NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
403705 | 1wpd | 6347 | cing | 4-filtered-FRED | STAR | entry | full | 211 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1wpd # This FRED archive file contains, for PDB entry <1wpd>: # # - 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_1wpd _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1wpd _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3792.49 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 $MTx_HsTx1 A . 1 1 stop_ save_ save_MTx_HsTx1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "MTx HsTx1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code VSCTGSKDCYAPCRKQTGCPYGKCMNRKCKCNRC _Entity.Number_of_monomers 34 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 VAL . 1 1 2 SER . 1 1 3 CYS . 1 1 4 THR . 1 1 5 GLY . 1 1 6 SER . 1 1 7 LYS . 1 1 8 ASP . 1 1 9 CYS . 1 1 10 TYR . 1 1 11 ALA . 1 1 12 PRO . 1 1 13 CYS . 1 1 14 ARG . 1 1 15 LYS . 1 1 16 GLN . 1 1 17 THR . 1 1 18 GLY . 1 1 19 CYS . 1 1 20 PRO . 1 1 21 TYR . 1 1 22 GLY . 1 1 23 LYS . 1 1 24 CYS . 1 1 25 MET . 1 1 26 ASN . 1 1 27 ARG . 1 1 28 LYS . 1 1 29 CYS . 1 1 30 LYS . 1 1 31 CYS . 1 1 32 ASN . 1 1 33 ARG . 1 1 34 CYS . 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 VAL 1 1 1 1 SER 2 2 1 1 CYS 3 3 1 1 THR 4 4 1 1 GLY 5 5 1 1 SER 6 6 1 1 LYS 7 7 1 1 ASP 8 8 1 1 CYS 9 9 1 1 TYR 10 10 1 1 ALA 11 11 1 1 PRO 12 12 1 1 CYS 13 13 1 1 ARG 14 14 1 1 LYS 15 15 1 1 GLN 16 16 1 1 THR 17 17 1 1 GLY 18 18 1 1 CYS 19 19 1 1 PRO 20 20 1 1 TYR 21 21 1 1 GLY 22 22 1 1 LYS 23 23 1 1 CYS 24 24 1 1 MET 25 25 1 1 ASN 26 26 1 1 ARG 27 27 1 1 LYS 28 28 1 1 CYS 29 29 1 1 LYS 30 30 1 1 CYS 31 31 1 1 ASN 32 32 1 1 ARG 33 33 1 1 CYS 34 34 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 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 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 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 VAL HA . 1 . HA 1 1 1 1 2 1 1 1 VAL HB . 1 . HB 1 1 2 1 1 1 1 1 VAL HA . 1 . HA 1 1 2 1 2 1 1 2 SER H . 2 . HN 1 1 3 1 1 1 1 1 VAL HB . 1 . HB 1 1 3 1 2 1 1 2 SER H . 2 . HN 1 1 4 1 1 1 1 1 VAL QG . 1 . HG* 1 1 4 1 2 1 1 2 SER H . 2 . HN 1 1 5 1 1 1 1 2 SER HA . 2 . HA 1 1 5 1 2 1 1 3 CYS H . 3 . HN 1 1 6 1 1 1 1 2 SER QB . 2 . HB* 1 1 6 1 2 1 1 3 CYS H . 3 . HN 1 1 7 1 1 1 1 3 CYS CB . 3 . CB 1 1 7 1 2 1 1 24 CYS SG . 24 . SG 1 1 8 1 1 1 1 3 CYS HA . 3 . HA 1 1 8 1 2 1 1 4 THR H . 4 . HN 1 1 9 1 1 1 1 3 CYS QB . 3 . HB* 1 1 9 1 2 1 1 4 THR H . 4 . HN 1 1 10 1 1 1 1 3 CYS QB . 3 . HB* 1 1 10 1 2 1 1 5 GLY H . 5 . HN 1 1 11 1 1 1 1 3 CYS HB2 . 3 . HB2 1 1 11 1 2 1 1 4 THR H . 4 . HN 1 1 12 1 1 1 1 3 CYS HB3 . 3 . HB1 1 1 12 1 2 1 1 4 THR H . 4 . HN 1 1 13 1 1 1 1 3 CYS SG . 3 . SG 1 1 13 1 2 1 1 24 CYS CB . 24 . CB 1 1 14 1 1 1 1 3 CYS SG . 3 . SG 1 1 14 1 2 1 1 24 CYS SG . 24 . SG 1 1 15 1 1 1 1 4 THR H . 4 . HN 1 1 15 1 2 1 1 5 GLY H . 5 . HN 1 1 16 1 1 1 1 4 THR HA . 4 . HA 1 1 16 1 2 1 1 5 GLY H . 5 . HN 1 1 17 1 1 1 1 4 THR HG1 . 4 . HG* 1 1 17 1 1 1 1 4 THR MG . 4 . HG* 1 1 17 1 2 1 1 5 GLY H . 5 . HN 1 1 18 1 1 1 1 4 THR HG1 . 4 . HG* 1 1 18 1 1 1 1 4 THR MG . 4 . HG* 1 1 18 1 2 1 1 10 TYR CG . 10 . CG 1 1 19 1 1 1 1 4 THR HG1 . 4 . HG* 1 1 19 1 1 1 1 4 THR MG . 4 . HG* 1 1 19 1 2 1 1 10 TYR CZ . 10 . CZ 1 1 20 1 1 1 1 5 GLY QA . 5 . HA* 1 1 20 1 2 1 1 6 SER H . 6 . HN 1 1 21 1 1 1 1 6 SER H . 6 . HN 1 1 21 1 2 1 1 7 LYS H . 7 . HN 1 1 22 1 1 1 1 6 SER HA . 6 . HA 1 1 22 1 2 1 1 7 LYS H . 7 . HN 1 1 23 1 1 1 1 6 SER HB2 . 6 . HB2 1 1 23 1 2 1 1 7 LYS H . 7 . HN 1 1 24 1 1 1 1 6 SER HB3 . 6 . HB1 1 1 24 1 2 1 1 7 LYS H . 7 . HN 1 1 25 1 1 1 1 7 LYS H . 7 . HN 1 1 25 1 2 1 1 7 LYS QB . 7 . HB* 1 1 26 1 1 1 1 7 LYS H . 7 . HN 1 1 26 1 2 1 1 7 LYS QD . 7 . HD* 1 1 27 1 1 1 1 7 LYS H . 7 . HN 1 1 27 1 2 1 1 7 LYS QE . 7 . HE* 1 1 28 1 1 1 1 7 LYS H . 7 . HN 1 1 28 1 2 1 1 7 LYS QG . 7 . HG* 1 1 29 1 1 1 1 7 LYS H . 7 . HN 1 1 29 1 2 1 1 8 ASP H . 8 . HN 1 1 30 1 1 1 1 7 LYS QE . 7 . HE* 1 1 30 1 2 1 1 9 CYS H . 9 . HN 1 1 31 1 1 1 1 8 ASP H . 8 . HN 1 1 31 1 2 1 1 9 CYS H . 9 . HN 1 1 32 1 1 1 1 8 ASP HA . 8 . HA 1 1 32 1 2 1 1 9 CYS H . 9 . HN 1 1 33 1 1 1 1 8 ASP QB . 8 . HB* 1 1 33 1 2 1 1 9 CYS H . 9 . HN 1 1 34 1 1 1 1 9 CYS CB . 9 . CB 1 1 34 1 2 1 1 29 CYS SG . 29 . SG 1 1 35 1 1 1 1 9 CYS H . 9 . HN 1 1 35 1 2 1 1 9 CYS HB2 . 9 . HB2 1 1 36 1 1 1 1 9 CYS H . 9 . HN 1 1 36 1 2 1 1 9 CYS QB . 9 . HB* 1 1 37 1 1 1 1 9 CYS H . 9 . HN 1 1 37 1 2 1 1 9 CYS HB3 . 9 . HB1 1 1 38 1 1 1 1 9 CYS H . 9 . HN 1 1 38 1 2 1 1 10 TYR H . 10 . HN 1 1 39 1 1 1 1 9 CYS HA . 9 . HA 1 1 39 1 2 1 1 9 CYS HB2 . 9 . HB2 1 1 40 1 1 1 1 9 CYS HA . 9 . HA 1 1 40 1 2 1 1 9 CYS QB . 9 . HB* 1 1 41 1 1 1 1 9 CYS HA . 9 . HA 1 1 41 1 2 1 1 9 CYS HB3 . 9 . HB1 1 1 42 1 1 1 1 9 CYS HA . 9 . HA 1 1 42 1 2 1 1 10 TYR H . 10 . HN 1 1 43 1 1 1 1 9 CYS HA . 9 . HA 1 1 43 1 2 1 1 11 ALA H . 11 . HN 1 1 44 1 1 1 1 9 CYS HA . 9 . HA 1 1 44 1 2 1 1 12 PRO QD . 12 . HD* 1 1 45 1 1 1 1 9 CYS QB . 9 . HB* 1 1 45 1 2 1 1 10 TYR H . 10 . HN 1 1 46 1 1 1 1 9 CYS HB2 . 9 . HB2 1 1 46 1 2 1 1 10 TYR H . 10 . HN 1 1 47 1 1 1 1 9 CYS HB3 . 9 . HB1 1 1 47 1 2 1 1 10 TYR H . 10 . HN 1 1 48 1 1 1 1 9 CYS SG . 9 . SG 1 1 48 1 2 1 1 29 CYS CB . 29 . CB 1 1 49 1 1 1 1 9 CYS SG . 9 . SG 1 1 49 1 2 1 1 29 CYS SG . 29 . SG 1 1 50 1 1 1 1 10 TYR CG . 10 . CG 1 1 50 1 2 1 1 11 ALA H . 11 . HN 1 1 51 1 1 1 1 10 TYR H . 10 . HN 1 1 51 1 2 1 1 10 TYR HA . 10 . HA 1 1 52 1 1 1 1 10 TYR H . 10 . HN 1 1 52 1 2 1 1 10 TYR QB . 10 . HB* 1 1 53 1 1 1 1 10 TYR H . 10 . HN 1 1 53 1 2 1 1 11 ALA H . 11 . HN 1 1 54 1 1 1 1 10 TYR H . 10 . HN 1 1 54 1 2 1 1 12 PRO QD . 12 . HD* 1 1 55 1 1 1 1 10 TYR QB . 10 . HB* 1 1 55 1 2 1 1 11 ALA H . 11 . HN 1 1 56 1 1 1 1 10 TYR O . 10 . O 1 1 56 1 2 1 1 14 ARG H . 14 . HN 1 1 57 1 1 1 1 10 TYR O . 10 . O 1 1 57 1 2 1 1 14 ARG N . 14 . N 1 1 58 1 1 1 1 11 ALA H . 11 . HN 1 1 58 1 2 1 1 12 PRO QD . 12 . HD* 1 1 59 1 1 1 1 11 ALA HA . 11 . HA 1 1 59 1 2 1 1 13 CYS H . 13 . HN 1 1 60 1 1 1 1 11 ALA HA . 11 . HA 1 1 60 1 2 1 1 14 ARG H . 14 . HN 1 1 61 1 1 1 1 11 ALA HA . 11 . HA 1 1 61 1 2 1 1 15 LYS H . 15 . HN 1 1 62 1 1 1 1 11 ALA MB . 11 . HB* 1 1 62 1 2 1 1 12 PRO QD . 12 . HD* 1 1 63 1 1 1 1 11 ALA O . 11 . O 1 1 63 1 2 1 1 15 LYS H . 15 . HN 1 1 64 1 1 1 1 11 ALA O . 11 . O 1 1 64 1 2 1 1 15 LYS N . 15 . N 1 1 65 1 1 1 1 12 PRO QB . 12 . HB* 1 1 65 1 2 1 1 13 CYS H . 13 . HN 1 1 66 1 1 1 1 12 PRO QD . 12 . HD* 1 1 66 1 2 1 1 13 CYS H . 13 . HN 1 1 67 1 1 1 1 12 PRO QG . 12 . HG* 1 1 67 1 2 1 1 13 CYS H . 13 . HN 1 1 68 1 1 1 1 12 PRO HG2 . 12 . HG2 1 1 68 1 2 1 1 13 CYS H . 13 . HN 1 1 69 1 1 1 1 12 PRO HG3 . 12 . HG1 1 1 69 1 2 1 1 13 CYS H . 13 . HN 1 1 70 1 1 1 1 13 CYS CB . 13 . CB 1 1 70 1 2 1 1 31 CYS SG . 31 . SG 1 1 71 1 1 1 1 13 CYS H . 13 . HN 1 1 71 1 2 1 1 14 ARG H . 14 . HN 1 1 72 1 1 1 1 13 CYS HA . 13 . HA 1 1 72 1 2 1 1 13 CYS HB2 . 13 . HB2 1 1 73 1 1 1 1 13 CYS HA . 13 . HA 1 1 73 1 2 1 1 13 CYS QB . 13 . HB* 1 1 74 1 1 1 1 13 CYS HA . 13 . HA 1 1 74 1 2 1 1 13 CYS HB3 . 13 . HB1 1 1 75 1 1 1 1 13 CYS HA . 13 . HA 1 1 75 1 2 1 1 14 ARG H . 14 . HN 1 1 76 1 1 1 1 13 CYS HA . 13 . HA 1 1 76 1 2 1 1 16 GLN H . 16 . HN 1 1 77 1 1 1 1 13 CYS HA . 13 . HA 1 1 77 1 2 1 1 17 THR H . 17 . HN 1 1 78 1 1 1 1 13 CYS QB . 13 . HB* 1 1 78 1 2 1 1 14 ARG H . 14 . HN 1 1 79 1 1 1 1 13 CYS HB2 . 13 . HB2 1 1 79 1 2 1 1 14 ARG H . 14 . HN 1 1 80 1 1 1 1 13 CYS HB3 . 13 . HB1 1 1 80 1 2 1 1 14 ARG H . 14 . HN 1 1 81 1 1 1 1 13 CYS O . 13 . O 1 1 81 1 2 1 1 17 THR H . 17 . HN 1 1 82 1 1 1 1 13 CYS O . 13 . O 1 1 82 1 2 1 1 17 THR N . 17 . N 1 1 83 1 1 1 1 13 CYS SG . 13 . SG 1 1 83 1 2 1 1 31 CYS CB . 31 . CB 1 1 84 1 1 1 1 13 CYS SG . 13 . SG 1 1 84 1 2 1 1 31 CYS SG . 31 . SG 1 1 85 1 1 1 1 14 ARG H . 14 . HN 1 1 85 1 2 1 1 14 ARG HA . 14 . HA 1 1 86 1 1 1 1 14 ARG H . 14 . HN 1 1 86 1 2 1 1 15 LYS H . 15 . HN 1 1 87 1 1 1 1 14 ARG HA . 14 . HA 1 1 87 1 2 1 1 14 ARG QB . 14 . HB* 1 1 88 1 1 1 1 14 ARG HA . 14 . HA 1 1 88 1 2 1 1 14 ARG QG . 14 . HG* 1 1 89 1 1 1 1 14 ARG HA . 14 . HA 1 1 89 1 2 1 1 15 LYS H . 15 . HN 1 1 90 1 1 1 1 14 ARG HA . 14 . HA 1 1 90 1 2 1 1 17 THR H . 17 . HN 1 1 91 1 1 1 1 14 ARG HA . 14 . HA 1 1 91 1 2 1 1 18 GLY H . 18 . HN 1 1 92 1 1 1 1 14 ARG O . 14 . O 1 1 92 1 2 1 1 18 GLY H . 18 . HN 1 1 93 1 1 1 1 14 ARG O . 14 . O 1 1 93 1 2 1 1 18 GLY N . 18 . N 1 1 94 1 1 1 1 15 LYS H . 15 . HN 1 1 94 1 2 1 1 16 GLN H . 16 . HN 1 1 95 1 1 1 1 15 LYS HA . 15 . HA 1 1 95 1 2 1 1 15 LYS HB2 . 15 . HB2 1 1 96 1 1 1 1 15 LYS HA . 15 . HA 1 1 96 1 2 1 1 15 LYS HB3 . 15 . HB1 1 1 97 1 1 1 1 15 LYS HA . 15 . HA 1 1 97 1 2 1 1 16 GLN H . 16 . HN 1 1 98 1 1 1 1 15 LYS QB . 15 . HB* 1 1 98 1 2 1 1 16 GLN H . 16 . HN 1 1 99 1 1 1 1 15 LYS HB2 . 15 . HB2 1 1 99 1 2 1 1 16 GLN H . 16 . HN 1 1 100 1 1 1 1 15 LYS HB3 . 15 . HB1 1 1 100 1 2 1 1 16 GLN H . 16 . HN 1 1 101 1 1 1 1 15 LYS QG . 15 . HG* 1 1 101 1 2 1 1 16 GLN H . 16 . HN 1 1 102 1 1 1 1 16 GLN H . 16 . HN 1 1 102 1 2 1 1 17 THR H . 17 . HN 1 1 103 1 1 1 1 16 GLN HA . 16 . HA 1 1 103 1 2 1 1 17 THR H . 17 . HN 1 1 104 1 1 1 1 16 GLN QB . 16 . HB* 1 1 104 1 2 1 1 17 THR H . 17 . HN 1 1 105 1 1 1 1 17 THR H . 17 . HN 1 1 105 1 2 1 1 17 THR HB . 17 . HB 1 1 106 1 1 1 1 17 THR H . 17 . HN 1 1 106 1 2 1 1 17 THR HG1 . 17 . HG* 1 1 106 1 2 1 1 17 THR MG . 17 . HG* 1 1 107 1 1 1 1 17 THR H . 17 . HN 1 1 107 1 2 1 1 18 GLY H . 18 . HN 1 1 108 1 1 1 1 17 THR HA . 17 . HA 1 1 108 1 2 1 1 18 GLY H . 18 . HN 1 1 109 1 1 1 1 18 GLY H . 18 . HN 1 1 109 1 2 1 1 18 GLY HA2 . 18 . HA2 1 1 110 1 1 1 1 18 GLY H . 18 . HN 1 1 110 1 2 1 1 18 GLY QA . 18 . HA* 1 1 111 1 1 1 1 18 GLY H . 18 . HN 1 1 111 1 2 1 1 18 GLY HA3 . 18 . HA1 1 1 112 1 1 1 1 18 GLY QA . 18 . HA* 1 1 112 1 2 1 1 19 CYS H . 19 . HN 1 1 113 1 1 1 1 18 GLY HA2 . 18 . HA2 1 1 113 1 2 1 1 19 CYS H . 19 . HN 1 1 114 1 1 1 1 18 GLY HA3 . 18 . HA1 1 1 114 1 2 1 1 19 CYS H . 19 . HN 1 1 115 1 1 1 1 19 CYS CB . 19 . CB 1 1 115 1 2 1 1 34 CYS SG . 34 . SG 1 1 116 1 1 1 1 19 CYS H . 19 . HN 1 1 116 1 2 1 1 19 CYS HA . 19 . HA 1 1 117 1 1 1 1 19 CYS HA . 19 . HA 1 1 117 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 118 1 1 1 1 19 CYS HA . 19 . HA 1 1 118 1 2 1 1 19 CYS QB . 19 . HB* 1 1 119 1 1 1 1 19 CYS HA . 19 . HA 1 1 119 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 120 1 1 1 1 19 CYS HA . 19 . HA 1 1 120 1 2 1 1 20 PRO QD . 20 . HD* 1 1 121 1 1 1 1 19 CYS SG . 19 . SG 1 1 121 1 2 1 1 34 CYS CB . 34 . CB 1 1 122 1 1 1 1 19 CYS SG . 19 . SG 1 1 122 1 2 1 1 34 CYS SG . 34 . SG 1 1 123 1 1 1 1 20 PRO QD . 20 . HD* 1 1 123 1 2 1 1 21 TYR H . 21 . HN 1 1 124 1 1 1 1 20 PRO HD2 . 20 . HD2 1 1 124 1 2 1 1 21 TYR H . 21 . HN 1 1 125 1 1 1 1 20 PRO HD3 . 20 . HD1 1 1 125 1 2 1 1 21 TYR H . 21 . HN 1 1 126 1 1 1 1 21 TYR CZ . 21 . CZ 1 1 126 1 2 1 1 21 TYR HA . 21 . HA 1 1 127 1 1 1 1 21 TYR H . 21 . HN 1 1 127 1 2 1 1 21 TYR HB2 . 21 . HB2 1 1 128 1 1 1 1 21 TYR H . 21 . HN 1 1 128 1 2 1 1 21 TYR QB . 21 . HB* 1 1 129 1 1 1 1 21 TYR H . 21 . HN 1 1 129 1 2 1 1 21 TYR HB3 . 21 . HB1 1 1 130 1 1 1 1 21 TYR HA . 21 . HA 1 1 130 1 2 1 1 22 GLY H . 22 . HN 1 1 131 1 1 1 1 21 TYR QB . 21 . HB* 1 1 131 1 2 1 1 32 ASN QD . 32 . HD* 1 1 132 1 1 1 1 21 TYR HB2 . 21 . HB2 1 1 132 1 2 1 1 22 GLY H . 22 . HN 1 1 133 1 1 1 1 21 TYR HB2 . 21 . HB2 1 1 133 1 2 1 1 32 ASN HD21 . 32 . HD21 1 1 134 1 1 1 1 21 TYR HB2 . 21 . HB2 1 1 134 1 2 1 1 32 ASN HD22 . 32 . HD22 1 1 135 1 1 1 1 21 TYR HB3 . 21 . HB1 1 1 135 1 2 1 1 22 GLY H . 22 . HN 1 1 136 1 1 1 1 21 TYR HB3 . 21 . HB1 1 1 136 1 2 1 1 32 ASN HD21 . 32 . HD21 1 1 137 1 1 1 1 21 TYR HB3 . 21 . HB1 1 1 137 1 2 1 1 32 ASN HD22 . 32 . HD22 1 1 138 1 1 1 1 22 GLY QA . 22 . HA* 1 1 138 1 2 1 1 23 LYS H . 23 . HN 1 1 139 1 1 1 1 22 GLY QA . 22 . HA* 1 1 139 1 2 1 1 31 CYS HA . 31 . HA 1 1 140 1 1 1 1 22 GLY QA . 22 . HA* 1 1 140 1 2 1 1 32 ASN H . 32 . HN 1 1 141 1 1 1 1 22 GLY HA2 . 22 . HA2 1 1 141 1 2 1 1 32 ASN H . 32 . HN 1 1 142 1 1 1 1 22 GLY HA3 . 22 . HA1 1 1 142 1 2 1 1 32 ASN H . 32 . HN 1 1 143 1 1 1 1 23 LYS H . 23 . HN 1 1 143 1 2 1 1 23 LYS HA . 23 . HA 1 1 144 1 1 1 1 23 LYS H . 23 . HN 1 1 144 1 2 1 1 30 LYS H . 30 . HN 1 1 145 1 1 1 1 23 LYS H . 23 . HN 1 1 145 1 2 1 1 31 CYS HA . 31 . HA 1 1 146 1 1 1 1 23 LYS H . 23 . HN 1 1 146 1 2 1 1 31 CYS O . 31 . O 1 1 147 1 1 1 1 23 LYS N . 23 . N 1 1 147 1 2 1 1 31 CYS O . 31 . O 1 1 148 1 1 1 1 24 CYS HA . 24 . HA 1 1 148 1 2 1 1 25 MET H . 25 . HN 1 1 149 1 1 1 1 24 CYS HA . 24 . HA 1 1 149 1 2 1 1 29 CYS HA . 29 . HA 1 1 150 1 1 1 1 24 CYS HA . 24 . HA 1 1 150 1 2 1 1 30 LYS H . 30 . HN 1 1 151 1 1 1 1 24 CYS QB . 24 . HB* 1 1 151 1 2 1 1 25 MET H . 25 . HN 1 1 152 1 1 1 1 24 CYS QB . 24 . HB* 1 1 152 1 2 1 1 31 CYS H . 31 . HN 1 1 153 1 1 1 1 24 CYS HB2 . 24 . HB2 1 1 153 1 2 1 1 31 CYS H . 31 . HN 1 1 154 1 1 1 1 24 CYS HB3 . 24 . HB1 1 1 154 1 2 1 1 31 CYS H . 31 . HN 1 1 155 1 1 1 1 25 MET H . 25 . HN 1 1 155 1 2 1 1 28 LYS H . 28 . HN 1 1 156 1 1 1 1 25 MET H . 25 . HN 1 1 156 1 2 1 1 28 LYS O . 28 . O 1 1 157 1 1 1 1 25 MET HA . 25 . HA 1 1 157 1 2 1 1 26 ASN H . 26 . HN 1 1 158 1 1 1 1 25 MET QB . 25 . HB* 1 1 158 1 2 1 1 26 ASN H . 26 . HN 1 1 159 1 1 1 1 25 MET N . 25 . N 1 1 159 1 2 1 1 28 LYS O . 28 . O 1 1 160 1 1 1 1 25 MET O . 25 . O 1 1 160 1 2 1 1 28 LYS H . 28 . HN 1 1 161 1 1 1 1 25 MET O . 25 . O 1 1 161 1 2 1 1 28 LYS N . 28 . N 1 1 162 1 1 1 1 26 ASN H . 26 . HN 1 1 162 1 2 1 1 27 ARG H . 27 . HN 1 1 163 1 1 1 1 26 ASN HA . 26 . HA 1 1 163 1 2 1 1 27 ARG H . 27 . HN 1 1 164 1 1 1 1 26 ASN QB . 26 . HB* 1 1 164 1 2 1 1 27 ARG H . 27 . HN 1 1 165 1 1 1 1 26 ASN HB2 . 26 . HB2 1 1 165 1 2 1 1 27 ARG H . 27 . HN 1 1 166 1 1 1 1 26 ASN HB3 . 26 . HB1 1 1 166 1 2 1 1 27 ARG H . 27 . HN 1 1 167 1 1 1 1 27 ARG H . 27 . HN 1 1 167 1 2 1 1 28 LYS H . 28 . HN 1 1 168 1 1 1 1 27 ARG HA . 27 . HA 1 1 168 1 2 1 1 27 ARG QD . 27 . HD* 1 1 169 1 1 1 1 27 ARG HA . 27 . HA 1 1 169 1 2 1 1 27 ARG HG2 . 27 . HG2 1 1 170 1 1 1 1 27 ARG HA . 27 . HA 1 1 170 1 2 1 1 27 ARG QG . 27 . HG* 1 1 171 1 1 1 1 27 ARG HA . 27 . HA 1 1 171 1 2 1 1 27 ARG HG3 . 27 . HG1 1 1 172 1 1 1 1 27 ARG HA . 27 . HA 1 1 172 1 2 1 1 28 LYS H . 28 . HN 1 1 173 1 1 1 1 28 LYS H . 28 . HN 1 1 173 1 2 1 1 28 LYS QB . 28 . HB* 1 1 174 1 1 1 1 28 LYS H . 28 . HN 1 1 174 1 2 1 1 28 LYS QD . 28 . HD* 1 1 175 1 1 1 1 28 LYS HA . 28 . HA 1 1 175 1 2 1 1 28 LYS QD . 28 . HD* 1 1 176 1 1 1 1 28 LYS HA . 28 . HA 1 1 176 1 2 1 1 28 LYS QG . 28 . HG* 1 1 177 1 1 1 1 28 LYS HA . 28 . HA 1 1 177 1 2 1 1 29 CYS H . 29 . HN 1 1 178 1 1 1 1 28 LYS QD . 28 . HD* 1 1 178 1 2 1 1 29 CYS H . 29 . HN 1 1 179 1 1 1 1 29 CYS H . 29 . HN 1 1 179 1 2 1 1 29 CYS HA . 29 . HA 1 1 180 1 1 1 1 29 CYS H . 29 . HN 1 1 180 1 2 1 1 29 CYS HB2 . 29 . HB2 1 1 181 1 1 1 1 29 CYS H . 29 . HN 1 1 181 1 2 1 1 29 CYS QB . 29 . HB* 1 1 182 1 1 1 1 29 CYS H . 29 . HN 1 1 182 1 2 1 1 29 CYS HB3 . 29 . HB1 1 1 183 1 1 1 1 29 CYS HA . 29 . HA 1 1 183 1 2 1 1 29 CYS HB2 . 29 . HB2 1 1 184 1 1 1 1 29 CYS HA . 29 . HA 1 1 184 1 2 1 1 29 CYS QB . 29 . HB* 1 1 185 1 1 1 1 29 CYS HA . 29 . HA 1 1 185 1 2 1 1 29 CYS HB3 . 29 . HB1 1 1 186 1 1 1 1 29 CYS HA . 29 . HA 1 1 186 1 2 1 1 30 LYS H . 30 . HN 1 1 187 1 1 1 1 29 CYS QB . 29 . HB* 1 1 187 1 2 1 1 30 LYS H . 30 . HN 1 1 188 1 1 1 1 29 CYS HB2 . 29 . HB2 1 1 188 1 2 1 1 30 LYS H . 30 . HN 1 1 189 1 1 1 1 29 CYS HB3 . 29 . HB1 1 1 189 1 2 1 1 30 LYS H . 30 . HN 1 1 190 1 1 1 1 30 LYS HA . 30 . HA 1 1 190 1 2 1 1 31 CYS H . 31 . HN 1 1 191 1 1 1 1 31 CYS HA . 31 . HA 1 1 191 1 2 1 1 32 ASN H . 32 . HN 1 1 192 1 1 1 1 31 CYS QB . 31 . HB* 1 1 192 1 2 1 1 32 ASN H . 32 . HN 1 1 193 1 1 1 1 32 ASN H . 32 . HN 1 1 193 1 2 1 1 32 ASN HB2 . 32 . HB2 1 1 194 1 1 1 1 32 ASN H . 32 . HN 1 1 194 1 2 1 1 32 ASN QB . 32 . HB* 1 1 195 1 1 1 1 32 ASN H . 32 . HN 1 1 195 1 2 1 1 32 ASN HB3 . 32 . HB1 1 1 196 1 1 1 1 32 ASN HA . 32 . HA 1 1 196 1 2 1 1 32 ASN HB2 . 32 . HB2 1 1 197 1 1 1 1 32 ASN HA . 32 . HA 1 1 197 1 2 1 1 32 ASN HB3 . 32 . HB1 1 1 198 1 1 1 1 32 ASN HA . 32 . HA 1 1 198 1 2 1 1 33 ARG H . 33 . HN 1 1 199 1 1 1 1 32 ASN QB . 32 . HB* 1 1 199 1 2 1 1 33 ARG H . 33 . HN 1 1 200 1 1 1 1 32 ASN HB2 . 32 . HB2 1 1 200 1 2 1 1 33 ARG H . 33 . HN 1 1 201 1 1 1 1 32 ASN HB3 . 32 . HB1 1 1 201 1 2 1 1 33 ARG H . 33 . HN 1 1 202 1 1 1 1 33 ARG HA . 33 . HA 1 1 202 1 2 1 1 33 ARG QD . 33 . HD* 1 1 203 1 1 1 1 33 ARG HA . 33 . HA 1 1 203 1 2 1 1 33 ARG QG . 33 . HG* 1 1 204 1 1 1 1 33 ARG HA . 33 . HA 1 1 204 1 2 1 1 34 CYS H . 34 . HN 1 1 205 1 1 1 1 33 ARG QD . 33 . HD* 1 1 205 1 2 1 1 34 CYS H . 34 . HN 1 1 206 1 1 1 1 34 CYS H . 34 . HN 1 1 206 1 2 1 1 34 CYS HB2 . 34 . HB2 1 1 207 1 1 1 1 34 CYS H . 34 . HN 1 1 207 1 2 1 1 34 CYS QB . 34 . HB* 1 1 208 1 1 1 1 34 CYS H . 34 . HN 1 1 208 1 2 1 1 34 CYS HB3 . 34 . HB1 1 1 209 1 1 1 1 34 CYS HA . 34 . HA 1 1 209 1 2 1 1 34 CYS HB2 . 34 . HB2 1 1 210 1 1 1 1 34 CYS HA . 34 . HA 1 1 210 1 2 1 1 34 CYS QB . 34 . HB* 1 1 211 1 1 1 1 34 CYS HA . 34 . HA 1 1 211 1 2 1 1 34 CYS HB3 . 34 . HB1 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 . . . . . 2.9 1.8 2.9 1 1 2 1 . . . . . 2.2 1.8 2.2 1 1 3 1 . . . . . 3.0 1.8 3.0 1 1 4 1 . . . . . 6.2 1.8 6.2 1 1 5 1 . . . . . 2.2 1.8 2.2 1 1 6 1 . . . . . 3.7 1.8 3.7 1 1 7 1 . . . . . 3.1 1.8 3.1 1 1 8 1 . . . . . 2.5 1.8 2.5 1 1 9 1 . . . . . 2.9 1.8 2.9 1 1 10 1 . . . . . 3.6 1.8 3.6 1 1 11 1 . . . . . 3.2 1.8 3.2 1 1 12 1 . . . . . 3.2 1.8 3.2 1 1 13 1 . . . . . 3.1 1.8 3.1 1 1 14 1 . . . . . 2.1 1.8 2.1 1 1 15 1 . . . . . 4.0 1.8 4.0 1 1 16 1 . . . . . 3.0 1.8 3.0 1 1 17 1 . . . . . 6.4 1.8 6.4 1 1 18 1 . . . . . 7.8 1.8 7.8 1 1 19 1 . . . . . 8.0 1.8 8.0 1 1 20 1 . . . . . 3.2 1.8 3.2 1 1 21 1 . . . . . 5.6 1.8 5.6 1 1 22 1 . . . . . 3.1 1.8 3.1 1 1 23 1 . . . . . 2.8 1.8 2.8 1 1 24 1 . . . . . 2.8 1.8 2.8 1 1 25 1 . . . . . 3.5 1.8 3.5 1 1 26 1 . . . . . 4.6 1.8 4.6 1 1 27 1 . . . . . 4.2 1.8 4.2 1 1 28 1 . . . . . 4.5 1.8 4.5 1 1 29 1 . . . . . 2.8 1.8 2.8 1 1 30 1 . . . . . 6.3 1.8 6.3 1 1 31 1 . . . . . 2.8 1.8 2.8 1 1 32 1 . . . . . 3.3 1.8 3.3 1 1 33 1 . . . . . 4.4 1.8 4.4 1 1 34 1 . . . . . 3.1 1.8 3.1 1 1 35 1 . . . . . 2.9 1.8 2.9 1 1 36 1 . . . . . 2.7 1.8 2.7 1 1 37 1 . . . . . 2.9 1.8 2.9 1 1 38 1 . . . . . 2.8 1.8 2.8 1 1 39 1 . . . . . 2.9 1.8 2.9 1 1 40 1 . . . . . 2.7 1.8 2.7 1 1 41 1 . . . . . 2.9 1.8 2.9 1 1 42 1 . . . . . 3.6 1.8 3.6 1 1 43 1 . . . . . 3.9 1.8 3.9 1 1 44 1 . . . . . 4.6 1.8 4.6 1 1 45 1 . . . . . 2.9 1.8 2.9 1 1 46 1 . . . . . 3.2 1.8 3.2 1 1 47 1 . . . . . 3.2 1.8 3.2 1 1 48 1 . . . . . 3.1 1.8 3.1 1 1 49 1 . . . . . 2.1 1.8 2.1 1 1 50 1 . . . . . 8.6 1.8 8.6 1 1 51 1 . . . . . 2.9 1.8 2.9 1 1 52 1 . . . . . 3.4 1.8 3.4 1 1 53 1 . . . . . 2.8 1.8 2.8 1 1 54 1 . . . . . 5.2 1.8 5.2 1 1 55 1 . . . . . 3.6 1.8 3.6 1 1 56 1 . . . . . 2.2 1.8 2.2 1 1 57 1 . . . . . 3.2 1.8 3.2 1 1 58 1 . . . . . 3.6 1.8 3.6 1 1 59 1 . . . . . 4.4 1.8 4.4 1 1 60 1 . . . . . 3.5 1.8 3.5 1 1 61 1 . . . . . 4.2 1.8 4.2 1 1 62 1 . . . . . 4.6 1.8 4.6 1 1 63 1 . . . . . 2.2 1.8 2.2 1 1 64 1 . . . . . 3.2 1.8 3.2 1 1 65 1 . . . . . 4.0 1.8 4.0 1 1 66 1 . . . . . 4.9 1.8 4.9 1 1 67 1 . . . . . 4.0 1.8 4.0 1 1 68 1 . . . . . 4.3 1.8 4.3 1 1 69 1 . . . . . 4.3 1.8 4.3 1 1 70 1 . . . . . 3.1 1.8 3.1 1 1 71 1 . . . . . 2.8 1.8 2.8 1 1 72 1 . . . . . 2.9 1.8 2.9 1 1 73 1 . . . . . 2.7 1.8 2.7 1 1 74 1 . . . . . 2.9 1.8 2.9 1 1 75 1 . . . . . 3.6 1.8 3.6 1 1 76 1 . . . . . 3.2 1.8 3.2 1 1 77 1 . . . . . 5.5 1.8 5.5 1 1 78 1 . . . . . 2.9 1.8 2.9 1 1 79 1 . . . . . 3.2 1.8 3.2 1 1 80 1 . . . . . 3.2 1.8 3.2 1 1 81 1 . . . . . 2.2 1.8 2.2 1 1 82 1 . . . . . 3.2 1.8 3.2 1 1 83 1 . . . . . 3.1 1.8 3.1 1 1 84 1 . . . . . 2.1 1.8 2.1 1 1 85 1 . . . . . 2.7 1.8 2.7 1 1 86 1 . . . . . 2.8 1.8 2.8 1 1 87 1 . . . . . 2.6 1.8 2.6 1 1 88 1 . . . . . 3.3 1.8 3.3 1 1 89 1 . . . . . 3.6 1.8 3.6 1 1 90 1 . . . . . 3.5 1.8 3.5 1 1 91 1 . . . . . 3.5 1.8 3.5 1 1 92 1 . . . . . 2.2 1.8 2.2 1 1 93 1 . . . . . 3.2 1.8 3.2 1 1 94 1 . . . . . 2.8 1.8 2.8 1 1 95 1 . . . . . 2.9 1.8 2.9 1 1 96 1 . . . . . 2.9 1.8 2.9 1 1 97 1 . . . . . 3.6 1.8 3.6 1 1 98 1 . . . . . 2.9 1.8 2.9 1 1 99 1 . . . . . 3.3 1.8 3.3 1 1 100 1 . . . . . 3.3 1.8 3.3 1 1 101 1 . . . . . 7.3 1.8 7.3 1 1 102 1 . . . . . 2.8 1.8 2.8 1 1 103 1 . . . . . 3.6 1.8 3.6 1 1 104 1 . . . . . 3.7 1.8 3.7 1 1 105 1 . . . . . 3.2 1.8 3.2 1 1 106 1 . . . . . 3.6 1.8 3.6 1 1 107 1 . . . . . 2.8 1.8 2.8 1 1 108 1 . . . . . 3.5 1.8 3.5 1 1 109 1 . . . . . 2.8 1.8 2.8 1 1 110 1 . . . . . 2.6 1.8 2.6 1 1 111 1 . . . . . 2.8 1.8 2.8 1 1 112 1 . . . . . 2.9 1.8 2.9 1 1 113 1 . . . . . 3.2 1.8 3.2 1 1 114 1 . . . . . 3.2 1.8 3.2 1 1 115 1 . . . . . 3.1 1.8 3.1 1 1 116 1 . . . . . 2.5 1.8 2.5 1 1 117 1 . . . . . 2.5 1.8 2.5 1 1 118 1 . . . . . 2.2 1.8 2.2 1 1 119 1 . . . . . 2.5 1.8 2.5 1 1 120 1 . . . . . 2.9 1.8 2.9 1 1 121 1 . . . . . 3.1 1.8 3.1 1 1 122 1 . . . . . 2.1 1.8 2.1 1 1 123 1 . . . . . 3.8 1.8 3.8 1 1 124 1 . . . . . 4.2 1.8 4.2 1 1 125 1 . . . . . 4.2 1.8 4.2 1 1 126 1 . . . . . 5.6 1.8 5.6 1 1 127 1 . . . . . 3.3 1.8 3.3 1 1 128 1 . . . . . 3.1 1.8 3.1 1 1 129 1 . . . . . 3.3 1.8 3.3 1 1 130 1 . . . . . 2.4 1.8 2.4 1 1 131 1 . . . . . 5.0 1.8 5.0 1 1 132 1 . . . . . 3.1 1.8 3.1 1 1 133 1 . . . . . 5.7 1.8 5.7 1 1 134 1 . . . . . 5.7 1.8 5.7 1 1 135 1 . . . . . 3.1 1.8 3.1 1 1 136 1 . . . . . 5.7 1.8 5.7 1 1 137 1 . . . . . 5.7 1.8 5.7 1 1 138 1 . . . . . 3.0 1.8 3.0 1 1 139 1 . . . . . 3.3 1.8 3.3 1 1 140 1 . . . . . 3.0 1.8 3.0 1 1 141 1 . . . . . 3.3 1.8 3.3 1 1 142 1 . . . . . 3.3 1.8 3.3 1 1 143 1 . . . . . 2.9 1.8 2.9 1 1 144 1 . . . . . 4.4 1.8 4.4 1 1 145 1 . . . . . 3.8 1.8 3.8 1 1 146 1 . . . . . 2.4 1.8 2.4 1 1 147 1 . . . . . 3.2 1.8 3.2 1 1 148 1 . . . . . 2.2 1.8 2.2 1 1 149 1 . . . . . 2.5 1.8 2.5 1 1 150 1 . . . . . 5.1 1.8 5.1 1 1 151 1 . . . . . 4.7 1.8 4.7 1 1 152 1 . . . . . 4.8 1.8 4.8 1 1 153 1 . . . . . 5.3 1.8 5.3 1 1 154 1 . . . . . 5.3 1.8 5.3 1 1 155 1 . . . . . 5.7 1.8 5.7 1 1 156 1 . . . . . 2.2 1.8 2.2 1 1 157 1 . . . . . 2.2 1.8 2.2 1 1 158 1 . . . . . 4.4 1.8 4.4 1 1 159 1 . . . . . 3.2 1.8 3.2 1 1 160 1 . . . . . 2.2 1.8 2.2 1 1 161 1 . . . . . 3.2 1.8 3.2 1 1 162 1 . . . . . 5.2 1.8 5.2 1 1 163 1 . . . . . 2.2 1.8 2.2 1 1 164 1 . . . . . 3.7 1.8 3.7 1 1 165 1 . . . . . 3.9 1.8 3.9 1 1 166 1 . . . . . 3.9 1.8 3.9 1 1 167 1 . . . . . 2.4 1.8 2.4 1 1 168 1 . . . . . 3.9 1.8 3.9 1 1 169 1 . . . . . 3.2 1.8 3.2 1 1 170 1 . . . . . 2.9 1.8 2.9 1 1 171 1 . . . . . 3.2 1.8 3.2 1 1 172 1 . . . . . 2.9 1.8 2.9 1 1 173 1 . . . . . 3.6 1.8 3.6 1 1 174 1 . . . . . 5.7 1.8 5.7 1 1 175 1 . . . . . 4.0 1.8 4.0 1 1 176 1 . . . . . 3.9 1.8 3.9 1 1 177 1 . . . . . 2.2 1.8 2.2 1 1 178 1 . . . . . 4.5 1.8 4.5 1 1 179 1 . . . . . 2.8 1.8 2.8 1 1 180 1 . . . . . 3.0 1.8 3.0 1 1 181 1 . . . . . 2.7 1.8 2.7 1 1 182 1 . . . . . 3.0 1.8 3.0 1 1 183 1 . . . . . 2.9 1.8 2.9 1 1 184 1 . . . . . 2.7 1.8 2.7 1 1 185 1 . . . . . 2.9 1.8 2.9 1 1 186 1 . . . . . 2.4 1.8 2.4 1 1 187 1 . . . . . 3.5 1.8 3.5 1 1 188 1 . . . . . 3.9 1.8 3.9 1 1 189 1 . . . . . 3.9 1.8 3.9 1 1 190 1 . . . . . 2.2 1.8 2.2 1 1 191 1 . . . . . 2.2 1.8 2.2 1 1 192 1 . . . . . 3.6 1.8 3.6 1 1 193 1 . . . . . 2.7 1.8 2.7 1 1 194 1 . . . . . 2.4 1.8 2.4 1 1 195 1 . . . . . 2.7 1.8 2.7 1 1 196 1 . . . . . 2.9 1.8 2.9 1 1 197 1 . . . . . 2.9 1.8 2.9 1 1 198 1 . . . . . 2.5 1.8 2.5 1 1 199 1 . . . . . 3.3 1.8 3.3 1 1 200 1 . . . . . 3.7 1.8 3.7 1 1 201 1 . . . . . 3.7 1.8 3.7 1 1 202 1 . . . . . 3.4 1.8 3.4 1 1 203 1 . . . . . 3.8 1.8 3.8 1 1 204 1 . . . . . 2.2 1.8 2.2 1 1 205 1 . . . . . 4.6 1.8 4.6 1 1 206 1 . . . . . 3.0 1.8 3.0 1 1 207 1 . . . . . 2.7 1.8 2.7 1 1 208 1 . . . . . 3.0 1.8 3.0 1 1 209 1 . . . . . 2.9 1.8 2.9 1 1 210 1 . . . . . 2.7 1.8 2.7 1 1 211 1 . . . . . 2.9 1.8 2.9 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 VAL C C -6.754 2.943 -5.492 1.00 . A A . 1 VAL C 1 1 1 2 1 1 1 VAL CA C -7.501 2.036 -6.465 1.00 . A A . 1 VAL CA 1 1 1 3 1 1 1 VAL CB C -8.658 1.349 -5.717 1.00 . A A . 1 VAL CB 1 1 1 4 1 1 1 VAL CG1 C -9.658 0.762 -6.701 1.00 . A A . 1 VAL CG1 1 1 1 5 1 1 1 VAL CG2 C -8.126 0.273 -4.781 1.00 . A A . 1 VAL CG2 1 1 1 6 1 1 1 VAL H1 H -5.895 0.755 -6.351 1.00 . A A . 1 VAL H1 1 1 1 7 1 1 1 VAL H2 H -6.116 1.494 -7.885 1.00 . A A . 1 VAL H2 1 1 1 8 1 1 1 VAL H3 H -7.159 0.227 -7.382 1.00 . A A . 1 VAL H3 1 1 1 9 1 1 1 VAL HA H -7.919 2.642 -7.255 1.00 . A A . 1 VAL HA 1 1 1 10 1 1 1 VAL HB H -9.168 2.092 -5.121 1.00 . A A . 1 VAL HB 1 1 1 11 1 1 1 VAL HG11 H -10.028 1.544 -7.347 1.00 . A A . 1 VAL HG11 1 1 1 12 1 1 1 VAL HG12 H -10.483 0.323 -6.159 1.00 . A A . 1 VAL HG12 1 1 1 13 1 1 1 VAL HG13 H -9.174 0.001 -7.296 1.00 . A A . 1 VAL HG13 1 1 1 14 1 1 1 VAL HG21 H -8.705 0.269 -3.870 1.00 . A A . 1 VAL HG21 1 1 1 15 1 1 1 VAL HG22 H -7.091 0.479 -4.549 1.00 . A A . 1 VAL HG22 1 1 1 16 1 1 1 VAL HG23 H -8.202 -0.692 -5.261 1.00 . A A . 1 VAL HG23 1 1 1 17 1 1 1 VAL N N -6.585 1.038 -7.075 1.00 . A A . 1 VAL N 1 1 1 18 1 1 1 VAL O O -5.896 2.487 -4.737 1.00 . A A . 1 VAL O 1 1 1 19 1 1 2 SER C C -7.368 5.567 -3.473 1.00 . A A . 2 SER C 1 1 1 20 1 1 2 SER CA C -6.450 5.200 -4.635 1.00 . A A . 2 SER CA 1 1 1 21 1 1 2 SER CB C -6.072 6.458 -5.418 1.00 . A A . 2 SER CB 1 1 1 22 1 1 2 SER H H -7.781 4.532 -6.139 1.00 . A A . 2 SER H 1 1 1 23 1 1 2 SER HA H -5.552 4.749 -4.240 1.00 . A A . 2 SER HA 1 1 1 24 1 1 2 SER HB2 H -5.849 7.258 -4.727 1.00 . A A . 2 SER HB2 1 1 1 25 1 1 2 SER HB3 H -5.202 6.255 -6.025 1.00 . A A . 2 SER HB3 1 1 1 26 1 1 2 SER HG H -7.128 6.341 -7.065 1.00 . A A . 2 SER HG 1 1 1 27 1 1 2 SER N N -7.089 4.229 -5.515 1.00 . A A . 2 SER N 1 1 1 28 1 1 2 SER O O -8.537 5.895 -3.672 1.00 . A A . 2 SER O 1 1 1 29 1 1 2 SER OG O -7.132 6.871 -6.264 1.00 . A A . 2 SER OG 1 1 1 30 1 1 3 CYS C C -7.132 7.158 -0.463 1.00 . A A . 3 CYS C 1 1 1 31 1 1 3 CYS CA C -7.599 5.835 -1.064 1.00 . A A . 3 CYS CA 1 1 1 32 1 1 3 CYS CB C -7.476 4.716 -0.028 1.00 . A A . 3 CYS CB 1 1 1 33 1 1 3 CYS H H -5.891 5.240 -2.165 1.00 . A A . 3 CYS H 1 1 1 34 1 1 3 CYS HA H -8.634 5.933 -1.354 1.00 . A A . 3 CYS HA 1 1 1 35 1 1 3 CYS HB2 H -6.522 4.802 0.472 1.00 . A A . 3 CYS HB2 1 1 1 36 1 1 3 CYS HB3 H -8.267 4.820 0.700 1.00 . A A . 3 CYS HB3 1 1 1 37 1 1 3 CYS N N -6.829 5.509 -2.259 1.00 . A A . 3 CYS N 1 1 1 38 1 1 3 CYS O O -6.122 7.719 -0.885 1.00 . A A . 3 CYS O 1 1 1 39 1 1 3 CYS SG S -7.584 3.037 -0.730 1.00 . A A . 3 CYS SG 1 1 1 40 1 1 4 THR C C -8.283 9.050 2.503 1.00 . A A . 4 THR C 1 1 1 41 1 1 4 THR CA C -7.535 8.905 1.182 1.00 . A A . 4 THR CA 1 1 1 42 1 1 4 THR CB C -7.859 10.087 0.267 1.00 . A A . 4 THR CB 1 1 1 43 1 1 4 THR CG2 C -7.192 11.376 0.696 1.00 . A A . 4 THR CG2 1 1 1 44 1 1 4 THR H H -8.669 7.155 0.816 1.00 . A A . 4 THR H 1 1 1 45 1 1 4 THR HA H -6.473 8.898 1.382 1.00 . A A . 4 THR HA 1 1 1 46 1 1 4 THR HB H -8.926 10.249 0.271 1.00 . A A . 4 THR HB 1 1 1 47 1 1 4 THR HG1 H -6.544 9.510 -1.066 1.00 . A A . 4 THR HG1 1 1 1 48 1 1 4 THR HG21 H -7.332 12.126 -0.069 1.00 . A A . 4 THR HG21 1 1 1 49 1 1 4 THR HG22 H -6.136 11.205 0.843 1.00 . A A . 4 THR HG22 1 1 1 50 1 1 4 THR HG23 H -7.634 11.719 1.620 1.00 . A A . 4 THR HG23 1 1 1 51 1 1 4 THR N N -7.874 7.648 0.524 1.00 . A A . 4 THR N 1 1 1 52 1 1 4 THR O O -8.605 10.160 2.926 1.00 . A A . 4 THR O 1 1 1 53 1 1 4 THR OG1 O -7.454 9.817 -1.063 1.00 . A A . 4 THR OG1 1 1 1 54 1 1 5 GLY C C -8.662 6.986 5.427 1.00 . A A . 5 GLY C 1 1 1 55 1 1 5 GLY CA C -9.260 7.945 4.417 1.00 . A A . 5 GLY CA 1 1 1 56 1 1 5 GLY H H -8.271 7.067 2.765 1.00 . A A . 5 GLY H 1 1 1 57 1 1 5 GLY HA2 H -9.223 8.945 4.821 1.00 . A A . 5 GLY HA2 1 1 1 58 1 1 5 GLY HA3 H -10.291 7.673 4.248 1.00 . A A . 5 GLY HA3 1 1 1 59 1 1 5 GLY N N -8.554 7.922 3.150 1.00 . A A . 5 GLY N 1 1 1 60 1 1 5 GLY O O -9.147 5.867 5.595 1.00 . A A . 5 GLY O 1 1 1 61 1 1 6 SER C C -6.021 7.437 7.983 1.00 . A A . 6 SER C 1 1 1 62 1 1 6 SER CA C -6.931 6.593 7.092 1.00 . A A . 6 SER CA 1 1 1 63 1 1 6 SER CB C -6.124 5.492 6.397 1.00 . A A . 6 SER CB 1 1 1 64 1 1 6 SER H H -7.258 8.323 5.917 1.00 . A A . 6 SER H 1 1 1 65 1 1 6 SER HA H -7.692 6.135 7.707 1.00 . A A . 6 SER HA 1 1 1 66 1 1 6 SER HB2 H -5.209 5.911 6.007 1.00 . A A . 6 SER HB2 1 1 1 67 1 1 6 SER HB3 H -5.889 4.717 7.111 1.00 . A A . 6 SER HB3 1 1 1 68 1 1 6 SER HG H -6.573 5.315 4.499 1.00 . A A . 6 SER HG 1 1 1 69 1 1 6 SER N N -7.600 7.422 6.098 1.00 . A A . 6 SER N 1 1 1 70 1 1 6 SER O O -6.202 8.649 8.100 1.00 . A A . 6 SER O 1 1 1 71 1 1 6 SER OG O -6.857 4.921 5.327 1.00 . A A . 6 SER OG 1 1 1 72 1 1 7 LYS C C -2.684 7.373 8.935 1.00 . A A . 7 LYS C 1 1 1 73 1 1 7 LYS CA C -4.100 7.481 9.484 1.00 . A A . 7 LYS CA 1 1 1 74 1 1 7 LYS CB C -4.162 6.898 10.897 1.00 . A A . 7 LYS CB 1 1 1 75 1 1 7 LYS CD C -5.524 4.788 10.795 1.00 . A A . 7 LYS CD 1 1 1 76 1 1 7 LYS CE C -5.513 3.521 9.955 1.00 . A A . 7 LYS CE 1 1 1 77 1 1 7 LYS CG C -4.129 5.379 10.930 1.00 . A A . 7 LYS CG 1 1 1 78 1 1 7 LYS H H -4.941 5.827 8.475 1.00 . A A . 7 LYS H 1 1 1 79 1 1 7 LYS HA H -4.383 8.523 9.520 1.00 . A A . 7 LYS HA 1 1 1 80 1 1 7 LYS HB2 H -3.321 7.267 11.464 1.00 . A A . 7 LYS HB2 1 1 1 81 1 1 7 LYS HB3 H -5.075 7.227 11.370 1.00 . A A . 7 LYS HB3 1 1 1 82 1 1 7 LYS HD2 H -5.901 4.553 11.779 1.00 . A A . 7 LYS HD2 1 1 1 83 1 1 7 LYS HD3 H -6.168 5.516 10.324 1.00 . A A . 7 LYS HD3 1 1 1 84 1 1 7 LYS HE2 H -6.400 3.505 9.340 1.00 . A A . 7 LYS HE2 1 1 1 85 1 1 7 LYS HE3 H -4.636 3.530 9.324 1.00 . A A . 7 LYS HE3 1 1 1 86 1 1 7 LYS HG2 H -3.519 5.024 10.113 1.00 . A A . 7 LYS HG2 1 1 1 87 1 1 7 LYS HG3 H -3.701 5.057 11.869 1.00 . A A . 7 LYS HG3 1 1 1 88 1 1 7 LYS HZ1 H -4.510 1.956 10.911 1.00 . A A . 7 LYS HZ1 1 1 1 89 1 1 7 LYS HZ2 H -6.055 1.545 10.359 1.00 . A A . 7 LYS HZ2 1 1 1 90 1 1 7 LYS HZ3 H -5.880 2.502 11.742 1.00 . A A . 7 LYS HZ3 1 1 1 91 1 1 7 LYS N N -5.040 6.791 8.609 1.00 . A A . 7 LYS N 1 1 1 92 1 1 7 LYS NZ N -5.487 2.295 10.801 1.00 . A A . 7 LYS NZ 1 1 1 93 1 1 7 LYS O O -1.732 7.134 9.679 1.00 . A A . 7 LYS O 1 1 1 94 1 1 8 ASP C C -0.937 6.012 6.592 1.00 . A A . 8 ASP C 1 1 1 95 1 1 8 ASP CA C -1.274 7.459 6.930 1.00 . A A . 8 ASP CA 1 1 1 96 1 1 8 ASP CB C -0.154 8.076 7.768 1.00 . A A . 8 ASP CB 1 1 1 97 1 1 8 ASP CG C 0.768 8.955 6.946 1.00 . A A . 8 ASP CG 1 1 1 98 1 1 8 ASP H H -3.369 7.716 7.091 1.00 . A A . 8 ASP H 1 1 1 99 1 1 8 ASP HA H -1.363 8.012 6.007 1.00 . A A . 8 ASP HA 1 1 1 100 1 1 8 ASP HB2 H -0.590 8.677 8.550 1.00 . A A . 8 ASP HB2 1 1 1 101 1 1 8 ASP HB3 H 0.430 7.285 8.210 1.00 . A A . 8 ASP HB3 1 1 1 102 1 1 8 ASP N N -2.562 7.540 7.619 1.00 . A A . 8 ASP N 1 1 1 103 1 1 8 ASP O O -0.097 5.385 7.236 1.00 . A A . 8 ASP O 1 1 1 104 1 1 8 ASP OD1 O 0.262 9.868 6.261 1.00 . A A . 8 ASP OD1 1 1 1 105 1 1 8 ASP OD2 O 1.996 8.731 6.988 1.00 . A A . 8 ASP OD2 1 1 1 106 1 1 9 CYS C C -0.428 4.061 3.972 1.00 . A A . 9 CYS C 1 1 1 107 1 1 9 CYS CA C -1.406 4.122 5.132 1.00 . A A . 9 CYS CA 1 1 1 108 1 1 9 CYS CB C -2.728 3.506 4.713 1.00 . A A . 9 CYS CB 1 1 1 109 1 1 9 CYS H H -2.266 6.055 5.115 1.00 . A A . 9 CYS H 1 1 1 110 1 1 9 CYS HA H -1.012 3.563 5.950 1.00 . A A . 9 CYS HA 1 1 1 111 1 1 9 CYS HB2 H -3.517 3.968 5.275 1.00 . A A . 9 CYS HB2 1 1 1 112 1 1 9 CYS HB3 H -2.876 3.696 3.669 1.00 . A A . 9 CYS HB3 1 1 1 113 1 1 9 CYS N N -1.610 5.495 5.577 1.00 . A A . 9 CYS N 1 1 1 114 1 1 9 CYS O O 0.664 3.506 4.087 1.00 . A A . 9 CYS O 1 1 1 115 1 1 9 CYS SG S -2.832 1.706 4.973 1.00 . A A . 9 CYS SG 1 1 1 116 1 1 10 TYR C C 1.399 5.158 1.951 1.00 . A A . 10 TYR C 1 1 1 117 1 1 10 TYR CA C -0.011 4.653 1.649 1.00 . A A . 10 TYR CA 1 1 1 118 1 1 10 TYR CB C -0.657 5.531 0.577 1.00 . A A . 10 TYR CB 1 1 1 119 1 1 10 TYR CD1 C -2.845 4.286 0.368 1.00 . A A . 10 TYR CD1 1 1 1 120 1 1 10 TYR CD2 C -1.580 4.683 -1.613 1.00 . A A . 10 TYR CD2 1 1 1 121 1 1 10 TYR CE1 C -3.812 3.635 -0.374 1.00 . A A . 10 TYR CE1 1 1 1 122 1 1 10 TYR CE2 C -2.544 4.034 -2.362 1.00 . A A . 10 TYR CE2 1 1 1 123 1 1 10 TYR CG C -1.713 4.819 -0.237 1.00 . A A . 10 TYR CG 1 1 1 124 1 1 10 TYR CZ C -3.656 3.512 -1.738 1.00 . A A . 10 TYR CZ 1 1 1 125 1 1 10 TYR H H -1.722 5.056 2.828 1.00 . A A . 10 TYR H 1 1 1 126 1 1 10 TYR HA H 0.055 3.641 1.278 1.00 . A A . 10 TYR HA 1 1 1 127 1 1 10 TYR HB2 H -1.124 6.382 1.053 1.00 . A A . 10 TYR HB2 1 1 1 128 1 1 10 TYR HB3 H 0.108 5.880 -0.102 1.00 . A A . 10 TYR HB3 1 1 1 129 1 1 10 TYR HD1 H -2.964 4.384 1.437 1.00 . A A . 10 TYR HD1 1 1 1 130 1 1 10 TYR HD2 H -0.707 5.092 -2.098 1.00 . A A . 10 TYR HD2 1 1 1 131 1 1 10 TYR HE1 H -4.683 3.226 0.115 1.00 . A A . 10 TYR HE1 1 1 1 132 1 1 10 TYR HE2 H -2.421 3.938 -3.431 1.00 . A A . 10 TYR HE2 1 1 1 133 1 1 10 TYR HH H -5.465 3.296 -2.353 1.00 . A A . 10 TYR HH 1 1 1 134 1 1 10 TYR N N -0.837 4.634 2.849 1.00 . A A . 10 TYR N 1 1 1 135 1 1 10 TYR O O 2.339 4.861 1.218 1.00 . A A . 10 TYR O 1 1 1 136 1 1 10 TYR OH O -4.618 2.865 -2.481 1.00 . A A . 10 TYR OH 1 1 1 137 1 1 11 ALA C C 3.782 5.393 3.931 1.00 . A A . 11 ALA C 1 1 1 138 1 1 11 ALA CA C 2.838 6.476 3.405 1.00 . A A . 11 ALA CA 1 1 1 139 1 1 11 ALA CB C 2.668 7.585 4.434 1.00 . A A . 11 ALA CB 1 1 1 140 1 1 11 ALA H H 0.753 6.139 3.573 1.00 . A A . 11 ALA H 1 1 1 141 1 1 11 ALA HA H 3.279 6.912 2.520 1.00 . A A . 11 ALA HA 1 1 1 142 1 1 11 ALA HB1 H 3.522 7.597 5.095 1.00 . A A . 11 ALA HB1 1 1 1 143 1 1 11 ALA HB2 H 1.771 7.408 5.008 1.00 . A A . 11 ALA HB2 1 1 1 144 1 1 11 ALA HB3 H 2.591 8.536 3.929 1.00 . A A . 11 ALA HB3 1 1 1 145 1 1 11 ALA N N 1.539 5.930 3.025 1.00 . A A . 11 ALA N 1 1 1 146 1 1 11 ALA O O 4.791 5.077 3.294 1.00 . A A . 11 ALA O 1 1 1 147 1 1 12 PRO C C 4.616 2.637 4.731 1.00 . A A . 12 PRO C 1 1 1 148 1 1 12 PRO CA C 4.303 3.762 5.709 1.00 . A A . 12 PRO CA 1 1 1 149 1 1 12 PRO CB C 3.454 3.240 6.881 1.00 . A A . 12 PRO CB 1 1 1 150 1 1 12 PRO CD C 2.299 5.110 5.932 1.00 . A A . 12 PRO CD 1 1 1 151 1 1 12 PRO CG C 2.096 3.833 6.693 1.00 . A A . 12 PRO CG 1 1 1 152 1 1 12 PRO HA H 5.228 4.169 6.089 1.00 . A A . 12 PRO HA 1 1 1 153 1 1 12 PRO HB2 H 3.418 2.161 6.847 1.00 . A A . 12 PRO HB2 1 1 1 154 1 1 12 PRO HB3 H 3.895 3.559 7.813 1.00 . A A . 12 PRO HB3 1 1 1 155 1 1 12 PRO HD2 H 1.437 5.329 5.319 1.00 . A A . 12 PRO HD2 1 1 1 156 1 1 12 PRO HD3 H 2.503 5.927 6.608 1.00 . A A . 12 PRO HD3 1 1 1 157 1 1 12 PRO HG2 H 1.474 3.155 6.128 1.00 . A A . 12 PRO HG2 1 1 1 158 1 1 12 PRO HG3 H 1.649 4.038 7.654 1.00 . A A . 12 PRO HG3 1 1 1 159 1 1 12 PRO N N 3.473 4.807 5.103 1.00 . A A . 12 PRO N 1 1 1 160 1 1 12 PRO O O 5.624 1.943 4.869 1.00 . A A . 12 PRO O 1 1 1 161 1 1 13 CYS C C 4.727 1.950 1.550 1.00 . A A . 13 CYS C 1 1 1 162 1 1 13 CYS CA C 3.936 1.427 2.739 1.00 . A A . 13 CYS CA 1 1 1 163 1 1 13 CYS CB C 2.595 0.894 2.268 1.00 . A A . 13 CYS CB 1 1 1 164 1 1 13 CYS H H 2.966 3.050 3.682 1.00 . A A . 13 CYS H 1 1 1 165 1 1 13 CYS HA H 4.482 0.623 3.185 1.00 . A A . 13 CYS HA 1 1 1 166 1 1 13 CYS HB2 H 1.834 1.616 2.496 1.00 . A A . 13 CYS HB2 1 1 1 167 1 1 13 CYS HB3 H 2.643 0.748 1.204 1.00 . A A . 13 CYS HB3 1 1 1 168 1 1 13 CYS N N 3.749 2.464 3.742 1.00 . A A . 13 CYS N 1 1 1 169 1 1 13 CYS O O 5.672 1.310 1.098 1.00 . A A . 13 CYS O 1 1 1 170 1 1 13 CYS SG S 2.105 -0.690 3.024 1.00 . A A . 13 CYS SG 1 1 1 171 1 1 14 ARG C C 6.515 3.686 0.104 1.00 . A A . 14 ARG C 1 1 1 172 1 1 14 ARG CA C 5.011 3.715 -0.099 1.00 . A A . 14 ARG CA 1 1 1 173 1 1 14 ARG CB C 4.519 5.151 -0.328 1.00 . A A . 14 ARG CB 1 1 1 174 1 1 14 ARG CD C 4.706 6.746 -2.269 1.00 . A A . 14 ARG CD 1 1 1 175 1 1 14 ARG CG C 5.455 6.011 -1.169 1.00 . A A . 14 ARG CG 1 1 1 176 1 1 14 ARG CZ C 5.305 7.918 -4.354 1.00 . A A . 14 ARG CZ 1 1 1 177 1 1 14 ARG H H 3.576 3.582 1.443 1.00 . A A . 14 ARG H 1 1 1 178 1 1 14 ARG HA H 4.773 3.113 -0.961 1.00 . A A . 14 ARG HA 1 1 1 179 1 1 14 ARG HB2 H 3.561 5.112 -0.826 1.00 . A A . 14 ARG HB2 1 1 1 180 1 1 14 ARG HB3 H 4.393 5.630 0.633 1.00 . A A . 14 ARG HB3 1 1 1 181 1 1 14 ARG HD2 H 3.853 6.154 -2.564 1.00 . A A . 14 ARG HD2 1 1 1 182 1 1 14 ARG HD3 H 4.369 7.696 -1.883 1.00 . A A . 14 ARG HD3 1 1 1 183 1 1 14 ARG HE H 6.337 6.410 -3.551 1.00 . A A . 14 ARG HE 1 1 1 184 1 1 14 ARG HG2 H 5.931 6.737 -0.527 1.00 . A A . 14 ARG HG2 1 1 1 185 1 1 14 ARG HG3 H 6.207 5.379 -1.617 1.00 . A A . 14 ARG HG3 1 1 1 186 1 1 14 ARG HH11 H 3.622 8.603 -3.464 1.00 . A A . 14 ARG HH11 1 1 1 187 1 1 14 ARG HH12 H 4.068 9.410 -4.929 1.00 . A A . 14 ARG HH12 1 1 1 188 1 1 14 ARG HH21 H 6.923 7.471 -5.478 1.00 . A A . 14 ARG HH21 1 1 1 189 1 1 14 ARG HH22 H 5.940 8.768 -6.074 1.00 . A A . 14 ARG HH22 1 1 1 190 1 1 14 ARG N N 4.335 3.117 1.042 1.00 . A A . 14 ARG N 1 1 1 191 1 1 14 ARG NE N 5.548 6.981 -3.440 1.00 . A A . 14 ARG NE 1 1 1 192 1 1 14 ARG NH1 N 4.245 8.708 -4.239 1.00 . A A . 14 ARG NH1 1 1 1 193 1 1 14 ARG NH2 N 6.123 8.064 -5.387 1.00 . A A . 14 ARG NH2 1 1 1 194 1 1 14 ARG O O 7.276 3.474 -0.840 1.00 . A A . 14 ARG O 1 1 1 195 1 1 15 LYS C C 8.912 2.469 1.234 1.00 . A A . 15 LYS C 1 1 1 196 1 1 15 LYS CA C 8.360 3.826 1.652 1.00 . A A . 15 LYS CA 1 1 1 197 1 1 15 LYS CB C 8.595 4.063 3.146 1.00 . A A . 15 LYS CB 1 1 1 198 1 1 15 LYS CD C 8.213 6.458 3.807 1.00 . A A . 15 LYS CD 1 1 1 199 1 1 15 LYS CE C 8.635 7.835 3.323 1.00 . A A . 15 LYS CE 1 1 1 200 1 1 15 LYS CG C 9.247 5.401 3.453 1.00 . A A . 15 LYS CG 1 1 1 201 1 1 15 LYS H H 6.289 4.015 2.065 1.00 . A A . 15 LYS H 1 1 1 202 1 1 15 LYS HA H 8.853 4.600 1.082 1.00 . A A . 15 LYS HA 1 1 1 203 1 1 15 LYS HB2 H 7.646 4.025 3.657 1.00 . A A . 15 LYS HB2 1 1 1 204 1 1 15 LYS HB3 H 9.233 3.281 3.529 1.00 . A A . 15 LYS HB3 1 1 1 205 1 1 15 LYS HD2 H 7.274 6.197 3.343 1.00 . A A . 15 LYS HD2 1 1 1 206 1 1 15 LYS HD3 H 8.092 6.484 4.880 1.00 . A A . 15 LYS HD3 1 1 1 207 1 1 15 LYS HE2 H 9.291 8.276 4.060 1.00 . A A . 15 LYS HE2 1 1 1 208 1 1 15 LYS HE3 H 9.166 7.728 2.389 1.00 . A A . 15 LYS HE3 1 1 1 209 1 1 15 LYS HG2 H 9.922 5.280 4.287 1.00 . A A . 15 LYS HG2 1 1 1 210 1 1 15 LYS HG3 H 9.801 5.729 2.585 1.00 . A A . 15 LYS HG3 1 1 1 211 1 1 15 LYS HZ1 H 6.695 8.216 2.650 1.00 . A A . 15 LYS HZ1 1 1 1 212 1 1 15 LYS HZ2 H 7.738 9.542 2.522 1.00 . A A . 15 LYS HZ2 1 1 1 213 1 1 15 LYS HZ3 H 7.125 9.091 4.033 1.00 . A A . 15 LYS HZ3 1 1 1 214 1 1 15 LYS N N 6.942 3.870 1.344 1.00 . A A . 15 LYS N 1 1 1 215 1 1 15 LYS NZ N 7.466 8.734 3.118 1.00 . A A . 15 LYS NZ 1 1 1 216 1 1 15 LYS O O 9.938 2.376 0.560 1.00 . A A . 15 LYS O 1 1 1 217 1 1 16 GLN C C 8.365 -0.261 -0.175 1.00 . A A . 16 GLN C 1 1 1 218 1 1 16 GLN CA C 8.585 0.053 1.307 1.00 . A A . 16 GLN CA 1 1 1 219 1 1 16 GLN CB C 7.797 -0.937 2.167 1.00 . A A . 16 GLN CB 1 1 1 220 1 1 16 GLN CD C 9.378 -0.715 4.125 1.00 . A A . 16 GLN CD 1 1 1 221 1 1 16 GLN CG C 7.935 -0.689 3.660 1.00 . A A . 16 GLN CG 1 1 1 222 1 1 16 GLN H H 7.387 1.567 2.164 1.00 . A A . 16 GLN H 1 1 1 223 1 1 16 GLN HA H 9.636 -0.056 1.530 1.00 . A A . 16 GLN HA 1 1 1 224 1 1 16 GLN HB2 H 6.751 -0.868 1.908 1.00 . A A . 16 GLN HB2 1 1 1 225 1 1 16 GLN HB3 H 8.146 -1.937 1.956 1.00 . A A . 16 GLN HB3 1 1 1 226 1 1 16 GLN HE21 H 9.429 1.272 4.158 1.00 . A A . 16 GLN HE21 1 1 1 227 1 1 16 GLN HE22 H 10.890 0.476 4.622 1.00 . A A . 16 GLN HE22 1 1 1 228 1 1 16 GLN HG2 H 7.516 0.279 3.892 1.00 . A A . 16 GLN HG2 1 1 1 229 1 1 16 GLN HG3 H 7.386 -1.453 4.191 1.00 . A A . 16 GLN HG3 1 1 1 230 1 1 16 GLN N N 8.203 1.418 1.637 1.00 . A A . 16 GLN N 1 1 1 231 1 1 16 GLN NE2 N 9.957 0.463 4.322 1.00 . A A . 16 GLN NE2 1 1 1 232 1 1 16 GLN O O 9.305 -0.605 -0.892 1.00 . A A . 16 GLN O 1 1 1 233 1 1 16 GLN OE1 O 9.965 -1.782 4.306 1.00 . A A . 16 GLN OE1 1 1 1 234 1 1 17 THR C C 7.276 0.575 -2.983 1.00 . A A . 17 THR C 1 1 1 235 1 1 17 THR CA C 6.760 -0.474 -2.007 1.00 . A A . 17 THR CA 1 1 1 236 1 1 17 THR CB C 5.242 -0.630 -2.151 1.00 . A A . 17 THR CB 1 1 1 237 1 1 17 THR CG2 C 4.470 0.632 -1.834 1.00 . A A . 17 THR CG2 1 1 1 238 1 1 17 THR H H 6.398 0.097 -0.002 1.00 . A A . 17 THR H 1 1 1 239 1 1 17 THR HA H 7.222 -1.411 -2.252 1.00 . A A . 17 THR HA 1 1 1 240 1 1 17 THR HB H 4.907 -1.401 -1.472 1.00 . A A . 17 THR HB 1 1 1 241 1 1 17 THR HG1 H 3.951 -1.136 -3.532 1.00 . A A . 17 THR HG1 1 1 1 242 1 1 17 THR HG21 H 3.446 0.378 -1.605 1.00 . A A . 17 THR HG21 1 1 1 243 1 1 17 THR HG22 H 4.493 1.293 -2.689 1.00 . A A . 17 THR HG22 1 1 1 244 1 1 17 THR HG23 H 4.918 1.126 -0.985 1.00 . A A . 17 THR HG23 1 1 1 245 1 1 17 THR N N 7.110 -0.169 -0.622 1.00 . A A . 17 THR N 1 1 1 246 1 1 17 THR O O 7.945 0.249 -3.963 1.00 . A A . 17 THR O 1 1 1 247 1 1 17 THR OG1 O 4.902 -1.022 -3.468 1.00 . A A . 17 THR OG1 1 1 1 248 1 1 18 GLY C C 6.193 3.673 -4.147 1.00 . A A . 18 GLY C 1 1 1 249 1 1 18 GLY CA C 7.363 2.900 -3.582 1.00 . A A . 18 GLY CA 1 1 1 250 1 1 18 GLY H H 6.416 2.024 -1.945 1.00 . A A . 18 GLY H 1 1 1 251 1 1 18 GLY HA2 H 7.992 3.572 -3.037 1.00 . A A . 18 GLY HA2 1 1 1 252 1 1 18 GLY HA3 H 7.919 2.479 -4.388 1.00 . A A . 18 GLY HA3 1 1 1 253 1 1 18 GLY N N 6.947 1.829 -2.720 1.00 . A A . 18 GLY N 1 1 1 254 1 1 18 GLY O O 5.501 4.385 -3.422 1.00 . A A . 18 GLY O 1 1 1 255 1 1 19 CYS C C 3.728 4.566 -5.303 1.00 . A A . 19 CYS C 1 1 1 256 1 1 19 CYS CA C 4.928 4.201 -6.184 1.00 . A A . 19 CYS CA 1 1 1 257 1 1 19 CYS CB C 4.477 3.353 -7.346 1.00 . A A . 19 CYS CB 1 1 1 258 1 1 19 CYS H H 6.610 2.961 -5.944 1.00 . A A . 