 2 547 1 1 5 LYS NZ N 7.406 7.538 -3.147 1.00 . A A . 5 LYS NZ 1 1 2 548 1 1 5 LYS O O 2.963 2.762 -5.009 1.00 . A A . 5 LYS O 1 1 2 549 1 1 6 TRP C C 2.242 2.000 -8.017 1.00 . A A . 6 TRP C 1 1 2 550 1 1 6 TRP CA C 3.195 3.125 -7.635 1.00 . A A . 6 TRP CA 1 1 2 551 1 1 6 TRP CB C 3.794 3.813 -8.863 1.00 . A A . 6 TRP CB 1 1 2 552 1 1 6 TRP CD1 C 6.278 4.253 -8.373 1.00 . A A . 6 TRP CD1 1 1 2 553 1 1 6 TRP CD2 C 5.001 6.088 -8.285 1.00 . A A . 6 TRP CD2 1 1 2 554 1 1 6 TRP CE2 C 6.336 6.455 -8.024 1.00 . A A . 6 TRP CE2 1 1 2 555 1 1 6 TRP CE3 C 4.021 7.082 -8.275 1.00 . A A . 6 TRP CE3 1 1 2 556 1 1 6 TRP CG C 4.987 4.674 -8.532 1.00 . A A . 6 TRP CG 1 1 2 557 1 1 6 TRP CH2 C 5.728 8.719 -7.753 1.00 . A A . 6 TRP CH2 1 1 2 558 1 1 6 TRP CZ2 C 6.710 7.769 -7.756 1.00 . A A . 6 TRP CZ2 1 1 2 559 1 1 6 TRP CZ3 C 4.393 8.386 -8.006 1.00 . A A . 6 TRP CZ3 1 1 2 560 1 1 6 TRP H H 5.121 2.427 -7.149 1.00 . A A . 6 TRP H 1 1 2 561 1 1 6 TRP HA H 2.629 3.859 -7.066 1.00 . A A . 6 TRP HA 1 1 2 562 1 1 6 TRP HB2 H 4.109 3.061 -9.571 1.00 . A A . 6 TRP HB2 1 1 2 563 1 1 6 TRP HB3 H 3.044 4.442 -9.318 1.00 . A A . 6 TRP HB3 1 1 2 564 1 1 6 TRP HD1 H 6.596 3.229 -8.470 1.00 . A A . 6 TRP HD1 1 1 2 565 1 1 6 TRP HE1 H 8.064 5.270 -7.948 1.00 . A A . 6 TRP HE1 1 1 2 566 1 1 6 TRP HE3 H 2.989 6.845 -8.458 1.00 . A A . 6 TRP HE3 1 1 2 567 1 1 6 TRP HH2 H 5.973 9.750 -7.546 1.00 . A A . 6 TRP HH2 1 1 2 568 1 1 6 TRP HZ2 H 7.736 8.042 -7.560 1.00 . A A . 6 TRP HZ2 1 1 2 569 1 1 6 TRP HZ3 H 3.646 9.166 -7.993 1.00 . A A . 6 TRP HZ3 1 1 2 570 1 1 6 TRP N N 4.254 2.641 -6.777 1.00 . A A . 6 TRP N 1 1 2 571 1 1 6 TRP NE1 N 7.095 5.318 -8.085 1.00 . A A . 6 TRP NE1 1 1 2 572 1 1 6 TRP O O 1.610 2.034 -9.071 1.00 . A A . 6 TRP O 1 1 2 573 1 1 7 GLU C C -0.090 0.172 -6.623 1.00 . A A . 7 GLU C 1 1 2 574 1 1 7 GLU CA C 1.211 -0.093 -7.368 1.00 . A A . 7 GLU CA 1 1 2 575 1 1 7 GLU CB C 1.824 -1.424 -6.928 1.00 . A A . 7 GLU CB 1 1 2 576 1 1 7 GLU CD C 1.906 -3.932 -7.255 1.00 . A A . 7 GLU CD 1 1 2 577 1 1 7 GLU CG C 1.190 -2.638 -7.592 1.00 . A A . 7 GLU CG 1 1 2 578 1 1 7 GLU H H 2.638 1.057 -6.281 1.00 . A A . 7 GLU H 1 1 2 579 1 1 7 GLU HA H 1.002 -0.130 -8.428 1.00 . A A . 7 GLU HA 1 1 2 580 1 1 7 GLU HB2 H 2.877 -1.418 -7.169 1.00 . A A . 7 GLU HB2 1 1 2 581 1 1 7 GLU HB3 H 1.709 -1.525 -5.860 1.00 . A A . 7 GLU HB3 1 1 2 582 1 1 7 GLU HG2 H 0.164 -2.717 -7.264 1.00 . A A . 7 GLU HG2 1 1 2 583 1 1 7 GLU HG3 H 1.213 -2.499 -8.663 1.00 . A A . 7 GLU HG3 1 1 2 584 1 1 7 GLU N N 2.120 1.017 -7.133 1.00 . A A . 7 GLU N 1 1 2 585 1 1 7 GLU O O -0.076 0.706 -5.513 1.00 . A A . 7 GLU O 1 1 2 586 1 1 7 GLU OE1 O 2.685 -3.957 -6.279 1.00 . A A . 7 GLU OE1 1 1 2 587 1 1 7 GLU OE2 O 1.708 -4.935 -7.974 1.00 . A A . 7 GLU OE2 1 1 2 588 1 1 8 TYR C C -2.676 -0.759 -5.360 1.00 . A A . 8 TYR C 1 1 2 589 1 1 8 TYR CA C -2.512 0.046 -6.646 1.00 . A A . 8 TYR CA 1 1 2 590 1 1 8 TYR CB C -3.618 -0.330 -7.641 1.00 . A A . 8 TYR CB 1 1 2 591 1 1 8 TYR CD1 C -5.553 0.935 -6.616 1.00 . A A . 8 TYR CD1 1 1 2 592 1 1 8 TYR CD2 C -5.800 -1.409 -6.965 1.00 . A A . 8 TYR CD2 1 1 2 593 1 1 8 TYR CE1 C -6.826 0.993 -6.082 1.00 . A A . 8 TYR CE1 1 1 2 594 1 1 8 TYR CE2 C -7.074 -1.358 -6.433 1.00 . A A . 8 TYR CE2 1 1 2 595 1 1 8 TYR CG C -5.018 -0.264 -7.066 1.00 . A A . 8 TYR CG 1 1 2 596 1 1 8 TYR CZ C -7.582 -0.156 -5.993 1.00 . A A . 8 TYR CZ 1 1 2 597 1 1 8 TYR H H -1.148 -0.579 -8.134 1.00 . A A . 8 TYR H 1 1 2 598 1 1 8 TYR HA H -2.593 1.097 -6.408 1.00 . A A . 8 TYR HA 1 1 2 599 1 1 8 TYR HB2 H -3.576 0.345 -8.482 1.00 . A A . 8 TYR HB2 1 1 2 600 1 1 8 TYR HB3 H -3.448 -1.339 -7.988 1.00 . A A . 8 TYR HB3 1 1 2 601 1 1 8 TYR HD1 H -4.959 1.835 -6.686 1.00 . A A . 8 TYR HD1 1 1 2 602 1 1 8 TYR HD2 H -5.398 -2.350 -7.310 1.00 . A A . 8 TYR HD2 1 1 2 603 1 1 8 TYR HE1 H -7.224 1.936 -5.738 1.00 . A A . 8 TYR HE1 1 1 2 604 1 1 8 TYR HE2 H -7.666 -2.259 -6.364 1.00 . A A . 8 TYR HE2 1 1 2 605 1 1 8 TYR HH H -8.807 0.254 -4.569 1.00 . A A . 8 TYR HH 1 1 2 606 1 1 8 TYR N N -1.205 -0.175 -7.244 1.00 . A A . 8 TYR N 1 1 2 607 1 1 8 TYR O O -2.738 -1.989 -5.384 1.00 . A A . 8 TYR O 1 1 2 608 1 1 8 TYR OH O -8.850 -0.101 -5.461 1.00 . A A . 8 TYR OH 1 1 2 609 1 1 9 CYS C C -4.464 -0.685 -2.646 1.00 . A A . 9 CYS C 1 1 2 610 1 1 9 CYS CA C -2.976 -0.698 -2.962 1.00 . A A . 9 CYS CA 1 1 2 611 1 1 9 CYS CB C -2.173 0.010 -1.861 1.00 . A A . 9 CYS CB 1 1 2 612 1 1 9 CYS H H -2.750 0.925 -4.294 1.00 . A A . 9 CYS H 1 1 2 613 1 1 9 CYS HA H -2.643 -1.723 -3.046 1.00 . A A . 9 CYS HA 1 1 2 614 1 1 9 CYS HB2 H -1.166 0.179 -2.212 1.00 . A A . 9 CYS HB2 1 1 2 615 1 1 9 CYS HB3 H -2.637 0.960 -1.643 1.00 . A A . 9 CYS HB3 1 1 2 616 1 1 9 CYS N N -2.778 -0.055 -4.246 1.00 . A A . 9 CYS N 1 1 2 617 1 1 9 CYS O O -5.096 0.371 -2.661 1.00 . A A . 9 CYS O 1 1 2 618 1 1 9 CYS SG S -2.064 -0.927 -0.296 1.00 . A A . 9 CYS SG 1 1 2 619 1 1 10 ILE C C -6.853 -1.202 -0.886 1.00 . A A . 10 ILE C 1 1 2 620 1 1 10 ILE CA C -6.449 -1.999 -2.126 1.00 . A A . 10 ILE CA 1 1 2 621 1 1 10 ILE CB C -6.860 -3.486 -1.942 1.00 . A A . 10 ILE CB 1 1 2 622 1 1 10 ILE CD1 C -5.227 -4.680 -3.517 1.00 . A A . 10 ILE CD1 1 1 2 623 1 1 10 ILE CG1 C -6.663 -4.281 -3.241 1.00 . A A . 10 ILE CG1 1 1 2 624 1 1 10 ILE CG2 C -8.308 -3.594 -1.481 1.00 . A A . 10 ILE CG2 1 1 2 625 1 1 10 ILE H H -4.467 -2.667 -2.442 1.00 . A A . 10 ILE H 1 1 2 626 1 1 10 ILE HA H -6.987 -1.607 -2.978 1.00 . A A . 10 ILE HA 1 1 2 627 1 1 10 ILE HB H -6.234 -3.912 -1.172 1.00 . A A . 10 ILE HB 1 1 2 628 1 1 10 ILE HD11 H -4.892 -4.209 -4.430 1.00 . A A . 10 ILE HD11 1 1 2 629 1 1 10 ILE HD12 H -5.165 -5.753 -3.623 1.00 . A A . 10 ILE HD12 1 1 2 630 1 1 10 ILE HD13 H -4.601 -4.363 -2.697 1.00 . A A . 10 ILE HD13 1 1 2 631 1 1 10 ILE HG12 H -7.249 -5.185 -3.191 1.00 . A A . 10 ILE HG12 1 1 2 632 1 1 10 ILE HG13 H -7.006 -3.684 -4.073 1.00 . A A . 10 ILE HG13 1 1 2 633 1 1 10 ILE HG21 H -8.811 -4.360 -2.053 1.00 . A A . 10 ILE HG21 1 1 2 634 1 1 10 ILE HG22 H -8.806 -2.647 -1.632 1.00 . A A . 10 ILE HG22 1 1 2 635 1 1 10 ILE HG23 H -8.334 -3.853 -0.434 1.00 . A A . 10 ILE HG23 1 1 2 636 1 1 10 ILE N N -5.023 -1.863 -2.405 1.00 . A A . 10 ILE N 1 1 2 637 1 1 10 ILE O O -7.868 -0.506 -0.888 1.00 . A A . 10 ILE O 1 1 2 638 1 1 11 VAL C C -5.727 0.803 1.391 1.00 . A A . 11 VAL C 1 1 2 639 1 1 11 VAL CA C -6.350 -0.595 1.398 1.00 . A A . 11 VAL CA 1 1 2 640 1 1 11 VAL CB C -5.869 -1.388 2.636 1.00 . A A . 11 VAL CB 1 1 2 641 1 1 11 VAL CG1 C -4.361 -1.592 2.612 1.00 . A A . 11 VAL CG1 1 1 2 642 1 1 11 VAL CG2 C -6.304 -0.696 3.919 1.00 . A A . 11 VAL CG2 1 1 2 643 1 1 11 VAL H H -5.261 -1.869 0.113 1.00 . A A . 11 VAL H 1 1 2 644 1 1 11 VAL HA H -7.423 -0.490 1.465 1.00 . A A . 11 VAL HA 1 1 2 645 1 1 11 VAL HB H -6.335 -2.363 2.608 1.00 . A A . 11 VAL HB 1 1 2 646 1 1 11 VAL HG11 H -3.906 -0.843 1.981 1.00 . A A . 11 VAL HG11 1 1 2 647 1 1 11 VAL HG12 H -4.136 -2.574 2.222 1.00 . A A . 11 VAL HG12 1 1 2 648 1 1 11 VAL HG13 H -3.969 -1.505 3.614 1.00 . A A . 11 VAL HG13 1 1 2 649 1 1 11 VAL HG21 H -6.077 0.358 3.855 1.00 . A A . 11 VAL HG21 1 1 2 650 1 1 11 VAL HG22 H -5.776 -1.128 4.757 1.00 . A A . 11 VAL HG22 1 1 2 651 1 1 11 VAL HG23 H -7.367 -0.828 4.057 1.00 . A A . 11 VAL HG23 1 1 2 652 1 1 11 VAL N N -6.058 -1.307 0.166 1.00 . A A . 11 VAL N 1 1 2 653 1 1 11 VAL O O -4.535 0.969 1.126 1.00 . A A . 11 VAL O 1 1 2 654 1 1 12 PRO C C -5.469 3.588 3.059 1.00 . A A . 12 PRO C 1 1 2 655 1 1 12 PRO CA C -6.073 3.211 1.710 1.00 . A A . 12 PRO CA 1 1 2 656 1 1 12 PRO CB C -7.360 3.993 1.456 1.00 . A A . 12 PRO CB 1 1 2 657 1 1 12 PRO CD C -7.975 1.727 1.988 1.00 . A A . 12 PRO CD 1 1 2 658 1 1 12 PRO CG C -8.436 3.162 2.070 1.00 . A A . 12 PRO CG 1 1 2 659 1 1 12 PRO HA H -5.362 3.421 0.929 1.00 . A A . 12 PRO HA 1 1 2 660 1 1 12 PRO HB2 H -7.292 4.964 1.926 1.00 . A A . 12 PRO HB2 1 1 2 661 1 1 12 PRO HB3 H -7.511 4.110 0.394 1.00 . A A . 12 PRO HB3 1 1 2 662 1 1 12 PRO HD2 H -8.127 1.229 2.934 1.00 . A A . 12 PRO HD2 1 1 2 663 1 1 12 PRO HD3 H -8.501 1.207 1.201 1.00 . A A . 12 PRO HD3 1 1 2 664 1 1 12 PRO HG2 H -8.576 3.450 3.102 1.00 . A A . 12 PRO HG2 1 1 2 665 1 1 12 PRO HG3 H -9.355 3.290 1.519 1.00 . A A . 12 PRO HG3 1 1 2 666 1 1 12 PRO N N -6.536 1.831 1.678 1.00 . A A . 12 PRO N 1 1 2 667 1 1 12 PRO O O -4.884 2.744 3.761 1.00 . A A . 12 PRO O 1 1 2 668 1 1 13 ILE C C -5.839 4.740 5.847 1.00 . A A . 13 ILE C 1 1 2 669 1 1 13 ILE CA C -5.138 5.408 4.668 1.00 . A A . 13 ILE CA 1 1 2 670 1 1 13 ILE CB C -5.338 6.940 4.739 1.00 . A A . 13 ILE CB 1 1 2 671 1 1 13 ILE CD1 C -5.026 9.097 3.410 1.00 . A A . 13 ILE CD1 1 1 2 672 1 1 13 ILE CG1 C -4.779 7.604 3.476 1.00 . A A . 13 ILE CG1 1 1 2 673 1 1 13 ILE CG2 C -4.661 7.508 5.982 1.00 . A A . 13 ILE CG2 1 1 2 674 1 1 13 ILE H H -6.112 5.450 2.794 1.00 . A A . 13 ILE H 1 1 2 675 1 1 13 ILE HA H -4.079 5.199 4.727 1.00 . A A . 13 ILE HA 1 1 2 676 1 1 13 ILE HB H -6.395 7.141 4.808 1.00 . A A . 13 ILE HB 1 1 2 677 1 1 13 ILE HD11 H -5.742 9.377 4.169 1.00 . A A . 13 ILE HD11 1 1 2 678 1 1 13 ILE HD12 H -5.415 9.355 2.437 1.00 . A A . 13 ILE HD12 1 1 2 679 1 1 13 ILE HD13 H -4.098 9.623 3.579 1.00 . A A . 13 ILE HD13 1 1 2 680 1 1 13 ILE HG12 H -3.712 7.445 3.436 1.00 . A A . 13 ILE HG12 1 1 2 681 1 1 13 ILE HG13 H -5.238 7.153 2.607 1.00 . A A . 13 ILE HG13 1 1 2 682 1 1 13 ILE HG21 H -5.390 8.036 6.578 1.00 . A A . 13 ILE HG21 1 1 2 683 1 1 13 ILE HG22 H -3.878 8.190 5.685 1.00 . A A . 13 ILE HG22 1 1 2 684 1 1 13 ILE HG23 H -4.237 6.701 6.561 1.00 . A A . 13 ILE HG23 1 1 2 685 1 1 13 ILE N N -5.633 4.861 3.409 1.00 . A A . 13 ILE N 1 1 2 686 1 1 13 ILE O O -6.805 5.260 6.405 1.00 . A A . 13 ILE O 1 1 2 687 1 1 14 LEU C C -4.895 1.595 7.447 1.00 . A A . 14 LEU C 1 1 2 688 1 1 14 LEU CA C -5.866 2.745 7.251 1.00 . A A . 14 LEU CA 1 1 2 689 1 1 14 LEU CB C -7.273 2.225 6.891 1.00 . A A . 14 LEU CB 1 1 2 690 1 1 14 LEU CD1 C -7.673 0.367 8.560 1.00 . A A . 14 LEU CD1 1 1 2 691 1 1 14 LEU CD2 C -8.140 2.741 9.196 1.00 . A A . 14 LEU CD2 1 1 2 692 1 1 14 LEU CG C -8.140 1.727 8.060 1.00 . A A . 14 LEU CG 1 1 2 693 1 1 14 LEU H H -4.585 3.222 5.661 1.00 . A A . 14 LEU H 1 1 2 694 1 1 14 LEU HA H -5.912 3.339 8.152 1.00 . A A . 14 LEU HA 1 1 2 695 1 1 14 LEU HB2 H -7.806 3.024 6.397 1.00 . A A . 14 LEU HB2 1 1 2 696 1 1 14 LEU HB3 H -7.158 1.412 6.190 1.00 . A A . 14 LEU HB3 1 1 2 697 1 1 14 LEU HD11 H -6.593 0.345 8.585 1.00 . A A . 14 LEU HD11 1 1 2 698 1 1 14 LEU HD12 H -8.035 -0.405 7.897 1.00 . A A . 14 LEU HD12 1 1 2 699 1 1 14 LEU HD13 H -8.060 0.197 9.554 1.00 . A A . 14 LEU HD13 1 1 2 700 1 1 14 LEU HD21 H -8.890 3.493 9.006 1.00 . A A . 14 LEU HD21 1 1 2 701 1 1 14 LEU HD22 H -7.168 3.209 9.260 1.00 . A A . 14 LEU HD22 1 1 2 702 1 1 14 LEU HD23 H -8.360 2.239 10.126 1.00 . A A . 14 LEU HD23 1 1 2 703 1 1 14 LEU HG H -9.158 1.618 7.716 1.00 . A A . 14 LEU HG 1 1 2 704 1 1 14 LEU N N -5.343 3.566 6.180 1.00 . A A . 14 LEU N 1 1 2 705 1 1 14 LEU O O -4.588 1.202 8.570 1.00 . A A . 14 LEU O 1 1 2 706 1 1 15 GLY C C -4.063 -1.375 6.498 1.00 . A A . 15 GLY C 1 1 2 707 1 1 15 GLY CA C -3.423 -0.002 6.383 1.00 . A A . 15 GLY CA 1 1 2 708 1 1 15 GLY H H -4.653 1.462 5.454 1.00 . A A . 15 GLY H 1 1 2 709 1 1 15 GLY HA2 H -2.822 0.023 5.488 1.00 . A A . 15 GLY HA2 1 1 2 710 1 1 15 GLY HA3 H -2.780 0.152 7.238 1.00 . A A . 15 GLY HA3 1 1 2 711 1 1 15 GLY N N -4.386 1.084 6.326 1.00 . A A . 15 GLY N 1 1 2 712 1 1 15 GLY O O -5.120 -1.535 7.106 1.00 . A A . 15 GLY O 1 1 2 713 1 1 16 PHE C C -2.781 -4.617 5.283 1.00 . A A . 16 PHE C 1 1 2 714 1 1 16 PHE CA C -3.857 -3.751 5.921 1.00 . A A . 16 PHE CA 1 1 2 715 1 1 16 PHE CB C -5.181 -3.909 5.162 1.00 . A A . 16 PHE CB 1 1 2 716 1 1 16 PHE CD1 C -5.867 -6.014 6.352 1.00 . A A . 16 PHE CD1 1 1 2 717 1 1 16 PHE CD2 C -6.089 -5.926 3.978 1.00 . A A . 16 PHE CD2 1 1 2 718 1 1 16 PHE CE1 C -6.366 -7.303 6.354 1.00 . A A . 16 PHE CE1 1 1 2 719 1 1 16 PHE CE2 C -6.588 -7.215 3.975 1.00 . A A . 16 PHE CE2 1 1 2 720 1 1 16 PHE CG C -5.722 -5.312 5.165 1.00 . A A . 16 PHE CG 1 1 2 721 1 1 16 PHE CZ C -6.727 -7.904 5.164 1.00 . A A . 16 PHE CZ 1 1 2 722 1 1 16 PHE H H -2.561 -2.154 5.450 1.00 . A A . 16 PHE H 1 1 2 723 1 1 16 PHE HA H -3.991 -4.052 6.949 1.00 . A A . 16 PHE HA 1 1 2 724 1 1 16 PHE HB2 H -5.923 -3.269 5.614 1.00 . A A . 16 PHE HB2 1 1 2 725 1 1 16 PHE HB3 H -5.035 -3.611 4.134 1.00 . A A . 16 PHE HB3 1 1 2 726 1 1 16 PHE HD1 H -5.585 -5.545 7.283 1.00 . A A . 16 PHE HD1 1 1 2 727 1 1 16 PHE HD2 H -5.979 -5.390 3.048 1.00 . A A . 16 PHE HD2 1 1 2 728 1 1 16 PHE HE1 H -6.474 -7.839 7.285 1.00 . A A . 16 PHE HE1 1 1 2 729 1 1 16 PHE HE2 H -6.871 -7.682 3.043 1.00 . A A . 16 PHE HE2 1 1 2 730 1 1 16 PHE HZ H -7.117 -8.911 5.163 1.00 . A A . 16 PHE HZ 1 1 2 731 1 1 16 PHE N N -3.401 -2.363 5.907 1.00 . A A . 16 PHE N 1 1 2 732 1 1 16 PHE O O -2.328 -5.600 5.863 1.00 . A A . 16 PHE O 1 1 2 733 1 1 17 VAL C C 0.037 -4.274 3.774 1.00 . A A . 17 VAL C 1 1 2 734 1 1 17 VAL CA C -1.293 -4.908 3.384 1.00 . A A . 17 VAL CA 1 1 2 735 1 1 17 VAL CB C -1.481 -4.837 1.848 1.00 . A A . 17 VAL CB 1 1 2 736 1 1 17 VAL CG1 C -0.800 -6.012 1.157 1.00 . A A . 17 VAL CG1 1 1 2 737 1 1 17 VAL CG2 C -2.957 -4.787 1.480 1.00 . A A . 17 VAL CG2 1 1 2 738 1 1 17 VAL H H -2.731 -3.399 3.705 1.00 . A A . 17 VAL H 1 1 2 739 1 1 17 VAL HA H -1.294 -5.944 3.691 1.00 . A A . 17 VAL HA 1 1 2 740 1 1 17 VAL HB H -1.013 -3.931 1.495 1.00 . A A . 17 VAL HB 1 1 2 741 1 1 17 VAL HG11 H -1.545 -6.625 0.669 1.00 . A A . 17 VAL HG11 1 1 2 742 1 1 17 VAL HG12 H -0.272 -6.604 1.890 1.00 . A A . 17 VAL HG12 1 1 2 743 1 1 17 VAL HG13 H -0.101 -5.643 0.421 1.00 . A A . 17 VAL HG13 1 1 2 744 1 1 17 VAL HG21 H -3.546 -4.635 2.373 1.00 . A A . 17 VAL HG21 1 1 2 745 1 1 17 VAL HG22 H -3.245 -5.718 1.013 1.00 . A A . 17 VAL HG22 1 1 2 746 1 1 17 VAL HG23 H -3.130 -3.972 0.792 1.00 . A A . 17 VAL HG23 1 1 2 747 1 1 17 VAL N N -2.350 -4.209 4.097 1.00 . A A . 17 VAL N 1 1 2 748 1 1 17 VAL O O 0.083 -3.433 4.676 1.00 . A A . 17 VAL O 1 1 2 749 1 1 18 TYR C C 3.293 -4.040 2.167 1.00 . A A . 18 TYR C 1 1 2 750 1 1 18 TYR CA C 2.411 -4.087 3.405 1.00 . A A . 18 TYR CA 1 1 2 751 1 1 18 TYR CB C 3.101 -4.901 4.508 1.00 . A A . 18 TYR CB 1 1 2 752 1 1 18 TYR CD1 C 4.692 -3.044 5.170 1.00 . A A . 18 TYR CD1 1 1 2 753 1 1 18 TYR CD2 C 5.569 -5.250 4.934 1.00 . A A . 18 TYR CD2 1 1 2 754 1 1 18 TYR CE1 C 5.949 -2.575 5.502 1.00 . A A . 18 TYR CE1 1 1 2 755 1 1 18 TYR CE2 C 6.830 -4.787 5.267 1.00 . A A . 18 TYR CE2 1 1 2 756 1 1 18 TYR CG C 4.479 -4.388 4.880 1.00 . A A . 18 TYR CG 1 1 2 757 1 1 18 TYR CZ C 7.014 -3.450 5.549 1.00 . A A . 18 TYR CZ 1 1 2 758 1 1 18 TYR H H 1.018 -5.310 2.386 1.00 . A A . 18 TYR H 1 1 2 759 1 1 18 TYR HA H 2.261 -3.079 3.760 1.00 . A A . 18 TYR HA 1 1 2 760 1 1 18 TYR HB2 H 2.490 -4.878 5.398 1.00 . A A . 18 TYR HB2 1 1 2 761 1 1 18 TYR HB3 H 3.206 -5.925 4.177 1.00 . A A . 18 TYR HB3 1 1 2 762 1 1 18 TYR HD1 H 3.856 -2.362 5.134 1.00 . A A . 18 TYR HD1 1 1 2 763 1 1 18 TYR HD2 H 5.422 -6.296 4.713 1.00 . A A . 18 TYR HD2 1 1 2 764 1 1 18 TYR HE1 H 6.092 -1.528 5.724 1.00 . A A . 18 TYR HE1 1 1 2 765 1 1 18 TYR HE2 H 7.663 -5.473 5.303 1.00 . A A . 18 TYR HE2 1 1 2 766 1 1 18 TYR HH H 8.365 -2.976 6.834 1.00 . A A . 18 TYR HH 1 1 2 767 1 1 18 TYR N N 1.107 -4.648 3.103 1.00 . A A . 18 TYR N 1 1 2 768 1 1 18 TYR O O 3.511 -5.052 1.497 1.00 . A A . 18 TYR O 1 1 2 769 1 1 18 TYR OH O 8.269 -2.986 5.879 1.00 . A A . 18 TYR OH 1 1 2 770 1 1 19 CYS C C 6.087 -3.166 1.086 1.00 . A A . 19 CYS C 1 1 2 771 1 1 19 CYS CA C 4.701 -2.644 0.762 1.00 . A A . 19 CYS CA 1 1 2 772 1 1 19 CYS CB C 4.795 -1.158 0.470 1.00 . A A . 19 CYS CB 1 1 2 773 1 1 19 CYS H H 3.603 -2.096 2.475 1.00 . A A . 19 CYS H 1 1 2 774 1 1 19 CYS HA H 4.306 -3.160 -0.098 1.00 . A A . 19 CYS HA 1 1 2 775 1 1 19 CYS HB2 H 4.948 -0.653 1.405 1.00 . A A . 19 CYS HB2 1 1 2 776 1 1 19 CYS HB3 H 5.645 -0.963 -0.176 1.00 . A A . 19 CYS HB3 1 1 2 777 1 1 19 CYS N N 3.811 -2.856 1.889 1.00 . A A . 19 CYS N 1 1 2 778 1 1 19 CYS O O 6.336 -3.637 2.196 1.00 . A A . 19 CYS O 1 1 2 779 1 1 19 CYS SG S 3.306 -0.446 -0.295 1.00 . A A . 19 CYS SG 1 1 2 780 1 1 20 CYS C C 8.998 -2.577 1.370 1.00 . A A . 20 CYS C 1 1 2 781 1 1 20 CYS CA C 8.360 -3.507 0.358 1.00 . A A . 20 CYS CA 1 1 2 782 1 1 20 CYS CB C 9.150 -3.510 -0.945 1.00 . A A . 20 CYS CB 1 1 2 783 1 1 20 CYS H H 6.754 -2.666 -0.732 1.00 . A A . 20 CYS H 1 1 2 784 1 1 20 CYS HA H 8.327 -4.511 0.764 1.00 . A A . 20 CYS HA 1 1 2 785 1 1 20 CYS HB2 H 9.341 -2.490 -1.233 1.00 . A A . 20 CYS HB2 1 1 2 786 1 1 20 CYS HB3 H 10.090 -4.014 -0.783 1.00 . A A . 20 CYS HB3 1 1 2 787 1 1 20 CYS N N 6.997 -3.065 0.132 1.00 . A A . 20 CYS N 1 1 2 788 1 1 20 CYS O O 8.579 -1.423 1.485 1.00 . A A . 20 CYS O 1 1 2 789 1 1 20 CYS SG S 8.294 -4.347 -2.327 1.00 . A A . 20 CYS SG 1 1 2 790 1 1 21 PRO C C 11.080 -0.893 2.611 1.00 . A A . 21 PRO C 1 1 2 791 1 1 21 PRO CA C 10.634 -2.235 3.152 1.00 . A A . 21 PRO CA 1 1 2 792 1 1 21 PRO CB C 11.822 -3.070 3.590 1.00 . A A . 21 PRO CB 1 1 2 793 1 1 21 PRO CD C 10.536 -4.416 2.092 1.00 . A A . 21 PRO CD 1 1 2 794 1 1 21 PRO CG C 11.402 -4.476 3.325 1.00 . A A . 21 PRO CG 1 1 2 795 1 1 21 PRO HA H 9.979 -2.073 3.996 1.00 . A A . 21 PRO HA 1 1 2 796 1 1 21 PRO HB2 H 12.695 -2.794 3.014 1.00 . A A . 21 PRO HB2 1 1 2 797 1 1 21 PRO HB3 H 12.000 -2.895 4.637 1.00 . A A . 21 PRO HB3 1 1 2 798 1 1 21 PRO HD2 H 11.133 -4.561 1.204 1.00 . A A . 21 PRO HD2 1 1 2 799 1 1 21 PRO HD3 H 9.747 -5.148 2.140 1.00 . A A . 21 PRO HD3 1 1 2 800 1 1 21 PRO HG2 H 12.271 -5.092 3.145 1.00 . A A . 21 PRO HG2 1 1 2 801 1 1 21 PRO HG3 H 10.837 -4.856 4.162 1.00 . A A . 21 PRO HG3 1 1 2 802 1 1 21 PRO N N 9.987 -3.053 2.136 1.00 . A A . 21 PRO N 1 1 2 803 1 1 21 PRO O O 11.964 -0.798 1.759 1.00 . A A . 21 PRO O 1 1 2 804 1 1 22 GLY C C 9.480 2.175 2.125 1.00 . A A . 22 GLY C 1 1 2 805 1 1 22 GLY CA C 10.707 1.481 2.687 1.00 . A A . 22 GLY CA 1 1 2 806 1 1 22 GLY H H 9.728 -0.046 3.765 1.00 . A A . 22 GLY H 1 1 2 807 1 1 22 GLY HA2 H 11.069 2.043 3.534 1.00 . A A . 22 GLY HA2 1 1 2 808 1 1 22 GLY HA3 H 11.474 1.459 1.926 1.00 . A A . 22 GLY HA3 1 1 2 809 1 1 22 GLY N N 10.427 0.130 3.108 1.00 . A A . 22 GLY N 1 1 2 810 1 1 22 GLY O O 9.363 3.395 2.215 1.00 . A A . 22 GLY O 1 1 2 811 1 1 23 LEU C C 6.153 1.670 1.841 1.00 . A A . 23 LEU C 1 1 2 812 1 1 23 LEU CA C 7.362 1.955 0.952 1.00 . A A . 23 LEU CA 1 1 2 813 1 1 23 LEU CB C 7.155 1.353 -0.437 1.00 . A A . 23 LEU CB 1 1 2 814 1 1 23 LEU CD1 C 8.133 0.620 -2.626 1.00 . A A . 23 LEU CD1 1 1 2 815 1 1 23 LEU CD2 C 8.665 2.889 -1.723 1.00 . A A . 23 LEU CD2 1 1 2 816 1 1 23 LEU CG C 8.367 1.440 -1.368 1.00 . A A . 23 LEU CG 1 1 2 817 1 1 23 LEU H H 8.711 0.428 1.489 1.00 . A A . 23 LEU H 1 1 2 818 1 1 23 LEU HA H 7.490 3.023 0.862 1.00 . A A . 23 LEU HA 1 1 2 819 1 1 23 LEU HB2 H 6.892 0.312 -0.320 1.00 . A A . 23 LEU HB2 1 1 2 820 1 1 23 LEU HB3 H 6.329 1.864 -0.910 1.00 . A A . 23 LEU HB3 1 1 2 821 1 1 23 LEU HD11 H 7.071 0.502 -2.786 1.00 . A A . 23 LEU HD11 1 1 2 822 1 1 23 LEU HD12 H 8.590 -0.351 -2.513 1.00 . A A . 23 LEU HD12 1 1 2 823 1 1 23 LEU HD13 H 8.570 1.128 -3.473 1.00 . A A . 23 LEU HD13 1 1 2 824 1 1 23 LEU HD21 H 8.503 3.513 -0.856 1.00 . A A . 23 LEU HD21 1 1 2 825 1 1 23 LEU HD22 H 8.011 3.206 -2.521 1.00 . A A . 23 LEU HD22 1 1 2 826 1 1 23 LEU HD23 H 9.692 2.977 -2.043 1.00 . A A . 23 LEU HD23 1 1 2 827 1 1 23 LEU HG H 9.231 1.034 -0.862 1.00 . A A . 23 LEU HG 1 1 2 828 1 1 23 LEU N N 8.570 1.402 1.538 1.00 . A A . 23 LEU N 1 1 2 829 1 1 23 LEU O O 6.108 0.644 2.528 1.00 . A A . 23 LEU O 1 1 2 830 1 1 24 ILE C C 2.708 2.788 1.849 1.00 . A A . 24 ILE C 1 1 2 831 1 1 24 ILE CA C 3.967 2.404 2.634 1.00 . A A . 24 ILE CA 1 1 2 832 1 1 24 ILE CB C 4.022 3.242 3.934 1.00 . A A . 24 ILE CB 1 1 2 833 1 1 24 ILE CD1 C 4.389 5.603 4.836 1.00 . A A . 24 ILE CD1 1 1 2 834 1 1 24 ILE CG1 C 4.413 4.693 3.626 1.00 . A A . 24 ILE CG1 1 1 2 835 1 1 24 ILE CG2 C 4.990 2.620 4.932 1.00 . A A . 24 ILE CG2 1 1 2 836 1 1 24 ILE H H 5.271 3.373 1.256 1.00 . A A . 24 ILE H 1 1 2 837 1 1 24 ILE HA H 3.897 1.361 2.909 1.00 . A A . 24 ILE HA 1 1 2 838 1 1 24 ILE HB H 3.038 3.232 4.378 1.00 . A A . 24 ILE HB 1 1 2 839 1 1 24 ILE HD11 H 5.243 6.262 4.808 1.00 . A A . 24 ILE HD11 1 1 2 840 1 1 24 ILE HD12 H 4.423 5.006 5.736 1.00 . A A . 24 ILE HD12 1 1 2 841 1 1 24 ILE HD13 H 3.481 6.189 4.827 1.00 . A A . 24 ILE HD13 1 1 2 842 1 1 24 ILE HG12 H 5.413 4.711 3.221 1.00 . A A . 24 ILE HG12 1 1 2 843 1 1 24 ILE HG13 H 3.727 5.095 2.894 1.00 . A A . 24 ILE HG13 1 1 2 844 1 1 24 ILE HG21 H 5.656 1.945 4.415 1.00 . A A . 24 ILE HG21 1 1 2 845 1 1 24 ILE HG22 H 4.434 2.076 5.681 1.00 . A A . 24 ILE HG22 1 1 2 846 1 1 24 ILE HG23 H 5.566 3.400 5.408 1.00 . A A . 24 ILE HG23 1 1 2 847 1 1 24 ILE N N 5.176 2.570 1.828 1.00 . A A . 24 ILE N 1 1 2 848 1 1 24 ILE O O 2.681 3.808 1.160 1.00 . A A . 24 ILE O 1 1 2 849 1 1 25 CYS C C -0.244 3.513 1.731 1.00 . A A . 25 CYS C 1 1 2 850 1 1 25 CYS CA C 0.402 2.209 1.259 1.00 . A A . 25 CYS CA 1 1 2 851 1 1 25 CYS CB C -0.581 1.052 1.470 1.00 . A A . 25 CYS CB 1 1 2 852 1 1 25 CYS H H 1.758 1.154 2.511 1.00 . A A . 25 CYS H 1 1 2 853 1 1 25 CYS HA H 0.619 2.294 0.205 1.00 . A A . 25 CYS HA 1 1 2 854 1 1 25 CYS HB2 H -0.553 0.753 2.507 1.00 . A A . 25 CYS HB2 1 1 2 855 1 1 25 CYS HB3 H -1.578 1.391 1.228 1.00 . A A . 25 CYS HB3 1 1 2 856 1 1 25 CYS N N 1.670 1.957 1.955 1.00 . A A . 25 CYS N 1 1 2 857 1 1 25 CYS O O -0.138 3.886 2.900 1.00 . A A . 25 CYS O 1 1 2 858 1 1 25 CYS SG S -0.242 -0.430 0.463 1.00 . A A . 25 CYS SG 1 1 2 859 1 1 26 GLY C C -2.808 5.697 0.290 1.00 . A A . 26 GLY C 1 1 2 860 1 1 26 GLY CA C -1.566 5.450 1.134 1.00 . A A . 26 GLY CA 1 1 2 861 1 1 26 GLY H H -0.960 3.847 -0.105 1.00 . A A . 26 GLY H 1 1 2 862 1 1 26 GLY HA2 H -1.851 5.436 2.175 1.00 . A A . 26 GLY HA2 1 1 2 863 1 1 26 GLY HA3 H -0.868 6.259 0.973 1.00 . A A . 26 GLY HA3 1 1 2 864 1 1 26 GLY N N -0.914 4.199 0.811 1.00 . A A . 26 GLY N 1 1 2 865 1 1 26 GLY O O -3.819 5.018 0.458 1.00 . A A . 26 GLY O 1 1 2 866 1 1 27 PRO C C -4.187 6.010 -2.588 1.00 . A A . 27 PRO C 1 1 2 867 1 1 27 PRO CA C -3.904 7.041 -1.490 1.00 . A A . 27 PRO CA 1 1 2 868 1 1 27 PRO CB C -3.480 8.378 -2.099 1.00 . A A . 27 PRO CB 1 1 2 869 1 1 27 PRO CD C -1.597 7.557 -0.868 1.00 . A A . 27 PRO CD 1 1 2 870 1 1 27 PRO CG C -1.991 8.346 -2.086 1.00 . A A . 27 PRO CG 1 1 2 871 1 1 27 PRO HA H -4.802 7.181 -0.908 1.00 . A A . 27 PRO HA 1 1 2 872 1 1 27 PRO HB2 H -3.865 8.457 -3.105 1.00 . A A . 27 PRO HB2 1 1 2 873 1 1 27 PRO HB3 H -3.861 9.189 -1.497 1.00 . A A . 27 PRO HB3 1 1 2 874 1 1 27 PRO HD2 H -0.715 6.968 -1.069 1.00 . A A . 27 PRO HD2 1 1 2 875 1 1 27 PRO HD3 H -1.428 8.217 -0.030 1.00 . A A . 27 PRO HD3 1 1 2 876 1 1 27 PRO HG2 H -1.626 7.861 -2.980 1.00 . A A . 27 PRO HG2 1 1 2 877 1 1 27 PRO HG3 H -1.603 9.352 -2.021 1.00 . A A . 27 PRO HG3 1 1 2 878 1 1 27 PRO N N -2.765 6.686 -0.622 1.00 . A A . 27 PRO N 1 1 2 879 1 1 27 PRO O O -4.069 6.306 -3.775 1.00 . A A . 27 PRO O 1 1 2 880 1 1 28 PHE C C -3.633 3.271 -3.870 1.00 . A A . 28 PHE C 1 1 2 881 1 1 28 PHE CA C -4.866 3.690 -3.072 1.00 . A A . 28 PHE CA 1 1 2 882 1 1 28 PHE CB C -6.049 4.022 -4.012 1.00 . A A . 28 PHE CB 1 1 2 883 1 1 28 PHE CD1 C -7.629 5.032 -2.330 1.00 . A A . 28 PHE CD1 1 1 2 884 1 1 28 PHE CD2 C -8.388 3.190 -3.641 1.00 . A A . 28 PHE CD2 1 1 2 885 1 1 28 PHE CE1 C -8.853 5.086 -1.691 1.00 . A A . 28 PHE CE1 1 1 2 886 1 1 28 PHE CE2 C -9.613 3.239 -3.004 1.00 . A A . 28 PHE CE2 1 1 2 887 1 1 28 PHE CG C -7.381 4.086 -3.313 1.00 . A A . 28 PHE CG 1 1 2 888 1 1 28 PHE CZ C -9.846 4.188 -2.028 1.00 . A A . 28 PHE CZ 1 1 2 889 1 1 28 PHE H H -4.615 4.651 -1.199 1.00 . A A . 28 PHE H 1 1 2 890 1 1 28 PHE HA H -5.153 2.854 -2.449 1.00 . A A . 28 PHE HA 1 1 2 891 1 1 28 PHE HB2 H -5.882 4.981 -4.482 1.00 . A A . 28 PHE HB2 1 1 2 892 1 1 28 PHE HB3 H -6.117 3.261 -4.779 1.00 . A A . 28 PHE HB3 1 1 2 893 1 1 28 PHE HD1 H -6.853 5.736 -2.067 1.00 . A A . 28 PHE HD1 1 1 2 894 1 1 28 PHE HD2 H -8.207 2.448 -4.404 1.00 . A A . 28 PHE HD2 1 1 2 895 1 1 28 PHE HE1 H -9.032 5.828 -0.927 1.00 . A A . 28 PHE HE1 1 1 2 896 1 1 28 PHE HE2 H -10.387 2.535 -3.269 1.00 . A A . 28 PHE HE2 1 1 2 897 1 1 28 PHE HZ H -10.803 4.228 -1.529 1.00 . A A . 28 PHE HZ 1 1 2 898 1 1 28 PHE N N -4.555 4.804 -2.166 1.00 . A A . 28 PHE N 1 1 2 899 1 1 28 PHE O O -3.733 2.603 -4.895 1.00 . A A . 28 PHE O 1 1 2 900 1 1 29 VAL C C -0.178 3.192 -2.829 1.00 . A A . 29 VAL C 1 1 2 901 1 1 29 VAL CA C -1.185 3.279 -3.953 1.00 . A A . 29 VAL CA 1 1 2 902 1 1 29 VAL CB C -0.688 4.314 -5.010 1.00 . A A . 29 VAL CB 1 1 2 903 1 1 29 VAL CG1 C -1.563 4.300 -6.254 1.00 . A A . 29 VAL CG1 1 1 2 904 1 1 29 VAL CG2 C -0.633 5.715 -4.415 1.00 . A A . 29 VAL CG2 1 1 2 905 1 1 29 VAL H H -2.455 4.127 -2.501 1.00 . A A . 29 VAL H 1 1 2 906 1 1 29 VAL HA H -1.277 2.310 -4.424 1.00 . A A . 29 VAL HA 1 1 2 907 1 1 29 VAL HB H 0.321 4.038 -5.316 1.00 . A A . 29 VAL HB 1 1 2 908 1 1 29 VAL HG11 H -2.360 3.582 -6.125 1.00 . A A . 29 VAL HG11 1 1 2 909 1 1 29 VAL HG12 H -0.967 4.025 -7.112 1.00 . A A . 29 VAL HG12 1 1 2 910 1 1 29 VAL HG13 H -1.985 5.282 -6.409 1.00 . A A . 29 VAL HG13 1 1 2 911 1 1 29 VAL HG21 H -1.596 6.191 -4.529 1.00 . A A . 29 VAL HG21 1 1 2 912 1 1 29 VAL HG22 H 0.118 6.295 -4.928 1.00 . A A . 29 VAL HG22 1 1 2 913 1 1 29 VAL HG23 H -0.385 5.650 -3.366 1.00 . A A . 29 VAL HG23 1 1 2 914 1 1 29 VAL N N -2.465 3.630 -3.352 1.00 . A A . 29 VAL N 1 1 2 915 1 1 29 VAL O O -0.560 3.151 -1.661 1.00 . A A . 29 VAL O 1 1 2 916 1 1 30 CYS C C 3.063 4.323 -2.366 1.00 . A A . 30 CYS C 1 1 2 917 1 1 30 CYS CA C 2.127 3.135 -2.164 1.00 . A A . 30 CYS CA 1 1 2 918 1 1 30 CYS CB C 2.885 1.811 -2.278 1.00 . A A . 30 CYS CB 1 1 2 919 1 1 30 CYS H H 1.332 3.236 -4.112 1.00 . A A . 30 CYS H 1 1 2 920 1 1 30 CYS HA H 1.667 3.205 -1.189 1.00 . A A . 30 CYS HA 1 1 2 921 1 1 30 CYS HB2 H 2.178 1.007 -2.421 1.00 . A A . 30 CYS HB2 1 1 2 922 1 1 30 CYS HB3 H 3.540 1.859 -3.136 1.00 . A A . 30 CYS HB3 1 1 2 923 1 1 30 CYS N N 1.082 3.190 -3.163 1.00 . A A . 30 CYS N 1 1 2 924 1 1 30 CYS O O 3.137 4.883 -3.461 1.00 . A A . 30 CYS O 1 1 2 925 1 1 30 CYS SG S 3.904 1.414 -0.831 1.00 . A A . 30 CYS SG 1 1 2 926 1 1 31 VAL C C 5.959 5.563 -0.676 1.00 . A A . 31 VAL C 1 1 2 927 1 1 31 VAL CA C 4.676 5.854 -1.432 1.00 . A A . 31 VAL CA 1 1 2 928 1 1 31 VAL CB C 4.056 7.170 -0.897 1.00 . A A . 31 VAL CB 1 1 2 929 1 1 31 VAL CG1 C 2.912 7.638 -1.785 1.00 . A A . 31 VAL CG1 1 1 2 930 1 1 31 VAL CG2 C 3.583 7.002 0.540 1.00 . A A . 31 VAL CG2 1 1 2 931 1 1 31 VAL H H 3.673 4.263 -0.462 1.00 . A A . 31 VAL H 1 1 2 932 1 1 31 VAL HA H 4.912 5.987 -2.485 1.00 . A A . 31 VAL HA 1 1 2 933 1 1 31 VAL HB H 4.823 7.931 -0.912 1.00 . A A . 31 VAL HB 1 1 2 934 1 1 31 VAL HG11 H 1.972 7.454 -1.286 1.00 . A A . 31 VAL HG11 1 1 2 935 1 1 31 VAL HG12 H 2.937 7.096 -2.719 1.00 . A A . 31 VAL HG12 1 1 2 936 1 1 31 VAL HG13 H 3.016 8.695 -1.979 1.00 . A A . 31 VAL HG13 1 1 2 937 1 1 31 VAL HG21 H 3.799 7.902 1.097 1.00 . A A . 31 VAL HG21 1 1 2 938 1 1 31 VAL HG22 H 4.096 6.167 0.993 1.00 . A A . 31 VAL HG22 1 1 2 939 1 1 31 VAL HG23 H 2.518 6.819 0.550 1.00 . A A . 31 VAL HG23 1 1 2 940 1 1 31 VAL N N 3.764 4.728 -1.326 1.00 . A A . 31 VAL N 1 1 2 941 1 1 31 VAL O O 5.944 4.650 0.171 1.00 . A A . 31 VAL O 1 1 2 942 1 1 31 VAL OXT O 6.974 6.240 -0.957 1.00 . A A . 31 VAL OXT 1 1 3 943 1 1 1 ALA C C 5.031 -8.706 -0.385 1.00 . A A . 1 ALA C 1 1 3 944 1 1 1 ALA CA C 5.267 -10.193 -0.580 1.00 . A A . 1 ALA CA 1 1 3 945 1 1 1 ALA CB C 4.124 -10.814 -1.370 1.00 . A A . 1 ALA CB 1 1 3 946 1 1 1 ALA H1 H 5.325 -10.157 1.504 1.00 . A A . 1 ALA H1 1 1 3 947 1 1 1 ALA H2 H 6.338 -11.320 0.808 1.00 . A A . 1 ALA H2 1 1 3 948 1 1 1 ALA H3 H 4.668 -11.577 0.858 1.00 . A A . 1 ALA H3 1 1 3 949 1 1 1 ALA HA H 6.182 -10.334 -1.138 1.00 . A A . 1 ALA HA 1 1 3 950 1 1 1 ALA HB1 H 4.009 -10.291 -2.308 1.00 . A A . 1 ALA HB1 1 1 3 951 1 1 1 ALA HB2 H 3.210 -10.737 -0.801 1.00 . A A . 1 ALA HB2 1 1 3 952 1 1 1 ALA HB3 H 4.342 -11.853 -1.562 1.00 . A A . 1 ALA HB3 1 1 3 953 1 1 1 ALA N N 5.410 -10.861 0.737 1.00 . A A . 1 ALA N 1 1 3 954 1 1 1 ALA O O 4.303 -8.311 0.520 1.00 . A A . 1 ALA O 1 1 3 955 1 1 2 CYS C C 5.054 -5.853 -2.443 1.00 . A A . 2 CYS C 1 1 3 956 1 1 2 CYS CA C 5.505 -6.444 -1.115 1.00 . A A . 2 CYS CA 1 1 3 957 1 1 2 CYS CB C 6.815 -5.821 -0.643 1.00 . A A . 2 CYS CB 1 1 3 958 1 1 2 CYS H H 6.227 -8.254 -1.923 1.00 . A A . 2 CYS H 1 1 3 959 1 1 2 CYS HA H 4.742 -6.228 -0.371 1.00 . A A . 2 CYS HA 1 1 3 960 1 1 2 CYS HB2 H 6.642 -4.778 -0.424 1.00 . A A . 2 CYS HB2 1 1 3 961 1 1 2 CYS HB3 H 7.130 -6.319 0.262 1.00 . A A . 2 CYS HB3 1 1 3 962 1 1 2 CYS N N 5.652 -7.886 -1.219 1.00 . A A . 2 CYS N 1 1 3 963 1 1 2 CYS O O 5.571 -6.209 -3.501 1.00 . A A . 2 CYS O 1 1 3 964 1 1 2 CYS SG S 8.201 -5.898 -1.821 1.00 . A A . 2 CYS SG 1 1 3 965 1 1 3 SER C C 4.378 -3.197 -4.052 1.00 . A A . 3 SER C 1 1 3 966 1 1 3 SER CA C 3.500 -4.346 -3.560 1.00 . A A . 3 SER CA 1 1 3 967 1 1 3 SER CB C 2.089 -3.843 -3.254 1.00 . A A . 3 SER CB 1 1 3 968 1 1 3 SER H H 3.675 -4.764 -1.501 1.00 . A A . 3 SER H 1 1 3 969 1 1 3 SER HA H 3.442 -5.094 -4.337 1.00 . A A . 3 SER HA 1 1 3 970 1 1 3 SER HB2 H 2.137 -3.086 -2.485 1.00 . A A . 3 SER HB2 1 1 3 971 1 1 3 SER HB3 H 1.656 -3.421 -4.150 1.00 . A A . 3 SER HB3 1 1 3 972 1 1 3 SER HG H 0.875 -5.345 -3.567 1.00 . A A . 3 SER HG 1 1 3 973 1 1 3 SER N N 4.060 -4.979 -2.376 1.00 . A A . 3 SER N 1 1 3 974 1 1 3 SER O O 5.060 -2.533 -3.264 1.00 . A A . 3 SER O 1 1 3 975 1 1 3 SER OG O 1.261 -4.903 -2.803 1.00 . A A . 3 SER OG 1 1 3 976 1 1 4 LYS C C 4.602 -0.532 -5.526 1.00 . A A . 4 LYS C 1 1 3 977 1 1 4 LYS CA C 5.112 -1.900 -5.992 1.00 . A A . 4 LYS CA 1 1 3 978 1 1 4 LYS CB C 5.022 -2.035 -7.519 1.00 . A A . 4 LYS CB 1 1 3 979 1 1 4 LYS CD C 5.624 -1.130 -9.803 1.00 . A A . 4 LYS CD 1 1 3 980 1 1 4 LYS CE C 4.224 -1.402 -10.348 1.00 . A A . 4 LYS CE 1 1 3 981 1 1 4 LYS CG C 5.628 -0.878 -8.297 1.00 . A A . 4 LYS CG 1 1 3 982 1 1 4 LYS H H 3.770 -3.535 -5.923 1.00 . A A . 4 LYS H 1 1 3 983 1 1 4 LYS HA H 6.143 -2.009 -5.689 1.00 . A A . 4 LYS HA 1 1 3 984 1 1 4 LYS HB2 H 5.531 -2.940 -7.814 1.00 . A A . 4 LYS HB2 1 1 3 985 1 1 4 LYS HB3 H 3.980 -2.118 -7.795 1.00 . A A . 4 LYS HB3 1 1 3 986 1 1 4 LYS HD2 H 6.024 -0.260 -10.301 1.00 . A A . 4 LYS HD2 1 1 3 987 1 1 4 LYS HD3 H 6.252 -1.983 -10.013 1.00 . A A . 4 LYS HD3 1 1 3 988 1 1 4 LYS HE2 H 3.507 -0.861 -9.748 1.00 . A A . 4 LYS HE2 1 1 3 989 1 1 4 LYS HE3 H 4.176 -1.047 -11.369 1.00 . A A . 4 LYS HE3 1 1 3 990 1 1 4 LYS HG2 H 5.057 0.016 -8.092 1.00 . A A . 4 LYS HG2 1 1 3 991 1 1 4 LYS HG3 H 6.647 -0.735 -7.969 1.00 . A A . 4 LYS HG3 1 1 3 992 1 1 4 LYS HZ1 H 3.259 -3.086 -11.125 1.00 . A A . 4 LYS HZ1 1 1 3 993 1 1 4 LYS HZ2 H 3.372 -3.095 -9.436 1.00 . A A . 4 LYS HZ2 1 1 3 994 1 1 4 LYS HZ3 H 4.737 -3.430 -10.383 1.00 . A A . 4 LYS HZ3 1 1 3 995 1 1 4 LYS N N 4.344 -2.968 -5.363 1.00 . A A . 4 LYS N 1 1 3 996 1 1 4 LYS NZ N 3.876 -2.852 -10.324 1.00 . A A . 4 LYS NZ 1 1 3 997 1 1 4 LYS O O 3.413 -0.361 -5.267 1.00 . A A . 4 LYS O 1 1 3 998 1 1 5 LYS C C 3.963 2.358 -5.685 1.00 . A A . 5 LYS C 1 1 3 999 1 1 5 LYS CA C 5.142 1.764 -4.922 1.00 . A A . 5 LYS CA 1 1 3 1000 1 1 5 LYS CB C 6.339 2.721 -4.989 1.00 . A A . 5 LYS CB 1 1 3 1001 1 1 5 LYS CD C 7.106 5.017 -4.265 1.00 . A A . 5 LYS CD 1 1 3 1002 1 1 5 LYS CE C 6.730 6.490 -4.222 1.00 . A A . 5 LYS CE 1 1 3 1003 1 1 5 LYS CG C 5.953 4.179 -4.781 1.00 . A A . 5 LYS CG 1 1 3 1004 1 1 5 LYS H H 6.446 0.232 -5.587 1.00 . A A . 5 LYS H 1 1 3 1005 1 1 5 LYS HA H 4.847 1.663 -3.894 1.00 . A A . 5 LYS HA 1 1 3 1006 1 1 5 LYS HB2 H 7.051 2.444 -4.224 1.00 . A A . 5 LYS HB2 1 1 3 1007 1 1 5 LYS HB3 H 6.808 2.629 -5.957 1.00 . A A . 5 LYS HB3 1 1 3 1008 1 1 5 LYS HD2 H 7.361 4.689 -3.268 1.00 . A A . 5 LYS HD2 1 1 3 1009 1 1 5 LYS HD3 H 7.954 4.889 -4.919 1.00 . A A . 5 LYS HD3 1 1 3 1010 1 1 5 LYS HE2 H 6.913 6.920 -5.196 1.00 . A A . 5 LYS HE2 1 1 3 1011 1 1 5 LYS HE3 H 5.678 6.576 -3.987 1.00 . A A . 5 LYS HE3 1 1 3 1012 1 1 5 LYS HG2 H 5.621 4.594 -5.717 1.00 . A A . 5 LYS HG2 1 1 3 1013 1 1 5 LYS HG3 H 5.144 4.223 -4.075 1.00 . A A . 5 LYS HG3 1 1 3 1014 1 1 5 LYS HZ1 H 8.539 7.095 -3.372 1.00 . A A . 5 LYS HZ1 1 1 3 1015 1 1 5 LYS HZ2 H 7.291 6.883 -2.245 1.00 . A A . 5 LYS HZ2 1 1 3 1016 1 1 5 LYS HZ3 H 7.306 8.246 -3.252 1.00 . A A . 5 LYS HZ3 1 1 3 1017 1 1 5 LYS N N 5.509 0.431 -5.392 1.00 . A A . 5 LYS N 1 1 3 1018 1 1 5 LYS NZ N 7.524 7.232 -3.208 1.00 . A A . 5 LYS NZ 1 1 3 1019 1 1 5 LYS O O 2.897 2.563 -5.135 1.00 . A A . 5 LYS O 1 1 3 1020 1 1 6 TRP C C 2.083 2.156 -8.178 1.00 . A A . 6 TRP C 1 1 3 1021 1 1 6 TRP CA C 3.068 3.223 -7.726 1.00 . A A . 6 TRP CA 1 1 3 1022 1 1 6 TRP CB C 3.649 3.996 -8.909 1.00 . A A . 6 TRP CB 1 1 3 1023 1 1 6 TRP CD1 C 6.141 4.402 -8.441 1.00 . A A . 6 TRP CD1 1 1 3 1024 1 1 6 TRP CD2 C 4.864 6.222 -8.195 1.00 . A A . 6 TRP CD2 1 1 3 1025 1 1 6 TRP CE2 C 6.203 6.572 -7.934 1.00 . A A . 6 TRP CE2 1 1 3 1026 1 1 6 TRP CE3 C 3.882 7.208 -8.094 1.00 . A A . 6 TRP CE3 1 1 3 1027 1 1 6 TRP CG C 4.849 4.830 -8.541 1.00 . A A . 6 TRP CG 1 1 3 1028 1 1 6 TRP CH2 C 5.595 8.810 -7.487 1.00 . A A . 6 TRP CH2 1 1 3 1029 1 1 6 TRP CZ2 C 6.580 7.865 -7.579 1.00 . A A . 6 TRP CZ2 1 1 3 1030 1 1 6 TRP CZ3 C 4.257 8.491 -7.738 1.00 . A A . 6 TRP CZ3 1 1 3 1031 1 1 6 TRP H H 4.991 2.453 -7.356 1.00 . A A . 6 TRP H 1 1 3 1032 1 1 6 TRP HA H 2.537 3.916 -7.081 1.00 . A A . 6 TRP HA 1 1 3 1033 1 1 6 TRP HB2 H 3.951 3.297 -9.675 1.00 . A A . 6 TRP HB2 1 1 3 1034 1 1 6 TRP HB3 H 2.892 4.655 -9.308 1.00 . A A . 6 TRP HB3 1 1 3 1035 1 1 6 TRP HD1 H 6.459 3.388 -8.620 1.00 . A A . 6 TRP HD1 1 1 3 1036 1 1 6 TRP HE1 H 7.934 5.390 -7.978 1.00 . A A . 6 TRP HE1 1 1 3 1037 1 1 6 TRP HE3 H 2.847 6.981 -8.275 1.00 . A A . 6 TRP HE3 1 1 3 1038 1 1 6 TRP HH2 H 5.842 9.824 -7.212 1.00 . A A . 6 TRP HH2 1 1 3 1039 1 1 6 TRP HZ2 H 7.609 8.127 -7.383 1.00 . A A . 6 TRP HZ2 1 1 3 1040 1 1 6 TRP HZ3 H 3.508 9.266 -7.655 1.00 . A A . 6 TRP HZ3 1 1 3 1041 1 1 6 TRP N N 4.139 2.635 -6.945 1.00 . A A . 6 TRP N 1 1 3 1042 1 1 6 TRP NE1 N 6.963 5.444 -8.092 1.00 . A A . 6 TRP NE1 1 1 3 1043 1 1 6 TRP O O 1.471 2.257 -9.240 1.00 . A A . 6 TRP O 1 1 3 1044 1 1 7 GLU C C -0.250 0.244 -6.766 1.00 . A A . 7 GLU C 1 1 3 1045 1 1 7 GLU CA C 0.992 0.064 -7.624 1.00 . A A . 7 GLU CA 1 1 3 1046 1 1 7 GLU CB C 1.659 -1.282 -7.359 1.00 . A A . 7 GLU CB 1 1 3 1047 1 1 7 GLU CD C 1.623 -3.768 -7.598 1.00 . A A . 7 GLU CD 1 1 3 1048 1 1 7 GLU CG C 0.807 -2.496 -7.665 1.00 . A A . 7 GLU CG 1 1 3 1049 1 1 7 GLU H H 2.441 1.127 -6.488 1.00 . A A . 7 GLU H 1 1 3 1050 1 1 7 GLU HA H 0.713 0.127 -8.666 1.00 . A A . 7 GLU HA 1 1 3 1051 1 1 7 GLU HB2 H 2.554 -1.346 -7.959 1.00 . A A . 7 GLU HB2 1 1 3 1052 1 1 7 GLU HB3 H 1.939 -1.324 -6.316 1.00 . A A . 7 GLU HB3 1 1 3 1053 1 1 7 GLU HG2 H 0.005 -2.556 -6.943 1.00 . A A . 7 GLU HG2 1 1 3 1054 1 1 7 GLU HG3 H 0.395 -2.398 -8.658 1.00 . A A . 7 GLU HG3 1 1 3 1055 1 1 7 GLU N N 1.922 1.141 -7.344 1.00 . A A . 7 GLU N 1 1 3 1056 1 1 7 GLU O O -0.155 0.604 -5.592 1.00 . A A . 7 GLU O 1 1 3 1057 1 1 7 GLU OE1 O 2.555 -3.910 -8.423 1.00 . A A . 7 GLU OE1 1 1 3 1058 1 1 7 GLU OE2 O 1.366 -4.601 -6.713 1.00 . A A . 7 GLU OE2 1 1 3 1059 1 1 8 TYR C C -2.740 -0.845 -5.507 1.00 . A A . 8 TYR C 1 1 3 1060 1 1 8 TYR CA C -2.674 0.159 -6.655 1.00 . A A . 8 TYR CA 1 1 3 1061 1 1 8 TYR CB C -3.833 -0.069 -7.634 1.00 . A A . 8 TYR CB 1 1 3 1062 1 1 8 TYR CD1 C -5.467 1.729 -6.942 1.00 . A A . 8 TYR CD1 1 1 3 1063 1 1 8 TYR CD2 C -6.188 -0.539 -6.857 1.00 . A A . 8 TYR CD2 1 1 3 1064 1 1 8 TYR CE1 C -6.705 2.145 -6.495 1.00 . A A . 8 TYR CE1 1 1 3 1065 1 1 8 TYR CE2 C -7.431 -0.132 -6.411 1.00 . A A . 8 TYR CE2 1 1 3 1066 1 1 8 TYR CG C -5.186 0.382 -7.128 1.00 . A A . 8 TYR CG 1 1 3 1067 1 1 8 TYR CZ C -7.684 1.210 -6.230 1.00 . A A . 8 TYR CZ 1 1 3 1068 1 1 8 TYR H H -1.418 -0.258 -8.300 1.00 . A A . 8 TYR H 1 1 3 1069 1 1 8 TYR HA H -2.727 1.163 -6.254 1.00 . A A . 8 TYR HA 1 1 3 1070 1 1 8 TYR HB2 H -3.630 0.468 -8.547 1.00 . A A . 8 TYR HB2 1 1 3 1071 1 1 8 TYR HB3 H -3.899 -1.125 -7.855 1.00 . A A . 8 TYR HB3 1 1 3 1072 1 1 8 TYR HD1 H -4.699 2.460 -7.152 1.00 . A A . 8 TYR HD1 1 1 3 1073 1 1 8 TYR HD2 H -5.986 -1.590 -6.997 1.00 . A A . 8 TYR HD2 1 1 3 1074 1 1 8 TYR HE1 H -6.904 3.197 -6.353 1.00 . A A . 8 TYR HE1 1 1 3 1075 1 1 8 TYR HE2 H -8.197 -0.864 -6.206 1.00 . A A . 8 TYR HE2 1 1 3 1076 1 1 8 TYR HH H -8.970 2.579 -5.817 1.00 . A A . 8 TYR HH 1 1 3 1077 1 1 8 TYR N N -1.411 0.013 -7.361 1.00 . A A . 8 TYR N 1 1 3 1078 1 1 8 TYR O O -2.677 -2.054 -5.728 1.00 . A A . 8 TYR O 1 1 3 1079 1 1 8 TYR OH O -8.919 1.619 -5.786 1.00 . A A . 8 TYR OH 1 1 3 1080 1 1 9 CYS C C -4.264 -1.857 -2.935 1.00 . A A . 9 CYS C 1 1 3 1081 1 1 9 CYS CA C -2.903 -1.184 -3.099 1.00 . A A . 9 CYS CA 1 1 3 1082 1 1 9 CYS CB C -2.561 -0.373 -1.846 1.00 . A A . 9 CYS CB 1 1 3 1083 1 1 9 CYS H H -2.882 0.639 -4.181 1.00 . A A . 9 CYS H 1 1 3 1084 1 1 9 CYS HA H -2.156 -1.955 -3.222 1.00 . A A . 9 CYS HA 1 1 3 1085 1 1 9 CYS HB2 H -3.239 0.464 -1.773 1.00 . A A . 9 CYS HB2 1 1 3 1086 1 1 9 CYS HB3 H -2.681 -1.003 -0.976 1.00 . A A . 9 CYS HB3 1 1 3 1087 1 1 9 CYS N N -2.850 -0.336 -4.288 1.00 . A A . 9 CYS N 1 1 3 1088 1 1 9 CYS O O -4.907 -1.737 -1.891 1.00 . A A . 9 CYS O 1 1 3 1089 1 1 9 CYS SG S -0.861 0.288 -1.826 1.00 . A A . 9 CYS SG 1 1 3 1090 1 1 10 ILE C C -5.787 -4.619 -3.160 1.00 . A A . 10 ILE C 1 1 3 1091 1 1 10 ILE CA C -5.959 -3.300 -3.930 1.00 . A A . 10 ILE CA 1 1 3 1092 1 1 10 ILE CB C -6.505 -3.537 -5.365 1.00 . A A . 10 ILE CB 1 1 3 1093 1 1 10 ILE CD1 C -8.502 -4.429 -6.686 1.00 . A A . 10 ILE CD1 1 1 3 1094 1 1 10 ILE CG1 C -7.860 -4.258 -5.325 1.00 . A A . 10 ILE CG1 1 1 3 1095 1 1 10 ILE CG2 C -5.498 -4.301 -6.222 1.00 . A A . 10 ILE CG2 1 1 3 1096 1 1 10 ILE H H -4.119 -2.655 -4.761 1.00 . A A . 10 ILE H 1 1 3 1097 1 1 10 ILE HA H -6.668 -2.682 -3.396 1.00 . A A . 10 ILE HA 1 1 3 1098 1 1 10 ILE HB H -6.646 -2.569 -5.822 1.00 . A A . 10 ILE HB 1 1 3 1099 1 1 10 ILE HD11 H -8.922 -5.422 -6.763 1.00 . A A . 10 ILE HD11 1 1 3 1100 1 1 10 ILE HD12 H -7.756 -4.293 -7.455 1.00 . A A . 10 ILE HD12 1 1 3 1101 1 1 10 ILE HD13 H -9.285 -3.696 -6.809 1.00 . A A . 10 ILE HD13 1 1 3 1102 1 1 10 ILE HG12 H -7.723 -5.241 -4.898 1.00 . A A . 10 ILE HG12 1 1 3 1103 1 1 10 ILE HG13 H -8.541 -3.693 -4.705 1.00 . A A . 10 ILE HG13 1 1 3 1104 1 1 10 ILE HG21 H -5.948 -4.545 -7.173 1.00 . A A . 10 ILE HG21 1 1 3 1105 1 1 10 ILE HG22 H -5.211 -5.210 -5.715 1.00 . A A . 10 ILE HG22 1 1 3 1106 1 1 10 ILE HG23 H -4.624 -3.687 -6.382 1.00 . A A . 10 ILE HG23 1 1 3 1107 1 1 10 ILE N N -4.690 -2.584 -3.961 1.00 . A A . 10 ILE N 1 1 3 1108 1 1 10 ILE O O -5.934 -5.718 -3.696 1.00 . A A . 10 ILE O 1 1 3 1109 1 1 11 VAL C C -6.483 -6.446 -0.816 1.00 . A A . 11 VAL C 1 1 3 1110 1 1 11 VAL CA C -5.205 -5.633 -1.029 1.00 . A A . 11 VAL CA 1 1 3 1111 1 1 11 VAL CB C -4.616 -5.200 0.335 1.00 . A A . 11 VAL CB 1 1 3 1112 1 1 11 VAL CG1 C -3.243 -4.573 0.143 1.00 . A A . 11 VAL CG1 1 1 3 1113 1 1 11 VAL CG2 C -5.542 -4.230 1.056 1.00 . A A . 11 VAL CG2 1 1 3 1114 1 1 11 VAL H H -5.310 -3.581 -1.527 1.00 . A A . 11 VAL H 1 1 3 1115 1 1 11 VAL HA H -4.478 -6.264 -1.519 1.00 . A A . 11 VAL HA 1 1 3 1116 1 1 11 VAL HB H -4.501 -6.082 0.950 1.00 . A A . 11 VAL HB 1 1 3 1117 1 1 11 VAL HG11 H -3.143 -4.230 -0.877 1.00 . A A . 11 VAL HG11 1 1 3 1118 1 1 11 VAL HG12 H -2.478 -5.306 0.352 1.00 . A A . 11 VAL HG12 1 1 3 1119 1 1 11 VAL HG13 H -3.133 -3.736 0.816 1.00 . A A . 11 VAL HG13 1 1 3 1120 1 1 11 VAL HG21 H -5.883 -4.676 1.979 1.00 . A A . 11 VAL HG21 1 1 3 1121 1 1 11 VAL HG22 H -6.392 -4.008 0.427 1.00 . A A . 11 VAL HG22 1 1 3 1122 1 1 11 VAL HG23 H -5.009 -3.317 1.273 1.00 . A A . 11 VAL HG23 1 1 3 1123 1 1 11 VAL N N -5.434 -4.485 -1.891 1.00 . A A . 11 VAL N 1 1 3 1124 1 1 11 VAL O O -7.530 -5.906 -0.455 1.00 . A A . 11 VAL O 1 1 3 1125 1 1 12 PRO C C -8.005 -8.746 0.564 1.00 . A A . 12 PRO C 1 1 3 1126 1 1 12 PRO CA C -7.551 -8.663 -0.890 1.00 . A A . 12 PRO CA 1 1 3 1127 1 1 12 PRO CB C -7.022 -10.025 -1.363 1.00 . A A . 12 PRO CB 1 1 3 1128 1 1 12 PRO CD C -5.208 -8.480 -1.501 1.00 . A A . 12 PRO CD 1 1 3 1129 1 1 12 PRO CG C -5.776 -9.720 -2.124 1.00 . A A . 12 PRO CG 1 1 3 1130 1 1 12 PRO HA H -8.384 -8.360 -1.508 1.00 . A A . 12 PRO HA 1 1 3 1131 1 1 12 PRO HB2 H -6.817 -10.649 -0.506 1.00 . A A . 12 PRO HB2 1 1 3 1132 1 1 12 PRO HB3 H -7.761 -10.499 -1.992 1.00 . A A . 12 PRO HB3 1 1 3 1133 1 1 12 PRO HD2 H -4.571 -8.733 -0.666 1.00 . A A . 12 PRO HD2 1 1 3 1134 1 1 12 PRO HD3 H -4.665 -7.901 -2.233 1.00 . A A . 12 PRO HD3 1 1 3 1135 1 1 12 PRO HG2 H -5.079 -10.539 -2.032 1.00 . A A . 12 PRO HG2 1 1 3 1136 1 1 12 PRO HG3 H -6.014 -9.543 -3.162 1.00 . A A . 12 PRO HG3 1 1 3 1137 1 1 12 PRO N N -6.409 -7.763 -1.051 1.00 . A A . 12 PRO N 1 1 3 1138 1 1 12 PRO O O -7.182 -8.827 1.475 1.00 . A A . 12 PRO O 1 1 3 1139 1 1 13 ILE C C -9.405 -10.020 2.879 1.00 . A A . 13 ILE C 1 1 3 1140 1 1 13 ILE CA C -9.884 -8.782 2.117 1.00 . A A . 13 ILE CA 1 1 3 1141 1 1 13 ILE CB C -11.429 -8.764 2.082 1.00 . A A . 13 ILE CB 1 1 3 1142 1 1 13 ILE CD1 C -13.476 -9.966 1.140 1.00 . A A . 13 ILE CD1 1 1 3 1143 1 1 13 ILE CG1 C -11.966 -9.864 1.157 1.00 . A A . 13 ILE CG1 1 1 3 1144 1 1 13 ILE CG2 C -11.928 -7.396 1.638 1.00 . A A . 13 ILE CG2 1 1 3 1145 1 1 13 ILE H H -9.916 -8.646 0.005 1.00 . A A . 13 ILE H 1 1 3 1146 1 1 13 ILE HA H -9.553 -7.903 2.651 1.00 . A A . 13 ILE HA 1 1 3 1147 1 1 13 ILE HB H -11.789 -8.941 3.085 1.00 . A A . 13 ILE HB 1 1 3 1148 1 1 13 ILE HD11 H -13.768 -11.006 1.172 1.00 . A A . 13 ILE HD11 1 1 3 1149 1 1 13 ILE HD12 H -13.858 -9.512 0.238 1.00 . A A . 13 ILE HD12 1 1 3 1150 1 1 13 ILE HD13 H -13.882 -9.453 2.001 1.00 . A A . 13 ILE HD13 1 1 3 1151 1 1 13 ILE HG12 H -11.638 -9.666 0.148 1.00 . A A . 13 ILE HG12 1 1 3 1152 1 1 13 ILE HG13 H -11.572 -10.817 1.478 1.00 . A A . 13 ILE HG13 1 1 3 1153 1 1 13 ILE HG21 H -12.815 -7.516 1.033 1.00 . A A . 13 ILE HG21 1 1 3 1154 1 1 13 ILE HG22 H -11.162 -6.904 1.058 1.00 . A A . 13 ILE HG22 1 1 3 1155 1 1 13 ILE HG23 H -12.162 -6.799 2.506 1.00 . A A . 13 ILE HG23 1 1 3 1156 1 1 13 ILE N N -9.315 -8.720 0.773 1.00 . A A . 13 ILE N 1 1 3 1157 1 1 13 ILE O O -9.192 -9.969 4.087 1.00 . A A . 13 ILE O 1 1 3 1158 1 1 14 LEU C C -7.290 -12.600 2.520 1.00 . A A . 14 LEU C 1 1 3 1159 1 1 14 LEU CA C -8.779 -12.366 2.784 1.00 . A A . 14 LEU CA 1 1 3 1160 1 1 14 LEU CB C -9.601 -13.563 2.274 1.00 . A A . 14 LEU CB 1 1 3 1161 1 1 14 LEU CD1 C -9.944 -15.337 0.535 1.00 . A A . 14 LEU CD1 1 1 3 1162 1 1 14 LEU CD2 C -10.111 -12.940 -0.121 1.00 . A A . 14 LEU CD2 1 1 3 1163 1 1 14 LEU CG C -9.413 -13.937 0.794 1.00 . A A . 14 LEU CG 1 1 3 1164 1 1 14 LEU H H -9.413 -11.109 1.206 1.00 . A A . 14 LEU H 1 1 3 1165 1 1 14 LEU HA H -8.927 -12.273 3.850 1.00 . A A . 14 LEU HA 1 1 3 1166 1 1 14 LEU HB2 H -9.344 -14.424 2.872 1.00 . A A . 14 LEU HB2 1 1 3 1167 1 1 14 LEU HB3 H -10.647 -13.342 2.432 1.00 . A A . 14 LEU HB3 1 1 3 1168 1 1 14 LEU HD11 H -10.816 -15.511 1.147 1.00 . A A . 14 LEU HD11 1 1 3 1169 1 1 14 LEU HD12 H -9.182 -16.062 0.780 1.00 . A A . 14 LEU HD12 1 1 3 1170 1 1 14 LEU HD13 H -10.210 -15.434 -0.508 1.00 . A A . 14 LEU HD13 1 1 3 1171 1 1 14 LEU HD21 H -9.375 -12.312 -0.599 1.00 . A A . 14 LEU HD21 1 1 3 1172 1 1 14 LEU HD22 H -10.785 -12.328 0.459 1.00 . A A . 14 LEU HD22 1 1 3 1173 1 1 14 LEU HD23 H -10.670 -13.475 -0.876 1.00 . A A . 14 LEU HD23 1 1 3 1174 1 1 14 LEU HG H -8.357 -13.930 0.559 1.00 . A A . 14 LEU HG 1 1 3 1175 1 1 14 LEU N N -9.233 -11.127 2.167 1.00 . A A . 14 LEU N 1 1 3 1176 1 1 14 LEU O O -6.833 -13.740 2.464 1.00 . A A . 14 LEU O 1 1 3 1177 1 1 15 GLY C C -4.459 -10.314 1.833 1.00 . A A . 15 GLY C 1 1 3 1178 1 1 15 GLY CA C -5.115 -11.650 2.104 1.00 . A A . 15 GLY CA 1 1 3 1179 1 1 15 GLY H H -6.947 -10.627 2.410 1.00 . A A . 15 GLY H 1 1 3 1180 1 1 15 GLY HA2 H -4.644 -12.102 2.964 1.00 . A A . 15 GLY HA2 1 1 3 1181 1 1 15 GLY HA3 H -4.970 -12.291 1.248 1.00 . A A . 15 GLY HA3 1 1 3 1182 1 1 15 GLY N N -6.537 -11.520 2.360 1.00 . A A . 15 GLY N 1 1 3 1183 1 1 15 GLY O O -3.863 -10.115 0.775 1.00 . A A . 15 GLY O 1 1 3 1184 1 1 16 PHE C C -2.496 -8.121 2.482 1.00 . A A . 16 PHE C 1 1 3 1185 1 1 16 PHE CA C -4.014 -8.063 2.642 1.00 . A A . 16 PHE CA 1 1 3 1186 1 1 16 PHE CB C -4.415 -7.174 3.831 1.00 . A A . 16 PHE CB 1 1 3 1187 1 1 16 PHE CD1 C -3.043 -8.039 5.762 1.00 . A A . 16 PHE CD1 1 1 3 1188 1 1 16 PHE CD2 C -5.415 -8.242 5.872 1.00 . A A . 16 PHE CD2 1 1 3 1189 1 1 16 PHE CE1 C -2.930 -8.641 7.000 1.00 . A A . 16 PHE CE1 1 1 3 1190 1 1 16 PHE CE2 C -5.309 -8.846 7.111 1.00 . A A . 16 PHE CE2 1 1 3 1191 1 1 16 PHE CG C -4.285 -7.832 5.183 1.00 . A A . 16 PHE CG 1 1 3 1192 1 1 16 PHE CZ C -4.065 -9.045 7.676 1.00 . A A . 16 PHE CZ 1 1 3 1193 1 1 16 PHE H H -5.084 -9.617 3.594 1.00 . A A . 16 PHE H 1 1 3 1194 1 1 16 PHE HA H -4.429 -7.633 1.742 1.00 . A A . 16 PHE HA 1 1 3 1195 1 1 16 PHE HB2 H -3.789 -6.295 3.835 1.00 . A A . 16 PHE HB2 1 1 3 1196 1 1 16 PHE HB3 H -5.444 -6.871 3.709 1.00 . A A . 16 PHE HB3 1 1 3 1197 1 1 16 PHE HD1 H -2.154 -7.723 5.236 1.00 . A A . 16 PHE HD1 1 1 3 1198 1 1 16 PHE HD2 H -6.390 -8.087 5.433 1.00 . A A . 16 PHE HD2 1 1 3 1199 1 1 16 PHE HE1 H -1.956 -8.797 7.440 1.00 . A A . 16 PHE HE1 1 1 3 1200 1 1 16 PHE HE2 H -6.198 -9.161 7.637 1.00 . A A . 16 PHE HE2 1 1 3 1201 1 1 16 PHE HZ H -3.980 -9.517 8.644 1.00 . A A . 16 PHE HZ 1 1 3 1202 1 1 16 PHE N N -4.587 -9.396 2.782 1.00 . A A . 16 PHE N 1 1 3 1203 1 1 16 PHE O O -1.807 -8.855 3.190 1.00 . A A . 16 PHE O 1 1 3 1204 1 1 17 VAL C C 0.080 -6.141 2.000 1.00 . A A . 17 VAL C 1 1 3 1205 1 1 17 VAL CA C -0.564 -7.310 1.252 1.00 . A A . 17 VAL CA 1 1 3 1206 1 1 17 VAL CB C -0.288 -7.176 -0.269 1.00 . A A . 17 VAL CB 1 1 3 1207 1 1 17 VAL CG1 C 1.061 -7.779 -0.637 1.00 . A A . 17 VAL CG1 1 1 3 1208 1 1 17 VAL CG2 C -1.400 -7.825 -1.083 1.00 . A A . 17 VAL CG2 1 1 3 1209 1 1 17 VAL H H -2.594 -6.801 0.995 1.00 . A A . 17 VAL H 1 1 3 1210 1 1 17 VAL HA H -0.124 -8.232 1.600 1.00 . A A . 17 VAL HA 1 1 3 1211 1 1 17 VAL HB H -0.263 -6.125 -0.514 1.00 . A A . 17 VAL HB 1 1 3 1212 1 1 17 VAL HG11 H 1.528 -8.184 0.247 1.00 . A A . 17 VAL HG11 1 1 3 1213 1 1 17 VAL HG12 H 1.694 -7.013 -1.060 1.00 . A A . 17 VAL HG12 1 1 3 1214 1 1 17 VAL HG13 H 0.918 -8.566 -1.363 1.00 . A A . 17 VAL HG13 1 1 3 1215 1 1 17 VAL HG21 H -1.346 -7.481 -2.105 1.00 . A A . 17 VAL HG21 1 1 3 1216 1 1 17 VAL HG22 H -2.358 -7.557 -0.663 1.00 . A A . 17 VAL HG22 1 1 3 1217 1 1 17 VAL HG23 H -1.284 -8.899 -1.058 1.00 . A A . 17 VAL HG23 1 1 3 1218 1 1 17 VAL N N -1.991 -7.352 1.529 1.00 . A A . 17 VAL N 1 1 3 1219 1 1 17 VAL O O -0.558 -5.500 2.837 1.00 . A A . 17 VAL O 1 1 3 1220 1 1 18 TYR C C 3.233 -4.379 1.408 1.00 . A A . 18 TYR C 1 1 3 1221 1 1 18 TYR CA C 2.083 -4.790 2.316 1.00 . A A . 18 TYR CA 1 1 3 1222 1 1 18 TYR CB C 2.614 -5.236 3.690 1.00 . A A . 18 TYR CB 1 1 3 1223 1 1 18 TYR CD1 C 4.824 -6.431 3.354 1.00 . A A . 18 TYR CD1 1 1 3 1224 1 1 18 TYR CD2 C 2.901 -7.743 3.867 1.00 . A A . 18 TYR CD2 1 1 3 1225 1 1 18 TYR CE1 C 5.593 -7.576 3.288 1.00 . A A . 18 TYR CE1 1 1 3 1226 1 1 18 TYR CE2 C 3.665 -8.892 3.807 1.00 . A A . 18 TYR CE2 1 1 3 1227 1 1 18 TYR CG C 3.465 -6.492 3.643 1.00 . A A . 18 TYR CG 1 1 3 1228 1 1 18 TYR CZ C 5.009 -8.803 3.516 1.00 . A A . 18 TYR CZ 1 1 3 1229 1 1 18 TYR H H 1.783 -6.417 1.011 1.00 . A A . 18 TYR H 1 1 3 1230 1 1 18 TYR HA H 1.417 -3.951 2.445 1.00 . A A . 18 TYR HA 1 1 3 1231 1 1 18 TYR HB2 H 3.218 -4.444 4.108 1.00 . A A . 18 TYR HB2 1 1 3 1232 1 1 18 TYR HB3 H 1.777 -5.427 4.345 1.00 . A A . 18 TYR HB3 1 1 3 1233 1 1 18 TYR HD1 H 5.278 -5.466 3.177 1.00 . A A . 18 TYR HD1 1 1 3 1234 1 1 18 TYR HD2 H 1.847 -7.810 4.094 1.00 . A A . 18 TYR HD2 1 1 3 1235 1 1 18 TYR HE1 H 6.647 -7.505 3.062 1.00 . A A . 18 TYR HE1 1 1 3 1236 1 1 18 TYR HE2 H 3.208 -9.854 3.986 1.00 . A A . 18 TYR HE2 1 1 3 1237 1 1 18 TYR HH H 6.168 -10.126 4.301 1.00 . A A . 18 TYR HH 1 1 3 1238 1 1 18 TYR N N 1.336 -5.870 1.690 1.00 . A A . 18 TYR N 1 1 3 1239 1 1 18 TYR O O 3.754 -5.201 0.663 1.00 . A A . 18 TYR O 1 1 3 1240 1 1 18 TYR OH O 5.771 -9.950 3.439 1.00 . A A . 18 TYR OH 1 1 3 1241 1 1 19 CYS C C 6.057 -3.115 1.076 1.00 . A A . 19 CYS C 1 1 3 1242 1 1 19 CYS CA C 4.698 -2.604 0.621 1.00 . A A . 19 CYS CA 1 1 3 1243 1 1 19 CYS CB C 4.712 -1.097 0.691 1.00 . A A . 19 CYS CB 1 1 3 1244 1 1 19 CYS H H 3.143 -2.491 2.056 1.00 . A A . 19 CYS H 1 1 3 1245 1 1 19 CYS HA H 4.522 -2.911 -0.398 1.00 . A A . 19 CYS HA 1 1 3 1246 1 1 19 CYS HB2 H 4.694 -0.825 1.727 1.00 . A A . 19 CYS HB2 1 1 3 1247 1 1 19 CYS HB3 H 5.625 -0.717 0.240 1.00 . A A . 19 CYS HB3 1 1 3 1248 1 1 19 CYS N N 3.611 -3.113 1.453 1.00 . A A . 19 CYS N 1 1 3 1249 1 1 19 CYS O O 6.204 -3.627 2.188 1.00 . A A . 19 CYS O 1 1 3 1250 1 1 19 CYS SG S 3.294 -0.296 -0.114 1.00 . A A . 19 CYS SG 1 1 3 1251 1 1 20 CYS C C 8.962 -2.440 1.606 1.00 . A A . 20 CYS C 1 1 3 1252 1 1 20 CYS CA C 8.416 -3.354 0.526 1.00 . A A . 20 CYS CA 1 1 3 1253 1 1 20 CYS CB C 9.305 -3.267 -0.716 1.00 . A A . 20 CYS CB 1 1 3 1254 1 1 20 CYS H H 6.874 -2.513 -0.646 1.00 . A A . 20 CYS H 1 1 3 1255 1 1 20 CYS HA H 8.396 -4.371 0.890 1.00 . A A . 20 CYS HA 1 1 3 1256 1 1 20 CYS HB2 H 9.548 -2.232 -0.893 1.00 . A A . 20 CYS HB2 1 1 3 1257 1 1 20 CYS HB3 H 10.216 -3.815 -0.529 1.00 . A A . 20 CYS HB3 1 1 3 1258 1 1 20 CYS N N 7.055 -2.945 0.215 1.00 . A A . 20 CYS N 1 1 3 1259 1 1 20 CYS O O 8.520 -1.296 1.717 1.00 . A A . 20 CYS O 1 1 3 1260 1 1 20 CYS SG S 8.550 -3.939 -2.239 1.00 . A A . 20 CYS SG 1 1 3 1261 1 1 21 PRO C C 10.976 -0.762 2.967 1.00 . A A . 21 PRO C 1 1 3 1262 1 1 21 PRO CA C 10.486 -2.099 3.486 1.00 . A A . 21 PRO CA 1 1 3 1263 1 1 21 PRO CB C 11.642 -2.934 4.010 1.00 . A A . 21 PRO CB 1 1 3 1264 1 1 21 PRO CD C 10.503 -4.262 2.379 1.00 . A A . 21 PRO CD 1 1 3 1265 1 1 21 PRO CG C 11.273 -4.340 3.672 1.00 . A A . 21 PRO CG 1 1 3 1266 1 1 21 PRO HA H 9.771 -1.932 4.279 1.00 . A A . 21 PRO HA 1 1 3 1267 1 1 21 PRO HB2 H 12.559 -2.633 3.523 1.00 . A A . 21 PRO HB2 1 1 3 1268 1 1 21 PRO HB3 H 11.723 -2.786 5.073 1.00 . A A . 21 PRO HB3 1 1 3 1269 1 1 21 PRO HD2 H 11.168 -4.365 1.535 1.00 . A A . 21 PRO HD2 1 1 3 1270 1 1 21 PRO HD3 H 9.732 -5.015 2.347 1.00 . A A . 21 PRO HD3 1 1 3 1271 1 1 21 PRO HG2 H 12.166 -4.933 3.542 1.00 . A A . 21 PRO HG2 1 1 3 1272 1 1 21 PRO HG3 H 10.654 -4.755 4.453 1.00 . A A . 21 PRO HG3 1 1 3 1273 1 1 21 PRO N N 9.915 -2.914 2.422 1.00 . A A . 21 PRO N 1 1 3 1274 1 1 21 PRO O O 11.874 -0.686 2.129 1.00 . A A . 21 PRO O 1 1 3 1275 1 1 22 GLY C C 9.484 2.323 2.414 1.00 . A A . 22 GLY C 1 1 3 1276 1 1 22 GLY CA C 10.672 1.622 3.041 1.00 . A A . 22 GLY CA 1 1 3 1277 1 1 22 GLY H H 9.628 0.124 4.100 1.00 . A A . 22 GLY H 1 1 3 1278 1 1 22 GLY HA2 H 10.999 2.187 3.903 1.00 . A A . 22 GLY HA2 1 1 3 1279 1 1 22 GLY HA3 H 11.476 1.582 2.321 1.00 . A A . 22 GLY HA3 1 1 3 1280 1 1 22 GLY N N 10.345 0.278 3.458 1.00 . A A . 22 GLY N 1 1 3 1281 1 1 22 GLY O O 9.349 3.539 2.522 1.00 . A A . 22 GLY O 1 1 3 1282 1 1 23 LEU C C 6.196 1.740 1.928 1.00 . A A . 23 LEU C 1 1 3 1283 1 1 23 LEU CA C 7.436 2.093 1.117 1.00 . A A . 23 LEU CA 1 1 3 1284 1 1 23 LEU CB C 7.319 1.532 -0.301 1.00 . A A . 23 LEU CB 1 1 3 1285 1 1 23 LEU CD1 C 8.375 1.006 -2.511 1.00 . A A . 23 LEU CD1 1 1 3 1286 1 1 23 LEU CD2 C 8.789 3.222 -1.431 1.00 . A A . 23 LEU CD2 1 1 3 1287 1 1 23 LEU CG C 8.546 1.739 -1.191 1.00 . A A . 23 LEU CG 1 1 3 1288 1 1 23 LEU H H 8.772 0.579 1.716 1.00 . A A . 23 LEU H 1 1 3 1289 1 1 23 LEU HA H 7.538 3.167 1.071 1.00 . A A . 23 LEU HA 1 1 3 1290 1 1 23 LEU HB2 H 7.126 0.471 -0.230 1.00 . A A . 23 LEU HB2 1 1 3 1291 1 1 23 LEU HB3 H 6.473 2.001 -0.782 1.00 . A A . 23 LEU HB3 1 1 3 1292 1 1 23 LEU HD11 H 7.887 1.655 -3.222 1.00 . A A . 23 LEU HD11 1 1 3 1293 1 1 23 LEU HD12 H 7.773 0.123 -2.356 1.00 . A A . 23 LEU HD12 1 1 3 1294 1 1 23 LEU HD13 H 9.344 0.718 -2.891 1.00 . A A . 23 LEU HD13 1 1 3 1295 1 1 23 LEU HD21 H 8.863 3.406 -2.492 1.00 . A A . 23 LEU HD21 1 1 3 1296 1 1 23 LEU HD22 H 9.710 3.518 -0.950 1.00 . A A . 23 LEU HD22 1 1 3 1297 1 1 23 LEU HD23 H 7.969 3.792 -1.022 1.00 . A A . 23 LEU HD23 1 1 3 1298 1 1 23 LEU HG H 9.415 1.332 -0.693 1.00 . A A . 23 LEU HG 1 1 3 1299 1 1 23 LEU N N 8.619 1.550 1.762 1.00 . A A . 23 LEU N 1 1 3 1300 1 1 23 LEU O O 6.177 0.718 2.620 1.00 . A A . 23 LEU O 1 1 3 1301 1 1 24 ILE C C 2.698 2.736 1.790 1.00 . A A . 24 ILE C 1 1 3 1302 1 1 24 ILE CA C 3.931 2.328 2.593 1.00 . A A . 24 ILE CA 1 1 3 1303 1 1 24 ILE CB C 3.910 3.081 3.945 1.00 . A A . 24 ILE CB 1 1 3 1304 1 1 24 ILE CD1 C 4.226 5.378 5.018 1.00 . A A . 24 ILE CD1 1 1 3 1305 1 1 24 ILE CG1 C 4.312 4.549 3.753 1.00 . A A . 24 ILE CG1 1 1 3 1306 1 1 24 ILE CG2 C 4.817 2.399 4.961 1.00 . A A . 24 ILE CG2 1 1 3 1307 1 1 24 ILE H H 5.241 3.381 1.283 1.00 . A A . 24 ILE H 1 1 3 1308 1 1 24 ILE HA H 3.877 1.269 2.798 1.00 . A A . 24 ILE HA 1 1 3 1309 1 1 24 ILE HB H 2.901 3.044 4.328 1.00 . A A . 24 ILE HB 1 1 3 1310 1 1 24 ILE HD11 H 3.708 4.817 5.781 1.00 . A A . 24 ILE HD11 1 1 3 1311 1 1 24 ILE HD12 H 3.686 6.291 4.813 1.00 . A A . 24 ILE HD12 1 1 3 1312 1 1 24 ILE HD13 H 5.222 5.617 5.359 1.00 . A A . 24 ILE HD13 1 1 3 1313 1 1 24 ILE HG12 H 5.331 4.592 3.399 1.00 . A A . 24 ILE HG12 1 1 3 1314 1 1 24 ILE HG13 H 3.662 4.998 3.017 1.00 . A A . 24 ILE HG13 1 1 3 1315 1 1 24 ILE HG21 H 5.613 1.884 4.444 1.00 . A A . 24 ILE HG21 1 1 3 1316 1 1 24 ILE HG22 H 4.243 1.688 5.537 1.00 . A A . 24 ILE HG22 1 1 3 1317 1 1 24 ILE HG23 H 5.240 3.141 5.623 1.00 . A A . 24 ILE HG23 1 1 3 1318 1 1 24 ILE N N 5.168 2.573 1.852 1.00 . A A . 24 ILE N 1 1 3 1319 1 1 24 ILE O O 2.664 3.807 1.185 1.00 . A A . 24 ILE O 1 1 3 1320 1 1 25 CYS C C -0.267 3.379 1.679 1.00 . A A . 25 CYS C 1 1 3 1321 1 1 25 CYS CA C 0.437 2.162 1.078 1.00 . A A . 25 CYS CA 1 1 3 1322 1 1 25 CYS CB C -0.509 0.957 1.114 1.00 . A A . 25 CYS CB 1 1 3 1323 1 1 25 CYS H H 1.766 1.032 2.291 1.00 . A A . 25 CYS H 1 1 3 1324 1 1 25 CYS HA H 0.689 2.379 0.052 1.00 . A A . 25 CYS HA 1 1 3 1325 1 1 25 CYS HB2 H -0.494 0.528 2.105 1.00 . A A . 25 CYS HB2 1 1 3 1326 1 1 25 CYS HB3 H -1.511 1.291 0.889 1.00 . A A . 25 CYS HB3 1 1 3 1327 1 1 25 CYS N N 1.680 1.875 1.794 1.00 . A A . 25 CYS N 1 1 3 1328 1 1 25 CYS O O -0.385 3.499 2.897 1.00 . A A . 25 CYS O 1 1 3 1329 1 1 25 CYS SG S -0.091 -0.370 -0.063 1.00 . A A . 25 CYS SG 1 1 3 1330 1 1 26 GLY C C -2.663 5.757 0.457 1.00 . A A . 26 GLY C 1 1 3 1331 1 1 26 GLY CA C -1.408 5.469 1.264 1.00 . A A . 26 GLY CA 1 1 3 1332 1 1 26 GLY H H -0.596 4.121 -0.145 1.00 . A A . 26 GLY H 1 1 3 1333 1 1 26 GLY HA2 H -1.680 5.349 2.302 1.00 . A A . 26 GLY HA2 1 1 3 1334 1 1 26 GLY HA3 H -0.735 6.309 1.173 1.00 . A A . 26 GLY HA3 1 1 3 1335 1 1 26 GLY N N -0.727 4.273 0.815 1.00 . A A . 26 GLY N 1 1 3 1336 1 1 26 GLY O O -3.702 5.138 0.688 1.00 . A A . 26 GLY O 1 1 3 1337 1 1 27 PRO C C -4.107 6.015 -2.381 1.00 . A A . 27 PRO C 1 1 3 1338 1 1 27 PRO CA C -3.743 7.082 -1.348 1.00 . A A . 27 PRO CA 1 1 3 1339 1 1 27 PRO CB C -3.275 8.370 -2.047 1.00 . A A . 27 PRO CB 1 1 3 1340 1 1 27 PRO CD C -1.407 7.487 -0.837 1.00 . A A . 27 PRO CD 1 1 3 1341 1 1 27 PRO CG C -1.996 8.756 -1.377 1.00 . A A . 27 PRO CG 1 1 3 1342 1 1 27 PRO HA H -4.615 7.292 -0.747 1.00 . A A . 27 PRO HA 1 1 3 1343 1 1 27 PRO HB2 H -3.123 8.173 -3.098 1.00 . A A . 27 PRO HB2 1 1 3 1344 1 1 27 PRO HB3 H -4.027 9.137 -1.929 1.00 . A A . 27 PRO HB3 1 1 3 1345 1 1 27 PRO HD2 H -0.815 6.991 -1.593 1.00 . A A . 27 PRO HD2 1 1 3 1346 1 1 27 PRO HD3 H -0.815 7.685 0.043 1.00 . A A . 27 PRO HD3 1 1 3 1347 1 1 27 PRO HG2 H -1.327 9.204 -2.095 1.00 . A A . 27 PRO HG2 1 1 3 1348 1 1 27 PRO HG3 H -2.199 9.446 -0.571 1.00 . A A . 27 PRO HG3 1 1 3 1349 1 1 27 PRO N N -2.599 6.700 -0.503 1.00 . A A . 27 PRO N 1 1 3 1350 1 1 27 PRO O O -4.094 6.267 -3.585 1.00 . A A . 27 PRO O 1 1 3 1351 1 1 28 PHE C C -3.607 3.238 -3.590 1.00 . A A . 28 PHE C 1 1 3 1352 1 1 28 PHE CA C -4.783 3.669 -2.709 1.00 . A A . 28 PHE CA 1 1 3 1353 1 1 28 PHE CB C -6.052 3.941 -3.555 1.00 . A A . 28 PHE CB 1 1 3 1354 1 1 28 PHE CD1 C -7.462 5.086 -1.808 1.00 . A A . 28 PHE CD1 1 1 3 1355 1 1 28 PHE CD2 C -8.353 3.169 -2.911 1.00 . A A . 28 PHE CD2 1 1 3 1356 1 1 28 PHE CE1 C -8.623 5.202 -1.066 1.00 . A A . 28 PHE CE1 1 1 3 1357 1 1 28 PHE CE2 C -9.515 3.281 -2.173 1.00 . A A . 28 PHE CE2 1 1 3 1358 1 1 28 PHE CG C -7.312 4.068 -2.739 1.00 . A A . 28 PHE CG 1 1 3 1359 1 1 28 PHE CZ C -9.650 4.299 -1.248 1.00 . A A . 28 PHE CZ 1 1 3 1360 1 1 28 PHE H H -4.388 4.714 -0.908 1.00 . A A . 28 PHE H 1 1 3 1361 1 1 28 PHE HA H -4.997 2.857 -2.029 1.00 . A A . 28 PHE HA 1 1 3 1362 1 1 28 PHE HB2 H -5.931 4.860 -4.112 1.00 . A A . 28 PHE HB2 1 1 3 1363 1 1 28 PHE HB3 H -6.195 3.124 -4.252 1.00 . A A . 28 PHE HB3 1 1 3 1364 1 1 28 PHE HD1 H -6.660 5.794 -1.665 1.00 . A A . 28 PHE HD1 1 1 3 1365 1 1 28 PHE HD2 H -8.249 2.372 -3.633 1.00 . A A . 28 PHE HD2 1 1 3 1366 1 1 28 PHE HE1 H -8.725 5.998 -0.344 1.00 . A A . 28 PHE HE1 1 1 3 1367 1 1 28 PHE HE2 H -10.318 2.573 -2.318 1.00 . A A . 28 PHE HE2 1 1 3 1368 1 1 28 PHE HZ H -10.558 4.387 -0.670 1.00 . A A . 28 PHE HZ 1 1 3 1369 1 1 28 PHE N N -4.417 4.824 -1.883 1.00 . A A . 28 PHE N 1 1 3 1370 1 1 28 PHE O O -3.767 2.454 -4.523 1.00 . A A . 28 PHE O 1 1 3 1371 1 1 29 VAL C C -0.070 3.461 -2.902 1.00 . A A . 29 VAL C 1 1 3 1372 1 1 29 VAL CA C -1.178 3.388 -3.930 1.00 . A A . 29 VAL CA 1 1 3 1373 1 1 29 VAL CB C -0.838 4.349 -5.105 1.00 . A A . 29 VAL CB 1 1 3 1374 1 1 29 VAL CG1 C -1.823 4.187 -6.253 1.00 . A A . 29 VAL CG1 1 1 3 1375 1 1 29 VAL CG2 C -0.805 5.796 -4.631 1.00 . A A . 29 VAL CG2 1 1 3 1376 1 1 29 VAL H H -2.358 4.305 -2.447 1.00 . A A . 29 VAL H 1 1 3 1377 1 1 29 VAL HA H -1.258 2.376 -4.310 1.00 . A A . 29 VAL HA 1 1 3 1378 1 1 29 VAL HB H 0.153 4.095 -5.478 1.00 . A A . 29 VAL HB 1 1 3 1379 1 1 29 VAL HG11 H -2.832 4.213 -5.868 1.00 . A A . 29 VAL HG11 1 1 3 1380 1 1 29 VAL HG12 H -1.650 3.241 -6.745 1.00 . A A . 29 VAL HG12 1 1 3 1381 1 1 29 VAL HG13 H -1.687 4.991 -6.961 1.00 . A A . 29 VAL HG13 1 1 3 1382 1 1 29 VAL HG21 H 0.212 6.074 -4.394 1.00 . A A . 29 VAL HG21 1 1 3 1383 1 1 29 VAL HG22 H -1.421 5.901 -3.750 1.00 . A A . 29 VAL HG22 1 1 3 1384 1 1 29 VAL HG23 H -1.180 6.440 -5.412 1.00 . A A . 29 VAL HG23 1 1 3 1385 1 1 29 VAL N N -2.417 3.720 -3.238 1.00 . A A . 29 VAL N 1 1 3 1386 1 1 29 VAL O O -0.264 4.044 -1.835 1.00 . A A . 29 VAL O 1 1 3 1387 1 1 30 CYS C C 3.028 4.149 -2.472 1.00 . A A . 30 CYS C 1 1 3 1388 1 1 30 CYS CA C 2.173 2.903 -2.256 1.00 . A A . 30 CYS CA 1 1 3 1389 1 1 30 CYS CB C 3.017 1.641 -2.427 1.00 . A A . 30 CYS CB 1 1 3 1390 1 1 30 CYS H H 1.177 2.429 -4.057 1.00 . A A . 30 CYS H 1 1 3 1391 1 1 30 CYS HA H 1.766 2.926 -1.257 1.00 . A A . 30 CYS HA 1 1 3 1392 1 1 30 CYS HB2 H 2.366 0.789 -2.558 1.00 . A A . 30 CYS HB2 1 1 3 1393 1 1 30 CYS HB3 H 3.628 1.751 -3.311 1.00 . A A . 30 CYS HB3 1 1 3 1394 1 1 30 CYS N N 1.067 2.884 -3.192 1.00 . A A . 30 CYS N 1 1 3 1395 1 1 30 CYS O O 3.096 4.688 -3.580 1.00 . A A . 30 CYS O 1 1 3 1396 1 1 30 CYS SG S 4.128 1.304 -1.032 1.00 . A A . 30 CYS SG 1 1 3 1397 1 1 31 VAL C C 5.788 5.585 -0.695 1.00 . A A . 31 VAL C 1 1 3 1398 1 1 31 VAL CA C 4.528 5.789 -1.520 1.00 . A A . 31 VAL CA 1 1 3 1399 1 1 31 VAL CB C 3.814 7.081 -1.049 1.00 . A A . 31 VAL CB 1 1 3 1400 1 1 31 VAL CG1 C 2.679 7.456 -1.991 1.00 . A A . 31 VAL CG1 1 1 3 1401 1 1 31 VAL CG2 C 3.296 6.930 0.375 1.00 . A A . 31 VAL CG2 1 1 3 1402 1 1 31 VAL H H 3.599 4.155 -0.556 1.00 . A A . 31 VAL H 1 1 3 1403 1 1 31 VAL HA H 4.808 5.909 -2.563 1.00 . A A . 31 VAL HA 1 1 3 1404 1 1 31 VAL HB H 4.535 7.887 -1.059 1.00 . A A . 31 VAL HB 1 1 3 1405 1 1 31 VAL HG11 H 3.046 8.139 -2.743 1.00 . A A . 31 VAL HG11 1 1 3 1406 1 1 31 VAL HG12 H 1.887 7.930 -1.430 1.00 . A A . 31 VAL HG12 1 1 3 1407 1 1 31 VAL HG13 H 2.299 6.565 -2.468 1.00 . A A . 31 VAL HG13 1 1 3 1408 1 1 31 VAL HG21 H 3.321 5.888 0.657 1.00 . A A . 31 VAL HG21 1 1 3 1409 1 1 31 VAL HG22 H 2.281 7.294 0.429 1.00 . A A . 31 VAL HG22 1 1 3 1410 1 1 31 VAL HG23 H 3.920 7.500 1.047 1.00 . A A . 31 VAL HG23 1 1 3 1411 1 1 31 VAL N N 3.680 4.615 -1.423 1.00 . A A . 31 VAL N 1 1 3 1412 1 1 31 VAL O O 5.787 4.678 0.160 1.00 . A A . 31 VAL O 1 1 3 1413 1 1 31 VAL OXT O 6.774 6.319 -0.930 1.00 . A A . 31 VAL OXT 1 1 4 1414 1 1 1 ALA C C 4.206 -8.648 -0.634 1.00 . A A . 1 ALA C 1 1 4 1415 1 1 1 ALA CA C 4.314 -10.153 -0.816 1.00 . A A . 1 ALA CA 1 1 4 1416 1 1 1 ALA CB C 3.659 -10.579 -2.122 1.00 . A A . 1 ALA CB 1 1 4 1417 1 1 1 ALA H1 H 4.207 -10.639 1.209 1.00 . A A . 1 ALA H1 1 1 4 1418 1 1 1 ALA H2 H 3.683 -11.874 0.174 1.00 . A A . 1 ALA H2 1 1 4 1419 1 1 1 ALA H3 H 2.701 -10.523 0.443 1.00 . A A . 1 ALA H3 1 1 4 1420 1 1 1 ALA HA H 5.358 -10.430 -0.853 1.00 . A A . 1 ALA HA 1 1 4 1421 1 1 1 ALA HB1 H 3.037 -9.777 -2.491 1.00 . A A . 1 ALA HB1 1 1 4 1422 1 1 1 ALA HB2 H 3.054 -11.457 -1.952 1.00 . A A . 1 ALA HB2 1 1 4 1423 1 1 1 ALA HB3 H 4.424 -10.805 -2.850 1.00 . A A . 1 ALA HB3 1 1 4 1424 1 1 1 ALA N N 3.682 -10.848 0.330 1.00 . A A . 1 ALA N 1 1 4 1425 1 1 1 ALA O O 3.182 -8.154 -0.167 1.00 . A A . 1 ALA O 1 1 4 1426 1 1 2 CYS C C 4.858 -5.814 -2.159 1.00 . A A . 2 CYS C 1 1 4 1427 1 1 2 CYS CA C 5.279 -6.482 -0.853 1.00 . A A . 2 CYS CA 1 1 4 1428 1 1 2 CYS CB C 6.665 -6.011 -0.418 1.00 . A A . 2 CYS CB 1 1 4 1429 1 1 2 CYS H H 6.052 -8.381 -1.350 1.00 . A A . 2 CYS H 1 1 4 1430 1 1 2 CYS HA H 4.566 -6.201 -0.084 1.00 . A A . 2 CYS HA 1 1 4 1431 1 1 2 CYS HB2 H 6.606 -4.967 -0.152 1.00 . A A . 2 CYS HB2 1 1 4 1432 1 1 2 CYS HB3 H 6.970 -6.574 0.452 1.00 . A A . 2 CYS HB3 1 1 4 1433 1 1 2 CYS N N 5.261 -7.931 -0.988 1.00 . A A . 2 CYS N 1 1 4 1434 1 1 2 CYS O O 5.313 -6.190 -3.239 1.00 . A A . 2 CYS O 1 1 4 1435 1 1 2 CYS SG S 7.980 -6.173 -1.667 1.00 . A A . 2 CYS SG 1 1 4 1436 1 1 3 SER C C 4.433 -3.008 -3.608 1.00 . A A . 3 SER C 1 1 4 1437 1 1 3 SER CA C 3.470 -4.122 -3.206 1.00 . A A . 3 SER CA 1 1 4 1438 1 1 3 SER CB C 2.093 -3.536 -2.892 1.00 . A A . 3 SER CB 1 1 4 1439 1 1 3 SER H H 3.632 -4.604 -1.158 1.00 . A A . 3 SER H 1 1 4 1440 1 1 3 SER HA H 3.378 -4.821 -4.023 1.00 . A A . 3 SER HA 1 1 4 1441 1 1 3 SER HB2 H 2.196 -2.751 -2.157 1.00 . A A . 3 SER HB2 1 1 4 1442 1 1 3 SER HB3 H 1.661 -3.130 -3.795 1.00 . A A . 3 SER HB3 1 1 4 1443 1 1 3 SER HG H 1.126 -5.233 -3.028 1.00 . A A . 3 SER HG 1 1 4 1444 1 1 3 SER N N 3.970 -4.842 -2.049 1.00 . A A . 3 SER N 1 1 4 1445 1 1 3 SER O O 5.025 -2.351 -2.746 1.00 . A A . 3 SER O 1 1 4 1446 1 1 3 SER OG O 1.225 -4.532 -2.377 1.00 . A A . 3 SER OG 1 1 4 1447 1 1 4 LYS C C 4.844 -0.377 -5.119 1.00 . A A . 4 LYS C 1 1 4 1448 1 1 4 LYS CA C 5.457 -1.743 -5.416 1.00 . A A . 4 LYS CA 1 1 4 1449 1 1 4 LYS CB C 5.720 -1.911 -6.918 1.00 . A A . 4 LYS CB 1 1 4 1450 1 1 4 LYS CD C 6.910 -3.269 -8.693 1.00 . A A . 4 LYS CD 1 1 4 1451 1 1 4 LYS CE C 5.833 -3.062 -9.751 1.00 . A A . 4 LYS CE 1 1 4 1452 1 1 4 LYS CG C 6.345 -3.254 -7.277 1.00 . A A . 4 LYS CG 1 1 4 1453 1 1 4 LYS H H 4.074 -3.339 -5.548 1.00 . A A . 4 LYS H 1 1 4 1454 1 1 4 LYS HA H 6.395 -1.820 -4.885 1.00 . A A . 4 LYS HA 1 1 4 1455 1 1 4 LYS HB2 H 4.783 -1.820 -7.449 1.00 . A A . 4 LYS HB2 1 1 4 1456 1 1 4 LYS HB3 H 6.388 -1.128 -7.245 1.00 . A A . 4 LYS HB3 1 1 4 1457 1 1 4 LYS HD2 H 7.639 -2.479 -8.784 1.00 . A A . 4 LYS HD2 1 1 4 1458 1 1 4 LYS HD3 H 7.391 -4.222 -8.865 1.00 . A A . 4 LYS HD3 1 1 4 1459 1 1 4 LYS HE2 H 5.355 -2.111 -9.576 1.00 . A A . 4 LYS HE2 1 1 4 1460 1 1 4 LYS HE3 H 6.302 -3.054 -10.724 1.00 . A A . 4 LYS HE3 1 1 4 1461 1 1 4 LYS HG2 H 7.144 -3.463 -6.583 1.00 . A A . 4 LYS HG2 1 1 4 1462 1 1 4 LYS HG3 H 5.588 -4.023 -7.195 1.00 . A A . 4 LYS HG3 1 1 4 1463 1 1 4 LYS HZ1 H 5.115 -4.926 -9.133 1.00 . A A . 4 LYS HZ1 1 1 4 1464 1 1 4 LYS HZ2 H 4.609 -4.477 -10.680 1.00 . A A . 4 LYS HZ2 1 1 4 1465 1 1 4 LYS HZ3 H 3.905 -3.753 -9.319 1.00 . A A . 4 LYS HZ3 1 1 4 1466 1 1 4 LYS N N 4.580 -2.792 -4.913 1.00 . A A . 4 LYS N 1 1 4 1467 1 1 4 LYS NZ N 4.799 -4.132 -9.721 1.00 . A A . 4 LYS NZ 1 1 4 1468 1 1 4 LYS O O 3.641 -0.267 -4.889 1.00 . A A . 4 LYS O 1 1 4 1469 1 1 5 LYS C C 3.998 2.420 -5.594 1.00 . A A . 5 LYS C 1 1 4 1470 1 1 5 LYS CA C 5.200 1.993 -4.760 1.00 . A A . 5 LYS CA 1 1 4 1471 1 1 5 LYS CB C 6.332 3.018 -4.902 1.00 . A A . 5 LYS CB 1 1 4 1472 1 1 5 LYS CD C 6.937 5.405 -4.360 1.00 . A A . 5 LYS CD 1 1 4 1473 1 1 5 LYS CE C 6.439 6.842 -4.366 1.00 . A A . 5 LYS CE 1 1 4 1474 1 1 5 LYS CG C 5.849 4.457 -4.816 1.00 . A A . 5 LYS CG 1 1 4 1475 1 1 5 LYS H H 6.626 0.504 -5.239 1.00 . A A . 5 LYS H 1 1 4 1476 1 1 5 LYS HA H 4.887 1.975 -3.733 1.00 . A A . 5 LYS HA 1 1 4 1477 1 1 5 LYS HB2 H 7.055 2.853 -4.117 1.00 . A A . 5 LYS HB2 1 1 4 1478 1 1 5 LYS HB3 H 6.814 2.877 -5.859 1.00 . A A . 5 LYS HB3 1 1 4 1479 1 1 5 LYS HD2 H 7.239 5.140 -3.358 1.00 . A A . 5 LYS HD2 1 1 4 1480 1 1 5 LYS HD3 H 7.781 5.323 -5.030 1.00 . A A . 5 LYS HD3 1 1 4 1481 1 1 5 LYS HE2 H 6.617 7.267 -5.343 1.00 . A A . 5 LYS HE2 1 1 4 1482 1 1 5 LYS HE3 H 5.376 6.844 -4.166 1.00 . A A . 5 LYS HE3 1 1 4 1483 1 1 5 LYS HG2 H 5.503 4.770 -5.784 1.00 . A A . 5 LYS HG2 1 1 4 1484 1 1 5 LYS HG3 H 5.032 4.501 -4.122 1.00 . A A . 5 LYS HG3 1 1 4 1485 1 1 5 LYS HZ1 H 8.131 7.801 -3.601 1.00 . A A . 5 LYS HZ1 1 1 4 1486 1 1 5 LYS HZ2 H 7.090 7.194 -2.407 1.00 . A A . 5 LYS HZ2 1 1 4 1487 1 1 5 LYS HZ3 H 6.678 8.598 -3.262 1.00 . A A . 5 LYS HZ3 1 1 4 1488 1 1 5 LYS N N 5.673 0.652 -5.082 1.00 . A A . 5 LYS N 1 1 4 1489 1 1 5 LYS NZ N 7.134 7.670 -3.343 1.00 . A A . 5 LYS NZ 1 1 4 1490 1 1 5 LYS O O 2.910 2.608 -5.078 1.00 . A A . 5 LYS O 1 1 4 1491 1 1 6 TRP C C 2.207 1.846 -8.112 1.00 . A A . 6 TRP C 1 1 4 1492 1 1 6 TRP CA C 3.101 3.014 -7.724 1.00 . A A . 6 TRP CA 1 1 4 1493 1 1 6 TRP CB C 3.662 3.732 -8.952 1.00 . A A . 6 TRP CB 1 1 4 1494 1 1 6 TRP CD1 C 6.118 4.303 -8.462 1.00 . A A . 6 TRP CD1 1 1 4 1495 1 1 6 TRP CD2 C 4.748 6.070 -8.394 1.00 . A A . 6 TRP CD2 1 1 4 1496 1 1 6 TRP CE2 C 6.061 6.507 -8.132 1.00 . A A . 6 TRP CE2 1 1 4 1497 1 1 6 TRP CE3 C 3.718 7.012 -8.396 1.00 . A A . 6 TRP CE3 1 1 4 1498 1 1 6 TRP CG C 4.809 4.655 -8.627 1.00 . A A . 6 TRP CG 1 1 4 1499 1 1 6 TRP CH2 C 5.337 8.739 -7.882 1.00 . A A . 6 TRP CH2 1 1 4 1500 1 1 6 TRP CZ2 C 6.367 7.841 -7.875 1.00 . A A . 6 TRP CZ2 1 1 4 1501 1 1 6 TRP CZ3 C 4.021 8.336 -8.137 1.00 . A A . 6 TRP CZ3 1 1 4 1502 1 1 6 TRP H H 5.058 2.418 -7.247 1.00 . A A . 6 TRP H 1 1 4 1503 1 1 6 TRP HA H 2.502 3.719 -7.153 1.00 . A A . 6 TRP HA 1 1 4 1504 1 1 6 TRP HB2 H 4.015 2.997 -9.661 1.00 . A A . 6 TRP HB2 1 1 4 1505 1 1 6 TRP HB3 H 2.879 4.319 -9.408 1.00 . A A . 6 TRP HB3 1 1 4 1506 1 1 6 TRP HD1 H 6.488 3.295 -8.551 1.00 . A A . 6 TRP HD1 1 1 4 1507 1 1 6 TRP HE1 H 7.849 5.413 -8.041 1.00 . A A . 6 TRP HE1 1 1 4 1508 1 1 6 TRP HE3 H 2.699 6.721 -8.581 1.00 . A A . 6 TRP HE3 1 1 4 1509 1 1 6 TRP HH2 H 5.528 9.784 -7.684 1.00 . A A . 6 TRP HH2 1 1 4 1510 1 1 6 TRP HZ2 H 7.377 8.169 -7.677 1.00 . A A . 6 TRP HZ2 1 1 4 1511 1 1 6 TRP HZ3 H 3.236 9.076 -8.134 1.00 . A A . 6 TRP HZ3 1 1 4 1512 1 1 6 TRP N N 4.186 2.583 -6.869 1.00 . A A . 6 TRP N 1 1 4 1513 1 1 6 TRP NE1 N 6.878 5.410 -8.181 1.00 . A A . 6 TRP NE1 1 1 4 1514 1 1 6 TRP O O 1.621 1.836 -9.192 1.00 . A A . 6 TRP O 1 1 4 1515 1 1 7 GLU C C -0.223 0.088 -7.217 1.00 . A A . 7 GLU C 1 1 4 1516 1 1 7 GLU CA C 1.243 -0.292 -7.458 1.00 . A A . 7 GLU CA 1 1 4 1517 1 1 7 GLU CB C 1.636 -1.454 -6.539 1.00 . A A . 7 GLU CB 1 1 4 1518 1 1 7 GLU CD C 2.335 -3.217 -8.203 1.00 . A A . 7 GLU CD 1 1 4 1519 1 1 7 GLU CG C 1.353 -2.834 -7.116 1.00 . A A . 7 GLU CG 1 1 4 1520 1 1 7 GLU H H 2.596 0.944 -6.352 1.00 . A A . 7 GLU H 1 1 4 1521 1 1 7 GLU HA H 1.367 -0.589 -8.489 1.00 . A A . 7 GLU HA 1 1 4 1522 1 1 7 GLU HB2 H 2.694 -1.389 -6.331 1.00 . A A . 7 GLU HB2 1 1 4 1523 1 1 7 GLU HB3 H 1.092 -1.360 -5.611 1.00 . A A . 7 GLU HB3 1 1 4 1524 1 1 7 GLU HG2 H 1.416 -3.563 -6.321 1.00 . A A . 7 GLU HG2 1 1 4 1525 1 1 7 GLU HG3 H 0.357 -2.840 -7.532 1.00 . A A . 7 GLU HG3 1 1 4 1526 1 1 7 GLU N N 2.096 0.871 -7.213 1.00 . A A . 7 GLU N 1 1 4 1527 1 1 7 GLU O O -0.728 1.063 -7.772 1.00 . A A . 7 GLU O 1 1 4 1528 1 1 7 GLU OE1 O 3.162 -2.371 -8.589 1.00 . A A . 7 GLU OE1 1 1 4 1529 1 1 7 GLU OE2 O 2.309 -4.373 -8.664 1.00 . A A . 7 GLU OE2 1 1 4 1530 1 1 8 TYR C C -2.611 -1.169 -4.749 1.00 . A A . 8 TYR C 1 1 4 1531 1 1 8 TYR CA C -2.281 -0.428 -6.033 1.00 . A A . 8 TYR CA 1 1 4 1532 1 1 8 TYR CB C -3.200 -0.897 -7.167 1.00 . A A . 8 TYR CB 1 1 4 1533 1 1 8 TYR CD1 C -5.017 0.841 -6.914 1.00 . A A . 8 TYR CD1 1 1 4 1534 1 1 8 TYR CD2 C -5.652 -1.456 -6.915 1.00 . A A . 8 TYR CD2 1 1 4 1535 1 1 8 TYR CE1 C -6.339 1.211 -6.757 1.00 . A A . 8 TYR CE1 1 1 4 1536 1 1 8 TYR CE2 C -6.976 -1.095 -6.758 1.00 . A A . 8 TYR CE2 1 1 4 1537 1 1 8 TYR CG C -4.651 -0.497 -6.995 1.00 . A A . 8 TYR CG 1 1 4 1538 1 1 8 TYR CZ C -7.314 0.240 -6.680 1.00 . A A . 8 TYR CZ 1 1 4 1539 1 1 8 TYR H H -0.432 -1.432 -5.947 1.00 . A A . 8 TYR H 1 1 4 1540 1 1 8 TYR HA H -2.408 0.634 -5.876 1.00 . A A . 8 TYR HA 1 1 4 1541 1 1 8 TYR HB2 H -2.852 -0.477 -8.099 1.00 . A A . 8 TYR HB2 1 1 4 1542 1 1 8 TYR HB3 H -3.159 -1.975 -7.230 1.00 . A A . 8 TYR HB3 1 1 4 1543 1 1 8 TYR HD1 H -4.250 1.599 -6.975 1.00 . A A . 8 TYR HD1 1 1 4 1544 1 1 8 TYR HD2 H -5.384 -2.501 -6.975 1.00 . A A . 8 TYR HD2 1 1 4 1545 1 1 8 TYR HE1 H -6.603 2.256 -6.696 1.00 . A A . 8 TYR HE1 1 1 4 1546 1 1 8 TYR HE2 H -7.740 -1.856 -6.698 1.00 . A A . 8 TYR HE2 1 1 4 1547 1 1 8 TYR HH H -8.690 1.559 -6.422 1.00 . A A . 8 TYR HH 1 1 4 1548 1 1 8 TYR N N -0.892 -0.677 -6.370 1.00 . A A . 8 TYR N 1 1 4 1549 1 1 8 TYR O O -2.253 -2.337 -4.593 1.00 . A A . 8 TYR O 1 1 4 1550 1 1 8 TYR OH O -8.632 0.605 -6.524 1.00 . A A . 8 TYR OH 1 1 4 1551 1 1 9 CYS C C -4.896 -0.534 -1.980 1.00 . A A . 9 CYS C 1 1 4 1552 1 1 9 CYS CA C -3.617 -1.124 -2.558 1.00 . A A . 9 CYS CA 1 1 4 1553 1 1 9 CYS CB C -2.457 -0.987 -1.564 1.00 . A A . 9 CYS CB 1 1 4 1554 1 1 9 CYS H H -3.525 0.437 -3.986 1.00 . A A . 9 CYS H 1 1 4 1555 1 1 9 CYS HA H -3.783 -2.173 -2.750 1.00 . A A . 9 CYS HA 1 1 4 1556 1 1 9 CYS HB2 H -2.795 -1.295 -0.586 1.00 . A A . 9 CYS HB2 1 1 4 1557 1 1 9 CYS HB3 H -1.649 -1.632 -1.877 1.00 . A A . 9 CYS HB3 1 1 4 1558 1 1 9 CYS N N -3.273 -0.500 -3.823 1.00 . A A . 9 CYS N 1 1 4 1559 1 1 9 CYS O O -5.055 0.681 -1.893 1.00 . A A . 9 CYS O 1 1 4 1560 1 1 9 CYS SG S -1.790 0.703 -1.407 1.00 . A A . 9 CYS SG 1 1 4 1561 1 1 10 ILE C C -7.384 -1.896 0.198 1.00 . A A . 10 ILE C 1 1 4 1562 1 1 10 ILE CA C -7.087 -1.029 -1.020 1.00 . A A . 10 ILE CA 1 1 4 1563 1 1 10 ILE CB C -8.238 -1.163 -2.044 1.00 . A A . 10 ILE CB 1 1 4 1564 1 1 10 ILE CD1 C -9.318 -2.760 -3.721 1.00 . A A . 10 ILE CD1 1 1 4 1565 1 1 10 ILE CG1 C -8.178 -2.524 -2.752 1.00 . A A . 10 ILE CG1 1 1 4 1566 1 1 10 ILE CG2 C -8.185 -0.026 -3.054 1.00 . A A . 10 ILE CG2 1 1 4 1567 1 1 10 ILE H H -5.611 -2.371 -1.700 1.00 . A A . 10 ILE H 1 1 4 1568 1 1 10 ILE HA H -7.018 0.005 -0.709 1.00 . A A . 10 ILE HA 1 1 4 1569 1 1 10 ILE HB H -9.173 -1.087 -1.509 1.00 . A A . 10 ILE HB 1 1 4 1570 1 1 10 ILE HD11 H -9.973 -3.523 -3.327 1.00 . A A . 10 ILE HD11 1 1 4 1571 1 1 10 ILE HD12 H -8.920 -3.082 -4.672 1.00 . A A . 10 ILE HD12 1 1 4 1572 1 1 10 ILE HD13 H -9.872 -1.843 -3.854 1.00 . A A . 10 ILE HD13 1 1 4 1573 1 1 10 ILE HG12 H -7.255 -2.592 -3.306 1.00 . A A . 10 ILE HG12 1 1 4 1574 1 1 10 ILE HG13 H -8.205 -3.308 -2.009 1.00 . A A . 10 ILE HG13 1 1 4 1575 1 1 10 ILE HG21 H -8.234 0.919 -2.535 1.00 . A A . 10 ILE HG21 1 1 4 1576 1 1 10 ILE HG22 H -9.022 -0.109 -3.732 1.00 . A A . 10 ILE HG22 1 1 4 1577 1 1 10 ILE HG23 H -7.262 -0.084 -3.612 1.00 . A A . 10 ILE HG23 1 1 4 1578 1 1 10 ILE N N -5.805 -1.418 -1.593 1.00 . A A . 10 ILE N 1 1 4 1579 1 1 10 ILE O O -8.465 -2.465 0.335 1.00 . A A . 10 ILE O 1 1 4 1580 1 1 11 VAL C C -7.505 -2.200 3.264 1.00 . A A . 11 VAL C 1 1 4 1581 1 1 11 VAL CA C -6.509 -2.807 2.276 1.00 . A A . 11 VAL CA 1 1 4 1582 1 1 11 VAL CB C -5.134 -2.991 2.960 1.00 . A A . 11 VAL CB 1 1 4 1583 1 1 11 VAL CG1 C -4.180 -3.730 2.038 1.00 . A A . 11 VAL CG1 1 1 4 1584 1 1 11 VAL CG2 C -4.538 -1.652 3.375 1.00 . A A . 11 VAL CG2 1 1 4 1585 1 1 11 VAL H H -5.555 -1.529 0.894 1.00 . A A . 11 VAL H 1 1 4 1586 1 1 11 VAL HA H -6.868 -3.783 1.982 1.00 . A A . 11 VAL HA 1 1 4 1587 1 1 11 VAL HB H -5.276 -3.589 3.849 1.00 . A A . 11 VAL HB 1 1 4 1588 1 1 11 VAL HG11 H -4.438 -4.778 2.018 1.00 . A A . 11 VAL HG11 1 1 4 1589 1 1 11 VAL HG12 H -3.169 -3.616 2.400 1.00 . A A . 11 VAL HG12 1 1 4 1590 1 1 11 VAL HG13 H -4.255 -3.322 1.041 1.00 . A A . 11 VAL HG13 1 1 4 1591 1 1 11 VAL HG21 H -4.374 -1.044 2.497 1.00 . A A . 11 VAL HG21 1 1 4 1592 1 1 11 VAL HG22 H -3.598 -1.817 3.880 1.00 . A A . 11 VAL HG22 1 1 4 1593 1 1 11 VAL HG23 H -5.220 -1.145 4.041 1.00 . A A . 11 VAL HG23 1 1 4 1594 1 1 11 VAL N N -6.392 -2.002 1.070 1.00 . A A . 11 VAL N 1 1 4 1595 1 1 11 VAL O O -7.507 -0.991 3.499 1.00 . A A . 11 VAL O 1 1 4 1596 1 1 12 PRO C C -8.782 -2.286 6.182 1.00 . A A . 12 PRO C 1 1 4 1597 1 1 12 PRO CA C -9.382 -2.583 4.806 1.00 . A A . 12 PRO CA 1 1 4 1598 1 1 12 PRO CB C -10.348 -3.765 4.883 1.00 . A A . 12 PRO CB 1 1 4 1599 1 1 12 PRO CD C -8.458 -4.488 3.603 1.00 . A A . 12 PRO CD 1 1 4 1600 1 1 12 PRO CG C -9.510 -4.956 4.573 1.00 . A A . 12 PRO CG 1 1 4 1601 1 1 12 PRO HA H -9.906 -1.709 4.449 1.00 . A A . 12 PRO HA 1 1 4 1602 1 1 12 PRO HB2 H -10.769 -3.825 5.876 1.00 . A A . 12 PRO HB2 1 1 4 1603 1 1 12 PRO HB3 H -11.137 -3.637 4.157 1.00 . A A . 12 PRO HB3 1 1 4 1604 1 1 12 PRO HD2 H -7.512 -4.965 3.814 1.00 . A A . 12 PRO HD2 1 1 4 1605 1 1 12 PRO HD3 H -8.764 -4.692 2.587 1.00 . A A . 12 PRO HD3 1 1 4 1606 1 1 12 PRO HG2 H -9.048 -5.325 5.476 1.00 . A A . 12 PRO HG2 1 1 4 1607 1 1 12 PRO HG3 H -10.119 -5.724 4.121 1.00 . A A . 12 PRO HG3 1 1 4 1608 1 1 12 PRO N N -8.377 -3.036 3.847 1.00 . A A . 12 PRO N 1 1 4 1609 1 1 12 PRO O O -7.571 -2.122 6.325 1.00 . A A . 12 PRO O 1 1 4 1610 1 1 13 ILE C C -8.209 -2.965 9.080 1.00 . A A . 13 ILE C 1 1 4 1611 1 1 13 ILE CA C -9.222 -1.942 8.561 1.00 . A A . 13 ILE CA 1 1 4 1612 1 1 13 ILE CB C -10.429 -1.885 9.525 1.00 . A A . 13 ILE CB 1 1 4 1613 1 1 13 ILE CD1 C -12.411 -3.228 10.415 1.00 . A A . 13 ILE CD1 1 1 4 1614 1 1 13 ILE CG1 C -11.267 -3.166 9.424 1.00 . A A . 13 ILE CG1 1 1 4 1615 1 1 13 ILE CG2 C -11.282 -0.659 9.225 1.00 . A A . 13 ILE CG2 1 1 4 1616 1 1 13 ILE H H -10.594 -2.365 7.007 1.00 . A A . 13 ILE H 1 1 4 1617 1 1 13 ILE HA H -8.753 -0.969 8.562 1.00 . A A . 13 ILE HA 1 1 4 1618 1 1 13 ILE HB H -10.050 -1.790 10.531 1.00 . A A . 13 ILE HB 1 1 4 1619 1 1 13 ILE HD11 H -12.015 -3.326 11.415 1.00 . A A . 13 ILE HD11 1 1 4 1620 1 1 13 ILE HD12 H -13.036 -4.079 10.191 1.00 . A A . 13 ILE HD12 1 1 4 1621 1 1 13 ILE HD13 H -12.996 -2.322 10.346 1.00 . A A . 13 ILE HD13 1 1 4 1622 1 1 13 ILE HG12 H -11.687 -3.236 8.432 1.00 . A A . 13 ILE HG12 1 1 4 1623 1 1 13 ILE HG13 H -10.628 -4.020 9.599 1.00 . A A . 13 ILE HG13 1 1 4 1624 1 1 13 ILE HG21 H -11.171 -0.389 8.185 1.00 . A A . 13 ILE HG21 1 1 4 1625 1 1 13 ILE HG22 H -10.959 0.164 9.847 1.00 . A A . 13 ILE HG22 1 1 4 1626 1 1 13 ILE HG23 H -12.317 -0.882 9.432 1.00 . A A . 13 ILE HG23 1 1 4 1627 1 1 13 ILE N N -9.644 -2.224 7.191 1.00 . A A . 13 ILE N 1 1 4 1628 1 1 13 ILE O O -7.310 -2.621 9.841 1.00 . A A . 13 ILE O 1 1 4 1629 1 1 14 LEU C C -6.352 -5.512 8.082 1.00 . A A . 14 LEU C 1 1 4 1630 1 1 14 LEU CA C -7.454 -5.273 9.110 1.00 . A A . 14 LEU CA 1 1 4 1631 1 1 14 LEU CB C -8.232 -6.569 9.354 1.00 . A A . 14 LEU CB 1 1 4 1632 1 1 14 LEU CD1 C -10.072 -7.802 10.530 1.00 . A A . 14 LEU CD1 1 1 4 1633 1 1 14 LEU CD2 C -8.736 -6.088 11.766 1.00 . A A . 14 LEU CD2 1 1 4 1634 1 1 14 LEU CG C -9.328 -6.480 10.420 1.00 . A A . 14 LEU CG 1 1 4 1635 1 1 14 LEU H H -9.095 -4.439 8.065 1.00 . A A . 14 LEU H 1 1 4 1636 1 1 14 LEU HA H -7.002 -4.956 10.037 1.00 . A A . 14 LEU HA 1 1 4 1637 1 1 14 LEU HB2 H -8.689 -6.870 8.423 1.00 . A A . 14 LEU HB2 1 1 4 1638 1 1 14 LEU HB3 H -7.532 -7.333 9.655 1.00 . A A . 14 LEU HB3 1 1 4 1639 1 1 14 LEU HD11 H -11.069 -7.688 10.132 1.00 . A A . 14 LEU HD11 1 1 4 1640 1 1 14 LEU HD12 H -10.129 -8.097 11.568 1.00 . A A . 14 LEU HD12 1 1 4 1641 1 1 14 LEU HD13 H -9.545 -8.559 9.969 1.00 . A A . 14 LEU HD13 1 1 4 1642 1 1 14 LEU HD21 H -8.307 -6.960 12.238 1.00 . A A . 14 LEU HD21 1 1 4 1643 1 1 14 LEU HD22 H -9.514 -5.683 12.397 1.00 . A A . 14 LEU HD22 1 1 4 1644 1 1 14 LEU HD23 H -7.968 -5.343 11.618 1.00 . A A . 14 LEU HD23 1 1 4 1645 1 1 14 LEU HG H -10.041 -5.720 10.132 1.00 . A A . 14 LEU HG 1 1 4 1646 1 1 14 LEU N N -8.361 -4.218 8.671 1.00 . A A . 14 LEU N 1 1 4 1647 1 1 14 LEU O O -5.669 -6.535 8.122 1.00 . A A . 14 LEU O 1 1 4 1648 1 1 15 GLY C C -5.399 -5.874 5.228 1.00 . A A . 15 GLY C 1 1 4 1649 1 1 15 GLY CA C -5.167 -4.682 6.140 1.00 . A A . 15 GLY CA 1 1 4 1650 1 1 15 GLY H H -6.759 -3.766 7.191 1.00 . A A . 15 GLY H 1 1 4 1651 1 1 15 GLY HA2 H -5.165 -3.782 5.544 1.00 . A A . 15 GLY HA2 1 1 4 1652 1 1 15 GLY HA3 H -4.204 -4.790 6.614 1.00 . A A . 15 GLY HA3 1 1 4 1653 1 1 15 GLY N N -6.184 -4.562 7.167 1.00 . A A . 15 GLY N 1 1 4 1654 1 1 15 GLY O O -6.522 -6.370 5.125 1.00 . A A . 15 GLY O 1 1 4 1655 1 1 16 PHE C C -3.028 -7.676 3.017 1.00 . A A . 16 PHE C 1 1 4 1656 1 1 16 PHE CA C -4.389 -7.478 3.671 1.00 . A A . 16 PHE CA 1 1 4 1657 1 1 16 PHE CB C -5.455 -7.273 2.586 1.00 . A A . 16 PHE CB 1 1 4 1658 1 1 16 PHE CD1 C -5.868 -9.737 2.323 1.00 . A A . 16 PHE CD1 1 1 4 1659 1 1 16 PHE CD2 C -5.766 -8.389 0.357 1.00 . A A . 16 PHE CD2 1 1 4 1660 1 1 16 PHE CE1 C -6.094 -10.857 1.546 1.00 . A A . 16 PHE CE1 1 1 4 1661 1 1 16 PHE CE2 C -5.992 -9.506 -0.424 1.00 . A A . 16 PHE CE2 1 1 4 1662 1 1 16 PHE CG C -5.701 -8.491 1.738 1.00 . A A . 16 PHE CG 1 1 4 1663 1 1 16 PHE CZ C -6.156 -10.742 0.171 1.00 . A A . 16 PHE CZ 1 1 4 1664 1 1 16 PHE H H -3.469 -5.891 4.724 1.00 . A A . 16 PHE H 1 1 4 1665 1 1 16 PHE HA H -4.632 -8.355 4.252 1.00 . A A . 16 PHE HA 1 1 4 1666 1 1 16 PHE HB2 H -6.389 -7.003 3.056 1.00 . A A . 16 PHE HB2 1 1 4 1667 1 1 16 PHE HB3 H -5.143 -6.471 1.932 1.00 . A A . 16 PHE HB3 1 1 4 1668 1 1 16 PHE HD1 H -5.820 -9.829 3.398 1.00 . A A . 16 PHE HD1 1 1 4 1669 1 1 16 PHE HD2 H -5.638 -7.423 -0.109 1.00 . A A . 16 PHE HD2 1 1 4 1670 1 1 16 PHE HE1 H -6.222 -11.822 2.014 1.00 . A A . 