19 CYS H 1 1 1 259 1 1 19 CYS HA H 5.342 5.090 -6.596 1.00 . A A . 19 CYS HA 1 1 1 260 1 1 19 CYS HB2 H 3.523 3.715 -7.679 1.00 . A A . 19 CYS HB2 1 1 1 261 1 1 19 CYS HB3 H 5.195 3.474 -8.136 1.00 . A A . 19 CYS HB3 1 1 1 262 1 1 19 CYS N N 5.998 3.531 -5.451 1.00 . A A . 19 CYS N 1 1 1 263 1 1 19 CYS O O 3.404 3.857 -4.350 1.00 . A A . 19 CYS O 1 1 1 264 1 1 19 CYS SG S 4.316 1.573 -6.985 1.00 . A A . 19 CYS SG 1 1 1 265 1 1 20 PRO C C 0.675 5.246 -4.934 1.00 . A A . 20 PRO C 1 1 1 266 1 1 20 PRO CA C 1.894 6.166 -4.846 1.00 . A A . 20 PRO CA 1 1 1 267 1 1 20 PRO CB C 1.576 7.523 -5.481 1.00 . A A . 20 PRO CB 1 1 1 268 1 1 20 PRO CD C 3.381 6.593 -6.733 1.00 . A A . 20 PRO CD 1 1 1 269 1 1 20 PRO CG C 2.153 7.450 -6.851 1.00 . A A . 20 PRO CG 1 1 1 270 1 1 20 PRO HA H 2.149 6.311 -3.807 1.00 . A A . 20 PRO HA 1 1 1 271 1 1 20 PRO HB2 H 0.505 7.668 -5.510 1.00 . A A . 20 PRO HB2 1 1 1 272 1 1 20 PRO HB3 H 2.035 8.311 -4.902 1.00 . A A . 20 PRO HB3 1 1 1 273 1 1 20 PRO HD2 H 3.542 6.036 -7.644 1.00 . A A . 20 PRO HD2 1 1 1 274 1 1 20 PRO HD3 H 4.244 7.198 -6.501 1.00 . A A . 20 PRO HD3 1 1 1 275 1 1 20 PRO HG2 H 1.442 6.997 -7.526 1.00 . A A . 20 PRO HG2 1 1 1 276 1 1 20 PRO HG3 H 2.419 8.439 -7.192 1.00 . A A . 20 PRO HG3 1 1 1 277 1 1 20 PRO N N 3.055 5.690 -5.614 1.00 . A A . 20 PRO N 1 1 1 278 1 1 20 PRO O O -0.324 5.475 -4.254 1.00 . A A . 20 PRO O 1 1 1 279 1 1 21 TYR C C -0.541 2.440 -4.679 1.00 . A A . 21 TYR C 1 1 1 280 1 1 21 TYR CA C -0.352 3.293 -5.930 1.00 . A A . 21 TYR CA 1 1 1 281 1 1 21 TYR CB C -0.103 2.398 -7.140 1.00 . A A . 21 TYR CB 1 1 1 282 1 1 21 TYR CD1 C 0.673 4.316 -8.597 1.00 . A A . 21 TYR CD1 1 1 1 283 1 1 21 TYR CD2 C 1.797 2.223 -8.800 1.00 . A A . 21 TYR CD2 1 1 1 284 1 1 21 TYR CE1 C 1.498 4.857 -9.564 1.00 . A A . 21 TYR CE1 1 1 1 285 1 1 21 TYR CE2 C 2.625 2.757 -9.769 1.00 . A A . 21 TYR CE2 1 1 1 286 1 1 21 TYR CG C 0.808 2.991 -8.198 1.00 . A A . 21 TYR CG 1 1 1 287 1 1 21 TYR CZ C 2.471 4.074 -10.147 1.00 . A A . 21 TYR CZ 1 1 1 288 1 1 21 TYR H H 1.548 4.070 -6.299 1.00 . A A . 21 TYR H 1 1 1 289 1 1 21 TYR HA H -1.250 3.868 -6.099 1.00 . A A . 21 TYR HA 1 1 1 290 1 1 21 TYR HB2 H 0.333 1.469 -6.811 1.00 . A A . 21 TYR HB2 1 1 1 291 1 1 21 TYR HB3 H -1.038 2.201 -7.601 1.00 . A A . 21 TYR HB3 1 1 1 292 1 1 21 TYR HD1 H -0.091 4.927 -8.138 1.00 . A A . 21 TYR HD1 1 1 1 293 1 1 21 TYR HD2 H 1.914 1.191 -8.501 1.00 . A A . 21 TYR HD2 1 1 1 294 1 1 21 TYR HE1 H 1.378 5.889 -9.860 1.00 . A A . 21 TYR HE1 1 1 1 295 1 1 21 TYR HE2 H 3.388 2.143 -10.225 1.00 . A A . 21 TYR HE2 1 1 1 296 1 1 21 TYR HH H 4.211 4.506 -10.844 1.00 . A A . 21 TYR HH 1 1 1 297 1 1 21 TYR N N 0.748 4.215 -5.770 1.00 . A A . 21 TYR N 1 1 1 298 1 1 21 TYR O O 0.336 2.377 -3.817 1.00 . A A . 21 TYR O 1 1 1 299 1 1 21 TYR OH O 3.295 4.610 -11.111 1.00 . A A . 21 TYR OH 1 1 1 300 1 1 22 GLY C C -3.107 -0.045 -3.718 1.00 . A A . 22 GLY C 1 1 1 301 1 1 22 GLY CA C -1.991 0.944 -3.441 1.00 . A A . 22 GLY CA 1 1 1 302 1 1 22 GLY H H -2.355 1.880 -5.308 1.00 . A A . 22 GLY H 1 1 1 303 1 1 22 GLY HA2 H -1.104 0.401 -3.171 1.00 . A A . 22 GLY HA2 1 1 1 304 1 1 22 GLY HA3 H -2.279 1.571 -2.612 1.00 . A A . 22 GLY HA3 1 1 1 305 1 1 22 GLY N N -1.696 1.786 -4.588 1.00 . A A . 22 GLY N 1 1 1 306 1 1 22 GLY O O -3.948 0.193 -4.583 1.00 . A A . 22 GLY O 1 1 1 307 1 1 23 LYS C C -5.226 -2.010 -2.052 1.00 . A A . 23 LYS C 1 1 1 308 1 1 23 LYS CA C -4.175 -2.152 -3.149 1.00 . A A . 23 LYS CA 1 1 1 309 1 1 23 LYS CB C -3.578 -3.561 -3.131 1.00 . A A . 23 LYS CB 1 1 1 310 1 1 23 LYS CD C -5.479 -5.147 -3.561 1.00 . A A . 23 LYS CD 1 1 1 311 1 1 23 LYS CE C -5.982 -6.273 -4.449 1.00 . A A . 23 LYS CE 1 1 1 312 1 1 23 LYS CG C -4.223 -4.507 -4.130 1.00 . A A . 23 LYS CG 1 1 1 313 1 1 23 LYS H H -2.452 -1.289 -2.283 1.00 . A A . 23 LYS H 1 1 1 314 1 1 23 LYS HA H -4.639 -1.977 -4.104 1.00 . A A . 23 LYS HA 1 1 1 315 1 1 23 LYS HB2 H -2.524 -3.496 -3.357 1.00 . A A . 23 LYS HB2 1 1 1 316 1 1 23 LYS HB3 H -3.699 -3.979 -2.142 1.00 . A A . 23 LYS HB3 1 1 1 317 1 1 23 LYS HD2 H -5.256 -5.547 -2.583 1.00 . A A . 23 LYS HD2 1 1 1 318 1 1 23 LYS HD3 H -6.249 -4.394 -3.478 1.00 . A A . 23 LYS HD3 1 1 1 319 1 1 23 LYS HE2 H -5.132 -6.808 -4.847 1.00 . A A . 23 LYS HE2 1 1 1 320 1 1 23 LYS HE3 H -6.582 -6.945 -3.853 1.00 . A A . 23 LYS HE3 1 1 1 321 1 1 23 LYS HG2 H -4.485 -3.953 -5.018 1.00 . A A . 23 LYS HG2 1 1 1 322 1 1 23 LYS HG3 H -3.516 -5.284 -4.382 1.00 . A A . 23 LYS HG3 1 1 1 323 1 1 23 LYS HZ1 H -6.543 -4.780 -5.798 1.00 . A A . 23 LYS HZ1 1 1 1 324 1 1 23 LYS HZ2 H -7.814 -5.794 -5.330 1.00 . A A . 23 LYS HZ2 1 1 1 325 1 1 23 LYS HZ3 H -6.651 -6.348 -6.426 1.00 . A A . 23 LYS HZ3 1 1 1 326 1 1 23 LYS N N -3.132 -1.152 -2.973 1.00 . A A . 23 LYS N 1 1 1 327 1 1 23 LYS NZ N -6.805 -5.763 -5.580 1.00 . A A . 23 LYS NZ 1 1 1 328 1 1 23 LYS O O -5.977 -2.942 -1.768 1.00 . A A . 23 LYS O 1 1 1 329 1 1 24 CYS C C -7.634 -0.524 -0.880 1.00 . A A . 24 CYS C 1 1 1 330 1 1 24 CYS CA C -6.198 -0.546 -0.361 1.00 . A A . 24 CYS CA 1 1 1 331 1 1 24 CYS CB C -5.824 0.788 0.308 1.00 . A A . 24 CYS CB 1 1 1 332 1 1 24 CYS H H -4.627 -0.134 -1.706 1.00 . A A . 24 CYS H 1 1 1 333 1 1 24 CYS HA H -6.109 -1.337 0.369 1.00 . A A . 24 CYS HA 1 1 1 334 1 1 24 CYS HB2 H -5.223 0.581 1.179 1.00 . A A . 24 CYS HB2 1 1 1 335 1 1 24 CYS HB3 H -5.238 1.373 -0.386 1.00 . A A . 24 CYS HB3 1 1 1 336 1 1 24 CYS N N -5.259 -0.831 -1.435 1.00 . A A . 24 CYS N 1 1 1 337 1 1 24 CYS O O -8.007 0.328 -1.684 1.00 . A A . 24 CYS O 1 1 1 338 1 1 24 CYS SG S -7.233 1.816 0.855 1.00 . A A . 24 CYS SG 1 1 1 339 1 1 25 MET C C -10.696 -1.596 0.467 1.00 . A A . 25 MET C 1 1 1 340 1 1 25 MET CA C -9.834 -1.570 -0.778 1.00 . A A . 25 MET CA 1 1 1 341 1 1 25 MET CB C -10.073 -2.829 -1.615 1.00 . A A . 25 MET CB 1 1 1 342 1 1 25 MET CE C -12.056 -5.097 -3.709 1.00 . A A . 25 MET CE 1 1 1 343 1 1 25 MET CG C -11.228 -2.699 -2.593 1.00 . A A . 25 MET CG 1 1 1 344 1 1 25 MET H H -8.069 -2.109 0.252 1.00 . A A . 25 MET H 1 1 1 345 1 1 25 MET HA H -10.096 -0.698 -1.360 1.00 . A A . 25 MET HA 1 1 1 346 1 1 25 MET HB2 H -9.177 -3.049 -2.177 1.00 . A A . 25 MET HB2 1 1 1 347 1 1 25 MET HB3 H -10.282 -3.654 -0.950 1.00 . A A . 25 MET HB3 1 1 1 348 1 1 25 MET HE1 H -11.546 -5.766 -3.031 1.00 . A A . 25 MET HE1 1 1 1 349 1 1 25 MET HE2 H -12.290 -5.621 -4.623 1.00 . A A . 25 MET HE2 1 1 1 350 1 1 25 MET HE3 H -12.969 -4.748 -3.250 1.00 . A A . 25 MET HE3 1 1 1 351 1 1 25 MET HG2 H -12.136 -3.016 -2.101 1.00 . A A . 25 MET HG2 1 1 1 352 1 1 25 MET HG3 H -11.321 -1.664 -2.884 1.00 . A A . 25 MET HG3 1 1 1 353 1 1 25 MET N N -8.432 -1.467 -0.395 1.00 . A A . 25 MET N 1 1 1 354 1 1 25 MET O O -10.298 -2.141 1.502 1.00 . A A . 25 MET O 1 1 1 355 1 1 25 MET SD S -10.999 -3.698 -4.076 1.00 . A A . 25 MET SD 1 1 1 356 1 1 26 ASN C C -11.956 -0.475 2.750 1.00 . A A . 26 ASN C 1 1 1 357 1 1 26 ASN CA C -12.734 -0.954 1.558 1.00 . A A . 26 ASN CA 1 1 1 358 1 1 26 ASN CB C -13.368 -2.345 1.789 1.00 . A A . 26 ASN CB 1 1 1 359 1 1 26 ASN CG C -12.581 -3.250 2.718 1.00 . A A . 26 ASN CG 1 1 1 360 1 1 26 ASN H H -12.137 -0.545 -0.440 1.00 . A A . 26 ASN H 1 1 1 361 1 1 26 ASN HA H -13.526 -0.251 1.422 1.00 . A A . 26 ASN HA 1 1 1 362 1 1 26 ASN HB2 H -14.351 -2.211 2.213 1.00 . A A . 26 ASN HB2 1 1 1 363 1 1 26 ASN HB3 H -13.466 -2.842 0.835 1.00 . A A . 26 ASN HB3 1 1 1 364 1 1 26 ASN HD21 H -13.774 -2.774 4.236 1.00 . A A . 26 ASN HD21 1 1 1 365 1 1 26 ASN HD22 H -12.506 -3.887 4.602 1.00 . A A . 26 ASN HD22 1 1 1 366 1 1 26 ASN N N -11.869 -0.985 0.394 1.00 . A A . 26 ASN N 1 1 1 367 1 1 26 ASN ND2 N -12.995 -3.309 3.980 1.00 . A A . 26 ASN ND2 1 1 1 368 1 1 26 ASN O O -10.821 -0.008 2.651 1.00 . A A . 26 ASN O 1 1 1 369 1 1 26 ASN OD1 O -11.627 -3.907 2.303 1.00 . A A . 26 ASN OD1 1 1 1 370 1 1 27 ARG C C -10.798 -1.078 5.444 1.00 . A A . 27 ARG C 1 1 1 371 1 1 27 ARG CA C -12.009 -0.221 5.139 1.00 . A A . 27 ARG CA 1 1 1 372 1 1 27 ARG CB C -13.042 -0.315 6.264 1.00 . A A . 27 ARG CB 1 1 1 373 1 1 27 ARG CD C -14.529 1.385 7.368 1.00 . A A . 27 ARG CD 1 1 1 374 1 1 27 ARG CG C -13.098 0.926 7.138 1.00 . A A . 27 ARG CG 1 1 1 375 1 1 27 ARG CZ C -14.320 3.488 8.636 1.00 . A A . 27 ARG CZ 1 1 1 376 1 1 27 ARG H H -13.454 -0.994 3.809 1.00 . A A . 27 ARG H 1 1 1 377 1 1 27 ARG HA H -11.679 0.787 5.037 1.00 . A A . 27 ARG HA 1 1 1 378 1 1 27 ARG HB2 H -14.018 -0.469 5.828 1.00 . A A . 27 ARG HB2 1 1 1 379 1 1 27 ARG HB3 H -12.801 -1.161 6.891 1.00 . A A . 27 ARG HB3 1 1 1 380 1 1 27 ARG HD2 H -14.847 1.966 6.516 1.00 . A A . 27 ARG HD2 1 1 1 381 1 1 27 ARG HD3 H -15.161 0.515 7.466 1.00 . A A . 27 ARG HD3 1 1 1 382 1 1 27 ARG HE H -15.010 1.769 9.378 1.00 . A A . 27 ARG HE 1 1 1 383 1 1 27 ARG HG2 H -12.645 0.703 8.092 1.00 . A A . 27 ARG HG2 1 1 1 384 1 1 27 ARG HG3 H -12.548 1.720 6.654 1.00 . A A . 27 ARG HG3 1 1 1 385 1 1 27 ARG HH11 H -13.723 3.609 6.707 1.00 . A A . 27 ARG HH11 1 1 1 386 1 1 27 ARG HH12 H -13.586 5.074 7.620 1.00 . A A . 27 ARG HH12 1 1 1 387 1 1 27 ARG HH21 H -14.832 3.695 10.580 1.00 . A A . 27 ARG HH21 1 1 1 388 1 1 27 ARG HH22 H -14.214 5.124 9.818 1.00 . A A . 27 ARG HH22 1 1 1 389 1 1 27 ARG N N -12.586 -0.611 3.861 1.00 . A A . 27 ARG N 1 1 1 390 1 1 27 ARG NE N -14.655 2.201 8.573 1.00 . A A . 27 ARG NE 1 1 1 391 1 1 27 ARG NH1 N -13.836 4.108 7.566 1.00 . A A . 27 ARG NH1 1 1 1 392 1 1 27 ARG NH2 N -14.467 4.157 9.771 1.00 . A A . 27 ARG NH2 1 1 1 393 1 1 27 ARG O O -10.224 -1.033 6.531 1.00 . A A . 27 ARG O 1 1 1 394 1 1 28 LYS C C -8.121 -2.228 3.645 1.00 . A A . 28 LYS C 1 1 1 395 1 1 28 LYS CA C -9.264 -2.730 4.529 1.00 . A A . 28 LYS CA 1 1 1 396 1 1 28 LYS CB C -9.644 -4.155 4.124 1.00 . A A . 28 LYS CB 1 1 1 397 1 1 28 LYS CD C -9.138 -5.446 6.220 1.00 . A A . 28 LYS CD 1 1 1 398 1 1 28 LYS CE C -8.936 -6.895 6.630 1.00 . A A . 28 LYS CE 1 1 1 399 1 1 28 LYS CG C -8.770 -5.222 4.761 1.00 . A A . 28 LYS CG 1 1 1 400 1 1 28 LYS H H -10.953 -1.791 3.612 1.00 . A A . 28 LYS H 1 1 1 401 1 1 28 LYS HA H -8.930 -2.737 5.555 1.00 . A A . 28 LYS HA 1 1 1 402 1 1 28 LYS HB2 H -10.667 -4.340 4.412 1.00 . A A . 28 LYS HB2 1 1 1 403 1 1 28 LYS HB3 H -9.560 -4.247 3.051 1.00 . A A . 28 LYS HB3 1 1 1 404 1 1 28 LYS HD2 H -8.516 -4.816 6.838 1.00 . A A . 28 LYS HD2 1 1 1 405 1 1 28 LYS HD3 H -10.176 -5.181 6.363 1.00 . A A . 28 LYS HD3 1 1 1 406 1 1 28 LYS HE2 H -9.349 -7.038 7.617 1.00 . A A . 28 LYS HE2 1 1 1 407 1 1 28 LYS HE3 H -9.456 -7.530 5.927 1.00 . A A . 28 LYS HE3 1 1 1 408 1 1 28 LYS HG2 H -8.899 -6.150 4.223 1.00 . A A . 28 LYS HG2 1 1 1 409 1 1 28 LYS HG3 H -7.738 -4.910 4.704 1.00 . A A . 28 LYS HG3 1 1 1 410 1 1 28 LYS HZ1 H -7.394 -8.303 6.571 1.00 . A A . 28 LYS HZ1 1 1 1 411 1 1 28 LYS HZ2 H -7.057 -6.958 7.540 1.00 . A A . 28 LYS HZ2 1 1 1 412 1 1 28 LYS HZ3 H -6.997 -6.822 5.855 1.00 . A A . 28 LYS HZ3 1 1 1 413 1 1 28 LYS N N -10.424 -1.842 4.444 1.00 . A A . 28 LYS N 1 1 1 414 1 1 28 LYS NZ N -7.496 -7.271 6.650 1.00 . A A . 28 LYS NZ 1 1 1 415 1 1 28 LYS O O -8.122 -2.433 2.431 1.00 . A A . 28 LYS O 1 1 1 416 1 1 29 CYS C C -5.095 -2.157 3.034 1.00 . A A . 29 CYS C 1 1 1 417 1 1 29 CYS CA C -5.997 -1.039 3.540 1.00 . A A . 29 CYS CA 1 1 1 418 1 1 29 CYS CB C -5.197 -0.110 4.437 1.00 . A A . 29 CYS CB 1 1 1 419 1 1 29 CYS H H -7.197 -1.438 5.229 1.00 . A A . 29 CYS H 1 1 1 420 1 1 29 CYS HA H -6.360 -0.480 2.707 1.00 . A A . 29 CYS HA 1 1 1 421 1 1 29 CYS HB2 H -5.878 0.448 5.055 1.00 . A A . 29 CYS HB2 1 1 1 422 1 1 29 CYS HB3 H -4.561 -0.705 5.056 1.00 . A A . 29 CYS HB3 1 1 1 423 1 1 29 CYS N N -7.144 -1.571 4.264 1.00 . A A . 29 CYS N 1 1 1 424 1 1 29 CYS O O -5.192 -3.298 3.484 1.00 . A A . 29 CYS O 1 1 1 425 1 1 29 CYS SG S -4.148 1.089 3.553 1.00 . A A . 29 CYS SG 1 1 1 426 1 1 30 LYS C C -2.519 -2.201 0.360 1.00 . A A . 30 LYS C 1 1 1 427 1 1 30 LYS CA C -3.283 -2.791 1.536 1.00 . A A . 30 LYS CA 1 1 1 428 1 1 30 LYS CB C -4.024 -4.058 1.098 1.00 . A A . 30 LYS CB 1 1 1 429 1 1 30 LYS CD C -5.121 -6.060 2.147 1.00 . A A . 30 LYS CD 1 1 1 430 1 1 30 LYS CE C -4.810 -7.508 2.495 1.00 . A A . 30 LYS CE 1 1 1 431 1 1 30 LYS CG C -3.855 -5.224 2.059 1.00 . A A . 30 LYS CG 1 1 1 432 1 1 30 LYS H H -4.179 -0.891 1.785 1.00 . A A . 30 LYS H 1 1 1 433 1 1 30 LYS HA H -2.571 -3.049 2.305 1.00 . A A . 30 LYS HA 1 1 1 434 1 1 30 LYS HB2 H -5.078 -3.836 1.018 1.00 . A A . 30 LYS HB2 1 1 1 435 1 1 30 LYS HB3 H -3.656 -4.363 0.129 1.00 . A A . 30 LYS HB3 1 1 1 436 1 1 30 LYS HD2 H -5.762 -5.647 2.913 1.00 . A A . 30 LYS HD2 1 1 1 437 1 1 30 LYS HD3 H -5.629 -6.030 1.195 1.00 . A A . 30 LYS HD3 1 1 1 438 1 1 30 LYS HE2 H -5.475 -8.150 1.938 1.00 . A A . 30 LYS HE2 1 1 1 439 1 1 30 LYS HE3 H -3.788 -7.719 2.215 1.00 . A A . 30 LYS HE3 1 1 1 440 1 1 30 LYS HG2 H -3.046 -5.850 1.712 1.00 . A A . 30 LYS HG2 1 1 1 441 1 1 30 LYS HG3 H -3.620 -4.838 3.040 1.00 . A A . 30 LYS HG3 1 1 1 442 1 1 30 LYS HZ1 H -4.595 -6.992 4.508 1.00 . A A . 30 LYS HZ1 1 1 1 443 1 1 30 LYS HZ2 H -4.484 -8.653 4.211 1.00 . A A . 30 LYS HZ2 1 1 1 444 1 1 30 LYS HZ3 H -5.991 -7.888 4.176 1.00 . A A . 30 LYS HZ3 1 1 1 445 1 1 30 LYS N N -4.211 -1.819 2.100 1.00 . A A . 30 LYS N 1 1 1 446 1 1 30 LYS NZ N -4.982 -7.779 3.949 1.00 . A A . 30 LYS NZ 1 1 1 447 1 1 30 LYS O O -2.901 -2.375 -0.791 1.00 . A A . 30 LYS O 1 1 1 448 1 1 31 CYS C C -0.371 -1.760 -1.558 1.00 . A A . 31 CYS C 1 1 1 449 1 1 31 CYS CA C -0.562 -0.887 -0.333 1.00 . A A . 31 CYS CA 1 1 1 450 1 1 31 CYS CB C 0.799 -0.550 0.279 1.00 . A A . 31 CYS CB 1 1 1 451 1 1 31 CYS H H -1.193 -1.428 1.620 1.00 . A A . 31 CYS H 1 1 1 452 1 1 31 CYS HA H -1.017 0.031 -0.667 1.00 . A A . 31 CYS HA 1 1 1 453 1 1 31 CYS HB2 H 1.525 -0.452 -0.514 1.00 . A A . 31 CYS HB2 1 1 1 454 1 1 31 CYS HB3 H 0.721 0.389 0.805 1.00 . A A . 31 CYS HB3 1 1 1 455 1 1 31 CYS N N -1.429 -1.513 0.674 1.00 . A A . 31 CYS N 1 1 1 456 1 1 31 CYS O O -0.792 -2.911 -1.610 1.00 . A A . 31 CYS O 1 1 1 457 1 1 31 CYS SG S 1.433 -1.793 1.454 1.00 . A A . 31 CYS SG 1 1 1 458 1 1 32 ASN C C 1.799 -2.601 -3.785 1.00 . A A . 32 ASN C 1 1 1 459 1 1 32 ASN CA C 0.497 -1.816 -3.820 1.00 . A A . 32 ASN CA 1 1 1 460 1 1 32 ASN CB C 0.569 -0.768 -4.909 1.00 . A A . 32 ASN CB 1 1 1 461 1 1 32 ASN CG C 0.167 -1.295 -6.272 1.00 . A A . 32 ASN CG 1 1 1 462 1 1 32 ASN H H 0.499 -0.222 -2.442 1.00 . A A . 32 ASN H 1 1 1 463 1 1 32 ASN HA H -0.313 -2.486 -4.036 1.00 . A A . 32 ASN HA 1 1 1 464 1 1 32 ASN HB2 H -0.082 0.042 -4.650 1.00 . A A . 32 ASN HB2 1 1 1 465 1 1 32 ASN HB3 H 1.574 -0.406 -4.959 1.00 . A A . 32 ASN HB3 1 1 1 466 1 1 32 ASN HD21 H 2.016 -1.024 -6.951 1.00 . A A . 32 ASN HD21 1 1 1 467 1 1 32 ASN HD22 H 0.886 -1.670 -8.088 1.00 . A A . 32 ASN HD22 1 1 1 468 1 1 32 ASN N N 0.238 -1.160 -2.554 1.00 . A A . 32 ASN N 1 1 1 469 1 1 32 ASN ND2 N 1.119 -1.333 -7.197 1.00 . A A . 32 ASN ND2 1 1 1 470 1 1 32 ASN O O 2.516 -2.602 -2.784 1.00 . A A . 32 ASN O 1 1 1 471 1 1 32 ASN OD1 O -0.987 -1.664 -6.493 1.00 . A A . 32 ASN OD1 1 1 1 472 1 1 33 ARG C C 4.181 -3.474 -6.153 1.00 . A A . 33 ARG C 1 1 1 473 1 1 33 ARG CA C 3.319 -4.036 -5.030 1.00 . A A . 33 ARG CA 1 1 1 474 1 1 33 ARG CB C 2.989 -5.504 -5.300 1.00 . A A . 33 ARG CB 1 1 1 475 1 1 33 ARG CD C 4.651 -6.711 -3.852 1.00 . A A . 33 ARG CD 1 1 1 476 1 1 33 ARG CG C 4.206 -6.416 -5.275 1.00 . A A . 33 ARG CG 1 1 1 477 1 1 33 ARG CZ C 6.363 -8.440 -4.242 1.00 . A A . 33 ARG CZ 1 1 1 478 1 1 33 ARG H H 1.482 -3.193 -5.655 1.00 . A A . 33 ARG H 1 1 1 479 1 1 33 ARG HA H 3.867 -3.958 -4.103 1.00 . A A . 33 ARG HA 1 1 1 480 1 1 33 ARG HB2 H 2.292 -5.849 -4.550 1.00 . A A . 33 ARG HB2 1 1 1 481 1 1 33 ARG HB3 H 2.526 -5.585 -6.273 1.00 . A A . 33 ARG HB3 1 1 1 482 1 1 33 ARG HD2 H 5.409 -5.994 -3.571 1.00 . A A . 33 ARG HD2 1 1 1 483 1 1 33 ARG HD3 H 3.800 -6.612 -3.194 1.00 . A A . 33 ARG HD3 1 1 1 484 1 1 33 ARG HE H 4.676 -8.712 -3.212 1.00 . A A . 33 ARG HE 1 1 1 485 1 1 33 ARG HG2 H 3.956 -7.346 -5.763 1.00 . A A . 33 ARG HG2 1 1 1 486 1 1 33 ARG HG3 H 5.015 -5.934 -5.805 1.00 . A A . 33 ARG HG3 1 1 1 487 1 1 33 ARG HH11 H 6.786 -6.642 -5.066 1.00 . A A . 33 ARG HH11 1 1 1 488 1 1 33 ARG HH12 H 7.974 -7.875 -5.326 1.00 . A A . 33 ARG HH12 1 1 1 489 1 1 33 ARG HH21 H 6.237 -10.335 -3.552 1.00 . A A . 33 ARG HH21 1 1 1 490 1 1 33 ARG HH22 H 7.662 -9.973 -4.466 1.00 . A A . 33 ARG HH22 1 1 1 491 1 1 33 ARG N N 2.098 -3.251 -4.897 1.00 . A A . 33 ARG N 1 1 1 492 1 1 33 ARG NE N 5.201 -8.058 -3.719 1.00 . A A . 33 ARG NE 1 1 1 493 1 1 33 ARG NH1 N 7.101 -7.582 -4.934 1.00 . A A . 33 ARG NH1 1 1 1 494 1 1 33 ARG NH2 N 6.789 -9.685 -4.073 1.00 . A A . 33 ARG NH2 1 1 1 495 1 1 33 ARG O O 4.042 -3.862 -7.313 1.00 . A A . 33 ARG O 1 1 1 496 1 1 34 CYS C C 7.170 -2.765 -7.039 1.00 . A A . 34 CYS C 1 1 1 497 1 1 34 CYS CA C 5.938 -1.911 -6.760 1.00 . A A . 34 CYS CA 1 1 1 498 1 1 34 CYS CB C 6.346 -0.544 -6.243 1.00 . A A . 34 CYS CB 1 1 1 499 1 1 34 CYS H H 5.112 -2.277 -4.856 1.00 . A A . 34 CYS H 1 1 1 500 1 1 34 CYS HA H 5.389 -1.776 -7.668 1.00 . A A . 34 CYS HA 1 1 1 501 1 1 34 CYS HB2 H 5.739 -0.311 -5.390 1.00 . A A . 34 CYS HB2 1 1 1 502 1 1 34 CYS HB3 H 7.376 -0.577 -5.950 1.00 . A A . 34 CYS HB3 1 1 1 503 1 1 34 CYS N N 5.059 -2.548 -5.795 1.00 . A A . 34 CYS N 1 1 1 504 1 1 34 CYS O O 7.410 -3.086 -8.223 1.00 . A A . 34 CYS O 1 1 1 505 1 1 34 CYS OXT O 7.885 -3.105 -6.074 1.00 . A A . 34 CYS OXT 1 1 1 506 1 1 34 CYS SG S 6.140 0.807 -7.447 1.00 . A A . 34 CYS SG 1 1 2 507 1 1 1 VAL C C -8.941 2.472 -5.047 1.00 . A A . 1 VAL C 1 1 2 508 1 1 1 VAL CA C -10.408 2.220 -5.375 1.00 . A A . 1 VAL CA 1 1 2 509 1 1 1 VAL CB C -10.931 1.082 -4.477 1.00 . A A . 1 VAL CB 1 1 2 510 1 1 1 VAL CG1 C -12.447 1.001 -4.545 1.00 . A A . 1 VAL CG1 1 1 2 511 1 1 1 VAL CG2 C -10.300 -0.244 -4.876 1.00 . A A . 1 VAL CG2 1 1 2 512 1 1 1 VAL H1 H -10.223 2.699 -7.366 1.00 . A A . 1 VAL H1 1 1 2 513 1 1 1 VAL H2 H -11.605 1.757 -6.982 1.00 . A A . 1 VAL H2 1 1 2 514 1 1 1 VAL H3 H -10.051 1.030 -7.014 1.00 . A A . 1 VAL H3 1 1 2 515 1 1 1 VAL HA H -10.974 3.114 -5.154 1.00 . A A . 1 VAL HA 1 1 2 516 1 1 1 VAL HB H -10.649 1.297 -3.458 1.00 . A A . 1 VAL HB 1 1 2 517 1 1 1 VAL HG11 H -12.748 0.687 -5.534 1.00 . A A . 1 VAL HG11 1 1 2 518 1 1 1 VAL HG12 H -12.869 1.972 -4.331 1.00 . A A . 1 VAL HG12 1 1 2 519 1 1 1 VAL HG13 H -12.802 0.286 -3.817 1.00 . A A . 1 VAL HG13 1 1 2 520 1 1 1 VAL HG21 H -10.606 -1.012 -4.181 1.00 . A A . 1 VAL HG21 1 1 2 521 1 1 1 VAL HG22 H -9.224 -0.151 -4.858 1.00 . A A . 1 VAL HG22 1 1 2 522 1 1 1 VAL HG23 H -10.621 -0.510 -5.872 1.00 . A A . 1 VAL HG23 1 1 2 523 1 1 1 VAL N N -10.587 1.897 -6.814 1.00 . A A . 1 VAL N 1 1 2 524 1 1 1 VAL O O -8.056 1.773 -5.539 1.00 . A A . 1 VAL O 1 1 2 525 1 1 2 SER C C -7.329 4.951 -2.795 1.00 . A A . 2 SER C 1 1 2 526 1 1 2 SER CA C -7.329 3.821 -3.820 1.00 . A A . 2 SER CA 1 1 2 527 1 1 2 SER CB C -6.509 4.229 -5.045 1.00 . A A . 2 SER CB 1 1 2 528 1 1 2 SER H H -9.439 3.998 -3.854 1.00 . A A . 2 SER H 1 1 2 529 1 1 2 SER HA H -6.882 2.946 -3.373 1.00 . A A . 2 SER HA 1 1 2 530 1 1 2 SER HB2 H -5.458 4.129 -4.821 1.00 . A A . 2 SER HB2 1 1 2 531 1 1 2 SER HB3 H -6.764 3.586 -5.875 1.00 . A A . 2 SER HB3 1 1 2 532 1 1 2 SER HG H -5.942 6.044 -5.514 1.00 . A A . 2 SER HG 1 1 2 533 1 1 2 SER N N -8.690 3.476 -4.213 1.00 . A A . 2 SER N 1 1 2 534 1 1 2 SER O O -8.101 5.904 -2.905 1.00 . A A . 2 SER O 1 1 2 535 1 1 2 SER OG O -6.772 5.572 -5.411 1.00 . A A . 2 SER OG 1 1 2 536 1 1 3 CYS C C -5.532 7.042 -1.227 1.00 . A A . 3 CYS C 1 1 2 537 1 1 3 CYS CA C -6.357 5.850 -0.753 1.00 . A A . 3 CYS CA 1 1 2 538 1 1 3 CYS CB C -5.730 5.252 0.508 1.00 . A A . 3 CYS CB 1 1 2 539 1 1 3 CYS H H -5.869 4.056 -1.764 1.00 . A A . 3 CYS H 1 1 2 540 1 1 3 CYS HA H -7.356 6.189 -0.522 1.00 . A A . 3 CYS HA 1 1 2 541 1 1 3 CYS HB2 H -4.666 5.147 0.357 1.00 . A A . 3 CYS HB2 1 1 2 542 1 1 3 CYS HB3 H -5.905 5.921 1.340 1.00 . A A . 3 CYS HB3 1 1 2 543 1 1 3 CYS N N -6.458 4.838 -1.798 1.00 . A A . 3 CYS N 1 1 2 544 1 1 3 CYS O O -4.938 7.009 -2.305 1.00 . A A . 3 CYS O 1 1 2 545 1 1 3 CYS SG S -6.388 3.615 0.965 1.00 . A A . 3 CYS SG 1 1 2 546 1 1 4 THR C C -4.630 10.217 0.459 1.00 . A A . 4 THR C 1 1 2 547 1 1 4 THR CA C -4.747 9.296 -0.752 1.00 . A A . 4 THR CA 1 1 2 548 1 1 4 THR CB C -5.420 10.037 -1.908 1.00 . A A . 4 THR CB 1 1 2 549 1 1 4 THR CG2 C -6.809 10.536 -1.573 1.00 . A A . 4 THR CG2 1 1 2 550 1 1 4 THR H H -5.994 8.058 0.430 1.00 . A A . 4 THR H 1 1 2 551 1 1 4 THR HA H -3.757 8.993 -1.056 1.00 . A A . 4 THR HA 1 1 2 552 1 1 4 THR HB H -5.503 9.367 -2.751 1.00 . A A . 4 THR HB 1 1 2 553 1 1 4 THR HG1 H -3.723 10.899 -2.373 1.00 . A A . 4 THR HG1 1 1 2 554 1 1 4 THR HG21 H -7.379 10.650 -2.483 1.00 . A A . 4 THR HG21 1 1 2 555 1 1 4 THR HG22 H -6.739 11.489 -1.070 1.00 . A A . 4 THR HG22 1 1 2 556 1 1 4 THR HG23 H -7.301 9.823 -0.928 1.00 . A A . 4 THR HG23 1 1 2 557 1 1 4 THR N N -5.500 8.093 -0.415 1.00 . A A . 4 THR N 1 1 2 558 1 1 4 THR O O -4.619 11.441 0.322 1.00 . A A . 4 THR O 1 1 2 559 1 1 4 THR OG1 O -4.645 11.156 -2.304 1.00 . A A . 4 THR OG1 1 1 2 560 1 1 5 GLY C C -4.653 9.563 4.105 1.00 . A A . 5 GLY C 1 1 2 561 1 1 5 GLY CA C -4.426 10.399 2.861 1.00 . A A . 5 GLY CA 1 1 2 562 1 1 5 GLY H H -4.555 8.642 1.689 1.00 . A A . 5 GLY H 1 1 2 563 1 1 5 GLY HA2 H -3.437 10.832 2.907 1.00 . A A . 5 GLY HA2 1 1 2 564 1 1 5 GLY HA3 H -5.155 11.195 2.837 1.00 . A A . 5 GLY HA3 1 1 2 565 1 1 5 GLY N N -4.541 9.620 1.643 1.00 . A A . 5 GLY N 1 1 2 566 1 1 5 GLY O O -3.768 8.820 4.532 1.00 . A A . 5 GLY O 1 1 2 567 1 1 6 SER C C -5.221 9.262 7.027 1.00 . A A . 6 SER C 1 1 2 568 1 1 6 SER CA C -6.182 8.929 5.889 1.00 . A A . 6 SER CA 1 1 2 569 1 1 6 SER CB C -6.176 7.419 5.581 1.00 . A A . 6 SER CB 1 1 2 570 1 1 6 SER H H -6.505 10.290 4.300 1.00 . A A . 6 SER H 1 1 2 571 1 1 6 SER HA H -7.178 9.220 6.185 1.00 . A A . 6 SER HA 1 1 2 572 1 1 6 SER HB2 H -7.184 7.075 5.502 1.00 . A A . 6 SER HB2 1 1 2 573 1 1 6 SER HB3 H -5.662 7.251 4.654 1.00 . A A . 6 SER HB3 1 1 2 574 1 1 6 SER HG H -5.673 5.723 6.419 1.00 . A A . 6 SER HG 1 1 2 575 1 1 6 SER N N -5.841 9.683 4.687 1.00 . A A . 6 SER N 1 1 2 576 1 1 6 SER O O -4.903 10.427 7.272 1.00 . A A . 6 SER O 1 1 2 577 1 1 6 SER OG O -5.538 6.658 6.589 1.00 . A A . 6 SER OG 1 1 2 578 1 1 7 LYS C C -2.412 8.069 8.393 1.00 . A A . 7 LYS C 1 1 2 579 1 1 7 LYS CA C -3.839 8.386 8.826 1.00 . A A . 7 LYS CA 1 1 2 580 1 1 7 LYS CB C -4.246 7.477 9.987 1.00 . A A . 7 LYS CB 1 1 2 581 1 1 7 LYS CD C -6.708 7.569 10.480 1.00 . A A . 7 LYS CD 1 1 2 582 1 1 7 LYS CE C -7.195 8.227 9.200 1.00 . A A . 7 LYS CE 1 1 2 583 1 1 7 LYS CG C -5.328 8.069 10.874 1.00 . A A . 7 LYS CG 1 1 2 584 1 1 7 LYS H H -5.064 7.330 7.451 1.00 . A A . 7 LYS H 1 1 2 585 1 1 7 LYS HA H -3.884 9.413 9.153 1.00 . A A . 7 LYS HA 1 1 2 586 1 1 7 LYS HB2 H -4.611 6.542 9.586 1.00 . A A . 7 LYS HB2 1 1 2 587 1 1 7 LYS HB3 H -3.377 7.280 10.598 1.00 . A A . 7 LYS HB3 1 1 2 588 1 1 7 LYS HD2 H -6.663 6.500 10.328 1.00 . A A . 7 LYS HD2 1 1 2 589 1 1 7 LYS HD3 H -7.403 7.792 11.276 1.00 . A A . 7 LYS HD3 1 1 2 590 1 1 7 LYS HE2 H -6.708 9.185 9.094 1.00 . A A . 7 LYS HE2 1 1 2 591 1 1 7 LYS HE3 H -6.932 7.596 8.363 1.00 . A A . 7 LYS HE3 1 1 2 592 1 1 7 LYS HG2 H -5.134 7.789 11.898 1.00 . A A . 7 LYS HG2 1 1 2 593 1 1 7 LYS HG3 H -5.306 9.146 10.782 1.00 . A A . 7 LYS HG3 1 1 2 594 1 1 7 LYS HZ1 H -9.051 8.324 8.245 1.00 . A A . 7 LYS HZ1 1 1 2 595 1 1 7 LYS HZ2 H -8.896 9.388 9.551 1.00 . A A . 7 LYS HZ2 1 1 2 596 1 1 7 LYS HZ3 H -9.125 7.736 9.830 1.00 . A A . 7 LYS HZ3 1 1 2 597 1 1 7 LYS N N -4.765 8.230 7.711 1.00 . A A . 7 LYS N 1 1 2 598 1 1 7 LYS NZ N -8.669 8.433 9.207 1.00 . A A . 7 LYS NZ 1 1 2 599 1 1 7 LYS O O -1.605 7.582 9.184 1.00 . A A . 7 LYS O 1 1 2 600 1 1 8 ASP C C -0.528 6.590 6.461 1.00 . A A . 8 ASP C 1 1 2 601 1 1 8 ASP CA C -0.783 8.089 6.575 1.00 . A A . 8 ASP CA 1 1 2 602 1 1 8 ASP CB C 0.297 8.749 7.439 1.00 . A A . 8 ASP CB 1 1 2 603 1 1 8 ASP CG C 0.859 10.005 6.801 1.00 . A A . 8 ASP CG 1 1 2 604 1 1 8 ASP H H -2.802 8.726 6.546 1.00 . A A . 8 ASP H 1 1 2 605 1 1 8 ASP HA H -0.751 8.521 5.586 1.00 . A A . 8 ASP HA 1 1 2 606 1 1 8 ASP HB2 H -0.125 9.014 8.396 1.00 . A A . 8 ASP HB2 1 1 2 607 1 1 8 ASP HB3 H 1.108 8.051 7.588 1.00 . A A . 8 ASP HB3 1 1 2 608 1 1 8 ASP N N -2.111 8.345 7.127 1.00 . A A . 8 ASP N 1 1 2 609 1 1 8 ASP O O 0.358 6.043 7.117 1.00 . A A . 8 ASP O 1 1 2 610 1 1 8 ASP OD1 O 0.084 10.734 6.146 1.00 . A A . 8 ASP OD1 1 1 2 611 1 1 8 ASP OD2 O 2.071 10.259 6.956 1.00 . A A . 8 ASP OD2 1 1 2 612 1 1 9 CYS C C -0.336 4.196 4.192 1.00 . A A . 9 CYS C 1 1 2 613 1 1 9 CYS CA C -1.191 4.498 5.409 1.00 . A A . 9 CYS CA 1 1 2 614 1 1 9 CYS CB C -2.560 3.867 5.233 1.00 . A A . 9 CYS CB 1 1 2 615 1 1 9 CYS H H -2.007 6.431 5.131 1.00 . A A . 9 CYS H 1 1 2 616 1 1 9 CYS HA H -0.728 4.075 6.271 1.00 . A A . 9 CYS HA 1 1 2 617 1 1 9 CYS HB2 H -3.272 4.418 5.816 1.00 . A A . 9 CYS HB2 1 1 2 618 1 1 9 CYS HB3 H -2.831 3.923 4.198 1.00 . A A . 9 CYS HB3 1 1 2 619 1 1 9 CYS N N -1.318 5.934 5.621 1.00 . A A . 9 CYS N 1 1 2 620 1 1 9 CYS O O 0.772 3.675 4.304 1.00 . A A . 9 CYS O 1 1 2 621 1 1 9 CYS SG S -2.652 2.119 5.737 1.00 . A A . 9 CYS SG 1 1 2 622 1 1 10 TYR C C 1.235 4.919 1.803 1.00 . A A . 10 TYR C 1 1 2 623 1 1 10 TYR CA C -0.166 4.306 1.772 1.00 . A A . 10 TYR CA 1 1 2 624 1 1 10 TYR CB C -0.986 4.893 0.614 1.00 . A A . 10 TYR CB 1 1 2 625 1 1 10 TYR CD1 C 0.388 4.773 -1.506 1.00 . A A . 10 TYR CD1 1 1 2 626 1 1 10 TYR CD2 C 0.068 6.906 -0.490 1.00 . A A . 10 TYR CD2 1 1 2 627 1 1 10 TYR CE1 C 1.142 5.359 -2.506 1.00 . A A . 10 TYR CE1 1 1 2 628 1 1 10 TYR CE2 C 0.820 7.498 -1.486 1.00 . A A . 10 TYR CE2 1 1 2 629 1 1 10 TYR CG C -0.161 5.535 -0.483 1.00 . A A . 10 TYR CG 1 1 2 630 1 1 10 TYR CZ C 1.354 6.721 -2.491 1.00 . A A . 10 TYR CZ 1 1 2 631 1 1 10 TYR H H -1.756 4.944 3.013 1.00 . A A . 10 TYR H 1 1 2 632 1 1 10 TYR HA H -0.075 3.240 1.631 1.00 . A A . 10 TYR HA 1 1 2 633 1 1 10 TYR HB2 H -1.571 4.106 0.164 1.00 . A A . 10 TYR HB2 1 1 2 634 1 1 10 TYR HB3 H -1.654 5.646 1.008 1.00 . A A . 10 TYR HB3 1 1 2 635 1 1 10 TYR HD1 H 0.218 3.706 -1.514 1.00 . A A . 10 TYR HD1 1 1 2 636 1 1 10 TYR HD2 H -0.352 7.513 0.298 1.00 . A A . 10 TYR HD2 1 1 2 637 1 1 10 TYR HE1 H 1.560 4.748 -3.293 1.00 . A A . 10 TYR HE1 1 1 2 638 1 1 10 TYR HE2 H 0.987 8.565 -1.474 1.00 . A A . 10 TYR HE2 1 1 2 639 1 1 10 TYR HH H 1.546 7.485 -4.244 1.00 . A A . 10 TYR HH 1 1 2 640 1 1 10 TYR N N -0.866 4.533 3.029 1.00 . A A . 10 TYR N 1 1 2 641 1 1 10 TYR O O 2.106 4.524 1.034 1.00 . A A . 10 TYR O 1 1 2 642 1 1 10 TYR OH O 2.104 7.308 -3.484 1.00 . A A . 10 TYR OH 1 1 2 643 1 1 11 ALA C C 3.815 5.656 3.387 1.00 . A A . 11 ALA C 1 1 2 644 1 1 11 ALA CA C 2.735 6.563 2.794 1.00 . A A . 11 ALA CA 1 1 2 645 1 1 11 ALA CB C 2.601 7.839 3.613 1.00 . A A . 11 ALA CB 1 1 2 646 1 1 11 ALA H H 0.704 6.174 3.271 1.00 . A A . 11 ALA H 1 1 2 647 1 1 11 ALA HA H 3.038 6.845 1.795 1.00 . A A . 11 ALA HA 1 1 2 648 1 1 11 ALA HB1 H 1.821 7.713 4.350 1.00 . A A . 11 ALA HB1 1 1 2 649 1 1 11 ALA HB2 H 2.350 8.662 2.960 1.00 . A A . 11 ALA HB2 1 1 2 650 1 1 11 ALA HB3 H 3.536 8.047 4.112 1.00 . A A . 11 ALA HB3 1 1 2 651 1 1 11 ALA N N 1.441 5.893 2.687 1.00 . A A . 11 ALA N 1 1 2 652 1 1 11 ALA O O 4.770 5.282 2.698 1.00 . A A . 11 ALA O 1 1 2 653 1 1 12 PRO C C 5.060 3.229 4.523 1.00 . A A . 12 PRO C 1 1 2 654 1 1 12 PRO CA C 4.666 4.437 5.361 1.00 . A A . 12 PRO CA 1 1 2 655 1 1 12 PRO CB C 3.946 3.995 6.646 1.00 . A A . 12 PRO CB 1 1 2 656 1 1 12 PRO CD C 2.602 5.678 5.581 1.00 . A A . 12 PRO CD 1 1 2 657 1 1 12 PRO CG C 2.550 4.522 6.539 1.00 . A A . 12 PRO CG 1 1 2 658 1 1 12 PRO HA H 5.556 4.992 5.620 1.00 . A A . 12 PRO HA 1 1 2 659 1 1 12 PRO HB2 H 3.952 2.917 6.709 1.00 . A A . 12 PRO HB2 1 1 2 660 1 1 12 PRO HB3 H 4.456 4.409 7.503 1.00 . A A . 12 PRO HB3 1 1 2 661 1 1 12 PRO HD2 H 1.668 5.772 5.047 1.00 . A A . 12 PRO HD2 1 1 2 662 1 1 12 PRO HD3 H 2.838 6.594 6.103 1.00 . A A . 12 PRO HD3 1 1 2 663 1 1 12 PRO HG2 H 1.897 3.752 6.160 1.00 . A A . 12 PRO HG2 1 1 2 664 1 1 12 PRO HG3 H 2.212 4.855 7.508 1.00 . A A . 12 PRO HG3 1 1 2 665 1 1 12 PRO N N 3.691 5.292 4.680 1.00 . A A . 12 PRO N 1 1 2 666 1 1 12 PRO O O 6.185 2.738 4.615 1.00 . A A . 12 PRO O 1 1 2 667 1 1 13 CYS C C 4.934 2.042 1.499 1.00 . A A . 13 CYS C 1 1 2 668 1 1 13 CYS CA C 4.390 1.610 2.848 1.00 . A A . 13 CYS CA 1 1 2 669 1 1 13 CYS CB C 3.132 0.785 2.654 1.00 . A A . 13 CYS CB 1 1 2 670 1 1 13 CYS H H 3.252 3.192 3.671 1.00 . A A . 13 CYS H 1 1 2 671 1 1 13 CYS HA H 5.123 0.999 3.331 1.00 . A A . 13 CYS HA 1 1 2 672 1 1 13 CYS HB2 H 2.380 1.147 3.326 1.00 . A A . 13 CYS HB2 1 1 2 673 1 1 13 CYS HB3 H 2.796 0.902 1.640 1.00 . A A . 13 CYS HB3 1 1 2 674 1 1 13 CYS N N 4.130 2.757 3.703 1.00 . A A . 13 CYS N 1 1 2 675 1 1 13 CYS O O 5.936 1.511 1.037 1.00 . A A . 13 CYS O 1 1 2 676 1 1 13 CYS SG S 3.359 -0.997 2.967 1.00 . A A . 13 CYS SG 1 1 2 677 1 1 14 ARG C C 6.213 3.665 -0.469 1.00 . A A . 14 ARG C 1 1 2 678 1 1 14 ARG CA C 4.702 3.512 -0.433 1.00 . A A . 14 ARG CA 1 1 2 679 1 1 14 ARG CB C 4.024 4.851 -0.752 1.00 . A A . 14 ARG CB 1 1 2 680 1 1 14 ARG CD C 5.495 6.765 -1.463 1.00 . A A . 14 ARG CD 1 1 2 681 1 1 14 ARG CG C 4.643 5.593 -1.927 1.00 . A A . 14 ARG CG 1 1 2 682 1 1 14 ARG CZ C 4.551 8.753 -2.572 1.00 . A A . 14 ARG CZ 1 1 2 683 1 1 14 ARG H H 3.484 3.401 1.298 1.00 . A A . 14 ARG H 1 1 2 684 1 1 14 ARG HA H 4.412 2.782 -1.172 1.00 . A A . 14 ARG HA 1 1 2 685 1 1 14 ARG HB2 H 2.986 4.667 -0.981 1.00 . A A . 14 ARG HB2 1 1 2 686 1 1 14 ARG HB3 H 4.084 5.487 0.119 1.00 . A A . 14 ARG HB3 1 1 2 687 1 1 14 ARG HD2 H 5.092 7.141 -0.534 1.00 . A A . 14 ARG HD2 1 1 2 688 1 1 14 ARG HD3 H 6.505 6.415 -1.301 1.00 . A A . 14 ARG HD3 1 1 2 689 1 1 14 ARG HE H 6.298 7.905 -3.035 1.00 . A A . 14 ARG HE 1 1 2 690 1 1 14 ARG HG2 H 5.264 4.911 -2.485 1.00 . A A . 14 ARG HG2 1 1 2 691 1 1 14 ARG HG3 H 3.852 5.965 -2.563 1.00 . A A . 14 ARG HG3 1 1 2 692 1 1 14 ARG HH11 H 3.395 7.992 -1.097 1.00 . A A . 14 ARG HH11 1 1 2 693 1 1 14 ARG HH12 H 2.758 9.391 -1.892 1.00 . A A . 14 ARG HH12 1 1 2 694 1 1 14 ARG HH21 H 5.458 9.745 -4.082 1.00 . A A . 14 ARG HH21 1 1 2 695 1 1 14 ARG HH22 H 3.926 10.386 -3.587 1.00 . A A . 14 ARG HH22 1 1 2 696 1 1 14 ARG N N 4.272 3.013 0.872 1.00 . A A . 14 ARG N 1 1 2 697 1 1 14 ARG NE N 5.519 7.848 -2.443 1.00 . A A . 14 ARG NE 1 1 2 698 1 1 14 ARG NH1 N 3.481 8.708 -1.790 1.00 . A A . 14 ARG NH1 1 1 2 699 1 1 14 ARG NH2 N 4.653 9.706 -3.489 1.00 . A A . 14 ARG NH2 1 1 2 700 1 1 14 ARG O O 6.848 3.463 -1.504 1.00 . A A . 14 ARG O 1 1 2 701 1 1 15 LYS C C 8.918 2.841 0.434 1.00 . A A . 15 LYS C 1 1 2 702 1 1 15 LYS CA C 8.223 4.155 0.785 1.00 . A A . 15 LYS CA 1 1 2 703 1 1 15 LYS CB C 8.611 4.596 2.199 1.00 . A A . 15 LYS CB 1 1 2 704 1 1 15 LYS CD C 9.290 6.642 3.490 1.00 . A A . 15 LYS CD 1 1 2 705 1 1 15 LYS CE C 9.533 8.122 3.243 1.00 . A A . 15 LYS CE 1 1 2 706 1 1 15 LYS CG C 9.508 5.823 2.229 1.00 . A A . 15 LYS CG 1 1 2 707 1 1 15 LYS H H 6.217 4.134 1.476 1.00 . A A . 15 LYS H 1 1 2 708 1 1 15 LYS HA H 8.531 4.913 0.081 1.00 . A A . 15 LYS HA 1 1 2 709 1 1 15 LYS HB2 H 7.712 4.821 2.752 1.00 . A A . 15 LYS HB2 1 1 2 710 1 1 15 LYS HB3 H 9.131 3.786 2.688 1.00 . A A . 15 LYS HB3 1 1 2 711 1 1 15 LYS HD2 H 8.272 6.506 3.825 1.00 . A A . 15 LYS HD2 1 1 2 712 1 1 15 LYS HD3 H 9.970 6.296 4.255 1.00 . A A . 15 LYS HD3 1 1 2 713 1 1 15 LYS HE2 H 10.567 8.344 3.458 1.00 . A A . 15 LYS HE2 1 1 2 714 1 1 15 LYS HE3 H 9.327 8.339 2.205 1.00 . A A . 15 LYS HE3 1 1 2 715 1 1 15 LYS HG2 H 10.539 5.505 2.192 1.00 . A A . 15 LYS HG2 1 1 2 716 1 1 15 LYS HG3 H 9.288 6.438 1.368 1.00 . A A . 15 LYS HG3 1 1 2 717 1 1 15 LYS HZ1 H 8.992 9.965 4.065 1.00 . A A . 15 LYS HZ1 1 1 2 718 1 1 15 LYS HZ2 H 8.699 8.648 5.085 1.00 . A A . 15 LYS HZ2 1 1 2 719 1 1 15 LYS HZ3 H 7.682 8.937 3.766 1.00 . A A . 15 LYS HZ3 1 1 2 720 1 1 15 LYS N N 6.783 4.001 0.679 1.00 . A A . 15 LYS N 1 1 2 721 1 1 15 LYS NZ N 8.666 8.978 4.100 1.00 . A A . 15 LYS NZ 1 1 2 722 1 1 15 LYS O O 9.774 2.795 -0.451 1.00 . A A . 15 LYS O 1 1 2 723 1 1 16 GLN C C 8.657 -0.139 -0.439 1.00 . A A . 16 GLN C 1 1 2 724 1 1 16 GLN CA C 9.116 0.453 0.896 1.00 . A A . 16 GLN CA 1 1 2 725 1 1 16 GLN CB C 8.745 -0.496 2.037 1.00 . A A . 16 GLN CB 1 1 2 726 1 1 16 GLN CD C 8.389 -0.401 4.536 1.00 . A A . 16 GLN CD 1 1 2 727 1 1 16 GLN CG C 9.320 -0.084 3.381 1.00 . A A . 16 GLN CG 1 1 2 728 1 1 16 GLN H H 7.843 1.874 1.823 1.00 . A A . 16 GLN H 1 1 2 729 1 1 16 GLN HA H 10.189 0.564 0.873 1.00 . A A . 16 GLN HA 1 1 2 730 1 1 16 GLN HB2 H 7.668 -0.530 2.125 1.00 . A A . 16 GLN HB2 1 1 2 731 1 1 16 GLN HB3 H 9.109 -1.485 1.801 1.00 . A A . 16 GLN HB3 1 1 2 732 1 1 16 GLN HE21 H 8.507 -2.344 4.130 1.00 . A A . 16 GLN HE21 1 1 2 733 1 1 16 GLN HE22 H 7.506 -1.916 5.472 1.00 . A A . 16 GLN HE22 1 1 2 734 1 1 16 GLN HG2 H 10.251 -0.610 3.536 1.00 . A A . 16 GLN HG2 1 1 2 735 1 1 16 GLN HG3 H 9.506 0.979 3.369 1.00 . A A . 16 GLN HG3 1 1 2 736 1 1 16 GLN N N 8.537 1.774 1.132 1.00 . A A . 16 GLN N 1 1 2 737 1 1 16 GLN NE2 N 8.105 -1.683 4.733 1.00 . A A . 16 GLN NE2 1 1 2 738 1 1 16 GLN O O 9.457 -0.695 -1.192 1.00 . A A . 16 GLN O 1 1 2 739 1 1 16 GLN OE1 O 7.930 0.497 5.242 1.00 . A A . 16 GLN OE1 1 1 2 740 1 1 17 THR C C 7.202 0.223 -3.158 1.00 . A A . 17 THR C 1 1 2 741 1 1 17 THR CA C 6.773 -0.567 -1.933 1.00 . A A . 17 THR CA 1 1 2 742 1 1 17 THR CB C 5.247 -0.556 -1.816 1.00 . A A . 17 THR CB 1 1 2 743 1 1 17 THR CG2 C 4.557 -1.393 -2.868 1.00 . A A . 17 THR CG2 1 1 2 744 1 1 17 THR H H 6.776 0.411 -0.070 1.00 . A A . 17 THR H 1 1 2 745 1 1 17 THR HA H 7.105 -1.582 -2.043 1.00 . A A . 17 THR HA 1 1 2 746 1 1 17 THR HB H 4.897 0.461 -1.922 1.00 . A A . 17 THR HB 1 1 2 747 1 1 17 THR HG1 H 4.788 -0.307 0.071 1.00 . A A . 17 THR HG1 1 1 2 748 1 1 17 THR HG21 H 3.487 -1.278 -2.774 1.00 . A A . 17 THR HG21 1 1 2 749 1 1 17 THR HG22 H 4.820 -2.432 -2.732 1.00 . A A . 17 THR HG22 1 1 2 750 1 1 17 THR HG23 H 4.867 -1.069 -3.848 1.00 . A A . 17 THR HG23 1 1 2 751 1 1 17 THR N N 7.360 -0.031 -0.712 1.00 . A A . 17 THR N 1 1 2 752 1 1 17 THR O O 7.847 -0.309 -4.063 1.00 . A A . 17 THR O 1 1 2 753 1 1 17 THR OG1 O 4.839 -1.038 -0.548 1.00 . A A . 17 THR OG1 1 1 2 754 1 1 18 GLY C C 5.945 2.933 -4.959 1.00 . A A . 18 GLY C 1 1 2 755 1 1 18 GLY CA C 7.164 2.340 -4.292 1.00 . A A . 18 GLY CA 1 1 2 756 1 1 18 GLY H H 6.323 1.846 -2.448 1.00 . A A . 18 GLY H 1 1 2 757 1 1 18 GLY HA2 H 7.794 3.136 -3.952 1.00 . A A . 18 GLY HA2 1 1 2 758 1 1 18 GLY HA3 H 7.697 1.755 -5.006 1.00 . A A . 18 GLY HA3 1 1 2 759 1 1 18 GLY N N 6.830 1.491 -3.183 1.00 . A A . 18 GLY N 1 1 2 760 1 1 18 GLY O O 5.248 3.761 -4.374 1.00 . A A . 18 GLY O 1 1 2 761 1 1 19 CYS C C 3.426 3.528 -6.171 1.00 . A A . 19 CYS C 1 1 2 762 1 1 19 CYS CA C 4.588 2.973 -7.006 1.00 . A A . 19 CYS CA 1 1 2 763 1 1 19 CYS CB C 4.099 1.868 -7.908 1.00 . A A . 19 CYS CB 1 1 2 764 1 1 19 CYS H H 6.328 1.866 -6.581 1.00 . A A . 19 CYS H 1 1 2 765 1 1 19 CYS HA H 4.960 3.742 -7.640 1.00 . A A . 19 CYS HA 1 1 2 766 1 1 19 CYS HB2 H 3.109 2.115 -8.238 1.00 . A A . 19 CYS HB2 1 1 2 767 1 1 19 CYS HB3 H 4.754 1.829 -8.758 1.00 . A A . 19 CYS HB3 1 1 2 768 1 1 19 CYS N N 5.710 2.509 -6.194 1.00 . A A . 19 CYS N 1 1 2 769 1 1 19 CYS O O 3.095 2.989 -5.115 1.00 . A A . 19 CYS O 1 1 2 770 1 1 19 CYS SG S 4.052 0.210 -7.148 1.00 . A A . 19 CYS SG 1 1 2 771 1 1 20 PRO C C 0.483 4.356 -5.682 1.00 . A A . 20 PRO C 1 1 2 772 1 1 20 PRO CA C 1.681 5.276 -5.925 1.00 . A A . 20 PRO CA 1 1 2 773 1 1 20 PRO CB C 1.276 6.423 -6.857 1.00 . A A . 20 PRO CB 1 1 2 774 1 1 20 PRO CD C 3.140 5.342 -7.879 1.00 . A A . 20 PRO CD 1 1 2 775 1 1 20 PRO CG C 2.475 6.676 -7.702 1.00 . A A . 20 PRO CG 1 1 2 776 1 1 20 PRO HA H 2.006 5.684 -4.981 1.00 . A A . 20 PRO HA 1 1 2 777 1 1 20 PRO HB2 H 0.429 6.121 -7.455 1.00 . A A . 20 PRO HB2 1 1 2 778 1 1 20 PRO HB3 H 1.018 7.292 -6.270 1.00 . A A . 20 PRO HB3 1 1 2 779 1 1 20 PRO HD2 H 2.739 4.831 -8.742 1.00 . A A . 20 PRO HD2 1 1 2 780 1 1 20 PRO HD3 H 4.209 5.465 -7.973 1.00 . A A . 20 PRO HD3 1 1 2 781 1 1 20 PRO HG2 H 2.172 7.075 -8.659 1.00 . A A . 20 PRO HG2 1 1 2 782 1 1 20 PRO HG3 H 3.140 7.363 -7.201 1.00 . A A . 20 PRO HG3 1 1 2 783 1 1 20 PRO N N 2.799 4.629 -6.635 1.00 . A A . 20 PRO N 1 1 2 784 1 1 20 PRO O O -0.428 4.708 -4.933 1.00 . A A . 20 PRO O 1 1 2 785 1 1 21 TYR C C -0.643 1.642 -4.773 1.00 . A A . 21 TYR C 1 1 2 786 1 1 21 TYR CA C -0.619 2.254 -6.170 1.00 . A A . 21 TYR CA 1 1 2 787 1 1 21 TYR CB C -0.494 1.153 -7.220 1.00 . A A . 21 TYR CB 1 1 2 788 1 1 21 TYR CD1 C 0.048 2.762 -9.094 1.00 . A A . 21 TYR CD1 1 1 2 789 1 1 21 TYR CD2 C 1.229 0.694 -9.013 1.00 . A A . 21 TYR CD2 1 1 2 790 1 1 21 TYR CE1 C 0.746 3.121 -10.232 1.00 . A A . 21 TYR CE1 1 1 2 791 1 1 21 TYR CE2 C 1.932 1.045 -10.150 1.00 . A A . 21 TYR CE2 1 1 2 792 1 1 21 TYR CG C 0.277 1.545 -8.466 1.00 . A A . 21 TYR CG 1 1 2 793 1 1 21 TYR CZ C 1.687 2.260 -10.755 1.00 . A A . 21 TYR CZ 1 1 2 794 1 1 21 TYR H H 1.202 2.952 -6.913 1.00 . A A . 21 TYR H 1 1 2 795 1 1 21 TYR HA H -1.545 2.784 -6.330 1.00 . A A . 21 TYR HA 1 1 2 796 1 1 21 TYR HB2 H -0.001 0.299 -6.784 1.00 . A A . 21 TYR HB2 1 1 2 797 1 1 21 TYR HB3 H -1.472 0.874 -7.526 1.00 . A A . 21 TYR HB3 1 1 2 798 1 1 21 TYR HD1 H -0.689 3.436 -8.682 1.00 . A A . 21 TYR HD1 1 1 2 799 1 1 21 TYR HD2 H 1.419 -0.257 -8.537 1.00 . A A . 21 TYR HD2 1 1 2 800 1 1 21 TYR HE1 H 0.554 4.073 -10.706 1.00 . A A . 21 TYR HE1 1 1 2 801 1 1 21 TYR HE2 H 2.669 0.370 -10.559 1.00 . A A . 21 TYR HE2 1 1 2 802 1 1 21 TYR HH H 1.992 2.185 -12.652 1.00 . A A . 21 TYR HH 1 1 2 803 1 1 21 TYR N N 0.472 3.190 -6.318 1.00 . A A . 21 TYR N 1 1 2 804 1 1 21 TYR O O 0.299 1.797 -3.996 1.00 . A A . 21 TYR O 1 1 2 805 1 1 21 TYR OH O 2.384 2.613 -11.888 1.00 . A A . 21 TYR OH 1 1 2 806 1 1 22 GLY C C -3.096 -0.611 -3.127 1.00 . A A . 22 GLY C 1 1 2 807 1 1 22 GLY CA C -1.895 0.312 -3.169 1.00 . A A . 22 GLY CA 1 1 2 808 1 1 22 GLY H H -2.448 0.873 -5.138 1.00 . A A . 22 GLY H 1 1 2 809 1 1 22 GLY HA2 H -1.010 -0.259 -2.947 1.00 . A A . 22 GLY HA2 1 1 2 810 1 1 22 GLY HA3 H -2.014 1.076 -2.416 1.00 . A A . 22 GLY HA3 1 1 2 811 1 1 22 GLY N N -1.737 0.950 -4.470 1.00 . A A . 22 GLY N 1 1 2 812 1 1 22 GLY O O -4.017 -0.466 -3.932 1.00 . A A . 22 GLY O 1 1 2 813 1 1 23 LYS C C -5.072 -2.114 -0.837 1.00 . A A . 23 LYS C 1 1 2 814 1 1 23 LYS CA C -4.234 -2.471 -2.060 1.00 . A A . 23 LYS CA 1 1 2 815 1 1 23 LYS CB C -3.742 -3.918 -1.962 1.00 . A A . 23 LYS CB 1 1 2 816 1 1 23 LYS CD C -4.545 -4.565 -4.254 1.00 . A A . 23 LYS CD 1 1 2 817 1 1 23 LYS CE C -5.817 -3.855 -4.691 1.00 . A A . 23 LYS CE 1 1 2 818 1 1 23 LYS CG C -4.574 -4.898 -2.772 1.00 . A A . 23 LYS CG 1 1 2 819 1 1 23 LYS H H -2.365 -1.621 -1.552 1.00 . A A . 23 LYS H 1 1 2 820 1 1 23 LYS HA H -4.840 -2.363 -2.941 1.00 . A A . 23 LYS HA 1 1 2 821 1 1 23 LYS HB2 H -2.722 -3.964 -2.319 1.00 . A A . 23 LYS HB2 1 1 2 822 1 1 23 LYS HB3 H -3.766 -4.226 -0.927 1.00 . A A . 23 LYS HB3 1 1 2 823 1 1 23 LYS HD2 H -3.701 -3.921 -4.452 1.00 . A A . 23 LYS HD2 1 1 2 824 1 1 23 LYS HD3 H -4.443 -5.481 -4.818 1.00 . A A . 23 LYS HD3 1 1 2 825 1 1 23 LYS HE2 H -6.483 -4.580 -5.137 1.00 . A A . 23 LYS HE2 1 1 2 826 1 1 23 LYS HE3 H -6.289 -3.421 -3.823 1.00 . A A . 23 LYS HE3 1 1 2 827 1 1 23 LYS HG2 H -4.179 -5.893 -2.629 1.00 . A A . 23 LYS HG2 1 1 2 828 1 1 23 LYS HG3 H -5.595 -4.861 -2.423 1.00 . A A . 23 LYS HG3 1 1 2 829 1 1 23 LYS HZ1 H -4.661 -2.986 -6.200 1.00 . A A . 23 LYS HZ1 1 1 2 830 1 1 23 LYS HZ2 H -5.438 -1.866 -5.200 1.00 . A A . 23 LYS HZ2 1 1 2 831 1 1 23 LYS HZ3 H -6.323 -2.713 -6.365 1.00 . A A . 23 LYS HZ3 1 1 2 832 1 1 23 LYS N N -3.109 -1.553 -2.184 1.00 . A A . 23 LYS N 1 1 2 833 1 1 23 LYS NZ N -5.540 -2.780 -5.683 1.00 . A A . 23 LYS NZ 1 1 2 834 1 1 23 LYS O O -5.780 -2.955 -0.284 1.00 . A A . 23 LYS O 1 1 2 835 1 1 24 CYS C C -7.169 -0.125 0.410 1.00 . A A . 24 CYS C 1 1 2 836 1 1 24 CYS CA C -5.701 -0.370 0.744 1.00 . A A . 24 CYS CA 1 1 2 837 1 1 24 CYS CB C -5.043 0.910 1.274 1.00 . A A . 24 CYS CB 1 1 2 838 1 1 24 CYS H H -4.383 -0.237 -0.898 1.00 . A A . 24 CYS H 1 1 2 839 1 1 24 CYS HA H -5.648 -1.131 1.507 1.00 . A A . 24 CYS HA 1 1 2 840 1 1 24 CYS HB2 H -5.541 1.216 2.179 1.00 . A A . 24 CYS HB2 1 1 2 841 1 1 24 CYS HB3 H -4.007 0.703 1.496 1.00 . A A . 24 CYS HB3 1 1 2 842 1 1 24 CYS N N -4.971 -0.855 -0.417 1.00 . A A . 24 CYS N 1 1 2 843 1 1 24 CYS O O -7.554 0.961 -0.024 1.00 . A A . 24 CYS O 1 1 2 844 1 1 24 CYS SG S -5.082 2.316 0.113 1.00 . A A . 24 CYS SG 1 1 2 845 1 1 25 MET C C -10.136 -0.389 1.514 1.00 . A A . 25 MET C 1 1 2 846 1 1 25 MET CA C -9.416 -1.055 0.352 1.00 . A A . 25 MET CA 1 1 2 847 1 1 25 MET CB C -10.003 -2.445 0.096 1.00 . A A . 25 MET CB 1 1 2 848 1 1 25 MET CE C -9.337 -6.021 0.747 1.00 . A A . 25 MET CE 1 1 2 849 1 1 25 MET CG C -9.922 -3.370 1.300 1.00 . A A . 25 MET CG 1 1 2 850 1 1 25 MET H H -7.619 -1.986 0.973 1.00 . A A . 25 MET H 1 1 2 851 1 1 25 MET HA H -9.553 -0.448 -0.531 1.00 . A A . 25 MET HA 1 1 2 852 1 1 25 MET HB2 H -11.042 -2.340 -0.180 1.00 . A A . 25 MET HB2 1 1 2 853 1 1 25 MET HB3 H -9.466 -2.905 -0.720 1.00 . A A . 25 MET HB3 1 1 2 854 1 1 25 MET HE1 H -10.327 -6.045 1.177 1.00 . A A . 25 MET HE1 1 1 2 855 1 1 25 MET HE2 H -8.767 -6.864 1.110 1.00 . A A . 25 MET HE2 1 1 2 856 1 1 25 MET HE3 H -9.410 -6.074 -0.329 1.00 . A A . 25 MET HE3 1 1 2 857 1 1 25 MET HG2 H -9.829 -2.769 2.193 1.00 . A A . 25 MET HG2 1 1 2 858 1 1 25 MET HG3 H -10.831 -3.951 1.352 1.00 . A A . 25 MET HG3 1 1 2 859 1 1 25 MET N N -7.986 -1.148 0.621 1.00 . A A . 25 MET N 1 1 2 860 1 1 25 MET O O -9.752 -0.552 2.672 1.00 . A A . 25 MET O 1 1 2 861 1 1 25 MET SD S -8.518 -4.499 1.216 1.00 . A A . 25 MET SD 1 1 2 862 1 1 26 ASN C C -12.299 0.126 3.374 1.00 . A A . 26 ASN C 1 1 2 863 1 1 26 ASN CA C -11.959 1.062 2.220 1.00 . A A . 26 ASN CA 1 1 2 864 1 1 26 ASN CB C -13.251 1.646 1.642 1.00 . A A . 26 ASN CB 1 1 2 865 1 1 26 ASN CG C -13.099 2.128 0.211 1.00 . A A . 26 ASN CG 1 1 2 866 1 1 26 ASN H H -11.432 0.453 0.253 1.00 . A A . 26 ASN H 1 1 2 867 1 1 26 ASN HA H -11.350 1.870 2.600 1.00 . A A . 26 ASN HA 1 1 2 868 1 1 26 ASN HB2 H -14.016 0.890 1.670 1.00 . A A . 26 ASN HB2 1 1 2 869 1 1 26 ASN HB3 H -13.560 2.483 2.252 1.00 . A A . 26 ASN HB3 1 1 2 870 1 1 26 ASN HD21 H -13.532 3.988 0.763 1.00 . A A . 26 ASN HD21 1 1 2 871 1 1 26 ASN HD22 H -13.210 3.760 -0.918 1.00 . A A . 26 ASN HD22 1 1 2 872 1 1 26 ASN N N -11.182 0.364 1.196 1.00 . A A . 26 ASN N 1 1 2 873 1 1 26 ASN ND2 N -13.300 3.422 -0.003 1.00 . A A . 26 ASN ND2 1 1 2 874 1 1 26 ASN O O -12.838 -0.962 3.169 1.00 . A A . 26 ASN O 1 1 2 875 1 1 26 ASN OD1 O -12.806 1.344 -0.692 1.00 . A A . 26 ASN OD1 1 1 2 876 1 1 27 ARG C C -11.253 -1.413 5.853 1.00 . A A . 27 ARG C 1 1 2 877 1 1 27 ARG CA C -12.218 -0.238 5.781 1.00 . A A . 27 ARG CA 1 1 2 878 1 1 27 ARG CB C -13.665 -0.738 5.810 1.00 . A A . 27 ARG CB 1 1 2 879 1 1 27 ARG CD C -14.774 -1.889 7.752 1.00 . A A . 27 ARG CD 1 1 2 880 1 1 27 ARG CG C -14.341 -0.557 7.159 1.00 . A A . 27 ARG CG 1 1 2 881 1 1 27 ARG CZ C -16.662 -2.738 9.089 1.00 . A A . 27 ARG CZ 1 1 2 882 1 1 27 ARG H H -11.531 1.424 4.670 1.00 . A A . 27 ARG H 1 1 2 883 1 1 27 ARG HA H -12.049 0.398 6.636 1.00 . A A . 27 ARG HA 1 1 2 884 1 1 27 ARG HB2 H -14.235 -0.196 5.070 1.00 . A A . 27 ARG HB2 1 1 2 885 1 1 27 ARG HB3 H -13.677 -1.789 5.561 1.00 . A A . 27 ARG HB3 1 1 2 886 1 1 27 ARG HD2 H -15.083 -2.542 6.951 1.00 . A A . 27 ARG HD2 1 1 2 887 1 1 27 ARG HD3 H -13.933 -2.327 8.269 1.00 . A A . 27 ARG HD3 1 1 2 888 1 1 27 ARG HE H -16.055 -0.837 9.046 1.00 . A A . 27 ARG HE 1 1 2 889 1 1 27 ARG HG2 H -13.649 -0.082 7.837 1.00 . A A . 27 ARG HG2 1 1 2 890 1 1 27 ARG HG3 H -15.211 0.071 7.032 1.00 . A A . 27 ARG HG3 1 1 2 891 1 1 27 ARG HH11 H -15.718 -4.145 7.984 1.00 . A A . 27 ARG HH11 1 1 2 892 1 1 27 ARG HH12 H -17.048 -4.717 8.933 1.00 . A A . 27 ARG HH12 1 1 2 893 1 1 27 ARG HH21 H -17.806 -1.588 10.295 1.00 . A A . 27 ARG HH21 1 1 2 894 1 1 27 ARG HH22 H -18.234 -3.266 10.245 1.00 . A A . 27 ARG HH22 1 1 2 895 1 1 27 ARG N N -11.967 0.554 4.583 1.00 . A A . 27 ARG N 1 1 2 896 1 1 27 ARG NE N -15.882 -1.735 8.692 1.00 . A A . 27 ARG NE 1 1 2 897 1 1 27 ARG NH1 N -16.459 -3.968 8.631 1.00 . A A . 27 ARG NH1 1 1 2 898 1 1 27 ARG NH2 N -17.647 -2.512 9.947 1.00 . A A . 27 ARG NH2 1 1 2 899 1 1 27 ARG O O -11.560 -2.454 6.433 1.00 . A A . 27 ARG O 1 1 2 900 1 1 28 LYS C C -7.868 -1.854 4.367 1.00 . A A . 28 LYS C 1 1 2 901 1 1 28 LYS CA C -9.049 -2.267 5.241 1.00 . A A . 28 LYS CA 1 1 2 902 1 1 28 LYS CB C -9.625 -3.597 4.744 1.00 . A A . 28 LYS CB 1 1 2 903 1 1 28 LYS CD C -9.973 -4.609 7.017 1.00 . A A . 28 LYS CD 1 1 2 904 1 1 28 LYS CE C -9.607 -5.751 7.952 1.00 . A A . 28 LYS CE 1 1 2 905 1 1 28 LYS CG C -9.317 -4.773 5.656 1.00 . A A . 28 LYS CG 1 1 2 906 1 1 28 LYS H H -9.903 -0.371 4.815 1.00 . A A . 28 LYS H 1 1 2 907 1 1 28 LYS HA H -8.697 -2.395 6.254 1.00 . A A . 28 LYS HA 1 1 2 908 1 1 28 LYS HB2 H -10.698 -3.505 4.661 1.00 . A A . 28 LYS HB2 1 1 2 909 1 1 28 LYS HB3 H -9.217 -3.812 3.766 1.00 . A A . 28 LYS HB3 1 1 2 910 1 1 28 LYS HD2 H -9.645 -3.679 7.456 1.00 . A A . 28 LYS HD2 1 1 2 911 1 1 28 LYS HD3 H -11.046 -4.591 6.888 1.00 . A A . 28 LYS HD3 1 1 2 912 1 1 28 LYS HE2 H -9.336 -6.612 7.361 1.00 . A A . 28 LYS HE2 1 1 2 913 1 1 28 LYS HE3 H -8.763 -5.448 8.555 1.00 . A A . 28 LYS HE3 1 1 2 914 1 1 28 LYS HG2 H -9.684 -5.679 5.197 1.00 . A A . 28 LYS HG2 1 1 2 915 1 1 28 LYS HG3 H -8.247 -4.842 5.788 1.00 . A A . 28 LYS HG3 1 1 2 916 1 1 28 LYS HZ1 H -10.531 -7.013 9.337 1.00 . A A . 28 LYS HZ1 1 1 2 917 1 1 28 LYS HZ2 H -11.611 -6.229 8.297 1.00 . A A . 28 LYS HZ2 1 1 2 918 1 1 28 LYS HZ3 H -10.884 -5.373 9.562 1.00 . A A . 28 LYS HZ3 1 1 2 919 1 1 28 LYS N N -10.080 -1.230 5.255 1.00 . A A . 28 LYS N 1 1 2 920 1 1 28 LYS NZ N -10.737 -6.117 8.850 1.00 . A A . 28 LYS NZ 1 1 2 921 1 1 28 LYS O O -7.865 -2.085 3.158 1.00 . A A . 28 LYS O 1 1 2 922 1 1 29 CYS C C -4.820 -1.980 3.852 1.00 . A A . 29 CYS C 1 1 2 923 1 1 29 CYS CA C -5.677 -0.800 4.284 1.00 . A A . 29 CYS CA 1 1 2 924 1 1 29 CYS CB C -4.858 0.127 5.165 1.00 . A A . 29 CYS CB 1 1 2 925 1 1 29 CYS H H -6.932 -1.094 5.955 1.00 . A A . 29 CYS H 1 1 2 926 1 1 29 CYS HA H -5.990 -0.259 3.421 1.00 . A A . 29 CYS HA 1 1 2 927 1 1 29 CYS HB2 H -5.526 0.733 5.748 1.00 . A A . 29 CYS HB2 1 1 2 928 1 1 29 CYS HB3 H -4.258 -0.472 5.818 1.00 . A A . 29 CYS HB3 1 1 2 929 1 1 29 CYS N N -6.867 -1.245 4.992 1.00 . A A . 29 CYS N 1 1 2 930 1 1 29 CYS O O -4.980 -3.093 4.354 1.00 . A A . 29 CYS O 1 1 2 931 1 1 29 CYS SG S -3.744 1.248 4.261 1.00 . A A . 29 CYS SG 1 1 2 932 1 1 30 LYS C C -2.248 -2.289 1.197 1.00 . A A . 30 LYS C 1 1 2 933 1 1 30 LYS CA C -3.005 -2.764 2.428 1.00 . A A . 30 LYS CA 1 1 2 934 1 1 30 LYS CB C -3.778 -4.046 2.103 1.00 . A A . 30 LYS CB 1 1 2 935 1 1 30 LYS CD C -2.463 -6.073 2.792 1.00 . A A . 30 LYS CD 1 1 2 936 1 1 30 LYS CE C -2.426 -7.282 3.712 1.00 . A A . 30 LYS CE 1 1 2 937 1 1 30 LYS CG C -3.609 -5.139 3.146 1.00 . A A . 30 LYS CG 1 1 2 938 1 1 30 LYS H H -3.818 -0.818 2.571 1.00 . A A . 30 LYS H 1 1 2 939 1 1 30 LYS HA H -2.285 -2.973 3.204 1.00 . A A . 30 LYS HA 1 1 2 940 1 1 30 LYS HB2 H -4.830 -3.810 2.030 1.00 . A A . 30 LYS HB2 1 1 2 941 1 1 30 LYS HB3 H -3.438 -4.431 1.152 1.00 . A A . 30 LYS HB3 1 1 2 942 1 1 30 LYS HD2 H -2.588 -6.412 1.775 1.00 . A A . 30 LYS HD2 1 1 2 943 1 1 30 LYS HD3 H -1.531 -5.535 2.883 1.00 . A A . 30 LYS HD3 1 1 2 944 1 1 30 LYS HE2 H -1.397 -7.523 3.929 1.00 . A A . 30 LYS HE2 1 1 2 945 1 1 30 LYS HE3 H -2.938 -7.036 4.631 1.00 . A A . 30 LYS HE3 1 1 2 946 1 1 30 LYS HG2 H -3.404 -4.681 4.103 1.00 . A A . 30 LYS HG2 1 1 2 947 1 1 30 LYS HG3 H -4.523 -5.711 3.206 1.00 . A A . 30 LYS HG3 1 1 2 948 1 1 30 LYS HZ1 H -2.896 -8.489 2.073 1.00 . A A . 30 LYS HZ1 1 1 2 949 1 1 30 LYS HZ2 H -4.108 -8.432 3.252 1.00 . A A . 30 LYS HZ2 1 1 2 950 1 1 30 LYS HZ3 H -2.709 -9.344 3.521 1.00 . A A . 30 LYS HZ3 1 1 2 951 1 1 30 LYS N N -3.900 -1.727 2.924 1.00 . A A . 30 LYS N 1 1 2 952 1 1 30 LYS NZ N -3.081 -8.469 3.097 1.00 . A A . 30 LYS NZ 1 1 2 953 1 1 30 LYS O O -2.640 -2.568 0.073 1.00 . A A . 30 LYS O 1 1 2 954 1 1 31 CYS C C -0.161 -2.003 -0.804 1.00 . A A . 31 CYS C 1 1 2 955 1 1 31 CYS CA C -0.290 -1.052 0.372 1.00 . A A . 31 CYS CA 1 1 2 956 1 1 31 CYS CB C 1.100 -0.730 0.932 1.00 . A A . 31 CYS CB 1 1 2 957 1 1 31 CYS H H -0.913 -1.409 2.372 1.00 . A A . 31 CYS H 1 1 2 958 1 1 31 CYS HA H -0.716 -0.139 -0.009 1.00 . A A . 31 CYS HA 1 1 2 959 1 1 31 CYS HB2 H 1.820 -0.762 0.129 1.00 . A A . 31 CYS HB2 1 1 2 960 1 1 31 CYS HB3 H 1.082 0.264 1.351 1.00 . A A . 31 CYS HB3 1 1 2 961 1 1 31 CYS N N -1.155 -1.580 1.438 1.00 . A A . 31 CYS N 1 1 2 962 1 1 31 CYS O O -0.648 -3.131 -0.792 1.00 . A A . 31 CYS O 1 1 2 963 1 1 31 CYS SG S 1.675 -1.871 2.235 1.00 . A A . 31 CYS SG 1 1 2 964 1 1 32 ASN C C 1.891 -3.152 -2.979 1.00 . A A . 32 ASN C 1 1 2 965 1 1 32 ASN CA C 0.676 -2.237 -3.068 1.00 . A A . 32 ASN CA 1 1 2 966 1 1 32 ASN CB C 0.877 -1.255 -4.202 1.00 . A A . 32 ASN CB 1 1 2 967 1 1 32 ASN CG C 0.440 -1.802 -5.547 1.00 . A A . 32 ASN CG 1 1 2 968 1 1 32 ASN H H 0.782 -0.570 -1.778 1.00 . A A . 32 ASN H 1 1 2 969 1 1 32 ASN HA H -0.196 -2.826 -3.268 1.00 . A A . 32 ASN HA 1 1 2 970 1 1 32 ASN HB2 H 0.317 -0.369 -3.994 1.00 . A A . 32 ASN HB2 1 1 2 971 1 1 32 ASN HB3 H 1.917 -1.009 -4.251 1.00 . A A . 32 ASN HB3 1 1 2 972 1 1 32 ASN HD21 H 2.329 -1.878 -6.160 1.00 . A A . 32 ASN HD21 1 1 2 973 1 1 32 ASN HD22 H 1.147 -2.408 -7.304 1.00 . A A . 32 ASN HD22 1 1 2 974 1 1 32 ASN N N 0.469 -1.497 -1.837 1.00 . A A . 32 ASN N 1 1 2 975 1 1 32 ASN ND2 N 1.402 -2.054 -6.425 1.00 . A A . 32 ASN ND2 1 1 2 976 1 1 32 ASN O O 2.599 -3.179 -1.973 1.00 . A A . 32 ASN O 1 1 2 977 1 1 32 ASN OD1 O -0.752 -1.994 -5.794 1.00 . A A . 32 ASN OD1 1 1 2 978 1 1 33 ARG C C 4.010 -4.532 -5.458 1.00 . A A . 33 ARG C 1 1 2 979 1 1 33 ARG CA C 3.264 -4.785 -4.158 1.00 . A A . 33 ARG CA 1 1 2 980 1 1 33 ARG CB C 2.803 -6.241 -4.083 1.00 . A A . 33 ARG CB 1 1 2 981 1 1 33 ARG CD C 4.083 -6.786 -1.990 1.00 . A A . 33 ARG CD 1 1 2 982 1 1 33 ARG CG C 2.720 -6.782 -2.664 1.00 . A A . 33 ARG CG 1 1 2 983 1 1 33 ARG CZ C 4.332 -9.076 -1.114 1.00 . A A . 33 ARG CZ 1 1 2 984 1 1 33 ARG H H 1.528 -3.787 -4.829 1.00 . A A . 33 ARG H 1 1 2 985 1 1 33 ARG HA H 3.930 -4.576 -3.333 1.00 . A A . 33 ARG HA 1 1 2 986 1 1 33 ARG HB2 H 1.825 -6.321 -4.533 1.00 . A A . 33 ARG HB2 1 1 2 987 1 1 33 ARG HB3 H 3.496 -6.857 -4.639 1.00 . A A . 33 ARG HB3 1 1 2 988 1 1 33 ARG HD2 H 4.835 -7.016 -2.729 1.00 . A A . 33 ARG HD2 1 1 2 989 1 1 33 ARG HD3 H 4.270 -5.805 -1.581 1.00 . A A . 33 ARG HD3 1 1 2 990 1 1 33 ARG HE H 4.073 -7.444 0.006 1.00 . A A . 33 ARG HE 1 1 2 991 1 1 33 ARG HG2 H 2.048 -6.160 -2.092 1.00 . A A . 33 ARG HG2 1 1 2 992 1 1 33 ARG HG3 H 2.340 -7.792 -2.696 1.00 . A A . 33 ARG HG3 1 1 2 993 1 1 33 ARG HH11 H 4.408 -8.937 -3.131 1.00 . A A . 33 ARG HH11 1 1 2 994 1 1 33 ARG HH12 H 4.582 -10.537 -2.489 1.00 . A A . 33 ARG HH12 1 1 2 995 1 1 33 ARG HH21 H 4.301 -9.547 0.851 1.00 . A A . 33 ARG HH21 1 1 2 996 1 1 33 ARG HH22 H 4.521 -10.883 -0.230 1.00 . A A . 33 ARG HH22 1 1 2 997 1 1 33 ARG N N 2.128 -3.878 -4.062 1.00 . A A . 33 ARG N 1 1 2 998 1 1 33 ARG NE N 4.157 -7.772 -0.914 1.00 . A A . 33 ARG NE 1 1 2 999 1 1 33 ARG NH1 N 4.450 -9.556 -2.346 1.00 . A A . 33 ARG NH1 1 1 2 1000 1 1 33 ARG NH2 N 4.389 -9.903 -0.079 1.00 . A A . 33 ARG NH2 1 1 2 1001 1 1 33 ARG O O 3.736 -5.157 -6.483 1.00 . A A . 33 ARG O 1 1 2 1002 1 1 34 CYS C C 6.910 -4.152 -6.769 1.00 . A A . 34 CYS C 1 1 2 1003 1 1 34 CYS CA C 5.725 -3.213 -6.565 1.00 . A A . 34 CYS CA 1 1 2 1004 1 1 34 CYS CB C 6.198 -1.785 -6.389 1.00 . A A . 34 CYS CB 1 1 2 1005 1 1 34 CYS H H 5.099 -3.123 -4.562 1.00 . A A . 34 CYS H 1 1 2 1006 1 1 34 CYS HA H 5.091 -3.254 -7.424 1.00 . A A . 34 CYS HA 1 1 2 1007 1 1 34 CYS HB2 H 5.743 -1.387 -5.504 1.00 . A A . 34 CYS HB2 1 1 2 1008 1 1 34 CYS HB3 H 7.260 -1.787 -6.269 1.00 . A A . 34 CYS HB3 1 1 2 1009 1 1 34 CYS N N 4.941 -3.591 -5.406 1.00 . A A . 34 CYS N 1 1 2 1010 1 1 34 CYS O O 6.789 -5.088 -7.586 1.00 . A A . 34 CYS O 1 1 2 1011 1 1 34 CYS OXT O 7.950 -3.941 -6.109 1.00 . A A . 34 CYS OXT 1 1 2 1012 1 1 34 CYS SG S 5.776 -0.670 -7.767 1.00 . A A . 34 CYS SG 1 1 3 1013 1 1 1 VAL C C -9.372 1.346 -4.602 1.00 . A A . 1 VAL C 1 1 3 1014 1 1 1 VAL CA C -10.811 0.866 -4.748 1.00 . A A . 1 VAL CA 1 1 3 1015 1 1 1 VAL CB C -11.121 -0.133 -3.618 1.00 . A A . 1 VAL CB 1 1 3 1016 1 1 1 VAL CG1 C -12.623 -0.291 -3.441 1.00 . A A . 1 VAL CG1 1 1 3 1017 1 1 1 VAL CG2 C -10.466 -1.477 -3.899 1.00 . A A . 1 VAL CG2 1 1 3 1018 1 1 1 VAL H1 H -11.004 1.021 -6.790 1.00 . A A . 1 VAL H1 1 1 3 1019 1 1 1 VAL H2 H -11.975 -0.197 -6.068 1.00 . A A . 1 VAL H2 1 1 3 1020 1 1 1 VAL H3 H -10.285 -0.437 -6.248 1.00 . A A . 1 VAL H3 1 1 3 1021 1 1 1 VAL HA H -11.474 1.715 -4.643 1.00 . A A . 1 VAL HA 1 1 3 1022 1 1 1 VAL HB H -10.712 0.257 -2.697 1.00 . A A . 1 VAL HB 1 1 3 1023 1 1 1 VAL HG11 H -13.121 0.609 -3.769 1.00 . A A . 1 VAL HG11 1 1 3 1024 1 1 1 VAL HG12 H -12.846 -0.465 -2.398 1.00 . A A . 1 VAL HG12 1 1 3 1025 1 1 1 VAL HG13 H -12.969 -1.129 -4.027 1.00 . A A . 1 VAL HG13 1 1 3 1026 1 1 1 VAL HG21 H -10.784 -2.195 -3.158 1.00 . A A . 1 VAL HG21 1 1 3 1027 1 1 1 VAL HG22 H -9.392 -1.369 -3.858 1.00 . A A . 1 VAL HG22 1 1 3 1028 1 1 1 VAL HG23 H -10.756 -1.820 -4.881 1.00 . A A . 1 VAL HG23 1 1 3 1029 1 1 1 VAL N N -11.039 0.258 -6.084 1.00 . A A . 1 VAL N 1 1 3 1030 1 1 1 VAL O O -8.436 0.674 -5.033 1.00 . A A . 1 VAL O 1 1 3 1031 1 1 2 SER C C -7.959 4.387 -2.997 1.00 . A A . 2 SER C 1 1 3 1032 1 1 2 SER CA C -7.875 3.084 -3.785 1.00 . A A . 2 SER CA 1 1 3 1033 1 1 2 SER CB C -7.191 3.331 -5.129 1.00 . A A . 2 SER CB 1 1 3 1034 1 1 2 SER H H -9.987 3.002 -3.666 1.00 . A A . 2 SER H 1 1 3 1035 1 1 2 SER HA H -7.292 2.372 -3.219 1.00 . A A . 2 SER HA 1 1 3 1036 1 1 2 SER HB2 H -6.297 3.918 -4.974 1.00 . A A . 2 SER HB2 1 1 3 1037 1 1 2 SER HB3 H -6.924 2.383 -5.575 1.00 . A A . 2 SER HB3 1 1 3 1038 1 1 2 SER HG H -7.519 4.526 -6.646 1.00 . A A . 2 SER HG 1 1 3 1039 1 1 2 SER N N -9.202 2.513 -3.988 1.00 . A A . 2 SER N 1 1 3 1040 1 1 2 SER O O -8.857 5.199 -3.214 1.00 . A A . 2 SER O 1 1 3 1041 1 1 2 SER OG O -8.046 4.027 -6.018 1.00 . A A . 2 SER OG 1 1 3 1042 1 1 3 CYS C C -6.353 6.943 -2.028 1.00 . A A . 3 CYS C 1 1 3 1043 1 1 3 CYS CA C -6.981 5.785 -1.260 1.00 . A A . 3 CYS CA 1 1 3 1044 1 1 3 CYS CB C -6.198 5.537 0.033 1.00 . A A . 3 CYS CB 1 1 3 1045 1 1 3 CYS H H -6.324 3.895 -1.955 1.00 . A A . 3 CYS H 1 1 3 1046 1 1 3 CYS HA H -7.999 6.044 -1.011 1.00 . A A . 3 CYS HA 1 1 3 1047 1 1 3 CYS HB2 H -5.147 5.693 -0.156 1.00 . A A . 3 CYS HB2 1 1 3 1048 1 1 3 CYS HB3 H -6.529 6.241 0.784 1.00 . A A . 3 CYS HB3 1 1 3 1049 1 1 3 CYS N N -7.015 4.579 -2.081 1.00 . A A . 3 CYS N 1 1 3 1050 1 1 3 CYS O O -5.829 6.762 -3.127 1.00 . A A . 3 CYS O 1 1 3 1051 1 1 3 CYS SG S -6.390 3.860 0.724 1.00 . A A . 3 CYS SG 1 1 3 1052 1 1 4 THR C C -5.322 10.294 -1.014 1.00 . A A . 4 THR C 1 1 3 1053 1 1 4 THR CA C -5.843 9.323 -2.068 1.00 . A A . 4 THR CA 1 1 3 1054 1 1 4 THR CB C -6.891 10.011 -2.942 1.00 . A A . 4 THR CB 1 1 3 1055 1 1 4 THR CG2 C -6.288 10.856 -4.043 1.00 . A A . 4 THR CG2 1 1 3 1056 1 1 4 THR H H -6.838 8.215 -0.564 1.00 . A A . 4 THR H 1 1 3 1057 1 1 4 THR HA H -5.017 9.009 -2.689 1.00 . A A . 4 THR HA 1 1 3 1058 1 1 4 THR HB H -7.494 10.659 -2.322 1.00 . A A . 4 THR HB 1 1 3 1059 1 1 4 THR HG1 H -7.215 8.340 -3.910 1.00 . A A . 4 THR HG1 1 1 3 1060 1 1 4 THR HG21 H -5.240 10.614 -4.152 1.00 . A A . 4 THR HG21 1 1 3 1061 1 1 4 THR HG22 H -6.391 11.902 -3.794 1.00 . A A . 4 THR HG22 1 1 3 1062 1 1 4 THR HG23 H -6.800 10.655 -4.973 1.00 . A A . 4 THR HG23 1 1 3 1063 1 1 4 THR N N -6.407 8.133 -1.440 1.00 . A A . 4 THR N 1 1 3 1064 1 1 4 THR O O -5.487 11.508 -1.136 1.00 . A A . 4 THR O 1 1 3 1065 1 1 4 THR OG1 O -7.743 9.057 -3.550 1.00 . A A . 4 THR OG1 1 1 3 1066 1 1 5 GLY C C -4.263 9.915 2.444 1.00 . A A . 5 GLY C 1 1 3 1067 1 1 5 GLY CA C -4.157 10.578 1.086 1.00 . A A . 5 GLY CA 1 1 3 1068 1 1 5 GLY H H -4.593 8.776 0.067 1.00 . A A . 5 GLY H 1 1 3 1069 1 1 5 GLY HA2 H -3.117 10.785 0.878 1.00 . A A . 5 GLY HA2 1 1 3 1070 1 1 5 GLY HA3 H -4.701 11.511 1.109 1.00 . A A . 5 GLY HA3 1 1 3 1071 1 1 5 GLY N N -4.693 9.750 0.023 1.00 . A A . 5 GLY N 1 1 3 1072 1 1 5 GLY O O -3.251 9.594 3.066 1.00 . A A . 5 GLY O 1 1 3 1073 1 1 6 SER C C -5.026 9.833 5.315 1.00 . A A . 6 SER C 1 1 3 1074 1 1 6 SER CA C -5.732 9.072 4.196 1.00 . A A . 6 SER CA 1 1 3 1075 1 1 6 SER CB C -5.254 7.620 4.171 1.00 . A A . 6 SER CB 1 1 3 1076 1 1 6 SER H H -6.260 9.982 2.359 1.00 . A A . 6 SER H 1 1 3 1077 1 1 6 SER HA H -6.795 9.090 4.382 1.00 . A A . 6 SER HA 1 1 3 1078 1 1 6 SER HB2 H -4.207 7.582 4.430 1.00 . A A . 6 SER HB2 1 1 3 1079 1 1 6 SER HB3 H -5.822 7.044 4.888 1.00 . A A . 6 SER HB3 1 1 3 1080 1 1 6 SER HG H -5.671 6.123 2.977 1.00 . A A . 6 SER HG 1 1 3 1081 1 1 6 SER N N -5.494 9.705 2.903 1.00 . A A . 6 SER N 1 1 3 1082 1 1 6 SER O O -4.537 10.945 5.111 1.00 . A A . 6 SER O 1 1 3 1083 1 1 6 SER OG O -5.426 7.048 2.886 1.00 . A A . 6 SER OG 1 1 3 1084 1 1 7 LYS C C -2.811 9.781 7.517 1.00 . A A . 7 LYS C 1 1 3 1085 1 1 7 LYS CA C -4.329 9.847 7.646 1.00 . A A . 7 LYS CA 1 1 3 1086 1 1 7 LYS CB C -4.773 9.161 8.939 1.00 . A A . 7 LYS CB 1 1 3 1087 1 1 7 LYS CD C -7.271 9.022 9.176 1.00 . A A . 7 LYS CD 1 1 3 1088 1 1 7 LYS CE C -7.674 9.309 7.739 1.00 . A A . 7 LYS CE 1 1 3 1089 1 1 7 LYS CG C -6.012 9.781 9.563 1.00 . A A . 7 LYS CG 1 1 3 1090 1 1 7 LYS H H -5.383 8.342 6.597 1.00 . A A . 7 LYS H 1 1 3 1091 1 1 7 LYS HA H -4.630 10.883 7.677 1.00 . A A . 7 LYS HA 1 1 3 1092 1 1 7 LYS HB2 H -4.984 8.123 8.728 1.00 . A A . 7 LYS HB2 1 1 3 1093 1 1 7 LYS HB3 H -3.968 9.216 9.657 1.00 . A A . 7 LYS HB3 1 1 3 1094 1 1 7 LYS HD2 H -7.089 7.963 9.283 1.00 . A A . 7 LYS HD2 1 1 3 1095 1 1 7 LYS HD3 H -8.075 9.320 9.833 1.00 . A A . 7 LYS HD3 1 1 3 1096 1 1 7 LYS HE2 H -7.228 10.244 7.432 1.00 . A A . 7 LYS HE2 1 1 3 1097 1 1 7 LYS HE3 H -7.307 8.512 7.109 1.00 . A A . 7 LYS HE3 1 1 3 1098 1 1 7 LYS HG2 H -5.909 9.763 10.637 1.00 . A A . 7 LYS HG2 1 1 3 1099 1 1 7 LYS HG3 H -6.100 10.803 9.224 1.00 . A A . 7 LYS HG3 1 1 3 1100 1 1 7 LYS HZ1 H -9.621 8.706 8.196 1.00 . A A . 7 LYS HZ1 1 1 3 1101 1 1 7 LYS HZ2 H -9.423 9.224 6.598 1.00 . A A . 7 LYS HZ2 1 1 3 1102 1 1 7 LYS HZ3 H -9.478 10.357 7.852 1.00 . A A . 7 LYS HZ3 1 1 3 1103 1 1 7 LYS N N -4.976 9.227 6.496 1.00 . A A . 7 LYS N 1 1 3 1104 1 1 7 LYS NZ N -9.152 9.406 7.585 1.00 . A A . 7 LYS NZ 1 1 3 1105 1 1 7 LYS O O -2.121 10.789 7.660 1.00 . A A . 7 LYS O 1 1 3 1106 1 1 8 ASP C C -0.540 6.928 6.781 1.00 . A A . 8 ASP C 1 1 3 1107 1 1 8 ASP CA C -0.859 8.386 7.096 1.00 . A A . 8 ASP CA 1 1 3 1108 1 1 8 ASP CB C -0.131 8.814 8.370 1.00 . A A . 8 ASP CB 1 1 3 1109 1 1 8 ASP CG C 1.169 9.539 8.078 1.00 . A A . 8 ASP CG 1 1 3 1110 1 1 8 ASP H H -2.898 7.818 7.141 1.00 . A A . 8 ASP H 1 1 3 1111 1 1 8 ASP HA H -0.521 9.001 6.275 1.00 . A A . 8 ASP HA 1 1 3 1112 1 1 8 ASP HB2 H -0.770 9.473 8.935 1.00 . A A . 8 ASP HB2 1 1 3 1113 1 1 8 ASP HB3 H 0.090 7.938 8.959 1.00 . A A . 8 ASP HB3 1 1 3 1114 1 1 8 ASP N N -2.296 8.585 7.244 1.00 . A A . 8 ASP N 1 1 3 1115 1 1 8 ASP O O 0.259 6.292 7.466 1.00 . A A . 8 ASP O 1 1 3 1116 1 1 8 ASP OD1 O 1.111 10.687 7.589 1.00 . A A . 8 ASP OD1 1 1 3 1117 1 1 8 ASP OD2 O 2.243 8.959 8.339 1.00 . A A . 8 ASP OD2 1 1 3 1118 1 1 9 CYS C C -0.121 4.941 4.073 1.00 . A A . 9 CYS C 1 1 3 1119 1 1 9 CYS CA C -0.964 5.021 5.331 1.00 . A A . 9 CYS CA 1 1 3 1120 1 1 9 CYS CB C -2.292 4.330 5.086 1.00 . A A . 9 CYS CB 1 1 3 1121 1 1 9 CYS H H -1.801 6.964 5.236 1.00 . A A . 9 CYS H 1 1 3 1122 1 1 9 CYS HA H -0.457 4.516 6.120 1.00 . A A . 9 CYS HA 1 1 3 1123 1 1 9 CYS HB2 H -3.041 4.800 5.692 1.00 . A A . 9 CYS HB2 1 1 3 1124 1 1 9 CYS HB3 H -2.550 4.440 4.052 1.00 . A A . 9 CYS HB3 1 1 3 1125 1 1 9 CYS N N -1.175 6.405 5.740 1.00 . A A . 9 CYS N 1 1 3 1126 1 1 9 CYS O O 0.974 4.379 4.075 1.00 . A A . 9 CYS O 1 1 3 1127 1 1 9 CYS SG S -2.287 2.549 5.474 1.00 . A A . 9 CYS SG 1 1 3 1128 1 1 10 TYR C C 1.504 5.896 1.882 1.00 . A A . 10 TYR C 1 1 3 1129 1 1 10 TYR CA C 0.038 5.512 1.714 1.00 . A A . 10 TYR CA 1 1 3 1130 1 1 10 TYR CB C -0.650 6.485 0.752 1.00 . A A . 10 TYR CB 1 1 3 1131 1 1 10 TYR CD1 C -1.751 4.587 -0.498 1.00 . A A . 10 TYR CD1 1 1 3 1132 1 1 10 TYR CD2 C -1.018 6.481 -1.745 1.00 . A A . 10 TYR CD2 1 1 3 1133 1 1 10 TYR CE1 C -2.207 3.993 -1.659 1.00 . A A . 10 TYR CE1 1 1 3 1134 1 1 10 TYR CE2 C -1.473 5.895 -2.910 1.00 . A A . 10 TYR CE2 1 1 3 1135 1 1 10 TYR CG C -1.149 5.838 -0.520 1.00 . A A . 10 TYR CG 1 1 3 1136 1 1 10 TYR CZ C -2.066 4.652 -2.862 1.00 . A A . 10 TYR CZ 1 1 3 1137 1 1 10 TYR H H -1.526 5.935 3.074 1.00 . A A . 10 TYR H 1 1 3 1138 1 1 10 TYR HA H -0.018 4.514 1.303 1.00 . A A . 10 TYR HA 1 1 3 1139 1 1 10 TYR HB2 H -1.500 6.929 1.251 1.00 . A A . 10 TYR HB2 1 1 3 1140 1 1 10 TYR HB3 H 0.046 7.265 0.479 1.00 . A A . 10 TYR HB3 1 1 3 1141 1 1 10 TYR HD1 H -1.860 4.074 0.447 1.00 . A A . 10 TYR HD1 1 1 3 1142 1 1 10 TYR HD2 H -0.552 7.455 -1.779 1.00 . A A . 10 TYR HD2 1 1 3 1143 1 1 10 TYR HE1 H -2.672 3.020 -1.620 1.00 . A A . 10 TYR HE1 1 1 3 1144 1 1 10 TYR HE2 H -1.362 6.411 -3.853 1.00 . A A . 10 TYR HE2 1 1 3 1145 1 1 10 TYR HH H -3.375 3.657 -3.860 1.00 . A A . 10 TYR HH 1 1 3 1146 1 1 10 TYR N N -0.648 5.507 2.998 1.00 . A A . 10 TYR N 1 1 3 1147 1 1 10 TYR O O 2.358 5.473 1.109 1.00 . A A . 10 TYR O 1 1 3 1148 1 1 10 TYR OH O -2.520 4.064 -4.021 1.00 . A A . 10 TYR OH 1 1 3 1149 1 1 11 ALA C C 4.026 6.020 3.699 1.00 . A A . 11 ALA C 1 1 3 1150 1 1 11 ALA CA C 3.148 7.150 3.161 1.00 . A A . 11 ALA CA 1 1 3 1151 1 1 11 ALA CB C 3.149 8.338 4.112 1.00 . A A . 11 ALA CB 1 1 3 1152 1 1 11 ALA H H 1.053 7.009 3.481 1.00 . A A . 11 ALA H 1 1 3 1153 1 1 11 ALA HA H 3.566 7.476 2.220 1.00 . A A . 11 ALA HA 1 1 3 1154 1 1 11 ALA HB1 H 2.269 8.301 4.737 1.00 . A A . 11 ALA HB1 1 1 3 1155 1 1 11 ALA HB2 H 3.147 9.256 3.543 1.00 . A A . 11 ALA HB2 1 1 3 1156 1 1 11 ALA HB3 H 4.033 8.303 4.732 1.00 . A A . 11 ALA HB3 1 1 3 1157 1 1 11 ALA N N 1.783 6.706 2.896 1.00 . A A . 11 ALA N 1 1 3 1158 1 1 11 ALA O O 4.931 5.551 3.009 1.00 . A A . 11 ALA O 1 1 3 1159 1 1 12 PRO C C 4.615 3.250 4.675 1.00 . A A . 12 PRO C 1 1 3 1160 1 1 12 PRO CA C 4.558 4.490 5.556 1.00 . A A . 12 PRO CA 1 1 3 1161 1 1 12 PRO CB C 3.814 4.187 6.867 1.00 . A A . 12 PRO CB 1 1 3 1162 1 1 12 PRO CD C 2.722 6.053 5.843 1.00 . A A . 12 PRO CD 1 1 3 1163 1 1 12 PRO CG C 2.497 4.879 6.750 1.00 . A A . 12 PRO CG 1 1 3 1164 1 1 12 PRO HA H 5.565 4.815 5.779 1.00 . A A . 12 PRO HA 1 1 3 1165 1 1 12 PRO HB2 H 3.689 3.119 6.971 1.00 . A A . 12 PRO HB2 1 1 3 1166 1 1 12 PRO HB3 H 4.384 4.567 7.701 1.00 . A A . 12 PRO HB3 1 1 3 1167 1 1 12 PRO HD2 H 1.822 6.289 5.295 1.00 . A A . 12 PRO HD2 1 1 3 1168 1 1 12 PRO HD3 H 3.061 6.909 6.407 1.00 . A A . 12 PRO HD3 1 1 3 1169 1 1 12 PRO HG2 H 1.767 4.209 6.321 1.00 . A A . 12 PRO HG2 1 1 3 1170 1 1 12 PRO HG3 H 2.172 5.214 7.724 1.00 . A A . 12 PRO HG3 1 1 3 1171 1 1 12 PRO N N 3.776 5.566 4.943 1.00 . A A . 12 PRO N 1 1 3 1172 1 1 12 PRO O O 5.524 2.429 4.798 1.00 . A A . 12 PRO O 1 1 3 1173 1 1 13 CYS C C 4.323 2.272 1.583 1.00 . A A . 13 CYS C 1 1 3 1174 1 1 13 CYS CA C 3.579 1.986 2.880 1.00 . A A . 13 CYS CA 1 1 3 1175 1 1 13 CYS CB C 2.134 1.623 2.589 1.00 . A A . 13 CYS CB 1 1 3 1176 1 1 13 CYS H H 2.943 3.809 3.733 1.00 . A A . 13 CYS H 1 1 3 1177 1 1 13 CYS HA H 4.043 1.155 3.364 1.00 . A A . 13 CYS HA 1 1 3 1178 1 1 13 CYS HB2 H 1.498 2.318 3.104 1.00 . A A . 13 CYS HB2 1 1 3 1179 1 1 13 CYS HB3 H 1.965 1.700 1.534 1.00 . A A . 13 CYS HB3 1 1 3 1180 1 1 13 CYS N N 3.639 3.122 3.784 1.00 . A A . 13 CYS N 1 1 3 1181 1 1 13 CYS O O 5.122 1.456 1.131 1.00 . A A . 13 CYS O 1 1 3 1182 1 1 13 CYS SG S 1.654 -0.056 3.115 1.00 . A A . 13 CYS SG 1 1 3 1183 1 1 14 ARG C C 6.224 3.640 -0.137 1.00 . A A . 14 ARG C 1 1 3 1184 1 1 14 ARG CA C 4.718 3.799 -0.265 1.00 . A A . 14 ARG CA 1 1 3 1185 1 1 14 ARG CB C 4.364 5.231 -0.671 1.00 . A A . 14 ARG CB 1 1 3 1186 1 1 14 ARG CD C 5.420 7.193 -1.834 1.00 . A A . 14 ARG CD 1 1 3 1187 1 1 14 ARG CG C 5.081 5.714 -1.923 1.00 . A A . 14 ARG CG 1 1 3 1188 1 1 14 ARG CZ C 3.571 8.334 -2.998 1.00 . A A . 14 ARG CZ 1 1 3 1189 1 1 14 ARG H H 3.418 4.050 1.379 1.00 . A A . 14 ARG H 1 1 3 1190 1 1 14 ARG HA H 4.365 3.120 -1.020 1.00 . A A . 14 ARG HA 1 1 3 1191 1 1 14 ARG HB2 H 3.301 5.285 -0.852 1.00 . A A . 14 ARG HB2 1 1 3 1192 1 1 14 ARG HB3 H 4.615 5.896 0.142 1.00 . A A . 14 ARG HB3 1 1 3 1193 1 1 14 ARG HD2 H 5.942 7.376 -0.906 1.00 . A A . 14 ARG HD2 1 1 3 1194 1 1 14 ARG HD3 H 6.061 7.453 -2.664 1.00 . A A . 14 ARG HD3 1 1 3 1195 1 1 14 ARG HE H 3.891 8.389 -1.028 1.00 . A A . 14 ARG HE 1 1 3 1196 1 1 14 ARG HG2 H 5.996 5.153 -2.043 1.00 . A A . 14 ARG HG2 1 1 3 1197 1 1 14 ARG HG3 H 4.442 5.550 -2.777 1.00 . A A . 14 ARG HG3 1 1 3 1198 1 1 14 ARG HH11 H 4.805 7.288 -4.210 1.00 . A A . 14 ARG HH11 1 1 3 1199 1 1 14 ARG HH12 H 3.497 8.099 -5.003 1.00 . A A . 14 ARG HH12 1 1 3 1200 1 1 14 ARG HH21 H 2.170 9.457 -2.069 1.00 . A A . 14 ARG HH21 1 1 3 1201 1 1 14 ARG HH22 H 2.001 9.331 -3.789 1.00 . A A . 14 ARG HH22 1 1 3 1202 1 1 14 ARG N N 4.061 3.433 0.981 1.00 . A A . 14 ARG N 1 1 3 1203 1 1 14 ARG NE N 4.224 8.032 -1.877 1.00 . A A . 14 ARG NE 1 1 3 1204 1 1 14 ARG NH1 N 3.993 7.869 -4.166 1.00 . A A . 14 ARG NH1 1 1 3 1205 1 1 14 ARG NH2 N 2.492 9.104 -2.947 1.00 . A A . 14 ARG NH2 1 1 3 1206 1 1 14 ARG O O 6.904 3.270 -1.092 1.00 . A A . 14 ARG O 1 1 3 1207 1 1 15 LYS C C 8.567 2.304 1.092 1.00 . A A . 15 LYS C 1 1 3 1208 1 1 15 LYS CA C 8.162 3.756 1.306 1.00 . A A . 15 LYS CA 1 1 3 1209 1 1 15 LYS CB C 8.501 4.195 2.731 1.00 . A A . 15 LYS CB 1 1 3 1210 1 1 15 LYS CD C 8.353 6.683 3.047 1.00 . A A . 15 LYS CD 1 1 3 1211 1 1 15 LYS CE C 9.127 7.906 3.513 1.00 . A A . 15 LYS CE 1 1 3 1212 1 1 15 LYS CG C 9.276 5.500 2.799 1.00 . A A . 15 LYS CG 1 1 3 1213 1 1 15 LYS H H 6.146 4.179 1.787 1.00 . A A . 15 LYS H 1 1 3 1214 1 1 15 LYS HA H 8.694 4.380 0.602 1.00 . A A . 15 LYS HA 1 1 3 1215 1 1 15 LYS HB2 H 7.581 4.316 3.283 1.00 . A A . 15 LYS HB2 1 1 3 1216 1 1 15 LYS HB3 H 9.093 3.425 3.203 1.00 . A A . 15 LYS HB3 1 1 3 1217 1 1 15 LYS HD2 H 7.838 6.924 2.130 1.00 . A A . 15 LYS HD2 1 1 3 1218 1 1 15 LYS HD3 H 7.634 6.413 3.806 1.00 . A A . 15 LYS HD3 1 1 3 1219 1 1 15 LYS HE2 H 10.005 7.577 4.049 1.00 . A A . 15 LYS HE2 1 1 3 1220 1 1 15 LYS HE3 H 9.428 8.477 2.647 1.00 . A A . 15 LYS HE3 1 1 3 1221 1 1 15 LYS HG2 H 9.993 5.442 3.604 1.00 . A A . 15 LYS HG2 1 1 3 1222 1 1 15 LYS HG3 H 9.794 5.649 1.863 1.00 . A A . 15 LYS HG3 1 1 3 1223 1 1 15 LYS HZ1 H 7.298 8.621 4.224 1.00 . A A . 15 LYS HZ1 1 1 3 1224 1 1 15 LYS HZ2 H 8.535 9.774 4.236 1.00 . A A . 15 LYS HZ2 1 1 3 1225 1 1 15 LYS HZ3 H 8.512 8.550 5.402 1.00 . A A . 15 LYS HZ3 1 1 3 1226 1 1 15 LYS N N 6.739 3.901 1.056 1.00 . A A . 15 LYS N 1 1 3 1227 1 1 15 LYS NZ N 8.312 8.774 4.406 1.00 . A A . 15 LYS NZ 1 1 3 1228 1 1 15 LYS O O 9.568 2.010 0.438 1.00 . A A . 15 LYS O 1 1 3 1229 1 1 16 GLN C C 7.759 -0.533 0.109 1.00 . A A . 16 GLN C 1 1 3 1230 1 1 16 GLN CA C 8.018 -0.030 1.530 1.00 . A A . 16 GLN CA 1 1 3 1231 1 1 16 GLN CB C 7.144 -0.802 2.520 1.00 . A A . 16 GLN CB 1 1 3 1232 1 1 16 GLN CD C 7.097 -3.304 2.168 1.00 . A A . 16 GLN CD 1 1 3 1233 1 1 16 GLN CG C 7.725 -2.148 2.922 1.00 . A A . 16 GLN CG 1 1 3 1234 1 1 16 GLN H H 6.982 1.705 2.157 1.00 . A A . 16 GLN H 1 1 3 1235 1 1 16 GLN HA H 9.055 -0.204 1.774 1.00 . A A . 16 GLN HA 1 1 3 1236 1 1 16 GLN HB2 H 7.018 -0.208 3.412 1.00 . A A . 16 GLN HB2 1 1 3 1237 1 1 16 GLN HB3 H 6.176 -0.972 2.071 1.00 . A A . 16 GLN HB3 1 1 3 1238 1 1 16 GLN HE21 H 5.404 -3.082 3.188 1.00 . A A . 16 GLN HE21 1 1 3 1239 1 1 16 GLN HE22 H 5.414 -4.353 2.020 1.00 . A A . 16 GLN HE22 1 1 3 1240 1 1 16 GLN HG2 H 8.786 -2.143 2.721 1.00 . A A . 16 GLN HG2 1 1 3 1241 1 1 16 GLN HG3 H 7.561 -2.295 3.980 1.00 . A A . 16 GLN HG3 1 1 3 1242 1 1 16 GLN N N 7.767 1.400 1.651 1.00 . A A . 16 GLN N 1 1 3 1243 1 1 16 GLN NE2 N 5.845 -3.611 2.492 1.00 . A A . 16 GLN NE2 1 1 3 1244 1 1 16 GLN O O 8.641 -1.117 -0.519 1.00 . A A . 16 GLN O 1 1 3 1245 1 1 16 GLN OE1 O 7.728 -3.914 1.306 1.00 . A A . 16 GLN OE1 1 1 3 1246 1 1 17 THR C C 6.856 0.027 -2.814 1.00 . A A . 17 THR C 1 1 3 1247 1 1 17 THR CA C 6.165 -0.777 -1.722 1.00 . A A . 17 THR CA 1 1 3 1248 1 1 17 THR CB C 4.648 -0.705 -1.908 1.00 . A A . 17 THR CB 1 1 3 1249 1 1 17 THR CG2 C 4.099 0.705 -1.850 1.00 . A A . 17 THR CG2 1 1 3 1250 1 1 17 THR H H 5.870 0.141 0.165 1.00 . A A . 17 THR H 1 1 3 1251 1 1 17 THR HA H 6.474 -1.803 -1.812 1.00 . A A . 17 THR HA 1 1 3 1252 1 1 17 THR HB H 4.172 -1.278 -1.125 1.00 . A A . 17 THR HB 1 1 3 1253 1 1 17 THR HG1 H 3.330 -1.136 -3.292 1.00 . A A . 17 THR HG1 1 1 3 1254 1 1 17 THR HG21 H 4.397 1.169 -0.922 1.00 . A A . 17 THR HG21 1 1 3 1255 1 1 17 THR HG22 H 3.022 0.675 -1.909 1.00 . A A . 17 THR HG22 1 1 3 1256 1 1 17 THR HG23 H 4.489 1.277 -2.679 1.00 . A A . 17 THR HG23 1 1 3 1257 1 1 17 THR N N 6.538 -0.322 -0.385 1.00 . A A . 17 THR N 1 1 3 1258 1 1 17 THR O O 7.408 -0.535 -3.759 1.00 . A A . 17 THR O 1 1 3 1259 1 1 17 THR OG1 O 4.272 -1.261 -3.156 1.00 . A A . 17 THR OG1 1 1 3 1260 1 1 18 GLY C C 6.366 2.999 -4.430 1.00 . A A . 18 GLY C 1 1 3 1261 1 1 18 GLY CA C 7.400 2.207 -3.668 1.00 . A A . 18 GLY CA 1 1 3 1262 1 1 18 GLY H H 6.345 1.725 -1.930 1.00 . A A . 18 GLY H 1 1 3 1263 1 1 18 GLY HA2 H 8.075 2.885 -3.188 1.00 . A A . 18 GLY HA2 1 1 3 1264 1 1 18 GLY HA3 H 7.946 1.601 -4.354 1.00 . A A . 18 GLY HA3 1 1 3 1265 1 1 18 GLY N N 6.802 1.342 -2.687 1.00 . A A . 18 GLY N 1 1 3 1266 1 1 18 GLY O O 5.731 3.900 -3.883 1.00 . A A . 18 GLY O 1 1 3 1267 1 1 19 CYS C C 4.059 3.892 -5.879 1.00 . A A . 19 CYS C 1 1 3 1268 1 1 19 CYS CA C 5.276 3.305 -6.603 1.00 . A A . 19 CYS CA 1 1 3 1269 1 1 19 CYS CB C 4.827 2.341 -7.672 1.00 . A A . 19 CYS CB 1 1 3 1270 1 1 19 CYS H H 6.777 1.946 -6.049 1.00 . A A . 19 CYS H 1 1 3 1271 1 1 19 CYS HA H 5.802 4.085 -7.095 1.00 . A A . 19 CYS HA 1 1 3 1272 1 1 19 CYS HB2 H 3.920 2.716 -8.107 1.00 . A A . 19 CYS HB2 1 1 3 1273 1 1 19 CYS HB3 H 5.593 2.312 -8.426 1.00 . A A . 19 CYS HB3 1 1 3 1274 1 1 19 CYS N N 6.219 2.656 -5.701 1.00 . A A . 19 CYS N 1 1 3 1275 1 1 19 CYS O O 3.608 3.357 -4.866 1.00 . A A . 19 CYS O 1 1 3 1276 1 1 19 CYS SG S 4.527 0.636 -7.098 1.00 . A A . 19 CYS SG 1 1 3 1277 1 1 20 PRO C C 1.117 4.803 -5.667 1.00 . A A . 20 PRO C 1 1 3 1278 1 1 20 PRO CA C 2.356 5.692 -5.790 1.00 . A A . 20 PRO CA 1 1 3 1279 1 1 20 PRO CB C 2.075 6.850 -6.754 1.00 . A A . 20 PRO CB 1 1 3 1280 1 1 20 PRO CD C 4.003 5.721 -7.591 1.00 . A A . 20 PRO CD 1 1 3 1281 1 1 20 PRO CG C 3.358 7.071 -7.476 1.00 . A A . 20 PRO CG 1 1 3 1282 1 1 20 PRO HA H 2.600 6.091 -4.818 1.00 . A A . 20 PRO HA 1 1 3 1283 1 1 20 PRO HB2 H 1.283 6.571 -7.433 1.00 . A A . 20 PRO HB2 1 1 3 1284 1 1 20 PRO HB3 H 1.783 7.725 -6.193 1.00 . A A . 20 PRO HB3 1 1 3 1285 1 1 20 PRO HD2 H 3.676 5.223 -8.492 1.00 . A A . 20 PRO HD2 1 1 3 1286 1 1 20 PRO HD3 H 5.078 5.813 -7.576 1.00 . A A . 20 PRO HD3 1 1 3 1287 1 1 20 PRO HG2 H 3.162 7.479 -8.457 1.00 . A A . 20 PRO HG2 1 1 3 1288 1 1 20 PRO HG3 H 3.989 7.740 -6.909 1.00 . A A . 20 PRO HG3 1 1 3 1289 1 1 20 PRO N N 3.516 5.014 -6.391 1.00 . A A . 20 PRO N 1 1 3 1290 1 1 20 PRO O O 0.160 5.167 -4.983 1.00 . A A . 20 PRO O 1 1 3 1291 1 1 21 TYR C C -0.153 2.105 -4.916 1.00 . A A . 21 TYR C 1 1 3 1292 1 1 21 TYR CA C -0.004 2.748 -6.293 1.00 . A A . 21 TYR CA 1 1 3 1293 1 1 21 TYR CB C 0.168 1.670 -7.358 1.00 . A A . 21 TYR CB 1 1 3 1294 1 1 21 TYR CD1 C 0.925 3.291 -9.146 1.00 . A A . 21 TYR CD1 1 1 3 1295 1 1 21 TYR CD2 C 2.046 1.193 -8.983 1.00 . A A . 21 TYR CD2 1 1 3 1296 1 1 21 TYR CE1 C 1.738 3.647 -10.204 1.00 . A A . 21 TYR CE1 1 1 3 1297 1 1 21 TYR CE2 C 2.863 1.543 -10.041 1.00 . A A . 21 TYR CE2 1 1 3 1298 1 1 21 TYR CG C 1.064 2.059 -8.518 1.00 . A A . 21 TYR CG 1 1 3 1299 1 1 21 TYR CZ C 2.705 2.772 -10.648 1.00 . A A . 21 TYR CZ 1 1 3 1300 1 1 21 TYR H H 1.891 3.405 -6.872 1.00 . A A . 21 TYR H 1 1 3 1301 1 1 21 TYR HA H -0.895 3.316 -6.510 1.00 . A A . 21 TYR HA 1 1 3 1302 1 1 21 TYR HB2 H 0.582 0.786 -6.904 1.00 . A A . 21 TYR HB2 1 1 3 1303 1 1 21 TYR HB3 H -0.789 1.445 -7.758 1.00 . A A . 21 TYR HB3 1 1 3 1304 1 1 21 TYR HD1 H 0.167 3.975 -8.796 1.00 . A A . 21 TYR HD1 1 1 3 1305 1 1 21 TYR HD2 H 2.168 0.233 -8.505 1.00 . A A . 21 TYR HD2 1 1 3 1306 1 1 21 TYR HE1 H 1.613 4.610 -10.680 1.00 . A A . 21 TYR HE1 1 1 3 1307 1 1 21 TYR HE2 H 3.621 0.857 -10.388 1.00 . A A . 21 TYR HE2 1 1 3 1308 1 1 21 TYR HH H 4.429 2.918 -11.486 1.00 . A A . 21 TYR HH 1 1 3 1309 1 1 21 TYR N N 1.123 3.653 -6.331 1.00 . A A . 21 TYR N 1 1 3 1310 1 1 21 TYR O O 0.766 2.144 -4.097 1.00 . A A . 21 TYR O 1 1 3 1311 1 1 21 TYR OH O 3.517 3.123 -11.702 1.00 . A A . 21 TYR OH 1 1 3 1312 1 1 22 GLY C C -2.809 -0.014 -3.424 1.00 . A A . 22 GLY C 1 1 3 1313 1 1 22 GLY CA C -1.581 0.875 -3.391 1.00 . A A . 22 GLY CA 1 1 3 1314 1 1 22 GLY H H -2.014 1.522 -5.363 1.00 . A A . 22 GLY H 1 1 3 1315 1 1 22 GLY HA2 H -0.729 0.283 -3.121 1.00 . A A . 22 GLY HA2 1 1 3 1316 1 1 22 GLY HA3 H -1.725 1.638 -2.642 1.00 . A A . 22 GLY HA3 1 1 3 1317 1 1 22 GLY N N -1.320 1.517 -4.670 1.00 . A A . 22 GLY N 1 1 3 1318 1 1 22 GLY O O -3.712 0.204 -4.232 1.00 . A A . 22 GLY O 1 1 3 1319 1 1 23 LYS C C -4.877 -1.547 -1.267 1.00 . A A . 23 LYS C 1 1 3 1320 1 1 23 LYS CA C -4.013 -1.897 -2.474 1.00 . A A . 23 LYS CA 1 1 3 1321 1 1 23 LYS CB C -3.564 -3.359 -2.403 1.00 . A A . 23 LYS CB 1 1 3 1322 1 1 23 LYS CD C -4.317 -5.723 -2.796 1.00 . A A . 23 LYS CD 1 1 3 1323 1 1 23 LYS CE C -4.494 -6.714 -3.935 1.00 . A A . 23 LYS CE 1 1 3 1324 1 1 23 LYS CG C -4.373 -4.288 -3.292 1.00 . A A . 23 LYS CG 1 1 3 1325 1 1 23 LYS H H -2.133 -1.132 -1.894 1.00 . A A . 23 LYS H 1 1 3 1326 1 1 23 LYS HA H -4.589 -1.747 -3.370 1.00 . A A . 23 LYS HA 1 1 3 1327 1 1 23 LYS HB2 H -2.528 -3.420 -2.702 1.00 . A A . 23 LYS HB2 1 1 3 1328 1 1 23 LYS HB3 H -3.654 -3.703 -1.383 1.00 . A A . 23 LYS HB3 1 1 3 1329 1 1 23 LYS HD2 H -3.359 -5.896 -2.328 1.00 . A A . 23 LYS HD2 1 1 3 1330 1 1 23 LYS HD3 H -5.105 -5.874 -2.073 1.00 . A A . 23 LYS HD3 1 1 3 1331 1 1 23 LYS HE2 H -5.162 -6.287 -4.667 1.00 . A A . 23 LYS HE2 1 1 3 1332 1 1 23 LYS HE3 H -3.531 -6.895 -4.390 1.00 . A A . 23 LYS HE3 1 1 3 1333 1 1 23 LYS HG2 H -5.402 -3.960 -3.299 1.00 . A A . 23 LYS HG2 1 1 3 1334 1 1 23 LYS HG3 H -3.973 -4.248 -4.295 1.00 . A A . 23 LYS HG3 1 1 3 1335 1 1 23 LYS HZ1 H -6.093 -8.004 -3.560 1.00 . A A . 23 LYS HZ1 1 1 3 1336 1 1 23 LYS HZ2 H -4.815 -8.162 -2.463 1.00 . A A . 23 LYS HZ2 1 1 3 1337 1 1 23 LYS HZ3 H -4.670 -8.794 -4.026 1.00 . A A . 23 LYS HZ3 1 1 3 1338 1 1 23 LYS N N -2.863 -1.008 -2.534 1.00 . A A . 23 LYS N 1 1 3 1339 1 1 23 LYS NZ N -5.057 -8.009 -3.463 1.00 . A A . 23 LYS NZ 1 1 3 1340 1 1 23 LYS O O -5.719 -2.336 -0.836 1.00 . A A . 23 LYS O 1 1 3 1341 1 1 24 CYS C C -6.836 0.427 0.087 1.00 . A A . 24 CYS C 1 1 3 1342 1 1 24 CYS CA C -5.381 0.121 0.438 1.00 . A A . 24 CYS CA 1 1 3 1343 1 1 24 CYS CB C -4.686 1.359 1.015 1.00 . A A . 24 CYS CB 1 1 3 1344 1 1 24 CYS H H -3.960 0.222 -1.113 1.00 . A A . 24 CYS H 1 1 3 1345 1 1 24 CYS HA H -5.365 -0.662 1.179 1.00 . A A . 24 CYS HA 1 1 3 1346 1 1 24 CYS HB2 H -5.119 1.594 1.973 1.00 . A A . 24 CYS HB2 1 1 3 1347 1 1 24 CYS HB3 H -3.638 1.137 1.151 1.00 . A A . 24 CYS HB3 1 1 3 1348 1 1 24 CYS N N -4.649 -0.354 -0.724 1.00 . A A . 24 CYS N 1 1 3 1349 1 1 24 CYS O O -7.132 1.382 -0.631 1.00 . A A . 24 CYS O 1 1 3 1350 1 1 24 CYS SG S -4.798 2.850 -0.029 1.00 . A A . 24 CYS SG 1 1 3 1351 1 1 25 MET C C -9.853 0.344 1.582 1.00 . A A . 25 MET C 1 1 3 1352 1 1 25 MET CA C -9.166 -0.224 0.352 1.00 . A A . 25 MET CA 1 1 3 1353 1 1 25 MET CB C -9.806 -1.558 -0.037 1.00 . A A . 25 MET CB 1 1 3 1354 1 1 25 MET CE C -9.791 -4.693 0.201 1.00 . A A . 25 MET CE 1 1 3 1355 1 1 25 MET CG C -8.993 -2.352 -1.046 1.00 . A A . 25 MET CG 1 1 3 1356 1 1 25 MET H H -7.442 -1.141 1.164 1.00 . A A . 25 MET H 1 1 3 1357 1 1 25 MET HA H -9.285 0.476 -0.462 1.00 . A A . 25 MET HA 1 1 3 1358 1 1 25 MET HB2 H -9.923 -2.161 0.851 1.00 . A A . 25 MET HB2 1 1 3 1359 1 1 25 MET HB3 H -10.780 -1.366 -0.463 1.00 . A A . 25 MET HB3 1 1 3 1360 1 1 25 MET HE1 H -8.962 -4.333 0.791 1.00 . A A . 25 MET HE1 1 1 3 1361 1 1 25 MET HE2 H -9.728 -5.768 0.110 1.00 . A A . 25 MET HE2 1 1 3 1362 1 1 25 MET HE3 H -10.720 -4.428 0.683 1.00 . A A . 25 MET HE3 1 1 3 1363 1 1 25 MET HG2 H -8.920 -1.779 -1.960 1.00 . A A . 25 MET HG2 1 1 3 1364 1 1 25 MET HG3 H -8.004 -2.513 -0.645 1.00 . A A . 25 MET HG3 1 1 3 1365 1 1 25 MET N N -7.740 -0.397 0.601 1.00 . A A . 25 MET N 1 1 3 1366 1 1 25 MET O O -9.458 0.060 2.713 1.00 . A A . 25 MET O 1 1 3 1367 1 1 25 MET SD S -9.730 -3.951 -1.428 1.00 . A A . 25 MET SD 1 1 3 1368 1 1 26 ASN C C -11.932 0.749 3.540 1.00 . A A . 26 ASN C 1 1 3 1369 1 1 26 ASN CA C -11.626 1.772 2.453 1.00 . A A . 26 ASN CA 1 1 3 1370 1 1 26 ASN CB C -12.934 2.398 1.962 1.00 . A A . 26 ASN CB 1 1 3 1371 1 1 26 ASN CG C -12.852 2.927 0.542 1.00 . A A . 26 ASN CG 1 1 3 1372 1 1 26 ASN H H -11.137 1.341 0.428 1.00 . A A . 26 ASN H 1 1 3 1373 1 1 26 ASN HA H -11.004 2.547 2.875 1.00 . A A . 26 ASN HA 1 1 3 1374 1 1 26 ASN HB2 H -13.712 1.655 2.007 1.00 . A A . 26 ASN HB2 1 1 3 1375 1 1 26 ASN HB3 H -13.194 3.219 2.616 1.00 . A A . 26 ASN HB3 1 1 3 1376 1 1 26 ASN HD21 H -13.917 1.384 -0.121 1.00 . A A . 26 ASN HD21 1 1 3 1377 1 1 26 ASN HD22 H -13.420 2.522 -1.320 1.00 . A A . 26 ASN HD22 1 1 3 1378 1 1 26 ASN N N -10.881 1.153 1.355 1.00 . A A . 26 ASN N 1 1 3 1379 1 1 26 ASN ND2 N -13.457 2.205 -0.394 1.00 . A A . 26 ASN ND2 1 1 3 1380 1 1 26 ASN O O -12.517 -0.302 3.277 1.00 . A A . 26 ASN O 1 1 3 1381 1 1 26 ASN OD1 O -12.251 3.971 0.289 1.00 . A A . 26 ASN OD1 1 1 3 1382 1 1 27 ARG C C -10.793 -1.020 5.818 1.00 . A A . 27 ARG C 1 1 3 1383 1 1 27 ARG CA C -11.731 0.177 5.899 1.00 . A A . 27 ARG CA 1 1 3 1384 1 1 27 ARG CB C -13.187 -0.293 5.961 1.00 . A A . 27 ARG CB 1 1 3 1385 1 1 27 ARG CD C -14.224 -1.584 7.855 1.00 . A A . 27 ARG CD 1 1 3 1386 1 1 27 ARG CG C -13.788 -0.215 7.355 1.00 . A A . 27 ARG CG 1 1 3 1387 1 1 27 ARG CZ C -15.729 -2.530 9.562 1.00 . A A . 27 ARG CZ 1 1 3 1388 1 1 27 ARG H H -11.053 1.910 4.896 1.00 . A A . 27 ARG H 1 1 3 1389 1 1 27 ARG HA H -11.502 0.734 6.794 1.00 . A A . 27 ARG HA 1 1 3 1390 1 1 27 ARG HB2 H -13.781 0.322 5.301 1.00 . A A . 27 ARG HB2 1 1 3 1391 1 1 27 ARG HB3 H -13.238 -1.319 5.625 1.00 . A A . 27 ARG HB3 1 1 3 1392 1 1 27 ARG HD2 H -14.603 -2.153 7.021 1.00 . A A . 27 ARG HD2 1 1 3 1393 1 1 27 ARG HD3 H -13.367 -2.088 8.276 1.00 . A A . 27 ARG HD3 1 1 3 1394 1 1 27 ARG HE H -15.640 -0.601 9.059 1.00 . A A . 27 ARG HE 1 1 3 1395 1 1 27 ARG HG2 H -13.050 0.185 8.034 1.00 . A A . 27 ARG HG2 1 1 3 1396 1 1 27 ARG HG3 H -14.648 0.439 7.329 1.00 . A A . 27 ARG HG3 1 1 3 1397 1 1 27 ARG HH11 H -14.532 -3.886 8.656 1.00 . A A . 27 ARG HH11 1 1 3 1398 1 1 27 ARG HH12 H -15.599 -4.526 9.859 1.00 . A A . 27 ARG HH12 1 1 3 1399 1 1 27 ARG HH21 H -17.044 -1.441 10.643 1.00 . A A . 27 ARG HH21 1 1 3 1400 1 1 27 ARG HH22 H -17.026 -3.138 10.988 1.00 . A A . 27 ARG HH22 1 1 3 1401 1 1 27 ARG N N -11.521 1.063 4.760 1.00 . A A . 27 ARG N 1 1 3 1402 1 1 27 ARG NE N -15.265 -1.488 8.875 1.00 . A A . 27 ARG NE 1 1 3 1403 1 1 27 ARG NH1 N -15.247 -3.747 9.340 1.00 . A A . 27 ARG NH1 1 1 3 1404 1 1 27 ARG NH2 N -16.677 -2.355 10.472 1.00 . A A . 27 ARG NH2 1 1 3 1405 1 1 27 ARG O O -11.104 -2.105 6.310 1.00 . A A . 27 ARG O 1 1 3 1406 1 1 28 LYS C C -7.493 -1.408 4.139 1.00 . A A . 28 LYS C 1 1 3 1407 1 1 28 LYS CA C -8.641 -1.865 5.035 1.00 . A A . 28 LYS CA 1 1 3 1408 1 1 28 LYS CB C -9.283 -3.131 4.457 1.00 . A A . 28 LYS CB 1 1 3 1409 1 1 28 LYS CD C -8.442 -5.258 5.496 1.00 . A A . 28 LYS CD 1 1 3 1410 1 1 28 LYS CE C -8.790 -6.430 6.400 1.00 . A A . 28 LYS CE 1 1 3 1411 1 1 28 LYS CG C -9.542 -4.209 5.496 1.00 . A A . 28 LYS CG 1 1 3 1412 1 1 28 LYS H H -9.457 0.083 4.823 1.00 . A A . 28 LYS H 1 1 3 1413 1 1 28 LYS HA H -8.244 -2.088 6.014 1.00 . A A . 28 LYS HA 1 1 3 1414 1 1 28 LYS HB2 H -10.225 -2.867 4.001 1.00 . A A . 28 LYS HB2 1 1 3 1415 1 1 28 LYS HB3 H -8.629 -3.540 3.700 1.00 . A A . 28 LYS HB3 1 1 3 1416 1 1 28 LYS HD2 H -8.304 -5.623 4.490 1.00 . A A . 28 LYS HD2 1 1 3 1417 1 1 28 LYS HD3 H -7.526 -4.805 5.847 1.00 . A A . 28 LYS HD3 1 1 3 1418 1 1 28 LYS HE2 H -9.655 -6.935 5.996 1.00 . A A . 28 LYS HE2 1 1 3 1419 1 1 28 LYS HE3 H -7.953 -7.112 6.423 1.00 . A A . 28 LYS HE3 1 1 3 1420 1 1 28 LYS HG2 H -9.588 -3.752 6.472 1.00 . A A . 28 LYS HG2 1 1 3 1421 1 1 28 LYS HG3 H -10.485 -4.688 5.275 1.00 . A A . 28 LYS HG3 1 1 3 1422 1 1 28 LYS HZ1 H -10.014 -5.504 7.817 1.00 . A A . 28 LYS HZ1 1 1 3 1423 1 1 28 LYS HZ2 H -8.360 -5.335 8.126 1.00 . A A . 28 LYS HZ2 1 1 3 1424 1 1 28 LYS HZ3 H -9.128 -6.811 8.426 1.00 . A A . 28 LYS HZ3 1 1 3 1425 1 1 28 LYS N N -9.641 -0.808 5.190 1.00 . A A . 28 LYS N 1 1 3 1426 1 1 28 LYS NZ N -9.095 -5.989 7.789 1.00 . A A . 28 LYS NZ 1 1 3 1427 1 1 28 LYS O O -7.554 -1.535 2.917 1.00 . A A . 28 LYS O 1 1 3 1428 1 1 29 CYS C C -4.392 -1.563 3.602 1.00 . A A . 29 CYS C 1 1 3 1429 1 1 29 CYS CA C -5.276 -0.406 4.039 1.00 . A A . 29 CYS CA 1 1 3 1430 1 1 29 CYS CB C -4.473 0.541 4.911 1.00 . A A . 29 CYS CB 1 1 3 1431 1 1 29 CYS H H -6.460 -0.809 5.733 1.00 . A A . 29 CYS H 1 1 3 1432 1 1 29 CYS HA H -5.616 0.126 3.182 1.00 . A A . 29 CYS HA 1 1 3 1433 1 1 29 CYS HB2 H -5.150 1.113 5.514 1.00 . A A . 29 CYS HB2 1 1 3 1434 1 1 29 CYS HB3 H -3.838 -0.043 5.544 1.00 . A A . 29 CYS HB3 1 1 3 1435 1 1 29 CYS N N -6.446 -0.881 4.762 1.00 . A A . 29 CYS N 1 1 3 1436 1 1 29 CYS O O -4.501 -2.671 4.127 1.00 . A A . 29 CYS O 1 1 3 1437 1 1 29 CYS SG S -3.420 1.720 4.006 1.00 . A A . 29 CYS SG 1 1 3 1438 1 1 30 LYS C C -1.953 -1.875 0.820 1.00 . A A . 30 LYS C 1 1 3 1439 1 1 30 LYS CA C -2.579 -2.302 2.142 1.00 . A A . 30 LYS CA 1 1 3 1440 1 1 30 LYS CB C -3.274 -3.659 1.967 1.00 . A A . 30 LYS CB 1 1 3 1441 1 1 30 LYS CD C -5.669 -4.407 2.142 1.00 . A A . 30 LYS CD 1 1 3 1442 1 1 30 LYS CE C -5.839 -5.782 1.517 1.00 . A A . 