16 PHE HE1 1 1 4 1671 1 1 16 PHE HE2 H -6.040 -9.413 -1.498 1.00 . A A . 16 PHE HE2 1 1 4 1672 1 1 16 PHE HZ H -6.333 -11.616 -0.437 1.00 . A A . 16 PHE HZ 1 1 4 1673 1 1 16 PHE N N -4.331 -6.332 4.579 1.00 . A A . 16 PHE N 1 1 4 1674 1 1 16 PHE O O -2.467 -8.771 3.026 1.00 . A A . 16 PHE O 1 1 4 1675 1 1 17 VAL C C -0.265 -5.647 2.521 1.00 . A A . 17 VAL C 1 1 4 1676 1 1 17 VAL CA C -1.196 -6.625 1.813 1.00 . A A . 17 VAL CA 1 1 4 1677 1 1 17 VAL CB C -1.283 -6.255 0.310 1.00 . A A . 17 VAL CB 1 1 4 1678 1 1 17 VAL CG1 C -0.187 -6.955 -0.485 1.00 . A A . 17 VAL CG1 1 1 4 1679 1 1 17 VAL CG2 C -2.653 -6.588 -0.265 1.00 . A A . 17 VAL CG2 1 1 4 1680 1 1 17 VAL H H -2.988 -5.752 2.501 1.00 . A A . 17 VAL H 1 1 4 1681 1 1 17 VAL HA H -0.794 -7.623 1.901 1.00 . A A . 17 VAL HA 1 1 4 1682 1 1 17 VAL HB H -1.129 -5.190 0.218 1.00 . A A . 17 VAL HB 1 1 4 1683 1 1 17 VAL HG11 H -0.629 -7.705 -1.123 1.00 . A A . 17 VAL HG11 1 1 4 1684 1 1 17 VAL HG12 H 0.506 -7.424 0.197 1.00 . A A . 17 VAL HG12 1 1 4 1685 1 1 17 VAL HG13 H 0.337 -6.231 -1.090 1.00 . A A . 17 VAL HG13 1 1 4 1686 1 1 17 VAL HG21 H -3.127 -5.683 -0.615 1.00 . A A . 17 VAL HG21 1 1 4 1687 1 1 17 VAL HG22 H -3.264 -7.041 0.502 1.00 . A A . 17 VAL HG22 1 1 4 1688 1 1 17 VAL HG23 H -2.540 -7.277 -1.089 1.00 . A A . 17 VAL HG23 1 1 4 1689 1 1 17 VAL N N -2.498 -6.596 2.461 1.00 . A A . 17 VAL N 1 1 4 1690 1 1 17 VAL O O -0.635 -5.064 3.541 1.00 . A A . 17 VAL O 1 1 4 1691 1 1 18 TYR C C 2.986 -4.227 1.538 1.00 . A A . 18 TYR C 1 1 4 1692 1 1 18 TYR CA C 1.912 -4.563 2.563 1.00 . A A . 18 TYR CA 1 1 4 1693 1 1 18 TYR CB C 2.546 -5.199 3.812 1.00 . A A . 18 TYR CB 1 1 4 1694 1 1 18 TYR CD1 C 4.456 -6.682 3.055 1.00 . A A . 18 TYR CD1 1 1 4 1695 1 1 18 TYR CD2 C 2.452 -7.726 3.816 1.00 . A A . 18 TYR CD2 1 1 4 1696 1 1 18 TYR CE1 C 5.012 -7.922 2.807 1.00 . A A . 18 TYR CE1 1 1 4 1697 1 1 18 TYR CE2 C 3.003 -8.969 3.575 1.00 . A A . 18 TYR CE2 1 1 4 1698 1 1 18 TYR CG C 3.167 -6.562 3.562 1.00 . A A . 18 TYR CG 1 1 4 1699 1 1 18 TYR CZ C 4.282 -9.061 3.070 1.00 . A A . 18 TYR CZ 1 1 4 1700 1 1 18 TYR H H 1.162 -5.955 1.163 1.00 . A A . 18 TYR H 1 1 4 1701 1 1 18 TYR HA H 1.402 -3.654 2.848 1.00 . A A . 18 TYR HA 1 1 4 1702 1 1 18 TYR HB2 H 3.321 -4.547 4.184 1.00 . A A . 18 TYR HB2 1 1 4 1703 1 1 18 TYR HB3 H 1.786 -5.315 4.572 1.00 . A A . 18 TYR HB3 1 1 4 1704 1 1 18 TYR HD1 H 5.026 -5.788 2.852 1.00 . A A . 18 TYR HD1 1 1 4 1705 1 1 18 TYR HD2 H 1.450 -7.651 4.211 1.00 . A A . 18 TYR HD2 1 1 4 1706 1 1 18 TYR HE1 H 6.014 -7.995 2.413 1.00 . A A . 18 TYR HE1 1 1 4 1707 1 1 18 TYR HE2 H 2.433 -9.861 3.780 1.00 . A A . 18 TYR HE2 1 1 4 1708 1 1 18 TYR HH H 5.318 -10.600 3.591 1.00 . A A . 18 TYR HH 1 1 4 1709 1 1 18 TYR N N 0.929 -5.465 1.980 1.00 . A A . 18 TYR N 1 1 4 1710 1 1 18 TYR O O 3.330 -5.057 0.703 1.00 . A A . 18 TYR O 1 1 4 1711 1 1 18 TYR OH O 4.829 -10.301 2.812 1.00 . A A . 18 TYR OH 1 1 4 1712 1 1 19 CYS C C 5.899 -3.129 1.060 1.00 . A A . 19 CYS C 1 1 4 1713 1 1 19 CYS CA C 4.540 -2.572 0.674 1.00 . A A . 19 CYS CA 1 1 4 1714 1 1 19 CYS CB C 4.621 -1.063 0.693 1.00 . A A . 19 CYS CB 1 1 4 1715 1 1 19 CYS H H 3.176 -2.383 2.281 1.00 . A A . 19 CYS H 1 1 4 1716 1 1 19 CYS HA H 4.281 -2.904 -0.319 1.00 . A A . 19 CYS HA 1 1 4 1717 1 1 19 CYS HB2 H 4.681 -0.753 1.720 1.00 . A A . 19 CYS HB2 1 1 4 1718 1 1 19 CYS HB3 H 5.519 -0.737 0.174 1.00 . A A . 19 CYS HB3 1 1 4 1719 1 1 19 CYS N N 3.501 -3.012 1.598 1.00 . A A . 19 CYS N 1 1 4 1720 1 1 19 CYS O O 6.080 -3.646 2.164 1.00 . A A . 19 CYS O 1 1 4 1721 1 1 19 CYS SG S 3.191 -0.227 -0.052 1.00 . A A . 19 CYS SG 1 1 4 1722 1 1 20 CYS C C 8.837 -2.541 1.453 1.00 . A A . 20 CYS C 1 1 4 1723 1 1 20 CYS CA C 8.214 -3.451 0.412 1.00 . A A . 20 CYS CA 1 1 4 1724 1 1 20 CYS CB C 9.048 -3.426 -0.866 1.00 . A A . 20 CYS CB 1 1 4 1725 1 1 20 CYS H H 6.656 -2.555 -0.699 1.00 . A A . 20 CYS H 1 1 4 1726 1 1 20 CYS HA H 8.168 -4.461 0.797 1.00 . A A . 20 CYS HA 1 1 4 1727 1 1 20 CYS HB2 H 9.234 -2.400 -1.136 1.00 . A A . 20 CYS HB2 1 1 4 1728 1 1 20 CYS HB3 H 9.992 -3.915 -0.675 1.00 . A A . 20 CYS HB3 1 1 4 1729 1 1 20 CYS N N 6.858 -2.995 0.154 1.00 . A A . 20 CYS N 1 1 4 1730 1 1 20 CYS O O 8.435 -1.383 1.573 1.00 . A A . 20 CYS O 1 1 4 1731 1 1 20 CYS SG S 8.265 -4.258 -2.292 1.00 . A A . 20 CYS SG 1 1 4 1732 1 1 21 PRO C C 10.969 -0.921 2.716 1.00 . A A . 21 PRO C 1 1 4 1733 1 1 21 PRO CA C 10.450 -2.238 3.261 1.00 . A A . 21 PRO CA 1 1 4 1734 1 1 21 PRO CB C 11.595 -3.111 3.747 1.00 . A A . 21 PRO CB 1 1 4 1735 1 1 21 PRO CD C 10.346 -4.406 2.174 1.00 . A A . 21 PRO CD 1 1 4 1736 1 1 21 PRO CG C 11.158 -4.504 3.438 1.00 . A A . 21 PRO CG 1 1 4 1737 1 1 21 PRO HA H 9.774 -2.039 4.080 1.00 . A A . 21 PRO HA 1 1 4 1738 1 1 21 PRO HB2 H 12.502 -2.849 3.222 1.00 . A A . 21 PRO HB2 1 1 4 1739 1 1 21 PRO HB3 H 11.722 -2.957 4.805 1.00 . A A . 21 PRO HB3 1 1 4 1740 1 1 21 PRO HD2 H 10.976 -4.535 1.307 1.00 . A A . 21 PRO HD2 1 1 4 1741 1 1 21 PRO HD3 H 9.548 -5.131 2.171 1.00 . A A . 21 PRO HD3 1 1 4 1742 1 1 21 PRO HG2 H 12.022 -5.134 3.282 1.00 . A A . 21 PRO HG2 1 1 4 1743 1 1 21 PRO HG3 H 10.551 -4.888 4.245 1.00 . A A . 21 PRO HG3 1 1 4 1744 1 1 21 PRO N N 9.808 -3.038 2.229 1.00 . A A . 21 PRO N 1 1 4 1745 1 1 21 PRO O O 11.848 -0.881 1.856 1.00 . A A . 21 PRO O 1 1 4 1746 1 1 22 GLY C C 9.559 2.225 2.212 1.00 . A A . 22 GLY C 1 1 4 1747 1 1 22 GLY CA C 10.743 1.472 2.783 1.00 . A A . 22 GLY CA 1 1 4 1748 1 1 22 GLY H H 9.680 0.015 3.877 1.00 . A A . 22 GLY H 1 1 4 1749 1 1 22 GLY HA2 H 11.134 2.019 3.627 1.00 . A A . 22 GLY HA2 1 1 4 1750 1 1 22 GLY HA3 H 11.509 1.400 2.025 1.00 . A A . 22 GLY HA3 1 1 4 1751 1 1 22 GLY N N 10.383 0.141 3.215 1.00 . A A . 22 GLY N 1 1 4 1752 1 1 22 GLY O O 9.481 3.445 2.332 1.00 . A A . 22 GLY O 1 1 4 1753 1 1 23 LEU C C 6.230 1.823 1.866 1.00 . A A . 23 LEU C 1 1 4 1754 1 1 23 LEU CA C 7.454 2.102 0.999 1.00 . A A . 23 LEU CA 1 1 4 1755 1 1 23 LEU CB C 7.246 1.541 -0.409 1.00 . A A . 23 LEU CB 1 1 4 1756 1 1 23 LEU CD1 C 8.214 0.904 -2.630 1.00 . A A . 23 LEU CD1 1 1 4 1757 1 1 23 LEU CD2 C 8.704 3.155 -1.660 1.00 . A A . 23 LEU CD2 1 1 4 1758 1 1 23 LEU CG C 8.445 1.687 -1.349 1.00 . A A . 23 LEU CG 1 1 4 1759 1 1 23 LEU H H 8.743 0.521 1.530 1.00 . A A . 23 LEU H 1 1 4 1760 1 1 23 LEU HA H 7.613 3.168 0.940 1.00 . A A . 23 LEU HA 1 1 4 1761 1 1 23 LEU HB2 H 7.007 0.491 -0.323 1.00 . A A . 23 LEU HB2 1 1 4 1762 1 1 23 LEU HB3 H 6.404 2.049 -0.854 1.00 . A A . 23 LEU HB3 1 1 4 1763 1 1 23 LEU HD11 H 9.008 1.116 -3.331 1.00 . A A . 23 LEU HD11 1 1 4 1764 1 1 23 LEU HD12 H 7.266 1.192 -3.063 1.00 . A A . 23 LEU HD12 1 1 4 1765 1 1 23 LEU HD13 H 8.202 -0.152 -2.409 1.00 . A A . 23 LEU HD13 1 1 4 1766 1 1 23 LEU HD21 H 8.527 3.337 -2.709 1.00 . A A . 23 LEU HD21 1 1 4 1767 1 1 23 LEU HD22 H 9.728 3.397 -1.420 1.00 . A A . 23 LEU HD22 1 1 4 1768 1 1 23 LEU HD23 H 8.041 3.771 -1.070 1.00 . A A . 23 LEU HD23 1 1 4 1769 1 1 23 LEU HG H 9.324 1.286 -0.866 1.00 . A A . 23 LEU HG 1 1 4 1770 1 1 23 LEU N N 8.634 1.497 1.592 1.00 . A A . 23 LEU N 1 1 4 1771 1 1 23 LEU O O 6.166 0.792 2.541 1.00 . A A . 23 LEU O 1 1 4 1772 1 1 24 ILE C C 2.797 2.893 1.833 1.00 . A A . 24 ILE C 1 1 4 1773 1 1 24 ILE CA C 4.051 2.560 2.645 1.00 . A A . 24 ILE CA 1 1 4 1774 1 1 24 ILE CB C 4.050 3.412 3.947 1.00 . A A . 24 ILE CB 1 1 4 1775 1 1 24 ILE CD1 C 5.673 5.328 3.359 1.00 . A A . 24 ILE CD1 1 1 4 1776 1 1 24 ILE CG1 C 4.243 4.914 3.658 1.00 . A A . 24 ILE CG1 1 1 4 1777 1 1 24 ILE CG2 C 5.112 2.909 4.919 1.00 . A A . 24 ILE CG2 1 1 4 1778 1 1 24 ILE H H 5.369 3.541 1.290 1.00 . A A . 24 ILE H 1 1 4 1779 1 1 24 ILE HA H 4.001 1.520 2.932 1.00 . A A . 24 ILE HA 1 1 4 1780 1 1 24 ILE HB H 3.090 3.274 4.422 1.00 . A A . 24 ILE HB 1 1 4 1781 1 1 24 ILE HD11 H 6.176 5.580 4.281 1.00 . A A . 24 ILE HD11 1 1 4 1782 1 1 24 ILE HD12 H 5.670 6.188 2.705 1.00 . A A . 24 ILE HD12 1 1 4 1783 1 1 24 ILE HD13 H 6.191 4.511 2.877 1.00 . A A . 24 ILE HD13 1 1 4 1784 1 1 24 ILE HG12 H 3.642 5.186 2.805 1.00 . A A . 24 ILE HG12 1 1 4 1785 1 1 24 ILE HG13 H 3.910 5.480 4.516 1.00 . A A . 24 ILE HG13 1 1 4 1786 1 1 24 ILE HG21 H 6.087 2.996 4.464 1.00 . A A . 24 ILE HG21 1 1 4 1787 1 1 24 ILE HG22 H 4.918 1.874 5.159 1.00 . A A . 24 ILE HG22 1 1 4 1788 1 1 24 ILE HG23 H 5.081 3.500 5.822 1.00 . A A . 24 ILE HG23 1 1 4 1789 1 1 24 ILE N N 5.265 2.732 1.851 1.00 . A A . 24 ILE N 1 1 4 1790 1 1 24 ILE O O 2.727 3.925 1.169 1.00 . A A . 24 ILE O 1 1 4 1791 1 1 25 CYS C C -0.207 3.403 1.715 1.00 . A A . 25 CYS C 1 1 4 1792 1 1 25 CYS CA C 0.552 2.195 1.165 1.00 . A A . 25 CYS CA 1 1 4 1793 1 1 25 CYS CB C -0.320 0.936 1.258 1.00 . A A . 25 CYS CB 1 1 4 1794 1 1 25 CYS H H 1.931 1.186 2.427 1.00 . A A . 25 CYS H 1 1 4 1795 1 1 25 CYS HA H 0.792 2.378 0.129 1.00 . A A . 25 CYS HA 1 1 4 1796 1 1 25 CYS HB2 H 0.163 0.133 0.722 1.00 . A A . 25 CYS HB2 1 1 4 1797 1 1 25 CYS HB3 H -0.421 0.657 2.297 1.00 . A A . 25 CYS HB3 1 1 4 1798 1 1 25 CYS N N 1.810 2.000 1.888 1.00 . A A . 25 CYS N 1 1 4 1799 1 1 25 CYS O O -0.228 3.630 2.926 1.00 . A A . 25 CYS O 1 1 4 1800 1 1 25 CYS SG S -2.000 1.127 0.568 1.00 . A A . 25 CYS SG 1 1 4 1801 1 1 26 GLY C C -2.799 5.603 0.408 1.00 . A A . 26 GLY C 1 1 4 1802 1 1 26 GLY CA C -1.550 5.355 1.241 1.00 . A A . 26 GLY CA 1 1 4 1803 1 1 26 GLY H H -0.755 3.954 -0.131 1.00 . A A . 26 GLY H 1 1 4 1804 1 1 26 GLY HA2 H -1.841 5.235 2.274 1.00 . A A . 26 GLY HA2 1 1 4 1805 1 1 26 GLY HA3 H -0.902 6.216 1.159 1.00 . A A . 26 GLY HA3 1 1 4 1806 1 1 26 GLY N N -0.815 4.179 0.824 1.00 . A A . 26 GLY N 1 1 4 1807 1 1 26 GLY O O -3.802 4.912 0.573 1.00 . A A . 26 GLY O 1 1 4 1808 1 1 27 PRO C C -4.213 5.949 -2.444 1.00 . A A . 27 PRO C 1 1 4 1809 1 1 27 PRO CA C -3.921 6.968 -1.341 1.00 . A A . 27 PRO CA 1 1 4 1810 1 1 27 PRO CB C -3.504 8.311 -1.944 1.00 . A A . 27 PRO CB 1 1 4 1811 1 1 27 PRO CD C -1.615 7.491 -0.728 1.00 . A A . 27 PRO CD 1 1 4 1812 1 1 27 PRO CG C -2.015 8.282 -1.943 1.00 . A A . 27 PRO CG 1 1 4 1813 1 1 27 PRO HA H -4.812 7.102 -0.748 1.00 . A A . 27 PRO HA 1 1 4 1814 1 1 27 PRO HB2 H -3.898 8.396 -2.946 1.00 . A A . 27 PRO HB2 1 1 4 1815 1 1 27 PRO HB3 H -3.883 9.116 -1.333 1.00 . A A . 27 PRO HB3 1 1 4 1816 1 1 27 PRO HD2 H -0.725 6.913 -0.931 1.00 . A A . 27 PRO HD2 1 1 4 1817 1 1 27 PRO HD3 H -1.453 8.149 0.114 1.00 . A A . 27 PRO HD3 1 1 4 1818 1 1 27 PRO HG2 H -1.657 7.798 -2.840 1.00 . A A . 27 PRO HG2 1 1 4 1819 1 1 27 PRO HG3 H -1.629 9.288 -1.878 1.00 . A A . 27 PRO HG3 1 1 4 1820 1 1 27 PRO N N -2.771 6.608 -0.489 1.00 . A A . 27 PRO N 1 1 4 1821 1 1 27 PRO O O -4.151 6.268 -3.632 1.00 . A A . 27 PRO O 1 1 4 1822 1 1 28 PHE C C -3.595 3.212 -3.735 1.00 . A A . 28 PHE C 1 1 4 1823 1 1 28 PHE CA C -4.832 3.614 -2.931 1.00 . A A . 28 PHE CA 1 1 4 1824 1 1 28 PHE CB C -6.029 3.935 -3.867 1.00 . A A . 28 PHE CB 1 1 4 1825 1 1 28 PHE CD1 C -7.515 4.464 -1.896 1.00 . A A . 28 PHE CD1 1 1 4 1826 1 1 28 PHE CD2 C -8.488 3.432 -3.813 1.00 . A A . 28 PHE CD2 1 1 4 1827 1 1 28 PHE CE1 C -8.746 4.471 -1.271 1.00 . A A . 28 PHE CE1 1 1 4 1828 1 1 28 PHE CE2 C -9.722 3.436 -3.191 1.00 . A A . 28 PHE CE2 1 1 4 1829 1 1 28 PHE CG C -7.369 3.945 -3.175 1.00 . A A . 28 PHE CG 1 1 4 1830 1 1 28 PHE CZ C -9.851 3.956 -1.918 1.00 . A A . 28 PHE CZ 1 1 4 1831 1 1 28 PHE H H -4.539 4.561 -1.058 1.00 . A A . 28 PHE H 1 1 4 1832 1 1 28 PHE HA H -5.106 2.772 -2.309 1.00 . A A . 28 PHE HA 1 1 4 1833 1 1 28 PHE HB2 H -5.892 4.908 -4.317 1.00 . A A . 28 PHE HB2 1 1 4 1834 1 1 28 PHE HB3 H -6.075 3.189 -4.651 1.00 . A A . 28 PHE HB3 1 1 4 1835 1 1 28 PHE HD1 H -6.651 4.867 -1.388 1.00 . A A . 28 PHE HD1 1 1 4 1836 1 1 28 PHE HD2 H -8.389 3.025 -4.808 1.00 . A A . 28 PHE HD2 1 1 4 1837 1 1 28 PHE HE1 H -8.845 4.878 -0.275 1.00 . A A . 28 PHE HE1 1 1 4 1838 1 1 28 PHE HE2 H -10.585 3.034 -3.701 1.00 . A A . 28 PHE HE2 1 1 4 1839 1 1 28 PHE HZ H -10.815 3.960 -1.431 1.00 . A A . 28 PHE HZ 1 1 4 1840 1 1 28 PHE N N -4.523 4.727 -2.026 1.00 . A A . 28 PHE N 1 1 4 1841 1 1 28 PHE O O -3.679 2.413 -4.666 1.00 . A A . 28 PHE O 1 1 4 1842 1 1 29 VAL C C -0.091 3.554 -2.891 1.00 . A A . 29 VAL C 1 1 4 1843 1 1 29 VAL CA C -1.161 3.434 -3.954 1.00 . A A . 29 VAL CA 1 1 4 1844 1 1 29 VAL CB C -0.800 4.376 -5.139 1.00 . A A . 29 VAL CB 1 1 4 1845 1 1 29 VAL CG1 C -1.748 4.180 -6.313 1.00 . A A . 29 VAL CG1 1 1 4 1846 1 1 29 VAL CG2 C -0.798 5.832 -4.692 1.00 . A A . 29 VAL CG2 1 1 4 1847 1 1 29 VAL H H -2.436 4.334 -2.541 1.00 . A A . 29 VAL H 1 1 4 1848 1 1 29 VAL HA H -1.194 2.412 -4.314 1.00 . A A . 29 VAL HA 1 1 4 1849 1 1 29 VAL HB H 0.203 4.127 -5.478 1.00 . A A . 29 VAL HB 1 1 4 1850 1 1 29 VAL HG11 H -1.493 4.871 -7.102 1.00 . A A . 29 VAL HG11 1 1 4 1851 1 1 29 VAL HG12 H -2.763 4.362 -5.990 1.00 . A A . 29 VAL HG12 1 1 4 1852 1 1 29 VAL HG13 H -1.663 3.167 -6.678 1.00 . A A . 29 VAL HG13 1 1 4 1853 1 1 29 VAL HG21 H -1.762 6.081 -4.274 1.00 . A A . 29 VAL HG21 1 1 4 1854 1 1 29 VAL HG22 H -0.599 6.468 -5.542 1.00 . A A . 29 VAL HG22 1 1 4 1855 1 1 29 VAL HG23 H -0.033 5.978 -3.946 1.00 . A A . 29 VAL HG23 1 1 4 1856 1 1 29 VAL N N -2.440 3.737 -3.327 1.00 . A A . 29 VAL N 1 1 4 1857 1 1 29 VAL O O -0.323 4.159 -1.845 1.00 . A A . 29 VAL O 1 1 4 1858 1 1 30 CYS C C 2.996 4.291 -2.448 1.00 . A A . 30 CYS C 1 1 4 1859 1 1 30 CYS CA C 2.148 3.049 -2.193 1.00 . A A . 30 CYS CA 1 1 4 1860 1 1 30 CYS CB C 2.995 1.785 -2.305 1.00 . A A . 30 CYS CB 1 1 4 1861 1 1 30 CYS H H 1.198 2.524 -3.999 1.00 . A A . 30 CYS H 1 1 4 1862 1 1 30 CYS HA H 1.725 3.108 -1.202 1.00 . A A . 30 CYS HA 1 1 4 1863 1 1 30 CYS HB2 H 2.350 0.935 -2.469 1.00 . A A . 30 CYS HB2 1 1 4 1864 1 1 30 CYS HB3 H 3.662 1.886 -3.149 1.00 . A A . 30 CYS HB3 1 1 4 1865 1 1 30 CYS N N 1.061 2.990 -3.144 1.00 . A A . 30 CYS N 1 1 4 1866 1 1 30 CYS O O 3.027 4.816 -3.563 1.00 . A A . 30 CYS O 1 1 4 1867 1 1 30 CYS SG S 4.010 1.448 -0.842 1.00 . A A . 30 CYS SG 1 1 4 1868 1 1 31 VAL C C 5.827 5.727 -0.810 1.00 . A A . 31 VAL C 1 1 4 1869 1 1 31 VAL CA C 4.526 5.938 -1.563 1.00 . A A . 31 VAL CA 1 1 4 1870 1 1 31 VAL CB C 3.840 7.229 -1.048 1.00 . A A . 31 VAL CB 1 1 4 1871 1 1 31 VAL CG1 C 2.653 7.604 -1.924 1.00 . A A . 31 VAL CG1 1 1 4 1872 1 1 31 VAL CG2 C 3.404 7.070 0.402 1.00 . A A . 31 VAL CG2 1 1 4 1873 1 1 31 VAL H H 3.629 4.316 -0.552 1.00 . A A . 31 VAL H 1 1 4 1874 1 1 31 VAL HA H 4.749 6.064 -2.620 1.00 . A A . 31 VAL HA 1 1 4 1875 1 1 31 VAL HB H 4.559 8.034 -1.097 1.00 . A A . 31 VAL HB 1 1 4 1876 1 1 31 VAL HG11 H 1.737 7.446 -1.375 1.00 . A A . 31 VAL HG11 1 1 4 1877 1 1 31 VAL HG12 H 2.652 6.989 -2.812 1.00 . A A . 31 VAL HG12 1 1 4 1878 1 1 31 VAL HG13 H 2.729 8.645 -2.206 1.00 . A A . 31 VAL HG13 1 1 4 1879 1 1 31 VAL HG21 H 4.071 7.631 1.041 1.00 . A A . 31 VAL HG21 1 1 4 1880 1 1 31 VAL HG22 H 3.437 6.026 0.676 1.00 . A A . 31 VAL HG22 1 1 4 1881 1 1 31 VAL HG23 H 2.397 7.441 0.518 1.00 . A A . 31 VAL HG23 1 1 4 1882 1 1 31 VAL N N 3.681 4.767 -1.426 1.00 . A A . 31 VAL N 1 1 4 1883 1 1 31 VAL O O 5.874 4.807 0.030 1.00 . A A . 31 VAL O 1 1 4 1884 1 1 31 VAL OXT O 6.797 6.468 -1.088 1.00 . A A . 31 VAL OXT 1 1 5 1885 1 1 1 ALA C C 5.387 -8.822 -0.478 1.00 . A A . 1 ALA C 1 1 5 1886 1 1 1 ALA CA C 5.637 -10.297 -0.739 1.00 . A A . 1 ALA CA 1 1 5 1887 1 1 1 ALA CB C 4.563 -10.864 -1.654 1.00 . A A . 1 ALA CB 1 1 5 1888 1 1 1 ALA H1 H 5.638 -10.368 1.346 1.00 . A A . 1 ALA H1 1 1 5 1889 1 1 1 ALA H2 H 6.540 -11.600 0.614 1.00 . A A . 1 ALA H2 1 1 5 1890 1 1 1 ALA H3 H 4.851 -11.674 0.611 1.00 . A A . 1 ALA H3 1 1 5 1891 1 1 1 ALA HA H 6.594 -10.411 -1.227 1.00 . A A . 1 ALA HA 1 1 5 1892 1 1 1 ALA HB1 H 4.558 -11.942 -1.579 1.00 . A A . 1 ALA HB1 1 1 5 1893 1 1 1 ALA HB2 H 4.769 -10.575 -2.674 1.00 . A A . 1 ALA HB2 1 1 5 1894 1 1 1 ALA HB3 H 3.598 -10.479 -1.359 1.00 . A A . 1 ALA HB3 1 1 5 1895 1 1 1 ALA N N 5.669 -11.039 0.545 1.00 . A A . 1 ALA N 1 1 5 1896 1 1 1 ALA O O 4.574 -8.476 0.372 1.00 . A A . 1 ALA O 1 1 5 1897 1 1 2 CYS C C 5.382 -5.888 -2.281 1.00 . A A . 2 CYS C 1 1 5 1898 1 1 2 CYS CA C 5.945 -6.527 -1.018 1.00 . A A . 2 CYS CA 1 1 5 1899 1 1 2 CYS CB C 7.286 -5.912 -0.627 1.00 . A A . 2 CYS CB 1 1 5 1900 1 1 2 CYS H H 6.736 -8.294 -1.857 1.00 . A A . 2 CYS H 1 1 5 1901 1 1 2 CYS HA H 5.242 -6.349 -0.209 1.00 . A A . 2 CYS HA 1 1 5 1902 1 1 2 CYS HB2 H 7.121 -4.891 -0.321 1.00 . A A . 2 CYS HB2 1 1 5 1903 1 1 2 CYS HB3 H 7.688 -6.466 0.209 1.00 . A A . 2 CYS HB3 1 1 5 1904 1 1 2 CYS N N 6.094 -7.962 -1.193 1.00 . A A . 2 CYS N 1 1 5 1905 1 1 2 CYS O O 5.823 -6.181 -3.391 1.00 . A A . 2 CYS O 1 1 5 1906 1 1 2 CYS SG S 8.557 -5.885 -1.930 1.00 . A A . 2 CYS SG 1 1 5 1907 1 1 3 SER C C 4.566 -3.238 -3.753 1.00 . A A . 3 SER C 1 1 5 1908 1 1 3 SER CA C 3.712 -4.377 -3.197 1.00 . A A . 3 SER CA 1 1 5 1909 1 1 3 SER CB C 2.366 -3.835 -2.717 1.00 . A A . 3 SER CB 1 1 5 1910 1 1 3 SER H H 4.057 -4.888 -1.181 1.00 . A A . 3 SER H 1 1 5 1911 1 1 3 SER HA H 3.541 -5.102 -3.977 1.00 . A A . 3 SER HA 1 1 5 1912 1 1 3 SER HB2 H 2.530 -2.968 -2.096 1.00 . A A . 3 SER HB2 1 1 5 1913 1 1 3 SER HB3 H 1.765 -3.559 -3.571 1.00 . A A . 3 SER HB3 1 1 5 1914 1 1 3 SER HG H 0.809 -4.465 -1.702 1.00 . A A . 3 SER HG 1 1 5 1915 1 1 3 SER N N 4.378 -5.048 -2.095 1.00 . A A . 3 SER N 1 1 5 1916 1 1 3 SER O O 5.246 -2.533 -3.000 1.00 . A A . 3 SER O 1 1 5 1917 1 1 3 SER OG O 1.666 -4.814 -1.962 1.00 . A A . 3 SER OG 1 1 5 1918 1 1 4 LYS C C 4.731 -0.636 -5.266 1.00 . A A . 4 LYS C 1 1 5 1919 1 1 4 LYS CA C 5.247 -1.993 -5.740 1.00 . A A . 4 LYS CA 1 1 5 1920 1 1 4 LYS CB C 5.092 -2.136 -7.262 1.00 . A A . 4 LYS CB 1 1 5 1921 1 1 4 LYS CD C 5.599 -1.249 -9.578 1.00 . A A . 4 LYS CD 1 1 5 1922 1 1 4 LYS CE C 4.139 -1.204 -10.022 1.00 . A A . 4 LYS CE 1 1 5 1923 1 1 4 LYS CG C 5.760 -1.035 -8.073 1.00 . A A . 4 LYS CG 1 1 5 1924 1 1 4 LYS H H 3.934 -3.646 -5.605 1.00 . A A . 4 LYS H 1 1 5 1925 1 1 4 LYS HA H 6.291 -2.088 -5.475 1.00 . A A . 4 LYS HA 1 1 5 1926 1 1 4 LYS HB2 H 5.520 -3.079 -7.565 1.00 . A A . 4 LYS HB2 1 1 5 1927 1 1 4 LYS HB3 H 4.040 -2.139 -7.503 1.00 . A A . 4 LYS HB3 1 1 5 1928 1 1 4 LYS HD2 H 6.142 -0.473 -10.099 1.00 . A A . 4 LYS HD2 1 1 5 1929 1 1 4 LYS HD3 H 6.013 -2.211 -9.837 1.00 . A A . 4 LYS HD3 1 1 5 1930 1 1 4 LYS HE2 H 3.589 -0.577 -9.337 1.00 . A A . 4 LYS HE2 1 1 5 1931 1 1 4 LYS HE3 H 4.092 -0.776 -11.014 1.00 . A A . 4 LYS HE3 1 1 5 1932 1 1 4 LYS HG2 H 5.316 -0.089 -7.807 1.00 . A A . 4 LYS HG2 1 1 5 1933 1 1 4 LYS HG3 H 6.814 -1.018 -7.834 1.00 . A A . 4 LYS HG3 1 1 5 1934 1 1 4 LYS HZ1 H 4.036 -3.193 -10.667 1.00 . A A . 4 LYS HZ1 1 1 5 1935 1 1 4 LYS HZ2 H 2.523 -2.487 -10.395 1.00 . A A . 4 LYS HZ2 1 1 5 1936 1 1 4 LYS HZ3 H 3.477 -2.964 -9.084 1.00 . A A . 4 LYS HZ3 1 1 5 1937 1 1 4 LYS N N 4.508 -3.056 -5.069 1.00 . A A . 4 LYS N 1 1 5 1938 1 1 4 LYS NZ N 3.506 -2.554 -10.048 1.00 . A A . 4 LYS NZ 1 1 5 1939 1 1 4 LYS O O 3.553 -0.494 -4.951 1.00 . A A . 4 LYS O 1 1 5 1940 1 1 5 LYS C C 4.011 2.220 -5.483 1.00 . A A . 5 LYS C 1 1 5 1941 1 1 5 LYS CA C 5.208 1.673 -4.715 1.00 . A A . 5 LYS CA 1 1 5 1942 1 1 5 LYS CB C 6.370 2.671 -4.804 1.00 . A A . 5 LYS CB 1 1 5 1943 1 1 5 LYS CD C 7.011 5.042 -4.214 1.00 . A A . 5 LYS CD 1 1 5 1944 1 1 5 LYS CE C 6.548 6.490 -4.234 1.00 . A A . 5 LYS CE 1 1 5 1945 1 1 5 LYS CG C 5.914 4.120 -4.705 1.00 . A A . 5 LYS CG 1 1 5 1946 1 1 5 LYS H H 6.543 0.187 -5.422 1.00 . A A . 5 LYS H 1 1 5 1947 1 1 5 LYS HA H 4.923 1.571 -3.683 1.00 . A A . 5 LYS HA 1 1 5 1948 1 1 5 LYS HB2 H 7.062 2.474 -3.999 1.00 . A A . 5 LYS HB2 1 1 5 1949 1 1 5 LYS HB3 H 6.876 2.536 -5.748 1.00 . A A . 5 LYS HB3 1 1 5 1950 1 1 5 LYS HD2 H 7.274 4.770 -3.203 1.00 . A A . 5 LYS HD2 1 1 5 1951 1 1 5 LYS HD3 H 7.872 4.939 -4.857 1.00 . A A . 5 LYS HD3 1 1 5 1952 1 1 5 LYS HE2 H 6.747 6.904 -5.212 1.00 . A A . 5 LYS HE2 1 1 5 1953 1 1 5 LYS HE3 H 5.484 6.521 -4.044 1.00 . A A . 5 LYS HE3 1 1 5 1954 1 1 5 LYS HG2 H 5.593 4.457 -5.674 1.00 . A A . 5 LYS HG2 1 1 5 1955 1 1 5 LYS HG3 H 5.084 4.171 -4.027 1.00 . A A . 5 LYS HG3 1 1 5 1956 1 1 5 LYS HZ1 H 7.162 6.854 -2.264 1.00 . A A . 5 LYS HZ1 1 1 5 1957 1 1 5 LYS HZ2 H 6.840 8.258 -3.160 1.00 . A A . 5 LYS HZ2 1 1 5 1958 1 1 5 LYS HZ3 H 8.261 7.388 -3.443 1.00 . A A . 5 LYS HZ3 1 1 5 1959 1 1 5 LYS N N 5.609 0.352 -5.184 1.00 . A A . 5 LYS N 1 1 5 1960 1 1 5 LYS NZ N 7.253 7.309 -3.209 1.00 . A A . 5 LYS NZ 1 1 5 1961 1 1 5 LYS O O 2.990 2.543 -4.913 1.00 . A A . 5 LYS O 1 1 5 1962 1 1 6 TRP C C 1.977 1.814 -7.840 1.00 . A A . 6 TRP C 1 1 5 1963 1 1 6 TRP CA C 3.042 2.869 -7.558 1.00 . A A . 6 TRP CA 1 1 5 1964 1 1 6 TRP CB C 3.600 3.494 -8.833 1.00 . A A . 6 TRP CB 1 1 5 1965 1 1 6 TRP CD1 C 6.102 3.931 -8.437 1.00 . A A . 6 TRP CD1 1 1 5 1966 1 1 6 TRP CD2 C 4.837 5.773 -8.350 1.00 . A A . 6 TRP CD2 1 1 5 1967 1 1 6 TRP CE2 C 6.181 6.138 -8.141 1.00 . A A . 6 TRP CE2 1 1 5 1968 1 1 6 TRP CE3 C 3.862 6.772 -8.329 1.00 . A A . 6 TRP CE3 1 1 5 1969 1 1 6 TRP CG C 4.810 4.355 -8.567 1.00 . A A . 6 TRP CG 1 1 5 1970 1 1 6 TRP CH2 C 5.592 8.411 -7.899 1.00 . A A . 6 TRP CH2 1 1 5 1971 1 1 6 TRP CZ2 C 6.570 7.457 -7.914 1.00 . A A . 6 TRP CZ2 1 1 5 1972 1 1 6 TRP CZ3 C 4.248 8.079 -8.100 1.00 . A A . 6 TRP CZ3 1 1 5 1973 1 1 6 TRP H H 4.951 2.059 -7.199 1.00 . A A . 6 TRP H 1 1 5 1974 1 1 6 TRP HA H 2.577 3.652 -6.966 1.00 . A A . 6 TRP HA 1 1 5 1975 1 1 6 TRP HB2 H 3.887 2.710 -9.519 1.00 . A A . 6 TRP HB2 1 1 5 1976 1 1 6 TRP HB3 H 2.841 4.111 -9.290 1.00 . A A . 6 TRP HB3 1 1 5 1977 1 1 6 TRP HD1 H 6.411 2.903 -8.520 1.00 . A A . 6 TRP HD1 1 1 5 1978 1 1 6 TRP HE1 H 7.905 4.948 -8.096 1.00 . A A . 6 TRP HE1 1 1 5 1979 1 1 6 TRP HE3 H 2.824 6.535 -8.472 1.00 . A A . 6 TRP HE3 1 1 5 1980 1 1 6 TRP HH2 H 5.848 9.446 -7.722 1.00 . A A . 6 TRP HH2 1 1 5 1981 1 1 6 TRP HZ2 H 7.603 7.729 -7.759 1.00 . A A . 6 TRP HZ2 1 1 5 1982 1 1 6 TRP HZ3 H 3.505 8.863 -8.080 1.00 . A A . 6 TRP HZ3 1 1 5 1983 1 1 6 TRP N N 4.129 2.330 -6.770 1.00 . A A . 6 TRP N 1 1 5 1984 1 1 6 TRP NE1 N 6.932 4.996 -8.202 1.00 . A A . 6 TRP NE1 1 1 5 1985 1 1 6 TRP O O 1.253 1.892 -8.829 1.00 . A A . 6 TRP O 1 1 5 1986 1 1 7 GLU C C -0.457 0.358 -6.494 1.00 . A A . 7 GLU C 1 1 5 1987 1 1 7 GLU CA C 0.848 -0.186 -7.048 1.00 . A A . 7 GLU CA 1 1 5 1988 1 1 7 GLU CB C 1.229 -1.444 -6.267 1.00 . A A . 7 GLU CB 1 1 5 1989 1 1 7 GLU CD C 1.437 -3.176 -8.059 1.00 . A A . 7 GLU CD 1 1 5 1990 1 1 7 GLU CG C 0.654 -2.718 -6.852 1.00 . A A . 7 GLU CG 1 1 5 1991 1 1 7 GLU H H 2.459 0.863 -6.137 1.00 . A A . 7 GLU H 1 1 5 1992 1 1 7 GLU HA H 0.723 -0.428 -8.094 1.00 . A A . 7 GLU HA 1 1 5 1993 1 1 7 GLU HB2 H 2.306 -1.533 -6.253 1.00 . A A . 7 GLU HB2 1 1 5 1994 1 1 7 GLU HB3 H 0.872 -1.344 -5.253 1.00 . A A . 7 GLU HB3 1 1 5 1995 1 1 7 GLU HG2 H 0.684 -3.493 -6.101 1.00 . A A . 7 GLU HG2 1 1 5 1996 1 1 7 GLU HG3 H -0.369 -2.537 -7.147 1.00 . A A . 7 GLU HG3 1 1 5 1997 1 1 7 GLU N N 1.862 0.851 -6.930 1.00 . A A . 7 GLU N 1 1 5 1998 1 1 7 GLU O O -0.445 1.130 -5.533 1.00 . A A . 7 GLU O 1 1 5 1999 1 1 7 GLU OE1 O 2.578 -3.652 -7.880 1.00 . A A . 7 GLU OE1 1 1 5 2000 1 1 7 GLU OE2 O 0.951 -3.006 -9.194 1.00 . A A . 7 GLU OE2 1 1 5 2001 1 1 8 TYR C C -3.273 -0.310 -5.333 1.00 . A A . 8 TYR C 1 1 5 2002 1 1 8 TYR CA C -2.885 0.404 -6.634 1.00 . A A . 8 TYR CA 1 1 5 2003 1 1 8 TYR CB C -3.921 0.136 -7.735 1.00 . A A . 8 TYR CB 1 1 5 2004 1 1 8 TYR CD1 C -5.279 2.252 -7.466 1.00 . A A . 8 TYR CD1 1 1 5 2005 1 1 8 TYR CD2 C -6.437 0.170 -7.509 1.00 . A A . 8 TYR CD2 1 1 5 2006 1 1 8 TYR CE1 C -6.480 2.921 -7.318 1.00 . A A . 8 TYR CE1 1 1 5 2007 1 1 8 TYR CE2 C -7.641 0.830 -7.363 1.00 . A A . 8 TYR CE2 1 1 5 2008 1 1 8 TYR CG C -5.236 0.867 -7.560 1.00 . A A . 8 TYR CG 1 1 5 2009 1 1 8 TYR CZ C -7.658 2.205 -7.268 1.00 . A A . 8 TYR CZ 1 1 5 2010 1 1 8 TYR H H -1.511 -0.664 -7.839 1.00 . A A . 8 TYR H 1 1 5 2011 1 1 8 TYR HA H -2.827 1.469 -6.442 1.00 . A A . 8 TYR HA 1 1 5 2012 1 1 8 TYR HB2 H -3.506 0.435 -8.686 1.00 . A A . 8 TYR HB2 1 1 5 2013 1 1 8 TYR HB3 H -4.135 -0.922 -7.764 1.00 . A A . 8 TYR HB3 1 1 5 2014 1 1 8 TYR HD1 H -4.355 2.810 -7.507 1.00 . A A . 8 TYR HD1 1 1 5 2015 1 1 8 TYR HD2 H -6.421 -0.909 -7.581 1.00 . A A . 8 TYR HD2 1 1 5 2016 1 1 8 TYR HE1 H -6.492 3.998 -7.244 1.00 . A A . 8 TYR HE1 1 1 5 2017 1 1 8 TYR HE2 H -8.563 0.269 -7.324 1.00 . A A . 8 TYR HE2 1 1 5 2018 1 1 8 TYR HH H -8.734 3.625 -6.549 1.00 . A A . 8 TYR HH 1 1 5 2019 1 1 8 TYR N N -1.571 -0.043 -7.083 1.00 . A A . 8 TYR N 1 1 5 2020 1 1 8 TYR O O -4.281 -1.013 -5.261 1.00 . A A . 8 TYR O 1 1 5 2021 1 1 8 TYR OH O -8.856 2.867 -7.124 1.00 . A A . 8 TYR OH 1 1 5 2022 1 1 9 CYS C C -3.826 -0.091 -2.288 1.00 . A A . 9 CYS C 1 1 5 2023 1 1 9 CYS CA C -2.665 -0.756 -3.016 1.00 . A A . 9 CYS CA 1 1 5 2024 1 1 9 CYS CB C -1.392 -0.673 -2.167 1.00 . A A . 9 CYS CB 1 1 5 2025 1 1 9 CYS H H -1.649 0.430 -4.441 1.00 . A A . 9 CYS H 1 1 5 2026 1 1 9 CYS HA H -2.906 -1.795 -3.183 1.00 . A A . 9 CYS HA 1 1 5 2027 1 1 9 CYS HB2 H -0.585 -1.158 -2.695 1.00 . A A . 9 CYS HB2 1 1 5 2028 1 1 9 CYS HB3 H -1.141 0.367 -2.012 1.00 . A A . 9 CYS HB3 1 1 5 2029 1 1 9 CYS N N -2.443 -0.135 -4.312 1.00 . A A . 9 CYS N 1 1 5 2030 1 1 9 CYS O O -3.688 1.001 -1.738 1.00 . A A . 9 CYS O 1 1 5 2031 1 1 9 CYS SG S -1.533 -1.460 -0.528 1.00 . A A . 9 CYS SG 1 1 5 2032 1 1 10 ILE C C -6.537 -1.111 -0.441 1.00 . A A . 10 ILE C 1 1 5 2033 1 1 10 ILE CA C -6.163 -0.242 -1.637 1.00 . A A . 10 ILE CA 1 1 5 2034 1 1 10 ILE CB C -7.355 -0.175 -2.614 1.00 . A A . 10 ILE CB 1 1 5 2035 1 1 10 ILE CD1 C -8.811 -1.581 -4.172 1.00 . A A . 10 ILE CD1 1 1 5 2036 1 1 10 ILE CG1 C -7.598 -1.543 -3.264 1.00 . A A . 10 ILE CG1 1 1 5 2037 1 1 10 ILE CG2 C -7.103 0.887 -3.675 1.00 . A A . 10 ILE CG2 1 1 5 2038 1 1 10 ILE H H -5.017 -1.623 -2.753 1.00 . A A . 10 ILE H 1 1 5 2039 1 1 10 ILE HA H -5.947 0.758 -1.290 1.00 . A A . 10 ILE HA 1 1 5 2040 1 1 10 ILE HB H -8.233 0.114 -2.056 1.00 . A A . 10 ILE HB 1 1 5 2041 1 1 10 ILE HD11 H -8.668 -2.336 -4.930 1.00 . A A . 10 ILE HD11 1 1 5 2042 1 1 10 ILE HD12 H -8.938 -0.617 -4.642 1.00 . A A . 10 ILE HD12 1 1 5 2043 1 1 10 ILE HD13 H -9.689 -1.817 -3.590 1.00 . A A . 10 ILE HD13 1 1 5 2044 1 1 10 ILE HG12 H -6.736 -1.810 -3.855 1.00 . A A . 10 ILE HG12 1 1 5 2045 1 1 10 ILE HG13 H -7.741 -2.280 -2.489 1.00 . A A . 10 ILE HG13 1 1 5 2046 1 1 10 ILE HG21 H -6.042 0.966 -3.859 1.00 . A A . 10 ILE HG21 1 1 5 2047 1 1 10 ILE HG22 H -7.481 1.837 -3.330 1.00 . A A . 10 ILE HG22 1 1 5 2048 1 1 10 ILE HG23 H -7.607 0.609 -4.589 1.00 . A A . 10 ILE HG23 1 1 5 2049 1 1 10 ILE N N -4.971 -0.759 -2.292 1.00 . A A . 10 ILE N 1 1 5 2050 1 1 10 ILE O O -7.709 -1.201 -0.077 1.00 . A A . 10 ILE O 1 1 5 2051 1 1 11 VAL C C -6.948 -3.450 1.320 1.00 . A A . 11 VAL C 1 1 5 2052 1 1 11 VAL CA C -5.649 -2.625 1.322 1.00 . A A . 11 VAL CA 1 1 5 2053 1 1 11 VAL CB C -5.502 -1.859 2.665 1.00 . A A . 11 VAL CB 1 1 5 2054 1 1 11 VAL CG1 C -4.069 -1.379 2.841 1.00 . A A . 11 VAL CG1 1 1 5 2055 1 1 11 VAL CG2 C -6.465 -0.680 2.763 1.00 . A A . 11 VAL CG2 1 1 5 2056 1 1 11 VAL H H -4.615 -1.596 -0.215 1.00 . A A . 11 VAL H 1 1 5 2057 1 1 11 VAL HA H -4.826 -3.326 1.268 1.00 . A A . 11 VAL HA 1 1 5 2058 1 1 11 VAL HB H -5.725 -2.544 3.469 1.00 . A A . 11 VAL HB 1 1 5 2059 1 1 11 VAL HG11 H -4.050 -0.299 2.852 1.00 . A A . 11 VAL HG11 1 1 5 2060 1 1 11 VAL HG12 H -3.465 -1.742 2.024 1.00 . A A . 11 VAL HG12 1 1 5 2061 1 1 11 VAL HG13 H -3.676 -1.755 3.774 1.00 . A A . 11 VAL HG13 1 1 5 2062 1 1 11 VAL HG21 H -6.910 -0.660 3.747 1.00 . A A . 11 VAL HG21 1 1 5 2063 1 1 11 VAL HG22 H -7.240 -0.787 2.019 1.00 . A A . 11 VAL HG22 1 1 5 2064 1 1 11 VAL HG23 H -5.926 0.240 2.592 1.00 . A A . 11 VAL HG23 1 1 5 2065 1 1 11 VAL N N -5.511 -1.737 0.151 1.00 . A A . 11 VAL N 1 1 5 2066 1 1 11 VAL O O -7.754 -3.365 2.248 1.00 . A A . 11 VAL O 1 1 5 2067 1 1 12 PRO C C -8.342 -6.252 1.214 1.00 . A A . 12 PRO C 1 1 5 2068 1 1 12 PRO CA C -8.368 -5.114 0.198 1.00 . A A . 12 PRO CA 1 1 5 2069 1 1 12 PRO CB C -8.329 -5.661 -1.230 1.00 . A A . 12 PRO CB 1 1 5 2070 1 1 12 PRO CD C -6.269 -4.491 -0.869 1.00 . A A . 12 PRO CD 1 1 5 2071 1 1 12 PRO CG C -6.888 -5.646 -1.607 1.00 . A A . 12 PRO CG 1 1 5 2072 1 1 12 PRO HA H -9.266 -4.529 0.339 1.00 . A A . 12 PRO HA 1 1 5 2073 1 1 12 PRO HB2 H -8.731 -6.664 -1.245 1.00 . A A . 12 PRO HB2 1 1 5 2074 1 1 12 PRO HB3 H -8.912 -5.025 -1.878 1.00 . A A . 12 PRO HB3 1 1 5 2075 1 1 12 PRO HD2 H -5.273 -4.748 -0.536 1.00 . A A . 12 PRO HD2 1 1 5 2076 1 1 12 PRO HD3 H -6.241 -3.614 -1.499 1.00 . A A . 12 PRO HD3 1 1 5 2077 1 1 12 PRO HG2 H -6.423 -6.574 -1.309 1.00 . A A . 12 PRO HG2 1 1 5 2078 1 1 12 PRO HG3 H -6.791 -5.504 -2.674 1.00 . A A . 12 PRO HG3 1 1 5 2079 1 1 12 PRO N N -7.170 -4.282 0.282 1.00 . A A . 12 PRO N 1 1 5 2080 1 1 12 PRO O O -7.298 -6.853 1.451 1.00 . A A . 12 PRO O 1 1 5 2081 1 1 13 ILE C C -9.146 -8.953 2.263 1.00 . A A . 13 ILE C 1 1 5 2082 1 1 13 ILE CA C -9.591 -7.601 2.819 1.00 . A A . 13 ILE CA 1 1 5 2083 1 1 13 ILE CB C -11.026 -7.722 3.376 1.00 . A A . 13 ILE CB 1 1 5 2084 1 1 13 ILE CD1 C -13.454 -8.156 2.711 1.00 . A A . 13 ILE CD1 1 1 5 2085 1 1 13 ILE CG1 C -12.035 -7.926 2.238 1.00 . A A . 13 ILE CG1 1 1 5 2086 1 1 13 ILE CG2 C -11.379 -6.487 4.194 1.00 . A A . 13 ILE CG2 1 1 5 2087 1 1 13 ILE H H -10.287 -6.017 1.593 1.00 . A A . 13 ILE H 1 1 5 2088 1 1 13 ILE HA H -8.937 -7.338 3.636 1.00 . A A . 13 ILE HA 1 1 5 2089 1 1 13 ILE HB H -11.061 -8.578 4.034 1.00 . A A . 13 ILE HB 1 1 5 2090 1 1 13 ILE HD11 H -13.606 -9.209 2.899 1.00 . A A . 13 ILE HD11 1 1 5 2091 1 1 13 ILE HD12 H -14.146 -7.823 1.951 1.00 . A A . 13 ILE HD12 1 1 5 2092 1 1 13 ILE HD13 H -13.625 -7.600 3.622 1.00 . A A . 13 ILE HD13 1 1 5 2093 1 1 13 ILE HG12 H -12.035 -7.050 1.607 1.00 . A A . 13 ILE HG12 1 1 5 2094 1 1 13 ILE HG13 H -11.736 -8.783 1.653 1.00 . A A . 13 ILE HG13 1 1 5 2095 1 1 13 ILE HG21 H -11.234 -6.696 5.244 1.00 . A A . 13 ILE HG21 1 1 5 2096 1 1 13 ILE HG22 H -12.412 -6.222 4.019 1.00 . A A . 13 ILE HG22 1 1 5 2097 1 1 13 ILE HG23 H -10.743 -5.666 3.899 1.00 . A A . 13 ILE HG23 1 1 5 2098 1 1 13 ILE N N -9.488 -6.538 1.817 1.00 . A A . 13 ILE N 1 1 5 2099 1 1 13 ILE O O -8.647 -9.800 2.998 1.00 . A A . 13 ILE O 1 1 5 2100 1 1 14 LEU C C -7.429 -10.543 0.248 1.00 . A A . 14 LEU C 1 1 5 2101 1 1 14 LEU CA C -8.951 -10.384 0.298 1.00 . A A . 14 LEU CA 1 1 5 2102 1 1 14 LEU CB C -9.530 -10.416 -1.121 1.00 . A A . 14 LEU CB 1 1 5 2103 1 1 14 LEU CD1 C -10.011 -12.880 -1.222 1.00 . A A . 14 LEU CD1 1 1 5 2104 1 1 14 LEU CD2 C -9.767 -11.565 -3.337 1.00 . A A . 14 LEU CD2 1 1 5 2105 1 1 14 LEU CG C -9.299 -11.716 -1.897 1.00 . A A . 14 LEU CG 1 1 5 2106 1 1 14 LEU H H -9.733 -8.426 0.434 1.00 . A A . 14 LEU H 1 1 5 2107 1 1 14 LEU HA H -9.368 -11.204 0.865 1.00 . A A . 14 LEU HA 1 1 5 2108 1 1 14 LEU HB2 H -10.595 -10.246 -1.054 1.00 . A A . 14 LEU HB2 1 1 5 2109 1 1 14 LEU HB3 H -9.090 -9.606 -1.682 1.00 . A A . 14 LEU HB3 1 1 5 2110 1 1 14 LEU HD11 H -10.777 -13.262 -1.880 1.00 . A A . 14 LEU HD11 1 1 5 2111 1 1 14 LEU HD12 H -10.462 -12.540 -0.302 1.00 . A A . 14 LEU HD12 1 1 5 2112 1 1 14 LEU HD13 H -9.298 -13.662 -1.007 1.00 . A A . 14 LEU HD13 1 1 5 2113 1 1 14 LEU HD21 H -10.642 -10.933 -3.367 1.00 . A A . 14 LEU HD21 1 1 5 2114 1 1 14 LEU HD22 H -10.011 -12.537 -3.739 1.00 . A A . 14 LEU HD22 1 1 5 2115 1 1 14 LEU HD23 H -8.980 -11.118 -3.926 1.00 . A A . 14 LEU HD23 1 1 5 2116 1 1 14 LEU HG H -8.241 -11.936 -1.910 1.00 . A A . 14 LEU HG 1 1 5 2117 1 1 14 LEU N N -9.331 -9.142 0.962 1.00 . A A . 14 LEU N 1 1 5 2118 1 1 14 LEU O O -6.915 -11.654 0.140 1.00 . A A . 14 LEU O 1 1 5 2119 1 1 15 GLY C C -4.656 -8.087 0.279 1.00 . A A . 15 GLY C 1 1 5 2120 1 1 15 GLY CA C -5.268 -9.471 0.270 1.00 . A A . 15 GLY CA 1 1 5 2121 1 1 15 GLY H H -7.174 -8.563 0.407 1.00 . A A . 15 GLY H 1 1 5 2122 1 1 15 GLY HA2 H -4.905 -10.021 1.126 1.00 . A A . 15 GLY HA2 1 1 5 2123 1 1 15 GLY HA3 H -4.963 -9.982 -0.631 1.00 . A A . 15 GLY HA3 1 1 5 2124 1 1 15 GLY N N -6.715 -9.427 0.318 1.00 . A A . 15 GLY N 1 1 5 2125 1 1 15 GLY O O -4.301 -7.551 -0.768 1.00 . A A . 15 GLY O 1 1 5 2126 1 1 16 PHE C C -2.500 -6.132 1.349 1.00 . A A . 16 PHE C 1 1 5 2127 1 1 16 PHE CA C -4.004 -6.158 1.616 1.00 . A A . 16 PHE CA 1 1 5 2128 1 1 16 PHE CB C -4.328 -5.597 3.010 1.00 . A A . 16 PHE CB 1 1 5 2129 1 1 16 PHE CD1 C -2.939 -7.020 4.557 1.00 . A A . 16 PHE CD1 1 1 5 2130 1 1 16 PHE CD2 C -5.312 -7.079 4.781 1.00 . A A . 16 PHE CD2 1 1 5 2131 1 1 16 PHE CE1 C -2.815 -7.924 5.595 1.00 . A A . 16 PHE CE1 1 1 5 2132 1 1 16 PHE CE2 C -5.195 -7.982 5.820 1.00 . A A . 16 PHE CE2 1 1 5 2133 1 1 16 PHE CG C -4.187 -6.588 4.136 1.00 . A A . 16 PHE CG 1 1 5 2134 1 1 16 PHE CZ C -3.944 -8.405 6.227 1.00 . A A . 16 PHE CZ 1 1 5 2135 1 1 16 PHE H H -4.881 -7.973 2.257 1.00 . A A . 16 PHE H 1 1 5 2136 1 1 16 PHE HA H -4.485 -5.531 0.878 1.00 . A A . 16 PHE HA 1 1 5 2137 1 1 16 PHE HB2 H -3.664 -4.771 3.217 1.00 . A A . 16 PHE HB2 1 1 5 2138 1 1 16 PHE HB3 H -5.347 -5.236 3.012 1.00 . A A . 16 PHE HB3 1 1 5 2139 1 1 16 PHE HD1 H -2.054 -6.644 4.064 1.00 . A A . 16 PHE HD1 1 1 5 2140 1 1 16 PHE HD2 H -6.290 -6.752 4.462 1.00 . A A . 16 PHE HD2 1 1 5 2141 1 1 16 PHE HE1 H -1.837 -8.253 5.912 1.00 . A A . 16 PHE HE1 1 1 5 2142 1 1 16 PHE HE2 H -6.079 -8.357 6.314 1.00 . A A . 16 PHE HE2 1 1 5 2143 1 1 16 PHE HZ H -3.849 -9.111 7.039 1.00 . A A . 16 PHE HZ 1 1 5 2144 1 1 16 PHE N N -4.557 -7.499 1.464 1.00 . A A . 16 PHE N 1 1 5 2145 1 1 16 PHE O O -1.970 -5.136 0.859 1.00 . A A . 16 PHE O 1 1 5 2146 1 1 17 VAL C C 0.356 -6.273 2.253 1.00 . A A . 17 VAL C 1 1 5 2147 1 1 17 VAL CA C -0.382 -7.370 1.481 1.00 . A A . 17 VAL CA 1 1 5 2148 1 1 17 VAL CB C 0.014 -7.345 -0.027 1.00 . A A . 17 VAL CB 1 1 5 2149 1 1 17 VAL CG1 C 1.348 -8.049 -0.258 1.00 . A A . 17 VAL CG1 1 1 5 2150 1 1 17 VAL CG2 C -1.061 -7.991 -0.891 1.00 . A A . 17 VAL CG2 1 1 5 2151 1 1 17 VAL H H -2.320 -7.989 2.058 1.00 . A A . 17 VAL H 1 1 5 2152 1 1 17 VAL HA H -0.073 -8.318 1.886 1.00 . A A . 17 VAL HA 1 1 5 2153 1 1 17 VAL HB H 0.119 -6.314 -0.334 1.00 . A A . 17 VAL HB 1 1 5 2154 1 1 17 VAL HG11 H 1.185 -8.943 -0.841 1.00 . A A . 17 VAL HG11 1 1 5 2155 1 1 17 VAL HG12 H 1.784 -8.313 0.694 1.00 . A A . 17 VAL HG12 1 1 5 2156 1 1 17 VAL HG13 H 2.017 -7.389 -0.790 1.00 . A A . 17 VAL HG13 1 1 5 2157 1 1 17 VAL HG21 H -1.320 -8.957 -0.481 1.00 . A A . 17 VAL HG21 1 1 5 2158 1 1 17 VAL HG22 H -0.689 -8.115 -1.898 1.00 . A A . 17 VAL HG22 1 1 5 2159 1 1 17 VAL HG23 H -1.938 -7.361 -0.906 1.00 . A A . 17 VAL HG23 1 1 5 2160 1 1 17 VAL N N -1.828 -7.239 1.674 1.00 . A A . 17 VAL N 1 1 5 2161 1 1 17 VAL O O -0.126 -5.790 3.280 1.00 . A A . 17 VAL O 1 1 5 2162 1 1 18 TYR C C 3.459 -4.471 1.425 1.00 . A A . 18 TYR C 1 1 5 2163 1 1 18 TYR CA C 2.346 -4.878 2.381 1.00 . A A . 18 TYR CA 1 1 5 2164 1 1 18 TYR CB C 2.936 -5.387 3.710 1.00 . A A . 18 TYR CB 1 1 5 2165 1 1 18 TYR CD1 C 5.114 -6.602 3.266 1.00 . A A . 18 TYR CD1 1 1 5 2166 1 1 18 TYR CD2 C 3.184 -7.903 3.785 1.00 . A A . 18 TYR CD2 1 1 5 2167 1 1 18 TYR CE1 C 5.865 -7.757 3.148 1.00 . A A . 18 TYR CE1 1 1 5 2168 1 1 18 TYR CE2 C 3.928 -9.060 3.667 1.00 . A A . 18 TYR CE2 1 1 5 2169 1 1 18 TYR CG C 3.761 -6.654 3.583 1.00 . A A . 18 TYR CG 1 1 5 2170 1 1 18 TYR CZ C 5.267 -8.982 3.349 1.00 . A A . 18 TYR CZ 1 1 5 2171 1 1 18 TYR H H 1.838 -6.341 0.951 1.00 . A A . 18 TYR H 1 1 5 2172 1 1 18 TYR HA H 1.722 -4.019 2.576 1.00 . A A . 18 TYR HA 1 1 5 2173 1 1 18 TYR HB2 H 3.572 -4.621 4.128 1.00 . A A . 18 TYR HB2 1 1 5 2174 1 1 18 TYR HB3 H 2.126 -5.586 4.399 1.00 . A A . 18 TYR HB3 1 1 5 2175 1 1 18 TYR HD1 H 5.581 -5.641 3.109 1.00 . A A . 18 TYR HD1 1 1 5 2176 1 1 18 TYR HD2 H 2.134 -7.961 4.032 1.00 . A A . 18 TYR HD2 1 1 5 2177 1 1 18 TYR HE1 H 6.914 -7.696 2.899 1.00 . A A . 18 TYR HE1 1 1 5 2178 1 1 18 TYR HE2 H 3.461 -10.021 3.829 1.00 . A A . 18 TYR HE2 1 1 5 2179 1 1 18 TYR HH H 6.395 -10.363 4.076 1.00 . A A . 18 TYR HH 1 1 5 2180 1 1 18 TYR N N 1.519 -5.902 1.761 1.00 . A A . 18 TYR N 1 1 5 2181 1 1 18 TYR O O 3.986 -5.307 0.695 1.00 . A A . 18 TYR O 1 1 5 2182 1 1 18 TYR OH O 6.010 -10.139 3.220 1.00 . A A . 18 TYR OH 1 1 5 2183 1 1 19 CYS C C 6.226 -3.142 0.964 1.00 . A A . 19 CYS C 1 1 5 2184 1 1 19 CYS CA C 4.843 -2.683 0.532 1.00 . A A . 19 CYS CA 1 1 5 2185 1 1 19 CYS CB C 4.812 -1.173 0.554 1.00 . A A . 19 CYS CB 1 1 5 2186 1 1 19 CYS H H 3.324 -2.562 2.004 1.00 . A A . 19 CYS H 1 1 5 2187 1 1 19 CYS HA H 4.645 -3.028 -0.471 1.00 . A A . 19 CYS HA 1 1 5 2188 1 1 19 CYS HB2 H 4.866 -0.865 1.580 1.00 . A A . 19 CYS HB2 1 1 5 2189 1 1 19 CYS HB3 H 5.674 -0.778 0.021 1.00 . A A . 19 CYS HB3 1 1 5 2190 1 1 19 CYS N N 3.796 -3.194 1.411 1.00 . A A . 19 CYS N 1 1 5 2191 1 1 19 CYS O O 6.410 -3.654 2.071 1.00 . A A . 19 CYS O 1 1 5 2192 1 1 19 CYS SG S 3.305 -0.452 -0.161 1.00 . A A . 19 CYS SG 1 1 5 2193 1 1 20 CYS C C 9.106 -2.379 1.467 1.00 . A A . 20 CYS C 1 1 5 2194 1 1 20 CYS CA C 8.581 -3.292 0.377 1.00 . A A . 20 CYS CA 1 1 5 2195 1 1 20 CYS CB C 9.446 -3.154 -0.876 1.00 . A A . 20 CYS CB 1 1 5 2196 1 1 20 CYS H H 6.991 -2.505 -0.769 1.00 . A A . 20 CYS H 1 1 5 2197 1 1 20 CYS HA H 8.605 -4.314 0.723 1.00 . A A . 20 CYS HA 1 1 5 2198 1 1 20 CYS HB2 H 9.605 -2.106 -1.071 1.00 . A A . 20 CYS HB2 1 1 5 2199 1 1 20 CYS HB3 H 10.399 -3.626 -0.695 1.00 . A A . 20 CYS HB3 1 1 5 2200 1 1 20 CYS N N 7.201 -2.933 0.088 1.00 . A A . 20 CYS N 1 1 5 2201 1 1 20 CYS O O 8.606 -1.266 1.623 1.00 . A A . 20 CYS O 1 1 5 2202 1 1 20 CYS SG S 8.722 -3.907 -2.376 1.00 . A A . 20 CYS SG 1 1 5 2203 1 1 21 PRO C C 11.050 -0.636 2.838 1.00 . A A . 21 PRO C 1 1 5 2204 1 1 21 PRO CA C 10.658 -2.017 3.321 1.00 . A A . 21 PRO CA 1 1 5 2205 1 1 21 PRO CB C 11.877 -2.799 3.777 1.00 . A A . 21 PRO CB 1 1 5 2206 1 1 21 PRO CD C 10.756 -4.140 2.146 1.00 . A A . 21 PRO CD 1 1 5 2207 1 1 21 PRO CG C 11.575 -4.213 3.409 1.00 . A A . 21 PRO CG 1 1 5 2208 1 1 21 PRO HA H 9.960 -1.922 4.140 1.00 . A A . 21 PRO HA 1 1 5 2209 1 1 21 PRO HB2 H 12.759 -2.433 3.269 1.00 . A A . 21 PRO HB2 1 1 5 2210 1 1 21 PRO HB3 H 11.988 -2.679 4.841 1.00 . A A . 21 PRO HB3 1 1 5 2211 1 1 21 PRO HD2 H 11.395 -4.187 1.278 1.00 . A A . 21 PRO HD2 1 1 5 2212 1 1 21 PRO HD3 H 10.023 -4.932 2.120 1.00 . A A . 21 PRO HD3 1 1 5 2213 1 1 21 PRO HG2 H 12.494 -4.751 3.231 1.00 . A A . 21 PRO HG2 1 1 5 2214 1 1 21 PRO HG3 H 11.008 -4.685 4.197 1.00 . A A . 21 PRO HG3 1 1 5 2215 1 1 21 PRO N N 10.102 -2.826 2.245 1.00 . A A . 21 PRO N 1 1 5 2216 1 1 21 PRO O O 11.923 -0.473 1.985 1.00 . A A . 21 PRO O 1 1 5 2217 1 1 22 GLY C C 9.357 2.345 2.382 1.00 . A A . 22 GLY C 1 1 5 2218 1 1 22 GLY CA C 10.590 1.717 3.003 1.00 . A A . 22 GLY CA 1 1 5 2219 1 1 22 GLY H H 9.670 0.119 4.026 1.00 . A A . 22 GLY H 1 1 5 2220 1 1 22 GLY HA2 H 10.864 2.279 3.882 1.00 . A A . 22 GLY HA2 1 1 5 2221 1 1 22 GLY HA3 H 11.400 1.759 2.290 1.00 . A A . 22 GLY HA3 1 1 5 2222 1 1 22 GLY N N 10.363 0.341 3.378 1.00 . A A . 22 GLY N 1 1 5 2223 1 1 22 GLY O O 9.131 3.544 2.524 1.00 . A A . 22 GLY O 1 1 5 2224 1 1 23 LEU C C 6.133 1.650 1.903 1.00 . A A . 23 LEU C 1 1 5 2225 1 1 23 LEU CA C 7.347 2.007 1.054 1.00 . A A . 23 LEU CA 1 1 5 2226 1 1 23 LEU CB C 7.221 1.379 -0.336 1.00 . A A . 23 LEU CB 1 1 5 2227 1 1 23 LEU CD1 C 8.288 0.700 -2.497 1.00 . A A . 23 LEU CD1 1 1 5 2228 1 1 23 LEU CD2 C 8.693 2.988 -1.576 1.00 . A A . 23 LEU CD2 1 1 5 2229 1 1 23 LEU CG C 8.452 1.526 -1.232 1.00 . A A . 23 LEU CG 1 1 5 2230 1 1 23 LEU H H 8.780 0.576 1.621 1.00 . A A . 23 LEU H 1 1 5 2231 1 1 23 LEU HA H 7.412 3.081 0.958 1.00 . A A . 23 LEU HA 1 1 5 2232 1 1 23 LEU HB2 H 7.013 0.326 -0.213 1.00 . A A . 23 LEU HB2 1 1 5 2233 1 1 23 LEU HB3 H 6.382 1.836 -0.839 1.00 . A A . 23 LEU HB3 1 1 5 2234 1 1 23 LEU HD11 H 7.540 1.155 -3.130 1.00 . A A . 23 LEU HD11 1 1 5 2235 1 1 23 LEU HD12 H 7.980 -0.301 -2.237 1.00 . A A . 23 LEU HD12 1 1 5 2236 1 1 23 LEU HD13 H 9.230 0.661 -3.026 1.00 . A A . 23 LEU HD13 1 1 5 2237 1 1 23 LEU HD21 H 8.633 3.120 -2.645 1.00 . A A . 23 LEU HD21 1 1 5 2238 1 1 23 LEU HD22 H 9.673 3.282 -1.230 1.00 . A A . 23 LEU HD22 1 1 5 2239 1 1 23 LEU HD23 H 7.944 3.599 -1.094 1.00 . A A . 23 LEU HD23 1 1 5 2240 1 1 23 LEU HG H 9.320 1.158 -0.703 1.00 . A A . 23 LEU HG 1 1 5 2241 1 1 23 LEU N N 8.558 1.532 1.695 1.00 . A A . 23 LEU N 1 1 5 2242 1 1 23 LEU O O 6.133 0.625 2.590 1.00 . A A . 23 LEU O 1 1 5 2243 1 1 24 ILE C C 2.638 2.627 1.836 1.00 . A A . 24 ILE C 1 1 5 2244 1 1 24 ILE CA C 3.887 2.237 2.625 1.00 . A A . 24 ILE CA 1 1 5 2245 1 1 24 ILE CB C 3.886 3.004 3.970 1.00 . A A . 24 ILE CB 1 1 5 2246 1 1 24 ILE CD1 C 4.186 5.319 5.007 1.00 . A A . 24 ILE CD1 1 1 5 2247 1 1 24 ILE CG1 C 4.270 4.474 3.754 1.00 . A A . 24 ILE CG1 1 1 5 2248 1 1 24 ILE CG2 C 4.823 2.340 4.971 1.00 . A A . 24 ILE CG2 1 1 5 2249 1 1 24 ILE H H 5.163 3.289 1.285 1.00 . A A . 24 ILE H 1 1 5 2250 1 1 24 ILE HA H 3.844 1.180 2.843 1.00 . A A . 24 ILE HA 1 1 5 2251 1 1 24 ILE HB H 2.886 2.961 4.374 1.00 . A A . 24 ILE HB 1 1 5 2252 1 1 24 ILE HD11 H 5.090 5.195 5.586 1.00 . A A . 24 ILE HD11 1 1 5 2253 1 1 24 ILE HD12 H 3.336 5.005 5.596 1.00 . A A . 24 ILE HD12 1 1 5 2254 1 1 24 ILE HD13 H 4.072 6.357 4.735 1.00 . A A . 24 ILE HD13 1 1 5 2255 1 1 24 ILE HG12 H 5.286 4.523 3.391 1.00 . A A . 24 ILE HG12 1 1 5 2256 1 1 24 ILE HG13 H 3.608 4.906 3.017 1.00 . A A . 24 ILE HG13 1 1 5 2257 1 1 24 ILE HG21 H 5.841 2.423 4.621 1.00 . A A . 24 ILE HG21 1 1 5 2258 1 1 24 ILE HG22 H 4.560 1.298 5.073 1.00 . A A . 24 ILE HG22 1 1 5 2259 1 1 24 ILE HG23 H 4.731 2.830 5.930 1.00 . A A . 24 ILE HG23 1 1 5 2260 1 1 24 ILE N N 5.104 2.483 1.856 1.00 . A A . 24 ILE N 1 1 5 2261 1 1 24 ILE O O 2.577 3.701 1.238 1.00 . A A . 24 ILE O 1 1 5 2262 1 1 25 CYS C C -0.296 3.255 1.680 1.00 . A A . 25 CYS C 1 1 5 2263 1 1 25 CYS CA C 0.384 2.000 1.128 1.00 . A A . 25 CYS CA 1 1 5 2264 1 1 25 CYS CB C -0.565 0.804 1.256 1.00 . A A . 25 CYS CB 1 1 5 2265 1 1 25 CYS H H 1.752 0.893 2.325 1.00 . A A . 25 CYS H 1 1 5 2266 1 1 25 CYS HA H 0.615 2.158 0.085 1.00 . A A . 25 CYS HA 1 1 5 2267 1 1 25 CYS HB2 H -0.743 0.607 2.302 1.00 . A A . 25 CYS HB2 1 1 5 2268 1 1 25 CYS HB3 H -1.502 1.045 0.778 1.00 . A A . 25 CYS HB3 1 1 5 2269 1 1 25 CYS N N 1.639 1.742 1.836 1.00 . A A . 25 CYS N 1 1 5 2270 1 1 25 CYS O O -0.320 3.470 2.893 1.00 . A A . 25 CYS O 1 1 5 2271 1 1 25 CYS SG S 0.060 -0.736 0.505 1.00 . A A . 25 CYS SG 1 1 5 2272 1 1 26 GLY C C -2.701 5.674 0.391 1.00 . A A . 26 GLY C 1 1 5 2273 1 1 26 GLY CA C -1.479 5.310 1.223 1.00 . A A . 26 GLY CA 1 1 5 2274 1 1 26 GLY H H -0.772 3.877 -0.165 1.00 . A A . 26 GLY H 1 1 5 2275 1 1 26 GLY HA2 H -1.783 5.197 2.253 1.00 . A A . 26 GLY HA2 1 1 5 2276 1 1 26 GLY HA3 H -0.764 6.118 1.160 1.00 . A A . 26 GLY HA3 1 1 5 2277 1 1 26 GLY N N -0.832 4.087 0.793 1.00 . A A . 26 GLY N 1 1 5 2278 1 1 26 GLY O O -3.730 5.004 0.477 1.00 . A A . 26 GLY O 1 1 5 2279 1 1 27 PRO C C -4.086 6.322 -2.418 1.00 . A A . 27 PRO C 1 1 5 2280 1 1 27 PRO CA C -3.736 7.242 -1.246 1.00 . A A . 27 PRO CA 1 1 5 2281 1 1 27 PRO CB C -3.230 8.595 -1.758 1.00 . A A . 27 PRO CB 1 1 5 2282 1 1 27 PRO CD C -1.427 7.615 -0.536 1.00 . A A . 27 PRO CD 1 1 5 2283 1 1 27 PRO CG C -1.746 8.485 -1.719 1.00 . A A . 27 PRO CG 1 1 5 2284 1 1 27 PRO HA H -4.622 7.398 -0.652 1.00 . A A . 27 PRO HA 1 1 5 2285 1 1 27 PRO HB2 H -3.588 8.757 -2.765 1.00 . A A . 27 PRO HB2 1 1 5 2286 1 1 27 PRO HB3 H -3.584 9.384 -1.112 1.00 . A A . 27 PRO HB3 1 1 5 2287 1 1 27 PRO HD2 H -0.545 7.023 -0.730 1.00 . A A . 27 PRO HD2 1 1 5 2288 1 1 27 PRO HD3 H -1.291 8.218 0.350 1.00 . A A . 27 PRO HD3 1 1 5 2289 1 1 27 PRO HG2 H -1.387 8.026 -2.629 1.00 . A A . 27 PRO HG2 1 1 5 2290 1 1 27 PRO HG3 H -1.308 9.464 -1.594 1.00 . A A . 27 PRO HG3 1 1 5 2291 1 1 27 PRO N N -2.619 6.757 -0.407 1.00 . A A . 27 PRO N 1 1 5 2292 1 1 27 PRO O O -3.966 6.706 -3.581 1.00 . A A . 27 PRO O 1 1 5 2293 1 1 28 PHE C C -3.686 3.623 -3.871 1.00 . A A . 28 PHE C 1 1 5 2294 1 1 28 PHE CA C -4.901 4.087 -3.067 1.00 . A A . 28 PHE CA 1 1 5 2295 1 1 28 PHE CB C -6.041 4.573 -4.001 1.00 . A A . 28 PHE CB 1 1 5 2296 1 1 28 PHE CD1 C -7.512 5.376 -2.114 1.00 . A A . 28 PHE CD1 1 1 5 2297 1 1 28 PHE CD2 C -8.516 4.157 -3.901 1.00 . A A . 28 PHE CD2 1 1 5 2298 1 1 28 PHE CE1 C -8.743 5.495 -1.500 1.00 . A A . 28 PHE CE1 1 1 5 2299 1 1 28 PHE CE2 C -9.750 4.274 -3.290 1.00 . A A . 28 PHE CE2 1 1 5 2300 1 1 28 PHE CG C -7.382 4.705 -3.322 1.00 . A A . 28 PHE CG 1 1 5 2301 1 1 28 PHE CZ C -9.864 4.943 -2.088 1.00 . A A . 28 PHE CZ 1 1 5 2302 1 1 28 PHE H H -4.574 4.886 -1.131 1.00 . A A . 28 PHE H 1 1 5 2303 1 1 28 PHE HA H -5.264 3.237 -2.505 1.00 . A A . 28 PHE HA 1 1 5 2304 1 1 28 PHE HB2 H -5.793 5.541 -4.413 1.00 . A A . 28 PHE HB2 1 1 5 2305 1 1 28 PHE HB3 H -6.158 3.866 -4.814 1.00 . A A . 28 PHE HB3 1 1 5 2306 1 1 28 PHE HD1 H -6.637 5.808 -1.653 1.00 . A A . 28 PHE HD1 1 1 5 2307 1 1 28 PHE HD2 H -8.429 3.631 -4.841 1.00 . A A . 28 PHE HD2 1 1 5 2308 1 1 28 PHE HE1 H -8.829 6.020 -0.560 1.00 . A A . 28 PHE HE1 1 1 5 2309 1 1 28 PHE HE2 H -10.625 3.841 -3.754 1.00 . A A . 28 PHE HE2 1 1 5 2310 1 1 28 PHE HZ H -10.827 5.036 -1.610 1.00 . A A . 28 PHE HZ 1 1 5 2311 1 1 28 PHE N N -4.517 5.110 -2.086 1.00 . A A . 28 PHE N 1 1 5 2312 1 1 28 PHE O O -3.818 2.900 -4.854 1.00 . A A . 28 PHE O 1 1 5 2313 1 1 29 VAL C C -0.190 3.630 -2.921 1.00 . A A . 29 VAL C 1 1 5 2314 1 1 29 VAL CA C -1.236 3.633 -4.018 1.00 . A A . 29 VAL CA 1 1 5 2315 1 1 29 VAL CB C -0.770 4.594 -5.150 1.00 . A A . 29 VAL CB 1 1 5 2316 1 1 29 VAL CG1 C -1.683 4.508 -6.365 1.00 . A A . 29 VAL CG1 1 1 5 2317 1 1 29 VAL CG2 C -0.687 6.029 -4.646 1.00 . A A . 29 VAL CG2 1 1 5 2318 1 1 29 VAL H H -2.465 4.558 -2.583 1.00 . A A . 29 VAL H 1 1 5 2319 1 1 29 VAL HA H -1.343 2.633 -4.428 1.00 . A A . 29 VAL HA 1 1 5 2320 1 1 29 VAL HB H 0.227 4.291 -5.464 1.00 . A A . 29 VAL HB 1 1 5 2321 1 1 29 VAL HG11 H -1.308 3.758 -7.045 1.00 . A A . 29 VAL HG11 1 1 5 2322 1 1 29 VAL HG12 H -1.710 5.466 -6.864 1.00 . A A . 29 VAL HG12 1 1 5 2323 1 1 29 VAL HG13 H -2.680 4.240 -6.047 1.00 . A A . 29 VAL HG13 1 1 5 2324 1 1 29 VAL HG21 H -0.330 6.031 -3.626 1.00 . A A . 29 VAL HG21 1 1 5 2325 1 1 29 VAL HG22 H -1.667 6.482 -4.685 1.00 . A A . 29 VAL HG22 1 1 5 2326 1 1 29 VAL HG23 H -0.005 6.590 -5.268 1.00 . A A . 29 VAL HG23 1 1 5 2327 1 1 29 VAL N N -2.500 4.013 -3.405 1.00 . A A . 29 VAL N 1 1 5 2328 1 1 29 VAL O O -0.410 4.221 -1.865 1.00 . A A . 29 VAL O 1 1 5 2329 1 1 30 CYS C C 2.915 4.162 -2.372 1.00 . A A . 30 CYS C 1 1 5 2330 1 1 30 CYS CA C 1.991 2.962 -2.160 1.00 . A A . 30 CYS CA 1 1 5 2331 1 1 30 CYS CB C 2.765 1.645 -2.267 1.00 . A A . 30 CYS CB 1 1 5 2332 1 1 30 CYS H H 1.071 2.552 -4.020 1.00 . A A . 30 CYS H 1 1 5 2333 1 1 30 CYS HA H 1.538 3.033 -1.182 1.00 . A A . 30 CYS HA 1 1 5 2334 1 1 30 CYS HB2 H 2.064 0.825 -2.302 1.00 . A A . 30 CYS HB2 1 1 5 2335 1 1 30 CYS HB3 H 3.338 1.654 -3.183 1.00 . A A . 30 CYS HB3 1 1 5 2336 1 1 30 CYS N N 0.933 2.995 -3.153 1.00 . A A . 30 CYS N 1 1 5 2337 1 1 30 CYS O O 2.985 4.713 -3.473 1.00 . A A . 30 CYS O 1 1 5 2338 1 1 30 CYS SG S 3.918 1.331 -0.901 1.00 . A A . 30 CYS SG 1 1 5 2339 1 1 31 VAL C C 5.794 5.453 -0.683 1.00 . A A . 31 VAL C 1 1 5 2340 1 1 31 VAL CA C 4.515 5.717 -1.458 1.00 . A A . 31 VAL CA 1 1 5 2341 1 1 31 VAL CB C 3.878 7.035 -0.952 1.00 . A A . 31 VAL CB 1 1 5 2342 1 1 31 VAL CG1 C 2.743 7.482 -1.864 1.00 . A A . 31 VAL CG1 1 1 5 2343 1 1 31 VAL CG2 C 3.384 6.885 0.480 1.00 . A A . 31 VAL CG2 1 1 5 2344 1 1 31 VAL H H 3.532 4.124 -0.470 1.00 . A A . 31 VAL H 1 1 5 2345 1 1 31 VAL HA H 4.761 5.833 -2.512 1.00 . A A . 31 VAL HA 1 1 5 2346 1 1 31 VAL HB H 4.638 7.803 -0.966 1.00 . A A . 31 VAL HB 1 1 5 2347 1 1 31 VAL HG11 H 3.043 8.368 -2.403 1.00 . A A . 31 VAL HG11 1 1 5 2348 1 1 31 VAL HG12 H 1.869 7.701 -1.269 1.00 . A A . 31 VAL HG12 1 1 5 2349 1 1 31 VAL HG13 H 2.514 6.693 -2.566 1.00 . A A . 31 VAL HG13 1 1 5 2350 1 1 31 VAL HG21 H 2.313 7.021 0.507 1.00 . A A . 31 VAL HG21 1 1 5 2351 1 1 31 VAL HG22 H 3.856 7.628 1.104 1.00 . A A . 31 VAL HG22 1 1 5 2352 1 1 31 VAL HG23 H 3.630 5.899 0.844 1.00 . A A . 31 VAL HG23 1 1 5 2353 1 1 31 VAL N N 3.614 4.582 -1.338 1.00 . A A . 31 VAL N 1 1 5 2354 1 1 31 VAL O O 5.784 4.549 0.172 1.00 . A A . 31 VAL O 1 1 5 2355 1 1 31 VAL OXT O 6.801 6.146 -0.956 1.00 . A A . 31 VAL OXT 1 1 6 2356 1 1 1 ALA C C 4.368 -8.595 -0.403 1.00 . A A . 1 ALA C 1 1 6 2357 1 1 1 ALA CA C 4.462 -10.080 -0.703 1.00 . A A . 1 ALA CA 1 1 6 2358 1 1 1 ALA CB C 3.380 -10.496 -1.688 1.00 . A A . 1 ALA CB 1 1 6 2359 1 1 1 ALA H1 H 5.012 -11.655 0.547 1.00 . A A . 1 ALA H1 1 1 6 2360 1 1 1 ALA H2 H 3.381 -11.226 0.657 1.00 . A A . 1 ALA H2 1 1 6 2361 1 1 1 ALA H3 H 4.561 -10.247 1.374 1.00 . A A . 1 ALA H3 1 1 6 2362 1 1 1 ALA HA H 5.425 -10.288 -1.148 1.00 . A A . 1 ALA HA 1 1 6 2363 1 1 1 ALA HB1 H 2.881 -11.380 -1.322 1.00 . A A . 1 ALA HB1 1 1 6 2364 1 1 1 ALA HB2 H 3.828 -10.706 -2.648 1.00 . A A . 1 ALA HB2 1 1 6 2365 1 1 1 ALA HB3 H 2.662 -9.695 -1.793 1.00 . A A . 1 ALA HB3 1 1 6 2366 1 1 1 ALA N N 4.346 -10.859 0.553 1.00 . A A . 1 ALA N 1 1 6 2367 1 1 1 ALA O O 3.570 -8.186 0.435 1.00 . A A . 1 ALA O 1 1 6 2368 1 1 2 CYS C C 4.645 -5.630 -2.081 1.00 . A A . 2 CYS C 1 1 6 2369 1 1 2 CYS CA C 5.189 -6.361 -0.859 1.00 . A A . 2 CYS CA 1 1 6 2370 1 1 2 CYS CB C 6.598 -5.889 -0.508 1.00 . A A . 2 CYS CB 1 1 6 2371 1 1 2 CYS H H 5.806 -8.180 -1.727 1.00 . A A . 2 CYS H 1 1 6 2372 1 1 2 CYS HA H 4.538 -6.137 -0.019 1.00 . A A . 2 CYS HA 1 1 6 2373 1 1 2 CYS HB2 H 6.551 -4.854 -0.212 1.00 . A A . 2 CYS HB2 1 1 6 2374 1 1 2 CYS HB3 H 6.963 -6.472 0.324 1.00 . A A . 2 CYS HB3 1 1 6 2375 1 1 2 CYS N N 5.185 -7.798 -1.073 1.00 . A A . 2 CYS N 1 1 6 2376 1 1 2 CYS O O 5.029 -5.918 -3.215 1.00 . A A . 2 CYS O 1 1 6 2377 1 1 2 CYS SG S 7.830 -6.009 -1.845 1.00 . A A . 2 CYS SG 1 1 6 2378 1 1 3 SER C C 4.066 -2.929 -3.496 1.00 . A A . 3 SER C 1 1 6 2379 1 1 3 SER CA C 3.092 -3.939 -2.888 1.00 . A A . 3 SER CA 1 1 6 2380 1 1 3 SER CB C 1.867 -3.220 -2.322 1.00 . A A . 3 SER CB 1 1 6 2381 1 1 3 SER H H 3.448 -4.554 -0.904 1.00 . A A . 3 SER H 1 1 6 2382 1 1 3 SER HA H 2.773 -4.625 -3.658 1.00 . A A . 3 SER HA 1 1 6 2383 1 1 3 SER HB2 H 2.189 -2.396 -1.702 1.00 . A A . 3 SER HB2 1 1 6 2384 1 1 3 SER HB3 H 1.262 -2.846 -3.135 1.00 . A A . 3 SER HB3 1 1 6 2385 1 1 3 SER HG H 0.164 -4.068 -1.827 1.00 . A A . 3 SER HG 1 1 6 2386 1 1 3 SER N N 3.727 -4.710 -1.834 1.00 . A A . 3 SER N 1 1 6 2387 1 1 3 SER O O 4.877 -2.323 -2.788 1.00 . A A . 3 SER O 1 1 6 2388 1 1 3 SER OG O 1.082 -4.106 -1.536 1.00 . A A . 3 SER OG 1 1 6 2389 1 1 4 LYS C C 4.406 -0.384 -5.204 1.00 . A A . 4 LYS C 1 1 6 2390 1 1 4 LYS CA C 4.828 -1.820 -5.532 1.00 . A A . 4 LYS CA 1 1 6 2391 1 1 4 LYS CB C 4.722 -2.101 -7.031 1.00 . A A . 4 LYS CB 1 1 6 2392 1 1 4 LYS CD C 5.545 -1.689 -9.376 1.00 . A A . 4 LYS CD 1 1 6 2393 1 1 4 LYS CE C 5.763 -3.161 -9.726 1.00 . A A . 4 LYS CE 1 1 6 2394 1 1 4 LYS CG C 5.756 -1.397 -7.891 1.00 . A A . 4 LYS CG 1 1 6 2395 1 1 4 LYS H H 3.304 -3.268 -5.310 1.00 . A A . 4 LYS H 1 1 6 2396 1 1 4 LYS HA H 5.847 -1.974 -5.208 1.00 . A A . 4 LYS HA 1 1 6 2397 1 1 4 LYS HB2 H 4.827 -3.163 -7.190 1.00 . A A . 4 LYS HB2 1 1 6 2398 1 1 4 LYS HB3 H 3.742 -1.795 -7.369 1.00 . A A . 4 LYS HB3 1 1 6 2399 1 1 4 LYS HD2 H 4.534 -1.417 -9.642 1.00 . A A . 4 LYS HD2 1 1 6 2400 1 1 4 LYS HD3 H 6.237 -1.088 -9.948 1.00 . A A . 4 LYS HD3 1 1 6 2401 1 1 4 LYS HE2 H 5.966 -3.238 -10.783 1.00 . A A . 4 LYS HE2 1 1 6 2402 1 1 4 LYS HE3 H 6.619 -3.522 -9.174 1.00 . A A . 4 LYS HE3 1 1 6 2403 1 1 4 LYS HG2 H 5.680 -0.332 -7.729 1.00 . A A . 4 LYS HG2 1 1 6 2404 1 1 4 LYS HG3 H 6.740 -1.738 -7.603 1.00 . A A . 4 LYS HG3 1 1 6 2405 1 1 4 LYS HZ1 H 3.712 -3.624 -9.832 1.00 . A A . 4 LYS HZ1 1 1 6 2406 1 1 4 LYS HZ2 H 4.441 -4.071 -8.373 1.00 . A A . 4 LYS HZ2 1 1 6 2407 1 1 4 LYS HZ3 H 4.725 -4.979 -9.768 1.00 . A A . 4 LYS HZ3 1 1 6 2408 1 1 4 LYS N N 3.976 -2.755 -4.810 1.00 . A A . 4 LYS N 1 1 6 2409 1 1 4 LYS NZ N 4.585 -4.019 -9.403 1.00 . A A . 4 LYS NZ 1 1 6 2410 1 1 4 LYS O O 3.221 -0.111 -5.021 1.00 . A A . 4 LYS O 1 1 6 2411 1 1 5 LYS C C 3.979 2.538 -5.535 1.00 . A A . 5 LYS C 1 1 6 2412 1 1 5 LYS CA C 5.108 1.908 -4.727 1.00 . A A . 5 LYS CA 1 1 6 2413 1 1 5 LYS CB C 6.372 2.768 -4.845 1.00 . A A . 5 LYS CB 1 1 6 2414 1 1 5 LYS CD C 7.316 5.034 -4.246 1.00 . A A . 5 LYS CD 1 1 6 2415 1 1 5 LYS CE C 7.022 6.526 -4.206 1.00 . A A . 5 LYS CE 1 1 6 2416 1 1 5 LYS CG C 6.094 4.257 -4.692 1.00 . A A . 5 LYS CG 1 1 6 2417 1 1 5 LYS H H 6.307 0.228 -5.210 1.00 . A A . 5 LYS H 1 1 6 2418 1 1 5 LYS HA H 4.801 1.906 -3.697 1.00 . A A . 5 LYS HA 1 1 6 2419 1 1 5 LYS HB2 H 7.073 2.470 -4.079 1.00 . A A . 5 LYS HB2 1 1 6 2420 1 1 5 LYS HB3 H 6.819 2.603 -5.816 1.00 . A A . 5 LYS HB3 1 1 6 2421 1 1 5 LYS HD2 H 7.603 4.703 -3.258 1.00 . A A . 5 LYS HD2 1 1 6 2422 1 1 5 LYS HD3 H 8.123 4.852 -4.941 1.00 . A A . 5 LYS HD3 1 1 6 2423 1 1 5 LYS HE2 H 7.206 6.940 -5.187 1.00 . A A . 5 LYS HE2 1 1 6 2424 1 1 5 LYS HE3 H 5.981 6.670 -3.947 1.00 . A A . 5 LYS HE3 1 1 6 2425 1 1 5 LYS HG2 H 5.762 4.653 -5.635 1.00 . A A . 5 LYS HG2 1 1 6 2426 1 1 5 LYS HG3 H 5.314 4.385 -3.966 1.00 . A A . 5 LYS HG3 1 1 6 2427 1 1 5 LYS HZ1 H 7.665 6.880 -2.245 1.00 . A A . 5 LYS HZ1 1 1 6 2428 1 1 5 LYS HZ2 H 7.696 8.252 -3.243 1.00 . A A . 5 LYS HZ2 1 1 6 2429 1 1 5 LYS HZ3 H 8.881 7.061 -3.415 1.00 . A A . 5 LYS HZ3 1 1 6 2430 1 1 5 LYS N N 5.381 0.514 -5.087 1.00 . A A . 5 LYS N 1 1 6 2431 1 1 5 LYS NZ N 7.878 7.231 -3.214 1.00 . A A . 5 LYS NZ 1 1 6 2432 1 1 5 LYS O O 2.921 2.832 -5.009 1.00 . A A . 5 LYS O 1 1 6 2433 1 1 6 TRP C C 2.145 2.328 -8.057 1.00 . A A . 6 TRP C 1 1 6 2434 1 1 6 TRP CA C 3.160 3.370 -7.617 1.00 . A A . 6 TRP CA 1 1 6 2435 1 1 6 TRP CB C 3.792 4.086 -8.810 1.00 . A A . 6 TRP CB 1 1 6 2436 1 1 6 TRP CD1 C 6.295 4.415 -8.335 1.00 . A A . 6 TRP CD1 1 1 6 2437 1 1 6 TRP CD2 C 5.078 6.280 -8.114 1.00 . A A . 6 TRP CD2 1 1 6 2438 1 1 6 TRP CE2 C 6.427 6.589 -7.853 1.00 . A A . 6 TRP CE2 1 1 6 2439 1 1 6 TRP CE3 C 4.129 7.299 -8.026 1.00 . A A . 6 TRP CE3 1 1 6 2440 1 1 6 TRP CG C 5.017 4.885 -8.445 1.00 . A A . 6 TRP CG 1 1 6 2441 1 1 6 TRP CH2 C 5.892 8.851 -7.434 1.00 . A A . 6 TRP CH2 1 1 6 2442 1 1 6 TRP CZ2 C 6.845 7.874 -7.513 1.00 . A A . 6 TRP CZ2 1 1 6 2443 1 1 6 TRP CZ3 C 4.544 8.572 -7.684 1.00 . A A . 6 TRP CZ3 1 1 6 2444 1 1 6 TRP H H 5.033 2.508 -7.196 1.00 . A A . 6 TRP H 1 1 6 2445 1 1 6 TRP HA H 2.646 4.100 -6.999 1.00 . A A . 6 TRP HA 1 1 6 2446 1 1 6 TRP HB2 H 4.079 3.354 -9.550 1.00 . A A . 6 TRP HB2 1 1 6 2447 1 1 6 TRP HB3 H 3.068 4.763 -9.241 1.00 . A A . 6 TRP HB3 1 1 6 2448 1 1 6 TRP HD1 H 6.579 3.390 -8.502 1.00 . A A . 6 TRP HD1 1 1 6 2449 1 1 6 TRP HE1 H 8.119 5.350 -7.880 1.00 . A A . 6 TRP HE1 1 1 6 2450 1 1 6 TRP HE3 H 3.086 7.103 -8.206 1.00 . A A . 6 TRP HE3 1 1 6 2451 1 1 6 TRP HH2 H 6.172 9.860 -7.170 1.00 . A A . 6 TRP HH2 1 1 6 2452 1 1 6 TRP HZ2 H 7.883 8.103 -7.317 1.00 . A A . 6 TRP HZ2 1 1 6 2453 1 1 6 TRP HZ3 H 3.821 9.372 -7.612 1.00 . A A . 6 TRP HZ3 1 1 6 2454 1 1 6 TRP N N 4.188 2.757 -6.801 1.00 . A A . 6 TRP N 1 1 6 2455 1 1 6 TRP NE1 N 7.150 5.435 -7.997 1.00 . A A . 6 TRP NE1 1 1 6 2456 1 1 6 TRP O O 1.605 2.385 -9.160 1.00 . A A . 6 TRP O 1 1 6 2457 1 1 7 GLU C C -0.066 0.238 -6.311 1.00 . A A . 7 GLU C 1 1 6 2458 1 1 7 GLU CA C 0.948 0.313 -7.444 1.00 . A A . 7 GLU CA 1 1 6 2459 1 1 7 GLU CB C 1.696 -1.007 -7.597 1.00 . A A . 7 GLU CB 1 1 6 2460 1 1 7 GLU CD C 1.826 -3.261 -8.676 1.00 . A A . 7 GLU CD 1 1 6 2461 1 1 7 GLU CG C 0.924 -2.104 -8.306 1.00 . A A . 7 GLU CG 1 1 6 2462 1 1 7 GLU H H 2.373 1.392 -6.295 1.00 . A A . 7 GLU H 1 1 6 2463 1 1 7 GLU HA H 0.433 0.544 -8.365 1.00 . A A . 7 GLU HA 1 1 6 2464 1 1 7 GLU HB2 H 2.602 -0.825 -8.156 1.00 . A A . 7 GLU HB2 1 1 6 2465 1 1 7 GLU HB3 H 1.962 -1.366 -6.614 1.00 . A A . 7 GLU HB3 1 1 6 2466 1 1 7 GLU HG2 H 0.143 -2.464 -7.651 1.00 . A A . 7 GLU HG2 1 1 6 2467 1 1 7 GLU HG3 H 0.486 -1.700 -9.207 1.00 . A A . 7 GLU HG3 1 1 6 2468 1 1 7 GLU N N 1.895 1.377 -7.174 1.00 . A A . 7 GLU N 1 1 6 2469 1 1 7 GLU O O 0.236 0.610 -5.176 1.00 . A A . 7 GLU O 1 1 6 2470 1 1 7 GLU OE1 O 2.367 -3.920 -7.762 1.00 . A A . 7 GLU OE1 1 1 6 2471 1 1 7 GLU OE2 O 2.060 -3.478 -9.884 1.00 . A A . 7 GLU OE2 1 1 6 2472 1 1 8 TYR C C -1.917 -1.278 -4.510 1.00 . A A . 8 TYR C 1 1 6 2473 1 1 8 TYR CA C -2.323 -0.325 -5.626 1.00 . A A . 8 TYR CA 1 1 6 2474 1 1 8 TYR CB C -3.633 -0.800 -6.266 1.00 . A A . 8 TYR CB 1 1 6 2475 1 1 8 TYR CD1 C -3.653 0.891 -8.153 1.00 . A A . 8 TYR CD1 1 1 6 2476 1 1 8 TYR CD2 C -5.651 0.582 -6.892 1.00 . A A . 8 TYR CD2 1 1 6 2477 1 1 8 TYR CE1 C -4.286 1.841 -8.931 1.00 . A A . 8 TYR CE1 1 1 6 2478 1 1 8 TYR CE2 C -6.290 1.531 -7.665 1.00 . A A . 8 TYR CE2 1 1 6 2479 1 1 8 TYR CG C -4.323 0.245 -7.121 1.00 . A A . 8 TYR CG 1 1 6 2480 1 1 8 TYR CZ C -5.604 2.158 -8.682 1.00 . A A . 8 TYR CZ 1 1 6 2481 1 1 8 TYR H H -1.453 -0.487 -7.546 1.00 . A A . 8 TYR H 1 1 6 2482 1 1 8 TYR HA H -2.475 0.658 -5.204 1.00 . A A . 8 TYR HA 1 1 6 2483 1 1 8 TYR HB2 H -3.428 -1.653 -6.893 1.00 . A A . 8 TYR HB2 1 1 6 2484 1 1 8 TYR HB3 H -4.318 -1.092 -5.484 1.00 . A A . 8 TYR HB3 1 1 6 2485 1 1 8 TYR HD1 H -2.621 0.640 -8.347 1.00 . A A . 8 TYR HD1 1 1 6 2486 1 1 8 TYR HD2 H -6.187 0.090 -6.093 1.00 . A A . 8 TYR HD2 1 1 6 2487 1 1 8 TYR HE1 H -3.747 2.332 -9.728 1.00 . A A . 8 TYR HE1 1 1 6 2488 1 1 8 TYR HE2 H -7.324 1.779 -7.470 1.00 . A A . 8 TYR HE2 1 1 6 2489 1 1 8 TYR HH H -6.064 3.978 -9.093 1.00 . A A . 8 TYR HH 1 1 6 2490 1 1 8 TYR N N -1.268 -0.220 -6.623 1.00 . A A . 8 TYR N 1 1 6 2491 1 1 8 TYR O O -1.538 -2.418 -4.766 1.00 . A A . 8 TYR O 1 1 6 2492 1 1 8 TYR OH O -6.237 3.105 -9.453 1.00 . A A . 8 TYR OH 1 1 6 2493 1 1 9 CYS C C -2.505 -2.844 -2.024 1.00 . A A . 9 CYS C 1 1 6 2494 1 1 9 CYS CA C -1.635 -1.591 -2.106 1.00 . A A . 9 CYS CA 1 1 6 2495 1 1 9 CYS CB C -1.782 -0.747 -0.834 1.00 . A A . 9 CYS CB 1 1 6 2496 1 1 9 CYS H H -2.298 0.127 -3.147 1.00 . A A . 9 CYS H 1 1 6 2497 1 1 9 CYS HA H -0.603 -1.890 -2.214 1.00 . A A . 9 CYS HA 1 1 6 2498 1 1 9 CYS HB2 H -1.139 0.116 -0.912 1.00 . A A . 9 CYS HB2 1 1 6 2499 1 1 9 CYS HB3 H -2.807 -0.416 -0.751 1.00 . A A . 9 CYS HB3 1 1 6 2500 1 1 9 CYS N N -1.996 -0.794 -3.276 1.00 . A A . 9 CYS N 1 1 6 2501 1 1 9 CYS O O -2.003 -3.934 -1.753 1.00 . A A . 9 CYS O 1 1 6 2502 1 1 9 CYS SG S -1.354 -1.612 0.713 1.00 . A A . 9 CYS SG 1 1 6 2503 1 1 10 ILE C C -5.050 -4.261 -0.849 1.00 . A A . 10 ILE C 1 1 6 2504 1 1 10 ILE CA C -4.779 -3.763 -2.270 1.00 . A A . 10 ILE CA 1 1 6 2505 1 1 10 ILE CB C -4.329 -4.949 -3.164 1.00 . A A . 10 ILE CB 1 1 6 2506 1 1 10 ILE CD1 C -5.499 -3.984 -5.221 1.00 . A A . 10 ILE CD1 1 1 6 2507 1 1 10 ILE CG1 C -4.206 -4.505 -4.626 1.00 . A A . 10 ILE CG1 1 1 6 2508 1 1 10 ILE CG2 C -5.292 -6.125 -3.044 1.00 . A A . 10 ILE CG2 1 1 6 2509 1 1 10 ILE H H -4.118 -1.771 -2.510 1.00 . A A . 10 ILE H 1 1 6 2510 1 1 10 ILE HA H -5.704 -3.377 -2.675 1.00 . A A . 10 ILE HA 1 1 6 2511 1 1 10 ILE HB H -3.361 -5.279 -2.817 1.00 . A A . 10 ILE HB 1 1 6 2512 1 1 10 ILE HD11 H -5.288 -3.472 -6.148 1.00 . A A . 10 ILE HD11 1 1 6 2513 1 1 10 ILE HD12 H -5.962 -3.298 -4.528 1.00 . A A . 10 ILE HD12 1 1 6 2514 1 1 10 ILE HD13 H -6.167 -4.811 -5.410 1.00 . A A . 10 ILE HD13 1 1 6 2515 1 1 10 ILE HG12 H -3.471 -3.717 -4.695 1.00 . A A . 10 ILE HG12 1 1 6 2516 1 1 10 ILE HG13 H -3.881 -5.345 -5.224 1.00 . A A . 10 ILE HG13 1 1 6 2517 1 1 10 ILE HG21 H -4.754 -7.001 -2.713 1.00 . A A . 10 ILE HG21 1 1 6 2518 1 1 10 ILE HG22 H -5.741 -6.322 -4.007 1.00 . A A . 10 ILE HG22 1 1 6 2519 1 1 10 ILE HG23 H -6.066 -5.886 -2.329 1.00 . A A . 10 ILE HG23 1 1 6 2520 1 1 10 ILE N N -3.806 -2.667 -2.286 1.00 . A A . 10 ILE N 1 1 6 2521 1 1 10 ILE O O -4.131 -4.499 -0.067 1.00 . A A . 10 ILE O 1 1 6 2522 1 1 11 VAL C C -7.833 -5.949 0.658 1.00 . A A . 11 VAL C 1 1 6 2523 1 1 11 VAL CA C -6.714 -4.912 0.790 1.00 . A A . 11 VAL CA 1 1 6 2524 1 1 11 VAL CB C -7.150 -3.757 1.735 1.00 . A A . 11 VAL CB 1 1 6 2525 1 1 11 VAL CG1 C -5.956 -2.892 2.113 1.00 . A A . 11 VAL CG1 1 1 6 2526 1 1 11 VAL CG2 C -8.236 -2.897 1.100 1.00 . A A . 11 VAL CG2 1 1 6 2527 1 1 11 VAL H H -7.019 -4.234 -1.184 1.00 . A A . 11 VAL H 1 1 6 2528 1 1 11 VAL HA H -5.851 -5.395 1.228 1.00 . A A . 11 VAL HA 1 1 6 2529 1 1 11 VAL HB H -7.544 -4.192 2.641 1.00 . A A . 11 VAL HB 1 1 6 2530 1 1 11 VAL HG11 H -5.117 -3.141 1.481 1.00 . A A . 11 VAL HG11 1 1 6 2531 1 1 11 VAL HG12 H -5.695 -3.071 3.145 1.00 . A A . 11 VAL HG12 1 1 6 2532 1 1 11 VAL HG13 H -6.211 -1.851 1.981 1.00 . A A . 11 VAL HG13 1 1 6 2533 1 1 11 VAL HG21 H -8.417 -2.031 1.721 1.00 . A A . 11 VAL HG21 1 1 6 2534 1 1 11 VAL HG22 H -9.145 -3.473 1.012 1.00 . A A . 11 VAL HG22 1 1 6 2535 1 1 11 VAL HG23 H -7.915 -2.577 0.120 1.00 . A A . 11 VAL HG23 1 1 6 2536 1 1 11 VAL N N -6.323 -4.428 -0.523 1.00 . A A . 11 VAL N 1 1 6 2537 1 1 11 VAL O O -8.970 -5.626 0.312 1.00 . A A . 11 VAL O 1 1 6 2538 1 1 12 PRO C C -9.473 -8.312 1.953 1.00 . A A . 12 PRO C 1 1 6 2539 1 1 12 PRO CA C -8.470 -8.325 0.805 1.00 . A A . 12 PRO CA 1 1 6 2540 1 1 12 PRO CB C -7.597 -9.589 0.874 1.00 . A A . 12 PRO CB 1 1 6 2541 1 1 12 PRO CD C -6.179 -7.704 1.287 1.00 . A A . 12 PRO CD 1 1 6 2542 1 1 12 PRO CG C -6.183 -9.115 0.775 1.00 . A A . 12 PRO CG 1 1 6 2543 1 1 12 PRO HA H -9.001 -8.300 -0.136 1.00 . A A . 12 PRO HA 1 1 6 2544 1 1 12 PRO HB2 H -7.774 -10.097 1.811 1.00 . A A . 12 PRO HB2 1 1 6 2545 1 1 12 PRO HB3 H -7.848 -10.245 0.054 1.00 . A A . 12 PRO HB3 1 1 6 2546 1 1 12 PRO HD2 H -6.053 -7.691 2.360 1.00 . A A . 12 PRO HD2 1 1 6 2547 1 1 12 PRO HD3 H -5.406 -7.127 0.803 1.00 . A A . 12 PRO HD3 1 1 6 2548 1 1 12 PRO HG2 H -5.544 -9.736 1.385 1.00 . A A . 12 PRO HG2 1 1 6 2549 1 1 12 PRO HG3 H -5.859 -9.140 -0.255 1.00 . A A . 12 PRO HG3 1 1 6 2550 1 1 12 PRO N N -7.510 -7.225 0.906 1.00 . A A . 12 PRO N 1 1 6 2551 1 1 12 PRO O O -9.146 -7.885 3.059 1.00 . A A . 12 PRO O 1 1 6 2552 1 1 13 ILE C C -11.434 -9.926 3.739 1.00 . A A . 13 ILE C 1 1 6 2553 1 1 13 ILE CA C -11.742 -8.841 2.702 1.00 . A A . 13 ILE CA 1 1 6 2554 1 1 13 ILE CB C -13.128 -9.101 2.065 1.00 . A A . 13 ILE CB 1 1 6 2555 1 1 13 ILE CD1 C -14.625 -8.449 0.103 1.00 . A A . 13 ILE CD1 1 1 6 2556 1 1 13 ILE CG1 C -13.328 -8.197 0.843 1.00 . A A . 13 ILE CG1 1 1 6 2557 1 1 13 ILE CG2 C -14.236 -8.859 3.084 1.00 . A A . 13 ILE CG2 1 1 6 2558 1 1 13 ILE H H -10.881 -9.118 0.787 1.00 . A A . 13 ILE H 1 1 6 2559 1 1 13 ILE HA H -11.770 -7.882 3.200 1.00 . A A . 13 ILE HA 1 1 6 2560 1 1 13 ILE HB H -13.172 -10.133 1.754 1.00 . A A . 13 ILE HB 1 1 6 2561 1 1 13 ILE HD11 H -14.462 -8.331 -0.959 1.00 . A A . 13 ILE HD11 1 1 6 2562 1 1 13 ILE HD12 H -15.372 -7.742 0.434 1.00 . A A . 13 ILE HD12 1 1 6 2563 1 1 13 ILE HD13 H -14.965 -9.454 0.306 1.00 . A A . 13 ILE HD13 1 1 6 2564 1 1 13 ILE HG12 H -13.325 -7.165 1.163 1.00 . A A . 13 ILE HG12 1 1 6 2565 1 1 13 ILE HG13 H -12.514 -8.356 0.151 1.00 . A A . 13 ILE HG13 1 1 6 2566 1 1 13 ILE HG21 H -14.747 -7.938 2.850 1.00 . A A . 13 ILE HG21 1 1 6 2567 1 1 13 ILE HG22 H -13.806 -8.791 4.074 1.00 . A A . 13 ILE HG22 1 1 6 2568 1 1 13 ILE HG23 H -14.938 -9.679 3.054 1.00 . A A . 13 ILE HG23 1 1 6 2569 1 1 13 ILE N N -10.687 -8.788 1.687 1.00 . A A . 13 ILE N 1 1 6 2570 1 1 13 ILE O O -12.143 -10.926 3.852 1.00 . A A . 13 ILE O 1 1 6 2571 1 1 14 LEU C C -8.653 -10.036 6.188 1.00 . A A . 14 LEU C 1 1 6 2572 1 1 14 LEU CA C -9.875 -10.633 5.497 1.00 . A A . 14 LEU CA 1 1 6 2573 1 1 14 LEU CB C -9.541 -12.011 4.893 1.00 . A A . 14 LEU CB 1 1 6 2574 1 1 14 LEU CD1 C -7.145 -12.012 4.096 1.00 . A A . 14 LEU CD1 1 1 6 2575 1 1 14 LEU CD2 C -8.907 -13.201 2.777 1.00 . A A . 14 LEU CD2 1 1 6 2576 1 1 14 LEU CG C -8.608 -12.009 3.673 1.00 . A A . 14 LEU CG 1 1 6 2577 1 1 14 LEU H H -9.834 -8.893 4.302 1.00 . A A . 14 LEU H 1 1 6 2578 1 1 14 LEU HA H -10.664 -10.747 6.226 1.00 . A A . 14 LEU HA 1 1 6 2579 1 1 14 LEU HB2 H -9.082 -12.612 5.664 1.00 . A A . 14 LEU HB2 1 1 6 2580 1 1 14 LEU HB3 H -10.469 -12.483 4.604 1.00 . A A . 14 LEU HB3 1 1 6 2581 1 1 14 LEU HD11 H -7.061 -11.638 5.105 1.00 . A A . 14 LEU HD11 1 1 6 2582 1 1 14 LEU HD12 H -6.576 -11.381 3.429 1.00 . A A . 14 LEU HD12 1 1 6 2583 1 1 14 LEU HD13 H -6.760 -13.021 4.052 1.00 . A A . 14 LEU HD13 1 1 6 2584 1 1 14 LEU HD21 H -9.476 -13.933 3.330 1.00 . A A . 14 LEU HD21 1 1 6 2585 1 1 14 LEU HD22 H -7.979 -13.642 2.443 1.00 . A A . 14 LEU HD22 1 1 6 2586 1 1 14 LEU HD23 H -9.478 -12.874 1.921 1.00 . A A . 14 LEU HD23 1 1 6 2587 1 1 14 LEU HG H -8.784 -11.110 3.099 1.00 . A A . 14 LEU HG 1 1 6 2588 1 1 14 LEU N N -10.349 -9.712 4.470 1.00 . A A . 14 LEU N 1 1 6 2589 1 1 14 LEU O O -8.310 -10.407 7.308 1.00 . A A . 14 LEU O 1 1 6 2590 1 1 15 GLY C C -6.344 -7.353 5.112 1.00 . A A . 15 GLY C 1 1 6 2591 1 1 15 GLY CA C -6.827 -8.454 6.032 1.00 . A A . 15 GLY CA 1 1 6 2592 1 1 15 GLY H H -8.329 -8.850 4.609 1.00 . A A . 15 GLY H 1 1 6 2593 1 1 15 GLY HA2 H -7.064 -8.030 6.997 1.00 . A A . 15 GLY HA2 1 1 6 2594 1 1 15 GLY HA3 H -6.041 -9.184 6.149 1.00 . A A . 15 GLY HA3 1 1 6 2595 1 1 15 GLY N N -8.003 -9.104 5.498 1.00 . A A . 15 GLY N 1 1 6 2596 1 1 15 GLY O O -7.146 -6.568 4.614 1.00 . A A . 15 GLY O 1 1 6 2597 1 1 16 PHE C C -3.019 -6.649 3.667 1.00 . A A . 16 PHE C 1 1 6 2598 1 1 16 PHE CA C -4.462 -6.292 4.001 1.00 . A A . 16 PHE CA 1 1 6 2599 1 1 16 PHE CB C -4.554 -4.896 4.644 1.00 . A A . 16 PHE CB 1 1 6 2600 1 1 16 PHE CD1 C -2.560 -4.783 6.186 1.00 . A A . 16 PHE CD1 1 1 6 2601 1 1 16 PHE CD2 C -4.741 -4.684 7.141 1.00 . A A . 16 PHE CD2 1 1 6 2602 1 1 16 PHE CE1 C -2.000 -4.682 7.445 1.00 . A A . 16 PHE CE1 1 1 6 2603 1 1 16 PHE CE2 C -4.188 -4.583 8.403 1.00 . A A . 16 PHE CE2 1 1 6 2604 1 1 16 PHE CG C -3.936 -4.786 6.017 1.00 . A A . 16 PHE CG 1 1 6 2605 1 1 16 PHE CZ C -2.815 -4.582 8.555 1.00 . A A . 16 PHE CZ 1 1 6 2606 1 1 16 PHE H H -4.449 -7.962 5.294 1.00 . A A . 16 PHE H 1 1 6 2607 1 1 16 PHE HA H -5.033 -6.290 3.084 1.00 . A A . 16 PHE HA 1 1 6 2608 1 1 16 PHE HB2 H -4.064 -4.181 4.003 1.00 . A A . 16 PHE HB2 1 1 6 2609 1 1 16 PHE HB3 H -5.598 -4.625 4.732 1.00 . A A . 16 PHE HB3 1 1 6 2610 1 1 16 PHE HD1 H -1.921 -4.861 5.318 1.00 . A A . 16 PHE HD1 1 1 6 2611 1 1 16 PHE HD2 H -5.816 -4.685 7.023 1.00 . A A . 16 PHE HD2 1 1 6 2612 1 1 16 PHE HE1 H -0.927 -4.681 7.561 1.00 . A A . 16 PHE HE1 1 1 6 2613 1 1 16 PHE HE2 H -4.827 -4.505 9.269 1.00 . A A . 16 PHE HE2 1 1 6 2614 1 1 16 PHE HZ H -2.380 -4.502 9.540 1.00 . A A . 16 PHE HZ 1 1 6 2615 1 1 16 PHE N N -5.042 -7.302 4.875 1.00 . A A . 16 PHE N 1 1 6 2616 1 1 16 PHE O O -2.364 -7.364 4.427 1.00 . A A . 16 PHE O 1 1 6 2617 1 1 17 VAL C C -0.227 -5.408 2.732 1.00 . A A . 17 VAL C 1 1 6 2618 1 1 17 VAL CA C -1.170 -6.439 2.105 1.00 . A A . 17 VAL CA 1 1 6 2619 1 1 17 VAL CB C -1.043 -6.431 0.557 1.00 . A A . 17 VAL CB 1 1 6 2620 1 1 17 VAL CG1 C 0.171 -7.229 0.094 1.00 . A A . 17 VAL CG1 1 1 6 2621 1 1 17 VAL CG2 C -2.305 -6.986 -0.089 1.00 . A A . 17 VAL CG2 1 1 6 2622 1 1 17 VAL H H -3.108 -5.607 1.962 1.00 . A A . 17 VAL H 1 1 6 2623 1 1 17 VAL HA H -0.894 -7.419 2.463 1.00 . A A . 17 VAL HA 1 1 6 2624 1 1 17 VAL HB H -0.919 -5.409 0.231 1.00 . A A . 17 VAL HB 1 1 6 2625 1 1 17 VAL HG11 H 0.895 -6.561 -0.348 1.00 . A A . 17 VAL HG11 1 1 6 2626 1 1 17 VAL HG12 H -0.138 -7.960 -0.640 1.00 . A A . 17 VAL HG12 1 1 6 2627 1 1 17 VAL HG13 H 0.615 -7.734 0.939 1.00 . A A . 17 VAL HG13 1 1 6 2628 1 1 17 VAL HG21 H -2.354 -8.053 0.075 1.00 . A A . 17 VAL HG21 1 1 6 2629 1 1 17 VAL HG22 H -2.284 -6.785 -1.150 1.00 . A A . 17 VAL HG22 1 1 6 2630 1 1 17 VAL HG23 H -3.171 -6.514 0.350 1.00 . A A . 17 VAL HG23 1 1 6 2631 1 1 17 VAL N N -2.537 -6.166 2.529 1.00 . A A . 17 VAL N 1 1 6 2632 1 1 17 VAL O O -0.609 -4.691 3.656 1.00 . A A . 17 VAL O 1 1 6 2633 1 1 18 TYR C C 3.051 -4.135 1.715 1.00 . A A . 18 TYR C 1 1 6 2634 1 1 18 TYR CA C 1.987 -4.417 2.766 1.00 . A A . 18 TYR CA 1 1 6 2635 1 1 18 TYR CB C 2.632 -4.998 4.037 1.00 . A A . 18 TYR CB 1 1 6 2636 1 1 18 TYR CD1 C 4.600 -6.457 3.389 1.00 . A A . 18 TYR CD1 1 1 6 2637 1 1 18 TYR CD2 C 2.576 -7.527 4.057 1.00 . A A . 18 TYR CD2 1 1 6 2638 1 1 18 TYR CE1 C 5.187 -7.690 3.178 1.00 . A A . 18 TYR CE1 1 1 6 2639 1 1 18 TYR CE2 C 3.158 -8.764 3.851 1.00 . A A . 18 TYR CE2 1 1 6 2640 1 1 18 TYR CG C 3.285 -6.353 3.830 1.00 . A A . 18 TYR CG 1 1 6 2641 1 1 18 TYR CZ C 4.462 -8.839 3.411 1.00 . A A . 18 TYR CZ 1 1 6 2642 1 1 18 TYR H H 1.246 -5.944 1.514 1.00 . A A . 18 TYR H 1 1 6 2643 1 1 18 TYR HA H 1.484 -3.494 3.014 1.00 . A A . 18 TYR HA 1 1 6 2644 1 1 18 TYR HB2 H 3.391 -4.316 4.389 1.00 . A A . 18 TYR HB2 1 1 6 2645 1 1 18 TYR HB3 H 1.873 -5.107 4.798 1.00 . A A . 18 TYR HB3 1 1 6 2646 1 1 18 TYR HD1 H 5.166 -5.556 3.209 1.00 . A A . 18 TYR HD1 1 1 6 2647 1 1 18 TYR HD2 H 1.554 -7.465 4.401 1.00 . A A . 18 TYR HD2 1 1 6 2648 1 1 18 TYR HE1 H 6.209 -7.750 2.835 1.00 . A A . 18 TYR HE1 1 1 6 2649 1 1 18 TYR HE2 H 2.590 -9.664 4.033 1.00 . A A . 18 TYR HE2 1 1 6 2650 1 1 18 TYR HH H 5.465 -10.372 4.004 1.00 . A A . 18 TYR HH 1 1 6 2651 1 1 18 TYR N N 0.996 -5.344 2.243 1.00 . A A . 18 TYR N 1 1 6 2652 1 1 18 TYR O O 3.421 -5.021 0.949 1.00 . A A . 18 TYR O 1 1 6 2653 1 1 18 TYR OH O 5.040 -10.071 3.190 1.00 . A A . 18 TYR OH 1 1 6 2654 1 1 19 CYS C C 5.920 -3.057 1.099 1.00 . A A . 19 CYS C 1 1 6 2655 1 1 19 CYS CA C 4.555 -2.506 0.719 1.00 . A A . 19 CYS CA 1 1 6 2656 1 1 19 CYS CB C 4.635 -0.996 0.668 1.00 . A A . 19 CYS CB 1 1 6 2657 1 1 19 CYS H H 3.187 -2.237 2.310 1.00 . A A . 19 CYS H 1 1 6 2658 1 1 19 CYS HA H 4.277 -2.880 -0.254 1.00 . A A . 19 CYS HA 1 1 6 2659 1 1 19 CYS HB2 H 4.659 -0.638 1.680 1.00 . A A . 19 CYS HB2 1 1 6 2660 1 1 19 CYS HB3 H 5.548 -0.693 0.163 1.00 . A A . 19 CYS HB3 1 1 6 2661 1 1 19 CYS N N 3.530 -2.905 1.677 1.00 . A A . 19 CYS N 1 1 6 2662 1 1 19 CYS O O 6.119 -3.553 2.209 1.00 . A A . 19 CYS O 1 1 6 2663 1 1 19 CYS SG S 3.224 -0.206 -0.163 1.00 . A A . 19 CYS SG 1 1 6 2664 1 1 20 CYS C C 8.870 -2.531 1.455 1.00 . A A . 20 CYS C 1 1 6 2665 1 1 20 CYS CA C 8.223 -3.413 0.407 1.00 . A A . 20 CYS CA 1 1 6 2666 1 1 20 CYS CB C 9.036 -3.366 -0.884 1.00 . A A . 20 CYS CB 1 1 6 2667 1 1 20 CYS H H 6.645 -2.534 -0.689 1.00 . A A . 20 CYS H 1 1 6 2668 1 1 20 CYS HA H 8.179 -4.429 0.770 1.00 . A A . 20 CYS HA 1 1 6 2669 1 1 20 CYS HB2 H 9.279 -2.338 -1.101 1.00 . A A . 20 CYS HB2 1 1 6 2670 1 1 20 CYS HB3 H 9.950 -3.921 -0.741 1.00 . A A . 20 CYS HB3 1 1 6 2671 1 1 20 CYS N N 6.865 -2.949 0.171 1.00 . A A . 20 CYS N 1 1 6 2672 1 1 20 CYS O O 8.477 -1.375 1.608 1.00 . A A . 20 CYS O 1 1 6 2673 1 1 20 CYS SG S 8.177 -4.065 -2.338 1.00 . A A . 20 CYS SG 1 1 6 2674 1 1 21 PRO C C 11.019 -0.942 2.710 1.00 . A A . 21 PRO C 1 1 6 2675 1 1 21 PRO CA C 10.523 -2.274 3.239 1.00 . A A . 21 PRO CA 1 1 6 2676 1 1 21 PRO CB C 11.684 -3.154 3.667 1.00 . A A . 21 PRO CB 1 1 6 2677 1 1 21 PRO CD C 10.387 -4.418 2.107 1.00 . A A . 21 PRO CD 1 1 6 2678 1 1 21 PRO CG C 11.242 -4.540 3.343 1.00 . A A . 21 PRO CG 1 1 6 2679 1 1 21 PRO HA H 9.869 -2.100 4.081 1.00 . A A . 21 PRO HA 1 1 6 2680 1 1 21 PRO HB2 H 12.573 -2.877 3.118 1.00 . A A . 21 PRO HB2 1 1 6 2681 1 1 21 PRO HB3 H 11.847 -3.022 4.723 1.00 . A A . 21 PRO HB3 1 1 6 2682 1 1 21 PRO HD2 H 10.988 -4.536 1.218 1.00 . A A . 21 PRO HD2 1 1 6 2683 1 1 21 PRO HD3 H 9.588 -5.143 2.122 1.00 . A A . 21 PRO HD3 1 1 6 2684 1 1 21 PRO HG2 H 12.101 -5.164 3.146 1.00 . A A . 21 PRO HG2 1 1 6 2685 1 1 21 PRO HG3 H 10.663 -4.943 4.160 1.00 . A A . 21 PRO HG3 1 1 6 2686 1 1 21 PRO N N 9.854 -3.050 2.203 1.00 . A A . 21 PRO N 1 1 6 2687 1 1 21 PRO O O 11.868 -0.876 1.822 1.00 . A A . 21 PRO O 1 1 6 2688 1 1 22 GLY C C 9.586 2.176 2.258 1.00 . A A . 22 GLY C 1 1 6 2689 1 1 22 GLY CA C 10.781 1.446 2.839 1.00 . A A . 22 GLY CA 1 1 6 2690 1 1 22 GLY H H 9.761 -0.042 3.933 1.00 . A A . 22 GLY H 1 1 6 2691 1 1 22 GLY HA2 H 11.147 1.996 3.694 1.00 . A A . 22 GLY HA2 1 1 6 2692 1 1 22 GLY HA3 H 11.559 1.399 2.092 1.00 . A A . 22 GLY HA3 1 1 6 2693 1 1 22 GLY N N 10.444 0.104 3.253 1.00 . A A . 22 GLY N 1 1 6 2694 1 1 22 GLY O O 9.486 3.395 2.367 1.00 . A A . 22 GLY O 1 1 6 2695 1 1 23 LEU C C 6.286 1.795 1.955 1.00 . A A . 23 LEU C 1 1 6 2696 1 1 23 LEU CA C 7.487 2.001 1.040 1.00 . A A . 23 LEU CA 1 1 6 2697 1 1 23 LEU CB C 7.232 1.350 -0.320 1.00 . A A . 23 LEU CB 1 1 6 2698 1 1 23 LEU CD1 C 8.101 0.564 -2.534 1.00 . A A . 23 LEU CD1 1 1 6 2699 1 1 23 LEU CD2 C 8.776 2.806 -1.658 1.00 . A A . 23 LEU CD2 1 1 6 2700 1 1 23 LEU CG C 8.417 1.374 -1.287 1.00 . A A . 23 LEU CG 1 1 6 2701 1 1 23 LEU H H 8.801 0.450 1.588 1.00 . A A . 23 LEU H 1 1 6 2702 1 1 23 LEU HA H 7.654 3.058 0.904 1.00 . A A . 23 LEU HA 1 1 6 2703 1 1 23 LEU HB2 H 6.952 0.319 -0.154 1.00 . A A . 23 LEU HB2 1 1 6 2704 1 1 23 LEU HB3 H 6.404 1.860 -0.789 1.00 . A A . 23 LEU HB3 1 1 6 2705 1 1 23 LEU HD11 H 7.588 -0.343 -2.253 1.00 . A A . 23 LEU HD11 1 1 6 2706 1 1 23 LEU HD12 H 9.020 0.315 -3.044 1.00 . A A . 23 LEU HD12 1 1 6 2707 1 1 23 LEU HD13 H 7.471 1.145 -3.192 1.00 . A A . 23 LEU HD13 1 1 6 2708 1 1 23 LEU HD21 H 9.591 3.145 -1.036 1.00 . A A . 23 LEU HD21 1 1 6 2709 1 1 23 LEU HD22 H 7.917 3.443 -1.504 1.00 . A A . 23 LEU HD22 1 1 6 2710 1 1 23 LEU HD23 H 9.074 2.846 -2.695 1.00 . A A . 23 LEU HD23 1 1 6 2711 1 1 23 LEU HG H 9.276 0.926 -0.807 1.00 . A A . 23 LEU HG 1 1 6 2712 1 1 23 LEU N N 8.676 1.425 1.640 1.00 . A A . 23 LEU N 1 1 6 2713 1 1 23 LEU O O 6.201 0.786 2.662 1.00 . A A . 23 LEU O 1 1 6 2714 1 1 24 ILE C C 2.899 2.907 1.965 1.00 . A A . 24 ILE C 1 1 6 2715 1 1 24 ILE CA C 4.168 2.650 2.776 1.00 . A A . 24 ILE CA 1 1 6 2716 1 1 24 ILE CB C 4.219 3.633 3.969 1.00 . A A . 24 ILE CB 1 1 6 2717 1 1 24 ILE CD1 C 4.526 6.091 4.593 1.00 . A A . 24 ILE CD1 1 1 6 2718 1 1 24 ILE CG1 C 4.553 5.052 3.491 1.00 . A A . 24 ILE CG1 1 1 6 2719 1 1 24 ILE CG2 C 5.230 3.160 5.005 1.00 . A A . 24 ILE CG2 1 1 6 2720 1 1 24 ILE H H 5.483 3.529 1.356 1.00 . A A . 24 ILE H 1 1 6 2721 1 1 24 ILE HA H 4.124 1.646 3.173 1.00 . A A . 24 ILE HA 1 1 6 2722 1 1 24 ILE HB H 3.245 3.640 4.436 1.00 . A A . 24 ILE HB 1 1 6 2723 1 1 24 ILE HD11 H 4.024 6.978 4.237 1.00 . A A . 24 ILE HD11 1 1 6 2724 1 1 24 ILE HD12 H 5.538 6.338 4.877 1.00 . A A . 24 ILE HD12 1 1 6 2725 1 1 24 ILE HD13 H 3.998 5.696 5.447 1.00 . A A . 24 ILE HD13 1 1 6 2726 1 1 24 ILE HG12 H 5.542 5.055 3.058 1.00 . A A . 24 ILE HG12 1 1 6 2727 1 1 24 ILE HG13 H 3.837 5.347 2.737 1.00 . A A . 24 ILE HG13 1 1 6 2728 1 1 24 ILE HG21 H 5.714 2.261 4.652 1.00 . A A . 24 ILE HG21 1 1 6 2729 1 1 24 ILE HG22 H 4.723 2.954 5.936 1.00 . A A . 24 ILE HG22 1 1 6 2730 1 1 24 ILE HG23 H 5.972 3.930 5.162 1.00 . A A . 24 ILE HG23 1 1 6 2731 1 1 24 ILE N N 5.361 2.743 1.945 1.00 . A A . 24 ILE N 1 1 6 2732 1 1 24 ILE O O 2.826 3.859 1.186 1.00 . A A . 24 ILE O 1 1 6 2733 1 1 25 CYS C C -0.043 3.497 1.735 1.00 . A A . 25 CYS C 1 1 6 2734 1 1 25 CYS CA C 0.630 2.156 1.439 1.00 . A A . 25 CYS CA 1 1 6 2735 1 1 25 CYS CB C -0.304 1.009 1.832 1.00 . A A . 25 CYS CB 1 1 6 2736 1 1 25 CYS H H 2.034 1.293 2.772 1.00 . A A . 25 CYS H 1 1 6 2737 1 1 25 CYS HA H 0.834 2.095 0.381 1.00 . A A . 25 CYS HA 1 1 6 2738 1 1 25 CYS HB2 H -0.442 1.019 2.904 1.00 . A A . 25 CYS HB2 1 1 6 2739 1 1 25 CYS HB3 H -1.260 1.153 1.352 1.00 . A A . 25 CYS HB3 1 1 6 2740 1 1 25 CYS N N 1.905 2.038 2.148 1.00 . A A . 25 CYS N 1 1 6 2741 1 1 25 CYS O O -0.019 3.978 2.867 1.00 . A A . 25 CYS O 1 1 6 2742 1 1 25 CYS SG S 0.307 -0.645 1.371 1.00 . A A . 25 CYS SG 1 1 6 2743 1 1 26 GLY C C -2.613 5.468 0.117 1.00 . A A . 26 GLY C 1 1 6 2744 1 1 26 GLY CA C -1.299 5.375 0.877 1.00 . A A . 26 GLY CA 1 1 6 2745 1 1 26 GLY H H -0.620 3.668 -0.174 1.00 . A A . 26 GLY H 1 1 6 2746 1 1 26 GLY HA2 H -1.494 5.529 1.928 1.00 . A A . 26 GLY HA2 1 1 6 2747 1 1 26 GLY HA3 H -0.639 6.155 0.527 1.00 . A A . 26 GLY HA3 1 1 6 2748 1 1 26 GLY N N -0.638 4.096 0.708 1.00 . A A . 26 GLY N 1 1 6 2749 1 1 26 GLY O O -3.461 4.582 0.233 1.00 . A A . 26 GLY O 1 1 6 2750 1 1 27 PRO C C -4.259 5.783 -2.580 1.00 . A A . 27 PRO C 1 1 6 2751 1 1 27 PRO CA C -4.044 6.786 -1.443 1.00 . A A . 27 PRO CA 1 1 6 2752 1 1 27 PRO CB C -3.843 8.197 -2.007 1.00 . A A . 27 PRO CB 1 1 6 2753 1 1 27 PRO CD C -1.842 7.648 -0.831 1.00 . A A . 27 PRO CD 1 1 6 2754 1 1 27 PRO CG C -2.368 8.397 -2.020 1.00 . A A . 27 PRO CG 1 1 6 2755 1 1 27 PRO HA H -4.913 6.782 -0.803 1.00 . A A . 27 PRO HA 1 1 6 2756 1 1 27 PRO HB2 H -4.258 8.251 -3.003 1.00 . A A . 27 PRO HB2 1 1 6 2757 1 1 27 PRO HB3 H -4.333 8.917 -1.368 1.00 . A A . 27 PRO HB3 1 1 6 2758 1 1 27 PRO HD2 H -0.853 7.262 -1.034 1.00 . A A . 27 PRO HD2 1 1 6 2759 1 1 27 PRO HD3 H -1.828 8.286 0.041 1.00 . A A . 27 PRO HD3 1 1 6 2760 1 1 27 PRO HG2 H -1.951 7.995 -2.932 1.00 . A A . 27 PRO HG2 1 1 6 2761 1 1 27 PRO HG3 H -2.139 9.448 -1.933 1.00 . A A . 27 PRO HG3 1 1 6 2762 1 1 27 PRO N N -2.811 6.549 -0.662 1.00 . A A . 27 PRO N 1 1 6 2763 1 1 27 PRO O O -4.134 6.126 -3.756 1.00 . A A . 27 PRO O 1 1 6 2764 1 1 28 PHE C C -3.541 3.131 -3.939 1.00 . A A . 28 PHE C 1 1 6 2765 1 1 28 PHE CA C -4.813 3.454 -3.160 1.00 . A A . 28 PHE CA 1 1 6 2766 1 1 28 PHE CB C -5.984 3.769 -4.121 1.00 . A A . 28 PHE CB 1 1 6 2767 1 1 28 PHE CD1 C -7.624 4.542 -2.371 1.00 . A A . 28 PHE CD1 1 1 6 2768 1 1 28 PHE CD2 C -8.333 2.903 -3.951 1.00 . A A . 28 PHE CD2 1 1 6 2769 1 1 28 PHE CE1 C -8.869 4.511 -1.775 1.00 . A A . 28 PHE CE1 1 1 6 2770 1 1 28 PHE CE2 C -9.580 2.868 -3.359 1.00 . A A . 28 PHE CE2 1 1 6 2771 1 1 28 PHE CG C -7.340 3.740 -3.466 1.00 . A A . 28 PHE CG 1 1 6 2772 1 1 28 PHE CZ C -9.849 3.673 -2.270 1.00 . A A . 28 PHE CZ 1 1 6 2773 1 1 28 PHE H H -4.642 4.350 -1.249 1.00 . A A . 28 PHE H 1 1 6 2774 1 1 28 PHE HA H -5.075 2.582 -2.579 1.00 . A A . 28 PHE HA 1 1 6 2775 1 1 28 PHE HB2 H -5.850 4.755 -4.545 1.00 . A A . 28 PHE HB2 1 1 6 2776 1 1 28 PHE HB3 H -5.991 3.040 -4.921 1.00 . A A . 28 PHE HB3 1 1 6 2777 1 1 28 PHE HD1 H -6.858 5.198 -1.983 1.00 . A A . 28 PHE HD1 1 1 6 2778 1 1 28 PHE HD2 H -8.124 2.274 -4.804 1.00 . A A . 28 PHE HD2 1 1 6 2779 1 1 28 PHE HE1 H -9.076 5.140 -0.922 1.00 . A A . 28 PHE HE1 1 1 6 2780 1 1 28 PHE HE2 H -10.344 2.212 -3.748 1.00 . A A . 28 PHE HE2 1 1 6 2781 1 1 28 PHE HZ H -10.824 3.647 -1.805 1.00 . A A . 28 PHE HZ 1 1 6 2782 1 1 28 PHE N N -4.575 4.543 -2.209 1.00 . A A . 28 PHE N 1 1 6 2783 1 1 28 PHE O O -3.590 2.519 -5.002 1.00 . A A . 28 PHE O 1 1 6 2784 1 1 29 VAL C C -0.091 3.131 -2.822 1.00 . A A . 29 VAL C 1 1 6 2785 1 1 29 VAL CA C -1.091 3.261 -3.956 1.00 . A A . 29 VAL CA 1 1 6 2786 1 1 29 VAL CB C -0.637 4.391 -4.936 1.00 . A A . 29 VAL CB 1 1 6 2787 1 1 29 VAL CG1 C -1.509 4.426 -6.183 1.00 . A A . 