30 LYS CE 1 1 3 1443 1 1 30 LYS CG C -4.669 -3.564 1.367 1.00 . A A . 30 LYS CG 1 1 3 1444 1 1 30 LYS H H -3.463 -0.383 2.285 1.00 . A A . 30 LYS H 1 1 3 1445 1 1 30 LYS HA H -1.788 -2.411 2.869 1.00 . A A . 30 LYS HA 1 1 3 1446 1 1 30 LYS HB2 H -2.671 -4.276 1.316 1.00 . A A . 30 LYS HB2 1 1 3 1447 1 1 30 LYS HB3 H -3.351 -4.138 2.931 1.00 . A A . 30 LYS HB3 1 1 3 1448 1 1 30 LYS HD2 H -5.317 -4.525 3.155 1.00 . A A . 30 LYS HD2 1 1 3 1449 1 1 30 LYS HD3 H -6.624 -3.902 2.146 1.00 . A A . 30 LYS HD3 1 1 3 1450 1 1 30 LYS HE2 H -4.865 -6.169 1.256 1.00 . A A . 30 LYS HE2 1 1 3 1451 1 1 30 LYS HE3 H -6.304 -6.438 2.240 1.00 . A A . 30 LYS HE3 1 1 3 1452 1 1 30 LYS HG2 H -4.990 -2.535 1.388 1.00 . A A . 30 LYS HG2 1 1 3 1453 1 1 30 LYS HG3 H -4.634 -3.911 0.345 1.00 . A A . 30 LYS HG3 1 1 3 1454 1 1 30 LYS HZ1 H -6.332 -6.416 -0.412 1.00 . A A . 30 LYS HZ1 1 1 3 1455 1 1 30 LYS HZ2 H -6.661 -4.782 -0.122 1.00 . A A . 30 LYS HZ2 1 1 3 1456 1 1 30 LYS HZ3 H -7.669 -5.975 0.528 1.00 . A A . 30 LYS HZ3 1 1 3 1457 1 1 30 LYS N N -3.504 -1.291 2.649 1.00 . A A . 30 LYS N 1 1 3 1458 1 1 30 LYS NZ N -6.685 -5.736 0.292 1.00 . A A . 30 LYS NZ 1 1 3 1459 1 1 30 LYS O O -2.482 -2.170 -0.248 1.00 . A A . 30 LYS O 1 1 3 1460 1 1 31 CYS C C -0.058 -1.751 -1.384 1.00 . A A . 31 CYS C 1 1 3 1461 1 1 31 CYS CA C -0.075 -0.723 -0.273 1.00 . A A . 31 CYS CA 1 1 3 1462 1 1 31 CYS CB C 1.365 -0.340 0.092 1.00 . A A . 31 CYS CB 1 1 3 1463 1 1 31 CYS H H -0.460 -0.998 1.799 1.00 . A A . 31 CYS H 1 1 3 1464 1 1 31 CYS HA H -0.560 0.152 -0.670 1.00 . A A . 31 CYS HA 1 1 3 1465 1 1 31 CYS HB2 H 2.002 -0.533 -0.758 1.00 . A A . 31 CYS HB2 1 1 3 1466 1 1 31 CYS HB3 H 1.396 0.713 0.317 1.00 . A A . 31 CYS HB3 1 1 3 1467 1 1 31 CYS N N -0.816 -1.191 0.910 1.00 . A A . 31 CYS N 1 1 3 1468 1 1 31 CYS O O -0.559 -2.863 -1.256 1.00 . A A . 31 CYS O 1 1 3 1469 1 1 31 CYS SG S 2.077 -1.237 1.515 1.00 . A A . 31 CYS SG 1 1 3 1470 1 1 32 ASN C C 1.800 -3.052 -3.642 1.00 . A A . 32 ASN C 1 1 3 1471 1 1 32 ASN CA C 0.584 -2.142 -3.686 1.00 . A A . 32 ASN CA 1 1 3 1472 1 1 32 ASN CB C 0.670 -1.234 -4.895 1.00 . A A . 32 ASN CB 1 1 3 1473 1 1 32 ASN CG C 0.124 -1.872 -6.158 1.00 . A A . 32 ASN CG 1 1 3 1474 1 1 32 ASN H H 0.821 -0.403 -2.518 1.00 . A A . 32 ASN H 1 1 3 1475 1 1 32 ASN HA H -0.300 -2.740 -3.764 1.00 . A A . 32 ASN HA 1 1 3 1476 1 1 32 ASN HB2 H 0.112 -0.340 -4.695 1.00 . A A . 32 ASN HB2 1 1 3 1477 1 1 32 ASN HB3 H 1.697 -0.979 -5.052 1.00 . A A . 32 ASN HB3 1 1 3 1478 1 1 32 ASN HD21 H -1.701 -1.207 -5.734 1.00 . A A . 32 ASN HD21 1 1 3 1479 1 1 32 ASN HD22 H -1.554 -2.119 -7.194 1.00 . A A . 32 ASN HD22 1 1 3 1480 1 1 32 ASN N N 0.490 -1.324 -2.493 1.00 . A A . 32 ASN N 1 1 3 1481 1 1 32 ASN ND2 N -1.175 -1.717 -6.385 1.00 . A A . 32 ASN ND2 1 1 3 1482 1 1 32 ASN O O 2.588 -3.020 -2.697 1.00 . A A . 32 ASN O 1 1 3 1483 1 1 32 ASN OD1 O 0.862 -2.496 -6.921 1.00 . A A . 32 ASN OD1 1 1 3 1484 1 1 33 ARG C C 4.004 -4.323 -5.914 1.00 . A A . 33 ARG C 1 1 3 1485 1 1 33 ARG CA C 3.072 -4.772 -4.800 1.00 . A A . 33 ARG CA 1 1 3 1486 1 1 33 ARG CB C 2.579 -6.196 -5.063 1.00 . A A . 33 ARG CB 1 1 3 1487 1 1 33 ARG CD C 3.384 -7.439 -3.033 1.00 . A A . 33 ARG CD 1 1 3 1488 1 1 33 ARG CG C 3.516 -7.271 -4.538 1.00 . A A . 33 ARG CG 1 1 3 1489 1 1 33 ARG CZ C 2.587 -9.764 -2.866 1.00 . A A . 33 ARG CZ 1 1 3 1490 1 1 33 ARG H H 1.284 -3.815 -5.404 1.00 . A A . 33 ARG H 1 1 3 1491 1 1 33 ARG HA H 3.616 -4.750 -3.867 1.00 . A A . 33 ARG HA 1 1 3 1492 1 1 33 ARG HB2 H 1.616 -6.325 -4.591 1.00 . A A . 33 ARG HB2 1 1 3 1493 1 1 33 ARG HB3 H 2.468 -6.334 -6.129 1.00 . A A . 33 ARG HB3 1 1 3 1494 1 1 33 ARG HD2 H 4.158 -6.861 -2.550 1.00 . A A . 33 ARG HD2 1 1 3 1495 1 1 33 ARG HD3 H 2.417 -7.068 -2.727 1.00 . A A . 33 ARG HD3 1 1 3 1496 1 1 33 ARG HE H 4.323 -9.094 -2.143 1.00 . A A . 33 ARG HE 1 1 3 1497 1 1 33 ARG HG2 H 3.276 -8.209 -5.016 1.00 . A A . 33 ARG HG2 1 1 3 1498 1 1 33 ARG HG3 H 4.533 -6.996 -4.773 1.00 . A A . 33 ARG HG3 1 1 3 1499 1 1 33 ARG HH11 H 1.320 -8.511 -3.824 1.00 . A A . 33 ARG HH11 1 1 3 1500 1 1 33 ARG HH12 H 0.784 -10.152 -3.693 1.00 . A A . 33 ARG HH12 1 1 3 1501 1 1 33 ARG HH21 H 3.619 -11.254 -1.970 1.00 . A A . 33 ARG HH21 1 1 3 1502 1 1 33 ARG HH22 H 2.088 -11.710 -2.640 1.00 . A A . 33 ARG HH22 1 1 3 1503 1 1 33 ARG N N 1.948 -3.853 -4.686 1.00 . A A . 33 ARG N 1 1 3 1504 1 1 33 ARG NE N 3.509 -8.835 -2.623 1.00 . A A . 33 ARG NE 1 1 3 1505 1 1 33 ARG NH1 N 1.472 -9.450 -3.514 1.00 . A A . 33 ARG NH1 1 1 3 1506 1 1 33 ARG NH2 N 2.780 -11.011 -2.459 1.00 . A A . 33 ARG NH2 1 1 3 1507 1 1 33 ARG O O 3.854 -4.723 -7.068 1.00 . A A . 33 ARG O 1 1 3 1508 1 1 34 CYS C C 7.122 -3.862 -6.659 1.00 . A A . 34 CYS C 1 1 3 1509 1 1 34 CYS CA C 5.912 -2.944 -6.514 1.00 . A A . 34 CYS CA 1 1 3 1510 1 1 34 CYS CB C 6.350 -1.557 -6.080 1.00 . A A . 34 CYS CB 1 1 3 1511 1 1 34 CYS H H 5.013 -3.188 -4.621 1.00 . A A . 34 CYS H 1 1 3 1512 1 1 34 CYS HA H 5.420 -2.861 -7.460 1.00 . A A . 34 CYS HA 1 1 3 1513 1 1 34 CYS HB2 H 5.695 -1.226 -5.298 1.00 . A A . 34 CYS HB2 1 1 3 1514 1 1 34 CYS HB3 H 7.355 -1.610 -5.709 1.00 . A A . 34 CYS HB3 1 1 3 1515 1 1 34 CYS N N 4.957 -3.474 -5.557 1.00 . A A . 34 CYS N 1 1 3 1516 1 1 34 CYS O O 7.725 -4.212 -5.623 1.00 . A A . 34 CYS O 1 1 3 1517 1 1 34 CYS OXT O 7.455 -4.224 -7.807 1.00 . A A . 34 CYS OXT 1 1 3 1518 1 1 34 CYS SG S 6.300 -0.306 -7.404 1.00 . A A . 34 CYS SG 1 1 4 1519 1 1 1 VAL C C -4.909 5.857 -7.529 1.00 . A A . 1 VAL C 1 1 4 1520 1 1 1 VAL CA C -5.116 6.784 -8.721 1.00 . A A . 1 VAL CA 1 1 4 1521 1 1 1 VAL CB C -4.271 6.270 -9.903 1.00 . A A . 1 VAL CB 1 1 4 1522 1 1 1 VAL CG1 C -4.698 6.943 -11.198 1.00 . A A . 1 VAL CG1 1 1 4 1523 1 1 1 VAL CG2 C -2.790 6.496 -9.639 1.00 . A A . 1 VAL CG2 1 1 4 1524 1 1 1 VAL H1 H -5.459 8.526 -7.684 1.00 . A A . 1 VAL H1 1 1 4 1525 1 1 1 VAL H2 H -4.800 8.745 -9.253 1.00 . A A . 1 VAL H2 1 1 4 1526 1 1 1 VAL H3 H -3.806 8.182 -7.973 1.00 . A A . 1 VAL H3 1 1 4 1527 1 1 1 VAL HA H -6.156 6.756 -9.010 1.00 . A A . 1 VAL HA 1 1 4 1528 1 1 1 VAL HB H -4.439 5.208 -10.004 1.00 . A A . 1 VAL HB 1 1 4 1529 1 1 1 VAL HG11 H -4.193 7.893 -11.294 1.00 . A A . 1 VAL HG11 1 1 4 1530 1 1 1 VAL HG12 H -5.766 7.104 -11.186 1.00 . A A . 1 VAL HG12 1 1 4 1531 1 1 1 VAL HG13 H -4.439 6.312 -12.035 1.00 . A A . 1 VAL HG13 1 1 4 1532 1 1 1 VAL HG21 H -2.573 7.553 -9.686 1.00 . A A . 1 VAL HG21 1 1 4 1533 1 1 1 VAL HG22 H -2.207 5.977 -10.385 1.00 . A A . 1 VAL HG22 1 1 4 1534 1 1 1 VAL HG23 H -2.538 6.119 -8.659 1.00 . A A . 1 VAL HG23 1 1 4 1535 1 1 1 VAL N N -4.764 8.185 -8.377 1.00 . A A . 1 VAL N 1 1 4 1536 1 1 1 VAL O O -3.926 5.977 -6.799 1.00 . A A . 1 VAL O 1 1 4 1537 1 1 2 SER C C -5.828 4.702 -4.890 1.00 . A A . 2 SER C 1 1 4 1538 1 1 2 SER CA C -5.768 3.981 -6.233 1.00 . A A . 2 SER CA 1 1 4 1539 1 1 2 SER CB C -4.481 3.159 -6.326 1.00 . A A . 2 SER CB 1 1 4 1540 1 1 2 SER H H -6.605 4.886 -7.954 1.00 . A A . 2 SER H 1 1 4 1541 1 1 2 SER HA H -6.615 3.317 -6.309 1.00 . A A . 2 SER HA 1 1 4 1542 1 1 2 SER HB2 H -3.638 3.785 -6.073 1.00 . A A . 2 SER HB2 1 1 4 1543 1 1 2 SER HB3 H -4.535 2.331 -5.636 1.00 . A A . 2 SER HB3 1 1 4 1544 1 1 2 SER HG H -5.123 2.296 -7.963 1.00 . A A . 2 SER HG 1 1 4 1545 1 1 2 SER N N -5.845 4.931 -7.338 1.00 . A A . 2 SER N 1 1 4 1546 1 1 2 SER O O -4.993 5.557 -4.594 1.00 . A A . 2 SER O 1 1 4 1547 1 1 2 SER OG O -4.293 2.652 -7.636 1.00 . A A . 2 SER OG 1 1 4 1548 1 1 3 CYS C C -7.225 6.461 -2.885 1.00 . A A . 3 CYS C 1 1 4 1549 1 1 3 CYS CA C -6.990 4.964 -2.768 1.00 . A A . 3 CYS CA 1 1 4 1550 1 1 3 CYS CB C -5.767 4.705 -1.890 1.00 . A A . 3 CYS CB 1 1 4 1551 1 1 3 CYS H H -7.456 3.663 -4.372 1.00 . A A . 3 CYS H 1 1 4 1552 1 1 3 CYS HA H -7.854 4.521 -2.298 1.00 . A A . 3 CYS HA 1 1 4 1553 1 1 3 CYS HB2 H -4.893 5.101 -2.380 1.00 . A A . 3 CYS HB2 1 1 4 1554 1 1 3 CYS HB3 H -5.900 5.210 -0.945 1.00 . A A . 3 CYS HB3 1 1 4 1555 1 1 3 CYS N N -6.821 4.351 -4.080 1.00 . A A . 3 CYS N 1 1 4 1556 1 1 3 CYS O O -7.262 7.019 -3.982 1.00 . A A . 3 CYS O 1 1 4 1557 1 1 3 CYS SG S -5.460 2.943 -1.538 1.00 . A A . 3 CYS SG 1 1 4 1558 1 1 4 THR C C -6.336 9.285 -1.339 1.00 . A A . 4 THR C 1 1 4 1559 1 1 4 THR CA C -7.621 8.534 -1.676 1.00 . A A . 4 THR CA 1 1 4 1560 1 1 4 THR CB C -8.694 8.846 -0.631 1.00 . A A . 4 THR CB 1 1 4 1561 1 1 4 THR CG2 C -8.394 8.247 0.726 1.00 . A A . 4 THR CG2 1 1 4 1562 1 1 4 THR H H -7.344 6.580 -0.906 1.00 . A A . 4 THR H 1 1 4 1563 1 1 4 THR HA H -7.971 8.856 -2.645 1.00 . A A . 4 THR HA 1 1 4 1564 1 1 4 THR HB H -9.639 8.444 -0.969 1.00 . A A . 4 THR HB 1 1 4 1565 1 1 4 THR HG1 H -8.038 10.605 -0.074 1.00 . A A . 4 THR HG1 1 1 4 1566 1 1 4 THR HG21 H -7.418 7.784 0.708 1.00 . A A . 4 THR HG21 1 1 4 1567 1 1 4 THR HG22 H -9.141 7.504 0.965 1.00 . A A . 4 THR HG22 1 1 4 1568 1 1 4 THR HG23 H -8.409 9.025 1.475 1.00 . A A . 4 THR HG23 1 1 4 1569 1 1 4 THR N N -7.385 7.097 -1.738 1.00 . A A . 4 THR N 1 1 4 1570 1 1 4 THR O O -6.279 10.036 -0.366 1.00 . A A . 4 THR O 1 1 4 1571 1 1 4 THR OG1 O -8.839 10.245 -0.462 1.00 . A A . 4 THR OG1 1 1 4 1572 1 1 5 GLY C C -3.219 9.054 -0.841 1.00 . A A . 5 GLY C 1 1 4 1573 1 1 5 GLY CA C -4.036 9.739 -1.918 1.00 . A A . 5 GLY CA 1 1 4 1574 1 1 5 GLY H H -5.405 8.465 -2.911 1.00 . A A . 5 GLY H 1 1 4 1575 1 1 5 GLY HA2 H -3.469 9.742 -2.837 1.00 . A A . 5 GLY HA2 1 1 4 1576 1 1 5 GLY HA3 H -4.223 10.759 -1.618 1.00 . A A . 5 GLY HA3 1 1 4 1577 1 1 5 GLY N N -5.305 9.075 -2.151 1.00 . A A . 5 GLY N 1 1 4 1578 1 1 5 GLY O O -2.597 8.021 -1.089 1.00 . A A . 5 GLY O 1 1 4 1579 1 1 6 SER C C -2.877 9.705 2.795 1.00 . A A . 6 SER C 1 1 4 1580 1 1 6 SER CA C -2.476 9.055 1.476 1.00 . A A . 6 SER CA 1 1 4 1581 1 1 6 SER CB C -0.970 9.217 1.258 1.00 . A A . 6 SER CB 1 1 4 1582 1 1 6 SER H H -3.738 10.447 0.498 1.00 . A A . 6 SER H 1 1 4 1583 1 1 6 SER HA H -2.710 8.002 1.523 1.00 . A A . 6 SER HA 1 1 4 1584 1 1 6 SER HB2 H -0.577 9.920 1.978 1.00 . A A . 6 SER HB2 1 1 4 1585 1 1 6 SER HB3 H -0.487 8.260 1.392 1.00 . A A . 6 SER HB3 1 1 4 1586 1 1 6 SER HG H -1.014 10.591 -0.138 1.00 . A A . 6 SER HG 1 1 4 1587 1 1 6 SER N N -3.221 9.626 0.359 1.00 . A A . 6 SER N 1 1 4 1588 1 1 6 SER O O -3.541 10.740 2.817 1.00 . A A . 6 SER O 1 1 4 1589 1 1 6 SER OG O -0.686 9.694 -0.046 1.00 . A A . 6 SER OG 1 1 4 1590 1 1 7 LYS C C -1.715 9.103 6.228 1.00 . A A . 7 LYS C 1 1 4 1591 1 1 7 LYS CA C -2.762 9.585 5.227 1.00 . A A . 7 LYS CA 1 1 4 1592 1 1 7 LYS CB C -4.156 9.128 5.667 1.00 . A A . 7 LYS CB 1 1 4 1593 1 1 7 LYS CD C -5.912 9.063 3.857 1.00 . A A . 7 LYS CD 1 1 4 1594 1 1 7 LYS CE C -6.387 7.701 4.340 1.00 . A A . 7 LYS CE 1 1 4 1595 1 1 7 LYS CG C -5.292 9.877 4.986 1.00 . A A . 7 LYS CG 1 1 4 1596 1 1 7 LYS H H -1.932 8.262 3.799 1.00 . A A . 7 LYS H 1 1 4 1597 1 1 7 LYS HA H -2.740 10.664 5.190 1.00 . A A . 7 LYS HA 1 1 4 1598 1 1 7 LYS HB2 H -4.261 8.077 5.447 1.00 . A A . 7 LYS HB2 1 1 4 1599 1 1 7 LYS HB3 H -4.248 9.272 6.734 1.00 . A A . 7 LYS HB3 1 1 4 1600 1 1 7 LYS HD2 H -6.756 9.605 3.459 1.00 . A A . 7 LYS HD2 1 1 4 1601 1 1 7 LYS HD3 H -5.174 8.923 3.081 1.00 . A A . 7 LYS HD3 1 1 4 1602 1 1 7 LYS HE2 H -5.546 7.023 4.342 1.00 . A A . 7 LYS HE2 1 1 4 1603 1 1 7 LYS HE3 H -6.768 7.802 5.344 1.00 . A A . 7 LYS HE3 1 1 4 1604 1 1 7 LYS HG2 H -6.056 10.093 5.718 1.00 . A A . 7 LYS HG2 1 1 4 1605 1 1 7 LYS HG3 H -4.908 10.802 4.582 1.00 . A A . 7 LYS HG3 1 1 4 1606 1 1 7 LYS HZ1 H -7.069 6.917 2.527 1.00 . A A . 7 LYS HZ1 1 1 4 1607 1 1 7 LYS HZ2 H -8.224 7.837 3.355 1.00 . A A . 7 LYS HZ2 1 1 4 1608 1 1 7 LYS HZ3 H -7.847 6.277 3.888 1.00 . A A . 7 LYS HZ3 1 1 4 1609 1 1 7 LYS N N -2.461 9.083 3.892 1.00 . A A . 7 LYS N 1 1 4 1610 1 1 7 LYS NZ N -7.457 7.144 3.466 1.00 . A A . 7 LYS NZ 1 1 4 1611 1 1 7 LYS O O -0.796 9.840 6.584 1.00 . A A . 7 LYS O 1 1 4 1612 1 1 8 ASP C C -0.526 5.851 7.214 1.00 . A A . 8 ASP C 1 1 4 1613 1 1 8 ASP CA C -0.924 7.271 7.626 1.00 . A A . 8 ASP CA 1 1 4 1614 1 1 8 ASP CB C -1.541 7.251 9.026 1.00 . A A . 8 ASP CB 1 1 4 1615 1 1 8 ASP CG C -1.225 8.507 9.814 1.00 . A A . 8 ASP CG 1 1 4 1616 1 1 8 ASP H H -2.611 7.319 6.348 1.00 . A A . 8 ASP H 1 1 4 1617 1 1 8 ASP HA H -0.038 7.887 7.643 1.00 . A A . 8 ASP HA 1 1 4 1618 1 1 8 ASP HB2 H -2.613 7.162 8.940 1.00 . A A . 8 ASP HB2 1 1 4 1619 1 1 8 ASP HB3 H -1.155 6.400 9.570 1.00 . A A . 8 ASP HB3 1 1 4 1620 1 1 8 ASP N N -1.858 7.858 6.672 1.00 . A A . 8 ASP N 1 1 4 1621 1 1 8 ASP O O 0.199 5.168 7.939 1.00 . A A . 8 ASP O 1 1 4 1622 1 1 8 ASP OD1 O -0.127 8.577 10.406 1.00 . A A . 8 ASP OD1 1 1 4 1623 1 1 8 ASP OD2 O -2.076 9.421 9.839 1.00 . A A . 8 ASP OD2 1 1 4 1624 1 1 9 CYS C C 0.164 4.146 4.306 1.00 . A A . 9 CYS C 1 1 4 1625 1 1 9 CYS CA C -0.695 4.078 5.551 1.00 . A A . 9 CYS CA 1 1 4 1626 1 1 9 CYS CB C -1.977 3.337 5.228 1.00 . A A . 9 CYS CB 1 1 4 1627 1 1 9 CYS H H -1.575 5.994 5.514 1.00 . A A . 9 CYS H 1 1 4 1628 1 1 9 CYS HA H -0.171 3.546 6.310 1.00 . A A . 9 CYS HA 1 1 4 1629 1 1 9 CYS HB2 H -2.747 3.675 5.894 1.00 . A A . 9 CYS HB2 1 1 4 1630 1 1 9 CYS HB3 H -2.257 3.566 4.219 1.00 . A A . 9 CYS HB3 1 1 4 1631 1 1 9 CYS N N -1.001 5.411 6.050 1.00 . A A . 9 CYS N 1 1 4 1632 1 1 9 CYS O O 1.302 3.677 4.286 1.00 . A A . 9 CYS O 1 1 4 1633 1 1 9 CYS SG S -1.856 1.524 5.375 1.00 . A A . 9 CYS SG 1 1 4 1634 1 1 10 TYR C C 1.697 5.420 2.187 1.00 . A A . 10 TYR C 1 1 4 1635 1 1 10 TYR CA C 0.287 4.875 1.992 1.00 . A A . 10 TYR CA 1 1 4 1636 1 1 10 TYR CB C -0.507 5.798 1.063 1.00 . A A . 10 TYR CB 1 1 4 1637 1 1 10 TYR CD1 C -1.748 3.820 0.100 1.00 . A A . 10 TYR CD1 1 1 4 1638 1 1 10 TYR CD2 C -1.261 5.655 -1.341 1.00 . A A . 10 TYR CD2 1 1 4 1639 1 1 10 TYR CE1 C -2.367 3.160 -0.943 1.00 . A A . 10 TYR CE1 1 1 4 1640 1 1 10 TYR CE2 C -1.880 5.001 -2.389 1.00 . A A . 10 TYR CE2 1 1 4 1641 1 1 10 TYR CG C -1.185 5.077 -0.080 1.00 . A A . 10 TYR CG 1 1 4 1642 1 1 10 TYR CZ C -2.431 3.755 -2.185 1.00 . A A . 10 TYR CZ 1 1 4 1643 1 1 10 TYR H H -1.313 5.081 3.357 1.00 . A A . 10 TYR H 1 1 4 1644 1 1 10 TYR HA H 0.352 3.897 1.540 1.00 . A A . 10 TYR HA 1 1 4 1645 1 1 10 TYR HB2 H -1.271 6.301 1.635 1.00 . A A . 10 TYR HB2 1 1 4 1646 1 1 10 TYR HB3 H 0.162 6.535 0.641 1.00 . A A . 10 TYR HB3 1 1 4 1647 1 1 10 TYR HD1 H -1.697 3.357 1.075 1.00 . A A . 10 TYR HD1 1 1 4 1648 1 1 10 TYR HD2 H -0.828 6.631 -1.498 1.00 . A A . 10 TYR HD2 1 1 4 1649 1 1 10 TYR HE1 H -2.800 2.183 -0.783 1.00 . A A . 10 TYR HE1 1 1 4 1650 1 1 10 TYR HE2 H -1.930 5.468 -3.362 1.00 . A A . 10 TYR HE2 1 1 4 1651 1 1 10 TYR HH H -2.445 3.044 -3.972 1.00 . A A . 10 TYR HH 1 1 4 1652 1 1 10 TYR N N -0.402 4.734 3.264 1.00 . A A . 10 TYR N 1 1 4 1653 1 1 10 TYR O O 2.578 5.173 1.375 1.00 . A A . 10 TYR O 1 1 4 1654 1 1 10 TYR OH O -3.048 3.100 -3.227 1.00 . A A . 10 TYR OH 1 1 4 1655 1 1 11 ALA C C 4.232 5.695 3.967 1.00 . A A . 11 ALA C 1 1 4 1656 1 1 11 ALA CA C 3.216 6.751 3.534 1.00 . A A . 11 ALA CA 1 1 4 1657 1 1 11 ALA CB C 3.108 7.862 4.569 1.00 . A A . 11 ALA CB 1 1 4 1658 1 1 11 ALA H H 1.156 6.343 3.878 1.00 . A A . 11 ALA H 1 1 4 1659 1 1 11 ALA HA H 3.569 7.189 2.612 1.00 . A A . 11 ALA HA 1 1 4 1660 1 1 11 ALA HB1 H 2.962 8.808 4.070 1.00 . A A . 11 ALA HB1 1 1 4 1661 1 1 11 ALA HB2 H 4.016 7.899 5.153 1.00 . A A . 11 ALA HB2 1 1 4 1662 1 1 11 ALA HB3 H 2.269 7.666 5.221 1.00 . A A . 11 ALA HB3 1 1 4 1663 1 1 11 ALA N N 1.902 6.173 3.259 1.00 . A A . 11 ALA N 1 1 4 1664 1 1 11 ALA O O 5.160 5.370 3.219 1.00 . A A . 11 ALA O 1 1 4 1665 1 1 12 PRO C C 5.274 3.035 4.680 1.00 . A A . 12 PRO C 1 1 4 1666 1 1 12 PRO CA C 4.982 4.115 5.711 1.00 . A A . 12 PRO CA 1 1 4 1667 1 1 12 PRO CB C 4.226 3.527 6.915 1.00 . A A . 12 PRO CB 1 1 4 1668 1 1 12 PRO CD C 3.006 5.440 6.141 1.00 . A A . 12 PRO CD 1 1 4 1669 1 1 12 PRO CG C 2.862 4.142 6.880 1.00 . A A . 12 PRO CG 1 1 4 1670 1 1 12 PRO HA H 5.913 4.550 6.044 1.00 . A A . 12 PRO HA 1 1 4 1671 1 1 12 PRO HB2 H 4.174 2.453 6.818 1.00 . A A . 12 PRO HB2 1 1 4 1672 1 1 12 PRO HB3 H 4.747 3.783 7.825 1.00 . A A . 12 PRO HB3 1 1 4 1673 1 1 12 PRO HD2 H 2.087 5.691 5.632 1.00 . A A . 12 PRO HD2 1 1 4 1674 1 1 12 PRO HD3 H 3.300 6.231 6.814 1.00 . A A . 12 PRO HD3 1 1 4 1675 1 1 12 PRO HG2 H 2.179 3.488 6.358 1.00 . A A . 12 PRO HG2 1 1 4 1676 1 1 12 PRO HG3 H 2.515 4.320 7.887 1.00 . A A . 12 PRO HG3 1 1 4 1677 1 1 12 PRO N N 4.075 5.136 5.185 1.00 . A A . 12 PRO N 1 1 4 1678 1 1 12 PRO O O 6.328 2.401 4.706 1.00 . A A . 12 PRO O 1 1 4 1679 1 1 13 CYS C C 5.150 2.420 1.505 1.00 . A A . 13 CYS C 1 1 4 1680 1 1 13 CYS CA C 4.473 1.841 2.726 1.00 . A A . 13 CYS CA 1 1 4 1681 1 1 13 CYS CB C 3.120 1.294 2.329 1.00 . A A . 13 CYS CB 1 1 4 1682 1 1 13 CYS H H 3.511 3.376 3.807 1.00 . A A . 13 CYS H 1 1 4 1683 1 1 13 CYS HA H 5.071 1.040 3.104 1.00 . A A . 13 CYS HA 1 1 4 1684 1 1 13 CYS HB2 H 2.430 1.488 3.122 1.00 . A A . 13 CYS HB2 1 1 4 1685 1 1 13 CYS HB3 H 2.791 1.797 1.439 1.00 . A A . 13 CYS HB3 1 1 4 1686 1 1 13 CYS N N 4.328 2.837 3.772 1.00 . A A . 13 CYS N 1 1 4 1687 1 1 13 CYS O O 6.157 1.903 1.053 1.00 . A A . 13 CYS O 1 1 4 1688 1 1 13 CYS SG S 3.106 -0.497 1.990 1.00 . A A . 13 CYS SG 1 1 4 1689 1 1 14 ARG C C 6.667 4.163 -0.134 1.00 . A A . 14 ARG C 1 1 4 1690 1 1 14 ARG CA C 5.158 4.141 -0.212 1.00 . A A . 14 ARG CA 1 1 4 1691 1 1 14 ARG CB C 4.626 5.548 -0.399 1.00 . A A . 14 ARG CB 1 1 4 1692 1 1 14 ARG CD C 3.382 6.099 -2.512 1.00 . A A . 14 ARG CD 1 1 4 1693 1 1 14 ARG CG C 3.267 5.607 -1.081 1.00 . A A . 14 ARG CG 1 1 4 1694 1 1 14 ARG CZ C 2.256 8.291 -2.519 1.00 . A A . 14 ARG CZ 1 1 4 1695 1 1 14 ARG H H 3.794 3.875 1.391 1.00 . A A . 14 ARG H 1 1 4 1696 1 1 14 ARG HA H 4.882 3.555 -1.063 1.00 . A A . 14 ARG HA 1 1 4 1697 1 1 14 ARG HB2 H 4.548 6.023 0.563 1.00 . A A . 14 ARG HB2 1 1 4 1698 1 1 14 ARG HB3 H 5.327 6.085 -1.006 1.00 . A A . 14 ARG HB3 1 1 4 1699 1 1 14 ARG HD2 H 4.322 6.619 -2.628 1.00 . A A . 14 ARG HD2 1 1 4 1700 1 1 14 ARG HD3 H 3.358 5.246 -3.175 1.00 . A A . 14 ARG HD3 1 1 4 1701 1 1 14 ARG HE H 1.550 6.639 -3.390 1.00 . A A . 14 ARG HE 1 1 4 1702 1 1 14 ARG HG2 H 2.835 4.617 -1.085 1.00 . A A . 14 ARG HG2 1 1 4 1703 1 1 14 ARG HG3 H 2.628 6.280 -0.529 1.00 . A A . 14 ARG HG3 1 1 4 1704 1 1 14 ARG HH11 H 4.021 8.259 -1.532 1.00 . A A . 14 ARG HH11 1 1 4 1705 1 1 14 ARG HH12 H 3.208 9.789 -1.551 1.00 . A A . 14 ARG HH12 1 1 4 1706 1 1 14 ARG HH21 H 0.482 8.650 -3.418 1.00 . A A . 14 ARG HH21 1 1 4 1707 1 1 14 ARG HH22 H 1.199 10.011 -2.621 1.00 . A A . 14 ARG HH22 1 1 4 1708 1 1 14 ARG N N 4.594 3.503 0.974 1.00 . A A . 14 ARG N 1 1 4 1709 1 1 14 ARG NE N 2.292 7.007 -2.867 1.00 . A A . 14 ARG NE 1 1 4 1710 1 1 14 ARG NH1 N 3.243 8.822 -1.809 1.00 . A A . 14 ARG NH1 1 1 4 1711 1 1 14 ARG NH2 N 1.228 9.046 -2.883 1.00 . A A . 14 ARG NH2 1 1 4 1712 1 1 14 ARG O O 7.358 4.045 -1.146 1.00 . A A . 14 ARG O 1 1 4 1713 1 1 15 LYS C C 9.175 2.949 0.723 1.00 . A A . 15 LYS C 1 1 4 1714 1 1 15 LYS CA C 8.612 4.252 1.284 1.00 . A A . 15 LYS CA 1 1 4 1715 1 1 15 LYS CB C 8.949 4.383 2.772 1.00 . A A . 15 LYS CB 1 1 4 1716 1 1 15 LYS CD C 8.675 6.880 2.774 1.00 . A A . 15 LYS CD 1 1 4 1717 1 1 15 LYS CE C 7.892 7.374 3.980 1.00 . A A . 15 LYS CE 1 1 4 1718 1 1 15 LYS CG C 9.581 5.715 3.137 1.00 . A A . 15 LYS CG 1 1 4 1719 1 1 15 LYS H H 6.570 4.331 1.859 1.00 . A A . 15 LYS H 1 1 4 1720 1 1 15 LYS HA H 9.040 5.085 0.744 1.00 . A A . 15 LYS HA 1 1 4 1721 1 1 15 LYS HB2 H 8.040 4.271 3.345 1.00 . A A . 15 LYS HB2 1 1 4 1722 1 1 15 LYS HB3 H 9.636 3.595 3.046 1.00 . A A . 15 LYS HB3 1 1 4 1723 1 1 15 LYS HD2 H 9.280 7.690 2.395 1.00 . A A . 15 LYS HD2 1 1 4 1724 1 1 15 LYS HD3 H 7.980 6.560 2.011 1.00 . A A . 15 LYS HD3 1 1 4 1725 1 1 15 LYS HE2 H 7.345 6.544 4.402 1.00 . A A . 15 LYS HE2 1 1 4 1726 1 1 15 LYS HE3 H 8.587 7.756 4.713 1.00 . A A . 15 LYS HE3 1 1 4 1727 1 1 15 LYS HG2 H 9.766 5.736 4.201 1.00 . A A . 15 LYS HG2 1 1 4 1728 1 1 15 LYS HG3 H 10.515 5.818 2.605 1.00 . A A . 15 LYS HG3 1 1 4 1729 1 1 15 LYS HZ1 H 6.395 8.181 2.766 1.00 . A A . 15 LYS HZ1 1 1 4 1730 1 1 15 LYS HZ2 H 7.441 9.336 3.423 1.00 . A A . 15 LYS HZ2 1 1 4 1731 1 1 15 LYS HZ3 H 6.262 8.613 4.396 1.00 . A A . 15 LYS HZ3 1 1 4 1732 1 1 15 LYS N N 7.177 4.270 1.082 1.00 . A A . 15 LYS N 1 1 4 1733 1 1 15 LYS NZ N 6.930 8.451 3.616 1.00 . A A . 15 LYS NZ 1 1 4 1734 1 1 15 LYS O O 10.022 2.956 -0.170 1.00 . A A . 15 LYS O 1 1 4 1735 1 1 16 GLN C C 8.574 0.174 -0.609 1.00 . A A . 16 GLN C 1 1 4 1736 1 1 16 GLN CA C 9.105 0.508 0.791 1.00 . A A . 16 GLN CA 1 1 4 1737 1 1 16 GLN CB C 8.674 -0.572 1.790 1.00 . A A . 16 GLN CB 1 1 4 1738 1 1 16 GLN CD C 6.794 -1.666 3.074 1.00 . A A . 16 GLN CD 1 1 4 1739 1 1 16 GLN CG C 7.176 -0.616 2.049 1.00 . A A . 16 GLN CG 1 1 4 1740 1 1 16 GLN H H 7.984 1.894 1.947 1.00 . A A . 16 GLN H 1 1 4 1741 1 1 16 GLN HA H 10.184 0.520 0.748 1.00 . A A . 16 GLN HA 1 1 4 1742 1 1 16 GLN HB2 H 8.978 -1.536 1.411 1.00 . A A . 16 GLN HB2 1 1 4 1743 1 1 16 GLN HB3 H 9.174 -0.393 2.731 1.00 . A A . 16 GLN HB3 1 1 4 1744 1 1 16 GLN HE21 H 6.496 -0.255 4.443 1.00 . A A . 16 GLN HE21 1 1 4 1745 1 1 16 GLN HE22 H 6.220 -1.879 4.965 1.00 . A A . 16 GLN HE22 1 1 4 1746 1 1 16 GLN HG2 H 6.857 0.349 2.412 1.00 . A A . 16 GLN HG2 1 1 4 1747 1 1 16 GLN HG3 H 6.670 -0.839 1.123 1.00 . A A . 16 GLN HG3 1 1 4 1748 1 1 16 GLN N N 8.676 1.829 1.246 1.00 . A A . 16 GLN N 1 1 4 1749 1 1 16 GLN NE2 N 6.471 -1.223 4.283 1.00 . A A . 16 GLN NE2 1 1 4 1750 1 1 16 GLN O O 9.327 -0.255 -1.482 1.00 . A A . 16 GLN O 1 1 4 1751 1 1 16 GLN OE1 O 6.791 -2.861 2.782 1.00 . A A . 16 GLN OE1 1 1 4 1752 1 1 17 THR C C 6.978 1.014 -3.175 1.00 . A A . 17 THR C 1 1 4 1753 1 1 17 THR CA C 6.606 0.037 -2.064 1.00 . A A . 17 THR CA 1 1 4 1754 1 1 17 THR CB C 5.088 0.030 -1.866 1.00 . A A . 17 THR CB 1 1 4 1755 1 1 17 THR CG2 C 4.449 -1.311 -2.161 1.00 . A A . 17 THR CG2 1 1 4 1756 1 1 17 THR H H 6.716 0.669 -0.067 1.00 . A A . 17 THR H 1 1 4 1757 1 1 17 THR HA H 6.918 -0.953 -2.360 1.00 . A A . 17 THR HA 1 1 4 1758 1 1 17 THR HB H 4.645 0.760 -2.526 1.00 . A A . 17 THR HB 1 1 4 1759 1 1 17 THR HG1 H 4.054 1.037 -0.541 1.00 . A A . 17 THR HG1 1 1 4 1760 1 1 17 THR HG21 H 3.788 -1.581 -1.351 1.00 . A A . 17 THR HG21 1 1 4 1761 1 1 17 THR HG22 H 5.220 -2.061 -2.264 1.00 . A A . 17 THR HG22 1 1 4 1762 1 1 17 THR HG23 H 3.886 -1.246 -3.080 1.00 . A A . 17 THR HG23 1 1 4 1763 1 1 17 THR N N 7.264 0.344 -0.801 1.00 . A A . 17 THR N 1 1 4 1764 1 1 17 THR O O 6.588 0.819 -4.325 1.00 . A A . 17 THR O 1 1 4 1765 1 1 17 THR OG1 O 4.752 0.377 -0.534 1.00 . A A . 17 THR OG1 1 1 4 1766 1 1 18 GLY C C 6.892 3.579 -4.603 1.00 . A A . 18 GLY C 1 1 4 1767 1 1 18 GLY CA C 8.090 3.031 -3.869 1.00 . A A . 18 GLY CA 1 1 4 1768 1 1 18 GLY H H 8.001 2.198 -1.919 1.00 . A A . 18 GLY H 1 1 4 1769 1 1 18 GLY HA2 H 8.619 3.843 -3.423 1.00 . A A . 18 GLY HA2 1 1 4 1770 1 1 18 GLY HA3 H 8.738 2.545 -4.583 1.00 . A A . 18 GLY HA3 1 1 4 1771 1 1 18 GLY N N 7.717 2.069 -2.848 1.00 . A A . 18 GLY N 1 1 4 1772 1 1 18 GLY O O 6.168 4.430 -4.088 1.00 . A A . 18 GLY O 1 1 4 1773 1 1 19 CYS C C 4.379 3.966 -5.917 1.00 . A A . 19 CYS C 1 1 4 1774 1 1 19 CYS CA C 5.613 3.485 -6.692 1.00 . A A . 19 CYS CA 1 1 4 1775 1 1 19 CYS CB C 5.244 2.364 -7.634 1.00 . A A . 19 CYS CB 1 1 4 1776 1 1 19 CYS H H 7.345 2.432 -6.139 1.00 . A A . 19 CYS H 1 1 4 1777 1 1 19 CYS HA H 5.976 4.282 -7.293 1.00 . A A . 19 CYS HA 1 1 4 1778 1 1 19 CYS HB2 H 4.251 2.544 -7.994 1.00 . A A . 19 CYS HB2 1 1 4 1779 1 1 19 CYS HB3 H 5.928 2.401 -8.463 1.00 . A A . 19 CYS HB3 1 1 4 1780 1 1 19 CYS N N 6.708 3.083 -5.817 1.00 . A A . 19 CYS N 1 1 4 1781 1 1 19 CYS O O 4.102 3.494 -4.814 1.00 . A A . 19 CYS O 1 1 4 1782 1 1 19 CYS SG S 5.300 0.686 -6.920 1.00 . A A . 19 CYS SG 1 1 4 1783 1 1 20 PRO C C 1.252 4.554 -5.735 1.00 . A A . 20 PRO C 1 1 4 1784 1 1 20 PRO CA C 2.441 5.511 -5.839 1.00 . A A . 20 PRO CA 1 1 4 1785 1 1 20 PRO CB C 2.085 6.692 -6.746 1.00 . A A . 20 PRO CB 1 1 4 1786 1 1 20 PRO CD C 3.912 5.565 -7.787 1.00 . A A . 20 PRO CD 1 1 4 1787 1 1 20 PRO CG C 2.655 6.335 -8.074 1.00 . A A . 20 PRO CG 1 1 4 1788 1 1 20 PRO HA H 2.675 5.884 -4.855 1.00 . A A . 20 PRO HA 1 1 4 1789 1 1 20 PRO HB2 H 1.012 6.802 -6.794 1.00 . A A . 20 PRO HB2 1 1 4 1790 1 1 20 PRO HB3 H 2.529 7.596 -6.357 1.00 . A A . 20 PRO HB3 1 1 4 1791 1 1 20 PRO HD2 H 4.080 4.818 -8.549 1.00 . A A . 20 PRO HD2 1 1 4 1792 1 1 20 PRO HD3 H 4.758 6.234 -7.719 1.00 . A A . 20 PRO HD3 1 1 4 1793 1 1 20 PRO HG2 H 1.956 5.721 -8.623 1.00 . A A . 20 PRO HG2 1 1 4 1794 1 1 20 PRO HG3 H 2.883 7.233 -8.630 1.00 . A A . 20 PRO HG3 1 1 4 1795 1 1 20 PRO N N 3.634 4.935 -6.483 1.00 . A A . 20 PRO N 1 1 4 1796 1 1 20 PRO O O 0.195 4.933 -5.231 1.00 . A A . 20 PRO O 1 1 4 1797 1 1 21 TYR C C 0.039 1.881 -4.761 1.00 . A A . 21 TYR C 1 1 4 1798 1 1 21 TYR CA C 0.338 2.360 -6.185 1.00 . A A . 21 TYR CA 1 1 4 1799 1 1 21 TYR CB C 0.701 1.171 -7.067 1.00 . A A . 21 TYR CB 1 1 4 1800 1 1 21 TYR CD1 C 1.460 2.676 -8.955 1.00 . A A . 21 TYR CD1 1 1 4 1801 1 1 21 TYR CD2 C 2.625 0.624 -8.614 1.00 . A A . 21 TYR CD2 1 1 4 1802 1 1 21 TYR CE1 C 2.287 2.973 -10.021 1.00 . A A . 21 TYR CE1 1 1 4 1803 1 1 21 TYR CE2 C 3.456 0.914 -9.679 1.00 . A A . 21 TYR CE2 1 1 4 1804 1 1 21 TYR CG C 1.614 1.498 -8.233 1.00 . A A . 21 TYR CG 1 1 4 1805 1 1 21 TYR CZ C 3.283 2.089 -10.379 1.00 . A A . 21 TYR CZ 1 1 4 1806 1 1 21 TYR H H 2.247 3.066 -6.628 1.00 . A A . 21 TYR H 1 1 4 1807 1 1 21 TYR HA H -0.547 2.830 -6.584 1.00 . A A . 21 TYR HA 1 1 4 1808 1 1 21 TYR HB2 H 1.185 0.419 -6.468 1.00 . A A . 21 TYR HB2 1 1 4 1809 1 1 21 TYR HB3 H -0.196 0.774 -7.468 1.00 . A A . 21 TYR HB3 1 1 4 1810 1 1 21 TYR HD1 H 0.678 3.366 -8.672 1.00 . A A . 21 TYR HD1 1 1 4 1811 1 1 21 TYR HD2 H 2.757 -0.297 -8.064 1.00 . A A . 21 TYR HD2 1 1 4 1812 1 1 21 TYR HE1 H 2.151 3.893 -10.570 1.00 . A A . 21 TYR HE1 1 1 4 1813 1 1 21 TYR HE2 H 4.237 0.222 -9.958 1.00 . A A . 21 TYR HE2 1 1 4 1814 1 1 21 TYR HH H 4.807 2.973 -11.149 1.00 . A A . 21 TYR HH 1 1 4 1815 1 1 21 TYR N N 1.407 3.328 -6.220 1.00 . A A . 21 TYR N 1 1 4 1816 1 1 21 TYR O O 0.819 2.103 -3.835 1.00 . A A . 21 TYR O 1 1 4 1817 1 1 21 TYR OH O 4.109 2.382 -11.440 1.00 . A A . 21 TYR OH 1 1 4 1818 1 1 22 GLY C C -2.896 0.016 -3.437 1.00 . A A . 22 GLY C 1 1 4 1819 1 1 22 GLY CA C -1.533 0.679 -3.327 1.00 . A A . 22 GLY CA 1 1 4 1820 1 1 22 GLY H H -1.665 1.069 -5.404 1.00 . A A . 22 GLY H 1 1 4 1821 1 1 22 GLY HA2 H -0.816 -0.044 -2.990 1.00 . A A . 22 GLY HA2 1 1 4 1822 1 1 22 GLY HA3 H -1.582 1.475 -2.608 1.00 . A A . 22 GLY HA3 1 1 4 1823 1 1 22 GLY N N -1.103 1.213 -4.615 1.00 . A A . 22 GLY N 1 1 4 1824 1 1 22 GLY O O -3.770 0.527 -4.137 1.00 . A A . 22 GLY O 1 1 4 1825 1 1 23 LYS C C -5.202 -1.549 -1.572 1.00 . A A . 23 LYS C 1 1 4 1826 1 1 23 LYS CA C -4.389 -1.800 -2.835 1.00 . A A . 23 LYS CA 1 1 4 1827 1 1 23 LYS CB C -4.195 -3.303 -3.055 1.00 . A A . 23 LYS CB 1 1 4 1828 1 1 23 LYS CD C -4.750 -5.325 -4.441 1.00 . A A . 23 LYS CD 1 1 4 1829 1 1 23 LYS CE C -5.986 -6.176 -4.677 1.00 . A A . 23 LYS CE 1 1 4 1830 1 1 23 LYS CG C -5.117 -3.887 -4.113 1.00 . A A . 23 LYS CG 1 1 4 1831 1 1 23 LYS H H -2.388 -1.500 -2.207 1.00 . A A . 23 LYS H 1 1 4 1832 1 1 23 LYS HA H -4.921 -1.390 -3.676 1.00 . A A . 23 LYS HA 1 1 4 1833 1 1 23 LYS HB2 H -3.175 -3.483 -3.359 1.00 . A A . 23 LYS HB2 1 1 4 1834 1 1 23 LYS HB3 H -4.380 -3.819 -2.124 1.00 . A A . 23 LYS HB3 1 1 4 1835 1 1 23 LYS HD2 H -4.142 -5.336 -5.333 1.00 . A A . 23 LYS HD2 1 1 4 1836 1 1 23 LYS HD3 H -4.190 -5.740 -3.615 1.00 . A A . 23 LYS HD3 1 1 4 1837 1 1 23 LYS HE2 H -6.828 -5.710 -4.186 1.00 . A A . 23 LYS HE2 1 1 4 1838 1 1 23 LYS HE3 H -6.175 -6.228 -5.740 1.00 . A A . 23 LYS HE3 1 1 4 1839 1 1 23 LYS HG2 H -6.133 -3.861 -3.746 1.00 . A A . 23 LYS HG2 1 1 4 1840 1 1 23 LYS HG3 H -5.042 -3.291 -5.011 1.00 . A A . 23 LYS HG3 1 1 4 1841 1 1 23 LYS HZ1 H -6.653 -8.134 -4.384 1.00 . A A . 23 LYS HZ1 1 1 4 1842 1 1 23 LYS HZ2 H -5.714 -7.533 -3.112 1.00 . A A . 23 LYS HZ2 1 1 4 1843 1 1 23 LYS HZ3 H -4.976 -8.000 -4.561 1.00 . A A . 23 LYS HZ3 1 1 4 1844 1 1 23 LYS N N -3.099 -1.121 -2.760 1.00 . A A . 23 LYS N 1 1 4 1845 1 1 23 LYS NZ N -5.820 -7.557 -4.146 1.00 . A A . 23 LYS NZ 1 1 4 1846 1 1 23 LYS O O -6.010 -2.384 -1.163 1.00 . A A . 23 LYS O 1 1 4 1847 1 1 24 CYS C C -7.154 0.197 0.019 1.00 . A A . 24 CYS C 1 1 4 1848 1 1 24 CYS CA C -5.666 -0.038 0.274 1.00 . A A . 24 CYS CA 1 1 4 1849 1 1 24 CYS CB C -5.004 1.195 0.916 1.00 . A A . 24 CYS CB 1 1 4 1850 1 1 24 CYS H H -4.306 0.220 -1.322 1.00 . A A . 24 CYS H 1 1 4 1851 1 1 24 CYS HA H -5.568 -0.872 0.954 1.00 . A A . 24 CYS HA 1 1 4 1852 1 1 24 CYS HB2 H -5.064 1.102 1.988 1.00 . A A . 24 CYS HB2 1 1 4 1853 1 1 24 CYS HB3 H -3.962 1.218 0.626 1.00 . A A . 24 CYS HB3 1 1 4 1854 1 1 24 CYS N N -4.970 -0.398 -0.951 1.00 . A A . 24 CYS N 1 1 4 1855 1 1 24 CYS O O -7.536 1.020 -0.812 1.00 . A A . 24 CYS O 1 1 4 1856 1 1 24 CYS SG S -5.738 2.807 0.469 1.00 . A A . 24 CYS SG 1 1 4 1857 1 1 25 MET C C -10.014 0.259 1.851 1.00 . A A . 25 MET C 1 1 4 1858 1 1 25 MET CA C -9.431 -0.418 0.620 1.00 . A A . 25 MET CA 1 1 4 1859 1 1 25 MET CB C -10.066 -1.797 0.429 1.00 . A A . 25 MET CB 1 1 4 1860 1 1 25 MET CE C -8.905 -4.671 -2.349 1.00 . A A . 25 MET CE 1 1 4 1861 1 1 25 MET CG C -9.708 -2.454 -0.893 1.00 . A A . 25 MET CG 1 1 4 1862 1 1 25 MET H H -7.615 -1.174 1.391 1.00 . A A . 25 MET H 1 1 4 1863 1 1 25 MET HA H -9.645 0.193 -0.244 1.00 . A A . 25 MET HA 1 1 4 1864 1 1 25 MET HB2 H -9.738 -2.445 1.229 1.00 . A A . 25 MET HB2 1 1 4 1865 1 1 25 MET HB3 H -11.140 -1.696 0.478 1.00 . A A . 25 MET HB3 1 1 4 1866 1 1 25 MET HE1 H -7.832 -4.679 -2.224 1.00 . A A . 25 MET HE1 1 1 4 1867 1 1 25 MET HE2 H -9.174 -3.938 -3.095 1.00 . A A . 25 MET HE2 1 1 4 1868 1 1 25 MET HE3 H -9.237 -5.647 -2.668 1.00 . A A . 25 MET HE3 1 1 4 1869 1 1 25 MET HG2 H -10.436 -2.160 -1.634 1.00 . A A . 25 MET HG2 1 1 4 1870 1 1 25 MET HG3 H -8.730 -2.112 -1.197 1.00 . A A . 25 MET HG3 1 1 4 1871 1 1 25 MET N N -7.985 -0.537 0.748 1.00 . A A . 25 MET N 1 1 4 1872 1 1 25 MET O O -9.528 0.067 2.966 1.00 . A A . 25 MET O 1 1 4 1873 1 1 25 MET SD S -9.685 -4.254 -0.791 1.00 . A A . 25 MET SD 1 1 4 1874 1 1 26 ASN C C -11.964 0.843 3.920 1.00 . A A . 26 ASN C 1 1 4 1875 1 1 26 ASN CA C -11.695 1.776 2.745 1.00 . A A . 26 ASN CA 1 1 4 1876 1 1 26 ASN CB C -13.012 2.426 2.305 1.00 . A A . 26 ASN CB 1 1 4 1877 1 1 26 ASN CG C -13.051 2.775 0.829 1.00 . A A . 26 ASN CG 1 1 4 1878 1 1 26 ASN H H -11.385 1.174 0.729 1.00 . A A . 26 ASN H 1 1 4 1879 1 1 26 ASN HA H -11.017 2.551 3.069 1.00 . A A . 26 ASN HA 1 1 4 1880 1 1 26 ASN HB2 H -13.819 1.746 2.518 1.00 . A A . 26 ASN HB2 1 1 4 1881 1 1 26 ASN HB3 H -13.160 3.333 2.874 1.00 . A A . 26 ASN HB3 1 1 4 1882 1 1 26 ASN HD21 H -13.881 1.019 0.408 1.00 . A A . 26 ASN HD21 1 1 4 1883 1 1 26 ASN HD22 H -13.598 2.057 -0.942 1.00 . A A . 26 ASN HD22 1 1 4 1884 1 1 26 ASN N N -11.051 1.059 1.642 1.00 . A A . 26 ASN N 1 1 4 1885 1 1 26 ASN ND2 N -13.562 1.858 0.016 1.00 . A A . 26 ASN ND2 1 1 4 1886 1 1 26 ASN O O -12.656 -0.166 3.785 1.00 . A A . 26 ASN O 1 1 4 1887 1 1 26 ASN OD1 O -12.625 3.858 0.424 1.00 . A A . 26 ASN OD1 1 1 4 1888 1 1 27 ARG C C -10.730 -0.876 6.206 1.00 . A A . 27 ARG C 1 1 4 1889 1 1 27 ARG CA C -11.561 0.397 6.284 1.00 . A A . 27 ARG CA 1 1 4 1890 1 1 27 ARG CB C -13.035 0.053 6.519 1.00 . A A . 27 ARG CB 1 1 4 1891 1 1 27 ARG CD C -13.963 -1.036 8.588 1.00 . A A . 27 ARG CD 1 1 4 1892 1 1 27 ARG CG C -13.483 0.261 7.957 1.00 . A A . 27 ARG CG 1 1 4 1893 1 1 27 ARG CZ C -16.400 -0.829 8.292 1.00 . A A . 27 ARG CZ 1 1 4 1894 1 1 27 ARG H H -10.860 2.001 5.100 1.00 . A A . 27 ARG H 1 1 4 1895 1 1 27 ARG HA H -11.203 0.990 7.110 1.00 . A A . 27 ARG HA 1 1 4 1896 1 1 27 ARG HB2 H -13.644 0.676 5.881 1.00 . A A . 27 ARG HB2 1 1 4 1897 1 1 27 ARG HB3 H -13.199 -0.983 6.258 1.00 . A A . 27 ARG HB3 1 1 4 1898 1 1 27 ARG HD2 H -13.233 -1.807 8.394 1.00 . A A . 27 ARG HD2 1 1 4 1899 1 1 27 ARG HD3 H -14.057 -0.889 9.654 1.00 . A A . 27 ARG HD3 1 1 4 1900 1 1 27 ARG HE H -15.267 -2.260 7.484 1.00 . A A . 27 ARG HE 1 1 4 1901 1 1 27 ARG HG2 H -12.652 0.642 8.531 1.00 . A A . 27 ARG HG2 1 1 4 1902 1 1 27 ARG HG3 H -14.290 0.979 7.971 1.00 . A A . 27 ARG HG3 1 1 4 1903 1 1 27 ARG HH11 H -15.573 0.603 9.458 1.00 . A A . 27 ARG HH11 1 1 4 1904 1 1 27 ARG HH12 H -17.286 0.726 9.234 1.00 . A A . 27 ARG HH12 1 1 4 1905 1 1 27 ARG HH21 H -17.520 -2.099 7.189 1.00 . A A . 27 ARG HH21 1 1 4 1906 1 1 27 ARG HH22 H -18.391 -0.807 7.946 1.00 . A A . 27 ARG HH22 1 1 4 1907 1 1 27 ARG N N -11.402 1.191 5.069 1.00 . A A . 27 ARG N 1 1 4 1908 1 1 27 ARG NE N -15.254 -1.460 8.052 1.00 . A A . 27 ARG NE 1 1 4 1909 1 1 27 ARG NH1 N -16.421 0.256 9.057 1.00 . A A . 27 ARG NH1 1 1 4 1910 1 1 27 ARG NH2 N -17.530 -1.282 7.765 1.00 . A A . 27 ARG NH2 1 1 4 1911 1 1 27 ARG O O -11.067 -1.890 6.816 1.00 . A A . 27 ARG O 1 1 4 1912 1 1 28 LYS C C -7.622 -1.633 4.298 1.00 . A A . 28 LYS C 1 1 4 1913 1 1 28 LYS CA C -8.742 -1.951 5.285 1.00 . A A . 28 LYS CA 1 1 4 1914 1 1 28 LYS CB C -9.521 -3.180 4.802 1.00 . A A . 28 LYS CB 1 1 4 1915 1 1 28 LYS CD C -7.950 -4.844 5.840 1.00 . A A . 28 LYS CD 1 1 4 1916 1 1 28 LYS CE C -7.882 -6.359 5.940 1.00 . A A . 28 LYS CE 1 1 4 1917 1 1 28 LYS CG C -8.649 -4.402 4.564 1.00 . A A . 28 LYS CG 1 1 4 1918 1 1 28 LYS H H -9.430 0.038 4.996 1.00 . A A . 28 LYS H 1 1 4 1919 1 1 28 LYS HA H -8.305 -2.170 6.247 1.00 . A A . 28 LYS HA 1 1 4 1920 1 1 28 LYS HB2 H -10.264 -3.436 5.541 1.00 . A A . 28 LYS HB2 1 1 4 1921 1 1 28 LYS HB3 H -10.019 -2.934 3.876 1.00 . A A . 28 LYS HB3 1 1 4 1922 1 1 28 LYS HD2 H -6.946 -4.447 5.846 1.00 . A A . 28 LYS HD2 1 1 4 1923 1 1 28 LYS HD3 H -8.497 -4.460 6.689 1.00 . A A . 28 LYS HD3 1 1 4 1924 1 1 28 LYS HE2 H -7.866 -6.773 4.943 1.00 . A A . 28 LYS HE2 1 1 4 1925 1 1 28 LYS HE3 H -6.972 -6.631 6.456 1.00 . A A . 28 LYS HE3 1 1 4 1926 1 1 28 LYS HG2 H -9.268 -5.210 4.206 1.00 . A A . 28 LYS HG2 1 1 4 1927 1 1 28 LYS HG3 H -7.902 -4.161 3.821 1.00 . A A . 28 LYS HG3 1 1 4 1928 1 1 28 LYS HZ1 H -8.852 -7.906 6.954 1.00 . A A . 28 LYS HZ1 1 1 4 1929 1 1 28 LYS HZ2 H -9.894 -6.901 6.078 1.00 . A A . 28 LYS HZ2 1 1 4 1930 1 1 28 LYS HZ3 H -9.228 -6.362 7.537 1.00 . A A . 28 LYS HZ3 1 1 4 1931 1 1 28 LYS N N -9.638 -0.807 5.451 1.00 . A A . 28 LYS N 1 1 4 1932 1 1 28 LYS NZ N -9.045 -6.921 6.679 1.00 . A A . 28 LYS NZ 1 1 4 1933 1 1 28 LYS O O -7.806 -1.728 3.087 1.00 . A A . 28 LYS O 1 1 4 1934 1 1 29 CYS C C -4.746 -2.181 3.324 1.00 . A A . 29 CYS C 1 1 4 1935 1 1 29 CYS CA C -5.307 -0.936 3.996 1.00 . A A . 29 CYS CA 1 1 4 1936 1 1 29 CYS CB C -4.227 -0.281 4.838 1.00 . A A . 29 CYS CB 1 1 4 1937 1 1 29 CYS H H -6.374 -1.209 5.797 1.00 . A A . 29 CYS H 1 1 4 1938 1 1 29 CYS HA H -5.623 -0.245 3.250 1.00 . A A . 29 CYS HA 1 1 4 1939 1 1 29 CYS HB2 H -4.698 0.301 5.603 1.00 . A A . 29 CYS HB2 1 1 4 1940 1 1 29 CYS HB3 H -3.634 -1.050 5.290 1.00 . A A . 29 CYS HB3 1 1 4 1941 1 1 29 CYS N N -6.460 -1.262 4.826 1.00 . A A . 29 CYS N 1 1 4 1942 1 1 29 CYS O O -5.040 -3.304 3.732 1.00 . A A . 29 CYS O 1 1 4 1943 1 1 29 CYS SG S -3.103 0.827 3.927 1.00 . A A . 29 CYS SG 1 1 4 1944 1 1 30 LYS C C -2.552 -2.599 0.359 1.00 . A A . 30 LYS C 1 1 4 1945 1 1 30 LYS CA C -3.318 -3.089 1.576 1.00 . A A . 30 LYS CA 1 1 4 1946 1 1 30 LYS CB C -4.380 -4.111 1.155 1.00 . A A . 30 LYS CB 1 1 4 1947 1 1 30 LYS CD C -5.818 -5.863 2.240 1.00 . A A . 30 LYS CD 1 1 4 1948 1 1 30 LYS CE C -5.868 -6.940 3.311 1.00 . A A . 30 LYS CE 1 1 4 1949 1 1 30 LYS CG C -4.401 -5.358 2.025 1.00 . A A . 30 LYS CG 1 1 4 1950 1 1 30 LYS H H -3.725 -1.056 2.020 1.00 . A A . 30 LYS H 1 1 4 1951 1 1 30 LYS HA H -2.616 -3.563 2.243 1.00 . A A . 30 LYS HA 1 1 4 1952 1 1 30 LYS HB2 H -5.352 -3.645 1.208 1.00 . A A . 30 LYS HB2 1 1 4 1953 1 1 30 LYS HB3 H -4.190 -4.413 0.135 1.00 . A A . 30 LYS HB3 1 1 4 1954 1 1 30 LYS HD2 H -6.443 -5.037 2.545 1.00 . A A . 30 LYS HD2 1 1 4 1955 1 1 30 LYS HD3 H -6.188 -6.274 1.312 1.00 . A A . 30 LYS HD3 1 1 4 1956 1 1 30 LYS HE2 H -4.933 -7.479 3.306 1.00 . A A . 30 LYS HE2 1 1 4 1957 1 1 30 LYS HE3 H -6.005 -6.467 4.273 1.00 . A A . 30 LYS HE3 1 1 4 1958 1 1 30 LYS HG2 H -3.823 -6.132 1.542 1.00 . A A . 30 LYS HG2 1 1 4 1959 1 1 30 LYS HG3 H -3.962 -5.123 2.983 1.00 . A A . 30 LYS HG3 1 1 4 1960 1 1 30 LYS HZ1 H -7.188 -8.427 3.955 1.00 . A A . 30 LYS HZ1 1 1 4 1961 1 1 30 LYS HZ2 H -6.720 -8.579 2.337 1.00 . A A . 30 LYS HZ2 1 1 4 1962 1 1 30 LYS HZ3 H -7.839 -7.392 2.786 1.00 . A A . 30 LYS HZ3 1 1 4 1963 1 1 30 LYS N N -3.928 -1.975 2.296 1.00 . A A . 30 LYS N 1 1 4 1964 1 1 30 LYS NZ N -6.981 -7.901 3.081 1.00 . A A . 30 LYS NZ 1 1 4 1965 1 1 30 LYS O O -3.040 -2.656 -0.758 1.00 . A A . 30 LYS O 1 1 4 1966 1 1 31 CYS C C -0.497 -2.492 -1.706 1.00 . A A . 31 CYS C 1 1 4 1967 1 1 31 CYS CA C -0.445 -1.640 -0.451 1.00 . A A . 31 CYS CA 1 1 4 1968 1 1 31 CYS CB C 0.994 -1.579 0.077 1.00 . A A . 31 CYS CB 1 1 4 1969 1 1 31 CYS H H -1.024 -2.148 1.530 1.00 . A A . 31 CYS H 1 1 4 1970 1 1 31 CYS HA H -0.744 -0.644 -0.730 1.00 . A A . 31 CYS HA 1 1 4 1971 1 1 31 CYS HB2 H 1.412 -2.575 0.077 1.00 . A A . 31 CYS HB2 1 1 4 1972 1 1 31 CYS HB3 H 1.582 -0.948 -0.572 1.00 . A A . 31 CYS HB3 1 1 4 1973 1 1 31 CYS N N -1.338 -2.140 0.603 1.00 . A A . 31 CYS N 1 1 4 1974 1 1 31 CYS O O -1.145 -3.528 -1.760 1.00 . A A . 31 CYS O 1 1 4 1975 1 1 31 CYS SG S 1.135 -0.920 1.774 1.00 . A A . 31 CYS SG 1 1 4 1976 1 1 32 ASN C C 1.573 -3.183 -4.326 1.00 . A A . 32 ASN C 1 1 4 1977 1 1 32 ASN CA C 0.191 -2.625 -4.029 1.00 . A A . 32 ASN CA 1 1 4 1978 1 1 32 ASN CB C -0.167 -1.585 -5.056 1.00 . A A . 32 ASN CB 1 1 4 1979 1 1 32 ASN CG C -0.880 -2.151 -6.269 1.00 . A A . 32 ASN CG 1 1 4 1980 1 1 32 ASN H H 0.567 -1.108 -2.628 1.00 . A A . 32 ASN H 1 1 4 1981 1 1 32 ASN HA H -0.523 -3.419 -4.074 1.00 . A A . 32 ASN HA 1 1 4 1982 1 1 32 ASN HB2 H -0.804 -0.869 -4.585 1.00 . A A . 32 ASN HB2 1 1 4 1983 1 1 32 ASN HB3 H 0.733 -1.099 -5.369 1.00 . A A . 32 ASN HB3 1 1 4 1984 1 1 32 ASN HD21 H 0.578 -1.504 -7.457 1.00 . A A . 32 ASN HD21 1 1 4 1985 1 1 32 ASN HD22 H -0.718 -2.335 -8.241 1.00 . A A . 32 ASN HD22 1 1 4 1986 1 1 32 ASN N N 0.145 -1.986 -2.732 1.00 . A A . 32 ASN N 1 1 4 1987 1 1 32 ASN ND2 N -0.279 -1.979 -7.441 1.00 . A A . 32 ASN ND2 1 1 4 1988 1 1 32 ASN O O 2.451 -3.231 -3.464 1.00 . A A . 32 ASN O 1 1 4 1989 1 1 32 ASN OD1 O -1.956 -2.736 -6.154 1.00 . A A . 32 ASN OD1 1 1 4 1990 1 1 33 ARG C C 4.070 -3.071 -6.104 1.00 . A A . 33 ARG C 1 1 4 1991 1 1 33 ARG CA C 3.005 -4.136 -6.053 1.00 . A A . 33 ARG CA 1 1 4 1992 1 1 33 ARG CB C 2.813 -4.740 -7.445 1.00 . A A . 33 ARG CB 1 1 4 1993 1 1 33 ARG CD C 2.127 -7.041 -6.705 1.00 . A A . 33 ARG CD 1 1 4 1994 1 1 33 ARG CG C 1.732 -5.807 -7.502 1.00 . A A . 33 ARG CG 1 1 4 1995 1 1 33 ARG CZ C 0.974 -8.775 -5.388 1.00 . A A . 33 ARG CZ 1 1 4 1996 1 1 33 ARG H H 0.992 -3.508 -6.185 1.00 . A A . 33 ARG H 1 1 4 1997 1 1 33 ARG HA H 3.351 -4.907 -5.388 1.00 . A A . 33 ARG HA 1 1 4 1998 1 1 33 ARG HB2 H 2.545 -3.950 -8.132 1.00 . A A . 33 ARG HB2 1 1 4 1999 1 1 33 ARG HB3 H 3.744 -5.183 -7.765 1.00 . A A . 33 ARG HB3 1 1 4 2000 1 1 33 ARG HD2 H 2.806 -7.634 -7.297 1.00 . A A . 33 ARG HD2 1 1 4 2001 1 1 33 ARG HD3 H 2.622 -6.724 -5.798 1.00 . A A . 33 ARG HD3 1 1 4 2002 1 1 33 ARG HE H 0.141 -7.713 -6.858 1.00 . A A . 33 ARG HE 1 1 4 2003 1 1 33 ARG HG2 H 0.819 -5.403 -7.093 1.00 . A A . 33 ARG HG2 1 1 4 2004 1 1 33 ARG HG3 H 1.574 -6.091 -8.532 1.00 . A A . 33 ARG HG3 1 1 4 2005 1 1 33 ARG HH11 H 2.905 -8.474 -4.868 1.00 . A A . 33 ARG HH11 1 1 4 2006 1 1 33 ARG HH12 H 2.072 -9.689 -3.958 1.00 . A A . 33 ARG HH12 1 1 4 2007 1 1 33 ARG HH21 H -0.956 -9.310 -5.662 1.00 . A A . 33 ARG HH21 1 1 4 2008 1 1 33 ARG HH22 H -0.119 -10.164 -4.408 1.00 . A A . 33 ARG HH22 1 1 4 2009 1 1 33 ARG N N 1.745 -3.586 -5.569 1.00 . A A . 33 ARG N 1 1 4 2010 1 1 33 ARG NE N 0.968 -7.857 -6.351 1.00 . A A . 33 ARG NE 1 1 4 2011 1 1 33 ARG NH1 N 2.074 -8.998 -4.680 1.00 . A A . 33 ARG NH1 1 1 4 2012 1 1 33 ARG NH2 N -0.124 -9.475 -5.131 1.00 . A A . 33 ARG NH2 1 1 4 2013 1 1 33 ARG O O 3.809 -1.882 -5.920 1.00 . A A . 33 ARG O 1 1 4 2014 1 1 34 CYS C C 6.584 -1.692 -5.399 1.00 . A A . 34 CYS C 1 1 4 2015 1 1 34 CYS CA C 6.418 -2.696 -6.544 1.00 . A A . 34 CYS CA 1 1 4 2016 1 1 34 CYS CB C 6.258 -2.047 -7.886 1.00 . A A . 34 CYS CB 1 1 4 2017 1 1 34 CYS H H 5.351 -4.462 -6.588 1.00 . A A . 34 CYS H 1 1 4 2018 1 1 34 CYS HA H 7.286 -3.335 -6.572 1.00 . A A . 34 CYS HA 1 1 4 2019 1 1 34 CYS HB2 H 6.841 -2.610 -8.583 1.00 . A A . 34 CYS HB2 1 1 4 2020 1 1 34 CYS HB3 H 5.219 -2.144 -8.157 1.00 . A A . 34 CYS HB3 1 1 4 2021 1 1 34 CYS N N 5.262 -3.531 -6.401 1.00 . A A . 34 CYS N 1 1 4 2022 1 1 34 CYS O O 5.674 -1.591 -4.553 1.00 . A A . 34 CYS O 1 1 4 2023 1 1 34 CYS OXT O 7.641 -1.028 -5.356 1.00 . A A . 34 CYS OXT 1 1 4 2024 1 1 34 CYS SG S 6.727 -0.280 -8.005 1.00 . A A . 34 CYS SG 1 1 5 2025 1 1 1 VAL C C -6.589 2.037 -5.667 1.00 . A A . 1 VAL C 1 1 5 2026 1 1 1 VAL CA C -6.977 0.662 -6.199 1.00 . A A . 1 VAL CA 1 1 5 2027 1 1 1 VAL CB C -6.264 0.428 -7.543 1.00 . A A . 1 VAL CB 1 1 5 2028 1 1 1 VAL CG1 C -6.448 -1.010 -8.004 1.00 . A A . 1 VAL CG1 1 1 5 2029 1 1 1 VAL CG2 C -6.776 1.401 -8.595 1.00 . A A . 1 VAL CG2 1 1 5 2030 1 1 1 VAL H1 H -8.785 1.350 -6.900 1.00 . A A . 