29 VAL CG1 1 1 6 2788 1 1 29 VAL CG2 C -0.646 5.749 -4.246 1.00 . A A . 29 VAL CG2 1 1 6 2789 1 1 29 VAL H H -2.437 3.970 -2.495 1.00 . A A . 29 VAL H 1 1 6 2790 1 1 29 VAL HA H -1.126 2.328 -4.495 1.00 . A A . 29 VAL HA 1 1 6 2791 1 1 29 VAL HB H 0.379 4.183 -5.257 1.00 . A A . 29 VAL HB 1 1 6 2792 1 1 29 VAL HG11 H -2.386 5.027 -5.991 1.00 . A A . 29 VAL HG11 1 1 6 2793 1 1 29 VAL HG12 H -1.809 3.422 -6.440 1.00 . A A . 29 VAL HG12 1 1 6 2794 1 1 29 VAL HG13 H -0.949 4.856 -7.001 1.00 . A A . 29 VAL HG13 1 1 6 2795 1 1 29 VAL HG21 H 0.200 6.329 -4.582 1.00 . A A . 29 VAL HG21 1 1 6 2796 1 1 29 VAL HG22 H -0.586 5.609 -3.176 1.00 . A A . 29 VAL HG22 1 1 6 2797 1 1 29 VAL HG23 H -1.560 6.270 -4.489 1.00 . A A . 29 VAL HG23 1 1 6 2798 1 1 29 VAL N N -2.401 3.515 -3.368 1.00 . A A . 29 VAL N 1 1 6 2799 1 1 29 VAL O O -0.469 2.809 -1.695 1.00 . A A . 29 VAL O 1 1 6 2800 1 1 30 CYS C C 3.182 4.462 -2.349 1.00 . A A . 30 CYS C 1 1 6 2801 1 1 30 CYS CA C 2.211 3.307 -2.125 1.00 . A A . 30 CYS CA 1 1 6 2802 1 1 30 CYS CB C 2.937 1.967 -2.251 1.00 . A A . 30 CYS CB 1 1 6 2803 1 1 30 CYS H H 1.389 3.631 -4.030 1.00 . A A . 30 CYS H 1 1 6 2804 1 1 30 CYS HA H 1.771 3.392 -1.144 1.00 . A A . 30 CYS HA 1 1 6 2805 1 1 30 CYS HB2 H 2.209 1.178 -2.379 1.00 . A A . 30 CYS HB2 1 1 6 2806 1 1 30 CYS HB3 H 3.572 1.998 -3.124 1.00 . A A . 30 CYS HB3 1 1 6 2807 1 1 30 CYS N N 1.156 3.385 -3.112 1.00 . A A . 30 CYS N 1 1 6 2808 1 1 30 CYS O O 3.273 4.996 -3.457 1.00 . A A . 30 CYS O 1 1 6 2809 1 1 30 CYS SG S 3.983 1.549 -0.828 1.00 . A A . 30 CYS SG 1 1 6 2810 1 1 31 VAL C C 6.118 5.635 -0.671 1.00 . A A . 31 VAL C 1 1 6 2811 1 1 31 VAL CA C 4.849 5.954 -1.441 1.00 . A A . 31 VAL CA 1 1 6 2812 1 1 31 VAL CB C 4.273 7.301 -0.939 1.00 . A A . 31 VAL CB 1 1 6 2813 1 1 31 VAL CG1 C 3.169 7.802 -1.858 1.00 . A A . 31 VAL CG1 1 1 6 2814 1 1 31 VAL CG2 C 3.761 7.172 0.489 1.00 . A A . 31 VAL CG2 1 1 6 2815 1 1 31 VAL H H 3.795 4.413 -0.447 1.00 . A A . 31 VAL H 1 1 6 2816 1 1 31 VAL HA H 5.097 6.057 -2.494 1.00 . A A . 31 VAL HA 1 1 6 2817 1 1 31 VAL HB H 5.069 8.030 -0.945 1.00 . A A . 31 VAL HB 1 1 6 2818 1 1 31 VAL HG11 H 3.218 8.879 -1.927 1.00 . A A . 31 VAL HG11 1 1 6 2819 1 1 31 VAL HG12 H 2.208 7.510 -1.459 1.00 . A A . 31 VAL HG12 1 1 6 2820 1 1 31 VAL HG13 H 3.296 7.373 -2.841 1.00 . A A . 31 VAL HG13 1 1 6 2821 1 1 31 VAL HG21 H 3.840 6.144 0.809 1.00 . A A . 31 VAL HG21 1 1 6 2822 1 1 31 VAL HG22 H 2.727 7.483 0.530 1.00 . A A . 31 VAL HG22 1 1 6 2823 1 1 31 VAL HG23 H 4.351 7.800 1.141 1.00 . A A . 31 VAL HG23 1 1 6 2824 1 1 31 VAL N N 3.899 4.862 -1.318 1.00 . A A . 31 VAL N 1 1 6 2825 1 1 31 VAL O O 6.074 4.726 0.179 1.00 . A A . 31 VAL O 1 1 6 2826 1 1 31 VAL OXT O 7.151 6.284 -0.942 1.00 . A A . 31 VAL OXT 1 1 7 2827 1 1 1 ALA C C 3.507 -8.326 -0.840 1.00 . A A . 1 ALA C 1 1 7 2828 1 1 1 ALA CA C 3.386 -9.812 -1.110 1.00 . A A . 1 ALA CA 1 1 7 2829 1 1 1 ALA CB C 3.499 -10.096 -2.601 1.00 . A A . 1 ALA CB 1 1 7 2830 1 1 1 ALA H1 H 2.223 -10.728 0.357 1.00 . A A . 1 ALA H1 1 1 7 2831 1 1 1 ALA H2 H 1.692 -11.023 -1.221 1.00 . A A . 1 ALA H2 1 1 7 2832 1 1 1 ALA H3 H 1.415 -9.514 -0.503 1.00 . A A . 1 ALA H3 1 1 7 2833 1 1 1 ALA HA H 4.189 -10.326 -0.603 1.00 . A A . 1 ALA HA 1 1 7 2834 1 1 1 ALA HB1 H 4.410 -9.659 -2.983 1.00 . A A . 1 ALA HB1 1 1 7 2835 1 1 1 ALA HB2 H 2.651 -9.667 -3.114 1.00 . A A . 1 ALA HB2 1 1 7 2836 1 1 1 ALA HB3 H 3.516 -11.164 -2.763 1.00 . A A . 1 ALA HB3 1 1 7 2837 1 1 1 ALA N N 2.091 -10.308 -0.583 1.00 . A A . 1 ALA N 1 1 7 2838 1 1 1 ALA O O 2.534 -7.696 -0.447 1.00 . A A . 1 ALA O 1 1 7 2839 1 1 2 CYS C C 4.527 -5.572 -2.085 1.00 . A A . 2 CYS C 1 1 7 2840 1 1 2 CYS CA C 4.878 -6.346 -0.823 1.00 . A A . 2 CYS CA 1 1 7 2841 1 1 2 CYS CB C 6.310 -6.057 -0.372 1.00 . A A . 2 CYS CB 1 1 7 2842 1 1 2 CYS H H 5.431 -8.312 -1.372 1.00 . A A . 2 CYS H 1 1 7 2843 1 1 2 CYS HA H 4.199 -6.032 -0.037 1.00 . A A . 2 CYS HA 1 1 7 2844 1 1 2 CYS HB2 H 6.374 -5.019 -0.086 1.00 . A A . 2 CYS HB2 1 1 7 2845 1 1 2 CYS HB3 H 6.539 -6.666 0.487 1.00 . A A . 2 CYS HB3 1 1 7 2846 1 1 2 CYS N N 4.682 -7.767 -1.051 1.00 . A A . 2 CYS N 1 1 7 2847 1 1 2 CYS O O 5.008 -5.880 -3.177 1.00 . A A . 2 CYS O 1 1 7 2848 1 1 2 CYS SG S 7.605 -6.346 -1.617 1.00 . A A . 2 CYS SG 1 1 7 2849 1 1 3 SER C C 4.231 -2.762 -3.467 1.00 . A A . 3 SER C 1 1 7 2850 1 1 3 SER CA C 3.190 -3.793 -3.044 1.00 . A A . 3 SER CA 1 1 7 2851 1 1 3 SER CB C 1.876 -3.111 -2.666 1.00 . A A . 3 SER CB 1 1 7 2852 1 1 3 SER H H 3.280 -4.424 -1.038 1.00 . A A . 3 SER H 1 1 7 2853 1 1 3 SER HA H 3.008 -4.458 -3.873 1.00 . A A . 3 SER HA 1 1 7 2854 1 1 3 SER HB2 H 1.665 -2.323 -3.373 1.00 . A A . 3 SER HB2 1 1 7 2855 1 1 3 SER HB3 H 1.078 -3.837 -2.684 1.00 . A A . 3 SER HB3 1 1 7 2856 1 1 3 SER HG H 2.327 -1.663 -1.422 1.00 . A A . 3 SER HG 1 1 7 2857 1 1 3 SER N N 3.650 -4.597 -1.929 1.00 . A A . 3 SER N 1 1 7 2858 1 1 3 SER O O 4.919 -2.167 -2.632 1.00 . A A . 3 SER O 1 1 7 2859 1 1 3 SER OG O 1.952 -2.549 -1.364 1.00 . A A . 3 SER OG 1 1 7 2860 1 1 4 LYS C C 4.713 -0.172 -5.106 1.00 . A A . 4 LYS C 1 1 7 2861 1 1 4 LYS CA C 5.250 -1.583 -5.341 1.00 . A A . 4 LYS CA 1 1 7 2862 1 1 4 LYS CB C 5.450 -1.855 -6.836 1.00 . A A . 4 LYS CB 1 1 7 2863 1 1 4 LYS CD C 6.812 -3.959 -6.314 1.00 . A A . 4 LYS CD 1 1 7 2864 1 1 4 LYS CE C 5.599 -4.880 -6.404 1.00 . A A . 4 LYS CE 1 1 7 2865 1 1 4 LYS CG C 6.678 -2.701 -7.175 1.00 . A A . 4 LYS CG 1 1 7 2866 1 1 4 LYS H H 3.727 -3.058 -5.378 1.00 . A A . 4 LYS H 1 1 7 2867 1 1 4 LYS HA H 6.196 -1.686 -4.831 1.00 . A A . 4 LYS HA 1 1 7 2868 1 1 4 LYS HB2 H 4.577 -2.370 -7.212 1.00 . A A . 4 LYS HB2 1 1 7 2869 1 1 4 LYS HB3 H 5.541 -0.908 -7.348 1.00 . A A . 4 LYS HB3 1 1 7 2870 1 1 4 LYS HD2 H 7.684 -4.508 -6.638 1.00 . A A . 4 LYS HD2 1 1 7 2871 1 1 4 LYS HD3 H 6.944 -3.658 -5.284 1.00 . A A . 4 LYS HD3 1 1 7 2872 1 1 4 LYS HE2 H 5.822 -5.795 -5.876 1.00 . A A . 4 LYS HE2 1 1 7 2873 1 1 4 LYS HE3 H 4.761 -4.391 -5.929 1.00 . A A . 4 LYS HE3 1 1 7 2874 1 1 4 LYS HG2 H 6.613 -3.003 -8.209 1.00 . A A . 4 LYS HG2 1 1 7 2875 1 1 4 LYS HG3 H 7.561 -2.092 -7.039 1.00 . A A . 4 LYS HG3 1 1 7 2876 1 1 4 LYS HZ1 H 5.269 -6.239 -7.953 1.00 . A A . 4 LYS HZ1 1 1 7 2877 1 1 4 LYS HZ2 H 5.880 -4.752 -8.470 1.00 . A A . 4 LYS HZ2 1 1 7 2878 1 1 4 LYS HZ3 H 4.253 -4.883 -8.007 1.00 . A A . 4 LYS HZ3 1 1 7 2879 1 1 4 LYS N N 4.324 -2.551 -4.772 1.00 . A A . 4 LYS N 1 1 7 2880 1 1 4 LYS NZ N 5.231 -5.213 -7.806 1.00 . A A . 4 LYS NZ 1 1 7 2881 1 1 4 LYS O O 3.518 0.004 -4.875 1.00 . A A . 4 LYS O 1 1 7 2882 1 1 5 LYS C C 3.985 2.642 -5.672 1.00 . A A . 5 LYS C 1 1 7 2883 1 1 5 LYS CA C 5.194 2.201 -4.857 1.00 . A A . 5 LYS CA 1 1 7 2884 1 1 5 LYS CB C 6.357 3.176 -5.074 1.00 . A A . 5 LYS CB 1 1 7 2885 1 1 5 LYS CD C 7.032 5.545 -4.511 1.00 . A A . 5 LYS CD 1 1 7 2886 1 1 5 LYS CE C 6.563 6.991 -4.481 1.00 . A A . 5 LYS CE 1 1 7 2887 1 1 5 LYS CG C 5.923 4.632 -4.994 1.00 . A A . 5 LYS CG 1 1 7 2888 1 1 5 LYS H H 6.540 0.618 -5.275 1.00 . A A . 5 LYS H 1 1 7 2889 1 1 5 LYS HA H 4.911 2.244 -3.821 1.00 . A A . 5 LYS HA 1 1 7 2890 1 1 5 LYS HB2 H 7.108 3.000 -4.318 1.00 . A A . 5 LYS HB2 1 1 7 2891 1 1 5 LYS HB3 H 6.786 3.000 -6.048 1.00 . A A . 5 LYS HB3 1 1 7 2892 1 1 5 LYS HD2 H 7.324 5.248 -3.515 1.00 . A A . 5 LYS HD2 1 1 7 2893 1 1 5 LYS HD3 H 7.875 5.461 -5.180 1.00 . A A . 5 LYS HD3 1 1 7 2894 1 1 5 LYS HE2 H 6.705 7.421 -5.462 1.00 . A A . 5 LYS HE2 1 1 7 2895 1 1 5 LYS HE3 H 5.510 7.011 -4.234 1.00 . A A . 5 LYS HE3 1 1 7 2896 1 1 5 LYS HG2 H 5.611 4.959 -5.969 1.00 . A A . 5 LYS HG2 1 1 7 2897 1 1 5 LYS HG3 H 5.091 4.704 -4.318 1.00 . A A . 5 LYS HG3 1 1 7 2898 1 1 5 LYS HZ1 H 8.319 7.847 -3.744 1.00 . A A . 5 LYS HZ1 1 1 7 2899 1 1 5 LYS HZ2 H 7.238 7.349 -2.533 1.00 . A A . 5 LYS HZ2 1 1 7 2900 1 1 5 LYS HZ3 H 6.927 8.756 -3.428 1.00 . A A . 5 LYS HZ3 1 1 7 2901 1 1 5 LYS N N 5.597 0.820 -5.121 1.00 . A A . 5 LYS N 1 1 7 2902 1 1 5 LYS NZ N 7.316 7.795 -3.483 1.00 . A A . 5 LYS NZ 1 1 7 2903 1 1 5 LYS O O 2.902 2.806 -5.143 1.00 . A A . 5 LYS O 1 1 7 2904 1 1 6 TRP C C 2.145 2.102 -8.139 1.00 . A A . 6 TRP C 1 1 7 2905 1 1 6 TRP CA C 3.039 3.279 -7.773 1.00 . A A . 6 TRP CA 1 1 7 2906 1 1 6 TRP CB C 3.562 3.999 -9.016 1.00 . A A . 6 TRP CB 1 1 7 2907 1 1 6 TRP CD1 C 6.038 4.572 -8.655 1.00 . A A . 6 TRP CD1 1 1 7 2908 1 1 6 TRP CD2 C 4.663 6.326 -8.446 1.00 . A A . 6 TRP CD2 1 1 7 2909 1 1 6 TRP CE2 C 5.987 6.764 -8.250 1.00 . A A . 6 TRP CE2 1 1 7 2910 1 1 6 TRP CE3 C 3.629 7.259 -8.355 1.00 . A A . 6 TRP CE3 1 1 7 2911 1 1 6 TRP CG C 4.719 4.920 -8.728 1.00 . A A . 6 TRP CG 1 1 7 2912 1 1 6 TRP CH2 C 5.265 8.982 -7.884 1.00 . A A . 6 TRP CH2 1 1 7 2913 1 1 6 TRP CZ2 C 6.300 8.092 -7.968 1.00 . A A . 6 TRP CZ2 1 1 7 2914 1 1 6 TRP CZ3 C 3.939 8.576 -8.072 1.00 . A A . 6 TRP CZ3 1 1 7 2915 1 1 6 TRP H H 5.018 2.690 -7.349 1.00 . A A . 6 TRP H 1 1 7 2916 1 1 6 TRP HA H 2.453 3.976 -7.182 1.00 . A A . 6 TRP HA 1 1 7 2917 1 1 6 TRP HB2 H 3.889 3.266 -9.738 1.00 . A A . 6 TRP HB2 1 1 7 2918 1 1 6 TRP HB3 H 2.764 4.589 -9.444 1.00 . A A . 6 TRP HB3 1 1 7 2919 1 1 6 TRP HD1 H 6.408 3.572 -8.800 1.00 . A A . 6 TRP HD1 1 1 7 2920 1 1 6 TRP HE1 H 7.782 5.684 -8.301 1.00 . A A . 6 TRP HE1 1 1 7 2921 1 1 6 TRP HE3 H 2.603 6.964 -8.489 1.00 . A A . 6 TRP HE3 1 1 7 2922 1 1 6 TRP HH2 H 5.462 10.021 -7.663 1.00 . A A . 6 TRP HH2 1 1 7 2923 1 1 6 TRP HZ2 H 7.318 8.420 -7.820 1.00 . A A . 6 TRP HZ2 1 1 7 2924 1 1 6 TRP HZ3 H 3.150 9.310 -7.997 1.00 . A A . 6 TRP HZ3 1 1 7 2925 1 1 6 TRP N N 4.150 2.838 -6.950 1.00 . A A . 6 TRP N 1 1 7 2926 1 1 6 TRP NE1 N 6.806 5.676 -8.383 1.00 . A A . 6 TRP NE1 1 1 7 2927 1 1 6 TRP O O 1.519 2.079 -9.197 1.00 . A A . 6 TRP O 1 1 7 2928 1 1 7 GLU C C 0.070 0.025 -6.471 1.00 . A A . 7 GLU C 1 1 7 2929 1 1 7 GLU CA C 1.256 -0.040 -7.427 1.00 . A A . 7 GLU CA 1 1 7 2930 1 1 7 GLU CB C 2.087 -1.299 -7.191 1.00 . A A . 7 GLU CB 1 1 7 2931 1 1 7 GLU CD C 2.429 -3.748 -7.571 1.00 . A A . 7 GLU CD 1 1 7 2932 1 1 7 GLU CG C 1.481 -2.579 -7.734 1.00 . A A . 7 GLU CG 1 1 7 2933 1 1 7 GLU H H 2.607 1.228 -6.391 1.00 . A A . 7 GLU H 1 1 7 2934 1 1 7 GLU HA H 0.894 -0.035 -8.445 1.00 . A A . 7 GLU HA 1 1 7 2935 1 1 7 GLU HB2 H 3.052 -1.165 -7.655 1.00 . A A . 7 GLU HB2 1 1 7 2936 1 1 7 GLU HB3 H 2.229 -1.421 -6.127 1.00 . A A . 7 GLU HB3 1 1 7 2937 1 1 7 GLU HG2 H 0.566 -2.791 -7.201 1.00 . A A . 7 GLU HG2 1 1 7 2938 1 1 7 GLU HG3 H 1.267 -2.448 -8.785 1.00 . A A . 7 GLU HG3 1 1 7 2939 1 1 7 GLU N N 2.083 1.136 -7.235 1.00 . A A . 7 GLU N 1 1 7 2940 1 1 7 GLU O O 0.202 0.503 -5.342 1.00 . A A . 7 GLU O 1 1 7 2941 1 1 7 GLU OE1 O 2.760 -4.087 -6.418 1.00 . A A . 7 GLU OE1 1 1 7 2942 1 1 7 GLU OE2 O 2.891 -4.303 -8.591 1.00 . A A . 7 GLU OE2 1 1 7 2943 1 1 8 TYR C C -2.136 -1.220 -4.850 1.00 . A A . 8 TYR C 1 1 7 2944 1 1 8 TYR CA C -2.306 -0.413 -6.135 1.00 . A A . 8 TYR CA 1 1 7 2945 1 1 8 TYR CB C -3.472 -0.973 -6.961 1.00 . A A . 8 TYR CB 1 1 7 2946 1 1 8 TYR CD1 C -5.396 -0.104 -5.566 1.00 . A A . 8 TYR CD1 1 1 7 2947 1 1 8 TYR CD2 C -5.326 -2.433 -6.063 1.00 . A A . 8 TYR CD2 1 1 7 2948 1 1 8 TYR CE1 C -6.567 -0.287 -4.856 1.00 . A A . 8 TYR CE1 1 1 7 2949 1 1 8 TYR CE2 C -6.498 -2.624 -5.356 1.00 . A A . 8 TYR CE2 1 1 7 2950 1 1 8 TYR CG C -4.755 -1.172 -6.180 1.00 . A A . 8 TYR CG 1 1 7 2951 1 1 8 TYR CZ C -7.113 -1.548 -4.754 1.00 . A A . 8 TYR CZ 1 1 7 2952 1 1 8 TYR H H -1.121 -0.781 -7.849 1.00 . A A . 8 TYR H 1 1 7 2953 1 1 8 TYR HA H -2.515 0.617 -5.874 1.00 . A A . 8 TYR HA 1 1 7 2954 1 1 8 TYR HB2 H -3.686 -0.293 -7.771 1.00 . A A . 8 TYR HB2 1 1 7 2955 1 1 8 TYR HB3 H -3.183 -1.929 -7.370 1.00 . A A . 8 TYR HB3 1 1 7 2956 1 1 8 TYR HD1 H -4.966 0.882 -5.648 1.00 . A A . 8 TYR HD1 1 1 7 2957 1 1 8 TYR HD2 H -4.841 -3.276 -6.534 1.00 . A A . 8 TYR HD2 1 1 7 2958 1 1 8 TYR HE1 H -7.049 0.556 -4.386 1.00 . A A . 8 TYR HE1 1 1 7 2959 1 1 8 TYR HE2 H -6.926 -3.612 -5.277 1.00 . A A . 8 TYR HE2 1 1 7 2960 1 1 8 TYR HH H -8.993 -1.256 -4.477 1.00 . A A . 8 TYR HH 1 1 7 2961 1 1 8 TYR N N -1.085 -0.431 -6.936 1.00 . A A . 8 TYR N 1 1 7 2962 1 1 8 TYR O O -1.617 -2.336 -4.867 1.00 . A A . 8 TYR O 1 1 7 2963 1 1 8 TYR OH O -8.280 -1.734 -4.048 1.00 . A A . 8 TYR OH 1 1 7 2964 1 1 9 CYS C C -3.599 -0.845 -1.528 1.00 . A A . 9 CYS C 1 1 7 2965 1 1 9 CYS CA C -2.479 -1.307 -2.452 1.00 . A A . 9 CYS CA 1 1 7 2966 1 1 9 CYS CB C -1.120 -1.017 -1.808 1.00 . A A . 9 CYS CB 1 1 7 2967 1 1 9 CYS H H -2.987 0.245 -3.792 1.00 . A A . 9 CYS H 1 1 7 2968 1 1 9 CYS HA H -2.573 -2.370 -2.614 1.00 . A A . 9 CYS HA 1 1 7 2969 1 1 9 CYS HB2 H -1.046 -1.565 -0.881 1.00 . A A . 9 CYS HB2 1 1 7 2970 1 1 9 CYS HB3 H -0.337 -1.343 -2.476 1.00 . A A . 9 CYS HB3 1 1 7 2971 1 1 9 CYS N N -2.580 -0.649 -3.742 1.00 . A A . 9 CYS N 1 1 7 2972 1 1 9 CYS O O -4.173 0.228 -1.720 1.00 . A A . 9 CYS O 1 1 7 2973 1 1 9 CYS SG S -0.832 0.744 -1.433 1.00 . A A . 9 CYS SG 1 1 7 2974 1 1 10 ILE C C -4.512 -1.897 1.814 1.00 . A A . 10 ILE C 1 1 7 2975 1 1 10 ILE CA C -4.926 -1.358 0.452 1.00 . A A . 10 ILE CA 1 1 7 2976 1 1 10 ILE CB C -6.315 -1.929 0.051 1.00 . A A . 10 ILE CB 1 1 7 2977 1 1 10 ILE CD1 C -5.961 -4.464 0.213 1.00 . A A . 10 ILE CD1 1 1 7 2978 1 1 10 ILE CG1 C -6.186 -3.268 -0.691 1.00 . A A . 10 ILE CG1 1 1 7 2979 1 1 10 ILE CG2 C -7.079 -0.923 -0.796 1.00 . A A . 10 ILE CG2 1 1 7 2980 1 1 10 ILE H H -3.390 -2.496 -0.430 1.00 . A A . 10 ILE H 1 1 7 2981 1 1 10 ILE HA H -5.009 -0.282 0.518 1.00 . A A . 10 ILE HA 1 1 7 2982 1 1 10 ILE HB H -6.879 -2.087 0.958 1.00 . A A . 10 ILE HB 1 1 7 2983 1 1 10 ILE HD11 H -5.512 -5.265 -0.356 1.00 . A A . 10 ILE HD11 1 1 7 2984 1 1 10 ILE HD12 H -6.907 -4.794 0.614 1.00 . A A . 10 ILE HD12 1 1 7 2985 1 1 10 ILE HD13 H -5.303 -4.185 1.021 1.00 . A A . 10 ILE HD13 1 1 7 2986 1 1 10 ILE HG12 H -7.091 -3.448 -1.250 1.00 . A A . 10 ILE HG12 1 1 7 2987 1 1 10 ILE HG13 H -5.354 -3.210 -1.377 1.00 . A A . 10 ILE HG13 1 1 7 2988 1 1 10 ILE HG21 H -7.533 -0.182 -0.154 1.00 . A A . 10 ILE HG21 1 1 7 2989 1 1 10 ILE HG22 H -7.850 -1.435 -1.355 1.00 . A A . 10 ILE HG22 1 1 7 2990 1 1 10 ILE HG23 H -6.400 -0.438 -1.481 1.00 . A A . 10 ILE HG23 1 1 7 2991 1 1 10 ILE N N -3.894 -1.661 -0.526 1.00 . A A . 10 ILE N 1 1 7 2992 1 1 10 ILE O O -3.853 -2.934 1.899 1.00 . A A . 10 ILE O 1 1 7 2993 1 1 11 VAL C C -5.351 -2.808 4.646 1.00 . A A . 11 VAL C 1 1 7 2994 1 1 11 VAL CA C -4.508 -1.595 4.219 1.00 . A A . 11 VAL CA 1 1 7 2995 1 1 11 VAL CB C -4.643 -0.417 5.233 1.00 . A A . 11 VAL CB 1 1 7 2996 1 1 11 VAL CG1 C -4.021 0.845 4.654 1.00 . A A . 11 VAL CG1 1 1 7 2997 1 1 11 VAL CG2 C -6.094 -0.157 5.622 1.00 . A A . 11 VAL CG2 1 1 7 2998 1 1 11 VAL H H -5.375 -0.354 2.743 1.00 . A A . 11 VAL H 1 1 7 2999 1 1 11 VAL HA H -3.469 -1.896 4.194 1.00 . A A . 11 VAL HA 1 1 7 3000 1 1 11 VAL HB H -4.085 -0.672 6.135 1.00 . A A . 11 VAL HB 1 1 7 3001 1 1 11 VAL HG11 H -3.935 1.591 5.430 1.00 . A A . 11 VAL HG11 1 1 7 3002 1 1 11 VAL HG12 H -4.647 1.222 3.859 1.00 . A A . 11 VAL HG12 1 1 7 3003 1 1 11 VAL HG13 H -3.041 0.616 4.262 1.00 . A A . 11 VAL HG13 1 1 7 3004 1 1 11 VAL HG21 H -6.749 -0.616 4.897 1.00 . A A . 11 VAL HG21 1 1 7 3005 1 1 11 VAL HG22 H -6.273 0.908 5.647 1.00 . A A . 11 VAL HG22 1 1 7 3006 1 1 11 VAL HG23 H -6.285 -0.577 6.599 1.00 . A A . 11 VAL HG23 1 1 7 3007 1 1 11 VAL N N -4.870 -1.181 2.871 1.00 . A A . 11 VAL N 1 1 7 3008 1 1 11 VAL O O -6.582 -2.794 4.552 1.00 . A A . 11 VAL O 1 1 7 3009 1 1 12 PRO C C -6.142 -5.043 6.796 1.00 . A A . 12 PRO C 1 1 7 3010 1 1 12 PRO CA C -5.358 -5.148 5.475 1.00 . A A . 12 PRO CA 1 1 7 3011 1 1 12 PRO CB C -4.205 -6.146 5.615 1.00 . A A . 12 PRO CB 1 1 7 3012 1 1 12 PRO CD C -3.219 -4.021 5.133 1.00 . A A . 12 PRO CD 1 1 7 3013 1 1 12 PRO CG C -3.000 -5.311 5.872 1.00 . A A . 12 PRO CG 1 1 7 3014 1 1 12 PRO HA H -6.029 -5.491 4.701 1.00 . A A . 12 PRO HA 1 1 7 3015 1 1 12 PRO HB2 H -4.404 -6.816 6.438 1.00 . A A . 12 PRO HB2 1 1 7 3016 1 1 12 PRO HB3 H -4.103 -6.711 4.700 1.00 . A A . 12 PRO HB3 1 1 7 3017 1 1 12 PRO HD2 H -2.790 -3.195 5.681 1.00 . A A . 12 PRO HD2 1 1 7 3018 1 1 12 PRO HD3 H -2.795 -4.078 4.141 1.00 . A A . 12 PRO HD3 1 1 7 3019 1 1 12 PRO HG2 H -2.904 -5.123 6.931 1.00 . A A . 12 PRO HG2 1 1 7 3020 1 1 12 PRO HG3 H -2.119 -5.811 5.497 1.00 . A A . 12 PRO HG3 1 1 7 3021 1 1 12 PRO N N -4.688 -3.901 5.069 1.00 . A A . 12 PRO N 1 1 7 3022 1 1 12 PRO O O -5.928 -5.836 7.713 1.00 . A A . 12 PRO O 1 1 7 3023 1 1 13 ILE C C -7.137 -3.680 9.332 1.00 . A A . 13 ILE C 1 1 7 3024 1 1 13 ILE CA C -7.922 -3.842 8.030 1.00 . A A . 13 ILE CA 1 1 7 3025 1 1 13 ILE CB C -8.973 -4.969 8.193 1.00 . A A . 13 ILE CB 1 1 7 3026 1 1 13 ILE CD1 C -10.503 -3.963 6.407 1.00 . A A . 13 ILE CD1 1 1 7 3027 1 1 13 ILE CG1 C -9.741 -5.184 6.882 1.00 . A A . 13 ILE CG1 1 1 7 3028 1 1 13 ILE CG2 C -9.941 -4.644 9.327 1.00 . A A . 13 ILE CG2 1 1 7 3029 1 1 13 ILE H H -7.171 -3.494 6.074 1.00 . A A . 13 ILE H 1 1 7 3030 1 1 13 ILE HA H -8.451 -2.924 7.851 1.00 . A A . 13 ILE HA 1 1 7 3031 1 1 13 ILE HB H -8.452 -5.879 8.450 1.00 . A A . 13 ILE HB 1 1 7 3032 1 1 13 ILE HD11 H -11.481 -3.947 6.865 1.00 . A A . 13 ILE HD11 1 1 7 3033 1 1 13 ILE HD12 H -10.609 -4.000 5.333 1.00 . A A . 13 ILE HD12 1 1 7 3034 1 1 13 ILE HD13 H -9.961 -3.070 6.684 1.00 . A A . 13 ILE HD13 1 1 7 3035 1 1 13 ILE HG12 H -9.043 -5.459 6.106 1.00 . A A . 13 ILE HG12 1 1 7 3036 1 1 13 ILE HG13 H -10.451 -5.986 7.020 1.00 . A A . 13 ILE HG13 1 1 7 3037 1 1 13 ILE HG21 H -10.150 -5.542 9.890 1.00 . A A . 13 ILE HG21 1 1 7 3038 1 1 13 ILE HG22 H -10.860 -4.256 8.914 1.00 . A A . 13 ILE HG22 1 1 7 3039 1 1 13 ILE HG23 H -9.497 -3.905 9.978 1.00 . A A . 13 ILE HG23 1 1 7 3040 1 1 13 ILE N N -7.057 -4.075 6.861 1.00 . A A . 13 ILE N 1 1 7 3041 1 1 13 ILE O O -6.813 -2.563 9.731 1.00 . A A . 13 ILE O 1 1 7 3042 1 1 14 LEU C C -4.645 -4.325 10.969 1.00 . A A . 14 LEU C 1 1 7 3043 1 1 14 LEU CA C -6.071 -4.791 11.230 1.00 . A A . 14 LEU CA 1 1 7 3044 1 1 14 LEU CB C -6.092 -6.182 11.883 1.00 . A A . 14 LEU CB 1 1 7 3045 1 1 14 LEU CD1 C -4.307 -7.518 10.694 1.00 . A A . 14 LEU CD1 1 1 7 3046 1 1 14 LEU CD2 C -6.367 -8.654 11.541 1.00 . A A . 14 LEU CD2 1 1 7 3047 1 1 14 LEU CG C -5.800 -7.370 10.953 1.00 . A A . 14 LEU CG 1 1 7 3048 1 1 14 LEU H H -7.107 -5.660 9.604 1.00 . A A . 14 LEU H 1 1 7 3049 1 1 14 LEU HA H -6.546 -4.085 11.895 1.00 . A A . 14 LEU HA 1 1 7 3050 1 1 14 LEU HB2 H -5.361 -6.191 12.678 1.00 . A A . 14 LEU HB2 1 1 7 3051 1 1 14 LEU HB3 H -7.069 -6.332 12.320 1.00 . A A . 14 LEU HB3 1 1 7 3052 1 1 14 LEU HD11 H -4.146 -8.255 9.923 1.00 . A A . 14 LEU HD11 1 1 7 3053 1 1 14 LEU HD12 H -3.814 -7.833 11.603 1.00 . A A . 14 LEU HD12 1 1 7 3054 1 1 14 LEU HD13 H -3.902 -6.569 10.376 1.00 . A A . 14 LEU HD13 1 1 7 3055 1 1 14 LEU HD21 H -5.557 -9.317 11.803 1.00 . A A . 14 LEU HD21 1 1 7 3056 1 1 14 LEU HD22 H -7.003 -9.133 10.813 1.00 . A A . 14 LEU HD22 1 1 7 3057 1 1 14 LEU HD23 H -6.941 -8.421 12.425 1.00 . A A . 14 LEU HD23 1 1 7 3058 1 1 14 LEU HG H -6.284 -7.199 10.003 1.00 . A A . 14 LEU HG 1 1 7 3059 1 1 14 LEU N N -6.828 -4.801 9.983 1.00 . A A . 14 LEU N 1 1 7 3060 1 1 14 LEU O O -3.888 -4.022 11.890 1.00 . A A . 14 LEU O 1 1 7 3061 1 1 15 GLY C C -3.119 -2.701 8.271 1.00 . A A . 15 GLY C 1 1 7 3062 1 1 15 GLY CA C -3.002 -3.808 9.287 1.00 . A A . 15 GLY CA 1 1 7 3063 1 1 15 GLY H H -4.980 -4.494 9.008 1.00 . A A . 15 GLY H 1 1 7 3064 1 1 15 GLY HA2 H -2.464 -3.445 10.151 1.00 . A A . 15 GLY HA2 1 1 7 3065 1 1 15 GLY HA3 H -2.461 -4.633 8.850 1.00 . A A . 15 GLY HA3 1 1 7 3066 1 1 15 GLY N N -4.307 -4.256 9.694 1.00 . A A . 15 GLY N 1 1 7 3067 1 1 15 GLY O O -4.155 -2.569 7.626 1.00 . A A . 15 GLY O 1 1 7 3068 1 1 16 PHE C C -0.988 -0.920 6.160 1.00 . A A . 16 PHE C 1 1 7 3069 1 1 16 PHE CA C -2.118 -0.799 7.175 1.00 . A A . 16 PHE CA 1 1 7 3070 1 1 16 PHE CB C -2.054 0.556 7.882 1.00 . A A . 16 PHE CB 1 1 7 3071 1 1 16 PHE CD1 C -3.969 0.222 9.486 1.00 . A A . 16 PHE CD1 1 1 7 3072 1 1 16 PHE CD2 C -3.946 2.186 8.135 1.00 . A A . 16 PHE CD2 1 1 7 3073 1 1 16 PHE CE1 C -5.156 0.628 10.063 1.00 . A A . 16 PHE CE1 1 1 7 3074 1 1 16 PHE CE2 C -5.134 2.597 8.709 1.00 . A A . 16 PHE CE2 1 1 7 3075 1 1 16 PHE CG C -3.349 0.994 8.515 1.00 . A A . 16 PHE CG 1 1 7 3076 1 1 16 PHE CZ C -5.740 1.817 9.674 1.00 . A A . 16 PHE CZ 1 1 7 3077 1 1 16 PHE H H -1.289 -2.036 8.680 1.00 . A A . 16 PHE H 1 1 7 3078 1 1 16 PHE HA H -3.056 -0.864 6.645 1.00 . A A . 16 PHE HA 1 1 7 3079 1 1 16 PHE HB2 H -1.320 0.498 8.657 1.00 . A A . 16 PHE HB2 1 1 7 3080 1 1 16 PHE HB3 H -1.759 1.312 7.170 1.00 . A A . 16 PHE HB3 1 1 7 3081 1 1 16 PHE HD1 H -3.513 -0.709 9.792 1.00 . A A . 16 PHE HD1 1 1 7 3082 1 1 16 PHE HD2 H -3.474 2.797 7.381 1.00 . A A . 16 PHE HD2 1 1 7 3083 1 1 16 PHE HE1 H -5.628 0.016 10.819 1.00 . A A . 16 PHE HE1 1 1 7 3084 1 1 16 PHE HE2 H -5.589 3.527 8.403 1.00 . A A . 16 PHE HE2 1 1 7 3085 1 1 16 PHE HZ H -6.669 2.137 10.123 1.00 . A A . 16 PHE HZ 1 1 7 3086 1 1 16 PHE N N -2.084 -1.897 8.131 1.00 . A A . 16 PHE N 1 1 7 3087 1 1 16 PHE O O -1.138 -0.531 5.004 1.00 . A A . 16 PHE O 1 1 7 3088 1 1 17 VAL C C 1.021 -2.808 4.754 1.00 . A A . 17 VAL C 1 1 7 3089 1 1 17 VAL CA C 1.276 -1.629 5.686 1.00 . A A . 17 VAL CA 1 1 7 3090 1 1 17 VAL CB C 2.606 -1.871 6.431 1.00 . A A . 17 VAL CB 1 1 7 3091 1 1 17 VAL CG1 C 3.778 -1.291 5.650 1.00 . A A . 17 VAL CG1 1 1 7 3092 1 1 17 VAL CG2 C 2.561 -1.313 7.847 1.00 . A A . 17 VAL CG2 1 1 7 3093 1 1 17 VAL H H 0.217 -1.764 7.512 1.00 . A A . 17 VAL H 1 1 7 3094 1 1 17 VAL HA H 1.370 -0.728 5.097 1.00 . A A . 17 VAL HA 1 1 7 3095 1 1 17 VAL HB H 2.756 -2.937 6.487 1.00 . A A . 17 VAL HB 1 1 7 3096 1 1 17 VAL HG11 H 4.214 -0.475 6.208 1.00 . A A . 17 VAL HG11 1 1 7 3097 1 1 17 VAL HG12 H 3.430 -0.927 4.695 1.00 . A A . 17 VAL HG12 1 1 7 3098 1 1 17 VAL HG13 H 4.523 -2.058 5.494 1.00 . A A . 17 VAL HG13 1 1 7 3099 1 1 17 VAL HG21 H 2.560 -2.128 8.555 1.00 . A A . 17 VAL HG21 1 1 7 3100 1 1 17 VAL HG22 H 1.663 -0.726 7.973 1.00 . A A . 17 VAL HG22 1 1 7 3101 1 1 17 VAL HG23 H 3.426 -0.690 8.016 1.00 . A A . 17 VAL HG23 1 1 7 3102 1 1 17 VAL N N 0.144 -1.464 6.588 1.00 . A A . 17 VAL N 1 1 7 3103 1 1 17 VAL O O 0.040 -3.535 4.915 1.00 . A A . 17 VAL O 1 1 7 3104 1 1 18 TYR C C 3.011 -3.998 1.872 1.00 . A A . 18 TYR C 1 1 7 3105 1 1 18 TYR CA C 1.834 -4.085 2.834 1.00 . A A . 18 TYR CA 1 1 7 3106 1 1 18 TYR CB C 0.515 -4.029 2.048 1.00 . A A . 18 TYR CB 1 1 7 3107 1 1 18 TYR CD1 C 0.204 -6.533 1.993 1.00 . A A . 18 TYR CD1 1 1 7 3108 1 1 18 TYR CD2 C -0.116 -5.319 -0.034 1.00 . A A . 18 TYR CD2 1 1 7 3109 1 1 18 TYR CE1 C -0.077 -7.715 1.336 1.00 . A A . 18 TYR CE1 1 1 7 3110 1 1 18 TYR CE2 C -0.403 -6.497 -0.699 1.00 . A A . 18 TYR CE2 1 1 7 3111 1 1 18 TYR CG C 0.192 -5.316 1.321 1.00 . A A . 18 TYR CG 1 1 7 3112 1 1 18 TYR CZ C -0.381 -7.693 -0.008 1.00 . A A . 18 TYR CZ 1 1 7 3113 1 1 18 TYR H H 2.687 -2.391 3.768 1.00 . A A . 18 TYR H 1 1 7 3114 1 1 18 TYR HA H 1.890 -5.020 3.374 1.00 . A A . 18 TYR HA 1 1 7 3115 1 1 18 TYR HB2 H -0.295 -3.821 2.731 1.00 . A A . 18 TYR HB2 1 1 7 3116 1 1 18 TYR HB3 H 0.574 -3.238 1.315 1.00 . A A . 18 TYR HB3 1 1 7 3117 1 1 18 TYR HD1 H 0.441 -6.547 3.046 1.00 . A A . 18 TYR HD1 1 1 7 3118 1 1 18 TYR HD2 H -0.131 -4.381 -0.572 1.00 . A A . 18 TYR HD2 1 1 7 3119 1 1 18 TYR HE1 H -0.063 -8.649 1.877 1.00 . A A . 18 TYR HE1 1 1 7 3120 1 1 18 TYR HE2 H -0.641 -6.480 -1.751 1.00 . A A . 18 TYR HE2 1 1 7 3121 1 1 18 TYR HH H -1.527 -8.825 -1.063 1.00 . A A . 18 TYR HH 1 1 7 3122 1 1 18 TYR N N 1.921 -2.995 3.804 1.00 . A A . 18 TYR N 1 1 7 3123 1 1 18 TYR O O 3.528 -5.008 1.401 1.00 . A A . 18 TYR O 1 1 7 3124 1 1 18 TYR OH O -0.650 -8.875 -0.667 1.00 . A A . 18 TYR OH 1 1 7 3125 1 1 19 CYS C C 5.830 -3.086 1.152 1.00 . A A . 19 CYS C 1 1 7 3126 1 1 19 CYS CA C 4.522 -2.477 0.677 1.00 . A A . 19 CYS CA 1 1 7 3127 1 1 19 CYS CB C 4.708 -0.976 0.588 1.00 . A A . 19 CYS CB 1 1 7 3128 1 1 19 CYS H H 2.940 -2.008 1.993 1.00 . A A . 19 CYS H 1 1 7 3129 1 1 19 CYS HA H 4.276 -2.863 -0.299 1.00 . A A . 19 CYS HA 1 1 7 3130 1 1 19 CYS HB2 H 4.894 -0.609 1.581 1.00 . A A . 19 CYS HB2 1 1 7 3131 1 1 19 CYS HB3 H 5.564 -0.748 -0.038 1.00 . A A . 19 CYS HB3 1 1 7 3132 1 1 19 CYS N N 3.412 -2.764 1.584 1.00 . A A . 19 CYS N 1 1 7 3133 1 1 19 CYS O O 5.974 -3.449 2.321 1.00 . A A . 19 CYS O 1 1 7 3134 1 1 19 CYS SG S 3.263 -0.084 -0.064 1.00 . A A . 19 CYS SG 1 1 7 3135 1 1 20 CYS C C 8.751 -2.755 1.575 1.00 . A A . 20 CYS C 1 1 7 3136 1 1 20 CYS CA C 8.108 -3.687 0.566 1.00 . A A . 20 CYS CA 1 1 7 3137 1 1 20 CYS CB C 8.984 -3.781 -0.683 1.00 . A A . 20 CYS CB 1 1 7 3138 1 1 20 CYS H H 6.622 -2.834 -0.669 1.00 . A A . 20 CYS H 1 1 7 3139 1 1 20 CYS HA H 7.983 -4.673 1.003 1.00 . A A . 20 CYS HA 1 1 7 3140 1 1 20 CYS HB2 H 9.339 -2.794 -0.928 1.00 . A A . 20 CYS HB2 1 1 7 3141 1 1 20 CYS HB3 H 9.832 -4.415 -0.466 1.00 . A A . 20 CYS HB3 1 1 7 3142 1 1 20 CYS N N 6.794 -3.162 0.240 1.00 . A A . 20 CYS N 1 1 7 3143 1 1 20 CYS O O 8.435 -1.562 1.591 1.00 . A A . 20 CYS O 1 1 7 3144 1 1 20 CYS SG S 8.141 -4.460 -2.157 1.00 . A A . 20 CYS SG 1 1 7 3145 1 1 21 PRO C C 10.913 -1.187 2.836 1.00 . A A . 21 PRO C 1 1 7 3146 1 1 21 PRO CA C 10.292 -2.429 3.443 1.00 . A A . 21 PRO CA 1 1 7 3147 1 1 21 PRO CB C 11.356 -3.334 4.035 1.00 . A A . 21 PRO CB 1 1 7 3148 1 1 21 PRO CD C 10.077 -4.663 2.513 1.00 . A A . 21 PRO CD 1 1 7 3149 1 1 21 PRO CG C 10.837 -4.716 3.813 1.00 . A A . 21 PRO CG 1 1 7 3150 1 1 21 PRO HA H 9.596 -2.136 4.215 1.00 . A A . 21 PRO HA 1 1 7 3151 1 1 21 PRO HB2 H 12.296 -3.173 3.527 1.00 . A A . 21 PRO HB2 1 1 7 3152 1 1 21 PRO HB3 H 11.457 -3.108 5.083 1.00 . A A . 21 PRO HB3 1 1 7 3153 1 1 21 PRO HD2 H 10.726 -4.910 1.686 1.00 . A A . 21 PRO HD2 1 1 7 3154 1 1 21 PRO HD3 H 9.228 -5.327 2.537 1.00 . A A . 21 PRO HD3 1 1 7 3155 1 1 21 PRO HG2 H 11.661 -5.410 3.740 1.00 . A A . 21 PRO HG2 1 1 7 3156 1 1 21 PRO HG3 H 10.178 -4.995 4.622 1.00 . A A . 21 PRO HG3 1 1 7 3157 1 1 21 PRO N N 9.642 -3.260 2.438 1.00 . A A . 21 PRO N 1 1 7 3158 1 1 21 PRO O O 11.838 -1.256 2.028 1.00 . A A . 21 PRO O 1 1 7 3159 1 1 22 GLY C C 9.688 2.050 2.160 1.00 . A A . 22 GLY C 1 1 7 3160 1 1 22 GLY CA C 10.822 1.213 2.720 1.00 . A A . 22 GLY CA 1 1 7 3161 1 1 22 GLY H H 9.619 -0.100 3.853 1.00 . A A . 22 GLY H 1 1 7 3162 1 1 22 GLY HA2 H 11.294 1.756 3.523 1.00 . A A . 22 GLY HA2 1 1 7 3163 1 1 22 GLY HA3 H 11.547 1.040 1.939 1.00 . A A . 22 GLY HA3 1 1 7 3164 1 1 22 GLY N N 10.362 -0.061 3.224 1.00 . A A . 22 GLY N 1 1 7 3165 1 1 22 GLY O O 9.695 3.270 2.292 1.00 . A A . 22 GLY O 1 1 7 3166 1 1 23 LEU C C 6.351 1.953 1.851 1.00 . A A . 23 LEU C 1 1 7 3167 1 1 23 LEU CA C 7.575 2.087 0.952 1.00 . A A . 23 LEU CA 1 1 7 3168 1 1 23 LEU CB C 7.281 1.516 -0.434 1.00 . A A . 23 LEU CB 1 1 7 3169 1 1 23 LEU CD1 C 8.106 0.827 -2.697 1.00 . A A . 23 LEU CD1 1 1 7 3170 1 1 23 LEU CD2 C 8.756 3.050 -1.760 1.00 . A A . 23 LEU CD2 1 1 7 3171 1 1 23 LEU CG C 8.439 1.599 -1.431 1.00 . A A . 23 LEU CG 1 1 7 3172 1 1 23 LEU H H 8.756 0.413 1.461 1.00 . A A . 23 LEU H 1 1 7 3173 1 1 23 LEU HA H 7.832 3.132 0.857 1.00 . A A . 23 LEU HA 1 1 7 3174 1 1 23 LEU HB2 H 7.007 0.477 -0.321 1.00 . A A . 23 LEU HB2 1 1 7 3175 1 1 23 LEU HB3 H 6.440 2.049 -0.850 1.00 . A A . 23 LEU HB3 1 1 7 3176 1 1 23 LEU HD11 H 7.119 1.105 -3.039 1.00 . A A . 23 LEU HD11 1 1 7 3177 1 1 23 LEU HD12 H 8.129 -0.232 -2.489 1.00 . A A . 23 LEU HD12 1 1 7 3178 1 1 23 LEU HD13 H 8.831 1.061 -3.462 1.00 . A A . 23 LEU HD13 1 1 7 3179 1 1 23 LEU HD21 H 9.772 3.125 -2.116 1.00 . A A . 23 LEU HD21 1 1 7 3180 1 1 23 LEU HD22 H 8.640 3.654 -0.872 1.00 . A A . 23 LEU HD22 1 1 7 3181 1 1 23 LEU HD23 H 8.080 3.402 -2.526 1.00 . A A . 23 LEU HD23 1 1 7 3182 1 1 23 LEU HG H 9.319 1.154 -0.990 1.00 . A A . 23 LEU HG 1 1 7 3183 1 1 23 LEU N N 8.714 1.393 1.534 1.00 . A A . 23 LEU N 1 1 7 3184 1 1 23 LEU O O 6.199 0.950 2.555 1.00 . A A . 23 LEU O 1 1 7 3185 1 1 24 ILE C C 3.017 3.132 1.809 1.00 . A A . 24 ILE C 1 1 7 3186 1 1 24 ILE CA C 4.272 2.920 2.650 1.00 . A A . 24 ILE CA 1 1 7 3187 1 1 24 ILE CB C 4.313 3.972 3.783 1.00 . A A . 24 ILE CB 1 1 7 3188 1 1 24 ILE CD1 C 4.638 6.458 4.267 1.00 . A A . 24 ILE CD1 1 1 7 3189 1 1 24 ILE CG1 C 4.664 5.357 3.226 1.00 . A A . 24 ILE CG1 1 1 7 3190 1 1 24 ILE CG2 C 5.305 3.552 4.859 1.00 . A A . 24 ILE CG2 1 1 7 3191 1 1 24 ILE H H 5.646 3.732 1.242 1.00 . A A . 24 ILE H 1 1 7 3192 1 1 24 ILE HA H 4.216 1.943 3.107 1.00 . A A . 24 ILE HA 1 1 7 3193 1 1 24 ILE HB H 3.331 4.011 4.232 1.00 . A A . 24 ILE HB 1 1 7 3194 1 1 24 ILE HD11 H 4.764 6.028 5.249 1.00 . A A . 24 ILE HD11 1 1 7 3195 1 1 24 ILE HD12 H 3.690 6.976 4.218 1.00 . A A . 24 ILE HD12 1 1 7 3196 1 1 24 ILE HD13 H 5.439 7.155 4.073 1.00 . A A . 24 ILE HD13 1 1 7 3197 1 1 24 ILE HG12 H 5.658 5.326 2.804 1.00 . A A . 24 ILE HG12 1 1 7 3198 1 1 24 ILE HG13 H 3.957 5.615 2.451 1.00 . A A . 24 ILE HG13 1 1 7 3199 1 1 24 ILE HG21 H 5.235 4.230 5.697 1.00 . A A . 24 ILE HG21 1 1 7 3200 1 1 24 ILE HG22 H 6.306 3.581 4.457 1.00 . A A . 24 ILE HG22 1 1 7 3201 1 1 24 ILE HG23 H 5.078 2.549 5.188 1.00 . A A . 24 ILE HG23 1 1 7 3202 1 1 24 ILE N N 5.478 2.952 1.830 1.00 . A A . 24 ILE N 1 1 7 3203 1 1 24 ILE O O 2.946 4.047 0.993 1.00 . A A . 24 ILE O 1 1 7 3204 1 1 25 CYS C C -0.029 3.576 1.702 1.00 . A A . 25 CYS C 1 1 7 3205 1 1 25 CYS CA C 0.773 2.348 1.270 1.00 . A A . 25 CYS CA 1 1 7 3206 1 1 25 CYS CB C -0.050 1.075 1.484 1.00 . A A . 25 CYS CB 1 1 7 3207 1 1 25 CYS H H 2.149 1.553 2.667 1.00 . A A . 25 CYS H 1 1 7 3208 1 1 25 CYS HA H 1.012 2.442 0.220 1.00 . A A . 25 CYS HA 1 1 7 3209 1 1 25 CYS HB2 H 0.563 0.217 1.252 1.00 . A A . 25 CYS HB2 1 1 7 3210 1 1 25 CYS HB3 H -0.356 1.023 2.518 1.00 . A A . 25 CYS HB3 1 1 7 3211 1 1 25 CYS N N 2.029 2.268 2.009 1.00 . A A . 25 CYS N 1 1 7 3212 1 1 25 CYS O O -0.043 3.932 2.881 1.00 . A A . 25 CYS O 1 1 7 3213 1 1 25 CYS SG S -1.549 0.976 0.454 1.00 . A A . 25 CYS SG 1 1 7 3214 1 1 26 GLY C C -2.787 5.449 0.301 1.00 . A A . 26 GLY C 1 1 7 3215 1 1 26 GLY CA C -1.459 5.408 1.043 1.00 . A A . 26 GLY CA 1 1 7 3216 1 1 26 GLY H H -0.622 3.901 -0.184 1.00 . A A . 26 GLY H 1 1 7 3217 1 1 26 GLY HA2 H -1.654 5.437 2.105 1.00 . A A . 26 GLY HA2 1 1 7 3218 1 1 26 GLY HA3 H -0.883 6.280 0.771 1.00 . A A . 26 GLY HA3 1 1 7 3219 1 1 26 GLY N N -0.680 4.225 0.743 1.00 . A A . 26 GLY N 1 1 7 3220 1 1 26 GLY O O -3.644 4.592 0.514 1.00 . A A . 26 GLY O 1 1 7 3221 1 1 27 PRO C C -4.435 5.576 -2.433 1.00 . A A . 27 PRO C 1 1 7 3222 1 1 27 PRO CA C -4.237 6.629 -1.339 1.00 . A A . 27 PRO CA 1 1 7 3223 1 1 27 PRO CB C -4.083 8.022 -1.955 1.00 . A A . 27 PRO CB 1 1 7 3224 1 1 27 PRO CD C -2.016 7.527 -0.859 1.00 . A A . 27 PRO CD 1 1 7 3225 1 1 27 PRO CG C -2.613 8.238 -2.042 1.00 . A A . 27 PRO CG 1 1 7 3226 1 1 27 PRO HA H -5.097 6.619 -0.689 1.00 . A A . 27 PRO HA 1 1 7 3227 1 1 27 PRO HB2 H -4.544 8.038 -2.932 1.00 . A A . 27 PRO HB2 1 1 7 3228 1 1 27 PRO HB3 H -4.552 8.754 -1.317 1.00 . A A . 27 PRO HB3 1 1 7 3229 1 1 27 PRO HD2 H -1.053 7.110 -1.116 1.00 . A A . 27 PRO HD2 1 1 7 3230 1 1 27 PRO HD3 H -1.925 8.201 -0.021 1.00 . A A . 27 PRO HD3 1 1 7 3231 1 1 27 PRO HG2 H -2.233 7.818 -2.962 1.00 . A A . 27 PRO HG2 1 1 7 3232 1 1 27 PRO HG3 H -2.393 9.294 -1.992 1.00 . A A . 27 PRO HG3 1 1 7 3233 1 1 27 PRO N N -2.990 6.457 -0.569 1.00 . A A . 27 PRO N 1 1 7 3234 1 1 27 PRO O O -4.461 5.896 -3.622 1.00 . A A . 27 PRO O 1 1 7 3235 1 1 28 PHE C C -3.512 2.946 -3.758 1.00 . A A . 28 PHE C 1 1 7 3236 1 1 28 PHE CA C -4.755 3.177 -2.900 1.00 . A A . 28 PHE CA 1 1 7 3237 1 1 28 PHE CB C -6.024 3.328 -3.778 1.00 . A A . 28 PHE CB 1 1 7 3238 1 1 28 PHE CD1 C -7.563 3.973 -1.888 1.00 . A A . 28 PHE CD1 1 1 7 3239 1 1 28 PHE CD2 C -8.291 2.308 -3.430 1.00 . A A . 28 PHE CD2 1 1 7 3240 1 1 28 PHE CE1 C -8.752 3.854 -1.194 1.00 . A A . 28 PHE CE1 1 1 7 3241 1 1 28 PHE CE2 C -9.481 2.185 -2.741 1.00 . A A . 28 PHE CE2 1 1 7 3242 1 1 28 PHE CG C -7.317 3.201 -3.014 1.00 . A A . 28 PHE CG 1 1 7 3243 1 1 28 PHE CZ C -9.712 2.958 -1.621 1.00 . A A . 28 PHE CZ 1 1 7 3244 1 1 28 PHE H H -4.519 4.160 -1.038 1.00 . A A . 28 PHE H 1 1 7 3245 1 1 28 PHE HA H -4.884 2.309 -2.268 1.00 . A A . 28 PHE HA 1 1 7 3246 1 1 28 PHE HB2 H -6.024 4.298 -4.257 1.00 . A A . 28 PHE HB2 1 1 7 3247 1 1 28 PHE HB3 H -6.018 2.560 -4.542 1.00 . A A . 28 PHE HB3 1 1 7 3248 1 1 28 PHE HD1 H -6.813 4.674 -1.552 1.00 . A A . 28 PHE HD1 1 1 7 3249 1 1 28 PHE HD2 H -8.112 1.700 -4.306 1.00 . A A . 28 PHE HD2 1 1 7 3250 1 1 28 PHE HE1 H -8.930 4.461 -0.318 1.00 . A A . 28 PHE HE1 1 1 7 3251 1 1 28 PHE HE2 H -10.231 1.484 -3.078 1.00 . A A . 28 PHE HE2 1 1 7 3252 1 1 28 PHE HZ H -10.642 2.864 -1.081 1.00 . A A . 28 PHE HZ 1 1 7 3253 1 1 28 PHE N N -4.564 4.324 -2.006 1.00 . A A . 28 PHE N 1 1 7 3254 1 1 28 PHE O O -3.543 2.192 -4.729 1.00 . A A . 28 PHE O 1 1 7 3255 1 1 29 VAL C C -0.045 3.610 -2.962 1.00 . A A . 29 VAL C 1 1 7 3256 1 1 29 VAL CA C -1.119 3.420 -4.014 1.00 . A A . 29 VAL CA 1 1 7 3257 1 1 29 VAL CB C -0.883 4.440 -5.165 1.00 . A A . 29 VAL CB 1 1 7 3258 1 1 29 VAL CG1 C -1.812 4.178 -6.340 1.00 . A A . 29 VAL CG1 1 1 7 3259 1 1 29 VAL CG2 C -1.043 5.869 -4.666 1.00 . A A . 29 VAL CG2 1 1 7 3260 1 1 29 VAL H H -2.440 4.113 -2.532 1.00 . A A . 29 VAL H 1 1 7 3261 1 1 29 VAL HA H -1.057 2.413 -4.418 1.00 . A A . 29 VAL HA 1 1 7 3262 1 1 29 VAL HB H 0.139 4.320 -5.520 1.00 . A A . 29 VAL HB 1 1 7 3263 1 1 29 VAL HG11 H -2.080 5.116 -6.805 1.00 . A A . 29 VAL HG11 1 1 7 3264 1 1 29 VAL HG12 H -2.706 3.683 -5.989 1.00 . A A . 29 VAL HG12 1 1 7 3265 1 1 29 VAL HG13 H -1.313 3.548 -7.062 1.00 . A A . 29 VAL HG13 1 1 7 3266 1 1 29 VAL HG21 H -0.899 6.556 -5.488 1.00 . A A . 29 VAL HG21 1 1 7 3267 1 1 29 VAL HG22 H -0.309 6.066 -3.898 1.00 . A A . 29 VAL HG22 1 1 7 3268 1 1 29 VAL HG23 H -2.034 5.999 -4.258 1.00 . A A . 29 VAL HG23 1 1 7 3269 1 1 29 VAL N N -2.404 3.562 -3.348 1.00 . A A . 29 VAL N 1 1 7 3270 1 1 29 VAL O O -0.289 4.249 -1.938 1.00 . A A . 29 VAL O 1 1 7 3271 1 1 30 CYS C C 3.040 4.414 -2.530 1.00 . A A . 30 CYS C 1 1 7 3272 1 1 30 CYS CA C 2.206 3.163 -2.247 1.00 . A A . 30 CYS CA 1 1 7 3273 1 1 30 CYS CB C 3.075 1.913 -2.334 1.00 . A A . 30 CYS CB 1 1 7 3274 1 1 30 CYS H H 1.253 2.549 -4.025 1.00 . A A . 30 CYS H 1 1 7 3275 1 1 30 CYS HA H 1.785 3.236 -1.255 1.00 . A A . 30 CYS HA 1 1 7 3276 1 1 30 CYS HB2 H 2.445 1.052 -2.504 1.00 . A A . 30 CYS HB2 1 1 7 3277 1 1 30 CYS HB3 H 3.755 2.019 -3.166 1.00 . A A . 30 CYS HB3 1 1 7 3278 1 1 30 CYS N N 1.115 3.055 -3.193 1.00 . A A . 30 CYS N 1 1 7 3279 1 1 30 CYS O O 3.009 4.959 -3.636 1.00 . A A . 30 CYS O 1 1 7 3280 1 1 30 CYS SG S 4.070 1.597 -0.849 1.00 . A A . 30 CYS SG 1 1 7 3281 1 1 31 VAL C C 5.934 5.852 -0.951 1.00 . A A . 31 VAL C 1 1 7 3282 1 1 31 VAL CA C 4.627 6.045 -1.704 1.00 . A A . 31 VAL CA 1 1 7 3283 1 1 31 VAL CB C 3.942 7.344 -1.211 1.00 . A A . 31 VAL CB 1 1 7 3284 1 1 31 VAL CG1 C 2.780 7.732 -2.114 1.00 . A A . 31 VAL CG1 1 1 7 3285 1 1 31 VAL CG2 C 3.470 7.198 0.230 1.00 . A A . 31 VAL CG2 1 1 7 3286 1 1 31 VAL H H 3.785 4.403 -0.673 1.00 . A A . 31 VAL H 1 1 7 3287 1 1 31 VAL HA H 4.846 6.150 -2.764 1.00 . A A . 31 VAL HA 1 1 7 3288 1 1 31 VAL HB H 4.671 8.141 -1.244 1.00 . A A . 31 VAL HB 1 1 7 3289 1 1 31 VAL HG11 H 2.552 6.912 -2.778 1.00 . A A . 31 VAL HG11 1 1 7 3290 1 1 31 VAL HG12 H 3.051 8.602 -2.695 1.00 . A A . 31 VAL HG12 1 1 7 3291 1 1 31 VAL HG13 H 1.914 7.959 -1.510 1.00 . A A . 31 VAL HG13 1 1 7 3292 1 1 31 VAL HG21 H 2.597 7.812 0.387 1.00 . A A . 31 VAL HG21 1 1 7 3293 1 1 31 VAL HG22 H 4.257 7.512 0.900 1.00 . A A . 31 VAL HG22 1 1 7 3294 1 1 31 VAL HG23 H 3.223 6.165 0.424 1.00 . A A . 31 VAL HG23 1 1 7 3295 1 1 31 VAL N N 3.787 4.871 -1.541 1.00 . A A . 31 VAL N 1 1 7 3296 1 1 31 VAL O O 5.999 4.934 -0.108 1.00 . A A . 31 VAL O 1 1 7 3297 1 1 31 VAL OXT O 6.892 6.610 -1.231 1.00 . A A . 31 VAL OXT 1 1 8 3298 1 1 1 ALA C C 4.966 -8.680 -0.332 1.00 . A A . 1 ALA C 1 1 8 3299 1 1 1 ALA CA C 5.150 -10.174 -0.530 1.00 . A A . 1 ALA CA 1 1 8 3300 1 1 1 ALA CB C 3.877 -10.802 -1.077 1.00 . A A . 1 ALA CB 1 1 8 3301 1 1 1 ALA H1 H 4.965 -11.663 0.916 1.00 . A A . 1 ALA H1 1 1 8 3302 1 1 1 ALA H2 H 5.360 -10.141 1.545 1.00 . A A . 1 ALA H2 1 1 8 3303 1 1 1 ALA H3 H 6.536 -11.061 0.748 1.00 . A A . 1 ALA H3 1 1 8 3304 1 1 1 ALA HA H 5.946 -10.339 -1.243 1.00 . A A . 1 ALA HA 1 1 8 3305 1 1 1 ALA HB1 H 3.670 -11.718 -0.545 1.00 . A A . 1 ALA HB1 1 1 8 3306 1 1 1 ALA HB2 H 4.004 -11.017 -2.128 1.00 . A A . 1 ALA HB2 1 1 8 3307 1 1 1 ALA HB3 H 3.053 -10.116 -0.948 1.00 . A A . 1 ALA HB3 1 1 8 3308 1 1 1 ALA N N 5.530 -10.806 0.757 1.00 . A A . 1 ALA N 1 1 8 3309 1 1 1 ALA O O 4.434 -8.257 0.686 1.00 . A A . 1 ALA O 1 1 8 3310 1 1 2 CYS C C 4.883 -5.835 -2.520 1.00 . A A . 2 CYS C 1 1 8 3311 1 1 2 CYS CA C 5.309 -6.440 -1.191 1.00 . A A . 2 CYS CA 1 1 8 3312 1 1 2 CYS CB C 6.639 -5.850 -0.734 1.00 . A A . 2 CYS CB 1 1 8 3313 1 1 2 CYS H H 5.847 -8.276 -2.082 1.00 . A A . 2 CYS H 1 1 8 3314 1 1 2 CYS HA H 4.555 -6.201 -0.447 1.00 . A A . 2 CYS HA 1 1 8 3315 1 1 2 CYS HB2 H 6.526 -4.783 -0.624 1.00 . A A . 2 CYS HB2 1 1 8 3316 1 1 2 CYS HB3 H 6.902 -6.272 0.228 1.00 . A A . 2 CYS HB3 1 1 8 3317 1 1 2 CYS N N 5.418 -7.886 -1.290 1.00 . A A . 2 CYS N 1 1 8 3318 1 1 2 CYS O O 5.391 -6.207 -3.577 1.00 . A A . 2 CYS O 1 1 8 3319 1 1 2 CYS SG S 8.042 -6.128 -1.859 1.00 . A A . 2 CYS SG 1 1 8 3320 1 1 3 SER C C 4.349 -3.119 -4.078 1.00 . A A . 3 SER C 1 1 8 3321 1 1 3 SER CA C 3.423 -4.254 -3.644 1.00 . A A . 3 SER CA 1 1 8 3322 1 1 3 SER CB C 2.018 -3.715 -3.369 1.00 . A A . 3 SER CB 1 1 8 3323 1 1 3 SER H H 3.563 -4.674 -1.583 1.00 . A A . 3 SER H 1 1 8 3324 1 1 3 SER HA H 3.371 -4.986 -4.436 1.00 . A A . 3 SER HA 1 1 8 3325 1 1 3 SER HB2 H 2.072 -2.933 -2.626 1.00 . A A . 3 SER HB2 1 1 8 3326 1 1 3 SER HB3 H 1.602 -3.317 -4.283 1.00 . A A . 3 SER HB3 1 1 8 3327 1 1 3 SER HG H 0.668 -5.111 -3.622 1.00 . A A . 3 SER HG 1 1 8 3328 1 1 3 SER N N 3.936 -4.914 -2.457 1.00 . A A . 3 SER N 1 1 8 3329 1 1 3 SER O O 4.997 -2.481 -3.244 1.00 . A A . 3 SER O 1 1 8 3330 1 1 3 SER OG O 1.167 -4.744 -2.888 1.00 . A A . 3 SER OG 1 1 8 3331 1 1 4 LYS C C 4.702 -0.451 -5.469 1.00 . A A . 4 LYS C 1 1 8 3332 1 1 4 LYS CA C 5.222 -1.806 -5.942 1.00 . A A . 4 LYS CA 1 1 8 3333 1 1 4 LYS CB C 5.217 -1.880 -7.470 1.00 . A A . 4 LYS CB 1 1 8 3334 1 1 4 LYS CD C 5.340 -3.491 -9.403 1.00 . A A . 4 LYS CD 1 1 8 3335 1 1 4 LYS CE C 5.559 -2.374 -10.414 1.00 . A A . 4 LYS CE 1 1 8 3336 1 1 4 LYS CG C 5.882 -3.133 -8.027 1.00 . A A . 4 LYS CG 1 1 8 3337 1 1 4 LYS H H 3.849 -3.412 -5.988 1.00 . A A . 4 LYS H 1 1 8 3338 1 1 4 LYS HA H 6.231 -1.941 -5.581 1.00 . A A . 4 LYS HA 1 1 8 3339 1 1 4 LYS HB2 H 4.195 -1.858 -7.818 1.00 . A A . 4 LYS HB2 1 1 8 3340 1 1 4 LYS HB3 H 5.739 -1.019 -7.861 1.00 . A A . 4 LYS HB3 1 1 8 3341 1 1 4 LYS HD2 H 5.841 -4.379 -9.755 1.00 . A A . 4 LYS HD2 1 1 8 3342 1 1 4 LYS HD3 H 4.280 -3.684 -9.320 1.00 . A A . 4 LYS HD3 1 1 8 3343 1 1 4 LYS HE2 H 5.561 -1.428 -9.893 1.00 . A A . 4 LYS HE2 1 1 8 3344 1 1 4 LYS HE3 H 6.514 -2.522 -10.896 1.00 . A A . 4 LYS HE3 1 1 8 3345 1 1 4 LYS HG2 H 6.945 -2.961 -8.104 1.00 . A A . 4 LYS HG2 1 1 8 3346 1 1 4 LYS HG3 H 5.697 -3.956 -7.351 1.00 . A A . 4 LYS HG3 1 1 8 3347 1 1 4 LYS HZ1 H 3.589 -2.022 -11.020 1.00 . A A . 4 LYS HZ1 1 1 8 3348 1 1 4 LYS HZ2 H 4.337 -3.310 -11.829 1.00 . A A . 4 LYS HZ2 1 1 8 3349 1 1 4 LYS HZ3 H 4.745 -1.718 -12.225 1.00 . A A . 4 LYS HZ3 1 1 8 3350 1 1 4 LYS N N 4.397 -2.872 -5.383 1.00 . A A . 4 LYS N 1 1 8 3351 1 1 4 LYS NZ N 4.490 -2.357 -11.450 1.00 . A A . 4 LYS NZ 1 1 8 3352 1 1 4 LYS O O 3.517 -0.307 -5.174 1.00 . A A . 4 LYS O 1 1 8 3353 1 1 5 LYS C C 4.013 2.426 -5.642 1.00 . A A . 5 LYS C 1 1 8 3354 1 1 5 LYS CA C 5.202 1.849 -4.884 1.00 . A A . 5 LYS CA 1 1 8 3355 1 1 5 LYS CB C 6.382 2.829 -4.939 1.00 . A A . 5 LYS CB 1 1 8 3356 1 1 5 LYS CD C 7.096 5.147 -4.227 1.00 . A A . 5 LYS CD 1 1 8 3357 1 1 5 LYS CE C 6.676 6.606 -4.169 1.00 . A A . 5 LYS CE 1 1 8 3358 1 1 5 LYS CG C 5.962 4.279 -4.732 1.00 . A A . 5 LYS CG 1 1 8 3359 1 1 5 LYS H H 6.526 0.352 -5.585 1.00 . A A . 5 LYS H 1 1 8 3360 1 1 5 LYS HA H 4.907 1.735 -3.858 1.00 . A A . 5 LYS HA 1 1 8 3361 1 1 5 LYS HB2 H 7.091 2.566 -4.168 1.00 . A A . 5 LYS HB2 1 1 8 3362 1 1 5 LYS HB3 H 6.861 2.748 -5.903 1.00 . A A . 5 LYS HB3 1 1 8 3363 1 1 5 LYS HD2 H 7.376 4.821 -3.235 1.00 . A A . 5 LYS HD2 1 1 8 3364 1 1 5 LYS HD3 H 7.940 5.049 -4.894 1.00 . A A . 5 LYS HD3 1 1 8 3365 1 1 5 LYS HE2 H 6.843 7.053 -5.140 1.00 . A A . 5 LYS HE2 1 1 8 3366 1 1 5 LYS HE3 H 5.622 6.658 -3.930 1.00 . A A . 5 LYS HE3 1 1 8 3367 1 1 5 LYS HG2 H 5.612 4.683 -5.665 1.00 . A A . 5 LYS HG2 1 1 8 3368 1 1 5 LYS HG3 H 5.159 4.305 -4.020 1.00 . A A . 5 LYS HG3 1 1 8 3369 1 1 5 LYS HZ1 H 7.225 8.376 -3.206 1.00 . A A . 5 LYS HZ1 1 1 8 3370 1 1 5 LYS HZ2 H 8.466 7.234 -3.295 1.00 . A A . 5 LYS HZ2 1 1 8 3371 1 1 5 LYS HZ3 H 7.201 7.021 -2.186 1.00 . A A . 5 LYS HZ3 1 1 8 3372 1 1 5 LYS N N 5.591 0.528 -5.363 1.00 . A A . 5 LYS N 1 1 8 3373 1 1 5 LYS NZ N 7.448 7.366 -3.149 1.00 . A A . 5 LYS NZ 1 1 8 3374 1 1 5 LYS O O 2.953 2.627 -5.086 1.00 . A A . 5 LYS O 1 1 8 3375 1 1 6 TRP C C 2.101 2.198 -8.109 1.00 . A A . 6 TRP C 1 1 8 3376 1 1 6 TRP CA C 3.092 3.269 -7.672 1.00 . A A . 6 TRP CA 1 1 8 3377 1 1 6 TRP CB C 3.654 4.046 -8.861 1.00 . A A . 6 TRP CB 1 1 8 3378 1 1 6 TRP CD1 C 6.136 4.532 -8.398 1.00 . A A . 6 TRP CD1 1 1 8 3379 1 1 6 TRP CD2 C 4.800 6.307 -8.134 1.00 . A A . 6 TRP CD2 1 1 8 3380 1 1 6 TRP CE2 C 6.127 6.700 -7.875 1.00 . A A . 6 TRP CE2 1 1 8 3381 1 1 6 TRP CE3 C 3.787 7.261 -8.021 1.00 . A A . 6 TRP CE3 1 1 8 3382 1 1 6 TRP CG C 4.828 4.918 -8.492 1.00 . A A . 6 TRP CG 1 1 8 3383 1 1 6 TRP CH2 C 5.451 8.913 -7.409 1.00 . A A . 6 TRP CH2 1 1 8 3384 1 1 6 TRP CZ2 C 6.465 8.001 -7.512 1.00 . A A . 6 TRP CZ2 1 1 8 3385 1 1 6 TRP CZ3 C 4.121 8.553 -7.657 1.00 . A A . 6 TRP CZ3 1 1 8 3386 1 1 6 TRP H H 5.028 2.517 -7.326 1.00 . A A . 6 TRP H 1 1 8 3387 1 1 6 TRP HA H 2.567 3.961 -7.021 1.00 . A A . 6 TRP HA 1 1 8 3388 1 1 6 TRP HB2 H 3.980 3.349 -9.618 1.00 . A A . 6 TRP HB2 1 1 8 3389 1 1 6 TRP HB3 H 2.881 4.679 -9.269 1.00 . A A . 6 TRP HB3 1 1 8 3390 1 1 6 TRP HD1 H 6.484 3.531 -8.586 1.00 . A A . 6 TRP HD1 1 1 8 3391 1 1 6 TRP HE1 H 7.897 5.575 -7.936 1.00 . A A . 6 TRP HE1 1 1 8 3392 1 1 6 TRP HE3 H 2.759 7.001 -8.200 1.00 . A A . 6 TRP HE3 1 1 8 3393 1 1 6 TRP HH2 H 5.665 9.932 -7.126 1.00 . A A . 6 TRP HH2 1 1 8 3394 1 1 6 TRP HZ2 H 7.485 8.296 -7.317 1.00 . A A . 6 TRP HZ2 1 1 8 3395 1 1 6 TRP HZ3 H 3.349 9.301 -7.564 1.00 . A A . 6 TRP HZ3 1 1 8 3396 1 1 6 TRP N N 4.177 2.694 -6.904 1.00 . A A . 6 TRP N 1 1 8 3397 1 1 6 TRP NE1 N 6.923 5.599 -8.046 1.00 . A A . 6 TRP NE1 1 1 8 3398 1 1 6 TRP O O 1.405 2.351 -9.111 1.00 . A A . 6 TRP O 1 1 8 3399 1 1 7 GLU C C -0.200 0.289 -6.823 1.00 . A A . 7 GLU C 1 1 8 3400 1 1 7 GLU CA C 1.079 0.059 -7.614 1.00 . A A . 7 GLU CA 1 1 8 3401 1 1 7 GLU CB C 1.666 -1.306 -7.258 1.00 . A A . 7 GLU CB 1 1 8 3402 1 1 7 GLU CD C 2.096 -2.249 -9.564 1.00 . A A . 7 GLU CD 1 1 8 3403 1 1 7 GLU CG C 1.336 -2.401 -8.261 1.00 . A A . 7 GLU CG 1 1 8 3404 1 1 7 GLU H H 2.586 1.074 -6.509 1.00 . A A . 7 GLU H 1 1 8 3405 1 1 7 GLU HA H 0.851 0.088 -8.669 1.00 . A A . 7 GLU HA 1 1 8 3406 1 1 7 GLU HB2 H 2.741 -1.216 -7.199 1.00 . A A . 7 GLU HB2 1 1 8 3407 1 1 7 GLU HB3 H 1.287 -1.606 -6.292 1.00 . A A . 7 GLU HB3 1 1 8 3408 1 1 7 GLU HG2 H 1.583 -3.357 -7.826 1.00 . A A . 7 GLU HG2 1 1 8 3409 1 1 7 GLU HG3 H 0.276 -2.368 -8.473 1.00 . A A . 7 GLU HG3 1 1 8 3410 1 1 7 GLU N N 2.016 1.129 -7.324 1.00 . A A . 7 GLU N 1 1 8 3411 1 1 7 GLU O O -0.152 0.670 -5.650 1.00 . A A . 7 GLU O 1 1 8 3412 1 1 7 GLU OE1 O 2.816 -1.242 -9.731 1.00 . A A . 7 GLU OE1 1 1 8 3413 1 1 7 GLU OE2 O 2.008 -3.147 -10.424 1.00 . A A . 7 GLU OE2 1 1 8 3414 1 1 8 TYR C C -2.771 -0.756 -5.660 1.00 . A A . 8 TYR C 1 1 8 3415 1 1 8 TYR CA C -2.622 0.238 -6.808 1.00 . A A . 8 TYR CA 1 1 8 3416 1 1 8 TYR CB C -3.754 0.052 -7.827 1.00 . A A . 8 TYR CB 1 1 8 3417 1 1 8 TYR CD1 C -5.587 1.304 -6.617 1.00 . A A . 8 TYR CD1 1 1 8 3418 1 1 8 TYR CD2 C -6.024 -0.930 -7.318 1.00 . A A . 8 TYR CD2 1 1 8 3419 1 1 8 TYR CE1 C -6.858 1.389 -6.082 1.00 . A A . 8 TYR CE1 1 1 8 3420 1 1 8 TYR CE2 C -7.298 -0.852 -6.787 1.00 . A A . 8 TYR CE2 1 1 8 3421 1 1 8 TYR CG C -5.147 0.145 -7.241 1.00 . A A . 8 TYR CG 1 1 8 3422 1 1 8 TYR CZ C -7.710 0.309 -6.170 1.00 . A A . 8 TYR CZ 1 1 8 3423 1 1 8 TYR H H -1.306 -0.241 -8.391 1.00 . A A . 8 TYR H 1 1 8 3424 1 1 8 TYR HA H -2.658 1.244 -6.407 1.00 . A A . 8 TYR HA 1 1 8 3425 1 1 8 TYR HB2 H -3.668 0.812 -8.589 1.00 . A A . 8 TYR HB2 1 1 8 3426 1 1 8 TYR HB3 H -3.653 -0.920 -8.288 1.00 . A A . 8 TYR HB3 1 1 8 3427 1 1 8 TYR HD1 H -4.918 2.150 -6.549 1.00 . A A . 8 TYR HD1 1 1 8 3428 1 1 8 TYR HD2 H -5.698 -1.840 -7.801 1.00 . A A . 8 TYR HD2 1 1 8 3429 1 1 8 TYR HE1 H -7.180 2.299 -5.598 1.00 . A A . 8 TYR HE1 1 1 8 3430 1 1 8 TYR HE2 H -7.964 -1.699 -6.858 1.00 . A A . 8 TYR HE2 1 1 8 3431 1 1 8 TYR HH H -9.072 -0.256 -4.935 1.00 . A A . 8 TYR HH 1 1 8 3432 1 1 8 TYR N N -1.335 0.059 -7.459 1.00 . A A . 8 TYR N 1 1 8 3433 1 1 8 TYR O O -2.530 -1.953 -5.830 1.00 . A A . 8 TYR O 1 1 8 3434 1 1 8 TYR OH O -8.977 0.390 -5.640 1.00 . A A . 8 TYR OH 1 1 8 3435 1 1 9 CYS C C -4.592 -1.945 -3.401 1.00 . A A . 9 CYS C 1 1 8 3436 1 1 9 CYS CA C -3.331 -1.085 -3.310 1.00 . A A . 9 CYS CA 1 1 8 3437 1 1 9 CYS CB C -3.389 -0.221 -2.048 1.00 . A A . 9 CYS CB 1 1 8 3438 1 1 9 CYS H H -3.325 0.715 -4.429 1.00 . A A . 9 CYS H 1 1 8 3439 1 1 9 CYS HA H -2.475 -1.738 -3.241 1.00 . A A . 9 CYS HA 1 1 8 3440 1 1 9 CYS HB2 H -4.193 0.493 -2.148 1.00 . A A . 9 CYS HB2 1 1 8 3441 1 1 9 CYS HB3 H -3.587 -0.857 -1.197 1.00 . A A . 9 CYS HB3 1 1 8 3442 1 1 9 CYS N N -3.157 -0.252 -4.496 1.00 . A A . 9 CYS N 1 1 8 3443 1 1 9 CYS O O -5.497 -1.822 -2.575 1.00 . A A . 9 CYS O 1 1 8 3444 1 1 9 CYS SG S -1.866 0.714 -1.698 1.00 . A A . 9 CYS SG 1 1 8 3445 1 1 10 ILE C C -5.674 -4.899 -3.595 1.00 . A A . 10 ILE C 1 1 8 3446 1 1 10 ILE CA C -5.777 -3.722 -4.580 1.00 . A A . 10 ILE CA 1 1 8 3447 1 1 10 ILE CB C -5.861 -4.209 -6.054 1.00 . A A . 10 ILE CB 1 1 8 3448 1 1 10 ILE CD1 C -7.304 -5.505 -7.718 1.00 . A A . 10 ILE CD1 1 1 8 3449 1 1 10 ILE CG1 C -7.109 -5.075 -6.278 1.00 . A A . 10 ILE CG1 1 1 8 3450 1 1 10 ILE CG2 C -4.593 -4.953 -6.461 1.00 . A A . 10 ILE CG2 1 1 8 3451 1 1 10 ILE H H -3.878 -2.883 -5.014 1.00 . A A . 10 ILE H 1 1 8 3452 1 1 10 ILE HA H -6.675 -3.162 -4.355 1.00 . A A . 10 ILE HA 1 1 8 3453 1 1 10 ILE HB H -5.936 -3.332 -6.682 1.00 . A A . 10 ILE HB 1 1 8 3454 1 1 10 ILE HD11 H -8.165 -6.155 -7.785 1.00 . A A . 10 ILE HD11 1 1 8 3455 1 1 10 ILE HD12 H -6.427 -6.033 -8.057 1.00 . A A . 10 ILE HD12 1 1 8 3456 1 1 10 ILE HD13 H -7.462 -4.633 -8.335 1.00 . A A . 10 ILE HD13 1 1 8 3457 1 1 10 ILE HG12 H -7.031 -5.968 -5.675 1.00 . A A . 10 ILE HG12 1 1 8 3458 1 1 10 ILE HG13 H -7.983 -4.518 -5.976 1.00 . A A . 10 ILE HG13 1 1 8 3459 1 1 10 ILE HG21 H -4.176 -5.453 -5.599 1.00 . A A . 10 ILE HG21 1 1 8 3460 1 1 10 ILE HG22 H -3.873 -4.250 -6.853 1.00 . A A . 10 ILE HG22 1 1 8 3461 1 1 10 ILE HG23 H -4.833 -5.684 -7.220 1.00 . A A . 10 ILE HG23 1 1 8 3462 1 1 10 ILE N N -4.640 -2.825 -4.393 1.00 . A A . 10 ILE N 1 1 8 3463 1 1 10 ILE O O -5.713 -6.074 -3.962 1.00 . A A . 10 ILE O 1 1 8 3464 1 1 11 VAL C C -6.738 -6.114 -0.864 1.00 . A A . 11 VAL C 1 1 8 3465 1 1 11 VAL CA C -5.382 -5.538 -1.269 1.00 . A A . 11 VAL CA 1 1 8 3466 1 1 11 VAL CB C -4.677 -4.931 -0.033 1.00 . A A . 11 VAL CB 1 1 8 3467 1 1 11 VAL CG1 C -3.269 -4.483 -0.393 1.00 . A A . 11 VAL CG1 1 1 8 3468 1 1 11 VAL CG2 C -5.472 -3.764 0.539 1.00 . A A . 11 VAL CG2 1 1 8 3469 1 1 11 VAL H H -5.481 -3.601 -2.097 1.00 . A A . 11 VAL H 1 1 8 3470 1 1 11 VAL HA H -4.765 -6.342 -1.644 1.00 . A A . 11 VAL HA 1 1 8 3471 1 1 11 VAL HB H -4.603 -5.697 0.726 1.00 . A A . 11 VAL HB 1 1 8 3472 1 1 11 VAL HG11 H -3.168 -4.441 -1.467 1.00 . A A . 11 VAL HG11 1 1 8 3473 1 1 11 VAL HG12 H -2.553 -5.184 0.009 1.00 . A A . 11 VAL HG12 1 1 8 3474 1 1 11 VAL HG13 H -3.085 -3.503 0.023 1.00 . A A . 11 VAL HG13 1 1 8 3475 1 1 11 VAL HG21 H -5.106 -3.530 1.529 1.00 . A A . 11 VAL HG21 1 1 8 3476 1 1 11 VAL HG22 H -6.516 -4.033 0.595 1.00 . A A . 11 VAL HG22 1 1 8 3477 1 1 11 VAL HG23 H -5.355 -2.902 -0.101 1.00 . A A . 11 VAL HG23 1 1 8 3478 1 1 11 VAL N N -5.516 -4.556 -2.327 1.00 . A A . 11 VAL N 1 1 8 3479 1 1 11 VAL O O -7.714 -5.382 -0.692 1.00 . A A . 11 VAL O 1 1 8 3480 1 1 12 PRO C C -8.481 -7.735 1.089 1.00 . A A . 12 PRO C 1 1 8 3481 1 1 12 PRO CA C -8.051 -8.122 -0.324 1.00 . A A . 12 PRO CA 1 1 8 3482 1 1 12 PRO CB C -7.691 -9.615 -0.384 1.00 . A A . 12 PRO CB 1 1 8 3483 1 1 12 PRO CD C -5.710 -8.388 -0.910 1.00 . A A . 12 PRO CD 1 1 8 3484 1 1 12 PRO CG C -6.423 -9.684 -1.166 1.00 . A A . 12 PRO CG 1 1 8 3485 1 1 12 PRO HA H -8.854 -7.912 -1.015 1.00 . A A . 12 PRO HA 1 1 8 3486 1 1 12 PRO HB2 H -7.556 -9.993 0.618 1.00 . A A . 12 PRO HB2 1 1 8 3487 1 1 12 PRO HB3 H -8.485 -10.158 -0.874 1.00 . A A . 12 PRO HB3 1 1 8 3488 1 1 12 PRO HD2 H -5.099 -8.462 -0.022 1.00 . A A . 12 PRO HD2 1 1 8 3489 1 1 12 PRO HD3 H -5.111 -8.110 -1.764 1.00 . A A . 12 PRO HD3 1 1 8 3490 1 1 12 PRO HG2 H -5.824 -10.515 -0.823 1.00 . A A . 12 PRO HG2 1 1 8 3491 1 1 12 PRO HG3 H -6.645 -9.788 -2.217 1.00 . A A . 12 PRO HG3 1 1 8 3492 1 1 12 PRO N N -6.815 -7.443 -0.713 1.00 . A A . 12 PRO N 1 1 8 3493 1 1 12 PRO O O -7.657 -7.669 2.000 1.00 . A A . 12 PRO O 1 1 8 3494 1 1 13 ILE C C -9.970 -8.097 3.651 1.00 . A A . 13 ILE C 1 1 8 3495 1 1 13 ILE CA C -10.311 -7.074 2.561 1.00 . A A . 13 ILE CA 1 1 8 3496 1 1 13 ILE CB C -11.846 -6.857 2.489 1.00 . A A . 13 ILE CB 1 1 8 3497 1 1 13 ILE CD1 C -13.884 -6.150 3.855 1.00 . A A . 13 ILE CD1 1 1 8 3498 1 1 13 ILE CG1 C -12.404 -6.470 3.865 1.00 . A A . 13 ILE CG1 1 1 8 3499 1 1 13 ILE CG2 C -12.549 -8.097 1.950 1.00 . A A . 13 ILE CG2 1 1 8 3500 1 1 13 ILE H H -10.374 -7.529 0.494 1.00 . A A . 13 ILE H 1 1 8 3501 1 1 13 ILE HA H -9.855 -6.130 2.826 1.00 . A A . 13 ILE HA 1 1 8 3502 1 1 13 ILE HB H -12.032 -6.046 1.799 1.00 . A A . 13 ILE HB 1 1 8 3503 1 1 13 ILE HD11 H -14.290 -6.292 4.846 1.00 . A A . 13 ILE HD11 1 1 8 3504 1 1 13 ILE HD12 H -14.389 -6.806 3.161 1.00 . A A . 13 ILE HD12 1 1 8 3505 1 1 13 ILE HD13 H -14.028 -5.124 3.551 1.00 . A A . 13 ILE HD13 1 1 8 3506 1 1 13 ILE HG12 H -12.248 -7.289 4.551 1.00 . A A . 13 ILE HG12 1 1 8 3507 1 1 13 ILE HG13 H -11.878 -5.599 4.227 1.00 . A A . 13 ILE HG13 1 1 8 3508 1 1 13 ILE HG21 H -12.012 -8.468 1.088 1.00 . A A . 13 ILE HG21 1 1 8 3509 1 1 13 ILE HG22 H -13.558 -7.842 1.662 1.00 . A A . 13 ILE HG22 1 1 8 3510 1 1 13 ILE HG23 H -12.574 -8.858 2.715 1.00 . A A . 13 ILE HG23 1 1 8 3511 1 1 13 ILE N N -9.771 -7.470 1.261 1.00 . A A . 13 ILE N 1 1 8 3512 1 1 13 ILE O O -9.676 -7.732 4.787 1.00 . A A . 13 ILE O 1 1 8 3513 1 1 14 LEU C C -8.250 -10.933 4.078 1.00 . A A . 14 LEU C 1 1 8 3514 1 1 14 LEU CA C -9.687 -10.435 4.252 1.00 . A A . 14 LEU CA 1 1 8 3515 1 1 14 LEU CB C -10.674 -11.607 4.109 1.00 . A A . 14 LEU CB 1 1 8 3516 1 1 14 LEU CD1 C -11.309 -13.745 2.963 1.00 . A A . 14 LEU CD1 1 1 8 3517 1 1 14 LEU CD2 C -11.174 -11.645 1.632 1.00 . A A . 14 LEU CD2 1 1 8 3518 1 1 14 LEU CG C -10.586 -12.417 2.806 1.00 . A A . 14 LEU CG 1 1 8 3519 1 1 14 LEU H H -10.229 -9.614 2.380 1.00 . A A . 14 LEU H 1 1 8 3520 1 1 14 LEU HA H -9.786 -10.018 5.243 1.00 . A A . 14 LEU HA 1 1 8 3521 1 1 14 LEU HB2 H -10.513 -12.283 4.935 1.00 . A A . 14 LEU HB2 1 1 8 3522 1 1 14 LEU HB3 H -11.677 -11.211 4.188 1.00 . A A . 14 LEU HB3 1 1 8 3523 1 1 14 LEU HD11 H -10.747 -14.522 2.466 1.00 . A A . 14 LEU HD11 1 1 8 3524 1 1 14 LEU HD12 H -12.293 -13.674 2.523 1.00 . A A . 14 LEU HD12 1 1 8 3525 1 1 14 LEU HD13 H -11.401 -13.983 4.013 1.00 . A A . 14 LEU HD13 1 1 8 3526 1 1 14 LEU HD21 H -11.453 -10.654 1.957 1.00 . A A . 14 LEU HD21 1 1 8 3527 1 1 14 LEU HD22 H -12.046 -12.162 1.261 1.00 . A A . 14 LEU HD22 1 1 8 3528 1 1 14 LEU HD23 H -10.438 -11.572 0.845 1.00 . A A . 14 LEU HD23 1 1 8 3529 1 1 14 LEU HG H -9.548 -12.626 2.587 1.00 . A A . 14 LEU HG 1 1 8 3530 1 1 14 LEU N N -9.998 -9.377 3.298 1.00 . A A . 14 LEU N 1 1 8 3531 1 1 14 LEU O O -7.952 -12.095 4.346 1.00 . A A . 14 LEU O 1 1 8 3532 1 1 15 GLY C C -5.159 -9.339 2.803 1.00 . A A . 15 GLY C 1 1 8 3533 1 1 15 GLY CA C -5.979 -10.442 3.434 1.00 . A A . 15 GLY CA 1 1 8 3534 1 1 15 GLY H H -7.649 -9.133 3.426 1.00 . A A . 15 GLY H 1 1 8 3535 1 1 15 GLY HA2 H -5.548 -10.695 4.391 1.00 . A A . 15 GLY HA2 1 1 8 3536 1 1 15 GLY HA3 H -5.946 -11.311 2.794 1.00 . A A . 15 GLY HA3 1 1 8 3537 1 1 15 GLY N N -7.364 -10.053 3.629 1.00 . A A . 15 GLY N 1 1 8 3538 1 1 15 GLY O O -4.551 -9.534 1.753 1.00 . A A . 15 GLY O 1 1 8 3539 1 1 16 PHE C C -2.924 -7.293 2.883 1.00 . A A . 16 PHE C 1 1 8 3540 1 1 16 PHE CA C -4.426 -7.023 2.929 1.00 . A A . 16 PHE CA 1 1 8 3541 1 1 16 PHE CB C -4.737 -5.770 3.766 1.00 . A A . 16 PHE CB 1 1 8 3542 1 1 16 PHE CD1 C -3.304 -5.905 5.833 1.00 . A A . 16 PHE CD1 1 1 8 3543 1 1 16 PHE CD2 C -5.665 -6.143 6.070 1.00 . A A . 16 PHE CD2 1 1 8 3544 1 1 16 PHE CE1 C -3.148 -6.064 7.197 1.00 . A A . 16 PHE CE1 1 1 8 3545 1 1 16 PHE CE2 C -5.515 -6.303 7.434 1.00 . A A . 16 PHE CE2 1 1 8 3546 1 1 16 PHE CG C -4.563 -5.943 5.253 1.00 . A A . 16 PHE CG 1 1 8 3547 1 1 16 PHE CZ C -4.255 -6.263 7.998 1.00 . A A . 16 PHE CZ 1 1 8 3548 1 1 16 PHE H H -5.677 -8.081 4.264 1.00 . A A . 16 PHE H 1 1 8 3549 1 1 16 PHE HA H -4.766 -6.850 1.918 1.00 . A A . 16 PHE HA 1 1 8 3550 1 1 16 PHE HB2 H -4.083 -4.970 3.452 1.00 . A A . 16 PHE HB2 1 1 8 3551 1 1 16 PHE HB3 H -5.762 -5.477 3.585 1.00 . A A . 16 PHE HB3 1 1 8 3552 1 1 16 PHE HD1 H -2.438 -5.749 5.208 1.00 . A A . 16 PHE HD1 1 1 8 3553 1 1 16 PHE HD2 H -6.651 -6.175 5.630 1.00 . A A . 16 PHE HD2 1 1 8 3554 1 1 16 PHE HE1 H -2.161 -6.033 7.635 1.00 . A A . 16 PHE HE1 1 1 8 3555 1 1 16 PHE HE2 H -6.382 -6.458 8.058 1.00 . A A . 16 PHE HE2 1 1 8 3556 1 1 16 PHE HZ H -4.135 -6.387 9.064 1.00 . A A . 16 PHE HZ 1 1 8 3557 1 1 16 PHE N N -5.161 -8.173 3.437 1.00 . A A . 16 PHE N 1 1 8 3558 1 1 16 PHE O O -2.355 -7.890 3.798 1.00 . A A . 16 PHE O 1 1 8 3559 1 1 17 VAL C C -0.104 -5.883 2.260 1.00 . A A . 17 VAL C 1 1 8 3560 1 1 17 VAL CA C -0.864 -7.044 1.615 1.00 . A A . 17 VAL CA 1 1 8 3561 1 1 17 VAL CB C -0.500 -7.151 0.111 1.00 . A A . 17 VAL CB 1 1 8 3562 1 1 17 VAL CG1 C 0.793 -7.934 -0.091 1.00 . A A . 17 VAL CG1 1 1 8 3563 1 1 17 VAL CG2 C -1.634 -7.792 -0.678 1.00 . A A . 17 VAL CG2 1 1 8 3564 1 1 17 VAL H H -2.807 -6.397 1.109 1.00 . A A . 17 VAL H 1 1 8 3565 1 1 17 VAL HA H -0.576 -7.962 2.103 1.00 . A A . 17 VAL HA 1 1 8 3566 1 1 17 VAL HB H -0.348 -6.152 -0.271 1.00 . A A . 17 VAL HB 1 1 8 3567 1 1 17 VAL HG11 H 1.121 -8.338 0.855 1.00 . A A . 17 VAL HG11 1 1 8 3568 1 1 17 VAL HG12 H 1.554 -7.277 -0.486 1.00 . A A . 17 VAL HG12 1 1 8 3569 1 1 17 VAL HG13 H 0.619 -8.742 -0.786 1.00 . A A . 17 VAL HG13 1 1 8 3570 1 1 17 VAL HG21 H -1.231 -8.539 -1.346 1.00 . A A . 17 VAL HG21 1 1 8 3571 1 1 17 VAL HG22 H -2.147 -7.034 -1.253 1.00 . A A . 17 VAL HG22 1 1 8 3572 1 1 17 VAL HG23 H -2.329 -8.257 0.004 1.00 . A A . 17 VAL HG23 1 1 8 3573 1 1 17 VAL N N -2.295 -6.857 1.801 1.00 . A A . 17 VAL N 1 1 8 3574 1 1 17 VAL O O -0.683 -5.083 2.995 1.00 . A A . 17 VAL O 1 1 8 3575 1 1 18 TYR C C 3.164 -4.426 1.587 1.00 . A A . 18 TYR C 1 1 8 3576 1 1 18 TYR CA C 2.022 -4.746 2.542 1.00 . A A . 18 TYR CA 1 1 8 3577 1 1 18 TYR CB C 2.580 -5.189 3.906 1.00 . A A . 18 TYR CB 1 1 8 3578 1 1 18 TYR CD1 C 4.770 -6.424 3.596 1.00 . A A . 18 TYR CD1 1 1 8 3579 1 1 18 TYR CD2 C 2.803 -7.708 4.006 1.00 . A A . 18 TYR CD2 1 1 8 3580 1 1 18 TYR CE1 C 5.515 -7.584 3.510 1.00 . A A . 18 TYR CE1 1 1 8 3581 1 1 18 TYR CE2 C 3.543 -8.872 3.928 1.00 . A A . 18 TYR CE2 1 1 8 3582 1 1 18 TYR CG C 3.402 -6.463 3.844 1.00 . A A . 18 TYR CG 1 1 8 3583 1 1 18 TYR CZ C 4.898 -8.805 3.677 1.00 . A A . 18 TYR CZ 1 1 8 3584 1 1 18 TYR H H 1.588 -6.463 1.396 1.00 . A A . 18 TYR H 1 1 8 3585 1 1 18 TYR HA H 1.414 -3.865 2.675 1.00 . A A . 18 TYR HA 1 1 8 3586 1 1 18 TYR HB2 H 3.209 -4.407 4.300 1.00 . A A . 18 TYR HB2 1 1 8 3587 1 1 18 TYR HB3 H 1.756 -5.358 4.584 1.00 . A A . 18 TYR HB3 1 1 8 3588 1 1 18 TYR HD1 H 5.253 -5.465 3.467 1.00 . A A . 18 TYR HD1 1 1 8 3589 1 1 18 TYR HD2 H 1.743 -7.758 4.201 1.00 . A A . 18 TYR HD2 1 1 8 3590 1 1 18 TYR HE1 H 6.577 -7.530 3.316 1.00 . A A . 18 TYR HE1 1 1 8 3591 1 1 18 TYR HE2 H 3.059 -9.828 4.058 1.00 . A A . 18 TYR HE2 1 1 8 3592 1 1 18 TYR HH H 6.034 -10.164 4.432 1.00 . A A . 18 TYR HH 1 1 8 3593 1 1 18 TYR N N 1.184 -5.796 1.986 1.00 . A A . 18 TYR N 1 1 8 3594 1 1 18 TYR O O 3.649 -5.304 0.878 1.00 . A A . 18 TYR O 1 1 8 3595 1 1 18 TYR OH O 5.635 -9.967 3.576 1.00 . A A . 18 TYR OH 1 1 8 3596 1 1 19 CYS C C 6.019 -3.208 1.267 1.00 . A A . 19 CYS C 1 1 8 3597 1 1 19 CYS CA C 4.683 -2.749 0.703 1.00 . A A . 19 CYS CA 1 1 8 3598 1 1 19 CYS CB C 4.688 -1.238 0.584 1.00 . A A . 19 CYS CB 1 1 8 3599 1 1 19 CYS H H 3.159 -2.508 2.153 1.00 . A A . 19 CYS H 1 1 8 3600 1 1 19 CYS HA H 4.536 -3.186 -0.273 1.00 . A A . 19 CYS HA 1 1 8 3601 1 1 19 CYS HB2 H 4.635 -0.833 1.575 1.00 . A A . 19 CYS HB2 1 1 8 3602 1 1 19 CYS HB3 H 5.614 -0.912 0.117 1.00 . A A . 19 CYS HB3 1 1 8 3603 1 1 19 CYS N N 3.587 -3.173 1.566 1.00 . A A . 19 CYS N 1 1 8 3604 1 1 19 CYS O O 6.121 -3.541 2.448 1.00 . A A . 19 CYS O 1 1 8 3605 1 1 19 CYS SG S 3.293 -0.555 -0.364 1.00 . A A . 19 CYS SG 1 1 8 3606 1 1 20 CYS C C 8.932 -2.557 1.790 1.00 . A A . 20 CYS C 1 1 8 3607 1 1 20 CYS CA C 8.372 -3.610 0.856 1.00 . A A . 20 CYS CA 1 1 8 3608 1 1 20 CYS CB C 9.311 -3.805 -0.334 1.00 . A A . 20 CYS CB 1 1 8 3609 1 1 20 CYS H H 6.906 -2.925 -0.501 1.00 . A A . 20 CYS H 1 1 8 3610 1 1 20 CYS HA H 8.281 -4.547 1.390 1.00 . A A . 20 CYS HA 1 1 8 3611 1 1 20 CYS HB2 H 8.876 -3.341 -1.195 1.00 . A A . 20 CYS HB2 1 1 8 3612 1 1 20 CYS HB3 H 10.257 -3.331 -0.112 1.00 . A A . 20 CYS HB3 1 1 8 3613 1 1 20 CYS N N 7.043 -3.211 0.424 1.00 . A A . 20 CYS N 1 1 8 3614 1 1 20 CYS O O 8.505 -1.401 1.748 1.00 . A A . 20 CYS O 1 1 8 3615 1 1 20 CYS SG S 9.642 -5.556 -0.747 1.00 . A A . 20 CYS SG 1 1 8 3616 1 1 21 PRO C C 11.015 -0.774 2.908 1.00 . A A . 21 PRO C 1 1 8 3617 1 1 21 PRO CA C 10.483 -2.012 3.598 1.00 . A A . 21 PRO CA 1 1 8 3618 1 1 21 PRO CB C 11.607 -2.815 4.232 1.00 . A A . 21 PRO CB 1 1 8 3619 1 1 21 PRO CD C 10.439 -4.290 2.763 1.00 . A A . 21 PRO CD 1 1 8 3620 1 1 21 PRO CG C 11.186 -4.238 4.069 1.00 . A A . 21 PRO CG 1 1 8 3621 1 1 21 PRO HA H 9.774 -1.717 4.358 1.00 . A A . 21 PRO HA 1 1 8 3622 1 1 21 PRO HB2 H 12.536 -2.609 3.718 1.00 . A A . 21 PRO HB2 1 1 8 3623 1 1 21 PRO HB3 H 11.688 -2.536 5.268 1.00 . A A . 21 PRO HB3 1 1 8 3624 1 1 21 PRO HD2 H 11.115 -4.495 1.947 1.00 . A A . 21 PRO HD2 1 1 8 3625 1 1 21 PRO HD3 H 9.651 -5.025 2.790 1.00 . A A . 21 PRO HD3 1 1 8 3626 1 1 21 PRO HG2 H 12.055 -4.877 4.032 1.00 . A A . 21 PRO HG2 1 1 8 3627 1 1 21 PRO HG3 H 10.539 -4.527 4.884 1.00 . A A . 21 PRO HG3 1 1 8 3628 1 1 21 PRO N N 9.881 -2.937 2.649 1.00 . A A . 21 PRO N 1 1 8 3629 1 1 21 PRO O O 11.931 -0.832 2.088 1.00 . A A . 21 PRO O 1 1 8 3630 1 1 22 GLY C C 9.553 2.320 2.078 1.00 . A A . 22 GLY C 1 1 8 3631 1 1 22 GLY CA C 10.757 1.600 2.647 1.00 . A A . 22 GLY CA 1 1 8 3632 1 1 22 GLY H H 9.664 0.283 3.878 1.00 . A A . 22 GLY H 1 1 8 3633 1 1 22 GLY HA2 H 11.212 2.221 3.403 1.00 . A A . 22 GLY HA2 1 1 8 3634 1 1 22 GLY HA3 H 11.470 1.430 1.854 1.00 . A A . 22 GLY HA3 1 1 8 3635 1 1 22 GLY N N 10.396 0.333 3.236 1.00 . A A . 22 GLY N 1 1 8 3636 1 1 22 GLY O O 9.476 3.544 2.135 1.00 . A A . 22 GLY O 1 1 8 3637 1 1 23 LEU C C 6.190 1.742 1.784 1.00 . A A . 23 LEU C 1 1 8 3638 1 1 23 LEU CA C 7.404 2.131 0.950 1.00 . A A . 23 LEU CA 1 1 8 3639 1 1 23 LEU CB C 7.212 1.657 -0.501 1.00 . A A . 23 LEU CB 1 1 8 3640 1 1 23 LEU CD1 C 8.704 3.514 -1.327 1.00 . A A . 23 LEU CD1 1 1 8 3641 1 1 23 LEU CD2 C 9.515 1.141 -1.399 1.00 . A A . 23 LEU CD2 1 1 8 3642 1 1 23 LEU CG C 8.303 2.058 -1.507 1.00 . A A . 23 LEU CG 1 1 8 3643 1 1 23 LEU H H 8.716 0.578 1.517 1.00 . A A . 23 LEU H 1 1 8 3644 1 1 23 LEU HA H 7.508 3.205 0.962 1.00 . A A . 23 LEU HA 1 1 8 3645 1 1 23 LEU HB2 H 7.147 0.579 -0.493 1.00 . A A . 23 LEU HB2 1 1 8 3646 1 1 23 LEU HB3 H 6.270 2.049 -0.857 1.00 . A A . 23 LEU HB3 1 1 8 3647 1 1 23 LEU HD11 H 8.725 4.003 -2.290 1.00 . A A . 23 LEU HD11 1 1 8 3648 1 1 23 LEU HD12 H 9.685 3.564 -0.878 1.00 . A A . 23 LEU HD12 1 1 8 3649 1 1 23 LEU HD13 H 7.988 4.009 -0.688 1.00 . A A . 23 LEU HD13 1 1 8 3650 1 1 23 LEU HD21 H 9.467 0.388 -2.171 1.00 . A A . 23 LEU HD21 1 1 8 3651 1 1 23 LEU HD22 H 9.519 0.664 -0.430 1.00 . A A . 23 LEU HD22 1 1 8 3652 1 1 23 LEU HD23 H 10.417 1.722 -1.517 1.00 . A A . 23 LEU HD23 1 1 8 3653 1 1 23 LEU HG H 7.902 1.954 -2.506 1.00 . A A . 23 LEU HG 1 1 8 3654 1 1 23 LEU N N 8.608 1.557 1.530 1.00 . A A . 23 LEU N 1 1 8 3655 1 1 23 LEU O O 6.171 0.673 2.401 1.00 . A A . 23 LEU O 1 1 8 3656 1 1 24 ILE C C 2.719 2.740 1.776 1.00 . A A . 24 ILE C 1 1 8 3657 1 1 24 ILE CA C 3.962 2.332 2.564 1.00 . A A . 24 ILE CA 1 1 8 3658 1 1 24 ILE CB C 3.960 3.066 3.927 1.00 . A A . 24 ILE CB 1 1 8 3659 1 1 24 ILE CD1 C 4.224 5.360 5.019 1.00 . A A . 24 ILE CD1 1 1 8 3660 1 1 24 ILE CG1 C 4.316 4.547 3.745 1.00 . A A . 24 ILE CG1 1 1 8 3661 1 1 24 ILE CG2 C 4.918 2.395 4.902 1.00 . A A . 24 ILE CG2 1 1 8 3662 1 1 24 ILE H H 5.253 3.441 1.286 1.00 . A A . 24 ILE H 1 1 8 3663 1 1 24 ILE HA H 3.919 1.269 2.754 1.00 . A A . 24 ILE HA 1 1 8 3664 1 1 24 ILE HB H 2.964 2.994 4.340 1.00 . A A . 24 ILE HB 1 1 8 3665 1 1 24 ILE HD11 H 3.190 5.454 5.314 1.00 . A A . 24 ILE HD11 1 1 8 3666 1 1 24 ILE HD12 H 4.642 6.341 4.851 1.00 . A A . 24 ILE HD12 1 1 8 3667 1 1 24 ILE HD13 H 4.778 4.862 5.803 1.00 . A A . 24 ILE HD13 1 1 8 3668 1 1 24 ILE HG12 H 5.327 4.624 3.376 1.00 . A A . 24 ILE HG12 1 1 8 3669 1 1 24 ILE HG13 H 3.641 4.985 3.023 1.00 . A A . 24 ILE HG13 1 1 8 3670 1 1 24 ILE HG21 H 5.900 2.336 4.456 1.00 . A A . 24 ILE HG21 1 1 8 3671 1 1 24 ILE HG22 H 4.564 1.400 5.127 1.00 . A A . 24 ILE HG22 1 1 8 3672 1 1 24 ILE HG23 H 4.970 2.974 5.811 1.00 . A A . 24 ILE HG23 1 1 8 3673 1 1 24 ILE N N 5.179 2.599 1.804 1.00 . A A . 24 ILE N 1 1 8 3674 1 1 24 ILE O O 2.671 3.822 1.191 1.00 . A A . 24 ILE O 1 1 8 3675 1 1 25 CYS C C -0.268 3.326 1.680 1.00 . A A . 25 CYS C 1 1 8 3676 1 1 25 CYS CA C 0.473 2.153 1.038 1.00 . A A . 25 CYS CA 1 1 8 3677 1 1 25 CYS CB C -0.437 0.921 0.996 1.00 . A A . 25 CYS CB 1 1 8 3678 1 1 25 CYS H H 1.811 1.013 2.233 1.00 . A A . 25 CYS H 1 1 8 3679 1 1 25 CYS HA H 0.733 2.425 0.029 1.00 . A A . 25 CYS HA 1 1 8 3680 1 1 25 CYS HB2 H 0.041 0.147 0.416 1.00 . A A . 25 CYS HB2 1 1 8 3681 1 1 25 CYS HB3 H -0.597 0.565 2.003 1.00 . A A . 25 CYS HB3 1 1 8 3682 1 1 25 CYS N N 1.714 1.867 1.757 1.00 . A A . 25 CYS N 1 1 8 3683 1 1 25 CYS O O -0.322 3.440 2.905 1.00 . A A . 25 CYS O 1 1 8 3684 1 1 25 CYS SG S -2.074 1.243 0.253 1.00 . A A . 25 CYS SG 1 1 8 3685 1 1 26 GLY C C -2.776 5.678 0.502 1.00 . A A . 26 GLY C 1 1 8 3686 1 1 26 GLY CA C -1.552 5.346 1.342 1.00 . A A . 26 GLY CA 1 1 8 3687 1 1 26 GLY H H -0.746 4.050 -0.124 1.00 . A A . 26 GLY H 1 1 8 3688 1 1 26 GLY HA2 H -1.868 5.149 2.355 1.00 . A A . 26 GLY HA2 1 1 8 3689 1 1 26 GLY HA3 H -0.889 6.198 1.343 1.00 . A A . 26 GLY HA3 1 1 8 3690 1 1 26 GLY N N -0.830 4.194 0.846 1.00 . A A . 26 GLY N 1 1 8 3691 1 1 26 GLY O O -3.835 5.079 0.685 1.00 . A A . 26 GLY O 1 1 8 3692 1 1 27 PRO C C -4.123 6.053 -2.384 1.00 . A A . 27 PRO C 1 1 8 3693 1 1 27 PRO CA C -3.781 7.067 -1.291 1.00 . A A . 27 PRO CA 1 1 8 3694 1 1 27 PRO CB C -3.276 8.376 -1.901 1.00 . A A . 27 PRO CB 1 1 8 3695 1 1 27 PRO CD C -1.436 7.418 -0.700 1.00 . A A . 27 PRO CD 1 1 8 3696 1 1 27 PRO CG C -1.792 8.245 -1.908 1.00 . A A . 27 PRO CG 1 1 8 3697 1 1 27 PRO HA H -4.667 7.259 -0.708 1.00 . A A . 27 PRO HA 1 1 8 3698 1 1 27 PRO HB2 H -3.669 8.484 -2.902 1.00 . A A . 27 PRO HB2 1 1 8 3699 1 1 27 PRO HB3 H -3.596 9.208 -1.291 1.00 . A A . 27 PRO HB3 1 1 8 3700 1 1 27 PRO HD2 H -0.610 6.759 -0.927 1.00 . A A . 27 PRO HD2 1 1 8 3701 1 1 27 PRO HD3 H -1.191 8.057 0.134 1.00 . A A . 27 PRO HD3 1 1 8 3702 1 1 27 PRO HG2 H -1.472 7.746 -2.811 1.00 . A A . 27 PRO HG2 1 1 8 3703 1 1 27 PRO HG3 H -1.338 9.221 -1.838 1.00 . A A . 27 PRO HG3 1 1 8 3704 1 1 27 PRO N N -2.664 6.646 -0.428 1.00 . A A . 27 PRO N 1 1 8 3705 1 1 27 PRO O O -4.074 6.362 -3.574 1.00 . A A . 27 PRO O 1 1 8 3706 1 1 28 PHE C C -3.615 3.312 -3.694 1.00 . A A . 28 PHE C 1 1 8 3707 1 1 28 PHE CA C -4.814 3.731 -2.842 1.00 . A A . 28 PHE CA 1 1 8 3708 1 1 28 PHE CB C -6.043 4.063 -3.727 1.00 . A A . 28 PHE CB 1 1 8 3709 1 1 28 PHE CD1 C -7.511 4.997 -1.905 1.00 . A A . 28 PHE CD1 1 1 8 3710 1 1 28 PHE CD2 C -8.402 3.306 -3.329 1.00 . A A . 28 PHE CD2 1 1 8 3711 1 1 28 PHE CE1 C -8.707 5.053 -1.216 1.00 . A A . 28 PHE CE1 1 1 8 3712 1 1 28 PHE CE2 C -9.602 3.357 -2.644 1.00 . A A . 28 PHE CE2 1 1 8 3713 1 1 28 PHE CG C -7.344 4.123 -2.969 1.00 . A A . 28 PHE CG 1 1 8 3714 1 1 28 PHE CZ C -9.754 4.231 -1.586 1.00 . A A . 28 PHE CZ 1 1 8 3715 1 1 28 PHE H H -4.461 4.687 -0.982 1.00 . A A . 28 PHE H 1 1 8 3716 1 1 28 PHE HA H -5.072 2.895 -2.206 1.00 . A A . 28 PHE HA 1 1 8 3717 1 1 28 PHE HB2 H -5.903 5.023 -4.206 1.00 . A A . 28 PHE HB2 1 1 8 3718 1 1 28 PHE HB3 H -6.146 3.301 -4.490 1.00 . A A . 28 PHE HB3 1 1 8 3719 1 1 28 PHE HD1 H -6.693 5.640 -1.615 1.00 . A A . 28 PHE HD1 1 1 8 3720 1 1 28 PHE HD2 H -8.286 2.621 -4.156 1.00 . A A . 28 PHE HD2 1 1 8 3721 1 1 28 PHE HE1 H -8.823 5.737 -0.388 1.00 . A A . 28 PHE HE1 1 1 8 3722 1 1 28 PHE HE2 H -10.419 2.715 -2.935 1.00 . A A . 28 PHE HE2 1 1 8 3723 1 1 28 PHE HZ H -10.689 4.272 -1.049 1.00 . A A . 28 PHE HZ 1 1 8 3724 1 1 28 PHE N N -4.459 4.843 -1.952 1.00 . A A . 28 PHE N 1 1 8 3725 1 1 28 PHE O O -3.751 2.549 -4.648 1.00 . A A . 28 PHE O 1 1 8 3726 1 1 29 VAL C C -0.090 3.508 -2.911 1.00 . A A . 29 VAL C 1 1 8 3727 1 1 29 VAL CA C -1.180 3.452 -3.964 1.00 . A A . 29 VAL CA 1 1 8 3728 1 1 29 VAL CB C -0.811 4.423 -5.122 1.00 . A A . 29 VAL CB 1 1 8 3729 1 1 29 VAL CG1 C -1.761 4.268 -6.300 1.00 . A A . 29 VAL CG1 1 1 8 3730 1 1 29 VAL CG2 C -0.793 5.866 -4.638 1.00 . A A . 29 VAL CG2 1 1 8 3731 1 1 29 VAL H H -2.391 4.348 -2.495 1.00 . A A . 29 VAL H 1 1 8 3732 1 1 29 VAL HA H -1.257 2.443 -4.360 1.00 . A A . 29 VAL HA 1 1 8 3733 1 1 29 VAL HB H 0.189 4.174 -5.470 1.00 . A A . 29 VAL HB 1 1 8 3734 1 1 29 VAL HG11 H -2.544 5.010 -6.231 1.00 . A A . 29 VAL HG11 1 1 8 3735 1 1 29 VAL HG12 H -2.199 3.281 -6.283 1.00 . A A . 29 VAL HG12 1 1 8 3736 1 1 29 VAL HG13 H -1.218 4.404 -7.224 1.00 . A A . 29 VAL HG13 1 1 8 3737 1 1 29 VAL HG21 H -0.736 5.881 -3.559 1.00 . A A . 29 VAL HG21 1 1 8 3738 1 1 29 VAL HG22 H -1.695 6.365 -4.958 1.00 . A A . 29 VAL HG22 1 1 8 3739 1 1 29 VAL HG23 H 0.065 6.374 -5.051 1.00 . A A . 29 VAL HG23 1 1 8 3740 1 1 29 VAL N N -2.434 3.780 -3.299 1.00 . A A . 29 VAL N 1 1 8 3741 1 1 29 VAL O O -0.306 4.076 -1.838 1.00 . A A . 29 VAL O 1 1 8 3742 1 1 30 CYS C C 3.001 4.205 -2.444 1.00 . A A . 30 CYS C 1 1 8 3743 1 1 30 CYS CA C 2.148 2.955 -2.241 1.00 . A A . 30 CYS CA 1 1 8 3744 1 1 30 CYS CB C 2.991 1.688 -2.393 1.00 . A A . 30 CYS CB 1 1 8 3745 1 1 30 CYS H H 1.184 2.506 -4.067 1.00 . A A . 30 CYS H 1 1 8 3746 1 1 30 CYS HA H 1.726 2.982 -1.251 1.00 . A A . 30 CYS HA 1 1 8 3747 1 1 30 CYS HB2 H 2.345 0.853 -2.617 1.00 . A A . 30 CYS HB2 1 1 8 3748 1 1 30 CYS HB3 H 3.680 1.827 -3.214 1.00 . A A . 30 CYS HB3 1 1 8 3749 1 1 30 CYS N N 1.056 2.941 -3.194 1.00 . A A . 30 CYS N 1 1 8 3750 1 1 30 CYS O O 3.091 4.737 -3.553 1.00 . A A . 30 CYS O 1 1 8 3751 1 1 30 CYS SG S 3.970 1.272 -0.922 1.00 . A A . 30 CYS SG 1 1 8 3752 1 1 31 VAL C C 5.716 5.682 -0.653 1.00 . A A . 31 VAL C 1 1 8 3753 1 1 31 VAL CA C 4.453 5.871 -1.476 1.00 . A A . 31 VAL CA 1 1 8 3754 1 1 31 VAL CB C 3.719 7.149 -0.998 1.00 . A A . 31 VAL CB 1 1 8 3755 1 1 31 VAL CG1 C 2.559 7.494 -1.921 1.00 . A A . 31 VAL CG1 1 1 8 3756 1 1 31 VAL CG2 C 3.229 6.989 0.435 1.00 . A A . 31 VAL CG2 1 1 8 3757 1 1 31 VAL H H 3.518 4.238 -0.513 1.00 . A A . 31 VAL H 1 1 8 3758 1 1 31 VAL HA H 4.729 6.000 -2.520 1.00 . A A . 31 VAL HA 1 1 8 3759 1 1 31 VAL HB H 4.421 7.969 -1.022 1.00 . A A . 31 VAL HB 1 1 8 3760 1 1 31 VAL HG11 H 2.685 8.499 -2.298 1.00 . A A . 31 VAL HG11 1 1 8 3761 1 1 31 VAL HG12 H 1.631 7.429 -1.373 1.00 . A A . 31 VAL HG12 1 1 8 3762 1 1 31 VAL HG13 H 2.538 6.800 -2.748 1.00 . A A . 31 VAL HG13 1 1 8 3763 1 1 31 VAL HG21 H 3.295 5.951 0.724 1.00 . A A . 31 VAL HG21 1 1 8 3764 1 1 31 VAL HG22 H 2.202 7.316 0.502 1.00 . A A . 31 VAL HG22 1 1 8 3765 1 1 31 VAL HG23 H 3.842 7.587 1.094 1.00 . A A . 31 VAL HG23 1 1 8 3766 1 1 31 VAL N N 3.619 4.687 -1.385 1.00 . A A . 31 VAL N 1 1 8 3767 1 1 31 VAL O O 5.731 4.767 0.192 1.00 . A A . 31 VAL O 1 1 8 3768 1 1 31 VAL OXT O 6.687 6.437 -0.880 1.00 . A A . 31 VAL OXT 1 1 9 3769 1 1 1 ALA C C 4.143 -8.519 -0.597 1.00 . A A . 1 ALA C 1 1 9 3770 1 1 1 ALA CA C 4.232 -10.030 -0.748 1.00 . A A . 1 ALA CA 1 1 9 3771 1 1 1 ALA CB C 3.213 -10.522 -1.764 1.00 . A A . 1 ALA CB 1 1 9 3772 1 1 1 ALA H1 H 4.645 -11.515 0.654 1.00 . A A . 1 ALA H1 1 1 9 3773 1 1 1 ALA H2 H 3.033 -11.010 0.643 1.00 . A A . 1 ALA H2 1 1 9 3774 1 1 1 ALA H3 H 4.221 -10.026 1.338 1.00 . A A . 1 ALA H3 1 1 9 3775 1 1 1 ALA HA H 5.218 -10.288 -1.107 1.00 . A A . 1 ALA HA 1 1 9 3776 1 1 1 ALA HB1 H 3.114 -11.594 -1.686 1.00 . A A . 1 ALA HB1 1 1 9 3777 1 1 1 ALA HB2 H 3.541 -10.261 -2.759 1.00 . A A . 1 ALA HB2 1 1 9 3778 1 1 1 ALA HB3 H 2.257 -10.057 -1.569 1.00 . A A . 1 ALA HB3 1 1 9 3779 1 1 1 ALA N N 4.018 -10.694 0.560 1.00 . A A . 1 ALA N 1 1 9 3780 1 1 1 ALA O O 3.293 -8.018 0.135 1.00 . A A . 1 ALA O 1 1 9 3781 1 1 2 CYS C C 4.775 -5.764 -2.607 1.00 . A A . 2 CYS C 1 1 9 3782 1 1 2 CYS CA C 5.044 -6.350 -1.227 1.00 . A A . 2 CYS CA 1 1 9 3783 1 1 2 CYS CB C 6.389 -5.868 -0.689 1.00 . A A . 2 CYS CB 1 1 9 3784 1 1 2 CYS H H 5.676 -8.262 -1.851 1.00 . A A . 2 CYS H 1 1 9 3785 1 1 2 CYS HA H 4.263 -6.016 -0.550 1.00 . A A . 2 CYS HA 1 1 9 3786 1 1 2 CYS HB2 H 6.377 -4.790 -0.641 1.00 . A A . 2 CYS HB2 1 1 9 3787 1 1 2 CYS HB3 H 6.532 -6.258 0.310 1.00 . A A . 2 CYS HB3 1 1 9 3788 1 1 2 CYS N N 5.021 -7.803 -1.284 1.00 . A A . 2 CYS N 1 1 9 3789 1 1 2 CYS O O 5.394 -6.161 -3.594 1.00 . A A . 2 CYS O 1 1 9 3790 1 1 2 CYS SG S 7.839 -6.346 -1.679 1.00 . A A . 2 CYS SG 1 1 9 3791 1 1 3 SER C C 4.413 -3.053 -4.253 1.00 . A A . 3 SER C 1 1 9 3792 1 1 3 SER CA C 3.468 -4.207 -3.929 1.00 . A A . 3 SER CA 1 1 9 3793 1 1 3 SER CB C 2.028 -3.698 -3.849 1.00 . A A . 3 SER CB 1 1 9 3794 1 1 3 SER H H 3.363 -4.578 -1.855 1.00 . A A . 3 SER H 1 1 9 3795 1 1 3 SER HA H 3.537 -4.949 -4.710 1.00 . A A . 3 SER HA 1 1 9 3796 1 1 3 SER HB2 H 1.978 -2.874 -3.153 1.00 . A A . 3 SER HB2 1 1 9 3797 1 1 3 SER HB3 H 1.711 -3.364 -4.827 1.00 . A A . 3 SER HB3 1 1 9 3798 1 1 3 SER HG H 0.515 -4.916 -4.102 1.00 . A A . 3 SER HG 1 1 9 3799 1 1 3 SER N N 3.834 -4.839 -2.673 1.00 . A A . 3 SER N 1 1 9 3800 1 1 3 SER O O 4.947 -2.408 -3.346 1.00 . A A . 3 SER O 1 1 9 3801 1 1 3 SER OG O 1.152 -4.722 -3.409 1.00 . A A . 3 SER OG 1 1 9 3802 1 1 4 LYS C C 4.837 -0.360 -5.544 1.00 . A A . 4 LYS C 1 1 9 3803 1 1 4 LYS CA C 5.457 -1.686 -5.982 1.00 . A A . 4 LYS CA 1 1 9 3804 1 1 4 LYS CB C 5.655 -1.704 -7.503 1.00 . A A . 4 LYS CB 1 1 9 3805 1 1 4 LYS CD C 6.296 -3.023 -9.543 1.00 . A A . 4 LYS CD 1 1 9 3806 1 1 4 LYS CE C 4.944 -3.589 -9.955 1.00 . A A . 4 LYS CE 1 1 9 3807 1 1 4 LYS CG C 6.414 -2.915 -8.027 1.00 . A A . 4 LYS CG 1 1 9 3808 1 1 4 LYS H H 4.134 -3.322 -6.215 1.00 . A A . 4 LYS H 1 1 9 3809 1 1 4 LYS HA H 6.415 -1.800 -5.496 1.00 . A A . 4 LYS HA 1 1 9 3810 1 1 4 LYS HB2 H 4.686 -1.687 -7.977 1.00 . A A . 4 LYS HB2 1 1 9 3811 1 1 4 LYS HB3 H 6.198 -0.816 -7.790 1.00 . A A . 4 LYS HB3 1 1 9 3812 1 1 4 LYS HD2 H 6.410 -2.040 -9.974 1.00 . A A . 4 LYS HD2 1 1 9 3813 1 1 4 LYS HD3 H 7.076 -3.673 -9.910 1.00 . A A . 4 LYS HD3 1 1 9 3814 1 1 4 LYS HE2 H 5.024 -4.664 -10.019 1.00 . A A . 4 LYS HE2 1 1 9 3815 1 1 4 LYS HE3 H 4.216 -3.330 -9.200 1.00 . A A . 4 LYS HE3 1 1 9 3816 1 1 4 LYS HG2 H 7.457 -2.819 -7.762 1.00 . A A . 4 LYS HG2 1 1 9 3817 1 1 4 LYS HG3 H 6.006 -3.808 -7.577 1.00 . A A . 4 LYS HG3 1 1 9 3818 1 1 4 LYS HZ1 H 3.756 -2.315 -11.120 1.00 . A A . 4 LYS HZ1 1 1 9 3819 1 1 4 LYS HZ2 H 4.061 -3.824 -11.835 1.00 . A A . 4 LYS HZ2 1 1 9 3820 1 1 4 LYS HZ3 H 5.277 -2.653 -11.796 1.00 . A A . 4 LYS HZ3 1 1 9 3821 1 1 4 LYS N N 4.601 -2.785 -5.546 1.00 . A A . 4 LYS N 1 1 9 3822 1 1 4 LYS NZ N 4.483 -3.062 -11.270 1.00 . A A . 4 LYS NZ 1 1 9 3823 1 1 4 LYS O O 3.636 -0.289 -5.276 1.00 . A A . 4 LYS O 1 1 9 3824 1 1 5 LYS C C 3.954 2.482 -5.707 1.00 . A A . 5 LYS C 1 1 9 3825 1 1 5 LYS CA C 5.197 1.977 -4.982 1.00 . A A . 5 LYS CA 1 1 9 3826 1 1 5 LYS CB C 6.322 3.014 -5.097 1.00 . A A . 5 LYS CB 1 1 9 3827 1 1 5 LYS CD C 6.936 5.381 -4.474 1.00 . A A . 5 LYS CD 1 1 9 3828 1 1 5 LYS CE C 6.450 6.822 -4.455 1.00 . A A . 5 LYS CE 1 1 9 3829 1 1 5 LYS CG C 5.838 4.447 -4.938 1.00 . A A . 5 LYS CG 1 1 9 3830 1 1 5 LYS H H 6.607 0.542 -5.634 1.00 . A A . 5 LYS H 1 1 9 3831 1 1 5 LYS HA H 4.943 1.872 -3.945 1.00 . A A . 5 LYS HA 1 1 9 3832 1 1 5 LYS HB2 H 7.059 2.816 -4.331 1.00 . A A . 5 LYS HB2 1 1 9 3833 1 1 5 LYS HB3 H 6.788 2.918 -6.067 1.00 . A A . 5 LYS HB3 1 1 9 3834 1 1 5 LYS HD2 H 7.241 5.099 -3.478 1.00 . A A . 5 LYS HD2 1 1 9 3835 1 1 5 LYS HD3 H 7.774 5.300 -5.150 1.00 . A A . 5 LYS HD3 1 1 9 3836 1 1 5 LYS HE2 H 6.593 7.249 -5.438 1.00 . A A . 5 LYS HE2 1 1 9 3837 1 1 5 LYS HE3 H 5.397 6.833 -4.210 1.00 . A A . 5 LYS HE3 1 1 9 3838 1 1 5 LYS HG2 H 5.464 4.800 -5.882 1.00 . A A . 5 LYS HG2 1 1 9 3839 1 1 5 LYS HG3 H 5.038 4.461 -4.220 1.00 . A A . 5 LYS HG3 1 1 9 3840 1 1 5 LYS HZ1 H 8.188 7.736 -3.744 1.00 . A A . 5 LYS HZ1 1 1 9 3841 1 1 5 LYS HZ2 H 7.163 7.171 -2.517 1.00 . A A . 5 LYS HZ2 1 1 9 3842 1 1 5 LYS HZ3 H 6.770 8.581 -3.376 1.00 . A A . 5 LYS HZ3 1 1 9 3843 1 1 5 LYS N N 5.659 0.669 -5.437 1.00 . A A . 5 LYS N 1 1 9 3844 1 1 5 LYS NZ N 7.196 7.638 -3.459 1.00 . A A . 5 LYS NZ 1 1 9 3845 1 1 5 LYS O O 2.932 2.724 -5.095 1.00 . A A . 5 LYS O 1 1 9 3846 1 1 6 TRP C C 1.866 2.122 -8.040 1.00 . A A . 6 TRP C 1 1 9 3847 1 1 6 TRP CA C 2.897 3.199 -7.721 1.00 . A A . 6 TRP CA 1 1 9 3848 1 1 6 TRP CB C 3.388 3.916 -8.976 1.00 . A A . 6 TRP CB 1 1 9 3849 1 1 6 TRP CD1 C 5.878 4.455 -8.643 1.00 . A A . 6 TRP CD1 1 1 9 3850 1 1 6 TRP CD2 C 4.530 6.229 -8.434 1.00 . A A . 6 TRP CD2 1 1 9 3851 1 1 6 TRP CE2 C 5.863 6.651 -8.252 1.00 . A A . 6 TRP CE2 1 1 9 3852 1 1 6 TRP CE3 C 3.511 7.176 -8.340 1.00 . A A . 6 TRP CE3 1 1 9 3853 1 1 6 TRP CG C 4.563 4.821 -8.710 1.00 . A A . 6 TRP CG 1 1 9 3854 1 1 6 TRP CH2 C 5.174 8.881 -7.894 1.00 . A A . 6 TRP CH2 1 1 9 3855 1 1 6 TRP CZ2 C 6.195 7.976 -7.981 1.00 . A A . 6 TRP CZ2 1 1 9 3856 1 1 6 TRP CZ3 C 3.841 8.491 -8.067 1.00 . A A . 6 TRP CZ3 1 1 9 3857 1 1 6 TRP H H 4.862 2.479 -7.454 1.00 . A A . 6 TRP H 1 1 9 3858 1 1 6 TRP HA H 2.418 3.930 -7.076 1.00 . A A . 6 TRP HA 1 1 9 3859 1 1 6 TRP HB2 H 3.687 3.182 -9.710 1.00 . A A . 6 TRP HB2 1 1 9 3860 1 1 6 TRP HB3 H 2.586 4.517 -9.379 1.00 . A A . 6 TRP HB3 1 1 9 3861 1 1 6 TRP HD1 H 6.233 3.449 -8.783 1.00 . A A . 6 TRP HD1 1 1 9 3862 1 1 6 TRP HE1 H 7.643 5.545 -8.313 1.00 . A A . 6 TRP HE1 1 1 9 3863 1 1 6 TRP HE3 H 2.480 6.895 -8.461 1.00 . A A . 6 TRP HE3 1 1 9 3864 1 1 6 TRP HH2 H 5.385 9.918 -7.682 1.00 . A A . 6 TRP HH2 1 1 9 3865 1 1 6 TRP HZ2 H 7.218 8.292 -7.846 1.00 . A A . 6 TRP HZ2 1 1 9 3866 1 1 6 TRP HZ3 H 3.062 9.235 -7.989 1.00 . A A . 6 TRP HZ3 1 1 9 3867 1 1 6 TRP N N 4.034 2.670 -6.990 1.00 . A A . 6 TRP N 1 1 9 3868 1 1 6 TRP NE1 N 6.665 5.551 -8.386 1.00 . A A . 6 TRP NE1 1 1 9 3869 1 1 6 TRP O O 1.084 2.260 -8.977 1.00 . A A . 6 TRP O 1 1 9 3870 1 1 7 GLU C C -0.323 0.218 -6.486 1.00 . A A . 7 GLU C 1 1 9 3871 1 1 7 GLU CA C 0.857 0.006 -7.417 1.00 . A A . 7 GLU CA 1 1 9 3872 1 1 7 GLU CB C 1.449 -1.375 -7.147 1.00 . A A . 7 GLU CB 1 1 9 3873 1 1 7 GLU CD C 2.104 -1.930 -9.530 1.00 . A A . 7 GLU CD 1 1 9 3874 1 1 7 GLU CG C 2.557 -1.772 -8.095 1.00 . A A . 7 GLU CG 1 1 9 3875 1 1 7 GLU H H 2.475 1.027 -6.461 1.00 . A A . 7 GLU H 1 1 9 3876 1 1 7 GLU HA H 0.510 0.050 -8.438 1.00 . A A . 7 GLU HA 1 1 9 3877 1 1 7 GLU HB2 H 1.846 -1.391 -6.142 1.00 . A A . 7 GLU HB2 1 1 9 3878 1 1 7 GLU HB3 H 0.660 -2.109 -7.221 1.00 . A A . 7 GLU HB3 1 1 9 3879 1 1 7 GLU HG2 H 3.325 -1.013 -8.064 1.00 . A A . 7 GLU HG2 1 1 9 3880 1 1 7 GLU HG3 H 2.973 -2.711 -7.762 1.00 . A A . 7 GLU HG3 1 1 9 3881 1 1 7 GLU N N 1.838 1.070 -7.228 1.00 . A A . 7 GLU N 1 1 9 3882 1 1 7 GLU O O -0.156 0.683 -5.356 1.00 . A A . 7 GLU O 1 1 9 3883 1 1 7 GLU OE1 O 1.168 -2.708 -9.775 1.00 . A A . 7 GLU OE1 1 1 9 3884 1 1 7 GLU OE2 O 2.740 -1.325 -10.419 1.00 . A A . 7 GLU OE2 1 1 9 3885 1 1 8 TYR C C -2.713 -1.068 -5.054 1.00 . A A . 8 TYR C 1 1 9 3886 1 1 8 TYR CA C -2.710 -0.007 -6.145 1.00 . A A . 8 TYR CA 1 1 9 3887 1 1 8 TYR CB C -3.972 -0.128 -7.007 1.00 . A A . 8 TYR CB 1 1 9 3888 1 1 8 TYR CD1 C -3.327 1.621 -8.720 1.00 . A A . 8 TYR CD1 1 1 9 3889 1 1 8 TYR CD2 C -5.500 1.742 -7.748 1.00 . A A . 8 TYR CD2 1 1 9 3890 1 1 8 TYR CE1 C -3.599 2.743 -9.477 1.00 . A A . 8 TYR CE1 1 1 9 3891 1 1 8 TYR CE2 C -5.779 2.865 -8.504 1.00 . A A . 8 TYR CE2 1 1 9 3892 1 1 8 TYR CG C -4.271 1.100 -7.842 1.00 . A A . 8 TYR CG 1 1 9 3893 1 1 8 TYR CZ C -4.825 3.362 -9.365 1.00 . A A . 8 TYR CZ 1 1 9 3894 1 1 8 TYR H H -1.574 -0.517 -7.855 1.00 . A A . 8 TYR H 1 1 9 3895 1 1 8 TYR HA H -2.690 0.969 -5.681 1.00 . A A . 8 TYR HA 1 1 9 3896 1 1 8 TYR HB2 H -3.859 -0.963 -7.681 1.00 . A A . 8 TYR HB2 1 1 9 3897 1 1 8 TYR HB3 H -4.822 -0.305 -6.363 1.00 . A A . 8 TYR HB3 1 1 9 3898 1 1 8 TYR HD1 H -2.367 1.134 -8.807 1.00 . A A . 8 TYR HD1 1 1 9 3899 1 1 8 TYR HD2 H -6.246 1.352 -7.071 1.00 . A A . 8 TYR HD2 1 1 9 3900 1 1 8 TYR HE1 H -2.851 3.132 -10.153 1.00 . A A . 8 TYR HE1 1 1 9 3901 1 1 8 TYR HE2 H -6.741 3.350 -8.415 1.00 . A A . 8 TYR HE2 1 1 9 3902 1 1 8 TYR HH H -4.823 5.265 -9.634 1.00 . A A . 8 TYR HH 1 1 9 3903 1 1 8 TYR N N -1.508 -0.139 -6.953 1.00 . A A . 8 TYR N 1 1 9 3904 1 1 8 TYR O O -3.131 -2.205 -5.276 1.00 . A A . 8 TYR O 1 1 9 3905 1 1 8 TYR OH O -5.098 4.481 -10.117 1.00 . A A . 8 TYR OH 1 1 9 3906 1 1 9 CYS C C -3.502 -1.827 -2.084 1.00 . A A . 9 CYS C 1 1 9 3907 1 1 9 CYS CA C -2.139 -1.602 -2.742 1.00 . A A . 