1 VAL H1 1 1 5 2031 1 1 1 VAL H2 H -8.863 0.546 -5.386 1.00 . A A . 1 VAL H2 1 1 5 2032 1 1 1 VAL H3 H -8.650 -0.357 -6.830 1.00 . A A . 1 VAL H3 1 1 5 2033 1 1 1 VAL HA H -6.640 -0.091 -5.500 1.00 . A A . 1 VAL HA 1 1 5 2034 1 1 1 VAL HB H -5.208 0.605 -7.404 1.00 . A A . 1 VAL HB 1 1 5 2035 1 1 1 VAL HG11 H -7.485 -1.182 -8.246 1.00 . A A . 1 VAL HG11 1 1 5 2036 1 1 1 VAL HG12 H -6.147 -1.682 -7.213 1.00 . A A . 1 VAL HG12 1 1 5 2037 1 1 1 VAL HG13 H -5.838 -1.189 -8.878 1.00 . A A . 1 VAL HG13 1 1 5 2038 1 1 1 VAL HG21 H -7.837 1.256 -8.733 1.00 . A A . 1 VAL HG21 1 1 5 2039 1 1 1 VAL HG22 H -6.263 1.224 -9.530 1.00 . A A . 1 VAL HG22 1 1 5 2040 1 1 1 VAL HG23 H -6.590 2.413 -8.269 1.00 . A A . 1 VAL HG23 1 1 5 2041 1 1 1 VAL N N -8.452 0.539 -6.342 1.00 . A A . 1 VAL N 1 1 5 2042 1 1 1 VAL O O -7.154 3.051 -6.073 1.00 . A A . 1 VAL O 1 1 5 2043 1 1 2 SER C C -6.268 3.989 -3.374 1.00 . A A . 2 SER C 1 1 5 2044 1 1 2 SER CA C -5.156 3.313 -4.168 1.00 . A A . 2 SER CA 1 1 5 2045 1 1 2 SER CB C -4.643 4.257 -5.258 1.00 . A A . 2 SER CB 1 1 5 2046 1 1 2 SER H H -5.210 1.218 -4.474 1.00 . A A . 2 SER H 1 1 5 2047 1 1 2 SER HA H -4.343 3.080 -3.496 1.00 . A A . 2 SER HA 1 1 5 2048 1 1 2 SER HB2 H -5.482 4.753 -5.723 1.00 . A A . 2 SER HB2 1 1 5 2049 1 1 2 SER HB3 H -3.990 4.993 -4.814 1.00 . A A . 2 SER HB3 1 1 5 2050 1 1 2 SER HG H -3.552 4.167 -6.882 1.00 . A A . 2 SER HG 1 1 5 2051 1 1 2 SER N N -5.621 2.062 -4.756 1.00 . A A . 2 SER N 1 1 5 2052 1 1 2 SER O O -7.426 3.995 -3.791 1.00 . A A . 2 SER O 1 1 5 2053 1 1 2 SER OG O -3.925 3.547 -6.252 1.00 . A A . 2 SER OG 1 1 5 2054 1 1 3 CYS C C -6.551 6.721 -1.256 1.00 . A A . 3 CYS C 1 1 5 2055 1 1 3 CYS CA C -6.876 5.237 -1.375 1.00 . A A . 3 CYS CA 1 1 5 2056 1 1 3 CYS CB C -6.900 4.602 0.017 1.00 . A A . 3 CYS CB 1 1 5 2057 1 1 3 CYS H H -4.970 4.519 -1.950 1.00 . A A . 3 CYS H 1 1 5 2058 1 1 3 CYS HA H -7.851 5.129 -1.826 1.00 . A A . 3 CYS HA 1 1 5 2059 1 1 3 CYS HB2 H -6.027 4.924 0.565 1.00 . A A . 3 CYS HB2 1 1 5 2060 1 1 3 CYS HB3 H -7.786 4.933 0.540 1.00 . A A . 3 CYS HB3 1 1 5 2061 1 1 3 CYS N N -5.908 4.557 -2.229 1.00 . A A . 3 CYS N 1 1 5 2062 1 1 3 CYS O O -5.504 7.178 -1.712 1.00 . A A . 3 CYS O 1 1 5 2063 1 1 3 CYS SG S -6.907 2.780 0.011 1.00 . A A . 3 CYS SG 1 1 5 2064 1 1 4 THR C C -7.727 9.315 0.951 1.00 . A A . 4 THR C 1 1 5 2065 1 1 4 THR CA C -7.272 8.899 -0.443 1.00 . A A . 4 THR CA 1 1 5 2066 1 1 4 THR CB C -8.049 9.682 -1.502 1.00 . A A . 4 THR CB 1 1 5 2067 1 1 4 THR CG2 C -7.357 9.717 -2.848 1.00 . A A . 4 THR CG2 1 1 5 2068 1 1 4 THR H H -8.269 7.041 -0.289 1.00 . A A . 4 THR H 1 1 5 2069 1 1 4 THR HA H -6.219 9.115 -0.546 1.00 . A A . 4 THR HA 1 1 5 2070 1 1 4 THR HB H -8.169 10.702 -1.166 1.00 . A A . 4 THR HB 1 1 5 2071 1 1 4 THR HG1 H -9.739 8.944 -0.843 1.00 . A A . 4 THR HG1 1 1 5 2072 1 1 4 THR HG21 H -7.120 10.739 -3.105 1.00 . A A . 4 THR HG21 1 1 5 2073 1 1 4 THR HG22 H -8.010 9.298 -3.600 1.00 . A A . 4 THR HG22 1 1 5 2074 1 1 4 THR HG23 H -6.446 9.138 -2.800 1.00 . A A . 4 THR HG23 1 1 5 2075 1 1 4 THR N N -7.457 7.466 -0.634 1.00 . A A . 4 THR N 1 1 5 2076 1 1 4 THR O O -8.190 10.436 1.157 1.00 . A A . 4 THR O 1 1 5 2077 1 1 4 THR OG1 O -9.336 9.123 -1.697 1.00 . A A . 4 THR OG1 1 1 5 2078 1 1 5 GLY C C -6.982 9.518 4.018 1.00 . A A . 5 GLY C 1 1 5 2079 1 1 5 GLY CA C -7.999 8.681 3.269 1.00 . A A . 5 GLY CA 1 1 5 2080 1 1 5 GLY H H -7.221 7.521 1.680 1.00 . A A . 5 GLY H 1 1 5 2081 1 1 5 GLY HA2 H -8.940 9.210 3.251 1.00 . A A . 5 GLY HA2 1 1 5 2082 1 1 5 GLY HA3 H -8.134 7.746 3.793 1.00 . A A . 5 GLY HA3 1 1 5 2083 1 1 5 GLY N N -7.594 8.398 1.905 1.00 . A A . 5 GLY N 1 1 5 2084 1 1 5 GLY O O -6.617 10.608 3.575 1.00 . A A . 5 GLY O 1 1 5 2085 1 1 6 SER C C -4.903 8.782 7.006 1.00 . A A . 6 SER C 1 1 5 2086 1 1 6 SER CA C -5.554 9.721 5.979 1.00 . A A . 6 SER CA 1 1 5 2087 1 1 6 SER CB C -6.231 10.907 6.676 1.00 . A A . 6 SER CB 1 1 5 2088 1 1 6 SER H H -6.862 8.141 5.459 1.00 . A A . 6 SER H 1 1 5 2089 1 1 6 SER HA H -4.784 10.098 5.323 1.00 . A A . 6 SER HA 1 1 5 2090 1 1 6 SER HB2 H -6.814 10.546 7.511 1.00 . A A . 6 SER HB2 1 1 5 2091 1 1 6 SER HB3 H -5.475 11.590 7.034 1.00 . A A . 6 SER HB3 1 1 5 2092 1 1 6 SER HG H -7.998 11.523 6.094 1.00 . A A . 6 SER HG 1 1 5 2093 1 1 6 SER N N -6.529 9.010 5.160 1.00 . A A . 6 SER N 1 1 5 2094 1 1 6 SER O O -4.552 7.650 6.680 1.00 . A A . 6 SER O 1 1 5 2095 1 1 6 SER OG O -7.090 11.601 5.788 1.00 . A A . 6 SER OG 1 1 5 2096 1 1 7 LYS C C -2.845 7.800 8.869 1.00 . A A . 7 LYS C 1 1 5 2097 1 1 7 LYS CA C -4.120 8.505 9.322 1.00 . A A . 7 LYS CA 1 1 5 2098 1 1 7 LYS CB C -5.115 7.510 9.932 1.00 . A A . 7 LYS CB 1 1 5 2099 1 1 7 LYS CD C -6.800 6.026 8.799 1.00 . A A . 7 LYS CD 1 1 5 2100 1 1 7 LYS CE C -7.064 6.117 7.308 1.00 . A A . 7 LYS CE 1 1 5 2101 1 1 7 LYS CG C -5.327 6.240 9.122 1.00 . A A . 7 LYS CG 1 1 5 2102 1 1 7 LYS H H -5.022 10.182 8.422 1.00 . A A . 7 LYS H 1 1 5 2103 1 1 7 LYS HA H -3.846 9.217 10.087 1.00 . A A . 7 LYS HA 1 1 5 2104 1 1 7 LYS HB2 H -4.759 7.224 10.910 1.00 . A A . 7 LYS HB2 1 1 5 2105 1 1 7 LYS HB3 H -6.069 8.005 10.043 1.00 . A A . 7 LYS HB3 1 1 5 2106 1 1 7 LYS HD2 H -7.097 5.049 9.148 1.00 . A A . 7 LYS HD2 1 1 5 2107 1 1 7 LYS HD3 H -7.382 6.784 9.304 1.00 . A A . 7 LYS HD3 1 1 5 2108 1 1 7 LYS HE2 H -8.129 6.067 7.139 1.00 . A A . 7 LYS HE2 1 1 5 2109 1 1 7 LYS HE3 H -6.686 7.062 6.949 1.00 . A A . 7 LYS HE3 1 1 5 2110 1 1 7 LYS HG2 H -4.771 6.310 8.202 1.00 . A A . 7 LYS HG2 1 1 5 2111 1 1 7 LYS HG3 H -4.970 5.397 9.696 1.00 . A A . 7 LYS HG3 1 1 5 2112 1 1 7 LYS HZ1 H -6.281 5.280 5.562 1.00 . A A . 7 LYS HZ1 1 1 5 2113 1 1 7 LYS HZ2 H -6.979 4.151 6.609 1.00 . A A . 7 LYS HZ2 1 1 5 2114 1 1 7 LYS HZ3 H -5.467 4.817 6.970 1.00 . A A . 7 LYS HZ3 1 1 5 2115 1 1 7 LYS N N -4.734 9.271 8.237 1.00 . A A . 7 LYS N 1 1 5 2116 1 1 7 LYS NZ N -6.402 5.014 6.560 1.00 . A A . 7 LYS NZ 1 1 5 2117 1 1 7 LYS O O -2.485 6.749 9.397 1.00 . A A . 7 LYS O 1 1 5 2118 1 1 8 ASP C C -1.097 6.422 6.907 1.00 . A A . 8 ASP C 1 1 5 2119 1 1 8 ASP CA C -0.929 7.861 7.343 1.00 . A A . 8 ASP CA 1 1 5 2120 1 1 8 ASP CB C 0.222 7.994 8.346 1.00 . A A . 8 ASP CB 1 1 5 2121 1 1 8 ASP CG C 0.022 7.178 9.608 1.00 . A A . 8 ASP CG 1 1 5 2122 1 1 8 ASP H H -2.528 9.220 7.504 1.00 . A A . 8 ASP H 1 1 5 2123 1 1 8 ASP HA H -0.687 8.448 6.469 1.00 . A A . 8 ASP HA 1 1 5 2124 1 1 8 ASP HB2 H 1.133 7.665 7.872 1.00 . A A . 8 ASP HB2 1 1 5 2125 1 1 8 ASP HB3 H 0.324 9.031 8.623 1.00 . A A . 8 ASP HB3 1 1 5 2126 1 1 8 ASP N N -2.172 8.396 7.885 1.00 . A A . 8 ASP N 1 1 5 2127 1 1 8 ASP O O -0.432 5.515 7.403 1.00 . A A . 8 ASP O 1 1 5 2128 1 1 8 ASP OD1 O 0.448 6.004 9.631 1.00 . A A . 8 ASP OD1 1 1 5 2129 1 1 8 ASP OD2 O -0.555 7.715 10.576 1.00 . A A . 8 ASP OD2 1 1 5 2130 1 1 9 CYS C C -1.327 4.570 4.284 1.00 . A A . 9 CYS C 1 1 5 2131 1 1 9 CYS CA C -2.275 4.906 5.426 1.00 . A A . 9 CYS CA 1 1 5 2132 1 1 9 CYS CB C -3.714 4.808 4.947 1.00 . A A . 9 CYS CB 1 1 5 2133 1 1 9 CYS H H -2.490 7.016 5.626 1.00 . A A . 9 CYS H 1 1 5 2134 1 1 9 CYS HA H -2.130 4.200 6.207 1.00 . A A . 9 CYS HA 1 1 5 2135 1 1 9 CYS HB2 H -4.309 5.513 5.499 1.00 . A A . 9 CYS HB2 1 1 5 2136 1 1 9 CYS HB3 H -3.746 5.054 3.903 1.00 . A A . 9 CYS HB3 1 1 5 2137 1 1 9 CYS N N -1.999 6.234 5.966 1.00 . A A . 9 CYS N 1 1 5 2138 1 1 9 CYS O O -0.479 3.687 4.402 1.00 . A A . 9 CYS O 1 1 5 2139 1 1 9 CYS SG S -4.470 3.161 5.155 1.00 . A A . 9 CYS SG 1 1 5 2140 1 1 10 TYR C C 0.815 5.434 2.296 1.00 . A A . 10 TYR C 1 1 5 2141 1 1 10 TYR CA C -0.646 5.085 2.007 1.00 . A A . 10 TYR CA 1 1 5 2142 1 1 10 TYR CB C -1.163 5.963 0.862 1.00 . A A . 10 TYR CB 1 1 5 2143 1 1 10 TYR CD1 C -1.938 3.932 -0.434 1.00 . A A . 10 TYR CD1 1 1 5 2144 1 1 10 TYR CD2 C -1.168 5.830 -1.654 1.00 . A A . 10 TYR CD2 1 1 5 2145 1 1 10 TYR CE1 C -2.186 3.267 -1.620 1.00 . A A . 10 TYR CE1 1 1 5 2146 1 1 10 TYR CE2 C -1.412 5.171 -2.843 1.00 . A A . 10 TYR CE2 1 1 5 2147 1 1 10 TYR CG C -1.425 5.223 -0.431 1.00 . A A . 10 TYR CG 1 1 5 2148 1 1 10 TYR CZ C -1.921 3.890 -2.821 1.00 . A A . 10 TYR CZ 1 1 5 2149 1 1 10 TYR H H -2.175 5.978 3.159 1.00 . A A . 10 TYR H 1 1 5 2150 1 1 10 TYR HA H -0.712 4.049 1.719 1.00 . A A . 10 TYR HA 1 1 5 2151 1 1 10 TYR HB2 H -2.091 6.423 1.168 1.00 . A A . 10 TYR HB2 1 1 5 2152 1 1 10 TYR HB3 H -0.438 6.738 0.658 1.00 . A A . 10 TYR HB3 1 1 5 2153 1 1 10 TYR HD1 H -2.144 3.446 0.508 1.00 . A A . 10 TYR HD1 1 1 5 2154 1 1 10 TYR HD2 H -0.769 6.833 -1.668 1.00 . A A . 10 TYR HD2 1 1 5 2155 1 1 10 TYR HE1 H -2.584 2.262 -1.603 1.00 . A A . 10 TYR HE1 1 1 5 2156 1 1 10 TYR HE2 H -1.204 5.661 -3.783 1.00 . A A . 10 TYR HE2 1 1 5 2157 1 1 10 TYR HH H -1.799 3.729 -4.738 1.00 . A A . 10 TYR HH 1 1 5 2158 1 1 10 TYR N N -1.480 5.288 3.183 1.00 . A A . 10 TYR N 1 1 5 2159 1 1 10 TYR O O 1.703 5.102 1.515 1.00 . A A . 10 TYR O 1 1 5 2160 1 1 10 TYR OH O -2.172 3.231 -4.006 1.00 . A A . 10 TYR OH 1 1 5 2161 1 1 11 ALA C C 3.305 5.384 4.201 1.00 . A A . 11 ALA C 1 1 5 2162 1 1 11 ALA CA C 2.412 6.546 3.764 1.00 . A A . 11 ALA CA 1 1 5 2163 1 1 11 ALA CB C 2.370 7.624 4.837 1.00 . A A . 11 ALA CB 1 1 5 2164 1 1 11 ALA H H 0.305 6.382 3.989 1.00 . A A . 11 ALA H 1 1 5 2165 1 1 11 ALA HA H 2.850 6.983 2.879 1.00 . A A . 11 ALA HA 1 1 5 2166 1 1 11 ALA HB1 H 2.303 8.595 4.369 1.00 . A A . 11 ALA HB1 1 1 5 2167 1 1 11 ALA HB2 H 3.268 7.573 5.434 1.00 . A A . 11 ALA HB2 1 1 5 2168 1 1 11 ALA HB3 H 1.507 7.469 5.468 1.00 . A A . 11 ALA HB3 1 1 5 2169 1 1 11 ALA N N 1.056 6.130 3.406 1.00 . A A . 11 ALA N 1 1 5 2170 1 1 11 ALA O O 4.241 5.016 3.492 1.00 . A A . 11 ALA O 1 1 5 2171 1 1 12 PRO C C 4.088 2.601 4.874 1.00 . A A . 12 PRO C 1 1 5 2172 1 1 12 PRO CA C 3.838 3.684 5.912 1.00 . A A . 12 PRO CA 1 1 5 2173 1 1 12 PRO CB C 2.984 3.135 7.068 1.00 . A A . 12 PRO CB 1 1 5 2174 1 1 12 PRO CD C 1.962 5.156 6.300 1.00 . A A . 12 PRO CD 1 1 5 2175 1 1 12 PRO CG C 1.673 3.848 6.973 1.00 . A A . 12 PRO CG 1 1 5 2176 1 1 12 PRO HA H 4.785 4.030 6.298 1.00 . A A . 12 PRO HA 1 1 5 2177 1 1 12 PRO HB2 H 2.859 2.069 6.950 1.00 . A A . 12 PRO HB2 1 1 5 2178 1 1 12 PRO HB3 H 3.474 3.341 8.007 1.00 . A A . 12 PRO HB3 1 1 5 2179 1 1 12 PRO HD2 H 1.094 5.508 5.763 1.00 . A A . 12 PRO HD2 1 1 5 2180 1 1 12 PRO HD3 H 2.292 5.891 7.019 1.00 . A A . 12 PRO HD3 1 1 5 2181 1 1 12 PRO HG2 H 0.981 3.267 6.383 1.00 . A A . 12 PRO HG2 1 1 5 2182 1 1 12 PRO HG3 H 1.275 4.016 7.962 1.00 . A A . 12 PRO HG3 1 1 5 2183 1 1 12 PRO N N 3.043 4.795 5.382 1.00 . A A . 12 PRO N 1 1 5 2184 1 1 12 PRO O O 5.073 1.866 4.951 1.00 . A A . 12 PRO O 1 1 5 2185 1 1 13 CYS C C 4.022 2.049 1.632 1.00 . A A . 13 CYS C 1 1 5 2186 1 1 13 CYS CA C 3.307 1.502 2.859 1.00 . A A . 13 CYS CA 1 1 5 2187 1 1 13 CYS CB C 1.936 0.978 2.476 1.00 . A A . 13 CYS CB 1 1 5 2188 1 1 13 CYS H H 2.418 3.110 3.904 1.00 . A A . 13 CYS H 1 1 5 2189 1 1 13 CYS HA H 3.879 0.688 3.247 1.00 . A A . 13 CYS HA 1 1 5 2190 1 1 13 CYS HB2 H 1.195 1.534 3.017 1.00 . A A . 13 CYS HB2 1 1 5 2191 1 1 13 CYS HB3 H 1.794 1.122 1.425 1.00 . A A . 13 CYS HB3 1 1 5 2192 1 1 13 CYS N N 3.187 2.501 3.907 1.00 . A A . 13 CYS N 1 1 5 2193 1 1 13 CYS O O 4.938 1.415 1.115 1.00 . A A . 13 CYS O 1 1 5 2194 1 1 13 CYS SG S 1.677 -0.789 2.843 1.00 . A A . 13 CYS SG 1 1 5 2195 1 1 14 ARG C C 5.733 3.830 0.106 1.00 . A A . 14 ARG C 1 1 5 2196 1 1 14 ARG CA C 4.219 3.810 -0.026 1.00 . A A . 14 ARG CA 1 1 5 2197 1 1 14 ARG CB C 3.686 5.221 -0.277 1.00 . A A . 14 ARG CB 1 1 5 2198 1 1 14 ARG CD C 4.945 7.272 -1.013 1.00 . A A . 14 ARG CD 1 1 5 2199 1 1 14 ARG CG C 4.361 5.935 -1.440 1.00 . A A . 14 ARG CG 1 1 5 2200 1 1 14 ARG CZ C 3.009 8.774 -1.280 1.00 . A A . 14 ARG CZ 1 1 5 2201 1 1 14 ARG H H 2.864 3.688 1.594 1.00 . A A . 14 ARG H 1 1 5 2202 1 1 14 ARG HA H 3.962 3.181 -0.861 1.00 . A A . 14 ARG HA 1 1 5 2203 1 1 14 ARG HB2 H 2.629 5.158 -0.490 1.00 . A A . 14 ARG HB2 1 1 5 2204 1 1 14 ARG HB3 H 3.830 5.812 0.615 1.00 . A A . 14 ARG HB3 1 1 5 2205 1 1 14 ARG HD2 H 5.674 7.101 -0.235 1.00 . A A . 14 ARG HD2 1 1 5 2206 1 1 14 ARG HD3 H 5.429 7.727 -1.865 1.00 . A A . 14 ARG HD3 1 1 5 2207 1 1 14 ARG HE H 3.907 8.362 0.454 1.00 . A A . 14 ARG HE 1 1 5 2208 1 1 14 ARG HG2 H 5.156 5.311 -1.818 1.00 . A A . 14 ARG HG2 1 1 5 2209 1 1 14 ARG HG3 H 3.631 6.102 -2.218 1.00 . A A . 14 ARG HG3 1 1 5 2210 1 1 14 ARG HH11 H 3.668 7.942 -3.002 1.00 . A A . 14 ARG HH11 1 1 5 2211 1 1 14 ARG HH12 H 2.307 9.002 -3.162 1.00 . A A . 14 ARG HH12 1 1 5 2212 1 1 14 ARG HH21 H 2.117 9.755 0.246 1.00 . A A . 14 ARG HH21 1 1 5 2213 1 1 14 ARG HH22 H 1.427 10.031 -1.319 1.00 . A A . 14 ARG HH22 1 1 5 2214 1 1 14 ARG N N 3.602 3.220 1.154 1.00 . A A . 14 ARG N 1 1 5 2215 1 1 14 ARG NE N 3.919 8.182 -0.509 1.00 . A A . 14 ARG NE 1 1 5 2216 1 1 14 ARG NH1 N 2.994 8.554 -2.589 1.00 . A A . 14 ARG NH1 1 1 5 2217 1 1 14 ARG NH2 N 2.111 9.586 -0.740 1.00 . A A . 14 ARG NH2 1 1 5 2218 1 1 14 ARG O O 6.452 3.710 -0.884 1.00 . A A . 14 ARG O 1 1 5 2219 1 1 15 LYS C C 8.221 2.607 1.162 1.00 . A A . 15 LYS C 1 1 5 2220 1 1 15 LYS CA C 7.648 3.957 1.571 1.00 . A A . 15 LYS CA 1 1 5 2221 1 1 15 LYS CB C 7.949 4.240 3.045 1.00 . A A . 15 LYS CB 1 1 5 2222 1 1 15 LYS CD C 10.270 5.079 2.572 1.00 . A A . 15 LYS CD 1 1 5 2223 1 1 15 LYS CE C 10.869 6.336 1.963 1.00 . A A . 15 LYS CE 1 1 5 2224 1 1 15 LYS CG C 8.943 5.369 3.256 1.00 . A A . 15 LYS CG 1 1 5 2225 1 1 15 LYS H H 5.599 4.029 2.091 1.00 . A A . 15 LYS H 1 1 5 2226 1 1 15 LYS HA H 8.090 4.729 0.960 1.00 . A A . 15 LYS HA 1 1 5 2227 1 1 15 LYS HB2 H 7.027 4.502 3.544 1.00 . A A . 15 LYS HB2 1 1 5 2228 1 1 15 LYS HB3 H 8.351 3.346 3.498 1.00 . A A . 15 LYS HB3 1 1 5 2229 1 1 15 LYS HD2 H 10.959 4.681 3.301 1.00 . A A . 15 LYS HD2 1 1 5 2230 1 1 15 LYS HD3 H 10.107 4.352 1.790 1.00 . A A . 15 LYS HD3 1 1 5 2231 1 1 15 LYS HE2 H 11.889 6.131 1.676 1.00 . A A . 15 LYS HE2 1 1 5 2232 1 1 15 LYS HE3 H 10.296 6.604 1.086 1.00 . A A . 15 LYS HE3 1 1 5 2233 1 1 15 LYS HG2 H 8.532 6.280 2.848 1.00 . A A . 15 LYS HG2 1 1 5 2234 1 1 15 LYS HG3 H 9.114 5.493 4.316 1.00 . A A . 15 LYS HG3 1 1 5 2235 1 1 15 LYS HZ1 H 9.875 7.738 3.150 1.00 . A A . 15 LYS HZ1 1 1 5 2236 1 1 15 LYS HZ2 H 11.330 8.302 2.499 1.00 . A A . 15 LYS HZ2 1 1 5 2237 1 1 15 LYS HZ3 H 11.349 7.216 3.795 1.00 . A A . 15 LYS HZ3 1 1 5 2238 1 1 15 LYS N N 6.216 3.956 1.333 1.00 . A A . 15 LYS N 1 1 5 2239 1 1 15 LYS NZ N 10.855 7.478 2.918 1.00 . A A . 15 LYS NZ 1 1 5 2240 1 1 15 LYS O O 9.224 2.530 0.452 1.00 . A A . 15 LYS O 1 1 5 2241 1 1 16 GLN C C 7.718 -0.157 -0.176 1.00 . A A . 16 GLN C 1 1 5 2242 1 1 16 GLN CA C 7.977 0.187 1.292 1.00 . A A . 16 GLN CA 1 1 5 2243 1 1 16 GLN CB C 7.251 -0.813 2.194 1.00 . A A . 16 GLN CB 1 1 5 2244 1 1 16 GLN CD C 7.461 -1.604 4.583 1.00 . A A . 16 GLN CD 1 1 5 2245 1 1 16 GLN CG C 7.249 -0.419 3.662 1.00 . A A . 16 GLN CG 1 1 5 2246 1 1 16 GLN H H 6.757 1.677 2.164 1.00 . A A . 16 GLN H 1 1 5 2247 1 1 16 GLN HA H 9.037 0.117 1.482 1.00 . A A . 16 GLN HA 1 1 5 2248 1 1 16 GLN HB2 H 6.225 -0.897 1.865 1.00 . A A . 16 GLN HB2 1 1 5 2249 1 1 16 GLN HB3 H 7.730 -1.777 2.102 1.00 . A A . 16 GLN HB3 1 1 5 2250 1 1 16 GLN HE21 H 8.851 -0.604 5.592 1.00 . A A . 16 GLN HE21 1 1 5 2251 1 1 16 GLN HE22 H 8.529 -2.207 6.147 1.00 . A A . 16 GLN HE22 1 1 5 2252 1 1 16 GLN HG2 H 8.043 0.294 3.831 1.00 . A A . 16 GLN HG2 1 1 5 2253 1 1 16 GLN HG3 H 6.300 0.037 3.898 1.00 . A A . 16 GLN HG3 1 1 5 2254 1 1 16 GLN N N 7.559 1.544 1.610 1.00 . A A . 16 GLN N 1 1 5 2255 1 1 16 GLN NE2 N 8.372 -1.457 5.537 1.00 . A A . 16 GLN NE2 1 1 5 2256 1 1 16 GLN O O 8.634 -0.535 -0.905 1.00 . A A . 16 GLN O 1 1 5 2257 1 1 16 GLN OE1 O 6.813 -2.641 4.440 1.00 . A A . 16 GLN OE1 1 1 5 2258 1 1 17 THR C C 6.577 0.638 -2.976 1.00 . A A . 17 THR C 1 1 5 2259 1 1 17 THR CA C 6.069 -0.378 -1.964 1.00 . A A . 17 THR CA 1 1 5 2260 1 1 17 THR CB C 4.546 -0.489 -2.073 1.00 . A A . 17 THR CB 1 1 5 2261 1 1 17 THR CG2 C 3.827 0.829 -1.869 1.00 . A A . 17 THR CG2 1 1 5 2262 1 1 17 THR H H 5.764 0.245 0.035 1.00 . A A . 17 THR H 1 1 5 2263 1 1 17 THR HA H 6.498 -1.334 -2.201 1.00 . A A . 17 THR HA 1 1 5 2264 1 1 17 THR HB H 4.191 -1.180 -1.322 1.00 . A A . 17 THR HB 1 1 5 2265 1 1 17 THR HG1 H 4.324 -1.933 -3.377 1.00 . A A . 17 THR HG1 1 1 5 2266 1 1 17 THR HG21 H 2.763 0.679 -1.968 1.00 . A A . 17 THR HG21 1 1 5 2267 1 1 17 THR HG22 H 4.157 1.539 -2.612 1.00 . A A . 17 THR HG22 1 1 5 2268 1 1 17 THR HG23 H 4.046 1.211 -0.885 1.00 . A A . 17 THR HG23 1 1 5 2269 1 1 17 THR N N 6.456 -0.050 -0.595 1.00 . A A . 17 THR N 1 1 5 2270 1 1 17 THR O O 7.096 0.274 -4.030 1.00 . A A . 17 THR O 1 1 5 2271 1 1 17 THR OG1 O 4.173 -0.985 -3.346 1.00 . A A . 17 THR OG1 1 1 5 2272 1 1 18 GLY C C 5.700 3.236 -4.582 1.00 . A A . 18 GLY C 1 1 5 2273 1 1 18 GLY CA C 6.790 2.954 -3.567 1.00 . A A . 18 GLY CA 1 1 5 2274 1 1 18 GLY H H 5.952 2.134 -1.831 1.00 . A A . 18 GLY H 1 1 5 2275 1 1 18 GLY HA2 H 6.997 3.853 -3.004 1.00 . A A . 18 GLY HA2 1 1 5 2276 1 1 18 GLY HA3 H 7.678 2.644 -4.078 1.00 . A A . 18 GLY HA3 1 1 5 2277 1 1 18 GLY N N 6.389 1.908 -2.666 1.00 . A A . 18 GLY N 1 1 5 2278 1 1 18 GLY O O 4.560 2.819 -4.387 1.00 . A A . 18 GLY O 1 1 5 2279 1 1 19 CYS C C 3.736 4.752 -6.152 1.00 . A A . 19 CYS C 1 1 5 2280 1 1 19 CYS CA C 5.078 4.267 -6.718 1.00 . A A . 19 CYS CA 1 1 5 2281 1 1 19 CYS CB C 4.874 3.096 -7.661 1.00 . A A . 19 CYS CB 1 1 5 2282 1 1 19 CYS H H 6.971 4.233 -5.760 1.00 . A A . 19 CYS H 1 1 5 2283 1 1 19 CYS HA H 5.504 5.059 -7.300 1.00 . A A . 19 CYS HA 1 1 5 2284 1 1 19 CYS HB2 H 3.996 3.284 -8.248 1.00 . A A . 19 CYS HB2 1 1 5 2285 1 1 19 CYS HB3 H 5.727 3.057 -8.312 1.00 . A A . 19 CYS HB3 1 1 5 2286 1 1 19 CYS N N 6.043 3.933 -5.664 1.00 . A A . 19 CYS N 1 1 5 2287 1 1 19 CYS O O 3.485 4.668 -4.950 1.00 . A A . 19 CYS O 1 1 5 2288 1 1 19 CYS SG S 4.682 1.462 -6.872 1.00 . A A . 19 CYS SG 1 1 5 2289 1 1 20 PRO C C 0.500 4.724 -6.405 1.00 . A A . 20 PRO C 1 1 5 2290 1 1 20 PRO CA C 1.553 5.819 -6.592 1.00 . A A . 20 PRO CA 1 1 5 2291 1 1 20 PRO CB C 1.144 6.753 -7.745 1.00 . A A . 20 PRO CB 1 1 5 2292 1 1 20 PRO CD C 3.063 5.485 -8.447 1.00 . A A . 20 PRO CD 1 1 5 2293 1 1 20 PRO CG C 2.280 6.737 -8.722 1.00 . A A . 20 PRO CG 1 1 5 2294 1 1 20 PRO HA H 1.634 6.390 -5.679 1.00 . A A . 20 PRO HA 1 1 5 2295 1 1 20 PRO HB2 H 0.235 6.388 -8.199 1.00 . A A . 20 PRO HB2 1 1 5 2296 1 1 20 PRO HB3 H 0.978 7.748 -7.358 1.00 . A A . 20 PRO HB3 1 1 5 2297 1 1 20 PRO HD2 H 2.662 4.654 -9.009 1.00 . A A . 20 PRO HD2 1 1 5 2298 1 1 20 PRO HD3 H 4.108 5.632 -8.673 1.00 . A A . 20 PRO HD3 1 1 5 2299 1 1 20 PRO HG2 H 1.896 6.721 -9.731 1.00 . A A . 20 PRO HG2 1 1 5 2300 1 1 20 PRO HG3 H 2.904 7.607 -8.573 1.00 . A A . 20 PRO HG3 1 1 5 2301 1 1 20 PRO N N 2.857 5.299 -7.011 1.00 . A A . 20 PRO N 1 1 5 2302 1 1 20 PRO O O -0.551 4.962 -5.809 1.00 . A A . 20 PRO O 1 1 5 2303 1 1 21 TYR C C -0.263 1.886 -5.412 1.00 . A A . 21 TYR C 1 1 5 2304 1 1 21 TYR CA C -0.148 2.421 -6.839 1.00 . A A . 21 TYR CA 1 1 5 2305 1 1 21 TYR CB C 0.312 1.306 -7.776 1.00 . A A . 21 TYR CB 1 1 5 2306 1 1 21 TYR CD1 C 0.845 2.790 -9.752 1.00 . A A . 21 TYR CD1 1 1 5 2307 1 1 21 TYR CD2 C 2.452 1.149 -9.113 1.00 . A A . 21 TYR CD2 1 1 5 2308 1 1 21 TYR CE1 C 1.669 3.204 -10.781 1.00 . A A . 21 TYR CE1 1 1 5 2309 1 1 21 TYR CE2 C 3.282 1.558 -10.140 1.00 . A A . 21 TYR CE2 1 1 5 2310 1 1 21 TYR CG C 1.221 1.757 -8.903 1.00 . A A . 21 TYR CG 1 1 5 2311 1 1 21 TYR CZ C 2.887 2.584 -10.970 1.00 . A A . 21 TYR CZ 1 1 5 2312 1 1 21 TYR H H 1.610 3.396 -7.407 1.00 . A A . 21 TYR H 1 1 5 2313 1 1 21 TYR HA H -1.118 2.767 -7.161 1.00 . A A . 21 TYR HA 1 1 5 2314 1 1 21 TYR HB2 H 0.842 0.562 -7.206 1.00 . A A . 21 TYR HB2 1 1 5 2315 1 1 21 TYR HB3 H -0.549 0.865 -8.217 1.00 . A A . 21 TYR HB3 1 1 5 2316 1 1 21 TYR HD1 H -0.109 3.273 -9.600 1.00 . A A . 21 TYR HD1 1 1 5 2317 1 1 21 TYR HD2 H 2.759 0.344 -8.462 1.00 . A A . 21 TYR HD2 1 1 5 2318 1 1 21 TYR HE1 H 1.360 4.009 -11.431 1.00 . A A . 21 TYR HE1 1 1 5 2319 1 1 21 TYR HE2 H 4.236 1.072 -10.289 1.00 . A A . 21 TYR HE2 1 1 5 2320 1 1 21 TYR HH H 3.738 3.954 -12.019 1.00 . A A . 21 TYR HH 1 1 5 2321 1 1 21 TYR N N 0.774 3.533 -6.930 1.00 . A A . 21 TYR N 1 1 5 2322 1 1 21 TYR O O 0.569 2.180 -4.554 1.00 . A A . 21 TYR O 1 1 5 2323 1 1 21 TYR OH O 3.711 2.994 -11.994 1.00 . A A . 21 TYR OH 1 1 5 2324 1 1 22 GLY C C -2.740 -0.415 -3.847 1.00 . A A . 22 GLY C 1 1 5 2325 1 1 22 GLY CA C -1.531 0.500 -3.861 1.00 . A A . 22 GLY CA 1 1 5 2326 1 1 22 GLY H H -1.927 0.888 -5.906 1.00 . A A . 22 GLY H 1 1 5 2327 1 1 22 GLY HA2 H -0.662 -0.068 -3.580 1.00 . A A . 22 GLY HA2 1 1 5 2328 1 1 22 GLY HA3 H -1.677 1.287 -3.141 1.00 . A A . 22 GLY HA3 1 1 5 2329 1 1 22 GLY N N -1.305 1.088 -5.174 1.00 . A A . 22 GLY N 1 1 5 2330 1 1 22 GLY O O -3.680 -0.211 -4.615 1.00 . A A . 22 GLY O 1 1 5 2331 1 1 23 LYS C C -4.664 -2.066 -1.609 1.00 . A A . 23 LYS C 1 1 5 2332 1 1 23 LYS CA C -3.864 -2.339 -2.877 1.00 . A A . 23 LYS CA 1 1 5 2333 1 1 23 LYS CB C -3.377 -3.790 -2.893 1.00 . A A . 23 LYS CB 1 1 5 2334 1 1 23 LYS CD C -3.885 -4.768 -5.151 1.00 . A A . 23 LYS CD 1 1 5 2335 1 1 23 LYS CE C -4.594 -5.895 -5.885 1.00 . A A . 23 LYS CE 1 1 5 2336 1 1 23 LYS CG C -4.278 -4.725 -3.683 1.00 . A A . 23 LYS CG 1 1 5 2337 1 1 23 LYS H H -1.977 -1.537 -2.365 1.00 . A A . 23 LYS H 1 1 5 2338 1 1 23 LYS HA H -4.495 -2.169 -3.732 1.00 . A A . 23 LYS HA 1 1 5 2339 1 1 23 LYS HB2 H -2.390 -3.822 -3.329 1.00 . A A . 23 LYS HB2 1 1 5 2340 1 1 23 LYS HB3 H -3.323 -4.151 -1.877 1.00 . A A . 23 LYS HB3 1 1 5 2341 1 1 23 LYS HD2 H -4.151 -3.828 -5.613 1.00 . A A . 23 LYS HD2 1 1 5 2342 1 1 23 LYS HD3 H -2.817 -4.918 -5.223 1.00 . A A . 23 LYS HD3 1 1 5 2343 1 1 23 LYS HE2 H -3.975 -6.779 -5.845 1.00 . A A . 23 LYS HE2 1 1 5 2344 1 1 23 LYS HE3 H -5.534 -6.092 -5.391 1.00 . A A . 23 LYS HE3 1 1 5 2345 1 1 23 LYS HG2 H -4.198 -5.719 -3.271 1.00 . A A . 23 LYS HG2 1 1 5 2346 1 1 23 LYS HG3 H -5.298 -4.380 -3.603 1.00 . A A . 23 LYS HG3 1 1 5 2347 1 1 23 LYS HZ1 H -5.597 -4.823 -7.372 1.00 . A A . 23 LYS HZ1 1 1 5 2348 1 1 23 LYS HZ2 H -5.173 -6.395 -7.828 1.00 . A A . 23 LYS HZ2 1 1 5 2349 1 1 23 LYS HZ3 H -3.989 -5.190 -7.756 1.00 . A A . 23 LYS HZ3 1 1 5 2350 1 1 23 LYS N N -2.737 -1.420 -2.969 1.00 . A A . 23 LYS N 1 1 5 2351 1 1 23 LYS NZ N -4.857 -5.552 -7.310 1.00 . A A . 23 LYS NZ 1 1 5 2352 1 1 23 LYS O O -5.400 -2.925 -1.123 1.00 . A A . 23 LYS O 1 1 5 2353 1 1 24 CYS C C -6.684 -0.354 -0.061 1.00 . A A . 24 CYS C 1 1 5 2354 1 1 24 CYS CA C -5.177 -0.457 0.146 1.00 . A A . 24 CYS CA 1 1 5 2355 1 1 24 CYS CB C -4.613 0.881 0.631 1.00 . A A . 24 CYS CB 1 1 5 2356 1 1 24 CYS H H -3.888 -0.229 -1.505 1.00 . A A . 24 CYS H 1 1 5 2357 1 1 24 CYS HA H -4.983 -1.208 0.896 1.00 . A A . 24 CYS HA 1 1 5 2358 1 1 24 CYS HB2 H -5.011 1.101 1.607 1.00 . A A . 24 CYS HB2 1 1 5 2359 1 1 24 CYS HB3 H -3.538 0.803 0.699 1.00 . A A . 24 CYS HB3 1 1 5 2360 1 1 24 CYS N N -4.496 -0.861 -1.072 1.00 . A A . 24 CYS N 1 1 5 2361 1 1 24 CYS O O -7.153 0.090 -1.110 1.00 . A A . 24 CYS O 1 1 5 2362 1 1 24 CYS SG S -4.994 2.292 -0.459 1.00 . A A . 24 CYS SG 1 1 5 2363 1 1 25 MET C C -9.433 -0.088 2.184 1.00 . A A . 25 MET C 1 1 5 2364 1 1 25 MET CA C -8.888 -0.722 0.914 1.00 . A A . 25 MET CA 1 1 5 2365 1 1 25 MET CB C -9.459 -2.131 0.744 1.00 . A A . 25 MET CB 1 1 5 2366 1 1 25 MET CE C -10.143 -3.520 -2.454 1.00 . A A . 25 MET CE 1 1 5 2367 1 1 25 MET CG C -10.721 -2.179 -0.100 1.00 . A A . 25 MET CG 1 1 5 2368 1 1 25 MET H H -6.991 -1.101 1.761 1.00 . A A . 25 MET H 1 1 5 2369 1 1 25 MET HA H -9.185 -0.115 0.072 1.00 . A A . 25 MET HA 1 1 5 2370 1 1 25 MET HB2 H -8.713 -2.755 0.273 1.00 . A A . 25 MET HB2 1 1 5 2371 1 1 25 MET HB3 H -9.687 -2.534 1.720 1.00 . A A . 25 MET HB3 1 1 5 2372 1 1 25 MET HE1 H -9.759 -4.461 -2.821 1.00 . A A . 25 MET HE1 1 1 5 2373 1 1 25 MET HE2 H -9.326 -2.826 -2.320 1.00 . A A . 25 MET HE2 1 1 5 2374 1 1 25 MET HE3 H -10.844 -3.116 -3.169 1.00 . A A . 25 MET HE3 1 1 5 2375 1 1 25 MET HG2 H -11.570 -1.970 0.535 1.00 . A A . 25 MET HG2 1 1 5 2376 1 1 25 MET HG3 H -10.654 -1.422 -0.868 1.00 . A A . 25 MET HG3 1 1 5 2377 1 1 25 MET N N -7.432 -0.764 0.955 1.00 . A A . 25 MET N 1 1 5 2378 1 1 25 MET O O -8.852 -0.226 3.260 1.00 . A A . 25 MET O 1 1 5 2379 1 1 25 MET SD S -10.970 -3.781 -0.888 1.00 . A A . 25 MET SD 1 1 5 2380 1 1 26 ASN C C -11.277 0.341 4.390 1.00 . A A . 26 ASN C 1 1 5 2381 1 1 26 ASN CA C -11.170 1.285 3.194 1.00 . A A . 26 ASN CA 1 1 5 2382 1 1 26 ASN CB C -12.562 1.818 2.845 1.00 . A A . 26 ASN CB 1 1 5 2383 1 1 26 ASN CG C -12.694 2.246 1.394 1.00 . A A . 26 ASN CG 1 1 5 2384 1 1 26 ASN H H -10.956 0.692 1.164 1.00 . A A . 26 ASN H 1 1 5 2385 1 1 26 ASN HA H -10.538 2.116 3.468 1.00 . A A . 26 ASN HA 1 1 5 2386 1 1 26 ASN HB2 H -13.288 1.047 3.042 1.00 . A A . 26 ASN HB2 1 1 5 2387 1 1 26 ASN HB3 H -12.777 2.672 3.472 1.00 . A A . 26 ASN HB3 1 1 5 2388 1 1 26 ASN HD21 H -12.184 4.107 1.871 1.00 . A A . 26 ASN HD21 1 1 5 2389 1 1 26 ASN HD22 H -12.516 3.825 0.199 1.00 . A A . 26 ASN HD22 1 1 5 2390 1 1 26 ASN N N -10.548 0.616 2.051 1.00 . A A . 26 ASN N 1 1 5 2391 1 1 26 ASN ND2 N -12.439 3.522 1.128 1.00 . A A . 26 ASN ND2 1 1 5 2392 1 1 26 ASN O O -11.845 -0.746 4.291 1.00 . A A . 26 ASN O 1 1 5 2393 1 1 26 ASN OD1 O -13.021 1.438 0.525 1.00 . A A . 26 ASN OD1 1 1 5 2394 1 1 27 ARG C C -9.747 -1.162 6.669 1.00 . A A . 27 ARG C 1 1 5 2395 1 1 27 ARG CA C -10.740 -0.010 6.745 1.00 . A A . 27 ARG CA 1 1 5 2396 1 1 27 ARG CB C -12.147 -0.543 7.030 1.00 . A A . 27 ARG CB 1 1 5 2397 1 1 27 ARG CD C -13.991 0.148 8.594 1.00 . A A . 27 ARG CD 1 1 5 2398 1 1 27 ARG CG C -12.571 -0.385 8.481 1.00 . A A . 27 ARG CG 1 1 5 2399 1 1 27 ARG CZ C -16.250 -0.606 7.962 1.00 . A A . 27 ARG CZ 1 1 5 2400 1 1 27 ARG H H -10.287 1.648 5.516 1.00 . A A . 27 ARG H 1 1 5 2401 1 1 27 ARG HA H -10.444 0.642 7.551 1.00 . A A . 27 ARG HA 1 1 5 2402 1 1 27 ARG HB2 H -12.853 -0.012 6.410 1.00 . A A . 27 ARG HB2 1 1 5 2403 1 1 27 ARG HB3 H -12.181 -1.594 6.780 1.00 . A A . 27 ARG HB3 1 1 5 2404 1 1 27 ARG HD2 H -14.152 0.496 9.604 1.00 . A A . 27 ARG HD2 1 1 5 2405 1 1 27 ARG HD3 H -14.106 0.973 7.906 1.00 . A A . 27 ARG HD3 1 1 5 2406 1 1 27 ARG HE H -14.698 -1.811 8.308 1.00 . A A . 27 ARG HE 1 1 5 2407 1 1 27 ARG HG2 H -12.519 -1.347 8.968 1.00 . A A . 27 ARG HG2 1 1 5 2408 1 1 27 ARG HG3 H -11.897 0.304 8.969 1.00 . A A . 27 ARG HG3 1 1 5 2409 1 1 27 ARG HH11 H -16.049 1.402 8.118 1.00 . A A . 27 ARG HH11 1 1 5 2410 1 1 27 ARG HH12 H -17.628 0.846 7.675 1.00 . A A . 27 ARG HH12 1 1 5 2411 1 1 27 ARG HH21 H -16.774 -2.542 7.724 1.00 . A A . 27 ARG HH21 1 1 5 2412 1 1 27 ARG HH22 H -18.040 -1.393 7.451 1.00 . A A . 27 ARG HH22 1 1 5 2413 1 1 27 ARG N N -10.723 0.775 5.515 1.00 . A A . 27 ARG N 1 1 5 2414 1 1 27 ARG NE N -14.985 -0.875 8.280 1.00 . A A . 27 ARG NE 1 1 5 2415 1 1 27 ARG NH1 N -16.676 0.651 7.915 1.00 . A A . 27 ARG NH1 1 1 5 2416 1 1 27 ARG NH2 N -17.090 -1.595 7.690 1.00 . A A . 27 ARG NH2 1 1 5 2417 1 1 27 ARG O O -9.922 -2.190 7.323 1.00 . A A . 27 ARG O 1 1 5 2418 1 1 28 LYS C C -6.728 -1.613 4.546 1.00 . A A . 28 LYS C 1 1 5 2419 1 1 28 LYS CA C -7.658 -1.986 5.697 1.00 . A A . 28 LYS CA 1 1 5 2420 1 1 28 LYS CB C -8.273 -3.366 5.435 1.00 . A A . 28 LYS CB 1 1 5 2421 1 1 28 LYS CD C -6.930 -5.213 6.484 1.00 . A A . 28 LYS CD 1 1 5 2422 1 1 28 LYS CE C -7.889 -6.371 6.703 1.00 . A A . 28 LYS CE 1 1 5 2423 1 1 28 LYS CG C -7.245 -4.462 5.200 1.00 . A A . 28 LYS CG 1 1 5 2424 1 1 28 LYS H H -8.629 -0.121 5.388 1.00 . A A . 28 LYS H 1 1 5 2425 1 1 28 LYS HA H -7.080 -2.025 6.608 1.00 . A A . 28 LYS HA 1 1 5 2426 1 1 28 LYS HB2 H -8.875 -3.649 6.284 1.00 . A A . 28 LYS HB2 1 1 5 2427 1 1 28 LYS HB3 H -8.906 -3.305 4.561 1.00 . A A . 28 LYS HB3 1 1 5 2428 1 1 28 LYS HD2 H -5.922 -5.599 6.427 1.00 . A A . 28 LYS HD2 1 1 5 2429 1 1 28 LYS HD3 H -7.008 -4.529 7.317 1.00 . A A . 28 LYS HD3 1 1 5 2430 1 1 28 LYS HE2 H -7.702 -7.124 5.952 1.00 . A A . 28 LYS HE2 1 1 5 2431 1 1 28 LYS HE3 H -7.711 -6.790 7.683 1.00 . A A . 28 LYS HE3 1 1 5 2432 1 1 28 LYS HG2 H -7.636 -5.161 4.475 1.00 . A A . 28 LYS HG2 1 1 5 2433 1 1 28 LYS HG3 H -6.336 -4.019 4.821 1.00 . A A . 28 LYS HG3 1 1 5 2434 1 1 28 LYS HZ1 H -9.515 -5.223 7.338 1.00 . A A . 28 LYS HZ1 1 1 5 2435 1 1 28 LYS HZ2 H -9.942 -6.753 6.757 1.00 . A A . 28 LYS HZ2 1 1 5 2436 1 1 28 LYS HZ3 H -9.501 -5.531 5.674 1.00 . A A . 28 LYS HZ3 1 1 5 2437 1 1 28 LYS N N -8.702 -0.972 5.871 1.00 . A A . 28 LYS N 1 1 5 2438 1 1 28 LYS NZ N -9.311 -5.939 6.612 1.00 . A A . 28 LYS NZ 1 1 5 2439 1 1 28 LYS O O -7.038 -1.864 3.383 1.00 . A A . 28 LYS O 1 1 5 2440 1 1 29 CYS C C -3.885 -1.831 3.329 1.00 . A A . 29 CYS C 1 1 5 2441 1 1 29 CYS CA C -4.613 -0.621 3.892 1.00 . A A . 29 CYS CA 1 1 5 2442 1 1 29 CYS CB C -3.630 0.327 4.539 1.00 . A A . 29 CYS CB 1 1 5 2443 1 1 29 CYS H H -5.383 -0.854 5.817 1.00 . A A . 29 CYS H 1 1 5 2444 1 1 29 CYS HA H -5.115 -0.110 3.106 1.00 . A A . 29 CYS HA 1 1 5 2445 1 1 29 CYS HB2 H -3.920 0.457 5.555 1.00 . A A . 29 CYS HB2 1 1 5 2446 1 1 29 CYS HB3 H -2.663 -0.113 4.509 1.00 . A A . 29 CYS HB3 1 1 5 2447 1 1 29 CYS N N -5.586 -1.022 4.879 1.00 . A A . 29 CYS N 1 1 5 2448 1 1 29 CYS O O -3.970 -2.930 3.876 1.00 . A A . 29 CYS O 1 1 5 2449 1 1 29 CYS SG S -3.537 1.984 3.786 1.00 . A A . 29 CYS SG 1 1 5 2450 1 1 30 LYS C C -1.755 -2.250 0.318 1.00 . A A . 30 LYS C 1 1 5 2451 1 1 30 LYS CA C -2.410 -2.703 1.611 1.00 . A A . 30 LYS CA 1 1 5 2452 1 1 30 LYS CB C -3.315 -3.913 1.350 1.00 . A A . 30 LYS CB 1 1 5 2453 1 1 30 LYS CD C -4.147 -6.108 2.245 1.00 . A A . 30 LYS CD 1 1 5 2454 1 1 30 LYS CE C -5.174 -5.773 3.315 1.00 . A A . 30 LYS CE 1 1 5 2455 1 1 30 LYS CG C -3.004 -5.107 2.238 1.00 . A A . 30 LYS CG 1 1 5 2456 1 1 30 LYS H H -3.128 -0.722 1.855 1.00 . A A . 30 LYS H 1 1 5 2457 1 1 30 LYS HA H -1.627 -2.992 2.294 1.00 . A A . 30 LYS HA 1 1 5 2458 1 1 30 LYS HB2 H -4.341 -3.623 1.520 1.00 . A A . 30 LYS HB2 1 1 5 2459 1 1 30 LYS HB3 H -3.202 -4.219 0.320 1.00 . A A . 30 LYS HB3 1 1 5 2460 1 1 30 LYS HD2 H -4.631 -6.094 1.280 1.00 . A A . 30 LYS HD2 1 1 5 2461 1 1 30 LYS HD3 H -3.749 -7.094 2.437 1.00 . A A . 30 LYS HD3 1 1 5 2462 1 1 30 LYS HE2 H -4.697 -5.829 4.282 1.00 . A A . 30 LYS HE2 1 1 5 2463 1 1 30 LYS HE3 H -5.533 -4.768 3.149 1.00 . A A . 30 LYS HE3 1 1 5 2464 1 1 30 LYS HG2 H -2.114 -5.595 1.870 1.00 . A A . 30 LYS HG2 1 1 5 2465 1 1 30 LYS HG3 H -2.835 -4.758 3.247 1.00 . A A . 30 LYS HG3 1 1 5 2466 1 1 30 LYS HZ1 H -6.662 -6.896 4.258 1.00 . A A . 30 LYS HZ1 1 1 5 2467 1 1 30 LYS HZ2 H -6.048 -7.614 2.856 1.00 . A A . 30 LYS HZ2 1 1 5 2468 1 1 30 LYS HZ3 H -7.110 -6.303 2.738 1.00 . A A . 30 LYS HZ3 1 1 5 2469 1 1 30 LYS N N -3.162 -1.622 2.239 1.00 . A A . 30 LYS N 1 1 5 2470 1 1 30 LYS NZ N -6.329 -6.712 3.290 1.00 . A A . 30 LYS NZ 1 1 5 2471 1 1 30 LYS O O -2.242 -2.526 -0.770 1.00 . A A . 30 LYS O 1 1 5 2472 1 1 31 CYS C C 0.191 -2.027 -1.834 1.00 . A A . 31 CYS C 1 1 5 2473 1 1 31 CYS CA C 0.157 -1.060 -0.665 1.00 . A A . 31 CYS CA 1 1 5 2474 1 1 31 CYS CB C 1.595 -0.745 -0.225 1.00 . A A . 31 CYS CB 1 1 5 2475 1 1 31 CYS H H -0.318 -1.403 1.377 1.00 . A A . 31 CYS H 1 1 5 2476 1 1 31 CYS HA H -0.289 -0.149 -1.024 1.00 . A A . 31 CYS HA 1 1 5 2477 1 1 31 CYS HB2 H 2.251 -0.896 -1.067 1.00 . A A . 31 CYS HB2 1 1 5 2478 1 1 31 CYS HB3 H 1.648 0.287 0.077 1.00 . A A . 31 CYS HB3 1 1 5 2479 1 1 31 CYS N N -0.632 -1.567 0.468 1.00 . A A . 31 CYS N 1 1 5 2480 1 1 31 CYS O O -0.286 -3.155 -1.765 1.00 . A A . 31 CYS O 1 1 5 2481 1 1 31 CYS SG S 2.237 -1.766 1.147 1.00 . A A . 31 CYS SG 1 1 5 2482 1 1 32 ASN C C 2.129 -3.113 -4.176 1.00 . A A . 32 ASN C 1 1 5 2483 1 1 32 ASN CA C 0.854 -2.285 -4.155 1.00 . A A . 32 ASN CA 1 1 5 2484 1 1 32 ASN CB C 0.874 -1.316 -5.318 1.00 . A A . 32 ASN CB 1 1 5 2485 1 1 32 ASN CG C 0.301 -1.902 -6.594 1.00 . A A . 32 ASN CG 1 1 5 2486 1 1 32 ASN H H 1.048 -0.602 -2.901 1.00 . A A . 32 ASN H 1 1 5 2487 1 1 32 ASN HA H 0.007 -2.935 -4.254 1.00 . A A . 32 ASN HA 1 1 5 2488 1 1 32 ASN HB2 H 0.305 -0.449 -5.053 1.00 . A A . 32 ASN HB2 1 1 5 2489 1 1 32 ASN HB3 H 1.887 -1.025 -5.493 1.00 . A A . 32 ASN HB3 1 1 5 2490 1 1 32 ASN HD21 H -1.388 -2.363 -5.652 1.00 . A A . 32 ASN HD21 1 1 5 2491 1 1 32 ASN HD22 H -1.322 -2.786 -7.326 1.00 . A A . 32 ASN HD22 1 1 5 2492 1 1 32 ASN N N 0.735 -1.531 -2.922 1.00 . A A . 32 ASN N 1 1 5 2493 1 1 32 ASN ND2 N -0.927 -2.401 -6.516 1.00 . A A . 32 ASN ND2 1 1 5 2494 1 1 32 ASN O O 2.923 -3.086 -3.235 1.00 . A A . 32 ASN O 1 1 5 2495 1 1 32 ASN OD1 O 0.955 -1.906 -7.637 1.00 . A A . 32 ASN OD1 1 1 5 2496 1 1 33 ARG C C 4.414 -4.018 -6.500 1.00 . A A . 33 ARG C 1 1 5 2497 1 1 33 ARG CA C 3.509 -4.651 -5.455 1.00 . A A . 33 ARG CA 1 1 5 2498 1 1 33 ARG CB C 3.127 -6.072 -5.869 1.00 . A A . 33 ARG CB 1 1 5 2499 1 1 33 ARG CD C 4.666 -7.373 -4.366 1.00 . A A . 33 ARG CD 1 1 5 2500 1 1 33 ARG CG C 4.283 -7.057 -5.804 1.00 . A A . 33 ARG CG 1 1 5 2501 1 1 33 ARG CZ C 6.599 -8.887 -4.562 1.00 . A A . 33 ARG CZ 1 1 5 2502 1 1 33 ARG H H 1.652 -3.788 -5.984 1.00 . A A . 33 ARG H 1 1 5 2503 1 1 33 ARG HA H 4.042 -4.679 -4.515 1.00 . A A . 33 ARG HA 1 1 5 2504 1 1 33 ARG HB2 H 2.344 -6.428 -5.216 1.00 . A A . 33 ARG HB2 1 1 5 2505 1 1 33 ARG HB3 H 2.757 -6.053 -6.883 1.00 . A A . 33 ARG HB3 1 1 5 2506 1 1 33 ARG HD2 H 4.450 -6.511 -3.752 1.00 . A A . 33 ARG HD2 1 1 5 2507 1 1 33 ARG HD3 H 4.076 -8.212 -4.027 1.00 . A A . 33 ARG HD3 1 1 5 2508 1 1 33 ARG HE H 6.679 -7.011 -3.888 1.00 . A A . 33 ARG HE 1 1 5 2509 1 1 33 ARG HG2 H 3.994 -7.972 -6.297 1.00 . A A . 33 ARG HG2 1 1 5 2510 1 1 33 ARG HG3 H 5.137 -6.629 -6.308 1.00 . A A . 33 ARG HG3 1 1 5 2511 1 1 33 ARG HH11 H 4.840 -9.693 -5.152 1.00 . A A . 33 ARG HH11 1 1 5 2512 1 1 33 ARG HH12 H 6.216 -10.738 -5.280 1.00 . A A . 33 ARG HH12 1 1 5 2513 1 1 33 ARG HH21 H 8.489 -8.384 -4.056 1.00 . A A . 33 ARG HH21 1 1 5 2514 1 1 33 ARG HH22 H 8.287 -9.995 -4.658 1.00 . A A . 33 ARG HH22 1 1 5 2515 1 1 33 ARG N N 2.322 -3.828 -5.271 1.00 . A A . 33 ARG N 1 1 5 2516 1 1 33 ARG NE N 6.082 -7.705 -4.236 1.00 . A A . 33 ARG NE 1 1 5 2517 1 1 33 ARG NH1 N 5.821 -9.852 -5.037 1.00 . A A . 33 ARG NH1 1 1 5 2518 1 1 33 ARG NH2 N 7.899 -9.107 -4.413 1.00 . A A . 33 ARG NH2 1 1 5 2519 1 1 33 ARG O O 4.372 -4.368 -7.679 1.00 . A A . 33 ARG O 1 1 5 2520 1 1 34 CYS C C 7.438 -3.117 -7.110 1.00 . A A . 34 CYS C 1 1 5 2521 1 1 34 CYS CA C 6.134 -2.351 -6.920 1.00 . A A . 34 CYS CA 1 1 5 2522 1 1 34 CYS CB C 6.408 -0.973 -6.344 1.00 . A A . 34 CYS CB 1 1 5 2523 1 1 34 CYS H H 5.188 -2.839 -5.096 1.00 . A A . 34 CYS H 1 1 5 2524 1 1 34 CYS HA H 5.657 -2.230 -7.870 1.00 . A A . 34 CYS HA 1 1 5 2525 1 1 34 CYS HB2 H 5.696 -0.786 -5.564 1.00 . A A . 34 CYS HB2 1 1 5 2526 1 1 34 CYS HB3 H 7.400 -0.958 -5.932 1.00 . A A . 34 CYS HB3 1 1 5 2527 1 1 34 CYS N N 5.219 -3.070 -6.047 1.00 . A A . 34 CYS N 1 1 5 2528 1 1 34 CYS O O 7.727 -3.517 -8.258 1.00 . A A . 34 CYS O 1 1 5 2529 1 1 34 CYS OXT O 8.162 -3.311 -6.110 1.00 . A A . 34 CYS OXT 1 1 5 2530 1 1 34 CYS SG S 6.274 0.392 -7.545 1.00 . A A . 34 CYS SG 1 1 6 2531 1 1 1 VAL C C -11.503 2.912 -3.724 1.00 . A A . 1 VAL C 1 1 6 2532 1 1 1 VAL CA C -12.287 1.744 -4.309 1.00 . A A . 1 VAL CA 1 1 6 2533 1 1 1 VAL CB C -11.588 0.428 -3.918 1.00 . A A . 1 VAL CB 1 1 6 2534 1 1 1 VAL CG1 C -12.498 -0.761 -4.183 1.00 . A A . 1 VAL CG1 1 1 6 2535 1 1 1 VAL CG2 C -10.272 0.280 -4.666 1.00 . A A . 1 VAL CG2 1 1 6 2536 1 1 1 VAL H1 H -12.933 2.747 -5.984 1.00 . A A . 1 VAL H1 1 1 6 2537 1 1 1 VAL H2 H -12.934 1.036 -6.129 1.00 . A A . 1 VAL H2 1 1 6 2538 1 1 1 VAL H3 H -11.454 1.904 -6.183 1.00 . A A . 1 VAL H3 1 1 6 2539 1 1 1 VAL HA H -13.280 1.741 -3.882 1.00 . A A . 1 VAL HA 1 1 6 2540 1 1 1 VAL HB H -11.373 0.460 -2.859 1.00 . A A . 1 VAL HB 1 1 6 2541 1 1 1 VAL HG11 H -13.529 -0.443 -4.136 1.00 . A A . 1 VAL HG11 1 1 6 2542 1 1 1 VAL HG12 H -12.321 -1.522 -3.437 1.00 . A A . 1 VAL HG12 1 1 6 2543 1 1 1 VAL HG13 H -12.289 -1.162 -5.164 1.00 . A A . 1 VAL HG13 1 1 6 2544 1 1 1 VAL HG21 H -9.762 -0.609 -4.327 1.00 . A A . 1 VAL HG21 1 1 6 2545 1 1 1 VAL HG22 H -9.651 1.144 -4.479 1.00 . A A . 1 VAL HG22 1 1 6 2546 1 1 1 VAL HG23 H -10.468 0.201 -5.726 1.00 . A A . 1 VAL HG23 1 1 6 2547 1 1 1 VAL N N -12.414 1.869 -5.784 1.00 . A A . 1 VAL N 1 1 6 2548 1 1 1 VAL O O -10.501 3.347 -4.292 1.00 . A A . 1 VAL O 1 1 6 2549 1 1 2 SER C C -10.643 4.086 -0.623 1.00 . A A . 2 SER C 1 1 6 2550 1 1 2 SER CA C -11.305 4.536 -1.921 1.00 . A A . 2 SER CA 1 1 6 2551 1 1 2 SER CB C -12.314 5.650 -1.633 1.00 . A A . 2 SER CB 1 1 6 2552 1 1 2 SER H H -12.767 3.028 -2.180 1.00 . A A . 2 SER H 1 1 6 2553 1 1 2 SER HA H -10.545 4.915 -2.588 1.00 . A A . 2 SER HA 1 1 6 2554 1 1 2 SER HB2 H -12.010 6.187 -0.746 1.00 . A A . 2 SER HB2 1 1 6 2555 1 1 2 SER HB3 H -12.345 6.330 -2.471 1.00 . A A . 2 SER HB3 1 1 6 2556 1 1 2 SER HG H -14.239 5.843 -1.329 1.00 . A A . 2 SER HG 1 1 6 2557 1 1 2 SER N N -11.964 3.417 -2.584 1.00 . A A . 2 SER N 1 1 6 2558 1 1 2 SER O O -11.219 3.315 0.145 1.00 . A A . 2 SER O 1 1 6 2559 1 1 2 SER OG O -13.612 5.122 -1.423 1.00 . A A . 2 SER OG 1 1 6 2560 1 1 3 CYS C C -9.412 4.697 2.069 1.00 . A A . 3 CYS C 1 1 6 2561 1 1 3 CYS CA C -8.688 4.221 0.821 1.00 . A A . 3 CYS CA 1 1 6 2562 1 1 3 CYS CB C -7.281 4.819 0.780 1.00 . A A . 3 CYS CB 1 1 6 2563 1 1 3 CYS H H -9.023 5.184 -1.034 1.00 . A A . 3 CYS H 1 1 6 2564 1 1 3 CYS HA H -8.608 3.146 0.864 1.00 . A A . 3 CYS HA 1 1 6 2565 1 1 3 CYS HB2 H -7.357 5.895 0.760 1.00 . A A . 3 CYS HB2 1 1 6 2566 1 1 3 CYS HB3 H -6.746 4.519 1.669 1.00 . A A . 3 CYS HB3 1 1 6 2567 1 1 3 CYS N N -9.430 4.573 -0.384 1.00 . A A . 3 CYS N 1 1 6 2568 1 1 3 CYS O O -10.476 5.312 1.995 1.00 . A A . 3 CYS O 1 1 6 2569 1 1 3 CYS SG S -6.289 4.307 -0.662 1.00 . A A . 3 CYS SG 1 1 6 2570 1 1 4 THR C C -8.862 6.138 4.966 1.00 . A A . 4 THR C 1 1 6 2571 1 1 4 THR CA C -9.394 4.783 4.502 1.00 . A A . 4 THR CA 1 1 6 2572 1 1 4 THR CB C -9.085 3.715 5.552 1.00 . A A . 4 THR CB 1 1 6 2573 1 1 4 THR CG2 C -7.618 3.344 5.611 1.00 . A A . 4 THR CG2 1 1 6 2574 1 1 4 THR H H -7.977 3.903 3.196 1.00 . A A . 4 THR H 1 1 6 2575 1 1 4 THR HA H -10.463 4.855 4.378 1.00 . A A . 4 THR HA 1 1 6 2576 1 1 4 THR HB H -9.642 2.820 5.314 1.00 . A A . 4 THR HB 1 1 6 2577 1 1 4 THR HG1 H -8.896 4.865 7.126 1.00 . A A . 4 THR HG1 1 1 6 2578 1 1 4 THR HG21 H -7.063 3.952 4.913 1.00 . A A . 4 THR HG21 1 1 6 2579 1 1 4 THR HG22 H -7.500 2.301 5.353 1.00 . A A . 4 THR HG22 1 1 6 2580 1 1 4 THR HG23 H -7.244 3.511 6.611 1.00 . A A . 4 THR HG23 1 1 6 2581 1 1 4 THR N N -8.821 4.399 3.216 1.00 . A A . 4 THR N 1 1 6 2582 1 1 4 THR O O -8.874 6.442 6.159 1.00 . A A . 4 THR O 1 1 6 2583 1 1 4 THR OG1 O -9.472 4.150 6.843 1.00 . A A . 4 THR OG1 1 1 6 2584 1 1 5 GLY C C -6.931 8.241 5.536 1.00 . A A . 5 GLY C 1 1 6 2585 1 1 5 GLY CA C -7.877 8.266 4.349 1.00 . A A . 5 GLY CA 1 1 6 2586 1 1 5 GLY H H -8.421 6.657 3.085 1.00 . A A . 5 GLY H 1 1 6 2587 1 1 5 GLY HA2 H -7.349 8.655 3.492 1.00 . A A . 5 GLY HA2 1 1 6 2588 1 1 5 GLY HA3 H -8.703 8.923 4.577 1.00 . A A . 5 GLY HA3 1 1 6 2589 1 1 5 GLY N N -8.402 6.951 4.018 1.00 . A A . 5 GLY N 1 1 6 2590 1 1 5 GLY O O -6.840 9.213 6.286 1.00 . A A . 5 GLY O 1 1 6 2591 1 1 6 SER C C -4.237 8.084 6.792 1.00 . A A . 6 SER C 1 1 6 2592 1 1 6 SER CA C -5.287 6.978 6.813 1.00 . A A . 6 SER CA 1 1 6 2593 1 1 6 SER CB C -4.603 5.610 6.754 1.00 . A A . 6 SER CB 1 1 6 2594 1 1 6 SER H H -6.346 6.384 5.078 1.00 . A A . 6 SER H 1 1 6 2595 1 1 6 SER HA H -5.847 7.049 7.734 1.00 . A A . 6 SER HA 1 1 6 2596 1 1 6 SER HB2 H -3.562 5.740 6.497 1.00 . A A . 6 SER HB2 1 1 6 2597 1 1 6 SER HB3 H -4.676 5.132 7.720 1.00 . A A . 6 SER HB3 1 1 6 2598 1 1 6 SER HG H -5.110 3.856 6.046 1.00 . A A . 6 SER HG 1 1 6 2599 1 1 6 SER N N -6.227 7.126 5.708 1.00 . A A . 6 SER N 1 1 6 2600 1 1 6 SER O O -4.122 8.826 5.817 1.00 . A A . 6 SER O 1 1 6 2601 1 1 6 SER OG O -5.209 4.774 5.785 1.00 . A A . 6 SER OG 1 1 6 2602 1 1 7 LYS C C -1.049 8.565 8.061 1.00 . A A . 7 LYS C 1 1 6 2603 1 1 7 LYS CA C -2.435 9.201 7.986 1.00 . A A . 7 LYS CA 1 1 6 2604 1 1 7 LYS CB C -2.673 10.073 9.220 1.00 . A A . 7 LYS CB 1 1 6 2605 1 1 7 LYS CD C -4.965 9.848 10.231 1.00 . A A . 7 LYS CD 1 1 6 2606 1 1 7 LYS CE C -5.850 8.878 9.466 1.00 . A A . 7 LYS CE 1 1 6 2607 1 1 7 LYS CG C -4.078 10.651 9.293 1.00 . A A . 7 LYS CG 1 1 6 2608 1 1 7 LYS H H -3.618 7.565 8.620 1.00 . A A . 7 LYS H 1 1 6 2609 1 1 7 LYS HA H -2.483 9.822 7.104 1.00 . A A . 7 LYS HA 1 1 6 2610 1 1 7 LYS HB2 H -2.506 9.479 10.105 1.00 . A A . 7 LYS HB2 1 1 6 2611 1 1 7 LYS HB3 H -1.971 10.894 9.208 1.00 . A A . 7 LYS HB3 1 1 6 2612 1 1 7 LYS HD2 H -4.338 9.288 10.910 1.00 . A A . 7 LYS HD2 1 1 6 2613 1 1 7 LYS HD3 H -5.589 10.527 10.790 1.00 . A A . 7 LYS HD3 1 1 6 2614 1 1 7 LYS HE2 H -5.935 9.215 8.445 1.00 . A A . 7 LYS HE2 1 1 6 2615 1 1 7 LYS HE3 H -5.390 7.900 9.485 1.00 . A A . 7 LYS HE3 1 1 6 2616 1 1 7 LYS HG2 H -4.021 11.668 9.652 1.00 . A A . 7 LYS HG2 1 1 6 2617 1 1 7 LYS HG3 H -4.514 10.641 8.304 1.00 . A A . 7 LYS HG3 1 1 6 2618 1 1 7 LYS HZ1 H -7.230 8.050 10.798 1.00 . A A . 7 LYS HZ1 1 1 6 2619 1 1 7 LYS HZ2 H -7.905 8.536 9.326 1.00 . A A . 7 LYS HZ2 1 1 6 2620 1 1 7 LYS HZ3 H -7.482 9.694 10.483 1.00 . A A . 7 LYS HZ3 1 1 6 2621 1 1 7 LYS N N -3.476 8.186 7.875 1.00 . A A . 7 LYS N 1 1 6 2622 1 1 7 LYS NZ N -7.212 8.783 10.060 1.00 . A A . 7 LYS NZ 1 1 6 2623 1 1 7 LYS O O -0.049 9.195 7.719 1.00 . A A . 7 LYS O 1 1 6 2624 1 1 8 ASP C C 0.205 5.228 7.980 1.00 . A A . 8 ASP C 1 1 6 2625 1 1 8 ASP CA C 0.276 6.605 8.635 1.00 . A A . 8 ASP CA 1 1 6 2626 1 1 8 ASP CB C 0.664 6.462 10.108 1.00 . A A . 8 ASP CB 1 1 6 2627 1 1 8 ASP CG C 2.158 6.596 10.328 1.00 . A A . 8 ASP CG 1 1 6 2628 1 1 8 ASP H H -1.820 6.860 8.776 1.00 . A A . 8 ASP H 1 1 6 2629 1 1 8 ASP HA H 1.030 7.190 8.130 1.00 . A A . 8 ASP HA 1 1 6 2630 1 1 8 ASP HB2 H 0.164 7.228 10.681 1.00 . A A . 8 ASP HB2 1 1 6 2631 1 1 8 ASP HB3 H 0.352 5.491 10.462 1.00 . A A . 8 ASP HB3 1 1 6 2632 1 1 8 ASP N N -0.993 7.314 8.514 1.00 . A A . 8 ASP N 1 1 6 2633 1 1 8 ASP O O 0.864 4.288 8.424 1.00 . A A . 8 ASP O 1 1 6 2634 1 1 8 ASP OD1 O 2.790 7.413 9.626 1.00 . A A . 8 ASP OD1 1 1 6 2635 1 1 8 ASP OD2 O 2.695 5.884 11.202 1.00 . A A . 8 ASP OD2 1 1 6 2636 1 1 9 CYS C C 0.027 3.873 4.901 1.00 . A A . 9 CYS C 1 1 6 2637 1 1 9 CYS CA C -0.734 3.849 6.211 1.00 . A A . 9 CYS CA 1 1 6 2638 1 1 9 CYS CB C -2.200 3.541 5.947 1.00 . A A . 9 CYS CB 1 1 6 2639 1 1 9 CYS H H -1.090 5.899 6.610 1.00 . A A . 9 CYS H 1 1 6 2640 1 1 9 CYS HA H -0.329 3.082 6.826 1.00 . A A . 9 CYS HA 1 1 6 2641 1 1 9 CYS HB2 H -2.786 3.923 6.759 1.00 . A A . 9 CYS HB2 1 1 6 2642 1 1 9 CYS HB3 H -2.493 4.026 5.039 1.00 . A A . 9 CYS HB3 1 1 6 2643 1 1 9 CYS N N -0.591 5.114 6.922 1.00 . A A . 9 CYS N 1 1 6 2644 1 1 9 CYS O O 1.068 3.232 4.759 1.00 . A A . 9 CYS O 1 1 6 2645 1 1 9 CYS SG S -2.576 1.763 5.772 1.00 . A A . 9 CYS SG 1 1 6 2646 1 1 10 TYR C C 1.544 5.291 2.768 1.00 . A A . 10 TYR C 1 1 6 2647 1 1 10 TYR CA C 0.127 4.741 2.644 1.00 . A A . 10 TYR CA 1 1 6 2648 1 1 10 TYR CB C -0.713 5.647 1.738 1.00 . A A . 10 TYR CB 1 1 6 2649 1 1 10 TYR CD1 C -1.929 3.562 0.969 1.00 . A A . 10 TYR CD1 1 1 6 2650 1 1 10 TYR CD2 C -2.119 5.534 -0.356 1.00 . A A . 10 TYR CD2 1 1 6 2651 1 1 10 TYR CE1 C -2.740 2.883 0.082 1.00 . A A . 10 TYR CE1 1 1 6 2652 1 1 10 TYR CE2 C -2.932 4.861 -1.248 1.00 . A A . 10 TYR CE2 1 1 6 2653 1 1 10 TYR CG C -1.604 4.899 0.767 1.00 . A A . 10 TYR CG 1 1 6 2654 1 1 10 TYR CZ C -3.237 3.536 -1.025 1.00 . A A . 10 TYR CZ 1 1 6 2655 1 1 10 TYR H H -1.331 5.111 4.129 1.00 . A A . 10 TYR H 1 1 6 2656 1 1 10 TYR HA H 0.177 3.756 2.208 1.00 . A A . 10 TYR HA 1 1 6 2657 1 1 10 TYR HB2 H -1.346 6.269 2.352 1.00 . A A . 10 TYR HB2 1 1 6 2658 1 1 10 TYR HB3 H -0.052 6.278 1.161 1.00 . A A . 10 TYR HB3 1 1 6 2659 1 1 10 TYR HD1 H -1.541 3.052 1.838 1.00 . A A . 10 TYR HD1 1 1 6 2660 1 1 10 TYR HD2 H -1.876 6.572 -0.529 1.00 . A A . 10 TYR HD2 1 1 6 2661 1 1 10 TYR HE1 H -2.978 1.845 0.257 1.00 . A A . 10 TYR HE1 1 1 6 2662 1 1 10 TYR HE2 H -3.321 5.373 -2.115 1.00 . A A . 10 TYR HE2 1 1 6 2663 1 1 10 TYR HH H -3.899 3.192 -2.799 1.00 . A A . 10 TYR HH 1 1 6 2664 1 1 10 TYR N N -0.500 4.622 3.949 1.00 . A A . 10 TYR N 1 1 6 2665 1 1 10 TYR O O 2.346 5.157 1.850 1.00 . A A . 10 TYR O 1 1 6 2666 1 1 10 TYR OH O -4.048 2.861 -1.910 1.00 . A A . 10 TYR OH 1 1 6 2667 1 1 11 ALA C C 4.228 5.397 4.336 1.00 . A A . 11 ALA C 1 1 6 2668 1 1 11 ALA CA C 3.176 6.481 4.119 1.00 . A A . 11 ALA CA 1 1 6 2669 1 1 11 ALA CB C 3.161 7.472 5.275 1.00 . A A . 11 ALA CB 1 1 6 2670 1 1 11 ALA H H 1.166 5.997 4.608 1.00 . A A . 11 ALA H 1 1 6 2671 1 1 11 ALA HA H 3.441 7.018 3.222 1.00 . A A . 11 ALA HA 1 1 6 2672 1 1 11 ALA HB1 H 4.115 7.449 5.782 1.00 . A A . 11 ALA HB1 1 1 6 2673 1 1 11 ALA HB2 H 2.379 7.203 5.969 1.00 . A A . 11 ALA HB2 1 1 6 2674 1 1 11 ALA HB3 H 2.978 8.466 4.895 1.00 . A A . 11 ALA HB3 1 1 6 2675 1 1 11 ALA N N 1.847 5.917 3.902 1.00 . A A . 11 ALA N 1 1 6 2676 1 1 11 ALA O O 5.070 5.160 3.468 1.00 . A A . 11 ALA O 1 1 6 2677 1 1 12 PRO C C 5.200 2.596 4.714 1.00 . A A . 12 PRO C 1 1 6 2678 1 1 12 PRO CA C 5.161 3.653 5.807 1.00 . A A . 12 PRO CA 1 1 6 2679 1 1 12 PRO CB C 4.644 3.052 7.123 1.00 . A A . 12 PRO CB 1 1 6 2680 1 1 12 PRO CD C 3.237 4.910 6.590 1.00 . A A . 12 PRO CD 1 1 6 2681 1 1 12 PRO CG C 3.257 3.581 7.287 1.00 . A A . 12 PRO CG 1 1 6 2682 1 1 12 PRO HA H 6.154 4.053 5.956 1.00 . A A . 12 PRO HA 1 1 6 2683 1 1 12 PRO HB2 H 4.647 1.974 7.054 1.00 . A A . 12 PRO HB2 1 1 6 2684 1 1 12 PRO HB3 H 5.281 3.365 7.937 1.00 . A A . 12 PRO HB3 1 1 6 2685 1 1 12 PRO HD2 H 2.250 5.122 6.205 1.00 . A A . 12 PRO HD2 1 1 6 2686 1 1 12 PRO HD3 H 3.563 5.694 7.258 1.00 . A A . 12 PRO HD3 1 1 6 2687 1 1 12 PRO HG2 H 2.550 2.907 6.827 1.00 . A A . 12 PRO HG2 1 1 6 2688 1 1 12 PRO HG3 H 3.032 3.705 8.336 1.00 . A A . 12 PRO HG3 1 1 6 2689 1 1 12 PRO N N 4.200 4.715 5.497 1.00 . A A . 12 PRO N 1 1 6 2690 1 1 12 PRO O O 6.180 1.864 4.576 1.00 . A A . 12 PRO O 1 1 6 2691 1 1 13 CYS C C 4.597 2.130 1.563 1.00 . A A . 13 CYS C 1 1 6 2692 1 1 13 CYS CA C 4.026 1.566 2.853 1.00 . A A . 13 CYS CA 1 1 6 2693 1 1 13 CYS CB C 2.577 1.170 2.642 1.00 . A A . 13 CYS CB 1 1 6 2694 1 1 13 CYS H H 3.379 3.137 4.099 1.00 . A A . 13 CYS H 1 1 6 2695 1 1 13 CYS HA H 4.582 0.697 3.127 1.00 . A A . 13 CYS HA 1 1 6 2696 1 1 13 CYS HB2 H 2.004 1.527 3.475 1.00 . A A . 13 CYS HB2 1 1 6 2697 1 1 13 CYS HB3 H 2.219 1.631 1.740 1.00 . A A . 13 CYS HB3 1 1 6 2698 1 1 13 CYS N N 4.126 2.527 3.937 1.00 . A A . 13 CYS N 1 1 6 2699 1 1 13 CYS O O 5.419 1.492 0.913 1.00 . A A . 13 CYS O 1 1 6 2700 1 1 13 CYS SG S 2.297 -0.625 2.503 1.00 . A A . 13 CYS SG 1 1 6 2701 1 1 14 ARG C C 6.145 3.939 -0.088 1.00 . A A . 14 ARG C 1 1 6 2702 1 1 14 ARG CA C 4.629 3.950 -0.037 1.00 . A A . 14 ARG CA 1 1 6 2703 1 1 14 ARG CB C 4.098 5.380 -0.168 1.00 . A A . 14 ARG CB 1 1 6 2704 1 1 14 ARG CD C 3.607 7.076 -1.957 1.00 . A A . 14 ARG CD 1 1 6 2705 1 1 14 ARG CG C 4.643 6.128 -1.375 1.00 . A A . 14 ARG CG 1 1 6 2706 1 1 14 ARG CZ C 4.946 8.759 -3.161 1.00 . A A . 14 ARG CZ 1 1 6 2707 1 1 14 ARG H H 3.495 3.793 1.741 1.00 . A A . 14 ARG H 1 1 6 2708 1 1 14 ARG HA H 4.257 3.357 -0.855 1.00 . A A . 14 ARG HA 1 1 6 2709 1 1 14 ARG HB2 H 3.022 5.343 -0.252 1.00 . A A . 14 ARG HB2 1 1 6 2710 1 1 14 ARG HB3 H 4.362 5.933 0.720 1.00 . A A . 14 ARG HB3 1 1 6 2711 1 1 14 ARG HD2 H 2.718 6.514 -2.198 1.00 . A A . 14 ARG HD2 1 1 6 2712 1 1 14 ARG HD3 H 3.368 7.826 -1.217 1.00 . A A . 14 ARG HD3 1 1 6 2713 1 1 14 ARG HE H 3.758 7.408 -4.026 1.00 . A A . 14 ARG HE 1 1 6 2714 1 1 14 ARG HG2 H 5.508 6.698 -1.072 1.00 . A A . 14 ARG HG2 1 1 6 2715 1 1 14 ARG HG3 H 4.928 5.412 -2.132 1.00 . A A . 14 ARG HG3 1 1 6 2716 1 1 14 ARG HH11 H 5.129 8.827 -1.148 1.00 . A A . 14 ARG HH11 1 1 6 2717 1 1 14 ARG HH12 H 6.061 9.998 -2.018 1.00 . A A . 14 ARG HH12 1 1 6 2718 1 1 14 ARG HH21 H 4.983 8.949 -5.172 1.00 . A A . 14 ARG HH21 1 1 6 2719 1 1 14 ARG HH22 H 5.977 10.068 -4.302 1.00 . A A . 14 ARG HH22 1 1 6 2720 1 1 14 ARG N N 4.154 3.327 1.188 1.00 . A A . 14 ARG N 1 1 6 2721 1 1 14 ARG NE N 4.089 7.739 -3.166 1.00 . A A . 14 ARG NE 1 1 6 2722 1 1 14 ARG NH1 N 5.417 9.233 -2.015 1.00 . A A . 14 ARG NH1 1 1 6 2723 1 1 14 ARG NH2 N 5.334 9.303 -4.305 1.00 . A A . 14 ARG NH2 1 1 6 2724 1 1 14 ARG O O 6.740 3.795 -1.154 1.00 . A A . 14 ARG O 1 1 6 2725 1 1 15 LYS C C 8.714 2.677 0.667 1.00 . A A . 15 LYS C 1 1 6 2726 1 1 15 LYS CA C 8.217 4.034 1.148 1.00 . A A . 15 LYS CA 1 1 6 2727 1 1 15 LYS CB C 8.682 4.288 2.583 1.00 . A A . 15 LYS CB 1 1 6 2728 1 1 15 LYS CD C 8.329 6.725 3.083 1.00 . A A . 15 LYS CD 1 1 6 2729 1 1 15 LYS CE C 8.691 8.036 2.403 1.00 . A A . 15 LYS CE 1 1 6 2730 1 1 15 LYS CG C 9.348 5.640 2.778 1.00 . A A . 15 LYS CG 1 1 6 2731 1 1 15 LYS H H 6.242 4.160 1.896 1.00 . A A . 15 LYS H 1 1 6 2732 1 1 15 LYS HA H 8.606 4.806 0.502 1.00 . A A . 15 LYS HA 1 1 6 2733 1 1 15 LYS HB2 H 7.827 4.235 3.239 1.00 . A A . 15 LYS HB2 1 1 6 2734 1 1 15 LYS HB3 H 9.387 3.519 2.864 1.00 . A A . 15 LYS HB3 1 1 6 2735 1 1 15 LYS HD2 H 7.359 6.405 2.729 1.00 . A A . 15 LYS HD2 1 1 6 2736 1 1 15 LYS HD3 H 8.291 6.880 4.150 1.00 . A A . 15 LYS HD3 1 1 6 2737 1 1 15 LYS HE2 H 9.574 8.439 2.876 1.00 . A A . 15 LYS HE2 1 1 6 2738 1 1 15 LYS HE3 H 8.897 7.842 1.361 1.00 . A A . 15 LYS HE3 1 1 6 2739 1 1 15 LYS HG2 H 10.045 5.573 3.600 1.00 . A A . 15 LYS HG2 1 1 6 2740 1 1 15 LYS HG3 H 9.880 5.901 1.874 1.00 . A A . 15 LYS HG3 1 1 6 2741 1 1 15 LYS HZ1 H 6.915 8.901 1.724 1.00 . A A . 15 LYS HZ1 1 1 6 2742 1 1 15 LYS HZ2 H 7.978 9.999 2.449 1.00 . A A . 15 LYS HZ2 1 1 6 2743 1 1 15 LYS HZ3 H 7.089 8.926 3.407 1.00 . A A . 15 LYS HZ3 1 1 6 2744 1 1 15 LYS N N 6.768 4.065 1.073 1.00 . A A . 15 LYS N 1 1 6 2745 1 1 15 LYS NZ N 7.591 9.035 2.503 1.00 . A A . 15 LYS NZ 1 1 6 2746 1 1 15 LYS O O 9.652 2.587 -0.126 1.00 . A A . 15 LYS O 1 1 6 2747 1 1 16 GLN C C 8.033 -0.061 -0.662 1.00 . A A . 16 GLN C 1 1 6 2748 1 1 16 GLN CA C 8.417 0.260 0.785 1.00 . A A . 16 GLN CA 1 1 6 2749 1 1 16 GLN CB C 7.740 -0.734 1.731 1.00 . A A . 16 GLN CB 1 1 6 2750 1 1 16 GLN CD C 8.551 -3.002 0.972 1.00 . A A . 16 GLN CD 1 1 6 2751 1 1 16 GLN CG C 8.598 -1.945 2.058 1.00 . A A . 16 GLN CG 1 1 6 2752 1 1 16 GLN H H 7.320 1.770 1.782 1.00 . A A . 16 GLN H 1 1 6 2753 1 1 16 GLN HA H 9.487 0.159 0.888 1.00 . A A . 16 GLN HA 1 1 6 2754 1 1 16 GLN HB2 H 7.503 -0.228 2.656 1.00 . A A . 16 GLN HB2 1 1 6 2755 1 1 16 GLN HB3 H 6.824 -1.080 1.275 1.00 . A A . 16 GLN HB3 1 1 6 2756 1 1 16 GLN HE21 H 8.059 -4.388 2.310 1.00 . A A . 16 GLN HE21 1 1 6 2757 1 1 16 GLN HE22 H 8.201 -4.937 0.678 1.00 . A A . 16 GLN HE22 1 1 6 2758 1 1 16 GLN HG2 H 9.621 -1.623 2.181 1.00 . A A . 16 GLN HG2 1 1 6 2759 1 1 16 GLN HG3 H 8.246 -2.381 2.981 1.00 . A A . 16 GLN HG3 1 1 6 2760 1 1 16 GLN N N 8.065 1.624 1.156 1.00 . A A . 16 GLN N 1 1 6 2761 1 1 16 GLN NE2 N 8.238 -4.234 1.359 1.00 . A A . 16 GLN NE2 1 1 6 2762 1 1 16 GLN O O 8.883 -0.444 -1.466 1.00 . A A . 16 GLN O 1 1 6 2763 1 1 16 GLN OE1 O 8.791 -2.716 -0.200 1.00 . A A . 16 GLN OE1 1 1 6 2764 1 1 17 THR C C 6.700 0.790 -3.350 1.00 . A A . 17 THR C 1 1 6 2765 1 1 17 THR CA C 6.247 -0.233 -2.317 1.00 . A A . 17 THR CA 1 1 6 2766 1 1 17 THR CB C 4.721 -0.309 -2.310 1.00 . A A . 17 THR CB 1 1 6 2767 1 1 17 THR CG2 C 4.064 0.913 -1.706 1.00 . A A . 17 THR CG2 1 1 6 2768 1 1 17 THR H H 6.109 0.369 -0.294 1.00 . A A . 17 THR H 1 1 6 2769 1 1 17 THR HA H 6.638 -1.199 -2.598 1.00 . A A . 17 THR HA 1 1 6 2770 1 1 17 THR HB H 4.417 -1.169 -1.732 1.00 . A A . 17 THR HB 1 1 6 2771 1 1 17 THR HG1 H 4.728 -1.130 -4.087 1.00 . A A . 17 THR HG1 1 1 6 2772 1 1 17 THR HG21 H 3.977 0.784 -0.638 1.00 . A A . 17 THR HG21 1 1 6 2773 1 1 17 THR HG22 H 3.081 1.041 -2.134 1.00 . A A . 17 THR HG22 1 1 6 2774 1 1 17 THR HG23 H 4.666 1.784 -1.915 1.00 . A A . 17 THR HG23 1 1 6 2775 1 1 17 THR N N 6.744 0.071 -0.979 1.00 . A A . 17 THR N 1 1 6 2776 1 1 17 THR O O 6.750 0.492 -4.544 1.00 . A A . 17 THR O 1 1 6 2777 1 1 17 THR OG1 O 4.223 -0.456 -3.627 1.00 . A A . 17 THR OG1 1 1 6 2778 1 1 18 GLY C C 6.257 3.605 -4.580 1.00 . A A . 18 GLY C 1 1 6 2779 1 1 18 GLY CA C 7.423 3.030 -3.820 1.00 . A A . 18 GLY CA 1 1 6 2780 1 1 18 GLY H H 6.942 2.194 -1.949 1.00 . A A . 18 GLY H 1 1 6 2781 1 1 18 GLY HA2 H 7.909 3.814 -3.289 1.00 . A A . 18 GLY HA2 1 1 6 2782 1 1 18 GLY HA3 H 8.115 2.602 -4.519 1.00 . A A . 18 GLY HA3 1 1 6 2783 1 1 18 GLY N N 7.008 1.999 -2.900 1.00 . A A . 18 GLY N 1 1 6 2784 1 1 18 GLY O O 5.526 4.457 -4.074 1.00 . A A . 18 GLY O 1 1 6 2785 1 1 19 CYS C C 3.834 4.152 -5.982 1.00 . A A . 19 CYS C 1 1 6 2786 1 1 19 CYS CA C 5.038 3.536 -6.706 1.00 . A A . 19 CYS CA 1 1 6 2787 1 1 19 CYS CB C 4.590 2.363 -7.541 1.00 . A A . 19 CYS CB 1 1 6 2788 1 1 19 CYS H H 6.745 2.461 -6.099 1.00 . A A . 19 CYS H 1 1 6 2789 1 1 19 CYS HA H 5.453 4.251 -7.376 1.00 . A A . 19 CYS HA 1 1 6 2790 1 1 19 CYS HB2 H 3.640 2.602 -7.979 1.00 . A A . 19 CYS HB2 1 1 6 2791 1 1 19 CYS HB3 H 5.313 2.225 -8.323 1.00 . A A . 19 CYS HB3 1 1 6 2792 1 1 19 CYS N N 6.104 3.122 -5.796 1.00 . A A . 19 CYS N 1 1 6 2793 1 1 19 CYS O O 3.408 3.656 -4.939 1.00 . A A . 19 CYS O 1 1 6 2794 1 1 19 CYS SG S 4.423 0.792 -6.629 1.00 . A A . 19 CYS SG 1 1 6 2795 1 1 20 PRO C C 0.857 5.085 -5.851 1.00 . A A . 20 PRO C 1 1 6 2796 1 1 20 PRO CA C 2.122 5.942 -5.921 1.00 . A A . 20 PRO CA 1 1 6 2797 1 1 20 PRO CB C 1.888 7.144 -6.847 1.00 . A A . 20 PRO CB 1 1 6 2798 1 1 20 PRO CD C 3.719 5.917 -7.761 1.00 . A A . 20 PRO CD 1 1 6 2799 1 1 20 PRO CG C 3.152 7.299 -7.620 1.00 . A A . 20 PRO CG 1 1 6 2800 1 1 20 PRO HA H 2.361 6.298 -4.930 1.00 . A A . 20 PRO HA 1 1 6 2801 1 1 20 PRO HB2 H 1.052 6.940 -7.498 1.00 . A A . 20 PRO HB2 1 1 6 2802 1 1 20 PRO HB3 H 1.682 8.022 -6.252 1.00 . A A . 20 PRO HB3 1 1 6 2803 1 1 20 PRO HD2 H 3.314 5.428 -8.634 1.00 . A A . 20 PRO HD2 1 1 6 2804 1 1 20 PRO HD3 H 4.796 5.955 -7.812 1.00 . A A . 20 PRO HD3 1 1 6 2805 1 1 20 PRO HG2 H 2.939 7.717 -8.592 1.00 . A A . 20 PRO HG2 1 1 6 2806 1 1 20 PRO HG3 H 3.839 7.932 -7.079 1.00 . A A . 20 PRO HG3 1 1 6 2807 1 1 20 PRO N N 3.272 5.250 -6.526 1.00 . A A . 20 PRO N 1 1 6 2808 1 1 20 PRO O O -0.116 5.467 -5.200 1.00 . A A . 20 PRO O 1 1 6 2809 1 1 21 TYR C C -0.503 2.412 -5.173 1.00 . A A . 21 TYR C 1 1 6 2810 1 1 21 TYR CA C -0.290 3.063 -6.537 1.00 . A A . 21 TYR CA 1 1 6 2811 1 1 21 TYR CB C -0.106 1.988 -7.605 1.00 . A A . 21 TYR CB 1 1 6 2812 1 1 21 TYR CD1 C 0.776 3.597 -9.344 1.00 . A A . 21 TYR CD1 1 1 6 2813 1 1 21 TYR CD2 C 1.813 1.459 -9.163 1.00 . A A . 21 TYR CD2 1 1 6 2814 1 1 21 TYR CE1 C 1.641 3.934 -10.368 1.00 . A A . 21 TYR CE1 1 1 6 2815 1 1 21 TYR CE2 C 2.682 1.789 -10.185 1.00 . A A . 21 TYR CE2 1 1 6 2816 1 1 21 TYR CG C 0.847 2.356 -8.725 1.00 . A A . 21 TYR CG 1 1 6 2817 1 1 21 TYR CZ C 2.592 3.028 -10.784 1.00 . A A . 21 TYR CZ 1 1 6 2818 1 1 21 TYR H H 1.640 3.676 -7.038 1.00 . A A . 21 TYR H 1 1 6 2819 1 1 21 TYR HA H -1.159 3.654 -6.781 1.00 . A A . 21 TYR HA 1 1 6 2820 1 1 21 TYR HB2 H 0.263 1.089 -7.141 1.00 . A A . 21 TYR HB2 1 1 6 2821 1 1 21 TYR HB3 H -1.053 1.793 -8.044 1.00 . A A . 21 TYR HB3 1 1 6 2822 1 1 21 TYR HD1 H 0.031 4.307 -9.015 1.00 . A A . 21 TYR HD1 1 1 6 2823 1 1 21 TYR HD2 H 1.881 0.490 -8.691 1.00 . A A . 21 TYR HD2 1 1 6 2824 1 1 21 TYR HE1 H 1.570 4.905 -10.837 1.00 . A A . 21 TYR HE1 1 1 6 2825 1 1 21 TYR HE2 H 3.425 1.077 -10.512 1.00 . A A . 21 TYR HE2 1 1 6 2826 1 1 21 TYR HH H 4.332 3.022 -11.603 1.00 . A A . 21 TYR HH 1 1 6 2827 1 1 21 TYR N N 0.859 3.939 -6.525 1.00 . A A . 21 TYR N 1 1 6 2828 1 1 21 TYR O O 0.389 2.416 -4.324 1.00 . A A . 21 TYR O 1 1 6 2829 1 1 21 TYR OH O 3.455 3.359 -11.803 1.00 . A A . 21 TYR OH 1 1 6 2830 1 1 22 GLY C C -3.064 0.124 -3.848 1.00 . A A . 22 GLY C 1 1 6 2831 1 1 22 GLY CA C -2.010 1.206 -3.709 1.00 . A A . 22 GLY CA 1 1 6 2832 1 1 22 GLY H H -2.365 1.883 -5.686 1.00 . A A . 22 GLY H 1 1 6 2833 1 1 22 GLY HA2 H -1.116 0.767 -3.316 1.00 . A A . 22 GLY HA2 1 1 6 2834 1 1 22 GLY HA3 H -2.361 1.948 -3.013 1.00 . A A . 22 GLY HA3 1 1 6 2835 1 1 22 GLY N N -1.695 1.854 -4.971 1.00 . A A . 22 GLY N 1 1 6 2836 1 1 22 GLY O O -3.906 0.185 -4.745 1.00 . A A . 22 GLY O 1 1 6 2837 1 1 23 LYS C C -5.083 -1.706 -1.918 1.00 . A A . 23 LYS C 1 1 6 2838 1 1 23 LYS CA C -4.012 -1.940 -2.979 1.00 . A A . 23 LYS CA 1 1 6 2839 1 1 23 LYS CB C -3.329 -3.290 -2.750 1.00 . A A . 23 LYS CB 1 1 6 2840 1 1 23 LYS CD C -3.159 -5.720 -3.364 1.00 . A A . 23 LYS CD 1 1 6 2841 1 1 23 LYS CE C -3.583 -6.792 -4.355 1.00 . A A . 23 LYS CE 1 1 6 2842 1 1 23 LYS CG C -3.875 -4.405 -3.626 1.00 . A A . 23 LYS CG 1 1 6 2843 1 1 23 LYS H H -2.358 -0.856 -2.244 1.00 . A A . 23 LYS H 1 1 6 2844 1 1 23 LYS HA H -4.476 -1.939 -3.951 1.00 . A A . 23 LYS HA 1 1 6 2845 1 1 23 LYS HB2 H -2.273 -3.185 -2.954 1.00 . A A . 23 LYS HB2 1 1 6 2846 1 1 23 LYS HB3 H -3.459 -3.577 -1.716 1.00 . A A . 23 LYS HB3 1 1 6 2847 1 1 23 LYS HD2 H -2.095 -5.564 -3.453 1.00 . A A . 23 LYS HD2 1 1 6 2848 1 1 23 LYS HD3 H -3.395 -6.054 -2.364 1.00 . A A . 23 LYS HD3 1 1 6 2849 1 1 23 LYS HE2 H -3.975 -6.312 -5.240 1.00 . A A . 23 LYS HE2 1 1 6 2850 1 1 23 LYS HE3 H -2.718 -7.381 -4.620 1.00 . A A . 23 LYS HE3 1 1 6 2851 1 1 23 LYS HG2 H -4.927 -4.532 -3.417 1.00 . A A . 23 LYS HG2 1 1 6 2852 1 1 23 LYS HG3 H -3.741 -4.133 -4.663 1.00 . A A . 23 LYS HG3 1 1 6 2853 1 1 23 LYS HZ1 H -4.492 -7.794 -2.764 1.00 . A A . 23 LYS HZ1 1 1 6 2854 1 1 23 LYS HZ2 H -4.570 -8.629 -4.234 1.00 . A A . 23 LYS HZ2 1 1 6 2855 1 1 23 LYS HZ3 H -5.573 -7.294 -3.965 1.00 . A A . 23 LYS HZ3 1 1 6 2856 1 1 23 LYS N N -3.035 -0.862 -2.950 1.00 . A A . 23 LYS N 1 1 6 2857 1 1 23 LYS NZ N -4.628 -7.690 -3.789 1.00 . A A . 23 LYS NZ 1 1 6 2858 1 1 23 LYS O O -5.921 -2.569 -1.659 1.00 . A A . 23 LYS O 1 1 6 2859 1 1 24 CYS C C -7.409 -0.522 -0.610 1.00 . A A . 24 CYS C 1 1 6 2860 1 1 24 CYS CA C -5.971 -0.141 -0.259 1.00 . A A . 24 CYS CA 1 1 6 2861 1 1 24 CYS CB C -5.849 1.367 0.000 1.00 . A A . 24 CYS CB 1 1 6 2862 1 1 24 CYS H H -4.333 0.111 -1.559 1.00 . A A . 24 CYS H 1 1 6 2863 1 1 24 CYS HA H -5.690 -0.665 0.640 1.00 . A A . 24 CYS HA 1 1 6 2864 1 1 24 CYS HB2 H -6.093 1.569 1.029 1.00 . A A . 24 CYS HB2 1 1 6 2865 1 1 24 CYS HB3 H -4.826 1.663 -0.180 1.00 . A A . 24 CYS HB3 1 1 6 2866 1 1 24 CYS N N -5.033 -0.525 -1.304 1.00 . A A . 24 CYS N 1 1 6 2867 1 1 24 CYS O O -7.895 -0.234 -1.704 1.00 . A A . 24 CYS O 1 1 6 2868 1 1 24 CYS SG S -6.919 2.415 -1.047 1.00 . A A . 24 CYS SG 1 1 6 2869 1 1 25 MET C C -10.376 -0.818 1.101 1.00 . A A . 25 MET C 1 1 6 2870 1 1 25 MET CA C -9.465 -1.582 0.154 1.00 . A A . 25 MET CA 1 1 6 2871 1 1 25 MET CB C -9.604 -3.088 0.392 1.00 . A A . 25 MET CB 1 1 6 2872 1 1 25 MET CE C -8.980 -6.527 0.145 1.00 . A A . 25 MET CE 1 1 6 2873 1 1 25 MET CG C -9.198 -3.932 -0.805 1.00 . A A . 25 MET CG 1 1 6 2874 1 1 25 MET H H -7.636 -1.356 1.189 1.00 . A A . 25 MET H 1 1 6 2875 1 1 25 MET HA H -9.754 -1.356 -0.862 1.00 . A A . 25 MET HA 1 1 6 2876 1 1 25 MET HB2 H -8.982 -3.367 1.229 1.00 . A A . 25 MET HB2 1 1 6 2877 1 1 25 MET HB3 H -10.634 -3.309 0.629 1.00 . A A . 25 MET HB3 1 1 6 2878 1 1 25 MET HE1 H -7.962 -6.186 0.034 1.00 . A A . 25 MET HE1 1 1 6 2879 1 1 25 MET HE2 H -9.052 -7.556 -0.174 1.00 . A A . 25 MET HE2 1 1 6 2880 1 1 25 MET HE3 H -9.276 -6.448 1.180 1.00 . A A . 25 MET HE3 1 1 6 2881 1 1 25 MET HG2 H -9.421 -3.384 -1.707 1.00 . A A . 25 MET HG2 1 1 6 2882 1 1 25 MET HG3 H -8.135 -4.119 -0.753 1.00 . A A . 25 MET HG3 1 1 6 2883 1 1 25 MET N N -8.081 -1.164 0.339 1.00 . A A . 25 MET N 1 1 6 2884 1 1 25 MET O O -9.992 -0.499 2.227 1.00 . A A . 25 MET O 1 1 6 2885 1 1 25 MET SD S -10.062 -5.514 -0.863 1.00 . A A . 25 MET SD 1 1 6 2886 1 1 26 ASN C C -12.651 -0.368 2.852 1.00 . A A . 26 ASN C 1 1 6 2887 1 1 26 ASN CA C -12.548 0.224 1.450 1.00 . A A . 26 ASN CA 1 1 6 2888 1 1 26 ASN CB C -13.937 0.238 0.806 1.00 . A A . 26 ASN CB 1 1 6 2889 1 1 26 ASN CG C -13.901 0.131 -0.708 1.00 . A A . 26 ASN CG 1 1 6 2890 1 1 26 ASN H H -11.822 -0.795 -0.270 1.00 . A A . 26 ASN H 1 1 6 2891 1 1 26 ASN HA H -12.192 1.241 1.532 1.00 . A A . 26 ASN HA 1 1 6 2892 1 1 26 ASN HB2 H -14.506 -0.590 1.193 1.00 . A A . 26 ASN HB2 1 1 6 2893 1 1 26 ASN HB3 H -14.435 1.160 1.069 1.00 . A A . 26 ASN HB3 1 1 6 2894 1 1 26 ASN HD21 H -14.952 1.811 -0.876 1.00 . A A . 26 ASN HD21 1 1 6 2895 1 1 26 ASN HD22 H -14.508 1.051 -2.363 1.00 . A A . 26 ASN HD22 1 1 6 2896 1 1 26 ASN N N -11.582 -0.518 0.638 1.00 . A A . 26 ASN N 1 1 6 2897 1 1 26 ASN ND2 N -14.516 1.096 -1.384 1.00 . A A . 26 ASN ND2 1 1 6 2898 1 1 26 ASN O O -12.963 -1.546 3.024 1.00 . A A . 26 ASN O 1 1 6 2899 1 1 26 ASN OD1 O -13.327 -0.805 -1.263 1.00 . A A . 26 ASN OD1 1 1 6 2900 1 1 27 ARG C C -11.228 -0.812 5.599 1.00 . A A . 27 ARG C 1 1 6 2901 1 1 27 ARG CA C -12.433 0.048 5.247 1.00 . A A . 27 ARG CA 1 1 6 2902 1 1 27 ARG CB C -13.729 -0.712 5.540 1.00 . A A . 27 ARG CB 1 1 6 2903 1 1 27 ARG CD C -14.514 -1.423 7.821 1.00 . A A . 27 ARG CD 1 1 6 2904 1 1 27 ARG CG C -14.409 -0.277 6.827 1.00 . A A . 27 ARG CG 1 1 6 2905 1 1 27 ARG CZ C -16.851 -1.146 8.552 1.00 . A A . 27 ARG CZ 1 1 6 2906 1 1 27 ARG H H -12.135 1.385 3.637 1.00 . A A . 27 ARG H 1 1 6 2907 1 1 27 ARG HA H -12.405 0.939 5.853 1.00 . A A . 27 ARG HA 1 1 6 2908 1 1 27 ARG HB2 H -14.417 -0.554 4.722 1.00 . A A . 27 ARG HB2 1 1 6 2909 1 1 27 ARG HB3 H -13.507 -1.768 5.611 1.00 . A A . 27 ARG HB3 1 1 6 2910 1 1 27 ARG HD2 H -14.751 -2.328 7.282 1.00 . A A . 27 ARG HD2 1 1 6 2911 1 1 27 ARG HD3 H -13.563 -1.540 8.319 1.00 . A A . 27 ARG HD3 1 1 6 2912 1 1 27 ARG HE H -15.259 -1.045 9.750 1.00 . A A . 27 ARG HE 1 1 6 2913 1 1 27 ARG HG2 H -13.834 0.520 7.274 1.00 . A A . 27 ARG HG2 1 1 6 2914 1 1 27 ARG HG3 H -15.402 0.079 6.595 1.00 . A A . 27 ARG HG3 1 1 6 2915 1 1 27 ARG HH11 H -16.629 -1.500 6.573 1.00 . A A . 27 ARG HH11 1 1 6 2916 1 1 27 ARG HH12 H -18.262 -1.301 7.112 1.00 . A A . 27 ARG HH12 1 1 6 2917 1 1 27 ARG HH21 H -17.407 -0.785 10.461 1.00 . A A . 27 ARG HH21 1 1 6 2918 1 1 27 ARG HH22 H -18.704 -0.896 9.319 1.00 . A A . 27 ARG HH22 1 1 6 2919 1 1 27 ARG N N -12.381 0.465 3.849 1.00 . A A . 27 ARG N 1 1 6 2920 1 1 27 ARG NE N -15.549 -1.185 8.824 1.00 . A A . 27 ARG NE 1 1 6 2921 1 1 27 ARG NH1 N -17.283 -1.331 7.310 1.00 . A A . 27 ARG NH1 1 1 6 2922 1 1 27 ARG NH2 N -17.726 -0.924 9.524 1.00 . A A . 27 ARG NH2 1 1 6 2923 1 1 27 ARG O O -11.294 -1.662 6.487 1.00 . A A . 27 ARG O 1 1 6 2924 1 1 28 LYS C C -7.830 -0.988 4.081 1.00 . A A . 28 LYS C 1 1 6 2925 1 1 28 LYS CA C -8.888 -1.329 5.129 1.00 . A A . 28 LYS CA 1 1 6 2926 1 1 28 LYS CB C -9.160 -2.839 5.113 1.00 . A A . 28 LYS CB 1 1 6 2927 1 1 28 LYS CD C -9.271 -3.130 7.607 1.00 . A A . 28 LYS CD 1 1 6 2928 1 1 28 LYS CE C -8.459 -3.528 8.828 1.00 . A A . 28 LYS CE 1 1 6 2929 1 1 28 LYS CG C -8.595 -3.570 6.319 1.00 . A A . 28 LYS CG 1 1 6 2930 1 1 28 LYS H H -10.141 0.117 4.205 1.00 . A A . 28 LYS H 1 1 6 2931 1 1 28 LYS HA H -8.514 -1.052 6.102 1.00 . A A . 28 LYS HA 1 1 6 2932 1 1 28 LYS HB2 H -10.227 -3.002 5.088 1.00 . A A . 28 LYS HB2 1 1 6 2933 1 1 28 LYS HB3 H -8.720 -3.264 4.223 1.00 . A A . 28 LYS HB3 1 1 6 2934 1 1 28 LYS HD2 H -9.381 -2.055 7.595 1.00 . A A . 28 LYS HD2 1 1 6 2935 1 1 28 LYS HD3 H -10.246 -3.592 7.667 1.00 . A A . 28 LYS HD3 1 1 6 2936 1 1 28 LYS HE2 H -8.850 -4.456 9.218 1.00 . A A . 28 LYS HE2 1 1 6 2937 1 1 28 LYS HE3 H -7.430 -3.669 8.530 1.00 . A A . 28 LYS HE3 1 1 6 2938 1 1 28 LYS HG2 H -8.748 -4.631 6.189 1.00 . A A . 28 LYS HG2 1 1 6 2939 1 1 28 LYS HG3 H -7.537 -3.364 6.390 1.00 . A A . 28 LYS HG3 1 1 6 2940 1 1 28 LYS HZ1 H -9.272 -2.720 10.574 1.00 . A A . 28 LYS HZ1 1 1 6 2941 1 1 28 LYS HZ2 H -8.710 -1.559 9.480 1.00 . A A . 28 LYS HZ2 1 1 6 2942 1 1 28 LYS HZ3 H -7.609 -2.452 10.405 1.00 . A A . 28 LYS HZ3 1 1 6 2943 1 1 28 LYS N N -10.124 -0.580 4.895 1.00 . A A . 28 LYS N 1 1 6 2944 1 1 28 LYS NZ N -8.516 -2.493 9.896 1.00 . A A . 28 LYS NZ 1 1 6 2945 1 1 28 LYS O O -7.860 -1.506 2.967 1.00 . A A . 28 LYS O 1 1 6 2946 1 1 29 CYS C C -4.858 -0.845 3.298 1.00 . A A . 29 CYS C 1 1 6 2947 1 1 29 CYS CA C -5.836 0.294 3.545 1.00 . A A . 29 CYS CA 1 1 6 2948 1 1 29 CYS CB C -5.122 1.522 4.122 1.00 . A A . 29 CYS CB 1 1 6 2949 1 1 29 CYS H H -6.924 0.270 5.345 1.00 . A A . 29 CYS H 1 1 6 2950 1 1 29 CYS HA H -6.293 0.567 2.613 1.00 . A A . 29 CYS HA 1 1 6 2951 1 1 29 CYS HB2 H -5.541 2.398 3.669 1.00 . A A . 29 CYS HB2 1 1 6 2952 1 1 29 CYS HB3 H -5.311 1.554 5.177 1.00 . A A . 29 CYS HB3 1 1 6 2953 1 1 29 CYS N N -6.897 -0.114 4.448 1.00 . A A . 29 CYS N 1 1 6 2954 1 1 29 CYS O O -4.819 -1.823 4.044 1.00 . A A . 29 CYS O 1 1 6 2955 1 1 29 CYS SG S -3.310 1.596 3.883 1.00 . A A . 29 CYS SG 1 1 6 2956 1 1 30 LYS C C -2.382 -1.361 0.573 1.00 . A A . 30 LYS C 1 1 6 2957 1 1 30 LYS CA C -3.073 -1.707 1.886 1.00 . A A . 30 LYS CA 1 1 6 2958 1 1 30 LYS CB C -3.702 -3.103 1.801 1.00 . A A . 30 LYS CB 1 1 6 2959 1 1 30 LYS CD C -5.559 -4.511 0.863 1.00 . A A . 30 LYS CD 1 1 6 2960 1 1 30 LYS CE C -5.649 -5.435 2.067 1.00 . A A . 30 LYS CE 1 1 6 2961 1 1 30 LYS CG C -5.125 -3.111 1.266 1.00 . A A . 30 LYS CG 1 1 6 2962 1 1 30 LYS H H -4.148 0.112 1.700 1.00 . A A . 30 LYS H 1 1 6 2963 1 1 30 LYS HA H -2.326 -1.713 2.667 1.00 . A A . 30 LYS HA 1 1 6 2964 1 1 30 LYS HB2 H -3.096 -3.718 1.153 1.00 . A A . 30 LYS HB2 1 1 6 2965 1 1 30 LYS HB3 H -3.712 -3.540 2.790 1.00 . A A . 30 LYS HB3 1 1 6 2966 1 1 30 LYS HD2 H -6.529 -4.455 0.392 1.00 . A A . 30 LYS HD2 1 1 6 2967 1 1 30 LYS HD3 H -4.841 -4.914 0.164 1.00 . A A . 30 LYS HD3 1 1 6 2968 1 1 30 LYS HE2 H -5.506 -6.452 1.735 1.00 . A A . 30 LYS HE2 1 1 6 2969 1 1 30 LYS HE3 H -4.869 -5.171 2.766 1.00 . A A . 30 LYS HE3 1 1 6 2970 1 1 30 LYS HG2 H -5.791 -2.746 2.032 1.00 . A A . 30 LYS HG2 1 1 6 2971 1 1 30 LYS HG3 H -5.176 -2.467 0.403 1.00 . A A . 30 LYS HG3 1 1 6 2972 1 1 30 LYS HZ1 H -7.676 -5.907 2.252 1.00 . A A . 30 LYS HZ1 1 1 6 2973 1 1 30 LYS HZ2 H -7.289 -4.341 2.759 1.00 . A A . 30 LYS HZ2 1 1 6 2974 1 1 30 LYS HZ3 H -6.890 -5.666 3.732 1.00 . A A . 30 LYS HZ3 1 1 6 2975 1 1 30 LYS N N -4.067 -0.701 2.245 1.00 . A A . 30 LYS N 1 1 6 2976 1 1 30 LYS NZ N -6.968 -5.329 2.749 1.00 . A A . 30 LYS NZ 1 1 6 2977 1 1 30 LYS O O -2.776 -1.826 -0.495 1.00 . A A . 30 LYS O 1 1 6 2978 1 1 31 CYS C C -0.333 -1.189 -1.498 1.00 . A A . 31 CYS C 1 1 6 2979 1 1 31 CYS CA C -0.532 -0.100 -0.459 1.00 . A A . 31 CYS CA 1 1 6 2980 1 1 31 CYS CB C 0.830 0.399 0.037 1.00 . A A . 31 CYS CB 1 1 6 2981 1 1 31 CYS H H -1.102 -0.220 1.577 1.00 . A A . 31 CYS H 1 1 6 2982 1 1 31 CYS HA H -1.030 0.720 -0.950 1.00 . A A . 31 CYS HA 1 1 6 2983 1 1 31 CYS HB2 H 1.299 0.976 -0.745 1.00 . A A . 31 CYS HB2 1 1 6 2984 1 1 31 CYS HB3 H 0.675 1.030 0.899 1.00 . A A . 31 CYS HB3 1 1 6 2985 1 1 31 CYS N N -1.341 -0.541 0.684 1.00 . A A . 31 CYS N 1 1 6 2986 1 1 31 CYS O O -0.694 -2.346 -1.310 1.00 . A A . 31 CYS O 1 1 6 2987 1 1 31 CYS SG S 1.994 -0.924 0.517 1.00 . A A . 31 CYS SG 1 1 6 2988 1 1 32 ASN C C 1.859 -2.270 -3.639 1.00 . A A . 32 ASN C 1 1 6 2989 1 1 32 ASN CA C 0.479 -1.644 -3.738 1.00 . A A . 32 ASN CA 1 1 6 2990 1 1 32 ASN CB C 0.381 -0.832 -5.011 1.00 . A A . 32 ASN CB 1 1 6 2991 1 1 32 ASN CG C -0.068 -1.649 -6.207 1.00 . A A . 32 ASN CG 1 1 6 2992 1 1 32 ASN H H 0.440 0.182 -2.692 1.00 . A A . 32 ASN H 1 1 6 2993 1 1 32 ASN HA H -0.259 -2.419 -3.760 1.00 . A A . 32 ASN HA 1 1 6 2994 1 1 32 ASN HB2 H -0.322 -0.035 -4.855 1.00 . A A . 32 ASN HB2 1 1 6 2995 1 1 32 ASN HB3 H 1.343 -0.412 -5.217 1.00 . A A . 32 ASN HB3 1 1 6 2996 1 1 32 ASN HD21 H -1.923 -1.716 -5.496 1.00 . A A . 32 ASN HD21 1 1 6 2997 1 1 32 ASN HD22 H -1.665 -2.529 -6.999 1.00 . A A . 32 ASN HD22 1 1 6 2998 1 1 32 ASN N N 0.219 -0.770 -2.612 1.00 . A A . 32 ASN N 1 1 6 2999 1 1 32 ASN ND2 N -1.348 -2.000 -6.237 1.00 . A A . 32 ASN ND2 1 1 6 3000 1 1 32 ASN O O 2.605 -2.025 -2.693 1.00 . A A . 32 ASN O 1 1 6 3001 1 1 32 ASN OD1 O 0.728 -1.961 -7.094 1.00 . A A . 32 ASN OD1 1 1 6 3002 1 1 33 ARG C C 3.885 -4.001 -6.131 1.00 . A A . 33 ARG C 1 1 6 3003 1 1 33 ARG CA C 3.487 -3.732 -4.695 1.00 . A A . 33 ARG CA 1 1 6 3004 1 1 33 ARG CB C 3.476 -5.031 -3.886 1.00 . A A . 33 ARG CB 1 1 6 3005 1 1 33 ARG CD C 4.985 -4.245 -2.037 1.00 . A A . 33 ARG CD 1 1 6 3006 1 1 33 ARG CG C 4.767 -5.284 -3.125 1.00 . A A . 33 ARG CG 1 1 6 3007 1 1 33 ARG CZ C 4.909 -5.516 0.072 1.00 . A A . 33 ARG CZ 1 1 6 3008 1 1 33 ARG H H 1.545 -3.214 -5.361 1.00 . A A . 33 ARG H 1 1 6 3009 1 1 33 ARG HA H 4.213 -3.054 -4.277 1.00 . A A . 33 ARG HA 1 1 6 3010 1 1 33 ARG HB2 H 2.666 -4.992 -3.174 1.00 . A A . 33 ARG HB2 1 1 6 3011 1 1 33 ARG HB3 H 3.312 -5.860 -4.560 1.00 . A A . 33 ARG HB3 1 1 6 3012 1 1 33 ARG HD2 H 5.636 -3.473 -2.418 1.00 . A A . 33 ARG HD2 1 1 6 3013 1 1 33 ARG HD3 H 4.030 -3.812 -1.775 1.00 . A A . 33 ARG HD3 1 1 6 3014 1 1 33 ARG HE H 6.551 -4.690 -0.708 1.00 . A A . 33 ARG HE 1 1 6 3015 1 1 33 ARG HG2 H 4.721 -6.262 -2.670 1.00 . A A . 33 ARG HG2 1 1 6 3016 1 1 33 ARG HG3 H 5.596 -5.247 -3.818 1.00 . A A . 33 ARG HG3 1 1 6 3017 1 1 33 ARG HH11 H 3.128 -5.350 -0.869 1.00 . A A . 33 ARG HH11 1 1 6 3018 1 1 33 ARG HH12 H 3.102 -6.240 0.616 1.00 . A A . 33 ARG HH12 1 1 6 3019 1 1 33 ARG HH21 H 6.519 -5.861 1.246 1.00 . A A . 33 ARG HH21 1 1 6 3020 1 1 33 ARG HH22 H 5.027 -6.529 1.818 1.00 . A A . 33 ARG HH22 1 1 6 3021 1 1 33 ARG N N 2.190 -3.072 -4.638 1.00 . A A . 33 ARG N 1 1 6 3022 1 1 33 ARG NE N 5.589 -4.824 -0.839 1.00 . A A . 33 ARG NE 1 1 6 3023 1 1 33 ARG NH1 N 3.606 -5.719 -0.072 1.00 . A A . 33 ARG NH1 1 1 6 3024 1 1 33 ARG NH2 N 5.537 -6.009 1.133 1.00 . A A . 33 ARG NH2 1 1 6 3025 1 1 33 ARG O O 3.806 -5.126 -6.624 1.00 . A A . 33 ARG O 1 1 6 3026 1 1 34 CYS C C 6.076 -3.645 -8.303 1.00 . A A . 34 CYS C 1 1 6 3027 1 1 34 CYS CA C 4.721 -2.961 -8.139 1.00 . A A . 34 CYS CA 1 1 6 3028 1 1 34 CYS CB C 4.785 -1.513 -8.567 1.00 . A A . 34 CYS CB 1 1 6 3029 1 1 34 CYS H H 4.337 -2.080 -6.346 1.00 . A A . 34 CYS H 1 1 6 3030 1 1 34 CYS HA H 3.977 -3.475 -8.726 1.00 . A A . 34 CYS HA 1 1 6 3031 1 1 34 CYS HB2 H 5.193 -1.478 -9.513 1.00 . A A . 34 CYS HB2 1 1 6 3032 1 1 34 CYS HB3 H 3.785 -1.110 -8.586 1.00 . A A . 34 CYS HB3 1 1 6 3033 1 1 34 CYS N N 4.307 -2.938 -6.788 1.00 . A A . 34 CYS N 1 1 6 3034 1 1 34 CYS O O 6.822 -3.725 -7.305 1.00 . A A . 34 CYS O 1 1 6 3035 1 1 34 CYS OXT O 6.379 -4.093 -9.429 1.00 . A A . 34 CYS OXT 1 1 6 3036 1 1 34 CYS SG S 5.791 -0.430 -7.499 1.00 . A A . 34 CYS SG 1 1 7 3037 1 1 1 VAL C C -8.457 4.529 -6.235 1.00 . A A . 1 VAL C 1 1 7 3038 1 1 1 VAL CA C -7.896 4.920 -7.597 1.00 . A A . 1 VAL CA 1 1 7 3039 1 1 1 VAL CB C -6.648 5.798 -7.390 1.00 . A A . 1 VAL CB 1 1 7 3040 1 1 1 VAL CG1 C -5.934 6.033 -8.711 1.00 . A A . 1 VAL CG1 1 1 7 3041 1 1 1 VAL CG2 C -7.026 7.118 -6.737 1.00 . A A . 1 VAL CG2 1 1 7 3042 1 1 1 VAL H1 H -8.419 6.205 -9.116 1.00 . A A . 1 VAL H1 1 1 7 3043 1 1 1 VAL H2 H -9.489 6.211 -7.774 1.00 . A A . 1 VAL H2 1 1 7 3044 1 1 1 VAL H3 H -9.504 4.899 -8.881 1.00 . A A . 1 VAL H3 1 1 7 3045 1 1 1 VAL HA H -7.599 4.023 -8.121 1.00 . A A . 1 VAL HA 1 1 7 3046 1 1 1 VAL HB H -5.972 5.276 -6.729 1.00 . A A . 1 VAL HB 1 1 7 3047 1 1 1 VAL HG11 H -6.432 6.822 -9.255 1.00 . A A . 1 VAL HG11 1 1 7 3048 1 1 1 VAL HG12 H -5.952 5.126 -9.298 1.00 . A A . 1 VAL HG12 1 1 7 3049 1 1 1 VAL HG13 H -4.909 6.318 -8.522 1.00 . A A . 1 VAL HG13 1 1 7 3050 1 1 1 VAL HG21 H -7.562 6.926 -5.818 1.00 . A A . 1 VAL HG21 1 1 7 3051 1 1 1 VAL HG22 H -7.657 7.684 -7.408 1.00 . A A . 1 VAL HG22 1 1 7 3052 1 1 1 VAL HG23 H -6.132 7.683 -6.521 1.00 . A A . 1 VAL HG23 1 1 7 3053 1 1 1 VAL N N -8.919 5.621 -8.416 1.00 . A A . 1 VAL N 1 1 7 3054 1 1 1 VAL O O -9.185 5.299 -5.608 1.00 . A A . 1 VAL O 1 1 7 3055 1 1 2 SER C C -7.886 3.564 -3.345 1.00 . A A . 2 SER C 1 1 7 3056 1 1 2 SER CA C -8.582 2.837 -4.491 1.00 . A A . 2 SER CA 1 1 7 3057 1 1 2 SER CB C -8.338 1.330 -4.377 1.00 . A A . 2 SER CB 1 1 7 3058 1 1 2 SER H H -7.529 2.761 -6.325 1.00 . A A . 2 SER H 1 1 7 3059 1 1 2 SER HA H -9.643 3.025 -4.429 1.00 . A A . 2 SER HA 1 1 7 3060 1 1 2 SER HB2 H -7.305 1.154 -4.115 1.00 . A A . 2 SER HB2 1 1 7 3061 1 1 2 SER HB3 H -8.979 0.921 -3.610 1.00 . A A . 2 SER HB3 1 1 7 3062 1 1 2 SER HG H -9.459 0.979 -5.945 1.00 . A A . 2 SER HG 1 1 7 3063 1 1 2 SER N N -8.113 3.329 -5.780 1.00 . A A . 2 SER N 1 1 7 3064 1 1 2 SER O O -6.660 3.547 -3.240 1.00 . A A . 2 SER O 1 1 7 3065 1 1 2 SER OG O -8.616 0.675 -5.602 1.00 . A A . 2 SER OG 1 1 7 3066 1 1 3 CYS C C -7.197 6.041 -1.815 1.00 . A A . 3 CYS C 1 1 7 3067 1 1 3 CYS CA C -8.137 4.934 -1.348 1.00 . A A . 3 CYS CA 1 1 7 3068 1 1 3 CYS CB C -7.398 3.986 -0.397 1.00 . A A . 3 CYS CB 1 1 7 3069 1 1 3 CYS H H -9.648 4.177 -2.624 1.00 . A A . 3 CYS H 1 1 7 3070 1 1 3 CYS HA H -8.966 5.383 -0.821 1.00 . A A . 3 CYS HA 1 1 7 3071 1 1 3 CYS HB2 H -6.377 3.878 -0.730 1.00 . A A . 3 CYS HB2 1 1 7 3072 1 1 3 CYS HB3 H -7.401 4.411 0.596 1.00 . A A . 3 CYS HB3 1 1 7 3073 1 1 3 CYS N N -8.677 4.200 -2.487 1.00 . A A . 3 CYS N 1 1 7 3074 1 1 3 CYS O O -6.780 6.067 -2.973 1.00 . A A . 3 CYS O 1 1 7 3075 1 1 3 CYS SG S -8.125 2.318 -0.289 1.00 . A A . 3 CYS SG 1 1 7 3076 1 1 4 THR C C -4.856 8.170 -0.200 1.00 . A A . 4 THR C 1 1 7 3077 1 1 4 THR CA C -5.976 8.061 -1.226 1.00 . A A . 4 THR CA 1 1 7 3078 1 1 4 THR CB C -6.761 9.373 -1.283 1.00 . A A . 4 THR CB 1 1 7 3079 1 1 4 THR CG2 C -7.803 9.399 -2.380 1.00 . A A . 4 THR CG2 1 1 7 3080 1 1 4 THR H H -7.232 6.878 0.000 1.00 . A A . 4 THR H 1 1 7 3081 1 1 4 THR HA H -5.543 7.869 -2.197 1.00 . A A . 4 THR HA 1 1 7 3082 1 1 4 THR HB H -6.071 10.186 -1.462 1.00 . A A . 4 THR HB 1 1 7 3083 1 1 4 THR HG1 H -6.823 9.438 0.673 1.00 . A A . 4 THR HG1 1 1 7 3084 1 1 4 THR HG21 H -7.690 10.302 -2.962 1.00 . A A . 4 THR HG21 1 1 7 3085 1 1 4 THR HG22 H -8.789 9.375 -1.941 1.00 . A A . 4 THR HG22 1 1 7 3086 1 1 4 THR HG23 H -7.673 8.540 -3.022 1.00 . A A . 4 THR HG23 1 1 7 3087 1 1 4 THR N N -6.867 6.952 -0.907 1.00 . A A . 4 THR N 1 1 7 3088 1 1 4 THR O O -4.430 9.269 0.157 1.00 . A A . 4 THR O 1 1 7 3089 1 1 4 THR OG1 O -7.424 9.614 -0.054 1.00 . A A . 4 THR OG1 1 1 7 3090 1 1 5 GLY C C -3.758 7.560 2.596 1.00 . A A . 5 GLY C 1 1 7 3091 1 1 5 GLY CA C -3.316 7.010 1.255 1.00 . A A . 5 GLY CA 1 1 7 3092 1 1 5 GLY H H -4.760 6.177 -0.048 1.00 . A A . 5 GLY H 1 1 7 3093 1 1 5 GLY HA2 H -2.976 5.993 1.389 1.00 . A A . 5 GLY HA2 1 1 7 3094 1 1 5 GLY HA3 H -2.494 7.607 0.887 1.00 . A A . 5 GLY HA3 1 1 7 3095 1 1 5 GLY N N -4.382 7.022 0.273 1.00 . A A . 5 GLY N 1 1 7 3096 1 1 5 GLY O O -2.967 8.170 3.316 1.00 . A A . 5 GLY O 1 1 7 3097 1 1 6 SER C C -4.806 7.235 5.376 1.00 . A A . 6 SER C 1 1 7 3098 1 1 6 SER CA C -5.572 7.823 4.196 1.00 . A A . 6 SER CA 1 1 7 3099 1 1 6 SER CB C -7.058 7.469 4.304 1.00 . A A . 6 SER CB 1 1 7 3100 1 1 6 SER H H -5.606 6.852 2.315 1.00 . A A . 6 SER H 1 1 7 3101 1 1 6 SER HA H -5.466 8.897 4.214 1.00 . A A . 6 SER HA 1 1 7 3102 1 1 6 SER HB2 H -7.193 6.711 5.060 1.00 . A A . 6 SER HB2 1 1 7 3103 1 1 6 SER HB3 H -7.617 8.352 4.575 1.00 . A A . 6 SER HB3 1 1 7 3104 1 1 6 SER HG H -8.075 7.658 2.638 1.00 . A A . 6 SER HG 1 1 7 3105 1 1 6 SER N N -5.025 7.345 2.932 1.00 . A A . 6 SER N 1 1 7 3106 1 1 6 SER O O -3.996 6.325 5.208 1.00 . A A . 6 SER O 1 1 7 3107 1 1 6 SER OG O -7.558 6.975 3.073 1.00 . A A . 6 SER OG 1 1 7 3108 1 1 7 LYS C C -2.912 7.111 7.571 1.00 . A A . 7 LYS C 1 1 7 3109 1 1 7 LYS CA C -4.403 7.332 7.795 1.00 . A A . 7 LYS CA 1 1 7 3110 1 1 7 LYS CB C -5.060 6.059 8.345 1.00 . A A . 7 LYS CB 1 1 7 3111 1 1 7 LYS CD C -6.267 4.683 6.624 1.00 . A A . 7 LYS CD 1 1 7 3112 1 1 7 LYS CE C -5.989 4.312 5.176 1.00 . A A . 7 LYS CE 1 1 7 3113 1 1 7 LYS CG C -4.981 4.858 7.417 1.00 . A A . 7 LYS CG 1 1 7 3114 1 1 7 LYS H H -5.709 8.507 6.619 1.00 . A A . 7 LYS H 1 1 7 3115 1 1 7 LYS HA H -4.521 8.120 8.523 1.00 . A A . 7 LYS HA 1 1 7 3116 1 1 7 LYS HB2 H -4.577 5.796 9.274 1.00 . A A . 7 LYS HB2 1 1 7 3117 1 1 7 LYS HB3 H -6.102 6.265 8.541 1.00 . A A . 7 LYS HB3 1 1 7 3118 1 1 7 LYS HD2 H -6.855 3.899 7.078 1.00 . A A . 7 LYS HD2 1 1 7 3119 1 1 7 LYS HD3 H -6.822 5.610 6.649 1.00 . A A . 7 LYS HD3 1 1 7 3120 1 1 7 LYS HE2 H -5.964 5.215 4.585 1.00 . A A . 7 LYS HE2 1 1 7 3121 1 1 7 LYS HE3 H -5.030 3.819 5.123 1.00 . A A . 7 LYS HE3 1 1 7 3122 1 1 7 LYS HG2 H -4.160 4.992 6.733 1.00 . A A . 7 LYS HG2 1 1 7 3123 1 1 7 LYS HG3 H -4.814 3.970 8.010 1.00 . A A . 7 LYS HG3 1 1 7 3124 1 1 7 LYS HZ1 H -7.391 2.776 5.374 1.00 . A A . 7 LYS HZ1 1 1 7 3125 1 1 7 LYS HZ2 H -6.634 2.822 3.862 1.00 . A A . 7 LYS HZ2 1 1 7 3126 1 1 7 LYS HZ3 H -7.825 3.960 4.245 1.00 . A A . 7 LYS HZ3 1 1 7 3127 1 1 7 LYS N N -5.063 7.776 6.566 1.00 . A A . 7 LYS N 1 1 7 3128 1 1 7 LYS NZ N -7.033 3.404 4.625 1.00 . A A . 7 LYS NZ 1 1 7 3129 1 1 7 LYS O O -2.298 6.252 8.202 1.00 . A A . 7 LYS O 1 1 7 3130 1 1 8 ASP C C -0.525 6.375 6.046 1.00 . A A . 8 ASP C 1 1 7 3131 1 1 8 ASP CA C -0.929 7.811 6.318 1.00 . A A . 8 ASP CA 1 1 7 3132 1 1 8 ASP CB C -0.063 8.407 7.424 1.00 . A A . 8 ASP CB 1 1 7 3133 1 1 8 ASP CG C -0.139 7.633 8.726 1.00 . A A . 8 ASP CG 1 1 7 3134 1 1 8 ASP H H -2.905 8.545 6.184 1.00 . A A . 8 ASP H 1 1 7 3135 1 1 8 ASP HA H -0.777 8.383 5.415 1.00 . A A . 8 ASP HA 1 1 7 3136 1 1 8 ASP HB2 H 0.962 8.413 7.093 1.00 . A A . 8 ASP HB2 1 1 7 3137 1 1 8 ASP HB3 H -0.384 9.421 7.609 1.00 . A A . 8 ASP HB3 1 1 7 3138 1 1 8 ASP N N -2.347 7.895 6.655 1.00 . A A . 8 ASP N 1 1 7 3139 1 1 8 ASP O O 0.421 5.849 6.630 1.00 . A A . 8 ASP O 1 1 7 3140 1 1 8 ASP OD1 O -1.041 7.927 9.539 1.00 . A A . 8 ASP OD1 1 1 7 3141 1 1 8 ASP OD2 O 0.702 6.734 8.932 1.00 . A A . 8 ASP OD2 1 1 7 3142 1 1 9 CYS C C -0.121 4.275 3.551 1.00 . A A . 9 CYS C 1 1 7 3143 1 1 9 CYS CA C -1.023 4.370 4.772 1.00 . A A . 9 CYS CA 1 1 7 3144 1 1 9 CYS CB C -2.334 3.657 4.491 1.00 . A A . 9 CYS CB 1 1 7 3145 1 1 9 CYS H H -2.007 6.252 4.740 1.00 . A A . 9 CYS H 1 1 7 3146 1 1 9 CYS HA H -0.543 3.884 5.591 1.00 . A A . 9 CYS HA 1 1 7 3147 1 1 9 CYS HB2 H -3.104 4.103 5.091 1.00 . A A . 9 CYS HB2 1 1 7 3148 1 1 9 CYS HB3 H -2.575 3.780 3.454 1.00 . A A . 9 CYS HB3 1 1 7 3149 1 1 9 CYS N N -1.267 5.756 5.152 1.00 . A A . 9 CYS N 1 1 7 3150 1 1 9 CYS O O 1.023 3.832 3.641 1.00 . A A . 9 CYS O 1 1 7 3151 1 1 9 CYS SG S -2.306 1.870 4.850 1.00 . A A . 9 CYS SG 1 1 7 3152 1 1 10 TYR C C 1.447 5.343 1.284 1.00 . A A . 10 TYR C 1 1 7 3153 1 1 10 TYR CA C 0.094 4.646 1.157 1.00 . A A . 10 TYR CA 1 1 7 3154 1 1 10 TYR CB C -0.718 5.297 0.034 1.00 . A A . 10 TYR CB 1 1 7 3155 1 1 10 TYR CD1 C -2.327 3.352 0.241 1.00 . A A . 10 TYR CD1 1 1 7 3156 1 1 10 TYR CD2 C -2.456 4.723 -1.705 1.00 . A A . 10 TYR CD2 1 1 7 3157 1 1 10 TYR CE1 C -3.363 2.571 -0.235 1.00 . A A . 10 TYR CE1 1 1 7 3158 1 1 10 TYR CE2 C -3.494 3.946 -2.187 1.00 . A A . 10 TYR CE2 1 1 7 3159 1 1 10 TYR CG C -1.855 4.441 -0.485 1.00 . A A . 10 TYR CG 1 1 7 3160 1 1 10 TYR CZ C -3.943 2.873 -1.448 1.00 . A A . 10 TYR CZ 1 1 7 3161 1 1 10 TYR H H -1.572 5.023 2.407 1.00 . A A . 10 TYR H 1 1 7 3162 1 1 10 TYR HA H 0.262 3.610 0.908 1.00 . A A . 10 TYR HA 1 1 7 3163 1 1 10 TYR HB2 H -1.141 6.221 0.397 1.00 . A A . 10 TYR HB2 1 1 7 3164 1 1 10 TYR HB3 H -0.060 5.512 -0.795 1.00 . A A . 10 TYR HB3 1 1 7 3165 1 1 10 TYR HD1 H -1.871 3.116 1.192 1.00 . A A . 10 TYR HD1 1 1 7 3166 1 1 10 TYR HD2 H -2.103 5.564 -2.283 1.00 . A A . 10 TYR HD2 1 1 7 3167 1 1 10 TYR HE1 H -3.714 1.730 0.345 1.00 . A A . 10 TYR HE1 1 1 7 3168 1 1 10 TYR HE2 H -3.948 4.184 -3.138 1.00 . A A . 10 TYR HE2 1 1 7 3169 1 1 10 TYR HH H -5.712 2.661 -2.168 1.00 . A A . 10 TYR HH 1 1 7 3170 1 1 10 TYR N N -0.652 4.687 2.409 1.00 . A A . 10 TYR N 1 1 7 3171 1 1 10 TYR O O 2.350 5.099 0.489 1.00 . A A . 10 TYR O 1 1 7 3172 1 1 10 TYR OH O -4.975 2.098 -1.925 1.00 . A A . 10 TYR OH 1 1 7 3173 1 1 11 ALA C C 3.941 6.030 2.992 1.00 . A A . 11 ALA C 1 1 7 3174 1 1 11 ALA CA C 2.830 6.944 2.481 1.00 . A A . 11 ALA CA 1 1 7 3175 1 1 11 ALA CB C 2.619 8.120 3.425 1.00 . A A . 11 ALA CB 1 1 7 3176 1 1 11 ALA H H 0.825 6.381 2.883 1.00 . A A . 11 ALA H 1 1 7 3177 1 1 11 ALA HA H 3.133 7.335 1.521 1.00 . A A . 11 ALA HA 1 1 7 3178 1 1 11 ALA HB1 H 1.829 7.883 4.123 1.00 . A A . 11 ALA HB1 1 1 7 3179 1 1 11 ALA HB2 H 2.346 8.995 2.854 1.00 . A A . 11 ALA HB2 1 1 7 3180 1 1 11 ALA HB3 H 3.533 8.314 3.967 1.00 . A A . 11 ALA HB3 1 1 7 3181 1 1 11 ALA N N 1.581 6.218 2.278 1.00 . A A . 11 ALA N 1 1 7 3182 1 1 11 ALA O O 4.910 5.769 2.281 1.00 . A A . 11 ALA O 1 1 7 3183 1 1 12 PRO C C 5.129 3.453 3.895 1.00 . A A . 12 PRO C 1 1 7 3184 1 1 12 PRO CA C 4.822 4.626 4.816 1.00 . A A . 12 PRO CA 1 1 7 3185 1 1 12 PRO CB C 4.173 4.137 6.120 1.00 . A A . 12 PRO CB 1 1 7 3186 1 1 12 PRO CD C 2.700 5.755 5.154 1.00 . A A . 12 PRO CD 1 1 7 3187 1 1 12 PRO CG C 2.737 4.537 6.029 1.00 . A A . 12 PRO CG 1 1 7 3188 1 1 12 PRO HA H 5.737 5.155 5.040 1.00 . A A . 12 PRO HA 1 1 7 3189 1 1 12 PRO HB2 H 4.277 3.064 6.195 1.00 . A A . 12 PRO HB2 1 1 7 3190 1 1 12 PRO HB3 H 4.658 4.608 6.962 1.00 . A A . 12 PRO HB3 1 1 7 3191 1 1 12 PRO HD2 H 1.762 5.812 4.620 1.00 . A A . 12 PRO HD2 1 1 7 3192 1 1 12 PRO HD3 H 2.862 6.648 5.738 1.00 . A A . 12 PRO HD3 1 1 7 3193 1 1 12 PRO HG2 H 2.161 3.738 5.584 1.00 . A A . 12 PRO HG2 1 1 7 3194 1 1 12 PRO HG3 H 2.358 4.770 7.013 1.00 . A A . 12 PRO HG3 1 1 7 3195 1 1 12 PRO N N 3.817 5.520 4.232 1.00 . A A . 12 PRO N 1 1 7 3196 1 1 12 PRO O O 6.206 2.859 3.959 1.00 . A A . 12 PRO O 1 1 7 3197 1 1 13 CYS C C 5.063 2.500 0.847 1.00 . A A . 13 CYS C 1 1 7 3198 1 1 13 CYS CA C 4.322 2.041 2.085 1.00 . A A . 13 CYS CA 1 1 7 3199 1 1 13 CYS CB C 2.958 1.505 1.693 1.00 . A A . 13 CYS CB 1 1 7 3200 1 1 13 CYS H H 3.338 3.649 3.031 1.00 . A A . 13 CYS H 1 1 7 3201 1 1 13 CYS HA H 4.880 1.263 2.554 1.00 . A A . 13 CYS HA 1 1 7 3202 1 1 13 CYS HB2 H 2.247 1.816 2.431 1.00 . A A . 13 CYS HB2 1 1 7 3203 1 1 13 CYS HB3 H 2.686 1.922 0.741 1.00 . A A . 13 CYS HB3 1 1 7 3204 1 1 13 CYS N N 4.171 3.133 3.033 1.00 . A A . 13 CYS N 1 1 7 3205 1 1 13 CYS O O 6.072 1.913 0.466 1.00 . A A . 13 CYS O 1 1 7 3206 1 1 13 CYS SG S 2.857 -0.309 1.554 1.00 . A A . 13 CYS SG 1 1 7 3207 1 1 14 ARG C C 6.670 4.263 -0.763 1.00 . A A . 14 ARG C 1 1 7 3208 1 1 14 ARG CA C 5.180 4.079 -0.984 1.00 . A A . 14 ARG CA 1 1 7 3209 1 1 14 ARG CB C 4.507 5.398 -1.402 1.00 . A A . 14 ARG CB 1 1 7 3210 1 1 14 ARG CD C 5.917 7.480 -1.227 1.00 . A A . 14 ARG CD 1 1 7 3211 1 1 14 ARG CG C 5.415 6.374 -2.143 1.00 . A A . 