9 CYS CA 1 1 9 3908 1 1 9 CYS CB C -1.134 -1.058 -1.723 1.00 . A A . 9 CYS CB 1 1 9 3909 1 1 9 CYS H H -1.890 0.224 -3.779 1.00 . A A . 9 CYS H 1 1 9 3910 1 1 9 CYS HA H -1.777 -2.551 -3.107 1.00 . A A . 9 CYS HA 1 1 9 3911 1 1 9 CYS HB2 H -1.309 -1.530 -0.767 1.00 . A A . 9 CYS HB2 1 1 9 3912 1 1 9 CYS HB3 H -0.133 -1.290 -2.057 1.00 . A A . 9 CYS HB3 1 1 9 3913 1 1 9 CYS N N -2.223 -0.694 -3.881 1.00 . A A . 9 CYS N 1 1 9 3914 1 1 9 CYS O O -3.638 -1.739 -0.863 1.00 . A A . 9 CYS O 1 1 9 3915 1 1 9 CYS SG S -1.232 0.747 -1.473 1.00 . A A . 9 CYS SG 1 1 9 3916 1 1 10 ILE C C -5.884 -3.732 -1.664 1.00 . A A . 10 ILE C 1 1 9 3917 1 1 10 ILE CA C -5.841 -2.394 -2.395 1.00 . A A . 10 ILE CA 1 1 9 3918 1 1 10 ILE CB C -6.890 -2.378 -3.529 1.00 . A A . 10 ILE CB 1 1 9 3919 1 1 10 ILE CD1 C -7.500 -3.424 -5.778 1.00 . A A . 10 ILE CD1 1 1 9 3920 1 1 10 ILE CG1 C -6.472 -3.312 -4.673 1.00 . A A . 10 ILE CG1 1 1 9 3921 1 1 10 ILE CG2 C -7.087 -0.957 -4.039 1.00 . A A . 10 ILE CG2 1 1 9 3922 1 1 10 ILE H H -4.327 -2.211 -3.861 1.00 . A A . 10 ILE H 1 1 9 3923 1 1 10 ILE HA H -6.087 -1.608 -1.694 1.00 . A A . 10 ILE HA 1 1 9 3924 1 1 10 ILE HB H -7.830 -2.719 -3.122 1.00 . A A . 10 ILE HB 1 1 9 3925 1 1 10 ILE HD11 H -8.380 -2.857 -5.509 1.00 . A A . 10 ILE HD11 1 1 9 3926 1 1 10 ILE HD12 H -7.769 -4.461 -5.917 1.00 . A A . 10 ILE HD12 1 1 9 3927 1 1 10 ILE HD13 H -7.087 -3.033 -6.696 1.00 . A A . 10 ILE HD13 1 1 9 3928 1 1 10 ILE HG12 H -5.556 -2.945 -5.110 1.00 . A A . 10 ILE HG12 1 1 9 3929 1 1 10 ILE HG13 H -6.303 -4.302 -4.275 1.00 . A A . 10 ILE HG13 1 1 9 3930 1 1 10 ILE HG21 H -7.919 -0.502 -3.524 1.00 . A A . 10 ILE HG21 1 1 9 3931 1 1 10 ILE HG22 H -7.289 -0.980 -5.101 1.00 . A A . 10 ILE HG22 1 1 9 3932 1 1 10 ILE HG23 H -6.192 -0.382 -3.856 1.00 . A A . 10 ILE HG23 1 1 9 3933 1 1 10 ILE N N -4.501 -2.137 -2.897 1.00 . A A . 10 ILE N 1 1 9 3934 1 1 10 ILE O O -5.452 -4.758 -2.193 1.00 . A A . 10 ILE O 1 1 9 3935 1 1 11 VAL C C -7.610 -5.822 -0.094 1.00 . A A . 11 VAL C 1 1 9 3936 1 1 11 VAL CA C -6.466 -4.920 0.366 1.00 . A A . 11 VAL CA 1 1 9 3937 1 1 11 VAL CB C -6.625 -4.595 1.869 1.00 . A A . 11 VAL CB 1 1 9 3938 1 1 11 VAL CG1 C -5.362 -3.942 2.407 1.00 . A A . 11 VAL CG1 1 1 9 3939 1 1 11 VAL CG2 C -7.831 -3.697 2.115 1.00 . A A . 11 VAL CG2 1 1 9 3940 1 1 11 VAL H H -6.699 -2.866 -0.065 1.00 . A A . 11 VAL H 1 1 9 3941 1 1 11 VAL HA H -5.536 -5.456 0.238 1.00 . A A . 11 VAL HA 1 1 9 3942 1 1 11 VAL HB H -6.778 -5.522 2.402 1.00 . A A . 11 VAL HB 1 1 9 3943 1 1 11 VAL HG11 H -5.547 -3.563 3.401 1.00 . A A . 11 VAL HG11 1 1 9 3944 1 1 11 VAL HG12 H -5.073 -3.127 1.759 1.00 . A A . 11 VAL HG12 1 1 9 3945 1 1 11 VAL HG13 H -4.566 -4.671 2.442 1.00 . A A . 11 VAL HG13 1 1 9 3946 1 1 11 VAL HG21 H -7.511 -2.790 2.605 1.00 . A A . 11 VAL HG21 1 1 9 3947 1 1 11 VAL HG22 H -8.543 -4.214 2.743 1.00 . A A . 11 VAL HG22 1 1 9 3948 1 1 11 VAL HG23 H -8.295 -3.452 1.171 1.00 . A A . 11 VAL HG23 1 1 9 3949 1 1 11 VAL N N -6.385 -3.713 -0.440 1.00 . A A . 11 VAL N 1 1 9 3950 1 1 11 VAL O O -8.743 -5.372 -0.273 1.00 . A A . 11 VAL O 1 1 9 3951 1 1 12 PRO C C -9.330 -8.374 0.378 1.00 . A A . 12 PRO C 1 1 9 3952 1 1 12 PRO CA C -8.320 -8.090 -0.725 1.00 . A A . 12 PRO CA 1 1 9 3953 1 1 12 PRO CB C -7.502 -9.353 -1.039 1.00 . A A . 12 PRO CB 1 1 9 3954 1 1 12 PRO CD C -6.007 -7.734 -0.114 1.00 . A A . 12 PRO CD 1 1 9 3955 1 1 12 PRO CG C -6.074 -8.920 -1.028 1.00 . A A . 12 PRO CG 1 1 9 3956 1 1 12 PRO HA H -8.839 -7.760 -1.614 1.00 . A A . 12 PRO HA 1 1 9 3957 1 1 12 PRO HB2 H -7.690 -10.100 -0.283 1.00 . A A . 12 PRO HB2 1 1 9 3958 1 1 12 PRO HB3 H -7.788 -9.736 -2.007 1.00 . A A . 12 PRO HB3 1 1 9 3959 1 1 12 PRO HD2 H -5.863 -8.050 0.909 1.00 . A A . 12 PRO HD2 1 1 9 3960 1 1 12 PRO HD3 H -5.219 -7.061 -0.419 1.00 . A A . 12 PRO HD3 1 1 9 3961 1 1 12 PRO HG2 H -5.451 -9.717 -0.653 1.00 . A A . 12 PRO HG2 1 1 9 3962 1 1 12 PRO HG3 H -5.768 -8.641 -2.026 1.00 . A A . 12 PRO HG3 1 1 9 3963 1 1 12 PRO N N -7.323 -7.115 -0.293 1.00 . A A . 12 PRO N 1 1 9 3964 1 1 12 PRO O O -8.979 -8.398 1.555 1.00 . A A . 12 PRO O 1 1 9 3965 1 1 13 ILE C C -11.302 -10.040 1.864 1.00 . A A . 13 ILE C 1 1 9 3966 1 1 13 ILE CA C -11.654 -8.862 0.945 1.00 . A A . 13 ILE CA 1 1 9 3967 1 1 13 ILE CB C -12.994 -9.139 0.213 1.00 . A A . 13 ILE CB 1 1 9 3968 1 1 13 ILE CD1 C -14.453 -8.119 2.040 1.00 . A A . 13 ILE CD1 1 1 9 3969 1 1 13 ILE CG1 C -14.136 -9.347 1.214 1.00 . A A . 13 ILE CG1 1 1 9 3970 1 1 13 ILE CG2 C -12.873 -10.341 -0.714 1.00 . A A . 13 ILE CG2 1 1 9 3971 1 1 13 ILE H H -10.795 -8.546 -0.963 1.00 . A A . 13 ILE H 1 1 9 3972 1 1 13 ILE HA H -11.783 -7.980 1.556 1.00 . A A . 13 ILE HA 1 1 9 3973 1 1 13 ILE HB H -13.222 -8.277 -0.398 1.00 . A A . 13 ILE HB 1 1 9 3974 1 1 13 ILE HD11 H -14.526 -8.395 3.082 1.00 . A A . 13 ILE HD11 1 1 9 3975 1 1 13 ILE HD12 H -15.392 -7.697 1.713 1.00 . A A . 13 ILE HD12 1 1 9 3976 1 1 13 ILE HD13 H -13.668 -7.389 1.915 1.00 . A A . 13 ILE HD13 1 1 9 3977 1 1 13 ILE HG12 H -15.031 -9.624 0.676 1.00 . A A . 13 ILE HG12 1 1 9 3978 1 1 13 ILE HG13 H -13.869 -10.144 1.892 1.00 . A A . 13 ILE HG13 1 1 9 3979 1 1 13 ILE HG21 H -12.488 -10.021 -1.672 1.00 . A A . 13 ILE HG21 1 1 9 3980 1 1 13 ILE HG22 H -13.846 -10.791 -0.850 1.00 . A A . 13 ILE HG22 1 1 9 3981 1 1 13 ILE HG23 H -12.200 -11.064 -0.279 1.00 . A A . 13 ILE HG23 1 1 9 3982 1 1 13 ILE N N -10.582 -8.585 -0.010 1.00 . A A . 13 ILE N 1 1 9 3983 1 1 13 ILE O O -11.729 -10.092 3.014 1.00 . A A . 13 ILE O 1 1 9 3984 1 1 14 LEU C C -8.662 -12.048 2.577 1.00 . A A . 14 LEU C 1 1 9 3985 1 1 14 LEU CA C -10.122 -12.143 2.130 1.00 . A A . 14 LEU CA 1 1 9 3986 1 1 14 LEU CB C -10.335 -13.422 1.317 1.00 . A A . 14 LEU CB 1 1 9 3987 1 1 14 LEU CD1 C -11.857 -14.948 0.037 1.00 . A A . 14 LEU CD1 1 1 9 3988 1 1 14 LEU CD2 C -12.676 -13.834 2.118 1.00 . A A . 14 LEU CD2 1 1 9 3989 1 1 14 LEU CG C -11.781 -13.696 0.895 1.00 . A A . 14 LEU CG 1 1 9 3990 1 1 14 LEU H H -10.203 -10.891 0.431 1.00 . A A . 14 LEU H 1 1 9 3991 1 1 14 LEU HA H -10.750 -12.180 3.008 1.00 . A A . 14 LEU HA 1 1 9 3992 1 1 14 LEU HB2 H -9.728 -13.360 0.425 1.00 . A A . 14 LEU HB2 1 1 9 3993 1 1 14 LEU HB3 H -9.991 -14.259 1.906 1.00 . A A . 14 LEU HB3 1 1 9 3994 1 1 14 LEU HD11 H -12.636 -15.595 0.412 1.00 . A A . 14 LEU HD11 1 1 9 3995 1 1 14 LEU HD12 H -10.910 -15.466 0.071 1.00 . A A . 14 LEU HD12 1 1 9 3996 1 1 14 LEU HD13 H -12.078 -14.672 -0.983 1.00 . A A . 14 LEU HD13 1 1 9 3997 1 1 14 LEU HD21 H -12.314 -13.189 2.905 1.00 . A A . 14 LEU HD21 1 1 9 3998 1 1 14 LEU HD22 H -12.665 -14.858 2.459 1.00 . A A . 14 LEU HD22 1 1 9 3999 1 1 14 LEU HD23 H -13.686 -13.551 1.859 1.00 . A A . 14 LEU HD23 1 1 9 4000 1 1 14 LEU HG H -12.141 -12.865 0.307 1.00 . A A . 14 LEU HG 1 1 9 4001 1 1 14 LEU N N -10.520 -10.981 1.350 1.00 . A A . 14 LEU N 1 1 9 4002 1 1 14 LEU O O -7.974 -13.062 2.675 1.00 . A A . 14 LEU O 1 1 9 4003 1 1 15 GLY C C -6.379 -9.231 3.368 1.00 . A A . 15 GLY C 1 1 9 4004 1 1 15 GLY CA C -6.816 -10.679 3.293 1.00 . A A . 15 GLY CA 1 1 9 4005 1 1 15 GLY H H -8.773 -10.046 2.765 1.00 . A A . 15 GLY H 1 1 9 4006 1 1 15 GLY HA2 H -6.710 -11.123 4.272 1.00 . A A . 15 GLY HA2 1 1 9 4007 1 1 15 GLY HA3 H -6.168 -11.202 2.603 1.00 . A A . 15 GLY HA3 1 1 9 4008 1 1 15 GLY N N -8.189 -10.837 2.853 1.00 . A A . 15 GLY N 1 1 9 4009 1 1 15 GLY O O -7.169 -8.354 3.710 1.00 . A A . 15 GLY O 1 1 9 4010 1 1 16 PHE C C -3.156 -7.667 2.437 1.00 . A A . 16 PHE C 1 1 9 4011 1 1 16 PHE CA C -4.544 -7.647 3.064 1.00 . A A . 16 PHE CA 1 1 9 4012 1 1 16 PHE CB C -4.485 -7.090 4.499 1.00 . A A . 16 PHE CB 1 1 9 4013 1 1 16 PHE CD1 C -2.325 -7.934 5.491 1.00 . A A . 16 PHE CD1 1 1 9 4014 1 1 16 PHE CD2 C -4.381 -8.730 6.401 1.00 . A A . 16 PHE CD2 1 1 9 4015 1 1 16 PHE CE1 C -1.622 -8.703 6.396 1.00 . A A . 16 PHE CE1 1 1 9 4016 1 1 16 PHE CE2 C -3.682 -9.500 7.310 1.00 . A A . 16 PHE CE2 1 1 9 4017 1 1 16 PHE CG C -3.713 -7.939 5.479 1.00 . A A . 16 PHE CG 1 1 9 4018 1 1 16 PHE CZ C -2.301 -9.488 7.308 1.00 . A A . 16 PHE CZ 1 1 9 4019 1 1 16 PHE H H -4.539 -9.737 2.780 1.00 . A A . 16 PHE H 1 1 9 4020 1 1 16 PHE HA H -5.182 -7.011 2.467 1.00 . A A . 16 PHE HA 1 1 9 4021 1 1 16 PHE HB2 H -4.020 -6.116 4.476 1.00 . A A . 16 PHE HB2 1 1 9 4022 1 1 16 PHE HB3 H -5.494 -6.987 4.874 1.00 . A A . 16 PHE HB3 1 1 9 4023 1 1 16 PHE HD1 H -1.793 -7.321 4.778 1.00 . A A . 16 PHE HD1 1 1 9 4024 1 1 16 PHE HD2 H -5.461 -8.744 6.402 1.00 . A A . 16 PHE HD2 1 1 9 4025 1 1 16 PHE HE1 H -0.542 -8.691 6.392 1.00 . A A . 16 PHE HE1 1 1 9 4026 1 1 16 PHE HE2 H -4.216 -10.111 8.024 1.00 . A A . 16 PHE HE2 1 1 9 4027 1 1 16 PHE HZ H -1.753 -10.089 8.018 1.00 . A A . 16 PHE HZ 1 1 9 4028 1 1 16 PHE N N -5.115 -8.988 3.043 1.00 . A A . 16 PHE N 1 1 9 4029 1 1 16 PHE O O -2.468 -8.688 2.477 1.00 . A A . 16 PHE O 1 1 9 4030 1 1 17 VAL C C -0.565 -5.489 2.033 1.00 . A A . 17 VAL C 1 1 9 4031 1 1 17 VAL CA C -1.436 -6.452 1.234 1.00 . A A . 17 VAL CA 1 1 9 4032 1 1 17 VAL CB C -1.509 -5.969 -0.235 1.00 . A A . 17 VAL CB 1 1 9 4033 1 1 17 VAL CG1 C -0.366 -6.553 -1.053 1.00 . A A . 17 VAL CG1 1 1 9 4034 1 1 17 VAL CG2 C -2.848 -6.314 -0.866 1.00 . A A . 17 VAL CG2 1 1 9 4035 1 1 17 VAL H H -3.336 -5.764 1.856 1.00 . A A . 17 VAL H 1 1 9 4036 1 1 17 VAL HA H -0.985 -7.435 1.253 1.00 . A A . 17 VAL HA 1 1 9 4037 1 1 17 VAL HB H -1.400 -4.895 -0.236 1.00 . A A . 17 VAL HB 1 1 9 4038 1 1 17 VAL HG11 H 0.153 -5.756 -1.567 1.00 . A A . 17 VAL HG11 1 1 9 4039 1 1 17 VAL HG12 H -0.760 -7.252 -1.775 1.00 . A A . 17 VAL HG12 1 1 9 4040 1 1 17 VAL HG13 H 0.323 -7.064 -0.396 1.00 . A A . 17 VAL HG13 1 1 9 4041 1 1 17 VAL HG21 H -2.961 -5.770 -1.792 1.00 . A A . 17 VAL HG21 1 1 9 4042 1 1 17 VAL HG22 H -3.646 -6.044 -0.190 1.00 . A A . 17 VAL HG22 1 1 9 4043 1 1 17 VAL HG23 H -2.889 -7.375 -1.066 1.00 . A A . 17 VAL HG23 1 1 9 4044 1 1 17 VAL N N -2.748 -6.547 1.857 1.00 . A A . 17 VAL N 1 1 9 4045 1 1 17 VAL O O -0.995 -4.967 3.062 1.00 . A A . 17 VAL O 1 1 9 4046 1 1 18 TYR C C 2.783 -4.098 1.310 1.00 . A A . 18 TYR C 1 1 9 4047 1 1 18 TYR CA C 1.581 -4.351 2.211 1.00 . A A . 18 TYR CA 1 1 9 4048 1 1 18 TYR CB C 2.036 -4.929 3.564 1.00 . A A . 18 TYR CB 1 1 9 4049 1 1 18 TYR CD1 C 4.079 -6.369 3.156 1.00 . A A . 18 TYR CD1 1 1 9 4050 1 1 18 TYR CD2 C 2.021 -7.453 3.684 1.00 . A A . 18 TYR CD2 1 1 9 4051 1 1 18 TYR CE1 C 4.705 -7.595 3.059 1.00 . A A . 18 TYR CE1 1 1 9 4052 1 1 18 TYR CE2 C 2.642 -8.683 3.589 1.00 . A A . 18 TYR CE2 1 1 9 4053 1 1 18 TYR CG C 2.727 -6.275 3.469 1.00 . A A . 18 TYR CG 1 1 9 4054 1 1 18 TYR CZ C 3.982 -8.748 3.277 1.00 . A A . 18 TYR CZ 1 1 9 4055 1 1 18 TYR H H 0.922 -5.692 0.722 1.00 . A A . 18 TYR H 1 1 9 4056 1 1 18 TYR HA H 1.072 -3.413 2.381 1.00 . A A . 18 TYR HA 1 1 9 4057 1 1 18 TYR HB2 H 2.725 -4.239 4.025 1.00 . A A . 18 TYR HB2 1 1 9 4058 1 1 18 TYR HB3 H 1.173 -5.044 4.203 1.00 . A A . 18 TYR HB3 1 1 9 4059 1 1 18 TYR HD1 H 4.642 -5.464 2.988 1.00 . A A . 18 TYR HD1 1 1 9 4060 1 1 18 TYR HD2 H 0.970 -7.399 3.927 1.00 . A A . 18 TYR HD2 1 1 9 4061 1 1 18 TYR HE1 H 5.755 -7.646 2.816 1.00 . A A . 18 TYR HE1 1 1 9 4062 1 1 18 TYR HE2 H 2.077 -9.588 3.760 1.00 . A A . 18 TYR HE2 1 1 9 4063 1 1 18 TYR HH H 4.971 -10.218 4.029 1.00 . A A . 18 TYR HH 1 1 9 4064 1 1 18 TYR N N 0.646 -5.251 1.551 1.00 . A A . 18 TYR N 1 1 9 4065 1 1 18 TYR O O 3.137 -4.940 0.488 1.00 . A A . 18 TYR O 1 1 9 4066 1 1 18 TYR OH O 4.604 -9.974 3.171 1.00 . A A . 18 TYR OH 1 1 9 4067 1 1 19 CYS C C 5.831 -3.147 1.265 1.00 . A A . 19 CYS C 1 1 9 4068 1 1 19 CYS CA C 4.558 -2.579 0.658 1.00 . A A . 19 CYS CA 1 1 9 4069 1 1 19 CYS CB C 4.674 -1.072 0.588 1.00 . A A . 19 CYS CB 1 1 9 4070 1 1 19 CYS H H 3.061 -2.297 2.124 1.00 . A A . 19 CYS H 1 1 9 4071 1 1 19 CYS HA H 4.426 -2.976 -0.337 1.00 . A A . 19 CYS HA 1 1 9 4072 1 1 19 CYS HB2 H 4.729 -0.701 1.593 1.00 . A A . 19 CYS HB2 1 1 9 4073 1 1 19 CYS HB3 H 5.580 -0.794 0.057 1.00 . A A . 19 CYS HB3 1 1 9 4074 1 1 19 CYS N N 3.396 -2.938 1.458 1.00 . A A . 19 CYS N 1 1 9 4075 1 1 19 CYS O O 5.860 -3.504 2.443 1.00 . A A . 19 CYS O 1 1 9 4076 1 1 19 CYS SG S 3.259 -0.262 -0.220 1.00 . A A . 19 CYS SG 1 1 9 4077 1 1 20 CYS C C 8.775 -2.671 1.868 1.00 . A A . 20 CYS C 1 1 9 4078 1 1 20 CYS CA C 8.167 -3.702 0.942 1.00 . A A . 20 CYS CA 1 1 9 4079 1 1 20 CYS CB C 9.120 -3.996 -0.215 1.00 . A A . 20 CYS CB 1 1 9 4080 1 1 20 CYS H H 6.809 -2.890 -0.458 1.00 . A A . 20 CYS H 1 1 9 4081 1 1 20 CYS HA H 7.987 -4.615 1.494 1.00 . A A . 20 CYS HA 1 1 9 4082 1 1 20 CYS HB2 H 8.716 -3.572 -1.113 1.00 . A A . 20 CYS HB2 1 1 9 4083 1 1 20 CYS HB3 H 10.077 -3.539 -0.004 1.00 . A A . 20 CYS HB3 1 1 9 4084 1 1 20 CYS N N 6.887 -3.207 0.465 1.00 . A A . 20 CYS N 1 1 9 4085 1 1 20 CYS O O 8.427 -1.489 1.793 1.00 . A A . 20 CYS O 1 1 9 4086 1 1 20 CYS SG S 9.403 -5.776 -0.516 1.00 . A A . 20 CYS SG 1 1 9 4087 1 1 21 PRO C C 10.942 -0.998 2.998 1.00 . A A . 21 PRO C 1 1 9 4088 1 1 21 PRO CA C 10.317 -2.186 3.700 1.00 . A A . 21 PRO CA 1 1 9 4089 1 1 21 PRO CB C 11.372 -3.044 4.376 1.00 . A A . 21 PRO CB 1 1 9 4090 1 1 21 PRO CD C 10.142 -4.475 2.915 1.00 . A A . 21 PRO CD 1 1 9 4091 1 1 21 PRO CG C 10.861 -4.439 4.238 1.00 . A A . 21 PRO CG 1 1 9 4092 1 1 21 PRO HA H 9.612 -1.830 4.439 1.00 . A A . 21 PRO HA 1 1 9 4093 1 1 21 PRO HB2 H 12.323 -2.913 3.877 1.00 . A A . 21 PRO HB2 1 1 9 4094 1 1 21 PRO HB3 H 11.451 -2.745 5.407 1.00 . A A . 21 PRO HB3 1 1 9 4095 1 1 21 PRO HD2 H 10.819 -4.744 2.121 1.00 . A A . 21 PRO HD2 1 1 9 4096 1 1 21 PRO HD3 H 9.306 -5.156 2.940 1.00 . A A . 21 PRO HD3 1 1 9 4097 1 1 21 PRO HG2 H 11.686 -5.137 4.238 1.00 . A A . 21 PRO HG2 1 1 9 4098 1 1 21 PRO HG3 H 10.178 -4.663 5.043 1.00 . A A . 21 PRO HG3 1 1 9 4099 1 1 21 PRO N N 9.678 -3.091 2.758 1.00 . A A . 21 PRO N 1 1 9 4100 1 1 21 PRO O O 11.875 -1.130 2.208 1.00 . A A . 21 PRO O 1 1 9 4101 1 1 22 GLY C C 9.680 2.168 2.085 1.00 . A A . 22 GLY C 1 1 9 4102 1 1 22 GLY CA C 10.831 1.382 2.678 1.00 . A A . 22 GLY CA 1 1 9 4103 1 1 22 GLY H H 9.628 0.158 3.905 1.00 . A A . 22 GLY H 1 1 9 4104 1 1 22 GLY HA2 H 11.318 1.984 3.429 1.00 . A A . 22 GLY HA2 1 1 9 4105 1 1 22 GLY HA3 H 11.539 1.151 1.897 1.00 . A A . 22 GLY HA3 1 1 9 4106 1 1 22 GLY N N 10.380 0.152 3.284 1.00 . A A . 22 GLY N 1 1 9 4107 1 1 22 GLY O O 9.673 3.396 2.135 1.00 . A A . 22 GLY O 1 1 9 4108 1 1 23 LEU C C 6.315 1.867 1.802 1.00 . A A . 23 LEU C 1 1 9 4109 1 1 23 LEU CA C 7.542 2.093 0.926 1.00 . A A . 23 LEU CA 1 1 9 4110 1 1 23 LEU CB C 7.307 1.526 -0.476 1.00 . A A . 23 LEU CB 1 1 9 4111 1 1 23 LEU CD1 C 8.204 0.921 -2.735 1.00 . A A . 23 LEU CD1 1 1 9 4112 1 1 23 LEU CD2 C 8.758 3.141 -1.731 1.00 . A A . 23 LEU CD2 1 1 9 4113 1 1 23 LEU CG C 8.482 1.673 -1.444 1.00 . A A . 23 LEU CG 1 1 9 4114 1 1 23 LEU H H 8.754 0.475 1.524 1.00 . A A . 23 LEU H 1 1 9 4115 1 1 23 LEU HA H 7.737 3.153 0.854 1.00 . A A . 23 LEU HA 1 1 9 4116 1 1 23 LEU HB2 H 7.075 0.475 -0.380 1.00 . A A . 23 LEU HB2 1 1 9 4117 1 1 23 LEU HB3 H 6.452 2.027 -0.905 1.00 . A A . 23 LEU HB3 1 1 9 4118 1 1 23 LEU HD11 H 9.136 0.572 -3.157 1.00 . A A . 23 LEU HD11 1 1 9 4119 1 1 23 LEU HD12 H 7.716 1.580 -3.438 1.00 . A A . 23 LEU HD12 1 1 9 4120 1 1 23 LEU HD13 H 7.564 0.076 -2.530 1.00 . A A . 23 LEU HD13 1 1 9 4121 1 1 23 LEU HD21 H 7.912 3.572 -2.246 1.00 . A A . 23 LEU HD21 1 1 9 4122 1 1 23 LEU HD22 H 9.639 3.228 -2.350 1.00 . A A . 23 LEU HD22 1 1 9 4123 1 1 23 LEU HD23 H 8.918 3.666 -0.802 1.00 . A A . 23 LEU HD23 1 1 9 4124 1 1 23 LEU HG H 9.367 1.247 -0.993 1.00 . A A . 23 LEU HG 1 1 9 4125 1 1 23 LEU N N 8.702 1.458 1.527 1.00 . A A . 23 LEU N 1 1 9 4126 1 1 23 LEU O O 6.208 0.836 2.471 1.00 . A A . 23 LEU O 1 1 9 4127 1 1 24 ILE C C 2.929 2.966 1.795 1.00 . A A . 24 ILE C 1 1 9 4128 1 1 24 ILE CA C 4.189 2.699 2.615 1.00 . A A . 24 ILE CA 1 1 9 4129 1 1 24 ILE CB C 4.213 3.649 3.834 1.00 . A A . 24 ILE CB 1 1 9 4130 1 1 24 ILE CD1 C 4.486 6.092 4.529 1.00 . A A . 24 ILE CD1 1 1 9 4131 1 1 24 ILE CG1 C 4.548 5.081 3.402 1.00 . A A . 24 ILE CG1 1 1 9 4132 1 1 24 ILE CG2 C 5.208 3.154 4.877 1.00 . A A . 24 ILE CG2 1 1 9 4133 1 1 24 ILE H H 5.532 3.631 1.253 1.00 . A A . 24 ILE H 1 1 9 4134 1 1 24 ILE HA H 4.148 1.686 2.986 1.00 . A A . 24 ILE HA 1 1 9 4135 1 1 24 ILE HB H 3.230 3.638 4.283 1.00 . A A . 24 ILE HB 1 1 9 4136 1 1 24 ILE HD11 H 4.639 7.084 4.132 1.00 . A A . 24 ILE HD11 1 1 9 4137 1 1 24 ILE HD12 H 5.257 5.871 5.253 1.00 . A A . 24 ILE HD12 1 1 9 4138 1 1 24 ILE HD13 H 3.519 6.039 5.006 1.00 . A A . 24 ILE HD13 1 1 9 4139 1 1 24 ILE HG12 H 5.548 5.103 2.996 1.00 . A A . 24 ILE HG12 1 1 9 4140 1 1 24 ILE HG13 H 3.850 5.392 2.639 1.00 . A A . 24 ILE HG13 1 1 9 4141 1 1 24 ILE HG21 H 5.841 2.398 4.437 1.00 . A A . 24 ILE HG21 1 1 9 4142 1 1 24 ILE HG22 H 4.672 2.732 5.713 1.00 . A A . 24 ILE HG22 1 1 9 4143 1 1 24 ILE HG23 H 5.815 3.979 5.216 1.00 . A A . 24 ILE HG23 1 1 9 4144 1 1 24 ILE N N 5.396 2.821 1.808 1.00 . A A . 24 ILE N 1 1 9 4145 1 1 24 ILE O O 2.845 3.948 1.059 1.00 . A A . 24 ILE O 1 1 9 4146 1 1 25 CYS C C -0.096 3.420 1.709 1.00 . A A . 25 CYS C 1 1 9 4147 1 1 25 CYS CA C 0.687 2.206 1.203 1.00 . A A . 25 CYS CA 1 1 9 4148 1 1 25 CYS CB C -0.146 0.932 1.363 1.00 . A A . 25 CYS CB 1 1 9 4149 1 1 25 CYS H H 2.082 1.308 2.522 1.00 . A A . 25 CYS H 1 1 9 4150 1 1 25 CYS HA H 0.915 2.351 0.156 1.00 . A A . 25 CYS HA 1 1 9 4151 1 1 25 CYS HB2 H 0.422 0.092 0.989 1.00 . A A . 25 CYS HB2 1 1 9 4152 1 1 25 CYS HB3 H -0.353 0.778 2.412 1.00 . A A . 25 CYS HB3 1 1 9 4153 1 1 25 CYS N N 1.951 2.075 1.925 1.00 . A A . 25 CYS N 1 1 9 4154 1 1 25 CYS O O -0.138 3.679 2.913 1.00 . A A . 25 CYS O 1 1 9 4155 1 1 25 CYS SG S -1.743 0.950 0.481 1.00 . A A . 25 CYS SG 1 1 9 4156 1 1 26 GLY C C -2.770 5.467 0.411 1.00 . A A . 26 GLY C 1 1 9 4157 1 1 26 GLY CA C -1.452 5.345 1.161 1.00 . A A . 26 GLY CA 1 1 9 4158 1 1 26 GLY H H -0.619 3.915 -0.159 1.00 . A A . 26 GLY H 1 1 9 4159 1 1 26 GLY HA2 H -1.658 5.307 2.219 1.00 . A A . 26 GLY HA2 1 1 9 4160 1 1 26 GLY HA3 H -0.853 6.219 0.953 1.00 . A A . 26 GLY HA3 1 1 9 4161 1 1 26 GLY N N -0.697 4.164 0.789 1.00 . A A . 26 GLY N 1 1 9 4162 1 1 26 GLY O O -3.653 4.623 0.566 1.00 . A A . 26 GLY O 1 1 9 4163 1 1 27 PRO C C -4.384 5.789 -2.321 1.00 . A A . 27 PRO C 1 1 9 4164 1 1 27 PRO CA C -4.167 6.780 -1.174 1.00 . A A . 27 PRO CA 1 1 9 4165 1 1 27 PRO CB C -3.963 8.196 -1.717 1.00 . A A . 27 PRO CB 1 1 9 4166 1 1 27 PRO CD C -1.927 7.582 -0.622 1.00 . A A . 27 PRO CD 1 1 9 4167 1 1 27 PRO CG C -2.485 8.372 -1.774 1.00 . A A . 27 PRO CG 1 1 9 4168 1 1 27 PRO HA H -5.036 6.765 -0.532 1.00 . A A . 27 PRO HA 1 1 9 4169 1 1 27 PRO HB2 H -4.407 8.275 -2.698 1.00 . A A . 27 PRO HB2 1 1 9 4170 1 1 27 PRO HB3 H -4.419 8.911 -1.049 1.00 . A A . 27 PRO HB3 1 1 9 4171 1 1 27 PRO HD2 H -0.973 7.151 -0.889 1.00 . A A . 27 PRO HD2 1 1 9 4172 1 1 27 PRO HD3 H -1.830 8.208 0.252 1.00 . A A . 27 PRO HD3 1 1 9 4173 1 1 27 PRO HG2 H -2.105 7.989 -2.709 1.00 . A A . 27 PRO HG2 1 1 9 4174 1 1 27 PRO HG3 H -2.235 9.417 -1.666 1.00 . A A . 27 PRO HG3 1 1 9 4175 1 1 27 PRO N N -2.935 6.528 -0.402 1.00 . A A . 27 PRO N 1 1 9 4176 1 1 27 PRO O O -4.380 6.168 -3.493 1.00 . A A . 27 PRO O 1 1 9 4177 1 1 28 PHE C C -3.529 3.213 -3.770 1.00 . A A . 28 PHE C 1 1 9 4178 1 1 28 PHE CA C -4.775 3.431 -2.913 1.00 . A A . 28 PHE CA 1 1 9 4179 1 1 28 PHE CB C -6.027 3.663 -3.796 1.00 . A A . 28 PHE CB 1 1 9 4180 1 1 28 PHE CD1 C -7.599 4.244 -1.913 1.00 . A A . 28 PHE CD1 1 1 9 4181 1 1 28 PHE CD2 C -8.295 2.625 -3.517 1.00 . A A . 28 PHE CD2 1 1 9 4182 1 1 28 PHE CE1 C -8.797 4.100 -1.242 1.00 . A A . 28 PHE CE1 1 1 9 4183 1 1 28 PHE CE2 C -9.497 2.477 -2.851 1.00 . A A . 28 PHE CE2 1 1 9 4184 1 1 28 PHE CG C -7.332 3.508 -3.058 1.00 . A A . 28 PHE CG 1 1 9 4185 1 1 28 PHE CZ C -9.748 3.216 -1.711 1.00 . A A . 28 PHE CZ 1 1 9 4186 1 1 28 PHE H H -4.536 4.309 -1.000 1.00 . A A . 28 PHE H 1 1 9 4187 1 1 28 PHE HA H -4.933 2.535 -2.330 1.00 . A A . 28 PHE HA 1 1 9 4188 1 1 28 PHE HB2 H -6.004 4.662 -4.207 1.00 . A A . 28 PHE HB2 1 1 9 4189 1 1 28 PHE HB3 H -6.025 2.948 -4.609 1.00 . A A . 28 PHE HB3 1 1 9 4190 1 1 28 PHE HD1 H -6.856 4.937 -1.544 1.00 . A A . 28 PHE HD1 1 1 9 4191 1 1 28 PHE HD2 H -8.101 2.045 -4.408 1.00 . A A . 28 PHE HD2 1 1 9 4192 1 1 28 PHE HE1 H -8.991 4.680 -0.351 1.00 . A A . 28 PHE HE1 1 1 9 4193 1 1 28 PHE HE2 H -10.239 1.785 -3.220 1.00 . A A . 28 PHE HE2 1 1 9 4194 1 1 28 PHE HZ H -10.686 3.101 -1.188 1.00 . A A . 28 PHE HZ 1 1 9 4195 1 1 28 PHE N N -4.562 4.523 -1.958 1.00 . A A . 28 PHE N 1 1 9 4196 1 1 28 PHE O O -3.579 2.532 -4.791 1.00 . A A . 28 PHE O 1 1 9 4197 1 1 29 VAL C C -0.037 3.708 -2.912 1.00 . A A . 29 VAL C 1 1 9 4198 1 1 29 VAL CA C -1.116 3.618 -3.972 1.00 . A A . 29 VAL CA 1 1 9 4199 1 1 29 VAL CB C -0.840 4.693 -5.062 1.00 . A A . 29 VAL CB 1 1 9 4200 1 1 29 VAL CG1 C -1.774 4.531 -6.252 1.00 . A A . 29 VAL CG1 1 1 9 4201 1 1 29 VAL CG2 C -0.954 6.098 -4.483 1.00 . A A . 29 VAL CG2 1 1 9 4202 1 1 29 VAL H H -2.430 4.256 -2.456 1.00 . A A . 29 VAL H 1 1 9 4203 1 1 29 VAL HA H -1.079 2.638 -4.431 1.00 . A A . 29 VAL HA 1 1 9 4204 1 1 29 VAL HB H 0.177 4.559 -5.419 1.00 . A A . 29 VAL HB 1 1 9 4205 1 1 29 VAL HG11 H -2.290 3.586 -6.180 1.00 . A A . 29 VAL HG11 1 1 9 4206 1 1 29 VAL HG12 H -1.199 4.558 -7.167 1.00 . A A . 29 VAL HG12 1 1 9 4207 1 1 29 VAL HG13 H -2.495 5.336 -6.256 1.00 . A A . 29 VAL HG13 1 1 9 4208 1 1 29 VAL HG21 H -0.959 6.819 -5.287 1.00 . A A . 29 VAL HG21 1 1 9 4209 1 1 29 VAL HG22 H -0.111 6.288 -3.835 1.00 . A A . 29 VAL HG22 1 1 9 4210 1 1 29 VAL HG23 H -1.870 6.182 -3.917 1.00 . A A . 29 VAL HG23 1 1 9 4211 1 1 29 VAL N N -2.404 3.760 -3.308 1.00 . A A . 29 VAL N 1 1 9 4212 1 1 29 VAL O O -0.249 4.317 -1.864 1.00 . A A . 29 VAL O 1 1 9 4213 1 1 30 CYS C C 3.061 4.368 -2.476 1.00 . A A . 30 CYS C 1 1 9 4214 1 1 30 CYS CA C 2.195 3.135 -2.225 1.00 . A A . 30 CYS CA 1 1 9 4215 1 1 30 CYS CB C 3.028 1.861 -2.367 1.00 . A A . 30 CYS CB 1 1 9 4216 1 1 30 CYS H H 1.214 2.640 -4.024 1.00 . A A . 30 CYS H 1 1 9 4217 1 1 30 CYS HA H 1.784 3.186 -1.227 1.00 . A A . 30 CYS HA 1 1 9 4218 1 1 30 CYS HB2 H 2.371 1.024 -2.553 1.00 . A A . 30 CYS HB2 1 1 9 4219 1 1 30 CYS HB3 H 3.695 1.974 -3.209 1.00 . A A . 30 CYS HB3 1 1 9 4220 1 1 30 CYS N N 1.098 3.111 -3.170 1.00 . A A . 30 CYS N 1 1 9 4221 1 1 30 CYS O O 3.074 4.913 -3.582 1.00 . A A . 30 CYS O 1 1 9 4222 1 1 30 CYS SG S 4.043 1.472 -0.913 1.00 . A A . 30 CYS SG 1 1 9 4223 1 1 31 VAL C C 5.940 5.757 -0.862 1.00 . A A . 31 VAL C 1 1 9 4224 1 1 31 VAL CA C 4.632 5.978 -1.604 1.00 . A A . 31 VAL CA 1 1 9 4225 1 1 31 VAL CB C 3.964 7.277 -1.083 1.00 . A A . 31 VAL CB 1 1 9 4226 1 1 31 VAL CG1 C 2.779 7.671 -1.953 1.00 . A A . 31 VAL CG1 1 1 9 4227 1 1 31 VAL CG2 C 3.530 7.121 0.367 1.00 . A A . 31 VAL CG2 1 1 9 4228 1 1 31 VAL H H 3.735 4.354 -0.593 1.00 . A A . 31 VAL H 1 1 9 4229 1 1 31 VAL HA H 4.848 6.102 -2.663 1.00 . A A . 31 VAL HA 1 1 9 4230 1 1 31 VAL HB H 4.692 8.073 -1.131 1.00 . A A . 31 VAL HB 1 1 9 4231 1 1 31 VAL HG11 H 1.946 7.948 -1.323 1.00 . A A . 31 VAL HG11 1 1 9 4232 1 1 31 VAL HG12 H 2.495 6.835 -2.576 1.00 . A A . 31 VAL HG12 1 1 9 4233 1 1 31 VAL HG13 H 3.053 8.508 -2.578 1.00 . A A . 31 VAL HG13 1 1 9 4234 1 1 31 VAL HG21 H 3.511 6.072 0.626 1.00 . A A . 31 VAL HG21 1 1 9 4235 1 1 31 VAL HG22 H 2.544 7.541 0.495 1.00 . A A . 31 VAL HG22 1 1 9 4236 1 1 31 VAL HG23 H 4.228 7.637 1.009 1.00 . A A . 31 VAL HG23 1 1 9 4237 1 1 31 VAL N N 3.776 4.816 -1.463 1.00 . A A . 31 VAL N 1 1 9 4238 1 1 31 VAL O O 5.976 4.868 0.014 1.00 . A A . 31 VAL O 1 1 9 4239 1 1 31 VAL OXT O 6.925 6.459 -1.182 1.00 . A A . 31 VAL OXT 1 1 10 4240 1 1 1 ALA C C 4.815 -8.633 0.461 1.00 . A A . 1 ALA C 1 1 10 4241 1 1 1 ALA CA C 4.952 -10.140 0.367 1.00 . A A . 1 ALA CA 1 1 10 4242 1 1 1 ALA CB C 3.600 -10.784 0.099 1.00 . A A . 1 ALA CB 1 1 10 4243 1 1 1 ALA H1 H 5.498 -9.932 2.358 1.00 . A A . 1 ALA H1 1 1 10 4244 1 1 1 ALA H2 H 6.531 -10.933 1.466 1.00 . A A . 1 ALA H2 1 1 10 4245 1 1 1 ALA H3 H 5.009 -11.498 1.942 1.00 . A A . 1 ALA H3 1 1 10 4246 1 1 1 ALA HA H 5.614 -10.384 -0.452 1.00 . A A . 1 ALA HA 1 1 10 4247 1 1 1 ALA HB1 H 3.645 -11.347 -0.821 1.00 . A A . 1 ALA HB1 1 1 10 4248 1 1 1 ALA HB2 H 2.846 -10.016 0.016 1.00 . A A . 1 ALA HB2 1 1 10 4249 1 1 1 ALA HB3 H 3.350 -11.448 0.914 1.00 . A A . 1 ALA HB3 1 1 10 4250 1 1 1 ALA N N 5.540 -10.665 1.619 1.00 . A A . 1 ALA N 1 1 10 4251 1 1 1 ALA O O 4.630 -8.100 1.552 1.00 . A A . 1 ALA O 1 1 10 4252 1 1 2 CYS C C 4.250 -6.067 -2.062 1.00 . A A . 2 CYS C 1 1 10 4253 1 1 2 CYS CA C 4.805 -6.506 -0.708 1.00 . A A . 2 CYS CA 1 1 10 4254 1 1 2 CYS CB C 6.160 -5.869 -0.401 1.00 . A A . 2 CYS CB 1 1 10 4255 1 1 2 CYS H H 5.069 -8.437 -1.510 1.00 . A A . 2 CYS H 1 1 10 4256 1 1 2 CYS HA H 4.102 -6.200 0.060 1.00 . A A . 2 CYS HA 1 1 10 4257 1 1 2 CYS HB2 H 6.032 -4.799 -0.349 1.00 . A A . 2 CYS HB2 1 1 10 4258 1 1 2 CYS HB3 H 6.496 -6.223 0.564 1.00 . A A . 2 CYS HB3 1 1 10 4259 1 1 2 CYS N N 4.917 -7.954 -0.671 1.00 . A A . 2 CYS N 1 1 10 4260 1 1 2 CYS O O 3.466 -6.803 -2.660 1.00 . A A . 2 CYS O 1 1 10 4261 1 1 2 CYS SG S 7.498 -6.185 -1.595 1.00 . A A . 2 CYS SG 1 1 10 4262 1 1 3 SER C C 4.942 -3.172 -4.267 1.00 . A A . 3 SER C 1 1 10 4263 1 1 3 SER CA C 4.147 -4.399 -3.825 1.00 . A A . 3 SER CA 1 1 10 4264 1 1 3 SER CB C 2.657 -4.052 -3.713 1.00 . A A . 3 SER CB 1 1 10 4265 1 1 3 SER H H 5.266 -4.340 -2.035 1.00 . A A . 3 SER H 1 1 10 4266 1 1 3 SER HA H 4.275 -5.182 -4.557 1.00 . A A . 3 SER HA 1 1 10 4267 1 1 3 SER HB2 H 2.139 -4.859 -3.217 1.00 . A A . 3 SER HB2 1 1 10 4268 1 1 3 SER HB3 H 2.543 -3.146 -3.136 1.00 . A A . 3 SER HB3 1 1 10 4269 1 1 3 SER HG H 1.313 -3.279 -4.907 1.00 . A A . 3 SER HG 1 1 10 4270 1 1 3 SER N N 4.640 -4.891 -2.545 1.00 . A A . 3 SER N 1 1 10 4271 1 1 3 SER O O 5.646 -2.558 -3.459 1.00 . A A . 3 SER O 1 1 10 4272 1 1 3 SER OG O 2.077 -3.856 -4.988 1.00 . A A . 3 SER OG 1 1 10 4273 1 1 4 LYS C C 4.921 -0.372 -5.539 1.00 . A A . 4 LYS C 1 1 10 4274 1 1 4 LYS CA C 5.520 -1.661 -6.095 1.00 . A A . 4 LYS CA 1 1 10 4275 1 1 4 LYS CB C 5.461 -1.646 -7.629 1.00 . A A . 4 LYS CB 1 1 10 4276 1 1 4 LYS CD C 6.518 -2.609 -9.711 1.00 . A A . 4 LYS CD 1 1 10 4277 1 1 4 LYS CE C 5.399 -2.087 -10.604 1.00 . A A . 4 LYS CE 1 1 10 4278 1 1 4 LYS CG C 6.048 -2.890 -8.287 1.00 . A A . 4 LYS CG 1 1 10 4279 1 1 4 LYS H H 4.236 -3.347 -6.132 1.00 . A A . 4 LYS H 1 1 10 4280 1 1 4 LYS HA H 6.553 -1.725 -5.784 1.00 . A A . 4 LYS HA 1 1 10 4281 1 1 4 LYS HB2 H 4.429 -1.559 -7.936 1.00 . A A . 4 LYS HB2 1 1 10 4282 1 1 4 LYS HB3 H 6.006 -0.785 -7.988 1.00 . A A . 4 LYS HB3 1 1 10 4283 1 1 4 LYS HD2 H 7.306 -1.872 -9.678 1.00 . A A . 4 LYS HD2 1 1 10 4284 1 1 4 LYS HD3 H 6.904 -3.526 -10.134 1.00 . A A . 4 LYS HD3 1 1 10 4285 1 1 4 LYS HE2 H 4.915 -1.261 -10.105 1.00 . A A . 4 LYS HE2 1 1 10 4286 1 1 4 LYS HE3 H 5.830 -1.741 -11.532 1.00 . A A . 4 LYS HE3 1 1 10 4287 1 1 4 LYS HG2 H 6.890 -3.230 -7.702 1.00 . A A . 4 LYS HG2 1 1 10 4288 1 1 4 LYS HG3 H 5.292 -3.660 -8.312 1.00 . A A . 4 LYS HG3 1 1 10 4289 1 1 4 LYS HZ1 H 4.790 -3.888 -11.475 1.00 . A A . 4 LYS HZ1 1 1 10 4290 1 1 4 LYS HZ2 H 3.581 -2.705 -11.423 1.00 . A A . 4 LYS HZ2 1 1 10 4291 1 1 4 LYS HZ3 H 4.005 -3.536 -10.014 1.00 . A A . 4 LYS HZ3 1 1 10 4292 1 1 4 LYS N N 4.822 -2.819 -5.547 1.00 . A A . 4 LYS N 1 1 10 4293 1 1 4 LYS NZ N 4.380 -3.128 -10.905 1.00 . A A . 4 LYS NZ 1 1 10 4294 1 1 4 LYS O O 3.748 -0.329 -5.177 1.00 . A A . 4 LYS O 1 1 10 4295 1 1 5 LYS C C 4.030 2.462 -5.629 1.00 . A A . 5 LYS C 1 1 10 4296 1 1 5 LYS CA C 5.274 1.946 -4.917 1.00 . A A . 5 LYS CA 1 1 10 4297 1 1 5 LYS CB C 6.389 2.999 -4.982 1.00 . A A . 5 LYS CB 1 1 10 4298 1 1 5 LYS CD C 6.959 5.366 -4.309 1.00 . A A . 5 LYS CD 1 1 10 4299 1 1 5 LYS CE C 6.457 6.800 -4.279 1.00 . A A . 5 LYS CE 1 1 10 4300 1 1 5 LYS CG C 5.883 4.425 -4.812 1.00 . A A . 5 LYS CG 1 1 10 4301 1 1 5 LYS H H 6.663 0.578 -5.742 1.00 . A A . 5 LYS H 1 1 10 4302 1 1 5 LYS HA H 5.019 1.782 -3.886 1.00 . A A . 5 LYS HA 1 1 10 4303 1 1 5 LYS HB2 H 7.105 2.798 -4.198 1.00 . A A . 5 LYS HB2 1 1 10 4304 1 1 5 LYS HB3 H 6.884 2.925 -5.938 1.00 . A A . 5 LYS HB3 1 1 10 4305 1 1 5 LYS HD2 H 7.245 5.071 -3.309 1.00 . A A . 5 LYS HD2 1 1 10 4306 1 1 5 LYS HD3 H 7.815 5.306 -4.964 1.00 . A A . 5 LYS HD3 1 1 10 4307 1 1 5 LYS HE2 H 6.615 7.244 -5.252 1.00 . A A . 5 LYS HE2 1 1 10 4308 1 1 5 LYS HE3 H 5.398 6.797 -4.056 1.00 . A A . 5 LYS HE3 1 1 10 4309 1 1 5 LYS HG2 H 5.529 4.788 -5.761 1.00 . A A . 5 LYS HG2 1 1 10 4310 1 1 5 LYS HG3 H 5.066 4.419 -4.114 1.00 . A A . 5 LYS HG3 1 1 10 4311 1 1 5 LYS HZ1 H 8.166 7.728 -3.515 1.00 . A A . 5 LYS HZ1 1 1 10 4312 1 1 5 LYS HZ2 H 7.120 7.132 -2.321 1.00 . A A . 5 LYS HZ2 1 1 10 4313 1 1 5 LYS HZ3 H 6.729 8.548 -3.168 1.00 . A A . 5 LYS HZ3 1 1 10 4314 1 1 5 LYS N N 5.733 0.671 -5.455 1.00 . A A . 5 LYS N 1 1 10 4315 1 1 5 LYS NZ N 7.169 7.612 -3.255 1.00 . A A . 5 LYS NZ 1 1 10 4316 1 1 5 LYS O O 2.992 2.646 -5.025 1.00 . A A . 5 LYS O 1 1 10 4317 1 1 6 TRP C C 2.017 2.099 -8.010 1.00 . A A . 6 TRP C 1 1 10 4318 1 1 6 TRP CA C 2.988 3.215 -7.644 1.00 . A A . 6 TRP CA 1 1 10 4319 1 1 6 TRP CB C 3.474 3.973 -8.880 1.00 . A A . 6 TRP CB 1 1 10 4320 1 1 6 TRP CD1 C 5.955 4.532 -8.529 1.00 . A A . 6 TRP CD1 1 1 10 4321 1 1 6 TRP CD2 C 4.591 6.288 -8.291 1.00 . A A . 6 TRP CD2 1 1 10 4322 1 1 6 TRP CE2 C 5.919 6.718 -8.096 1.00 . A A . 6 TRP CE2 1 1 10 4323 1 1 6 TRP CE3 C 3.562 7.224 -8.183 1.00 . A A . 6 TRP CE3 1 1 10 4324 1 1 6 TRP CG C 4.639 4.885 -8.591 1.00 . A A . 6 TRP CG 1 1 10 4325 1 1 6 TRP CH2 C 5.208 8.934 -7.697 1.00 . A A . 6 TRP CH2 1 1 10 4326 1 1 6 TRP CZ2 C 6.239 8.041 -7.799 1.00 . A A . 6 TRP CZ2 1 1 10 4327 1 1 6 TRP CZ3 C 3.880 8.536 -7.885 1.00 . A A . 6 TRP CZ3 1 1 10 4328 1 1 6 TRP H H 4.963 2.536 -7.362 1.00 . A A . 6 TRP H 1 1 10 4329 1 1 6 TRP HA H 2.470 3.909 -6.993 1.00 . A A . 6 TRP HA 1 1 10 4330 1 1 6 TRP HB2 H 3.783 3.263 -9.632 1.00 . A A . 6 TRP HB2 1 1 10 4331 1 1 6 TRP HB3 H 2.665 4.574 -9.267 1.00 . A A . 6 TRP HB3 1 1 10 4332 1 1 6 TRP HD1 H 6.320 3.531 -8.688 1.00 . A A . 6 TRP HD1 1 1 10 4333 1 1 6 TRP HE1 H 7.709 5.630 -8.172 1.00 . A A . 6 TRP HE1 1 1 10 4334 1 1 6 TRP HE3 H 2.534 6.936 -8.315 1.00 . A A . 6 TRP HE3 1 1 10 4335 1 1 6 TRP HH2 H 5.410 9.970 -7.466 1.00 . A A . 6 TRP HH2 1 1 10 4336 1 1 6 TRP HZ2 H 7.258 8.364 -7.652 1.00 . A A . 6 TRP HZ2 1 1 10 4337 1 1 6 TRP HZ3 H 3.094 9.272 -7.795 1.00 . A A . 6 TRP HZ3 1 1 10 4338 1 1 6 TRP N N 4.125 2.700 -6.907 1.00 . A A . 6 TRP N 1 1 10 4339 1 1 6 TRP NE1 N 6.732 5.628 -8.249 1.00 . A A . 6 TRP NE1 1 1 10 4340 1 1 6 TRP O O 1.258 2.211 -8.971 1.00 . A A . 6 TRP O 1 1 10 4341 1 1 7 GLU C C -0.140 0.132 -6.605 1.00 . A A . 7 GLU C 1 1 10 4342 1 1 7 GLU CA C 1.122 -0.081 -7.432 1.00 . A A . 7 GLU CA 1 1 10 4343 1 1 7 GLU CB C 1.777 -1.399 -7.028 1.00 . A A . 7 GLU CB 1 1 10 4344 1 1 7 GLU CD C 2.091 -2.891 -9.026 1.00 . A A . 7 GLU CD 1 1 10 4345 1 1 7 GLU CG C 1.265 -2.608 -7.792 1.00 . A A . 7 GLU CG 1 1 10 4346 1 1 7 GLU H H 2.645 1.015 -6.437 1.00 . A A . 7 GLU H 1 1 10 4347 1 1 7 GLU HA H 0.863 -0.110 -8.480 1.00 . A A . 7 GLU HA 1 1 10 4348 1 1 7 GLU HB2 H 2.841 -1.323 -7.194 1.00 . A A . 7 GLU HB2 1 1 10 4349 1 1 7 GLU HB3 H 1.598 -1.565 -5.976 1.00 . A A . 7 GLU HB3 1 1 10 4350 1 1 7 GLU HG2 H 1.303 -3.471 -7.144 1.00 . A A . 7 GLU HG2 1 1 10 4351 1 1 7 GLU HG3 H 0.244 -2.424 -8.091 1.00 . A A . 7 GLU HG3 1 1 10 4352 1 1 7 GLU N N 2.026 1.036 -7.214 1.00 . A A . 7 GLU N 1 1 10 4353 1 1 7 GLU O O -0.077 0.671 -5.498 1.00 . A A . 7 GLU O 1 1 10 4354 1 1 7 GLU OE1 O 2.082 -2.066 -9.963 1.00 . A A . 7 GLU OE1 1 1 10 4355 1 1 7 GLU OE2 O 2.793 -3.925 -9.052 1.00 . A A . 7 GLU OE2 1 1 10 4356 1 1 8 TYR C C -2.557 -1.039 -5.192 1.00 . A A . 8 TYR C 1 1 10 4357 1 1 8 TYR CA C -2.539 -0.146 -6.430 1.00 . A A . 8 TYR CA 1 1 10 4358 1 1 8 TYR CB C -3.703 -0.504 -7.365 1.00 . A A . 8 TYR CB 1 1 10 4359 1 1 8 TYR CD1 C -5.565 0.459 -5.945 1.00 . A A . 8 TYR CD1 1 1 10 4360 1 1 8 TYR CD2 C -5.817 -1.756 -6.783 1.00 . A A . 8 TYR CD2 1 1 10 4361 1 1 8 TYR CE1 C -6.796 0.369 -5.326 1.00 . A A . 8 TYR CE1 1 1 10 4362 1 1 8 TYR CE2 C -7.049 -1.854 -6.167 1.00 . A A . 8 TYR CE2 1 1 10 4363 1 1 8 TYR CG C -5.053 -0.600 -6.683 1.00 . A A . 8 TYR CG 1 1 10 4364 1 1 8 TYR CZ C -7.534 -0.790 -5.439 1.00 . A A . 8 TYR CZ 1 1 10 4365 1 1 8 TYR H H -1.261 -0.713 -8.018 1.00 . A A . 8 TYR H 1 1 10 4366 1 1 8 TYR HA H -2.631 0.887 -6.117 1.00 . A A . 8 TYR HA 1 1 10 4367 1 1 8 TYR HB2 H -3.779 0.251 -8.133 1.00 . A A . 8 TYR HB2 1 1 10 4368 1 1 8 TYR HB3 H -3.498 -1.458 -7.828 1.00 . A A . 8 TYR HB3 1 1 10 4369 1 1 8 TYR HD1 H -4.985 1.366 -5.859 1.00 . A A . 8 TYR HD1 1 1 10 4370 1 1 8 TYR HD2 H -5.434 -2.590 -7.352 1.00 . A A . 8 TYR HD2 1 1 10 4371 1 1 8 TYR HE1 H -7.175 1.204 -4.755 1.00 . A A . 8 TYR HE1 1 1 10 4372 1 1 8 TYR HE2 H -7.627 -2.762 -6.256 1.00 . A A . 8 TYR HE2 1 1 10 4373 1 1 8 TYR HH H -8.852 -1.751 -4.419 1.00 . A A . 8 TYR HH 1 1 10 4374 1 1 8 TYR N N -1.275 -0.289 -7.135 1.00 . A A . 8 TYR N 1 1 10 4375 1 1 8 TYR O O -2.487 -2.265 -5.293 1.00 . A A . 8 TYR O 1 1 10 4376 1 1 8 TYR OH O -8.760 -0.883 -4.821 1.00 . A A . 8 TYR OH 1 1 10 4377 1 1 9 CYS C C -4.044 -1.779 -2.528 1.00 . A A . 9 CYS C 1 1 10 4378 1 1 9 CYS CA C -2.678 -1.145 -2.765 1.00 . A A . 9 CYS CA 1 1 10 4379 1 1 9 CYS CB C -2.315 -0.227 -1.596 1.00 . A A . 9 CYS CB 1 1 10 4380 1 1 9 CYS H H -2.702 0.564 -4.014 1.00 . A A . 9 CYS H 1 1 10 4381 1 1 9 CYS HA H -1.942 -1.932 -2.829 1.00 . A A . 9 CYS HA 1 1 10 4382 1 1 9 CYS HB2 H -2.901 0.677 -1.663 1.00 . A A . 9 CYS HB2 1 1 10 4383 1 1 9 CYS HB3 H -2.546 -0.731 -0.669 1.00 . A A . 9 CYS HB3 1 1 10 4384 1 1 9 CYS N N -2.650 -0.415 -4.026 1.00 . A A . 9 CYS N 1 1 10 4385 1 1 9 CYS O O -4.850 -1.265 -1.752 1.00 . A A . 9 CYS O 1 1 10 4386 1 1 9 CYS SG S -0.558 0.259 -1.540 1.00 . A A . 9 CYS SG 1 1 10 4387 1 1 10 ILE C C -5.638 -4.291 -1.690 1.00 . A A . 10 ILE C 1 1 10 4388 1 1 10 ILE CA C -5.557 -3.612 -3.064 1.00 . A A . 10 ILE CA 1 1 10 4389 1 1 10 ILE CB C -5.753 -4.640 -4.213 1.00 . A A . 10 ILE CB 1 1 10 4390 1 1 10 ILE CD1 C -8.300 -4.659 -4.036 1.00 . A A . 10 ILE CD1 1 1 10 4391 1 1 10 ILE CG1 C -7.024 -5.473 -3.999 1.00 . A A . 10 ILE CG1 1 1 10 4392 1 1 10 ILE CG2 C -4.532 -5.542 -4.365 1.00 . A A . 10 ILE CG2 1 1 10 4393 1 1 10 ILE H H -3.608 -3.251 -3.806 1.00 . A A . 10 ILE H 1 1 10 4394 1 1 10 ILE HA H -6.352 -2.881 -3.129 1.00 . A A . 10 ILE HA 1 1 10 4395 1 1 10 ILE HB H -5.859 -4.083 -5.132 1.00 . A A . 10 ILE HB 1 1 10 4396 1 1 10 ILE HD11 H -8.364 -4.132 -4.976 1.00 . A A . 10 ILE HD11 1 1 10 4397 1 1 10 ILE HD12 H -8.297 -3.947 -3.224 1.00 . A A . 10 ILE HD12 1 1 10 4398 1 1 10 ILE HD13 H -9.150 -5.318 -3.934 1.00 . A A . 10 ILE HD13 1 1 10 4399 1 1 10 ILE HG12 H -7.088 -6.223 -4.773 1.00 . A A . 10 ILE HG12 1 1 10 4400 1 1 10 ILE HG13 H -6.969 -5.960 -3.036 1.00 . A A . 10 ILE HG13 1 1 10 4401 1 1 10 ILE HG21 H -4.784 -6.385 -4.992 1.00 . A A . 10 ILE HG21 1 1 10 4402 1 1 10 ILE HG22 H -4.223 -5.895 -3.393 1.00 . A A . 10 ILE HG22 1 1 10 4403 1 1 10 ILE HG23 H -3.727 -4.983 -4.819 1.00 . A A . 10 ILE HG23 1 1 10 4404 1 1 10 ILE N N -4.295 -2.895 -3.201 1.00 . A A . 10 ILE N 1 1 10 4405 1 1 10 ILE O O -5.277 -5.456 -1.519 1.00 . A A . 10 ILE O 1 1 10 4406 1 1 11 VAL C C -7.395 -4.974 0.804 1.00 . A A . 11 VAL C 1 1 10 4407 1 1 11 VAL CA C -6.204 -4.029 0.656 1.00 . A A . 11 VAL CA 1 1 10 4408 1 1 11 VAL CB C -6.322 -2.872 1.675 1.00 . A A . 11 VAL CB 1 1 10 4409 1 1 11 VAL CG1 C -5.042 -2.048 1.693 1.00 . A A . 11 VAL CG1 1 1 10 4410 1 1 11 VAL CG2 C -7.520 -1.983 1.365 1.00 . A A . 11 VAL CG2 1 1 10 4411 1 1 11 VAL H H -6.341 -2.604 -0.896 1.00 . A A . 11 VAL H 1 1 10 4412 1 1 11 VAL HA H -5.301 -4.578 0.879 1.00 . A A . 11 VAL HA 1 1 10 4413 1 1 11 VAL HB H -6.460 -3.297 2.659 1.00 . A A . 11 VAL HB 1 1 10 4414 1 1 11 VAL HG11 H -4.321 -2.517 2.347 1.00 . A A . 11 VAL HG11 1 1 10 4415 1 1 11 VAL HG12 H -5.260 -1.053 2.051 1.00 . A A . 11 VAL HG12 1 1 10 4416 1 1 11 VAL HG13 H -4.638 -1.990 0.693 1.00 . A A . 11 VAL HG13 1 1 10 4417 1 1 11 VAL HG21 H -7.248 -1.266 0.604 1.00 . A A . 11 VAL HG21 1 1 10 4418 1 1 11 VAL HG22 H -7.823 -1.462 2.260 1.00 . A A . 11 VAL HG22 1 1 10 4419 1 1 11 VAL HG23 H -8.337 -2.594 1.009 1.00 . A A . 11 VAL HG23 1 1 10 4420 1 1 11 VAL N N -6.089 -3.531 -0.704 1.00 . A A . 11 VAL N 1 1 10 4421 1 1 11 VAL O O -8.480 -4.712 0.282 1.00 . A A . 11 VAL O 1 1 10 4422 1 1 12 PRO C C -9.361 -6.537 2.635 1.00 . A A . 12 PRO C 1 1 10 4423 1 1 12 PRO CA C -8.255 -7.081 1.737 1.00 . A A . 12 PRO CA 1 1 10 4424 1 1 12 PRO CB C -7.528 -8.242 2.423 1.00 . A A . 12 PRO CB 1 1 10 4425 1 1 12 PRO CD C -5.934 -6.481 2.160 1.00 . A A . 12 PRO CD 1 1 10 4426 1 1 12 PRO CG C -6.329 -7.624 3.053 1.00 . A A . 12 PRO CG 1 1 10 4427 1 1 12 PRO HA H -8.683 -7.419 0.805 1.00 . A A . 12 PRO HA 1 1 10 4428 1 1 12 PRO HB2 H -8.177 -8.689 3.161 1.00 . A A . 12 PRO HB2 1 1 10 4429 1 1 12 PRO HB3 H -7.249 -8.980 1.686 1.00 . A A . 12 PRO HB3 1 1 10 4430 1 1 12 PRO HD2 H -5.534 -5.667 2.745 1.00 . A A . 12 PRO HD2 1 1 10 4431 1 1 12 PRO HD3 H -5.214 -6.809 1.425 1.00 . A A . 12 PRO HD3 1 1 10 4432 1 1 12 PRO HG2 H -6.579 -7.260 4.039 1.00 . A A . 12 PRO HG2 1 1 10 4433 1 1 12 PRO HG3 H -5.530 -8.348 3.111 1.00 . A A . 12 PRO HG3 1 1 10 4434 1 1 12 PRO N N -7.200 -6.093 1.516 1.00 . A A . 12 PRO N 1 1 10 4435 1 1 12 PRO O O -9.118 -5.680 3.491 1.00 . A A . 12 PRO O 1 1 10 4436 1 1 13 ILE C C -11.441 -6.788 4.713 1.00 . A A . 13 ILE C 1 1 10 4437 1 1 13 ILE CA C -11.715 -6.599 3.224 1.00 . A A . 13 ILE CA 1 1 10 4438 1 1 13 ILE CB C -13.033 -7.327 2.835 1.00 . A A . 13 ILE CB 1 1 10 4439 1 1 13 ILE CD1 C -12.115 -9.606 2.049 1.00 . A A . 13 ILE CD1 1 1 10 4440 1 1 13 ILE CG1 C -12.950 -8.851 3.065 1.00 . A A . 13 ILE CG1 1 1 10 4441 1 1 13 ILE CG2 C -13.395 -7.023 1.388 1.00 . A A . 13 ILE CG2 1 1 10 4442 1 1 13 ILE H H -10.705 -7.711 1.739 1.00 . A A . 13 ILE H 1 1 10 4443 1 1 13 ILE HA H -11.852 -5.543 3.036 1.00 . A A . 13 ILE HA 1 1 10 4444 1 1 13 ILE HB H -13.822 -6.926 3.456 1.00 . A A . 13 ILE HB 1 1 10 4445 1 1 13 ILE HD11 H -12.741 -10.307 1.517 1.00 . A A . 13 ILE HD11 1 1 10 4446 1 1 13 ILE HD12 H -11.326 -10.140 2.557 1.00 . A A . 13 ILE HD12 1 1 10 4447 1 1 13 ILE HD13 H -11.682 -8.907 1.348 1.00 . A A . 13 ILE HD13 1 1 10 4448 1 1 13 ILE HG12 H -12.521 -9.033 4.039 1.00 . A A . 13 ILE HG12 1 1 10 4449 1 1 13 ILE HG13 H -13.950 -9.261 3.041 1.00 . A A . 13 ILE HG13 1 1 10 4450 1 1 13 ILE HG21 H -14.289 -7.566 1.118 1.00 . A A . 13 ILE HG21 1 1 10 4451 1 1 13 ILE HG22 H -12.584 -7.324 0.742 1.00 . A A . 13 ILE HG22 1 1 10 4452 1 1 13 ILE HG23 H -13.570 -5.963 1.276 1.00 . A A . 13 ILE HG23 1 1 10 4453 1 1 13 ILE N N -10.575 -7.035 2.433 1.00 . A A . 13 ILE N 1 1 10 4454 1 1 13 ILE O O -11.026 -7.863 5.149 1.00 . A A . 13 ILE O 1 1 10 4455 1 1 14 LEU C C -9.943 -5.914 7.246 1.00 . A A . 14 LEU C 1 1 10 4456 1 1 14 LEU CA C -11.422 -5.705 6.915 1.00 . A A . 14 LEU CA 1 1 10 4457 1 1 14 LEU CB C -12.282 -6.765 7.616 1.00 . A A . 14 LEU CB 1 1 10 4458 1 1 14 LEU CD1 C -14.537 -7.722 8.143 1.00 . A A . 14 LEU CD1 1 1 10 4459 1 1 14 LEU CD2 C -14.231 -5.243 8.042 1.00 . A A . 14 LEU CD2 1 1 10 4460 1 1 14 LEU CG C -13.793 -6.583 7.464 1.00 . A A . 14 LEU CG 1 1 10 4461 1 1 14 LEU H H -11.959 -4.893 5.040 1.00 . A A . 14 LEU H 1 1 10 4462 1 1 14 LEU HA H -11.714 -4.731 7.279 1.00 . A A . 14 LEU HA 1 1 10 4463 1 1 14 LEU HB2 H -12.015 -7.733 7.216 1.00 . A A . 14 LEU HB2 1 1 10 4464 1 1 14 LEU HB3 H -12.043 -6.751 8.668 1.00 . A A . 14 LEU HB3 1 1 10 4465 1 1 14 LEU HD11 H -14.739 -7.459 9.171 1.00 . A A . 14 LEU HD11 1 1 10 4466 1 1 14 LEU HD12 H -13.932 -8.616 8.113 1.00 . A A . 14 LEU HD12 1 1 10 4467 1 1 14 LEU HD13 H -15.469 -7.901 7.628 1.00 . A A . 14 LEU HD13 1 1 10 4468 1 1 14 LEU HD21 H -13.844 -4.443 7.427 1.00 . A A . 14 LEU HD21 1 1 10 4469 1 1 14 LEU HD22 H -13.848 -5.142 9.046 1.00 . A A . 14 LEU HD22 1 1 10 4470 1 1 14 LEU HD23 H -15.309 -5.195 8.061 1.00 . A A . 14 LEU HD23 1 1 10 4471 1 1 14 LEU HG H -14.049 -6.595 6.415 1.00 . A A . 14 LEU HG 1 1 10 4472 1 1 14 LEU N N -11.652 -5.715 5.471 1.00 . A A . 14 LEU N 1 1 10 4473 1 1 14 LEU O O -9.603 -6.421 8.315 1.00 . A A . 14 LEU O 1 1 10 4474 1 1 15 GLY C C -6.838 -4.699 5.701 1.00 . A A . 15 GLY C 1 1 10 4475 1 1 15 GLY CA C -7.645 -5.646 6.563 1.00 . A A . 15 GLY CA 1 1 10 4476 1 1 15 GLY H H -9.386 -5.100 5.496 1.00 . A A . 15 GLY H 1 1 10 4477 1 1 15 GLY HA2 H -7.434 -5.442 7.602 1.00 . A A . 15 GLY HA2 1 1 10 4478 1 1 15 GLY HA3 H -7.351 -6.661 6.337 1.00 . A A . 15 GLY HA3 1 1 10 4479 1 1 15 GLY N N -9.066 -5.506 6.335 1.00 . A A . 15 GLY N 1 1 10 4480 1 1 15 GLY O O -7.364 -3.693 5.225 1.00 . A A . 15 GLY O 1 1 10 4481 1 1 16 PHE C C -3.385 -4.932 4.386 1.00 . A A . 16 PHE C 1 1 10 4482 1 1 16 PHE CA C -4.681 -4.190 4.689 1.00 . A A . 16 PHE CA 1 1 10 4483 1 1 16 PHE CB C -4.389 -2.849 5.386 1.00 . A A . 16 PHE CB 1 1 10 4484 1 1 16 PHE CD1 C -2.578 -3.397 7.053 1.00 . A A . 16 PHE CD1 1 1 10 4485 1 1 16 PHE CD2 C -4.684 -2.635 7.871 1.00 . A A . 16 PHE CD2 1 1 10 4486 1 1 16 PHE CE1 C -2.107 -3.499 8.349 1.00 . A A . 16 PHE CE1 1 1 10 4487 1 1 16 PHE CE2 C -4.220 -2.736 9.169 1.00 . A A . 16 PHE CE2 1 1 10 4488 1 1 16 PHE CG C -3.870 -2.964 6.799 1.00 . A A . 16 PHE CG 1 1 10 4489 1 1 16 PHE CZ C -2.930 -3.169 9.408 1.00 . A A . 16 PHE CZ 1 1 10 4490 1 1 16 PHE H H -5.207 -5.835 5.906 1.00 . A A . 16 PHE H 1 1 10 4491 1 1 16 PHE HA H -5.188 -3.993 3.756 1.00 . A A . 16 PHE HA 1 1 10 4492 1 1 16 PHE HB2 H -3.649 -2.312 4.811 1.00 . A A . 16 PHE HB2 1 1 10 4493 1 1 16 PHE HB3 H -5.299 -2.266 5.415 1.00 . A A . 16 PHE HB3 1 1 10 4494 1 1 16 PHE HD1 H -1.933 -3.656 6.226 1.00 . A A . 16 PHE HD1 1 1 10 4495 1 1 16 PHE HD2 H -5.693 -2.297 7.687 1.00 . A A . 16 PHE HD2 1 1 10 4496 1 1 16 PHE HE1 H -1.099 -3.837 8.533 1.00 . A A . 16 PHE HE1 1 1 10 4497 1 1 16 PHE HE2 H -4.864 -2.477 9.996 1.00 . A A . 16 PHE HE2 1 1 10 4498 1 1 16 PHE HZ H -2.564 -3.247 10.421 1.00 . A A . 16 PHE HZ 1 1 10 4499 1 1 16 PHE N N -5.565 -5.019 5.499 1.00 . A A . 16 PHE N 1 1 10 4500 1 1 16 PHE O O -2.972 -5.809 5.145 1.00 . A A . 16 PHE O 1 1 10 4501 1 1 17 VAL C C -0.330 -4.373 3.372 1.00 . A A . 17 VAL C 1 1 10 4502 1 1 17 VAL CA C -1.504 -5.213 2.873 1.00 . A A . 17 VAL CA 1 1 10 4503 1 1 17 VAL CB C -1.405 -5.371 1.334 1.00 . A A . 17 VAL CB 1 1 10 4504 1 1 17 VAL CG1 C -0.535 -6.566 0.962 1.00 . A A . 17 VAL CG1 1 1 10 4505 1 1 17 VAL CG2 C -2.784 -5.500 0.705 1.00 . A A . 17 VAL CG2 1 1 10 4506 1 1 17 VAL H H -3.137 -3.880 2.709 1.00 . A A . 17 VAL H 1 1 10 4507 1 1 17 VAL HA H -1.457 -6.192 3.326 1.00 . A A . 17 VAL HA 1 1 10 4508 1 1 17 VAL HB H -0.935 -4.483 0.937 1.00 . A A . 17 VAL HB 1 1 10 4509 1 1 17 VAL HG11 H -0.462 -7.235 1.807 1.00 . A A . 17 VAL HG11 1 1 10 4510 1 1 17 VAL HG12 H 0.451 -6.222 0.688 1.00 . A A . 17 VAL HG12 1 1 10 4511 1 1 17 VAL HG13 H -0.979 -7.088 0.127 1.00 . A A . 17 VAL HG13 1 1 10 4512 1 1 17 VAL HG21 H -2.754 -6.241 -0.079 1.00 . A A . 17 VAL HG21 1 1 10 4513 1 1 17 VAL HG22 H -3.080 -4.548 0.289 1.00 . A A . 17 VAL HG22 1 1 10 4514 1 1 17 VAL HG23 H -3.495 -5.800 1.459 1.00 . A A . 17 VAL HG23 1 1 10 4515 1 1 17 VAL N N -2.756 -4.583 3.272 1.00 . A A . 17 VAL N 1 1 10 4516 1 1 17 VAL O O -0.522 -3.400 4.103 1.00 . A A . 17 VAL O 1 1 10 4517 1 1 18 TYR C C 3.087 -4.024 2.228 1.00 . A A . 18 TYR C 1 1 10 4518 1 1 18 TYR CA C 2.066 -4.007 3.357 1.00 . A A . 18 TYR CA 1 1 10 4519 1 1 18 TYR CB C 2.676 -4.613 4.629 1.00 . A A . 18 TYR CB 1 1 10 4520 1 1 18 TYR CD1 C 4.019 -2.547 5.209 1.00 . A A . 18 TYR CD1 1 1 10 4521 1 1 18 TYR CD2 C 5.092 -4.671 5.370 1.00 . A A . 18 TYR CD2 1 1 10 4522 1 1 18 TYR CE1 C 5.185 -1.923 5.610 1.00 . A A . 18 TYR CE1 1 1 10 4523 1 1 18 TYR CE2 C 6.261 -4.053 5.775 1.00 . A A . 18 TYR CE2 1 1 10 4524 1 1 18 TYR CG C 3.951 -3.931 5.081 1.00 . A A . 18 TYR CG 1 1 10 4525 1 1 18 TYR CZ C 6.303 -2.680 5.891 1.00 . A A . 18 TYR CZ 1 1 10 4526 1 1 18 TYR H H 0.962 -5.508 2.370 1.00 . A A . 18 TYR H 1 1 10 4527 1 1 18 TYR HA H 1.782 -2.985 3.556 1.00 . A A . 18 TYR HA 1 1 10 4528 1 1 18 TYR HB2 H 1.959 -4.542 5.432 1.00 . A A . 18 TYR HB2 1 1 10 4529 1 1 18 TYR HB3 H 2.903 -5.654 4.448 1.00 . A A . 18 TYR HB3 1 1 10 4530 1 1 18 TYR HD1 H 3.142 -1.957 4.988 1.00 . A A . 18 TYR HD1 1 1 10 4531 1 1 18 TYR HD2 H 5.058 -5.746 5.277 1.00 . A A . 18 TYR HD2 1 1 10 4532 1 1 18 TYR HE1 H 5.217 -0.847 5.703 1.00 . A A . 18 TYR HE1 1 1 10 4533 1 1 18 TYR HE2 H 7.136 -4.646 5.995 1.00 . A A . 18 TYR HE2 1 1 10 4534 1 1 18 TYR HH H 7.415 -1.855 7.227 1.00 . A A . 18 TYR HH 1 1 10 4535 1 1 18 TYR N N 0.873 -4.735 2.963 1.00 . A A . 18 TYR N 1 1 10 4536 1 1 18 TYR O O 3.366 -5.071 1.643 1.00 . A A . 18 TYR O 1 1 10 4537 1 1 18 TYR OH O 7.466 -2.060 6.290 1.00 . A A . 18 TYR OH 1 1 10 4538 1 1 19 CYS C C 5.976 -3.235 1.313 1.00 . A A . 19 CYS C 1 1 10 4539 1 1 19 CYS CA C 4.623 -2.711 0.875 1.00 . A A . 19 CYS CA 1 1 10 4540 1 1 19 CYS CB C 4.754 -1.249 0.503 1.00 . A A . 19 CYS CB 1 1 10 4541 1 1 19 CYS H H 3.355 -2.060 2.432 1.00 . A A . 19 CYS H 1 1 10 4542 1 1 19 CYS HA H 4.288 -3.267 0.014 1.00 . A A . 19 CYS HA 1 1 10 4543 1 1 19 CYS HB2 H 4.780 -0.680 1.412 1.00 . A A . 19 CYS HB2 1 1 10 4544 1 1 19 CYS HB3 H 5.679 -1.089 -0.042 1.00 . A A . 19 CYS HB3 1 1 10 4545 1 1 19 CYS N N 3.630 -2.856 1.928 1.00 . A A . 19 CYS N 1 1 10 4546 1 1 19 CYS O O 6.151 -3.669 2.450 1.00 . A A . 19 CYS O 1 1 10 4547 1 1 19 CYS SG S 3.377 -0.618 -0.498 1.00 . A A . 19 CYS SG 1 1 10 4548 1 1 20 CYS C C 8.909 -2.659 1.655 1.00 . A A . 20 CYS C 1 1 10 4549 1 1 20 CYS CA C 8.277 -3.646 0.694 1.00 . A A . 20 CYS CA 1 1 10 4550 1 1 20 CYS CB C 9.102 -3.747 -0.588 1.00 . A A . 20 CYS CB 1 1 10 4551 1 1 20 CYS H H 6.739 -2.824 -0.487 1.00 . A A . 20 CYS H 1 1 10 4552 1 1 20 CYS HA H 8.211 -4.617 1.163 1.00 . A A . 20 CYS HA 1 1 10 4553 1 1 20 CYS HB2 H 9.511 -2.773 -0.811 1.00 . A A . 20 CYS HB2 1 1 10 4554 1 1 20 CYS HB3 H 9.914 -4.441 -0.428 1.00 . A A . 20 CYS HB3 1 1 10 4555 1 1 20 CYS N N 6.936 -3.187 0.401 1.00 . A A . 20 CYS N 1 1 10 4556 1 1 20 CYS O O 8.537 -1.482 1.645 1.00 . A A . 20 CYS O 1 1 10 4557 1 1 20 CYS SG S 8.159 -4.313 -2.055 1.00 . A A . 20 CYS SG 1 1 10 4558 1 1 21 PRO C C 10.994 -0.946 2.837 1.00 . A A . 21 PRO C 1 1 10 4559 1 1 21 PRO CA C 10.478 -2.218 3.479 1.00 . A A . 21 PRO CA 1 1 10 4560 1 1 21 PRO CB C 11.618 -3.047 4.037 1.00 . A A . 21 PRO CB 1 1 10 4561 1 1 21 PRO CD C 10.335 -4.485 2.620 1.00 . A A . 21 PRO CD 1 1 10 4562 1 1 21 PRO CG C 11.158 -4.457 3.884 1.00 . A A . 21 PRO CG 1 1 10 4563 1 1 21 PRO HA H 9.797 -1.959 4.277 1.00 . A A . 21 PRO HA 1 1 10 4564 1 1 21 PRO HB2 H 12.520 -2.856 3.472 1.00 . A A . 21 PRO HB2 1 1 10 4565 1 1 21 PRO HB3 H 11.764 -2.783 5.069 1.00 . A A . 21 PRO HB3 1 1 10 4566 1 1 21 PRO HD2 H 10.954 -4.741 1.773 1.00 . A A . 21 PRO HD2 1 1 10 4567 1 1 21 PRO HD3 H 9.515 -5.180 2.713 1.00 . A A . 21 PRO HD3 1 1 10 4568 1 1 21 PRO HG2 H 12.010 -5.115 3.793 1.00 . A A . 21 PRO HG2 1 1 10 4569 1 1 21 PRO HG3 H 10.552 -4.741 4.732 1.00 . A A . 21 PRO HG3 1 1 10 4570 1 1 21 PRO N N 9.842 -3.103 2.511 1.00 . A A . 21 PRO N 1 1 10 4571 1 1 21 PRO O O 11.903 -0.962 2.007 1.00 . A A . 21 PRO O 1 1 10 4572 1 1 22 GLY C C 9.510 2.155 2.109 1.00 . A A . 22 GLY C 1 1 10 4573 1 1 22 GLY CA C 10.715 1.437 2.687 1.00 . A A . 22 GLY CA 1 1 10 4574 1 1 22 GLY H H 9.644 0.053 3.867 1.00 . A A . 22 GLY H 1 1 10 4575 1 1 22 GLY HA2 H 11.136 2.039 3.476 1.00 . A A . 22 GLY HA2 1 1 10 4576 1 1 22 GLY HA3 H 11.452 1.310 1.909 1.00 . A A . 22 GLY HA3 1 1 10 4577 1 1 22 GLY N N 10.369 0.141 3.220 1.00 . A A . 22 GLY N 1 1 10 4578 1 1 22 GLY O O 9.427 3.378 2.176 1.00 . A A . 22 GLY O 1 1 10 4579 1 1 23 LEU C C 6.172 1.737 1.841 1.00 . A A . 23 LEU C 1 1 10 4580 1 1 23 LEU CA C 7.383 1.969 0.944 1.00 . A A . 23 LEU CA 1 1 10 4581 1 1 23 LEU CB C 7.147 1.348 -0.434 1.00 . A A . 23 LEU CB 1 1 10 4582 1 1 23 LEU CD1 C 8.046 0.650 -2.665 1.00 . A A . 23 LEU CD1 1 1 10 4583 1 1 23 LEU CD2 C 8.576 2.920 -1.764 1.00 . A A . 23 LEU CD2 1 1 10 4584 1 1 23 LEU CG C 8.318 1.464 -1.410 1.00 . A A . 23 LEU CG 1 1 10 4585 1 1 23 LEU H H 8.695 0.416 1.514 1.00 . A A . 23 LEU H 1 1 10 4586 1 1 23 LEU HA H 7.541 3.031 0.831 1.00 . A A . 23 LEU HA 1 1 10 4587 1 1 23 LEU HB2 H 6.919 0.301 -0.298 1.00 . A A . 23 LEU HB2 1 1 10 4588 1 1 23 LEU HB3 H 6.288 1.830 -0.878 1.00 . A A . 23 LEU HB3 1 1 10 4589 1 1 23 LEU HD11 H 8.898 0.023 -2.880 1.00 . A A . 23 LEU HD11 1 1 10 4590 1 1 23 LEU HD12 H 7.872 1.318 -3.497 1.00 . A A . 23 LEU HD12 1 1 10 4591 1 1 23 LEU HD13 H 7.173 0.032 -2.512 1.00 . A A . 23 LEU HD13 1 1 10 4592 1 1 23 LEU HD21 H 8.056 3.166 -2.679 1.00 . A A . 23 LEU HD21 1 1 10 4593 1 1 23 LEU HD22 H 9.636 3.075 -1.901 1.00 . A A . 23 LEU HD22 1 1 10 4594 1 1 23 LEU HD23 H 8.220 3.554 -0.967 1.00 . A A . 23 LEU HD23 1 1 10 4595 1 1 23 LEU HG H 9.208 1.068 -0.943 1.00 . A A . 23 LEU HG 1 1 10 4596 1 1 23 LEU N N 8.579 1.394 1.539 1.00 . A A . 23 LEU N 1 1 10 4597 1 1 23 LEU O O 6.079 0.707 2.517 1.00 . A A . 23 LEU O 1 1 10 4598 1 1 24 ILE C C 2.793 2.928 1.855 1.00 . A A . 24 ILE C 1 1 10 4599 1 1 24 ILE CA C 4.041 2.573 2.662 1.00 . A A . 24 ILE CA 1 1 10 4600 1 1 24 ILE CB C 4.106 3.472 3.919 1.00 . A A . 24 ILE CB 1 1 10 4601 1 1 24 ILE CD1 C 4.495 5.869 4.712 1.00 . A A . 24 ILE CD1 1 1 10 4602 1 1 24 ILE CG1 C 4.499 4.906 3.543 1.00 . A A . 24 ILE CG1 1 1 10 4603 1 1 24 ILE CG2 C 5.081 2.894 4.938 1.00 . A A . 24 ILE CG2 1 1 10 4604 1 1 24 ILE H H 5.376 3.489 1.281 1.00 . A A . 24 ILE H 1 1 10 4605 1 1 24 ILE HA H 3.961 1.546 2.988 1.00 . A A . 24 ILE HA 1 1 10 4606 1 1 24 ILE HB H 3.125 3.485 4.371 1.00 . A A . 24 ILE HB 1 1 10 4607 1 1 24 ILE HD11 H 5.065 5.448 5.526 1.00 . A A . 24 ILE HD11 1 1 10 4608 1 1 24 ILE HD12 H 3.479 6.040 5.034 1.00 . A A . 24 ILE HD12 1 1 10 4609 1 1 24 ILE HD13 H 4.939 6.805 4.408 1.00 . A A . 24 ILE HD13 1 1 10 4610 1 1 24 ILE HG12 H 5.494 4.900 3.123 1.00 . A A . 24 ILE HG12 1 1 10 4611 1 1 24 ILE HG13 H 3.805 5.278 2.802 1.00 . A A . 24 ILE HG13 1 1 10 4612 1 1 24 ILE HG21 H 5.739 2.192 4.448 1.00 . A A . 24 ILE HG21 1 1 10 4613 1 1 24 ILE HG22 H 4.529 2.387 5.717 1.00 . A A . 24 ILE HG22 1 1 10 4614 1 1 24 ILE HG23 H 5.665 3.693 5.371 1.00 . A A . 24 ILE HG23 1 1 10 4615 1 1 24 ILE N N 5.246 2.686 1.848 1.00 . A A . 24 ILE N 1 1 10 4616 1 1 24 ILE O O 2.766 3.925 1.139 1.00 . A A . 24 ILE O 1 1 10 4617 1 1 25 CYS C C -0.205 3.579 1.744 1.00 . A A . 25 CYS C 1 1 10 4618 1 1 25 CYS CA C 0.511 2.327 1.243 1.00 . A A . 25 CYS CA 1 1 10 4619 1 1 25 CYS CB C -0.420 1.120 1.367 1.00 . A A . 25 CYS CB 1 1 10 4620 1 1 25 CYS H H 1.843 1.311 2.544 1.00 . A A . 25 CYS H 1 1 10 4621 1 1 25 CYS HA H 0.759 2.468 0.202 1.00 . A A . 25 CYS HA 1 1 10 4622 1 1 25 CYS HB2 H -0.423 0.781 2.392 1.00 . A A . 25 CYS HB2 1 1 10 4623 1 1 25 CYS HB3 H -1.421 1.418 1.091 1.00 . A A . 25 CYS HB3 1 1 10 4624 1 1 25 CYS N N 1.761 2.098 1.967 1.00 . A A . 25 CYS N 1 1 10 4625 1 1 25 CYS O O -0.244 3.849 2.944 1.00 . A A . 25 CYS O 1 1 10 4626 1 1 25 CYS SG S 0.044 -0.299 0.320 1.00 . A A . 25 CYS SG 1 1 10 4627 1 1 26 GLY C C -2.777 5.693 0.370 1.00 . A A . 26 GLY C 1 1 10 4628 1 1 26 GLY CA C -1.480 5.549 1.150 1.00 . A A . 26 GLY CA 1 1 10 4629 1 1 26 GLY H H -0.699 4.063 -0.130 1.00 . A A . 26 GLY H 1 1 10 4630 1 1 26 GLY HA2 H -1.706 5.538 2.206 1.00 . A A . 26 GLY HA2 1 1 10 4631 1 1 26 GLY HA3 H -0.846 6.396 0.937 1.00 . A A . 26 GLY HA3 1 1 10 4632 1 1 26 GLY N N -0.770 4.334 0.811 1.00 . A A . 26 GLY N 1 1 10 4633 1 1 26 GLY O O -3.714 4.923 0.578 1.00 . A A . 26 GLY O 1 1 10 4634 1 1 27 PRO C C -4.326 5.878 -2.420 1.00 . A A . 27 PRO C 1 1 10 4635 1 1 27 PRO CA C -4.065 6.944 -1.351 1.00 . A A . 27 PRO CA 1 1 10 4636 1 1 27 PRO CB C -3.769 8.298 -2.000 1.00 . A A . 27 PRO CB 1 1 10 4637 1 1 27 PRO CD C -1.783 7.650 -0.832 1.00 . A A . 27 PRO CD 1 1 10 4638 1 1 27 PRO CG C -2.282 8.379 -2.049 1.00 . A A . 27 PRO CG 1 1 10 4639 1 1 27 PRO HA H -4.941 7.031 -0.727 1.00 . A A . 27 PRO HA 1 1 10 4640 1 1 27 PRO HB2 H -4.200 8.328 -2.989 1.00 . A A . 27 PRO HB2 1 1 10 4641 1 1 27 PRO HB3 H -4.186 9.090 -1.395 1.00 . A A . 27 PRO HB3 1 1 10 4642 1 1 27 PRO HD2 H -0.859 7.137 -1.054 1.00 . A A . 27 PRO HD2 1 1 10 4643 1 1 27 PRO HD3 H -1.647 8.338 -0.011 1.00 . A A . 27 PRO HD3 1 1 10 4644 1 1 27 PRO HG2 H -1.919 7.901 -2.948 1.00 . A A . 27 PRO HG2 1 1 10 4645 1 1 27 PRO HG3 H -1.970 9.412 -2.022 1.00 . A A . 27 PRO HG3 1 1 10 4646 1 1 27 PRO N N -2.860 6.686 -0.537 1.00 . A A . 27 PRO N 1 1 10 4647 1 1 27 PRO O O -4.305 6.163 -3.616 1.00 . A A . 27 PRO O 1 1 10 4648 1 1 28 PHE C C -3.609 3.151 -3.674 1.00 . A A . 28 PHE C 1 1 10 4649 1 1 28 PHE CA C -4.835 3.499 -2.827 1.00 . A A . 28 PHE CA 1 1 10 4650 1 1 28 PHE CB C -6.086 3.719 -3.715 1.00 . A A . 28 PHE CB 1 1 10 4651 1 1 28 PHE CD1 C -7.608 4.607 -1.911 1.00 . A A . 28 PHE CD1 1 1 10 4652 1 1 28 PHE CD2 C -8.390 2.819 -3.281 1.00 . A A . 28 PHE CD2 1 1 10 4653 1 1 28 PHE CE1 C -8.803 4.602 -1.217 1.00 . A A . 28 PHE CE1 1 1 10 4654 1 1 28 PHE CE2 C -9.586 2.810 -2.591 1.00 . A A . 28 PHE CE2 1 1 10 4655 1 1 28 PHE CG C -7.386 3.715 -2.951 1.00 . A A . 28 PHE CG 1 1 10 4656 1 1 28 PHE CZ C -9.793 3.702 -1.558 1.00 . A A . 28 PHE CZ 1 1 10 4657 1 1 28 PHE H H -4.552 4.516 -0.988 1.00 . A A . 28 PHE H 1 1 10 4658 1 1 28 PHE HA H -5.029 2.660 -2.173 1.00 . A A . 28 PHE HA 1 1 10 4659 1 1 28 PHE HB2 H -6.012 4.670 -4.223 1.00 . A A . 28 PHE HB2 1 1 10 4660 1 1 28 PHE HB3 H -6.139 2.929 -4.453 1.00 . A A . 28 PHE HB3 1 1 10 4661 1 1 28 PHE HD1 H -6.834 5.312 -1.643 1.00 . A A . 28 PHE HD1 1 1 10 4662 1 1 28 PHE HD2 H -8.229 2.119 -4.088 1.00 . A A . 28 PHE HD2 1 1 10 4663 1 1 28 PHE HE1 H -8.962 5.301 -0.409 1.00 . A A . 28 PHE HE1 1 1 10 4664 1 1 28 PHE HE2 H -10.360 2.106 -2.861 1.00 . A A . 28 PHE HE2 1 1 10 4665 1 1 28 PHE HZ H -10.728 3.697 -1.017 1.00 . A A . 28 PHE HZ 1 1 10 4666 1 1 28 PHE N N -4.565 4.653 -1.961 1.00 . A A . 28 PHE N 1 1 10 4667 1 1 28 PHE O O -3.696 2.381 -4.627 1.00 . A A . 28 PHE O 1 1 10 4668 1 1 29 VAL C C -0.106 3.537 -2.893 1.00 . A A . 29 VAL C 1 1 10 4669 1 1 29 VAL CA C -1.191 3.429 -3.943 1.00 . A A . 29 VAL CA 1 1 10 4670 1 1 29 VAL CB C -0.876 4.422 -5.097 1.00 . A A . 29 VAL CB 1 1 10 4671 1 1 29 VAL CG1 C -1.817 4.219 -6.275 1.00 . A A . 29 VAL CG1 1 1 10 4672 1 1 29 VAL CG2 C -0.936 5.862 -4.606 1.00 . A A . 29 VAL CG2 1 1 10 4673 1 1 29 VAL H H -2.452 4.260 -2.475 1.00 . A A . 29 VAL H 1 1 10 4674 1 1 29 VAL HA H -1.215 2.418 -4.342 1.00 . A A . 29 VAL HA 1 1 10 4675 1 1 29 VAL HB H 0.135 4.228 -5.443 1.00 . A A . 29 VAL HB 1 1 10 4676 1 1 29 VAL HG11 H -2.057 3.170 -6.369 1.00 . A A . 29 VAL HG11 1 1 10 4677 1 1 29 VAL HG12 H -1.338 4.562 -7.181 1.00 . A A . 29 VAL HG12 1 1 10 4678 1 1 29 VAL HG13 H -2.724 4.783 -6.112 1.00 . A A . 29 VAL HG13 1 1 10 4679 1 1 29 VAL HG21 H -0.081 6.065 -3.979 1.00 . A A . 29 VAL HG21 1 1 10 4680 1 1 29 VAL HG22 H -1.843 6.010 -4.037 1.00 . A A . 29 VAL HG22 1 1 10 4681 1 1 29 VAL HG23 H -0.929 6.532 -5.453 1.00 . A A . 29 VAL HG23 1 1 10 4682 1 1 29 VAL N N -2.460 3.687 -3.278 1.00 . A A . 29 VAL N 1 1 10 4683 1 1 29 VAL O O -0.334 4.131 -1.840 1.00 . A A . 29 VAL O 1 1 10 4684 1 1 30 CYS C C 2.982 4.272 -2.428 1.00 . A A . 30 CYS C 1 1 10 4685 1 1 30 CYS CA C 2.132 3.024 -2.194 1.00 . A A . 30 CYS CA 1 1 10 4686 1 1 30 CYS CB C 2.986 1.764 -2.311 1.00 . A A . 30 CYS CB 1 1 10 4687 1 1 30 CYS H H 1.181 2.506 -4.008 1.00 . A A . 30 CYS H 1 1 10 4688 1 1 30 CYS HA H 1.704 3.072 -1.205 1.00 . A A . 30 CYS HA 1 1 10 4689 1 1 30 CYS HB2 H 2.356 0.931 -2.586 1.00 . A A . 30 CYS HB2 1 1 10 4690 1 1 30 CYS HB3 H 3.727 1.914 -3.084 1.00 . A A . 30 CYS HB3 1 1 10 4691 1 1 30 CYS N N 1.045 2.973 -3.152 1.00 . A A . 30 CYS N 1 1 10 4692 1 1 30 CYS O O 3.006 4.825 -3.530 1.00 . A A . 30 CYS O 1 1 10 4693 1 1 30 CYS SG S 3.864 1.324 -0.787 1.00 . A A . 30 CYS SG 1 1 10 4694 1 1 31 VAL C C 5.817 5.674 -0.748 1.00 . A A . 31 VAL C 1 1 10 4695 1 1 31 VAL CA C 4.524 5.893 -1.515 1.00 . A A . 31 VAL CA 1 1 10 4696 1 1 31 VAL CB C 3.835 7.182 -0.998 1.00 . A A . 31 VAL CB 1 1 10 4697 1 1 31 VAL CG1 C 2.654 7.565 -1.879 1.00 . A A . 31 VAL CG1 1 1 10 4698 1 1 31 VAL CG2 C 3.391 7.021 0.449 1.00 . A A . 31 VAL CG2 1 1 10 4699 1 1 31 VAL H H 3.629 4.250 -0.536 1.00 . A A . 31 VAL H 1 1 10 4700 1 1 31 VAL HA H 4.760 6.026 -2.567 1.00 . A A . 31 VAL HA 1 1 10 4701 1 1 31 VAL HB H 4.555 7.986 -1.039 1.00 . A A . 31 VAL HB 1 1 10 4702 1 1 31 VAL HG11 H 1.804 7.805 -1.257 1.00 . A A . 31 VAL HG11 1 1 10 4703 1 1 31 VAL HG12 H 2.404 6.737 -2.526 1.00 . A A . 31 VAL HG12 1 1 10 4704 1 1 31 VAL HG13 H 2.916 8.424 -2.479 1.00 . A A . 31 VAL HG13 1 1 10 4705 1 1 31 VAL HG21 H 3.040 6.012 0.607 1.00 . A A . 31 VAL HG21 1 1 10 4706 1 1 31 VAL HG22 H 2.592 7.717 0.659 1.00 . A A . 31 VAL HG22 1 1 10 4707 1 1 31 VAL HG23 H 4.224 7.220 1.106 1.00 . A A . 31 VAL HG23 1 1 10 4708 1 1 31 VAL N N 3.677 4.721 -1.400 1.00 . A A . 31 VAL N 1 1 10 4709 1 1 31 VAL O O 5.856 4.745 0.082 1.00 . A A . 31 VAL O 1 1 10 4710 1 1 31 VAL OXT O 6.788 6.422 -1.003 1.00 . A A . 31 VAL OXT 1 1 11 4711 1 1 1 ALA C C 4.615 -8.517 -0.225 1.00 . A A . 1 ALA C 1 1 11 4712 1 1 1 ALA CA C 4.686 -10.020 -0.419 1.00 . A A . 1 ALA CA 1 1 11 4713 1 1 1 ALA CB C 3.447 -10.527 -1.142 1.00 . A A . 1 ALA CB 1 1 11 4714 1 1 1 ALA H1 H 4.614 -10.001 1.655 1.00 . A A . 1 ALA H1 1 1 11 4715 1 1 1 ALA H2 H 5.798 -11.031 1.019 1.00 . A A . 1 ALA H2 1 1 11 4716 1 1 1 ALA H3 H 4.168 -11.482 0.967 1.00 . A A . 1 ALA H3 1 1 11 4717 1 1 1 ALA HA H 5.552 -10.257 -1.019 1.00 . A A . 1 ALA HA 1 1 11 4718 1 1 1 ALA HB1 H 3.668 -11.472 -1.613 1.00 . A A . 1 ALA HB1 1 1 11 4719 1 1 1 ALA HB2 H 3.150 -9.810 -1.893 1.00 . A A . 1 ALA HB2 1 1 11 4720 1 1 1 ALA HB3 H 2.644 -10.657 -0.432 1.00 . A A . 1 ALA HB3 1 1 11 4721 1 1 1 ALA N N 4.827 -10.684 0.896 1.00 . A A . 1 ALA N 1 1 11 4722 1 1 1 ALA O O 4.226 -8.055 0.844 1.00 . A A . 1 ALA O 1 1 11 4723 1 1 2 CYS C C 4.749 -5.742 -2.574 1.00 . A A . 2 CYS C 1 1 11 4724 1 1 2 CYS CA C 4.986 -6.313 -1.181 1.00 . A A . 2 CYS CA 1 1 11 4725 1 1 2 CYS CB C 6.297 -5.793 -0.592 1.00 . A A . 2 CYS CB 1 1 11 4726 1 1 2 CYS H H 5.309 -8.197 -2.070 1.00 . A A . 2 CYS H 1 1 11 4727 1 1 2 CYS HA H 4.169 -6.000 -0.536 1.00 . A A . 2 CYS HA 1 1 11 4728 1 1 2 CYS HB2 H 6.225 -4.721 -0.495 1.00 . A A . 2 CYS HB2 1 1 11 4729 1 1 2 CYS HB3 H 6.440 -6.219 0.391 1.00 . A A . 2 CYS HB3 1 1 11 4730 1 1 2 CYS N N 5.000 -7.767 -1.245 1.00 . A A . 2 CYS N 1 1 11 4731 1 1 2 CYS O O 5.391 -6.150 -3.541 1.00 . A A . 2 CYS O 1 1 11 4732 1 1 2 CYS SG S 7.798 -6.137 -1.561 1.00 . A A . 2 CYS SG 1 1 11 4733 1 1 3 SER C C 4.379 -3.032 -4.254 1.00 . A A . 3 SER C 1 1 11 4734 1 1 3 SER CA C 3.460 -4.210 -3.945 1.00 . A A . 3 SER CA 1 1 11 4735 1 1 3 SER CB C 2.004 -3.746 -3.917 1.00 . A A . 3 SER CB 1 1 11 4736 1 1 3 SER H H 3.309 -4.559 -1.872 1.00 . A A . 3 SER H 1 1 11 4737 1 1 3 SER HA H 3.576 -4.956 -4.716 1.00 . A A . 3 SER HA 1 1 11 4738 1 1 3 SER HB2 H 1.888 -2.973 -3.171 1.00 . A A . 3 SER HB2 1 1 11 4739 1 1 3 SER HB3 H 1.733 -3.357 -4.887 1.00 . A A . 3 SER HB3 1 1 11 4740 1 1 3 SER HG H 1.094 -5.427 -4.345 1.00 . A A . 3 SER HG 1 1 11 4741 1 1 3 SER N N 3.803 -4.823 -2.673 1.00 . A A . 3 SER N 1 1 11 4742 1 1 3 SER O O 4.915 -2.396 -3.342 1.00 . A A . 3 SER O 1 1 11 4743 1 1 3 SER OG O 1.138 -4.823 -3.599 1.00 . A A . 3 SER OG 1 1 11 4744 1 1 4 LYS C C 4.764 -0.302 -5.537 1.00 . A A . 4 LYS C 1 1 11 4745 1 1 4 LYS CA C 5.378 -1.629 -5.978 1.00 . A A . 4 LYS CA 1 1 11 4746 1 1 4 LYS CB C 5.575 -1.647 -7.500 1.00 . A A . 4 LYS CB 1 1 11 4747 1 1 4 LYS CD C 6.635 -3.946 -7.647 1.00 . A A . 4 LYS CD 1 1 11 4748 1 1 4 LYS CE C 6.246 -4.755 -8.879 1.00 . A A . 4 LYS CE 1 1 11 4749 1 1 4 LYS CG C 6.780 -2.463 -7.959 1.00 . A A . 4 LYS CG 1 1 11 4750 1 1 4 LYS H H 4.073 -3.283 -6.217 1.00 . A A . 4 LYS H 1 1 11 4751 1 1 4 LYS HA H 6.341 -1.736 -5.500 1.00 . A A . 4 LYS HA 1 1 11 4752 1 1 4 LYS HB2 H 4.690 -2.064 -7.960 1.00 . A A . 4 LYS HB2 1 1 11 4753 1 1 4 LYS HB3 H 5.703 -0.631 -7.846 1.00 . A A . 4 LYS HB3 1 1 11 4754 1 1 4 LYS HD2 H 7.577 -4.318 -7.271 1.00 . A A . 4 LYS HD2 1 1 11 4755 1 1 4 LYS HD3 H 5.872 -4.071 -6.891 1.00 . A A . 4 LYS HD3 1 1 11 4756 1 1 4 LYS HE2 H 6.972 -4.571 -9.656 1.00 . A A . 4 LYS HE2 1 1 11 4757 1 1 4 LYS HE3 H 6.255 -5.803 -8.621 1.00 . A A . 4 LYS HE3 1 1 11 4758 1 1 4 LYS HG2 H 6.893 -2.344 -9.026 1.00 . A A . 4 LYS HG2 1 1 11 4759 1 1 4 LYS HG3 H 7.663 -2.085 -7.462 1.00 . A A . 4 LYS HG3 1 1 11 4760 1 1 4 LYS HZ1 H 4.890 -3.423 -9.755 1.00 . A A . 4 LYS HZ1 1 1 11 4761 1 1 4 LYS HZ2 H 4.188 -4.462 -8.623 1.00 . A A . 4 LYS HZ2 1 1 11 4762 1 1 4 LYS HZ3 H 4.618 -5.043 -10.154 1.00 . A A . 4 LYS HZ3 1 1 11 4763 1 1 4 LYS N N 4.543 -2.742 -5.541 1.00 . A A . 4 LYS N 1 1 11 4764 1 1 4 LYS NZ N 4.897 -4.397 -9.392 1.00 . A A . 4 LYS NZ 1 1 11 4765 1 1 4 LYS O O 3.581 -0.231 -5.212 1.00 . A A . 4 LYS O 1 1 11 4766 1 1 5 LYS C C 3.856 2.500 -5.799 1.00 . A A . 5 LYS C 1 1 11 4767 1 1 5 LYS CA C 5.106 2.046 -5.057 1.00 . A A . 5 LYS CA 1 1 11 4768 1 1 5 LYS CB C 6.216 3.095 -5.204 1.00 . A A . 5 LYS CB 1 1 11 4769 1 1 5 LYS CD C 6.808 5.469 -4.591 1.00 . A A . 5 LYS CD 1 1 11 4770 1 1 5 LYS CE C 6.296 6.900 -4.543 1.00 . A A . 5 LYS CE 1 1 11 4771 1 1 5 LYS CG C 5.717 4.522 -5.044 1.00 . A A . 5 LYS CG 1 1 11 4772 1 1 5 LYS H H 6.516 0.623 -5.740 1.00 . A A . 5 LYS H 1 1 11 4773 1 1 5 LYS HA H 4.855 1.958 -4.016 1.00 . A A . 5 LYS HA 1 1 11 4774 1 1 5 LYS HB2 H 6.971 2.913 -4.453 1.00 . A A . 5 LYS HB2 1 1 11 4775 1 1 5 LYS HB3 H 6.661 2.999 -6.183 1.00 . A A . 5 LYS HB3 1 1 11 4776 1 1 5 LYS HD2 H 7.139 5.180 -3.605 1.00 . A A . 5 LYS HD2 1 1 11 4777 1 1 5 LYS HD3 H 7.634 5.412 -5.284 1.00 . A A . 5 LYS HD3 1 1 11 4778 1 1 5 LYS HE2 H 6.424 7.345 -5.520 1.00 . A A . 5 LYS HE2 1 1 11 4779 1 1 5 LYS HE3 H 5.245 6.887 -4.294 1.00 . A A . 5 LYS HE3 1 1 11 4780 1 1 5 LYS HG2 H 5.330 4.868 -5.985 1.00 . A A . 5 LYS HG2 1 1 11 4781 1 1 5 LYS HG3 H 4.926 4.528 -4.318 1.00 . A A . 5 LYS HG3 1 1 11 4782 1 1 5 LYS HZ1 H 7.035 7.221 -2.611 1.00 . A A . 5 LYS HZ1 1 1 11 4783 1 1 5 LYS HZ2 H 6.572 8.639 -3.419 1.00 . A A . 5 LYS HZ2 1 1 11 4784 1 1 5 LYS HZ3 H 8.013 7.862 -3.840 1.00 . A A . 5 LYS HZ3 1 1 11 4785 1 1 5 LYS N N 5.575 0.739 -5.495 1.00 . A A . 5 LYS N 1 1 11 4786 1 1 5 LYS NZ N 7.031 7.717 -3.539 1.00 . A A . 5 LYS NZ 1 1 11 4787 1 1 5 LYS O O 2.802 2.673 -5.209 1.00 . A A . 5 LYS O 1 1 11 4788 1 1 6 TRP C C 1.915 1.987 -8.227 1.00 . A A . 6 TRP C 1 1 11 4789 1 1 6 TRP CA C 2.831 3.150 -7.858 1.00 . A A . 6 TRP CA 1 1 11 4790 1 1 6 TRP CB C 3.322 3.902 -9.095 1.00 . A A . 6 TRP CB 1 1 11 4791 1 1 6 TRP CD1 C 5.796 4.483 -8.722 1.00 . A A . 6 TRP CD1 1 1 11 4792 1 1 6 TRP CD2 C 4.418 6.235 -8.527 1.00 . A A . 6 TRP CD2 1 1 11 4793 1 1 6 TRP CE2 C 5.739 6.677 -8.325 1.00 . A A . 6 TRP CE2 1 1 11 4794 1 1 6 TRP CE3 C 3.381 7.167 -8.444 1.00 . A A . 6 TRP CE3 1 1 11 4795 1 1 6 TRP CG C 4.477 4.827 -8.805 1.00 . A A . 6 TRP CG 1 1 11 4796 1 1 6 TRP CH2 C 5.012 8.895 -7.970 1.00 . A A . 6 TRP CH2 1 1 11 4797 1 1 6 TRP CZ2 C 6.048 8.006 -8.046 1.00 . A A . 6 TRP CZ2 1 1 11 4798 1 1 6 TRP CZ3 C 3.688 8.485 -8.164 1.00 . A A . 6 TRP CZ3 1 1 11 4799 1 1 6 TRP H H 4.811 2.537 -7.516 1.00 . A A . 6 TRP H 1 1 11 4800 1 1 6 TRP HA H 2.268 3.836 -7.237 1.00 . A A . 6 TRP HA 1 1 11 4801 1 1 6 TRP HB2 H 3.643 3.189 -9.840 1.00 . A A . 6 TRP HB2 1 1 11 4802 1 1 6 TRP HB3 H 2.511 4.494 -9.494 1.00 . A A . 6 TRP HB3 1 1 11 4803 1 1 6 TRP HD1 H 6.169 3.483 -8.860 1.00 . A A . 6 TRP HD1 1 1 11 4804 1 1 6 TRP HE1 H 7.538 5.598 -8.364 1.00 . A A . 6 TRP HE1 1 1 11 4805 1 1 6 TRP HE3 H 2.356 6.870 -8.580 1.00 . A A . 6 TRP HE3 1 1 11 4806 1 1 6 TRP HH2 H 5.205 9.935 -7.753 1.00 . A A . 6 TRP HH2 1 1 11 4807 1 1 6 TRP HZ2 H 7.065 8.337 -7.895 1.00 . A A . 6 TRP HZ2 1 1 11 4808 1 1 6 TRP HZ3 H 2.897 9.218 -8.095 1.00 . A A . 6 TRP HZ3 1 1 11 4809 1 1 6 TRP N N 3.964 2.696 -7.080 1.00 . A A . 6 TRP N 1 1 11 4810 1 1 6 TRP NE1 N 6.562 5.590 -8.451 1.00 . A A . 6 TRP NE1 1 1 11 4811 1 1 6 TRP O O 1.273 2.002 -9.275 1.00 . A A . 6 TRP O 1 1 11 4812 1 1 7 GLU C C -0.455 0.168 -7.219 1.00 . A A . 7 GLU C 1 1 11 4813 1 1 7 GLU CA C 0.997 -0.174 -7.577 1.00 . A A . 7 GLU CA 1 1 11 4814 1 1 7 GLU CB C 1.464 -1.359 -6.731 1.00 . A A . 7 GLU CB 1 1 11 4815 1 1 7 GLU CD C 2.465 -3.245 -8.051 1.00 . A A . 7 GLU CD 1 1 11 4816 1 1 7 GLU CG C 1.227 -2.717 -7.365 1.00 . A A . 7 GLU CG 1 1 11 4817 1 1 7 GLU H H 2.404 1.041 -6.515 1.00 . A A . 7 GLU H 1 1 11 4818 1 1 7 GLU HA H 1.054 -0.436 -8.624 1.00 . A A . 7 GLU HA 1 1 11 4819 1 1 7 GLU HB2 H 2.523 -1.256 -6.546 1.00 . A A . 7 GLU HB2 1 1 11 4820 1 1 7 GLU HB3 H 0.942 -1.333 -5.785 1.00 . A A . 7 GLU HB3 1 1 11 4821 1 1 7 GLU HG2 H 0.934 -3.416 -6.595 1.00 . A A . 7 GLU HG2 1 1 11 4822 1 1 7 GLU HG3 H 0.436 -2.629 -8.095 1.00 . A A . 7 GLU HG3 1 1 11 4823 1 1 7 GLU N N 1.856 0.988 -7.348 1.00 . A A . 7 GLU N 1 1 11 4824 1 1 7 GLU O O -1.019 1.145 -7.708 1.00 . A A . 7 GLU O 1 1 11 4825 1 1 7 GLU OE1 O 2.863 -2.695 -9.096 1.00 . A A . 7 GLU OE1 1 1 11 4826 1 1 7 GLU OE2 O 3.081 -4.197 -7.524 1.00 . A A . 7 GLU OE2 1 1 11 4827 1 1 8 TYR C C -2.610 -1.202 -4.592 1.00 . A A . 8 TYR C 1 1 11 4828 1 1 8 TYR CA C -2.409 -0.444 -5.895 1.00 . A A . 8 TYR CA 1 1 11 4829 1 1 8 TYR CB C -3.405 -0.938 -6.951 1.00 . A A . 8 TYR CB 1 1 11 4830 1 1 8 TYR CD1 C -5.393 0.457 -6.245 1.00 . A A . 8 TYR CD1 1 1 11 4831 1 1 8 TYR CD2 C -5.691 -1.898 -6.458 1.00 . A A . 8 TYR CD2 1 1 11 4832 1 1 8 TYR CE1 C -6.715 0.594 -5.867 1.00 . A A . 8 TYR CE1 1 1 11 4833 1 1 8 TYR CE2 C -7.015 -1.767 -6.083 1.00 . A A . 8 TYR CE2 1 1 11 4834 1 1 8 TYR CG C -4.858 -0.789 -6.546 1.00 . A A . 8 TYR CG 1 1 11 4835 1 1 8 TYR CZ C -7.521 -0.520 -5.789 1.00 . A A . 8 TYR CZ 1 1 11 4836 1 1 8 TYR H H -0.534 -1.395 -5.986 1.00 . A A . 8 TYR H 1 1 11 4837 1 1 8 TYR HA H -2.560 0.613 -5.719 1.00 . A A . 8 TYR HA 1 1 11 4838 1 1 8 TYR HB2 H -3.259 -0.378 -7.862 1.00 . A A . 8 TYR HB2 1 1 11 4839 1 1 8 TYR HB3 H -3.221 -1.984 -7.146 1.00 . A A . 8 TYR HB3 1 1 11 4840 1 1 8 TYR HD1 H -4.759 1.329 -6.307 1.00 . A A . 8 TYR HD1 1 1 11 4841 1 1 8 TYR HD2 H -5.291 -2.874 -6.689 1.00 . A A . 8 TYR HD2 1 1 11 4842 1 1 8 TYR HE1 H -7.111 1.572 -5.638 1.00 . A A . 8 TYR HE1 1 1 11 4843 1 1 8 TYR HE2 H -7.646 -2.641 -6.021 1.00 . A A . 8 TYR HE2 1 1 11 4844 1 1 8 TYR HH H -9.163 0.474 -5.689 1.00 . A A . 8 TYR HH 1 1 11 4845 1 1 8 TYR N N -1.043 -0.639 -6.347 1.00 . A A . 8 TYR N 1 1 11 4846 1 1 8 TYR O O -2.189 -2.353 -4.469 1.00 . A A . 8 TYR O 1 1 11 4847 1 1 8 TYR OH O -8.837 -0.387 -5.411 1.00 . A A . 8 TYR OH 1 1 11 4848 1 1 9 CYS C C -4.577 -0.479 -1.568 1.00 . A A . 9 CYS C 1 1 11 4849 1 1 9 CYS CA C -3.460 -1.185 -2.327 1.00 . A A . 9 CYS CA 1 1 11 4850 1 1 9 CYS CB C -2.167 -1.177 -1.504 1.00 . A A . 9 CYS CB 1 1 11 4851 1 1 9 CYS H H -3.533 0.366 -3.766 1.00 . A A . 9 CYS H 1 1 11 4852 1 1 9 CYS HA H -3.755 -2.209 -2.503 1.00 . A A . 9 CYS HA 1 1 11 4853 1 1 9 CYS HB2 H -2.389 -1.482 -0.493 1.00 . A A . 9 CYS HB2 1 1 11 4854 1 1 9 CYS HB3 H -1.468 -1.875 -1.940 1.00 . A A . 9 CYS HB3 1 1 11 4855 1 1 9 CYS N N -3.231 -0.559 -3.618 1.00 . A A . 9 CYS N 1 1 11 4856 1 1 9 CYS O O -4.675 0.745 -1.583 1.00 . A A . 9 CYS O 1 1 11 4857 1 1 9 CYS SG S -1.348 0.451 -1.422 1.00 . A A . 9 CYS SG 1 1 11 4858 1 1 10 ILE C C -6.429 -1.172 1.321 1.00 . A A . 10 ILE C 1 1 11 4859 1 1 10 ILE CA C -6.532 -0.722 -0.143 1.00 . A A . 10 ILE CA 1 1 11 4860 1 1 10 ILE CB C -7.899 -1.119 -0.771 1.00 . A A . 10 ILE CB 1 1 11 4861 1 1 10 ILE CD1 C -9.117 0.883 0.244 1.00 . A A . 10 ILE CD1 1 1 11 4862 1 1 10 ILE CG1 C -9.071 -0.623 0.086 1.00 . A A . 10 ILE CG1 1 1 11 4863 1 1 10 ILE CG2 C -7.990 -2.624 -0.994 1.00 . A A . 10 ILE CG2 1 1 11 4864 1 1 10 ILE H H -5.292 -2.232 -0.939 1.00 . A A . 10 ILE H 1 1 11 4865 1 1 10 ILE HA H -6.451 0.356 -0.172 1.00 . A A . 10 ILE HA 1 1 11 4866 1 1 10 ILE HB H -7.959 -0.646 -1.740 1.00 . A A . 10 ILE HB 1 1 11 4867 1 1 10 ILE HD11 H -10.142 1.219 0.185 1.00 . A A . 10 ILE HD11 1 1 11 4868 1 1 10 ILE HD12 H -8.541 1.345 -0.543 1.00 . A A . 10 ILE HD12 1 1 11 4869 1 1 10 ILE HD13 H -8.702 1.156 1.203 1.00 . A A . 10 ILE HD13 1 1 11 4870 1 1 10 ILE HG12 H -9.999 -0.934 -0.370 1.00 . A A . 10 ILE HG12 1 1 11 4871 1 1 10 ILE HG13 H -8.997 -1.058 1.072 1.00 . A A . 10 ILE HG13 1 1 11 4872 1 1 10 ILE HG21 H -7.393 -2.899 -1.852 1.00 . A A . 10 ILE HG21 1 1 11 4873 1 1 10 ILE HG22 H -9.019 -2.901 -1.170 1.00 . A A . 10 ILE HG22 1 1 11 4874 1 1 10 ILE HG23 H -7.622 -3.142 -0.120 1.00 . A A . 10 ILE HG23 1 1 11 4875 1 1 10 ILE N N -5.419 -1.262 -0.909 1.00 . A A . 10 ILE N 1 1 11 4876 1 1 10 ILE O O -7.146 -2.060 1.785 1.00 . A A . 10 ILE O 1 1 11 4877 1 1 11 VAL C C -6.312 -0.197 4.332 1.00 . A A . 11 VAL C 1 1 11 4878 1 1 11 VAL CA C -5.279 -0.887 3.440 1.00 . A A . 11 VAL CA 1 1 11 4879 1 1 11 VAL CB C -3.852 -0.505 3.897 1.00 . A A . 11 VAL CB 1 1 11 4880 1 1 11 VAL CG1 C -2.817 -1.331 3.150 1.00 . A A . 11 VAL CG1 1 1 11 4881 1 1 11 VAL CG2 C -3.592 0.983 3.700 1.00 . A A . 11 VAL CG2 1 1 11 4882 1 1 11 VAL H H -4.948 0.131 1.618 1.00 . A A . 11 VAL H 1 1 11 4883 1 1 11 VAL HA H -5.391 -1.957 3.547 1.00 . A A . 11 VAL HA 1 1 11 4884 1 1 11 VAL HB H -3.764 -0.728 4.951 1.00 . A A . 11 VAL HB 1 1 11 4885 1 1 11 VAL HG11 H -3.280 -1.803 2.295 1.00 . A A . 11 VAL HG11 1 1 11 4886 1 1 11 VAL HG12 H -2.418 -2.090 3.808 1.00 . A A . 11 VAL HG12 1 1 11 4887 1 1 11 VAL HG13 H -2.016 -0.688 2.816 1.00 . A A . 11 VAL HG13 1 1 11 4888 1 1 11 VAL HG21 H -3.709 1.234 2.656 1.00 . A A . 11 VAL HG21 1 1 11 4889 1 1 11 VAL HG22 H -2.586 1.217 4.016 1.00 . A A . 11 VAL HG22 1 1 11 4890 1 1 11 VAL HG23 H -4.296 1.553 4.289 1.00 . A A . 11 VAL HG23 1 1 11 4891 1 1 11 VAL N N -5.502 -0.559 2.039 1.00 . A A . 11 VAL N 1 1 11 4892 1 1 11 VAL O O -6.700 0.944 4.081 1.00 . A A . 11 VAL O 1 1 11 4893 1 1 12 PRO C C -7.260 0.912 7.021 1.00 . A A . 12 PRO C 1 1 11 4894 1 1 12 PRO CA C -7.771 -0.340 6.311 1.00 . A A . 12 PRO CA 1 1 11 4895 1 1 12 PRO CB C -8.004 -1.472 7.319 1.00 . A A . 12 PRO CB 1 1 11 4896 1 1 12 PRO CD C -6.385 -2.258 5.747 1.00 . A A . 12 PRO CD 1 1 11 4897 1 1 12 PRO CG C -6.824 -2.371 7.179 1.00 . A A . 12 PRO CG 1 1 11 4898 1 1 12 PRO HA H -8.698 -0.109 5.804 1.00 . A A . 12 PRO HA 1 1 11 4899 1 1 12 PRO HB2 H -8.070 -1.061 8.316 1.00 . A A . 12 PRO HB2 1 1 11 4900 1 1 12 PRO HB3 H -8.922 -1.988 7.078 1.00 . A A . 12 PRO HB3 1 1 11 4901 1 1 12 PRO HD2 H -5.316 -2.386 5.667 1.00 . A A . 12 PRO HD2 1 1 11 4902 1 1 12 PRO HD3 H -6.902 -2.982 5.135 1.00 . A A . 12 PRO HD3 1 1 11 4903 1 1 12 PRO HG2 H -6.034 -2.046 7.839 1.00 . A A . 12 PRO HG2 1 1 11 4904 1 1 12 PRO HG3 H -7.109 -3.388 7.404 1.00 . A A . 12 PRO HG3 1 1 11 4905 1 1 12 PRO N N -6.781 -0.888 5.384 1.00 . A A . 12 PRO N 1 1 11 4906 1 1 12 PRO O O -6.089 0.987 7.398 1.00 . A A . 12 PRO O 1 1 11 4907 1 1 13 ILE C C -7.214 2.947 9.230 1.00 . A A . 13 ILE C 1 1 11 4908 1 1 13 ILE CA C -7.817 3.160 7.839 1.00 . A A . 13 ILE CA 1 1 11 4909 1 1 13 ILE CB C -9.069 4.061 7.956 1.00 . A A . 13 ILE CB 1 1 11 4910 1 1 13 ILE CD1 C -11.036 4.998 6.626 1.00 . A A . 13 ILE CD1 1 1 11 4911 1 1 13 ILE CG1 C -9.743 4.211 6.587 1.00 . A A . 13 ILE CG1 1 1 11 4912 1 1 13 ILE CG2 C -8.701 5.429 8.519 1.00 . A A . 13 ILE CG2 1 1 11 4913 1 1 13 ILE H H -9.057 1.757 6.853 1.00 . A A . 13 ILE H 1 1 11 4914 1 1 13 ILE HA H -7.092 3.668 7.222 1.00 . A A . 13 ILE HA 1 1 11 4915 1 1 13 ILE HB H -9.761 3.592 8.639 1.00 . A A . 13 ILE HB 1 1 11 4916 1 1 13 ILE HD11 H -10.821 6.050 6.505 1.00 . A A . 13 ILE HD11 1 1 11 4917 1 1 13 ILE HD12 H -11.528 4.837 7.573 1.00 . A A . 13 ILE HD12 1 1 11 4918 1 1 13 ILE HD13 H -11.682 4.669 5.825 1.00 . A A . 13 ILE HD13 1 1 11 4919 1 1 13 ILE HG12 H -9.067 4.719 5.915 1.00 . A A . 13 ILE HG12 1 1 11 4920 1 1 13 ILE HG13 H -9.963 3.230 6.194 1.00 . A A . 13 ILE HG13 1 1 11 4921 1 1 13 ILE HG21 H -8.153 5.989 7.776 1.00 . A A . 13 ILE HG21 1 1 11 4922 1 1 13 ILE HG22 H -8.089 5.303 9.399 1.00 . A A . 13 ILE HG22 1 1 11 4923 1 1 13 ILE HG23 H -9.601 5.965 8.780 1.00 . A A . 13 ILE HG23 1 1 11 4924 1 1 13 ILE N N -8.148 1.890 7.189 1.00 . A A . 13 ILE N 1 1 11 4925 1 1 13 ILE O O -6.417 3.755 9.701 1.00 . A A . 13 ILE O 1 1 11 4926 1 1 14 LEU C C -5.584 1.369 11.210 1.00 . A A . 14 LEU C 1 1 11 4927 1 1 14 LEU CA C -7.106 1.513 11.207 1.00 . A A . 14 LEU CA 1 1 11 4928 1 1 14 LEU CB C -7.750 0.214 11.718 1.00 . A A . 14 LEU CB 1 1 11 4929 1 1 14 LEU CD1 C -9.542 1.489 12.945 1.00 . A A . 14 LEU CD1 1 1 11 4930 1 1 14 LEU CD2 C -10.098 0.329 10.795 1.00 . A A . 14 LEU CD2 1 1 11 4931 1 1 14 LEU CG C -9.247 0.289 12.058 1.00 . A A . 14 LEU CG 1 1 11 4932 1 1 14 LEU H H -8.235 1.248 9.440 1.00 . A A . 14 LEU H 1 1 11 4933 1 1 14 LEU HA H -7.377 2.320 11.871 1.00 . A A . 14 LEU HA 1 1 11 4934 1 1 14 LEU HB2 H -7.615 -0.546 10.963 1.00 . A A . 14 LEU HB2 1 1 11 4935 1 1 14 LEU HB3 H -7.220 -0.094 12.608 1.00 . A A . 14 LEU HB3 1 1 11 4936 1 1 14 LEU HD11 H -8.618 1.863 13.361 1.00 . A A . 14 LEU HD11 1 1 11 4937 1 1 14 LEU HD12 H -10.203 1.192 13.746 1.00 . A A . 14 LEU HD12 1 1 11 4938 1 1 14 LEU HD13 H -10.012 2.263 12.358 1.00 . A A . 14 LEU HD13 1 1 11 4939 1 1 14 LEU HD21 H -9.543 -0.097 9.972 1.00 . A A . 14 LEU HD21 1 1 11 4940 1 1 14 LEU HD22 H -10.353 1.352 10.565 1.00 . A A . 14 LEU HD22 1 1 11 4941 1 1 14 LEU HD23 H -11.003 -0.240 10.952 1.00 . A A . 14 LEU HD23 1 1 11 4942 1 1 14 LEU HG H -9.520 -0.599 12.611 1.00 . A A . 14 LEU HG 1 1 11 4943 1 1 14 LEU N N -7.601 1.850 9.874 1.00 . A A . 14 LEU N 1 1 11 4944 1 1 14 LEU O O -4.930 1.622 12.219 1.00 . A A . 14 LEU O 1 1 11 4945 1 1 15 GLY C C -3.221 -0.578 9.451 1.00 . A A . 15 GLY C 1 1 11 4946 1 1 15 GLY CA C -3.597 0.794 9.966 1.00 . A A . 15 GLY CA 1 1 11 4947 1 1 15 GLY H H -5.601 0.779 9.298 1.00 . A A . 15 GLY H 1 1 11 4948 1 1 15 GLY HA2 H -3.206 1.541 9.291 1.00 . A A . 15 GLY HA2 1 1 11 4949 1 1 15 GLY HA3 H -3.152 0.936 10.941 1.00 . A A . 15 GLY HA3 1 1 11 4950 1 1 15 GLY N N -5.030 0.962 10.075 1.00 . A A . 15 GLY N 1 1 11 4951 1 1 15 GLY O O -3.669 -1.590 9.989 1.00 . A A . 15 GLY O 1 1 11 4952 1 1 16 PHE C C -0.904 -1.589 6.744 1.00 . A A . 16 PHE C 1 1 11 4953 1 1 16 PHE CA C -1.962 -1.862 7.806 1.00 . A A . 16 PHE CA 1 1 11 4954 1 1 16 PHE CB C -3.150 -2.603 7.179 1.00 . A A . 16 PHE CB 1 1 11 4955 1 1 16 PHE CD1 C -2.141 -4.886 7.462 1.00 . A A . 16 PHE CD1 1 1 11 4956 1 1 16 PHE CD2 C -3.182 -4.356 5.383 1.00 . A A . 16 PHE CD2 1 1 11 4957 1 1 16 PHE CE1 C -1.836 -6.149 6.991 1.00 . A A . 16 PHE CE1 1 1 11 4958 1 1 16 PHE CE2 C -2.880 -5.617 4.906 1.00 . A A . 16 PHE CE2 1 1 11 4959 1 1 16 PHE CG C -2.817 -3.976 6.665 1.00 . A A . 16 PHE CG 1 1 11 4960 1 1 16 PHE CZ C -2.205 -6.515 5.711 1.00 . A A . 16 PHE CZ 1 1 11 4961 1 1 16 PHE H H -2.086 0.236 8.023 1.00 . A A . 16 PHE H 1 1 11 4962 1 1 16 PHE HA H -1.532 -2.474 8.584 1.00 . A A . 16 PHE HA 1 1 11 4963 1 1 16 PHE HB2 H -3.928 -2.709 7.919 1.00 . A A . 16 PHE HB2 1 1 11 4964 1 1 16 PHE HB3 H -3.529 -2.020 6.351 1.00 . A A . 16 PHE HB3 1 1 11 4965 1 1 16 PHE HD1 H -1.851 -4.601 8.463 1.00 . A A . 16 PHE HD1 1 1 11 4966 1 1 16 PHE HD2 H -3.709 -3.655 4.752 1.00 . A A . 16 PHE HD2 1 1 11 4967 1 1 16 PHE HE1 H -1.308 -6.849 7.622 1.00 . A A . 16 PHE HE1 1 1 11 4968 1 1 16 PHE HE2 H -3.170 -5.900 3.905 1.00 . A A . 16 PHE HE2 1 1 11 4969 1 1 16 PHE HZ H -1.968 -7.500 5.340 1.00 . A A . 16 PHE HZ 1 1 11 4970 1 1 16 PHE N N -2.402 -0.610 8.406 1.00 . A A . 16 PHE N 1 1 11 4971 1 1 16 PHE O O -1.042 -0.664 5.946 1.00 . A A . 16 PHE O 1 1 11 4972 1 1 17 VAL C C 1.106 -3.362 4.725 1.00 . A A . 17 VAL C 1 1 11 4973 1 1 17 VAL CA C 1.209 -2.243 5.756 1.00 . A A . 17 VAL CA 1 1 11 4974 1 1 17 VAL CB C 2.613 -2.275 6.407 1.00 . A A . 17 VAL CB 1 1 11 4975 1 1 17 VAL CG1 C 3.599 -1.425 5.614 1.00 . A A . 17 VAL CG1 1 1 11 4976 1 1 17 VAL CG2 C 2.558 -1.820 7.858 1.00 . A A . 17 VAL CG2 1 1 11 4977 1 1 17 VAL H H 0.196 -3.123 7.387 1.00 . A A . 17 VAL H 1 1 11 4978 1 1 17 VAL HA H 1.078 -1.291 5.259 1.00 . A A . 17 VAL HA 1 1 11 4979 1 1 17 VAL HB H 2.967 -3.294 6.384 1.00 . A A . 17 VAL HB 1 1 11 4980 1 1 17 VAL HG11 H 4.267 -2.069 5.061 1.00 . A A . 17 VAL HG11 1 1 11 4981 1 1 17 VAL HG12 H 4.172 -0.811 6.293 1.00 . A A . 17 VAL HG12 1 1 11 4982 1 1 17 VAL HG13 H 3.057 -0.793 4.927 1.00 . A A . 17 VAL HG13 1 1 11 4983 1 1 17 VAL HG21 H 3.501 -1.370 8.131 1.00 . A A . 17 VAL HG21 1 1 11 4984 1 1 17 VAL HG22 H 2.367 -2.671 8.495 1.00 . A A . 17 VAL HG22 1 1 11 4985 1 1 17 VAL HG23 H 1.765 -1.096 7.979 1.00 . A A . 17 VAL HG23 1 1 11 4986 1 1 17 VAL N N 0.144 -2.397 6.733 1.00 . A A . 17 VAL N 1 1 11 4987 1 1 17 VAL O O 0.194 -4.183 4.794 1.00 . A A . 17 VAL O 1 1 11 4988 1 1 18 TYR C C 3.270 -4.208 1.836 1.00 . A A . 18 TYR C 1 1 11 4989 1 1 18 TYR CA C 2.080 -4.431 2.756 1.00 . A A . 18 TYR CA 1 1 11 4990 1 1 18 TYR CB C 0.788 -4.439 1.928 1.00 . A A . 18 TYR CB 1 1 11 4991 1 1 18 TYR CD1 C 0.863 -6.929 1.524 1.00 . A A . 18 TYR CD1 1 1 11 4992 1 1 18 TYR CD2 C 0.373 -5.507 -0.325 1.00 . A A . 18 TYR CD2 1 1 11 4993 1 1 18 TYR CE1 C 0.767 -8.037 0.705 1.00 . A A . 18 TYR CE1 1 1 11 4994 1 1 18 TYR CE2 C 0.272 -6.612 -1.150 1.00 . A A . 18 TYR CE2 1 1 11 4995 1 1 18 TYR CG C 0.668 -5.646 1.024 1.00 . A A . 18 TYR CG 1 1 11 4996 1 1 18 TYR CZ C 0.471 -7.874 -0.629 1.00 . A A . 18 TYR CZ 1 1 11 4997 1 1 18 TYR H H 2.760 -2.730 3.813 1.00 . A A . 18 TYR H 1 1 11 4998 1 1 18 TYR HA H 2.192 -5.389 3.243 1.00 . A A . 18 TYR HA 1 1 11 4999 1 1 18 TYR HB2 H -0.061 -4.435 2.595 1.00 . A A . 18 TYR HB2 1 1 11 5000 1 1 18 TYR HB3 H 0.758 -3.554 1.308 1.00 . A A . 18 TYR HB3 1 1 11 5001 1 1 18 TYR HD1 H 1.093 -7.053 2.572 1.00 . A A . 18 TYR HD1 1 1 11 5002 1 1 18 TYR HD2 H 0.218 -4.518 -0.729 1.00 . A A . 18 TYR HD2 1 1 11 5003 1 1 18 TYR HE1 H 0.921 -9.025 1.114 1.00 . A A . 18 TYR HE1 1 1 11 5004 1 1 18 TYR HE2 H 0.040 -6.484 -2.197 1.00 . A A . 18 TYR HE2 1 1 11 5005 1 1 18 TYR HH H -0.393 -8.888 -2.017 1.00 . A A . 18 TYR HH 1 1 11 5006 1 1 18 TYR N N 2.050 -3.402 3.793 1.00 . A A . 18 TYR N 1 1 11 5007 1 1 18 TYR O O 3.901 -5.156 1.379 1.00 . A A . 18 TYR O 1 1 11 5008 1 1 18 TYR OH O 0.378 -8.976 -1.450 1.00 . A A . 18 TYR OH 1 1 11 5009 1 1 19 CYS C C 6.006 -3.077 1.225 1.00 . A A . 19 CYS C 1 1 11 5010 1 1 19 CYS CA C 4.675 -2.564 0.699 1.00 . A A . 19 CYS CA 1 1 11 5011 1 1 19 CYS CB C 4.741 -1.057 0.603 1.00 . A A . 