14 ARG CG 1 1 7 3212 1 1 14 ARG CZ C 8.284 7.510 -1.910 1.00 . A A . 14 ARG CZ 1 1 7 3213 1 1 14 ARG H H 3.751 3.981 0.567 1.00 . A A . 14 ARG H 1 1 7 3214 1 1 14 ARG HA H 5.042 3.341 -1.758 1.00 . A A . 14 ARG HA 1 1 7 3215 1 1 14 ARG HB2 H 3.670 5.170 -2.044 1.00 . A A . 14 ARG HB2 1 1 7 3216 1 1 14 ARG HB3 H 4.139 5.892 -0.515 1.00 . A A . 14 ARG HB3 1 1 7 3217 1 1 14 ARG HD2 H 5.715 8.434 -1.692 1.00 . A A . 14 ARG HD2 1 1 7 3218 1 1 14 ARG HD3 H 5.387 7.421 -0.287 1.00 . A A . 14 ARG HD3 1 1 7 3219 1 1 14 ARG HE H 7.634 7.188 -0.052 1.00 . A A . 14 ARG HE 1 1 7 3220 1 1 14 ARG HG2 H 6.264 5.838 -2.539 1.00 . A A . 14 ARG HG2 1 1 7 3221 1 1 14 ARG HG3 H 4.859 6.819 -2.956 1.00 . A A . 14 ARG HG3 1 1 7 3222 1 1 14 ARG HH11 H 6.975 7.851 -3.414 1.00 . A A . 14 ARG HH11 1 1 7 3223 1 1 14 ARG HH12 H 8.645 7.865 -3.868 1.00 . A A . 14 ARG HH12 1 1 7 3224 1 1 14 ARG HH21 H 9.832 7.208 -0.646 1.00 . A A . 14 ARG HH21 1 1 7 3225 1 1 14 ARG HH22 H 10.268 7.500 -2.297 1.00 . A A . 14 ARG HH22 1 1 7 3226 1 1 14 ARG N N 4.558 3.553 0.217 1.00 . A A . 14 ARG N 1 1 7 3227 1 1 14 ARG NE N 7.351 7.372 -0.971 1.00 . A A . 14 ARG NE 1 1 7 3228 1 1 14 ARG NH1 N 7.939 7.762 -3.167 1.00 . A A . 14 ARG NH1 1 1 7 3229 1 1 14 ARG NH2 N 9.567 7.396 -1.592 1.00 . A A . 14 ARG NH2 1 1 7 3230 1 1 14 ARG O O 7.479 3.965 -1.642 1.00 . A A . 14 ARG O 1 1 7 3231 1 1 15 LYS C C 9.154 3.572 0.577 1.00 . A A . 15 LYS C 1 1 7 3232 1 1 15 LYS CA C 8.431 4.899 0.761 1.00 . A A . 15 LYS CA 1 1 7 3233 1 1 15 LYS CB C 8.583 5.395 2.200 1.00 . A A . 15 LYS CB 1 1 7 3234 1 1 15 LYS CD C 8.974 7.546 3.440 1.00 . A A . 15 LYS CD 1 1 7 3235 1 1 15 LYS CE C 9.742 7.312 4.730 1.00 . A A . 15 LYS CE 1 1 7 3236 1 1 15 LYS CG C 9.461 6.629 2.328 1.00 . A A . 15 LYS CG 1 1 7 3237 1 1 15 LYS H H 6.344 4.916 1.098 1.00 . A A . 15 LYS H 1 1 7 3238 1 1 15 LYS HA H 8.850 5.627 0.083 1.00 . A A . 15 LYS HA 1 1 7 3239 1 1 15 LYS HB2 H 7.605 5.633 2.592 1.00 . A A . 15 LYS HB2 1 1 7 3240 1 1 15 LYS HB3 H 9.017 4.608 2.797 1.00 . A A . 15 LYS HB3 1 1 7 3241 1 1 15 LYS HD2 H 9.109 8.572 3.132 1.00 . A A . 15 LYS HD2 1 1 7 3242 1 1 15 LYS HD3 H 7.925 7.357 3.615 1.00 . A A . 15 LYS HD3 1 1 7 3243 1 1 15 LYS HE2 H 10.799 7.311 4.510 1.00 . A A . 15 LYS HE2 1 1 7 3244 1 1 15 LYS HE3 H 9.518 8.115 5.417 1.00 . A A . 15 LYS HE3 1 1 7 3245 1 1 15 LYS HG2 H 10.471 6.320 2.548 1.00 . A A . 15 LYS HG2 1 1 7 3246 1 1 15 LYS HG3 H 9.443 7.170 1.394 1.00 . A A . 15 LYS HG3 1 1 7 3247 1 1 15 LYS HZ1 H 10.055 5.786 6.123 1.00 . A A . 15 LYS HZ1 1 1 7 3248 1 1 15 LYS HZ2 H 9.395 5.254 4.659 1.00 . A A . 15 LYS HZ2 1 1 7 3249 1 1 15 LYS HZ3 H 8.423 6.073 5.775 1.00 . A A . 15 LYS HZ3 1 1 7 3250 1 1 15 LYS N N 7.031 4.720 0.427 1.00 . A A . 15 LYS N 1 1 7 3251 1 1 15 LYS NZ N 9.379 6.015 5.366 1.00 . A A . 15 LYS NZ 1 1 7 3252 1 1 15 LYS O O 10.233 3.512 -0.013 1.00 . A A . 15 LYS O 1 1 7 3253 1 1 16 GLN C C 9.019 0.665 -0.487 1.00 . A A . 16 GLN C 1 1 7 3254 1 1 16 GLN CA C 9.094 1.171 0.953 1.00 . A A . 16 GLN CA 1 1 7 3255 1 1 16 GLN CB C 8.362 0.202 1.882 1.00 . A A . 16 GLN CB 1 1 7 3256 1 1 16 GLN CD C 8.944 -1.121 3.953 1.00 . A A . 16 GLN CD 1 1 7 3257 1 1 16 GLN CG C 8.850 0.254 3.321 1.00 . A A . 16 GLN CG 1 1 7 3258 1 1 16 GLN H H 7.658 2.615 1.520 1.00 . A A . 16 GLN H 1 1 7 3259 1 1 16 GLN HA H 10.131 1.222 1.248 1.00 . A A . 16 GLN HA 1 1 7 3260 1 1 16 GLN HB2 H 7.308 0.439 1.873 1.00 . A A . 16 GLN HB2 1 1 7 3261 1 1 16 GLN HB3 H 8.498 -0.804 1.514 1.00 . A A . 16 GLN HB3 1 1 7 3262 1 1 16 GLN HE21 H 10.839 -1.284 3.375 1.00 . A A . 16 GLN HE21 1 1 7 3263 1 1 16 GLN HE22 H 10.203 -2.632 4.249 1.00 . A A . 16 GLN HE22 1 1 7 3264 1 1 16 GLN HG2 H 9.829 0.709 3.340 1.00 . A A . 16 GLN HG2 1 1 7 3265 1 1 16 GLN HG3 H 8.163 0.854 3.899 1.00 . A A . 16 GLN HG3 1 1 7 3266 1 1 16 GLN N N 8.532 2.505 1.075 1.00 . A A . 16 GLN N 1 1 7 3267 1 1 16 GLN NE2 N 10.113 -1.741 3.848 1.00 . A A . 16 GLN NE2 1 1 7 3268 1 1 16 GLN O O 10.043 0.433 -1.132 1.00 . A A . 16 GLN O 1 1 7 3269 1 1 16 GLN OE1 O 7.978 -1.619 4.531 1.00 . A A . 16 GLN OE1 1 1 7 3270 1 1 17 THR C C 7.889 0.997 -3.395 1.00 . A A . 17 THR C 1 1 7 3271 1 1 17 THR CA C 7.557 -0.029 -2.318 1.00 . A A . 17 THR CA 1 1 7 3272 1 1 17 THR CB C 6.100 -0.478 -2.447 1.00 . A A . 17 THR CB 1 1 7 3273 1 1 17 THR CG2 C 5.954 -1.959 -2.718 1.00 . A A . 17 THR CG2 1 1 7 3274 1 1 17 THR H H 7.017 0.675 -0.408 1.00 . A A . 17 THR H 1 1 7 3275 1 1 17 THR HA H 8.190 -0.884 -2.459 1.00 . A A . 17 THR HA 1 1 7 3276 1 1 17 THR HB H 5.640 0.057 -3.260 1.00 . A A . 17 THR HB 1 1 7 3277 1 1 17 THR HG1 H 4.622 0.366 -1.476 1.00 . A A . 17 THR HG1 1 1 7 3278 1 1 17 THR HG21 H 6.816 -2.311 -3.265 1.00 . A A . 17 THR HG21 1 1 7 3279 1 1 17 THR HG22 H 5.062 -2.132 -3.301 1.00 . A A . 17 THR HG22 1 1 7 3280 1 1 17 THR HG23 H 5.880 -2.491 -1.781 1.00 . A A . 17 THR HG23 1 1 7 3281 1 1 17 THR N N 7.793 0.474 -0.973 1.00 . A A . 17 THR N 1 1 7 3282 1 1 17 THR O O 8.726 0.759 -4.266 1.00 . A A . 17 THR O 1 1 7 3283 1 1 17 THR OG1 O 5.376 -0.188 -1.262 1.00 . A A . 17 THR OG1 1 1 7 3284 1 1 18 GLY C C 6.044 3.753 -4.723 1.00 . A A . 18 GLY C 1 1 7 3285 1 1 18 GLY CA C 7.369 3.164 -4.308 1.00 . A A . 18 GLY CA 1 1 7 3286 1 1 18 GLY H H 6.543 2.237 -2.649 1.00 . A A . 18 GLY H 1 1 7 3287 1 1 18 GLY HA2 H 7.980 3.932 -3.892 1.00 . A A . 18 GLY HA2 1 1 7 3288 1 1 18 GLY HA3 H 7.850 2.751 -5.165 1.00 . A A . 18 GLY HA3 1 1 7 3289 1 1 18 GLY N N 7.195 2.122 -3.342 1.00 . A A . 18 GLY N 1 1 7 3290 1 1 18 GLY O O 5.356 4.372 -3.914 1.00 . A A . 18 GLY O 1 1 7 3291 1 1 19 CYS C C 3.336 4.202 -5.484 1.00 . A A . 19 CYS C 1 1 7 3292 1 1 19 CYS CA C 4.433 4.030 -6.544 1.00 . A A . 19 CYS CA 1 1 7 3293 1 1 19 CYS CB C 3.946 3.128 -7.651 1.00 . A A . 19 CYS CB 1 1 7 3294 1 1 19 CYS H H 6.291 3.047 -6.556 1.00 . A A . 19 CYS H 1 1 7 3295 1 1 19 CYS HA H 4.633 4.972 -6.988 1.00 . A A . 19 CYS HA 1 1 7 3296 1 1 19 CYS HB2 H 2.884 3.231 -7.717 1.00 . A A . 19 CYS HB2 1 1 7 3297 1 1 19 CYS HB3 H 4.386 3.479 -8.567 1.00 . A A . 19 CYS HB3 1 1 7 3298 1 1 19 CYS N N 5.688 3.545 -5.985 1.00 . A A . 19 CYS N 1 1 7 3299 1 1 19 CYS O O 3.268 3.442 -4.518 1.00 . A A . 19 CYS O 1 1 7 3300 1 1 19 CYS SG S 4.334 1.345 -7.484 1.00 . A A . 19 CYS SG 1 1 7 3301 1 1 20 PRO C C 0.191 4.586 -4.778 1.00 . A A . 20 PRO C 1 1 7 3302 1 1 20 PRO CA C 1.400 5.520 -4.686 1.00 . A A . 20 PRO CA 1 1 7 3303 1 1 20 PRO CB C 0.992 6.944 -5.060 1.00 . A A . 20 PRO CB 1 1 7 3304 1 1 20 PRO CD C 2.502 6.195 -6.758 1.00 . A A . 20 PRO CD 1 1 7 3305 1 1 20 PRO CG C 1.285 7.046 -6.516 1.00 . A A . 20 PRO CG 1 1 7 3306 1 1 20 PRO HA H 1.771 5.514 -3.672 1.00 . A A . 20 PRO HA 1 1 7 3307 1 1 20 PRO HB2 H -0.059 7.086 -4.856 1.00 . A A . 20 PRO HB2 1 1 7 3308 1 1 20 PRO HB3 H 1.575 7.651 -4.489 1.00 . A A . 20 PRO HB3 1 1 7 3309 1 1 20 PRO HD2 H 2.425 5.690 -7.709 1.00 . A A . 20 PRO HD2 1 1 7 3310 1 1 20 PRO HD3 H 3.397 6.797 -6.721 1.00 . A A . 20 PRO HD3 1 1 7 3311 1 1 20 PRO HG2 H 0.447 6.673 -7.086 1.00 . A A . 20 PRO HG2 1 1 7 3312 1 1 20 PRO HG3 H 1.489 8.074 -6.777 1.00 . A A . 20 PRO HG3 1 1 7 3313 1 1 20 PRO N N 2.476 5.225 -5.644 1.00 . A A . 20 PRO N 1 1 7 3314 1 1 20 PRO O O -0.820 4.821 -4.116 1.00 . A A . 20 PRO O 1 1 7 3315 1 1 21 TYR C C -1.011 1.787 -4.458 1.00 . A A . 21 TYR C 1 1 7 3316 1 1 21 TYR CA C -0.818 2.606 -5.731 1.00 . A A . 21 TYR CA 1 1 7 3317 1 1 21 TYR CB C -0.564 1.677 -6.911 1.00 . A A . 21 TYR CB 1 1 7 3318 1 1 21 TYR CD1 C 0.215 3.573 -8.397 1.00 . A A . 21 TYR CD1 1 1 7 3319 1 1 21 TYR CD2 C 1.262 1.445 -8.646 1.00 . A A . 21 TYR CD2 1 1 7 3320 1 1 21 TYR CE1 C 1.016 4.088 -9.400 1.00 . A A . 21 TYR CE1 1 1 7 3321 1 1 21 TYR CE2 C 2.067 1.953 -9.648 1.00 . A A . 21 TYR CE2 1 1 7 3322 1 1 21 TYR CG C 0.324 2.245 -8.003 1.00 . A A . 21 TYR CG 1 1 7 3323 1 1 21 TYR CZ C 1.939 3.275 -10.021 1.00 . A A . 21 TYR CZ 1 1 7 3324 1 1 21 TYR H H 1.086 3.376 -6.102 1.00 . A A . 21 TYR H 1 1 7 3325 1 1 21 TYR HA H -1.716 3.175 -5.919 1.00 . A A . 21 TYR HA 1 1 7 3326 1 1 21 TYR HB2 H -0.111 0.767 -6.556 1.00 . A A . 21 TYR HB2 1 1 7 3327 1 1 21 TYR HB3 H -1.500 1.450 -7.354 1.00 . A A . 21 TYR HB3 1 1 7 3328 1 1 21 TYR HD1 H -0.508 4.209 -7.908 1.00 . A A . 21 TYR HD1 1 1 7 3329 1 1 21 TYR HD2 H 1.358 0.411 -8.352 1.00 . A A . 21 TYR HD2 1 1 7 3330 1 1 21 TYR HE1 H 0.916 5.123 -9.692 1.00 . A A . 21 TYR HE1 1 1 7 3331 1 1 21 TYR HE2 H 2.790 1.315 -10.134 1.00 . A A . 21 TYR HE2 1 1 7 3332 1 1 21 TYR HH H 3.638 3.470 -10.900 1.00 . A A . 21 TYR HH 1 1 7 3333 1 1 21 TYR N N 0.278 3.534 -5.587 1.00 . A A . 21 TYR N 1 1 7 3334 1 1 21 TYR O O -0.137 1.749 -3.592 1.00 . A A . 21 TYR O 1 1 7 3335 1 1 21 TYR OH O 2.739 3.784 -11.018 1.00 . A A . 21 TYR OH 1 1 7 3336 1 1 22 GLY C C -3.682 -0.557 -3.363 1.00 . A A . 22 GLY C 1 1 7 3337 1 1 22 GLY CA C -2.457 0.321 -3.183 1.00 . A A . 22 GLY CA 1 1 7 3338 1 1 22 GLY H H -2.820 1.203 -5.078 1.00 . A A . 22 GLY H 1 1 7 3339 1 1 22 GLY HA2 H -1.614 -0.304 -2.984 1.00 . A A . 22 GLY HA2 1 1 7 3340 1 1 22 GLY HA3 H -2.608 0.965 -2.336 1.00 . A A . 22 GLY HA3 1 1 7 3341 1 1 22 GLY N N -2.165 1.134 -4.353 1.00 . A A . 22 GLY N 1 1 7 3342 1 1 22 GLY O O -4.608 -0.195 -4.090 1.00 . A A . 22 GLY O 1 1 7 3343 1 1 23 LYS C C -5.798 -2.380 -1.611 1.00 . A A . 23 LYS C 1 1 7 3344 1 1 23 LYS CA C -4.841 -2.617 -2.776 1.00 . A A . 23 LYS CA 1 1 7 3345 1 1 23 LYS CB C -4.373 -4.074 -2.787 1.00 . A A . 23 LYS CB 1 1 7 3346 1 1 23 LYS CD C -5.170 -4.723 -5.080 1.00 . A A . 23 LYS CD 1 1 7 3347 1 1 23 LYS CE C -6.285 -5.410 -5.852 1.00 . A A . 23 LYS CE 1 1 7 3348 1 1 23 LYS CG C -5.275 -4.997 -3.588 1.00 . A A . 23 LYS CG 1 1 7 3349 1 1 23 LYS H H -2.953 -1.943 -2.108 1.00 . A A . 23 LYS H 1 1 7 3350 1 1 23 LYS HA H -5.356 -2.405 -3.698 1.00 . A A . 23 LYS HA 1 1 7 3351 1 1 23 LYS HB2 H -3.380 -4.118 -3.211 1.00 . A A . 23 LYS HB2 1 1 7 3352 1 1 23 LYS HB3 H -4.337 -4.437 -1.771 1.00 . A A . 23 LYS HB3 1 1 7 3353 1 1 23 LYS HD2 H -5.236 -3.657 -5.246 1.00 . A A . 23 LYS HD2 1 1 7 3354 1 1 23 LYS HD3 H -4.219 -5.087 -5.438 1.00 . A A . 23 LYS HD3 1 1 7 3355 1 1 23 LYS HE2 H -6.537 -6.333 -5.352 1.00 . A A . 23 LYS HE2 1 1 7 3356 1 1 23 LYS HE3 H -7.149 -4.761 -5.867 1.00 . A A . 23 LYS HE3 1 1 7 3357 1 1 23 LYS HG2 H -4.985 -6.021 -3.401 1.00 . A A . 23 LYS HG2 1 1 7 3358 1 1 23 LYS HG3 H -6.298 -4.847 -3.275 1.00 . A A . 23 LYS HG3 1 1 7 3359 1 1 23 LYS HZ1 H -6.203 -4.955 -7.890 1.00 . A A . 23 LYS HZ1 1 1 7 3360 1 1 23 LYS HZ2 H -6.311 -6.610 -7.562 1.00 . A A . 23 LYS HZ2 1 1 7 3361 1 1 23 LYS HZ3 H -4.850 -5.795 -7.320 1.00 . A A . 23 LYS HZ3 1 1 7 3362 1 1 23 LYS N N -3.702 -1.710 -2.687 1.00 . A A . 23 LYS N 1 1 7 3363 1 1 23 LYS NZ N -5.885 -5.714 -7.254 1.00 . A A . 23 LYS NZ 1 1 7 3364 1 1 23 LYS O O -6.738 -3.146 -1.395 1.00 . A A . 23 LYS O 1 1 7 3365 1 1 24 CYS C C -7.851 -1.001 -0.060 1.00 . A A . 24 CYS C 1 1 7 3366 1 1 24 CYS CA C -6.362 -0.941 0.284 1.00 . A A . 24 CYS CA 1 1 7 3367 1 1 24 CYS CB C -5.951 0.461 0.768 1.00 . A A . 24 CYS CB 1 1 7 3368 1 1 24 CYS H H -4.780 -0.739 -1.093 1.00 . A A . 24 CYS H 1 1 7 3369 1 1 24 CYS HA H -6.162 -1.651 1.073 1.00 . A A . 24 CYS HA 1 1 7 3370 1 1 24 CYS HB2 H -5.239 0.354 1.569 1.00 . A A . 24 CYS HB2 1 1 7 3371 1 1 24 CYS HB3 H -5.474 0.981 -0.049 1.00 . A A . 24 CYS HB3 1 1 7 3372 1 1 24 CYS N N -5.544 -1.306 -0.864 1.00 . A A . 24 CYS N 1 1 7 3373 1 1 24 CYS O O -8.302 -0.400 -1.034 1.00 . A A . 24 CYS O 1 1 7 3374 1 1 24 CYS SG S -7.307 1.519 1.390 1.00 . A A . 24 CYS SG 1 1 7 3375 1 1 25 MET C C -10.792 -1.054 1.581 1.00 . A A . 25 MET C 1 1 7 3376 1 1 25 MET CA C -10.037 -1.879 0.551 1.00 . A A . 25 MET CA 1 1 7 3377 1 1 25 MET CB C -10.447 -3.349 0.653 1.00 . A A . 25 MET CB 1 1 7 3378 1 1 25 MET CE C -12.786 -4.273 -2.675 1.00 . A A . 25 MET CE 1 1 7 3379 1 1 25 MET CG C -11.642 -3.709 -0.215 1.00 . A A . 25 MET CG 1 1 7 3380 1 1 25 MET H H -8.178 -2.191 1.507 1.00 . A A . 25 MET H 1 1 7 3381 1 1 25 MET HA H -10.281 -1.509 -0.434 1.00 . A A . 25 MET HA 1 1 7 3382 1 1 25 MET HB2 H -9.612 -3.965 0.352 1.00 . A A . 25 MET HB2 1 1 7 3383 1 1 25 MET HB3 H -10.695 -3.572 1.680 1.00 . A A . 25 MET HB3 1 1 7 3384 1 1 25 MET HE1 H -13.554 -4.069 -1.944 1.00 . A A . 25 MET HE1 1 1 7 3385 1 1 25 MET HE2 H -12.905 -5.278 -3.051 1.00 . A A . 25 MET HE2 1 1 7 3386 1 1 25 MET HE3 H -12.869 -3.571 -3.492 1.00 . A A . 25 MET HE3 1 1 7 3387 1 1 25 MET HG2 H -12.139 -4.565 0.218 1.00 . A A . 25 MET HG2 1 1 7 3388 1 1 25 MET HG3 H -12.323 -2.870 -0.231 1.00 . A A . 25 MET HG3 1 1 7 3389 1 1 25 MET N N -8.601 -1.735 0.750 1.00 . A A . 25 MET N 1 1 7 3390 1 1 25 MET O O -10.345 -0.899 2.716 1.00 . A A . 25 MET O 1 1 7 3391 1 1 25 MET SD S -11.175 -4.109 -1.909 1.00 . A A . 25 MET SD 1 1 7 3392 1 1 26 ASN C C -12.865 -0.327 3.449 1.00 . A A . 26 ASN C 1 1 7 3393 1 1 26 ASN CA C -12.752 0.310 2.066 1.00 . A A . 26 ASN CA 1 1 7 3394 1 1 26 ASN CB C -14.159 0.539 1.501 1.00 . A A . 26 ASN CB 1 1 7 3395 1 1 26 ASN CG C -14.234 0.411 -0.009 1.00 . A A . 26 ASN CG 1 1 7 3396 1 1 26 ASN H H -12.228 -0.673 0.252 1.00 . A A . 26 ASN H 1 1 7 3397 1 1 26 ASN HA H -12.258 1.264 2.169 1.00 . A A . 26 ASN HA 1 1 7 3398 1 1 26 ASN HB2 H -14.829 -0.182 1.939 1.00 . A A . 26 ASN HB2 1 1 7 3399 1 1 26 ASN HB3 H -14.486 1.532 1.775 1.00 . A A . 26 ASN HB3 1 1 7 3400 1 1 26 ASN HD21 H -15.181 -1.330 0.160 1.00 . A A . 26 ASN HD21 1 1 7 3401 1 1 26 ASN HD22 H -14.890 -0.787 -1.454 1.00 . A A . 26 ASN HD22 1 1 7 3402 1 1 26 ASN N N -11.935 -0.517 1.173 1.00 . A A . 26 ASN N 1 1 7 3403 1 1 26 ASN ND2 N -14.828 -0.679 -0.482 1.00 . A A . 26 ASN ND2 1 1 7 3404 1 1 26 ASN O O -13.365 -1.443 3.595 1.00 . A A . 26 ASN O 1 1 7 3405 1 1 26 ASN OD1 O -13.762 1.280 -0.742 1.00 . A A . 26 ASN OD1 1 1 7 3406 1 1 27 ARG C C -11.329 -1.107 6.087 1.00 . A A . 27 ARG C 1 1 7 3407 1 1 27 ARG CA C -12.424 -0.077 5.838 1.00 . A A . 27 ARG CA 1 1 7 3408 1 1 27 ARG CB C -13.794 -0.672 6.177 1.00 . A A . 27 ARG CB 1 1 7 3409 1 1 27 ARG CD C -15.794 0.165 7.450 1.00 . A A . 27 ARG CD 1 1 7 3410 1 1 27 ARG CG C -14.328 -0.228 7.530 1.00 . A A . 27 ARG CG 1 1 7 3411 1 1 27 ARG CZ C -16.719 -0.997 9.417 1.00 . A A . 27 ARG CZ 1 1 7 3412 1 1 27 ARG H H -12.006 1.272 4.264 1.00 . A A . 27 ARG H 1 1 7 3413 1 1 27 ARG HA H -12.246 0.773 6.478 1.00 . A A . 27 ARG HA 1 1 7 3414 1 1 27 ARG HB2 H -14.502 -0.374 5.418 1.00 . A A . 27 ARG HB2 1 1 7 3415 1 1 27 ARG HB3 H -13.717 -1.749 6.181 1.00 . A A . 27 ARG HB3 1 1 7 3416 1 1 27 ARG HD2 H -15.864 1.167 7.054 1.00 . A A . 27 ARG HD2 1 1 7 3417 1 1 27 ARG HD3 H -16.301 -0.519 6.786 1.00 . A A . 27 ARG HD3 1 1 7 3418 1 1 27 ARG HE H -16.687 0.983 9.168 1.00 . A A . 27 ARG HE 1 1 7 3419 1 1 27 ARG HG2 H -14.221 -1.040 8.232 1.00 . A A . 27 ARG HG2 1 1 7 3420 1 1 27 ARG HG3 H -13.755 0.622 7.870 1.00 . A A . 27 ARG HG3 1 1 7 3421 1 1 27 ARG HH11 H -15.956 -2.224 8.000 1.00 . A A . 27 ARG HH11 1 1 7 3422 1 1 27 ARG HH12 H -16.612 -3.016 9.393 1.00 . A A . 27 ARG HH12 1 1 7 3423 1 1 27 ARG HH21 H -17.550 -0.057 11.001 1.00 . A A . 27 ARG HH21 1 1 7 3424 1 1 27 ARG HH22 H -17.518 -1.786 11.096 1.00 . A A . 27 ARG HH22 1 1 7 3425 1 1 27 ARG N N -12.391 0.396 4.456 1.00 . A A . 27 ARG N 1 1 7 3426 1 1 27 ARG NE N -16.443 0.126 8.758 1.00 . A A . 27 ARG NE 1 1 7 3427 1 1 27 ARG NH1 N -16.403 -2.176 8.893 1.00 . A A . 27 ARG NH1 1 1 7 3428 1 1 27 ARG NH2 N -17.311 -0.942 10.601 1.00 . A A . 27 ARG NH2 1 1 7 3429 1 1 27 ARG O O -11.483 -2.004 6.915 1.00 . A A . 27 ARG O 1 1 7 3430 1 1 28 LYS C C -8.018 -1.626 4.457 1.00 . A A . 28 LYS C 1 1 7 3431 1 1 28 LYS CA C -9.092 -1.892 5.509 1.00 . A A . 28 LYS CA 1 1 7 3432 1 1 28 LYS CB C -9.571 -3.343 5.406 1.00 . A A . 28 LYS CB 1 1 7 3433 1 1 28 LYS CD C -8.424 -4.888 7.024 1.00 . A A . 28 LYS CD 1 1 7 3434 1 1 28 LYS CE C -8.519 -5.599 8.365 1.00 . A A . 28 LYS CE 1 1 7 3435 1 1 28 LYS CG C -9.662 -4.049 6.749 1.00 . A A . 28 LYS CG 1 1 7 3436 1 1 28 LYS H H -10.159 -0.231 4.722 1.00 . A A . 28 LYS H 1 1 7 3437 1 1 28 LYS HA H -8.664 -1.734 6.488 1.00 . A A . 28 LYS HA 1 1 7 3438 1 1 28 LYS HB2 H -10.549 -3.356 4.951 1.00 . A A . 28 LYS HB2 1 1 7 3439 1 1 28 LYS HB3 H -8.885 -3.895 4.781 1.00 . A A . 28 LYS HB3 1 1 7 3440 1 1 28 LYS HD2 H -8.321 -5.626 6.243 1.00 . A A . 28 LYS HD2 1 1 7 3441 1 1 28 LYS HD3 H -7.559 -4.242 7.029 1.00 . A A . 28 LYS HD3 1 1 7 3442 1 1 28 LYS HE2 H -9.235 -6.402 8.282 1.00 . A A . 28 LYS HE2 1 1 7 3443 1 1 28 LYS HE3 H -7.549 -6.006 8.611 1.00 . A A . 28 LYS HE3 1 1 7 3444 1 1 28 LYS HG2 H -9.763 -3.309 7.529 1.00 . A A . 28 LYS HG2 1 1 7 3445 1 1 28 LYS HG3 H -10.529 -4.693 6.748 1.00 . A A . 28 LYS HG3 1 1 7 3446 1 1 28 LYS HZ1 H -8.563 -3.726 9.288 1.00 . A A . 28 LYS HZ1 1 1 7 3447 1 1 28 LYS HZ2 H -8.604 -5.023 10.371 1.00 . A A . 28 LYS HZ2 1 1 7 3448 1 1 28 LYS HZ3 H -9.986 -4.620 9.483 1.00 . A A . 28 LYS HZ3 1 1 7 3449 1 1 28 LYS N N -10.220 -0.971 5.364 1.00 . A A . 28 LYS N 1 1 7 3450 1 1 28 LYS NZ N -8.948 -4.678 9.453 1.00 . A A . 28 LYS NZ 1 1 7 3451 1 1 28 LYS O O -8.201 -1.927 3.281 1.00 . A A . 28 LYS O 1 1 7 3452 1 1 29 CYS C C -5.109 -2.040 3.506 1.00 . A A . 29 CYS C 1 1 7 3453 1 1 29 CYS CA C -5.784 -0.766 3.994 1.00 . A A . 29 CYS CA 1 1 7 3454 1 1 29 CYS CB C -4.769 0.116 4.700 1.00 . A A . 29 CYS CB 1 1 7 3455 1 1 29 CYS H H -6.803 -0.855 5.841 1.00 . A A . 29 CYS H 1 1 7 3456 1 1 29 CYS HA H -6.173 -0.235 3.155 1.00 . A A . 29 CYS HA 1 1 7 3457 1 1 29 CYS HB2 H -5.292 0.803 5.340 1.00 . A A . 29 CYS HB2 1 1 7 3458 1 1 29 CYS HB3 H -4.134 -0.509 5.294 1.00 . A A . 29 CYS HB3 1 1 7 3459 1 1 29 CYS N N -6.892 -1.067 4.892 1.00 . A A . 29 CYS N 1 1 7 3460 1 1 29 CYS O O -5.307 -3.115 4.071 1.00 . A A . 29 CYS O 1 1 7 3461 1 1 29 CYS SG S -3.704 1.098 3.596 1.00 . A A . 29 CYS SG 1 1 7 3462 1 1 30 LYS C C -2.903 -2.687 0.586 1.00 . A A . 30 LYS C 1 1 7 3463 1 1 30 LYS CA C -3.594 -3.052 1.892 1.00 . A A . 30 LYS CA 1 1 7 3464 1 1 30 LYS CB C -4.550 -4.229 1.668 1.00 . A A . 30 LYS CB 1 1 7 3465 1 1 30 LYS CD C -5.762 -5.969 3.017 1.00 . A A . 30 LYS CD 1 1 7 3466 1 1 30 LYS CE C -5.943 -7.270 2.253 1.00 . A A . 30 LYS CE 1 1 7 3467 1 1 30 LYS CG C -4.419 -5.326 2.713 1.00 . A A . 30 LYS CG 1 1 7 3468 1 1 30 LYS H H -4.184 -1.027 2.051 1.00 . A A . 30 LYS H 1 1 7 3469 1 1 30 LYS HA H -2.836 -3.346 2.602 1.00 . A A . 30 LYS HA 1 1 7 3470 1 1 30 LYS HB2 H -5.565 -3.863 1.688 1.00 . A A . 30 LYS HB2 1 1 7 3471 1 1 30 LYS HB3 H -4.352 -4.662 0.698 1.00 . A A . 30 LYS HB3 1 1 7 3472 1 1 30 LYS HD2 H -5.820 -6.175 4.076 1.00 . A A . 30 LYS HD2 1 1 7 3473 1 1 30 LYS HD3 H -6.549 -5.284 2.738 1.00 . A A . 30 LYS HD3 1 1 7 3474 1 1 30 LYS HE2 H -5.067 -7.883 2.398 1.00 . A A . 30 LYS HE2 1 1 7 3475 1 1 30 LYS HE3 H -6.809 -7.783 2.642 1.00 . A A . 30 LYS HE3 1 1 7 3476 1 1 30 LYS HG2 H -3.744 -6.084 2.343 1.00 . A A . 30 LYS HG2 1 1 7 3477 1 1 30 LYS HG3 H -4.020 -4.898 3.621 1.00 . A A . 30 LYS HG3 1 1 7 3478 1 1 30 LYS HZ1 H -5.719 -6.120 0.522 1.00 . A A . 30 LYS HZ1 1 1 7 3479 1 1 30 LYS HZ2 H -7.147 -7.026 0.563 1.00 . A A . 30 LYS HZ2 1 1 7 3480 1 1 30 LYS HZ3 H -5.671 -7.789 0.248 1.00 . A A . 30 LYS HZ3 1 1 7 3481 1 1 30 LYS N N -4.305 -1.911 2.454 1.00 . A A . 30 LYS N 1 1 7 3482 1 1 30 LYS NZ N -6.133 -7.035 0.794 1.00 . A A . 30 LYS NZ 1 1 7 3483 1 1 30 LYS O O -3.433 -2.919 -0.494 1.00 . A A . 30 LYS O 1 1 7 3484 1 1 31 CYS C C -1.005 -2.688 -1.604 1.00 . A A . 31 CYS C 1 1 7 3485 1 1 31 CYS CA C -0.882 -1.720 -0.437 1.00 . A A . 31 CYS CA 1 1 7 3486 1 1 31 CYS CB C 0.588 -1.608 -0.014 1.00 . A A . 31 CYS CB 1 1 7 3487 1 1 31 CYS H H -1.364 -1.982 1.615 1.00 . A A . 31 CYS H 1 1 7 3488 1 1 31 CYS HA H -1.213 -0.753 -0.781 1.00 . A A . 31 CYS HA 1 1 7 3489 1 1 31 CYS HB2 H 0.988 -2.602 0.132 1.00 . A A . 31 CYS HB2 1 1 7 3490 1 1 31 CYS HB3 H 1.143 -1.116 -0.799 1.00 . A A . 31 CYS HB3 1 1 7 3491 1 1 31 CYS N N -1.708 -2.125 0.713 1.00 . A A . 31 CYS N 1 1 7 3492 1 1 31 CYS O O -1.531 -3.788 -1.479 1.00 . A A . 31 CYS O 1 1 7 3493 1 1 31 CYS SG S 0.858 -0.672 1.529 1.00 . A A . 31 CYS SG 1 1 7 3494 1 1 32 ASN C C 0.755 -3.523 -4.361 1.00 . A A . 32 ASN C 1 1 7 3495 1 1 32 ASN CA C -0.613 -2.995 -3.976 1.00 . A A . 32 ASN CA 1 1 7 3496 1 1 32 ASN CB C -1.112 -2.083 -5.065 1.00 . A A . 32 ASN CB 1 1 7 3497 1 1 32 ASN CG C -1.899 -2.805 -6.140 1.00 . A A . 32 ASN CG 1 1 7 3498 1 1 32 ASN H H -0.201 -1.319 -2.785 1.00 . A A . 32 ASN H 1 1 7 3499 1 1 32 ASN HA H -1.296 -3.811 -3.857 1.00 . A A . 32 ASN HA 1 1 7 3500 1 1 32 ASN HB2 H -1.735 -1.340 -4.616 1.00 . A A . 32 ASN HB2 1 1 7 3501 1 1 32 ASN HB3 H -0.267 -1.601 -5.512 1.00 . A A . 32 ASN HB3 1 1 7 3502 1 1 32 ASN HD21 H -0.409 -2.558 -7.432 1.00 . A A . 32 ASN HD21 1 1 7 3503 1 1 32 ASN HD22 H -1.794 -3.396 -8.035 1.00 . A A . 32 ASN HD22 1 1 7 3504 1 1 32 ASN N N -0.555 -2.230 -2.750 1.00 . A A . 32 ASN N 1 1 7 3505 1 1 32 ASN ND2 N -1.307 -2.933 -7.322 1.00 . A A . 32 ASN ND2 1 1 7 3506 1 1 32 ASN O O 1.751 -3.269 -3.685 1.00 . A A . 32 ASN O 1 1 7 3507 1 1 32 ASN OD1 O -3.026 -3.244 -5.911 1.00 . A A . 32 ASN OD1 1 1 7 3508 1 1 33 ARG C C 2.877 -3.626 -6.539 1.00 . A A . 33 ARG C 1 1 7 3509 1 1 33 ARG CA C 2.049 -4.766 -5.985 1.00 . A A . 33 ARG CA 1 1 7 3510 1 1 33 ARG CB C 1.801 -5.829 -7.057 1.00 . A A . 33 ARG CB 1 1 7 3511 1 1 33 ARG CD C 2.684 -7.833 -5.825 1.00 . A A . 33 ARG CD 1 1 7 3512 1 1 33 ARG CG C 2.829 -6.949 -7.053 1.00 . A A . 33 ARG CG 1 1 7 3513 1 1 33 ARG CZ C 4.994 -8.214 -5.057 1.00 . A A . 33 ARG CZ 1 1 7 3514 1 1 33 ARG H H -0.033 -4.372 -5.979 1.00 . A A . 33 ARG H 1 1 7 3515 1 1 33 ARG HA H 2.585 -5.201 -5.154 1.00 . A A . 33 ARG HA 1 1 7 3516 1 1 33 ARG HB2 H 0.826 -6.264 -6.898 1.00 . A A . 33 ARG HB2 1 1 7 3517 1 1 33 ARG HB3 H 1.821 -5.356 -8.028 1.00 . A A . 33 ARG HB3 1 1 7 3518 1 1 33 ARG HD2 H 2.531 -7.204 -4.961 1.00 . A A . 33 ARG HD2 1 1 7 3519 1 1 33 ARG HD3 H 1.825 -8.475 -5.959 1.00 . A A . 33 ARG HD3 1 1 7 3520 1 1 33 ARG HE H 3.818 -9.601 -5.878 1.00 . A A . 33 ARG HE 1 1 7 3521 1 1 33 ARG HG2 H 2.692 -7.554 -7.937 1.00 . A A . 33 ARG HG2 1 1 7 3522 1 1 33 ARG HG3 H 3.818 -6.517 -7.060 1.00 . A A . 33 ARG HG3 1 1 7 3523 1 1 33 ARG HH11 H 4.325 -6.323 -4.796 1.00 . A A . 33 ARG HH11 1 1 7 3524 1 1 33 ARG HH12 H 5.947 -6.617 -4.264 1.00 . A A . 33 ARG HH12 1 1 7 3525 1 1 33 ARG HH21 H 5.950 -9.990 -5.179 1.00 . A A . 33 ARG HH21 1 1 7 3526 1 1 33 ARG HH22 H 6.869 -8.699 -4.482 1.00 . A A . 33 ARG HH22 1 1 7 3527 1 1 33 ARG N N 0.796 -4.231 -5.476 1.00 . A A . 33 ARG N 1 1 7 3528 1 1 33 ARG NE N 3.866 -8.663 -5.604 1.00 . A A . 33 ARG NE 1 1 7 3529 1 1 33 ARG NH1 N 5.097 -6.948 -4.674 1.00 . A A . 33 ARG NH1 1 1 7 3530 1 1 33 ARG NH2 N 6.023 -9.035 -4.892 1.00 . A A . 33 ARG NH2 1 1 7 3531 1 1 33 ARG O O 2.964 -3.417 -7.749 1.00 . A A . 33 ARG O 1 1 7 3532 1 1 34 CYS C C 5.744 -1.976 -5.689 1.00 . A A . 34 CYS C 1 1 7 3533 1 1 34 CYS CA C 4.265 -1.716 -5.954 1.00 . A A . 34 CYS CA 1 1 7 3534 1 1 34 CYS CB C 3.777 -0.522 -5.147 1.00 . A A . 34 CYS CB 1 1 7 3535 1 1 34 CYS H H 3.317 -3.110 -4.677 1.00 . A A . 34 CYS H 1 1 7 3536 1 1 34 CYS HA H 4.128 -1.505 -6.993 1.00 . A A . 34 CYS HA 1 1 7 3537 1 1 34 CYS HB2 H 2.725 -0.371 -5.344 1.00 . A A . 34 CYS HB2 1 1 7 3538 1 1 34 CYS HB3 H 3.910 -0.743 -4.110 1.00 . A A . 34 CYS HB3 1 1 7 3539 1 1 34 CYS N N 3.456 -2.878 -5.620 1.00 . A A . 34 CYS N 1 1 7 3540 1 1 34 CYS O O 6.562 -1.070 -5.957 1.00 . A A . 34 CYS O 1 1 7 3541 1 1 34 CYS OXT O 6.073 -3.084 -5.217 1.00 . A A . 34 CYS OXT 1 1 7 3542 1 1 34 CYS SG S 4.631 1.045 -5.498 1.00 . A A . 34 CYS SG 1 1 8 3543 1 1 1 VAL C C -6.661 5.482 -6.981 1.00 . A A . 1 VAL C 1 1 8 3544 1 1 1 VAL CA C -5.573 5.928 -7.950 1.00 . A A . 1 VAL CA 1 1 8 3545 1 1 1 VAL CB C -4.917 7.212 -7.408 1.00 . A A . 1 VAL CB 1 1 8 3546 1 1 1 VAL CG1 C -3.589 7.470 -8.104 1.00 . A A . 1 VAL CG1 1 1 8 3547 1 1 1 VAL CG2 C -5.854 8.399 -7.572 1.00 . A A . 1 VAL CG2 1 1 8 3548 1 1 1 VAL H1 H -7.067 6.565 -9.213 1.00 . A A . 1 VAL H1 1 1 8 3549 1 1 1 VAL H2 H -6.179 5.210 -9.780 1.00 . A A . 1 VAL H2 1 1 8 3550 1 1 1 VAL H3 H -5.480 6.778 -9.821 1.00 . A A . 1 VAL H3 1 1 8 3551 1 1 1 VAL HA H -4.817 5.157 -8.005 1.00 . A A . 1 VAL HA 1 1 8 3552 1 1 1 VAL HB H -4.725 7.076 -6.354 1.00 . A A . 1 VAL HB 1 1 8 3553 1 1 1 VAL HG11 H -3.616 7.046 -9.097 1.00 . A A . 1 VAL HG11 1 1 8 3554 1 1 1 VAL HG12 H -2.792 7.012 -7.538 1.00 . A A . 1 VAL HG12 1 1 8 3555 1 1 1 VAL HG13 H -3.419 8.534 -8.170 1.00 . A A . 1 VAL HG13 1 1 8 3556 1 1 1 VAL HG21 H -5.768 9.047 -6.711 1.00 . A A . 1 VAL HG21 1 1 8 3557 1 1 1 VAL HG22 H -6.870 8.047 -7.657 1.00 . A A . 1 VAL HG22 1 1 8 3558 1 1 1 VAL HG23 H -5.586 8.948 -8.463 1.00 . A A . 1 VAL HG23 1 1 8 3559 1 1 1 VAL N N -6.124 6.139 -9.314 1.00 . A A . 1 VAL N 1 1 8 3560 1 1 1 VAL O O -7.787 5.981 -7.023 1.00 . A A . 1 VAL O 1 1 8 3561 1 1 2 SER C C -7.080 4.715 -3.777 1.00 . A A . 2 SER C 1 1 8 3562 1 1 2 SER CA C -7.268 4.028 -5.126 1.00 . A A . 2 SER CA 1 1 8 3563 1 1 2 SER CB C -7.103 2.516 -4.968 1.00 . A A . 2 SER CB 1 1 8 3564 1 1 2 SER H H -5.407 4.184 -6.122 1.00 . A A . 2 SER H 1 1 8 3565 1 1 2 SER HA H -8.264 4.237 -5.487 1.00 . A A . 2 SER HA 1 1 8 3566 1 1 2 SER HB2 H -6.052 2.276 -4.902 1.00 . A A . 2 SER HB2 1 1 8 3567 1 1 2 SER HB3 H -7.603 2.193 -4.066 1.00 . A A . 2 SER HB3 1 1 8 3568 1 1 2 SER HG H -8.570 1.589 -5.877 1.00 . A A . 2 SER HG 1 1 8 3569 1 1 2 SER N N -6.319 4.541 -6.107 1.00 . A A . 2 SER N 1 1 8 3570 1 1 2 SER O O -5.954 4.916 -3.322 1.00 . A A . 2 SER O 1 1 8 3571 1 1 2 SER OG O -7.660 1.823 -6.072 1.00 . A A . 2 SER OG 1 1 8 3572 1 1 3 CYS C C -7.417 7.073 -1.944 1.00 . A A . 3 CYS C 1 1 8 3573 1 1 3 CYS CA C -8.150 5.739 -1.844 1.00 . A A . 3 CYS CA 1 1 8 3574 1 1 3 CYS CB C -7.466 4.845 -0.805 1.00 . A A . 3 CYS CB 1 1 8 3575 1 1 3 CYS H H -9.061 4.888 -3.555 1.00 . A A . 3 CYS H 1 1 8 3576 1 1 3 CYS HA H -9.167 5.923 -1.534 1.00 . A A . 3 CYS HA 1 1 8 3577 1 1 3 CYS HB2 H -6.397 4.962 -0.889 1.00 . A A . 3 CYS HB2 1 1 8 3578 1 1 3 CYS HB3 H -7.779 5.153 0.183 1.00 . A A . 3 CYS HB3 1 1 8 3579 1 1 3 CYS N N -8.191 5.074 -3.142 1.00 . A A . 3 CYS N 1 1 8 3580 1 1 3 CYS O O -6.771 7.363 -2.951 1.00 . A A . 3 CYS O 1 1 8 3581 1 1 3 CYS SG S -7.844 3.069 -0.979 1.00 . A A . 3 CYS SG 1 1 8 3582 1 1 4 THR C C -7.046 9.856 0.493 1.00 . A A . 4 THR C 1 1 8 3583 1 1 4 THR CA C -6.871 9.186 -0.867 1.00 . A A . 4 THR CA 1 1 8 3584 1 1 4 THR CB C -7.434 10.085 -1.972 1.00 . A A . 4 THR CB 1 1 8 3585 1 1 4 THR CG2 C -6.595 10.081 -3.231 1.00 . A A . 4 THR CG2 1 1 8 3586 1 1 4 THR H H -8.053 7.595 -0.121 1.00 . A A . 4 THR H 1 1 8 3587 1 1 4 THR HA H -5.817 9.033 -1.045 1.00 . A A . 4 THR HA 1 1 8 3588 1 1 4 THR HB H -7.480 11.102 -1.609 1.00 . A A . 4 THR HB 1 1 8 3589 1 1 4 THR HG1 H -9.257 9.520 -1.530 1.00 . A A . 4 THR HG1 1 1 8 3590 1 1 4 THR HG21 H -6.198 11.070 -3.402 1.00 . A A . 4 THR HG21 1 1 8 3591 1 1 4 THR HG22 H -7.209 9.788 -4.071 1.00 . A A . 4 THR HG22 1 1 8 3592 1 1 4 THR HG23 H -5.781 9.380 -3.119 1.00 . A A . 4 THR HG23 1 1 8 3593 1 1 4 THR N N -7.523 7.882 -0.895 1.00 . A A . 4 THR N 1 1 8 3594 1 1 4 THR O O -7.200 11.074 0.583 1.00 . A A . 4 THR O 1 1 8 3595 1 1 4 THR OG1 O -8.745 9.680 -2.326 1.00 . A A . 4 THR OG1 1 1 8 3596 1 1 5 GLY C C -6.336 8.836 3.909 1.00 . A A . 5 GLY C 1 1 8 3597 1 1 5 GLY CA C -7.175 9.583 2.892 1.00 . A A . 5 GLY CA 1 1 8 3598 1 1 5 GLY H H -6.892 8.089 1.419 1.00 . A A . 5 GLY H 1 1 8 3599 1 1 5 GLY HA2 H -6.881 10.622 2.892 1.00 . A A . 5 GLY HA2 1 1 8 3600 1 1 5 GLY HA3 H -8.214 9.513 3.178 1.00 . A A . 5 GLY HA3 1 1 8 3601 1 1 5 GLY N N -7.020 9.052 1.551 1.00 . A A . 5 GLY N 1 1 8 3602 1 1 5 GLY O O -5.114 8.984 3.944 1.00 . A A . 5 GLY O 1 1 8 3603 1 1 6 SER C C -5.592 8.166 6.755 1.00 . A A . 6 SER C 1 1 8 3604 1 1 6 SER CA C -6.296 7.250 5.754 1.00 . A A . 6 SER CA 1 1 8 3605 1 1 6 SER CB C -5.286 6.306 5.097 1.00 . A A . 6 SER CB 1 1 8 3606 1 1 6 SER H H -7.965 7.949 4.654 1.00 . A A . 6 SER H 1 1 8 3607 1 1 6 SER HA H -7.034 6.662 6.280 1.00 . A A . 6 SER HA 1 1 8 3608 1 1 6 SER HB2 H -4.365 6.839 4.912 1.00 . A A . 6 SER HB2 1 1 8 3609 1 1 6 SER HB3 H -5.093 5.472 5.757 1.00 . A A . 6 SER HB3 1 1 8 3610 1 1 6 SER HG H -6.608 5.350 4.013 1.00 . A A . 6 SER HG 1 1 8 3611 1 1 6 SER N N -6.991 8.027 4.734 1.00 . A A . 6 SER N 1 1 8 3612 1 1 6 SER O O -5.921 9.346 6.869 1.00 . A A . 6 SER O 1 1 8 3613 1 1 6 SER OG O -5.778 5.809 3.864 1.00 . A A . 6 SER OG 1 1 8 3614 1 1 7 LYS C C -2.382 8.049 8.362 1.00 . A A . 7 LYS C 1 1 8 3615 1 1 7 LYS CA C -3.868 8.372 8.465 1.00 . A A . 7 LYS CA 1 1 8 3616 1 1 7 LYS CB C -4.380 8.064 9.873 1.00 . A A . 7 LYS CB 1 1 8 3617 1 1 7 LYS CD C -3.339 6.251 11.274 1.00 . A A . 7 LYS CD 1 1 8 3618 1 1 7 LYS CE C -2.625 4.945 10.970 1.00 . A A . 7 LYS CE 1 1 8 3619 1 1 7 LYS CG C -4.375 6.581 10.210 1.00 . A A . 7 LYS CG 1 1 8 3620 1 1 7 LYS H H -4.401 6.669 7.340 1.00 . A A . 7 LYS H 1 1 8 3621 1 1 7 LYS HA H -4.012 9.422 8.258 1.00 . A A . 7 LYS HA 1 1 8 3622 1 1 7 LYS HB2 H -3.757 8.579 10.590 1.00 . A A . 7 LYS HB2 1 1 8 3623 1 1 7 LYS HB3 H -5.392 8.427 9.962 1.00 . A A . 7 LYS HB3 1 1 8 3624 1 1 7 LYS HD2 H -2.610 7.047 11.312 1.00 . A A . 7 LYS HD2 1 1 8 3625 1 1 7 LYS HD3 H -3.834 6.167 12.230 1.00 . A A . 7 LYS HD3 1 1 8 3626 1 1 7 LYS HE2 H -3.241 4.125 11.307 1.00 . A A . 7 LYS HE2 1 1 8 3627 1 1 7 LYS HE3 H -2.478 4.868 9.903 1.00 . A A . 7 LYS HE3 1 1 8 3628 1 1 7 LYS HG2 H -5.351 6.302 10.576 1.00 . A A . 7 LYS HG2 1 1 8 3629 1 1 7 LYS HG3 H -4.149 6.020 9.315 1.00 . A A . 7 LYS HG3 1 1 8 3630 1 1 7 LYS HZ1 H -1.352 5.313 12.586 1.00 . A A . 7 LYS HZ1 1 1 8 3631 1 1 7 LYS HZ2 H -0.579 5.353 11.081 1.00 . A A . 7 LYS HZ2 1 1 8 3632 1 1 7 LYS HZ3 H -1.019 3.870 11.766 1.00 . A A . 7 LYS HZ3 1 1 8 3633 1 1 7 LYS N N -4.621 7.612 7.476 1.00 . A A . 7 LYS N 1 1 8 3634 1 1 7 LYS NZ N -1.301 4.865 11.648 1.00 . A A . 7 LYS NZ 1 1 8 3635 1 1 7 LYS O O -1.742 7.689 9.351 1.00 . A A . 7 LYS O 1 1 8 3636 1 1 8 ASP C C -0.234 6.401 6.598 1.00 . A A . 8 ASP C 1 1 8 3637 1 1 8 ASP CA C -0.438 7.886 6.875 1.00 . A A . 8 ASP CA 1 1 8 3638 1 1 8 ASP CB C 0.454 8.333 8.040 1.00 . A A . 8 ASP CB 1 1 8 3639 1 1 8 ASP CG C 1.744 8.974 7.567 1.00 . A A . 8 ASP CG 1 1 8 3640 1 1 8 ASP H H -2.425 8.450 6.408 1.00 . A A . 8 ASP H 1 1 8 3641 1 1 8 ASP HA H -0.160 8.441 5.991 1.00 . A A . 8 ASP HA 1 1 8 3642 1 1 8 ASP HB2 H -0.083 9.051 8.641 1.00 . A A . 8 ASP HB2 1 1 8 3643 1 1 8 ASP HB3 H 0.700 7.474 8.646 1.00 . A A . 8 ASP HB3 1 1 8 3644 1 1 8 ASP N N -1.848 8.169 7.148 1.00 . A A . 8 ASP N 1 1 8 3645 1 1 8 ASP O O 0.659 5.765 7.159 1.00 . A A . 8 ASP O 1 1 8 3646 1 1 8 ASP OD1 O 1.714 9.679 6.537 1.00 . A A . 8 ASP OD1 1 1 8 3647 1 1 8 ASP OD2 O 2.785 8.771 8.229 1.00 . A A . 8 ASP OD2 1 1 8 3648 1 1 9 CYS C C -0.193 4.254 4.090 1.00 . A A . 9 CYS C 1 1 8 3649 1 1 9 CYS CA C -1.002 4.447 5.360 1.00 . A A . 9 CYS CA 1 1 8 3650 1 1 9 CYS CB C -2.398 3.887 5.166 1.00 . A A . 9 CYS CB 1 1 8 3651 1 1 9 CYS H H -1.763 6.419 5.314 1.00 . A A . 9 CYS H 1 1 8 3652 1 1 9 CYS HA H -0.530 3.922 6.157 1.00 . A A . 9 CYS HA 1 1 8 3653 1 1 9 CYS HB2 H -3.082 4.444 5.778 1.00 . A A . 9 CYS HB2 1 1 8 3654 1 1 9 CYS HB3 H -2.671 4.001 4.135 1.00 . A A . 9 CYS HB3 1 1 8 3655 1 1 9 CYS N N -1.075 5.856 5.725 1.00 . A A . 9 CYS N 1 1 8 3656 1 1 9 CYS O O 0.871 3.636 4.098 1.00 . A A . 9 CYS O 1 1 8 3657 1 1 9 CYS SG S -2.573 2.125 5.597 1.00 . A A . 9 CYS SG 1 1 8 3658 1 1 10 TYR C C 1.396 5.180 1.779 1.00 . A A . 10 TYR C 1 1 8 3659 1 1 10 TYR CA C -0.046 4.688 1.704 1.00 . A A . 10 TYR CA 1 1 8 3660 1 1 10 TYR CB C -0.812 5.504 0.658 1.00 . A A . 10 TYR CB 1 1 8 3661 1 1 10 TYR CD1 C -2.213 3.433 0.241 1.00 . A A . 10 TYR CD1 1 1 8 3662 1 1 10 TYR CD2 C -2.381 5.244 -1.301 1.00 . A A . 10 TYR CD2 1 1 8 3663 1 1 10 TYR CE1 C -3.132 2.715 -0.498 1.00 . A A . 10 TYR CE1 1 1 8 3664 1 1 10 TYR CE2 C -3.303 4.533 -2.044 1.00 . A A . 10 TYR CE2 1 1 8 3665 1 1 10 TYR CG C -1.820 4.710 -0.147 1.00 . A A . 10 TYR CG 1 1 8 3666 1 1 10 TYR CZ C -3.674 3.269 -1.639 1.00 . A A . 10 TYR CZ 1 1 8 3667 1 1 10 TYR H H -1.563 5.269 3.061 1.00 . A A . 10 TYR H 1 1 8 3668 1 1 10 TYR HA H -0.045 3.651 1.410 1.00 . A A . 10 TYR HA 1 1 8 3669 1 1 10 TYR HB2 H -1.346 6.299 1.157 1.00 . A A . 10 TYR HB2 1 1 8 3670 1 1 10 TYR HB3 H -0.104 5.938 -0.035 1.00 . A A . 10 TYR HB3 1 1 8 3671 1 1 10 TYR HD1 H -1.790 3.001 1.135 1.00 . A A . 10 TYR HD1 1 1 8 3672 1 1 10 TYR HD2 H -2.087 6.235 -1.616 1.00 . A A . 10 TYR HD2 1 1 8 3673 1 1 10 TYR HE1 H -3.422 1.725 -0.181 1.00 . A A . 10 TYR HE1 1 1 8 3674 1 1 10 TYR HE2 H -3.727 4.966 -2.936 1.00 . A A . 10 TYR HE2 1 1 8 3675 1 1 10 TYR HH H -4.261 2.438 -3.270 1.00 . A A . 10 TYR HH 1 1 8 3676 1 1 10 TYR N N -0.710 4.790 2.997 1.00 . A A . 10 TYR N 1 1 8 3677 1 1 10 TYR O O 2.220 4.823 0.944 1.00 . A A . 10 TYR O 1 1 8 3678 1 1 10 TYR OH O -4.591 2.556 -2.377 1.00 . A A . 10 TYR OH 1 1 8 3679 1 1 11 ALA C C 4.056 5.527 3.377 1.00 . A A . 11 ALA C 1 1 8 3680 1 1 11 ALA CA C 3.036 6.569 2.919 1.00 . A A . 11 ALA CA 1 1 8 3681 1 1 11 ALA CB C 3.018 7.753 3.875 1.00 . A A . 11 ALA CB 1 1 8 3682 1 1 11 ALA H H 0.990 6.282 3.402 1.00 . A A . 11 ALA H 1 1 8 3683 1 1 11 ALA HA H 3.343 6.933 1.949 1.00 . A A . 11 ALA HA 1 1 8 3684 1 1 11 ALA HB1 H 2.785 8.654 3.327 1.00 . A A . 11 ALA HB1 1 1 8 3685 1 1 11 ALA HB2 H 3.987 7.855 4.340 1.00 . A A . 11 ALA HB2 1 1 8 3686 1 1 11 ALA HB3 H 2.269 7.589 4.635 1.00 . A A . 11 ALA HB3 1 1 8 3687 1 1 11 ALA N N 1.693 6.018 2.767 1.00 . A A . 11 ALA N 1 1 8 3688 1 1 11 ALA O O 4.982 5.189 2.636 1.00 . A A . 11 ALA O 1 1 8 3689 1 1 12 PRO C C 5.121 2.881 4.184 1.00 . A A . 12 PRO C 1 1 8 3690 1 1 12 PRO CA C 4.833 4.011 5.162 1.00 . A A . 12 PRO CA 1 1 8 3691 1 1 12 PRO CB C 4.102 3.477 6.406 1.00 . A A . 12 PRO CB 1 1 8 3692 1 1 12 PRO CD C 2.851 5.339 5.564 1.00 . A A . 12 PRO CD 1 1 8 3693 1 1 12 PRO CG C 2.732 4.073 6.362 1.00 . A A . 12 PRO CG 1 1 8 3694 1 1 12 PRO HA H 5.765 4.466 5.462 1.00 . A A . 12 PRO HA 1 1 8 3695 1 1 12 PRO HB2 H 4.061 2.398 6.364 1.00 . A A . 12 PRO HB2 1 1 8 3696 1 1 12 PRO HB3 H 4.635 3.783 7.294 1.00 . A A . 12 PRO HB3 1 1 8 3697 1 1 12 PRO HD2 H 1.923 5.556 5.056 1.00 . A A . 12 PRO HD2 1 1 8 3698 1 1 12 PRO HD3 H 3.144 6.162 6.196 1.00 . A A . 12 PRO HD3 1 1 8 3699 1 1 12 PRO HG2 H 2.051 3.389 5.882 1.00 . A A . 12 PRO HG2 1 1 8 3700 1 1 12 PRO HG3 H 2.398 4.293 7.362 1.00 . A A . 12 PRO HG3 1 1 8 3701 1 1 12 PRO N N 3.911 5.006 4.608 1.00 . A A . 12 PRO N 1 1 8 3702 1 1 12 PRO O O 6.181 2.257 4.235 1.00 . A A . 12 PRO O 1 1 8 3703 1 1 13 CYS C C 4.855 2.095 0.986 1.00 . A A . 13 CYS C 1 1 8 3704 1 1 13 CYS CA C 4.331 1.562 2.308 1.00 . A A . 13 CYS CA 1 1 8 3705 1 1 13 CYS CB C 3.014 0.844 2.079 1.00 . A A . 13 CYS CB 1 1 8 3706 1 1 13 CYS H H 3.346 3.149 3.306 1.00 . A A . 13 CYS H 1 1 8 3707 1 1 13 CYS HA H 5.034 0.856 2.696 1.00 . A A . 13 CYS HA 1 1 8 3708 1 1 13 CYS HB2 H 2.321 1.158 2.833 1.00 . A A . 13 CYS HB2 1 1 8 3709 1 1 13 CYS HB3 H 2.635 1.112 1.110 1.00 . A A . 13 CYS HB3 1 1 8 3710 1 1 13 CYS N N 4.172 2.621 3.295 1.00 . A A . 13 CYS N 1 1 8 3711 1 1 13 CYS O O 5.803 1.551 0.428 1.00 . A A . 13 CYS O 1 1 8 3712 1 1 13 CYS SG S 3.146 -0.973 2.146 1.00 . A A . 13 CYS SG 1 1 8 3713 1 1 14 ARG C C 6.150 3.889 -0.849 1.00 . A A . 14 ARG C 1 1 8 3714 1 1 14 ARG CA C 4.641 3.732 -0.795 1.00 . A A . 14 ARG CA 1 1 8 3715 1 1 14 ARG CB C 3.952 5.078 -1.037 1.00 . A A . 14 ARG CB 1 1 8 3716 1 1 14 ARG CD C 4.006 7.255 -2.293 1.00 . A A . 14 ARG CD 1 1 8 3717 1 1 14 ARG CG C 4.421 5.792 -2.296 1.00 . A A . 14 ARG CG 1 1 8 3718 1 1 14 ARG CZ C 5.653 8.291 -0.782 1.00 . A A . 14 ARG CZ 1 1 8 3719 1 1 14 ARG H H 3.474 3.541 0.964 1.00 . A A . 14 ARG H 1 1 8 3720 1 1 14 ARG HA H 4.347 3.040 -1.566 1.00 . A A . 14 ARG HA 1 1 8 3721 1 1 14 ARG HB2 H 2.890 4.912 -1.124 1.00 . A A . 14 ARG HB2 1 1 8 3722 1 1 14 ARG HB3 H 4.140 5.724 -0.192 1.00 . A A . 14 ARG HB3 1 1 8 3723 1 1 14 ARG HD2 H 4.473 7.750 -3.132 1.00 . A A . 14 ARG HD2 1 1 8 3724 1 1 14 ARG HD3 H 2.933 7.311 -2.396 1.00 . A A . 14 ARG HD3 1 1 8 3725 1 1 14 ARG HE H 3.699 8.135 -0.410 1.00 . A A . 14 ARG HE 1 1 8 3726 1 1 14 ARG HG2 H 5.498 5.735 -2.353 1.00 . A A . 14 ARG HG2 1 1 8 3727 1 1 14 ARG HG3 H 3.987 5.306 -3.158 1.00 . A A . 14 ARG HG3 1 1 8 3728 1 1 14 ARG HH11 H 6.432 7.573 -2.505 1.00 . A A . 14 ARG HH11 1 1 8 3729 1 1 14 ARG HH12 H 7.571 8.307 -1.425 1.00 . A A . 14 ARG HH12 1 1 8 3730 1 1 14 ARG HH21 H 5.193 9.100 1.012 1.00 . A A . 14 ARG HH21 1 1 8 3731 1 1 14 ARG HH22 H 6.867 9.174 0.571 1.00 . A A . 14 ARG HH22 1 1 8 3732 1 1 14 ARG N N 4.229 3.151 0.479 1.00 . A A . 14 ARG N 1 1 8 3733 1 1 14 ARG NE N 4.402 7.934 -1.062 1.00 . A A . 14 ARG NE 1 1 8 3734 1 1 14 ARG NH1 N 6.632 8.036 -1.641 1.00 . A A . 14 ARG NH1 1 1 8 3735 1 1 14 ARG NH2 N 5.927 8.906 0.361 1.00 . A A . 14 ARG NH2 1 1 8 3736 1 1 14 ARG O O 6.756 3.787 -1.915 1.00 . A A . 14 ARG O 1 1 8 3737 1 1 15 LYS C C 8.835 2.931 -0.089 1.00 . A A . 15 LYS C 1 1 8 3738 1 1 15 LYS CA C 8.199 4.235 0.376 1.00 . A A . 15 LYS CA 1 1 8 3739 1 1 15 LYS CB C 8.644 4.567 1.803 1.00 . A A . 15 LYS CB 1 1 8 3740 1 1 15 LYS CD C 8.844 6.551 3.332 1.00 . A A . 15 LYS CD 1 1 8 3741 1 1 15 LYS CE C 9.918 6.207 4.351 1.00 . A A . 15 LYS CE 1 1 8 3742 1 1 15 LYS CG C 9.174 5.983 1.961 1.00 . A A . 15 LYS CG 1 1 8 3743 1 1 15 LYS H H 6.222 4.158 1.132 1.00 . A A . 15 LYS H 1 1 8 3744 1 1 15 LYS HA H 8.499 5.033 -0.288 1.00 . A A . 15 LYS HA 1 1 8 3745 1 1 15 LYS HB2 H 7.801 4.445 2.467 1.00 . A A . 15 LYS HB2 1 1 8 3746 1 1 15 LYS HB3 H 9.424 3.879 2.096 1.00 . A A . 15 LYS HB3 1 1 8 3747 1 1 15 LYS HD2 H 8.765 7.625 3.256 1.00 . A A . 15 LYS HD2 1 1 8 3748 1 1 15 LYS HD3 H 7.901 6.142 3.663 1.00 . A A . 15 LYS HD3 1 1 8 3749 1 1 15 LYS HE2 H 10.838 5.992 3.827 1.00 . A A . 15 LYS HE2 1 1 8 3750 1 1 15 LYS HE3 H 10.064 7.056 5.002 1.00 . A A . 15 LYS HE3 1 1 8 3751 1 1 15 LYS HG2 H 10.246 5.972 1.836 1.00 . A A . 15 LYS HG2 1 1 8 3752 1 1 15 LYS HG3 H 8.726 6.611 1.204 1.00 . A A . 15 LYS HG3 1 1 8 3753 1 1 15 LYS HZ1 H 8.509 4.910 5.188 1.00 . A A . 15 LYS HZ1 1 1 8 3754 1 1 15 LYS HZ2 H 9.882 5.144 6.149 1.00 . A A . 15 LYS HZ2 1 1 8 3755 1 1 15 LYS HZ3 H 9.970 4.162 4.775 1.00 . A A . 15 LYS HZ3 1 1 8 3756 1 1 15 LYS N N 6.755 4.107 0.307 1.00 . A A . 15 LYS N 1 1 8 3757 1 1 15 LYS NZ N 9.544 5.023 5.174 1.00 . A A . 15 LYS NZ 1 1 8 3758 1 1 15 LYS O O 9.696 2.920 -0.969 1.00 . A A . 15 LYS O 1 1 8 3759 1 1 16 GLN C C 8.389 0.069 -1.230 1.00 . A A . 16 GLN C 1 1 8 3760 1 1 16 GLN CA C 8.875 0.505 0.155 1.00 . A A . 16 GLN CA 1 1 8 3761 1 1 16 GLN CB C 8.432 -0.516 1.203 1.00 . A A . 16 GLN CB 1 1 8 3762 1 1 16 GLN CD C 8.441 -0.853 3.707 1.00 . A A . 16 GLN CD 1 1 8 3763 1 1 16 GLN CG C 9.250 -0.466 2.484 1.00 . A A . 16 GLN CG 1 1 8 3764 1 1 16 GLN H H 7.680 1.911 1.189 1.00 . A A . 16 GLN H 1 1 8 3765 1 1 16 GLN HA H 9.953 0.549 0.145 1.00 . A A . 16 GLN HA 1 1 8 3766 1 1 16 GLN HB2 H 7.398 -0.333 1.454 1.00 . A A . 16 GLN HB2 1 1 8 3767 1 1 16 GLN HB3 H 8.521 -1.507 0.784 1.00 . A A . 16 GLN HB3 1 1 8 3768 1 1 16 GLN HE21 H 8.667 0.971 4.464 1.00 . A A . 16 GLN HE21 1 1 8 3769 1 1 16 GLN HE22 H 7.750 -0.132 5.427 1.00 . A A . 16 GLN HE22 1 1 8 3770 1 1 16 GLN HG2 H 10.083 -1.148 2.392 1.00 . A A . 16 GLN HG2 1 1 8 3771 1 1 16 GLN HG3 H 9.621 0.539 2.619 1.00 . A A . 16 GLN HG3 1 1 8 3772 1 1 16 GLN N N 8.381 1.830 0.504 1.00 . A A . 16 GLN N 1 1 8 3773 1 1 16 GLN NE2 N 8.269 0.090 4.625 1.00 . A A . 16 GLN NE2 1 1 8 3774 1 1 16 GLN O O 9.192 -0.268 -2.100 1.00 . A A . 16 GLN O 1 1 8 3775 1 1 16 GLN OE1 O 7.976 -1.987 3.825 1.00 . A A . 16 GLN OE1 1 1 8 3776 1 1 17 THR C C 6.709 0.652 -3.797 1.00 . A A . 17 THR C 1 1 8 3777 1 1 17 THR CA C 6.471 -0.361 -2.681 1.00 . A A . 17 THR CA 1 1 8 3778 1 1 17 THR CB C 4.969 -0.594 -2.500 1.00 . A A . 17 THR CB 1 1 8 3779 1 1 17 THR CG2 C 4.197 0.670 -2.192 1.00 . A A . 17 THR CG2 1 1 8 3780 1 1 17 THR H H 6.478 0.327 -0.683 1.00 . A A . 17 THR H 1 1 8 3781 1 1 17 THR HA H 6.931 -1.295 -2.965 1.00 . A A . 17 THR HA 1 1 8 3782 1 1 17 THR HB H 4.819 -1.281 -1.679 1.00 . A A . 17 THR HB 1 1 8 3783 1 1 17 THR HG1 H 3.989 -2.004 -3.442 1.00 . A A . 17 THR HG1 1 1 8 3784 1 1 17 THR HG21 H 4.310 0.916 -1.147 1.00 . A A . 17 THR HG21 1 1 8 3785 1 1 17 THR HG22 H 3.151 0.515 -2.414 1.00 . A A . 17 THR HG22 1 1 8 3786 1 1 17 THR HG23 H 4.577 1.480 -2.797 1.00 . A A . 17 THR HG23 1 1 8 3787 1 1 17 THR N N 7.068 0.057 -1.417 1.00 . A A . 17 THR N 1 1 8 3788 1 1 17 THR O O 6.398 0.384 -4.957 1.00 . A A . 17 THR O 1 1 8 3789 1 1 17 THR OG1 O 4.405 -1.168 -3.666 1.00 . A A . 17 THR OG1 1 1 8 3790 1 1 18 GLY C C 6.217 3.425 -4.989 1.00 . A A . 18 GLY C 1 1 8 3791 1 1 18 GLY CA C 7.496 2.823 -4.460 1.00 . A A . 18 GLY CA 1 1 8 3792 1 1 18 GLY H H 7.480 1.990 -2.523 1.00 . A A . 18 GLY H 1 1 8 3793 1 1 18 GLY HA2 H 8.099 3.604 -4.048 1.00 . A A . 18 GLY HA2 1 1 8 3794 1 1 18 GLY HA3 H 8.027 2.369 -5.278 1.00 . A A . 18 GLY HA3 1 1 8 3795 1 1 18 GLY N N 7.252 1.815 -3.454 1.00 . A A . 18 GLY N 1 1 8 3796 1 1 18 GLY O O 5.551 4.198 -4.301 1.00 . A A . 18 GLY O 1 1 8 3797 1 1 19 CYS C C 3.607 4.032 -5.962 1.00 . A A . 19 CYS C 1 1 8 3798 1 1 19 CYS CA C 4.701 3.539 -6.917 1.00 . A A . 19 CYS CA 1 1 8 3799 1 1 19 CYS CB C 4.153 2.453 -7.809 1.00 . A A . 