19 CYS CB 1 1 11 5012 1 1 19 CYS H H 3.012 -2.229 1.959 1.00 . A A . 19 CYS H 1 1 11 5013 1 1 19 CYS HA H 4.497 -2.973 -0.283 1.00 . A A . 19 CYS HA 1 1 11 5014 1 1 19 CYS HB2 H 4.764 -0.670 1.603 1.00 . A A . 19 CYS HB2 1 1 11 5015 1 1 19 CYS HB3 H 5.648 -0.758 0.087 1.00 . A A . 19 CYS HB3 1 1 11 5016 1 1 19 CYS N N 3.563 -2.941 1.565 1.00 . A A . 19 CYS N 1 1 11 5017 1 1 19 CYS O O 6.135 -3.405 2.407 1.00 . A A . 19 CYS O 1 1 11 5018 1 1 19 CYS SG S 3.317 -0.303 -0.241 1.00 . A A . 19 CYS SG 1 1 11 5019 1 1 20 CYS C C 8.898 -2.656 1.742 1.00 . A A . 20 CYS C 1 1 11 5020 1 1 20 CYS CA C 8.321 -3.603 0.705 1.00 . A A . 20 CYS CA 1 1 11 5021 1 1 20 CYS CB C 9.240 -3.640 -0.517 1.00 . A A . 20 CYS CB 1 1 11 5022 1 1 20 CYS H H 6.827 -2.859 -0.586 1.00 . A A . 20 CYS H 1 1 11 5023 1 1 20 CYS HA H 8.228 -4.598 1.124 1.00 . A A . 20 CYS HA 1 1 11 5024 1 1 20 CYS HB2 H 9.589 -2.640 -0.715 1.00 . A A . 20 CYS HB2 1 1 11 5025 1 1 20 CYS HB3 H 10.089 -4.270 -0.294 1.00 . A A . 20 CYS HB3 1 1 11 5026 1 1 20 CYS N N 6.995 -3.139 0.337 1.00 . A A . 20 CYS N 1 1 11 5027 1 1 20 CYS O O 8.525 -1.480 1.768 1.00 . A A . 20 CYS O 1 1 11 5028 1 1 20 CYS SG S 8.459 -4.275 -2.045 1.00 . A A . 20 CYS SG 1 1 11 5029 1 1 21 PRO C C 10.948 -1.002 3.067 1.00 . A A . 21 PRO C 1 1 11 5030 1 1 21 PRO CA C 10.389 -2.287 3.645 1.00 . A A . 21 PRO CA 1 1 11 5031 1 1 21 PRO CB C 11.496 -3.145 4.232 1.00 . A A . 21 PRO CB 1 1 11 5032 1 1 21 PRO CD C 10.301 -4.515 2.678 1.00 . A A . 21 PRO CD 1 1 11 5033 1 1 21 PRO CG C 11.053 -4.547 3.983 1.00 . A A . 21 PRO CG 1 1 11 5034 1 1 21 PRO HA H 9.670 -2.048 4.415 1.00 . A A . 21 PRO HA 1 1 11 5035 1 1 21 PRO HB2 H 12.430 -2.925 3.735 1.00 . A A . 21 PRO HB2 1 1 11 5036 1 1 21 PRO HB3 H 11.578 -2.932 5.284 1.00 . A A . 21 PRO HB3 1 1 11 5037 1 1 21 PRO HD2 H 10.967 -4.719 1.853 1.00 . A A . 21 PRO HD2 1 1 11 5038 1 1 21 PRO HD3 H 9.485 -5.220 2.689 1.00 . A A . 21 PRO HD3 1 1 11 5039 1 1 21 PRO HG2 H 11.913 -5.196 3.905 1.00 . A A . 21 PRO HG2 1 1 11 5040 1 1 21 PRO HG3 H 10.404 -4.876 4.782 1.00 . A A . 21 PRO HG3 1 1 11 5041 1 1 21 PRO N N 9.797 -3.132 2.616 1.00 . A A . 21 PRO N 1 1 11 5042 1 1 21 PRO O O 11.877 -1.006 2.260 1.00 . A A . 21 PRO O 1 1 11 5043 1 1 22 GLY C C 9.570 2.133 2.363 1.00 . A A . 22 GLY C 1 1 11 5044 1 1 22 GLY CA C 10.730 1.393 3.001 1.00 . A A . 22 GLY CA 1 1 11 5045 1 1 22 GLY H H 9.596 -0.005 4.101 1.00 . A A . 22 GLY H 1 1 11 5046 1 1 22 GLY HA2 H 11.101 1.972 3.832 1.00 . A A . 22 GLY HA2 1 1 11 5047 1 1 22 GLY HA3 H 11.517 1.281 2.270 1.00 . A A . 22 GLY HA3 1 1 11 5048 1 1 22 GLY N N 10.340 0.086 3.477 1.00 . A A . 22 GLY N 1 1 11 5049 1 1 22 GLY O O 9.464 3.350 2.488 1.00 . A A . 22 GLY O 1 1 11 5050 1 1 23 LEU C C 6.306 1.806 1.896 1.00 . A A . 23 LEU C 1 1 11 5051 1 1 23 LEU CA C 7.543 1.980 1.024 1.00 . A A . 23 LEU CA 1 1 11 5052 1 1 23 LEU CB C 7.314 1.326 -0.346 1.00 . A A . 23 LEU CB 1 1 11 5053 1 1 23 LEU CD1 C 9.614 0.572 -1.068 1.00 . A A . 23 LEU CD1 1 1 11 5054 1 1 23 LEU CD2 C 7.919 1.227 -2.775 1.00 . A A . 23 LEU CD2 1 1 11 5055 1 1 23 LEU CG C 8.443 1.494 -1.375 1.00 . A A . 23 LEU CG 1 1 11 5056 1 1 23 LEU H H 8.826 0.420 1.624 1.00 . A A . 23 LEU H 1 1 11 5057 1 1 23 LEU HA H 7.733 3.034 0.889 1.00 . A A . 23 LEU HA 1 1 11 5058 1 1 23 LEU HB2 H 7.159 0.269 -0.190 1.00 . A A . 23 LEU HB2 1 1 11 5059 1 1 23 LEU HB3 H 6.412 1.743 -0.769 1.00 . A A . 23 LEU HB3 1 1 11 5060 1 1 23 LEU HD11 H 9.851 0.630 -0.016 1.00 . A A . 23 LEU HD11 1 1 11 5061 1 1 23 LEU HD12 H 10.473 0.876 -1.648 1.00 . A A . 23 LEU HD12 1 1 11 5062 1 1 23 LEU HD13 H 9.349 -0.443 -1.323 1.00 . A A . 23 LEU HD13 1 1 11 5063 1 1 23 LEU HD21 H 7.448 2.120 -3.160 1.00 . A A . 23 LEU HD21 1 1 11 5064 1 1 23 LEU HD22 H 7.198 0.425 -2.743 1.00 . A A . 23 LEU HD22 1 1 11 5065 1 1 23 LEU HD23 H 8.740 0.949 -3.418 1.00 . A A . 23 LEU HD23 1 1 11 5066 1 1 23 LEU HG H 8.801 2.512 -1.341 1.00 . A A . 23 LEU HG 1 1 11 5067 1 1 23 LEU N N 8.698 1.394 1.683 1.00 . A A . 23 LEU N 1 1 11 5068 1 1 23 LEU O O 6.188 0.814 2.623 1.00 . A A . 23 LEU O 1 1 11 5069 1 1 24 ILE C C 2.923 2.970 1.795 1.00 . A A . 24 ILE C 1 1 11 5070 1 1 24 ILE CA C 4.167 2.676 2.630 1.00 . A A . 24 ILE CA 1 1 11 5071 1 1 24 ILE CB C 4.204 3.640 3.838 1.00 . A A . 24 ILE CB 1 1 11 5072 1 1 24 ILE CD1 C 4.564 6.079 4.507 1.00 . A A . 24 ILE CD1 1 1 11 5073 1 1 24 ILE CG1 C 4.600 5.054 3.392 1.00 . A A . 24 ILE CG1 1 1 11 5074 1 1 24 ILE CG2 C 5.157 3.121 4.906 1.00 . A A . 24 ILE CG2 1 1 11 5075 1 1 24 ILE H H 5.526 3.530 1.232 1.00 . A A . 24 ILE H 1 1 11 5076 1 1 24 ILE HA H 4.094 1.668 3.012 1.00 . A A . 24 ILE HA 1 1 11 5077 1 1 24 ILE HB H 3.213 3.672 4.266 1.00 . A A . 24 ILE HB 1 1 11 5078 1 1 24 ILE HD11 H 5.357 6.797 4.359 1.00 . A A . 24 ILE HD11 1 1 11 5079 1 1 24 ILE HD12 H 4.699 5.582 5.456 1.00 . A A . 24 ILE HD12 1 1 11 5080 1 1 24 ILE HD13 H 3.611 6.586 4.498 1.00 . A A . 24 ILE HD13 1 1 11 5081 1 1 24 ILE HG12 H 5.604 5.030 2.998 1.00 . A A . 24 ILE HG12 1 1 11 5082 1 1 24 ILE HG13 H 3.922 5.381 2.618 1.00 . A A . 24 ILE HG13 1 1 11 5083 1 1 24 ILE HG21 H 5.828 2.396 4.468 1.00 . A A . 24 ILE HG21 1 1 11 5084 1 1 24 ILE HG22 H 4.591 2.655 5.698 1.00 . A A . 24 ILE HG22 1 1 11 5085 1 1 24 ILE HG23 H 5.730 3.945 5.308 1.00 . A A . 24 ILE HG23 1 1 11 5086 1 1 24 ILE N N 5.385 2.755 1.832 1.00 . A A . 24 ILE N 1 1 11 5087 1 1 24 ILE O O 2.876 3.943 1.048 1.00 . A A . 24 ILE O 1 1 11 5088 1 1 25 CYS C C -0.092 3.511 1.717 1.00 . A A . 25 CYS C 1 1 11 5089 1 1 25 CYS CA C 0.663 2.285 1.200 1.00 . A A . 25 CYS CA 1 1 11 5090 1 1 25 CYS CB C -0.207 1.033 1.334 1.00 . A A . 25 CYS CB 1 1 11 5091 1 1 25 CYS H H 2.015 1.353 2.540 1.00 . A A . 25 CYS H 1 1 11 5092 1 1 25 CYS HA H 0.906 2.438 0.159 1.00 . A A . 25 CYS HA 1 1 11 5093 1 1 25 CYS HB2 H 0.336 0.183 0.948 1.00 . A A . 25 CYS HB2 1 1 11 5094 1 1 25 CYS HB3 H -0.428 0.868 2.377 1.00 . A A . 25 CYS HB3 1 1 11 5095 1 1 25 CYS N N 1.916 2.115 1.932 1.00 . A A . 25 CYS N 1 1 11 5096 1 1 25 CYS O O -0.058 3.809 2.912 1.00 . A A . 25 CYS O 1 1 11 5097 1 1 25 CYS SG S -1.792 1.128 0.437 1.00 . A A . 25 CYS SG 1 1 11 5098 1 1 26 GLY C C -2.779 5.592 0.403 1.00 . A A . 26 GLY C 1 1 11 5099 1 1 26 GLY CA C -1.497 5.408 1.200 1.00 . A A . 26 GLY CA 1 1 11 5100 1 1 26 GLY H H -0.740 3.943 -0.127 1.00 . A A . 26 GLY H 1 1 11 5101 1 1 26 GLY HA2 H -1.746 5.337 2.248 1.00 . A A . 26 GLY HA2 1 1 11 5102 1 1 26 GLY HA3 H -0.867 6.272 1.048 1.00 . A A . 26 GLY HA3 1 1 11 5103 1 1 26 GLY N N -0.759 4.222 0.816 1.00 . A A . 26 GLY N 1 1 11 5104 1 1 26 GLY O O -3.740 4.847 0.595 1.00 . A A . 26 GLY O 1 1 11 5105 1 1 27 PRO C C -4.290 5.859 -2.398 1.00 . A A . 27 PRO C 1 1 11 5106 1 1 27 PRO CA C -4.013 6.903 -1.316 1.00 . A A . 27 PRO CA 1 1 11 5107 1 1 27 PRO CB C -3.676 8.259 -1.958 1.00 . A A . 27 PRO CB 1 1 11 5108 1 1 27 PRO CD C -1.734 7.536 -0.764 1.00 . A A . 27 PRO CD 1 1 11 5109 1 1 27 PRO CG C -2.464 8.756 -1.241 1.00 . A A . 27 PRO CG 1 1 11 5110 1 1 27 PRO HA H -4.894 7.007 -0.701 1.00 . A A . 27 PRO HA 1 1 11 5111 1 1 27 PRO HB2 H -3.479 8.119 -3.011 1.00 . A A . 27 PRO HB2 1 1 11 5112 1 1 27 PRO HB3 H -4.510 8.934 -1.832 1.00 . A A . 27 PRO HB3 1 1 11 5113 1 1 27 PRO HD2 H -1.080 7.157 -1.537 1.00 . A A . 27 PRO HD2 1 1 11 5114 1 1 27 PRO HD3 H -1.177 7.752 0.135 1.00 . A A . 27 PRO HD3 1 1 11 5115 1 1 27 PRO HG2 H -1.843 9.323 -1.919 1.00 . A A . 27 PRO HG2 1 1 11 5116 1 1 27 PRO HG3 H -2.758 9.368 -0.402 1.00 . A A . 27 PRO HG3 1 1 11 5117 1 1 27 PRO N N -2.828 6.597 -0.492 1.00 . A A . 27 PRO N 1 1 11 5118 1 1 27 PRO O O -4.254 6.161 -3.590 1.00 . A A . 27 PRO O 1 1 11 5119 1 1 28 PHE C C -3.598 3.144 -3.667 1.00 . A A . 28 PHE C 1 1 11 5120 1 1 28 PHE CA C -4.832 3.497 -2.840 1.00 . A A . 28 PHE CA 1 1 11 5121 1 1 28 PHE CB C -6.058 3.754 -3.756 1.00 . A A . 28 PHE CB 1 1 11 5122 1 1 28 PHE CD1 C -7.581 4.650 -1.959 1.00 . A A . 28 PHE CD1 1 1 11 5123 1 1 28 PHE CD2 C -8.421 2.974 -3.432 1.00 . A A . 28 PHE CD2 1 1 11 5124 1 1 28 PHE CE1 C -8.797 4.688 -1.304 1.00 . A A . 28 PHE CE1 1 1 11 5125 1 1 28 PHE CE2 C -9.640 3.009 -2.782 1.00 . A A . 28 PHE CE2 1 1 11 5126 1 1 28 PHE CG C -7.377 3.793 -3.029 1.00 . A A . 28 PHE CG 1 1 11 5127 1 1 28 PHE CZ C -9.827 3.866 -1.716 1.00 . A A . 28 PHE CZ 1 1 11 5128 1 1 28 PHE H H -4.545 4.482 -0.986 1.00 . A A . 28 PHE H 1 1 11 5129 1 1 28 PHE HA H -5.055 2.653 -2.202 1.00 . A A . 28 PHE HA 1 1 11 5130 1 1 28 PHE HB2 H -5.943 4.699 -4.267 1.00 . A A . 28 PHE HB2 1 1 11 5131 1 1 28 PHE HB3 H -6.116 2.963 -4.494 1.00 . A A . 28 PHE HB3 1 1 11 5132 1 1 28 PHE HD1 H -6.776 5.293 -1.635 1.00 . A A . 28 PHE HD1 1 1 11 5133 1 1 28 PHE HD2 H -8.275 2.301 -4.264 1.00 . A A . 28 PHE HD2 1 1 11 5134 1 1 28 PHE HE1 H -8.941 5.360 -0.470 1.00 . A A . 28 PHE HE1 1 1 11 5135 1 1 28 PHE HE2 H -10.444 2.366 -3.107 1.00 . A A . 28 PHE HE2 1 1 11 5136 1 1 28 PHE HZ H -10.779 3.895 -1.206 1.00 . A A . 28 PHE HZ 1 1 11 5137 1 1 28 PHE N N -4.552 4.634 -1.956 1.00 . A A . 28 PHE N 1 1 11 5138 1 1 28 PHE O O -3.677 2.368 -4.617 1.00 . A A . 28 PHE O 1 1 11 5139 1 1 29 VAL C C -0.082 3.548 -2.890 1.00 . A A . 29 VAL C 1 1 11 5140 1 1 29 VAL CA C -1.180 3.433 -3.927 1.00 . A A . 29 VAL CA 1 1 11 5141 1 1 29 VAL CB C -0.874 4.422 -5.087 1.00 . A A . 29 VAL CB 1 1 11 5142 1 1 29 VAL CG1 C -1.833 4.227 -6.252 1.00 . A A . 29 VAL CG1 1 1 11 5143 1 1 29 VAL CG2 C -0.917 5.863 -4.596 1.00 . A A . 29 VAL CG2 1 1 11 5144 1 1 29 VAL H H -2.448 4.271 -2.469 1.00 . A A . 29 VAL H 1 1 11 5145 1 1 29 VAL HA H -1.197 2.424 -4.320 1.00 . A A . 29 VAL HA 1 1 11 5146 1 1 29 VAL HB H 0.129 4.221 -5.448 1.00 . A A . 29 VAL HB 1 1 11 5147 1 1 29 VAL HG11 H -2.735 3.749 -5.899 1.00 . A A . 29 VAL HG11 1 1 11 5148 1 1 29 VAL HG12 H -1.367 3.606 -7.002 1.00 . A A . 29 VAL HG12 1 1 11 5149 1 1 29 VAL HG13 H -2.079 5.187 -6.681 1.00 . A A . 29 VAL HG13 1 1 11 5150 1 1 29 VAL HG21 H -0.853 5.880 -3.519 1.00 . A A . 29 VAL HG21 1 1 11 5151 1 1 29 VAL HG22 H -1.844 6.323 -4.908 1.00 . A A . 29 VAL HG22 1 1 11 5152 1 1 29 VAL HG23 H -0.085 6.412 -5.015 1.00 . A A . 29 VAL HG23 1 1 11 5153 1 1 29 VAL N N -2.450 3.689 -3.266 1.00 . A A . 29 VAL N 1 1 11 5154 1 1 29 VAL O O -0.289 4.144 -1.834 1.00 . A A . 29 VAL O 1 1 11 5155 1 1 30 CYS C C 3.014 4.301 -2.525 1.00 . A A . 30 CYS C 1 1 11 5156 1 1 30 CYS CA C 2.185 3.049 -2.259 1.00 . A A . 30 CYS CA 1 1 11 5157 1 1 30 CYS CB C 3.050 1.798 -2.412 1.00 . A A . 30 CYS CB 1 1 11 5158 1 1 30 CYS H H 1.183 2.536 -4.042 1.00 . A A . 30 CYS H 1 1 11 5159 1 1 30 CYS HA H 1.793 3.091 -1.255 1.00 . A A . 30 CYS HA 1 1 11 5160 1 1 30 CYS HB2 H 2.415 0.945 -2.603 1.00 . A A . 30 CYS HB2 1 1 11 5161 1 1 30 CYS HB3 H 3.715 1.935 -3.253 1.00 . A A . 30 CYS HB3 1 1 11 5162 1 1 30 CYS N N 1.069 2.991 -3.180 1.00 . A A . 30 CYS N 1 1 11 5163 1 1 30 CYS O O 2.999 4.843 -3.632 1.00 . A A . 30 CYS O 1 1 11 5164 1 1 30 CYS SG S 4.074 1.433 -0.958 1.00 . A A . 30 CYS SG 1 1 11 5165 1 1 31 VAL C C 5.898 5.730 -0.969 1.00 . A A . 31 VAL C 1 1 11 5166 1 1 31 VAL CA C 4.569 5.942 -1.676 1.00 . A A . 31 VAL CA 1 1 11 5167 1 1 31 VAL CB C 3.893 7.224 -1.125 1.00 . A A . 31 VAL CB 1 1 11 5168 1 1 31 VAL CG1 C 2.687 7.612 -1.967 1.00 . A A . 31 VAL CG1 1 1 11 5169 1 1 31 VAL CG2 C 3.490 7.044 0.332 1.00 . A A . 31 VAL CG2 1 1 11 5170 1 1 31 VAL H H 3.721 4.297 -0.655 1.00 . A A . 31 VAL H 1 1 11 5171 1 1 31 VAL HA H 4.755 6.078 -2.737 1.00 . A A . 31 VAL HA 1 1 11 5172 1 1 31 VAL HB H 4.611 8.030 -1.177 1.00 . A A . 31 VAL HB 1 1 11 5173 1 1 31 VAL HG11 H 1.869 7.889 -1.317 1.00 . A A . 31 VAL HG11 1 1 11 5174 1 1 31 VAL HG12 H 2.392 6.775 -2.581 1.00 . A A . 31 VAL HG12 1 1 11 5175 1 1 31 VAL HG13 H 2.944 8.450 -2.598 1.00 . A A . 31 VAL HG13 1 1 11 5176 1 1 31 VAL HG21 H 3.000 7.940 0.684 1.00 . A A . 31 VAL HG21 1 1 11 5177 1 1 31 VAL HG22 H 4.371 6.858 0.929 1.00 . A A . 31 VAL HG22 1 1 11 5178 1 1 31 VAL HG23 H 2.815 6.207 0.418 1.00 . A A . 31 VAL HG23 1 1 11 5179 1 1 31 VAL N N 3.736 4.764 -1.524 1.00 . A A . 31 VAL N 1 1 11 5180 1 1 31 VAL O O 5.977 4.811 -0.129 1.00 . A A . 31 VAL O 1 1 11 5181 1 1 31 VAL OXT O 6.855 6.474 -1.282 1.00 . A A . 31 VAL OXT 1 1 12 5182 1 1 1 ALA C C 5.190 -8.702 -0.413 1.00 . A A . 1 ALA C 1 1 12 5183 1 1 1 ALA CA C 5.336 -10.173 -0.757 1.00 . A A . 1 ALA CA 1 1 12 5184 1 1 1 ALA CB C 3.979 -10.783 -1.075 1.00 . A A . 1 ALA CB 1 1 12 5185 1 1 1 ALA H1 H 5.505 -11.799 0.531 1.00 . A A . 1 ALA H1 1 1 12 5186 1 1 1 ALA H2 H 5.902 -10.311 1.235 1.00 . A A . 1 ALA H2 1 1 12 5187 1 1 1 ALA H3 H 6.980 -11.055 0.164 1.00 . A A . 1 ALA H3 1 1 12 5188 1 1 1 ALA HA H 5.967 -10.271 -1.630 1.00 . A A . 1 ALA HA 1 1 12 5189 1 1 1 ALA HB1 H 3.201 -10.189 -0.618 1.00 . A A . 1 ALA HB1 1 1 12 5190 1 1 1 ALA HB2 H 3.937 -11.790 -0.687 1.00 . A A . 1 ALA HB2 1 1 12 5191 1 1 1 ALA HB3 H 3.835 -10.804 -2.145 1.00 . A A . 1 ALA HB3 1 1 12 5192 1 1 1 ALA N N 5.976 -10.887 0.371 1.00 . A A . 1 ALA N 1 1 12 5193 1 1 1 ALA O O 4.950 -8.362 0.742 1.00 . A A . 1 ALA O 1 1 12 5194 1 1 2 CYS C C 4.763 -5.734 -2.477 1.00 . A A . 2 CYS C 1 1 12 5195 1 1 2 CYS CA C 5.248 -6.408 -1.199 1.00 . A A . 2 CYS CA 1 1 12 5196 1 1 2 CYS CB C 6.598 -5.840 -0.763 1.00 . A A . 2 CYS CB 1 1 12 5197 1 1 2 CYS H H 5.554 -8.175 -2.305 1.00 . A A . 2 CYS H 1 1 12 5198 1 1 2 CYS HA H 4.524 -6.222 -0.416 1.00 . A A . 2 CYS HA 1 1 12 5199 1 1 2 CYS HB2 H 6.483 -4.786 -0.564 1.00 . A A . 2 CYS HB2 1 1 12 5200 1 1 2 CYS HB3 H 6.913 -6.328 0.150 1.00 . A A . 2 CYS HB3 1 1 12 5201 1 1 2 CYS N N 5.352 -7.842 -1.405 1.00 . A A . 2 CYS N 1 1 12 5202 1 1 2 CYS O O 5.221 -6.058 -3.571 1.00 . A A . 2 CYS O 1 1 12 5203 1 1 2 CYS SG S 7.947 -6.011 -1.971 1.00 . A A . 2 CYS SG 1 1 12 5204 1 1 3 SER C C 4.206 -3.039 -3.987 1.00 . A A . 3 SER C 1 1 12 5205 1 1 3 SER CA C 3.252 -4.115 -3.472 1.00 . A A . 3 SER CA 1 1 12 5206 1 1 3 SER CB C 1.915 -3.485 -3.078 1.00 . A A . 3 SER CB 1 1 12 5207 1 1 3 SER H H 3.475 -4.622 -1.437 1.00 . A A . 3 SER H 1 1 12 5208 1 1 3 SER HA H 3.083 -4.836 -4.257 1.00 . A A . 3 SER HA 1 1 12 5209 1 1 3 SER HB2 H 2.084 -2.716 -2.341 1.00 . A A . 3 SER HB2 1 1 12 5210 1 1 3 SER HB3 H 1.453 -3.051 -3.953 1.00 . A A . 3 SER HB3 1 1 12 5211 1 1 3 SER HG H 0.579 -4.910 -3.246 1.00 . A A . 3 SER HG 1 1 12 5212 1 1 3 SER N N 3.816 -4.820 -2.332 1.00 . A A . 3 SER N 1 1 12 5213 1 1 3 SER O O 4.935 -2.419 -3.209 1.00 . A A . 3 SER O 1 1 12 5214 1 1 3 SER OG O 1.036 -4.457 -2.532 1.00 . A A . 3 SER OG 1 1 12 5215 1 1 4 LYS C C 4.561 -0.422 -5.461 1.00 . A A . 4 LYS C 1 1 12 5216 1 1 4 LYS CA C 5.020 -1.800 -5.925 1.00 . A A . 4 LYS CA 1 1 12 5217 1 1 4 LYS CB C 4.927 -1.895 -7.451 1.00 . A A . 4 LYS CB 1 1 12 5218 1 1 4 LYS CD C 4.512 -3.592 -9.263 1.00 . A A . 4 LYS CD 1 1 12 5219 1 1 4 LYS CE C 4.671 -2.541 -10.353 1.00 . A A . 4 LYS CE 1 1 12 5220 1 1 4 LYS CG C 5.321 -3.253 -8.016 1.00 . A A . 4 LYS CG 1 1 12 5221 1 1 4 LYS H H 3.568 -3.336 -5.856 1.00 . A A . 4 LYS H 1 1 12 5222 1 1 4 LYS HA H 6.041 -1.961 -5.613 1.00 . A A . 4 LYS HA 1 1 12 5223 1 1 4 LYS HB2 H 3.912 -1.688 -7.750 1.00 . A A . 4 LYS HB2 1 1 12 5224 1 1 4 LYS HB3 H 5.578 -1.149 -7.884 1.00 . A A . 4 LYS HB3 1 1 12 5225 1 1 4 LYS HD2 H 4.848 -4.543 -9.647 1.00 . A A . 4 LYS HD2 1 1 12 5226 1 1 4 LYS HD3 H 3.468 -3.661 -8.992 1.00 . A A . 4 LYS HD3 1 1 12 5227 1 1 4 LYS HE2 H 4.521 -1.564 -9.920 1.00 . A A . 4 LYS HE2 1 1 12 5228 1 1 4 LYS HE3 H 5.671 -2.607 -10.756 1.00 . A A . 4 LYS HE3 1 1 12 5229 1 1 4 LYS HG2 H 6.369 -3.236 -8.274 1.00 . A A . 4 LYS HG2 1 1 12 5230 1 1 4 LYS HG3 H 5.144 -4.010 -7.265 1.00 . A A . 4 LYS HG3 1 1 12 5231 1 1 4 LYS HZ1 H 3.789 -3.687 -11.862 1.00 . A A . 4 LYS HZ1 1 1 12 5232 1 1 4 LYS HZ2 H 3.838 -2.032 -12.201 1.00 . A A . 4 LYS HZ2 1 1 12 5233 1 1 4 LYS HZ3 H 2.711 -2.633 -11.084 1.00 . A A . 4 LYS HZ3 1 1 12 5234 1 1 4 LYS N N 4.183 -2.816 -5.298 1.00 . A A . 4 LYS N 1 1 12 5235 1 1 4 LYS NZ N 3.690 -2.738 -11.456 1.00 . A A . 4 LYS NZ 1 1 12 5236 1 1 4 LYS O O 3.381 -0.230 -5.168 1.00 . A A . 4 LYS O 1 1 12 5237 1 1 5 LYS C C 3.968 2.463 -5.658 1.00 . A A . 5 LYS C 1 1 12 5238 1 1 5 LYS CA C 5.149 1.867 -4.904 1.00 . A A . 5 LYS CA 1 1 12 5239 1 1 5 LYS CB C 6.360 2.807 -5.002 1.00 . A A . 5 LYS CB 1 1 12 5240 1 1 5 LYS CD C 7.167 5.104 -4.326 1.00 . A A . 5 LYS CD 1 1 12 5241 1 1 5 LYS CE C 6.798 6.578 -4.267 1.00 . A A . 5 LYS CE 1 1 12 5242 1 1 5 LYS CG C 5.994 4.272 -4.804 1.00 . A A . 5 LYS CG 1 1 12 5243 1 1 5 LYS H H 6.414 0.312 -5.593 1.00 . A A . 5 LYS H 1 1 12 5244 1 1 5 LYS HA H 4.868 1.782 -3.871 1.00 . A A . 5 LYS HA 1 1 12 5245 1 1 5 LYS HB2 H 7.081 2.530 -4.247 1.00 . A A . 5 LYS HB2 1 1 12 5246 1 1 5 LYS HB3 H 6.810 2.699 -5.977 1.00 . A A . 5 LYS HB3 1 1 12 5247 1 1 5 LYS HD2 H 7.453 4.774 -3.338 1.00 . A A . 5 LYS HD2 1 1 12 5248 1 1 5 LYS HD3 H 7.994 4.974 -5.007 1.00 . A A . 5 LYS HD3 1 1 12 5249 1 1 5 LYS HE2 H 6.969 7.015 -5.242 1.00 . A A . 5 LYS HE2 1 1 12 5250 1 1 5 LYS HE3 H 5.749 6.667 -4.018 1.00 . A A . 5 LYS HE3 1 1 12 5251 1 1 5 LYS HG2 H 5.645 4.678 -5.737 1.00 . A A . 5 LYS HG2 1 1 12 5252 1 1 5 LYS HG3 H 5.203 4.333 -4.080 1.00 . A A . 5 LYS HG3 1 1 12 5253 1 1 5 LYS HZ1 H 7.400 6.945 -2.297 1.00 . A A . 5 LYS HZ1 1 1 12 5254 1 1 5 LYS HZ2 H 7.380 8.325 -3.283 1.00 . A A . 5 LYS HZ2 1 1 12 5255 1 1 5 LYS HZ3 H 8.621 7.190 -3.450 1.00 . A A . 5 LYS HZ3 1 1 12 5256 1 1 5 LYS N N 5.486 0.524 -5.368 1.00 . A A . 5 LYS N 1 1 12 5257 1 1 5 LYS NZ N 7.608 7.313 -3.260 1.00 . A A . 5 LYS NZ 1 1 12 5258 1 1 5 LYS O O 2.911 2.684 -5.094 1.00 . A A . 5 LYS O 1 1 12 5259 1 1 6 TRP C C 2.066 2.236 -8.143 1.00 . A A . 6 TRP C 1 1 12 5260 1 1 6 TRP CA C 3.065 3.301 -7.710 1.00 . A A . 6 TRP CA 1 1 12 5261 1 1 6 TRP CB C 3.648 4.050 -8.909 1.00 . A A . 6 TRP CB 1 1 12 5262 1 1 6 TRP CD1 C 6.148 4.445 -8.468 1.00 . A A . 6 TRP CD1 1 1 12 5263 1 1 6 TRP CD2 C 4.884 6.274 -8.221 1.00 . A A . 6 TRP CD2 1 1 12 5264 1 1 6 TRP CE2 C 6.228 6.619 -7.976 1.00 . A A . 6 TRP CE2 1 1 12 5265 1 1 6 TRP CE3 C 3.909 7.267 -8.115 1.00 . A A . 6 TRP CE3 1 1 12 5266 1 1 6 TRP CG C 4.856 4.880 -8.559 1.00 . A A . 6 TRP CG 1 1 12 5267 1 1 6 TRP CH2 C 5.639 8.862 -7.536 1.00 . A A . 6 TRP CH2 1 1 12 5268 1 1 6 TRP CZ2 C 6.616 7.912 -7.634 1.00 . A A . 6 TRP CZ2 1 1 12 5269 1 1 6 TRP CZ3 C 4.294 8.549 -7.770 1.00 . A A . 6 TRP CZ3 1 1 12 5270 1 1 6 TRP H H 4.985 2.517 -7.344 1.00 . A A . 6 TRP H 1 1 12 5271 1 1 6 TRP HA H 2.546 4.012 -7.075 1.00 . A A . 6 TRP HA 1 1 12 5272 1 1 6 TRP HB2 H 3.942 3.334 -9.664 1.00 . A A . 6 TRP HB2 1 1 12 5273 1 1 6 TRP HB3 H 2.895 4.709 -9.316 1.00 . A A . 6 TRP HB3 1 1 12 5274 1 1 6 TRP HD1 H 6.458 3.428 -8.644 1.00 . A A . 6 TRP HD1 1 1 12 5275 1 1 6 TRP HE1 H 7.953 5.427 -8.033 1.00 . A A . 6 TRP HE1 1 1 12 5276 1 1 6 TRP HE3 H 2.871 7.045 -8.282 1.00 . A A . 6 TRP HE3 1 1 12 5277 1 1 6 TRP HH2 H 5.894 9.877 -7.269 1.00 . A A . 6 TRP HH2 1 1 12 5278 1 1 6 TRP HZ2 H 7.649 8.169 -7.450 1.00 . A A . 6 TRP HZ2 1 1 12 5279 1 1 6 TRP HZ3 H 3.551 9.329 -7.683 1.00 . A A . 6 TRP HZ3 1 1 12 5280 1 1 6 TRP N N 4.137 2.718 -6.926 1.00 . A A . 6 TRP N 1 1 12 5281 1 1 6 TRP NE1 N 6.980 5.486 -8.137 1.00 . A A . 6 TRP NE1 1 1 12 5282 1 1 6 TRP O O 1.408 2.363 -9.173 1.00 . A A . 6 TRP O 1 1 12 5283 1 1 7 GLU C C -0.109 0.176 -6.557 1.00 . A A . 7 GLU C 1 1 12 5284 1 1 7 GLU CA C 1.008 0.120 -7.588 1.00 . A A . 7 GLU CA 1 1 12 5285 1 1 7 GLU CB C 1.708 -1.238 -7.523 1.00 . A A . 7 GLU CB 1 1 12 5286 1 1 7 GLU CD C 0.518 -2.345 -9.441 1.00 . A A . 7 GLU CD 1 1 12 5287 1 1 7 GLU CG C 0.843 -2.403 -7.966 1.00 . A A . 7 GLU CG 1 1 12 5288 1 1 7 GLU H H 2.495 1.172 -6.498 1.00 . A A . 7 GLU H 1 1 12 5289 1 1 7 GLU HA H 0.590 0.264 -8.573 1.00 . A A . 7 GLU HA 1 1 12 5290 1 1 7 GLU HB2 H 2.582 -1.208 -8.157 1.00 . A A . 7 GLU HB2 1 1 12 5291 1 1 7 GLU HB3 H 2.022 -1.417 -6.505 1.00 . A A . 7 GLU HB3 1 1 12 5292 1 1 7 GLU HG2 H 1.368 -3.324 -7.762 1.00 . A A . 7 GLU HG2 1 1 12 5293 1 1 7 GLU HG3 H -0.082 -2.382 -7.406 1.00 . A A . 7 GLU HG3 1 1 12 5294 1 1 7 GLU N N 1.946 1.199 -7.326 1.00 . A A . 7 GLU N 1 1 12 5295 1 1 7 GLU O O 0.124 0.573 -5.411 1.00 . A A . 7 GLU O 1 1 12 5296 1 1 7 GLU OE1 O 1.456 -2.481 -10.258 1.00 . A A . 7 GLU OE1 1 1 12 5297 1 1 7 GLU OE2 O -0.660 -2.152 -9.782 1.00 . A A . 7 GLU OE2 1 1 12 5298 1 1 8 TYR C C -2.218 -1.207 -4.910 1.00 . A A . 8 TYR C 1 1 12 5299 1 1 8 TYR CA C -2.439 -0.204 -6.038 1.00 . A A . 8 TYR CA 1 1 12 5300 1 1 8 TYR CB C -3.744 -0.531 -6.777 1.00 . A A . 8 TYR CB 1 1 12 5301 1 1 8 TYR CD1 C -5.314 0.119 -4.900 1.00 . A A . 8 TYR CD1 1 1 12 5302 1 1 8 TYR CD2 C -5.599 -2.018 -5.916 1.00 . A A . 8 TYR CD2 1 1 12 5303 1 1 8 TYR CE1 C -6.366 -0.143 -4.043 1.00 . A A . 8 TYR CE1 1 1 12 5304 1 1 8 TYR CE2 C -6.654 -2.285 -5.065 1.00 . A A . 8 TYR CE2 1 1 12 5305 1 1 8 TYR CG C -4.912 -0.812 -5.851 1.00 . A A . 8 TYR CG 1 1 12 5306 1 1 8 TYR CZ C -7.033 -1.345 -4.129 1.00 . A A . 8 TYR CZ 1 1 12 5307 1 1 8 TYR H H -1.437 -0.525 -7.876 1.00 . A A . 8 TYR H 1 1 12 5308 1 1 8 TYR HA H -2.511 0.787 -5.613 1.00 . A A . 8 TYR HA 1 1 12 5309 1 1 8 TYR HB2 H -4.012 0.305 -7.405 1.00 . A A . 8 TYR HB2 1 1 12 5310 1 1 8 TYR HB3 H -3.591 -1.404 -7.393 1.00 . A A . 8 TYR HB3 1 1 12 5311 1 1 8 TYR HD1 H -4.792 1.062 -4.836 1.00 . A A . 8 TYR HD1 1 1 12 5312 1 1 8 TYR HD2 H -5.301 -2.753 -6.649 1.00 . A A . 8 TYR HD2 1 1 12 5313 1 1 8 TYR HE1 H -6.662 0.594 -3.312 1.00 . A A . 8 TYR HE1 1 1 12 5314 1 1 8 TYR HE2 H -7.177 -3.229 -5.133 1.00 . A A . 8 TYR HE2 1 1 12 5315 1 1 8 TYR HH H -8.176 -0.882 -2.654 1.00 . A A . 8 TYR HH 1 1 12 5316 1 1 8 TYR N N -1.310 -0.215 -6.952 1.00 . A A . 8 TYR N 1 1 12 5317 1 1 8 TYR O O -2.202 -2.420 -5.133 1.00 . A A . 8 TYR O 1 1 12 5318 1 1 8 TYR OH O -8.078 -1.610 -3.274 1.00 . A A . 8 TYR OH 1 1 12 5319 1 1 9 CYS C C -3.219 -2.069 -2.060 1.00 . A A . 9 CYS C 1 1 12 5320 1 1 9 CYS CA C -1.870 -1.564 -2.554 1.00 . A A . 9 CYS CA 1 1 12 5321 1 1 9 CYS CB C -1.110 -0.829 -1.446 1.00 . A A . 9 CYS CB 1 1 12 5322 1 1 9 CYS H H -2.096 0.269 -3.574 1.00 . A A . 9 CYS H 1 1 12 5323 1 1 9 CYS HA H -1.284 -2.412 -2.878 1.00 . A A . 9 CYS HA 1 1 12 5324 1 1 9 CYS HB2 H -1.270 -1.343 -0.510 1.00 . A A . 9 CYS HB2 1 1 12 5325 1 1 9 CYS HB3 H -0.054 -0.842 -1.679 1.00 . A A . 9 CYS HB3 1 1 12 5326 1 1 9 CYS N N -2.063 -0.702 -3.700 1.00 . A A . 9 CYS N 1 1 12 5327 1 1 9 CYS O O -4.075 -1.289 -1.643 1.00 . A A . 9 CYS O 1 1 12 5328 1 1 9 CYS SG S -1.605 0.908 -1.209 1.00 . A A . 9 CYS SG 1 1 12 5329 1 1 10 ILE C C -4.825 -3.902 -0.210 1.00 . A A . 10 ILE C 1 1 12 5330 1 1 10 ILE CA C -4.660 -3.995 -1.724 1.00 . A A . 10 ILE CA 1 1 12 5331 1 1 10 ILE CB C -4.725 -5.474 -2.164 1.00 . A A . 10 ILE CB 1 1 12 5332 1 1 10 ILE CD1 C -4.232 -7.044 -4.116 1.00 . A A . 10 ILE CD1 1 1 12 5333 1 1 10 ILE CG1 C -4.302 -5.611 -3.631 1.00 . A A . 10 ILE CG1 1 1 12 5334 1 1 10 ILE CG2 C -6.131 -6.025 -1.966 1.00 . A A . 10 ILE CG2 1 1 12 5335 1 1 10 ILE H H -2.697 -3.940 -2.501 1.00 . A A . 10 ILE H 1 1 12 5336 1 1 10 ILE HA H -5.471 -3.461 -2.200 1.00 . A A . 10 ILE HA 1 1 12 5337 1 1 10 ILE HB H -4.049 -6.043 -1.545 1.00 . A A . 10 ILE HB 1 1 12 5338 1 1 10 ILE HD11 H -5.210 -7.358 -4.453 1.00 . A A . 10 ILE HD11 1 1 12 5339 1 1 10 ILE HD12 H -3.907 -7.681 -3.308 1.00 . A A . 10 ILE HD12 1 1 12 5340 1 1 10 ILE HD13 H -3.531 -7.112 -4.934 1.00 . A A . 10 ILE HD13 1 1 12 5341 1 1 10 ILE HG12 H -5.013 -5.087 -4.253 1.00 . A A . 10 ILE HG12 1 1 12 5342 1 1 10 ILE HG13 H -3.325 -5.168 -3.759 1.00 . A A . 10 ILE HG13 1 1 12 5343 1 1 10 ILE HG21 H -6.817 -5.502 -2.617 1.00 . A A . 10 ILE HG21 1 1 12 5344 1 1 10 ILE HG22 H -6.432 -5.883 -0.938 1.00 . A A . 10 ILE HG22 1 1 12 5345 1 1 10 ILE HG23 H -6.142 -7.078 -2.202 1.00 . A A . 10 ILE HG23 1 1 12 5346 1 1 10 ILE N N -3.410 -3.377 -2.139 1.00 . A A . 10 ILE N 1 1 12 5347 1 1 10 ILE O O -3.907 -4.227 0.545 1.00 . A A . 10 ILE O 1 1 12 5348 1 1 11 VAL C C -7.561 -4.022 2.059 1.00 . A A . 11 VAL C 1 1 12 5349 1 1 11 VAL CA C -6.271 -3.300 1.650 1.00 . A A . 11 VAL CA 1 1 12 5350 1 1 11 VAL CB C -6.354 -1.809 2.055 1.00 . A A . 11 VAL CB 1 1 12 5351 1 1 11 VAL CG1 C -4.962 -1.200 2.139 1.00 . A A . 11 VAL CG1 1 1 12 5352 1 1 11 VAL CG2 C -7.213 -1.022 1.071 1.00 . A A . 11 VAL CG2 1 1 12 5353 1 1 11 VAL H H -6.681 -3.196 -0.424 1.00 . A A . 11 VAL H 1 1 12 5354 1 1 11 VAL HA H -5.446 -3.743 2.189 1.00 . A A . 11 VAL HA 1 1 12 5355 1 1 11 VAL HB H -6.811 -1.745 3.031 1.00 . A A . 11 VAL HB 1 1 12 5356 1 1 11 VAL HG11 H -4.523 -1.436 3.098 1.00 . A A . 11 VAL HG11 1 1 12 5357 1 1 11 VAL HG12 H -5.030 -0.128 2.030 1.00 . A A . 11 VAL HG12 1 1 12 5358 1 1 11 VAL HG13 H -4.343 -1.605 1.351 1.00 . A A . 11 VAL HG13 1 1 12 5359 1 1 11 VAL HG21 H -6.683 -0.135 0.759 1.00 . A A . 11 VAL HG21 1 1 12 5360 1 1 11 VAL HG22 H -8.139 -0.738 1.550 1.00 . A A . 11 VAL HG22 1 1 12 5361 1 1 11 VAL HG23 H -7.427 -1.637 0.210 1.00 . A A . 11 VAL HG23 1 1 12 5362 1 1 11 VAL N N -5.991 -3.448 0.226 1.00 . A A . 11 VAL N 1 1 12 5363 1 1 11 VAL O O -8.549 -3.389 2.428 1.00 . A A . 11 VAL O 1 1 12 5364 1 1 12 PRO C C -9.107 -5.983 3.854 1.00 . A A . 12 PRO C 1 1 12 5365 1 1 12 PRO CA C -8.739 -6.166 2.384 1.00 . A A . 12 PRO CA 1 1 12 5366 1 1 12 PRO CB C -8.307 -7.614 2.118 1.00 . A A . 12 PRO CB 1 1 12 5367 1 1 12 PRO CD C -6.447 -6.222 1.592 1.00 . A A . 12 PRO CD 1 1 12 5368 1 1 12 PRO CG C -7.125 -7.507 1.219 1.00 . A A . 12 PRO CG 1 1 12 5369 1 1 12 PRO HA H -9.594 -5.924 1.770 1.00 . A A . 12 PRO HA 1 1 12 5370 1 1 12 PRO HB2 H -8.051 -8.092 3.052 1.00 . A A . 12 PRO HB2 1 1 12 5371 1 1 12 PRO HB3 H -9.114 -8.151 1.643 1.00 . A A . 12 PRO HB3 1 1 12 5372 1 1 12 PRO HD2 H -5.757 -6.380 2.409 1.00 . A A . 12 PRO HD2 1 1 12 5373 1 1 12 PRO HD3 H -5.936 -5.801 0.739 1.00 . A A . 12 PRO HD3 1 1 12 5374 1 1 12 PRO HG2 H -6.460 -8.343 1.382 1.00 . A A . 12 PRO HG2 1 1 12 5375 1 1 12 PRO HG3 H -7.446 -7.477 0.188 1.00 . A A . 12 PRO HG3 1 1 12 5376 1 1 12 PRO N N -7.568 -5.368 2.007 1.00 . A A . 12 PRO N 1 1 12 5377 1 1 12 PRO O O -8.235 -5.760 4.701 1.00 . A A . 12 PRO O 1 1 12 5378 1 1 13 ILE C C -10.230 -6.908 6.444 1.00 . A A . 13 ILE C 1 1 12 5379 1 1 13 ILE CA C -10.899 -5.910 5.503 1.00 . A A . 13 ILE CA 1 1 12 5380 1 1 13 ILE CB C -12.434 -6.095 5.556 1.00 . A A . 13 ILE CB 1 1 12 5381 1 1 13 ILE CD1 C -12.840 -3.665 4.871 1.00 . A A . 13 ILE CD1 1 1 12 5382 1 1 13 ILE CG1 C -13.125 -5.127 4.588 1.00 . A A . 13 ILE CG1 1 1 12 5383 1 1 13 ILE CG2 C -12.955 -5.894 6.974 1.00 . A A . 13 ILE CG2 1 1 12 5384 1 1 13 ILE H H -11.036 -6.243 3.422 1.00 . A A . 13 ILE H 1 1 12 5385 1 1 13 ILE HA H -10.664 -4.906 5.829 1.00 . A A . 13 ILE HA 1 1 12 5386 1 1 13 ILE HB H -12.659 -7.107 5.259 1.00 . A A . 13 ILE HB 1 1 12 5387 1 1 13 ILE HD11 H -12.063 -3.589 5.617 1.00 . A A . 13 ILE HD11 1 1 12 5388 1 1 13 ILE HD12 H -13.738 -3.188 5.237 1.00 . A A . 13 ILE HD12 1 1 12 5389 1 1 13 ILE HD13 H -12.519 -3.178 3.963 1.00 . A A . 13 ILE HD13 1 1 12 5390 1 1 13 ILE HG12 H -12.793 -5.337 3.582 1.00 . A A . 13 ILE HG12 1 1 12 5391 1 1 13 ILE HG13 H -14.194 -5.274 4.646 1.00 . A A . 13 ILE HG13 1 1 12 5392 1 1 13 ILE HG21 H -13.778 -6.572 7.154 1.00 . A A . 13 ILE HG21 1 1 12 5393 1 1 13 ILE HG22 H -13.295 -4.877 7.092 1.00 . A A . 13 ILE HG22 1 1 12 5394 1 1 13 ILE HG23 H -12.164 -6.095 7.681 1.00 . A A . 13 ILE HG23 1 1 12 5395 1 1 13 ILE N N -10.399 -6.070 4.143 1.00 . A A . 13 ILE N 1 1 12 5396 1 1 13 ILE O O -10.371 -8.118 6.276 1.00 . A A . 13 ILE O 1 1 12 5397 1 1 14 LEU C C -7.749 -8.101 7.747 1.00 . A A . 14 LEU C 1 1 12 5398 1 1 14 LEU CA C -8.777 -7.183 8.410 1.00 . A A . 14 LEU CA 1 1 12 5399 1 1 14 LEU CB C -9.750 -8.008 9.269 1.00 . A A . 14 LEU CB 1 1 12 5400 1 1 14 LEU CD1 C -11.161 -6.091 10.106 1.00 . A A . 14 LEU CD1 1 1 12 5401 1 1 14 LEU CD2 C -11.137 -8.262 11.342 1.00 . A A . 14 LEU CD2 1 1 12 5402 1 1 14 LEU CG C -10.318 -7.293 10.503 1.00 . A A . 14 LEU CG 1 1 12 5403 1 1 14 LEU H H -9.430 -5.400 7.476 1.00 . A A . 14 LEU H 1 1 12 5404 1 1 14 LEU HA H -8.248 -6.498 9.055 1.00 . A A . 14 LEU HA 1 1 12 5405 1 1 14 LEU HB2 H -10.577 -8.309 8.643 1.00 . A A . 14 LEU HB2 1 1 12 5406 1 1 14 LEU HB3 H -9.233 -8.896 9.602 1.00 . A A . 14 LEU HB3 1 1 12 5407 1 1 14 LEU HD11 H -10.663 -5.184 10.417 1.00 . A A . 14 LEU HD11 1 1 12 5408 1 1 14 LEU HD12 H -12.126 -6.154 10.586 1.00 . A A . 14 LEU HD12 1 1 12 5409 1 1 14 LEU HD13 H -11.291 -6.081 9.034 1.00 . A A . 14 LEU HD13 1 1 12 5410 1 1 14 LEU HD21 H -11.376 -9.135 10.753 1.00 . A A . 14 LEU HD21 1 1 12 5411 1 1 14 LEU HD22 H -12.050 -7.781 11.658 1.00 . A A . 14 LEU HD22 1 1 12 5412 1 1 14 LEU HD23 H -10.567 -8.558 12.210 1.00 . A A . 14 LEU HD23 1 1 12 5413 1 1 14 LEU HG H -9.498 -6.937 11.111 1.00 . A A . 14 LEU HG 1 1 12 5414 1 1 14 LEU N N -9.496 -6.375 7.421 1.00 . A A . 14 LEU N 1 1 12 5415 1 1 14 LEU O O -7.472 -9.194 8.240 1.00 . A A . 14 LEU O 1 1 12 5416 1 1 15 GLY C C -5.469 -7.645 4.874 1.00 . A A . 15 GLY C 1 1 12 5417 1 1 15 GLY CA C -6.186 -8.442 5.941 1.00 . A A . 15 GLY CA 1 1 12 5418 1 1 15 GLY H H -7.436 -6.768 6.285 1.00 . A A . 15 GLY H 1 1 12 5419 1 1 15 GLY HA2 H -5.462 -8.804 6.655 1.00 . A A . 15 GLY HA2 1 1 12 5420 1 1 15 GLY HA3 H -6.675 -9.286 5.477 1.00 . A A . 15 GLY HA3 1 1 12 5421 1 1 15 GLY N N -7.178 -7.648 6.638 1.00 . A A . 15 GLY N 1 1 12 5422 1 1 15 GLY O O -5.228 -8.140 3.775 1.00 . A A . 15 GLY O 1 1 12 5423 1 1 16 PHE C C -2.993 -5.969 4.065 1.00 . A A . 16 PHE C 1 1 12 5424 1 1 16 PHE CA C -4.436 -5.523 4.275 1.00 . A A . 16 PHE CA 1 1 12 5425 1 1 16 PHE CB C -4.497 -4.069 4.767 1.00 . A A . 16 PHE CB 1 1 12 5426 1 1 16 PHE CD1 C -2.789 -3.964 6.618 1.00 . A A . 16 PHE CD1 1 1 12 5427 1 1 16 PHE CD2 C -5.083 -3.612 7.166 1.00 . A A . 16 PHE CD2 1 1 12 5428 1 1 16 PHE CE1 C -2.442 -3.788 7.944 1.00 . A A . 16 PHE CE1 1 1 12 5429 1 1 16 PHE CE2 C -4.743 -3.435 8.494 1.00 . A A . 16 PHE CE2 1 1 12 5430 1 1 16 PHE CG C -4.113 -3.879 6.213 1.00 . A A . 16 PHE CG 1 1 12 5431 1 1 16 PHE CZ C -3.421 -3.523 8.883 1.00 . A A . 16 PHE CZ 1 1 12 5432 1 1 16 PHE H H -5.351 -6.076 6.096 1.00 . A A . 16 PHE H 1 1 12 5433 1 1 16 PHE HA H -4.950 -5.586 3.327 1.00 . A A . 16 PHE HA 1 1 12 5434 1 1 16 PHE HB2 H -3.827 -3.470 4.170 1.00 . A A . 16 PHE HB2 1 1 12 5435 1 1 16 PHE HB3 H -5.505 -3.701 4.642 1.00 . A A . 16 PHE HB3 1 1 12 5436 1 1 16 PHE HD1 H -2.024 -4.170 5.886 1.00 . A A . 16 PHE HD1 1 1 12 5437 1 1 16 PHE HD2 H -6.118 -3.543 6.862 1.00 . A A . 16 PHE HD2 1 1 12 5438 1 1 16 PHE HE1 H -1.408 -3.858 8.246 1.00 . A A . 16 PHE HE1 1 1 12 5439 1 1 16 PHE HE2 H -5.509 -3.229 9.225 1.00 . A A . 16 PHE HE2 1 1 12 5440 1 1 16 PHE HZ H -3.152 -3.386 9.919 1.00 . A A . 16 PHE HZ 1 1 12 5441 1 1 16 PHE N N -5.131 -6.406 5.203 1.00 . A A . 16 PHE N 1 1 12 5442 1 1 16 PHE O O -2.357 -6.497 4.979 1.00 . A A . 16 PHE O 1 1 12 5443 1 1 17 VAL C C -0.156 -5.039 2.977 1.00 . A A . 17 VAL C 1 1 12 5444 1 1 17 VAL CA C -1.118 -6.144 2.535 1.00 . A A . 17 VAL CA 1 1 12 5445 1 1 17 VAL CB C -0.940 -6.421 1.020 1.00 . A A . 17 VAL CB 1 1 12 5446 1 1 17 VAL CG1 C 0.208 -7.392 0.770 1.00 . A A . 17 VAL CG1 1 1 12 5447 1 1 17 VAL CG2 C -2.228 -6.956 0.408 1.00 . A A . 17 VAL CG2 1 1 12 5448 1 1 17 VAL H H -3.041 -5.339 2.168 1.00 . A A . 17 VAL H 1 1 12 5449 1 1 17 VAL HA H -0.884 -7.048 3.079 1.00 . A A . 17 VAL HA 1 1 12 5450 1 1 17 VAL HB H -0.697 -5.489 0.536 1.00 . A A . 17 VAL HB 1 1 12 5451 1 1 17 VAL HG11 H 0.549 -7.796 1.713 1.00 . A A . 17 VAL HG11 1 1 12 5452 1 1 17 VAL HG12 H 1.021 -6.872 0.287 1.00 . A A . 17 VAL HG12 1 1 12 5453 1 1 17 VAL HG13 H -0.132 -8.198 0.137 1.00 . A A . 17 VAL HG13 1 1 12 5454 1 1 17 VAL HG21 H -2.563 -7.817 0.968 1.00 . A A . 17 VAL HG21 1 1 12 5455 1 1 17 VAL HG22 H -2.046 -7.243 -0.618 1.00 . A A . 17 VAL HG22 1 1 12 5456 1 1 17 VAL HG23 H -2.987 -6.189 0.439 1.00 . A A . 17 VAL HG23 1 1 12 5457 1 1 17 VAL N N -2.485 -5.763 2.857 1.00 . A A . 17 VAL N 1 1 12 5458 1 1 17 VAL O O -0.557 -4.081 3.639 1.00 . A A . 17 VAL O 1 1 12 5459 1 1 18 TYR C C 3.230 -4.177 1.930 1.00 . A A . 18 TYR C 1 1 12 5460 1 1 18 TYR CA C 2.115 -4.193 2.969 1.00 . A A . 18 TYR CA 1 1 12 5461 1 1 18 TYR CB C 2.686 -4.512 4.359 1.00 . A A . 18 TYR CB 1 1 12 5462 1 1 18 TYR CD1 C 3.531 -2.163 4.791 1.00 . A A . 18 TYR CD1 1 1 12 5463 1 1 18 TYR CD2 C 4.947 -3.996 5.358 1.00 . A A . 18 TYR CD2 1 1 12 5464 1 1 18 TYR CE1 C 4.496 -1.277 5.234 1.00 . A A . 18 TYR CE1 1 1 12 5465 1 1 18 TYR CE2 C 5.916 -3.115 5.803 1.00 . A A . 18 TYR CE2 1 1 12 5466 1 1 18 TYR CG C 3.741 -3.537 4.845 1.00 . A A . 18 TYR CG 1 1 12 5467 1 1 18 TYR CZ C 5.686 -1.758 5.738 1.00 . A A . 18 TYR CZ 1 1 12 5468 1 1 18 TYR H H 1.366 -5.953 2.080 1.00 . A A . 18 TYR H 1 1 12 5469 1 1 18 TYR HA H 1.646 -3.221 2.994 1.00 . A A . 18 TYR HA 1 1 12 5470 1 1 18 TYR HB2 H 1.880 -4.508 5.078 1.00 . A A . 18 TYR HB2 1 1 12 5471 1 1 18 TYR HB3 H 3.131 -5.496 4.337 1.00 . A A . 18 TYR HB3 1 1 12 5472 1 1 18 TYR HD1 H 2.599 -1.790 4.396 1.00 . A A . 18 TYR HD1 1 1 12 5473 1 1 18 TYR HD2 H 5.127 -5.060 5.407 1.00 . A A . 18 TYR HD2 1 1 12 5474 1 1 18 TYR HE1 H 4.315 -0.213 5.184 1.00 . A A . 18 TYR HE1 1 1 12 5475 1 1 18 TYR HE2 H 6.848 -3.492 6.198 1.00 . A A . 18 TYR HE2 1 1 12 5476 1 1 18 TYR HH H 6.792 -1.009 7.123 1.00 . A A . 18 TYR HH 1 1 12 5477 1 1 18 TYR N N 1.105 -5.173 2.608 1.00 . A A . 18 TYR N 1 1 12 5478 1 1 18 TYR O O 3.626 -5.224 1.411 1.00 . A A . 18 TYR O 1 1 12 5479 1 1 18 TYR OH O 6.649 -0.879 6.182 1.00 . A A . 18 TYR OH 1 1 12 5480 1 1 19 CYS C C 6.125 -3.276 1.241 1.00 . A A . 19 CYS C 1 1 12 5481 1 1 19 CYS CA C 4.798 -2.820 0.663 1.00 . A A . 19 CYS CA 1 1 12 5482 1 1 19 CYS CB C 4.899 -1.360 0.266 1.00 . A A . 19 CYS CB 1 1 12 5483 1 1 19 CYS H H 3.362 -2.190 2.079 1.00 . A A . 19 CYS H 1 1 12 5484 1 1 19 CYS HA H 4.565 -3.411 -0.210 1.00 . A A . 19 CYS HA 1 1 12 5485 1 1 19 CYS HB2 H 4.913 -0.773 1.167 1.00 . A A . 19 CYS HB2 1 1 12 5486 1 1 19 CYS HB3 H 5.819 -1.187 -0.280 1.00 . A A . 19 CYS HB3 1 1 12 5487 1 1 19 CYS N N 3.725 -2.988 1.631 1.00 . A A . 19 CYS N 1 1 12 5488 1 1 19 CYS O O 6.220 -3.595 2.426 1.00 . A A . 19 CYS O 1 1 12 5489 1 1 19 CYS SG S 3.504 -0.774 -0.744 1.00 . A A . 19 CYS SG 1 1 12 5490 1 1 20 CYS C C 9.005 -2.637 1.791 1.00 . A A . 20 CYS C 1 1 12 5491 1 1 20 CYS CA C 8.471 -3.695 0.851 1.00 . A A . 20 CYS CA 1 1 12 5492 1 1 20 CYS CB C 9.427 -3.895 -0.324 1.00 . A A . 20 CYS CB 1 1 12 5493 1 1 20 CYS H H 7.023 -3.019 -0.526 1.00 . A A . 20 CYS H 1 1 12 5494 1 1 20 CYS HA H 8.365 -4.632 1.383 1.00 . A A . 20 CYS HA 1 1 12 5495 1 1 20 CYS HB2 H 9.069 -3.328 -1.159 1.00 . A A . 20 CYS HB2 1 1 12 5496 1 1 20 CYS HB3 H 10.406 -3.532 -0.042 1.00 . A A . 20 CYS HB3 1 1 12 5497 1 1 20 CYS N N 7.152 -3.294 0.404 1.00 . A A . 20 CYS N 1 1 12 5498 1 1 20 CYS O O 8.563 -1.488 1.739 1.00 . A A . 20 CYS O 1 1 12 5499 1 1 20 CYS SG S 9.607 -5.634 -0.863 1.00 . A A . 20 CYS SG 1 1 12 5500 1 1 21 PRO C C 11.012 -0.808 2.943 1.00 . A A . 21 PRO C 1 1 12 5501 1 1 21 PRO CA C 10.512 -2.064 3.622 1.00 . A A . 21 PRO CA 1 1 12 5502 1 1 21 PRO CB C 11.651 -2.838 4.260 1.00 . A A . 21 PRO CB 1 1 12 5503 1 1 21 PRO CD C 10.516 -4.345 2.797 1.00 . A A . 21 PRO CD 1 1 12 5504 1 1 21 PRO CG C 11.256 -4.270 4.108 1.00 . A A . 21 PRO CG 1 1 12 5505 1 1 21 PRO HA H 9.790 -1.794 4.379 1.00 . A A . 21 PRO HA 1 1 12 5506 1 1 21 PRO HB2 H 12.576 -2.618 3.745 1.00 . A A . 21 PRO HB2 1 1 12 5507 1 1 21 PRO HB3 H 11.726 -2.550 5.294 1.00 . A A . 21 PRO HB3 1 1 12 5508 1 1 21 PRO HD2 H 11.197 -4.551 1.987 1.00 . A A . 21 PRO HD2 1 1 12 5509 1 1 21 PRO HD3 H 9.736 -5.089 2.828 1.00 . A A . 21 PRO HD3 1 1 12 5510 1 1 21 PRO HG2 H 12.136 -4.895 4.080 1.00 . A A . 21 PRO HG2 1 1 12 5511 1 1 21 PRO HG3 H 10.610 -4.563 4.920 1.00 . A A . 21 PRO HG3 1 1 12 5512 1 1 21 PRO N N 9.944 -3.000 2.666 1.00 . A A . 21 PRO N 1 1 12 5513 1 1 21 PRO O O 11.954 -0.829 2.151 1.00 . A A . 21 PRO O 1 1 12 5514 1 1 22 GLY C C 9.441 2.217 2.055 1.00 . A A . 22 GLY C 1 1 12 5515 1 1 22 GLY CA C 10.657 1.553 2.668 1.00 . A A . 22 GLY CA 1 1 12 5516 1 1 22 GLY H H 9.588 0.189 3.871 1.00 . A A . 22 GLY H 1 1 12 5517 1 1 22 GLY HA2 H 11.058 2.194 3.435 1.00 . A A . 22 GLY HA2 1 1 12 5518 1 1 22 GLY HA3 H 11.405 1.413 1.901 1.00 . A A . 22 GLY HA3 1 1 12 5519 1 1 22 GLY N N 10.336 0.272 3.250 1.00 . A A . 22 GLY N 1 1 12 5520 1 1 22 GLY O O 9.315 3.438 2.096 1.00 . A A . 22 GLY O 1 1 12 5521 1 1 23 LEU C C 6.133 1.699 1.761 1.00 . A A . 23 LEU C 1 1 12 5522 1 1 23 LEU CA C 7.341 1.939 0.862 1.00 . A A . 23 LEU CA 1 1 12 5523 1 1 23 LEU CB C 7.128 1.271 -0.497 1.00 . A A . 23 LEU CB 1 1 12 5524 1 1 23 LEU CD1 C 8.047 0.532 -2.706 1.00 . A A . 23 LEU CD1 1 1 12 5525 1 1 23 LEU CD2 C 8.625 2.794 -1.812 1.00 . A A . 23 LEU CD2 1 1 12 5526 1 1 23 LEU CG C 8.319 1.347 -1.453 1.00 . A A . 23 LEU CG 1 1 12 5527 1 1 23 LEU H H 8.691 0.440 1.481 1.00 . A A . 23 LEU H 1 1 12 5528 1 1 23 LEU HA H 7.471 3.002 0.720 1.00 . A A . 23 LEU HA 1 1 12 5529 1 1 23 LEU HB2 H 6.895 0.230 -0.328 1.00 . A A . 23 LEU HB2 1 1 12 5530 1 1 23 LEU HB3 H 6.281 1.739 -0.976 1.00 . A A . 23 LEU HB3 1 1 12 5531 1 1 23 LEU HD11 H 7.221 0.969 -3.248 1.00 . A A . 23 LEU HD11 1 1 12 5532 1 1 23 LEU HD12 H 7.799 -0.482 -2.429 1.00 . A A . 23 LEU HD12 1 1 12 5533 1 1 23 LEU HD13 H 8.928 0.529 -3.332 1.00 . A A . 23 LEU HD13 1 1 12 5534 1 1 23 LEU HD21 H 8.793 2.874 -2.876 1.00 . A A . 23 LEU HD21 1 1 12 5535 1 1 23 LEU HD22 H 9.510 3.117 -1.283 1.00 . A A . 23 LEU HD22 1 1 12 5536 1 1 23 LEU HD23 H 7.790 3.420 -1.531 1.00 . A A . 23 LEU HD23 1 1 12 5537 1 1 23 LEU HG H 9.189 0.931 -0.967 1.00 . A A . 23 LEU HG 1 1 12 5538 1 1 23 LEU N N 8.545 1.414 1.483 1.00 . A A . 23 LEU N 1 1 12 5539 1 1 23 LEU O O 6.010 0.634 2.373 1.00 . A A . 23 LEU O 1 1 12 5540 1 1 24 ILE C C 2.784 2.858 1.873 1.00 . A A . 24 ILE C 1 1 12 5541 1 1 24 ILE CA C 4.054 2.555 2.668 1.00 . A A . 24 ILE CA 1 1 12 5542 1 1 24 ILE CB C 4.116 3.482 3.904 1.00 . A A . 24 ILE CB 1 1 12 5543 1 1 24 ILE CD1 C 4.442 5.906 4.636 1.00 . A A . 24 ILE CD1 1 1 12 5544 1 1 24 ILE CG1 C 4.456 4.918 3.489 1.00 . A A . 24 ILE CG1 1 1 12 5545 1 1 24 ILE CG2 C 5.131 2.954 4.910 1.00 . A A . 24 ILE CG2 1 1 12 5546 1 1 24 ILE H H 5.397 3.509 1.323 1.00 . A A . 24 ILE H 1 1 12 5547 1 1 24 ILE HA H 4.004 1.535 3.018 1.00 . A A . 24 ILE HA 1 1 12 5548 1 1 24 ILE HB H 3.145 3.473 4.377 1.00 . A A . 24 ILE HB 1 1 12 5549 1 1 24 ILE HD11 H 3.958 5.457 5.491 1.00 . A A . 24 ILE HD11 1 1 12 5550 1 1 24 ILE HD12 H 3.901 6.793 4.341 1.00 . A A . 24 ILE HD12 1 1 12 5551 1 1 24 ILE HD13 H 5.456 6.172 4.895 1.00 . A A . 24 ILE HD13 1 1 12 5552 1 1 24 ILE HG12 H 5.443 4.934 3.051 1.00 . A A . 24 ILE HG12 1 1 12 5553 1 1 24 ILE HG13 H 3.737 5.252 2.754 1.00 . A A . 24 ILE HG13 1 1 12 5554 1 1 24 ILE HG21 H 4.878 3.312 5.898 1.00 . A A . 24 ILE HG21 1 1 12 5555 1 1 24 ILE HG22 H 6.117 3.303 4.643 1.00 . A A . 24 ILE HG22 1 1 12 5556 1 1 24 ILE HG23 H 5.116 1.874 4.905 1.00 . A A . 24 ILE HG23 1 1 12 5557 1 1 24 ILE N N 5.246 2.677 1.840 1.00 . A A . 24 ILE N 1 1 12 5558 1 1 24 ILE O O 2.715 3.844 1.141 1.00 . A A . 24 ILE O 1 1 12 5559 1 1 25 CYS C C -0.192 3.437 1.769 1.00 . A A . 25 CYS C 1 1 12 5560 1 1 25 CYS CA C 0.510 2.155 1.321 1.00 . A A . 25 CYS CA 1 1 12 5561 1 1 25 CYS CB C -0.392 0.944 1.583 1.00 . A A . 25 CYS CB 1 1 12 5562 1 1 25 CYS H H 1.910 1.218 2.612 1.00 . A A . 25 CYS H 1 1 12 5563 1 1 25 CYS HA H 0.715 2.220 0.264 1.00 . A A . 25 CYS HA 1 1 12 5564 1 1 25 CYS HB2 H 0.105 0.054 1.227 1.00 . A A . 25 CYS HB2 1 1 12 5565 1 1 25 CYS HB3 H -0.557 0.854 2.647 1.00 . A A . 25 CYS HB3 1 1 12 5566 1 1 25 CYS N N 1.784 1.992 2.020 1.00 . A A . 25 CYS N 1 1 12 5567 1 1 25 CYS O O -0.177 3.779 2.954 1.00 . A A . 25 CYS O 1 1 12 5568 1 1 25 CYS SG S -2.026 1.021 0.773 1.00 . A A . 25 CYS SG 1 1 12 5569 1 1 26 GLY C C -2.764 5.570 0.358 1.00 . A A . 26 GLY C 1 1 12 5570 1 1 26 GLY CA C -1.471 5.386 1.139 1.00 . A A . 26 GLY CA 1 1 12 5571 1 1 26 GLY H H -0.759 3.835 -0.110 1.00 . A A . 26 GLY H 1 1 12 5572 1 1 26 GLY HA2 H -1.698 5.397 2.195 1.00 . A A . 26 GLY HA2 1 1 12 5573 1 1 26 GLY HA3 H -0.811 6.213 0.916 1.00 . A A . 26 GLY HA3 1 1 12 5574 1 1 26 GLY N N -0.790 4.148 0.821 1.00 . A A . 26 GLY N 1 1 12 5575 1 1 26 GLY O O -3.700 4.787 0.517 1.00 . A A . 26 GLY O 1 1 12 5576 1 1 27 PRO C C -4.278 5.930 -2.427 1.00 . A A . 27 PRO C 1 1 12 5577 1 1 27 PRO CA C -4.042 6.925 -1.292 1.00 . A A . 27 PRO CA 1 1 12 5578 1 1 27 PRO CB C -3.751 8.324 -1.861 1.00 . A A . 27 PRO CB 1 1 12 5579 1 1 27 PRO CD C -1.782 7.595 -0.718 1.00 . A A . 27 PRO CD 1 1 12 5580 1 1 27 PRO CG C -2.550 8.817 -1.125 1.00 . A A . 27 PRO CG 1 1 12 5581 1 1 27 PRO HA H -4.926 6.965 -0.675 1.00 . A A . 27 PRO HA 1 1 12 5582 1 1 27 PRO HB2 H -3.558 8.248 -2.921 1.00 . A A . 27 PRO HB2 1 1 12 5583 1 1 27 PRO HB3 H -4.604 8.964 -1.694 1.00 . A A . 27 PRO HB3 1 1 12 5584 1 1 27 PRO HD2 H -1.126 7.277 -1.514 1.00 . A A . 27 PRO HD2 1 1 12 5585 1 1 27 PRO HD3 H -1.224 7.781 0.188 1.00 . A A . 27 PRO HD3 1 1 12 5586 1 1 27 PRO HG2 H -1.950 9.438 -1.773 1.00 . A A . 27 PRO HG2 1 1 12 5587 1 1 27 PRO HG3 H -2.858 9.372 -0.252 1.00 . A A . 27 PRO HG3 1 1 12 5588 1 1 27 PRO N N -2.846 6.615 -0.486 1.00 . A A . 27 PRO N 1 1 12 5589 1 1 27 PRO O O -4.233 6.292 -3.602 1.00 . A A . 27 PRO O 1 1 12 5590 1 1 28 PHE C C -3.489 3.308 -3.819 1.00 . A A . 28 PHE C 1 1 12 5591 1 1 28 PHE CA C -4.745 3.581 -2.994 1.00 . A A . 28 PHE CA 1 1 12 5592 1 1 28 PHE CB C -5.969 3.848 -3.906 1.00 . A A . 28 PHE CB 1 1 12 5593 1 1 28 PHE CD1 C -7.552 4.533 -2.069 1.00 . A A . 28 PHE CD1 1 1 12 5594 1 1 28 PHE CD2 C -8.284 2.911 -3.656 1.00 . A A . 28 PHE CD2 1 1 12 5595 1 1 28 PHE CE1 C -8.769 4.454 -1.421 1.00 . A A . 28 PHE CE1 1 1 12 5596 1 1 28 PHE CE2 C -9.504 2.828 -3.012 1.00 . A A . 28 PHE CE2 1 1 12 5597 1 1 28 PHE CG C -7.293 3.763 -3.193 1.00 . A A . 28 PHE CG 1 1 12 5598 1 1 28 PHE CZ C -9.747 3.600 -1.893 1.00 . A A . 28 PHE CZ 1 1 12 5599 1 1 28 PHE H H -4.511 4.477 -1.088 1.00 . A A . 28 PHE H 1 1 12 5600 1 1 28 PHE HA H -4.948 2.699 -2.402 1.00 . A A . 28 PHE HA 1 1 12 5601 1 1 28 PHE HB2 H -5.895 4.838 -4.337 1.00 . A A . 28 PHE HB2 1 1 12 5602 1 1 28 PHE HB3 H -5.980 3.116 -4.705 1.00 . A A . 28 PHE HB3 1 1 12 5603 1 1 28 PHE HD1 H -6.788 5.200 -1.697 1.00 . A A . 28 PHE HD1 1 1 12 5604 1 1 28 PHE HD2 H -8.095 2.306 -4.530 1.00 . A A . 28 PHE HD2 1 1 12 5605 1 1 28 PHE HE1 H -8.957 5.058 -0.545 1.00 . A A . 28 PHE HE1 1 1 12 5606 1 1 28 PHE HE2 H -10.266 2.161 -3.385 1.00 . A A . 28 PHE HE2 1 1 12 5607 1 1 28 PHE HZ H -10.700 3.537 -1.388 1.00 . A A . 28 PHE HZ 1 1 12 5608 1 1 28 PHE N N -4.511 4.677 -2.051 1.00 . A A . 28 PHE N 1 1 12 5609 1 1 28 PHE O O -3.536 2.615 -4.832 1.00 . A A . 28 PHE O 1 1 12 5610 1 1 29 VAL C C -0.006 3.699 -2.901 1.00 . A A . 29 VAL C 1 1 12 5611 1 1 29 VAL CA C -1.065 3.634 -3.979 1.00 . A A . 29 VAL CA 1 1 12 5612 1 1 29 VAL CB C -0.733 4.690 -5.074 1.00 . A A . 29 VAL CB 1 1 12 5613 1 1 29 VAL CG1 C -1.662 4.561 -6.272 1.00 . A A . 29 VAL CG1 1 1 12 5614 1 1 29 VAL CG2 C -0.789 6.101 -4.503 1.00 . A A . 29 VAL CG2 1 1 12 5615 1 1 29 VAL H H -2.386 4.343 -2.500 1.00 . A A . 29 VAL H 1 1 12 5616 1 1 29 VAL HA H -1.055 2.649 -4.428 1.00 . A A . 29 VAL HA 1 1 12 5617 1 1 29 VAL HB H 0.280 4.506 -5.420 1.00 . A A . 29 VAL HB 1 1 12 5618 1 1 29 VAL HG11 H -2.545 4.010 -5.985 1.00 . A A . 29 VAL HG11 1 1 12 5619 1 1 29 VAL HG12 H -1.152 4.038 -7.068 1.00 . A A . 29 VAL HG12 1 1 12 5620 1 1 29 VAL HG13 H -1.947 5.546 -6.613 1.00 . A A . 29 VAL HG13 1 1 12 5621 1 1 29 VAL HG21 H -0.006 6.699 -4.946 1.00 . A A . 29 VAL HG21 1 1 12 5622 1 1 29 VAL HG22 H -0.651 6.063 -3.433 1.00 . A A . 29 VAL HG22 1 1 12 5623 1 1 29 VAL HG23 H -1.749 6.542 -4.728 1.00 . A A . 29 VAL HG23 1 1 12 5624 1 1 29 VAL N N -2.359 3.829 -3.342 1.00 . A A . 29 VAL N 1 1 12 5625 1 1 29 VAL O O -0.226 4.305 -1.851 1.00 . A A . 29 VAL O 1 1 12 5626 1 1 30 CYS C C 3.107 4.288 -2.414 1.00 . A A . 30 CYS C 1 1 12 5627 1 1 30 CYS CA C 2.200 3.082 -2.176 1.00 . A A . 30 CYS CA 1 1 12 5628 1 1 30 CYS CB C 2.995 1.782 -2.289 1.00 . A A . 30 CYS CB 1 1 12 5629 1 1 30 CYS H H 1.246 2.613 -3.997 1.00 . A A . 30 CYS H 1 1 12 5630 1 1 30 CYS HA H 1.769 3.153 -1.189 1.00 . A A . 30 CYS HA 1 1 12 5631 1 1 30 CYS HB2 H 2.342 0.996 -2.642 1.00 . A A . 30 CYS HB2 1 1 12 5632 1 1 30 CYS HB3 H 3.795 1.922 -3.002 1.00 . A A . 30 CYS HB3 1 1 12 5633 1 1 30 CYS N N 1.123 3.082 -3.142 1.00 . A A . 30 CYS N 1 1 12 5634 1 1 30 CYS O O 3.190 4.805 -3.531 1.00 . A A . 30 CYS O 1 1 12 5635 1 1 30 CYS SG S 3.737 1.236 -0.727 1.00 . A A . 30 CYS SG 1 1 12 5636 1 1 31 VAL C C 5.948 5.634 -0.717 1.00 . A A . 31 VAL C 1 1 12 5637 1 1 31 VAL CA C 4.674 5.883 -1.505 1.00 . A A . 31 VAL CA 1 1 12 5638 1 1 31 VAL CB C 4.023 7.202 -1.019 1.00 . A A . 31 VAL CB 1 1 12 5639 1 1 31 VAL CG1 C 2.889 7.626 -1.941 1.00 . A A . 31 VAL CG1 1 1 12 5640 1 1 31 VAL CG2 C 3.522 7.064 0.412 1.00 . A A . 31 VAL CG2 1 1 12 5641 1 1 31 VAL H H 3.688 4.305 -0.502 1.00 . A A . 31 VAL H 1 1 12 5642 1 1 31 VAL HA H 4.928 5.989 -2.558 1.00 . A A . 31 VAL HA 1 1 12 5643 1 1 31 VAL HB H 4.776 7.977 -1.038 1.00 . A A . 31 VAL HB 1 1 12 5644 1 1 31 VAL HG11 H 2.773 6.897 -2.728 1.00 . A A . 31 VAL HG11 1 1 12 5645 1 1 31 VAL HG12 H 3.117 8.589 -2.373 1.00 . A A . 31 VAL HG12 1 1 12 5646 1 1 31 VAL HG13 H 1.972 7.695 -1.375 1.00 . A A . 31 VAL HG13 1 1 12 5647 1 1 31 VAL HG21 H 4.365 6.970 1.081 1.00 . A A . 31 VAL HG21 1 1 12 5648 1 1 31 VAL HG22 H 2.899 6.186 0.492 1.00 . A A . 31 VAL HG22 1 1 12 5649 1 1 31 VAL HG23 H 2.948 7.939 0.678 1.00 . A A . 31 VAL HG23 1 1 12 5650 1 1 31 VAL N N 3.782 4.744 -1.379 1.00 . A A . 31 VAL N 1 1 12 5651 1 1 31 VAL O O 5.940 4.724 0.134 1.00 . A A . 31 VAL O 1 1 12 5652 1 1 31 VAL OXT O 6.950 6.337 -0.977 1.00 . A A . 31 VAL OXT 1 1 13 5653 1 1 1 ALA C C 4.705 -8.643 -0.061 1.00 . A A . 1 ALA C 1 1 13 5654 1 1 1 ALA CA C 4.731 -10.136 -0.337 1.00 . A A . 1 ALA CA 1 1 13 5655 1 1 1 ALA CB C 3.365 -10.615 -0.808 1.00 . A A . 1 ALA CB 1 1 13 5656 1 1 1 ALA H1 H 4.524 -11.684 1.040 1.00 . A A . 1 ALA H1 1 1 13 5657 1 1 1 ALA H2 H 5.065 -10.226 1.711 1.00 . A A . 1 ALA H2 1 1 13 5658 1 1 1 ALA H3 H 6.124 -11.183 0.800 1.00 . A A . 1 ALA H3 1 1 13 5659 1 1 1 ALA HA H 5.452 -10.339 -1.116 1.00 . A A . 1 ALA HA 1 1 13 5660 1 1 1 ALA HB1 H 3.059 -10.040 -1.670 1.00 . A A . 1 ALA HB1 1 1 13 5661 1 1 1 ALA HB2 H 2.645 -10.484 -0.014 1.00 . A A . 1 ALA HB2 1 1 13 5662 1 1 1 ALA HB3 H 3.422 -11.659 -1.075 1.00 . A A . 1 ALA HB3 1 1 13 5663 1 1 1 ALA N N 5.141 -10.861 0.887 1.00 . A A . 1 ALA N 1 1 13 5664 1 1 1 ALA O O 4.457 -8.233 1.070 1.00 . A A . 1 ALA O 1 1 13 5665 1 1 2 CYS C C 4.577 -5.741 -2.248 1.00 . A A . 2 CYS C 1 1 13 5666 1 1 2 CYS CA C 4.983 -6.395 -0.935 1.00 . A A . 2 CYS CA 1 1 13 5667 1 1 2 CYS CB C 6.364 -5.916 -0.485 1.00 . A A . 2 CYS CB 1 1 13 5668 1 1 2 CYS H H 5.170 -8.228 -1.961 1.00 . A A . 2 CYS H 1 1 13 5669 1 1 2 CYS HA H 4.257 -6.118 -0.175 1.00 . A A . 2 CYS HA 1 1 13 5670 1 1 2 CYS HB2 H 6.302 -4.866 -0.248 1.00 . A A . 2 CYS HB2 1 1 13 5671 1 1 2 CYS HB3 H 6.651 -6.455 0.407 1.00 . A A . 2 CYS HB3 1 1 13 5672 1 1 2 CYS N N 4.971 -7.843 -1.081 1.00 . A A . 2 CYS N 1 1 13 5673 1 1 2 CYS O O 4.994 -6.173 -3.322 1.00 . A A . 2 CYS O 1 1 13 5674 1 1 2 CYS SG S 7.702 -6.113 -1.702 1.00 . A A . 2 CYS SG 1 1 13 5675 1 1 3 SER C C 4.227 -2.932 -3.752 1.00 . A A . 3 SER C 1 1 13 5676 1 1 3 SER CA C 3.245 -4.023 -3.330 1.00 . A A . 3 SER CA 1 1 13 5677 1 1 3 SER CB C 1.865 -3.418 -3.036 1.00 . A A . 3 SER CB 1 1 13 5678 1 1 3 SER H H 3.420 -4.446 -1.271 1.00 . A A . 3 SER H 1 1 13 5679 1 1 3 SER HA H 3.153 -4.739 -4.132 1.00 . A A . 3 SER HA 1 1 13 5680 1 1 3 SER HB2 H 1.223 -4.180 -2.623 1.00 . A A . 3 SER HB2 1 1 13 5681 1 1 3 SER HB3 H 1.972 -2.615 -2.322 1.00 . A A . 3 SER HB3 1 1 13 5682 1 1 3 SER HG H 0.299 -2.993 -4.147 1.00 . A A . 3 SER HG 1 1 13 5683 1 1 3 SER N N 3.734 -4.725 -2.154 1.00 . A A . 3 SER N 1 1 13 5684 1 1 3 SER O O 4.835 -2.271 -2.901 1.00 . A A . 3 SER O 1 1 13 5685 1 1 3 SER OG O 1.258 -2.904 -4.210 1.00 . A A . 3 SER OG 1 1 13 5686 1 1 4 LYS C C 4.715 -0.340 -5.239 1.00 . A A . 4 LYS C 1 1 13 5687 1 1 4 LYS CA C 5.255 -1.722 -5.605 1.00 . A A . 4 LYS CA 1 1 13 5688 1 1 4 LYS CB C 5.382 -1.878 -7.128 1.00 . A A . 4 LYS CB 1 1 13 5689 1 1 4 LYS CD C 6.605 -1.233 -9.250 1.00 . A A . 4 LYS CD 1 1 13 5690 1 1 4 LYS CE C 5.369 -0.886 -10.068 1.00 . A A . 4 LYS CE 1 1 13 5691 1 1 4 LYS CG C 6.412 -0.952 -7.763 1.00 . A A . 4 LYS CG 1 1 13 5692 1 1 4 LYS H H 3.844 -3.296 -5.679 1.00 . A A . 4 LYS H 1 1 13 5693 1 1 4 LYS HA H 6.227 -1.849 -5.151 1.00 . A A . 4 LYS HA 1 1 13 5694 1 1 4 LYS HB2 H 5.665 -2.897 -7.351 1.00 . A A . 4 LYS HB2 1 1 13 5695 1 1 4 LYS HB3 H 4.423 -1.674 -7.579 1.00 . A A . 4 LYS HB3 1 1 13 5696 1 1 4 LYS HD2 H 7.436 -0.646 -9.610 1.00 . A A . 4 LYS HD2 1 1 13 5697 1 1 4 LYS HD3 H 6.825 -2.283 -9.379 1.00 . A A . 4 LYS HD3 1 1 13 5698 1 1 4 LYS HE2 H 4.689 -0.322 -9.446 1.00 . A A . 4 LYS HE2 1 1 13 5699 1 1 4 LYS HE3 H 5.669 -0.280 -10.910 1.00 . A A . 4 LYS HE3 1 1 13 5700 1 1 4 LYS HG2 H 6.081 0.069 -7.644 1.00 . A A . 4 LYS HG2 1 1 13 5701 1 1 4 LYS HG3 H 7.358 -1.084 -7.256 1.00 . A A . 4 LYS HG3 1 1 13 5702 1 1 4 LYS HZ1 H 3.635 -1.920 -10.624 1.00 . A A . 4 LYS HZ1 1 1 13 5703 1 1 4 LYS HZ2 H 4.819 -2.901 -9.922 1.00 . A A . 4 LYS HZ2 1 1 13 5704 1 1 4 LYS HZ3 H 5.012 -2.356 -11.512 1.00 . A A . 4 LYS HZ3 1 1 13 5705 1 1 4 LYS N N 4.368 -2.743 -5.062 1.00 . A A . 4 LYS N 1 1 13 5706 1 1 4 LYS NZ N 4.668 -2.098 -10.570 1.00 . A A . 4 LYS NZ 1 1 13 5707 1 1 4 LYS O O 3.518 -0.182 -5.009 1.00 . A A . 4 LYS O 1 1 13 5708 1 1 5 LYS C C 3.992 2.488 -5.604 1.00 . A A . 5 LYS C 1 1 13 5709 1 1 5 LYS CA C 5.171 1.995 -4.776 1.00 . A A . 5 LYS CA 1 1 13 5710 1 1 5 LYS CB C 6.341 2.982 -4.875 1.00 . A A . 5 LYS CB 1 1 13 5711 1 1 5 LYS CD C 7.041 5.327 -4.260 1.00 . A A . 5 LYS CD 1 1 13 5712 1 1 5 LYS CE C 6.606 6.783 -4.236 1.00 . A A . 5 LYS CE 1 1 13 5713 1 1 5 LYS CG C 5.912 4.435 -4.733 1.00 . A A . 5 LYS CG 1 1 13 5714 1 1 5 LYS H H 6.538 0.469 -5.317 1.00 . A A . 5 LYS H 1 1 13 5715 1 1 5 LYS HA H 4.850 1.949 -3.752 1.00 . A A . 5 LYS HA 1 1 13 5716 1 1 5 LYS HB2 H 7.054 2.760 -4.094 1.00 . A A . 5 LYS HB2 1 1 13 5717 1 1 5 LYS HB3 H 6.821 2.861 -5.834 1.00 . A A . 5 LYS HB3 1 1 13 5718 1 1 5 LYS HD2 H 7.331 5.030 -3.263 1.00 . A A . 5 LYS HD2 1 1 13 5719 1 1 5 LYS HD3 H 7.880 5.221 -4.932 1.00 . A A . 5 LYS HD3 1 1 13 5720 1 1 5 LYS HE2 H 6.773 7.210 -5.216 1.00 . A A . 5 LYS HE2 1 1 13 5721 1 1 5 LYS HE3 H 5.550 6.829 -4.005 1.00 . A A . 5 LYS HE3 1 1 13 5722 1 1 5 LYS HG2 H 5.567 4.794 -5.686 1.00 . A A . 5 LYS HG2 1 1 13 5723 1 1 5 LYS HG3 H 5.106 4.486 -4.025 1.00 . A A . 5 LYS HG3 1 1 13 5724 1 1 5 LYS HZ1 H 8.381 7.540 -3.437 1.00 . A A . 5 LYS HZ1 1 1 13 5725 1 1 5 LYS HZ2 H 7.207 7.172 -2.270 1.00 . A A . 5 LYS HZ2 1 1 13 5726 1 1 5 LYS HZ3 H 7.047 8.559 -3.231 1.00 . A A . 5 LYS HZ3 1 1 13 5727 1 1 5 LYS N N 5.591 0.650 -5.151 1.00 . A A . 5 LYS N 1 1 13 5728 1 1 5 LYS NZ N 7.365 7.572 -3.229 1.00 . A A . 5 LYS NZ 1 1 13 5729 1 1 5 LYS O O 2.889 2.639 -5.104 1.00 . A A . 5 LYS O 1 1 13 5730 1 1 6 TRP C C 2.281 2.054 -8.202 1.00 . A A . 6 TRP C 1 1 13 5731 1 1 6 TRP CA C 3.148 3.211 -7.720 1.00 . A A . 6 TRP CA 1 1 13 5732 1 1 6 TRP CB C 3.732 3.996 -8.895 1.00 . A A . 6 TRP CB 1 1 13 5733 1 1 6 TRP CD1 C 6.184 4.546 -8.361 1.00 . A A . 6 TRP CD1 1 1 13 5734 1 1 6 TRP CD2 C 4.805 6.300 -8.193 1.00 . A A . 6 TRP CD2 1 1 13 5735 1 1 6 TRP CE2 C 6.114 6.728 -7.901 1.00 . A A . 6 TRP CE2 1 1 13 5736 1 1 6 TRP CE3 C 3.769 7.235 -8.143 1.00 . A A . 6 TRP CE3 1 1 13 5737 1 1 6 TRP CG C 4.873 4.901 -8.508 1.00 . A A . 6 TRP CG 1 1 13 5738 1 1 6 TRP CH2 C 5.376 8.938 -7.524 1.00 . A A . 6 TRP CH2 1 1 13 5739 1 1 6 TRP CZ2 C 6.411 8.047 -7.565 1.00 . A A . 6 TRP CZ2 1 1 13 5740 1 1 6 TRP CZ3 C 4.064 8.543 -7.806 1.00 . A A . 6 TRP CZ3 1 1 13 5741 1 1 6 TRP H H 5.092 2.583 -7.231 1.00 . A A . 6 TRP H 1 1 13 5742 1 1 6 TRP HA H 2.526 3.876 -7.127 1.00 . A A . 6 TRP HA 1 1 13 5743 1 1 6 TRP HB2 H 4.097 3.300 -9.637 1.00 . A A . 6 TRP HB2 1 1 13 5744 1 1 6 TRP HB3 H 2.956 4.605 -9.334 1.00 . A A . 6 TRP HB3 1 1 13 5745 1 1 6 TRP HD1 H 6.560 3.548 -8.509 1.00 . A A . 6 TRP HD1 1 1 13 5746 1 1 6 TRP HE1 H 7.907 5.640 -7.870 1.00 . A A . 6 TRP HE1 1 1 13 5747 1 1 6 TRP HE3 H 2.753 6.949 -8.350 1.00 . A A . 6 TRP HE3 1 1 13 5748 1 1 6 TRP HH2 H 5.561 9.971 -7.265 1.00 . A A . 6 TRP HH2 1 1 13 5749 1 1 6 TRP HZ2 H 7.418 8.367 -7.345 1.00 . A A . 6 TRP HZ2 1 1 13 5750 1 1 6 TRP HZ3 H 3.273 9.278 -7.763 1.00 . A A . 6 TRP HZ3 1 1 13 5751 1 1 6 TRP N N 4.212 2.730 -6.865 1.00 . A A . 6 TRP N 1 1 13 5752 1 1 6 TRP NE1 N 6.937 5.640 -8.013 1.00 . A A . 6 TRP NE1 1 1 13 5753 1 1 6 TRP O O 1.742 2.091 -9.304 1.00 . A A . 6 TRP O 1 1 13 5754 1 1 7 GLU C C -0.127 0.137 -7.330 1.00 . A A . 7 GLU C 1 1 13 5755 1 1 7 GLU CA C 1.331 -0.129 -7.712 1.00 . A A . 7 GLU CA 1 1 13 5756 1 1 7 GLU CB C 1.835 -1.392 -7.009 1.00 . A A . 7 GLU CB 1 1 13 5757 1 1 7 GLU CD C 2.355 -2.858 -8.987 1.00 . A A . 7 GLU CD 1 1 13 5758 1 1 7 GLU CG C 1.518 -2.687 -7.740 1.00 . A A . 7 GLU CG 1 1 13 5759 1 1 7 GLU H H 2.615 1.060 -6.477 1.00 . A A . 7 GLU H 1 1 13 5760 1 1 7 GLU HA H 1.390 -0.268 -8.782 1.00 . A A . 7 GLU HA 1 1 13 5761 1 1 7 GLU HB2 H 2.908 -1.322 -6.902 1.00 . A A . 7 GLU HB2 1 1 13 5762 1 1 7 GLU HB3 H 1.390 -1.441 -6.027 1.00 . A A . 7 GLU HB3 1 1 13 5763 1 1 7 GLU HG2 H 1.710 -3.518 -7.077 1.00 . A A . 7 GLU HG2 1 1 13 5764 1 1 7 GLU HG3 H 0.474 -2.683 -8.020 1.00 . A A . 7 GLU HG3 1 1 13 5765 1 1 7 GLU N N 2.151 1.030 -7.363 1.00 . A A . 7 GLU N 1 1 13 5766 1 1 7 GLU O O -0.762 1.051 -7.851 1.00 . A A . 7 GLU O 1 1 13 5767 1 1 7 GLU OE1 O 2.153 -2.099 -9.958 1.00 . A A . 7 GLU OE1 1 1 13 5768 1 1 7 GLU OE2 O 3.264 -3.715 -8.988 1.00 . A A . 7 GLU OE2 1 1 13 5769 1 1 8 TYR C C -2.160 -1.213 -4.590 1.00 . A A . 8 TYR C 1 1 13 5770 1 1 8 TYR CA C -2.010 -0.523 -5.939 1.00 . A A . 8 TYR CA 1 1 13 5771 1 1 8 TYR CB C -2.988 -1.134 -6.952 1.00 . A A . 8 TYR CB 1 1 13 5772 1 1 8 TYR CD1 C -5.031 0.238 -6.369 1.00 . A A . 8 TYR CD1 1 1 13 5773 1 1 8 TYR CD2 C -5.237 -2.136 -6.384 1.00 . A A . 8 TYR CD2 1 1 13 5774 1 1 8 TYR CE1 C -6.360 0.356 -6.013 1.00 . A A . 8 TYR CE1 1 1 13 5775 1 1 8 TYR CE2 C -6.567 -2.026 -6.028 1.00 . A A . 8 TYR CE2 1 1 13 5776 1 1 8 TYR CG C -4.445 -1.007 -6.561 1.00 . A A . 8 TYR CG 1 1 13 5777 1 1 8 TYR CZ C -7.124 -0.778 -5.842 1.00 . A A . 8 TYR CZ 1 1 13 5778 1 1 8 TYR H H -0.080 -1.368 -6.021 1.00 . A A . 8 TYR H 1 1 13 5779 1 1 8 TYR HA H -2.222 0.530 -5.822 1.00 . A A . 8 TYR HA 1 1 13 5780 1 1 8 TYR HB2 H -2.859 -0.641 -7.904 1.00 . A A . 8 TYR HB2 1 1 13 5781 1 1 8 TYR HB3 H -2.765 -2.185 -7.067 1.00 . A A . 8 TYR HB3 1 1 13 5782 1 1 8 TYR HD1 H -4.430 1.126 -6.504 1.00 . A A . 8 TYR HD1 1 1 13 5783 1 1 8 TYR HD2 H -4.797 -3.112 -6.529 1.00 . A A . 8 TYR HD2 1 1 13 5784 1 1 8 TYR HE1 H -6.795 1.333 -5.869 1.00 . A A . 8 TYR HE1 1 1 13 5785 1 1 8 TYR HE2 H -7.165 -2.916 -5.896 1.00 . A A . 8 TYR HE2 1 1 13 5786 1 1 8 TYR HH H -8.709 0.258 -5.518 1.00 . A A . 8 TYR HH 1 1 13 5787 1 1 8 TYR N N -0.642 -0.662 -6.405 1.00 . A A . 8 TYR N 1 1 13 5788 1 1 8 TYR O O -1.595 -2.287 -4.365 1.00 . A A . 8 TYR O 1 1 13 5789 1 1 8 TYR OH O -8.447 -0.665 -5.486 1.00 . A A . 8 TYR OH 1 1 13 5790 1 1 9 CYS C C -4.406 -0.601 -1.765 1.00 . A A . 9 CYS C 1 1 13 5791 1 1 9 CYS CA C -3.126 -1.159 -2.372 1.00 . A A . 9 CYS CA 1 1 13 5792 1 1 9 CYS CB C -1.926 -0.879 -1.460 1.00 . A A . 9 CYS CB 1 1 13 5793 1 1 9 CYS H H -3.333 0.261 -3.924 1.00 . A A . 9 CYS H 1 1 13 5794 1 1 9 CYS HA H -3.237 -2.228 -2.485 1.00 . A A . 9 CYS HA 1 1 13 5795 1 1 9 CYS HB2 H -2.099 -1.341 -0.501 1.00 . A A . 9 CYS HB2 1 1 13 5796 1 1 9 CYS HB3 H -1.041 -1.310 -1.905 1.00 . A A . 9 CYS HB3 1 1 13 5797 1 1 9 CYS N N -2.911 -0.598 -3.694 1.00 . A A . 9 CYS N 1 1 13 5798 1 1 9 CYS O O -4.819 0.512 -2.085 1.00 . A A . 9 CYS O 1 1 13 5799 1 1 9 CYS SG S -1.593 0.886 -1.167 1.00 . A A . 9 CYS SG 1 1 13 5800 1 1 10 ILE C C -6.594 -1.960 0.889 1.00 . A A . 10 ILE C 1 1 13 5801 1 1 10 ILE CA C -6.278 -0.995 -0.252 1.00 . A A . 10 ILE CA 1 1 13 5802 1 1 10 ILE CB C -7.463 -0.940 -1.256 1.00 . A A . 10 ILE CB 1 1 13 5803 1 1 10 ILE CD1 C -8.662 0.903 0.039 1.00 . A A . 10 ILE CD1 1 1 13 5804 1 1 10 ILE CG1 C -8.750 -0.487 -0.557 1.00 . A A . 10 ILE CG1 1 1 13 5805 1 1 10 ILE CG2 C -7.671 -2.288 -1.936 1.00 . A A . 10 ILE CG2 1 1 13 5806 1 1 10 ILE H H -4.655 -2.266 -0.703 1.00 . A A . 10 ILE H 1 1 13 5807 1 1 10 ILE HA H -6.134 -0.005 0.160 1.00 . A A . 10 ILE HA 1 1 13 5808 1 1 10 ILE HB H -7.213 -0.221 -2.022 1.00 . A A . 10 ILE HB 1 1 13 5809 1 1 10 ILE HD11 H -7.734 1.004 0.582 1.00 . A A . 10 ILE HD11 1 1 13 5810 1 1 10 ILE HD12 H -9.491 1.058 0.712 1.00 . A A . 10 ILE HD12 1 1 13 5811 1 1 10 ILE HD13 H -8.696 1.637 -0.753 1.00 . A A . 10 ILE HD13 1 1 13 5812 1 1 10 ILE HG12 H -9.559 -0.490 -1.271 1.00 . A A . 10 ILE HG12 1 1 13 5813 1 1 10 ILE HG13 H -8.979 -1.177 0.241 1.00 . A A . 10 ILE HG13 1 1 13 5814 1 1 10 ILE HG21 H -6.719 -2.673 -2.268 1.00 . A A . 10 ILE HG21 1 1 13 5815 1 1 10 ILE HG22 H -8.326 -2.164 -2.786 1.00 . A A . 10 ILE HG22 1 1 13 5816 1 1 10 ILE HG23 H -8.116 -2.979 -1.236 1.00 . A A . 10 ILE HG23 1 1 13 5817 1 1 10 ILE N N -5.035 -1.390 -0.904 1.00 . A A . 10 ILE N 1 1 13 5818 1 1 10 ILE O O -7.168 -1.576 1.907 1.00 . A A . 10 ILE O 1 1 13 5819 1 1 11 VAL C C -5.719 -3.880 3.023 1.00 . A A . 11 VAL C 1 1 13 5820 1 1 11 VAL CA C -6.411 -4.248 1.712 1.00 . A A . 11 VAL CA 1 1 13 5821 1 1 11 VAL CB C -5.899 -5.620 1.224 1.00 . A A . 11 VAL CB 1 1 13 5822 1 1 11 VAL CG1 C -6.749 -6.122 0.066 1.00 . A A . 11 VAL CG1 1 1 13 5823 1 1 11 VAL CG2 C -4.435 -5.539 0.813 1.00 . A A . 11 VAL CG2 1 1 13 5824 1 1 11 VAL H H -5.740 -3.452 -0.119 1.00 . A A . 11 VAL H 1 1 13 5825 1 1 11 VAL HA H -7.474 -4.326 1.888 1.00 . A A . 11 VAL HA 1 1 13 5826 1 1 11 VAL HB H -5.985 -6.327 2.039 1.00 . A A . 11 VAL HB 1 1 13 5827 1 1 11 VAL HG11 H -7.338 -6.967 0.392 1.00 . A A . 11 VAL HG11 1 1 13 5828 1 1 11 VAL HG12 H -6.106 -6.425 -0.748 1.00 . A A . 11 VAL HG12 1 1 13 5829 1 1 11 VAL HG13 H -7.406 -5.332 -0.268 1.00 . A A . 11 VAL HG13 1 1 13 5830 1 1 11 VAL HG21 H -4.307 -4.746 0.092 1.00 . A A . 11 VAL HG21 1 1 13 5831 1 1 11 VAL HG22 H -4.131 -6.478 0.374 1.00 . A A . 11 VAL HG22 1 1 13 5832 1 1 11 VAL HG23 H -3.828 -5.335 1.683 1.00 . A A . 11 VAL HG23 1 1 13 5833 1 1 11 VAL N N -6.196 -3.216 0.708 1.00 . A A . 11 VAL N 1 1 13 5834 1 1 11 VAL O O -4.648 -3.270 3.017 1.00 . A A . 11 VAL O 1 1 13 5835 1 1 12 PRO C C -4.372 -4.439 5.687 1.00 . A A . 12 PRO C 1 1 13 5836 1 1 12 PRO CA C -5.794 -3.919 5.491 1.00 . A A . 12 PRO CA 1 1 13 5837 1 1 12 PRO CB C -6.757 -4.627 6.448 1.00 . A A . 12 PRO CB 1 1 13 5838 1 1 12 PRO CD C -7.629 -4.934 4.248 1.00 . A A . 12 PRO CD 1 1 13 5839 1 1 12 PRO CG C -8.028 -4.753 5.685 1.00 . A A . 12 PRO CG 1 1 13 5840 1 1 12 PRO HA H -5.813 -2.857 5.683 1.00 . A A . 12 PRO HA 1 1 13 5841 1 1 12 PRO HB2 H -6.357 -5.595 6.714 1.00 . A A . 12 PRO HB2 1 1 13 5842 1 1 12 PRO HB3 H -6.889 -4.029 7.337 1.00 . A A . 12 PRO HB3 1 1 13 5843 1 1 12 PRO HD2 H -7.510 -5.983 4.018 1.00 . A A . 12 PRO HD2 1 1 13 5844 1 1 12 PRO HD3 H -8.358 -4.482 3.593 1.00 . A A . 12 PRO HD3 1 1 13 5845 1 1 12 PRO HG2 H -8.582 -5.613 6.032 1.00 . A A . 12 PRO HG2 1 1 13 5846 1 1 12 PRO HG3 H -8.617 -3.855 5.800 1.00 . A A . 12 PRO HG3 1 1 13 5847 1 1 12 PRO N N -6.338 -4.228 4.164 1.00 . A A . 12 PRO N 1 1 13 5848 1 1 12 PRO O O -4.155 -5.631 5.920 1.00 . A A . 12 PRO O 1 1 13 5849 1 1 13 ILE C C -1.727 -4.396 7.176 1.00 . A A . 13 ILE C 1 1 13 5850 1 1 13 ILE CA C -1.998 -3.855 5.776 1.00 . A A . 13 ILE CA 1 1 13 5851 1 1 13 ILE CB C -1.093 -2.632 5.514 1.00 . A A . 13 ILE CB 1 1 13 5852 1 1 13 ILE CD1 C -0.590 -0.251 6.289 1.00 . A A . 13 ILE CD1 1 1 13 5853 1 1 13 ILE CG1 C -1.489 -1.463 6.423 1.00 . A A . 13 ILE CG1 1 1 13 5854 1 1 13 ILE CG2 C -1.168 -2.225 4.048 1.00 . A A . 13 ILE CG2 1 1 13 5855 1 1 13 ILE H H -3.659 -2.594 5.422 1.00 . A A . 13 ILE H 1 1 13 5856 1 1 13 ILE HA H -1.749 -4.620 5.054 1.00 . A A . 13 ILE HA 1 1 13 5857 1 1 13 ILE HB H -0.073 -2.916 5.729 1.00 . A A . 13 ILE HB 1 1 13 5858 1 1 13 ILE HD11 H -0.504 0.240 7.247 1.00 . A A . 13 ILE HD11 1 1 13 5859 1 1 13 ILE HD12 H -1.013 0.433 5.569 1.00 . A A . 13 ILE HD12 1 1 13 5860 1 1 13 ILE HD13 H 0.388 -0.566 5.957 1.00 . A A . 13 ILE HD13 1 1 13 5861 1 1 13 ILE HG12 H -2.495 -1.154 6.183 1.00 . A A . 13 ILE HG12 1 1 13 5862 1 1 13 ILE HG13 H -1.455 -1.790 7.452 1.00 . A A . 13 ILE HG13 1 1 13 5863 1 1 13 ILE HG21 H -1.755 -1.324 3.955 1.00 . A A . 13 ILE HG21 1 1 13 5864 1 1 13 ILE HG22 H -1.632 -3.017 3.479 1.00 . A A . 13 ILE HG22 1 1 13 5865 1 1 13 ILE HG23 H -0.172 -2.048 3.672 1.00 . A A . 13 ILE HG23 1 1 13 5866 1 1 13 ILE N N -3.410 -3.524 5.604 1.00 . A A . 13 ILE N 1 1 13 5867 1 1 13 ILE O O -0.699 -5.018 7.429 1.00 . A A . 13 ILE O 1 1 13 5868 1 1 14 LEU C C -2.613 -6.124 9.544 1.00 . A A . 14 LEU C 1 1 13 5869 1 1 14 LEU CA C -2.571 -4.597 9.453 1.00 . A A . 14 LEU CA 1 1 13 5870 1 1 14 LEU CB C -3.711 -3.990 10.279 1.00 . A A . 14 LEU CB 1 1 13 5871 1 1 14 LEU CD1 C -2.433 -3.672 12.419 1.00 . A A . 14 LEU CD1 1 1 13 5872 1 1 14 LEU CD2 C -4.932 -3.783 12.458 1.00 . A A . 14 LEU CD2 1 1 13 5873 1 1 14 LEU CG C -3.669 -4.290 11.781 1.00 . A A . 14 LEU CG 1 1 13 5874 1 1 14 LEU H H -3.461 -3.649 7.796 1.00 . A A . 14 LEU H 1 1 13 5875 1 1 14 LEU HA H -1.629 -4.249 9.848 1.00 . A A . 14 LEU HA 1 1 13 5876 1 1 14 LEU HB2 H -3.687 -2.918 10.148 1.00 . A A . 14 LEU HB2 1 1 13 5877 1 1 14 LEU HB3 H -4.646 -4.361 9.887 1.00 . A A . 14 LEU HB3 1 1 13 5878 1 1 14 LEU HD11 H -1.637 -3.628 11.690 1.00 . A A . 14 LEU HD11 1 1 13 5879 1 1 14 LEU HD12 H -2.122 -4.276 13.258 1.00 . A A . 14 LEU HD12 1 1 13 5880 1 1 14 LEU HD13 H -2.666 -2.674 12.760 1.00 . A A . 14 LEU HD13 1 1 13 5881 1 1 14 LEU HD21 H -5.321 -4.547 13.115 1.00 . A A . 14 LEU HD21 1 1 13 5882 1 1 14 LEU HD22 H -5.672 -3.543 11.708 1.00 . A A . 14 LEU HD22 1 1 13 5883 1 1 14 LEU HD23 H -4.702 -2.898 13.033 1.00 . A A . 14 LEU HD23 1 1 13 5884 1 1 14 LEU HG H -3.618 -5.360 11.924 1.00 . A A . 14 LEU HG 1 1 13 5885 1 1 14 LEU N N -2.669 -4.148 8.074 1.00 . A A . 14 LEU N 1 1 13 5886 1 1 14 LEU O O -2.140 -6.701 10.522 1.00 . A A . 14 LEU O 1 1 13 5887 1 1 15 GLY C C -3.622 -8.867 7.255 1.00 . A A . 15 GLY C 1 1 13 5888 1 1 15 GLY CA C -3.263 -8.228 8.582 1.00 . A A . 15 GLY CA 1 1 13 5889 1 1 15 GLY H H -3.558 -6.287 7.772 1.00 . A A . 15 GLY H 1 1 13 5890 1 1 15 GLY HA2 H -2.306 -8.613 8.900 1.00 . A A . 15 GLY HA2 1 1 13 5891 1 1 15 GLY HA3 H -4.007 -8.509 9.314 1.00 . A A . 15 GLY HA3 1 1 13 5892 1 1 15 GLY N N -3.185 -6.781 8.537 1.00 . A A . 15 GLY N 1 1 13 5893 1 1 15 GLY O O -4.601 -9.607 7.170 1.00 . A A . 15 GLY O 1 1 13 5894 1 1 16 PHE C C -1.825 -9.048 4.032 1.00 . A A . 16 PHE C 1 1 13 5895 1 1 16 PHE CA C -3.059 -9.204 4.915 1.00 . A A . 16 PHE CA 1 1 13 5896 1 1 16 PHE CB C -4.278 -8.571 4.234 1.00 . A A . 16 PHE CB 1 1 13 5897 1 1 16 PHE CD1 C -5.084 -10.795 3.389 1.00 . A A . 16 PHE CD1 1 1 13 5898 1 1 16 PHE CD2 C -5.241 -8.910 1.939 1.00 . A A . 16 PHE CD2 1 1 13 5899 1 1 16 PHE CE1 C -5.636 -11.599 2.410 1.00 . A A . 16 PHE CE1 1 1 13 5900 1 1 16 PHE CE2 C -5.793 -9.711 0.956 1.00 . A A . 16 PHE CE2 1 1 13 5901 1 1 16 PHE CG C -4.879 -9.441 3.164 1.00 . A A . 16 PHE CG 1 1 13 5902 1 1 16 PHE CZ C -5.992 -11.056 1.192 1.00 . A A . 16 PHE CZ 1 1 13 5903 1 1 16 PHE H H -2.040 -8.032 6.359 1.00 . A A . 16 PHE H 1 1 13 5904 1 1 16 PHE HA H -3.246 -10.258 5.062 1.00 . A A . 16 PHE HA 1 1 13 5905 1 1 16 PHE HB2 H -5.040 -8.378 4.973 1.00 . A A . 16 PHE HB2 1 1 13 5906 1 1 16 PHE HB3 H -3.982 -7.638 3.777 1.00 . A A . 16 PHE HB3 1 1 13 5907 1 1 16 PHE HD1 H -4.806 -11.221 4.342 1.00 . A A . 16 PHE HD1 1 1 13 5908 1 1 16 PHE HD2 H -5.086 -7.859 1.751 1.00 . A A . 16 PHE HD2 1 1 13 5909 1 1 16 PHE HE1 H -5.790 -12.651 2.598 1.00 . A A . 16 PHE HE1 1 1 13 5910 1 1 16 PHE HE2 H -6.072 -9.282 0.004 1.00 . A A . 16 PHE HE2 1 1 13 5911 1 1 16 PHE HZ H -6.423 -11.682 0.426 1.00 . A A . 16 PHE HZ 1 1 13 5912 1 1 16 PHE N N -2.820 -8.611 6.228 1.00 . A A . 16 PHE N 1 1 13 5913 1 1 16 PHE O O -1.176 -10.032 3.677 1.00 . A A . 16 PHE O 1 1 13 5914 1 1 17 VAL C C 0.315 -6.220 3.351 1.00 . A A . 17 VAL C 1 1 13 5915 1 1 17 VAL CA C -0.319 -7.520 2.874 1.00 . A A . 17 VAL CA 1 1 13 5916 1 1 17 VAL CB C -0.646 -7.382 1.361 1.00 . A A . 17 VAL CB 1 1 13 5917 1 1 17 VAL CG1 C 0.543 -7.810 0.511 1.00 . A A . 17 VAL CG1 1 1 13 5918 1 1 17 VAL CG2 C -1.887 -8.172 0.969 1.00 . A A . 17 VAL CG2 1 1 13 5919 1 1 17 VAL H H -2.033 -7.060 4.027 1.00 . A A . 17 VAL H 1 1 13 5920 1 1 17 VAL HA H 0.389 -8.327 3.004 1.00 . A A . 17 VAL HA 1 1 13 5921 1 1 17 VAL HB H -0.833 -6.337 1.158 1.00 . A A . 17 VAL HB 1 1 13 5922 1 1 17 VAL HG11 H 1.368 -8.076 1.155 1.00 . A A . 17 VAL HG11 1 1 13 5923 1 1 17 VAL HG12 H 0.836 -6.995 -0.134 1.00 . A A . 17 VAL HG12 1 1 13 5924 1 1 17 VAL HG13 H 0.267 -8.663 -0.092 1.00 . A A . 17 VAL HG13 1 1 13 5925 1 1 17 VAL HG21 H -2.410 -8.486 1.860 1.00 . A A . 17 VAL HG21 1 1 13 5926 1 1 17 VAL HG22 H -1.595 -9.040 0.397 1.00 . A A . 17 VAL HG22 1 1 13 5927 1 1 17 VAL HG23 H -2.536 -7.549 0.371 1.00 . A A . 17 VAL HG23 1 1 13 5928 1 1 17 VAL N N -1.490 -7.807 3.698 1.00 . A A . 17 VAL N 1 1 13 5929 1 1 17 VAL O O -0.159 -5.617 4.309 1.00 . A A . 17 VAL O 1 1 13 5930 1 1 18 TYR C C 3.126 -4.271 1.966 1.00 . A A . 18 TYR C 1 1 13 5931 1 1 18 TYR CA C 2.079 -4.571 3.031 1.00 . A A . 18 TYR CA 1 1 13 5932 1 1 18 TYR CB C 2.752 -4.719 4.403 1.00 . A A . 18 TYR CB 1 1 13 5933 1 1 18 TYR CD1 C 2.557 -2.269 4.995 1.00 . A A . 18 TYR CD1 1 1 13 5934 1 1 18 TYR CD2 C 4.613 -3.381 5.464 1.00 . A A . 18 TYR CD2 1 1 13 5935 1 1 18 TYR CE1 C 3.070 -1.094 5.511 1.00 . A A . 18 TYR CE1 1 1 13 5936 1 1 18 TYR CE2 C 5.133 -2.209 5.980 1.00 . A A . 18 TYR CE2 1 1 13 5937 1 1 18 TYR CG C 3.318 -3.431 4.962 1.00 . A A . 18 TYR CG 1 1 13 5938 1 1 18 TYR CZ C 4.358 -1.071 6.001 1.00 . A A . 18 TYR CZ 1 1 13 5939 1 1 18 TYR H H 1.695 -6.324 1.921 1.00 . A A . 18 TYR H 1 1 13 5940 1 1 18 TYR HA H 1.363 -3.764 3.065 1.00 . A A . 18 TYR HA 1 1 13 5941 1 1 18 TYR HB2 H 2.027 -5.092 5.110 1.00 . A A . 18 TYR HB2 1 1 13 5942 1 1 18 TYR HB3 H 3.561 -5.429 4.320 1.00 . A A . 18 TYR HB3 1 1 13 5943 1 1 18 TYR HD1 H 1.548 -2.291 4.610 1.00 . A A . 18 TYR HD1 1 1 13 5944 1 1 18 TYR HD2 H 5.219 -4.275 5.444 1.00 . A A . 18 TYR HD2 1 1 13 5945 1 1 18 TYR HE1 H 2.463 -0.202 5.527 1.00 . A A . 18 TYR HE1 1 1 13 5946 1 1 18 TYR HE2 H 6.142 -2.191 6.364 1.00 . A A . 18 TYR HE2 1 1 13 5947 1 1 18 TYR HH H 5.485 -0.109 7.226 1.00 . A A . 18 TYR HH 1 1 13 5948 1 1 18 TYR N N 1.375 -5.796 2.680 1.00 . A A . 18 TYR N 1 1 13 5949 1 1 18 TYR O O 3.588 -5.181 1.284 1.00 . A A . 18 TYR O 1 1 13 5950 1 1 18 TYR OH O 4.870 0.096 6.519 1.00 . A A . 18 TYR OH 1 1 13 5951 1 1 19 CYS C C 5.870 -3.120 1.206 1.00 . A A . 19 CYS C 1 1 13 5952 1 1 19 CYS CA C 4.489 -2.600 0.836 1.00 . A A . 19 CYS CA 1 1 13 5953 1 1 19 CYS CB C 4.546 -1.091 0.761 1.00 . A A . 19 CYS CB 1 1 13 5954 1 1 19 CYS H H 3.079 -2.315 2.390 1.00 . A A . 19 CYS H 1 1 13 5955 1 1 19 CYS HA H 4.203 -2.996 -0.126 1.00 . A A . 19 CYS HA 1 1 13 5956 1 1 19 CYS HB2 H 4.532 -0.717 1.766 1.00 . A A . 19 CYS HB2 1 1 13 5957 1 1 19 CYS HB3 H 5.472 -0.784 0.282 1.00 . A A . 19 CYS HB3 1 1 13 5958 1 1 19 CYS N N 3.489 -3.005 1.819 1.00 . A A . 19 CYS N 1 1 13 5959 1 1 19 CYS O O 6.098 -3.557 2.335 1.00 . A A . 19 CYS O 1 1 13 5960 1 1 19 CYS SG S 3.157 -0.327 -0.127 1.00 . A A . 19 CYS SG 1 1 13 5961 1 1 20 CYS C C 8.800 -2.576 1.503 1.00 . A A . 20 CYS C 1 1 13 5962 1 1 20 CYS CA C 8.156 -3.499 0.485 1.00 . A A . 20 CYS CA 1 1 13 5963 1 1 20 CYS CB C 8.964 -3.473 -0.811 1.00 . A A . 20 CYS CB 1 1 13 5964 1 1 20 CYS H H 6.552 -2.685 -0.624 1.00 . A A . 20 CYS H 1 1 13 5965 1 1 20 CYS HA H 8.125 -4.508 0.876 1.00 . A A . 20 CYS HA 1 1 13 5966 1 1 20 CYS HB2 H 9.205 -2.450 -1.046 1.00 . A A . 20 CYS HB2 1 1 13 5967 1 1 20 CYS HB3 H 9.880 -4.026 -0.662 1.00 . A A . 20 CYS HB3 1 1 13 5968 1 1 20 CYS N N 6.791 -3.055 0.252 1.00 . A A . 20 CYS N 1 1 13 5969 1 1 20 CYS O O 8.415 -1.409 1.601 1.00 . A A . 20 CYS O 1 1 13 5970 1 1 20 CYS SG S 8.104 -4.196 -2.254 1.00 . A A . 20 CYS SG 1 1 13 5971 1 1 21 PRO C C 10.964 -0.954 2.701 1.00 . A A . 21 PRO C 1 1 13 5972 1 1 21 PRO CA C 10.438 -2.250 3.287 1.00 . A A . 21 PRO CA 1 1 13 5973 1 1 21 PRO CB C 11.579 -3.124 3.778 1.00 . A A . 21 PRO CB 1 1 13 5974 1 1 21 PRO CD C 10.299 -4.441 2.248 1.00 . A A . 21 PRO CD 1 1 13 5975 1 1 21 PRO CG C 11.125 -4.519 3.505 1.00 . A A . 21 PRO CG 1 1 13 5976 1 1 21 PRO HA H 9.774 -2.024 4.109 1.00 . A A . 21 PRO HA 1 1 13 5977 1 1 21 PRO HB2 H 12.483 -2.884 3.236 1.00 . A A . 21 PRO HB2 1 1 13 5978 1 1 21 PRO HB3 H 11.722 -2.949 4.831 1.00 . A A . 21 PRO HB3 1 1 13 5979 1 1 21 PRO HD2 H 10.918 -4.596 1.378 1.00 . A A . 21 PRO HD2 1 1 13 5980 1 1 21 PRO HD3 H 9.495 -5.159 2.272 1.00 . A A . 21 PRO HD3 1 1 13 5981 1 1 21 PRO HG2 H 11.981 -5.160 3.353 1.00 . A A . 21 PRO HG2 1 1 13 5982 1 1 21 PRO HG3 H 10.524 -4.878 4.327 1.00 . A A . 21 PRO HG3 1 1 13 5983 1 1 21 PRO N N 9.774 -3.067 2.281 1.00 . A A . 21 PRO N 1 1 13 5984 1 1 21 PRO O O 11.820 -0.947 1.817 1.00 . A A . 21 PRO O 1 1 13 5985 1 1 22 GLY C C 9.598 2.190 2.130 1.00 . A A . 22 GLY C 1 1 13 5986 1 1 22 GLY CA C 10.780 1.444 2.716 1.00 . A A . 22 GLY CA 1 1 13 5987 1 1 22 GLY H H 9.720 0.032 3.872 1.00 . A A . 22 GLY H 1 1 13 5988 1 1 22 GLY HA2 H 11.182 2.013 3.540 1.00 . A A . 22 GLY HA2 1 1 13 5989 1 1 22 GLY HA3 H 11.540 1.340 1.955 1.00 . A A . 22 GLY HA3 1 1 13 5990 1 1 22 GLY N N 10.409 0.130 3.189 1.00 . A A . 22 GLY N 1 1 13 5991 1 1 22 GLY O O 9.550 3.416 2.182 1.00 . A A . 22 GLY O 1 1 13 5992 1 1 23 LEU C C 6.252 1.827 1.876 1.00 . A A . 23 LEU C 1 1 13 5993 1 1 23 LEU CA C 7.462 2.047 0.976 1.00 . A A . 23 LEU CA 1 1 13 5994 1 1 23 LEU CB C 7.215 1.431 -0.403 1.00 . A A . 23 LEU CB 1 1 13 5995 1 1 23 LEU CD1 C 8.105 0.719 -2.633 1.00 . A A . 23 LEU CD1 1 1 13 5996 1 1 23 LEU CD2 C 8.684 2.974 -1.725 1.00 . A A . 23 LEU CD2 1 1 13 5997 1 1 23 LEU CG C 8.392 1.523 -1.376 1.00 . A A . 23 LEU CG 1 1 13 5998 1 1 23 LEU H H 8.728 0.468 1.564 1.00 . A A . 23 LEU H 1 1 13 5999 1 1 23 LEU HA H 7.637 3.106 0.868 1.00 . A A . 23 LEU HA 1 1 13 6000 1 1 23 LEU HB2 H 6.967 0.387 -0.267 1.00 . A A . 23 LEU HB2 1 1 13 6001 1 1 23 LEU HB3 H 6.368 1.929 -0.849 1.00 . A A . 23 LEU HB3 1 1 13 6002 1 1 23 LEU HD11 H 8.824 0.976 -3.397 1.00 . A A . 23 LEU HD11 1 1 13 6003 1 1 23 LEU HD12 H 7.110 0.945 -2.985 1.00 . A A . 23 LEU HD12 1 1 13 6004 1 1 23 LEU HD13 H 8.178 -0.335 -2.411 1.00 . A A . 23 LEU HD13 1 1 13 6005 1 1 23 LEU HD21 H 9.732 3.084 -1.962 1.00 . A A . 23 LEU HD21 1 1 13 6006 1 1 23 LEU HD22 H 8.438 3.604 -0.882 1.00 . A A . 23 LEU HD22 1 1 13 6007 1 1 23 LEU HD23 H 8.089 3.266 -2.578 1.00 . A A . 23 LEU HD23 1 1 13 6008 1 1 23 LEU HG H 9.272 1.106 -0.907 1.00 . A A . 23 LEU HG 1 1 13 6009 1 1 23 LEU N N 8.643 1.449 1.573 1.00 . A A . 23 LEU N 1 1 13 6010 1 1 23 LEU O O 6.157 0.802 2.557 1.00 . A A . 23 LEU O 1 1 13 6011 1 1 24 ILE C C 2.870 2.944 1.896 1.00 . A A . 24 ILE C 1 1 13 6012 1 1 24 ILE CA C 4.134 2.669 2.707 1.00 . A A . 24 ILE CA 1 1 13 6013 1 1 24 ILE CB C 4.179 3.627 3.920 1.00 . A A . 24 ILE CB 1 1 13 6014 1 1 24 ILE CD1 C 4.451 6.076 4.593 1.00 . A A . 24 ILE CD1 1 1 13 6015 1 1 24 ILE CG1 C 4.495 5.059 3.472 1.00 . A A . 24 ILE CG1 1 1 13 6016 1 1 24 ILE CG2 C 5.200 3.144 4.943 1.00 . A A . 24 ILE CG2 1 1 13 6017 1 1 24 ILE H H 5.459 3.580 1.315 1.00 . A A . 24 ILE H 1 1 13 6018 1 1 24 ILE HA H 4.089 1.657 3.083 1.00 . A A . 24 ILE HA 1 1 13 6019 1 1 24 ILE HB H 3.207 3.613 4.390 1.00 . A A . 24 ILE HB 1 1 13 6020 1 1 24 ILE HD11 H 5.045 6.936 4.323 1.00 . A A . 24 ILE HD11 1 1 13 6021 1 1 24 ILE HD12 H 4.847 5.634 5.496 1.00 . A A . 24 ILE HD12 1 1 13 6022 1 1 24 ILE HD13 H 3.429 6.383 4.760 1.00 . A A . 24 ILE HD13 1 1 13 6023 1 1 24 ILE HG12 H 5.485 5.084 3.044 1.00 . A A . 24 ILE HG12 1 1 13 6024 1 1 24 ILE HG13 H 3.777 5.360 2.722 1.00 . A A . 24 ILE HG13 1 1 13 6025 1 1 24 ILE HG21 H 5.613 3.993 5.467 1.00 . A A . 24 ILE HG21 1 1 13 6026 1 1 24 ILE HG22 H 5.993 2.614 4.437 1.00 . A A . 24 ILE HG22 1 1 13 6027 1 1 24 ILE HG23 H 4.718 2.484 5.648 1.00 . A A . 24 ILE HG23 1 1 13 6028 1 1 24 ILE N N 5.331 2.779 1.883 1.00 . A A . 24 ILE N 1 1 13 6029 1 1 24 ILE O O 2.795 3.918 1.148 1.00 . A A . 24 ILE O 1 1 13 6030 1 1 25 CYS C C -0.119 3.488 1.761 1.00 . A A . 25 CYS C 1 1 13 6031 1 1 25 CYS CA C 0.612 2.215 1.329 1.00 . A A . 25 CYS CA 1 1 13 6032 1 1 25 CYS CB C -0.277 0.994 1.574 1.00 . A A . 25 CYS CB 1 1 13 6033 1 1 25 CYS H H 2.004 1.305 2.648 1.00 . A A . 25 CYS H 1 1 13 6034 1 1 25 CYS HA H 0.834 2.283 0.274 1.00 . A A . 25 CYS HA 1 1 13 6035 1 1 25 CYS HB2 H 0.207 0.119 1.166 1.00 . A A . 25 CYS HB2 1 1 13 6036 1 1 25 CYS HB3 H -0.408 0.862 2.638 1.00 . A A . 25 CYS HB3 1 1 13 6037 1 1 25 CYS N N 1.878 2.070 2.045 1.00 . A A . 25 CYS N 1 1 13 6038 1 1 25 CYS O O -0.114 3.845 2.941 1.00 . A A . 25 CYS O 1 1 13 6039 1 1 25 CYS SG S -1.934 1.107 0.820 1.00 . A A . 25 CYS SG 1 1 13 6040 1 1 26 GLY C C -2.751 5.529 0.319 1.00 . A A . 26 GLY C 1 1 13 6041 1 1 26 GLY CA C -1.450 5.396 1.098 1.00 . A A . 26 GLY CA 1 1 13 6042 1 1 26 GLY H H -0.700 3.841 -0.124 1.00 . A A . 26 GLY H 1 1 13 6043 1 1 26 GLY HA2 H -1.675 5.420 2.154 1.00 . A A . 26 GLY HA2 1 1 13 6044 1 1 26 GLY HA3 H -0.814 6.235 0.858 1.00 . A A . 26 GLY HA3 1 1 13 6045 1 1 26 GLY N N -0.737 4.170 0.802 1.00 . A A . 26 GLY N 1 1 13 6046 1 1 26 GLY O O -3.662 4.719 0.489 1.00 . A A . 26 GLY O 1 1 13 6047 1 1 27 PRO C C -4.309 5.811 -2.461 1.00 . A A . 27 PRO C 1 1 13 6048 1 1 27 PRO CA C -4.081 6.825 -1.336 1.00 . A A . 27 PRO CA 1 1 13 6049 1 1 27 PRO CB C -3.828 8.220 -1.912 1.00 . A A . 27 PRO CB 1 1 13 6050 1 1 27 PRO CD C -1.826 7.579 -0.773 1.00 . A A . 27 PRO CD 1 1 13 6051 1 1 27 PRO CG C -2.346 8.351 -1.954 1.00 . A A . 27 PRO CG 1 1 13 6052 1 1 27 PRO HA H -4.959 6.851 -0.709 1.00 . A A . 27 PRO HA 1 1 13 6053 1 1 27 PRO HB2 H -4.260 8.287 -2.900 1.00 . A A . 27 PRO HB2 1 1 13 6054 1 1 27 PRO HB3 H -4.271 8.965 -1.268 1.00 . A A . 27 PRO HB3 1 1 13 6055 1 1 27 PRO HD2 H -0.883 7.112 -1.014 1.00 . A A . 27 PRO HD2 1 1 13 6056 1 1 27 PRO HD3 H -1.719 8.229 0.083 1.00 . A A . 27 PRO HD3 1 1 13 6057 1 1 27 PRO HG2 H -1.966 7.930 -2.873 1.00 . A A . 27 PRO HG2 1 1 13 6058 1 1 27 PRO HG3 H -2.067 9.392 -1.874 1.00 . A A . 27 PRO HG3 1 1 13 6059 1 1 27 PRO N N -2.869 6.564 -0.535 1.00 . A A . 27 PRO N 1 1 13 6060 1 1 27 PRO O O -4.259 6.156 -3.641 1.00 . A A . 27 PRO O 1 1 13 6061 1 1 28 PHE C C -3.523 3.135 -3.799 1.00 . A A . 28 PHE C 1 1 13 6062 1 1 28 PHE CA C -4.786 3.452 -3.000 1.00 . A A . 28 PHE CA 1 1 13 6063 1 1 28 PHE CB C -5.987 3.721 -3.944 1.00 . A A . 28 PHE CB 1 1 13 6064 1 1 28 PHE CD1 C -7.598 4.551 -2.192 1.00 . A A . 28 PHE CD1 1 1 13 6065 1 1 28 PHE CD2 C -8.329 2.855 -3.701 1.00 . A A . 28 PHE CD2 1 1 13 6066 1 1 28 PHE CE1 C -8.835 4.540 -1.577 1.00 . A A . 28 PHE CE1 1 1 13 6067 1 1 28 PHE CE2 C -9.568 2.841 -3.090 1.00 . A A . 28 PHE CE2 1 1 13 6068 1 1 28 PHE CG C -7.329 3.707 -3.261 1.00 . A A . 28 PHE CG 1 1 13 6069 1 1 28 PHE CZ C -9.821 3.685 -2.026 1.00 . A A . 28 PHE CZ 1 1 13 6070 1 1 28 PHE H H -4.559 4.374 -1.105 1.00 . A A . 28 PHE H 1 1 13 6071 1 1 28 PHE HA H -5.018 2.584 -2.397 1.00 . A A . 28 PHE HA 1 1 13 6072 1 1 28 PHE HB2 H -5.875 4.688 -4.413 1.00 . A A . 28 PHE HB2 1 1 13 6073 1 1 28 PHE HB3 H -6.007 2.959 -4.715 1.00 . A A . 28 PHE HB3 1 1 13 6074 1 1 28 PHE HD1 H -6.827 5.219 -1.839 1.00 . A A . 28 PHE HD1 1 1 13 6075 1 1 28 PHE HD2 H -8.132 2.193 -4.531 1.00 . A A . 28 PHE HD2 1 1 13 6076 1 1 28 PHE HE1 H -9.030 5.201 -0.745 1.00 . A A . 28 PHE HE1 1 1 13 6077 1 1 28 PHE HE2 H -10.338 2.172 -3.444 1.00 . A A . 28 PHE HE2 1 1 13 6078 1 1 28 PHE HZ H -10.789 3.675 -1.548 1.00 . A A . 28 PHE HZ 1 1 13 6079 1 1 28 PHE N N -4.549 4.562 -2.069 1.00 . A A . 28 PHE N 1 1 13 6080 1 1 28 PHE O O -3.562 2.375 -4.764 1.00 . A A . 28 PHE O 1 1 13 6081 1 1 29 VAL C C -0.046 3.578 -2.901 1.00 . A A . 29 VAL C 1 1 13 6082 1 1 29 VAL CA C -1.102 3.461 -3.977 1.00 . A A . 29 VAL CA 1 1 13 6083 1 1 29 VAL CB C -0.768 4.464 -5.120 1.00 . A A . 29 VAL CB 1 1 13 6084 1 1 29 VAL CG1 C -1.690 4.270 -6.316 1.00 . A A . 29 VAL CG1 1 1 13 6085 1 1 29 VAL CG2 C -0.838 5.900 -4.620 1.00 . A A . 29 VAL CG2 1 1 13 6086 1 1 29 VAL H H -2.427 4.252 -2.544 1.00 . A A . 29 VAL H 1 1 13 6087 1 1 29 VAL HA H -1.092 2.454 -4.379 1.00 . A A . 29 VAL HA 1 1 13 6088 1 1 29 VAL HB H 0.249 4.273 -5.452 1.00 . A A . 29 VAL HB 1 1 13 6089 1 1 29 VAL HG11 H -1.507 5.050 -7.041 1.00 . A A . 29 VAL HG11 1 1 13 6090 1 1 29 VAL HG12 H -2.718 4.317 -5.988 1.00 . A A . 29 VAL HG12 1 1 13 6091 1 1 29 VAL HG13 H -1.498 3.308 -6.765 1.00 . A A . 29 VAL HG13 1 1 13 6092 1 1 29 VAL HG21 H -1.775 6.343 -4.925 1.00 . A A . 29 VAL HG21 1 1 13 6093 1 1 29 VAL HG22 H -0.019 6.467 -5.038 1.00 . A A . 29 VAL HG22 1 1 13 6094 1 1 29 VAL HG23 H -0.770 5.909 -3.542 1.00 . A A . 29 VAL HG23 1 1 13 6095 1 1 29 VAL N N -2.396 3.689 -3.353 1.00 . A A . 29 VAL N 1 1 13 6096 1 1 29 VAL O O -0.291 4.178 -1.855 1.00 . A A . 29 VAL O 1 1 13 6097 1 1 30 CYS C C 3.035 4.311 -2.415 1.00 . A A . 30 CYS C 1 1 13 6098 1 1 30 CYS CA C 2.185 3.065 -2.179 1.00 . A A . 30 CYS CA 1 1 13 6099 1 1 30 CYS CB C 3.040 1.806 -2.293 1.00 . A A . 30 CYS CB 1 1 13 6100 1 1 30 CYS H H 1.253 2.550 -3.996 1.00 . A A . 30 CYS H 1 1 13 6101 1 1 30 CYS HA H 1.752 3.115 -1.191 1.00 . A A . 30 CYS HA 1 1 13 6102 1 1 30 CYS HB2 H 2.409 0.964 -2.539 1.00 . A A . 30 CYS HB2 1 1 13 6103 1 1 30 CYS HB3 H 3.760 1.946 -3.086 1.00 . A A . 30 CYS HB3 1 1 13 6104 1 1 30 CYS N N 1.108 3.013 -3.142 1.00 . A A . 30 CYS N 1 1 13 6105 1 1 30 CYS O O 3.091 4.832 -3.531 1.00 . A A . 30 CYS O 1 1 13 6106 1 1 30 CYS SG S 3.961 1.412 -0.781 1.00 . A A . 30 CYS SG 1 1 13 6107 1 1 31 VAL C C 5.823 5.771 -0.718 1.00 . A A . 31 VAL C 1 1 13 6108 1 1 31 VAL CA C 4.534 5.970 -1.499 1.00 . A A . 31 VAL CA 1 1 13 6109 1 1 31 VAL CB C 3.829 7.256 -1.003 1.00 . A A . 31 VAL CB 1 1 13 6110 1 1 31 VAL CG1 C 2.664 7.626 -1.911 1.00 . A A . 31 VAL CG1 1 1 13 6111 1 1 31 VAL CG2 C 3.353 7.096 0.434 1.00 . A A . 31 VAL CG2 1 1 13 6112 1 1 31 VAL H H 3.620 4.345 -0.503 1.00 . A A . 31 VAL H 1 1 13 6113 1 1 31 VAL HA H 4.777 6.094 -2.551 1.00 . A A . 31 VAL HA 1 1 13 6114 1 1 31 VAL HB H 4.545 8.065 -1.031 1.00 . A A . 31 VAL HB 1 1 13 6115 1 1 31 VAL HG11 H 2.225 6.728 -2.318 1.00 . A A . 31 VAL HG11 1 1 13 6116 1 1 31 VAL HG12 H 3.022 8.249 -2.718 1.00 . A A . 31 VAL HG12 1 1 13 6117 1 1 31 VAL HG13 H 1.921 8.166 -1.343 1.00 . A A . 31 VAL HG13 1 1 13 6118 1 1 31 VAL HG21 H 2.456 7.678 0.584 1.00 . A A . 31 VAL HG21 1 1 13 6119 1 1 31 VAL HG22 H 4.123 7.440 1.109 1.00 . A A . 31 VAL HG22 1 1 13 6120 1 1 31 VAL HG23 H 3.143 6.054 0.629 1.00 . A A . 31 VAL HG23 1 1 13 6121 1 1 31 VAL N N 3.692 4.793 -1.378 1.00 . A A . 31 VAL N 1 1 13 6122 1 1 31 VAL O O 5.874 4.830 0.098 1.00 . A A . 31 VAL O 1 1 13 6123 1 1 31 VAL OXT O 6.779 6.542 -0.952 1.00 . A A . 31 VAL OXT 1 1 14 6124 1 1 1 ALA C C 5.009 -8.802 -0.755 1.00 . A A . 1 ALA C 1 1 14 6125 1 1 1 ALA CA C 5.256 -10.289 -0.950 1.00 . A A . 1 ALA CA 1 1 14 6126 1 1 1 ALA CB C 4.627 -10.768 -2.250 1.00 . A A . 1 ALA CB 1 1 14 6127 1 1 1 ALA H1 H 3.686 -10.899 0.267 1.00 . A A . 1 ALA H1 1 1 14 6128 1 1 1 ALA H2 H 5.155 -10.722 1.087 1.00 . A A . 1 ALA H2 1 1 14 6129 1 1 1 ALA H3 H 4.900 -12.062 0.082 1.00 . A A . 1 ALA H3 1 1 14 6130 1 1 1 ALA HA H 6.322 -10.464 -1.005 1.00 . A A . 1 ALA HA 1 1 14 6131 1 1 1 ALA HB1 H 4.685 -11.845 -2.303 1.00 . A A . 1 ALA HB1 1 1 14 6132 1 1 1 ALA HB2 H 5.158 -10.337 -3.087 1.00 . A A . 1 ALA HB2 1 1 14 6133 1 1 1 ALA HB3 H 3.592 -10.461 -2.284 1.00 . A A . 1 ALA HB3 1 1 14 6134 1 1 1 ALA N N 4.712 -11.049 0.198 1.00 . A A . 1 ALA N 1 1 14 6135 1 1 1 ALA O O 3.939 -8.407 -0.297 1.00 . A A . 1 ALA O 1 1 14 6136 1 1 2 CYS C C 5.365 -5.919 -2.236 1.00 . A A . 2 CYS C 1 1 14 6137 1 1 2 CYS CA C 5.887 -6.548 -0.947 1.00 . A A . 2 CYS CA 1 1 14 6138 1 1 2 CYS CB C 7.235 -5.957 -0.544 1.00 . A A . 2 CYS CB 1 1 14 6139 1 1 2 CYS H H 6.830 -8.365 -1.450 1.00 . A A . 2 CYS H 1 1 14 6140 1 1 2 CYS HA H 5.172 -6.337 -0.156 1.00 . A A . 2 CYS HA 1 1 14 6141 1 1 2 CYS HB2 H 7.087 -4.932 -0.241 1.00 . A A . 2 CYS HB2 1 1 14 6142 1 1 2 CYS HB3 H 7.620 -6.516 0.298 1.00 . A A . 2 CYS HB3 1 1 14 6143 1 1 2 CYS N N 5.999 -7.990 -1.092 1.00 . A A . 2 CYS N 1 1 14 6144 1 1 2 CYS O O 5.804 -6.263 -3.333 1.00 . A A . 2 CYS O 1 1 14 6145 1 1 2 CYS SG S 8.518 -5.956 -1.836 1.00 . A A . 2 CYS SG 1 1 14 6146 1 1 3 SER C C 4.667 -3.205 -3.717 1.00 . A A . 3 SER C 1 1 14 6147 1 1 3 SER CA C 3.792 -4.352 -3.219 1.00 . A A . 3 SER CA 1 1 14 6148 1 1 3 SER CB C 2.409 -3.825 -2.816 1.00 . A A . 3 SER CB 1 1 14 6149 1 1 3 SER H H 4.087 -4.816 -1.182 1.00 . A A . 3 SER H 1 1 14 6150 1 1 3 SER HA H 3.674 -5.074 -4.012 1.00 . A A . 3 SER HA 1 1 14 6151 1 1 3 SER HB2 H 1.820 -4.638 -2.419 1.00 . A A . 3 SER HB2 1 1 14 6152 1 1 3 SER HB3 H 2.526 -3.064 -2.058 1.00 . A A . 3 SER HB3 1 1 14 6153 1 1 3 SER HG H 2.005 -2.351 -4.045 1.00 . A A . 3 SER HG 1 1 14 6154 1 1 3 SER N N 4.406 -5.023 -2.088 1.00 . A A . 3 SER N 1 1 14 6155 1 1 3 SER O O 5.286 -2.492 -2.921 1.00 . A A . 3 SER O 1 1 14 6156 1 1 3 SER OG O 1.724 -3.265 -3.921 1.00 . A A . 3 SER OG 1 1 14 6157 1 1 4 LYS C C 4.826 -0.601 -5.273 1.00 . A A . 4 LYS C 1 1 14 6158 1 1 4 LYS CA C 5.457 -1.940 -5.645 1.00 . A A . 4 LYS CA 1 1 14 6159 1 1 4 LYS CB C 5.514 -2.098 -7.169 1.00 . A A . 4 LYS CB 1 1 14 6160 1 1 4 LYS CD C 6.134 -3.552 -9.124 1.00 . A A . 4 LYS CD 1 1 14 6161 1 1 4 LYS CE C 4.853 -4.339 -9.353 1.00 . A A . 4 LYS CE 1 1 14 6162 1 1 4 LYS CG C 6.357 -3.274 -7.643 1.00 . A A . 4 LYS CG 1 1 14 6163 1 1 4 LYS H H 4.158 -3.608 -5.606 1.00 . A A . 4 LYS H 1 1 14 6164 1 1 4 LYS HA H 6.460 -1.976 -5.246 1.00 . A A . 4 LYS HA 1 1 14 6165 1 1 4 LYS HB2 H 4.510 -2.234 -7.540 1.00 . A A . 4 LYS HB2 1 1 14 6166 1 1 4 LYS HB3 H 5.924 -1.195 -7.596 1.00 . A A . 4 LYS HB3 1 1 14 6167 1 1 4 LYS HD2 H 6.067 -2.612 -9.651 1.00 . A A . 4 LYS HD2 1 1 14 6168 1 1 4 LYS HD3 H 6.970 -4.122 -9.503 1.00 . A A . 4 LYS HD3 1 1 14 6169 1 1 4 LYS HE2 H 5.110 -5.368 -9.550 1.00 . A A . 4 LYS HE2 1 1 14 6170 1 1 4 LYS HE3 H 4.250 -4.285 -8.458 1.00 . A A . 4 LYS HE3 1 1 14 6171 1 1 4 LYS HG2 H 7.400 -3.046 -7.482 1.00 . A A . 4 LYS HG2 1 1 14 6172 1 1 4 LYS HG3 H 6.085 -4.151 -7.076 1.00 . A A . 4 LYS HG3 1 1 14 6173 1 1 4 LYS HZ1 H 3.053 -3.713 -10.217 1.00 . A A . 4 LYS HZ1 1 1 14 6174 1 1 4 LYS HZ2 H 4.117 -4.460 -11.308 1.00 . A A . 4 LYS HZ2 1 1 14 6175 1 1 4 LYS HZ3 H 4.415 -2.880 -10.786 1.00 . A A . 4 LYS HZ3 1 1 14 6176 1 1 4 LYS N N 4.692 -3.018 -5.035 1.00 . A A . 4 LYS N 1 1 14 6177 1 1 4 LYS NZ N 4.061 -3.813 -10.501 1.00 . A A . 4 LYS NZ 1 1 14 6178 1 1 4 LYS O O 3.619 -0.517 -5.035 1.00 . A A . 4 LYS O 1 1 14 6179 1 1 5 LYS C C 3.984 2.250 -5.591 1.00 . A A . 5 LYS C 1 1 14 6180 1 1 5 LYS CA C 5.176 1.750 -4.785 1.00 . A A . 5 LYS CA 1 1 14 6181 1 1 5 LYS CB C 6.313 2.776 -4.861 1.00 . A A . 5 LYS CB 1 1 14 6182 1 1 5 LYS CD C 6.898 5.172 -4.316 1.00 . A A . 5 LYS CD 1 1 14 6183 1 1 5 LYS CE C 6.404 6.608 -4.367 1.00 . A A . 5 LYS CE 1 1 14 6184 1 1 5 LYS CG C 5.825 4.217 -4.793 1.00 . A A . 5 LYS CG 1 1 14 6185 1 1 5 LYS H H 6.601 0.294 -5.349 1.00 . A A . 5 LYS H 1 1 14 6186 1 1 5 LYS HA H 4.862 1.674 -3.762 1.00 . A A . 5 LYS HA 1 1 14 6187 1 1 5 LYS HB2 H 6.993 2.608 -4.038 1.00 . A A . 5 LYS HB2 1 1 14 6188 1 1 5 LYS HB3 H 6.846 2.641 -5.791 1.00 . A A . 5 LYS HB3 1 1 14 6189 1 1 5 LYS HD2 H 7.162 4.926 -3.298 1.00 . A A . 5 LYS HD2 1 1 14 6190 1 1 5 LYS HD3 H 7.765 5.074 -4.953 1.00 . A A . 5 LYS HD3 1 1 14 6191 1 1 5 LYS HE2 H 6.602 7.008 -5.352 1.00 . A A . 5 LYS HE2 1 1 14 6192 1 1 5 LYS HE3 H 5.337 6.618 -4.186 1.00 . A A . 5 LYS HE3 1 1 14 6193 1 1 5 LYS HG2 H 5.501 4.527 -5.768 1.00 . A A . 5 LYS HG2 1 1 14 6194 1 1 5 LYS HG3 H 4.991 4.262 -4.122 1.00 . A A . 5 LYS HG3 1 1 14 6195 1 1 5 LYS HZ1 H 7.051 6.990 -2.413 1.00 . A A . 5 LYS HZ1 1 1 14 6196 1 1 5 LYS HZ2 H 6.607 8.379 -3.280 1.00 . A A . 5 LYS HZ2 1 1 14 6197 1 1 5 LYS HZ3 H 8.074 7.612 -3.615 1.00 . A A . 5 LYS HZ3 1 1 14 6198 1 1 5 LYS N N 5.648 0.430 -5.181 1.00 . A A . 5 LYS N 1 1 14 6199 1 1 5 LYS NZ N 7.083 7.461 -3.353 1.00 . A A . 5 LYS NZ 1 1 14 6200 1 1 5 LYS O O 2.959 2.598 -5.043 1.00 . A A . 5 LYS O 1 1 14 6201 1 1 6 TRP C C 1.939 1.823 -7.944 1.00 . A A . 6 TRP C 1 1 14 6202 1 1 6 TRP CA C 3.024 2.857 -7.670 1.00 . A A . 6 TRP CA 1 1 14 6203 1 1 6 TRP CB C 3.581 3.480 -8.946 1.00 . A A . 6 TRP CB 1 1 14 6204 1 1 6 TRP CD1 C 6.063 3.990 -8.519 1.00 . A A . 6 TRP CD1 1 1 14 6205 1 1 6 TRP CD2 C 4.749 5.800 -8.476 1.00 . A A . 6 TRP CD2 1 1 14 6206 1 1 6 TRP CE2 C 6.080 6.204 -8.254 1.00 . A A . 6 TRP CE2 1 1 14 6207 1 1 6 TRP CE3 C 3.748 6.772 -8.482 1.00 . A A . 6 TRP CE3 1 1 14 6208 1 1 6 TRP CG C 4.763 4.378 -8.674 1.00 . A A . 6 TRP CG 1 1 14 6209 1 1 6 TRP CH2 C 5.427 8.464 -8.052 1.00 . A A . 6 TRP CH2 1 1 14 6210 1 1 6 TRP CZ2 C 6.430 7.536 -8.042 1.00 . A A . 6 TRP CZ2 1 1 14 6211 1 1 6 TRP CZ3 C 4.095 8.093 -8.267 1.00 . A A . 6 TRP CZ3 1 1 14 6212 1 1 6 TRP H H 4.940 2.063 -7.299 1.00 . A A . 6 TRP H 1 1 14 6213 1 1 6 TRP HA H 2.565 3.648 -7.081 1.00 . A A . 6 TRP HA 1 1 14 6214 1 1 6 TRP HB2 H 3.900 2.695 -9.617 1.00 . A A . 6 TRP HB2 1 1 14 6215 1 1 6 TRP HB3 H 2.811 4.071 -9.420 1.00 . A A . 6 TRP HB3 1 1 14 6216 1 1 6 TRP HD1 H 6.400 2.971 -8.583 1.00 . A A . 6 TRP HD1 1 1 14 6217 1 1 6 TRP HE1 H 7.834 5.061 -8.167 1.00 . A A . 6 TRP HE1 1 1 14 6218 1 1 6 TRP HE3 H 2.717 6.506 -8.635 1.00 . A A . 6 TRP HE3 1 1 14 6219 1 1 6 TRP HH2 H 5.653 9.507 -7.888 1.00 . A A . 6 TRP HH2 1 1 14 6220 1 1 6 TRP HZ2 H 7.454 7.838 -7.875 1.00 . A A . 6 TRP HZ2 1 1 14 6221 1 1 6 TRP HZ3 H 3.331 8.856 -8.267 1.00 . A A . 6 TRP HZ3 1 1 14 6222 1 1 6 TRP N N 4.111 2.328 -6.877 1.00 . A A . 6 TRP N 1 1 14 6223 1 1 6 TRP NE1 N 6.862 5.083 -8.288 1.00 . A A . 6 TRP NE1 1 1 14 6224 1 1 6 TRP O O 1.149 1.980 -8.873 1.00 . A A . 6 TRP O 1 1 14 6225 1 1 7 GLU C C -0.474 0.354 -6.623 1.00 . A A . 7 GLU C 1 1 14 6226 1 1 7 GLU CA C 0.798 -0.192 -7.245 1.00 . A A . 7 GLU CA 1 1 14 6227 1 1 7 GLU CB C 1.132 -1.527 -6.582 1.00 . A A . 7 GLU CB 1 1 14 6228 1 1 7 GLU CD C 2.132 -2.495 -8.706 1.00 . A A . 7 GLU CD 1 1 14 6229 1 1 7 GLU CG C 2.281 -2.286 -7.215 1.00 . A A . 7 GLU CG 1 1 14 6230 1 1 7 GLU H H 2.489 0.745 -6.328 1.00 . A A . 7 GLU H 1 1 14 6231 1 1 7 GLU HA H 0.633 -0.347 -8.301 1.00 . A A . 7 GLU HA 1 1 14 6232 1 1 7 GLU HB2 H 1.384 -1.344 -5.548 1.00 . A A . 7 GLU HB2 1 1 14 6233 1 1 7 GLU HB3 H 0.255 -2.156 -6.617 1.00 . A A . 7 GLU HB3 1 1 14 6234 1 1 7 GLU HG2 H 3.193 -1.734 -7.040 1.00 . A A . 7 GLU HG2 1 1 14 6235 1 1 7 GLU HG3 H 2.357 -3.253 -6.738 1.00 . A A . 7 GLU HG3 1 1 14 6236 1 1 7 GLU N N 1.857 0.800 -7.095 1.00 . A A . 7 GLU N 1 1 14 6237 1 1 7 GLU O O -0.428 1.016 -5.584 1.00 . A A . 7 GLU O 1 1 14 6238 1 1 7 GLU OE1 O 2.393 -1.553 -9.473 1.00 . A A . 7 GLU OE1 1 1 14 6239 1 1 7 GLU OE2 O 1.811 -3.627 -9.122 1.00 . A A . 7 GLU OE2 1 1 14 6240 1 1 8 TYR C C -3.341 -0.309 -5.556 1.00 . A A . 8 TYR C 1 1 14 6241 1 1 8 TYR CA C -2.892 0.541 -6.751 1.00 . A A . 8 TYR CA 1 1 14 6242 1 1 8 TYR CB C -3.936 0.487 -7.876 1.00 . A A . 8 TYR CB 1 1 14 6243 1 1 8 TYR CD1 C -5.168 2.647 -7.426 1.00 . A A . 8 TYR CD1 1 1 14 6244 1 1 8 TYR CD2 C -6.430 0.627 -7.501 1.00 . A A . 8 TYR CD2 1 1 14 6245 1 1 8 TYR CE1 C -6.321 3.363 -7.174 1.00 . A A . 8 TYR CE1 1 1 14 6246 1 1 8 TYR CE2 C -7.589 1.336 -7.251 1.00 . A A . 8 TYR CE2 1 1 14 6247 1 1 8 TYR CG C -5.201 1.268 -7.592 1.00 . A A . 8 TYR CG 1 1 14 6248 1 1 8 TYR CZ C -7.529 2.704 -7.087 1.00 . A A . 8 TYR CZ 1 1 14 6249 1 1 8 TYR H H -1.573 -0.456 -8.071 1.00 . A A . 8 TYR H 1 1 14 6250 1 1 8 TYR HA H -2.773 1.565 -6.424 1.00 . A A . 8 TYR HA 1 1 14 6251 1 1 8 TYR HB2 H -3.499 0.887 -8.778 1.00 . A A . 8 TYR HB2 1 1 14 6252 1 1 8 TYR HB3 H -4.213 -0.544 -8.046 1.00 . A A . 8 TYR HB3 1 1 14 6253 1 1 8 TYR HD1 H -4.220 3.161 -7.496 1.00 . A A . 8 TYR HD1 1 1 14 6254 1 1 8 TYR HD2 H -6.473 -0.445 -7.627 1.00 . A A . 8 TYR HD2 1 1 14 6255 1 1 8 TYR HE1 H -6.275 4.435 -7.047 1.00 . A A . 8 TYR HE1 1 1 14 6256 1 1 8 TYR HE2 H -8.534 0.820 -7.183 1.00 . A A . 8 TYR HE2 1 1 14 6257 1 1 8 TYR HH H -8.479 4.353 -6.830 1.00 . A A . 8 TYR HH 1 1 14 6258 1 1 8 TYR N N -1.604 0.078 -7.250 1.00 . A A . 8 TYR N 1 1 14 6259 1 1 8 TYR O O -4.404 -0.936 -5.580 1.00 . A A . 8 TYR O 1 1 14 6260 1 1 8 TYR OH O -8.679 3.415 -6.839 1.00 . A A . 8 TYR OH 1 1 14 6261 1 1 9 CYS C C -3.832 -0.372 -2.438 1.00 . A A . 9 CYS C 1 1 14 6262 1 1 9 CYS CA C -2.831 -1.110 -3.320 1.00 . A A . 9 CYS CA 1 1 14 6263 1 1 9 CYS CB C -1.558 -1.459 -2.536 1.00 . A A . 9 CYS CB 1 1 14 6264 1 1 9 CYS H H -1.682 0.175 -4.550 1.00 . A A . 9 CYS H 1 1 14 6265 1 1 9 CYS HA H -3.291 -2.031 -3.649 1.00 . A A . 9 CYS HA 1 1 14 6266 1 1 9 CYS HB2 H -1.840 -1.911 -1.597 1.00 . A A . 9 CYS HB2 1 1 14 6267 1 1 9 CYS HB3 H -0.980 -2.170 -3.109 1.00 . A A . 9 CYS HB3 1 1 14 6268 1 1 9 CYS N N -2.521 -0.338 -4.513 1.00 . A A . 9 CYS N 1 1 14 6269 1 1 9 CYS O O -3.481 0.196 -1.407 1.00 . A A . 9 CYS O 1 1 14 6270 1 1 9 CYS SG S -0.473 -0.045 -2.156 1.00 . A A . 9 CYS SG 1 1 14 6271 1 1 10 ILE C C -6.335 -0.359 -0.752 1.00 . A A . 10 ILE C 1 1 14 6272 1 1 10 ILE CA C -6.171 0.265 -2.140 1.00 . A A . 10 ILE CA 1 1 14 6273 1 1 10 ILE CB C -7.504 0.176 -2.929 1.00 . A A . 10 ILE CB 1 1 14 6274 1 1 10 ILE CD1 C -9.982 0.784 -2.858 1.00 . A A . 10 ILE CD1 1 1 14 6275 1 1 10 ILE CG1 C -8.652 0.808 -2.134 1.00 . A A . 10 ILE CG1 1 1 14 6276 1 1 10 ILE CG2 C -7.825 -1.271 -3.286 1.00 . A A . 10 ILE CG2 1 1 14 6277 1 1 10 ILE H H -5.295 -0.855 -3.706 1.00 . A A . 10 ILE H 1 1 14 6278 1 1 10 ILE HA H -5.913 1.308 -2.026 1.00 . A A . 10 ILE HA 1 1 14 6279 1 1 10 ILE HB H -7.378 0.722 -3.851 1.00 . A A . 10 ILE HB 1 1 14 6280 1 1 10 ILE HD11 H -10.723 0.306 -2.233 1.00 . A A . 10 ILE HD11 1 1 14 6281 1 1 10 ILE HD12 H -9.879 0.234 -3.781 1.00 . A A . 10 ILE HD12 1 1 14 6282 1 1 10 ILE HD13 H -10.293 1.796 -3.073 1.00 . A A . 10 ILE HD13 1 1 14 6283 1 1 10 ILE HG12 H -8.773 0.273 -1.203 1.00 . A A . 10 ILE HG12 1 1 14 6284 1 1 10 ILE HG13 H -8.407 1.839 -1.920 1.00 . A A . 10 ILE HG13 1 1 14 6285 1 1 10 ILE HG21 H -8.271 -1.762 -2.434 1.00 . A A . 10 ILE HG21 1 1 14 6286 1 1 10 ILE HG22 H -6.917 -1.784 -3.563 1.00 . A A . 10 ILE HG22 1 1 14 6287 1 1 10 ILE HG23 H -8.517 -1.292 -4.115 1.00 . A A . 10 ILE HG23 1 1 14 6288 1 1 10 ILE N N -5.090 -0.388 -2.868 1.00 . A A . 10 ILE N 1 1 14 6289 1 1 10 ILE O O -6.731 0.309 0.204 1.00 . A A . 10 ILE O 1 1 14 6290 1 1 11 VAL C C -5.052 -1.874 1.597 1.00 . A A . 11 VAL C 1 1 14 6291 1 1 11 VAL CA C -6.101 -2.370 0.602 1.00 . A A . 11 VAL CA 1 1 14 6292 1 1 11 VAL CB C -5.942 -3.891 0.387 1.00 . A A . 11 VAL CB 1 1 14 6293 1 1 11 VAL CG1 C -7.164 -4.458 -0.321 1.00 . A A . 11 VAL CG1 1 1 14 6294 1 1 11 VAL CG2 C -4.679 -4.200 -0.407 1.00 . A A . 11 VAL CG2 1 1 14 6295 1 1 11 VAL H H -5.690 -2.111 -1.451 1.00 . A A . 11 VAL H 1 1 14 6296 1 1 11 VAL HA H -7.083 -2.189 1.016 1.00 . A A . 11 VAL HA 1 1 14 6297 1 1 11 VAL HB H -5.860 -4.365 1.354 1.00 . A A . 11 VAL HB 1 1 14 6298 1 1 11 VAL HG11 H -7.525 -3.742 -1.045 1.00 . A A . 11 VAL HG11 1 1 14 6299 1 1 11 VAL HG12 H -7.938 -4.659 0.404 1.00 . A A . 11 VAL HG12 1 1 14 6300 1 1 11 VAL HG13 H -6.895 -5.374 -0.824 1.00 . A A . 11 VAL HG13 1 1 14 6301 1 1 11 VAL HG21 H -4.410 -3.342 -1.005 1.00 . A A . 11 VAL HG21 1 1 14 6302 1 1 11 VAL HG22 H -4.858 -5.047 -1.053 1.00 . A A . 11 VAL HG22 1 1 14 6303 1 1 11 VAL HG23 H -3.873 -4.431 0.275 1.00 . A A . 11 VAL HG23 1 1 14 6304 1 1 11 VAL N N -6.012 -1.644 -0.655 1.00 . A A . 11 VAL N 1 1 14 6305 1 1 11 VAL O O -3.886 -1.685 1.250 1.00 . A A . 11 VAL O 1 1 14 6306 1 1 12 PRO C C -3.532 -2.201 4.317 1.00 . A A . 12 PRO C 1 1 14 6307 1 1 12 PRO CA C -4.565 -1.157 3.900 1.00 . A A . 12 PRO CA 1 1 14 6308 1 1 12 PRO CB C -5.511 -0.844 5.062 1.00 . A A . 12 PRO CB 1 1 14 6309 1 1 12 PRO CD C -6.840 -1.828 3.339 1.00 . A A . 12 PRO CD 1 1 14 6310 1 1 12 PRO CG C -6.701 -1.708 4.830 1.00 . A A . 12 PRO CG 1 1 14 6311 1 1 12 PRO HA H -4.056 -0.255 3.595 1.00 . A A . 12 PRO HA 1 1 14 6312 1 1 12 PRO HB2 H -5.026 -1.081 5.998 1.00 . A A . 12 PRO HB2 1 1 14 6313 1 1 12 PRO HB3 H -5.775 0.203 5.042 1.00 . A A . 12 PRO HB3 1 1 14 6314 1 1 12 PRO HD2 H -7.216 -2.806 3.072 1.00 . A A . 12 PRO HD2 1 1 14 6315 1 1 12 PRO HD3 H -7.491 -1.056 2.957 1.00 . A A . 12 PRO HD3 1 1 14 6316 1 1 12 PRO HG2 H -6.540 -2.681 5.271 1.00 . A A . 12 PRO HG2 1 1 14 6317 1 1 12 PRO HG3 H -7.580 -1.244 5.252 1.00 . A A . 12 PRO HG3 1 1 14 6318 1 1 12 PRO N N -5.463 -1.643 2.851 1.00 . A A . 12 PRO N 1 1 14 6319 1 1 12 PRO O O -3.842 -3.390 4.414 1.00 . A A . 12 PRO O 1 1 14 6320 1 1 13 ILE C C -1.628 -3.486 6.168 1.00 . A A . 13 ILE C 1 1 14 6321 1 1 13 ILE CA C -1.214 -2.625 4.977 1.00 . A A . 13 ILE CA 1 1 14 6322 1 1 13 ILE CB C 0.046 -1.813 5.355 1.00 . A A . 13 ILE CB 1 1 14 6323 1 1 13 ILE CD1 C 1.645 -0.021 4.513 1.00 . A A . 13 ILE CD1 1 1 14 6324 1 1 13 ILE CG1 C 0.471 -0.918 4.189 1.00 . A A . 13 ILE CG1 1 1 14 6325 1 1 13 ILE CG2 C 1.183 -2.745 5.756 1.00 . A A . 13 ILE CG2 1 1 14 6326 1 1 13 ILE H H -2.132 -0.786 4.468 1.00 . A A . 13 ILE H 1 1 14 6327 1 1 13 ILE HA H -0.969 -3.268 4.144 1.00 . A A . 13 ILE HA 1 1 14 6328 1 1 13 ILE HB H -0.196 -1.194 6.205 1.00 . A A . 13 ILE HB 1 1 14 6329 1 1 13 ILE HD11 H 2.372 -0.077 3.716 1.00 . A A . 13 ILE HD11 1 1 14 6330 1 1 13 ILE HD12 H 2.100 -0.343 5.439 1.00 . A A . 13 ILE HD12 1 1 14 6331 1 1 13 ILE HD13 H 1.303 0.998 4.616 1.00 . A A . 13 ILE HD13 1 1 14 6332 1 1 13 ILE HG12 H 0.750 -1.538 3.350 1.00 . A A . 13 ILE HG12 1 1 14 6333 1 1 13 ILE HG13 H -0.360 -0.290 3.904 1.00 . A A . 13 ILE HG13 1 1 14 6334 1 1 13 ILE HG21 H 2.046 -2.158 6.035 1.00 . A A . 13 ILE HG21 1 1 14 6335 1 1 13 ILE HG22 H 1.435 -3.384 4.924 1.00 . A A . 13 ILE HG22 1 1 14 6336 1 1 13 ILE HG23 H 0.874 -3.351 6.595 1.00 . A A . 13 ILE HG23 1 1 14 6337 1 1 13 ILE N N -2.307 -1.743 4.566 1.00 . A A . 13 ILE N 1 1 14 6338 1 1 13 ILE O O -1.359 -4.683 6.208 1.00 . A A . 13 ILE O 1 1 14 6339 1 1 14 LEU C C -4.112 -4.281 8.031 1.00 . A A . 14 LEU C 1 1 14 6340 1 1 14 LEU CA C -2.778 -3.582 8.307 1.00 . A A . 14 LEU CA 1 1 14 6341 1 1 14 LEU CB C -2.880 -2.651 9.543 1.00 . A A . 14 LEU CB 1 1 14 6342 1 1 14 LEU CD1 C -2.423 -0.322 8.640 1.00 . A A . 14 LEU CD1 1 1 14 6343 1 1 14 LEU CD2 C -4.758 -1.219 8.593 1.00 . A A . 14 LEU CD2 1 1 14 6344 1 1 14 LEU CG C -3.433 -1.218 9.344 1.00 . A A . 14 LEU CG 1 1 14 6345 1 1 14 LEU H H -2.507 -1.919 7.032 1.00 . A A . 14 LEU H 1 1 14 6346 1 1 14 LEU HA H -2.045 -4.348 8.522 1.00 . A A . 14 LEU HA 1 1 14 6347 1 1 14 LEU HB2 H -3.510 -3.143 10.269 1.00 . A A . 14 LEU HB2 1 1 14 6348 1 1 14 LEU HB3 H -1.890 -2.565 9.968 1.00 . A A . 14 LEU HB3 1 1 14 6349 1 1 14 LEU HD11 H -2.019 -0.839 7.783 1.00 . A A . 14 LEU HD11 1 1 14 6350 1 1 14 LEU HD12 H -1.623 -0.075 9.322 1.00 . A A . 14 LEU HD12 1 1 14 6351 1 1 14 LEU HD13 H -2.912 0.585 8.314 1.00 . A A . 14 LEU HD13 1 1 14 6352 1 1 14 LEU HD21 H -5.393 -0.435 8.982 1.00 . A A . 14 LEU HD21 1 1 14 6353 1 1 14 LEU HD22 H -5.244 -2.174 8.723 1.00 . A A . 14 LEU HD22 1 1 14 6354 1 1 14 LEU HD23 H -4.576 -1.046 7.543 1.00 . A A . 14 LEU HD23 1 1 14 6355 1 1 14 LEU HG H -3.613 -0.787 10.320 1.00 . A A . 14 LEU HG 1 1 14 6356 1 1 14 LEU N N -2.306 -2.870 7.127 1.00 . A A . 14 LEU N 1 1 14 6357 1 1 14 LEU O O -4.957 -4.406 8.916 1.00 . A A . 14 LEU O 1 1 14 6358 1 1 15 GLY C C -5.265 -6.434 5.320 1.00 . A A . 15 GLY C 1 1 14 6359 1 1 15 GLY CA C -5.506 -5.416 6.415 1.00 . A A . 15 GLY CA 1 1 14 6360 1 1 15 GLY H H -3.575 -4.604 6.130 1.00 . A A . 15 GLY H 1 1 14 6361 1 1 15 GLY HA2 H -5.913 -5.919 7.281 1.00 . A A . 15 GLY HA2 1 1 14 6362 1 1 15 GLY HA3 H -6.220 -4.687 6.064 1.00 . A A . 15 GLY HA3 1 1 14 6363 1 1 15 GLY N N -4.287 -4.735 6.797 1.00 . A A . 15 GLY N 1 1 14 6364 1 1 15 GLY O O -5.792 -7.546 5.373 1.00 . A A . 15 GLY O 1 1 14 6365 1 1 16 PHE C C -2.915 -6.455 2.474 1.00 . A A . 16 PHE C 1 1 14 6366 1 1 16 PHE CA C -4.153 -6.948 3.222 1.00 . A A . 16 PHE CA 1 1 14 6367 1 1 16 PHE CB C -5.351 -7.043 2.268 1.00 . A A . 16 PHE CB 1 1 14 6368 1 1 16 PHE CD1 C -4.793 -9.417 1.660 1.00 . A A . 16 PHE CD1 1 1 14 6369 1 1 16 PHE CD2 C -5.637 -7.978 -0.045 1.00 . A A . 16 PHE CD2 1 1 14 6370 1 1 16 PHE CE1 C -4.710 -10.453 0.749 1.00 . A A . 16 PHE CE1 1 1 14 6371 1 1 16 PHE CE2 C -5.556 -9.010 -0.960 1.00 . A A . 16 PHE CE2 1 1 14 6372 1 1 16 PHE CG C -5.257 -8.169 1.274 1.00 . A A . 16 PHE CG 1 1 14 6373 1 1 16 PHE CZ C -5.091 -10.249 -0.563 1.00 . A A . 16 PHE CZ 1 1 14 6374 1 1 16 PHE H H -4.070 -5.157 4.341 1.00 . A A . 16 PHE H 1 1 14 6375 1 1 16 PHE HA H -3.947 -7.927 3.629 1.00 . A A . 16 PHE HA 1 1 14 6376 1 1 16 PHE HB2 H -6.250 -7.190 2.847 1.00 . A A . 16 PHE HB2 1 1 14 6377 1 1 16 PHE HB3 H -5.433 -6.119 1.716 1.00 . A A . 16 PHE HB3 1 1 14 6378 1 1 16 PHE HD1 H -4.496 -9.578 2.686 1.00 . A A . 16 PHE HD1 1 1 14 6379 1 1 16 PHE HD2 H -5.999 -7.009 -0.357 1.00 . A A . 16 PHE HD2 1 1 14 6380 1 1 16 PHE HE1 H -4.347 -11.421 1.062 1.00 . A A . 16 PHE HE1 1 1 14 6381 1 1 16 PHE HE2 H -5.855 -8.848 -1.985 1.00 . A A . 16 PHE HE2 1 1 14 6382 1 1 16 PHE HZ H -5.027 -11.056 -1.277 1.00 . A A . 16 PHE HZ 1 1 14 6383 1 1 16 PHE N N -4.464 -6.059 4.329 1.00 . A A . 16 PHE N 1 1 14 6384 1 1 16 PHE O O -2.800 -5.270 2.163 1.00 . A A . 16 PHE O 1 1 14 6385 1 1 17 VAL C C 0.128 -6.116 2.299 1.00 . A A . 17 VAL C 1 1 14 6386 1 1 17 VAL CA C -0.735 -7.103 1.498 1.00 . A A . 17 VAL CA 1 1 14 6387 1 1 17 VAL CB C -0.957 -6.566 0.051 1.00 . A A . 17 VAL CB 1 1 14 6388 1 1 17 VAL CG1 C 0.245 -6.866 -0.839 1.00 . A A . 17 VAL CG1 1 1 14 6389 1 1 17 VAL CG2 C -2.215 -7.153 -0.574 1.00 . A A . 17 VAL CG2 1 1 14 6390 1 1 17 VAL H H -2.167 -8.302 2.493 1.00 . A A . 17 VAL H 1 1 14 6391 1 1 17 VAL HA H -0.193 -8.036 1.424 1.00 . A A . 17 VAL HA 1 1 14 6392 1 1 17 VAL HB H -1.071 -5.495 0.104 1.00 . A A . 17 VAL HB 1 1 14 6393 1 1 17 VAL HG11 H 0.916 -7.538 -0.324 1.00 . A A . 17 VAL HG11 1 1 14 6394 1 1 17 VAL HG12 H 0.762 -5.946 -1.071 1.00 . A A . 17 VAL HG12 1 1 14 6395 1 1 17 VAL HG13 H -0.093 -7.328 -1.755 1.00 . A A . 17 VAL HG13 1 1 14 6396 1 1 17 VAL HG21 H -2.435 -6.635 -1.496 1.00 . A A . 17 VAL HG21 1 1 14 6397 1 1 17 VAL HG22 H -3.044 -7.039 0.108 1.00 . A A . 17 VAL HG22 1 1 14 6398 1 1 17 VAL HG23 H -2.060 -8.202 -0.780 1.00 . A A . 17 VAL HG23 1 1 14 6399 1 1 17 VAL N N -1.995 -7.386 2.201 1.00 . A A . 17 VAL N 1 1 14 6400 1 1 17 VAL O O -0.192 -5.776 3.438 1.00 . A A . 17 VAL O 1 1 14 6401 1 1 18 TYR C C 3.270 -4.383 1.353 1.00 . A A . 18 TYR C 1 1 14 6402 1 1 18 TYR CA C 2.164 -4.753 2.335 1.00 . A A . 18 TYR CA 1 1 14 6403 1 1 18 TYR CB C 2.773 -5.375 3.607 1.00 . A A . 18 TYR CB 1 1 14 6404 1 1 18 TYR CD1 C 4.840 -6.695 2.967 1.00 . A A . 18 TYR CD1 1 1 14 6405 1 1 18 TYR CD2 C 2.874 -7.903 3.566 1.00 . A A . 18 TYR CD2 1 1 14 6406 1 1 18 TYR CE1 C 5.511 -7.884 2.754 1.00 . A A . 18 TYR CE1 1 1 14 6407 1 1 18 TYR CE2 C 3.538 -9.096 3.355 1.00 . A A . 18 TYR CE2 1 1 14 6408 1 1 18 TYR CG C 3.510 -6.682 3.374 1.00 . A A . 18 TYR CG 1 1 14 6409 1 1 18 TYR CZ C 4.856 -9.080 2.949 1.00 . A A . 18 TYR CZ 1 1 14 6410 1 1 18 TYR H H 1.430 -5.998 0.799 1.00 . A A . 18 TYR H 1 1 14 6411 1 1 18 TYR HA H 1.618 -3.860 2.602 1.00 . A A . 18 TYR HA 1 1 14 6412 1 1 18 TYR HB2 H 3.473 -4.676 4.038 1.00 . A A . 18 TYR HB2 1 1 14 6413 1 1 18 TYR HB3 H 1.981 -5.564 4.317 1.00 . A A . 18 TYR HB3 1 1 14 6414 1 1 18 TYR HD1 H 5.352 -5.756 2.816 1.00 . A A . 18 TYR HD1 1 1 14 6415 1 1 18 TYR HD2 H 1.842 -7.912 3.883 1.00 . A A . 18 TYR HD2 1 1 14 6416 1 1 18 TYR HE1 H 6.543 -7.872 2.437 1.00 . A A . 18 TYR HE1 1 1 14 6417 1 1 18 TYR HE2 H 3.026 -10.033 3.509 1.00 . A A . 18 TYR HE2 1 1 14 6418 1 1 18 TYR HH H 5.981 -10.529 3.535 1.00 . A A . 18 TYR HH 1 1 14 6419 1 1 18 TYR N N 1.231 -5.679 1.700 1.00 . A A . 18 TYR N 1 1 14 6420 1 1 18 TYR O O 3.692 -5.214 0.550 1.00 . A A . 18 TYR O 1 1 14 6421 1 1 18 TYR OH O 5.519 -10.269 2.727 1.00 . A A . 18 TYR OH 1 1 14 6422 1 1 19 CYS C C 6.153 -3.182 0.948 1.00 . A A . 19 CYS C 1 1 14 6423 1 1 19 CYS CA C 4.788 -2.675 0.515 1.00 . A A . 19 CYS CA 1 1 14 6424 1 1 19 CYS CB C 4.826 -1.165 0.528 1.00 . A A . 19 CYS CB 1 1 14 6425 1 1 19 CYS H H 3.343 -2.513 2.057 1.00 . A A . 19 CYS H 1 1 14 6426 1 1 19 CYS HA H 4.575 -3.020 -0.485 1.00 . A A . 19 CYS HA 1 1 14 6427 1 1 19 CYS HB2 H 4.898 -0.851 1.552 1.00 . A A . 19 CYS HB2 1 1 14 6428 1 1 19 CYS HB3 H 5.701 -0.814 -0.010 1.00 . A A . 19 CYS HB3 1 1 14 6429 1 1 19 CYS N N 3.727 -3.142 1.406 1.00 . A A . 19 CYS N 1 1 14 6430 1 1 19 CYS O O 6.306 -3.758 2.026 1.00 . A A . 19 CYS O 1 1 14 6431 1 1 19 CYS SG S 3.356 -0.379 -0.186 1.00 . A A . 19 CYS SG 1 1 14 6432 1 1 20 CYS C C 9.045 -2.396 1.498 1.00 . A A . 20 CYS C 1 1 14 6433 1 1 20 CYS CA C 8.519 -3.313 0.413 1.00 . A A . 20 CYS CA 1 1 14 6434 1 1 20 CYS CB C 9.397 -3.206 -0.831 1.00 . A A . 20 CYS CB 1 1 14 6435 1 1 20 CYS H H 6.966 -2.442 -0.720 1.00 . A A . 20 CYS H 1 1 14 6436 1 1 20 CYS HA H 8.519 -4.332 0.773 1.00 . A A . 20 CYS HA 1 1 14 6437 1 1 20 CYS HB2 H 9.564 -2.164 -1.047 1.00 . A A . 20 CYS HB2 1 1 14 6438 1 1 20 CYS HB3 H 10.346 -3.680 -0.630 1.00 . A A . 20 CYS HB3 1 1 14 6439 1 1 20 CYS N N 7.151 -2.928 0.111 1.00 . A A . 20 CYS N 1 1 14 6440 1 1 20 CYS O O 8.557 -1.274 1.636 1.00 . A A . 20 CYS O 1 1 14 6441 1 1 20 CYS SG S 8.684 -3.987 -2.322 1.00 . A A . 20 CYS SG 1 1 14 6442 1 1 21 PRO C C 10.996 -0.656 2.873 1.00 . A A . 21 PRO C 1 1 14 6443 1 1 21 PRO CA C 10.578 -2.028 3.364 1.00 . A A . 21 PRO CA 1 1 14 6444 1 1 21 PRO CB C 11.780 -2.820 3.847 1.00 . A A . 21 PRO CB 1 1 14 6445 1 1 21 PRO CD C 10.662 -4.168 2.218 1.00 . A A . 21 PRO CD 1 1 14 6446 1 1 21 PRO CG C 11.464 -4.234 3.492 1.00 . A A . 21 PRO CG 1 1 14 6447 1 1 21 PRO HA H 9.870 -1.915 4.173 1.00 . A A . 21 PRO HA 1 1 14 6448 1 1 21 PRO HB2 H 12.671 -2.471 3.346 1.00 . A A . 21 PRO HB2 1 1 14 6449 1 1 21 PRO HB3 H 11.878 -2.686 4.911 1.00 . A A . 21 PRO HB3 1 1 14 6450 1 1 21 PRO HD2 H 11.311 -4.235 1.358 1.00 . A A . 21 PRO HD2 1 1 14 6451 1 1 21 PRO HD3 H 9.919 -4.950 2.192 1.00 . A A . 21 PRO HD3 1 1 14 6452 1 1 21 PRO HG2 H 12.379 -4.786 3.334 1.00 . A A . 21 PRO HG2 1 1 14 6453 1 1 21 PRO HG3 H 10.881 -4.689 4.279 1.00 . A A . 21 PRO HG3 1 1 14 6454 1 1 21 PRO N N 10.025 -2.844 2.291 1.00 . A A . 21 PRO N 1 1 14 6455 1 1 21 PRO O O 11.891 -0.515 2.040 1.00 . A A . 21 PRO O 1 1 14 6456 1 1 22 GLY C C 9.351 2.360 2.374 1.00 . A A . 22 GLY C 1 1 14 6457 1 1 22 GLY CA C 10.565 1.706 3.004 1.00 . A A . 22 GLY CA 1 1 14 6458 1 1 22 GLY H H 9.602 0.131 4.024 1.00 . A A . 22 GLY H 1 1 14 6459 1 1 22 GLY HA2 H 10.849 2.267 3.881 1.00 . A A . 22 GLY HA2 1 1 14 6460 1 1 22 GLY HA3 H 11.380 1.727 2.295 1.00 . A A . 22 GLY HA3 1 1 14 6461 1 1 22 GLY N N 10.310 0.337 3.386 1.00 . A A . 22 GLY N 1 1 14 6462 1 1 22 GLY O O 9.150 3.564 2.513 1.00 . A A . 22 GLY O 1 1 14 6463 1 1 23 LEU C C 6.106 1.693 1.831 1.00 . A A . 23 LEU C 1 1 14 6464 1 1 23 LEU CA C 7.345 2.070 1.026 1.00 . A A . 23 LEU CA 1 1 14 6465 1 1 23 LEU CB C 7.254 1.490 -0.387 1.00 . A A . 23 LEU CB 1 1 14 6466 1 1 23 LEU CD1 C 8.367 0.906 -2.554 1.00 . A A . 23 LEU CD1 1 1 14 6467 1 1 23 LEU CD2 C 8.715 3.167 -1.547 1.00 . A A . 23 LEU CD2 1 1 14 6468 1 1 23 LEU CG C 8.496 1.689 -1.257 1.00 . A A . 23 LEU CG 1 1 14 6469 1 1 23 LEU H H 8.745 0.606 1.606 1.00 . A A . 23 LEU H 1 1 14 6470 1 1 23 LEU HA H 7.418 3.145 0.967 1.00 . A A . 23 LEU HA 1 1 14 6471 1 1 23 LEU HB2 H 7.065 0.429 -0.305 1.00 . A A . 23 LEU HB2 1 1 14 6472 1 1 23 LEU HB3 H 6.415 1.949 -0.888 1.00 . A A . 23 LEU HB3 1 1 14 6473 1 1 23 LEU HD11 H 7.323 0.812 -2.815 1.00 . A A . 23 LEU HD11 1 1 14 6474 1 1 23 LEU HD12 H 8.797 -0.076 -2.425 1.00 . A A . 23 LEU HD12 1 1 14 6475 1 1 23 LEU HD13 H 8.889 1.427 -3.343 1.00 . A A . 23 LEU HD13 1 1 14 6476 1 1 23 LEU HD21 H 8.398 3.387 -2.556 1.00 . A A . 23 LEU HD21 1 1 14 6477 1 1 23 LEU HD22 H 9.763 3.404 -1.439 1.00 . A A . 23 LEU HD22 1 1 14 6478 1 1 23 LEU HD23 H 8.138 3.758 -0.852 1.00 . A A . 23 LEU HD23 1 1 14 6479 1 1 23 LEU HG H 9.362 1.318 -0.728 1.00 . A A . 23 LEU HG 1 1 14 6480 1 1 23 LEU N N 8.540 1.565 1.680 1.00 . A A . 23 LEU N 1 1 14 6481 1 1 23 LEU O O 6.097 0.663 2.512 1.00 . A A . 23 LEU O 1 1 14 6482 1 1 24 ILE C C 2.588 2.669 1.693 1.00 . A A . 24 ILE C 1 1 14 6483 1 1 24 ILE CA C 3.826 2.246 2.491 1.00 . A A . 24 ILE CA 1 1 14 6484 1 1 24 ILE CB C 3.776 2.949 3.882 1.00 . A A . 24 ILE CB 1 1 14 6485 1 1 24 ILE CD1 C 5.416 4.915 3.560 1.00 . A A . 24 ILE CD1 1 1 14 6486 1 1 24 ILE CG1 C 3.978 4.474 3.769 1.00 . A A . 24 ILE CG1 1 1 14 6487 1 1 24 ILE CG2 C 4.793 2.340 4.840 1.00 . A A . 24 ILE CG2 1 1 14 6488 1 1 24 ILE H H 5.132 3.327 1.197 1.00 . A A . 24 ILE H 1 1 14 6489 1 1 24 ILE HA H 3.774 1.180 2.657 1.00 . A A . 24 ILE HA 1 1 14 6490 1 1 24 ILE HB H 2.797 2.765 4.299 1.00 . A A . 24 ILE HB 1 1 14 6491 1 1 24 ILE HD11 H 6.063 4.355 4.219 1.00 . A A . 24 ILE HD11 1 1 14 6492 1 1 24 ILE HD12 H 5.505 5.969 3.779 1.00 . A A . 24 ILE HD12 1 1 14 6493 1 1 24 ILE HD13 H 5.703 4.735 2.535 1.00 . A A . 24 ILE HD13 1 1 14 6494 1 1 24 ILE HG12 H 3.402 4.841 2.934 1.00 . A A . 24 ILE HG12 1 1 14 6495 1 1 24 ILE HG13 H 3.618 4.941 4.674 1.00 . A A . 24 ILE HG13 1 1 14 6496 1 1 24 ILE HG21 H 4.894 2.974 5.709 1.00 . A A . 24 ILE HG21 1 1 14 6497 1 1 24 ILE HG22 H 5.749 2.253 4.344 1.00 . A A . 24 ILE HG22 1 1 14 6498 1 1 24 ILE HG23 H 4.456 1.360 5.146 1.00 . A A . 24 ILE HG23 1 1 14 6499 1 1 24 ILE N N 5.064 2.515 1.759 1.00 . A A . 24 ILE N 1 1 14 6500 1 1 24 ILE O O 2.533 3.774 1.150 1.00 . A A . 24 ILE O 1 1 14 6501 1 1 25 CYS C C -0.436 3.175 1.634 1.00 . A A . 25 CYS C 1 1 14 6502 1 1 25 CYS CA C 0.346 2.083 0.910 1.00 . A A . 25 CYS CA 1 1 14 6503 1 1 25 CYS CB C -0.522 0.828 0.763 1.00 . A A . 25 CYS CB 1 1 14 6504 1 1 25 CYS H H 1.692 0.912 2.076 1.00 . A A . 25 CYS H 1 1 14 6505 1 1 25 CYS HA H 0.608 2.442 -0.069 1.00 . A A . 25 CYS HA 1 1 14 6506 1 1 25 CYS HB2 H -0.691 0.399 1.739 1.00 . A A . 25 CYS HB2 1 1 14 6507 1 1 25 CYS HB3 H -1.471 1.106 0.327 1.00 . A A . 25 CYS HB3 1 1 14 6508 1 1 25 CYS N N 1.590 1.784 1.628 1.00 . A A . 25 CYS N 1 1 14 6509 1 1 25 CYS O O -0.582 3.134 2.858 1.00 . A A . 25 CYS O 1 1 14 6510 1 1 25 CYS SG S 0.214 -0.466 -0.289 1.00 . A A . 25 CYS SG 1 1 14 6511 1 1 26 GLY C C -2.793 5.761 0.583 1.00 . A A . 26 GLY C 1 1 14 6512 1 1 26 GLY CA C -1.679 5.241 1.478 1.00 . A A . 26 GLY CA 1 1 14 6513 1 1 26 GLY H H -0.775 4.137 -0.090 1.00 . A A . 26 GLY H 1 1 14 6514 1 1 26 GLY HA2 H -2.111 4.897 2.405 1.00 . A A . 26 GLY HA2 1 1 14 6515 1 1 26 GLY HA3 H -0.999 6.052 1.692 1.00 . A A . 26 GLY HA3 1 1 14 6516 1 1 26 GLY N N -0.930 4.152 0.881 1.00 . A A . 26 GLY N 1 1 14 6517 1 1 26 GLY O O -3.946 5.358 0.733 1.00 . A A . 26 GLY O 1 1 14 6518 1 1 27 PRO C C -3.916 6.301 -2.376 1.00 . A A . 27 PRO C 1 1 14 6519 1 1 27 PRO CA C -3.482 7.260 -1.270 1.00 . A A . 27 PRO CA 1 1 14 6520 1 1 27 PRO CB C -2.763 8.483 -1.866 1.00 . A A . 27 PRO CB 1 1 14 6521 1 1 27 PRO CD C -1.152 7.225 -0.607 1.00 . A A . 27 PRO CD 1 1 14 6522 1 1 27 PRO CG C -1.463 8.597 -1.131 1.00 . A A . 27 PRO CG 1 1 14 6523 1 1 27 PRO HA H -4.357 7.581 -0.729 1.00 . A A . 27 PRO HA 1 1 14 6524 1 1 27 PRO HB2 H -2.601 8.324 -2.922 1.00 . A A . 27 PRO HB2 1 1 14 6525 1 1 27 PRO HB3 H -3.372 9.363 -1.723 1.00 . A A . 27 PRO HB3 1 1 14 6526 1 1 27 PRO HD2 H -0.622 6.646 -1.348 1.00 . A A . 27 PRO HD2 1 1 14 6527 1 1 27 PRO HD3 H -0.583 7.288 0.309 1.00 . A A . 27 PRO HD3 1 1 14 6528 1 1 27 PRO HG2 H -0.687 8.922 -1.807 1.00 . A A . 27 PRO HG2 1 1 14 6529 1 1 27 PRO HG3 H -1.566 9.296 -0.314 1.00 . A A . 27 PRO HG3 1 1 14 6530 1 1 27 PRO N N -2.486 6.673 -0.359 1.00 . A A . 27 PRO N 1 1 14 6531 1 1 27 PRO O O -3.812 6.613 -3.562 1.00 . A A . 27 PRO O 1 1 14 6532 1 1 28 PHE C C -3.670 3.545 -3.699 1.00 . A A . 28 PHE C 1 1 14 6533 1 1 28 PHE CA C -4.841 4.070 -2.865 1.00 . A A . 28 PHE CA 1 1 14 6534 1 1 28 PHE CB C -6.012 4.539 -3.770 1.00 . A A . 28 PHE CB 1 1 14 6535 1 1 28 PHE CD1 C -7.353 5.471 -1.846 1.00 . A A . 28 PHE CD1 1 1 14 6536 1 1 28 PHE CD2 C -8.498 4.264 -3.552 1.00 . A A . 28 PHE CD2 1 1 14 6537 1 1 28 PHE CE1 C -8.548 5.675 -1.183 1.00 . A A . 28 PHE CE1 1 1 14 6538 1 1 28 PHE CE2 C -9.696 4.466 -2.895 1.00 . A A . 28 PHE CE2 1 1 14 6539 1 1 28 PHE CG C -7.312 4.762 -3.038 1.00 . A A . 28 PHE CG 1 1 14 6540 1 1 28 PHE CZ C -9.721 5.173 -1.709 1.00 . A A . 28 PHE CZ 1 1 14 6541 1 1 28 PHE H H -4.420 4.971 -0.991 1.00 . A A . 28 PHE H 1 1 14 6542 1 1 28 PHE HA H -5.195 3.260 -2.244 1.00 . A A . 28 PHE HA 1 1 14 6543 1 1 28 PHE HB2 H -5.753 5.470 -4.255 1.00 . A A . 28 PHE HB2 1 1 14 6544 1 1 28 PHE HB3 H -6.193 3.787 -4.529 1.00 . A A . 28 PHE HB3 1 1 14 6545 1 1 28 PHE HD1 H -6.436 5.865 -1.433 1.00 . A A . 28 PHE HD1 1 1 14 6546 1 1 28 PHE HD2 H -8.481 3.710 -4.480 1.00 . A A . 28 PHE HD2 1 1 14 6547 1 1 28 PHE HE1 H -8.564 6.229 -0.256 1.00 . A A . 28 PHE HE1 1 1 14 6548 1 1 28 PHE HE2 H -10.613 4.072 -3.308 1.00 . A A . 28 PHE HE2 1 1 14 6549 1 1 28 PHE HZ H -10.657 5.332 -1.193 1.00 . A A . 28 PHE HZ 1 1 14 6550 1 1 28 PHE N N -4.387 5.133 -1.959 1.00 . A A . 28 PHE N 1 1 14 6551 1 1 28 PHE O O -3.859 2.787 -4.648 1.00 . A A . 28 PHE O 1 1 14 6552 1 1 29 VAL C C -0.138 3.518 -2.882 1.00 . A A . 29 VAL C 1 1 14 6553 1 1 29 VAL CA C -1.223 3.503 -3.940 1.00 . A A . 29 VAL CA 1 1 14 6554 1 1 29 VAL CB C -0.778 4.420 -5.118 1.00 . A A . 29 VAL CB 1 1 14 6555 1 1 29 VAL CG1 C -1.744 4.326 -6.291 1.00 . A A . 29 VAL CG1 1 1 14 6556 1 1 29 VAL CG2 C -0.638 5.865 -4.656 1.00 . A A . 29 VAL CG2 1 1 14 6557 1 1 29 VAL H H -2.382 4.502 -2.500 1.00 . A A . 29 VAL H 1 1 14 6558 1 1 29 VAL HA H -1.357 2.492 -4.311 1.00 . A A . 29 VAL HA 1 1 14 6559 1 1 29 VAL HB H 0.198 4.083 -5.465 1.00 . A A . 29 VAL HB 1 1 14 6560 1 1 29 VAL HG11 H -2.712 4.008 -5.934 1.00 . A A . 29 VAL HG11 1 1 14 6561 1 1 29 VAL HG12 H -1.371 3.610 -7.008 1.00 . A A . 29 VAL HG12 1 1 14 6562 1 1 29 VAL HG13 H -1.834 5.295 -6.761 1.00 . A A . 29 VAL HG13 1 1 14 6563 1 1 29 VAL HG21 H -0.124 5.890 -3.707 1.00 . A A . 29 VAL HG21 1 1 14 6564 1 1 29 VAL HG22 H -1.619 6.304 -4.547 1.00 . A A . 29 VAL HG22 1 1 14 6565 1 1 29 VAL HG23 H -0.073 6.423 -5.387 1.00 . A A . 29 VAL HG23 1 1 14 6566 1 1 29 VAL N N -2.457 3.927 -3.297 1.00 . A A . 29 VAL N 1 1 14 6567 1 1 29 VAL O O -0.339 4.081 -1.804 1.00 . A A . 29 VAL O 1 1 14 6568 1 1 30 CYS C C 2.961 4.157 -2.444 1.00 . A A . 30 CYS C 1 1 14 6569 1 1 30 CYS CA C 2.093 2.920 -2.231 1.00 . A A . 30 CYS CA 1 1 14 6570 1 1 30 CYS CB C 2.909 1.637 -2.393 1.00 . A A . 30 CYS CB 1 1 14 6571 1 1 30 CYS H H 1.115 2.515 -4.057 1.00 . A A . 30 CYS H 1 1 14 6572 1 1 30 CYS HA H 1.681 2.957 -1.239 1.00 . A A . 30 CYS HA 1 1 14 6573 1 1 30 CYS HB2 H 2.237 0.795 -2.463 1.00 . A A . 30 CYS HB2 1 1 14 6574 1 1 30 CYS HB3 H 3.482 1.703 -3.306 1.00 . A A . 30 CYS HB3 1 1 14 6575 1 1 30 CYS N N 0.996 2.934 -3.175 1.00 . A A . 30 CYS N 1 1 14 6576 1 1 30 CYS O O 3.005 4.716 -3.542 1.00 . A A . 30 CYS O 1 1 14 6577 1 1 30 CYS SG S 4.073 1.312 -1.039 1.00 . A A . 30 CYS SG 1 1 14 6578 1 1 31 VAL C C 5.794 5.542 -0.792 1.00 . A A . 31 VAL C 1 1 14 6579 1 1 31 VAL CA C 4.485 5.777 -1.523 1.00 . A A . 31 VAL CA 1 1 14 6580 1 1 31 VAL CB C 3.807 7.051 -0.959 1.00 . A A . 31 VAL CB 1 1 14 6581 1 1 31 VAL CG1 C 2.533 7.383 -1.725 1.00 . A A . 31 VAL CG1 1 1 14 6582 1 1 31 VAL CG2 C 3.508 6.898 0.526 1.00 . A A . 31 VAL CG2 1 1 14 6583 1 1 31 VAL H H 3.572 4.140 -0.542 1.00 . A A . 31 VAL H 1 1 14 6584 1 1 31 VAL HA H 4.694 5.930 -2.580 1.00 . A A . 31 VAL HA 1 1 14 6585 1 1 31 VAL HB H 4.492 7.877 -1.079 1.00 . A A . 31 VAL HB 1 1 14 6586 1 1 31 VAL HG11 H 1.674 7.078 -1.143 1.00 . A A . 31 VAL HG11 1 1 14 6587 1 1 31 VAL HG12 H 2.533 6.859 -2.669 1.00 . A A . 31 VAL HG12 1 1 14 6588 1 1 31 VAL HG13 H 2.487 8.447 -1.903 1.00 . A A . 31 VAL HG13 1 1 14 6589 1 1 31 VAL HG21 H 3.247 7.859 0.942 1.00 . A A . 31 VAL HG21 1 1 14 6590 1 1 31 VAL HG22 H 4.382 6.512 1.030 1.00 . A A . 31 VAL HG22 1 1 14 6591 1 1 31 VAL HG23 H 2.684 6.213 0.658 1.00 . A A . 31 VAL HG23 1 1 14 6592 1 1 31 VAL N N 3.639 4.604 -1.408 1.00 . A A . 31 VAL N 1 1 14 6593 1 1 31 VAL O O 5.836 4.626 0.051 1.00 . A A . 31 VAL O 1 1 14 6594 1 1 31 VAL OXT O 6.772 6.266 -1.088 1.00 . A A . 31 VAL OXT 1 1 15 6595 1 1 1 ALA C C 4.226 -8.522 -0.667 1.00 . A A . 1 ALA C 1 1 15 6596 1 1 1 ALA CA C 4.227 -10.022 -0.438 1.00 . A A . 1 ALA CA 1 1 15 6597 1 1 1 ALA CB C 4.247 -10.766 -1.765 1.00 . A A . 1 ALA CB 1 1 15 6598 1 1 1 ALA H1 H 3.317 -10.675 1.316 1.00 . A A . 1 ALA H1 1 1 15 6599 1 1 1 ALA H2 H 2.545 -11.198 -0.096 1.00 . A A . 1 ALA H2 1 1 15 6600 1 1 1 ALA H3 H 2.383 -9.591 0.411 1.00 . A A . 1 ALA H3 1 1 15 6601 1 1 1 ALA HA H 5.113 -10.293 0.119 1.00 . A A . 1 ALA HA 1 1 15 6602 1 1 1 ALA HB1 H 5.113 -10.465 -2.334 1.00 . A A . 1 ALA HB1 1 1 15 6603 1 1 1 ALA HB2 H 3.351 -10.532 -2.322 1.00 . A A . 1 ALA HB2 1 1 15 6604 1 1 1 ALA HB3 H 4.289 -11.830 -1.581 1.00 . A A . 1 ALA HB3 1 1 15 6605 1 1 1 ALA N N 3.037 -10.402 0.354 1.00 . A A . 1 ALA N 1 1 15 6606 1 1 1 ALA O O 3.165 -7.903 -0.660 1.00 . A A . 1 ALA O 1 1 15 6607 1 1 2 CYS C C 5.384 -6.234 -2.588 1.00 . A A . 2 CYS C 1 1 15 6608 1 1 2 CYS CA C 5.507 -6.515 -1.094 1.00 . A A . 2 CYS CA 1 1 15 6609 1 1 2 CYS CB C 6.821 -5.979 -0.522 1.00 . A A . 2 CYS CB 1 1 15 6610 1 1 2 CYS H H 6.215 -8.489 -0.860 1.00 . A A . 2 CYS H 1 1 15 6611 1 1 2 CYS HA H 4.681 -6.035 -0.585 1.00 . A A . 2 CYS HA 1 1 15 6612 1 1 2 CYS HB2 H 6.767 -4.903 -0.477 1.00 . A A . 2 CYS HB2 1 1 15 6613 1 1 2 CYS HB3 H 6.945 -6.355 0.486 1.00 . A A . 2 CYS HB3 1 1 15 6614 1 1 2 CYS N N 5.401 -7.945 -0.863 1.00 . A A . 2 CYS N 1 1 15 6615 1 1 2 CYS O O 5.833 -7.034 -3.408 1.00 . A A . 2 CYS O 1 1 15 6616 1 1 2 CYS SG S 8.327 -6.398 -1.450 1.00 . A A . 2 CYS SG 1 1 15 6617 1 1 3 SER C C 5.252 -3.533 -4.768 1.00 . A A . 3 SER C 1 1 15 6618 1 1 3 SER CA C 4.523 -4.815 -4.350 1.00 . A A . 3 SER CA 1 1 15 6619 1 1 3 SER CB C 3.021 -4.691 -4.621 1.00 . A A . 3 SER CB 1 1 15 6620 1 1 3 SER H H 4.356 -4.550 -2.258 1.00 . A A . 3 SER H 1 1 15 6621 1 1 3 SER HA H 4.911 -5.635 -4.932 1.00 . A A . 3 SER HA 1 1 15 6622 1 1 3 SER HB2 H 2.504 -5.505 -4.136 1.00 . A A . 3 SER HB2 1 1 15 6623 1 1 3 SER HB3 H 2.666 -3.753 -4.221 1.00 . A A . 3 SER HB3 1 1 15 6624 1 1 3 SER HG H 1.801 -4.908 -6.145 1.00 . A A . 3 SER HG 1 1 15 6625 1 1 3 SER N N 4.732 -5.135 -2.945 1.00 . A A . 3 SER N 1 1 15 6626 1 1 3 SER O O 6.165 -3.064 -4.083 1.00 . A A . 3 SER O 1 1 15 6627 1 1 3 SER OG O 2.741 -4.735 -6.012 1.00 . A A . 3 SER OG 1 1 15 6628 1 1 4 LYS C C 4.855 -0.528 -5.793 1.00 . A A . 4 LYS C 1 1 15 6629 1 1 4 LYS CA C 5.417 -1.772 -6.471 1.00 . A A . 4 LYS CA 1 1 15 6630 1 1 4 LYS CB C 5.138 -1.696 -7.976 1.00 . A A . 4 LYS CB 1 1 15 6631 1 1 4 LYS CD C 4.948 -2.888 -10.179 1.00 . A A . 4 LYS CD 1 1 15 6632 1 1 4 LYS CE C 4.443 -4.180 -10.804 1.00 . A A . 4 LYS CE 1 1 15 6633 1 1 4 LYS CG C 5.181 -3.042 -8.684 1.00 . A A . 4 LYS CG 1 1 15 6634 1 1 4 LYS H H 4.100 -3.424 -6.394 1.00 . A A . 4 LYS H 1 1 15 6635 1 1 4 LYS HA H 6.485 -1.808 -6.312 1.00 . A A . 4 LYS HA 1 1 15 6636 1 1 4 LYS HB2 H 4.157 -1.268 -8.125 1.00 . A A . 4 LYS HB2 1 1 15 6637 1 1 4 LYS HB3 H 5.874 -1.050 -8.433 1.00 . A A . 4 LYS HB3 1 1 15 6638 1 1 4 LYS HD2 H 4.215 -2.112 -10.341 1.00 . A A . 4 LYS HD2 1 1 15 6639 1 1 4 LYS HD3 H 5.879 -2.610 -10.651 1.00 . A A . 4 LYS HD3 1 1 15 6640 1 1 4 LYS HE2 H 4.438 -4.068 -11.877 1.00 . A A . 4 LYS HE2 1 1 15 6641 1 1 4 LYS HE3 H 5.111 -4.983 -10.530 1.00 . A A . 4 LYS HE3 1 1 15 6642 1 1 4 LYS HG2 H 6.149 -3.491 -8.525 1.00 . A A . 4 LYS HG2 1 1 15 6643 1 1 4 LYS HG3 H 4.412 -3.680 -8.272 1.00 . A A . 4 LYS HG3 1 1 15 6644 1 1 4 LYS HZ1 H 2.618 -3.680 -9.898 1.00 . A A . 4 LYS HZ1 1 1 15 6645 1 1 4 LYS HZ2 H 3.092 -5.286 -9.650 1.00 . A A . 4 LYS HZ2 1 1 15 6646 1 1 4 LYS HZ3 H 2.479 -4.813 -11.149 1.00 . A A . 4 LYS HZ3 1 1 15 6647 1 1 4 LYS N N 4.834 -2.986 -5.909 1.00 . A A . 4 LYS N 1 1 15 6648 1 1 4 LYS NZ N 3.066 -4.518 -10.347 1.00 . A A . 4 LYS NZ 1 1 15 6649 1 1 4 LYS O O 3.713 -0.518 -5.340 1.00 . A A . 4 LYS O 1 1 15 6650 1 1 5 LYS C C 3.966 2.323 -5.752 1.00 . A A . 5 LYS C 1 1 15 6651 1 1 5 LYS CA C 5.228 1.765 -5.106 1.00 . A A . 5 LYS CA 1 1 15 6652 1 1 5 LYS CB C 6.347 2.816 -5.160 1.00 . A A . 5 LYS CB 1 1 15 6653 1 1 5 LYS CD C 6.933 5.166 -4.447 1.00 . A A . 5 LYS CD 1 1 15 6654 1 1 5 LYS CE C 6.450 6.607 -4.423 1.00 . A A . 5 LYS CE 1 1 15 6655 1 1 5 LYS CG C 5.847 4.239 -4.950 1.00 . A A . 5 LYS CG 1 1 15 6656 1 1 5 LYS H H 6.557 0.459 -6.109 1.00 . A A . 5 LYS H 1 1 15 6657 1 1 5 LYS HA H 5.011 1.548 -4.075 1.00 . A A . 5 LYS HA 1 1 15 6658 1 1 5 LYS HB2 H 7.072 2.593 -4.391 1.00 . A A . 5 LYS HB2 1 1 15 6659 1 1 5 LYS HB3 H 6.829 2.764 -6.125 1.00 . A A . 5 LYS HB3 1 1 15 6660 1 1 5 LYS HD2 H 7.212 4.871 -3.446 1.00 . A A . 5 LYS HD2 1 1 15 6661 1 1 5 LYS HD3 H 7.790 5.092 -5.100 1.00 . A A . 5 LYS HD3 1 1 15 6662 1 1 5 LYS HE2 H 6.586 7.034 -5.407 1.00 . A A . 5 LYS HE2 1 1 15 6663 1 1 5 LYS HE3 H 5.398 6.619 -4.174 1.00 . A A . 5 LYS HE3 1 1 15 6664 1 1 5 LYS HG2 H 5.474 4.624 -5.881 1.00 . A A . 5 LYS HG2 1 1 15 6665 1 1 5 LYS HG3 H 5.044 4.218 -4.238 1.00 . A A . 5 LYS HG3 1 1 15 6666 1 1 5 LYS HZ1 H 6.812 8.385 -3.390 1.00 . A A . 5 LYS HZ1 1 1 15 6667 1 1 5 LYS HZ2 H 8.203 7.473 -3.689 1.00 . A A . 5 LYS HZ2 1 1 15 6668 1 1 5 LYS HZ3 H 7.117 6.989 -2.477 1.00 . A A . 5 LYS HZ3 1 1 15 6669 1 1 5 LYS N N 5.658 0.522 -5.730 1.00 . A A . 5 LYS N 1 1 15 6670 1 1 5 LYS NZ N 7.199 7.424 -3.431 1.00 . A A . 5 LYS NZ 1 1 15 6671 1 1 5 LYS O O 2.977 2.570 -5.099 1.00 . A A . 5 LYS O 1 1 15 6672 1 1 6 TRP C C 1.778 2.016 -7.977 1.00 . A A . 6 TRP C 1 1 15 6673 1 1 6 TRP CA C 2.828 3.086 -7.694 1.00 . A A . 6 TRP CA 1 1 15 6674 1 1 6 TRP CB C 3.266 3.824 -8.956 1.00 . A A . 6 TRP CB 1 1 15 6675 1 1 6 TRP CD1 C 5.773 4.335 -8.703 1.00 . A A . 6 TRP CD1 1 1 15 6676 1 1 6 TRP CD2 C 4.452 6.118 -8.414 1.00 . A A . 6 TRP CD2 1 1 15 6677 1 1 6 TRP CE2 C 5.794 6.524 -8.275 1.00 . A A . 6 TRP CE2 1 1 15 6678 1 1 6 TRP CE3 C 3.446 7.073 -8.265 1.00 . A A . 6 TRP CE3 1 1 15 6679 1 1 6 TRP CG C 4.460 4.715 -8.717 1.00 . A A . 6 TRP CG 1 1 15 6680 1 1 6 TRP CH2 C 5.142 8.752 -7.852 1.00 . A A . 6 TRP CH2 1 1 15 6681 1 1 6 TRP CZ2 C 6.150 7.841 -7.994 1.00 . A A . 6 TRP CZ2 1 1 15 6682 1 1 6 TRP CZ3 C 3.799 8.379 -7.982 1.00 . A A . 6 TRP CZ3 1 1 15 6683 1 1 6 TRP H H 4.786 2.324 -7.539 1.00 . A A . 6 TRP H 1 1 15 6684 1 1 6 TRP HA H 2.385 3.805 -7.012 1.00 . A A . 6 TRP HA 1 1 15 6685 1 1 6 TRP HB2 H 3.530 3.105 -9.717 1.00 . A A . 6 TRP HB2 1 1 15 6686 1 1 6 TRP HB3 H 2.453 4.440 -9.310 1.00 . A A . 6 TRP HB3 1 1 15 6687 1 1 6 TRP HD1 H 6.111 3.328 -8.872 1.00 . A A . 6 TRP HD1 1 1 15 6688 1 1 6 TRP HE1 H 7.559 5.402 -8.421 1.00 . A A . 6 TRP HE1 1 1 15 6689 1 1 6 TRP HE3 H 2.408 6.804 -8.352 1.00 . A A . 6 TRP HE3 1 1 15 6690 1 1 6 TRP HH2 H 5.372 9.784 -7.630 1.00 . A A . 6 TRP HH2 1 1 15 6691 1 1 6 TRP HZ2 H 7.181 8.144 -7.891 1.00 . A A . 6 TRP HZ2 1 1 15 6692 1 1 6 TRP HZ3 H 3.032 9.129 -7.862 1.00 . A A . 6 TRP HZ3 1 1 15 6693 1 1 6 TRP N N 3.989 2.531 -7.031 1.00 . A A . 6 TRP N 1 1 15 6694 1 1 6 TRP NE1 N 6.580 5.419 -8.458 1.00 . A A . 6 TRP NE1 1 1 15 6695 1 1 6 TRP O O 0.932 2.179 -8.855 1.00 . A A . 6 TRP O 1 1 15 6696 1 1 7 GLU C C -0.473 0.309 -6.693 1.00 . A A . 7 GLU C 1 1 15 6697 1 1 7 GLU CA C 0.836 -0.128 -7.338 1.00 . A A . 7 GLU CA 1 1 15 6698 1 1 7 GLU CB C 1.324 -1.414 -6.673 1.00 . A A . 7 GLU CB 1 1 15 6699 1 1 7 GLU CD C 1.111 -3.180 -8.463 1.00 . A A . 7 GLU CD 1 1 15 6700 1 1 7 GLU CG C 0.597 -2.666 -7.132 1.00 . A A . 7 GLU CG 1 1 15 6701 1 1 7 GLU H H 2.502 0.874 -6.485 1.00 . A A . 7 GLU H 1 1 15 6702 1 1 7 GLU HA H 0.675 -0.303 -8.392 1.00 . A A . 7 GLU HA 1 1 15 6703 1 1 7 GLU HB2 H 2.375 -1.538 -6.889 1.00 . A A . 7 GLU HB2 1 1 15 6704 1 1 7 GLU HB3 H 1.195 -1.322 -5.605 1.00 . A A . 7 GLU HB3 1 1 15 6705 1 1 7 GLU HG2 H 0.731 -3.439 -6.390 1.00 . A A . 7 GLU HG2 1 1 15 6706 1 1 7 GLU HG3 H -0.454 -2.441 -7.232 1.00 . A A . 7 GLU HG3 1 1 15 6707 1 1 7 GLU N N 1.814 0.938 -7.195 1.00 . A A . 7 GLU N 1 1 15 6708 1 1 7 GLU O O -0.478 0.844 -5.580 1.00 . A A . 7 GLU O 1 1 15 6709 1 1 7 GLU OE1 O 1.949 -2.499 -9.090 1.00 . A A . 7 GLU OE1 1 1 15 6710 1 1 7 GLU OE2 O 0.701 -4.279 -8.881 1.00 . A A . 7 GLU OE2 1 1 15 6711 1 1 8 TYR C C -3.351 -0.584 -5.850 1.00 . A A . 8 TYR C 1 1 15 6712 1 1 8 TYR CA C -2.893 0.447 -6.888 1.00 . A A . 8 TYR CA 1 1 15 6713 1 1 8 TYR CB C -3.874 0.515 -8.066 1.00 . A A . 8 TYR CB 1 1 15 6714 1 1 8 TYR CD1 C -4.818 2.722 -7.269 1.00 . A A . 8 TYR CD1 1 1 15 6715 1 1 8 TYR CD2 C -6.282 1.209 -8.382 1.00 . A A . 8 TYR CD2 1 1 15 6716 1 1 8 TYR CE1 C -5.853 3.626 -7.125 1.00 . A A . 8 TYR CE1 1 1 15 6717 1 1 8 TYR CE2 C -7.322 2.108 -8.246 1.00 . A A . 8 TYR CE2 1 1 15 6718 1 1 8 TYR CG C -5.013 1.499 -7.896 1.00 . A A . 8 TYR CG 1 1 15 6719 1 1 8 TYR CZ C -7.104 3.314 -7.615 1.00 . A A . 8 TYR CZ 1 1 15 6720 1 1 8 TYR H H -1.499 -0.346 -8.263 1.00 . A A . 8 TYR H 1 1 15 6721 1 1 8 TYR HA H -2.819 1.420 -6.413 1.00 . A A . 8 TYR HA 1 1 15 6722 1 1 8 TYR HB2 H -3.332 0.798 -8.955 1.00 . A A . 8 TYR HB2 1 1 15 6723 1 1 8 TYR HB3 H -4.306 -0.465 -8.217 1.00 . A A . 8 TYR HB3 1 1 15 6724 1 1 8 TYR HD1 H -3.837 2.963 -6.886 1.00 . A A . 8 TYR HD1 1 1 15 6725 1 1 8 TYR HD2 H -6.452 0.261 -8.873 1.00 . A A . 8 TYR HD2 1 1 15 6726 1 1 8 TYR HE1 H -5.681 4.570 -6.631 1.00 . A A . 8 TYR HE1 1 1 15 6727 1 1 8 TYR HE2 H -8.301 1.863 -8.630 1.00 . A A . 8 TYR HE2 1 1 15 6728 1 1 8 TYR HH H -7.779 5.098 -7.382 1.00 . A A . 8 TYR HH 1 1 15 6729 1 1 8 TYR N N -1.573 0.083 -7.387 1.00 . A A . 8 TYR N 1 1 15 6730 1 1 8 TYR O O -4.277 -1.356 -6.089 1.00 . A A . 8 TYR O 1 1 15 6731 1 1 8 TYR OH O -8.137 4.212 -7.476 1.00 . A A . 8 TYR OH 1 1 15 6732 1 1 9 CYS C C -4.339 -1.427 -3.062 1.00 . A A . 9 CYS C 1 1 15 6733 1 1 9 CYS CA C -2.927 -1.554 -3.635 1.00 . A A . 9 CYS CA 1 1 15 6734 1 1 9 CYS CB C -1.885 -1.399 -2.518 1.00 . A A . 9 CYS CB 1 1 15 6735 1 1 9 CYS H H -1.904 0.022 -4.615 1.00 . A A . 9 CYS H 1 1 15 6736 1 1 9 CYS HA H -2.826 -2.545 -4.051 1.00 . A A . 9 CYS HA 1 1 15 6737 1 1 9 CYS HB2 H -2.275 -1.836 -1.612 1.00 . A A . 9 CYS HB2 1 1 15 6738 1 1 9 CYS HB3 H -0.983 -1.922 -2.805 1.00 . A A . 9 CYS HB3 1 1 15 6739 1 1 9 CYS N N -2.654 -0.607 -4.717 1.00 . A A . 9 CYS N 1 1 15 6740 1 1 9 CYS O O -4.871 -2.400 -2.531 1.00 . A A . 9 CYS O 1 1 15 6741 1 1 9 CYS SG S -1.428 0.329 -2.144 1.00 . A A . 9 CYS SG 1 1 15 6742 1 1 10 ILE C C -6.299 -0.131 -1.121 1.00 . A A . 10 ILE C 1 1 15 6743 1 1 10 ILE CA C -6.287 0.000 -2.644 1.00 . A A . 10 ILE CA 1 1 15 6744 1 1 10 ILE CB C -7.334 -0.963 -3.264 1.00 . A A . 10 ILE CB 1 1 15 6745 1 1 10 ILE CD1 C -7.841 0.576 -5.228 1.00 . A A . 10 ILE CD1 1 1 15 6746 1 1 10 ILE CG1 C -7.384 -0.797 -4.785 1.00 . A A . 10 ILE CG1 1 1 15 6747 1 1 10 ILE CG2 C -8.717 -0.724 -2.664 1.00 . A A . 10 ILE CG2 1 1 15 6748 1 1 10 ILE H H -4.456 0.499 -3.599 1.00 . A A . 10 ILE H 1 1 15 6749 1 1 10 ILE HA H -6.563 1.013 -2.904 1.00 . A A . 10 ILE HA 1 1 15 6750 1 1 10 ILE HB H -7.040 -1.976 -3.029 1.00 . A A . 10 ILE HB 1 1 15 6751 1 1 10 ILE HD11 H -7.989 1.203 -4.362 1.00 . A A . 10 ILE HD11 1 1 15 6752 1 1 10 ILE HD12 H -8.771 0.487 -5.771 1.00 . A A . 10 ILE HD12 1 1 15 6753 1 1 10 ILE HD13 H -7.091 1.016 -5.869 1.00 . A A . 10 ILE HD13 1 1 15 6754 1 1 10 ILE HG12 H -6.397 -0.963 -5.190 1.00 . A A . 10 ILE HG12 1 1 15 6755 1 1 10 ILE HG13 H -8.066 -1.525 -5.197 1.00 . A A . 10 ILE HG13 1 1 15 6756 1 1 10 ILE HG21 H -9.436 -0.596 -3.459 1.00 . A A . 10 ILE HG21 1 1 15 6757 1 1 10 ILE HG22 H -8.695 0.166 -2.052 1.00 . A A . 10 ILE HG22 1 1 15 6758 1 1 10 ILE HG23 H -8.998 -1.570 -2.057 1.00 . A A . 10 ILE HG23 1 1 15 6759 1 1 10 ILE N N -4.936 -0.237 -3.165 1.00 . A A . 10 ILE N 1 1 15 6760 1 1 10 ILE O O -6.607 -1.185 -0.566 1.00 . A A . 10 ILE O 1 1 15 6761 1 1 11 VAL C C -6.503 2.275 1.525 1.00 . A A . 11 VAL C 1 1 15 6762 1 1 11 VAL CA C -5.902 0.976 1.004 1.00 . A A . 11 VAL CA 1 1 15 6763 1 1 11 VAL CB C -4.454 0.854 1.532 1.00 . A A . 11 VAL CB 1 1 15 6764 1 1 11 VAL CG1 C -3.827 -0.470 1.122 1.00 . A A . 11 VAL CG1 1 1 15 6765 1 1 11 VAL CG2 C -3.614 2.022 1.045 1.00 . A A . 11 VAL CG2 1 1 15 6766 1 1 11 VAL H H -5.708 1.761 -0.943 1.00 . A A . 11 VAL H 1 1 15 6767 1 1 11 VAL HA H -6.479 0.141 1.376 1.00 . A A . 11 VAL HA 1 1 15 6768 1 1 11 VAL HB H -4.485 0.890 2.611 1.00 . A A . 11 VAL HB 1 1 15 6769 1 1 11 VAL HG11 H -4.396 -1.285 1.545 1.00 . A A . 11 VAL HG11 1 1 15 6770 1 1 11 VAL HG12 H -2.810 -0.515 1.485 1.00 . A A . 11 VAL HG12 1 1 15 6771 1 1 11 VAL HG13 H -3.828 -0.552 0.045 1.00 . A A . 11 VAL HG13 1 1 15 6772 1 1 11 VAL HG21 H -2.655 2.007 1.542 1.00 . A A . 11 VAL HG21 1 1 15 6773 1 1 11 VAL HG22 H -4.121 2.949 1.271 1.00 . A A . 11 VAL HG22 1 1 15 6774 1 1 11 VAL HG23 H -3.468 1.941 -0.022 1.00 . A A . 11 VAL HG23 1 1 15 6775 1 1 11 VAL N N -5.948 0.952 -0.449 1.00 . A A . 11 VAL N 1 1 15 6776 1 1 11 VAL O O -6.586 3.259 0.788 1.00 . A A . 11 VAL O 1 1 15 6777 1 1 12 PRO C C -6.536 4.664 3.394 1.00 . A A . 12 PRO C 1 1 15 6778 1 1 12 PRO CA C -7.514 3.493 3.409 1.00 . A A . 12 PRO CA 1 1 15 6779 1 1 12 PRO CB C -7.812 3.063 4.851 1.00 . A A . 12 PRO CB 1 1 15 6780 1 1 12 PRO CD C -6.869 1.171 3.743 1.00 . A A . 12 PRO CD 1 1 15 6781 1 1 12 PRO CG C -7.839 1.575 4.816 1.00 . A A . 12 PRO CG 1 1 15 6782 1 1 12 PRO HA H -8.431 3.782 2.916 1.00 . A A . 12 PRO HA 1 1 15 6783 1 1 12 PRO HB2 H -7.033 3.429 5.504 1.00 . A A . 12 PRO HB2 1 1 15 6784 1 1 12 PRO HB3 H -8.764 3.467 5.159 1.00 . A A . 12 PRO HB3 1 1 15 6785 1 1 12 PRO HD2 H -5.875 1.062 4.153 1.00 . A A . 12 PRO HD2 1 1 15 6786 1 1 12 PRO HD3 H -7.188 0.253 3.270 1.00 . A A . 12 PRO HD3 1 1 15 6787 1 1 12 PRO HG2 H -7.529 1.178 5.771 1.00 . A A . 12 PRO HG2 1 1 15 6788 1 1 12 PRO HG3 H -8.833 1.231 4.570 1.00 . A A . 12 PRO HG3 1 1 15 6789 1 1 12 PRO N N -6.930 2.299 2.798 1.00 . A A . 12 PRO N 1 1 15 6790 1 1 12 PRO O O -5.339 4.482 3.618 1.00 . A A . 12 PRO O 1 1 15 6791 1 1 13 ILE C C -5.449 7.309 4.345 1.00 . A A . 13 ILE C 1 1 15 6792 1 1 13 ILE CA C -6.246 7.078 3.053 1.00 . A A . 13 ILE CA 1 1 15 6793 1 1 13 ILE CB C -7.134 8.312 2.749 1.00 . A A . 13 ILE CB 1 1 15 6794 1 1 13 ILE CD1 C -5.383 9.470 1.299 1.00 . A A . 13 ILE CD1 1 1 15 6795 1 1 13 ILE CG1 C -6.279 9.564 2.517 1.00 . A A . 13 ILE CG1 1 1 15 6796 1 1 13 ILE CG2 C -8.134 8.553 3.872 1.00 . A A . 13 ILE CG2 1 1 15 6797 1 1 13 ILE H H -8.015 5.922 2.943 1.00 . A A . 13 ILE H 1 1 15 6798 1 1 13 ILE HA H -5.548 6.961 2.237 1.00 . A A . 13 ILE HA 1 1 15 6799 1 1 13 ILE HB H -7.695 8.103 1.851 1.00 . A A . 13 ILE HB 1 1 15 6800 1 1 13 ILE HD11 H -5.158 10.463 0.941 1.00 . A A . 13 ILE HD11 1 1 15 6801 1 1 13 ILE HD12 H -5.889 8.912 0.523 1.00 . A A . 13 ILE HD12 1 1 15 6802 1 1 13 ILE HD13 H -4.467 8.966 1.565 1.00 . A A . 13 ILE HD13 1 1 15 6803 1 1 13 ILE HG12 H -6.929 10.415 2.385 1.00 . A A . 13 ILE HG12 1 1 15 6804 1 1 13 ILE HG13 H -5.651 9.726 3.380 1.00 . A A . 13 ILE HG13 1 1 15 6805 1 1 13 ILE HG21 H -9.095 8.149 3.591 1.00 . A A . 13 ILE HG21 1 1 15 6806 1 1 13 ILE HG22 H -8.227 9.614 4.050 1.00 . A A . 13 ILE HG22 1 1 15 6807 1 1 13 ILE HG23 H -7.788 8.066 4.773 1.00 . A A . 13 ILE HG23 1 1 15 6808 1 1 13 ILE N N -7.056 5.858 3.119 1.00 . A A . 13 ILE N 1 1 15 6809 1 1 13 ILE O O -4.430 7.996 4.340 1.00 . A A . 13 ILE O 1 1 15 6810 1 1 14 LEU C C -3.840 6.268 6.687 1.00 . A A . 14 LEU C 1 1 15 6811 1 1 14 LEU CA C -5.255 6.842 6.737 1.00 . A A . 14 LEU CA 1 1 15 6812 1 1 14 LEU CB C -6.061 6.133 7.837 1.00 . A A . 14 LEU CB 1 1 15 6813 1 1 14 LEU CD1 C -7.252 8.272 8.428 1.00 . A A . 14 LEU CD1 1 1 15 6814 1 1 14 LEU CD2 C -8.467 6.485 7.156 1.00 . A A . 14 LEU CD2 1 1 15 6815 1 1 14 LEU CG C -7.407 6.774 8.212 1.00 . A A . 14 LEU CG 1 1 15 6816 1 1 14 LEU H H -6.727 6.178 5.374 1.00 . A A . 14 LEU H 1 1 15 6817 1 1 14 LEU HA H -5.193 7.893 6.974 1.00 . A A . 14 LEU HA 1 1 15 6818 1 1 14 LEU HB2 H -6.251 5.121 7.512 1.00 . A A . 14 LEU HB2 1 1 15 6819 1 1 14 LEU HB3 H -5.450 6.095 8.726 1.00 . A A . 14 LEU HB3 1 1 15 6820 1 1 14 LEU HD11 H -6.202 8.524 8.461 1.00 . A A . 14 LEU HD11 1 1 15 6821 1 1 14 LEU HD12 H -7.718 8.551 9.360 1.00 . A A . 14 LEU HD12 1 1 15 6822 1 1 14 LEU HD13 H -7.725 8.803 7.615 1.00 . A A . 14 LEU HD13 1 1 15 6823 1 1 14 LEU HD21 H -9.223 7.256 7.185 1.00 . A A . 14 LEU HD21 1 1 15 6824 1 1 14 LEU HD22 H -8.922 5.526 7.357 1.00 . A A . 14 LEU HD22 1 1 15 6825 1 1 14 LEU HD23 H -8.006 6.468 6.180 1.00 . A A . 14 LEU HD23 1 1 15 6826 1 1 14 LEU HG H -7.745 6.344 9.144 1.00 . A A . 14 LEU HG 1 1 15 6827 1 1 14 LEU N N -5.919 6.717 5.441 1.00 . A A . 14 LEU N 1 1 15 6828 1 1 14 LEU O O -2.951 6.727 7.402 1.00 . A A . 14 LEU O 1 1 15 6829 1 1 15 GLY C C -2.351 3.179 6.080 1.00 . A A . 15 GLY C 1 1 15 6830 1 1 15 GLY CA C -2.336 4.650 5.717 1.00 . A A . 15 GLY CA 1 1 15 6831 1 1 15 GLY H H -4.386 4.939 5.293 1.00 . A A . 15 GLY H 1 1 15 6832 1 1 15 GLY HA2 H -1.997 4.755 4.697 1.00 . A A . 15 GLY HA2 1 1 15 6833 1 1 15 GLY HA3 H -1.646 5.163 6.369 1.00 . A A . 15 GLY HA3 1 1 15 6834 1 1 15 GLY N N -3.641 5.264 5.841 1.00 . A A . 15 GLY N 1 1 15 6835 1 1 15 GLY O O -3.004 2.775 7.042 1.00 . A A . 15 GLY O 1 1 15 6836 1 1 16 PHE C C -0.356 0.374 4.779 1.00 . A A . 16 PHE C 1 1 15 6837 1 1 16 PHE CA C -1.550 0.943 5.534 1.00 . A A . 16 PHE CA 1 1 15 6838 1 1 16 PHE CB C -2.844 0.256 5.078 1.00 . A A . 16 PHE CB 1 1 15 6839 1 1 16 PHE CD1 C -2.572 -1.692 6.641 1.00 . A A . 16 PHE CD1 1 1 15 6840 1 1 16 PHE CD2 C -3.252 -2.124 4.396 1.00 . A A . 16 PHE CD2 1 1 15 6841 1 1 16 PHE CE1 C -2.616 -3.045 6.917 1.00 . A A . 16 PHE CE1 1 1 15 6842 1 1 16 PHE CE2 C -3.298 -3.479 4.667 1.00 . A A . 16 PHE CE2 1 1 15 6843 1 1 16 PHE CG C -2.890 -1.216 5.378 1.00 . A A . 16 PHE CG 1 1 15 6844 1 1 16 PHE CZ C -2.979 -3.939 5.929 1.00 . A A . 16 PHE CZ 1 1 15 6845 1 1 16 PHE H H -1.134 2.767 4.548 1.00 . A A . 16 PHE H 1 1 15 6846 1 1 16 PHE HA H -1.411 0.778 6.593 1.00 . A A . 16 PHE HA 1 1 15 6847 1 1 16 PHE HB2 H -3.683 0.720 5.574 1.00 . A A . 16 PHE HB2 1 1 15 6848 1 1 16 PHE HB3 H -2.950 0.382 4.010 1.00 . A A . 16 PHE HB3 1 1 15 6849 1 1 16 PHE HD1 H -2.289 -0.994 7.414 1.00 . A A . 16 PHE HD1 1 1 15 6850 1 1 16 PHE HD2 H -3.501 -1.765 3.408 1.00 . A A . 16 PHE HD2 1 1 15 6851 1 1 16 PHE HE1 H -2.366 -3.404 7.906 1.00 . A A . 16 PHE HE1 1 1 15 6852 1 1 16 PHE HE2 H -3.582 -4.175 3.893 1.00 . A A . 16 PHE HE2 1 1 15 6853 1 1 16 PHE HZ H -3.013 -4.998 6.143 1.00 . A A . 16 PHE HZ 1 1 15 6854 1 1 16 PHE N N -1.631 2.379 5.305 1.00 . A A . 16 PHE N 1 1 15 6855 1 1 16 PHE O O -0.145 0.698 3.613 1.00 . A A . 16 PHE O 1 1 15 6856 1 1 17 VAL C C 1.180 -2.105 3.791 1.00 . A A . 17 VAL C 1 1 15 6857 1 1 17 VAL CA C 1.606 -1.039 4.793 1.00 . A A . 17 VAL CA 1 1 15 6858 1 1 17 VAL CB C 2.594 -1.680 5.787 1.00 . A A . 17 VAL CB 1 1 15 6859 1 1 17 VAL CG1 C 4.027 -1.549 5.287 1.00 . A A . 17 VAL CG1 1 1 15 6860 1 1 17 VAL CG2 C 2.444 -1.094 7.184 1.00 . A A . 17 VAL CG2 1 1 15 6861 1 1 17 VAL H H 0.236 -0.683 6.369 1.00 . A A . 17 VAL H 1 1 15 6862 1 1 17 VAL HA H 2.119 -0.248 4.264 1.00 . A A . 17 VAL HA 1 1 15 6863 1 1 17 VAL HB H 2.368 -2.731 5.828 1.00 . A A . 17 VAL HB 1 1 15 6864 1 1 17 VAL HG11 H 4.022 -1.150 4.283 1.00 . A A . 17 VAL HG11 1 1 15 6865 1 1 17 VAL HG12 H 4.497 -2.521 5.285 1.00 . A A . 17 VAL HG12 1 1 15 6866 1 1 17 VAL HG13 H 4.576 -0.884 5.937 1.00 . A A . 17 VAL HG13 1 1 15 6867 1 1 17 VAL HG21 H 2.672 -1.851 7.919 1.00 . A A . 17 VAL HG21 1 1 15 6868 1 1 17 VAL HG22 H 1.430 -0.749 7.324 1.00 . A A . 17 VAL HG22 1 1 15 6869 1 1 17 VAL HG23 H 3.125 -0.263 7.302 1.00 . A A . 17 VAL HG23 1 1 15 6870 1 1 17 VAL N N 0.436 -0.459 5.438 1.00 . A A . 17 VAL N 1 1 15 6871 1 1 17 VAL O O 0.022 -2.520 3.760 1.00 . A A . 17 VAL O 1 1 15 6872 1 1 18 TYR C C 3.238 -3.796 1.235 1.00 . A A . 18 TYR C 1 1 15 6873 1 1 18 TYR CA C 1.932 -3.573 1.984 1.00 . A A . 18 TYR CA 1 1 15 6874 1 1 18 TYR CB C 0.833 -3.168 0.993 1.00 . A A . 18 TYR CB 1 1 15 6875 1 1 18 TYR CD1 C 0.175 -5.542 0.437 1.00 . A A . 18 TYR CD1 1 1 15 6876 1 1 18 TYR CD2 C 0.454 -4.004 -1.362 1.00 . A A . 18 TYR CD2 1 1 15 6877 1 1 18 TYR CE1 C -0.143 -6.543 -0.462 1.00 . A A . 18 TYR CE1 1 1 15 6878 1 1 18 TYR CE2 C 0.136 -4.999 -2.268 1.00 . A A . 18 TYR CE2 1 1 15 6879 1 1 18 TYR CG C 0.479 -4.258 0.003 1.00 . A A . 18 TYR CG 1 1 15 6880 1 1 18 TYR CZ C -0.162 -6.267 -1.812 1.00 . A A . 18 TYR CZ 1 1 15 6881 1 1 18 TYR H H 3.037 -2.178 3.123 1.00 . A A . 18 TYR H 1 1 15 6882 1 1 18 TYR HA H 1.650 -4.489 2.483 1.00 . A A . 18 TYR HA 1 1 15 6883 1 1 18 TYR HB2 H -0.062 -2.916 1.543 1.00 . A A . 18 TYR HB2 1 1 15 6884 1 1 18 TYR HB3 H 1.162 -2.304 0.434 1.00 . A A . 18 TYR HB3 1 1 15 6885 1 1 18 TYR HD1 H 0.189 -5.757 1.495 1.00 . A A . 18 TYR HD1 1 1 15 6886 1 1 18 TYR HD2 H 0.689 -3.010 -1.716 1.00 . A A . 18 TYR HD2 1 1 15 6887 1 1 18 TYR HE1 H -0.376 -7.534 -0.104 1.00 . A A . 18 TYR HE1 1 1 15 6888 1 1 18 TYR HE2 H 0.121 -4.782 -3.325 1.00 . A A . 18 TYR HE2 1 1 15 6889 1 1 18 TYR HH H -1.366 -7.122 -3.044 1.00 . A A . 18 TYR HH 1 1 15 6890 1 1 18 TYR N N 2.140 -2.544 3.000 1.00 . A A . 18 TYR N 1 1 15 6891 1 1 18 TYR O O 3.651 -4.928 0.982 1.00 . A A . 18 TYR O 1 1 15 6892 1 1 18 TYR OH O -0.476 -7.262 -2.708 1.00 . A A . 18 TYR OH 1 1 15 6893 1 1 19 CYS C C 6.271 -3.205 1.052 1.00 . A A . 19 CYS C 1 1 15 6894 1 1 19 CYS CA C 5.143 -2.710 0.170 1.00 . A A . 19 CYS CA 1 1 15 6895 1 1 19 CYS CB C 5.489 -1.314 -0.320 1.00 . A A . 19 CYS CB 1 1 15 6896 1 1 19 CYS H H 3.485 -1.820 1.124 1.00 . A A . 19 CYS H 1 1 15 6897 1 1 19 CYS HA H 5.036 -3.367 -0.683 1.00 . A A . 19 CYS HA 1 1 15 6898 1 1 19 CYS HB2 H 5.348 -0.620 0.493 1.00 . A A . 19 CYS HB2 1 1 15 6899 1 1 19 CYS HB3 H 6.526 -1.288 -0.629 1.00 . A A . 19 CYS HB3 1 1 15 6900 1 1 19 CYS N N 3.878 -2.688 0.888 1.00 . A A . 19 CYS N 1 1 15 6901 1 1 19 CYS O O 6.095 -3.420 2.252 1.00 . A A . 19 CYS O 1 1 15 6902 1 1 19 CYS SG S 4.473 -0.746 -1.706 1.00 . A A . 19 CYS SG 1 1 15 6903 1 1 20 CYS C C 9.067 -2.695 2.088 1.00 . A A . 20 CYS C 1 1 15 6904 1 1 20 CYS CA C 8.607 -3.813 1.173 1.00 . A A . 20 CYS CA 1 1 15 6905 1 1 20 CYS CB C 9.729 -4.225 0.218 1.00 . A A . 20 CYS CB 1 1 15 6906 1 1 20 CYS H H 7.518 -3.164 -0.507 1.00 . A A . 20 CYS H 1 1 15 6907 1 1 20 CYS HA H 8.318 -4.669 1.767 1.00 . A A . 20 CYS HA 1 1 15 6908 1 1 20 CYS HB2 H 9.587 -3.724 -0.717 1.00 . A A . 20 CYS HB2 1 1 15 6909 1 1 20 CYS HB3 H 10.675 -3.920 0.644 1.00 . A A . 20 CYS HB3 1 1 15 6910 1 1 20 CYS N N 7.440 -3.367 0.447 1.00 . A A . 20 CYS N 1 1 15 6911 1 1 20 CYS O O 8.692 -1.535 1.883 1.00 . A A . 20 CYS O 1 1 15 6912 1 1 20 CYS SG S 9.816 -6.025 -0.113 1.00 . A A . 20 CYS SG 1 1 15 6913 1 1 21 PRO C C 10.955 -0.826 3.369 1.00 . A A . 21 PRO C 1 1 15 6914 1 1 21 PRO CA C 10.347 -2.027 4.062 1.00 . A A . 21 PRO CA 1 1 15 6915 1 1 21 PRO CB C 11.386 -2.776 4.874 1.00 . A A . 21 PRO CB 1 1 15 6916 1 1 21 PRO CD C 10.338 -4.370 3.433 1.00 . A A . 21 PRO CD 1 1 15 6917 1 1 21 PRO CG C 10.957 -4.204 4.798 1.00 . A A . 21 PRO CG 1 1 15 6918 1 1 21 PRO HA H 9.554 -1.692 4.714 1.00 . A A . 21 PRO HA 1 1 15 6919 1 1 21 PRO HB2 H 12.366 -2.627 4.440 1.00 . A A . 21 PRO HB2 1 1 15 6920 1 1 21 PRO HB3 H 11.367 -2.404 5.882 1.00 . A A . 21 PRO HB3 1 1 15 6921 1 1 21 PRO HD2 H 11.076 -4.694 2.717 1.00 . A A . 21 PRO HD2 1 1 15 6922 1 1 21 PRO HD3 H 9.515 -5.066 3.460 1.00 . A A . 21 PRO HD3 1 1 15 6923 1 1 21 PRO HG2 H 11.814 -4.852 4.905 1.00 . A A . 21 PRO HG2 1 1 15 6924 1 1 21 PRO HG3 H 10.228 -4.410 5.567 1.00 . A A . 21 PRO HG3 1 1 15 6925 1 1 21 PRO N N 9.862 -3.018 3.113 1.00 . A A . 21 PRO N 1 1 15 6926 1 1 21 PRO O O 11.994 -0.909 2.715 1.00 . A A . 21 PRO O 1 1 15 6927 1 1 22 GLY C C 9.493 2.229 2.248 1.00 . A A . 22 GLY C 1 1 15 6928 1 1 22 GLY CA C 10.664 1.512 2.888 1.00 . A A . 22 GLY CA 1 1 15 6929 1 1 22 GLY H H 9.433 0.232 4.023 1.00 . A A . 22 GLY H 1 1 15 6930 1 1 22 GLY HA2 H 11.099 2.152 3.640 1.00 . A A . 22 GLY HA2 1 1 15 6931 1 1 22 GLY HA3 H 11.404 1.304 2.131 1.00 . A A . 22 GLY HA3 1 1 15 6932 1 1 22 GLY N N 10.257 0.273 3.505 1.00 . A A . 22 GLY N 1 1 15 6933 1 1 22 GLY O O 9.393 3.451 2.322 1.00 . A A . 22 GLY O 1 1 15 6934 1 1 23 LEU C C 6.158 1.644 1.713 1.00 . A A . 23 LEU C 1 1 15 6935 1 1 23 LEU CA C 7.432 2.031 0.963 1.00 . A A . 23 LEU CA 1 1 15 6936 1 1 23 LEU CB C 7.358 1.546 -0.487 1.00 . A A . 23 LEU CB 1 1 15 6937 1 1 23 LEU CD1 C 8.467 1.167 -2.701 1.00 . A A . 23 LEU CD1 1 1 15 6938 1 1 23 LEU CD2 C 8.823 3.322 -1.487 1.00 . A A . 23 LEU CD2 1 1 15 6939 1 1 23 LEU CG C 8.601 1.825 -1.336 1.00 . A A . 23 LEU CG 1 1 15 6940 1 1 23 LEU H H 8.736 0.487 1.600 1.00 . A A . 23 LEU H 1 1 15 6941 1 1 23 LEU HA H 7.532 3.105 0.973 1.00 . A A . 23 LEU HA 1 1 15 6942 1 1 23 LEU HB2 H 7.186 0.479 -0.478 1.00 . A A . 23 LEU HB2 1 1 15 6943 1 1 23 LEU HB3 H 6.513 2.024 -0.960 1.00 . A A . 23 LEU HB3 1 1 15 6944 1 1 23 LEU HD11 H 9.444 1.077 -3.153 1.00 . A A . 23 LEU HD11 1 1 15 6945 1 1 23 LEU HD12 H 7.833 1.772 -3.331 1.00 . A A . 23 LEU HD12 1 1 15 6946 1 1 23 LEU HD13 H 8.031 0.186 -2.586 1.00 . A A . 23 LEU HD13 1 1 15 6947 1 1 23 LEU HD21 H 8.957 3.765 -0.512 1.00 . A A . 23 LEU HD21 1 1 15 6948 1 1 23 LEU HD22 H 7.965 3.767 -1.969 1.00 . A A . 23 LEU HD22 1 1 15 6949 1 1 23 LEU HD23 H 9.704 3.496 -2.086 1.00 . A A . 23 LEU HD23 1 1 15 6950 1 1 23 LEU HG H 9.465 1.404 -0.846 1.00 . A A . 23 LEU HG 1 1 15 6951 1 1 23 LEU N N 8.604 1.463 1.621 1.00 . A A . 23 LEU N 1 1 15 6952 1 1 23 LEU O O 6.064 0.543 2.263 1.00 . A A . 23 LEU O 1 1 15 6953 1 1 24 ILE C C 2.720 2.794 1.618 1.00 . A A . 24 ILE C 1 1 15 6954 1 1 24 ILE CA C 3.915 2.288 2.427 1.00 . A A . 24 ILE CA 1 1 15 6955 1 1 24 ILE CB C 3.879 2.943 3.828 1.00 . A A . 24 ILE CB 1 1 15 6956 1 1 24 ILE CD1 C 4.147 5.165 5.057 1.00 . A A . 24 ILE CD1 1 1 15 6957 1 1 24 ILE CG1 C 4.261 4.425 3.741 1.00 . A A . 24 ILE CG1 1 1 15 6958 1 1 24 ILE CG2 C 4.797 2.203 4.794 1.00 . A A . 24 ILE CG2 1 1 15 6959 1 1 24 ILE H H 5.313 3.411 1.275 1.00 . A A . 24 ILE H 1 1 15 6960 1 1 24 ILE HA H 3.821 1.219 2.553 1.00 . A A . 24 ILE HA 1 1 15 6961 1 1 24 ILE HB H 2.871 2.864 4.207 1.00 . A A . 24 ILE HB 1 1 15 6962 1 1 24 ILE HD11 H 4.702 4.635 5.817 1.00 . A A . 24 ILE HD11 1 1 15 6963 1 1 24 ILE HD12 H 3.108 5.227 5.346 1.00 . A A . 24 ILE HD12 1 1 15 6964 1 1 24 ILE HD13 H 4.550 6.161 4.946 1.00 . A A . 24 ILE HD13 1 1 15 6965 1 1 24 ILE HG12 H 5.283 4.507 3.403 1.00 . A A . 24 ILE HG12 1 1 15 6966 1 1 24 ILE HG13 H 3.612 4.915 3.028 1.00 . A A . 24 ILE HG13 1 1 15 6967 1 1 24 ILE HG21 H 5.592 1.725 4.241 1.00 . A A . 24 ILE HG21 1 1 15 6968 1 1 24 ILE HG22 H 4.230 1.456 5.329 1.00 . A A . 24 ILE HG22 1 1 15 6969 1 1 24 ILE HG23 H 5.220 2.905 5.497 1.00 . A A . 24 ILE HG23 1 1 15 6970 1 1 24 ILE N N 5.181 2.544 1.736 1.00 . A A . 24 ILE N 1 1 15 6971 1 1 24 ILE O O 2.773 3.860 1.014 1.00 . A A . 24 ILE O 1 1 15 6972 1 1 25 CYS C C -0.367 3.466 1.650 1.00 . A A . 25 CYS C 1 1 15 6973 1 1 25 CYS CA C 0.429 2.402 0.893 1.00 . A A . 25 CYS CA 1 1 15 6974 1 1 25 CYS CB C -0.445 1.173 0.612 1.00 . A A . 25 CYS CB 1 1 15 6975 1 1 25 CYS H H 1.647 1.184 2.123 1.00 . A A . 25 CYS H 1 1 15 6976 1 1 25 CYS HA H 0.734 2.825 -0.044 1.00 . A A . 25 CYS HA 1 1 15 6977 1 1 25 CYS HB2 H -0.443 0.535 1.482 1.00 . A A . 25 CYS HB2 1 1 15 6978 1 1 25 CYS HB3 H -1.455 1.499 0.414 1.00 . A A . 25 CYS HB3 1 1 15 6979 1 1 25 CYS N N 1.639 2.024 1.618 1.00 . A A . 25 CYS N 1 1 15 6980 1 1 25 CYS O O -0.495 3.414 2.875 1.00 . A A . 25 CYS O 1 1 15 6981 1 1 25 CYS SG S 0.102 0.169 -0.811 1.00 . A A . 25 CYS SG 1 1 15 6982 1 1 26 GLY C C -2.886 5.861 0.657 1.00 . A A . 26 GLY C 1 1 15 6983 1 1 26 GLY CA C -1.674 5.500 1.500 1.00 . A A . 26 GLY CA 1 1 15 6984 1 1 26 GLY H H -0.753 4.416 -0.067 1.00 . A A . 26 GLY H 1 1 15 6985 1 1 26 GLY HA2 H -2.006 5.188 2.478 1.00 . A A . 26 GLY HA2 1 1 15 6986 1 1 26 GLY HA3 H -1.047 6.373 1.604 1.00 . A A . 26 GLY HA3 1 1 15 6987 1 1 26 GLY N N -0.896 4.430 0.906 1.00 . A A . 26 GLY N 1 1 15 6988 1 1 26 GLY O O -3.977 5.346 0.891 1.00 . A A . 26 GLY O 1 1 15 6989 1 1 27 PRO C C -4.198 6.105 -2.257 1.00 . A A . 27 PRO C 1 1 15 6990 1 1 27 PRO CA C -3.831 7.165 -1.220 1.00 . A A . 27 PRO CA 1 1 15 6991 1 1 27 PRO CB C -3.285 8.424 -1.891 1.00 . A A . 27 PRO CB 1 1 15 6992 1 1 27 PRO CD C -1.459 7.411 -0.698 1.00 . A A . 27 PRO CD 1 1 15 6993 1 1 27 PRO CG C -1.806 8.236 -1.913 1.00 . A A . 27 PRO CG 1 1 15 6994 1 1 27 PRO HA H -4.710 7.409 -0.645 1.00 . A A . 27 PRO HA 1 1 15 6995 1 1 27 PRO HB2 H -3.688 8.505 -2.891 1.00 . A A . 27 PRO HB2 1 1 15 6996 1 1 27 PRO HB3 H -3.563 9.293 -1.314 1.00 . A A . 27 PRO HB3 1 1 15 6997 1 1 27 PRO HD2 H -0.700 6.684 -0.943 1.00 . A A . 27 PRO HD2 1 1 15 6998 1 1 27 PRO HD3 H -1.122 8.051 0.105 1.00 . A A . 27 PRO HD3 1 1 15 6999 1 1 27 PRO HG2 H -1.517 7.712 -2.812 1.00 . A A . 27 PRO HG2 1 1 15 7000 1 1 27 PRO HG3 H -1.315 9.196 -1.865 1.00 . A A . 27 PRO HG3 1 1 15 7001 1 1 27 PRO N N -2.727 6.746 -0.343 1.00 . A A . 27 PRO N 1 1 15 7002 1 1 27 PRO O O -4.195 6.360 -3.460 1.00 . A A . 27 PRO O 1 1 15 7003 1 1 28 PHE C C -3.703 3.329 -3.476 1.00 . A A . 28 PHE C 1 1 15 7004 1 1 28 PHE CA C -4.867 3.755 -2.578 1.00 . A A . 28 PHE CA 1 1 15 7005 1 1 28 PHE CB C -6.153 4.011 -3.403 1.00 . A A . 28 PHE CB 1 1 15 7006 1 1 28 PHE CD1 C -7.548 5.232 -1.699 1.00 . A A . 28 PHE CD1 1 1 15 7007 1 1 28 PHE CD2 C -8.403 3.212 -2.630 1.00 . A A . 28 PHE CD2 1 1 15 7008 1 1 28 PHE CE1 C -8.684 5.361 -0.925 1.00 . A A . 28 PHE CE1 1 1 15 7009 1 1 28 PHE CE2 C -9.542 3.335 -1.858 1.00 . A A . 28 PHE CE2 1 1 15 7010 1 1 28 PHE CG C -7.392 4.158 -2.561 1.00 . A A . 28 PHE CG 1 1 15 7011 1 1 28 PHE CZ C -9.683 4.412 -1.005 1.00 . A A . 28 PHE CZ 1 1 15 7012 1 1 28 PHE H H -4.463 4.805 -0.782 1.00 . A A . 28 PHE H 1 1 15 7013 1 1 28 PHE HA H -5.064 2.941 -1.893 1.00 . A A . 28 PHE HA 1 1 15 7014 1 1 28 PHE HB2 H -6.044 4.919 -3.980 1.00 . A A . 28 PHE HB2 1 1 15 7015 1 1 28 PHE HB3 H -6.312 3.180 -4.079 1.00 . A A . 28 PHE HB3 1 1 15 7016 1 1 28 PHE HD1 H -6.768 5.977 -1.635 1.00 . A A . 28 PHE HD1 1 1 15 7017 1 1 28 PHE HD2 H -8.294 2.369 -3.298 1.00 . A A . 28 PHE HD2 1 1 15 7018 1 1 28 PHE HE1 H -8.791 6.204 -0.256 1.00 . A A . 28 PHE HE1 1 1 15 7019 1 1 28 PHE HE2 H -10.322 2.591 -1.923 1.00 . A A . 28 PHE HE2 1 1 15 7020 1 1 28 PHE HZ H -10.573 4.510 -0.400 1.00 . A A . 28 PHE HZ 1 1 15 7021 1 1 28 PHE N N -4.498 4.913 -1.758 1.00 . A A . 28 PHE N 1 1 15 7022 1 1 28 PHE O O -3.873 2.529 -4.394 1.00 . A A . 28 PHE O 1 1 15 7023 1 1 29 VAL C C -0.155 3.529 -2.860 1.00 . A A . 29 VAL C 1 1 15 7024 1 1 29 VAL CA C -1.286 3.502 -3.871 1.00 . A A . 29 VAL CA 1 1 15 7025 1 1 29 VAL CB C -0.944 4.486 -5.025 1.00 . A A . 29 VAL CB 1 1 15 7026 1 1 29 VAL CG1 C -1.966 4.400 -6.147 1.00 . A A . 29 VAL CG1 1 1 15 7027 1 1 29 VAL CG2 C -0.838 5.913 -4.508 1.00 . A A . 29 VAL CG2 1 1 15 7028 1 1 29 VAL H H -2.442 4.427 -2.372 1.00 . A A . 29 VAL H 1 1 15 7029 1 1 29 VAL HA H -1.389 2.500 -4.281 1.00 . A A . 29 VAL HA 1 1 15 7030 1 1 29 VAL HB H 0.025 4.206 -5.435 1.00 . A A . 29 VAL HB 1 1 15 7031 1 1 29 VAL HG11 H -2.944 4.212 -5.728 1.00 . A A . 29 VAL HG11 1 1 15 7032 1 1 29 VAL HG12 H -1.700 3.595 -6.816 1.00 . A A . 29 VAL HG12 1 1 15 7033 1 1 29 VAL HG13 H -1.981 5.331 -6.692 1.00 . A A . 29 VAL HG13 1 1 15 7034 1 1 29 VAL HG21 H -0.193 5.936 -3.643 1.00 . A A . 29 VAL HG21 1 1 15 7035 1 1 29 VAL HG22 H -1.821 6.270 -4.234 1.00 . A A . 29 VAL HG22 1 1 15 7036 1 1 29 VAL HG23 H -0.428 6.547 -5.280 1.00 . A A . 29 VAL HG23 1 1 15 7037 1 1 29 VAL N N -2.513 3.831 -3.155 1.00 . A A . 29 VAL N 1 1 15 7038 1 1 29 VAL O O -0.326 4.066 -1.761 1.00 . A A . 29 VAL O 1 1 15 7039 1 1 30 CYS C C 2.984 4.170 -2.533 1.00 . A A . 30 CYS C 1 1 15 7040 1 1 30 CYS CA C 2.111 2.938 -2.306 1.00 . A A . 30 CYS CA 1 1 15 7041 1 1 30 CYS CB C 2.887 1.643 -2.527 1.00 . A A . 30 CYS CB 1 1 15 7042 1 1 30 CYS H H 1.061 2.552 -4.095 1.00 . A A . 30 CYS H 1 1 15 7043 1 1 30 CYS HA H 1.741 2.958 -1.300 1.00 . A A . 30 CYS HA 1 1 15 7044 1 1 30 CYS HB2 H 2.185 0.839 -2.684 1.00 . A A . 30 CYS HB2 1 1 15 7045 1 1 30 CYS HB3 H 3.494 1.753 -3.416 1.00 . A A . 30 CYS HB3 1 1 15 7046 1 1 30 CYS N N 0.974 2.964 -3.207 1.00 . A A . 30 CYS N 1 1 15 7047 1 1 30 CYS O O 3.024 4.724 -3.633 1.00 . A A . 30 CYS O 1 1 15 7048 1 1 30 CYS SG S 3.983 1.146 -1.176 1.00 . A A . 30 CYS SG 1 1 15 7049 1 1 31 VAL C C 5.822 5.556 -0.866 1.00 . A A . 31 VAL C 1 1 15 7050 1 1 31 VAL CA C 4.517 5.789 -1.611 1.00 . A A . 31 VAL CA 1 1 15 7051 1 1 31 VAL CB C 3.838 7.069 -1.059 1.00 . A A . 31 VAL CB 1 1 15 7052 1 1 31 VAL CG1 C 2.575 7.405 -1.840 1.00 . A A . 31 VAL CG1 1 1 15 7053 1 1 31 VAL CG2 C 3.523 6.921 0.424 1.00 . A A . 31 VAL CG2 1 1 15 7054 1 1 31 VAL H H 3.599 4.159 -0.631 1.00 . A A . 31 VAL H 1 1 15 7055 1 1 31 VAL HA H 4.737 5.938 -2.666 1.00 . A A . 31 VAL HA 1 1 15 7056 1 1 31 VAL HB H 4.529 7.892 -1.173 1.00 . A A . 31 VAL HB 1 1 15 7057 1 1 31 VAL HG11 H 1.707 7.164 -1.242 1.00 . A A . 31 VAL HG11 1 1 15 7058 1 1 31 VAL HG12 H 2.553 6.832 -2.754 1.00 . A A . 31 VAL HG12 1 1 15 7059 1 1 31 VAL HG13 H 2.567 8.460 -2.075 1.00 . A A . 31 VAL HG13 1 1 15 7060 1 1 31 VAL HG21 H 3.073 7.832 0.789 1.00 . A A . 31 VAL HG21 1 1 15 7061 1 1 31 VAL HG22 H 4.434 6.725 0.967 1.00 . A A . 31 VAL HG22 1 1 15 7062 1 1 31 VAL HG23 H 2.836 6.099 0.564 1.00 . A A . 31 VAL HG23 1 1 15 7063 1 1 31 VAL N N 3.667 4.620 -1.498 1.00 . A A . 31 VAL N 1 1 15 7064 1 1 31 VAL O O 5.856 4.648 -0.012 1.00 . A A . 31 VAL O 1 1 15 7065 1 1 31 VAL OXT O 6.804 6.275 -1.160 1.00 . A A . 31 VAL OXT 1 1 16 7066 1 1 1 ALA C C 4.748 -8.492 0.628 1.00 . A A . 1 ALA C 1 1 16 7067 1 1 1 ALA CA C 4.962 -9.995 0.588 1.00 . A A . 1 ALA CA 1 1 16 7068 1 1 1 ALA CB C 3.632 -10.720 0.448 1.00 . A A . 1 ALA CB 1 1 16 7069 1 1 1 ALA H1 H 6.669 -10.612 1.611 1.00 . A A . 1 ALA H1 1 1 16 7070 1 1 1 ALA H2 H 5.239 -11.304 2.185 1.00 . A A . 1 ALA H2 1 1 16 7071 1 1 1 ALA H3 H 5.602 -9.691 2.548 1.00 . A A . 1 ALA H3 1 1 16 7072 1 1 1 ALA HA H 5.575 -10.241 -0.268 1.00 . A A . 1 ALA HA 1 1 16 7073 1 1 1 ALA HB1 H 3.334 -11.113 1.409 1.00 . A A . 1 ALA HB1 1 1 16 7074 1 1 1 ALA HB2 H 3.737 -11.532 -0.256 1.00 . A A . 1 ALA HB2 1 1 16 7075 1 1 1 ALA HB3 H 2.880 -10.030 0.093 1.00 . A A . 1 ALA HB3 1 1 16 7076 1 1 1 ALA N N 5.668 -10.434 1.816 1.00 . A A . 1 ALA N 1 1 16 7077 1 1 1 ALA O O 4.527 -7.936 1.696 1.00 . A A . 1 ALA O 1 1 16 7078 1 1 2 CYS C C 4.065 -5.993 -1.944 1.00 . A A . 2 CYS C 1 1 16 7079 1 1 2 CYS CA C 4.646 -6.398 -0.591 1.00 . A A . 2 CYS CA 1 1 16 7080 1 1 2 CYS CB C 5.978 -5.701 -0.314 1.00 . A A . 2 CYS CB 1 1 16 7081 1 1 2 CYS H H 5.011 -8.335 -1.349 1.00 . A A . 2 CYS H 1 1 16 7082 1 1 2 CYS HA H 3.944 -6.105 0.183 1.00 . A A . 2 CYS HA 1 1 16 7083 1 1 2 CYS HB2 H 5.809 -4.636 -0.285 1.00 . A A . 2 CYS HB2 1 1 16 7084 1 1 2 CYS HB3 H 6.340 -6.020 0.653 1.00 . A A . 2 CYS HB3 1 1 16 7085 1 1 2 CYS N N 4.825 -7.841 -0.523 1.00 . A A . 2 CYS N 1 1 16 7086 1 1 2 CYS O O 3.314 -6.762 -2.542 1.00 . A A . 2 CYS O 1 1 16 7087 1 1 2 CYS SG S 7.311 -5.998 -1.520 1.00 . A A . 2 CYS SG 1 1 16 7088 1 1 3 SER C C 4.708 -3.122 -4.178 1.00 . A A . 3 SER C 1 1 16 7089 1 1 3 SER CA C 3.885 -4.313 -3.694 1.00 . A A . 3 SER CA 1 1 16 7090 1 1 3 SER CB C 2.411 -3.913 -3.548 1.00 . A A . 3 SER CB 1 1 16 7091 1 1 3 SER H H 4.997 -4.221 -1.906 1.00 . A A . 3 SER H 1 1 16 7092 1 1 3 SER HA H 3.966 -5.113 -4.414 1.00 . A A . 3 SER HA 1 1 16 7093 1 1 3 SER HB2 H 1.853 -4.744 -3.146 1.00 . A A . 3 SER HB2 1 1 16 7094 1 1 3 SER HB3 H 2.335 -3.071 -2.875 1.00 . A A . 3 SER HB3 1 1 16 7095 1 1 3 SER HG H 1.620 -2.613 -4.786 1.00 . A A . 3 SER HG 1 1 16 7096 1 1 3 SER N N 4.398 -4.797 -2.421 1.00 . A A . 3 SER N 1 1 16 7097 1 1 3 SER O O 5.364 -2.448 -3.379 1.00 . A A . 3 SER O 1 1 16 7098 1 1 3 SER OG O 1.845 -3.550 -4.797 1.00 . A A . 3 SER OG 1 1 16 7099 1 1 4 LYS C C 4.832 -0.439 -5.560 1.00 . A A . 4 LYS C 1 1 16 7100 1 1 4 LYS CA C 5.386 -1.761 -6.090 1.00 . A A . 4 LYS CA 1 1 16 7101 1 1 4 LYS CB C 5.255 -1.819 -7.615 1.00 . A A . 4 LYS CB 1 1 16 7102 1 1 4 LYS CD C 5.786 -0.715 -9.810 1.00 . A A . 4 LYS CD 1 1 16 7103 1 1 4 LYS CE C 5.638 -2.046 -10.538 1.00 . A A . 4 LYS CE 1 1 16 7104 1 1 4 LYS CG C 6.216 -0.905 -8.363 1.00 . A A . 4 LYS CG 1 1 16 7105 1 1 4 LYS H H 4.110 -3.448 -6.054 1.00 . A A . 4 LYS H 1 1 16 7106 1 1 4 LYS HA H 6.427 -1.846 -5.815 1.00 . A A . 4 LYS HA 1 1 16 7107 1 1 4 LYS HB2 H 5.437 -2.833 -7.939 1.00 . A A . 4 LYS HB2 1 1 16 7108 1 1 4 LYS HB3 H 4.247 -1.543 -7.887 1.00 . A A . 4 LYS HB3 1 1 16 7109 1 1 4 LYS HD2 H 4.836 -0.202 -9.828 1.00 . A A . 4 LYS HD2 1 1 16 7110 1 1 4 LYS HD3 H 6.529 -0.118 -10.319 1.00 . A A . 4 LYS HD3 1 1 16 7111 1 1 4 LYS HE2 H 6.568 -2.275 -11.036 1.00 . A A . 4 LYS HE2 1 1 16 7112 1 1 4 LYS HE3 H 5.417 -2.816 -9.814 1.00 . A A . 4 LYS HE3 1 1 16 7113 1 1 4 LYS HG2 H 6.236 0.058 -7.874 1.00 . A A . 4 LYS HG2 1 1 16 7114 1 1 4 LYS HG3 H 7.204 -1.342 -8.343 1.00 . A A . 4 LYS HG3 1 1 16 7115 1 1 4 LYS HZ1 H 4.285 -2.962 -11.841 1.00 . A A . 4 LYS HZ1 1 1 16 7116 1 1 4 LYS HZ2 H 4.840 -1.460 -12.382 1.00 . A A . 4 LYS HZ2 1 1 16 7117 1 1 4 LYS HZ3 H 3.696 -1.542 -11.129 1.00 . A A . 4 LYS HZ3 1 1 16 7118 1 1 4 LYS N N 4.662 -2.873 -5.484 1.00 . A A . 4 LYS N 1 1 16 7119 1 1 4 LYS NZ N 4.546 -2.000 -11.548 1.00 . A A . 4 LYS NZ 1 1 16 7120 1 1 4 LYS O O 3.645 -0.337 -5.257 1.00 . A A . 4 LYS O 1 1 16 7121 1 1 5 LYS C C 4.075 2.426 -5.633 1.00 . A A . 5 LYS C 1 1 16 7122 1 1 5 LYS CA C 5.282 1.855 -4.902 1.00 . A A . 5 LYS CA 1 1 16 7123 1 1 5 LYS CB C 6.441 2.860 -4.946 1.00 . A A . 5 LYS CB 1 1 16 7124 1 1 5 LYS CD C 7.122 5.177 -4.203 1.00 . A A . 5 LYS CD 1 1 16 7125 1 1 5 LYS CE C 6.679 6.629 -4.115 1.00 . A A . 5 LYS CE 1 1 16 7126 1 1 5 LYS CG C 5.997 4.299 -4.716 1.00 . A A . 5 LYS CG 1 1 16 7127 1 1 5 LYS H H 6.633 0.415 -5.662 1.00 . A A . 5 LYS H 1 1 16 7128 1 1 5 LYS HA H 5.001 1.705 -3.875 1.00 . A A . 5 LYS HA 1 1 16 7129 1 1 5 LYS HB2 H 7.160 2.599 -4.183 1.00 . A A . 5 LYS HB2 1 1 16 7130 1 1 5 LYS HB3 H 6.917 2.802 -5.913 1.00 . A A . 5 LYS HB3 1 1 16 7131 1 1 5 LYS HD2 H 7.412 4.838 -3.219 1.00 . A A . 5 LYS HD2 1 1 16 7132 1 1 5 LYS HD3 H 7.962 5.104 -4.877 1.00 . A A . 5 LYS HD3 1 1 16 7133 1 1 5 LYS HE2 H 6.841 7.097 -5.076 1.00 . A A . 5 LYS HE2 1 1 16 7134 1 1 5 LYS HE3 H 5.625 6.660 -3.877 1.00 . A A . 5 LYS HE3 1 1 16 7135 1 1 5 LYS HG2 H 5.640 4.710 -5.644 1.00 . A A . 5 LYS HG2 1 1 16 7136 1 1 5 LYS HG3 H 5.196 4.302 -4.001 1.00 . A A . 5 LYS HG3 1 1 16 7137 1 1 5 LYS HZ1 H 7.236 6.978 -2.129 1.00 . A A . 5 LYS HZ1 1 1 16 7138 1 1 5 LYS HZ2 H 7.165 8.378 -3.082 1.00 . A A . 5 LYS HZ2 1 1 16 7139 1 1 5 LYS HZ3 H 8.460 7.306 -3.257 1.00 . A A . 5 LYS HZ3 1 1 16 7140 1 1 5 LYS N N 5.696 0.558 -5.426 1.00 . A A . 5 LYS N 1 1 16 7141 1 1 5 LYS NZ N 7.441 7.378 -3.080 1.00 . A A . 5 LYS NZ 1 1 16 7142 1 1 5 LYS O O 3.016 2.595 -5.062 1.00 . A A . 5 LYS O 1 1 16 7143 1 1 6 TRP C C 2.151 2.223 -8.094 1.00 . A A . 6 TRP C 1 1 16 7144 1 1 6 TRP CA C 3.129 3.299 -7.642 1.00 . A A . 6 TRP CA 1 1 16 7145 1 1 6 TRP CB C 3.675 4.098 -8.825 1.00 . A A . 6 TRP CB 1 1 16 7146 1 1 6 TRP CD1 C 6.154 4.596 -8.376 1.00 . A A . 6 TRP CD1 1 1 16 7147 1 1 6 TRP CD2 C 4.808 6.360 -8.089 1.00 . A A . 6 TRP CD2 1 1 16 7148 1 1 6 TRP CE2 C 6.135 6.760 -7.836 1.00 . A A . 6 TRP CE2 1 1 16 7149 1 1 6 TRP CE3 C 3.788 7.305 -7.964 1.00 . A A . 6 TRP CE3 1 1 16 7150 1 1 6 TRP CG C 4.844 4.974 -8.457 1.00 . A A . 6 TRP CG 1 1 16 7151 1 1 6 TRP CH2 C 5.443 8.964 -7.349 1.00 . A A . 6 TRP CH2 1 1 16 7152 1 1 6 TRP CZ2 C 6.464 8.061 -7.465 1.00 . A A . 6 TRP CZ2 1 1 16 7153 1 1 6 TRP CZ3 C 4.115 8.596 -7.592 1.00 . A A . 6 TRP CZ3 1 1 16 7154 1 1 6 TRP H H 5.076 2.572 -7.320 1.00 . A A . 6 TRP H 1 1 16 7155 1 1 6 TRP HA H 2.599 3.975 -6.981 1.00 . A A . 6 TRP HA 1 1 16 7156 1 1 6 TRP HB2 H 3.999 3.414 -9.595 1.00 . A A . 6 TRP HB2 1 1 16 7157 1 1 6 TRP HB3 H 2.892 4.730 -9.217 1.00 . A A . 6 TRP HB3 1 1 16 7158 1 1 6 TRP HD1 H 6.510 3.599 -8.574 1.00 . A A . 6 TRP HD1 1 1 16 7159 1 1 6 TRP HE1 H 7.911 5.649 -7.915 1.00 . A A . 6 TRP HE1 1 1 16 7160 1 1 6 TRP HE3 H 2.761 7.038 -8.138 1.00 . A A . 6 TRP HE3 1 1 16 7161 1 1 6 TRP HH2 H 5.652 9.984 -7.061 1.00 . A A . 6 TRP HH2 1 1 16 7162 1 1 6 TRP HZ2 H 7.483 8.361 -7.274 1.00 . A A . 6 TRP HZ2 1 1 16 7163 1 1 6 TRP HZ3 H 3.338 9.338 -7.490 1.00 . A A . 6 TRP HZ3 1 1 16 7164 1 1 6 TRP N N 4.225 2.726 -6.890 1.00 . A A . 6 TRP N 1 1 16 7165 1 1 6 TRP NE1 N 6.937 5.666 -8.019 1.00 . A A . 6 TRP NE1 1 1 16 7166 1 1 6 TRP O O 1.445 2.389 -9.088 1.00 . A A . 6 TRP O 1 1 16 7167 1 1 7 GLU C C -0.100 0.249 -6.819 1.00 . A A . 7 GLU C 1 1 16 7168 1 1 7 GLU CA C 1.162 0.063 -7.646 1.00 . A A . 7 GLU CA 1 1 16 7169 1 1 7 GLU CB C 1.782 -1.305 -7.357 1.00 . A A . 7 GLU CB 1 1 16 7170 1 1 7 GLU CD C 2.145 -2.136 -9.722 1.00 . A A . 7 GLU CD 1 1 16 7171 1 1 7 GLU CG C 1.449 -2.371 -8.392 1.00 . A A . 7 GLU CG 1 1 16 7172 1 1 7 GLU H H 2.662 1.070 -6.523 1.00 . A A . 7 GLU H 1 1 16 7173 1 1 7 GLU HA H 0.910 0.129 -8.694 1.00 . A A . 7 GLU HA 1 1 16 7174 1 1 7 GLU HB2 H 2.855 -1.198 -7.319 1.00 . A A . 7 GLU HB2 1 1 16 7175 1 1 7 GLU HB3 H 1.430 -1.648 -6.395 1.00 . A A . 7 GLU HB3 1 1 16 7176 1 1 7 GLU HG2 H 1.756 -3.333 -8.009 1.00 . A A . 7 GLU HG2 1 1 16 7177 1 1 7 GLU HG3 H 0.382 -2.374 -8.557 1.00 . A A . 7 GLU HG3 1 1 16 7178 1 1 7 GLU N N 2.088 1.136 -7.336 1.00 . A A . 7 GLU N 1 1 16 7179 1 1 7 GLU O O -0.029 0.600 -5.638 1.00 . A A . 7 GLU O 1 1 16 7180 1 1 7 GLU OE1 O 2.728 -1.050 -9.916 1.00 . A A . 7 GLU OE1 1 1 16 7181 1 1 7 GLU OE2 O 2.135 -3.043 -10.577 1.00 . A A . 7 GLU OE2 1 1 16 7182 1 1 8 TYR C C -2.619 -0.818 -5.599 1.00 . A A . 8 TYR C 1 1 16 7183 1 1 8 TYR CA C -2.522 0.174 -6.754 1.00 . A A . 8 TYR CA 1 1 16 7184 1 1 8 TYR CB C -3.671 -0.043 -7.748 1.00 . A A . 8 TYR CB 1 1 16 7185 1 1 8 TYR CD1 C -5.535 1.049 -6.431 1.00 . A A . 8 TYR CD1 1 1 16 7186 1 1 8 TYR CD2 C -5.870 -1.168 -7.231 1.00 . A A . 8 TYR CD2 1 1 16 7187 1 1 8 TYR CE1 C -6.794 1.038 -5.864 1.00 . A A . 8 TYR CE1 1 1 16 7188 1 1 8 TYR CE2 C -7.132 -1.187 -6.668 1.00 . A A . 8 TYR CE2 1 1 16 7189 1 1 8 TYR CG C -5.051 -0.053 -7.122 1.00 . A A . 8 TYR CG 1 1 16 7190 1 1 8 TYR CZ C -7.588 -0.081 -5.985 1.00 . A A . 8 TYR CZ 1 1 16 7191 1 1 8 TYR H H -1.235 -0.244 -8.378 1.00 . A A . 8 TYR H 1 1 16 7192 1 1 8 TYR HA H -2.572 1.180 -6.356 1.00 . A A . 8 TYR HA 1 1 16 7193 1 1 8 TYR HB2 H -3.651 0.748 -8.482 1.00 . A A . 8 TYR HB2 1 1 16 7194 1 1 8 TYR HB3 H -3.527 -0.990 -8.247 1.00 . A A . 8 TYR HB3 1 1 16 7195 1 1 8 TYR HD1 H -4.911 1.925 -6.339 1.00 . A A . 8 TYR HD1 1 1 16 7196 1 1 8 TYR HD2 H -5.508 -2.034 -7.766 1.00 . A A . 8 TYR HD2 1 1 16 7197 1 1 8 TYR HE1 H -7.152 1.906 -5.328 1.00 . A A . 8 TYR HE1 1 1 16 7198 1 1 8 TYR HE2 H -7.753 -2.065 -6.764 1.00 . A A . 8 TYR HE2 1 1 16 7199 1 1 8 TYR HH H -8.800 -0.510 -4.555 1.00 . A A . 8 TYR HH 1 1 16 7200 1 1 8 TYR N N -1.246 0.026 -7.438 1.00 . A A . 8 TYR N 1 1 16 7201 1 1 8 TYR O O -2.564 -2.033 -5.804 1.00 . A A . 8 TYR O 1 1 16 7202 1 1 8 TYR OH O -8.843 -0.095 -5.421 1.00 . A A . 8 TYR OH 1 1 16 7203 1 1 9 CYS C C -4.236 -1.800 -3.146 1.00 . A A . 9 CYS C 1 1 16 7204 1 1 9 CYS CA C -2.866 -1.133 -3.206 1.00 . A A . 9 CYS CA 1 1 16 7205 1 1 9 CYS CB C -2.613 -0.316 -1.932 1.00 . A A . 9 CYS CB 1 1 16 7206 1 1 9 CYS H H -2.797 0.681 -4.294 1.00 . A A . 9 CYS H 1 1 16 7207 1 1 9 CYS HA H -2.113 -1.903 -3.282 1.00 . A A . 9 CYS HA 1 1 16 7208 1 1 9 CYS HB2 H -3.321 0.498 -1.888 1.00 . A A . 9 CYS HB2 1 1 16 7209 1 1 9 CYS HB3 H -2.753 -0.954 -1.071 1.00 . A A . 9 CYS HB3 1 1 16 7210 1 1 9 CYS N N -2.761 -0.295 -4.390 1.00 . A A . 9 CYS N 1 1 16 7211 1 1 9 CYS O O -5.171 -1.274 -2.545 1.00 . A A . 9 CYS O 1 1 16 7212 1 1 9 CYS SG S -0.937 0.401 -1.827 1.00 . A A . 9 CYS SG 1 1 16 7213 1 1 10 ILE C C -5.947 -4.222 -2.428 1.00 . A A . 10 ILE C 1 1 16 7214 1 1 10 ILE CA C -5.585 -3.722 -3.823 1.00 . A A . 10 ILE CA 1 1 16 7215 1 1 10 ILE CB C -5.516 -4.931 -4.796 1.00 . A A . 10 ILE CB 1 1 16 7216 1 1 10 ILE CD1 C -3.048 -5.613 -4.490 1.00 . A A . 10 ILE CD1 1 1 16 7217 1 1 10 ILE CG1 C -4.507 -5.996 -4.322 1.00 . A A . 10 ILE CG1 1 1 16 7218 1 1 10 ILE CG2 C -5.176 -4.461 -6.204 1.00 . A A . 10 ILE CG2 1 1 16 7219 1 1 10 ILE H H -3.553 -3.313 -4.255 1.00 . A A . 10 ILE H 1 1 16 7220 1 1 10 ILE HA H -6.366 -3.057 -4.165 1.00 . A A . 10 ILE HA 1 1 16 7221 1 1 10 ILE HB H -6.500 -5.377 -4.832 1.00 . A A . 10 ILE HB 1 1 16 7222 1 1 10 ILE HD11 H -2.953 -4.537 -4.456 1.00 . A A . 10 ILE HD11 1 1 16 7223 1 1 10 ILE HD12 H -2.687 -5.976 -5.441 1.00 . A A . 10 ILE HD12 1 1 16 7224 1 1 10 ILE HD13 H -2.468 -6.051 -3.692 1.00 . A A . 10 ILE HD13 1 1 16 7225 1 1 10 ILE HG12 H -4.673 -6.191 -3.274 1.00 . A A . 10 ILE HG12 1 1 16 7226 1 1 10 ILE HG13 H -4.675 -6.907 -4.879 1.00 . A A . 10 ILE HG13 1 1 16 7227 1 1 10 ILE HG21 H -4.921 -5.312 -6.815 1.00 . A A . 10 ILE HG21 1 1 16 7228 1 1 10 ILE HG22 H -4.336 -3.782 -6.162 1.00 . A A . 10 ILE HG22 1 1 16 7229 1 1 10 ILE HG23 H -6.029 -3.953 -6.630 1.00 . A A . 10 ILE HG23 1 1 16 7230 1 1 10 ILE N N -4.340 -2.961 -3.787 1.00 . A A . 10 ILE N 1 1 16 7231 1 1 10 ILE O O -7.109 -4.494 -2.132 1.00 . A A . 10 ILE O 1 1 16 7232 1 1 11 VAL C C -5.913 -3.783 0.594 1.00 . A A . 11 VAL C 1 1 16 7233 1 1 11 VAL CA C -5.111 -4.797 -0.219 1.00 . A A . 11 VAL CA 1 1 16 7234 1 1 11 VAL CB C -3.750 -5.066 0.462 1.00 . A A . 11 VAL CB 1 1 16 7235 1 1 11 VAL CG1 C -3.006 -6.169 -0.273 1.00 . A A . 11 VAL CG1 1 1 16 7236 1 1 11 VAL CG2 C -2.900 -3.801 0.516 1.00 . A A . 11 VAL CG2 1 1 16 7237 1 1 11 VAL H H -4.035 -4.101 -1.888 1.00 . A A . 11 VAL H 1 1 16 7238 1 1 11 VAL HA H -5.660 -5.727 -0.252 1.00 . A A . 11 VAL HA 1 1 16 7239 1 1 11 VAL HB H -3.933 -5.397 1.474 1.00 . A A . 11 VAL HB 1 1 16 7240 1 1 11 VAL HG11 H -2.676 -6.915 0.436 1.00 . A A . 11 VAL HG11 1 1 16 7241 1 1 11 VAL HG12 H -2.149 -5.751 -0.780 1.00 . A A . 11 VAL HG12 1 1 16 7242 1 1 11 VAL HG13 H -3.664 -6.627 -0.996 1.00 . A A . 11 VAL HG13 1 1 16 7243 1 1 11 VAL HG21 H -2.110 -3.866 -0.217 1.00 . A A . 11 VAL HG21 1 1 16 7244 1 1 11 VAL HG22 H -2.470 -3.699 1.502 1.00 . A A . 11 VAL HG22 1 1 16 7245 1 1 11 VAL HG23 H -3.520 -2.942 0.303 1.00 . A A . 11 VAL HG23 1 1 16 7246 1 1 11 VAL N N -4.931 -4.338 -1.582 1.00 . A A . 11 VAL N 1 1 16 7247 1 1 11 VAL O O -5.706 -2.574 0.474 1.00 . A A . 11 VAL O 1 1 16 7248 1 1 12 PRO C C -6.912 -2.425 3.094 1.00 . A A . 12 PRO C 1 1 16 7249 1 1 12 PRO CA C -7.713 -3.402 2.234 1.00 . A A . 12 PRO CA 1 1 16 7250 1 1 12 PRO CB C -8.481 -4.389 3.113 1.00 . A A . 12 PRO CB 1 1 16 7251 1 1 12 PRO CD C -7.193 -5.690 1.583 1.00 . A A . 12 PRO CD 1 1 16 7252 1 1 12 PRO CG C -8.495 -5.655 2.331 1.00 . A A . 12 PRO CG 1 1 16 7253 1 1 12 PRO HA H -8.409 -2.845 1.623 1.00 . A A . 12 PRO HA 1 1 16 7254 1 1 12 PRO HB2 H -7.968 -4.511 4.057 1.00 . A A . 12 PRO HB2 1 1 16 7255 1 1 12 PRO HB3 H -9.482 -4.020 3.286 1.00 . A A . 12 PRO HB3 1 1 16 7256 1 1 12 PRO HD2 H -6.437 -6.197 2.165 1.00 . A A . 12 PRO HD2 1 1 16 7257 1 1 12 PRO HD3 H -7.319 -6.172 0.625 1.00 . A A . 12 PRO HD3 1 1 16 7258 1 1 12 PRO HG2 H -8.567 -6.500 3.001 1.00 . A A . 12 PRO HG2 1 1 16 7259 1 1 12 PRO HG3 H -9.325 -5.651 1.640 1.00 . A A . 12 PRO HG3 1 1 16 7260 1 1 12 PRO N N -6.860 -4.265 1.415 1.00 . A A . 12 PRO N 1 1 16 7261 1 1 12 PRO O O -6.081 -2.831 3.920 1.00 . A A . 12 PRO O 1 1 16 7262 1 1 13 ILE C C -6.657 -0.201 5.124 1.00 . A A . 13 ILE C 1 1 16 7263 1 1 13 ILE CA C -6.523 -0.045 3.605 1.00 . A A . 13 ILE CA 1 1 16 7264 1 1 13 ILE CB C -7.092 1.326 3.159 1.00 . A A . 13 ILE CB 1 1 16 7265 1 1 13 ILE CD1 C -6.720 3.850 3.283 1.00 . A A . 13 ILE CD1 1 1 16 7266 1 1 13 ILE CG1 C -6.282 2.481 3.761 1.00 . A A . 13 ILE CG1 1 1 16 7267 1 1 13 ILE CG2 C -8.564 1.446 3.536 1.00 . A A . 13 ILE CG2 1 1 16 7268 1 1 13 ILE H H -7.858 -0.907 2.212 1.00 . A A . 13 ILE H 1 1 16 7269 1 1 13 ILE HA H -5.474 -0.072 3.347 1.00 . A A . 13 ILE HA 1 1 16 7270 1 1 13 ILE HB H -7.025 1.378 2.082 1.00 . A A . 13 ILE HB 1 1 16 7271 1 1 13 ILE HD11 H -7.135 3.767 2.290 1.00 . A A . 13 ILE HD11 1 1 16 7272 1 1 13 ILE HD12 H -5.869 4.513 3.262 1.00 . A A . 13 ILE HD12 1 1 16 7273 1 1 13 ILE HD13 H -7.468 4.243 3.955 1.00 . A A . 13 ILE HD13 1 1 16 7274 1 1 13 ILE HG12 H -6.383 2.460 4.836 1.00 . A A . 13 ILE HG12 1 1 16 7275 1 1 13 ILE HG13 H -5.241 2.354 3.501 1.00 . A A . 13 ILE HG13 1 1 16 7276 1 1 13 ILE HG21 H -9.167 1.460 2.640 1.00 . A A . 13 ILE HG21 1 1 16 7277 1 1 13 ILE HG22 H -8.721 2.361 4.089 1.00 . A A . 13 ILE HG22 1 1 16 7278 1 1 13 ILE HG23 H -8.848 0.603 4.148 1.00 . A A . 13 ILE HG23 1 1 16 7279 1 1 13 ILE N N -7.186 -1.136 2.886 1.00 . A A . 13 ILE N 1 1 16 7280 1 1 13 ILE O O -5.911 0.408 5.887 1.00 . A A . 13 ILE O 1 1 16 7281 1 1 14 LEU C C -6.556 -1.781 7.642 1.00 . A A . 14 LEU C 1 1 16 7282 1 1 14 LEU CA C -7.838 -1.303 6.959 1.00 . A A . 14 LEU CA 1 1 16 7283 1 1 14 LEU CB C -8.941 -2.356 7.118 1.00 . A A . 14 LEU CB 1 1 16 7284 1 1 14 LEU CD1 C -9.935 -1.469 9.246 1.00 . A A . 14 LEU CD1 1 1 16 7285 1 1 14 LEU CD2 C -10.304 -3.855 8.593 1.00 . A A . 14 LEU CD2 1 1 16 7286 1 1 14 LEU CG C -9.332 -2.686 8.560 1.00 . A A . 14 LEU CG 1 1 16 7287 1 1 14 LEU H H -8.150 -1.498 4.881 1.00 . A A . 14 LEU H 1 1 16 7288 1 1 14 LEU HA H -8.159 -0.383 7.422 1.00 . A A . 14 LEU HA 1 1 16 7289 1 1 14 LEU HB2 H -9.821 -2.002 6.601 1.00 . A A . 14 LEU HB2 1 1 16 7290 1 1 14 LEU HB3 H -8.609 -3.267 6.642 1.00 . A A . 14 LEU HB3 1 1 16 7291 1 1 14 LEU HD11 H -10.810 -1.145 8.701 1.00 . A A . 14 LEU HD11 1 1 16 7292 1 1 14 LEU HD12 H -9.208 -0.671 9.267 1.00 . A A . 14 LEU HD12 1 1 16 7293 1 1 14 LEU HD13 H -10.216 -1.727 10.257 1.00 . A A . 14 LEU HD13 1 1 16 7294 1 1 14 LEU HD21 H -10.549 -4.147 7.583 1.00 . A A . 14 LEU HD21 1 1 16 7295 1 1 14 LEU HD22 H -11.204 -3.561 9.111 1.00 . A A . 14 LEU HD22 1 1 16 7296 1 1 14 LEU HD23 H -9.848 -4.688 9.108 1.00 . A A . 14 LEU HD23 1 1 16 7297 1 1 14 LEU HG H -8.446 -2.971 9.109 1.00 . A A . 14 LEU HG 1 1 16 7298 1 1 14 LEU N N -7.603 -1.038 5.545 1.00 . A A . 14 LEU N 1 1 16 7299 1 1 14 LEU O O -6.303 -1.452 8.799 1.00 . A A . 14 LEU O 1 1 16 7300 1 1 15 GLY C C -4.163 -4.438 7.038 1.00 . A A . 15 GLY C 1 1 16 7301 1 1 15 GLY CA C -4.504 -3.034 7.487 1.00 . A A . 15 GLY CA 1 1 16 7302 1 1 15 GLY H H -5.988 -2.775 5.992 1.00 . A A . 15 GLY H 1 1 16 7303 1 1 15 GLY HA2 H -3.704 -2.372 7.193 1.00 . A A . 15 GLY HA2 1 1 16 7304 1 1 15 GLY HA3 H -4.587 -3.024 8.564 1.00 . A A . 15 GLY HA3 1 1 16 7305 1 1 15 GLY N N -5.746 -2.549 6.918 1.00 . A A . 15 GLY N 1 1 16 7306 1 1 15 GLY O O -3.825 -5.294 7.854 1.00 . A A . 15 GLY O 1 1 16 7307 1 1 16 PHE C C -2.631 -5.961 4.427 1.00 . A A . 16 PHE C 1 1 16 7308 1 1 16 PHE CA C -3.940 -5.996 5.201 1.00 . A A . 16 PHE CA 1 1 16 7309 1 1 16 PHE CB C -5.071 -6.502 4.301 1.00 . A A . 16 PHE CB 1 1 16 7310 1 1 16 PHE CD1 C -6.956 -6.073 5.920 1.00 . A A . 16 PHE CD1 1 1 16 7311 1 1 16 PHE CD2 C -6.819 -8.212 4.873 1.00 . A A . 16 PHE CD2 1 1 16 7312 1 1 16 PHE CE1 C -8.088 -6.475 6.601 1.00 . A A . 16 PHE CE1 1 1 16 7313 1 1 16 PHE CE2 C -7.952 -8.619 5.553 1.00 . A A . 16 PHE CE2 1 1 16 7314 1 1 16 PHE CG C -6.308 -6.936 5.048 1.00 . A A . 16 PHE CG 1 1 16 7315 1 1 16 PHE CZ C -8.586 -7.750 6.417 1.00 . A A . 16 PHE CZ 1 1 16 7316 1 1 16 PHE H H -4.519 -3.963 5.130 1.00 . A A . 16 PHE H 1 1 16 7317 1 1 16 PHE HA H -3.828 -6.674 6.035 1.00 . A A . 16 PHE HA 1 1 16 7318 1 1 16 PHE HB2 H -5.359 -5.715 3.621 1.00 . A A . 16 PHE HB2 1 1 16 7319 1 1 16 PHE HB3 H -4.714 -7.347 3.731 1.00 . A A . 16 PHE HB3 1 1 16 7320 1 1 16 PHE HD1 H -6.568 -5.076 6.063 1.00 . A A . 16 PHE HD1 1 1 16 7321 1 1 16 PHE HD2 H -6.324 -8.893 4.197 1.00 . A A . 16 PHE HD2 1 1 16 7322 1 1 16 PHE HE1 H -8.583 -5.794 7.277 1.00 . A A . 16 PHE HE1 1 1 16 7323 1 1 16 PHE HE2 H -8.340 -9.617 5.407 1.00 . A A . 16 PHE HE2 1 1 16 7324 1 1 16 PHE HZ H -9.472 -8.066 6.950 1.00 . A A . 16 PHE HZ 1 1 16 7325 1 1 16 PHE N N -4.249 -4.682 5.740 1.00 . A A . 16 PHE N 1 1 16 7326 1 1 16 PHE O O -2.420 -5.077 3.596 1.00 . A A . 16 PHE O 1 1 16 7327 1 1 17 VAL C C 0.387 -5.788 4.365 1.00 . A A . 17 VAL C 1 1 16 7328 1 1 17 VAL CA C -0.452 -7.037 4.064 1.00 . A A . 17 VAL CA 1 1 16 7329 1 1 17 VAL CB C -0.588 -7.289 2.532 1.00 . A A . 17 VAL CB 1 1 16 7330 1 1 17 VAL CG1 C 0.685 -7.892 1.945 1.00 . A A . 17 VAL CG1 1 1 16 7331 1 1 17 VAL CG2 C -1.767 -8.211 2.243 1.00 . A A . 17 VAL CG2 1 1 16 7332 1 1 17 VAL H H -2.003 -7.591 5.392 1.00 . A A . 17 VAL H 1 1 16 7333 1 1 17 VAL HA H 0.060 -7.884 4.493 1.00 . A A . 17 VAL HA 1 1 16 7334 1 1 17 VAL HB H -0.771 -6.343 2.045 1.00 . A A . 17 VAL HB 1 1 16 7335 1 1 17 VAL HG11 H 1.386 -8.100 2.742 1.00 . A A . 17 VAL HG11 1 1 16 7336 1 1 17 VAL HG12 H 1.127 -7.197 1.248 1.00 . A A . 17 VAL HG12 1 1 16 7337 1 1 17 VAL HG13 H 0.443 -8.811 1.432 1.00 . A A . 17 VAL HG13 1 1 16 7338 1 1 17 VAL HG21 H -2.541 -7.657 1.732 1.00 . A A . 17 VAL HG21 1 1 16 7339 1 1 17 VAL HG22 H -2.156 -8.600 3.172 1.00 . A A . 17 VAL HG22 1 1 16 7340 1 1 17 VAL HG23 H -1.439 -9.030 1.619 1.00 . A A . 17 VAL HG23 1 1 16 7341 1 1 17 VAL N N -1.761 -6.929 4.713 1.00 . A A . 17 VAL N 1 1 16 7342 1 1 17 VAL O O 0.120 -5.076 5.334 1.00 . A A . 17 VAL O 1 1 16 7343 1 1 18 TYR C C 3.182 -4.193 2.551 1.00 . A A . 18 TYR C 1 1 16 7344 1 1 18 TYR CA C 2.302 -4.414 3.776 1.00 . A A . 18 TYR CA 1 1 16 7345 1 1 18 TYR CB C 3.187 -4.667 5.011 1.00 . A A . 18 TYR CB 1 1 16 7346 1 1 18 TYR CD1 C 3.544 -7.155 5.323 1.00 . A A . 18 TYR CD1 1 1 16 7347 1 1 18 TYR CD2 C 5.310 -5.883 4.353 1.00 . A A . 18 TYR CD2 1 1 16 7348 1 1 18 TYR CE1 C 4.300 -8.304 5.202 1.00 . A A . 18 TYR CE1 1 1 16 7349 1 1 18 TYR CE2 C 6.069 -7.029 4.223 1.00 . A A . 18 TYR CE2 1 1 16 7350 1 1 18 TYR CG C 4.034 -5.924 4.902 1.00 . A A . 18 TYR CG 1 1 16 7351 1 1 18 TYR CZ C 5.561 -8.237 4.650 1.00 . A A . 18 TYR CZ 1 1 16 7352 1 1 18 TYR H H 1.593 -6.164 2.836 1.00 . A A . 18 TYR H 1 1 16 7353 1 1 18 TYR HA H 1.699 -3.534 3.944 1.00 . A A . 18 TYR HA 1 1 16 7354 1 1 18 TYR HB2 H 3.853 -3.829 5.146 1.00 . A A . 18 TYR HB2 1 1 16 7355 1 1 18 TYR HB3 H 2.556 -4.765 5.882 1.00 . A A . 18 TYR HB3 1 1 16 7356 1 1 18 TYR HD1 H 2.554 -7.205 5.756 1.00 . A A . 18 TYR HD1 1 1 16 7357 1 1 18 TYR HD2 H 5.708 -4.935 4.020 1.00 . A A . 18 TYR HD2 1 1 16 7358 1 1 18 TYR HE1 H 3.901 -9.250 5.537 1.00 . A A . 18 TYR HE1 1 1 16 7359 1 1 18 TYR HE2 H 7.059 -6.975 3.792 1.00 . A A . 18 TYR HE2 1 1 16 7360 1 1 18 TYR HH H 6.871 -9.493 5.286 1.00 . A A . 18 TYR HH 1 1 16 7361 1 1 18 TYR N N 1.412 -5.547 3.568 1.00 . A A . 18 TYR N 1 1 16 7362 1 1 18 TYR O O 3.503 -5.139 1.835 1.00 . A A . 18 TYR O 1 1 16 7363 1 1 18 TYR OH O 6.311 -9.385 4.508 1.00 . A A . 18 TYR OH 1 1 16 7364 1 1 19 CYS C C 5.876 -3.080 1.480 1.00 . A A . 19 CYS C 1 1 16 7365 1 1 19 CYS CA C 4.455 -2.617 1.204 1.00 . A A . 19 CYS CA 1 1 16 7366 1 1 19 CYS CB C 4.456 -1.120 0.961 1.00 . A A . 19 CYS CB 1 1 16 7367 1 1 19 CYS H H 3.304 -2.237 2.939 1.00 . A A . 19 CYS H 1 1 16 7368 1 1 19 CYS HA H 4.082 -3.122 0.326 1.00 . A A . 19 CYS HA 1 1 16 7369 1 1 19 CYS HB2 H 4.259 -0.638 1.898 1.00 . A A . 19 CYS HB2 1 1 16 7370 1 1 19 CYS HB3 H 5.435 -0.813 0.602 1.00 . A A . 19 CYS HB3 1 1 16 7371 1 1 19 CYS N N 3.582 -2.950 2.325 1.00 . A A . 19 CYS N 1 1 16 7372 1 1 19 CYS O O 6.197 -3.502 2.590 1.00 . A A . 19 CYS O 1 1 16 7373 1 1 19 CYS SG S 3.204 -0.535 -0.223 1.00 . A A . 19 CYS SG 1 1 16 7374 1 1 20 CYS C C 8.815 -2.482 1.567 1.00 . A A . 20 CYS C 1 1 16 7375 1 1 20 CYS CA C 8.111 -3.422 0.607 1.00 . A A . 20 CYS CA 1 1 16 7376 1 1 20 CYS CB C 8.815 -3.417 -0.748 1.00 . A A . 20 CYS CB 1 1 16 7377 1 1 20 CYS H H 6.417 -2.662 -0.399 1.00 . A A . 20 CYS H 1 1 16 7378 1 1 20 CYS HA H 8.122 -4.423 1.015 1.00 . A A . 20 CYS HA 1 1 16 7379 1 1 20 CYS HB2 H 9.063 -2.399 -1.001 1.00 . A A . 20 CYS HB2 1 1 16 7380 1 1 20 CYS HB3 H 9.726 -3.990 -0.668 1.00 . A A . 20 CYS HB3 1 1 16 7381 1 1 20 CYS N N 6.726 -3.006 0.464 1.00 . A A . 20 CYS N 1 1 16 7382 1 1 20 CYS O O 8.418 -1.322 1.690 1.00 . A A . 20 CYS O 1 1 16 7383 1 1 20 CYS SG S 7.826 -4.120 -2.121 1.00 . A A . 20 CYS SG 1 1 16 7384 1 1 21 PRO C C 11.029 -0.817 2.623 1.00 . A A . 21 PRO C 1 1 16 7385 1 1 21 PRO CA C 10.571 -2.126 3.232 1.00 . A A . 21 PRO CA 1 1 16 7386 1 1 21 PRO CB C 11.761 -2.980 3.635 1.00 . A A . 21 PRO CB 1 1 16 7387 1 1 21 PRO CD C 10.387 -4.324 2.216 1.00 . A A . 21 PRO CD 1 1 16 7388 1 1 21 PRO CG C 11.308 -4.382 3.407 1.00 . A A . 21 PRO CG 1 1 16 7389 1 1 21 PRO HA H 9.966 -1.917 4.104 1.00 . A A . 21 PRO HA 1 1 16 7390 1 1 21 PRO HB2 H 12.615 -2.730 3.020 1.00 . A A . 21 PRO HB2 1 1 16 7391 1 1 21 PRO HB3 H 11.986 -2.796 4.672 1.00 . A A . 21 PRO HB3 1 1 16 7392 1 1 21 PRO HD2 H 10.941 -4.480 1.302 1.00 . A A . 21 PRO HD2 1 1 16 7393 1 1 21 PRO HD3 H 9.596 -5.051 2.308 1.00 . A A . 21 PRO HD3 1 1 16 7394 1 1 21 PRO HG2 H 12.158 -5.014 3.194 1.00 . A A . 21 PRO HG2 1 1 16 7395 1 1 21 PRO HG3 H 10.776 -4.743 4.274 1.00 . A A . 21 PRO HG3 1 1 16 7396 1 1 21 PRO N N 9.850 -2.955 2.277 1.00 . A A . 21 PRO N 1 1 16 7397 1 1 21 PRO O O 11.830 -0.784 1.690 1.00 . A A . 21 PRO O 1 1 16 7398 1 1 22 GLY C C 9.585 2.267 2.071 1.00 . A A . 22 GLY C 1 1 16 7399 1 1 22 GLY CA C 10.793 1.578 2.674 1.00 . A A . 22 GLY CA 1 1 16 7400 1 1 22 GLY H H 9.841 0.131 3.879 1.00 . A A . 22 GLY H 1 1 16 7401 1 1 22 GLY HA2 H 11.161 2.172 3.497 1.00 . A A . 22 GLY HA2 1 1 16 7402 1 1 22 GLY HA3 H 11.565 1.506 1.922 1.00 . A A . 22 GLY HA3 1 1 16 7403 1 1 22 GLY N N 10.482 0.252 3.156 1.00 . A A . 22 GLY N 1 1 16 7404 1 1 22 GLY O O 9.550 3.491 1.977 1.00 . A A . 22 GLY O 1 1 16 7405 1 1 23 LEU C C 6.171 1.695 1.906 1.00 . A A . 23 LEU C 1 1 16 7406 1 1 23 LEU CA C 7.390 2.019 1.047 1.00 . A A . 23 LEU CA 1 1 16 7407 1 1 23 LEU CB C 7.216 1.429 -0.354 1.00 . A A . 23 LEU CB 1 1 16 7408 1 1 23 LEU CD1 C 8.209 0.789 -2.564 1.00 . A A . 23 LEU CD1 1 1 16 7409 1 1 23 LEU CD2 C 8.676 3.047 -1.598 1.00 . A A . 23 LEU CD2 1 1 16 7410 1 1 23 LEU CG C 8.423 1.579 -1.283 1.00 . A A . 23 LEU CG 1 1 16 7411 1 1 23 LEU H H 8.676 0.502 1.748 1.00 . A A . 23 LEU H 1 1 16 7412 1 1 23 LEU HA H 7.499 3.090 0.972 1.00 . A A . 23 LEU HA 1 1 16 7413 1 1 23 LEU HB2 H 6.997 0.376 -0.253 1.00 . A A . 23 LEU HB2 1 1 16 7414 1 1 23 LEU HB3 H 6.370 1.911 -0.821 1.00 . A A . 23 LEU HB3 1 1 16 7415 1 1 23 LEU HD11 H 7.335 0.164 -2.460 1.00 . A A . 23 LEU HD11 1 1 16 7416 1 1 23 LEU HD12 H 9.075 0.171 -2.754 1.00 . A A . 23 LEU HD12 1 1 16 7417 1 1 23 LEU HD13 H 8.068 1.472 -3.389 1.00 . A A . 23 LEU HD13 1 1 16 7418 1 1 23 LEU HD21 H 9.728 3.197 -1.795 1.00 . A A . 23 LEU HD21 1 1 16 7419 1 1 23 LEU HD22 H 8.378 3.652 -0.755 1.00 . A A . 23 LEU HD22 1 1 16 7420 1 1 23 LEU HD23 H 8.103 3.333 -2.467 1.00 . A A . 23 LEU HD23 1 1 16 7421 1 1 23 LEU HG H 9.301 1.186 -0.790 1.00 . A A . 23 LEU HG 1 1 16 7422 1 1 23 LEU N N 8.596 1.479 1.653 1.00 . A A . 23 LEU N 1 1 16 7423 1 1 23 LEU O O 6.165 0.694 2.630 1.00 . A A . 23 LEU O 1 1 16 7424 1 1 24 ILE C C 2.679 2.716 1.788 1.00 . A A . 24 ILE C 1 1 16 7425 1 1 24 ILE CA C 3.919 2.329 2.599 1.00 . A A . 24 ILE CA 1 1 16 7426 1 1 24 ILE CB C 3.923 3.139 3.919 1.00 . A A . 24 ILE CB 1 1 16 7427 1 1 24 ILE CD1 C 4.259 5.478 4.888 1.00 . A A . 24 ILE CD1 1 1 16 7428 1 1 24 ILE CG1 C 4.322 4.597 3.657 1.00 . A A . 24 ILE CG1 1 1 16 7429 1 1 24 ILE CG2 C 4.851 2.498 4.943 1.00 . A A . 24 ILE CG2 1 1 16 7430 1 1 24 ILE H H 5.213 3.320 1.230 1.00 . A A . 24 ILE H 1 1 16 7431 1 1 24 ILE HA H 3.856 1.279 2.847 1.00 . A A . 24 ILE HA 1 1 16 7432 1 1 24 ILE HB H 2.922 3.119 4.323 1.00 . A A . 24 ILE HB 1 1 16 7433 1 1 24 ILE HD11 H 4.913 6.327 4.757 1.00 . A A . 24 ILE HD11 1 1 16 7434 1 1 24 ILE HD12 H 4.571 4.911 5.752 1.00 . A A . 24 ILE HD12 1 1 16 7435 1 1 24 ILE HD13 H 3.246 5.824 5.031 1.00 . A A . 24 ILE HD13 1 1 16 7436 1 1 24 ILE HG12 H 5.334 4.624 3.285 1.00 . A A . 24 ILE HG12 1 1 16 7437 1 1 24 ILE HG13 H 3.659 5.016 2.914 1.00 . A A . 24 ILE HG13 1 1 16 7438 1 1 24 ILE HG21 H 4.274 2.164 5.792 1.00 . A A . 24 ILE HG21 1 1 16 7439 1 1 24 ILE HG22 H 5.583 3.223 5.268 1.00 . A A . 24 ILE HG22 1 1 16 7440 1 1 24 ILE HG23 H 5.355 1.655 4.495 1.00 . A A . 24 ILE HG23 1 1 16 7441 1 1 24 ILE N N 5.145 2.533 1.828 1.00 . A A . 24 ILE N 1 1 16 7442 1 1 24 ILE O O 2.658 3.755 1.131 1.00 . A A . 24 ILE O 1 1 16 7443 1 1 25 CYS C C -0.312 3.369 1.693 1.00 . A A . 25 CYS C 1 1 16 7444 1 1 25 CYS CA C 0.404 2.152 1.111 1.00 . A A . 25 CYS CA 1 1 16 7445 1 1 25 CYS CB C -0.540 0.942 1.142 1.00 . A A . 25 CYS CB 1 1 16 7446 1 1 25 CYS H H 1.717 1.060 2.377 1.00 . A A . 25 CYS H 1 1 16 7447 1 1 25 CYS HA H 0.665 2.363 0.085 1.00 . A A . 25 CYS HA 1 1 16 7448 1 1 25 CYS HB2 H -0.485 0.481 2.116 1.00 . A A . 25 CYS HB2 1 1 16 7449 1 1 25 CYS HB3 H -1.551 1.282 0.970 1.00 . A A . 25 CYS HB3 1 1 16 7450 1 1 25 CYS N N 1.645 1.877 1.838 1.00 . A A . 25 CYS N 1 1 16 7451 1 1 25 CYS O O -0.418 3.514 2.910 1.00 . A A . 25 CYS O 1 1 16 7452 1 1 25 CYS SG S -0.168 -0.345 -0.097 1.00 . A A . 25 CYS SG 1 1 16 7453 1 1 26 GLY C C -2.760 5.672 0.434 1.00 . A A . 26 GLY C 1 1 16 7454 1 1 26 GLY CA C -1.496 5.427 1.241 1.00 . A A . 26 GLY CA 1 1 16 7455 1 1 26 GLY H H -0.676 4.060 -0.145 1.00 . A A . 26 GLY H 1 1 16 7456 1 1 26 GLY HA2 H -1.760 5.325 2.283 1.00 . A A . 26 GLY HA2 1 1 16 7457 1 1 26 GLY HA3 H -0.839 6.277 1.126 1.00 . A A . 26 GLY HA3 1 1 16 7458 1 1 26 GLY N N -0.798 4.233 0.815 1.00 . A A . 26 GLY N 1 1 16 7459 1 1 26 GLY O O -3.760 4.980 0.625 1.00 . A A . 26 GLY O 1 1 16 7460 1 1 27 PRO C C -4.198 5.965 -2.404 1.00 . A A . 27 PRO C 1 1 16 7461 1 1 27 PRO CA C -3.910 7.002 -1.317 1.00 . A A . 27 PRO CA 1 1 16 7462 1 1 27 PRO CB C -3.516 8.345 -1.936 1.00 . A A . 27 PRO CB 1 1 16 7463 1 1 27 PRO CD C -1.592 7.535 -0.761 1.00 . A A . 27 PRO CD 1 1 16 7464 1 1 27 PRO CG C -2.027 8.328 -1.965 1.00 . A A . 27 PRO CG 1 1 16 7465 1 1 27 PRO HA H -4.796 7.128 -0.714 1.00 . A A . 27 PRO HA 1 1 16 7466 1 1 27 PRO HB2 H -3.931 8.419 -2.931 1.00 . A A . 27 PRO HB2 1 1 16 7467 1 1 27 PRO HB3 H -3.889 9.151 -1.323 1.00 . A A . 27 PRO HB3 1 1 16 7468 1 1 27 PRO HD2 H -0.715 6.949 -0.994 1.00 . A A . 27 PRO HD2 1 1 16 7469 1 1 27 PRO HD3 H -1.395 8.193 0.072 1.00 . A A . 27 PRO HD3 1 1 16 7470 1 1 27 PRO HG2 H -1.684 7.851 -2.870 1.00 . A A . 27 PRO HG2 1 1 16 7471 1 1 27 PRO HG3 H -1.648 9.337 -1.904 1.00 . A A . 27 PRO HG3 1 1 16 7472 1 1 27 PRO N N -2.747 6.661 -0.478 1.00 . A A . 27 PRO N 1 1 16 7473 1 1 27 PRO O O -4.170 6.269 -3.595 1.00 . A A . 27 PRO O 1 1 16 7474 1 1 28 PHE C C -3.546 3.248 -3.704 1.00 . A A . 28 PHE C 1 1 16 7475 1 1 28 PHE CA C -4.762 3.607 -2.847 1.00 . A A . 28 PHE CA 1 1 16 7476 1 1 28 PHE CB C -6.012 3.870 -3.724 1.00 . A A . 28 PHE CB 1 1 16 7477 1 1 28 PHE CD1 C -7.505 4.678 -1.860 1.00 . A A . 28 PHE CD1 1 1 16 7478 1 1 28 PHE CD2 C -8.337 3.005 -3.340 1.00 . A A . 28 PHE CD2 1 1 16 7479 1 1 28 PHE CE1 C -8.698 4.659 -1.163 1.00 . A A . 28 PHE CE1 1 1 16 7480 1 1 28 PHE CE2 C -9.532 2.981 -2.647 1.00 . A A . 28 PHE CE2 1 1 16 7481 1 1 28 PHE CG C -7.310 3.851 -2.957 1.00 . A A . 28 PHE CG 1 1 16 7482 1 1 28 PHE CZ C -9.713 3.810 -1.557 1.00 . A A . 28 PHE CZ 1 1 16 7483 1 1 28 PHE H H -4.456 4.589 -0.994 1.00 . A A . 28 PHE H 1 1 16 7484 1 1 28 PHE HA H -4.972 2.762 -2.207 1.00 . A A . 28 PHE HA 1 1 16 7485 1 1 28 PHE HB2 H -5.928 4.839 -4.197 1.00 . A A . 28 PHE HB2 1 1 16 7486 1 1 28 PHE HB3 H -6.074 3.109 -4.491 1.00 . A A . 28 PHE HB3 1 1 16 7487 1 1 28 PHE HD1 H -6.713 5.344 -1.551 1.00 . A A . 28 PHE HD1 1 1 16 7488 1 1 28 PHE HD2 H -8.197 2.355 -4.192 1.00 . A A . 28 PHE HD2 1 1 16 7489 1 1 28 PHE HE1 H -8.837 5.307 -0.310 1.00 . A A . 28 PHE HE1 1 1 16 7490 1 1 28 PHE HE2 H -10.324 2.317 -2.958 1.00 . A A . 28 PHE HE2 1 1 16 7491 1 1 28 PHE HZ H -10.646 3.793 -1.013 1.00 . A A . 28 PHE HZ 1 1 16 7492 1 1 28 PHE N N -4.466 4.740 -1.965 1.00 . A A . 28 PHE N 1 1 16 7493 1 1 28 PHE O O -3.653 2.515 -4.682 1.00 . A A . 28 PHE O 1 1 16 7494 1 1 29 VAL C C -0.033 3.496 -2.896 1.00 . A A . 29 VAL C 1 1 16 7495 1 1 29 VAL CA C -1.117 3.454 -3.954 1.00 . A A . 29 VAL CA 1 1 16 7496 1 1 29 VAL CB C -0.764 4.472 -5.075 1.00 . A A . 29 VAL CB 1 1 16 7497 1 1 29 VAL CG1 C -1.706 4.337 -6.262 1.00 . A A . 29 VAL CG1 1 1 16 7498 1 1 29 VAL CG2 C -0.779 5.897 -4.541 1.00 . A A . 29 VAL CG2 1 1 16 7499 1 1 29 VAL H H -2.358 4.275 -2.462 1.00 . A A . 29 VAL H 1 1 16 7500 1 1 29 VAL HA H -1.169 2.458 -4.384 1.00 . A A . 29 VAL HA 1 1 16 7501 1 1 29 VAL HB H 0.242 4.255 -5.425 1.00 . A A . 29 VAL HB 1 1 16 7502 1 1 29 VAL HG11 H -2.626 3.872 -5.940 1.00 . A A . 29 VAL HG11 1 1 16 7503 1 1 29 VAL HG12 H -1.242 3.727 -7.023 1.00 . A A . 29 VAL HG12 1 1 16 7504 1 1 29 VAL HG13 H -1.919 5.316 -6.665 1.00 . A A . 29 VAL HG13 1 1 16 7505 1 1 29 VAL HG21 H -0.943 6.585 -5.357 1.00 . A A . 29 VAL HG21 1 1 16 7506 1 1 29 VAL HG22 H 0.168 6.116 -4.070 1.00 . A A . 29 VAL HG22 1 1 16 7507 1 1 29 VAL HG23 H -1.573 6.001 -3.817 1.00 . A A . 29 VAL HG23 1 1 16 7508 1 1 29 VAL N N -2.381 3.730 -3.285 1.00 . A A . 29 VAL N 1 1 16 7509 1 1 29 VAL O O -0.247 4.065 -1.827 1.00 . A A . 29 VAL O 1 1 16 7510 1 1 30 CYS C C 3.055 4.146 -2.402 1.00 . A A . 30 CYS C 1 1 16 7511 1 1 30 CYS CA C 2.190 2.900 -2.209 1.00 . A A . 30 CYS CA 1 1 16 7512 1 1 30 CYS CB C 3.021 1.626 -2.375 1.00 . A A . 30 CYS CB 1 1 16 7513 1 1 30 CYS H H 1.230 2.466 -4.040 1.00 . A A . 30 CYS H 1 1 16 7514 1 1 30 CYS HA H 1.761 2.919 -1.218 1.00 . A A . 30 CYS HA 1 1 16 7515 1 1 30 CYS HB2 H 2.366 0.797 -2.600 1.00 . A A . 30 CYS HB2 1 1 16 7516 1 1 30 CYS HB3 H 3.702 1.765 -3.203 1.00 . A A . 30 CYS HB3 1 1 16 7517 1 1 30 CYS N N 1.104 2.908 -3.170 1.00 . A A . 30 CYS N 1 1 16 7518 1 1 30 CYS O O 3.143 4.689 -3.505 1.00 . A A . 30 CYS O 1 1 16 7519 1 1 30 CYS SG S 4.015 1.190 -0.917 1.00 . A A . 30 CYS SG 1 1 16 7520 1 1 31 VAL C C 5.792 5.585 -0.611 1.00 . A A . 31 VAL C 1 1 16 7521 1 1 31 VAL CA C 4.526 5.793 -1.424 1.00 . A A . 31 VAL CA 1 1 16 7522 1 1 31 VAL CB C 3.807 7.072 -0.929 1.00 . A A . 31 VAL CB 1 1 16 7523 1 1 31 VAL CG1 C 2.659 7.449 -1.854 1.00 . A A . 31 VAL CG1 1 1 16 7524 1 1 31 VAL CG2 C 3.305 6.897 0.498 1.00 . A A . 31 VAL CG2 1 1 16 7525 1 1 31 VAL H H 3.580 4.159 -0.473 1.00 . A A . 31 VAL H 1 1 16 7526 1 1 31 VAL HA H 4.797 5.931 -2.467 1.00 . A A . 31 VAL HA 1 1 16 7527 1 1 31 VAL HB H 4.521 7.884 -0.935 1.00 . A A . 31 VAL HB 1 1 16 7528 1 1 31 VAL HG11 H 2.846 8.424 -2.281 1.00 . A A . 31 VAL HG11 1 1 16 7529 1 1 31 VAL HG12 H 1.736 7.473 -1.293 1.00 . A A . 31 VAL HG12 1 1 16 7530 1 1 31 VAL HG13 H 2.581 6.719 -2.646 1.00 . A A . 31 VAL HG13 1 1 16 7531 1 1 31 VAL HG21 H 2.673 6.023 0.553 1.00 . A A . 31 VAL HG21 1 1 16 7532 1 1 31 VAL HG22 H 2.740 7.769 0.792 1.00 . A A . 31 VAL HG22 1 1 16 7533 1 1 31 VAL HG23 H 4.148 6.772 1.163 1.00 . A A . 31 VAL HG23 1 1 16 7534 1 1 31 VAL N N 3.682 4.614 -1.340 1.00 . A A . 31 VAL N 1 1 16 7535 1 1 31 VAL O O 5.808 4.660 0.221 1.00 . A A . 31 VAL O 1 1 16 7536 1 1 31 VAL OXT O 6.767 6.338 -0.834 1.00 . A A . 31 VAL OXT 1 1 17 7537 1 1 1 ALA C C 4.282 -8.674 -0.522 1.00 . A A . 1 ALA C 1 1 17 7538 1 1 1 ALA CA C 4.411 -10.183 -0.644 1.00 . A A . 1 ALA CA 1 1 17 7539 1 1 1 ALA CB C 3.823 -10.662 -1.963 1.00 . A A . 1 ALA CB 1 1 17 7540 1 1 1 ALA H1 H 4.243 -10.639 1.385 1.00 . A A . 1 ALA H1 1 1 17 7541 1 1 1 ALA H2 H 3.700 -11.869 0.352 1.00 . A A . 1 ALA H2 1 1 17 7542 1 1 1 ALA H3 H 2.760 -10.482 0.582 1.00 . A A . 1 ALA H3 1 1 17 7543 1 1 1 ALA HA H 5.459 -10.450 -0.621 1.00 . A A . 1 ALA HA 1 1 17 7544 1 1 1 ALA HB1 H 3.151 -11.487 -1.779 1.00 . A A . 1 ALA HB1 1 1 17 7545 1 1 1 ALA HB2 H 4.620 -10.987 -2.616 1.00 . A A . 1 ALA HB2 1 1 17 7546 1 1 1 ALA HB3 H 3.281 -9.854 -2.431 1.00 . A A . 1 ALA HB3 1 1 17 7547 1 1 1 ALA N N 3.731 -10.842 0.496 1.00 . A A . 1 ALA N 1 1 17 7548 1 1 1 ALA O O 3.239 -8.176 -0.103 1.00 . A A . 1 ALA O 1 1 17 7549 1 1 2 CYS C C 4.906 -5.897 -2.125 1.00 . A A . 2 CYS C 1 1 17 7550 1 1 2 CYS CA C 5.345 -6.505 -0.796 1.00 . A A . 2 CYS CA 1 1 17 7551 1 1 2 CYS CB C 6.728 -6.006 -0.386 1.00 . A A . 2 CYS CB 1 1 17 7552 1 1 2 CYS H H 6.145 -8.415 -1.196 1.00 . A A . 2 CYS H 1 1 17 7553 1 1 2 CYS HA H 4.634 -6.202 -0.034 1.00 . A A . 2 CYS HA 1 1 17 7554 1 1 2 CYS HB2 H 6.659 -4.958 -0.141 1.00 . A A . 2 CYS HB2 1 1 17 7555 1 1 2 CYS HB3 H 7.048 -6.548 0.492 1.00 . A A . 2 CYS HB3 1 1 17 7556 1 1 2 CYS N N 5.341 -7.958 -0.873 1.00 . A A . 2 CYS N 1 1 17 7557 1 1 2 CYS O O 5.288 -6.374 -3.193 1.00 . A A . 2 CYS O 1 1 17 7558 1 1 2 CYS SG S 8.036 -6.176 -1.642 1.00 . A A . 2 CYS SG 1 1 17 7559 1 1 3 SER C C 4.465 -3.100 -3.727 1.00 . A A . 3 SER C 1 1 17 7560 1 1 3 SER CA C 3.546 -4.216 -3.234 1.00 . A A . 3 SER CA 1 1 17 7561 1 1 3 SER CB C 2.159 -3.657 -2.935 1.00 . A A . 3 SER CB 1 1 17 7562 1 1 3 SER H H 3.778 -4.564 -1.164 1.00 . A A . 3 SER H 1 1 17 7563 1 1 3 SER HA H 3.461 -4.960 -4.011 1.00 . A A . 3 SER HA 1 1 17 7564 1 1 3 SER HB2 H 2.239 -2.857 -2.216 1.00 . A A . 3 SER HB2 1 1 17 7565 1 1 3 SER HB3 H 1.717 -3.283 -3.847 1.00 . A A . 3 SER HB3 1 1 17 7566 1 1 3 SER HG H 0.937 -4.358 -1.569 1.00 . A A . 3 SER HG 1 1 17 7567 1 1 3 SER N N 4.072 -4.873 -2.047 1.00 . A A . 3 SER N 1 1 17 7568 1 1 3 SER O O 5.145 -2.435 -2.937 1.00 . A A . 3 SER O 1 1 17 7569 1 1 3 SER OG O 1.322 -4.668 -2.402 1.00 . A A . 3 SER OG 1 1 17 7570 1 1 4 LYS C C 4.707 -0.489 -5.307 1.00 . A A . 4 LYS C 1 1 17 7571 1 1 4 LYS CA C 5.266 -1.864 -5.682 1.00 . A A . 4 LYS CA 1 1 17 7572 1 1 4 LYS CB C 5.246 -2.081 -7.201 1.00 . A A . 4 LYS CB 1 1 17 7573 1 1 4 LYS CD C 5.934 -0.024 -8.518 1.00 . A A . 4 LYS CD 1 1 17 7574 1 1 4 LYS CE C 4.650 -0.105 -9.340 1.00 . A A . 4 LYS CE 1 1 17 7575 1 1 4 LYS CG C 6.359 -1.385 -7.977 1.00 . A A . 4 LYS CG 1 1 17 7576 1 1 4 LYS H H 3.889 -3.462 -5.601 1.00 . A A . 4 LYS H 1 1 17 7577 1 1 4 LYS HA H 6.280 -1.948 -5.320 1.00 . A A . 4 LYS HA 1 1 17 7578 1 1 4 LYS HB2 H 5.320 -3.141 -7.397 1.00 . A A . 4 LYS HB2 1 1 17 7579 1 1 4 LYS HB3 H 4.299 -1.727 -7.584 1.00 . A A . 4 LYS HB3 1 1 17 7580 1 1 4 LYS HD2 H 5.772 0.646 -7.688 1.00 . A A . 4 LYS HD2 1 1 17 7581 1 1 4 LYS HD3 H 6.725 0.363 -9.144 1.00 . A A . 4 LYS HD3 1 1 17 7582 1 1 4 LYS HE2 H 3.829 -0.322 -8.675 1.00 . A A . 4 LYS HE2 1 1 17 7583 1 1 4 LYS HE3 H 4.483 0.855 -9.809 1.00 . A A . 4 LYS HE3 1 1 17 7584 1 1 4 LYS HG2 H 7.205 -1.245 -7.320 1.00 . A A . 4 LYS HG2 1 1 17 7585 1 1 4 LYS HG3 H 6.650 -2.015 -8.805 1.00 . A A . 4 LYS HG3 1 1 17 7586 1 1 4 LYS HZ1 H 4.205 -2.022 -10.060 1.00 . A A . 4 LYS HZ1 1 1 17 7587 1 1 4 LYS HZ2 H 5.679 -1.398 -10.628 1.00 . A A . 4 LYS HZ2 1 1 17 7588 1 1 4 LYS HZ3 H 4.219 -0.821 -11.255 1.00 . A A . 4 LYS HZ3 1 1 17 7589 1 1 4 LYS N N 4.465 -2.899 -5.042 1.00 . A A . 4 LYS N 1 1 17 7590 1 1 4 LYS NZ N 4.699 -1.156 -10.397 1.00 . A A . 4 LYS NZ 1 1 17 7591 1 1 4 LYS O O 3.504 -0.339 -5.110 1.00 . A A . 4 LYS O 1 1 17 7592 1 1 5 LYS C C 3.986 2.373 -5.579 1.00 . A A . 5 LYS C 1 1 17 7593 1 1 5 LYS CA C 5.162 1.840 -4.767 1.00 . A A . 5 LYS CA 1 1 17 7594 1 1 5 LYS CB C 6.337 2.824 -4.840 1.00 . A A . 5 LYS CB 1 1 17 7595 1 1 5 LYS CD C 7.061 5.152 -4.177 1.00 . A A . 5 LYS CD 1 1 17 7596 1 1 5 LYS CE C 6.662 6.620 -4.170 1.00 . A A . 5 LYS CE 1 1 17 7597 1 1 5 LYS CG C 5.921 4.280 -4.665 1.00 . A A . 5 LYS CG 1 1 17 7598 1 1 5 LYS H H 6.534 0.316 -5.305 1.00 . A A . 5 LYS H 1 1 17 7599 1 1 5 LYS HA H 4.842 1.773 -3.745 1.00 . A A . 5 LYS HA 1 1 17 7600 1 1 5 LYS HB2 H 7.046 2.579 -4.064 1.00 . A A . 5 LYS HB2 1 1 17 7601 1 1 5 LYS HB3 H 6.819 2.724 -5.801 1.00 . A A . 5 LYS HB3 1 1 17 7602 1 1 5 LYS HD2 H 7.326 4.856 -3.172 1.00 . A A . 5 LYS HD2 1 1 17 7603 1 1 5 LYS HD3 H 7.910 5.021 -4.832 1.00 . A A . 5 LYS HD3 1 1 17 7604 1 1 5 LYS HE2 H 6.837 7.029 -5.155 1.00 . A A . 5 LYS HE2 1 1 17 7605 1 1 5 LYS HE3 H 5.609 6.697 -3.938 1.00 . A A . 5 LYS HE3 1 1 17 7606 1 1 5 LYS HG2 H 5.575 4.664 -5.609 1.00 . A A . 5 LYS HG2 1 1 17 7607 1 1 5 LYS HG3 H 5.116 4.325 -3.955 1.00 . A A . 5 LYS HG3 1 1 17 7608 1 1 5 LYS HZ1 H 7.196 8.409 -3.235 1.00 . A A . 5 LYS HZ1 1 1 17 7609 1 1 5 LYS HZ2 H 8.460 7.296 -3.350 1.00 . A A . 5 LYS HZ2 1 1 17 7610 1 1 5 LYS HZ3 H 7.231 7.062 -2.205 1.00 . A A . 5 LYS HZ3 1 1 17 7611 1 1 5 LYS N N 5.582 0.498 -5.168 1.00 . A A . 5 LYS N 1 1 17 7612 1 1 5 LYS NZ N 7.444 7.404 -3.176 1.00 . A A . 5 LYS NZ 1 1 17 7613 1 1 5 LYS O O 2.890 2.534 -5.068 1.00 . A A . 5 LYS O 1 1 17 7614 1 1 6 TRP C C 2.220 2.073 -8.149 1.00 . A A . 6 TRP C 1 1 17 7615 1 1 6 TRP CA C 3.135 3.182 -7.655 1.00 . A A . 6 TRP CA 1 1 17 7616 1 1 6 TRP CB C 3.723 3.975 -8.823 1.00 . A A . 6 TRP CB 1 1 17 7617 1 1 6 TRP CD1 C 6.183 4.489 -8.295 1.00 . A A . 6 TRP CD1 1 1 17 7618 1 1 6 TRP CD2 C 4.825 6.255 -8.098 1.00 . A A . 6 TRP CD2 1 1 17 7619 1 1 6 TRP CE2 C 6.141 6.664 -7.807 1.00 . A A . 6 TRP CE2 1 1 17 7620 1 1 6 TRP CE3 C 3.799 7.200 -8.031 1.00 . A A . 6 TRP CE3 1 1 17 7621 1 1 6 TRP CG C 4.876 4.860 -8.431 1.00 . A A . 6 TRP CG 1 1 17 7622 1 1 6 TRP CH2 C 5.427 8.878 -7.397 1.00 . A A . 6 TRP CH2 1 1 17 7623 1 1 6 TRP CZ2 C 6.453 7.976 -7.456 1.00 . A A . 6 TRP CZ2 1 1 17 7624 1 1 6 TRP CZ3 C 4.109 8.500 -7.679 1.00 . A A . 6 TRP CZ3 1 1 17 7625 1 1 6 TRP H H 5.072 2.504 -7.207 1.00 . A A . 6 TRP H 1 1 17 7626 1 1 6 TRP HA H 2.547 3.854 -7.036 1.00 . A A . 6 TRP HA 1 1 17 7627 1 1 6 TRP HB2 H 4.073 3.285 -9.576 1.00 . A A . 6 TRP HB2 1 1 17 7628 1 1 6 TRP HB3 H 2.951 4.601 -9.247 1.00 . A A . 6 TRP HB3 1 1 17 7629 1 1 6 TRP HD1 H 6.548 3.488 -8.459 1.00 . A A . 6 TRP HD1 1 1 17 7630 1 1 6 TRP HE1 H 7.921 5.557 -7.798 1.00 . A A . 6 TRP HE1 1 1 17 7631 1 1 6 TRP HE3 H 2.779 6.926 -8.236 1.00 . A A . 6 TRP HE3 1 1 17 7632 1 1 6 TRP HH2 H 5.624 9.904 -7.126 1.00 . A A . 6 TRP HH2 1 1 17 7633 1 1 6 TRP HZ2 H 7.464 8.283 -7.236 1.00 . A A . 6 TRP HZ2 1 1 17 7634 1 1 6 TRP HZ3 H 3.327 9.242 -7.622 1.00 . A A . 6 TRP HZ3 1 1 17 7635 1 1 6 TRP N N 4.198 2.650 -6.831 1.00 . A A . 6 TRP N 1 1 17 7636 1 1 6 TRP NE1 N 6.950 5.569 -7.936 1.00 . A A . 6 TRP NE1 1 1 17 7637 1 1 6 TRP O O 1.676 2.153 -9.246 1.00 . A A . 6 TRP O 1 1 17 7638 1 1 7 GLU C C -0.257 0.243 -7.284 1.00 . A A . 7 GLU C 1 1 17 7639 1 1 7 GLU CA C 1.180 -0.070 -7.704 1.00 . A A . 7 GLU CA 1 1 17 7640 1 1 7 GLU CB C 1.650 -1.383 -7.070 1.00 . A A . 7 GLU CB 1 1 17 7641 1 1 7 GLU CD C 2.311 -2.514 -9.225 1.00 . A A . 7 GLU CD 1 1 17 7642 1 1 7 GLU CG C 1.471 -2.600 -7.967 1.00 . A A . 7 GLU CG 1 1 17 7643 1 1 7 GLU H H 2.524 1.030 -6.446 1.00 . A A . 7 GLU H 1 1 17 7644 1 1 7 GLU HA H 1.213 -0.167 -8.779 1.00 . A A . 7 GLU HA 1 1 17 7645 1 1 7 GLU HB2 H 2.699 -1.294 -6.826 1.00 . A A . 7 GLU HB2 1 1 17 7646 1 1 7 GLU HB3 H 1.093 -1.549 -6.160 1.00 . A A . 7 GLU HB3 1 1 17 7647 1 1 7 GLU HG2 H 1.760 -3.483 -7.418 1.00 . A A . 7 GLU HG2 1 1 17 7648 1 1 7 GLU HG3 H 0.431 -2.674 -8.250 1.00 . A A . 7 GLU HG3 1 1 17 7649 1 1 7 GLU N N 2.053 1.038 -7.331 1.00 . A A . 7 GLU N 1 1 17 7650 1 1 7 GLU O O -0.838 1.236 -7.717 1.00 . A A . 7 GLU O 1 1 17 7651 1 1 7 GLU OE1 O 2.005 -1.683 -10.097 1.00 . A A . 7 GLU OE1 1 1 17 7652 1 1 7 GLU OE2 O 3.325 -3.236 -9.325 1.00 . A A . 7 GLU OE2 1 1 17 7653 1 1 8 TYR C C -2.290 -1.014 -4.552 1.00 . A A . 8 TYR C 1 1 17 7654 1 1 8 TYR CA C -2.174 -0.408 -5.942 1.00 . A A . 8 TYR CA 1 1 17 7655 1 1 8 TYR CB C -3.176 -1.061 -6.902 1.00 . A A . 8 TYR CB 1 1 17 7656 1 1 8 TYR CD1 C -5.098 0.530 -6.490 1.00 . A A . 8 TYR CD1 1 1 17 7657 1 1 8 TYR CD2 C -5.530 -1.810 -6.374 1.00 . A A . 8 TYR CD2 1 1 17 7658 1 1 8 TYR CE1 C -6.423 0.794 -6.199 1.00 . A A . 8 TYR CE1 1 1 17 7659 1 1 8 TYR CE2 C -6.858 -1.554 -6.084 1.00 . A A . 8 TYR CE2 1 1 17 7660 1 1 8 TYR CG C -4.629 -0.775 -6.582 1.00 . A A . 8 TYR CG 1 1 17 7661 1 1 8 TYR CZ C -7.298 -0.252 -5.997 1.00 . A A . 8 TYR CZ 1 1 17 7662 1 1 8 TYR H H -0.304 -1.365 -6.107 1.00 . A A . 8 TYR H 1 1 17 7663 1 1 8 TYR HA H -2.367 0.654 -5.883 1.00 . A A . 8 TYR HA 1 1 17 7664 1 1 8 TYR HB2 H -2.985 -0.705 -7.902 1.00 . A A . 8 TYR HB2 1 1 17 7665 1 1 8 TYR HB3 H -3.037 -2.133 -6.877 1.00 . A A . 8 TYR HB3 1 1 17 7666 1 1 8 TYR HD1 H -4.411 1.347 -6.647 1.00 . A A . 8 TYR HD1 1 1 17 7667 1 1 8 TYR HD2 H -5.182 -2.830 -6.443 1.00 . A A . 8 TYR HD2 1 1 17 7668 1 1 8 TYR HE1 H -6.767 1.815 -6.133 1.00 . A A . 8 TYR HE1 1 1 17 7669 1 1 8 TYR HE2 H -7.543 -2.373 -5.926 1.00 . A A . 8 TYR HE2 1 1 17 7670 1 1 8 TYR HH H -8.797 -0.233 -4.794 1.00 . A A . 8 TYR HH 1 1 17 7671 1 1 8 TYR N N -0.818 -0.597 -6.429 1.00 . A A . 8 TYR N 1 1 17 7672 1 1 8 TYR O O -1.773 -2.100 -4.299 1.00 . A A . 8 TYR O 1 1 17 7673 1 1 8 TYR OH O -8.619 0.006 -5.707 1.00 . A A . 8 TYR OH 1 1 17 7674 1 1 9 CYS C C -4.571 -0.952 -1.921 1.00 . A A . 9 CYS C 1 1 17 7675 1 1 9 CYS CA C -3.102 -0.785 -2.285 1.00 . A A . 9 CYS CA 1 1 17 7676 1 1 9 CYS CB C -2.430 0.177 -1.306 1.00 . A A . 9 CYS CB 1 1 17 7677 1 1 9 CYS H H -3.327 0.562 -3.906 1.00 . A A . 9 CYS H 1 1 17 7678 1 1 9 CYS HA H -2.618 -1.746 -2.216 1.00 . A A . 9 CYS HA 1 1 17 7679 1 1 9 CYS HB2 H -2.786 1.178 -1.497 1.00 . A A . 9 CYS HB2 1 1 17 7680 1 1 9 CYS HB3 H -2.695 -0.106 -0.297 1.00 . A A . 9 CYS HB3 1 1 17 7681 1 1 9 CYS N N -2.945 -0.307 -3.650 1.00 . A A . 9 CYS N 1 1 17 7682 1 1 9 CYS O O -5.453 -0.717 -2.749 1.00 . A A . 9 CYS O 1 1 17 7683 1 1 9 CYS SG S -0.612 0.211 -1.412 1.00 . A A . 9 CYS SG 1 1 17 7684 1 1 10 ILE C C -6.797 -2.789 -0.863 1.00 . A A . 10 ILE C 1 1 17 7685 1 1 10 ILE CA C -6.166 -1.585 -0.159 1.00 . A A . 10 ILE CA 1 1 17 7686 1 1 10 ILE CB C -7.063 -0.324 -0.297 1.00 . A A . 10 ILE CB 1 1 17 7687 1 1 10 ILE CD1 C -7.102 2.199 0.106 1.00 . A A . 10 ILE CD1 1 1 17 7688 1 1 10 ILE CG1 C -6.321 0.910 0.235 1.00 . A A . 10 ILE CG1 1 1 17 7689 1 1 10 ILE CG2 C -8.373 -0.511 0.463 1.00 . A A . 10 ILE CG2 1 1 17 7690 1 1 10 ILE H H -4.055 -1.535 -0.082 1.00 . A A . 10 ILE H 1 1 17 7691 1 1 10 ILE HA H -6.075 -1.819 0.893 1.00 . A A . 10 ILE HA 1 1 17 7692 1 1 10 ILE HB H -7.292 -0.179 -1.342 1.00 . A A . 10 ILE HB 1 1 17 7693 1 1 10 ILE HD11 H -8.028 2.116 0.656 1.00 . A A . 10 ILE HD11 1 1 17 7694 1 1 10 ILE HD12 H -7.318 2.386 -0.937 1.00 . A A . 10 ILE HD12 1 1 17 7695 1 1 10 ILE HD13 H -6.518 3.015 0.504 1.00 . A A . 10 ILE HD13 1 1 17 7696 1 1 10 ILE HG12 H -6.100 0.762 1.281 1.00 . A A . 10 ILE HG12 1 1 17 7697 1 1 10 ILE HG13 H -5.395 1.026 -0.309 1.00 . A A . 10 ILE HG13 1 1 17 7698 1 1 10 ILE HG21 H -8.311 -0.006 1.416 1.00 . A A . 10 ILE HG21 1 1 17 7699 1 1 10 ILE HG22 H -8.549 -1.563 0.624 1.00 . A A . 10 ILE HG22 1 1 17 7700 1 1 10 ILE HG23 H -9.186 -0.094 -0.114 1.00 . A A . 10 ILE HG23 1 1 17 7701 1 1 10 ILE N N -4.815 -1.364 -0.674 1.00 . A A . 10 ILE N 1 1 17 7702 1 1 10 ILE O O -7.911 -2.734 -1.384 1.00 . A A . 10 ILE O 1 1 17 7703 1 1 11 VAL C C -6.212 -6.270 -0.514 1.00 . A A . 11 VAL C 1 1 17 7704 1 1 11 VAL CA C -6.467 -5.124 -1.496 1.00 . A A . 11 VAL CA 1 1 17 7705 1 1 11 VAL CB C -5.692 -5.374 -2.819 1.00 . A A . 11 VAL CB 1 1 17 7706 1 1 11 VAL CG1 C -6.279 -6.539 -3.604 1.00 . A A . 11 VAL CG1 1 1 17 7707 1 1 11 VAL CG2 C -5.670 -4.123 -3.682 1.00 . A A . 11 VAL CG2 1 1 17 7708 1 1 11 VAL H H -5.163 -3.852 -0.444 1.00 . A A . 11 VAL H 1 1 17 7709 1 1 11 VAL HA H -7.524 -5.059 -1.711 1.00 . A A . 11 VAL HA 1 1 17 7710 1 1 11 VAL HB H -4.671 -5.624 -2.567 1.00 . A A . 11 VAL HB 1 1 17 7711 1 1 11 VAL HG11 H -6.447 -7.373 -2.938 1.00 . A A . 11 VAL HG11 1 1 17 7712 1 1 11 VAL HG12 H -5.590 -6.831 -4.381 1.00 . A A . 11 VAL HG12 1 1 17 7713 1 1 11 VAL HG13 H -7.217 -6.237 -4.046 1.00 . A A . 11 VAL HG13 1 1 17 7714 1 1 11 VAL HG21 H -5.730 -3.249 -3.050 1.00 . A A . 11 VAL HG21 1 1 17 7715 1 1 11 VAL HG22 H -6.512 -4.137 -4.359 1.00 . A A . 11 VAL HG22 1 1 17 7716 1 1 11 VAL HG23 H -4.752 -4.093 -4.250 1.00 . A A . 11 VAL HG23 1 1 17 7717 1 1 11 VAL N N -6.043 -3.880 -0.873 1.00 . A A . 11 VAL N 1 1 17 7718 1 1 11 VAL O O -5.222 -6.240 0.219 1.00 . A A . 11 VAL O 1 1 17 7719 1 1 12 PRO C C -5.602 -9.059 0.458 1.00 . A A . 12 PRO C 1 1 17 7720 1 1 12 PRO CA C -6.994 -8.418 0.462 1.00 . A A . 12 PRO CA 1 1 17 7721 1 1 12 PRO CB C -8.043 -9.419 -0.053 1.00 . A A . 12 PRO CB 1 1 17 7722 1 1 12 PRO CD C -8.344 -7.364 -1.245 1.00 . A A . 12 PRO CD 1 1 17 7723 1 1 12 PRO CG C -8.565 -8.845 -1.331 1.00 . A A . 12 PRO CG 1 1 17 7724 1 1 12 PRO HA H -7.244 -8.132 1.473 1.00 . A A . 12 PRO HA 1 1 17 7725 1 1 12 PRO HB2 H -7.572 -10.378 -0.218 1.00 . A A . 12 PRO HB2 1 1 17 7726 1 1 12 PRO HB3 H -8.829 -9.523 0.679 1.00 . A A . 12 PRO HB3 1 1 17 7727 1 1 12 PRO HD2 H -8.206 -6.942 -2.230 1.00 . A A . 12 PRO HD2 1 1 17 7728 1 1 12 PRO HD3 H -9.168 -6.886 -0.736 1.00 . A A . 12 PRO HD3 1 1 17 7729 1 1 12 PRO HG2 H -8.021 -9.256 -2.167 1.00 . A A . 12 PRO HG2 1 1 17 7730 1 1 12 PRO HG3 H -9.619 -9.062 -1.426 1.00 . A A . 12 PRO HG3 1 1 17 7731 1 1 12 PRO N N -7.115 -7.274 -0.453 1.00 . A A . 12 PRO N 1 1 17 7732 1 1 12 PRO O O -4.863 -8.962 -0.518 1.00 . A A . 12 PRO O 1 1 17 7733 1 1 13 ILE C C -3.550 -11.252 0.587 1.00 . A A . 13 ILE C 1 1 17 7734 1 1 13 ILE CA C -3.971 -10.378 1.779 1.00 . A A . 13 ILE CA 1 1 17 7735 1 1 13 ILE CB C -4.008 -11.251 3.058 1.00 . A A . 13 ILE CB 1 1 17 7736 1 1 13 ILE CD1 C -3.780 -9.228 4.609 1.00 . A A . 13 ILE CD1 1 1 17 7737 1 1 13 ILE CG1 C -4.584 -10.459 4.240 1.00 . A A . 13 ILE CG1 1 1 17 7738 1 1 13 ILE CG2 C -2.618 -11.774 3.403 1.00 . A A . 13 ILE CG2 1 1 17 7739 1 1 13 ILE H H -5.917 -9.730 2.307 1.00 . A A . 13 ILE H 1 1 17 7740 1 1 13 ILE HA H -3.226 -9.609 1.923 1.00 . A A . 13 ILE HA 1 1 17 7741 1 1 13 ILE HB H -4.645 -12.102 2.864 1.00 . A A . 13 ILE HB 1 1 17 7742 1 1 13 ILE HD11 H -3.644 -9.194 5.679 1.00 . A A . 13 ILE HD11 1 1 17 7743 1 1 13 ILE HD12 H -4.309 -8.343 4.286 1.00 . A A . 13 ILE HD12 1 1 17 7744 1 1 13 ILE HD13 H -2.817 -9.268 4.123 1.00 . A A . 13 ILE HD13 1 1 17 7745 1 1 13 ILE HG12 H -5.584 -10.136 3.992 1.00 . A A . 13 ILE HG12 1 1 17 7746 1 1 13 ILE HG13 H -4.624 -11.100 5.107 1.00 . A A . 13 ILE HG13 1 1 17 7747 1 1 13 ILE HG21 H -2.005 -11.779 2.513 1.00 . A A . 13 ILE HG21 1 1 17 7748 1 1 13 ILE HG22 H -2.697 -12.779 3.790 1.00 . A A . 13 ILE HG22 1 1 17 7749 1 1 13 ILE HG23 H -2.167 -11.134 4.147 1.00 . A A . 13 ILE HG23 1 1 17 7750 1 1 13 ILE N N -5.268 -9.708 1.575 1.00 . A A . 13 ILE N 1 1 17 7751 1 1 13 ILE O O -2.363 -11.523 0.397 1.00 . A A . 13 ILE O 1 1 17 7752 1 1 14 LEU C C -3.293 -11.844 -2.354 1.00 . A A . 14 LEU C 1 1 17 7753 1 1 14 LEU CA C -4.263 -12.519 -1.376 1.00 . A A . 14 LEU CA 1 1 17 7754 1 1 14 LEU CB C -5.579 -12.837 -2.091 1.00 . A A . 14 LEU CB 1 1 17 7755 1 1 14 LEU CD1 C -7.915 -13.741 -2.023 1.00 . A A . 14 LEU CD1 1 1 17 7756 1 1 14 LEU CD2 C -6.099 -14.892 -0.746 1.00 . A A . 14 LEU CD2 1 1 17 7757 1 1 14 LEU CG C -6.629 -13.551 -1.236 1.00 . A A . 14 LEU CG 1 1 17 7758 1 1 14 LEU H H -5.442 -11.429 -0.002 1.00 . A A . 14 LEU H 1 1 17 7759 1 1 14 LEU HA H -3.822 -13.442 -1.031 1.00 . A A . 14 LEU HA 1 1 17 7760 1 1 14 LEU HB2 H -6.004 -11.909 -2.445 1.00 . A A . 14 LEU HB2 1 1 17 7761 1 1 14 LEU HB3 H -5.357 -13.461 -2.944 1.00 . A A . 14 LEU HB3 1 1 17 7762 1 1 14 LEU HD11 H -8.624 -12.975 -1.746 1.00 . A A . 14 LEU HD11 1 1 17 7763 1 1 14 LEU HD12 H -8.332 -14.713 -1.802 1.00 . A A . 14 LEU HD12 1 1 17 7764 1 1 14 LEU HD13 H -7.704 -13.672 -3.080 1.00 . A A . 14 LEU HD13 1 1 17 7765 1 1 14 LEU HD21 H -5.020 -14.864 -0.720 1.00 . A A . 14 LEU HD21 1 1 17 7766 1 1 14 LEU HD22 H -6.423 -15.673 -1.416 1.00 . A A . 14 LEU HD22 1 1 17 7767 1 1 14 LEU HD23 H -6.479 -15.088 0.246 1.00 . A A . 14 LEU HD23 1 1 17 7768 1 1 14 LEU HG H -6.854 -12.942 -0.371 1.00 . A A . 14 LEU HG 1 1 17 7769 1 1 14 LEU N N -4.522 -11.684 -0.206 1.00 . A A . 14 LEU N 1 1 17 7770 1 1 14 LEU O O -2.538 -12.521 -3.049 1.00 . A A . 14 LEU O 1 1 17 7771 1 1 15 GLY C C -2.519 -8.299 -3.116 1.00 . A A . 15 GLY C 1 1 17 7772 1 1 15 GLY CA C -2.442 -9.798 -3.311 1.00 . A A . 15 GLY CA 1 1 17 7773 1 1 15 GLY H H -3.944 -10.017 -1.834 1.00 . A A . 15 GLY H 1 1 17 7774 1 1 15 GLY HA2 H -1.425 -10.121 -3.140 1.00 . A A . 15 GLY HA2 1 1 17 7775 1 1 15 GLY HA3 H -2.717 -10.033 -4.328 1.00 . A A . 15 GLY HA3 1 1 17 7776 1 1 15 GLY N N -3.321 -10.517 -2.409 1.00 . A A . 15 GLY N 1 1 17 7777 1 1 15 GLY O O -3.551 -7.786 -2.698 1.00 . A A . 15 GLY O 1 1 17 7778 1 1 16 PHE C C -1.507 -5.734 -1.821 1.00 . A A . 16 PHE C 1 1 17 7779 1 1 16 PHE CA C -1.344 -6.146 -3.283 1.00 . A A . 16 PHE CA 1 1 17 7780 1 1 16 PHE CB C -2.386 -5.444 -4.167 1.00 . A A . 16 PHE CB 1 1 17 7781 1 1 16 PHE CD1 C -2.043 -6.806 -6.260 1.00 . A A . 16 PHE CD1 1 1 17 7782 1 1 16 PHE CD2 C -1.974 -4.431 -6.427 1.00 . A A . 16 PHE CD2 1 1 17 7783 1 1 16 PHE CE1 C -1.810 -6.912 -7.617 1.00 . A A . 16 PHE CE1 1 1 17 7784 1 1 16 PHE CE2 C -1.742 -4.530 -7.785 1.00 . A A . 16 PHE CE2 1 1 17 7785 1 1 16 PHE CG C -2.126 -5.565 -5.647 1.00 . A A . 16 PHE CG 1 1 17 7786 1 1 16 PHE CZ C -1.659 -5.773 -8.381 1.00 . A A . 16 PHE CZ 1 1 17 7787 1 1 16 PHE H H -0.637 -8.087 -3.747 1.00 . A A . 16 PHE H 1 1 17 7788 1 1 16 PHE HA H -0.356 -5.845 -3.609 1.00 . A A . 16 PHE HA 1 1 17 7789 1 1 16 PHE HB2 H -3.358 -5.869 -3.968 1.00 . A A . 16 PHE HB2 1 1 17 7790 1 1 16 PHE HB3 H -2.405 -4.392 -3.918 1.00 . A A . 16 PHE HB3 1 1 17 7791 1 1 16 PHE HD1 H -2.161 -7.700 -5.663 1.00 . A A . 16 PHE HD1 1 1 17 7792 1 1 16 PHE HD2 H -2.036 -3.457 -5.962 1.00 . A A . 16 PHE HD2 1 1 17 7793 1 1 16 PHE HE1 H -1.746 -7.887 -8.080 1.00 . A A . 16 PHE HE1 1 1 17 7794 1 1 16 PHE HE2 H -1.625 -3.636 -8.380 1.00 . A A . 16 PHE HE2 1 1 17 7795 1 1 16 PHE HZ H -1.478 -5.853 -9.443 1.00 . A A . 16 PHE HZ 1 1 17 7796 1 1 16 PHE N N -1.419 -7.605 -3.420 1.00 . A A . 16 PHE N 1 1 17 7797 1 1 16 PHE O O -2.290 -4.844 -1.483 1.00 . A A . 16 PHE O 1 1 17 7798 1 1 17 VAL C C 0.264 -5.098 0.848 1.00 . A A . 17 VAL C 1 1 17 7799 1 1 17 VAL CA C -0.774 -6.152 0.467 1.00 . A A . 17 VAL CA 1 1 17 7800 1 1 17 VAL CB C -0.504 -7.457 1.258 1.00 . A A . 17 VAL CB 1 1 17 7801 1 1 17 VAL CG1 C -1.216 -7.437 2.605 1.00 . A A . 17 VAL CG1 1 1 17 7802 1 1 17 VAL CG2 C -0.920 -8.678 0.451 1.00 . A A . 17 VAL CG2 1 1 17 7803 1 1 17 VAL H H -0.154 -7.095 -1.311 1.00 . A A . 17 VAL H 1 1 17 7804 1 1 17 VAL HA H -1.744 -5.789 0.744 1.00 . A A . 17 VAL HA 1 1 17 7805 1 1 17 VAL HB H 0.559 -7.525 1.443 1.00 . A A . 17 VAL HB 1 1 17 7806 1 1 17 VAL HG11 H -1.669 -6.469 2.758 1.00 . A A . 17 VAL HG11 1 1 17 7807 1 1 17 VAL HG12 H -0.502 -7.630 3.392 1.00 . A A . 17 VAL HG12 1 1 17 7808 1 1 17 VAL HG13 H -1.982 -8.199 2.619 1.00 . A A . 17 VAL HG13 1 1 17 7809 1 1 17 VAL HG21 H -1.665 -9.234 0.999 1.00 . A A . 17 VAL HG21 1 1 17 7810 1 1 17 VAL HG22 H -0.059 -9.305 0.276 1.00 . A A . 17 VAL HG22 1 1 17 7811 1 1 17 VAL HG23 H -1.332 -8.360 -0.495 1.00 . A A . 17 VAL HG23 1 1 17 7812 1 1 17 VAL N N -0.750 -6.405 -0.965 1.00 . A A . 17 VAL N 1 1 17 7813 1 1 17 VAL O O 0.489 -4.129 0.123 1.00 . A A . 17 VAL O 1 1 17 7814 1 1 18 TYR C C 3.022 -4.171 1.533 1.00 . A A . 18 TYR C 1 1 17 7815 1 1 18 TYR CA C 1.903 -4.430 2.542 1.00 . A A . 18 TYR CA 1 1 17 7816 1 1 18 TYR CB C 2.484 -5.048 3.824 1.00 . A A . 18 TYR CB 1 1 17 7817 1 1 18 TYR CD1 C 4.418 -6.565 3.205 1.00 . A A . 18 TYR CD1 1 1 17 7818 1 1 18 TYR CD2 C 2.351 -7.574 3.831 1.00 . A A . 18 TYR CD2 1 1 17 7819 1 1 18 TYR CE1 C 4.974 -7.814 3.010 1.00 . A A . 18 TYR CE1 1 1 17 7820 1 1 18 TYR CE2 C 2.899 -8.826 3.633 1.00 . A A . 18 TYR CE2 1 1 17 7821 1 1 18 TYR CG C 3.097 -6.421 3.617 1.00 . A A . 18 TYR CG 1 1 17 7822 1 1 18 TYR CZ C 4.210 -8.941 3.222 1.00 . A A . 18 TYR CZ 1 1 17 7823 1 1 18 TYR H H 0.618 -6.105 2.498 1.00 . A A . 18 TYR H 1 1 17 7824 1 1 18 TYR HA H 1.434 -3.490 2.790 1.00 . A A . 18 TYR HA 1 1 17 7825 1 1 18 TYR HB2 H 3.255 -4.398 4.210 1.00 . A A . 18 TYR HB2 1 1 17 7826 1 1 18 TYR HB3 H 1.697 -5.141 4.558 1.00 . A A . 18 TYR HB3 1 1 17 7827 1 1 18 TYR HD1 H 5.014 -5.681 3.039 1.00 . A A . 18 TYR HD1 1 1 17 7828 1 1 18 TYR HD2 H 1.324 -7.482 4.151 1.00 . A A . 18 TYR HD2 1 1 17 7829 1 1 18 TYR HE1 H 6.001 -7.904 2.688 1.00 . A A . 18 TYR HE1 1 1 17 7830 1 1 18 TYR HE2 H 2.302 -9.710 3.804 1.00 . A A . 18 TYR HE2 1 1 17 7831 1 1 18 TYR HH H 5.241 -10.461 3.805 1.00 . A A . 18 TYR HH 1 1 17 7832 1 1 18 TYR N N 0.877 -5.314 1.994 1.00 . A A . 18 TYR N 1 1 17 7833 1 1 18 TYR O O 3.404 -5.055 0.769 1.00 . A A . 18 TYR O 1 1 17 7834 1 1 18 TYR OH O 4.757 -10.191 3.014 1.00 . A A . 18 TYR OH 1 1 17 7835 1 1 19 CYS C C 5.952 -3.130 1.064 1.00 . A A . 19 CYS C 1 1 17 7836 1 1 19 CYS CA C 4.611 -2.559 0.635 1.00 . A A . 19 CYS CA 1 1 17 7837 1 1 19 CYS CB C 4.722 -1.051 0.627 1.00 . A A . 19 CYS CB 1 1 17 7838 1 1 19 CYS H H 3.183 -2.287 2.167 1.00 . A A . 19 CYS H 1 1 17 7839 1 1 19 CYS HA H 4.372 -2.905 -0.358 1.00 . A A . 19 CYS HA 1 1 17 7840 1 1 19 CYS HB2 H 4.826 -0.728 1.647 1.00 . A A . 19 CYS HB2 1 1 17 7841 1 1 19 CYS HB3 H 5.602 -0.750 0.069 1.00 . A A . 19 CYS HB3 1 1 17 7842 1 1 19 CYS N N 3.537 -2.953 1.538 1.00 . A A . 19 CYS N 1 1 17 7843 1 1 19 CYS O O 6.098 -3.649 2.172 1.00 . A A . 19 CYS O 1 1 17 7844 1 1 19 CYS SG S 3.275 -0.206 -0.072 1.00 . A A . 19 CYS SG 1 1 17 7845 1 1 20 CYS C C 8.897 -2.541 1.515 1.00 . A A . 20 CYS C 1 1 17 7846 1 1 20 CYS CA C 8.287 -3.461 0.477 1.00 . A A . 20 CYS CA 1 1 17 7847 1 1 20 CYS CB C 9.145 -3.458 -0.786 1.00 . A A . 20 CYS CB 1 1 17 7848 1 1 20 CYS H H 6.763 -2.555 -0.670 1.00 . A A . 20 CYS H 1 1 17 7849 1 1 20 CYS HA H 8.228 -4.465 0.875 1.00 . A A . 20 CYS HA 1 1 17 7850 1 1 20 CYS HB2 H 9.368 -2.437 -1.049 1.00 . A A . 20 CYS HB2 1 1 17 7851 1 1 20 CYS HB3 H 10.069 -3.978 -0.582 1.00 . A A . 20 CYS HB3 1 1 17 7852 1 1 20 CYS N N 6.940 -2.999 0.186 1.00 . A A . 20 CYS N 1 1 17 7853 1 1 20 CYS O O 8.492 -1.382 1.617 1.00 . A A . 20 CYS O 1 1 17 7854 1 1 20 CYS SG S 8.362 -4.256 -2.232 1.00 . A A . 20 CYS SG 1 1 17 7855 1 1 21 PRO C C 11.001 -0.896 2.782 1.00 . A A . 21 PRO C 1 1 17 7856 1 1 21 PRO CA C 10.494 -2.213 3.336 1.00 . A A . 21 PRO CA 1 1 17 7857 1 1 21 PRO CB C 11.646 -3.072 3.830 1.00 . A A . 21 PRO CB 1 1 17 7858 1 1 21 PRO CD C 10.405 -4.394 2.273 1.00 . A A . 21 PRO CD 1 1 17 7859 1 1 21 PRO CG C 11.224 -4.471 3.534 1.00 . A A . 21 PRO CG 1 1 17 7860 1 1 21 PRO HA H 9.814 -2.015 4.153 1.00 . A A . 21 PRO HA 1 1 17 7861 1 1 21 PRO HB2 H 12.551 -2.805 3.303 1.00 . A A . 21 PRO HB2 1 1 17 7862 1 1 21 PRO HB3 H 11.772 -2.906 4.887 1.00 . A A . 21 PRO HB3 1 1 17 7863 1 1 21 PRO HD2 H 11.031 -4.536 1.405 1.00 . A A . 21 PRO HD2 1 1 17 7864 1 1 21 PRO HD3 H 9.609 -5.122 2.287 1.00 . A A . 21 PRO HD3 1 1 17 7865 1 1 21 PRO HG2 H 12.093 -5.092 3.381 1.00 . A A . 21 PRO HG2 1 1 17 7866 1 1 21 PRO HG3 H 10.626 -4.854 4.347 1.00 . A A . 21 PRO HG3 1 1 17 7867 1 1 21 PRO N N 9.862 -3.027 2.308 1.00 . A A . 21 PRO N 1 1 17 7868 1 1 21 PRO O O 11.880 -0.854 1.922 1.00 . A A . 21 PRO O 1 1 17 7869 1 1 22 GLY C C 9.559 2.225 2.241 1.00 . A A . 22 GLY C 1 1 17 7870 1 1 22 GLY CA C 10.751 1.495 2.827 1.00 . A A . 22 GLY CA 1 1 17 7871 1 1 22 GLY H H 9.701 0.037 3.933 1.00 . A A . 22 GLY H 1 1 17 7872 1 1 22 GLY HA2 H 11.128 2.057 3.668 1.00 . A A . 22 GLY HA2 1 1 17 7873 1 1 22 GLY HA3 H 11.523 1.425 2.076 1.00 . A A . 22 GLY HA3 1 1 17 7874 1 1 22 GLY N N 10.405 0.165 3.271 1.00 . A A . 22 GLY N 1 1 17 7875 1 1 22 GLY O O 9.465 3.445 2.344 1.00 . A A . 22 GLY O 1 1 17 7876 1 1 23 LEU C C 6.247 1.797 1.903 1.00 . A A . 23 LEU C 1 1 17 7877 1 1 23 LEU CA C 7.463 2.054 1.019 1.00 . A A . 23 LEU CA 1 1 17 7878 1 1 23 LEU CB C 7.253 1.446 -0.368 1.00 . A A . 23 LEU CB 1 1 17 7879 1 1 23 LEU CD1 C 8.206 0.733 -2.572 1.00 . A A . 23 LEU CD1 1 1 17 7880 1 1 23 LEU CD2 C 8.762 2.988 -1.648 1.00 . A A . 23 LEU CD2 1 1 17 7881 1 1 23 LEU CG C 8.458 1.537 -1.307 1.00 . A A . 23 LEU CG 1 1 17 7882 1 1 23 LEU H H 8.771 0.501 1.576 1.00 . A A . 23 LEU H 1 1 17 7883 1 1 23 LEU HA H 7.616 3.119 0.925 1.00 . A A . 23 LEU HA 1 1 17 7884 1 1 23 LEU HB2 H 6.996 0.404 -0.245 1.00 . A A . 23 LEU HB2 1 1 17 7885 1 1 23 LEU HB3 H 6.422 1.951 -0.837 1.00 . A A . 23 LEU HB3 1 1 17 7886 1 1 23 LEU HD11 H 7.489 1.250 -3.192 1.00 . A A . 23 LEU HD11 1 1 17 7887 1 1 23 LEU HD12 H 7.820 -0.240 -2.310 1.00 . A A . 23 LEU HD12 1 1 17 7888 1 1 23 LEU HD13 H 9.133 0.619 -3.116 1.00 . A A . 23 LEU HD13 1 1 17 7889 1 1 23 LEU HD21 H 9.728 3.051 -2.126 1.00 . A A . 23 LEU HD21 1 1 17 7890 1 1 23 LEU HD22 H 8.768 3.577 -0.742 1.00 . A A . 23 LEU HD22 1 1 17 7891 1 1 23 LEU HD23 H 8.004 3.367 -2.318 1.00 . A A . 23 LEU HD23 1 1 17 7892 1 1 23 LEU HG H 9.323 1.120 -0.813 1.00 . A A . 23 LEU HG 1 1 17 7893 1 1 23 LEU N N 8.649 1.476 1.625 1.00 . A A . 23 LEU N 1 1 17 7894 1 1 23 LEU O O 6.196 0.788 2.614 1.00 . A A . 23 LEU O 1 1 17 7895 1 1 24 ILE C C 2.808 2.878 1.878 1.00 . A A . 24 ILE C 1 1 17 7896 1 1 24 ILE CA C 4.070 2.549 2.675 1.00 . A A . 24 ILE CA 1 1 17 7897 1 1 24 ILE CB C 4.110 3.441 3.940 1.00 . A A . 24 ILE CB 1 1 17 7898 1 1 24 ILE CD1 C 4.442 5.840 4.748 1.00 . A A . 24 ILE CD1 1 1 17 7899 1 1 24 ILE CG1 C 4.479 4.884 3.574 1.00 . A A . 24 ILE CG1 1 1 17 7900 1 1 24 ILE CG2 C 5.088 2.876 4.963 1.00 . A A . 24 ILE CG2 1 1 17 7901 1 1 24 ILE H H 5.372 3.490 1.280 1.00 . A A . 24 ILE H 1 1 17 7902 1 1 24 ILE HA H 4.016 1.519 2.996 1.00 . A A . 24 ILE HA 1 1 17 7903 1 1 24 ILE HB H 3.126 3.434 4.384 1.00 . A A . 24 ILE HB 1 1 17 7904 1 1 24 ILE HD11 H 3.616 6.525 4.628 1.00 . A A . 24 ILE HD11 1 1 17 7905 1 1 24 ILE HD12 H 5.368 6.395 4.788 1.00 . A A . 24 ILE HD12 1 1 17 7906 1 1 24 ILE HD13 H 4.317 5.281 5.663 1.00 . A A . 24 ILE HD13 1 1 17 7907 1 1 24 ILE HG12 H 5.479 4.900 3.166 1.00 . A A . 24 ILE HG12 1 1 17 7908 1 1 24 ILE HG13 H 3.786 5.246 2.829 1.00 . A A . 24 ILE HG13 1 1 17 7909 1 1 24 ILE HG21 H 4.540 2.351 5.731 1.00 . A A . 24 ILE HG21 1 1 17 7910 1 1 24 ILE HG22 H 5.648 3.684 5.410 1.00 . A A . 24 ILE HG22 1 1 17 7911 1 1 24 ILE HG23 H 5.767 2.194 4.474 1.00 . A A . 24 ILE HG23 1 1 17 7912 1 1 24 ILE N N 5.276 2.698 1.868 1.00 . A A . 24 ILE N 1 1 17 7913 1 1 24 ILE O O 2.746 3.886 1.176 1.00 . A A . 24 ILE O 1 1 17 7914 1 1 25 CYS C C -0.175 3.481 1.755 1.00 . A A . 25 CYS C 1 1 17 7915 1 1 25 CYS CA C 0.534 2.211 1.287 1.00 . A A . 25 CYS CA 1 1 17 7916 1 1 25 CYS CB C -0.387 1.008 1.497 1.00 . A A . 25 CYS CB 1 1 17 7917 1 1 25 CYS H H 1.916 1.222 2.559 1.00 . A A . 25 CYS H 1 1 17 7918 1 1 25 CYS HA H 0.753 2.303 0.234 1.00 . A A . 25 CYS HA 1 1 17 7919 1 1 25 CYS HB2 H -0.305 0.677 2.521 1.00 . A A . 25 CYS HB2 1 1 17 7920 1 1 25 CYS HB3 H -1.406 1.311 1.304 1.00 . A A . 25 CYS HB3 1 1 17 7921 1 1 25 CYS N N 1.802 2.014 1.991 1.00 . A A . 25 CYS N 1 1 17 7922 1 1 25 CYS O O -0.195 3.791 2.945 1.00 . A A . 25 CYS O 1 1 17 7923 1 1 25 CYS SG S -0.020 -0.418 0.427 1.00 . A A . 25 CYS SG 1 1 17 7924 1 1 26 GLY C C -2.744 5.590 0.326 1.00 . A A . 26 GLY C 1 1 17 7925 1 1 26 GLY CA C -1.454 5.433 1.120 1.00 . A A . 26 GLY CA 1 1 17 7926 1 1 26 GLY H H -0.697 3.907 -0.127 1.00 . A A . 26 GLY H 1 1 17 7927 1 1 26 GLY HA2 H -1.691 5.440 2.175 1.00 . A A . 26 GLY HA2 1 1 17 7928 1 1 26 GLY HA3 H -0.807 6.270 0.903 1.00 . A A . 26 GLY HA3 1 1 17 7929 1 1 26 GLY N N -0.753 4.207 0.806 1.00 . A A . 26 GLY N 1 1 17 7930 1 1 26 GLY O O -3.655 4.772 0.458 1.00 . A A . 26 GLY O 1 1 17 7931 1 1 27 PRO C C -4.293 5.924 -2.445 1.00 . A A . 27 PRO C 1 1 17 7932 1 1 27 PRO CA C -4.050 6.936 -1.318 1.00 . A A . 27 PRO CA 1 1 17 7933 1 1 27 PRO CB C -3.761 8.324 -1.899 1.00 . A A . 27 PRO CB 1 1 17 7934 1 1 27 PRO CD C -1.803 7.670 -0.697 1.00 . A A . 27 PRO CD 1 1 17 7935 1 1 27 PRO CG C -2.276 8.435 -1.901 1.00 . A A . 27 PRO CG 1 1 17 7936 1 1 27 PRO HA H -4.933 6.987 -0.701 1.00 . A A . 27 PRO HA 1 1 17 7937 1 1 27 PRO HB2 H -4.163 8.390 -2.899 1.00 . A A . 27 PRO HB2 1 1 17 7938 1 1 27 PRO HB3 H -4.210 9.080 -1.273 1.00 . A A . 27 PRO HB3 1 1 17 7939 1 1 27 PRO HD2 H -0.847 7.207 -0.896 1.00 . A A . 27 PRO HD2 1 1 17 7940 1 1 27 PRO HD3 H -1.736 8.321 0.161 1.00 . A A . 27 PRO HD3 1 1 17 7941 1 1 27 PRO HG2 H -1.876 7.997 -2.805 1.00 . A A . 27 PRO HG2 1 1 17 7942 1 1 27 PRO HG3 H -1.984 9.471 -1.825 1.00 . A A . 27 PRO HG3 1 1 17 7943 1 1 27 PRO N N -2.850 6.650 -0.502 1.00 . A A . 27 PRO N 1 1 17 7944 1 1 27 PRO O O -4.213 6.262 -3.624 1.00 . A A . 27 PRO O 1 1 17 7945 1 1 28 PHE C C -3.578 3.224 -3.771 1.00 . A A . 28 PHE C 1 1 17 7946 1 1 28 PHE CA C -4.838 3.579 -2.982 1.00 . A A . 28 PHE CA 1 1 17 7947 1 1 28 PHE CB C -6.024 3.873 -3.939 1.00 . A A . 28 PHE CB 1 1 17 7948 1 1 28 PHE CD1 C -7.651 4.957 -2.350 1.00 . A A . 28 PHE CD1 1 1 17 7949 1 1 28 PHE CD2 C -8.344 3.006 -3.534 1.00 . A A . 28 PHE CD2 1 1 17 7950 1 1 28 PHE CE1 C -8.885 5.025 -1.733 1.00 . A A . 28 PHE CE1 1 1 17 7951 1 1 28 PHE CE2 C -9.581 3.070 -2.921 1.00 . A A . 28 PHE CE2 1 1 17 7952 1 1 28 PHE CG C -7.364 3.946 -3.255 1.00 . A A . 28 PHE CG 1 1 17 7953 1 1 28 PHE CZ C -9.852 4.081 -2.019 1.00 . A A . 28 PHE CZ 1 1 17 7954 1 1 28 PHE H H -4.608 4.504 -1.089 1.00 . A A . 28 PHE H 1 1 17 7955 1 1 28 PHE HA H -5.098 2.721 -2.377 1.00 . A A . 28 PHE HA 1 1 17 7956 1 1 28 PHE HB2 H -5.867 4.818 -4.440 1.00 . A A . 28 PHE HB2 1 1 17 7957 1 1 28 PHE HB3 H -6.081 3.088 -4.682 1.00 . A A . 28 PHE HB3 1 1 17 7958 1 1 28 PHE HD1 H -6.897 5.696 -2.125 1.00 . A A . 28 PHE HD1 1 1 17 7959 1 1 28 PHE HD2 H -8.133 2.213 -4.237 1.00 . A A . 28 PHE HD2 1 1 17 7960 1 1 28 PHE HE1 H -9.094 5.816 -1.029 1.00 . A A . 28 PHE HE1 1 1 17 7961 1 1 28 PHE HE2 H -10.336 2.332 -3.147 1.00 . A A . 28 PHE HE2 1 1 17 7962 1 1 28 PHE HZ H -10.818 4.134 -1.539 1.00 . A A . 28 PHE HZ 1 1 17 7963 1 1 28 PHE N N -4.579 4.686 -2.053 1.00 . A A . 28 PHE N 1 1 17 7964 1 1 28 PHE O O -3.630 2.453 -4.722 1.00 . A A . 28 PHE O 1 1 17 7965 1 1 29 VAL C C -0.088 3.576 -2.884 1.00 . A A . 29 VAL C 1 1 17 7966 1 1 29 VAL CA C -1.151 3.484 -3.956 1.00 . A A . 29 VAL CA 1 1 17 7967 1 1 29 VAL CB C -0.790 4.473 -5.101 1.00 . A A . 29 VAL CB 1 1 17 7968 1 1 29 VAL CG1 C -1.718 4.304 -6.295 1.00 . A A . 29 VAL CG1 1 1 17 7969 1 1 29 VAL CG2 C -0.821 5.912 -4.603 1.00 . A A . 29 VAL CG2 1 1 17 7970 1 1 29 VAL H H -2.455 4.332 -2.530 1.00 . A A . 29 VAL H 1 1 17 7971 1 1 29 VAL HA H -1.172 2.477 -4.355 1.00 . A A . 29 VAL HA 1 1 17 7972 1 1 29 VAL HB H 0.222 4.255 -5.432 1.00 . A A . 29 VAL HB 1 1 17 7973 1 1 29 VAL HG11 H -1.474 5.039 -7.048 1.00 . A A . 29 VAL HG11 1 1 17 7974 1 1 29 VAL HG12 H -2.741 4.439 -5.978 1.00 . A A . 29 VAL HG12 1 1 17 7975 1 1 29 VAL HG13 H -1.596 3.313 -6.707 1.00 . A A . 29 VAL HG13 1 1 17 7976 1 1 29 VAL HG21 H -0.582 6.580 -5.416 1.00 . A A . 29 VAL HG21 1 1 17 7977 1 1 29 VAL HG22 H -0.096 6.035 -3.811 1.00 . A A . 29 VAL HG22 1 1 17 7978 1 1 29 VAL HG23 H -1.807 6.142 -4.225 1.00 . A A . 29 VAL HG23 1 1 17 7979 1 1 29 VAL N N -2.439 3.754 -3.331 1.00 . A A . 29 VAL N 1 1 17 7980 1 1 29 VAL O O -0.328 4.157 -1.829 1.00 . A A . 29 VAL O 1 1 17 7981 1 1 30 CYS C C 3.001 4.287 -2.404 1.00 . A A . 30 CYS C 1 1 17 7982 1 1 30 CYS CA C 2.148 3.042 -2.183 1.00 . A A . 30 CYS CA 1 1 17 7983 1 1 30 CYS CB C 3.001 1.786 -2.327 1.00 . A A . 30 CYS CB 1 1 17 7984 1 1 30 CYS H H 1.203 2.563 -4.005 1.00 . A A . 30 CYS H 1 1 17 7985 1 1 30 CYS HA H 1.722 3.074 -1.192 1.00 . A A . 30 CYS HA 1 1 17 7986 1 1 30 CYS HB2 H 2.361 0.931 -2.481 1.00 . A A . 30 CYS HB2 1 1 17 7987 1 1 30 CYS HB3 H 3.640 1.901 -3.192 1.00 . A A . 30 CYS HB3 1 1 17 7988 1 1 30 CYS N N 1.064 3.011 -3.142 1.00 . A A . 30 CYS N 1 1 17 7989 1 1 30 CYS O O 3.078 4.806 -3.520 1.00 . A A . 30 CYS O 1 1 17 7990 1 1 30 CYS SG S 4.069 1.459 -0.900 1.00 . A A . 30 CYS SG 1 1 17 7991 1 1 31 VAL C C 5.770 5.732 -0.671 1.00 . A A . 31 VAL C 1 1 17 7992 1 1 31 VAL CA C 4.486 5.942 -1.459 1.00 . A A . 31 VAL CA 1 1 17 7993 1 1 31 VAL CB C 3.781 7.226 -0.957 1.00 . A A . 31 VAL CB 1 1 17 7994 1 1 31 VAL CG1 C 2.614 7.598 -1.860 1.00 . A A . 31 VAL CG1 1 1 17 7995 1 1 31 VAL CG2 C 3.309 7.061 0.482 1.00 . A A . 31 VAL CG2 1 1 17 7996 1 1 31 VAL H H 3.553 4.319 -0.482 1.00 . A A . 31 VAL H 1 1 17 7997 1 1 31 VAL HA H 4.737 6.074 -2.507 1.00 . A A . 31 VAL HA 1 1 17 7998 1 1 31 VAL HB H 4.495 8.035 -0.984 1.00 . A A . 31 VAL HB 1 1 17 7999 1 1 31 VAL HG11 H 2.938 8.331 -2.584 1.00 . A A . 31 VAL HG11 1 1 17 8000 1 1 31 VAL HG12 H 1.813 8.009 -1.264 1.00 . A A . 31 VAL HG12 1 1 17 8001 1 1 31 VAL HG13 H 2.262 6.716 -2.374 1.00 . A A . 31 VAL HG13 1 1 17 8002 1 1 31 VAL HG21 H 2.233 6.965 0.500 1.00 . A A . 31 VAL HG21 1 1 17 8003 1 1 31 VAL HG22 H 3.602 7.925 1.059 1.00 . A A . 31 VAL HG22 1 1 17 8004 1 1 31 VAL HG23 H 3.756 6.175 0.908 1.00 . A A . 31 VAL HG23 1 1 17 8005 1 1 31 VAL N N 3.640 4.768 -1.355 1.00 . A A . 31 VAL N 1 1 17 8006 1 1 31 VAL O O 5.819 4.777 0.127 1.00 . A A . 31 VAL O 1 1 17 8007 1 1 31 VAL OXT O 6.726 6.511 -0.883 1.00 . A A . 31 VAL OXT 1 1 18 8008 1 1 1 ALA C C 4.863 -8.725 -0.201 1.00 . A A . 1 ALA C 1 1 18 8009 1 1 1 ALA CA C 5.000 -10.207 -0.504 1.00 . A A . 1 ALA CA 1 1 18 8010 1 1 1 ALA CB C 3.760 -10.719 -1.221 1.00 . A A . 1 ALA CB 1 1 18 8011 1 1 1 ALA H1 H 6.139 -11.440 0.731 1.00 . A A . 1 ALA H1 1 1 18 8012 1 1 1 ALA H2 H 4.472 -11.666 0.886 1.00 . A A . 1 ALA H2 1 1 18 8013 1 1 1 ALA H3 H 5.206 -10.303 1.570 1.00 . A A . 1 ALA H3 1 1 18 8014 1 1 1 ALA HA H 5.855 -10.357 -1.148 1.00 . A A . 1 ALA HA 1 1 18 8015 1 1 1 ALA HB1 H 3.865 -10.554 -2.283 1.00 . A A . 1 ALA HB1 1 1 18 8016 1 1 1 ALA HB2 H 2.891 -10.192 -0.858 1.00 . A A . 1 ALA HB2 1 1 18 8017 1 1 1 ALA HB3 H 3.646 -11.777 -1.030 1.00 . A A . 1 ALA HB3 1 1 18 8018 1 1 1 ALA N N 5.219 -10.959 0.756 1.00 . A A . 1 ALA N 1 1 18 8019 1 1 1 ALA O O 4.202 -8.352 0.761 1.00 . A A . 1 ALA O 1 1 18 8020 1 1 2 CYS C C 4.869 -5.743 -2.014 1.00 . A A . 2 CYS C 1 1 18 8021 1 1 2 CYS CA C 5.447 -6.451 -0.796 1.00 . A A . 2 CYS CA 1 1 18 8022 1 1 2 CYS CB C 6.842 -5.926 -0.463 1.00 . A A . 2 CYS CB 1 1 18 8023 1 1 2 CYS H H 6.021 -8.239 -1.757 1.00 . A A . 2 CYS H 1 1 18 8024 1 1 2 CYS HA H 4.797 -6.250 0.050 1.00 . A A . 2 CYS HA 1 1 18 8025 1 1 2 CYS HB2 H 6.758 -4.897 -0.150 1.00 . A A . 2 CYS HB2 1 1 18 8026 1 1 2 CYS HB3 H 7.247 -6.505 0.353 1.00 . A A . 2 CYS HB3 1 1 18 8027 1 1 2 CYS N N 5.498 -7.889 -1.005 1.00 . A A . 2 CYS N 1 1 18 8028 1 1 2 CYS O O 5.185 -6.082 -3.156 1.00 . A A . 2 CYS O 1 1 18 8029 1 1 2 CYS SG S 8.050 -5.976 -1.827 1.00 . A A . 2 CYS SG 1 1 18 8030 1 1 3 SER C C 4.315 -3.005 -3.417 1.00 . A A . 3 SER C 1 1 18 8031 1 1 3 SER CA C 3.352 -4.020 -2.810 1.00 . A A . 3 SER CA 1 1 18 8032 1 1 3 SER CB C 2.114 -3.307 -2.253 1.00 . A A . 3 SER CB 1 1 18 8033 1 1 3 SER H H 3.780 -4.579 -0.821 1.00 . A A . 3 SER H 1 1 18 8034 1 1 3 SER HA H 3.042 -4.713 -3.579 1.00 . A A . 3 SER HA 1 1 18 8035 1 1 3 SER HB2 H 1.451 -4.036 -1.812 1.00 . A A . 3 SER HB2 1 1 18 8036 1 1 3 SER HB3 H 2.421 -2.599 -1.498 1.00 . A A . 3 SER HB3 1 1 18 8037 1 1 3 SER HG H 1.909 -1.830 -3.530 1.00 . A A . 3 SER HG 1 1 18 8038 1 1 3 SER N N 4.000 -4.779 -1.756 1.00 . A A . 3 SER N 1 1 18 8039 1 1 3 SER O O 5.094 -2.369 -2.701 1.00 . A A . 3 SER O 1 1 18 8040 1 1 3 SER OG O 1.410 -2.613 -3.270 1.00 . A A . 3 SER OG 1 1 18 8041 1 1 4 LYS C C 4.653 -0.482 -5.076 1.00 . A A . 4 LYS C 1 1 18 8042 1 1 4 LYS CA C 5.078 -1.895 -5.451 1.00 . A A . 4 LYS CA 1 1 18 8043 1 1 4 LYS CB C 4.965 -2.080 -6.973 1.00 . A A . 4 LYS CB 1 1 18 8044 1 1 4 LYS CD C 4.697 -4.598 -7.096 1.00 . A A . 4 LYS CD 1 1 18 8045 1 1 4 LYS CE C 4.659 -5.661 -8.183 1.00 . A A . 4 LYS CE 1 1 18 8046 1 1 4 LYS CG C 5.527 -3.392 -7.517 1.00 . A A . 4 LYS CG 1 1 18 8047 1 1 4 LYS H H 3.584 -3.374 -5.236 1.00 . A A . 4 LYS H 1 1 18 8048 1 1 4 LYS HA H 6.102 -2.050 -5.145 1.00 . A A . 4 LYS HA 1 1 18 8049 1 1 4 LYS HB2 H 3.922 -2.029 -7.247 1.00 . A A . 4 LYS HB2 1 1 18 8050 1 1 4 LYS HB3 H 5.487 -1.266 -7.456 1.00 . A A . 4 LYS HB3 1 1 18 8051 1 1 4 LYS HD2 H 5.129 -5.026 -6.203 1.00 . A A . 4 LYS HD2 1 1 18 8052 1 1 4 LYS HD3 H 3.688 -4.272 -6.888 1.00 . A A . 4 LYS HD3 1 1 18 8053 1 1 4 LYS HE2 H 5.673 -5.889 -8.481 1.00 . A A . 4 LYS HE2 1 1 18 8054 1 1 4 LYS HE3 H 4.194 -6.550 -7.783 1.00 . A A . 4 LYS HE3 1 1 18 8055 1 1 4 LYS HG2 H 5.543 -3.343 -8.595 1.00 . A A . 4 LYS HG2 1 1 18 8056 1 1 4 LYS HG3 H 6.535 -3.516 -7.149 1.00 . A A . 4 LYS HG3 1 1 18 8057 1 1 4 LYS HZ1 H 3.290 -5.972 -9.732 1.00 . A A . 4 LYS HZ1 1 1 18 8058 1 1 4 LYS HZ2 H 4.540 -4.909 -10.131 1.00 . A A . 4 LYS HZ2 1 1 18 8059 1 1 4 LYS HZ3 H 3.280 -4.390 -9.121 1.00 . A A . 4 LYS HZ3 1 1 18 8060 1 1 4 LYS N N 4.239 -2.848 -4.735 1.00 . A A . 4 LYS N 1 1 18 8061 1 1 4 LYS NZ N 3.893 -5.206 -9.377 1.00 . A A . 4 LYS NZ 1 1 18 8062 1 1 4 LYS O O 3.491 -0.256 -4.737 1.00 . A A . 4 LYS O 1 1 18 8063 1 1 5 LYS C C 4.079 2.377 -5.535 1.00 . A A . 5 LYS C 1 1 18 8064 1 1 5 LYS CA C 5.258 1.832 -4.744 1.00 . A A . 5 LYS CA 1 1 18 8065 1 1 5 LYS CB C 6.464 2.764 -4.908 1.00 . A A . 5 LYS CB 1 1 18 8066 1 1 5 LYS CD C 7.253 5.099 -4.348 1.00 . A A . 5 LYS CD 1 1 18 8067 1 1 5 LYS CE C 6.844 6.562 -4.297 1.00 . A A . 5 LYS CE 1 1 18 8068 1 1 5 LYS CG C 6.087 4.234 -4.775 1.00 . A A . 5 LYS CG 1 1 18 8069 1 1 5 LYS H H 6.495 0.232 -5.371 1.00 . A A . 5 LYS H 1 1 18 8070 1 1 5 LYS HA H 4.977 1.821 -3.706 1.00 . A A . 5 LYS HA 1 1 18 8071 1 1 5 LYS HB2 H 7.198 2.528 -4.152 1.00 . A A . 5 LYS HB2 1 1 18 8072 1 1 5 LYS HB3 H 6.898 2.611 -5.885 1.00 . A A . 5 LYS HB3 1 1 18 8073 1 1 5 LYS HD2 H 7.582 4.789 -3.367 1.00 . A A . 5 LYS HD2 1 1 18 8074 1 1 5 LYS HD3 H 8.059 4.982 -5.057 1.00 . A A . 5 LYS HD3 1 1 18 8075 1 1 5 LYS HE2 H 7.027 7.005 -5.267 1.00 . A A . 5 LYS HE2 1 1 18 8076 1 1 5 LYS HE3 H 5.789 6.622 -4.071 1.00 . A A . 5 LYS HE3 1 1 18 8077 1 1 5 LYS HG2 H 5.724 4.592 -5.722 1.00 . A A . 5 LYS HG2 1 1 18 8078 1 1 5 LYS HG3 H 5.304 4.319 -4.049 1.00 . A A . 5 LYS HG3 1 1 18 8079 1 1 5 LYS HZ1 H 8.630 7.246 -3.456 1.00 . A A . 5 LYS HZ1 1 1 18 8080 1 1 5 LYS HZ2 H 7.421 6.910 -2.316 1.00 . A A . 5 LYS HZ2 1 1 18 8081 1 1 5 LYS HZ3 H 7.331 8.311 -3.267 1.00 . A A . 5 LYS HZ3 1 1 18 8082 1 1 5 LYS N N 5.581 0.462 -5.112 1.00 . A A . 5 LYS N 1 1 18 8083 1 1 5 LYS NZ N 7.613 7.313 -3.268 1.00 . A A . 5 LYS NZ 1 1 18 8084 1 1 5 LYS O O 3.027 2.643 -4.991 1.00 . A A . 5 LYS O 1 1 18 8085 1 1 6 TRP C C 2.139 1.999 -7.951 1.00 . A A . 6 TRP C 1 1 18 8086 1 1 6 TRP CA C 3.157 3.080 -7.611 1.00 . A A . 6 TRP CA 1 1 18 8087 1 1 6 TRP CB C 3.728 3.749 -8.860 1.00 . A A . 6 TRP CB 1 1 18 8088 1 1 6 TRP CD1 C 6.235 4.141 -8.457 1.00 . A A . 6 TRP CD1 1 1 18 8089 1 1 6 TRP CD2 C 4.995 5.997 -8.313 1.00 . A A . 6 TRP CD2 1 1 18 8090 1 1 6 TRP CE2 C 6.345 6.339 -8.097 1.00 . A A . 6 TRP CE2 1 1 18 8091 1 1 6 TRP CE3 C 4.033 7.008 -8.259 1.00 . A A . 6 TRP CE3 1 1 18 8092 1 1 6 TRP CG C 4.948 4.586 -8.568 1.00 . A A . 6 TRP CG 1 1 18 8093 1 1 6 TRP CH2 C 5.786 8.612 -7.788 1.00 . A A . 6 TRP CH2 1 1 18 8094 1 1 6 TRP CZ2 C 6.751 7.644 -7.834 1.00 . A A . 6 TRP CZ2 1 1 18 8095 1 1 6 TRP CZ3 C 4.437 8.303 -7.995 1.00 . A A . 6 TRP CZ3 1 1 18 8096 1 1 6 TRP H H 5.082 2.314 -7.226 1.00 . A A . 6 TRP H 1 1 18 8097 1 1 6 TRP HA H 2.654 3.834 -7.012 1.00 . A A . 6 TRP HA 1 1 18 8098 1 1 6 TRP HB2 H 4.005 2.990 -9.576 1.00 . A A . 6 TRP HB2 1 1 18 8099 1 1 6 TRP HB3 H 2.975 4.392 -9.293 1.00 . A A . 6 TRP HB3 1 1 18 8100 1 1 6 TRP HD1 H 6.530 3.113 -8.572 1.00 . A A . 6 TRP HD1 1 1 18 8101 1 1 6 TRP HE1 H 8.053 5.123 -8.092 1.00 . A A . 6 TRP HE1 1 1 18 8102 1 1 6 TRP HE3 H 2.992 6.789 -8.406 1.00 . A A . 6 TRP HE3 1 1 18 8103 1 1 6 TRP HH2 H 6.056 9.637 -7.584 1.00 . A A . 6 TRP HH2 1 1 18 8104 1 1 6 TRP HZ2 H 7.788 7.899 -7.673 1.00 . A A . 6 TRP HZ2 1 1 18 8105 1 1 6 TRP HZ3 H 3.705 9.095 -7.950 1.00 . A A . 6 TRP HZ3 1 1 18 8106 1 1 6 TRP N N 4.238 2.543 -6.812 1.00 . A A . 6 TRP N 1 1 18 8107 1 1 6 TRP NE1 N 7.081 5.189 -8.193 1.00 . A A . 6 TRP NE1 1 1 18 8108 1 1 6 TRP O O 1.418 2.098 -8.942 1.00 . A A . 6 TRP O 1 1 18 8109 1 1 7 GLU C C -0.237 0.364 -6.674 1.00 . A A . 7 GLU C 1 1 18 8110 1 1 7 GLU CA C 1.087 -0.081 -7.274 1.00 . A A . 7 GLU CA 1 1 18 8111 1 1 7 GLU CB C 1.556 -1.370 -6.598 1.00 . A A . 7 GLU CB 1 1 18 8112 1 1 7 GLU CD C 1.163 -3.016 -8.462 1.00 . A A . 7 GLU CD 1 1 18 8113 1 1 7 GLU CG C 0.809 -2.614 -7.047 1.00 . A A . 7 GLU CG 1 1 18 8114 1 1 7 GLU H H 2.641 0.981 -6.286 1.00 . A A . 7 GLU H 1 1 18 8115 1 1 7 GLU HA H 0.963 -0.249 -8.333 1.00 . A A . 7 GLU HA 1 1 18 8116 1 1 7 GLU HB2 H 2.604 -1.512 -6.812 1.00 . A A . 7 GLU HB2 1 1 18 8117 1 1 7 GLU HB3 H 1.428 -1.268 -5.530 1.00 . A A . 7 GLU HB3 1 1 18 8118 1 1 7 GLU HG2 H 1.059 -3.428 -6.384 1.00 . A A . 7 GLU HG2 1 1 18 8119 1 1 7 GLU HG3 H -0.253 -2.420 -6.997 1.00 . A A . 7 GLU HG3 1 1 18 8120 1 1 7 GLU N N 2.055 0.988 -7.090 1.00 . A A . 7 GLU N 1 1 18 8121 1 1 7 GLU O O -0.266 0.936 -5.580 1.00 . A A . 7 GLU O 1 1 18 8122 1 1 7 GLU OE1 O 2.360 -3.261 -8.729 1.00 . A A . 7 GLU OE1 1 1 18 8123 1 1 7 GLU OE2 O 0.254 -3.103 -9.303 1.00 . A A . 7 GLU OE2 1 1 18 8124 1 1 8 TYR C C -3.097 -0.448 -5.801 1.00 . A A . 8 TYR C 1 1 18 8125 1 1 8 TYR CA C -2.645 0.500 -6.913 1.00 . A A . 8 TYR CA 1 1 18 8126 1 1 8 TYR CB C -3.640 0.477 -8.080 1.00 . A A . 8 TYR CB 1 1 18 8127 1 1 8 TYR CD1 C -4.780 2.692 -7.664 1.00 . A A . 8 TYR CD1 1 1 18 8128 1 1 8 TYR CD2 C -6.142 0.747 -7.868 1.00 . A A . 8 TYR CD2 1 1 18 8129 1 1 8 TYR CE1 C -5.907 3.466 -7.471 1.00 . A A . 8 TYR CE1 1 1 18 8130 1 1 8 TYR CE2 C -7.274 1.516 -7.676 1.00 . A A . 8 TYR CE2 1 1 18 8131 1 1 8 TYR CG C -4.877 1.321 -7.865 1.00 . A A . 8 TYR CG 1 1 18 8132 1 1 8 TYR CZ C -7.151 2.874 -7.476 1.00 . A A . 8 TYR CZ 1 1 18 8133 1 1 8 TYR H H -1.235 -0.337 -8.249 1.00 . A A . 8 TYR H 1 1 18 8134 1 1 8 TYR HA H -2.579 1.506 -6.511 1.00 . A A . 8 TYR HA 1 1 18 8135 1 1 8 TYR HB2 H -3.146 0.841 -8.968 1.00 . A A . 8 TYR HB2 1 1 18 8136 1 1 8 TYR HB3 H -3.959 -0.542 -8.247 1.00 . A A . 8 TYR HB3 1 1 18 8137 1 1 8 TYR HD1 H -3.804 3.153 -7.659 1.00 . A A . 8 TYR HD1 1 1 18 8138 1 1 8 TYR HD2 H -6.237 -0.317 -8.024 1.00 . A A . 8 TYR HD2 1 1 18 8139 1 1 8 TYR HE1 H -5.810 4.531 -7.316 1.00 . A A . 8 TYR HE1 1 1 18 8140 1 1 8 TYR HE2 H -8.249 1.052 -7.680 1.00 . A A . 8 TYR HE2 1 1 18 8141 1 1 8 TYR HH H -8.018 4.559 -7.153 1.00 . A A . 8 TYR HH 1 1 18 8142 1 1 8 TYR N N -1.324 0.116 -7.383 1.00 . A A . 8 TYR N 1 1 18 8143 1 1 8 TYR O O -3.891 -1.363 -6.033 1.00 . A A . 8 TYR O 1 1 18 8144 1 1 8 TYR OH O -8.276 3.643 -7.284 1.00 . A A . 8 TYR OH 1 1 18 8145 1 1 9 CYS C C -4.288 -0.838 -2.912 1.00 . A A . 9 CYS C 1 1 18 8146 1 1 9 CYS CA C -2.874 -1.080 -3.449 1.00 . A A . 9 CYS CA 1 1 18 8147 1 1 9 CYS CB C -1.829 -0.886 -2.336 1.00 . A A . 9 CYS CB 1 1 18 8148 1 1 9 CYS H H -1.916 0.494 -4.493 1.00 . A A . 9 CYS H 1 1 18 8149 1 1 9 CYS HA H -2.819 -2.105 -3.785 1.00 . A A . 9 CYS HA 1 1 18 8150 1 1 9 CYS HB2 H -2.178 -1.377 -1.441 1.00 . A A . 9 CYS HB2 1 1 18 8151 1 1 9 CYS HB3 H -0.899 -1.342 -2.647 1.00 . A A . 9 CYS HB3 1 1 18 8152 1 1 9 CYS N N -2.562 -0.240 -4.601 1.00 . A A . 9 CYS N 1 1 18 8153 1 1 9 CYS O O -4.472 -0.485 -1.750 1.00 . A A . 9 CYS O 1 1 18 8154 1 1 9 CYS SG S -1.477 0.853 -1.905 1.00 . A A . 9 CYS SG 1 1 18 8155 1 1 10 ILE C C -7.162 -2.199 -2.674 1.00 . A A . 10 ILE C 1 1 18 8156 1 1 10 ILE CA C -6.686 -0.910 -3.369 1.00 . A A . 10 ILE CA 1 1 18 8157 1 1 10 ILE CB C -7.568 -0.574 -4.604 1.00 . A A . 10 ILE CB 1 1 18 8158 1 1 10 ILE CD1 C -9.904 0.164 -5.333 1.00 . A A . 10 ILE CD1 1 1 18 8159 1 1 10 ILE CG1 C -9.007 -0.245 -4.183 1.00 . A A . 10 ILE CG1 1 1 18 8160 1 1 10 ILE CG2 C -7.543 -1.714 -5.618 1.00 . A A . 10 ILE CG2 1 1 18 8161 1 1 10 ILE H H -5.076 -1.370 -4.670 1.00 . A A . 10 ILE H 1 1 18 8162 1 1 10 ILE HA H -6.749 -0.090 -2.667 1.00 . A A . 10 ILE HA 1 1 18 8163 1 1 10 ILE HB H -7.142 0.295 -5.083 1.00 . A A . 10 ILE HB 1 1 18 8164 1 1 10 ILE HD11 H -9.451 -0.136 -6.267 1.00 . A A . 10 ILE HD11 1 1 18 8165 1 1 10 ILE HD12 H -10.035 1.236 -5.324 1.00 . A A . 10 ILE HD12 1 1 18 8166 1 1 10 ILE HD13 H -10.865 -0.316 -5.229 1.00 . A A . 10 ILE HD13 1 1 18 8167 1 1 10 ILE HG12 H -9.447 -1.114 -3.716 1.00 . A A . 10 ILE HG12 1 1 18 8168 1 1 10 ILE HG13 H -8.989 0.567 -3.471 1.00 . A A . 10 ILE HG13 1 1 18 8169 1 1 10 ILE HG21 H -7.861 -2.629 -5.139 1.00 . A A . 10 ILE HG21 1 1 18 8170 1 1 10 ILE HG22 H -6.538 -1.837 -5.997 1.00 . A A . 10 ILE HG22 1 1 18 8171 1 1 10 ILE HG23 H -8.210 -1.484 -6.435 1.00 . A A . 10 ILE HG23 1 1 18 8172 1 1 10 ILE N N -5.287 -1.064 -3.759 1.00 . A A . 10 ILE N 1 1 18 8173 1 1 10 ILE O O -8.263 -2.706 -2.894 1.00 . A A . 10 ILE O 1 1 18 8174 1 1 11 VAL C C -7.391 -3.696 0.152 1.00 . A A . 11 VAL C 1 1 18 8175 1 1 11 VAL CA C -6.550 -3.950 -1.095 1.00 . A A . 11 VAL CA 1 1 18 8176 1 1 11 VAL CB C -5.230 -4.644 -0.697 1.00 . A A . 11 VAL CB 1 1 18 8177 1 1 11 VAL CG1 C -4.767 -5.584 -1.801 1.00 . A A . 11 VAL CG1 1 1 18 8178 1 1 11 VAL CG2 C -4.150 -3.612 -0.400 1.00 . A A . 11 VAL CG2 1 1 18 8179 1 1 11 VAL H H -5.430 -2.273 -1.706 1.00 . A A . 11 VAL H 1 1 18 8180 1 1 11 VAL HA H -7.093 -4.617 -1.748 1.00 . A A . 11 VAL HA 1 1 18 8181 1 1 11 VAL HB H -5.401 -5.225 0.198 1.00 . A A . 11 VAL HB 1 1 18 8182 1 1 11 VAL HG11 H -4.862 -6.606 -1.468 1.00 . A A . 11 VAL HG11 1 1 18 8183 1 1 11 VAL HG12 H -3.734 -5.377 -2.040 1.00 . A A . 11 VAL HG12 1 1 18 8184 1 1 11 VAL HG13 H -5.376 -5.434 -2.680 1.00 . A A . 11 VAL HG13 1 1 18 8185 1 1 11 VAL HG21 H -3.836 -3.706 0.629 1.00 . A A . 11 VAL HG21 1 1 18 8186 1 1 11 VAL HG22 H -4.545 -2.620 -0.567 1.00 . A A . 11 VAL HG22 1 1 18 8187 1 1 11 VAL HG23 H -3.304 -3.778 -1.052 1.00 . A A . 11 VAL HG23 1 1 18 8188 1 1 11 VAL N N -6.290 -2.727 -1.833 1.00 . A A . 11 VAL N 1 1 18 8189 1 1 11 VAL O O -7.160 -2.737 0.889 1.00 . A A . 11 VAL O 1 1 18 8190 1 1 12 PRO C C -8.516 -4.684 2.874 1.00 . A A . 12 PRO C 1 1 18 8191 1 1 12 PRO CA C -9.265 -4.450 1.564 1.00 . A A . 12 PRO CA 1 1 18 8192 1 1 12 PRO CB C -10.308 -5.549 1.340 1.00 . A A . 12 PRO CB 1 1 18 8193 1 1 12 PRO CD C -8.715 -5.734 -0.432 1.00 . A A . 12 PRO CD 1 1 18 8194 1 1 12 PRO CG C -9.639 -6.533 0.444 1.00 . A A . 12 PRO CG 1 1 18 8195 1 1 12 PRO HA H -9.752 -3.486 1.597 1.00 . A A . 12 PRO HA 1 1 18 8196 1 1 12 PRO HB2 H -10.575 -5.993 2.287 1.00 . A A . 12 PRO HB2 1 1 18 8197 1 1 12 PRO HB3 H -11.185 -5.126 0.873 1.00 . A A . 12 PRO HB3 1 1 18 8198 1 1 12 PRO HD2 H -7.829 -6.304 -0.666 1.00 . A A . 12 PRO HD2 1 1 18 8199 1 1 12 PRO HD3 H -9.222 -5.429 -1.336 1.00 . A A . 12 PRO HD3 1 1 18 8200 1 1 12 PRO HG2 H -9.076 -7.242 1.034 1.00 . A A . 12 PRO HG2 1 1 18 8201 1 1 12 PRO HG3 H -10.375 -7.045 -0.156 1.00 . A A . 12 PRO HG3 1 1 18 8202 1 1 12 PRO N N -8.383 -4.564 0.402 1.00 . A A . 12 PRO N 1 1 18 8203 1 1 12 PRO O O -7.528 -5.415 2.908 1.00 . A A . 12 PRO O 1 1 18 8204 1 1 13 ILE C C -8.220 -5.629 5.720 1.00 . A A . 13 ILE C 1 1 18 8205 1 1 13 ILE CA C -8.376 -4.172 5.270 1.00 . A A . 13 ILE CA 1 1 18 8206 1 1 13 ILE CB C -9.156 -3.387 6.358 1.00 . A A . 13 ILE CB 1 1 18 8207 1 1 13 ILE CD1 C -11.565 -3.490 5.447 1.00 . A A . 13 ILE CD1 1 1 18 8208 1 1 13 ILE CG1 C -10.593 -3.916 6.533 1.00 . A A . 13 ILE CG1 1 1 18 8209 1 1 13 ILE CG2 C -9.165 -1.900 6.028 1.00 . A A . 13 ILE CG2 1 1 18 8210 1 1 13 ILE H H -9.783 -3.484 3.842 1.00 . A A . 13 ILE H 1 1 18 8211 1 1 13 ILE HA H -7.390 -3.737 5.199 1.00 . A A . 13 ILE HA 1 1 18 8212 1 1 13 ILE HB H -8.626 -3.509 7.291 1.00 . A A . 13 ILE HB 1 1 18 8213 1 1 13 ILE HD11 H -11.218 -3.853 4.491 1.00 . A A . 13 ILE HD11 1 1 18 8214 1 1 13 ILE HD12 H -11.629 -2.413 5.423 1.00 . A A . 13 ILE HD12 1 1 18 8215 1 1 13 ILE HD13 H -12.541 -3.905 5.656 1.00 . A A . 13 ILE HD13 1 1 18 8216 1 1 13 ILE HG12 H -10.569 -4.995 6.542 1.00 . A A . 13 ILE HG12 1 1 18 8217 1 1 13 ILE HG13 H -10.981 -3.566 7.479 1.00 . A A . 13 ILE HG13 1 1 18 8218 1 1 13 ILE HG21 H -9.758 -1.373 6.761 1.00 . A A . 13 ILE HG21 1 1 18 8219 1 1 13 ILE HG22 H -9.589 -1.751 5.046 1.00 . A A . 13 ILE HG22 1 1 18 8220 1 1 13 ILE HG23 H -8.153 -1.522 6.044 1.00 . A A . 13 ILE HG23 1 1 18 8221 1 1 13 ILE N N -8.994 -4.055 3.945 1.00 . A A . 13 ILE N 1 1 18 8222 1 1 13 ILE O O -7.367 -5.933 6.550 1.00 . A A . 13 ILE O 1 1 18 8223 1 1 14 LEU C C -7.628 -8.547 5.145 1.00 . A A . 14 LEU C 1 1 18 8224 1 1 14 LEU CA C -8.986 -7.942 5.505 1.00 . A A . 14 LEU CA 1 1 18 8225 1 1 14 LEU CB C -10.097 -8.721 4.785 1.00 . A A . 14 LEU CB 1 1 18 8226 1 1 14 LEU CD1 C -11.628 -8.460 6.766 1.00 . A A . 14 LEU CD1 1 1 18 8227 1 1 14 LEU CD2 C -12.041 -7.116 4.691 1.00 . A A . 14 LEU CD2 1 1 18 8228 1 1 14 LEU CG C -11.534 -8.439 5.248 1.00 . A A . 14 LEU CG 1 1 18 8229 1 1 14 LEU H H -9.692 -6.213 4.508 1.00 . A A . 14 LEU H 1 1 18 8230 1 1 14 LEU HA H -9.133 -8.030 6.571 1.00 . A A . 14 LEU HA 1 1 18 8231 1 1 14 LEU HB2 H -10.035 -8.496 3.731 1.00 . A A . 14 LEU HB2 1 1 18 8232 1 1 14 LEU HB3 H -9.905 -9.777 4.917 1.00 . A A . 14 LEU HB3 1 1 18 8233 1 1 14 LEU HD11 H -11.451 -9.463 7.123 1.00 . A A . 14 LEU HD11 1 1 18 8234 1 1 14 LEU HD12 H -12.613 -8.138 7.070 1.00 . A A . 14 LEU HD12 1 1 18 8235 1 1 14 LEU HD13 H -10.886 -7.794 7.181 1.00 . A A . 14 LEU HD13 1 1 18 8236 1 1 14 LEU HD21 H -12.975 -6.857 5.169 1.00 . A A . 14 LEU HD21 1 1 18 8237 1 1 14 LEU HD22 H -12.196 -7.209 3.626 1.00 . A A . 14 LEU HD22 1 1 18 8238 1 1 14 LEU HD23 H -11.312 -6.342 4.881 1.00 . A A . 14 LEU HD23 1 1 18 8239 1 1 14 LEU HG H -12.177 -9.223 4.871 1.00 . A A . 14 LEU HG 1 1 18 8240 1 1 14 LEU N N -9.038 -6.519 5.165 1.00 . A A . 14 LEU N 1 1 18 8241 1 1 14 LEU O O -7.178 -9.501 5.775 1.00 . A A . 14 LEU O 1 1 18 8242 1 1 15 GLY C C -5.006 -7.501 2.781 1.00 . A A . 15 GLY C 1 1 18 8243 1 1 15 GLY CA C -5.698 -8.485 3.694 1.00 . A A . 15 GLY CA 1 1 18 8244 1 1 15 GLY H H -7.396 -7.230 3.659 1.00 . A A . 15 GLY H 1 1 18 8245 1 1 15 GLY HA2 H -5.078 -8.658 4.562 1.00 . A A . 15 GLY HA2 1 1 18 8246 1 1 15 GLY HA3 H -5.836 -9.417 3.167 1.00 . A A . 15 GLY HA3 1 1 18 8247 1 1 15 GLY N N -6.987 -7.990 4.127 1.00 . A A . 15 GLY N 1 1 18 8248 1 1 15 GLY O O -4.740 -7.801 1.620 1.00 . A A . 15 GLY O 1 1 18 8249 1 1 16 PHE C C -2.598 -5.494 2.329 1.00 . A A . 16 PHE C 1 1 18 8250 1 1 16 PHE CA C -4.097 -5.251 2.535 1.00 . A A . 16 PHE CA 1 1 18 8251 1 1 16 PHE CB C -4.339 -3.886 3.196 1.00 . A A . 16 PHE CB 1 1 18 8252 1 1 16 PHE CD1 C -2.939 -4.327 5.251 1.00 . A A . 16 PHE CD1 1 1 18 8253 1 1 16 PHE CD2 C -5.091 -3.343 5.528 1.00 . A A . 16 PHE CD2 1 1 18 8254 1 1 16 PHE CE1 C -2.742 -4.291 6.618 1.00 . A A . 16 PHE CE1 1 1 18 8255 1 1 16 PHE CE2 C -4.900 -3.304 6.897 1.00 . A A . 16 PHE CE2 1 1 18 8256 1 1 16 PHE CG C -4.115 -3.855 4.689 1.00 . A A . 16 PHE CG 1 1 18 8257 1 1 16 PHE CZ C -3.724 -3.779 7.442 1.00 . A A . 16 PHE CZ 1 1 18 8258 1 1 16 PHE H H -4.998 -6.135 4.234 1.00 . A A . 16 PHE H 1 1 18 8259 1 1 16 PHE HA H -4.567 -5.241 1.564 1.00 . A A . 16 PHE HA 1 1 18 8260 1 1 16 PHE HB2 H -3.676 -3.163 2.751 1.00 . A A . 16 PHE HB2 1 1 18 8261 1 1 16 PHE HB3 H -5.361 -3.586 3.009 1.00 . A A . 16 PHE HB3 1 1 18 8262 1 1 16 PHE HD1 H -2.170 -4.728 4.608 1.00 . A A . 16 PHE HD1 1 1 18 8263 1 1 16 PHE HD2 H -6.013 -2.973 5.105 1.00 . A A . 16 PHE HD2 1 1 18 8264 1 1 16 PHE HE1 H -1.821 -4.664 7.042 1.00 . A A . 16 PHE HE1 1 1 18 8265 1 1 16 PHE HE2 H -5.670 -2.901 7.539 1.00 . A A . 16 PHE HE2 1 1 18 8266 1 1 16 PHE HZ H -3.573 -3.749 8.511 1.00 . A A . 16 PHE HZ 1 1 18 8267 1 1 16 PHE N N -4.739 -6.312 3.306 1.00 . A A . 16 PHE N 1 1 18 8268 1 1 16 PHE O O -1.909 -4.663 1.737 1.00 . A A . 16 PHE O 1 1 18 8269 1 1 17 VAL C C 0.196 -5.901 3.247 1.00 . A A . 17 VAL C 1 1 18 8270 1 1 17 VAL CA C -0.696 -7.000 2.670 1.00 . A A . 17 VAL CA 1 1 18 8271 1 1 17 VAL CB C -0.318 -7.294 1.188 1.00 . A A . 17 VAL CB 1 1 18 8272 1 1 17 VAL CG1 C 0.910 -8.194 1.103 1.00 . A A . 17 VAL CG1 1 1 18 8273 1 1 17 VAL CG2 C -1.482 -7.936 0.440 1.00 . A A . 17 VAL CG2 1 1 18 8274 1 1 17 VAL H H -2.713 -7.257 3.258 1.00 . A A . 17 VAL H 1 1 18 8275 1 1 17 VAL HA H -0.519 -7.893 3.235 1.00 . A A . 17 VAL HA 1 1 18 8276 1 1 17 VAL HB H -0.083 -6.356 0.705 1.00 . A A . 17 VAL HB 1 1 18 8277 1 1 17 VAL HG11 H 1.496 -8.089 2.005 1.00 . A A . 17 VAL HG11 1 1 18 8278 1 1 17 VAL HG12 H 1.508 -7.908 0.251 1.00 . A A . 17 VAL HG12 1 1 18 8279 1 1 17 VAL HG13 H 0.596 -9.222 0.995 1.00 . A A . 17 VAL HG13 1 1 18 8280 1 1 17 VAL HG21 H -1.364 -7.768 -0.620 1.00 . A A . 17 VAL HG21 1 1 18 8281 1 1 17 VAL HG22 H -2.410 -7.497 0.774 1.00 . A A . 17 VAL HG22 1 1 18 8282 1 1 17 VAL HG23 H -1.495 -8.998 0.638 1.00 . A A . 17 VAL HG23 1 1 18 8283 1 1 17 VAL N N -2.107 -6.638 2.807 1.00 . A A . 17 VAL N 1 1 18 8284 1 1 17 VAL O O -0.129 -5.293 4.267 1.00 . A A . 17 VAL O 1 1 18 8285 1 1 18 TYR C C 3.241 -4.334 1.904 1.00 . A A . 18 TYR C 1 1 18 8286 1 1 18 TYR CA C 2.270 -4.662 3.033 1.00 . A A . 18 TYR CA 1 1 18 8287 1 1 18 TYR CB C 3.038 -5.155 4.273 1.00 . A A . 18 TYR CB 1 1 18 8288 1 1 18 TYR CD1 C 5.093 -6.457 3.564 1.00 . A A . 18 TYR CD1 1 1 18 8289 1 1 18 TYR CD2 C 3.198 -7.679 4.338 1.00 . A A . 18 TYR CD2 1 1 18 8290 1 1 18 TYR CE1 C 5.775 -7.640 3.352 1.00 . A A . 18 TYR CE1 1 1 18 8291 1 1 18 TYR CE2 C 3.875 -8.866 4.132 1.00 . A A . 18 TYR CE2 1 1 18 8292 1 1 18 TYR CG C 3.793 -6.454 4.060 1.00 . A A . 18 TYR CG 1 1 18 8293 1 1 18 TYR CZ C 5.162 -8.842 3.638 1.00 . A A . 18 TYR CZ 1 1 18 8294 1 1 18 TYR H H 1.504 -6.205 1.808 1.00 . A A . 18 TYR H 1 1 18 8295 1 1 18 TYR HA H 1.719 -3.769 3.290 1.00 . A A . 18 TYR HA 1 1 18 8296 1 1 18 TYR HB2 H 3.754 -4.402 4.564 1.00 . A A . 18 TYR HB2 1 1 18 8297 1 1 18 TYR HB3 H 2.338 -5.307 5.081 1.00 . A A . 18 TYR HB3 1 1 18 8298 1 1 18 TYR HD1 H 5.572 -5.514 3.342 1.00 . A A . 18 TYR HD1 1 1 18 8299 1 1 18 TYR HD2 H 2.190 -7.696 4.725 1.00 . A A . 18 TYR HD2 1 1 18 8300 1 1 18 TYR HE1 H 6.784 -7.620 2.967 1.00 . A A . 18 TYR HE1 1 1 18 8301 1 1 18 TYR HE2 H 3.395 -9.807 4.356 1.00 . A A . 18 TYR HE2 1 1 18 8302 1 1 18 TYR HH H 6.313 -10.272 4.217 1.00 . A A . 18 TYR HH 1 1 18 8303 1 1 18 TYR N N 1.312 -5.669 2.599 1.00 . A A . 18 TYR N 1 1 18 8304 1 1 18 TYR O O 3.592 -5.202 1.109 1.00 . A A . 18 TYR O 1 1 18 8305 1 1 18 TYR OH O 5.834 -10.025 3.415 1.00 . A A . 18 TYR OH 1 1 18 8306 1 1 19 CYS C C 6.018 -3.126 1.131 1.00 . A A . 19 CYS C 1 1 18 8307 1 1 19 CYS CA C 4.611 -2.648 0.811 1.00 . A A . 19 CYS CA 1 1 18 8308 1 1 19 CYS CB C 4.621 -1.136 0.727 1.00 . A A . 19 CYS CB 1 1 18 8309 1 1 19 CYS H H 3.349 -2.426 2.495 1.00 . A A . 19 CYS H 1 1 18 8310 1 1 19 CYS HA H 4.299 -3.058 -0.137 1.00 . A A . 19 CYS HA 1 1 18 8311 1 1 19 CYS HB2 H 4.591 -0.756 1.731 1.00 . A A . 19 CYS HB2 1 1 18 8312 1 1 19 CYS HB3 H 5.539 -0.801 0.250 1.00 . A A . 19 CYS HB3 1 1 18 8313 1 1 19 CYS N N 3.668 -3.082 1.835 1.00 . A A . 19 CYS N 1 1 18 8314 1 1 19 CYS O O 6.278 -3.636 2.222 1.00 . A A . 19 CYS O 1 1 18 8315 1 1 19 CYS SG S 3.209 -0.418 -0.171 1.00 . A A . 19 CYS SG 1 1 18 8316 1 1 20 CYS C C 8.938 -2.442 1.422 1.00 . A A . 20 CYS C 1 1 18 8317 1 1 20 CYS CA C 8.311 -3.339 0.373 1.00 . A A . 20 CYS CA 1 1 18 8318 1 1 20 CYS CB C 9.083 -3.235 -0.938 1.00 . A A . 20 CYS CB 1 1 18 8319 1 1 20 CYS H H 6.661 -2.524 -0.664 1.00 . A A . 20 CYS H 1 1 18 8320 1 1 20 CYS HA H 8.330 -4.362 0.722 1.00 . A A . 20 CYS HA 1 1 18 8321 1 1 20 CYS HB2 H 9.231 -2.192 -1.169 1.00 . A A . 20 CYS HB2 1 1 18 8322 1 1 20 CYS HB3 H 10.045 -3.709 -0.817 1.00 . A A . 20 CYS HB3 1 1 18 8323 1 1 20 CYS N N 6.926 -2.946 0.182 1.00 . A A . 20 CYS N 1 1 18 8324 1 1 20 CYS O O 8.489 -1.311 1.607 1.00 . A A . 20 CYS O 1 1 18 8325 1 1 20 CYS SG S 8.245 -4.020 -2.360 1.00 . A A . 20 CYS SG 1 1 18 8326 1 1 21 PRO C C 11.042 -0.774 2.664 1.00 . A A . 21 PRO C 1 1 18 8327 1 1 21 PRO CA C 10.614 -2.136 3.173 1.00 . A A . 21 PRO CA 1 1 18 8328 1 1 21 PRO CB C 11.821 -2.970 3.566 1.00 . A A . 21 PRO CB 1 1 18 8329 1 1 21 PRO CD C 10.558 -4.262 2.002 1.00 . A A . 21 PRO CD 1 1 18 8330 1 1 21 PRO CG C 11.437 -4.369 3.221 1.00 . A A . 21 PRO CG 1 1 18 8331 1 1 21 PRO HA H 9.968 -2.007 4.029 1.00 . A A . 21 PRO HA 1 1 18 8332 1 1 21 PRO HB2 H 12.688 -2.643 3.010 1.00 . A A . 21 PRO HB2 1 1 18 8333 1 1 21 PRO HB3 H 11.994 -2.852 4.623 1.00 . A A . 21 PRO HB3 1 1 18 8334 1 1 21 PRO HD2 H 11.149 -4.332 1.102 1.00 . A A . 21 PRO HD2 1 1 18 8335 1 1 21 PRO HD3 H 9.794 -5.024 2.011 1.00 . A A . 21 PRO HD3 1 1 18 8336 1 1 21 PRO HG2 H 12.321 -4.949 2.998 1.00 . A A . 21 PRO HG2 1 1 18 8337 1 1 21 PRO HG3 H 10.891 -4.814 4.039 1.00 . A A . 21 PRO HG3 1 1 18 8338 1 1 21 PRO N N 9.964 -2.923 2.136 1.00 . A A . 21 PRO N 1 1 18 8339 1 1 21 PRO O O 11.878 -0.653 1.769 1.00 . A A . 21 PRO O 1 1 18 8340 1 1 22 GLY C C 9.495 2.279 2.238 1.00 . A A . 22 GLY C 1 1 18 8341 1 1 22 GLY CA C 10.706 1.600 2.847 1.00 . A A . 22 GLY CA 1 1 18 8342 1 1 22 GLY H H 9.766 0.047 3.922 1.00 . A A . 22 GLY H 1 1 18 8343 1 1 22 GLY HA2 H 11.019 2.156 3.718 1.00 . A A . 22 GLY HA2 1 1 18 8344 1 1 22 GLY HA3 H 11.508 1.602 2.123 1.00 . A A . 22 GLY HA3 1 1 18 8345 1 1 22 GLY N N 10.430 0.236 3.236 1.00 . A A . 22 GLY N 1 1 18 8346 1 1 22 GLY O O 9.380 3.500 2.284 1.00 . A A . 22 GLY O 1 1 18 8347 1 1 23 LEU C C 6.169 1.716 1.886 1.00 . A A . 23 LEU C 1 1 18 8348 1 1 23 LEU CA C 7.397 2.022 1.035 1.00 . A A . 23 LEU CA 1 1 18 8349 1 1 23 LEU CB C 7.232 1.410 -0.359 1.00 . A A . 23 LEU CB 1 1 18 8350 1 1 23 LEU CD1 C 8.245 0.721 -2.544 1.00 . A A . 23 LEU CD1 1 1 18 8351 1 1 23 LEU CD2 C 8.748 2.979 -1.598 1.00 . A A . 23 LEU CD2 1 1 18 8352 1 1 23 LEU CG C 8.456 1.522 -1.270 1.00 . A A . 23 LEU CG 1 1 18 8353 1 1 23 LEU H H 8.731 0.513 1.651 1.00 . A A . 23 LEU H 1 1 18 8354 1 1 23 LEU HA H 7.510 3.092 0.944 1.00 . A A . 23 LEU HA 1 1 18 8355 1 1 23 LEU HB2 H 6.992 0.363 -0.240 1.00 . A A . 23 LEU HB2 1 1 18 8356 1 1 23 LEU HB3 H 6.402 1.899 -0.846 1.00 . A A . 23 LEU HB3 1 1 18 8357 1 1 23 LEU HD11 H 7.357 0.114 -2.444 1.00 . A A . 23 LEU HD11 1 1 18 8358 1 1 23 LEU HD12 H 9.100 0.084 -2.714 1.00 . A A . 23 LEU HD12 1 1 18 8359 1 1 23 LEU HD13 H 8.126 1.397 -3.378 1.00 . A A . 23 LEU HD13 1 1 18 8360 1 1 23 LEU HD21 H 9.723 3.245 -1.218 1.00 . A A . 23 LEU HD21 1 1 18 8361 1 1 23 LEU HD22 H 7.998 3.608 -1.140 1.00 . A A . 23 LEU HD22 1 1 18 8362 1 1 23 LEU HD23 H 8.729 3.117 -2.669 1.00 . A A . 23 LEU HD23 1 1 18 8363 1 1 23 LEU HG H 9.316 1.114 -0.758 1.00 . A A . 23 LEU HG 1 1 18 8364 1 1 23 LEU N N 8.593 1.488 1.660 1.00 . A A . 23 LEU N 1 1 18 8365 1 1 23 LEU O O 6.123 0.694 2.575 1.00 . A A . 23 LEU O 1 1 18 8366 1 1 24 ILE C C 2.712 2.748 1.758 1.00 . A A . 24 ILE C 1 1 18 8367 1 1 24 ILE CA C 3.943 2.396 2.593 1.00 . A A . 24 ILE CA 1 1 18 8368 1 1 24 ILE CB C 3.922 3.230 3.896 1.00 . A A . 24 ILE CB 1 1 18 8369 1 1 24 ILE CD1 C 4.198 5.592 4.825 1.00 . A A . 24 ILE CD1 1 1 18 8370 1 1 24 ILE CG1 C 4.285 4.693 3.611 1.00 . A A . 24 ILE CG1 1 1 18 8371 1 1 24 ILE CG2 C 4.863 2.631 4.933 1.00 . A A . 24 ILE CG2 1 1 18 8372 1 1 24 ILE H H 5.267 3.391 1.254 1.00 . A A . 24 ILE H 1 1 18 8373 1 1 24 ILE HA H 3.888 1.352 2.864 1.00 . A A . 24 ILE HA 1 1 18 8374 1 1 24 ILE HB H 2.920 3.190 4.295 1.00 . A A . 24 ILE HB 1 1 18 8375 1 1 24 ILE HD11 H 3.829 6.563 4.530 1.00 . A A . 24 ILE HD11 1 1 18 8376 1 1 24 ILE HD12 H 5.180 5.699 5.265 1.00 . A A . 24 ILE HD12 1 1 18 8377 1 1 24 ILE HD13 H 3.525 5.156 5.549 1.00 . A A . 24 ILE HD13 1 1 18 8378 1 1 24 ILE HG12 H 5.297 4.739 3.237 1.00 . A A . 24 ILE HG12 1 1 18 8379 1 1 24 ILE HG13 H 3.613 5.083 2.860 1.00 . A A . 24 ILE HG13 1 1 18 8380 1 1 24 ILE HG21 H 5.254 3.417 5.561 1.00 . A A . 24 ILE HG21 1 1 18 8381 1 1 24 ILE HG22 H 5.678 2.130 4.433 1.00 . A A . 24 ILE HG22 1 1 18 8382 1 1 24 ILE HG23 H 4.322 1.920 5.540 1.00 . A A . 24 ILE HG23 1 1 18 8383 1 1 24 ILE N N 5.174 2.592 1.832 1.00 . A A . 24 ILE N 1 1 18 8384 1 1 24 ILE O O 2.658 3.802 1.125 1.00 . A A . 24 ILE O 1 1 18 8385 1 1 25 CYS C C -0.295 3.237 1.603 1.00 . A A . 25 CYS C 1 1 18 8386 1 1 25 CYS CA C 0.493 2.080 0.995 1.00 . A A . 25 CYS CA 1 1 18 8387 1 1 25 CYS CB C -0.365 0.807 0.953 1.00 . A A . 25 CYS CB 1 1 18 8388 1 1 25 CYS H H 1.828 1.025 2.273 1.00 . A A . 25 CYS H 1 1 18 8389 1 1 25 CYS HA H 0.772 2.345 -0.011 1.00 . A A . 25 CYS HA 1 1 18 8390 1 1 25 CYS HB2 H 0.192 0.024 0.463 1.00 . A A . 25 CYS HB2 1 1 18 8391 1 1 25 CYS HB3 H -0.586 0.501 1.966 1.00 . A A . 25 CYS HB3 1 1 18 8392 1 1 25 CYS N N 1.726 1.854 1.755 1.00 . A A . 25 CYS N 1 1 18 8393 1 1 25 CYS O O -0.425 3.332 2.826 1.00 . A A . 25 CYS O 1 1 18 8394 1 1 25 CYS SG S -1.954 0.992 0.068 1.00 . A A . 25 CYS SG 1 1 18 8395 1 1 26 GLY C C -2.792 5.552 0.416 1.00 . A A . 26 GLY C 1 1 18 8396 1 1 26 GLY CA C -1.541 5.272 1.232 1.00 . A A . 26 GLY CA 1 1 18 8397 1 1 26 GLY H H -0.646 4.009 -0.212 1.00 . A A . 26 GLY H 1 1 18 8398 1 1 26 GLY HA2 H -1.829 5.096 2.258 1.00 . A A . 26 GLY HA2 1 1 18 8399 1 1 26 GLY HA3 H -0.901 6.140 1.195 1.00 . A A . 26 GLY HA3 1 1 18 8400 1 1 26 GLY N N -0.797 4.125 0.754 1.00 . A A . 26 GLY N 1 1 18 8401 1 1 26 GLY O O -3.787 4.840 0.539 1.00 . A A . 26 GLY O 1 1 18 8402 1 1 27 PRO C C -4.199 6.038 -2.413 1.00 . A A . 27 PRO C 1 1 18 8403 1 1 27 PRO CA C -3.926 7.000 -1.255 1.00 . A A . 27 PRO CA 1 1 18 8404 1 1 27 PRO CB C -3.526 8.381 -1.780 1.00 . A A . 27 PRO CB 1 1 18 8405 1 1 27 PRO CD C -1.627 7.515 -0.609 1.00 . A A . 27 PRO CD 1 1 18 8406 1 1 27 PRO CG C -2.037 8.374 -1.774 1.00 . A A . 27 PRO CG 1 1 18 8407 1 1 27 PRO HA H -4.821 7.087 -0.659 1.00 . A A . 27 PRO HA 1 1 18 8408 1 1 27 PRO HB2 H -3.919 8.518 -2.777 1.00 . A A . 27 PRO HB2 1 1 18 8409 1 1 27 PRO HB3 H -3.918 9.145 -1.125 1.00 . A A . 27 PRO HB3 1 1 18 8410 1 1 27 PRO HD2 H -0.733 6.959 -0.846 1.00 . A A . 27 PRO HD2 1 1 18 8411 1 1 27 PRO HD3 H -1.471 8.123 0.270 1.00 . A A . 27 PRO HD3 1 1 18 8412 1 1 27 PRO HG2 H -1.669 7.951 -2.697 1.00 . A A . 27 PRO HG2 1 1 18 8413 1 1 27 PRO HG3 H -1.666 9.379 -1.647 1.00 . A A . 27 PRO HG3 1 1 18 8414 1 1 27 PRO N N -2.775 6.607 -0.422 1.00 . A A . 27 PRO N 1 1 18 8415 1 1 27 PRO O O -4.151 6.422 -3.582 1.00 . A A . 27 PRO O 1 1 18 8416 1 1 28 PHE C C -3.526 3.399 -3.860 1.00 . A A . 28 PHE C 1 1 18 8417 1 1 28 PHE CA C -4.763 3.717 -3.020 1.00 . A A . 28 PHE CA 1 1 18 8418 1 1 28 PHE CB C -5.981 4.052 -3.918 1.00 . A A . 28 PHE CB 1 1 18 8419 1 1 28 PHE CD1 C -7.477 4.823 -2.040 1.00 . A A . 28 PHE CD1 1 1 18 8420 1 1 28 PHE CD2 C -8.363 3.308 -3.652 1.00 . A A . 28 PHE CD2 1 1 18 8421 1 1 28 PHE CE1 C -8.687 4.830 -1.375 1.00 . A A . 28 PHE CE1 1 1 18 8422 1 1 28 PHE CE2 C -9.577 3.311 -2.992 1.00 . A A . 28 PHE CE2 1 1 18 8423 1 1 28 PHE CG C -7.300 4.063 -3.186 1.00 . A A . 28 PHE CG 1 1 18 8424 1 1 28 PHE CZ C -9.739 4.073 -1.851 1.00 . A A . 28 PHE CZ 1 1 18 8425 1 1 28 PHE H H -4.484 4.572 -1.101 1.00 . A A . 28 PHE H 1 1 18 8426 1 1 28 PHE HA H -5.001 2.836 -2.440 1.00 . A A . 28 PHE HA 1 1 18 8427 1 1 28 PHE HB2 H -5.852 5.029 -4.363 1.00 . A A . 28 PHE HB2 1 1 18 8428 1 1 28 PHE HB3 H -6.053 3.313 -4.706 1.00 . A A . 28 PHE HB3 1 1 18 8429 1 1 28 PHE HD1 H -6.656 5.415 -1.666 1.00 . A A . 28 PHE HD1 1 1 18 8430 1 1 28 PHE HD2 H -8.238 2.713 -4.544 1.00 . A A . 28 PHE HD2 1 1 18 8431 1 1 28 PHE HE1 H -8.811 5.427 -0.483 1.00 . A A . 28 PHE HE1 1 1 18 8432 1 1 28 PHE HE2 H -10.398 2.718 -3.367 1.00 . A A . 28 PHE HE2 1 1 18 8433 1 1 28 PHE HZ H -10.687 4.077 -1.333 1.00 . A A . 28 PHE HZ 1 1 18 8434 1 1 28 PHE N N -4.478 4.788 -2.060 1.00 . A A . 28 PHE N 1 1 18 8435 1 1 28 PHE O O -3.607 2.692 -4.860 1.00 . A A . 28 PHE O 1 1 18 8436 1 1 29 VAL C C -0.031 3.704 -2.961 1.00 . A A . 29 VAL C 1 1 18 8437 1 1 29 VAL CA C -1.090 3.653 -4.046 1.00 . A A . 29 VAL CA 1 1 18 8438 1 1 29 VAL CB C -0.727 4.689 -5.150 1.00 . A A . 29 VAL CB 1 1 18 8439 1 1 29 VAL CG1 C -1.651 4.565 -6.352 1.00 . A A . 29 VAL CG1 1 1 18 8440 1 1 29 VAL CG2 C -0.759 6.106 -4.597 1.00 . A A . 29 VAL CG2 1 1 18 8441 1 1 29 VAL H H -2.378 4.411 -2.565 1.00 . A A . 29 VAL H 1 1 18 8442 1 1 29 VAL HA H -1.112 2.660 -4.488 1.00 . A A . 29 VAL HA 1 1 18 8443 1 1 29 VAL HB H 0.286 4.481 -5.488 1.00 . A A . 29 VAL HB 1 1 18 8444 1 1 29 VAL HG11 H -2.417 3.832 -6.145 1.00 . A A . 29 VAL HG11 1 1 18 8445 1 1 29 VAL HG12 H -1.081 4.255 -7.215 1.00 . A A . 29 VAL HG12 1 1 18 8446 1 1 29 VAL HG13 H -2.113 5.521 -6.551 1.00 . A A . 29 VAL HG13 1 1 18 8447 1 1 29 VAL HG21 H -0.801 6.071 -3.518 1.00 . A A . 29 VAL HG21 1 1 18 8448 1 1 29 VAL HG22 H -1.629 6.622 -4.974 1.00 . A A . 29 VAL HG22 1 1 18 8449 1 1 29 VAL HG23 H 0.134 6.633 -4.905 1.00 . A A . 29 VAL HG23 1 1 18 8450 1 1 29 VAL N N -2.374 3.891 -3.402 1.00 . A A . 29 VAL N 1 1 18 8451 1 1 29 VAL O O -0.246 4.326 -1.919 1.00 . A A . 29 VAL O 1 1 18 8452 1 1 30 CYS C C 3.079 4.249 -2.433 1.00 . A A . 30 CYS C 1 1 18 8453 1 1 30 CYS CA C 2.154 3.053 -2.204 1.00 . A A . 30 CYS CA 1 1 18 8454 1 1 30 CYS CB C 2.923 1.732 -2.299 1.00 . A A . 30 CYS CB 1 1 18 8455 1 1 30 CYS H H 1.209 2.582 -4.033 1.00 . A A . 30 CYS H 1 1 18 8456 1 1 30 CYS HA H 1.711 3.137 -1.226 1.00 . A A . 30 CYS HA 1 1 18 8457 1 1 30 CYS HB2 H 2.222 0.923 -2.436 1.00 . A A . 30 CYS HB2 1 1 18 8458 1 1 30 CYS HB3 H 3.579 1.775 -3.158 1.00 . A A . 30 CYS HB3 1 1 18 8459 1 1 30 CYS N N 1.087 3.063 -3.184 1.00 . A A . 30 CYS N 1 1 18 8460 1 1 30 CYS O O 3.165 4.780 -3.542 1.00 . A A . 30 CYS O 1 1 18 8461 1 1 30 CYS SG S 3.945 1.346 -0.850 1.00 . A A . 30 CYS SG 1 1 18 8462 1 1 31 VAL C C 5.944 5.544 -0.752 1.00 . A A . 31 VAL C 1 1 18 8463 1 1 31 VAL CA C 4.659 5.820 -1.513 1.00 . A A . 31 VAL CA 1 1 18 8464 1 1 31 VAL CB C 4.028 7.134 -0.987 1.00 . A A . 31 VAL CB 1 1 18 8465 1 1 31 VAL CG1 C 2.820 7.535 -1.822 1.00 . A A . 31 VAL CG1 1 1 18 8466 1 1 31 VAL CG2 C 3.640 7.002 0.480 1.00 . A A . 31 VAL CG2 1 1 18 8467 1 1 31 VAL H H 3.659 4.246 -0.520 1.00 . A A . 31 VAL H 1 1 18 8468 1 1 31 VAL HA H 4.896 5.946 -2.567 1.00 . A A . 31 VAL HA 1 1 18 8469 1 1 31 VAL HB H 4.765 7.918 -1.069 1.00 . A A . 31 VAL HB 1 1 18 8470 1 1 31 VAL HG11 H 2.846 8.600 -2.007 1.00 . A A . 31 VAL HG11 1 1 18 8471 1 1 31 VAL HG12 H 1.914 7.286 -1.289 1.00 . A A . 31 VAL HG12 1 1 18 8472 1 1 31 VAL HG13 H 2.840 7.007 -2.764 1.00 . A A . 31 VAL HG13 1 1 18 8473 1 1 31 VAL HG21 H 4.515 6.756 1.062 1.00 . A A . 31 VAL HG21 1 1 18 8474 1 1 31 VAL HG22 H 2.904 6.219 0.588 1.00 . A A . 31 VAL HG22 1 1 18 8475 1 1 31 VAL HG23 H 3.226 7.936 0.829 1.00 . A A . 31 VAL HG23 1 1 18 8476 1 1 31 VAL N N 3.759 4.688 -1.393 1.00 . A A . 31 VAL N 1 1 18 8477 1 1 31 VAL O O 5.936 4.629 0.094 1.00 . A A . 31 VAL O 1 1 18 8478 1 1 31 VAL OXT O 6.953 6.233 -1.026 1.00 . A A . 31 VAL OXT 1 1 19 8479 1 1 1 ALA C C 3.274 -8.387 0.057 1.00 . A A . 1 ALA C 1 1 19 8480 1 1 1 ALA CA C 3.390 -9.900 0.045 1.00 . A A . 1 ALA CA 1 1 19 8481 1 1 1 ALA CB C 3.121 -10.447 -1.349 1.00 . A A . 1 ALA CB 1 1 19 8482 1 1 1 ALA H1 H 2.405 -11.512 0.922 1.00 . A A . 1 ALA H1 1 1 19 8483 1 1 1 ALA H2 H 1.490 -10.090 0.860 1.00 . A A . 1 ALA H2 1 1 19 8484 1 1 1 ALA H3 H 2.735 -10.240 1.995 1.00 . A A . 1 ALA H3 1 1 19 8485 1 1 1 ALA HA H 4.393 -10.179 0.333 1.00 . A A . 1 ALA HA 1 1 19 8486 1 1 1 ALA HB1 H 2.994 -9.625 -2.039 1.00 . A A . 1 ALA HB1 1 1 19 8487 1 1 1 ALA HB2 H 2.222 -11.046 -1.334 1.00 . A A . 1 ALA HB2 1 1 19 8488 1 1 1 ALA HB3 H 3.955 -11.056 -1.664 1.00 . A A . 1 ALA HB3 1 1 19 8489 1 1 1 ALA N N 2.440 -10.480 1.022 1.00 . A A . 1 ALA N 1 1 19 8490 1 1 1 ALA O O 2.251 -7.852 0.480 1.00 . A A . 1 ALA O 1 1 19 8491 1 1 2 CYS C C 3.721 -5.759 -1.760 1.00 . A A . 2 CYS C 1 1 19 8492 1 1 2 CYS CA C 4.306 -6.249 -0.434 1.00 . A A . 2 CYS CA 1 1 19 8493 1 1 2 CYS CB C 5.715 -5.709 -0.195 1.00 . A A . 2 CYS CB 1 1 19 8494 1 1 2 CYS H H 5.104 -8.182 -0.724 1.00 . A A . 2 CYS H 1 1 19 8495 1 1 2 CYS HA H 3.666 -5.898 0.368 1.00 . A A . 2 CYS HA 1 1 19 8496 1 1 2 CYS HB2 H 5.662 -4.635 -0.121 1.00 . A A . 2 CYS HB2 1 1 19 8497 1 1 2 CYS HB3 H 6.082 -6.102 0.745 1.00 . A A . 2 CYS HB3 1 1 19 8498 1 1 2 CYS N N 4.315 -7.703 -0.400 1.00 . A A . 2 CYS N 1 1 19 8499 1 1 2 CYS O O 2.846 -6.418 -2.325 1.00 . A A . 2 CYS O 1 1 19 8500 1 1 2 CYS SG S 6.958 -6.091 -1.468 1.00 . A A . 2 CYS SG 1 1 19 8501 1 1 3 SER C C 4.526 -2.914 -3.989 1.00 . A A . 3 SER C 1 1 19 8502 1 1 3 SER CA C 3.666 -4.078 -3.507 1.00 . A A . 3 SER CA 1 1 19 8503 1 1 3 SER CB C 2.214 -3.616 -3.313 1.00 . A A . 3 SER CB 1 1 19 8504 1 1 3 SER H H 4.877 -4.123 -1.778 1.00 . A A . 3 SER H 1 1 19 8505 1 1 3 SER HA H 3.691 -4.864 -4.246 1.00 . A A . 3 SER HA 1 1 19 8506 1 1 3 SER HB2 H 1.657 -4.393 -2.812 1.00 . A A . 3 SER HB2 1 1 19 8507 1 1 3 SER HB3 H 2.205 -2.720 -2.707 1.00 . A A . 3 SER HB3 1 1 19 8508 1 1 3 SER HG H 1.283 -4.158 -4.948 1.00 . A A . 3 SER HG 1 1 19 8509 1 1 3 SER N N 4.182 -4.616 -2.257 1.00 . A A . 3 SER N 1 1 19 8510 1 1 3 SER O O 5.155 -2.221 -3.184 1.00 . A A . 3 SER O 1 1 19 8511 1 1 3 SER OG O 1.586 -3.336 -4.551 1.00 . A A . 3 SER OG 1 1 19 8512 1 1 4 LYS C C 4.733 -0.282 -5.458 1.00 . A A . 4 LYS C 1 1 19 8513 1 1 4 LYS CA C 5.291 -1.624 -5.919 1.00 . A A . 4 LYS CA 1 1 19 8514 1 1 4 LYS CB C 5.211 -1.736 -7.446 1.00 . A A . 4 LYS CB 1 1 19 8515 1 1 4 LYS CD C 5.717 -0.751 -9.704 1.00 . A A . 4 LYS CD 1 1 19 8516 1 1 4 LYS CE C 4.292 -0.335 -10.047 1.00 . A A . 4 LYS CE 1 1 19 8517 1 1 4 LYS CG C 5.981 -0.665 -8.206 1.00 . A A . 4 LYS CG 1 1 19 8518 1 1 4 LYS H H 4.001 -3.294 -5.878 1.00 . A A . 4 LYS H 1 1 19 8519 1 1 4 LYS HA H 6.322 -1.707 -5.607 1.00 . A A . 4 LYS HA 1 1 19 8520 1 1 4 LYS HB2 H 5.600 -2.699 -7.741 1.00 . A A . 4 LYS HB2 1 1 19 8521 1 1 4 LYS HB3 H 4.173 -1.676 -7.741 1.00 . A A . 4 LYS HB3 1 1 19 8522 1 1 4 LYS HD2 H 6.404 -0.097 -10.219 1.00 . A A . 4 LYS HD2 1 1 19 8523 1 1 4 LYS HD3 H 5.873 -1.769 -10.030 1.00 . A A . 4 LYS HD3 1 1 19 8524 1 1 4 LYS HE2 H 3.714 -0.289 -9.135 1.00 . A A . 4 LYS HE2 1 1 19 8525 1 1 4 LYS HE3 H 4.317 0.644 -10.504 1.00 . A A . 4 LYS HE3 1 1 19 8526 1 1 4 LYS HG2 H 5.674 0.307 -7.850 1.00 . A A . 4 LYS HG2 1 1 19 8527 1 1 4 LYS HG3 H 7.038 -0.799 -8.027 1.00 . A A . 4 LYS HG3 1 1 19 8528 1 1 4 LYS HZ1 H 2.749 -0.888 -11.344 1.00 . A A . 4 LYS HZ1 1 1 19 8529 1 1 4 LYS HZ2 H 3.411 -2.182 -10.478 1.00 . A A . 4 LYS HZ2 1 1 19 8530 1 1 4 LYS HZ3 H 4.263 -1.506 -11.781 1.00 . A A . 4 LYS HZ3 1 1 19 8531 1 1 4 LYS N N 4.535 -2.707 -5.304 1.00 . A A . 4 LYS N 1 1 19 8532 1 1 4 LYS NZ N 3.638 -1.290 -10.983 1.00 . A A . 4 LYS NZ 1 1 19 8533 1 1 4 LYS O O 3.534 -0.153 -5.216 1.00 . A A . 4 LYS O 1 1 19 8534 1 1 5 LYS C C 3.998 2.554 -5.672 1.00 . A A . 5 LYS C 1 1 19 8535 1 1 5 LYS CA C 5.172 2.023 -4.860 1.00 . A A . 5 LYS CA 1 1 19 8536 1 1 5 LYS CB C 6.340 3.017 -4.897 1.00 . A A . 5 LYS CB 1 1 19 8537 1 1 5 LYS CD C 7.030 5.347 -4.221 1.00 . A A . 5 LYS CD 1 1 19 8538 1 1 5 LYS CE C 6.610 6.808 -4.199 1.00 . A A . 5 LYS CE 1 1 19 8539 1 1 5 LYS CG C 5.908 4.467 -4.735 1.00 . A A . 5 LYS CG 1 1 19 8540 1 1 5 LYS H H 6.547 0.549 -5.503 1.00 . A A . 5 LYS H 1 1 19 8541 1 1 5 LYS HA H 4.844 1.914 -3.842 1.00 . A A . 5 LYS HA 1 1 19 8542 1 1 5 LYS HB2 H 7.028 2.777 -4.099 1.00 . A A . 5 LYS HB2 1 1 19 8543 1 1 5 LYS HB3 H 6.852 2.919 -5.843 1.00 . A A . 5 LYS HB3 1 1 19 8544 1 1 5 LYS HD2 H 7.287 5.041 -3.218 1.00 . A A . 5 LYS HD2 1 1 19 8545 1 1 5 LYS HD3 H 7.888 5.237 -4.866 1.00 . A A . 5 LYS HD3 1 1 19 8546 1 1 5 LYS HE2 H 6.796 7.235 -5.175 1.00 . A A . 5 LYS HE2 1 1 19 8547 1 1 5 LYS HE3 H 5.552 6.866 -3.981 1.00 . A A . 5 LYS HE3 1 1 19 8548 1 1 5 LYS HG2 H 5.582 4.846 -5.687 1.00 . A A . 5 LYS HG2 1 1 19 8549 1 1 5 LYS HG3 H 5.087 4.506 -4.042 1.00 . A A . 5 LYS HG3 1 1 19 8550 1 1 5 LYS HZ1 H 7.074 8.580 -3.197 1.00 . A A . 5 LYS HZ1 1 1 19 8551 1 1 5 LYS HZ2 H 8.385 7.528 -3.366 1.00 . A A . 5 LYS HZ2 1 1 19 8552 1 1 5 LYS HZ3 H 7.177 7.196 -2.222 1.00 . A A . 5 LYS HZ3 1 1 19 8553 1 1 5 LYS N N 5.599 0.709 -5.315 1.00 . A A . 5 LYS N 1 1 19 8554 1 1 5 LYS NZ N 7.367 7.585 -3.181 1.00 . A A . 5 LYS NZ 1 1 19 8555 1 1 5 LYS O O 2.898 2.705 -5.168 1.00 . A A . 5 LYS O 1 1 19 8556 1 1 6 TRP C C 2.281 2.210 -8.276 1.00 . A A . 6 TRP C 1 1 19 8557 1 1 6 TRP CA C 3.168 3.337 -7.767 1.00 . A A . 6 TRP CA 1 1 19 8558 1 1 6 TRP CB C 3.765 4.140 -8.925 1.00 . A A . 6 TRP CB 1 1 19 8559 1 1 6 TRP CD1 C 6.217 4.657 -8.362 1.00 . A A . 6 TRP CD1 1 1 19 8560 1 1 6 TRP CD2 C 4.853 6.421 -8.180 1.00 . A A . 6 TRP CD2 1 1 19 8561 1 1 6 TRP CE2 C 6.165 6.832 -7.869 1.00 . A A . 6 TRP CE2 1 1 19 8562 1 1 6 TRP CE3 C 3.827 7.366 -8.124 1.00 . A A . 6 TRP CE3 1 1 19 8563 1 1 6 TRP CG C 4.912 5.027 -8.514 1.00 . A A . 6 TRP CG 1 1 19 8564 1 1 6 TRP CH2 C 5.444 9.043 -7.464 1.00 . A A . 6 TRP CH2 1 1 19 8565 1 1 6 TRP CZ2 C 6.471 8.142 -7.509 1.00 . A A . 6 TRP CZ2 1 1 19 8566 1 1 6 TRP CZ3 C 4.131 8.664 -7.764 1.00 . A A . 6 TRP CZ3 1 1 19 8567 1 1 6 TRP H H 5.100 2.667 -7.295 1.00 . A A . 6 TRP H 1 1 19 8568 1 1 6 TRP HA H 2.557 3.998 -7.160 1.00 . A A . 6 TRP HA 1 1 19 8569 1 1 6 TRP HB2 H 4.127 3.457 -9.679 1.00 . A A . 6 TRP HB2 1 1 19 8570 1 1 6 TRP HB3 H 2.996 4.766 -9.354 1.00 . A A . 6 TRP HB3 1 1 19 8571 1 1 6 TRP HD1 H 6.585 3.657 -8.522 1.00 . A A . 6 TRP HD1 1 1 19 8572 1 1 6 TRP HE1 H 7.946 5.726 -7.837 1.00 . A A . 6 TRP HE1 1 1 19 8573 1 1 6 TRP HE3 H 2.809 7.092 -8.344 1.00 . A A . 6 TRP HE3 1 1 19 8574 1 1 6 TRP HH2 H 5.636 10.069 -7.186 1.00 . A A . 6 TRP HH2 1 1 19 8575 1 1 6 TRP HZ2 H 7.479 8.450 -7.275 1.00 . A A . 6 TRP HZ2 1 1 19 8576 1 1 6 TRP HZ3 H 3.347 9.406 -7.717 1.00 . A A . 6 TRP HZ3 1 1 19 8577 1 1 6 TRP N N 4.222 2.821 -6.925 1.00 . A A . 6 TRP N 1 1 19 8578 1 1 6 TRP NE1 N 6.978 5.737 -7.989 1.00 . A A . 6 TRP NE1 1 1 19 8579 1 1 6 TRP O O 1.766 2.272 -9.391 1.00 . A A . 6 TRP O 1 1 19 8580 1 1 7 GLU C C -0.221 0.419 -7.579 1.00 . A A . 7 GLU C 1 1 19 8581 1 1 7 GLU CA C 1.247 0.058 -7.841 1.00 . A A . 7 GLU CA 1 1 19 8582 1 1 7 GLU CB C 1.624 -1.228 -7.098 1.00 . A A . 7 GLU CB 1 1 19 8583 1 1 7 GLU CD C 1.852 -2.719 -9.116 1.00 . A A . 7 GLU CD 1 1 19 8584 1 1 7 GLU CG C 1.149 -2.496 -7.795 1.00 . A A . 7 GLU CG 1 1 19 8585 1 1 7 GLU H H 2.550 1.182 -6.558 1.00 . A A . 7 GLU H 1 1 19 8586 1 1 7 GLU HA H 1.377 -0.098 -8.904 1.00 . A A . 7 GLU HA 1 1 19 8587 1 1 7 GLU HB2 H 2.699 -1.275 -7.006 1.00 . A A . 7 GLU HB2 1 1 19 8588 1 1 7 GLU HB3 H 1.188 -1.201 -6.110 1.00 . A A . 7 GLU HB3 1 1 19 8589 1 1 7 GLU HG2 H 1.343 -3.341 -7.152 1.00 . A A . 7 GLU HG2 1 1 19 8590 1 1 7 GLU HG3 H 0.087 -2.417 -7.976 1.00 . A A . 7 GLU HG3 1 1 19 8591 1 1 7 GLU N N 2.101 1.178 -7.452 1.00 . A A . 7 GLU N 1 1 19 8592 1 1 7 GLU O O -0.717 1.426 -8.079 1.00 . A A . 7 GLU O 1 1 19 8593 1 1 7 GLU OE1 O 3.048 -3.075 -9.105 1.00 . A A . 7 GLU OE1 1 1 19 8594 1 1 7 GLU OE2 O 1.239 -2.485 -10.172 1.00 . A A . 7 GLU OE2 1 1 19 8595 1 1 8 TYR C C -2.713 -1.074 -5.314 1.00 . A A . 8 TYR C 1 1 19 8596 1 1 8 TYR CA C -2.309 -0.172 -6.477 1.00 . A A . 8 TYR CA 1 1 19 8597 1 1 8 TYR CB C -3.174 -0.465 -7.713 1.00 . A A . 8 TYR CB 1 1 19 8598 1 1 8 TYR CD1 C -4.500 1.678 -7.527 1.00 . A A . 8 TYR CD1 1 1 19 8599 1 1 8 TYR CD2 C -5.666 -0.321 -8.091 1.00 . A A . 8 TYR CD2 1 1 19 8600 1 1 8 TYR CE1 C -5.681 2.392 -7.592 1.00 . A A . 8 TYR CE1 1 1 19 8601 1 1 8 TYR CE2 C -6.853 0.386 -8.158 1.00 . A A . 8 TYR CE2 1 1 19 8602 1 1 8 TYR CG C -4.471 0.312 -7.774 1.00 . A A . 8 TYR CG 1 1 19 8603 1 1 8 TYR CZ C -6.854 1.741 -7.907 1.00 . A A . 8 TYR CZ 1 1 19 8604 1 1 8 TYR H H -0.460 -1.193 -6.425 1.00 . A A . 8 TYR H 1 1 19 8605 1 1 8 TYR HA H -2.424 0.864 -6.184 1.00 . A A . 8 TYR HA 1 1 19 8606 1 1 8 TYR HB2 H -2.608 -0.224 -8.600 1.00 . A A . 8 TYR HB2 1 1 19 8607 1 1 8 TYR HB3 H -3.417 -1.517 -7.727 1.00 . A A . 8 TYR HB3 1 1 19 8608 1 1 8 TYR HD1 H -3.579 2.185 -7.279 1.00 . A A . 8 TYR HD1 1 1 19 8609 1 1 8 TYR HD2 H -5.662 -1.384 -8.286 1.00 . A A . 8 TYR HD2 1 1 19 8610 1 1 8 TYR HE1 H -5.681 3.454 -7.398 1.00 . A A . 8 TYR HE1 1 1 19 8611 1 1 8 TYR HE2 H -7.771 -0.125 -8.404 1.00 . A A . 8 TYR HE2 1 1 19 8612 1 1 8 TYR HH H -7.882 3.347 -7.668 1.00 . A A . 8 TYR HH 1 1 19 8613 1 1 8 TYR N N -0.907 -0.404 -6.795 1.00 . A A . 8 TYR N 1 1 19 8614 1 1 8 TYR O O -3.634 -1.881 -5.425 1.00 . A A . 8 TYR O 1 1 19 8615 1 1 8 TYR OH O -8.032 2.450 -7.973 1.00 . A A . 8 TYR OH 1 1 19 8616 1 1 9 CYS C C -3.627 -1.558 -2.448 1.00 . A A . 9 CYS C 1 1 19 8617 1 1 9 CYS CA C -2.222 -1.758 -3.014 1.00 . A A . 9 CYS CA 1 1 19 8618 1 1 9 CYS CB C -1.173 -1.430 -1.949 1.00 . A A . 9 CYS CB 1 1 19 8619 1 1 9 CYS H H -1.251 -0.299 -4.200 1.00 . A A . 9 CYS H 1 1 19 8620 1 1 9 CYS HA H -2.113 -2.793 -3.299 1.00 . A A . 9 CYS HA 1 1 19 8621 1 1 9 CYS HB2 H -1.508 -1.810 -0.995 1.00 . A A . 9 CYS HB2 1 1 19 8622 1 1 9 CYS HB3 H -0.240 -1.907 -2.213 1.00 . A A . 9 CYS HB3 1 1 19 8623 1 1 9 CYS N N -1.985 -0.947 -4.208 1.00 . A A . 9 CYS N 1 1 19 8624 1 1 9 CYS O O -4.346 -2.528 -2.227 1.00 . A A . 9 CYS O 1 1 19 8625 1 1 9 CYS SG S -0.849 0.356 -1.752 1.00 . A A . 9 CYS SG 1 1 19 8626 1 1 10 ILE C C -5.470 -0.429 -0.227 1.00 . A A . 10 ILE C 1 1 19 8627 1 1 10 ILE CA C -5.313 0.059 -1.670 1.00 . A A . 10 ILE CA 1 1 19 8628 1 1 10 ILE CB C -6.473 -0.514 -2.518 1.00 . A A . 10 ILE CB 1 1 19 8629 1 1 10 ILE CD1 C -7.443 -0.606 -4.870 1.00 . A A . 10 ILE CD1 1 1 19 8630 1 1 10 ILE CG1 C -6.379 -0.023 -3.965 1.00 . A A . 10 ILE CG1 1 1 19 8631 1 1 10 ILE CG2 C -7.818 -0.132 -1.912 1.00 . A A . 10 ILE CG2 1 1 19 8632 1 1 10 ILE H H -3.365 0.421 -2.419 1.00 . A A . 10 ILE H 1 1 19 8633 1 1 10 ILE HA H -5.391 1.138 -1.679 1.00 . A A . 10 ILE HA 1 1 19 8634 1 1 10 ILE HB H -6.395 -1.591 -2.507 1.00 . A A . 10 ILE HB 1 1 19 8635 1 1 10 ILE HD11 H -7.039 -0.734 -5.863 1.00 . A A . 10 ILE HD11 1 1 19 8636 1 1 10 ILE HD12 H -8.288 0.064 -4.909 1.00 . A A . 10 ILE HD12 1 1 19 8637 1 1 10 ILE HD13 H -7.758 -1.563 -4.484 1.00 . A A . 10 ILE HD13 1 1 19 8638 1 1 10 ILE HG12 H -6.482 1.052 -3.981 1.00 . A A . 10 ILE HG12 1 1 19 8639 1 1 10 ILE HG13 H -5.413 -0.294 -4.368 1.00 . A A . 10 ILE HG13 1 1 19 8640 1 1 10 ILE HG21 H -8.586 -0.785 -2.300 1.00 . A A . 10 ILE HG21 1 1 19 8641 1 1 10 ILE HG22 H -8.051 0.891 -2.169 1.00 . A A . 10 ILE HG22 1 1 19 8642 1 1 10 ILE HG23 H -7.770 -0.231 -0.838 1.00 . A A . 10 ILE HG23 1 1 19 8643 1 1 10 ILE N N -3.998 -0.295 -2.218 1.00 . A A . 10 ILE N 1 1 19 8644 1 1 10 ILE O O -5.490 -1.627 0.040 1.00 . A A . 10 ILE O 1 1 19 8645 1 1 11 VAL C C -7.255 -0.117 2.407 1.00 . A A . 11 VAL C 1 1 19 8646 1 1 11 VAL CA C -5.780 0.143 2.101 1.00 . A A . 11 VAL CA 1 1 19 8647 1 1 11 VAL CB C -5.221 1.223 3.056 1.00 . A A . 11 VAL CB 1 1 19 8648 1 1 11 VAL CG1 C -3.700 1.233 3.017 1.00 . A A . 11 VAL CG1 1 1 19 8649 1 1 11 VAL CG2 C -5.768 2.602 2.710 1.00 . A A . 11 VAL CG2 1 1 19 8650 1 1 11 VAL H H -5.600 1.446 0.446 1.00 . A A . 11 VAL H 1 1 19 8651 1 1 11 VAL HA H -5.230 -0.773 2.272 1.00 . A A . 11 VAL HA 1 1 19 8652 1 1 11 VAL HB H -5.529 0.979 4.064 1.00 . A A . 11 VAL HB 1 1 19 8653 1 1 11 VAL HG11 H -3.321 0.395 3.583 1.00 . A A . 11 VAL HG11 1 1 19 8654 1 1 11 VAL HG12 H -3.335 2.153 3.446 1.00 . A A . 11 VAL HG12 1 1 19 8655 1 1 11 VAL HG13 H -3.367 1.155 1.992 1.00 . A A . 11 VAL HG13 1 1 19 8656 1 1 11 VAL HG21 H -5.755 2.734 1.638 1.00 . A A . 11 VAL HG21 1 1 19 8657 1 1 11 VAL HG22 H -5.154 3.360 3.173 1.00 . A A . 11 VAL HG22 1 1 19 8658 1 1 11 VAL HG23 H -6.781 2.689 3.072 1.00 . A A . 11 VAL HG23 1 1 19 8659 1 1 11 VAL N N -5.603 0.503 0.703 1.00 . A A . 11 VAL N 1 1 19 8660 1 1 11 VAL O O -8.114 0.726 2.142 1.00 . A A . 11 VAL O 1 1 19 8661 1 1 12 PRO C C -9.485 -0.829 4.452 1.00 . A A . 12 PRO C 1 1 19 8662 1 1 12 PRO CA C -8.944 -1.664 3.296 1.00 . A A . 12 PRO CA 1 1 19 8663 1 1 12 PRO CB C -8.843 -3.139 3.694 1.00 . A A . 12 PRO CB 1 1 19 8664 1 1 12 PRO CD C -6.612 -2.365 3.289 1.00 . A A . 12 PRO CD 1 1 19 8665 1 1 12 PRO CG C -7.424 -3.331 4.106 1.00 . A A . 12 PRO CG 1 1 19 8666 1 1 12 PRO HA H -9.600 -1.561 2.443 1.00 . A A . 12 PRO HA 1 1 19 8667 1 1 12 PRO HB2 H -9.522 -3.342 4.508 1.00 . A A . 12 PRO HB2 1 1 19 8668 1 1 12 PRO HB3 H -9.094 -3.759 2.846 1.00 . A A . 12 PRO HB3 1 1 19 8669 1 1 12 PRO HD2 H -5.790 -1.977 3.871 1.00 . A A . 12 PRO HD2 1 1 19 8670 1 1 12 PRO HD3 H -6.248 -2.844 2.392 1.00 . A A . 12 PRO HD3 1 1 19 8671 1 1 12 PRO HG2 H -7.317 -3.113 5.159 1.00 . A A . 12 PRO HG2 1 1 19 8672 1 1 12 PRO HG3 H -7.118 -4.346 3.900 1.00 . A A . 12 PRO HG3 1 1 19 8673 1 1 12 PRO N N -7.570 -1.297 2.960 1.00 . A A . 12 PRO N 1 1 19 8674 1 1 12 PRO O O -8.777 -0.569 5.420 1.00 . A A . 12 PRO O 1 1 19 8675 1 1 13 ILE C C -11.262 -0.222 6.747 1.00 . A A . 13 ILE C 1 1 19 8676 1 1 13 ILE CA C -11.381 0.412 5.359 1.00 . A A . 13 ILE CA 1 1 19 8677 1 1 13 ILE CB C -12.875 0.641 5.025 1.00 . A A . 13 ILE CB 1 1 19 8678 1 1 13 ILE CD1 C -12.325 2.598 3.474 1.00 . A A . 13 ILE CD1 1 1 19 8679 1 1 13 ILE CG1 C -13.025 1.262 3.631 1.00 . A A . 13 ILE CG1 1 1 19 8680 1 1 13 ILE CG2 C -13.539 1.526 6.075 1.00 . A A . 13 ILE CG2 1 1 19 8681 1 1 13 ILE H H -11.241 -0.643 3.530 1.00 . A A . 13 ILE H 1 1 19 8682 1 1 13 ILE HA H -10.888 1.374 5.373 1.00 . A A . 13 ILE HA 1 1 19 8683 1 1 13 ILE HB H -13.371 -0.318 5.037 1.00 . A A . 13 ILE HB 1 1 19 8684 1 1 13 ILE HD11 H -11.793 2.617 2.534 1.00 . A A . 13 ILE HD11 1 1 19 8685 1 1 13 ILE HD12 H -11.626 2.736 4.286 1.00 . A A . 13 ILE HD12 1 1 19 8686 1 1 13 ILE HD13 H -13.057 3.392 3.491 1.00 . A A . 13 ILE HD13 1 1 19 8687 1 1 13 ILE HG12 H -12.610 0.586 2.898 1.00 . A A . 13 ILE HG12 1 1 19 8688 1 1 13 ILE HG13 H -14.074 1.411 3.422 1.00 . A A . 13 ILE HG13 1 1 19 8689 1 1 13 ILE HG21 H -14.157 2.262 5.586 1.00 . A A . 13 ILE HG21 1 1 19 8690 1 1 13 ILE HG22 H -12.778 2.023 6.659 1.00 . A A . 13 ILE HG22 1 1 19 8691 1 1 13 ILE HG23 H -14.149 0.915 6.725 1.00 . A A . 13 ILE HG23 1 1 19 8692 1 1 13 ILE N N -10.736 -0.408 4.335 1.00 . A A . 13 ILE N 1 1 19 8693 1 1 13 ILE O O -11.079 0.471 7.745 1.00 . A A . 13 ILE O 1 1 19 8694 1 1 14 LEU C C -9.863 -2.780 8.331 1.00 . A A . 14 LEU C 1 1 19 8695 1 1 14 LEU CA C -11.279 -2.256 8.072 1.00 . A A . 14 LEU CA 1 1 19 8696 1 1 14 LEU CB C -12.278 -3.423 8.115 1.00 . A A . 14 LEU CB 1 1 19 8697 1 1 14 LEU CD1 C -13.961 -2.042 9.378 1.00 . A A . 14 LEU CD1 1 1 19 8698 1 1 14 LEU CD2 C -14.309 -2.492 6.937 1.00 . A A . 14 LEU CD2 1 1 19 8699 1 1 14 LEU CG C -13.760 -3.041 8.248 1.00 . A A . 14 LEU CG 1 1 19 8700 1 1 14 LEU H H -11.516 -2.047 5.981 1.00 . A A . 14 LEU H 1 1 19 8701 1 1 14 LEU HA H -11.531 -1.558 8.856 1.00 . A A . 14 LEU HA 1 1 19 8702 1 1 14 LEU HB2 H -12.161 -3.998 7.208 1.00 . A A . 14 LEU HB2 1 1 19 8703 1 1 14 LEU HB3 H -12.019 -4.055 8.952 1.00 . A A . 14 LEU HB3 1 1 19 8704 1 1 14 LEU HD11 H -13.007 -1.616 9.656 1.00 . A A . 14 LEU HD11 1 1 19 8705 1 1 14 LEU HD12 H -14.393 -2.545 10.231 1.00 . A A . 14 LEU HD12 1 1 19 8706 1 1 14 LEU HD13 H -14.624 -1.255 9.050 1.00 . A A . 14 LEU HD13 1 1 19 8707 1 1 14 LEU HD21 H -15.334 -2.185 7.077 1.00 . A A . 14 LEU HD21 1 1 19 8708 1 1 14 LEU HD22 H -14.262 -3.260 6.179 1.00 . A A . 14 LEU HD22 1 1 19 8709 1 1 14 LEU HD23 H -13.718 -1.644 6.627 1.00 . A A . 14 LEU HD23 1 1 19 8710 1 1 14 LEU HG H -14.325 -3.929 8.496 1.00 . A A . 14 LEU HG 1 1 19 8711 1 1 14 LEU N N -11.371 -1.543 6.805 1.00 . A A . 14 LEU N 1 1 19 8712 1 1 14 LEU O O -9.693 -3.831 8.948 1.00 . A A . 14 LEU O 1 1 19 8713 1 1 15 GLY C C -6.473 -1.702 7.294 1.00 . A A . 15 GLY C 1 1 19 8714 1 1 15 GLY CA C -7.484 -2.491 8.097 1.00 . A A . 15 GLY CA 1 1 19 8715 1 1 15 GLY H H -9.023 -1.215 7.383 1.00 . A A . 15 GLY H 1 1 19 8716 1 1 15 GLY HA2 H -7.253 -2.385 9.147 1.00 . A A . 15 GLY HA2 1 1 19 8717 1 1 15 GLY HA3 H -7.404 -3.535 7.828 1.00 . A A . 15 GLY HA3 1 1 19 8718 1 1 15 GLY N N -8.849 -2.054 7.872 1.00 . A A . 15 GLY N 1 1 19 8719 1 1 15 GLY O O -6.621 -0.495 7.115 1.00 . A A . 15 GLY O 1 1 19 8720 1 1 16 PHE C C -3.428 -2.842 5.510 1.00 . A A . 16 PHE C 1 1 19 8721 1 1 16 PHE CA C -4.392 -1.775 6.014 1.00 . A A . 16 PHE CA 1 1 19 8722 1 1 16 PHE CB C -3.639 -0.697 6.819 1.00 . A A . 16 PHE CB 1 1 19 8723 1 1 16 PHE CD1 C -1.885 -1.929 8.151 1.00 . A A . 16 PHE CD1 1 1 19 8724 1 1 16 PHE CD2 C -3.653 -0.844 9.328 1.00 . A A . 16 PHE CD2 1 1 19 8725 1 1 16 PHE CE1 C -1.343 -2.352 9.349 1.00 . A A . 16 PHE CE1 1 1 19 8726 1 1 16 PHE CE2 C -3.113 -1.263 10.529 1.00 . A A . 16 PHE CE2 1 1 19 8727 1 1 16 PHE CG C -3.048 -1.173 8.124 1.00 . A A . 16 PHE CG 1 1 19 8728 1 1 16 PHE CZ C -1.958 -2.018 10.540 1.00 . A A . 16 PHE CZ 1 1 19 8729 1 1 16 PHE H H -5.393 -3.354 6.994 1.00 . A A . 16 PHE H 1 1 19 8730 1 1 16 PHE HA H -4.862 -1.308 5.161 1.00 . A A . 16 PHE HA 1 1 19 8731 1 1 16 PHE HB2 H -2.830 -0.315 6.216 1.00 . A A . 16 PHE HB2 1 1 19 8732 1 1 16 PHE HB3 H -4.322 0.110 7.040 1.00 . A A . 16 PHE HB3 1 1 19 8733 1 1 16 PHE HD1 H -1.403 -2.191 7.220 1.00 . A A . 16 PHE HD1 1 1 19 8734 1 1 16 PHE HD2 H -4.559 -0.257 9.321 1.00 . A A . 16 PHE HD2 1 1 19 8735 1 1 16 PHE HE1 H -0.439 -2.943 9.355 1.00 . A A . 16 PHE HE1 1 1 19 8736 1 1 16 PHE HE2 H -3.595 -0.999 11.459 1.00 . A A . 16 PHE HE2 1 1 19 8737 1 1 16 PHE HZ H -1.534 -2.346 11.478 1.00 . A A . 16 PHE HZ 1 1 19 8738 1 1 16 PHE N N -5.446 -2.393 6.811 1.00 . A A . 16 PHE N 1 1 19 8739 1 1 16 PHE O O -3.200 -3.849 6.180 1.00 . A A . 16 PHE O 1 1 19 8740 1 1 17 VAL C C -0.508 -3.141 4.121 1.00 . A A . 17 VAL C 1 1 19 8741 1 1 17 VAL CA C -1.924 -3.567 3.747 1.00 . A A . 17 VAL CA 1 1 19 8742 1 1 17 VAL CB C -2.054 -3.642 2.206 1.00 . A A . 17 VAL CB 1 1 19 8743 1 1 17 VAL CG1 C -1.588 -4.994 1.681 1.00 . A A . 17 VAL CG1 1 1 19 8744 1 1 17 VAL CG2 C -3.482 -3.365 1.765 1.00 . A A . 17 VAL CG2 1 1 19 8745 1 1 17 VAL H H -3.090 -1.804 3.840 1.00 . A A . 17 VAL H 1 1 19 8746 1 1 17 VAL HA H -2.119 -4.545 4.161 1.00 . A A . 17 VAL HA 1 1 19 8747 1 1 17 VAL HB H -1.416 -2.883 1.778 1.00 . A A . 17 VAL HB 1 1 19 8748 1 1 17 VAL HG11 H -2.410 -5.491 1.186 1.00 . A A . 17 VAL HG11 1 1 19 8749 1 1 17 VAL HG12 H -1.243 -5.601 2.505 1.00 . A A . 17 VAL HG12 1 1 19 8750 1 1 17 VAL HG13 H -0.781 -4.849 0.978 1.00 . A A . 17 VAL HG13 1 1 19 8751 1 1 17 VAL HG21 H -4.044 -2.967 2.597 1.00 . A A . 17 VAL HG21 1 1 19 8752 1 1 17 VAL HG22 H -3.939 -4.285 1.429 1.00 . A A . 17 VAL HG22 1 1 19 8753 1 1 17 VAL HG23 H -3.478 -2.649 0.957 1.00 . A A . 17 VAL HG23 1 1 19 8754 1 1 17 VAL N N -2.871 -2.623 4.328 1.00 . A A . 17 VAL N 1 1 19 8755 1 1 17 VAL O O -0.323 -2.220 4.916 1.00 . A A . 17 VAL O 1 1 19 8756 1 1 18 TYR C C 2.700 -3.531 2.545 1.00 . A A . 18 TYR C 1 1 19 8757 1 1 18 TYR CA C 1.868 -3.449 3.816 1.00 . A A . 18 TYR CA 1 1 19 8758 1 1 18 TYR CB C 2.448 -4.354 4.918 1.00 . A A . 18 TYR CB 1 1 19 8759 1 1 18 TYR CD1 C 3.652 -6.339 3.908 1.00 . A A . 18 TYR CD1 1 1 19 8760 1 1 18 TYR CD2 C 1.515 -6.706 4.899 1.00 . A A . 18 TYR CD2 1 1 19 8761 1 1 18 TYR CE1 C 3.743 -7.681 3.596 1.00 . A A . 18 TYR CE1 1 1 19 8762 1 1 18 TYR CE2 C 1.601 -8.051 4.593 1.00 . A A . 18 TYR CE2 1 1 19 8763 1 1 18 TYR CG C 2.537 -5.826 4.561 1.00 . A A . 18 TYR CG 1 1 19 8764 1 1 18 TYR CZ C 2.717 -8.532 3.941 1.00 . A A . 18 TYR CZ 1 1 19 8765 1 1 18 TYR H H 0.282 -4.502 2.901 1.00 . A A . 18 TYR H 1 1 19 8766 1 1 18 TYR HA H 1.885 -2.428 4.166 1.00 . A A . 18 TYR HA 1 1 19 8767 1 1 18 TYR HB2 H 3.444 -4.018 5.156 1.00 . A A . 18 TYR HB2 1 1 19 8768 1 1 18 TYR HB3 H 1.829 -4.266 5.801 1.00 . A A . 18 TYR HB3 1 1 19 8769 1 1 18 TYR HD1 H 4.455 -5.669 3.640 1.00 . A A . 18 TYR HD1 1 1 19 8770 1 1 18 TYR HD2 H 0.641 -6.325 5.407 1.00 . A A . 18 TYR HD2 1 1 19 8771 1 1 18 TYR HE1 H 4.617 -8.058 3.085 1.00 . A A . 18 TYR HE1 1 1 19 8772 1 1 18 TYR HE2 H 0.796 -8.718 4.864 1.00 . A A . 18 TYR HE2 1 1 19 8773 1 1 18 TYR HH H 2.916 -10.378 4.454 1.00 . A A . 18 TYR HH 1 1 19 8774 1 1 18 TYR N N 0.484 -3.788 3.540 1.00 . A A . 18 TYR N 1 1 19 8775 1 1 18 TYR O O 2.549 -4.452 1.740 1.00 . A A . 18 TYR O 1 1 19 8776 1 1 18 TYR OH O 2.807 -9.876 3.635 1.00 . A A . 18 TYR OH 1 1 19 8777 1 1 19 CYS C C 5.785 -3.093 1.511 1.00 . A A . 19 CYS C 1 1 19 8778 1 1 19 CYS CA C 4.431 -2.490 1.204 1.00 . A A . 19 CYS CA 1 1 19 8779 1 1 19 CYS CB C 4.610 -1.045 0.769 1.00 . A A . 19 CYS CB 1 1 19 8780 1 1 19 CYS H H 3.632 -1.849 3.045 1.00 . A A . 19 CYS H 1 1 19 8781 1 1 19 CYS HA H 3.966 -3.046 0.405 1.00 . A A . 19 CYS HA 1 1 19 8782 1 1 19 CYS HB2 H 4.644 -0.437 1.653 1.00 . A A . 19 CYS HB2 1 1 19 8783 1 1 19 CYS HB3 H 5.548 -0.940 0.233 1.00 . A A . 19 CYS HB3 1 1 19 8784 1 1 19 CYS N N 3.567 -2.553 2.368 1.00 . A A . 19 CYS N 1 1 19 8785 1 1 19 CYS O O 6.019 -3.588 2.614 1.00 . A A . 19 CYS O 1 1 19 8786 1 1 19 CYS SG S 3.272 -0.397 -0.282 1.00 . A A . 19 CYS SG 1 1 19 8787 1 1 20 CYS C C 8.769 -2.642 1.628 1.00 . A A . 20 CYS C 1 1 19 8788 1 1 20 CYS CA C 8.012 -3.577 0.706 1.00 . A A . 20 CYS CA 1 1 19 8789 1 1 20 CYS CB C 8.721 -3.693 -0.642 1.00 . A A . 20 CYS CB 1 1 19 8790 1 1 20 CYS H H 6.434 -2.632 -0.321 1.00 . A A . 20 CYS H 1 1 19 8791 1 1 20 CYS HA H 7.934 -4.553 1.164 1.00 . A A . 20 CYS HA 1 1 19 8792 1 1 20 CYS HB2 H 9.122 -2.726 -0.904 1.00 . A A . 20 CYS HB2 1 1 19 8793 1 1 20 CYS HB3 H 9.533 -4.398 -0.550 1.00 . A A . 20 CYS HB3 1 1 19 8794 1 1 20 CYS N N 6.676 -3.046 0.533 1.00 . A A . 20 CYS N 1 1 19 8795 1 1 20 CYS O O 8.445 -1.454 1.684 1.00 . A A . 20 CYS O 1 1 19 8796 1 1 20 CYS SG S 7.644 -4.252 -2.018 1.00 . A A . 20 CYS SG 1 1 19 8797 1 1 21 PRO C C 11.035 -1.043 2.645 1.00 . A A . 21 PRO C 1 1 19 8798 1 1 21 PRO CA C 10.517 -2.307 3.303 1.00 . A A . 21 PRO CA 1 1 19 8799 1 1 21 PRO CB C 11.666 -3.196 3.742 1.00 . A A . 21 PRO CB 1 1 19 8800 1 1 21 PRO CD C 10.209 -4.543 2.406 1.00 . A A . 21 PRO CD 1 1 19 8801 1 1 21 PRO CG C 11.141 -4.584 3.589 1.00 . A A . 21 PRO CG 1 1 19 8802 1 1 21 PRO HA H 9.921 -2.038 4.162 1.00 . A A . 21 PRO HA 1 1 19 8803 1 1 21 PRO HB2 H 12.526 -3.020 3.112 1.00 . A A . 21 PRO HB2 1 1 19 8804 1 1 21 PRO HB3 H 11.905 -2.969 4.768 1.00 . A A . 21 PRO HB3 1 1 19 8805 1 1 21 PRO HD2 H 10.740 -4.796 1.499 1.00 . A A . 21 PRO HD2 1 1 19 8806 1 1 21 PRO HD3 H 9.375 -5.211 2.553 1.00 . A A . 21 PRO HD3 1 1 19 8807 1 1 21 PRO HG2 H 11.957 -5.267 3.404 1.00 . A A . 21 PRO HG2 1 1 19 8808 1 1 21 PRO HG3 H 10.603 -4.874 4.481 1.00 . A A . 21 PRO HG3 1 1 19 8809 1 1 21 PRO N N 9.760 -3.141 2.378 1.00 . A A . 21 PRO N 1 1 19 8810 1 1 21 PRO O O 11.867 -1.080 1.738 1.00 . A A . 21 PRO O 1 1 19 8811 1 1 22 GLY C C 9.687 2.127 2.031 1.00 . A A . 22 GLY C 1 1 19 8812 1 1 22 GLY CA C 10.876 1.357 2.576 1.00 . A A . 22 GLY CA 1 1 19 8813 1 1 22 GLY H H 9.841 0.000 3.817 1.00 . A A . 22 GLY H 1 1 19 8814 1 1 22 GLY HA2 H 11.337 1.937 3.360 1.00 . A A . 22 GLY HA2 1 1 19 8815 1 1 22 GLY HA3 H 11.593 1.213 1.780 1.00 . A A . 22 GLY HA3 1 1 19 8816 1 1 22 GLY N N 10.505 0.066 3.108 1.00 . A A . 22 GLY N 1 1 19 8817 1 1 22 GLY O O 9.700 3.354 2.017 1.00 . A A . 22 GLY O 1 1 19 8818 1 1 23 LEU C C 6.265 1.828 1.895 1.00 . A A . 23 LEU C 1 1 19 8819 1 1 23 LEU CA C 7.484 2.047 1.002 1.00 . A A . 23 LEU CA 1 1 19 8820 1 1 23 LEU CB C 7.222 1.483 -0.394 1.00 . A A . 23 LEU CB 1 1 19 8821 1 1 23 LEU CD1 C 8.094 0.816 -2.645 1.00 . A A . 23 LEU CD1 1 1 19 8822 1 1 23 LEU CD2 C 8.695 3.045 -1.688 1.00 . A A . 23 LEU CD2 1 1 19 8823 1 1 23 LEU CG C 8.393 1.588 -1.371 1.00 . A A . 23 LEU CG 1 1 19 8824 1 1 23 LEU H H 8.706 0.426 1.590 1.00 . A A . 23 LEU H 1 1 19 8825 1 1 23 LEU HA H 7.679 3.106 0.925 1.00 . A A . 23 LEU HA 1 1 19 8826 1 1 23 LEU HB2 H 6.957 0.440 -0.292 1.00 . A A . 23 LEU HB2 1 1 19 8827 1 1 23 LEU HB3 H 6.380 2.009 -0.819 1.00 . A A . 23 LEU HB3 1 1 19 8828 1 1 23 LEU HD11 H 7.941 -0.226 -2.408 1.00 . A A . 23 LEU HD11 1 1 19 8829 1 1 23 LEU HD12 H 8.925 0.912 -3.328 1.00 . A A . 23 LEU HD12 1 1 19 8830 1 1 23 LEU HD13 H 7.202 1.214 -3.106 1.00 . A A . 23 LEU HD13 1 1 19 8831 1 1 23 LEU HD21 H 9.718 3.136 -2.023 1.00 . A A . 23 LEU HD21 1 1 19 8832 1 1 23 LEU HD22 H 8.554 3.644 -0.800 1.00 . A A . 23 LEU HD22 1 1 19 8833 1 1 23 LEU HD23 H 8.029 3.390 -2.464 1.00 . A A . 23 LEU HD23 1 1 19 8834 1 1 23 LEU HG H 9.272 1.154 -0.916 1.00 . A A . 23 LEU HG 1 1 19 8835 1 1 23 LEU N N 8.666 1.410 1.565 1.00 . A A . 23 LEU N 1 1 19 8836 1 1 23 LEU O O 6.179 0.823 2.608 1.00 . A A . 23 LEU O 1 1 19 8837 1 1 24 ILE C C 2.861 2.908 1.784 1.00 . A A . 24 ILE C 1 1 19 8838 1 1 24 ILE CA C 4.100 2.663 2.647 1.00 . A A . 24 ILE CA 1 1 19 8839 1 1 24 ILE CB C 4.102 3.655 3.834 1.00 . A A . 24 ILE CB 1 1 19 8840 1 1 24 ILE CD1 C 4.369 6.118 4.450 1.00 . A A . 24 ILE CD1 1 1 19 8841 1 1 24 ILE CG1 C 4.444 5.071 3.358 1.00 . A A . 24 ILE CG1 1 1 19 8842 1 1 24 ILE CG2 C 5.079 3.194 4.909 1.00 . A A . 24 ILE CG2 1 1 19 8843 1 1 24 ILE H H 5.445 3.542 1.252 1.00 . A A . 24 ILE H 1 1 19 8844 1 1 24 ILE HA H 4.050 1.661 3.046 1.00 . A A . 24 ILE HA 1 1 19 8845 1 1 24 ILE HB H 3.112 3.659 4.265 1.00 . A A . 24 ILE HB 1 1 19 8846 1 1 24 ILE HD11 H 4.126 7.076 4.013 1.00 . A A . 24 ILE HD11 1 1 19 8847 1 1 24 ILE HD12 H 5.322 6.182 4.953 1.00 . A A . 24 ILE HD12 1 1 19 8848 1 1 24 ILE HD13 H 3.603 5.843 5.160 1.00 . A A . 24 ILE HD13 1 1 19 8849 1 1 24 ILE HG12 H 5.450 5.078 2.965 1.00 . A A . 24 ILE HG12 1 1 19 8850 1 1 24 ILE HG13 H 3.756 5.356 2.576 1.00 . A A . 24 ILE HG13 1 1 19 8851 1 1 24 ILE HG21 H 5.760 2.469 4.489 1.00 . A A . 24 ILE HG21 1 1 19 8852 1 1 24 ILE HG22 H 4.531 2.744 5.723 1.00 . A A . 24 ILE HG22 1 1 19 8853 1 1 24 ILE HG23 H 5.635 4.043 5.276 1.00 . A A . 24 ILE HG23 1 1 19 8854 1 1 24 ILE N N 5.320 2.761 1.850 1.00 . A A . 24 ILE N 1 1 19 8855 1 1 24 ILE O O 2.814 3.850 0.998 1.00 . A A . 24 ILE O 1 1 19 8856 1 1 25 CYS C C -0.237 3.301 1.708 1.00 . A A . 25 CYS C 1 1 19 8857 1 1 25 CYS CA C 0.628 2.170 1.155 1.00 . A A . 25 CYS CA 1 1 19 8858 1 1 25 CYS CB C -0.143 0.846 1.170 1.00 . A A . 25 CYS CB 1 1 19 8859 1 1 25 CYS H H 1.954 1.312 2.564 1.00 . A A . 25 CYS H 1 1 19 8860 1 1 25 CYS HA H 0.898 2.407 0.137 1.00 . A A . 25 CYS HA 1 1 19 8861 1 1 25 CYS HB2 H 0.516 0.051 0.857 1.00 . A A . 25 CYS HB2 1 1 19 8862 1 1 25 CYS HB3 H -0.482 0.649 2.177 1.00 . A A . 25 CYS HB3 1 1 19 8863 1 1 25 CYS N N 1.861 2.046 1.928 1.00 . A A . 25 CYS N 1 1 19 8864 1 1 25 CYS O O -0.408 3.422 2.921 1.00 . A A . 25 CYS O 1 1 19 8865 1 1 25 CYS SG S -1.607 0.812 0.077 1.00 . A A . 25 CYS SG 1 1 19 8866 1 1 26 GLY C C -2.839 5.431 0.396 1.00 . A A . 26 GLY C 1 1 19 8867 1 1 26 GLY CA C -1.586 5.249 1.239 1.00 . A A . 26 GLY CA 1 1 19 8868 1 1 26 GLY H H -0.583 3.996 -0.139 1.00 . A A . 26 GLY H 1 1 19 8869 1 1 26 GLY HA2 H -1.881 5.092 2.266 1.00 . A A . 26 GLY HA2 1 1 19 8870 1 1 26 GLY HA3 H -0.997 6.152 1.183 1.00 . A A . 26 GLY HA3 1 1 19 8871 1 1 26 GLY N N -0.766 4.133 0.817 1.00 . A A . 26 GLY N 1 1 19 8872 1 1 26 GLY O O -3.781 4.645 0.505 1.00 . A A . 26 GLY O 1 1 19 8873 1 1 27 PRO C C -4.275 5.805 -2.432 1.00 . A A . 27 PRO C 1 1 19 8874 1 1 27 PRO CA C -4.041 6.809 -1.303 1.00 . A A . 27 PRO CA 1 1 19 8875 1 1 27 PRO CB C -3.694 8.190 -1.884 1.00 . A A . 27 PRO CB 1 1 19 8876 1 1 27 PRO CD C -1.808 7.473 -0.606 1.00 . A A . 27 PRO CD 1 1 19 8877 1 1 27 PRO CG C -2.550 8.691 -1.068 1.00 . A A . 27 PRO CG 1 1 19 8878 1 1 27 PRO HA H -4.944 6.886 -0.718 1.00 . A A . 27 PRO HA 1 1 19 8879 1 1 27 PRO HB2 H -3.417 8.083 -2.923 1.00 . A A . 27 PRO HB2 1 1 19 8880 1 1 27 PRO HB3 H -4.550 8.841 -1.802 1.00 . A A . 27 PRO HB3 1 1 19 8881 1 1 27 PRO HD2 H -1.098 7.154 -1.356 1.00 . A A . 27 PRO HD2 1 1 19 8882 1 1 27 PRO HD3 H -1.312 7.662 0.334 1.00 . A A . 27 PRO HD3 1 1 19 8883 1 1 27 PRO HG2 H -1.909 9.314 -1.674 1.00 . A A . 27 PRO HG2 1 1 19 8884 1 1 27 PRO HG3 H -2.922 9.245 -0.219 1.00 . A A . 27 PRO HG3 1 1 19 8885 1 1 27 PRO N N -2.883 6.485 -0.443 1.00 . A A . 27 PRO N 1 1 19 8886 1 1 27 PRO O O -4.212 6.153 -3.610 1.00 . A A . 27 PRO O 1 1 19 8887 1 1 28 PHE C C -3.536 3.148 -3.798 1.00 . A A . 28 PHE C 1 1 19 8888 1 1 28 PHE CA C -4.791 3.463 -2.984 1.00 . A A . 28 PHE CA 1 1 19 8889 1 1 28 PHE CB C -6.000 3.754 -3.911 1.00 . A A . 28 PHE CB 1 1 19 8890 1 1 28 PHE CD1 C -7.524 4.176 -1.946 1.00 . A A . 28 PHE CD1 1 1 19 8891 1 1 28 PHE CD2 C -8.416 3.078 -3.865 1.00 . A A . 28 PHE CD2 1 1 19 8892 1 1 28 PHE CE1 C -8.755 4.094 -1.324 1.00 . A A . 28 PHE CE1 1 1 19 8893 1 1 28 PHE CE2 C -9.650 2.994 -3.248 1.00 . A A . 28 PHE CE2 1 1 19 8894 1 1 28 PHE CG C -7.339 3.668 -3.224 1.00 . A A . 28 PHE CG 1 1 19 8895 1 1 28 PHE CZ C -9.819 3.503 -1.975 1.00 . A A . 28 PHE CZ 1 1 19 8896 1 1 28 PHE H H -4.560 4.374 -1.084 1.00 . A A . 28 PHE H 1 1 19 8897 1 1 28 PHE HA H -5.023 2.592 -2.388 1.00 . A A . 28 PHE HA 1 1 19 8898 1 1 28 PHE HB2 H -5.914 4.749 -4.326 1.00 . A A . 28 PHE HB2 1 1 19 8899 1 1 28 PHE HB3 H -6.004 3.036 -4.722 1.00 . A A . 28 PHE HB3 1 1 19 8900 1 1 28 PHE HD1 H -6.693 4.639 -1.436 1.00 . A A . 28 PHE HD1 1 1 19 8901 1 1 28 PHE HD2 H -8.286 2.679 -4.861 1.00 . A A . 28 PHE HD2 1 1 19 8902 1 1 28 PHE HE1 H -8.885 4.494 -0.329 1.00 . A A . 28 PHE HE1 1 1 19 8903 1 1 28 PHE HE2 H -10.480 2.531 -3.759 1.00 . A A . 28 PHE HE2 1 1 19 8904 1 1 28 PHE HZ H -10.782 3.438 -1.490 1.00 . A A . 28 PHE HZ 1 1 19 8905 1 1 28 PHE N N -4.540 4.563 -2.048 1.00 . A A . 28 PHE N 1 1 19 8906 1 1 28 PHE O O -3.587 2.396 -4.764 1.00 . A A . 28 PHE O 1 1 19 8907 1 1 29 VAL C C -0.049 3.558 -2.932 1.00 . A A . 29 VAL C 1 1 19 8908 1 1 29 VAL CA C -1.115 3.464 -4.002 1.00 . A A . 29 VAL CA 1 1 19 8909 1 1 29 VAL CB C -0.782 4.485 -5.129 1.00 . A A . 29 VAL CB 1 1 19 8910 1 1 29 VAL CG1 C -1.721 4.328 -6.316 1.00 . A A . 29 VAL CG1 1 1 19 8911 1 1 29 VAL CG2 C -0.828 5.911 -4.598 1.00 . A A . 29 VAL CG2 1 1 19 8912 1 1 29 VAL H H -2.421 4.256 -2.548 1.00 . A A . 29 VAL H 1 1 19 8913 1 1 29 VAL HA H -1.119 2.463 -4.423 1.00 . A A . 29 VAL HA 1 1 19 8914 1 1 29 VAL HB H 0.230 4.289 -5.479 1.00 . A A . 29 VAL HB 1 1 19 8915 1 1 29 VAL HG11 H -2.620 4.902 -6.143 1.00 . A A . 29 VAL HG11 1 1 19 8916 1 1 29 VAL HG12 H -1.978 3.287 -6.438 1.00 . A A . 29 VAL HG12 1 1 19 8917 1 1 29 VAL HG13 H -1.234 4.686 -7.211 1.00 . A A . 29 VAL HG13 1 1 19 8918 1 1 29 VAL HG21 H -0.475 6.591 -5.360 1.00 . A A . 29 VAL HG21 1 1 19 8919 1 1 29 VAL HG22 H -0.196 5.990 -3.725 1.00 . A A . 29 VAL HG22 1 1 19 8920 1 1 29 VAL HG23 H -1.843 6.164 -4.331 1.00 . A A . 29 VAL HG23 1 1 19 8921 1 1 29 VAL N N -2.402 3.694 -3.361 1.00 . A A . 29 VAL N 1 1 19 8922 1 1 29 VAL O O -0.293 4.124 -1.867 1.00 . A A . 29 VAL O 1 1 19 8923 1 1 30 CYS C C 3.031 4.312 -2.456 1.00 . A A . 30 CYS C 1 1 19 8924 1 1 30 CYS CA C 2.195 3.052 -2.240 1.00 . A A . 30 CYS CA 1 1 19 8925 1 1 30 CYS CB C 3.058 1.800 -2.384 1.00 . A A . 30 CYS CB 1 1 19 8926 1 1 30 CYS H H 1.256 2.580 -4.066 1.00 . A A . 30 CYS H 1 1 19 8927 1 1 30 CYS HA H 1.768 3.079 -1.251 1.00 . A A . 30 CYS HA 1 1 19 8928 1 1 30 CYS HB2 H 2.428 0.956 -2.629 1.00 . A A . 30 CYS HB2 1 1 19 8929 1 1 30 CYS HB3 H 3.762 1.955 -3.190 1.00 . A A . 30 CYS HB3 1 1 19 8930 1 1 30 CYS N N 1.112 3.014 -3.198 1.00 . A A . 30 CYS N 1 1 19 8931 1 1 30 CYS O O 3.084 4.850 -3.564 1.00 . A A . 30 CYS O 1 1 19 8932 1 1 30 CYS SG S 4.012 1.387 -0.895 1.00 . A A . 30 CYS SG 1 1 19 8933 1 1 31 VAL C C 5.781 5.789 -0.707 1.00 . A A . 31 VAL C 1 1 19 8934 1 1 31 VAL CA C 4.501 5.979 -1.506 1.00 . A A . 31 VAL CA 1 1 19 8935 1 1 31 VAL CB C 3.770 7.250 -1.006 1.00 . A A . 31 VAL CB 1 1 19 8936 1 1 31 VAL CG1 C 2.597 7.600 -1.910 1.00 . A A . 31 VAL CG1 1 1 19 8937 1 1 31 VAL CG2 C 3.300 7.078 0.430 1.00 . A A . 31 VAL CG2 1 1 19 8938 1 1 31 VAL H H 3.604 4.328 -0.541 1.00 . A A . 31 VAL H 1 1 19 8939 1 1 31 VAL HA H 4.759 6.118 -2.552 1.00 . A A . 31 VAL HA 1 1 19 8940 1 1 31 VAL HB H 4.469 8.074 -1.035 1.00 . A A . 31 VAL HB 1 1 19 8941 1 1 31 VAL HG11 H 2.545 8.671 -2.037 1.00 . A A . 31 VAL HG11 1 1 19 8942 1 1 31 VAL HG12 H 1.679 7.246 -1.463 1.00 . A A . 31 VAL HG12 1 1 19 8943 1 1 31 VAL HG13 H 2.732 7.130 -2.874 1.00 . A A . 31 VAL HG13 1 1 19 8944 1 1 31 VAL HG21 H 3.720 7.863 1.042 1.00 . A A . 31 VAL HG21 1 1 19 8945 1 1 31 VAL HG22 H 3.626 6.119 0.803 1.00 . A A . 31 VAL HG22 1 1 19 8946 1 1 31 VAL HG23 H 2.223 7.131 0.466 1.00 . A A . 31 VAL HG23 1 1 19 8947 1 1 31 VAL N N 3.677 4.789 -1.410 1.00 . A A . 31 VAL N 1 1 19 8948 1 1 31 VAL O O 5.839 4.833 0.090 1.00 . A A . 31 VAL O 1 1 19 8949 1 1 31 VAL OXT O 6.725 6.586 -0.907 1.00 . A A . 31 VAL OXT 1 1 20 8950 1 1 1 ALA C C 4.389 -8.615 -0.600 1.00 . A A . 1 ALA C 1 1 20 8951 1 1 1 ALA CA C 4.539 -10.108 -0.844 1.00 . A A . 1 ALA CA 1 1 20 8952 1 1 1 ALA CB C 3.746 -10.525 -2.073 1.00 . A A . 1 ALA CB 1 1 20 8953 1 1 1 ALA H1 H 4.070 -11.883 0.141 1.00 . A A . 1 ALA H1 1 1 20 8954 1 1 1 ALA H2 H 3.132 -10.561 0.618 1.00 . A A . 1 ALA H2 1 1 20 8955 1 1 1 ALA H3 H 4.734 -10.694 1.149 1.00 . A A . 1 ALA H3 1 1 20 8956 1 1 1 ALA HA H 5.581 -10.332 -1.020 1.00 . A A . 1 ALA HA 1 1 20 8957 1 1 1 ALA HB1 H 3.413 -11.546 -1.960 1.00 . A A . 1 ALA HB1 1 1 20 8958 1 1 1 ALA HB2 H 4.371 -10.446 -2.950 1.00 . A A . 1 ALA HB2 1 1 20 8959 1 1 1 ALA HB3 H 2.888 -9.878 -2.185 1.00 . A A . 1 ALA HB3 1 1 20 8960 1 1 1 ALA N N 4.088 -10.866 0.346 1.00 . A A . 1 ALA N 1 1 20 8961 1 1 1 ALA O O 3.398 -8.177 -0.021 1.00 . A A . 1 ALA O 1 1 20 8962 1 1 2 CYS C C 4.806 -5.719 -2.107 1.00 . A A . 2 CYS C 1 1 20 8963 1 1 2 CYS CA C 5.356 -6.405 -0.858 1.00 . A A . 2 CYS CA 1 1 20 8964 1 1 2 CYS CB C 6.759 -5.904 -0.523 1.00 . A A . 2 CYS CB 1 1 20 8965 1 1 2 CYS H H 6.142 -8.258 -1.485 1.00 . A A . 2 CYS H 1 1 20 8966 1 1 2 CYS HA H 4.700 -6.167 -0.026 1.00 . A A . 2 CYS HA 1 1 20 8967 1 1 2 CYS HB2 H 6.690 -4.882 -0.182 1.00 . A A . 2 CYS HB2 1 1 20 8968 1 1 2 CYS HB3 H 7.161 -6.511 0.277 1.00 . A A . 2 CYS HB3 1 1 20 8969 1 1 2 CYS N N 5.375 -7.848 -1.034 1.00 . A A . 2 CYS N 1 1 20 8970 1 1 2 CYS O O 5.098 -6.127 -3.232 1.00 . A A . 2 CYS O 1 1 20 8971 1 1 2 CYS SG S 7.957 -5.936 -1.893 1.00 . A A . 2 CYS SG 1 1 20 8972 1 1 3 SER C C 4.350 -2.924 -3.542 1.00 . A A . 3 SER C 1 1 20 8973 1 1 3 SER CA C 3.369 -3.954 -2.975 1.00 . A A . 3 SER CA 1 1 20 8974 1 1 3 SER CB C 2.097 -3.270 -2.460 1.00 . A A . 3 SER CB 1 1 20 8975 1 1 3 SER H H 3.784 -4.448 -0.968 1.00 . A A . 3 SER H 1 1 20 8976 1 1 3 SER HA H 3.105 -4.650 -3.756 1.00 . A A . 3 SER HA 1 1 20 8977 1 1 3 SER HB2 H 1.514 -3.982 -1.899 1.00 . A A . 3 SER HB2 1 1 20 8978 1 1 3 SER HB3 H 2.372 -2.446 -1.818 1.00 . A A . 3 SER HB3 1 1 20 8979 1 1 3 SER HG H 1.394 -3.359 -4.294 1.00 . A A . 3 SER HG 1 1 20 8980 1 1 3 SER N N 3.989 -4.702 -1.893 1.00 . A A . 3 SER N 1 1 20 8981 1 1 3 SER O O 5.157 -2.353 -2.801 1.00 . A A . 3 SER O 1 1 20 8982 1 1 3 SER OG O 1.304 -2.774 -3.522 1.00 . A A . 3 SER OG 1 1 20 8983 1 1 4 LYS C C 4.670 -0.323 -5.176 1.00 . A A . 4 LYS C 1 1 20 8984 1 1 4 LYS CA C 5.154 -1.725 -5.510 1.00 . A A . 4 LYS CA 1 1 20 8985 1 1 4 LYS CB C 5.177 -1.902 -7.038 1.00 . A A . 4 LYS CB 1 1 20 8986 1 1 4 LYS CD C 6.074 -4.279 -7.090 1.00 . A A . 4 LYS CD 1 1 20 8987 1 1 4 LYS CE C 5.551 -5.319 -6.108 1.00 . A A . 4 LYS CE 1 1 20 8988 1 1 4 LYS CG C 4.971 -3.330 -7.531 1.00 . A A . 4 LYS CG 1 1 20 8989 1 1 4 LYS H H 3.605 -3.174 -5.387 1.00 . A A . 4 LYS H 1 1 20 8990 1 1 4 LYS HA H 6.152 -1.856 -5.118 1.00 . A A . 4 LYS HA 1 1 20 8991 1 1 4 LYS HB2 H 4.399 -1.289 -7.467 1.00 . A A . 4 LYS HB2 1 1 20 8992 1 1 4 LYS HB3 H 6.131 -1.555 -7.409 1.00 . A A . 4 LYS HB3 1 1 20 8993 1 1 4 LYS HD2 H 6.471 -4.785 -7.958 1.00 . A A . 4 LYS HD2 1 1 20 8994 1 1 4 LYS HD3 H 6.857 -3.708 -6.613 1.00 . A A . 4 LYS HD3 1 1 20 8995 1 1 4 LYS HE2 H 6.272 -6.119 -6.032 1.00 . A A . 4 LYS HE2 1 1 20 8996 1 1 4 LYS HE3 H 5.431 -4.853 -5.141 1.00 . A A . 4 LYS HE3 1 1 20 8997 1 1 4 LYS HG2 H 4.031 -3.694 -7.145 1.00 . A A . 4 LYS HG2 1 1 20 8998 1 1 4 LYS HG3 H 4.930 -3.319 -8.612 1.00 . A A . 4 LYS HG3 1 1 20 8999 1 1 4 LYS HZ1 H 4.151 -6.870 -6.209 1.00 . A A . 4 LYS HZ1 1 1 20 9000 1 1 4 LYS HZ2 H 4.157 -5.872 -7.570 1.00 . A A . 4 LYS HZ2 1 1 20 9001 1 1 4 LYS HZ3 H 3.452 -5.330 -6.134 1.00 . A A . 4 LYS HZ3 1 1 20 9002 1 1 4 LYS N N 4.277 -2.693 -4.854 1.00 . A A . 4 LYS N 1 1 20 9003 1 1 4 LYS NZ N 4.240 -5.891 -6.534 1.00 . A A . 4 LYS NZ 1 1 20 9004 1 1 4 LYS O O 3.500 -0.138 -4.846 1.00 . A A . 4 LYS O 1 1 20 9005 1 1 5 LYS C C 3.953 2.485 -5.700 1.00 . A A . 5 LYS C 1 1 20 9006 1 1 5 LYS CA C 5.173 2.026 -4.917 1.00 . A A . 5 LYS CA 1 1 20 9007 1 1 5 LYS CB C 6.330 3.002 -5.148 1.00 . A A . 5 LYS CB 1 1 20 9008 1 1 5 LYS CD C 7.033 5.351 -4.572 1.00 . A A . 5 LYS CD 1 1 20 9009 1 1 5 LYS CE C 6.591 6.802 -4.551 1.00 . A A . 5 LYS CE 1 1 20 9010 1 1 5 LYS CG C 5.904 4.454 -5.024 1.00 . A A . 5 LYS CG 1 1 20 9011 1 1 5 LYS H H 6.478 0.462 -5.498 1.00 . A A . 5 LYS H 1 1 20 9012 1 1 5 LYS HA H 4.916 2.042 -3.874 1.00 . A A . 5 LYS HA 1 1 20 9013 1 1 5 LYS HB2 H 7.104 2.809 -4.421 1.00 . A A . 5 LYS HB2 1 1 20 9014 1 1 5 LYS HB3 H 6.728 2.848 -6.140 1.00 . A A . 5 LYS HB3 1 1 20 9015 1 1 5 LYS HD2 H 7.337 5.061 -3.577 1.00 . A A . 5 LYS HD2 1 1 20 9016 1 1 5 LYS HD3 H 7.864 5.245 -5.253 1.00 . A A . 5 LYS HD3 1 1 20 9017 1 1 5 LYS HE2 H 6.744 7.226 -5.534 1.00 . A A . 5 LYS HE2 1 1 20 9018 1 1 5 LYS HE3 H 5.538 6.844 -4.305 1.00 . A A . 5 LYS HE3 1 1 20 9019 1 1 5 LYS HG2 H 5.549 4.802 -5.977 1.00 . A A . 5 LYS HG2 1 1 20 9020 1 1 5 LYS HG3 H 5.103 4.513 -4.313 1.00 . A A . 5 LYS HG3 1 1 20 9021 1 1 5 LYS HZ1 H 8.368 7.603 -3.802 1.00 . A A . 5 LYS HZ1 1 1 20 9022 1 1 5 LYS HZ2 H 7.255 7.162 -2.600 1.00 . A A . 5 LYS HZ2 1 1 20 9023 1 1 5 LYS HZ3 H 7.008 8.568 -3.518 1.00 . A A . 5 LYS HZ3 1 1 20 9024 1 1 5 LYS N N 5.555 0.659 -5.244 1.00 . A A . 5 LYS N 1 1 20 9025 1 1 5 LYS NZ N 7.360 7.593 -3.554 1.00 . A A . 5 LYS NZ 1 1 20 9026 1 1 5 LYS O O 2.896 2.716 -5.142 1.00 . A A . 5 LYS O 1 1 20 9027 1 1 6 TRP C C 2.022 1.919 -8.101 1.00 . A A . 6 TRP C 1 1 20 9028 1 1 6 TRP CA C 2.974 3.070 -7.793 1.00 . A A . 6 TRP CA 1 1 20 9029 1 1 6 TRP CB C 3.501 3.739 -9.061 1.00 . A A . 6 TRP CB 1 1 20 9030 1 1 6 TRP CD1 C 6.001 4.218 -8.712 1.00 . A A . 6 TRP CD1 1 1 20 9031 1 1 6 TRP CD2 C 4.703 6.032 -8.550 1.00 . A A . 6 TRP CD2 1 1 20 9032 1 1 6 TRP CE2 C 6.044 6.420 -8.366 1.00 . A A . 6 TRP CE2 1 1 20 9033 1 1 6 TRP CE3 C 3.710 7.010 -8.484 1.00 . A A . 6 TRP CE3 1 1 20 9034 1 1 6 TRP CG C 4.698 4.619 -8.800 1.00 . A A . 6 TRP CG 1 1 20 9035 1 1 6 TRP CH2 C 5.417 8.673 -8.058 1.00 . A A . 6 TRP CH2 1 1 20 9036 1 1 6 TRP CZ2 C 6.412 7.738 -8.117 1.00 . A A . 6 TRP CZ2 1 1 20 9037 1 1 6 TRP CZ3 C 4.074 8.318 -8.234 1.00 . A A . 6 TRP CZ3 1 1 20 9038 1 1 6 TRP H H 4.937 2.419 -7.404 1.00 . A A . 6 TRP H 1 1 20 9039 1 1 6 TRP HA H 2.429 3.807 -7.211 1.00 . A A . 6 TRP HA 1 1 20 9040 1 1 6 TRP HB2 H 3.791 2.978 -9.770 1.00 . A A . 6 TRP HB2 1 1 20 9041 1 1 6 TRP HB3 H 2.722 4.352 -9.490 1.00 . A A . 6 TRP HB3 1 1 20 9042 1 1 6 TRP HD1 H 6.328 3.199 -8.826 1.00 . A A . 6 TRP HD1 1 1 20 9043 1 1 6 TRP HE1 H 7.792 5.261 -8.389 1.00 . A A . 6 TRP HE1 1 1 20 9044 1 1 6 TRP HE3 H 2.673 6.755 -8.608 1.00 . A A . 6 TRP HE3 1 1 20 9045 1 1 6 TRP HH2 H 5.656 9.708 -7.864 1.00 . A A . 6 TRP HH2 1 1 20 9046 1 1 6 TRP HZ2 H 7.444 8.028 -7.979 1.00 . A A . 6 TRP HZ2 1 1 20 9047 1 1 6 TRP HZ3 H 3.317 9.086 -8.178 1.00 . A A . 6 TRP HZ3 1 1 20 9048 1 1 6 TRP N N 4.087 2.618 -6.986 1.00 . A A . 6 TRP N 1 1 20 9049 1 1 6 TRP NE1 N 6.816 5.294 -8.470 1.00 . A A . 6 TRP NE1 1 1 20 9050 1 1 6 TRP O O 1.301 1.941 -9.099 1.00 . A A . 6 TRP O 1 1 20 9051 1 1 7 GLU C C -0.179 0.099 -6.589 1.00 . A A . 7 GLU C 1 1 20 9052 1 1 7 GLU CA C 1.098 -0.200 -7.362 1.00 . A A . 7 GLU CA 1 1 20 9053 1 1 7 GLU CB C 1.769 -1.488 -6.872 1.00 . A A . 7 GLU CB 1 1 20 9054 1 1 7 GLU CD C 1.761 -4.003 -6.797 1.00 . A A . 7 GLU CD 1 1 20 9055 1 1 7 GLU CG C 0.938 -2.751 -7.032 1.00 . A A . 7 GLU CG 1 1 20 9056 1 1 7 GLU H H 2.579 0.989 -6.404 1.00 . A A . 7 GLU H 1 1 20 9057 1 1 7 GLU HA H 0.859 -0.297 -8.412 1.00 . A A . 7 GLU HA 1 1 20 9058 1 1 7 GLU HB2 H 2.688 -1.625 -7.421 1.00 . A A . 7 GLU HB2 1 1 20 9059 1 1 7 GLU HB3 H 2.007 -1.373 -5.824 1.00 . A A . 7 GLU HB3 1 1 20 9060 1 1 7 GLU HG2 H 0.126 -2.728 -6.321 1.00 . A A . 7 GLU HG2 1 1 20 9061 1 1 7 GLU HG3 H 0.540 -2.782 -8.035 1.00 . A A . 7 GLU HG3 1 1 20 9062 1 1 7 GLU N N 1.996 0.932 -7.212 1.00 . A A . 7 GLU N 1 1 20 9063 1 1 7 GLU O O -0.126 0.588 -5.458 1.00 . A A . 7 GLU O 1 1 20 9064 1 1 7 GLU OE1 O 2.046 -4.326 -5.625 1.00 . A A . 7 GLU OE1 1 1 20 9065 1 1 7 GLU OE2 O 2.187 -4.639 -7.780 1.00 . A A . 7 GLU OE2 1 1 20 9066 1 1 8 TYR C C -2.922 -0.821 -5.455 1.00 . A A . 8 TYR C 1 1 20 9067 1 1 8 TYR CA C -2.607 0.143 -6.594 1.00 . A A . 8 TYR CA 1 1 20 9068 1 1 8 TYR CB C -3.733 0.114 -7.636 1.00 . A A . 8 TYR CB 1 1 20 9069 1 1 8 TYR CD1 C -2.636 1.679 -9.300 1.00 . A A . 8 TYR CD1 1 1 20 9070 1 1 8 TYR CD2 C -4.896 2.099 -8.674 1.00 . A A . 8 TYR CD2 1 1 20 9071 1 1 8 TYR CE1 C -2.656 2.781 -10.133 1.00 . A A . 8 TYR CE1 1 1 20 9072 1 1 8 TYR CE2 C -4.925 3.203 -9.508 1.00 . A A . 8 TYR CE2 1 1 20 9073 1 1 8 TYR CG C -3.754 1.318 -8.556 1.00 . A A . 8 TYR CG 1 1 20 9074 1 1 8 TYR CZ C -3.803 3.538 -10.234 1.00 . A A . 8 TYR CZ 1 1 20 9075 1 1 8 TYR H H -1.298 -0.500 -8.126 1.00 . A A . 8 TYR H 1 1 20 9076 1 1 8 TYR HA H -2.548 1.141 -6.184 1.00 . A A . 8 TYR HA 1 1 20 9077 1 1 8 TYR HB2 H -3.621 -0.767 -8.251 1.00 . A A . 8 TYR HB2 1 1 20 9078 1 1 8 TYR HB3 H -4.683 0.071 -7.126 1.00 . A A . 8 TYR HB3 1 1 20 9079 1 1 8 TYR HD1 H -1.740 1.083 -9.220 1.00 . A A . 8 TYR HD1 1 1 20 9080 1 1 8 TYR HD2 H -5.775 1.835 -8.104 1.00 . A A . 8 TYR HD2 1 1 20 9081 1 1 8 TYR HE1 H -1.777 3.041 -10.704 1.00 . A A . 8 TYR HE1 1 1 20 9082 1 1 8 TYR HE2 H -5.824 3.797 -9.585 1.00 . A A . 8 TYR HE2 1 1 20 9083 1 1 8 TYR HH H -3.458 5.395 -10.601 1.00 . A A . 8 TYR HH 1 1 20 9084 1 1 8 TYR N N -1.320 -0.143 -7.215 1.00 . A A . 8 TYR N 1 1 20 9085 1 1 8 TYR O O -3.598 -1.834 -5.649 1.00 . A A . 8 TYR O 1 1 20 9086 1 1 8 TYR OH O -3.825 4.637 -11.064 1.00 . A A . 8 TYR OH 1 1 20 9087 1 1 9 CYS C C -4.085 -1.041 -2.537 1.00 . A A . 9 CYS C 1 1 20 9088 1 1 9 CYS CA C -2.679 -1.296 -3.080 1.00 . A A . 9 CYS CA 1 1 20 9089 1 1 9 CYS CB C -1.617 -1.004 -2.010 1.00 . A A . 9 CYS CB 1 1 20 9090 1 1 9 CYS H H -1.922 0.342 -4.181 1.00 . A A . 9 CYS H 1 1 20 9091 1 1 9 CYS HA H -2.606 -2.334 -3.371 1.00 . A A . 9 CYS HA 1 1 20 9092 1 1 9 CYS HB2 H -1.918 -1.465 -1.082 1.00 . A A . 9 CYS HB2 1 1 20 9093 1 1 9 CYS HB3 H -0.674 -1.428 -2.326 1.00 . A A . 9 CYS HB3 1 1 20 9094 1 1 9 CYS N N -2.442 -0.487 -4.266 1.00 . A A . 9 CYS N 1 1 20 9095 1 1 9 CYS O O -4.255 -0.524 -1.434 1.00 . A A . 9 CYS O 1 1 20 9096 1 1 9 CYS SG S -1.342 0.771 -1.679 1.00 . A A . 9 CYS SG 1 1 20 9097 1 1 10 ILE C C -6.954 -2.153 -1.860 1.00 . A A . 10 ILE C 1 1 20 9098 1 1 10 ILE CA C -6.498 -1.208 -2.980 1.00 . A A . 10 ILE CA 1 1 20 9099 1 1 10 ILE CB C -7.416 -1.380 -4.220 1.00 . A A . 10 ILE CB 1 1 20 9100 1 1 10 ILE CD1 C -6.985 -3.865 -4.719 1.00 . A A . 10 ILE CD1 1 1 20 9101 1 1 10 ILE CG1 C -6.861 -2.433 -5.197 1.00 . A A . 10 ILE CG1 1 1 20 9102 1 1 10 ILE CG2 C -7.592 -0.049 -4.932 1.00 . A A . 10 ILE CG2 1 1 20 9103 1 1 10 ILE H H -4.871 -1.790 -4.211 1.00 . A A . 10 ILE H 1 1 20 9104 1 1 10 ILE HA H -6.608 -0.192 -2.630 1.00 . A A . 10 ILE HA 1 1 20 9105 1 1 10 ILE HB H -8.386 -1.702 -3.873 1.00 . A A . 10 ILE HB 1 1 20 9106 1 1 10 ILE HD11 H -7.732 -3.921 -3.941 1.00 . A A . 10 ILE HD11 1 1 20 9107 1 1 10 ILE HD12 H -6.035 -4.200 -4.331 1.00 . A A . 10 ILE HD12 1 1 20 9108 1 1 10 ILE HD13 H -7.279 -4.496 -5.546 1.00 . A A . 10 ILE HD13 1 1 20 9109 1 1 10 ILE HG12 H -7.390 -2.354 -6.134 1.00 . A A . 10 ILE HG12 1 1 20 9110 1 1 10 ILE HG13 H -5.812 -2.231 -5.367 1.00 . A A . 10 ILE HG13 1 1 20 9111 1 1 10 ILE HG21 H -7.250 0.750 -4.291 1.00 . A A . 10 ILE HG21 1 1 20 9112 1 1 10 ILE HG22 H -8.637 0.099 -5.165 1.00 . A A . 10 ILE HG22 1 1 20 9113 1 1 10 ILE HG23 H -7.017 -0.050 -5.846 1.00 . A A . 10 ILE HG23 1 1 20 9114 1 1 10 ILE N N -5.088 -1.395 -3.337 1.00 . A A . 10 ILE N 1 1 20 9115 1 1 10 ILE O O -7.950 -2.861 -1.991 1.00 . A A . 10 ILE O 1 1 20 9116 1 1 11 VAL C C -7.734 -2.440 1.162 1.00 . A A . 11 VAL C 1 1 20 9117 1 1 11 VAL CA C -6.536 -2.986 0.384 1.00 . A A . 11 VAL CA 1 1 20 9118 1 1 11 VAL CB C -5.321 -3.134 1.323 1.00 . A A . 11 VAL CB 1 1 20 9119 1 1 11 VAL CG1 C -4.240 -3.971 0.659 1.00 . A A . 11 VAL CG1 1 1 20 9120 1 1 11 VAL CG2 C -4.764 -1.772 1.721 1.00 . A A . 11 VAL CG2 1 1 20 9121 1 1 11 VAL H H -5.440 -1.550 -0.712 1.00 . A A . 11 VAL H 1 1 20 9122 1 1 11 VAL HA H -6.790 -3.968 0.009 1.00 . A A . 11 VAL HA 1 1 20 9123 1 1 11 VAL HB H -5.641 -3.647 2.220 1.00 . A A . 11 VAL HB 1 1 20 9124 1 1 11 VAL HG11 H -4.558 -4.245 -0.337 1.00 . A A . 11 VAL HG11 1 1 20 9125 1 1 11 VAL HG12 H -4.068 -4.866 1.240 1.00 . A A . 11 VAL HG12 1 1 20 9126 1 1 11 VAL HG13 H -3.326 -3.399 0.601 1.00 . A A . 11 VAL HG13 1 1 20 9127 1 1 11 VAL HG21 H -5.467 -1.271 2.368 1.00 . A A . 11 VAL HG21 1 1 20 9128 1 1 11 VAL HG22 H -4.602 -1.177 0.835 1.00 . A A . 11 VAL HG22 1 1 20 9129 1 1 11 VAL HG23 H -3.826 -1.904 2.241 1.00 . A A . 11 VAL HG23 1 1 20 9130 1 1 11 VAL N N -6.220 -2.148 -0.759 1.00 . A A . 11 VAL N 1 1 20 9131 1 1 11 VAL O O -7.799 -1.253 1.481 1.00 . A A . 11 VAL O 1 1 20 9132 1 1 12 PRO C C -9.688 -2.877 3.709 1.00 . A A . 12 PRO C 1 1 20 9133 1 1 12 PRO CA C -9.911 -2.924 2.197 1.00 . A A . 12 PRO CA 1 1 20 9134 1 1 12 PRO CB C -10.897 -4.030 1.827 1.00 . A A . 12 PRO CB 1 1 20 9135 1 1 12 PRO CD C -8.713 -4.739 1.107 1.00 . A A . 12 PRO CD 1 1 20 9136 1 1 12 PRO CG C -10.047 -5.236 1.605 1.00 . A A . 12 PRO CG 1 1 20 9137 1 1 12 PRO HA H -10.292 -1.971 1.861 1.00 . A A . 12 PRO HA 1 1 20 9138 1 1 12 PRO HB2 H -11.594 -4.180 2.639 1.00 . A A . 12 PRO HB2 1 1 20 9139 1 1 12 PRO HB3 H -11.432 -3.754 0.931 1.00 . A A . 12 PRO HB3 1 1 20 9140 1 1 12 PRO HD2 H -7.908 -5.261 1.603 1.00 . A A . 12 PRO HD2 1 1 20 9141 1 1 12 PRO HD3 H -8.640 -4.866 0.036 1.00 . A A . 12 PRO HD3 1 1 20 9142 1 1 12 PRO HG2 H -9.922 -5.770 2.535 1.00 . A A . 12 PRO HG2 1 1 20 9143 1 1 12 PRO HG3 H -10.507 -5.874 0.865 1.00 . A A . 12 PRO HG3 1 1 20 9144 1 1 12 PRO N N -8.708 -3.307 1.464 1.00 . A A . 12 PRO N 1 1 20 9145 1 1 12 PRO O O -8.786 -3.530 4.226 1.00 . A A . 12 PRO O 1 1 20 9146 1 1 13 ILE C C -9.041 -1.793 6.395 1.00 . A A . 13 ILE C 1 1 20 9147 1 1 13 ILE CA C -10.468 -1.918 5.860 1.00 . A A . 13 ILE CA 1 1 20 9148 1 1 13 ILE CB C -11.263 -2.993 6.667 1.00 . A A . 13 ILE CB 1 1 20 9149 1 1 13 ILE CD1 C -11.856 -4.979 5.132 1.00 . A A . 13 ILE CD1 1 1 20 9150 1 1 13 ILE CG1 C -10.951 -4.440 6.225 1.00 . A A . 13 ILE CG1 1 1 20 9151 1 1 13 ILE CG2 C -12.758 -2.712 6.577 1.00 . A A . 13 ILE CG2 1 1 20 9152 1 1 13 ILE H H -11.213 -1.609 3.902 1.00 . A A . 13 ILE H 1 1 20 9153 1 1 13 ILE HA H -10.944 -0.973 6.054 1.00 . A A . 13 ILE HA 1 1 20 9154 1 1 13 ILE HB H -10.982 -2.885 7.706 1.00 . A A . 13 ILE HB 1 1 20 9155 1 1 13 ILE HD11 H -12.691 -5.497 5.580 1.00 . A A . 13 ILE HD11 1 1 20 9156 1 1 13 ILE HD12 H -11.301 -5.664 4.509 1.00 . A A . 13 ILE HD12 1 1 20 9157 1 1 13 ILE HD13 H -12.221 -4.160 4.530 1.00 . A A . 13 ILE HD13 1 1 20 9158 1 1 13 ILE HG12 H -9.937 -4.481 5.856 1.00 . A A . 13 ILE HG12 1 1 20 9159 1 1 13 ILE HG13 H -11.040 -5.094 7.081 1.00 . A A . 13 ILE HG13 1 1 20 9160 1 1 13 ILE HG21 H -13.040 -2.598 5.541 1.00 . A A . 13 ILE HG21 1 1 20 9161 1 1 13 ILE HG22 H -12.986 -1.804 7.115 1.00 . A A . 13 ILE HG22 1 1 20 9162 1 1 13 ILE HG23 H -13.306 -3.535 7.011 1.00 . A A . 13 ILE HG23 1 1 20 9163 1 1 13 ILE N N -10.526 -2.095 4.398 1.00 . A A . 13 ILE N 1 1 20 9164 1 1 13 ILE O O -8.305 -0.897 5.990 1.00 . A A . 13 ILE O 1 1 20 9165 1 1 14 LEU C C -6.265 -3.189 6.944 1.00 . A A . 14 LEU C 1 1 20 9166 1 1 14 LEU CA C -7.321 -2.651 7.907 1.00 . A A . 14 LEU CA 1 1 20 9167 1 1 14 LEU CB C -7.303 -3.462 9.204 1.00 . A A . 14 LEU CB 1 1 20 9168 1 1 14 LEU CD1 C -8.150 -3.842 11.531 1.00 . A A . 14 LEU CD1 1 1 20 9169 1 1 14 LEU CD2 C -7.844 -1.510 10.685 1.00 . A A . 14 LEU CD2 1 1 20 9170 1 1 14 LEU CG C -8.220 -2.937 10.312 1.00 . A A . 14 LEU CG 1 1 20 9171 1 1 14 LEU H H -9.290 -3.367 7.602 1.00 . A A . 14 LEU H 1 1 20 9172 1 1 14 LEU HA H -7.087 -1.623 8.136 1.00 . A A . 14 LEU HA 1 1 20 9173 1 1 14 LEU HB2 H -7.596 -4.476 8.973 1.00 . A A . 14 LEU HB2 1 1 20 9174 1 1 14 LEU HB3 H -6.292 -3.475 9.581 1.00 . A A . 14 LEU HB3 1 1 20 9175 1 1 14 LEU HD11 H -7.878 -4.841 11.223 1.00 . A A . 14 LEU HD11 1 1 20 9176 1 1 14 LEU HD12 H -9.114 -3.865 12.018 1.00 . A A . 14 LEU HD12 1 1 20 9177 1 1 14 LEU HD13 H -7.408 -3.463 12.219 1.00 . A A . 14 LEU HD13 1 1 20 9178 1 1 14 LEU HD21 H -8.474 -1.171 11.493 1.00 . A A . 14 LEU HD21 1 1 20 9179 1 1 14 LEU HD22 H -7.981 -0.866 9.828 1.00 . A A . 14 LEU HD22 1 1 20 9180 1 1 14 LEU HD23 H -6.811 -1.479 10.997 1.00 . A A . 14 LEU HD23 1 1 20 9181 1 1 14 LEU HG H -9.240 -2.935 9.956 1.00 . A A . 14 LEU HG 1 1 20 9182 1 1 14 LEU N N -8.657 -2.680 7.313 1.00 . A A . 14 LEU N 1 1 20 9183 1 1 14 LEU O O -5.239 -3.723 7.365 1.00 . A A . 14 LEU O 1 1 20 9184 1 1 15 GLY C C -5.624 -4.995 4.457 1.00 . A A . 15 GLY C 1 1 20 9185 1 1 15 GLY CA C -5.595 -3.493 4.651 1.00 . A A . 15 GLY CA 1 1 20 9186 1 1 15 GLY H H -7.364 -2.596 5.384 1.00 . A A . 15 GLY H 1 1 20 9187 1 1 15 GLY HA2 H -5.839 -3.018 3.713 1.00 . A A . 15 GLY HA2 1 1 20 9188 1 1 15 GLY HA3 H -4.595 -3.200 4.939 1.00 . A A . 15 GLY HA3 1 1 20 9189 1 1 15 GLY N N -6.521 -3.034 5.657 1.00 . A A . 15 GLY N 1 1 20 9190 1 1 15 GLY O O -6.658 -5.636 4.648 1.00 . A A . 15 GLY O 1 1 20 9191 1 1 16 PHE C C -2.895 -7.255 3.407 1.00 . A A . 16 PHE C 1 1 20 9192 1 1 16 PHE CA C -4.324 -6.975 3.841 1.00 . A A . 16 PHE CA 1 1 20 9193 1 1 16 PHE CB C -5.293 -7.457 2.753 1.00 . A A . 16 PHE CB 1 1 20 9194 1 1 16 PHE CD1 C -5.366 -9.826 3.588 1.00 . A A . 16 PHE CD1 1 1 20 9195 1 1 16 PHE CD2 C -5.119 -9.456 1.245 1.00 . A A . 16 PHE CD2 1 1 20 9196 1 1 16 PHE CE1 C -5.335 -11.191 3.379 1.00 . A A . 16 PHE CE1 1 1 20 9197 1 1 16 PHE CE2 C -5.087 -10.821 1.030 1.00 . A A . 16 PHE CE2 1 1 20 9198 1 1 16 PHE CG C -5.260 -8.943 2.525 1.00 . A A . 16 PHE CG 1 1 20 9199 1 1 16 PHE CZ C -5.194 -11.689 2.099 1.00 . A A . 16 PHE CZ 1 1 20 9200 1 1 16 PHE H H -3.698 -4.966 3.953 1.00 . A A . 16 PHE H 1 1 20 9201 1 1 16 PHE HA H -4.527 -7.498 4.765 1.00 . A A . 16 PHE HA 1 1 20 9202 1 1 16 PHE HB2 H -6.300 -7.187 3.031 1.00 . A A . 16 PHE HB2 1 1 20 9203 1 1 16 PHE HB3 H -5.041 -6.972 1.821 1.00 . A A . 16 PHE HB3 1 1 20 9204 1 1 16 PHE HD1 H -5.476 -9.436 4.590 1.00 . A A . 16 PHE HD1 1 1 20 9205 1 1 16 PHE HD2 H -5.035 -8.778 0.409 1.00 . A A . 16 PHE HD2 1 1 20 9206 1 1 16 PHE HE1 H -5.418 -11.867 4.217 1.00 . A A . 16 PHE HE1 1 1 20 9207 1 1 16 PHE HE2 H -4.977 -11.208 0.028 1.00 . A A . 16 PHE HE2 1 1 20 9208 1 1 16 PHE HZ H -5.169 -12.756 1.934 1.00 . A A . 16 PHE HZ 1 1 20 9209 1 1 16 PHE N N -4.477 -5.545 4.077 1.00 . A A . 16 PHE N 1 1 20 9210 1 1 16 PHE O O -2.209 -8.105 3.969 1.00 . A A . 16 PHE O 1 1 20 9211 1 1 17 VAL C C -0.194 -5.633 2.576 1.00 . A A . 17 VAL C 1 1 20 9212 1 1 17 VAL CA C -1.103 -6.646 1.884 1.00 . A A . 17 VAL CA 1 1 20 9213 1 1 17 VAL CB C -1.058 -6.439 0.349 1.00 . A A . 17 VAL CB 1 1 20 9214 1 1 17 VAL CG1 C 0.140 -7.150 -0.266 1.00 . A A . 17 VAL CG1 1 1 20 9215 1 1 17 VAL CG2 C -2.349 -6.919 -0.302 1.00 . A A . 17 VAL CG2 1 1 20 9216 1 1 17 VAL H H -3.048 -5.843 2.008 1.00 . A A . 17 VAL H 1 1 20 9217 1 1 17 VAL HA H -0.752 -7.643 2.108 1.00 . A A . 17 VAL HA 1 1 20 9218 1 1 17 VAL HB H -0.954 -5.382 0.155 1.00 . A A . 17 VAL HB 1 1 20 9219 1 1 17 VAL HG11 H 0.657 -7.710 0.499 1.00 . A A . 17 VAL HG11 1 1 20 9220 1 1 17 VAL HG12 H 0.811 -6.420 -0.693 1.00 . A A . 17 VAL HG12 1 1 20 9221 1 1 17 VAL HG13 H -0.199 -7.824 -1.039 1.00 . A A . 17 VAL HG13 1 1 20 9222 1 1 17 VAL HG21 H -3.150 -6.886 0.422 1.00 . A A . 17 VAL HG21 1 1 20 9223 1 1 17 VAL HG22 H -2.220 -7.933 -0.650 1.00 . A A . 17 VAL HG22 1 1 20 9224 1 1 17 VAL HG23 H -2.591 -6.278 -1.137 1.00 . A A . 17 VAL HG23 1 1 20 9225 1 1 17 VAL N N -2.453 -6.511 2.403 1.00 . A A . 17 VAL N 1 1 20 9226 1 1 17 VAL O O -0.600 -4.984 3.540 1.00 . A A . 17 VAL O 1 1 20 9227 1 1 18 TYR C C 3.047 -4.219 1.620 1.00 . A A . 18 TYR C 1 1 20 9228 1 1 18 TYR CA C 1.991 -4.579 2.656 1.00 . A A . 18 TYR CA 1 1 20 9229 1 1 18 TYR CB C 2.648 -5.213 3.894 1.00 . A A . 18 TYR CB 1 1 20 9230 1 1 18 TYR CD1 C 4.608 -6.631 3.131 1.00 . A A . 18 TYR CD1 1 1 20 9231 1 1 18 TYR CD2 C 2.632 -7.745 3.868 1.00 . A A . 18 TYR CD2 1 1 20 9232 1 1 18 TYR CE1 C 5.208 -7.849 2.884 1.00 . A A . 18 TYR CE1 1 1 20 9233 1 1 18 TYR CE2 C 3.226 -8.968 3.621 1.00 . A A . 18 TYR CE2 1 1 20 9234 1 1 18 TYR CG C 3.309 -6.554 3.625 1.00 . A A . 18 TYR CG 1 1 20 9235 1 1 18 TYR CZ C 4.513 -9.014 3.129 1.00 . A A . 18 TYR CZ 1 1 20 9236 1 1 18 TYR H H 1.285 -6.045 1.314 1.00 . A A . 18 TYR H 1 1 20 9237 1 1 18 TYR HA H 1.468 -3.683 2.952 1.00 . A A . 18 TYR HA 1 1 20 9238 1 1 18 TYR HB2 H 3.406 -4.543 4.273 1.00 . A A . 18 TYR HB2 1 1 20 9239 1 1 18 TYR HB3 H 1.895 -5.362 4.654 1.00 . A A . 18 TYR HB3 1 1 20 9240 1 1 18 TYR HD1 H 5.150 -5.716 2.940 1.00 . A A . 18 TYR HD1 1 1 20 9241 1 1 18 TYR HD2 H 1.624 -7.705 4.252 1.00 . A A . 18 TYR HD2 1 1 20 9242 1 1 18 TYR HE1 H 6.216 -7.887 2.500 1.00 . A A . 18 TYR HE1 1 1 20 9243 1 1 18 TYR HE2 H 2.683 -9.880 3.817 1.00 . A A . 18 TYR HE2 1 1 20 9244 1 1 18 TYR HH H 5.554 -10.542 3.669 1.00 . A A . 18 TYR HH 1 1 20 9245 1 1 18 TYR N N 1.024 -5.501 2.085 1.00 . A A . 18 TYR N 1 1 20 9246 1 1 18 TYR O O 3.399 -5.042 0.780 1.00 . A A . 18 TYR O 1 1 20 9247 1 1 18 TYR OH O 5.105 -10.234 2.872 1.00 . A A . 18 TYR OH 1 1 20 9248 1 1 19 CYS C C 5.929 -3.086 1.101 1.00 . A A . 19 CYS C 1 1 20 9249 1 1 19 CYS CA C 4.560 -2.536 0.739 1.00 . A A . 19 CYS CA 1 1 20 9250 1 1 19 CYS CB C 4.621 -1.025 0.756 1.00 . A A . 19 CYS CB 1 1 20 9251 1 1 19 CYS H H 3.211 -2.370 2.362 1.00 . A A . 19 CYS H 1 1 20 9252 1 1 19 CYS HA H 4.290 -2.869 -0.251 1.00 . A A . 19 CYS HA 1 1 20 9253 1 1 19 CYS HB2 H 4.623 -0.713 1.784 1.00 . A A . 19 CYS HB2 1 1 20 9254 1 1 19 CYS HB3 H 5.541 -0.689 0.283 1.00 . A A . 19 CYS HB3 1 1 20 9255 1 1 19 CYS N N 3.540 -2.993 1.674 1.00 . A A . 19 CYS N 1 1 20 9256 1 1 19 CYS O O 6.121 -3.638 2.186 1.00 . A A . 19 CYS O 1 1 20 9257 1 1 19 CYS SG S 3.216 -0.214 -0.065 1.00 . A A . 19 CYS SG 1 1 20 9258 1 1 20 CYS C C 8.873 -2.508 1.504 1.00 . A A . 20 CYS C 1 1 20 9259 1 1 20 CYS CA C 8.244 -3.367 0.425 1.00 . A A . 20 CYS CA 1 1 20 9260 1 1 20 CYS CB C 9.061 -3.274 -0.862 1.00 . A A . 20 CYS CB 1 1 20 9261 1 1 20 CYS H H 6.669 -2.452 -0.644 1.00 . A A . 20 CYS H 1 1 20 9262 1 1 20 CYS HA H 8.211 -4.393 0.759 1.00 . A A . 20 CYS HA 1 1 20 9263 1 1 20 CYS HB2 H 9.278 -2.237 -1.056 1.00 . A A . 20 CYS HB2 1 1 20 9264 1 1 20 CYS HB3 H 9.989 -3.809 -0.725 1.00 . A A . 20 CYS HB3 1 1 20 9265 1 1 20 CYS N N 6.882 -2.913 0.195 1.00 . A A . 20 CYS N 1 1 20 9266 1 1 20 CYS O O 8.460 -1.364 1.694 1.00 . A A . 20 CYS O 1 1 20 9267 1 1 20 CYS SG S 8.221 -3.967 -2.332 1.00 . A A . 20 CYS SG 1 1 20 9268 1 1 21 PRO C C 10.999 -0.928 2.813 1.00 . A A . 21 PRO C 1 1 20 9269 1 1 21 PRO CA C 10.515 -2.280 3.299 1.00 . A A . 21 PRO CA 1 1 20 9270 1 1 21 PRO CB C 11.683 -3.159 3.711 1.00 . A A . 21 PRO CB 1 1 20 9271 1 1 21 PRO CD C 10.417 -4.389 2.098 1.00 . A A . 21 PRO CD 1 1 20 9272 1 1 21 PRO CG C 11.265 -4.540 3.335 1.00 . A A . 21 PRO CG 1 1 20 9273 1 1 21 PRO HA H 9.853 -2.138 4.141 1.00 . A A . 21 PRO HA 1 1 20 9274 1 1 21 PRO HB2 H 12.575 -2.851 3.184 1.00 . A A . 21 PRO HB2 1 1 20 9275 1 1 21 PRO HB3 H 11.831 -3.062 4.773 1.00 . A A . 21 PRO HB3 1 1 20 9276 1 1 21 PRO HD2 H 11.024 -4.468 1.210 1.00 . A A . 21 PRO HD2 1 1 20 9277 1 1 21 PRO HD3 H 9.629 -5.125 2.084 1.00 . A A . 21 PRO HD3 1 1 20 9278 1 1 21 PRO HG2 H 12.136 -5.143 3.122 1.00 . A A . 21 PRO HG2 1 1 20 9279 1 1 21 PRO HG3 H 10.687 -4.981 4.134 1.00 . A A . 21 PRO HG3 1 1 20 9280 1 1 21 PRO N N 9.863 -3.034 2.236 1.00 . A A . 21 PRO N 1 1 20 9281 1 1 21 PRO O O 11.854 -0.828 1.932 1.00 . A A . 21 PRO O 1 1 20 9282 1 1 22 GLY C C 9.573 2.177 2.383 1.00 . A A . 22 GLY C 1 1 20 9283 1 1 22 GLY CA C 10.746 1.455 3.017 1.00 . A A . 22 GLY CA 1 1 20 9284 1 1 22 GLY H H 9.733 -0.075 4.060 1.00 . A A . 22 GLY H 1 1 20 9285 1 1 22 GLY HA2 H 11.054 1.994 3.901 1.00 . A A . 22 GLY HA2 1 1 20 9286 1 1 22 GLY HA3 H 11.566 1.437 2.314 1.00 . A A . 22 GLY HA3 1 1 20 9287 1 1 22 GLY N N 10.416 0.098 3.387 1.00 . A A . 22 GLY N 1 1 20 9288 1 1 22 GLY O O 9.481 3.399 2.459 1.00 . A A . 22 GLY O 1 1 20 9289 1 1 23 LEU C C 6.273 1.780 1.960 1.00 . A A . 23 LEU C 1 1 20 9290 1 1 23 LEU CA C 7.513 1.989 1.100 1.00 . A A . 23 LEU CA 1 1 20 9291 1 1 23 LEU CB C 7.302 1.341 -0.276 1.00 . A A . 23 LEU CB 1 1 20 9292 1 1 23 LEU CD1 C 9.620 0.642 -0.996 1.00 . A A . 23 LEU CD1 1 1 20 9293 1 1 23 LEU CD2 C 7.912 1.258 -2.699 1.00 . A A . 23 LEU CD2 1 1 20 9294 1 1 23 LEU CG C 8.427 1.536 -1.300 1.00 . A A . 23 LEU CG 1 1 20 9295 1 1 23 LEU H H 8.796 0.442 1.725 1.00 . A A . 23 LEU H 1 1 20 9296 1 1 23 LEU HA H 7.683 3.048 0.972 1.00 . A A . 23 LEU HA 1 1 20 9297 1 1 23 LEU HB2 H 7.166 0.280 -0.127 1.00 . A A . 23 LEU HB2 1 1 20 9298 1 1 23 LEU HB3 H 6.392 1.743 -0.697 1.00 . A A . 23 LEU HB3 1 1 20 9299 1 1 23 LEU HD11 H 10.473 0.973 -1.567 1.00 . A A . 23 LEU HD11 1 1 20 9300 1 1 23 LEU HD12 H 9.380 -0.378 -1.261 1.00 . A A . 23 LEU HD12 1 1 20 9301 1 1 23 LEU HD13 H 9.848 0.695 0.059 1.00 . A A . 23 LEU HD13 1 1 20 9302 1 1 23 LEU HD21 H 7.761 2.192 -3.220 1.00 . A A . 23 LEU HD21 1 1 20 9303 1 1 23 LEU HD22 H 6.975 0.725 -2.638 1.00 . A A . 23 LEU HD22 1 1 20 9304 1 1 23 LEU HD23 H 8.633 0.659 -3.236 1.00 . A A . 23 LEU HD23 1 1 20 9305 1 1 23 LEU HG H 8.762 2.563 -1.266 1.00 . A A . 23 LEU HG 1 1 20 9306 1 1 23 LEU N N 8.677 1.419 1.754 1.00 . A A . 23 LEU N 1 1 20 9307 1 1 23 LEU O O 6.185 0.797 2.702 1.00 . A A . 23 LEU O 1 1 20 9308 1 1 24 ILE C C 2.852 2.877 1.785 1.00 . A A . 24 ILE C 1 1 20 9309 1 1 24 ILE CA C 4.082 2.577 2.637 1.00 . A A . 24 ILE CA 1 1 20 9310 1 1 24 ILE CB C 4.082 3.514 3.867 1.00 . A A . 24 ILE CB 1 1 20 9311 1 1 24 ILE CD1 C 4.400 5.941 4.601 1.00 . A A . 24 ILE CD1 1 1 20 9312 1 1 24 ILE CG1 C 4.453 4.946 3.460 1.00 . A A . 24 ILE CG1 1 1 20 9313 1 1 24 ILE CG2 C 5.031 2.993 4.939 1.00 . A A . 24 ILE CG2 1 1 20 9314 1 1 24 ILE H H 5.432 3.454 1.246 1.00 . A A . 24 ILE H 1 1 20 9315 1 1 24 ILE HA H 4.013 1.560 2.993 1.00 . A A . 24 ILE HA 1 1 20 9316 1 1 24 ILE HB H 3.084 3.515 4.280 1.00 . A A . 24 ILE HB 1 1 20 9317 1 1 24 ILE HD11 H 3.414 6.379 4.651 1.00 . A A . 24 ILE HD11 1 1 20 9318 1 1 24 ILE HD12 H 5.132 6.718 4.435 1.00 . A A . 24 ILE HD12 1 1 20 9319 1 1 24 ILE HD13 H 4.617 5.435 5.530 1.00 . A A . 24 ILE HD13 1 1 20 9320 1 1 24 ILE HG12 H 5.457 4.951 3.064 1.00 . A A . 24 ILE HG12 1 1 20 9321 1 1 24 ILE HG13 H 3.768 5.283 2.694 1.00 . A A . 24 ILE HG13 1 1 20 9322 1 1 24 ILE HG21 H 5.695 2.260 4.507 1.00 . A A . 24 ILE HG21 1 1 20 9323 1 1 24 ILE HG22 H 4.460 2.538 5.735 1.00 . A A . 24 ILE HG22 1 1 20 9324 1 1 24 ILE HG23 H 5.611 3.814 5.336 1.00 . A A . 24 ILE HG23 1 1 20 9325 1 1 24 ILE N N 5.313 2.689 1.862 1.00 . A A . 24 ILE N 1 1 20 9326 1 1 24 ILE O O 2.802 3.880 1.073 1.00 . A A . 24 ILE O 1 1 20 9327 1 1 25 CYS C C -0.168 3.360 1.650 1.00 . A A . 25 CYS C 1 1 20 9328 1 1 25 CYS CA C 0.620 2.169 1.103 1.00 . A A . 25 CYS CA 1 1 20 9329 1 1 25 CYS CB C -0.227 0.892 1.161 1.00 . A A . 25 CYS CB 1 1 20 9330 1 1 25 CYS H H 1.961 1.211 2.444 1.00 . A A . 25 CYS H 1 1 20 9331 1 1 25 CYS HA H 0.885 2.370 0.077 1.00 . A A . 25 CYS HA 1 1 20 9332 1 1 25 CYS HB2 H 0.333 0.080 0.722 1.00 . A A . 25 CYS HB2 1 1 20 9333 1 1 25 CYS HB3 H -0.437 0.657 2.195 1.00 . A A . 25 CYS HB3 1 1 20 9334 1 1 25 CYS N N 1.858 1.996 1.862 1.00 . A A . 25 CYS N 1 1 20 9335 1 1 25 CYS O O -0.257 3.547 2.864 1.00 . A A . 25 CYS O 1 1 20 9336 1 1 25 CYS SG S -1.824 0.997 0.283 1.00 . A A . 25 CYS SG 1 1 20 9337 1 1 26 GLY C C -2.751 5.538 0.379 1.00 . A A . 26 GLY C 1 1 20 9338 1 1 26 GLY CA C -1.469 5.339 1.170 1.00 . A A . 26 GLY CA 1 1 20 9339 1 1 26 GLY H H -0.601 3.982 -0.205 1.00 . A A . 26 GLY H 1 1 20 9340 1 1 26 GLY HA2 H -1.720 5.236 2.215 1.00 . A A . 26 GLY HA2 1 1 20 9341 1 1 26 GLY HA3 H -0.846 6.213 1.047 1.00 . A A . 26 GLY HA3 1 1 20 9342 1 1 26 GLY N N -0.719 4.171 0.753 1.00 . A A . 26 GLY N 1 1 20 9343 1 1 26 GLY O O -3.708 4.785 0.548 1.00 . A A . 26 GLY O 1 1 20 9344 1 1 27 PRO C C -4.260 5.876 -2.416 1.00 . A A . 27 PRO C 1 1 20 9345 1 1 27 PRO CA C -3.994 6.888 -1.299 1.00 . A A . 27 PRO CA 1 1 20 9346 1 1 27 PRO CB C -3.668 8.264 -1.881 1.00 . A A . 27 PRO CB 1 1 20 9347 1 1 27 PRO CD C -1.706 7.527 -0.727 1.00 . A A . 27 PRO CD 1 1 20 9348 1 1 27 PRO CG C -2.180 8.322 -1.912 1.00 . A A . 27 PRO CG 1 1 20 9349 1 1 27 PRO HA H -4.876 6.958 -0.680 1.00 . A A . 27 PRO HA 1 1 20 9350 1 1 27 PRO HB2 H -4.090 8.347 -2.873 1.00 . A A . 27 PRO HB2 1 1 20 9351 1 1 27 PRO HB3 H -4.078 9.034 -1.244 1.00 . A A . 27 PRO HB3 1 1 20 9352 1 1 27 PRO HD2 H -0.790 7.006 -0.964 1.00 . A A . 27 PRO HD2 1 1 20 9353 1 1 27 PRO HD3 H -1.565 8.171 0.128 1.00 . A A . 27 PRO HD3 1 1 20 9354 1 1 27 PRO HG2 H -1.815 7.882 -2.829 1.00 . A A . 27 PRO HG2 1 1 20 9355 1 1 27 PRO HG3 H -1.850 9.347 -1.831 1.00 . A A . 27 PRO HG3 1 1 20 9356 1 1 27 PRO N N -2.805 6.570 -0.487 1.00 . A A . 27 PRO N 1 1 20 9357 1 1 27 PRO O O -4.247 6.222 -3.599 1.00 . A A . 27 PRO O 1 1 20 9358 1 1 28 PHE C C -3.535 3.216 -3.792 1.00 . A A . 28 PHE C 1 1 20 9359 1 1 28 PHE CA C -4.764 3.519 -2.934 1.00 . A A . 28 PHE CA 1 1 20 9360 1 1 28 PHE CB C -6.014 3.783 -3.813 1.00 . A A . 28 PHE CB 1 1 20 9361 1 1 28 PHE CD1 C -7.478 4.540 -1.901 1.00 . A A . 28 PHE CD1 1 1 20 9362 1 1 28 PHE CD2 C -8.381 3.010 -3.490 1.00 . A A . 28 PHE CD2 1 1 20 9363 1 1 28 PHE CE1 C -8.674 4.533 -1.209 1.00 . A A . 28 PHE CE1 1 1 20 9364 1 1 28 PHE CE2 C -9.579 2.998 -2.801 1.00 . A A . 28 PHE CE2 1 1 20 9365 1 1 28 PHE CG C -7.316 3.778 -3.049 1.00 . A A . 28 PHE CG 1 1 20 9366 1 1 28 PHE CZ C -9.725 3.761 -1.660 1.00 . A A . 28 PHE CZ 1 1 20 9367 1 1 28 PHE H H -4.474 4.447 -1.049 1.00 . A A . 28 PHE H 1 1 20 9368 1 1 28 PHE HA H -4.958 2.650 -2.320 1.00 . A A . 28 PHE HA 1 1 20 9369 1 1 28 PHE HB2 H -5.924 4.747 -4.295 1.00 . A A . 28 PHE HB2 1 1 20 9370 1 1 28 PHE HB3 H -6.078 3.014 -4.573 1.00 . A A . 28 PHE HB3 1 1 20 9371 1 1 28 PHE HD1 H -6.656 5.146 -1.547 1.00 . A A . 28 PHE HD1 1 1 20 9372 1 1 28 PHE HD2 H -8.267 2.412 -4.382 1.00 . A A . 28 PHE HD2 1 1 20 9373 1 1 28 PHE HE1 H -8.786 5.131 -0.317 1.00 . A A . 28 PHE HE1 1 1 20 9374 1 1 28 PHE HE2 H -10.399 2.393 -3.156 1.00 . A A . 28 PHE HE2 1 1 20 9375 1 1 28 PHE HZ H -10.661 3.754 -1.120 1.00 . A A . 28 PHE HZ 1 1 20 9376 1 1 28 PHE N N -4.493 4.631 -2.016 1.00 . A A . 28 PHE N 1 1 20 9377 1 1 28 PHE O O -3.618 2.497 -4.786 1.00 . A A . 28 PHE O 1 1 20 9378 1 1 29 VAL C C -0.029 3.636 -2.958 1.00 . A A . 29 VAL C 1 1 20 9379 1 1 29 VAL CA C -1.107 3.530 -4.019 1.00 . A A . 29 VAL CA 1 1 20 9380 1 1 29 VAL CB C -0.801 4.552 -5.151 1.00 . A A . 29 VAL CB 1 1 20 9381 1 1 29 VAL CG1 C -1.736 4.366 -6.338 1.00 . A A . 29 VAL CG1 1 1 20 9382 1 1 29 VAL CG2 C -0.880 5.981 -4.631 1.00 . A A . 29 VAL CG2 1 1 20 9383 1 1 29 VAL H H -2.391 4.272 -2.528 1.00 . A A . 29 VAL H 1 1 20 9384 1 1 29 VAL HA H -1.102 2.531 -4.436 1.00 . A A . 29 VAL HA 1 1 20 9385 1 1 29 VAL HB H 0.214 4.377 -5.501 1.00 . A A . 29 VAL HB 1 1 20 9386 1 1 29 VAL HG11 H -1.321 3.630 -7.011 1.00 . A A . 29 VAL HG11 1 1 20 9387 1 1 29 VAL HG12 H -1.849 5.306 -6.857 1.00 . A A . 29 VAL HG12 1 1 20 9388 1 1 29 VAL HG13 H -2.700 4.029 -5.986 1.00 . A A . 29 VAL HG13 1 1 20 9389 1 1 29 VAL HG21 H -0.121 6.132 -3.877 1.00 . A A . 29 VAL HG21 1 1 20 9390 1 1 29 VAL HG22 H -1.855 6.154 -4.200 1.00 . A A . 29 VAL HG22 1 1 20 9391 1 1 29 VAL HG23 H -0.719 6.671 -5.447 1.00 . A A . 29 VAL HG23 1 1 20 9392 1 1 29 VAL N N -2.388 3.741 -3.360 1.00 . A A . 29 VAL N 1 1 20 9393 1 1 29 VAL O O -0.242 4.270 -1.924 1.00 . A A . 29 VAL O 1 1 20 9394 1 1 30 CYS C C 3.073 4.288 -2.507 1.00 . A A . 30 CYS C 1 1 20 9395 1 1 30 CYS CA C 2.197 3.064 -2.243 1.00 . A A . 30 CYS CA 1 1 20 9396 1 1 30 CYS CB C 3.023 1.781 -2.350 1.00 . A A . 30 CYS CB 1 1 20 9397 1 1 30 CYS H H 1.222 2.533 -4.039 1.00 . A A . 30 CYS H 1 1 20 9398 1 1 30 CYS HA H 1.776 3.137 -1.253 1.00 . A A . 30 CYS HA 1 1 20 9399 1 1 30 CYS HB2 H 2.361 0.941 -2.501 1.00 . A A . 30 CYS HB2 1 1 20 9400 1 1 30 CYS HB3 H 3.683 1.863 -3.202 1.00 . A A . 30 CYS HB3 1 1 20 9401 1 1 30 CYS N N 1.105 3.024 -3.196 1.00 . A A . 30 CYS N 1 1 20 9402 1 1 30 CYS O O 3.071 4.843 -3.608 1.00 . A A . 30 CYS O 1 1 20 9403 1 1 30 CYS SG S 4.051 1.437 -0.894 1.00 . A A . 30 CYS SG 1 1 20 9404 1 1 31 VAL C C 6.023 5.615 -0.985 1.00 . A A . 31 VAL C 1 1 20 9405 1 1 31 VAL CA C 4.688 5.870 -1.666 1.00 . A A . 31 VAL CA 1 1 20 9406 1 1 31 VAL CB C 4.067 7.169 -1.094 1.00 . A A . 31 VAL CB 1 1 20 9407 1 1 31 VAL CG1 C 2.859 7.604 -1.911 1.00 . A A . 31 VAL CG1 1 1 20 9408 1 1 31 VAL CG2 C 3.684 6.994 0.369 1.00 . A A . 31 VAL CG2 1 1 20 9409 1 1 31 VAL H H 3.793 4.252 -0.642 1.00 . A A . 31 VAL H 1 1 20 9410 1 1 31 VAL HA H 4.861 6.009 -2.731 1.00 . A A . 31 VAL HA 1 1 20 9411 1 1 31 VAL HB H 4.808 7.952 -1.154 1.00 . A A . 31 VAL HB 1 1 20 9412 1 1 31 VAL HG11 H 1.967 7.523 -1.307 1.00 . A A . 31 VAL HG11 1 1 20 9413 1 1 31 VAL HG12 H 2.765 6.970 -2.780 1.00 . A A . 31 VAL HG12 1 1 20 9414 1 1 31 VAL HG13 H 2.988 8.629 -2.226 1.00 . A A . 31 VAL HG13 1 1 20 9415 1 1 31 VAL HG21 H 2.985 7.766 0.654 1.00 . A A . 31 VAL HG21 1 1 20 9416 1 1 31 VAL HG22 H 4.569 7.065 0.983 1.00 . A A . 31 VAL HG22 1 1 20 9417 1 1 31 VAL HG23 H 3.226 6.025 0.508 1.00 . A A . 31 VAL HG23 1 1 20 9418 1 1 31 VAL N N 3.819 4.719 -1.508 1.00 . A A . 31 VAL N 1 1 20 9419 1 1 31 VAL O O 6.087 4.691 -0.149 1.00 . A A . 31 VAL O 1 1 20 9420 1 1 31 VAL OXT O 6.998 6.329 -1.317 1.00 . A A . 31 VAL OXT 1 1 stop_ save_
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