19 CYS CB 1 1 8 3800 1 1 19 CYS H H 6.497 2.460 -6.689 1.00 . A A . 19 CYS H 1 1 8 3801 1 1 19 CYS HA H 5.005 4.338 -7.551 1.00 . A A . 19 CYS HA 1 1 8 3802 1 1 19 CYS HB2 H 3.184 2.758 -8.160 1.00 . A A . 19 CYS HB2 1 1 8 3803 1 1 19 CYS HB3 H 4.817 2.351 -8.646 1.00 . A A . 19 CYS HB3 1 1 8 3804 1 1 19 CYS N N 5.896 3.063 -6.222 1.00 . A A . 19 CYS N 1 1 8 3805 1 1 19 CYS O O 3.344 3.410 -4.933 1.00 . A A . 19 CYS O 1 1 8 3806 1 1 19 CYS SG S 3.981 0.823 -7.011 1.00 . A A . 19 CYS SG 1 1 8 3807 1 1 20 PRO C C 0.638 4.891 -5.363 1.00 . A A . 20 PRO C 1 1 8 3808 1 1 20 PRO CA C 1.901 5.751 -5.448 1.00 . A A . 20 PRO CA 1 1 8 3809 1 1 20 PRO CB C 1.576 7.086 -6.137 1.00 . A A . 20 PRO CB 1 1 8 3810 1 1 20 PRO CD C 3.209 5.985 -7.486 1.00 . A A . 20 PRO CD 1 1 8 3811 1 1 20 PRO CG C 2.706 7.337 -7.076 1.00 . A A . 20 PRO CG 1 1 8 3812 1 1 20 PRO HA H 2.261 5.946 -4.449 1.00 . A A . 20 PRO HA 1 1 8 3813 1 1 20 PRO HB2 H 0.637 7.001 -6.665 1.00 . A A . 20 PRO HB2 1 1 8 3814 1 1 20 PRO HB3 H 1.503 7.866 -5.393 1.00 . A A . 20 PRO HB3 1 1 8 3815 1 1 20 PRO HD2 H 2.652 5.614 -8.333 1.00 . A A . 20 PRO HD2 1 1 8 3816 1 1 20 PRO HD3 H 4.264 6.028 -7.710 1.00 . A A . 20 PRO HD3 1 1 8 3817 1 1 20 PRO HG2 H 2.353 7.882 -7.939 1.00 . A A . 20 PRO HG2 1 1 8 3818 1 1 20 PRO HG3 H 3.485 7.891 -6.574 1.00 . A A . 20 PRO HG3 1 1 8 3819 1 1 20 PRO N N 2.957 5.168 -6.288 1.00 . A A . 20 PRO N 1 1 8 3820 1 1 20 PRO O O -0.278 5.206 -4.603 1.00 . A A . 20 PRO O 1 1 8 3821 1 1 21 TYR C C -0.688 2.166 -4.838 1.00 . A A . 21 TYR C 1 1 8 3822 1 1 21 TYR CA C -0.576 2.946 -6.146 1.00 . A A . 21 TYR CA 1 1 8 3823 1 1 21 TYR CB C -0.491 1.978 -7.322 1.00 . A A . 21 TYR CB 1 1 8 3824 1 1 21 TYR CD1 C 0.241 3.770 -8.952 1.00 . A A . 21 TYR CD1 1 1 8 3825 1 1 21 TYR CD2 C 1.228 1.609 -9.138 1.00 . A A . 21 TYR CD2 1 1 8 3826 1 1 21 TYR CE1 C 0.995 4.213 -10.021 1.00 . A A . 21 TYR CE1 1 1 8 3827 1 1 21 TYR CE2 C 1.988 2.044 -10.208 1.00 . A A . 21 TYR CE2 1 1 8 3828 1 1 21 TYR CG C 0.344 2.463 -8.492 1.00 . A A . 21 TYR CG 1 1 8 3829 1 1 21 TYR CZ C 1.867 3.345 -10.645 1.00 . A A . 21 TYR CZ 1 1 8 3830 1 1 21 TYR H H 1.312 3.602 -6.739 1.00 . A A . 21 TYR H 1 1 8 3831 1 1 21 TYR HA H -1.456 3.560 -6.261 1.00 . A A . 21 TYR HA 1 1 8 3832 1 1 21 TYR HB2 H -0.074 1.044 -6.984 1.00 . A A . 21 TYR HB2 1 1 8 3833 1 1 21 TYR HB3 H -1.475 1.811 -7.682 1.00 . A A . 21 TYR HB3 1 1 8 3834 1 1 21 TYR HD1 H -0.444 4.447 -8.460 1.00 . A A . 21 TYR HD1 1 1 8 3835 1 1 21 TYR HD2 H 1.320 0.588 -8.794 1.00 . A A . 21 TYR HD2 1 1 8 3836 1 1 21 TYR HE1 H 0.901 5.233 -10.364 1.00 . A A . 21 TYR HE1 1 1 8 3837 1 1 21 TYR HE2 H 2.671 1.365 -10.696 1.00 . A A . 21 TYR HE2 1 1 8 3838 1 1 21 TYR HH H 3.103 4.575 -11.459 1.00 . A A . 21 TYR HH 1 1 8 3839 1 1 21 TYR N N 0.578 3.814 -6.142 1.00 . A A . 21 TYR N 1 1 8 3840 1 1 21 TYR O O 0.264 2.094 -4.061 1.00 . A A . 21 TYR O 1 1 8 3841 1 1 21 TYR OH O 2.622 3.783 -11.710 1.00 . A A . 21 TYR OH 1 1 8 3842 1 1 22 GLY C C -3.263 -0.135 -3.520 1.00 . A A . 22 GLY C 1 1 8 3843 1 1 22 GLY CA C -2.091 0.821 -3.391 1.00 . A A . 22 GLY CA 1 1 8 3844 1 1 22 GLY H H -2.582 1.684 -5.263 1.00 . A A . 22 GLY H 1 1 8 3845 1 1 22 GLY HA2 H -1.205 0.258 -3.165 1.00 . A A . 22 GLY HA2 1 1 8 3846 1 1 22 GLY HA3 H -2.285 1.502 -2.578 1.00 . A A . 22 GLY HA3 1 1 8 3847 1 1 22 GLY N N -1.863 1.588 -4.605 1.00 . A A . 22 GLY N 1 1 8 3848 1 1 22 GLY O O -4.157 0.083 -4.338 1.00 . A A . 22 GLY O 1 1 8 3849 1 1 23 LYS C C -5.406 -1.830 -1.671 1.00 . A A . 23 LYS C 1 1 8 3850 1 1 23 LYS CA C -4.362 -2.157 -2.738 1.00 . A A . 23 LYS CA 1 1 8 3851 1 1 23 LYS CB C -3.826 -3.576 -2.535 1.00 . A A . 23 LYS CB 1 1 8 3852 1 1 23 LYS CD C -3.604 -5.862 -3.554 1.00 . A A . 23 LYS CD 1 1 8 3853 1 1 23 LYS CE C -3.906 -6.814 -2.408 1.00 . A A . 23 LYS CE 1 1 8 3854 1 1 23 LYS CG C -4.449 -4.601 -3.468 1.00 . A A . 23 LYS CG 1 1 8 3855 1 1 23 LYS H H -2.550 -1.311 -2.064 1.00 . A A . 23 LYS H 1 1 8 3856 1 1 23 LYS HA H -4.827 -2.092 -3.709 1.00 . A A . 23 LYS HA 1 1 8 3857 1 1 23 LYS HB2 H -2.759 -3.571 -2.701 1.00 . A A . 23 LYS HB2 1 1 8 3858 1 1 23 LYS HB3 H -4.021 -3.881 -1.518 1.00 . A A . 23 LYS HB3 1 1 8 3859 1 1 23 LYS HD2 H -3.814 -6.362 -4.488 1.00 . A A . 23 LYS HD2 1 1 8 3860 1 1 23 LYS HD3 H -2.560 -5.587 -3.517 1.00 . A A . 23 LYS HD3 1 1 8 3861 1 1 23 LYS HE2 H -4.076 -6.236 -1.512 1.00 . A A . 23 LYS HE2 1 1 8 3862 1 1 23 LYS HE3 H -4.798 -7.374 -2.647 1.00 . A A . 23 LYS HE3 1 1 8 3863 1 1 23 LYS HG2 H -5.429 -4.862 -3.099 1.00 . A A . 23 LYS HG2 1 1 8 3864 1 1 23 LYS HG3 H -4.536 -4.170 -4.455 1.00 . A A . 23 LYS HG3 1 1 8 3865 1 1 23 LYS HZ1 H -1.941 -7.248 -1.847 1.00 . A A . 23 LYS HZ1 1 1 8 3866 1 1 23 LYS HZ2 H -2.556 -8.277 -3.040 1.00 . A A . 23 LYS HZ2 1 1 8 3867 1 1 23 LYS HZ3 H -3.055 -8.454 -1.434 1.00 . A A . 23 LYS HZ3 1 1 8 3868 1 1 23 LYS N N -3.274 -1.189 -2.704 1.00 . A A . 23 LYS N 1 1 8 3869 1 1 23 LYS NZ N -2.786 -7.765 -2.165 1.00 . A A . 23 LYS NZ 1 1 8 3870 1 1 23 LYS O O -6.332 -2.605 -1.434 1.00 . A A . 23 LYS O 1 1 8 3871 1 1 24 CYS C C -7.611 -0.387 -0.397 1.00 . A A . 24 CYS C 1 1 8 3872 1 1 24 CYS CA C -6.151 -0.226 0.022 1.00 . A A . 24 CYS CA 1 1 8 3873 1 1 24 CYS CB C -5.838 1.237 0.383 1.00 . A A . 24 CYS CB 1 1 8 3874 1 1 24 CYS H H -4.481 -0.104 -1.262 1.00 . A A . 24 CYS H 1 1 8 3875 1 1 24 CYS HA H -5.978 -0.840 0.891 1.00 . A A . 24 CYS HA 1 1 8 3876 1 1 24 CYS HB2 H -5.178 1.251 1.236 1.00 . A A . 24 CYS HB2 1 1 8 3877 1 1 24 CYS HB3 H -5.335 1.697 -0.452 1.00 . A A . 24 CYS HB3 1 1 8 3878 1 1 24 CYS N N -5.241 -0.673 -1.027 1.00 . A A . 24 CYS N 1 1 8 3879 1 1 24 CYS O O -8.056 0.193 -1.386 1.00 . A A . 24 CYS O 1 1 8 3880 1 1 24 CYS SG S -7.285 2.271 0.802 1.00 . A A . 24 CYS SG 1 1 8 3881 1 1 25 MET C C -10.617 -0.561 1.040 1.00 . A A . 25 MET C 1 1 8 3882 1 1 25 MET CA C -9.762 -1.409 0.111 1.00 . A A . 25 MET CA 1 1 8 3883 1 1 25 MET CB C -10.100 -2.891 0.289 1.00 . A A . 25 MET CB 1 1 8 3884 1 1 25 MET CE C -13.880 -4.191 -0.320 1.00 . A A . 25 MET CE 1 1 8 3885 1 1 25 MET CG C -11.250 -3.361 -0.586 1.00 . A A . 25 MET CG 1 1 8 3886 1 1 25 MET H H -7.935 -1.598 1.157 1.00 . A A . 25 MET H 1 1 8 3887 1 1 25 MET HA H -9.967 -1.118 -0.908 1.00 . A A . 25 MET HA 1 1 8 3888 1 1 25 MET HB2 H -9.227 -3.479 0.048 1.00 . A A . 25 MET HB2 1 1 8 3889 1 1 25 MET HB3 H -10.367 -3.065 1.321 1.00 . A A . 25 MET HB3 1 1 8 3890 1 1 25 MET HE1 H -13.946 -4.229 -1.398 1.00 . A A . 25 MET HE1 1 1 8 3891 1 1 25 MET HE2 H -14.093 -3.188 0.020 1.00 . A A . 25 MET HE2 1 1 8 3892 1 1 25 MET HE3 H -14.598 -4.876 0.108 1.00 . A A . 25 MET HE3 1 1 8 3893 1 1 25 MET HG2 H -11.894 -2.520 -0.793 1.00 . A A . 25 MET HG2 1 1 8 3894 1 1 25 MET HG3 H -10.847 -3.742 -1.512 1.00 . A A . 25 MET HG3 1 1 8 3895 1 1 25 MET N N -8.349 -1.173 0.378 1.00 . A A . 25 MET N 1 1 8 3896 1 1 25 MET O O -10.249 -0.322 2.190 1.00 . A A . 25 MET O 1 1 8 3897 1 1 25 MET SD S -12.230 -4.659 0.194 1.00 . A A . 25 MET SD 1 1 8 3898 1 1 26 ASN C C -12.857 0.158 2.721 1.00 . A A . 26 ASN C 1 1 8 3899 1 1 26 ASN CA C -12.659 0.734 1.322 1.00 . A A . 26 ASN CA 1 1 8 3900 1 1 26 ASN CB C -14.023 0.889 0.642 1.00 . A A . 26 ASN CB 1 1 8 3901 1 1 26 ASN CG C -13.958 0.786 -0.871 1.00 . A A . 26 ASN CG 1 1 8 3902 1 1 26 ASN H H -11.981 -0.324 -0.393 1.00 . A A . 26 ASN H 1 1 8 3903 1 1 26 ASN HA H -12.204 1.709 1.415 1.00 . A A . 26 ASN HA 1 1 8 3904 1 1 26 ASN HB2 H -14.681 0.120 1.010 1.00 . A A . 26 ASN HB2 1 1 8 3905 1 1 26 ASN HB3 H -14.434 1.855 0.900 1.00 . A A . 26 ASN HB3 1 1 8 3906 1 1 26 ASN HD21 H -12.831 2.422 -0.958 1.00 . A A . 26 ASN HD21 1 1 8 3907 1 1 26 ASN HD22 H -13.200 1.683 -2.475 1.00 . A A . 26 ASN HD22 1 1 8 3908 1 1 26 ASN N N -11.753 -0.102 0.533 1.00 . A A . 26 ASN N 1 1 8 3909 1 1 26 ASN ND2 N -13.259 1.725 -1.498 1.00 . A A . 26 ASN ND2 1 1 8 3910 1 1 26 ASN O O -13.288 -0.985 2.881 1.00 . A A . 26 ASN O 1 1 8 3911 1 1 26 ASN OD1 O -14.528 -0.127 -1.468 1.00 . A A . 26 ASN OD1 1 1 8 3912 1 1 27 ARG C C -11.541 -0.393 5.518 1.00 . A A . 27 ARG C 1 1 8 3913 1 1 27 ARG CA C -12.667 0.553 5.122 1.00 . A A . 27 ARG CA 1 1 8 3914 1 1 27 ARG CB C -14.025 -0.111 5.369 1.00 . A A . 27 ARG CB 1 1 8 3915 1 1 27 ARG CD C -14.932 -0.765 7.621 1.00 . A A . 27 ARG CD 1 1 8 3916 1 1 27 ARG CG C -14.713 0.372 6.636 1.00 . A A . 27 ARG CG 1 1 8 3917 1 1 27 ARG CZ C -16.513 -1.375 9.411 1.00 . A A . 27 ARG CZ 1 1 8 3918 1 1 27 ARG H H -12.197 1.853 3.522 1.00 . A A . 27 ARG H 1 1 8 3919 1 1 27 ARG HA H -12.598 1.442 5.729 1.00 . A A . 27 ARG HA 1 1 8 3920 1 1 27 ARG HB2 H -14.673 0.099 4.530 1.00 . A A . 27 ARG HB2 1 1 8 3921 1 1 27 ARG HB3 H -13.883 -1.179 5.444 1.00 . A A . 27 ARG HB3 1 1 8 3922 1 1 27 ARG HD2 H -15.142 -1.669 7.070 1.00 . A A . 27 ARG HD2 1 1 8 3923 1 1 27 ARG HD3 H -14.031 -0.898 8.201 1.00 . A A . 27 ARG HD3 1 1 8 3924 1 1 27 ARG HE H -16.466 0.389 8.480 1.00 . A A . 27 ARG HE 1 1 8 3925 1 1 27 ARG HG2 H -14.098 1.126 7.103 1.00 . A A . 27 ARG HG2 1 1 8 3926 1 1 27 ARG HG3 H -15.670 0.799 6.372 1.00 . A A . 27 ARG HG3 1 1 8 3927 1 1 27 ARG HH11 H -15.203 -2.836 8.915 1.00 . A A . 27 ARG HH11 1 1 8 3928 1 1 27 ARG HH12 H -16.324 -3.240 10.171 1.00 . A A . 27 ARG HH12 1 1 8 3929 1 1 27 ARG HH21 H -17.942 -0.142 10.131 1.00 . A A . 27 ARG HH21 1 1 8 3930 1 1 27 ARG HH22 H -17.880 -1.711 10.861 1.00 . A A . 27 ARG HH22 1 1 8 3931 1 1 27 ARG N N -12.536 0.961 3.725 1.00 . A A . 27 ARG N 1 1 8 3932 1 1 27 ARG NE N -16.045 -0.494 8.529 1.00 . A A . 27 ARG NE 1 1 8 3933 1 1 27 ARG NH1 N -15.969 -2.583 9.506 1.00 . A A . 27 ARG NH1 1 1 8 3934 1 1 27 ARG NH2 N -17.529 -1.049 10.199 1.00 . A A . 27 ARG NH2 1 1 8 3935 1 1 27 ARG O O -11.711 -1.248 6.387 1.00 . A A . 27 ARG O 1 1 8 3936 1 1 28 LYS C C -8.114 -0.851 4.134 1.00 . A A . 28 LYS C 1 1 8 3937 1 1 28 LYS CA C -9.221 -1.066 5.164 1.00 . A A . 28 LYS CA 1 1 8 3938 1 1 28 LYS CB C -9.618 -2.547 5.194 1.00 . A A . 28 LYS CB 1 1 8 3939 1 1 28 LYS CD C -8.419 -3.781 7.024 1.00 . A A . 28 LYS CD 1 1 8 3940 1 1 28 LYS CE C -8.673 -5.009 7.883 1.00 . A A . 28 LYS CE 1 1 8 3941 1 1 28 LYS CG C -9.720 -3.121 6.597 1.00 . A A . 28 LYS CG 1 1 8 3942 1 1 28 LYS H H -10.317 0.476 4.197 1.00 . A A . 28 LYS H 1 1 8 3943 1 1 28 LYS HA H -8.847 -0.786 6.137 1.00 . A A . 28 LYS HA 1 1 8 3944 1 1 28 LYS HB2 H -10.579 -2.660 4.712 1.00 . A A . 28 LYS HB2 1 1 8 3945 1 1 28 LYS HB3 H -8.883 -3.118 4.647 1.00 . A A . 28 LYS HB3 1 1 8 3946 1 1 28 LYS HD2 H -7.871 -4.078 6.143 1.00 . A A . 28 LYS HD2 1 1 8 3947 1 1 28 LYS HD3 H -7.835 -3.071 7.592 1.00 . A A . 28 LYS HD3 1 1 8 3948 1 1 28 LYS HE2 H -9.128 -4.696 8.811 1.00 . A A . 28 LYS HE2 1 1 8 3949 1 1 28 LYS HE3 H -9.348 -5.667 7.355 1.00 . A A . 28 LYS HE3 1 1 8 3950 1 1 28 LYS HG2 H -9.949 -2.322 7.287 1.00 . A A . 28 LYS HG2 1 1 8 3951 1 1 28 LYS HG3 H -10.510 -3.856 6.620 1.00 . A A . 28 LYS HG3 1 1 8 3952 1 1 28 LYS HZ1 H -6.731 -5.111 8.646 1.00 . A A . 28 LYS HZ1 1 1 8 3953 1 1 28 LYS HZ2 H -6.995 -6.112 7.308 1.00 . A A . 28 LYS HZ2 1 1 8 3954 1 1 28 LYS HZ3 H -7.613 -6.545 8.822 1.00 . A A . 28 LYS HZ3 1 1 8 3955 1 1 28 LYS N N -10.387 -0.229 4.878 1.00 . A A . 28 LYS N 1 1 8 3956 1 1 28 LYS NZ N -7.415 -5.746 8.185 1.00 . A A . 28 LYS NZ 1 1 8 3957 1 1 28 LYS O O -8.172 -1.385 3.026 1.00 . A A . 28 LYS O 1 1 8 3958 1 1 29 CYS C C -5.122 -1.025 3.422 1.00 . A A . 29 CYS C 1 1 8 3959 1 1 29 CYS CA C -5.988 0.214 3.622 1.00 . A A . 29 CYS CA 1 1 8 3960 1 1 29 CYS CB C -5.166 1.379 4.186 1.00 . A A . 29 CYS CB 1 1 8 3961 1 1 29 CYS H H -7.112 0.330 5.398 1.00 . A A . 29 CYS H 1 1 8 3962 1 1 29 CYS HA H -6.396 0.508 2.674 1.00 . A A . 29 CYS HA 1 1 8 3963 1 1 29 CYS HB2 H -5.512 2.287 3.728 1.00 . A A . 29 CYS HB2 1 1 8 3964 1 1 29 CYS HB3 H -5.338 1.435 5.244 1.00 . A A . 29 CYS HB3 1 1 8 3965 1 1 29 CYS N N -7.105 -0.069 4.507 1.00 . A A . 29 CYS N 1 1 8 3966 1 1 29 CYS O O -5.212 -1.992 4.178 1.00 . A A . 29 CYS O 1 1 8 3967 1 1 29 CYS SG S -3.358 1.294 3.918 1.00 . A A . 29 CYS SG 1 1 8 3968 1 1 30 LYS C C -2.638 -1.838 0.774 1.00 . A A . 30 LYS C 1 1 8 3969 1 1 30 LYS CA C -3.376 -2.079 2.088 1.00 . A A . 30 LYS CA 1 1 8 3970 1 1 30 LYS CB C -4.132 -3.414 2.031 1.00 . A A . 30 LYS CB 1 1 8 3971 1 1 30 LYS CD C -6.072 -4.667 1.043 1.00 . A A . 30 LYS CD 1 1 8 3972 1 1 30 LYS CE C -6.970 -5.271 2.110 1.00 . A A . 30 LYS CE 1 1 8 3973 1 1 30 LYS CG C -5.540 -3.308 1.468 1.00 . A A . 30 LYS CG 1 1 8 3974 1 1 30 LYS H H -4.252 -0.168 1.847 1.00 . A A . 30 LYS H 1 1 8 3975 1 1 30 LYS HA H -2.645 -2.130 2.881 1.00 . A A . 30 LYS HA 1 1 8 3976 1 1 30 LYS HB2 H -3.574 -4.102 1.414 1.00 . A A . 30 LYS HB2 1 1 8 3977 1 1 30 LYS HB3 H -4.198 -3.818 3.031 1.00 . A A . 30 LYS HB3 1 1 8 3978 1 1 30 LYS HD2 H -6.640 -4.550 0.132 1.00 . A A . 30 LYS HD2 1 1 8 3979 1 1 30 LYS HD3 H -5.238 -5.330 0.868 1.00 . A A . 30 LYS HD3 1 1 8 3980 1 1 30 LYS HE2 H -6.692 -4.865 3.070 1.00 . A A . 30 LYS HE2 1 1 8 3981 1 1 30 LYS HE3 H -7.995 -5.008 1.891 1.00 . A A . 30 LYS HE3 1 1 8 3982 1 1 30 LYS HG2 H -6.192 -2.899 2.225 1.00 . A A . 30 LYS HG2 1 1 8 3983 1 1 30 LYS HG3 H -5.524 -2.654 0.612 1.00 . A A . 30 LYS HG3 1 1 8 3984 1 1 30 LYS HZ1 H -5.901 -7.048 1.858 1.00 . A A . 30 LYS HZ1 1 1 8 3985 1 1 30 LYS HZ2 H -7.553 -7.191 1.529 1.00 . A A . 30 LYS HZ2 1 1 8 3986 1 1 30 LYS HZ3 H -7.016 -7.094 3.129 1.00 . A A . 30 LYS HZ3 1 1 8 3987 1 1 30 LYS N N -4.277 -0.976 2.400 1.00 . A A . 30 LYS N 1 1 8 3988 1 1 30 LYS NZ N -6.852 -6.756 2.160 1.00 . A A . 30 LYS NZ 1 1 8 3989 1 1 30 LYS O O -3.088 -2.256 -0.290 1.00 . A A . 30 LYS O 1 1 8 3990 1 1 31 CYS C C -0.632 -1.919 -1.332 1.00 . A A . 31 CYS C 1 1 8 3991 1 1 31 CYS CA C -0.628 -0.838 -0.265 1.00 . A A . 31 CYS CA 1 1 8 3992 1 1 31 CYS CB C 0.807 -0.604 0.224 1.00 . A A . 31 CYS CB 1 1 8 3993 1 1 31 CYS H H -1.221 -0.863 1.770 1.00 . A A . 31 CYS H 1 1 8 3994 1 1 31 CYS HA H -0.981 0.070 -0.726 1.00 . A A . 31 CYS HA 1 1 8 3995 1 1 31 CYS HB2 H 1.492 -0.820 -0.583 1.00 . A A . 31 CYS HB2 1 1 8 3996 1 1 31 CYS HB3 H 0.915 0.431 0.513 1.00 . A A . 31 CYS HB3 1 1 8 3997 1 1 31 CYS N N -1.496 -1.160 0.880 1.00 . A A . 31 CYS N 1 1 8 3998 1 1 31 CYS O O -1.126 -3.024 -1.139 1.00 . A A . 31 CYS O 1 1 8 3999 1 1 31 CYS SG S 1.291 -1.633 1.651 1.00 . A A . 31 CYS SG 1 1 8 4000 1 1 32 ASN C C 1.269 -3.216 -3.660 1.00 . A A . 32 ASN C 1 1 8 4001 1 1 32 ASN CA C -0.036 -2.434 -3.628 1.00 . A A . 32 ASN CA 1 1 8 4002 1 1 32 ASN CB C -0.155 -1.600 -4.883 1.00 . A A . 32 ASN CB 1 1 8 4003 1 1 32 ASN CG C -0.790 -2.347 -6.038 1.00 . A A . 32 ASN CG 1 1 8 4004 1 1 32 ASN H H 0.234 -0.638 -2.570 1.00 . A A . 32 ASN H 1 1 8 4005 1 1 32 ASN HA H -0.857 -3.122 -3.587 1.00 . A A . 32 ASN HA 1 1 8 4006 1 1 32 ASN HB2 H -0.749 -0.735 -4.663 1.00 . A A . 32 ASN HB2 1 1 8 4007 1 1 32 ASN HB3 H 0.827 -1.284 -5.171 1.00 . A A . 32 ASN HB3 1 1 8 4008 1 1 32 ASN HD21 H 0.905 -2.240 -7.074 1.00 . A A . 32 ASN HD21 1 1 8 4009 1 1 32 ASN HD22 H -0.405 -3.049 -7.859 1.00 . A A . 32 ASN HD22 1 1 8 4010 1 1 32 ASN N N -0.102 -1.553 -2.481 1.00 . A A . 32 ASN N 1 1 8 4011 1 1 32 ASN ND2 N -0.019 -2.568 -7.097 1.00 . A A . 32 ASN ND2 1 1 8 4012 1 1 32 ASN O O 2.134 -3.053 -2.798 1.00 . A A . 32 ASN O 1 1 8 4013 1 1 32 ASN OD1 O -1.961 -2.723 -5.981 1.00 . A A . 32 ASN OD1 1 1 8 4014 1 1 33 ARG C C 3.340 -4.419 -6.117 1.00 . A A . 33 ARG C 1 1 8 4015 1 1 33 ARG CA C 2.599 -4.863 -4.862 1.00 . A A . 33 ARG CA 1 1 8 4016 1 1 33 ARG CB C 2.234 -6.345 -4.961 1.00 . A A . 33 ARG CB 1 1 8 4017 1 1 33 ARG CD C 3.218 -7.250 -2.833 1.00 . A A . 33 ARG CD 1 1 8 4018 1 1 33 ARG CG C 3.276 -7.269 -4.352 1.00 . A A . 33 ARG CG 1 1 8 4019 1 1 33 ARG CZ C 2.643 -9.574 -2.250 1.00 . A A . 33 ARG CZ 1 1 8 4020 1 1 33 ARG H H 0.673 -4.118 -5.328 1.00 . A A . 33 ARG H 1 1 8 4021 1 1 33 ARG HA H 3.241 -4.709 -4.008 1.00 . A A . 33 ARG HA 1 1 8 4022 1 1 33 ARG HB2 H 1.297 -6.509 -4.451 1.00 . A A . 33 ARG HB2 1 1 8 4023 1 1 33 ARG HB3 H 2.117 -6.606 -6.003 1.00 . A A . 33 ARG HB3 1 1 8 4024 1 1 33 ARG HD2 H 3.943 -6.539 -2.467 1.00 . A A . 33 ARG HD2 1 1 8 4025 1 1 33 ARG HD3 H 2.228 -6.942 -2.527 1.00 . A A . 33 ARG HD3 1 1 8 4026 1 1 33 ARG HE H 4.390 -8.694 -1.854 1.00 . A A . 33 ARG HE 1 1 8 4027 1 1 33 ARG HG2 H 3.095 -8.277 -4.696 1.00 . A A . 33 ARG HG2 1 1 8 4028 1 1 33 ARG HG3 H 4.257 -6.949 -4.671 1.00 . A A . 33 ARG HG3 1 1 8 4029 1 1 33 ARG HH11 H 1.173 -8.560 -3.200 1.00 . A A . 33 ARG HH11 1 1 8 4030 1 1 33 ARG HH12 H 0.794 -10.196 -2.780 1.00 . A A . 33 ARG HH12 1 1 8 4031 1 1 33 ARG HH21 H 3.893 -10.847 -1.301 1.00 . A A . 33 ARG HH21 1 1 8 4032 1 1 33 ARG HH22 H 2.338 -11.495 -1.702 1.00 . A A . 33 ARG HH22 1 1 8 4033 1 1 33 ARG N N 1.401 -4.053 -4.677 1.00 . A A . 33 ARG N 1 1 8 4034 1 1 33 ARG NE N 3.507 -8.561 -2.257 1.00 . A A . 33 ARG NE 1 1 8 4035 1 1 33 ARG NH1 N 1.437 -9.432 -2.788 1.00 . A A . 33 ARG NH1 1 1 8 4036 1 1 33 ARG NH2 N 2.986 -10.734 -1.706 1.00 . A A . 33 ARG NH2 1 1 8 4037 1 1 33 ARG O O 3.065 -4.893 -7.218 1.00 . A A . 33 ARG O 1 1 8 4038 1 1 34 CYS C C 6.126 -3.950 -7.492 1.00 . A A . 34 CYS C 1 1 8 4039 1 1 34 CYS CA C 5.053 -2.963 -7.043 1.00 . A A . 34 CYS CA 1 1 8 4040 1 1 34 CYS CB C 5.685 -1.649 -6.627 1.00 . A A . 34 CYS CB 1 1 8 4041 1 1 34 CYS H H 4.439 -3.151 -5.034 1.00 . A A . 34 CYS H 1 1 8 4042 1 1 34 CYS HA H 4.386 -2.774 -7.856 1.00 . A A . 34 CYS HA 1 1 8 4043 1 1 34 CYS HB2 H 5.233 -1.336 -5.705 1.00 . A A . 34 CYS HB2 1 1 8 4044 1 1 34 CYS HB3 H 6.736 -1.799 -6.476 1.00 . A A . 34 CYS HB3 1 1 8 4045 1 1 34 CYS N N 4.274 -3.494 -5.936 1.00 . A A . 34 CYS N 1 1 8 4046 1 1 34 CYS O O 6.065 -4.398 -8.657 1.00 . A A . 34 CYS O 1 1 8 4047 1 1 34 CYS OXT O 7.018 -4.266 -6.677 1.00 . A A . 34 CYS OXT 1 1 8 4048 1 1 34 CYS SG S 5.470 -0.293 -7.825 1.00 . A A . 34 CYS SG 1 1 9 4049 1 1 1 VAL C C -10.049 4.710 -4.193 1.00 . A A . 1 VAL C 1 1 9 4050 1 1 1 VAL CA C -10.587 3.580 -5.012 1.00 . A A . 1 VAL CA 1 1 9 4051 1 1 1 VAL CB C -11.167 4.169 -6.258 1.00 . A A . 1 VAL CB 1 1 9 4052 1 1 1 VAL CG1 C -10.109 4.881 -7.095 1.00 . A A . 1 VAL CG1 1 1 9 4053 1 1 1 VAL CG2 C -11.923 3.135 -7.077 1.00 . A A . 1 VAL CG2 1 1 9 4054 1 1 1 VAL H1 H -12.050 2.120 -4.946 1.00 . A A . 1 VAL H1 1 1 9 4055 1 1 1 VAL H2 H -12.348 3.467 -3.930 1.00 . A A . 1 VAL H2 1 1 9 4056 1 1 1 VAL H3 H -11.166 2.300 -3.492 1.00 . A A . 1 VAL H3 1 1 9 4057 1 1 1 VAL HA H -9.810 2.941 -5.205 1.00 . A A . 1 VAL HA 1 1 9 4058 1 1 1 VAL HB H -11.866 4.891 -5.883 1.00 . A A . 1 VAL HB 1 1 9 4059 1 1 1 VAL HG11 H -10.040 5.913 -6.785 1.00 . A A . 1 VAL HG11 1 1 9 4060 1 1 1 VAL HG12 H -10.385 4.836 -8.138 1.00 . A A . 1 VAL HG12 1 1 9 4061 1 1 1 VAL HG13 H -9.153 4.397 -6.954 1.00 . A A . 1 VAL HG13 1 1 9 4062 1 1 1 VAL HG21 H -11.449 2.171 -6.968 1.00 . A A . 1 VAL HG21 1 1 9 4063 1 1 1 VAL HG22 H -11.916 3.424 -8.118 1.00 . A A . 1 VAL HG22 1 1 9 4064 1 1 1 VAL HG23 H -12.943 3.075 -6.728 1.00 . A A . 1 VAL HG23 1 1 9 4065 1 1 1 VAL N N -11.632 2.797 -4.278 1.00 . A A . 1 VAL N 1 1 9 4066 1 1 1 VAL O O -9.366 5.632 -4.638 1.00 . A A . 1 VAL O 1 1 9 4067 1 1 2 SER C C -9.597 4.677 -0.698 1.00 . A A . 2 SER C 1 1 9 4068 1 1 2 SER CA C -10.063 5.459 -1.922 1.00 . A A . 2 SER CA 1 1 9 4069 1 1 2 SER CB C -11.269 6.326 -1.559 1.00 . A A . 2 SER CB 1 1 9 4070 1 1 2 SER H H -10.924 3.771 -2.892 1.00 . A A . 2 SER H 1 1 9 4071 1 1 2 SER HA H -9.258 6.098 -2.254 1.00 . A A . 2 SER HA 1 1 9 4072 1 1 2 SER HB2 H -11.207 6.608 -0.519 1.00 . A A . 2 SER HB2 1 1 9 4073 1 1 2 SER HB3 H -11.269 7.214 -2.173 1.00 . A A . 2 SER HB3 1 1 9 4074 1 1 2 SER HG H -13.183 6.034 -1.252 1.00 . A A . 2 SER HG 1 1 9 4075 1 1 2 SER N N -10.399 4.556 -3.017 1.00 . A A . 2 SER N 1 1 9 4076 1 1 2 SER O O -10.323 3.831 -0.176 1.00 . A A . 2 SER O 1 1 9 4077 1 1 2 SER OG O -12.484 5.625 -1.769 1.00 . A A . 2 SER OG 1 1 9 4078 1 1 3 CYS C C -8.668 4.524 2.155 1.00 . A A . 3 CYS C 1 1 9 4079 1 1 3 CYS CA C -7.818 4.291 0.919 1.00 . A A . 3 CYS CA 1 1 9 4080 1 1 3 CYS CB C -6.390 4.770 1.181 1.00 . A A . 3 CYS CB 1 1 9 4081 1 1 3 CYS H H -7.850 5.651 -0.703 1.00 . A A . 3 CYS H 1 1 9 4082 1 1 3 CYS HA H -7.798 3.233 0.716 1.00 . A A . 3 CYS HA 1 1 9 4083 1 1 3 CYS HB2 H -6.405 5.833 1.367 1.00 . A A . 3 CYS HB2 1 1 9 4084 1 1 3 CYS HB3 H -6.007 4.265 2.056 1.00 . A A . 3 CYS HB3 1 1 9 4085 1 1 3 CYS N N -8.382 4.967 -0.245 1.00 . A A . 3 CYS N 1 1 9 4086 1 1 3 CYS O O -9.690 5.209 2.110 1.00 . A A . 3 CYS O 1 1 9 4087 1 1 3 CYS SG S -5.223 4.465 -0.188 1.00 . A A . 3 CYS SG 1 1 9 4088 1 1 4 THR C C -8.543 5.358 5.249 1.00 . A A . 4 THR C 1 1 9 4089 1 1 4 THR CA C -8.930 4.065 4.532 1.00 . A A . 4 THR CA 1 1 9 4090 1 1 4 THR CB C -8.617 2.859 5.418 1.00 . A A . 4 THR CB 1 1 9 4091 1 1 4 THR CG2 C -7.139 2.540 5.493 1.00 . A A . 4 THR CG2 1 1 9 4092 1 1 4 THR H H -7.408 3.411 3.213 1.00 . A A . 4 THR H 1 1 9 4093 1 1 4 THR HA H -9.989 4.085 4.326 1.00 . A A . 4 THR HA 1 1 9 4094 1 1 4 THR HB H -9.122 1.991 5.018 1.00 . A A . 4 THR HB 1 1 9 4095 1 1 4 THR HG1 H -8.864 2.309 7.282 1.00 . A A . 4 THR HG1 1 1 9 4096 1 1 4 THR HG21 H -6.957 1.860 6.312 1.00 . A A . 4 THR HG21 1 1 9 4097 1 1 4 THR HG22 H -6.581 3.451 5.651 1.00 . A A . 4 THR HG22 1 1 9 4098 1 1 4 THR HG23 H -6.822 2.081 4.567 1.00 . A A . 4 THR HG23 1 1 9 4099 1 1 4 THR N N -8.228 3.942 3.258 1.00 . A A . 4 THR N 1 1 9 4100 1 1 4 THR O O -8.188 5.344 6.428 1.00 . A A . 4 THR O 1 1 9 4101 1 1 4 THR OG1 O -9.080 3.071 6.740 1.00 . A A . 4 THR OG1 1 1 9 4102 1 1 5 GLY C C -6.885 7.777 5.726 1.00 . A A . 5 GLY C 1 1 9 4103 1 1 5 GLY CA C -8.275 7.760 5.120 1.00 . A A . 5 GLY CA 1 1 9 4104 1 1 5 GLY H H -8.908 6.432 3.599 1.00 . A A . 5 GLY H 1 1 9 4105 1 1 5 GLY HA2 H -8.331 8.520 4.354 1.00 . A A . 5 GLY HA2 1 1 9 4106 1 1 5 GLY HA3 H -8.994 7.992 5.893 1.00 . A A . 5 GLY HA3 1 1 9 4107 1 1 5 GLY N N -8.617 6.477 4.533 1.00 . A A . 5 GLY N 1 1 9 4108 1 1 5 GLY O O -5.958 7.171 5.187 1.00 . A A . 5 GLY O 1 1 9 4109 1 1 6 SER C C -4.406 9.207 6.624 1.00 . A A . 6 SER C 1 1 9 4110 1 1 6 SER CA C -5.456 8.570 7.530 1.00 . A A . 6 SER CA 1 1 9 4111 1 1 6 SER CB C -4.984 7.185 7.983 1.00 . A A . 6 SER CB 1 1 9 4112 1 1 6 SER H H -7.518 8.934 7.227 1.00 . A A . 6 SER H 1 1 9 4113 1 1 6 SER HA H -5.589 9.196 8.399 1.00 . A A . 6 SER HA 1 1 9 4114 1 1 6 SER HB2 H -4.131 6.887 7.394 1.00 . A A . 6 SER HB2 1 1 9 4115 1 1 6 SER HB3 H -4.703 7.229 9.026 1.00 . A A . 6 SER HB3 1 1 9 4116 1 1 6 SER HG H -6.817 6.539 8.234 1.00 . A A . 6 SER HG 1 1 9 4117 1 1 6 SER N N -6.741 8.473 6.848 1.00 . A A . 6 SER N 1 1 9 4118 1 1 6 SER O O -4.629 9.380 5.425 1.00 . A A . 6 SER O 1 1 9 4119 1 1 6 SER OG O -6.008 6.219 7.826 1.00 . A A . 6 SER OG 1 1 9 4120 1 1 7 LYS C C -0.906 9.340 6.521 1.00 . A A . 7 LYS C 1 1 9 4121 1 1 7 LYS CA C -2.180 10.179 6.452 1.00 . A A . 7 LYS CA 1 1 9 4122 1 1 7 LYS CB C -1.905 11.586 6.984 1.00 . A A . 7 LYS CB 1 1 9 4123 1 1 7 LYS CD C -0.735 12.538 8.996 1.00 . A A . 7 LYS CD 1 1 9 4124 1 1 7 LYS CE C 0.586 11.785 8.972 1.00 . A A . 7 LYS CE 1 1 9 4125 1 1 7 LYS CG C -1.880 11.669 8.502 1.00 . A A . 7 LYS CG 1 1 9 4126 1 1 7 LYS H H -3.149 9.395 8.165 1.00 . A A . 7 LYS H 1 1 9 4127 1 1 7 LYS HA H -2.494 10.249 5.421 1.00 . A A . 7 LYS HA 1 1 9 4128 1 1 7 LYS HB2 H -0.948 11.918 6.610 1.00 . A A . 7 LYS HB2 1 1 9 4129 1 1 7 LYS HB3 H -2.675 12.252 6.621 1.00 . A A . 7 LYS HB3 1 1 9 4130 1 1 7 LYS HD2 H -0.653 13.406 8.359 1.00 . A A . 7 LYS HD2 1 1 9 4131 1 1 7 LYS HD3 H -0.943 12.851 10.008 1.00 . A A . 7 LYS HD3 1 1 9 4132 1 1 7 LYS HE2 H 0.382 10.726 8.992 1.00 . A A . 7 LYS HE2 1 1 9 4133 1 1 7 LYS HE3 H 1.111 12.034 8.061 1.00 . A A . 7 LYS HE3 1 1 9 4134 1 1 7 LYS HG2 H -2.812 12.090 8.846 1.00 . A A . 7 LYS HG2 1 1 9 4135 1 1 7 LYS HG3 H -1.763 10.673 8.904 1.00 . A A . 7 LYS HG3 1 1 9 4136 1 1 7 LYS HZ1 H 2.447 12.126 9.859 1.00 . A A . 7 LYS HZ1 1 1 9 4137 1 1 7 LYS HZ2 H 1.305 11.446 10.904 1.00 . A A . 7 LYS HZ2 1 1 9 4138 1 1 7 LYS HZ3 H 1.201 13.083 10.491 1.00 . A A . 7 LYS HZ3 1 1 9 4139 1 1 7 LYS N N -3.264 9.556 7.205 1.00 . A A . 7 LYS N 1 1 9 4140 1 1 7 LYS NZ N 1.445 12.134 10.138 1.00 . A A . 7 LYS NZ 1 1 9 4141 1 1 7 LYS O O -0.106 9.335 5.585 1.00 . A A . 7 LYS O 1 1 9 4142 1 1 8 ASP C C 0.163 6.342 7.479 1.00 . A A . 8 ASP C 1 1 9 4143 1 1 8 ASP CA C 0.460 7.799 7.819 1.00 . A A . 8 ASP CA 1 1 9 4144 1 1 8 ASP CB C 0.963 7.906 9.259 1.00 . A A . 8 ASP CB 1 1 9 4145 1 1 8 ASP CG C 2.476 7.863 9.347 1.00 . A A . 8 ASP CG 1 1 9 4146 1 1 8 ASP H H -1.390 8.680 8.346 1.00 . A A . 8 ASP H 1 1 9 4147 1 1 8 ASP HA H 1.228 8.160 7.152 1.00 . A A . 8 ASP HA 1 1 9 4148 1 1 8 ASP HB2 H 0.624 8.838 9.685 1.00 . A A . 8 ASP HB2 1 1 9 4149 1 1 8 ASP HB3 H 0.563 7.084 9.835 1.00 . A A . 8 ASP HB3 1 1 9 4150 1 1 8 ASP N N -0.721 8.636 7.633 1.00 . A A . 8 ASP N 1 1 9 4151 1 1 8 ASP O O 0.791 5.430 8.016 1.00 . A A . 8 ASP O 1 1 9 4152 1 1 8 ASP OD1 O 3.131 8.759 8.774 1.00 . A A . 8 ASP OD1 1 1 9 4153 1 1 8 ASP OD2 O 3.007 6.933 9.991 1.00 . A A . 8 ASP OD2 1 1 9 4154 1 1 9 CYS C C -0.376 4.336 4.964 1.00 . A A . 9 CYS C 1 1 9 4155 1 1 9 CYS CA C -1.171 4.778 6.178 1.00 . A A . 9 CYS CA 1 1 9 4156 1 1 9 CYS CB C -2.657 4.705 5.871 1.00 . A A . 9 CYS CB 1 1 9 4157 1 1 9 CYS H H -1.264 6.894 6.190 1.00 . A A . 9 CYS H 1 1 9 4158 1 1 9 CYS HA H -0.956 4.122 6.985 1.00 . A A . 9 CYS HA 1 1 9 4159 1 1 9 CYS HB2 H -3.173 5.416 6.489 1.00 . A A . 9 CYS HB2 1 1 9 4160 1 1 9 CYS HB3 H -2.807 4.956 4.841 1.00 . A A . 9 CYS HB3 1 1 9 4161 1 1 9 CYS N N -0.798 6.128 6.585 1.00 . A A . 9 CYS N 1 1 9 4162 1 1 9 CYS O O 0.479 3.457 5.049 1.00 . A A . 9 CYS O 1 1 9 4163 1 1 9 CYS SG S -3.405 3.069 6.158 1.00 . A A . 9 CYS SG 1 1 9 4164 1 1 10 TYR C C 1.473 5.106 2.643 1.00 . A A . 10 TYR C 1 1 9 4165 1 1 10 TYR CA C 0.021 4.645 2.595 1.00 . A A . 10 TYR CA 1 1 9 4166 1 1 10 TYR CB C -0.699 5.319 1.425 1.00 . A A . 10 TYR CB 1 1 9 4167 1 1 10 TYR CD1 C -1.763 3.077 0.905 1.00 . A A . 10 TYR CD1 1 1 9 4168 1 1 10 TYR CD2 C -1.773 4.756 -0.787 1.00 . A A . 10 TYR CD2 1 1 9 4169 1 1 10 TYR CE1 C -2.423 2.214 0.056 1.00 . A A . 10 TYR CE1 1 1 9 4170 1 1 10 TYR CE2 C -2.436 3.897 -1.641 1.00 . A A . 10 TYR CE2 1 1 9 4171 1 1 10 TYR CG C -1.425 4.364 0.499 1.00 . A A . 10 TYR CG 1 1 9 4172 1 1 10 TYR CZ C -2.758 2.627 -1.214 1.00 . A A . 10 TYR CZ 1 1 9 4173 1 1 10 TYR H H -1.356 5.654 3.840 1.00 . A A . 10 TYR H 1 1 9 4174 1 1 10 TYR HA H 0.000 3.577 2.459 1.00 . A A . 10 TYR HA 1 1 9 4175 1 1 10 TYR HB2 H -1.428 6.012 1.818 1.00 . A A . 10 TYR HB2 1 1 9 4176 1 1 10 TYR HB3 H 0.022 5.867 0.837 1.00 . A A . 10 TYR HB3 1 1 9 4177 1 1 10 TYR HD1 H -1.505 2.755 1.902 1.00 . A A . 10 TYR HD1 1 1 9 4178 1 1 10 TYR HD2 H -1.519 5.752 -1.119 1.00 . A A . 10 TYR HD2 1 1 9 4179 1 1 10 TYR HE1 H -2.675 1.218 0.391 1.00 . A A . 10 TYR HE1 1 1 9 4180 1 1 10 TYR HE2 H -2.697 4.220 -2.638 1.00 . A A . 10 TYR HE2 1 1 9 4181 1 1 10 TYR HH H -3.098 1.891 -2.958 1.00 . A A . 10 TYR HH 1 1 9 4182 1 1 10 TYR N N -0.665 4.960 3.837 1.00 . A A . 10 TYR N 1 1 9 4183 1 1 10 TYR O O 2.270 4.760 1.775 1.00 . A A . 10 TYR O 1 1 9 4184 1 1 10 TYR OH O -3.419 1.768 -2.062 1.00 . A A . 10 TYR OH 1 1 9 4185 1 1 11 ALA C C 4.162 5.326 4.193 1.00 . A A . 11 ALA C 1 1 9 4186 1 1 11 ALA CA C 3.168 6.412 3.790 1.00 . A A . 11 ALA CA 1 1 9 4187 1 1 11 ALA CB C 3.205 7.565 4.781 1.00 . A A . 11 ALA CB 1 1 9 4188 1 1 11 ALA H H 1.129 6.152 4.314 1.00 . A A . 11 ALA H 1 1 9 4189 1 1 11 ALA HA H 3.465 6.790 2.824 1.00 . A A . 11 ALA HA 1 1 9 4190 1 1 11 ALA HB1 H 2.947 8.483 4.275 1.00 . A A . 11 ALA HB1 1 1 9 4191 1 1 11 ALA HB2 H 4.198 7.650 5.198 1.00 . A A . 11 ALA HB2 1 1 9 4192 1 1 11 ALA HB3 H 2.496 7.380 5.575 1.00 . A A . 11 ALA HB3 1 1 9 4193 1 1 11 ALA N N 1.810 5.900 3.652 1.00 . A A . 11 ALA N 1 1 9 4194 1 1 11 ALA O O 5.082 5.012 3.437 1.00 . A A . 11 ALA O 1 1 9 4195 1 1 12 PRO C C 5.204 2.651 4.811 1.00 . A A . 12 PRO C 1 1 9 4196 1 1 12 PRO CA C 4.896 3.687 5.883 1.00 . A A . 12 PRO CA 1 1 9 4197 1 1 12 PRO CB C 4.116 3.050 7.046 1.00 . A A . 12 PRO CB 1 1 9 4198 1 1 12 PRO CD C 2.945 5.029 6.361 1.00 . A A . 12 PRO CD 1 1 9 4199 1 1 12 PRO CG C 2.769 3.703 7.042 1.00 . A A . 12 PRO CG 1 1 9 4200 1 1 12 PRO HA H 5.822 4.103 6.252 1.00 . A A . 12 PRO HA 1 1 9 4201 1 1 12 PRO HB2 H 4.035 1.985 6.885 1.00 . A A . 12 PRO HB2 1 1 9 4202 1 1 12 PRO HB3 H 4.638 3.237 7.973 1.00 . A A . 12 PRO HB3 1 1 9 4203 1 1 12 PRO HD2 H 2.033 5.328 5.869 1.00 . A A . 12 PRO HD2 1 1 9 4204 1 1 12 PRO HD3 H 3.265 5.781 7.066 1.00 . A A . 12 PRO HD3 1 1 9 4205 1 1 12 PRO HG2 H 2.069 3.092 6.497 1.00 . A A . 12 PRO HG2 1 1 9 4206 1 1 12 PRO HG3 H 2.430 3.846 8.055 1.00 . A A . 12 PRO HG3 1 1 9 4207 1 1 12 PRO N N 4.001 4.735 5.391 1.00 . A A . 12 PRO N 1 1 9 4208 1 1 12 PRO O O 6.268 2.032 4.815 1.00 . A A . 12 PRO O 1 1 9 4209 1 1 13 CYS C C 5.006 2.172 1.569 1.00 . A A . 13 CYS C 1 1 9 4210 1 1 13 CYS CA C 4.433 1.515 2.807 1.00 . A A . 13 CYS CA 1 1 9 4211 1 1 13 CYS CB C 3.108 0.864 2.460 1.00 . A A . 13 CYS CB 1 1 9 4212 1 1 13 CYS H H 3.438 2.996 3.944 1.00 . A A . 13 CYS H 1 1 9 4213 1 1 13 CYS HA H 5.111 0.758 3.136 1.00 . A A . 13 CYS HA 1 1 9 4214 1 1 13 CYS HB2 H 2.445 0.978 3.292 1.00 . A A . 13 CYS HB2 1 1 9 4215 1 1 13 CYS HB3 H 2.692 1.362 1.604 1.00 . A A . 13 CYS HB3 1 1 9 4216 1 1 13 CYS N N 4.265 2.471 3.891 1.00 . A A . 13 CYS N 1 1 9 4217 1 1 13 CYS O O 6.047 1.756 1.063 1.00 . A A . 13 CYS O 1 1 9 4218 1 1 13 CYS SG S 3.228 -0.912 2.066 1.00 . A A . 13 CYS SG 1 1 9 4219 1 1 14 ARG C C 6.233 4.281 0.018 1.00 . A A . 14 ARG C 1 1 9 4220 1 1 14 ARG CA C 4.779 3.877 -0.123 1.00 . A A . 14 ARG CA 1 1 9 4221 1 1 14 ARG CB C 3.915 5.086 -0.441 1.00 . A A . 14 ARG CB 1 1 9 4222 1 1 14 ARG CD C 1.632 5.956 -1.040 1.00 . A A . 14 ARG CD 1 1 9 4223 1 1 14 ARG CG C 2.527 4.729 -0.946 1.00 . A A . 14 ARG CG 1 1 9 4224 1 1 14 ARG CZ C 2.820 7.706 -2.312 1.00 . A A . 14 ARG CZ 1 1 9 4225 1 1 14 ARG H H 3.494 3.480 1.508 1.00 . A A . 14 ARG H 1 1 9 4226 1 1 14 ARG HA H 4.705 3.181 -0.933 1.00 . A A . 14 ARG HA 1 1 9 4227 1 1 14 ARG HB2 H 3.813 5.688 0.447 1.00 . A A . 14 ARG HB2 1 1 9 4228 1 1 14 ARG HB3 H 4.412 5.660 -1.202 1.00 . A A . 14 ARG HB3 1 1 9 4229 1 1 14 ARG HD2 H 0.603 5.633 -1.059 1.00 . A A . 14 ARG HD2 1 1 9 4230 1 1 14 ARG HD3 H 1.798 6.573 -0.170 1.00 . A A . 14 ARG HD3 1 1 9 4231 1 1 14 ARG HE H 1.373 6.540 -3.041 1.00 . A A . 14 ARG HE 1 1 9 4232 1 1 14 ARG HG2 H 2.615 4.287 -1.928 1.00 . A A . 14 ARG HG2 1 1 9 4233 1 1 14 ARG HG3 H 2.078 4.018 -0.270 1.00 . A A . 14 ARG HG3 1 1 9 4234 1 1 14 ARG HH11 H 3.434 7.518 -0.393 1.00 . A A . 14 ARG HH11 1 1 9 4235 1 1 14 ARG HH12 H 4.246 8.737 -1.315 1.00 . A A . 14 ARG HH12 1 1 9 4236 1 1 14 ARG HH21 H 2.443 8.143 -4.248 1.00 . A A . 14 ARG HH21 1 1 9 4237 1 1 14 ARG HH22 H 3.684 9.092 -3.501 1.00 . A A . 14 ARG HH22 1 1 9 4238 1 1 14 ARG N N 4.321 3.193 1.070 1.00 . A A . 14 ARG N 1 1 9 4239 1 1 14 ARG NE N 1.903 6.742 -2.242 1.00 . A A . 14 ARG NE 1 1 9 4240 1 1 14 ARG NH1 N 3.560 8.011 -1.253 1.00 . A A . 14 ARG NH1 1 1 9 4241 1 1 14 ARG NH2 N 2.997 8.368 -3.447 1.00 . A A . 14 ARG NH2 1 1 9 4242 1 1 14 ARG O O 6.980 4.301 -0.959 1.00 . A A . 14 ARG O 1 1 9 4243 1 1 15 LYS C C 8.894 3.721 1.085 1.00 . A A . 15 LYS C 1 1 9 4244 1 1 15 LYS CA C 8.033 4.908 1.488 1.00 . A A . 15 LYS CA 1 1 9 4245 1 1 15 LYS CB C 8.256 5.259 2.961 1.00 . A A . 15 LYS CB 1 1 9 4246 1 1 15 LYS CD C 9.753 6.611 4.458 1.00 . A A . 15 LYS CD 1 1 9 4247 1 1 15 LYS CE C 10.466 7.939 4.653 1.00 . A A . 15 LYS CE 1 1 9 4248 1 1 15 LYS CG C 8.945 6.597 3.170 1.00 . A A . 15 LYS CG 1 1 9 4249 1 1 15 LYS H H 6.024 4.500 1.995 1.00 . A A . 15 LYS H 1 1 9 4250 1 1 15 LYS HA H 8.286 5.757 0.869 1.00 . A A . 15 LYS HA 1 1 9 4251 1 1 15 LYS HB2 H 7.298 5.291 3.459 1.00 . A A . 15 LYS HB2 1 1 9 4252 1 1 15 LYS HB3 H 8.862 4.491 3.416 1.00 . A A . 15 LYS HB3 1 1 9 4253 1 1 15 LYS HD2 H 9.087 6.447 5.291 1.00 . A A . 15 LYS HD2 1 1 9 4254 1 1 15 LYS HD3 H 10.488 5.820 4.419 1.00 . A A . 15 LYS HD3 1 1 9 4255 1 1 15 LYS HE2 H 9.849 8.728 4.247 1.00 . A A . 15 LYS HE2 1 1 9 4256 1 1 15 LYS HE3 H 10.610 8.105 5.710 1.00 . A A . 15 LYS HE3 1 1 9 4257 1 1 15 LYS HG2 H 9.610 6.782 2.339 1.00 . A A . 15 LYS HG2 1 1 9 4258 1 1 15 LYS HG3 H 8.196 7.374 3.216 1.00 . A A . 15 LYS HG3 1 1 9 4259 1 1 15 LYS HZ1 H 12.530 7.621 4.619 1.00 . A A . 15 LYS HZ1 1 1 9 4260 1 1 15 LYS HZ2 H 12.026 8.935 3.682 1.00 . A A . 15 LYS HZ2 1 1 9 4261 1 1 15 LYS HZ3 H 11.771 7.356 3.130 1.00 . A A . 15 LYS HZ3 1 1 9 4262 1 1 15 LYS N N 6.650 4.561 1.243 1.00 . A A . 15 LYS N 1 1 9 4263 1 1 15 LYS NZ N 11.791 7.964 3.974 1.00 . A A . 15 LYS NZ 1 1 9 4264 1 1 15 LYS O O 9.892 3.865 0.380 1.00 . A A . 15 LYS O 1 1 9 4265 1 1 16 GLN C C 8.970 0.924 -0.267 1.00 . A A . 16 GLN C 1 1 9 4266 1 1 16 GLN CA C 9.164 1.304 1.201 1.00 . A A . 16 GLN CA 1 1 9 4267 1 1 16 GLN CB C 8.673 0.169 2.101 1.00 . A A . 16 GLN CB 1 1 9 4268 1 1 16 GLN CD C 10.611 -0.531 3.563 1.00 . A A . 16 GLN CD 1 1 9 4269 1 1 16 GLN CG C 9.732 -0.886 2.380 1.00 . A A . 16 GLN CG 1 1 9 4270 1 1 16 GLN H H 7.646 2.490 2.066 1.00 . A A . 16 GLN H 1 1 9 4271 1 1 16 GLN HA H 10.217 1.462 1.381 1.00 . A A . 16 GLN HA 1 1 9 4272 1 1 16 GLN HB2 H 8.354 0.586 3.045 1.00 . A A . 16 GLN HB2 1 1 9 4273 1 1 16 GLN HB3 H 7.831 -0.313 1.627 1.00 . A A . 16 GLN HB3 1 1 9 4274 1 1 16 GLN HE21 H 9.401 -1.521 4.791 1.00 . A A . 16 GLN HE21 1 1 9 4275 1 1 16 GLN HE22 H 10.773 -0.773 5.530 1.00 . A A . 16 GLN HE22 1 1 9 4276 1 1 16 GLN HG2 H 9.240 -1.825 2.586 1.00 . A A . 16 GLN HG2 1 1 9 4277 1 1 16 GLN HG3 H 10.356 -0.991 1.505 1.00 . A A . 16 GLN HG3 1 1 9 4278 1 1 16 GLN N N 8.470 2.537 1.525 1.00 . A A . 16 GLN N 1 1 9 4279 1 1 16 GLN NE2 N 10.222 -0.988 4.748 1.00 . A A . 16 GLN NE2 1 1 9 4280 1 1 16 GLN O O 9.921 0.900 -1.048 1.00 . A A . 16 GLN O 1 1 9 4281 1 1 16 GLN OE1 O 11.629 0.146 3.415 1.00 . A A . 16 GLN OE1 1 1 9 4282 1 1 17 THR C C 7.437 1.329 -2.985 1.00 . A A . 17 THR C 1 1 9 4283 1 1 17 THR CA C 7.389 0.182 -1.983 1.00 . A A . 17 THR CA 1 1 9 4284 1 1 17 THR CB C 6.008 -0.480 -2.007 1.00 . A A . 17 THR CB 1 1 9 4285 1 1 17 THR CG2 C 4.871 0.473 -1.713 1.00 . A A . 17 THR CG2 1 1 9 4286 1 1 17 THR H H 7.011 0.631 0.051 1.00 . A A . 17 THR H 1 1 9 4287 1 1 17 THR HA H 8.118 -0.548 -2.280 1.00 . A A . 17 THR HA 1 1 9 4288 1 1 17 THR HB H 5.985 -1.262 -1.261 1.00 . A A . 17 THR HB 1 1 9 4289 1 1 17 THR HG1 H 6.546 -1.528 -3.571 1.00 . A A . 17 THR HG1 1 1 9 4290 1 1 17 THR HG21 H 4.697 1.101 -2.574 1.00 . A A . 17 THR HG21 1 1 9 4291 1 1 17 THR HG22 H 5.129 1.090 -0.864 1.00 . A A . 17 THR HG22 1 1 9 4292 1 1 17 THR HG23 H 3.977 -0.090 -1.491 1.00 . A A . 17 THR HG23 1 1 9 4293 1 1 17 THR N N 7.725 0.597 -0.624 1.00 . A A . 17 THR N 1 1 9 4294 1 1 17 THR O O 8.057 1.220 -4.043 1.00 . A A . 17 THR O 1 1 9 4295 1 1 17 THR OG1 O 5.759 -1.068 -3.270 1.00 . A A . 17 THR OG1 1 1 9 4296 1 1 18 GLY C C 5.844 3.263 -4.761 1.00 . A A . 18 GLY C 1 1 9 4297 1 1 18 GLY CA C 6.690 3.550 -3.545 1.00 . A A . 18 GLY CA 1 1 9 4298 1 1 18 GLY H H 6.267 2.428 -1.816 1.00 . A A . 18 GLY H 1 1 9 4299 1 1 18 GLY HA2 H 6.262 4.387 -3.014 1.00 . A A . 18 GLY HA2 1 1 9 4300 1 1 18 GLY HA3 H 7.673 3.808 -3.859 1.00 . A A . 18 GLY HA3 1 1 9 4301 1 1 18 GLY N N 6.751 2.411 -2.658 1.00 . A A . 18 GLY N 1 1 9 4302 1 1 18 GLY O O 6.248 2.517 -5.650 1.00 . A A . 18 GLY O 1 1 9 4303 1 1 19 CYS C C 2.276 4.036 -5.366 1.00 . A A . 19 CYS C 1 1 9 4304 1 1 19 CYS CA C 3.695 3.725 -5.847 1.00 . A A . 19 CYS CA 1 1 9 4305 1 1 19 CYS CB C 3.748 2.401 -6.474 1.00 . A A . 19 CYS CB 1 1 9 4306 1 1 19 CYS H H 4.447 4.444 -4.032 1.00 . A A . 19 CYS H 1 1 9 4307 1 1 19 CYS HA H 3.944 4.368 -6.573 1.00 . A A . 19 CYS HA 1 1 9 4308 1 1 19 CYS HB2 H 4.203 1.767 -5.803 1.00 . A A . 19 CYS HB2 1 1 9 4309 1 1 19 CYS HB3 H 2.757 2.113 -6.666 1.00 . A A . 19 CYS HB3 1 1 9 4310 1 1 19 CYS N N 4.667 3.868 -4.776 1.00 . A A . 19 CYS N 1 1 9 4311 1 1 19 CYS O O 1.766 3.381 -4.457 1.00 . A A . 19 CYS O 1 1 9 4312 1 1 19 CYS SG S 4.665 2.337 -8.054 1.00 . A A . 19 CYS SG 1 1 9 4313 1 1 20 PRO C C -0.725 4.296 -5.520 1.00 . A A . 20 PRO C 1 1 9 4314 1 1 20 PRO CA C 0.262 5.460 -5.577 1.00 . A A . 20 PRO CA 1 1 9 4315 1 1 20 PRO CB C -0.135 6.439 -6.683 1.00 . A A . 20 PRO CB 1 1 9 4316 1 1 20 PRO CD C 2.163 5.898 -7.044 1.00 . A A . 20 PRO CD 1 1 9 4317 1 1 20 PRO CG C 1.153 7.005 -7.164 1.00 . A A . 20 PRO CG 1 1 9 4318 1 1 20 PRO HA H 0.260 5.973 -4.628 1.00 . A A . 20 PRO HA 1 1 9 4319 1 1 20 PRO HB2 H -0.654 5.907 -7.469 1.00 . A A . 20 PRO HB2 1 1 9 4320 1 1 20 PRO HB3 H -0.777 7.206 -6.276 1.00 . A A . 20 PRO HB3 1 1 9 4321 1 1 20 PRO HD2 H 2.226 5.344 -7.970 1.00 . A A . 20 PRO HD2 1 1 9 4322 1 1 20 PRO HD3 H 3.131 6.297 -6.776 1.00 . A A . 20 PRO HD3 1 1 9 4323 1 1 20 PRO HG2 H 1.056 7.315 -8.195 1.00 . A A . 20 PRO HG2 1 1 9 4324 1 1 20 PRO HG3 H 1.440 7.843 -6.546 1.00 . A A . 20 PRO HG3 1 1 9 4325 1 1 20 PRO N N 1.623 5.053 -5.961 1.00 . A A . 20 PRO N 1 1 9 4326 1 1 20 PRO O O -1.742 4.370 -4.830 1.00 . A A . 20 PRO O 1 1 9 4327 1 1 21 TYR C C -1.266 1.314 -4.971 1.00 . A A . 21 TYR C 1 1 9 4328 1 1 21 TYR CA C -1.284 2.064 -6.294 1.00 . A A . 21 TYR CA 1 1 9 4329 1 1 21 TYR CB C -0.826 1.142 -7.422 1.00 . A A . 21 TYR CB 1 1 9 4330 1 1 21 TYR CD1 C -0.470 2.931 -9.172 1.00 . A A . 21 TYR CD1 1 1 9 4331 1 1 21 TYR CD2 C 1.267 1.335 -8.828 1.00 . A A . 21 TYR CD2 1 1 9 4332 1 1 21 TYR CE1 C 0.285 3.549 -10.151 1.00 . A A . 21 TYR CE1 1 1 9 4333 1 1 21 TYR CE2 C 2.028 1.948 -9.805 1.00 . A A . 21 TYR CE2 1 1 9 4334 1 1 21 TYR CG C 0.006 1.816 -8.495 1.00 . A A . 21 TYR CG 1 1 9 4335 1 1 21 TYR CZ C 1.533 3.053 -10.464 1.00 . A A . 21 TYR CZ 1 1 9 4336 1 1 21 TYR H H 0.381 3.222 -6.789 1.00 . A A . 21 TYR H 1 1 9 4337 1 1 21 TYR HA H -2.294 2.384 -6.494 1.00 . A A . 21 TYR HA 1 1 9 4338 1 1 21 TYR HB2 H -0.238 0.341 -7.007 1.00 . A A . 21 TYR HB2 1 1 9 4339 1 1 21 TYR HB3 H -1.690 0.737 -7.894 1.00 . A A . 21 TYR HB3 1 1 9 4340 1 1 21 TYR HD1 H -1.448 3.318 -8.924 1.00 . A A . 21 TYR HD1 1 1 9 4341 1 1 21 TYR HD2 H 1.651 0.469 -8.311 1.00 . A A . 21 TYR HD2 1 1 9 4342 1 1 21 TYR HE1 H -0.103 4.415 -10.666 1.00 . A A . 21 TYR HE1 1 1 9 4343 1 1 21 TYR HE2 H 3.005 1.558 -10.050 1.00 . A A . 21 TYR HE2 1 1 9 4344 1 1 21 TYR HH H 2.380 4.598 -11.232 1.00 . A A . 21 TYR HH 1 1 9 4345 1 1 21 TYR N N -0.429 3.229 -6.252 1.00 . A A . 21 TYR N 1 1 9 4346 1 1 21 TYR O O -0.472 1.616 -4.078 1.00 . A A . 21 TYR O 1 1 9 4347 1 1 21 TYR OH O 2.289 3.665 -11.437 1.00 . A A . 21 TYR OH 1 1 9 4348 1 1 22 GLY C C -3.549 -1.210 -3.528 1.00 . A A . 22 GLY C 1 1 9 4349 1 1 22 GLY CA C -2.234 -0.476 -3.650 1.00 . A A . 22 GLY CA 1 1 9 4350 1 1 22 GLY H H -2.749 0.147 -5.613 1.00 . A A . 22 GLY H 1 1 9 4351 1 1 22 GLY HA2 H -1.442 -1.201 -3.659 1.00 . A A . 22 GLY HA2 1 1 9 4352 1 1 22 GLY HA3 H -2.111 0.166 -2.791 1.00 . A A . 22 GLY HA3 1 1 9 4353 1 1 22 GLY N N -2.149 0.329 -4.860 1.00 . A A . 22 GLY N 1 1 9 4354 1 1 22 GLY O O -4.429 -1.057 -4.376 1.00 . A A . 22 GLY O 1 1 9 4355 1 1 23 LYS C C -5.755 -2.007 -1.179 1.00 . A A . 23 LYS C 1 1 9 4356 1 1 23 LYS CA C -4.943 -2.722 -2.245 1.00 . A A . 23 LYS CA 1 1 9 4357 1 1 23 LYS CB C -4.665 -4.170 -1.837 1.00 . A A . 23 LYS CB 1 1 9 4358 1 1 23 LYS CD C -5.418 -6.560 -2.033 1.00 . A A . 23 LYS CD 1 1 9 4359 1 1 23 LYS CE C -6.174 -7.381 -3.065 1.00 . A A . 23 LYS CE 1 1 9 4360 1 1 23 LYS CG C -5.846 -5.102 -2.058 1.00 . A A . 23 LYS CG 1 1 9 4361 1 1 23 LYS H H -2.988 -2.068 -1.796 1.00 . A A . 23 LYS H 1 1 9 4362 1 1 23 LYS HA H -5.495 -2.712 -3.170 1.00 . A A . 23 LYS HA 1 1 9 4363 1 1 23 LYS HB2 H -3.830 -4.541 -2.412 1.00 . A A . 23 LYS HB2 1 1 9 4364 1 1 23 LYS HB3 H -4.409 -4.195 -0.791 1.00 . A A . 23 LYS HB3 1 1 9 4365 1 1 23 LYS HD2 H -4.361 -6.619 -2.246 1.00 . A A . 23 LYS HD2 1 1 9 4366 1 1 23 LYS HD3 H -5.612 -6.965 -1.051 1.00 . A A . 23 LYS HD3 1 1 9 4367 1 1 23 LYS HE2 H -7.008 -7.864 -2.580 1.00 . A A . 23 LYS HE2 1 1 9 4368 1 1 23 LYS HE3 H -6.540 -6.718 -3.835 1.00 . A A . 23 LYS HE3 1 1 9 4369 1 1 23 LYS HG2 H -6.574 -4.937 -1.279 1.00 . A A . 23 LYS HG2 1 1 9 4370 1 1 23 LYS HG3 H -6.289 -4.883 -3.020 1.00 . A A . 23 LYS HG3 1 1 9 4371 1 1 23 LYS HZ1 H -4.578 -8.729 -3.017 1.00 . A A . 23 LYS HZ1 1 1 9 4372 1 1 23 LYS HZ2 H -4.844 -8.036 -4.537 1.00 . A A . 23 LYS HZ2 1 1 9 4373 1 1 23 LYS HZ3 H -5.883 -9.243 -3.966 1.00 . A A . 23 LYS HZ3 1 1 9 4374 1 1 23 LYS N N -3.704 -1.995 -2.463 1.00 . A A . 23 LYS N 1 1 9 4375 1 1 23 LYS NZ N -5.309 -8.420 -3.691 1.00 . A A . 23 LYS NZ 1 1 9 4376 1 1 23 LYS O O -6.401 -2.630 -0.336 1.00 . A A . 23 LYS O 1 1 9 4377 1 1 24 CYS C C -7.791 0.500 -0.739 1.00 . A A . 24 CYS C 1 1 9 4378 1 1 24 CYS CA C -6.377 0.165 -0.269 1.00 . A A . 24 CYS CA 1 1 9 4379 1 1 24 CYS CB C -5.556 1.439 -0.040 1.00 . A A . 24 CYS CB 1 1 9 4380 1 1 24 CYS H H -5.139 -0.259 -1.915 1.00 . A A . 24 CYS H 1 1 9 4381 1 1 24 CYS HA H -6.443 -0.376 0.663 1.00 . A A . 24 CYS HA 1 1 9 4382 1 1 24 CYS HB2 H -5.684 1.766 0.979 1.00 . A A . 24 CYS HB2 1 1 9 4383 1 1 24 CYS HB3 H -4.517 1.203 -0.200 1.00 . A A . 24 CYS HB3 1 1 9 4384 1 1 24 CYS N N -5.687 -0.681 -1.224 1.00 . A A . 24 CYS N 1 1 9 4385 1 1 24 CYS O O -8.007 0.889 -1.886 1.00 . A A . 24 CYS O 1 1 9 4386 1 1 24 CYS SG S -5.977 2.836 -1.139 1.00 . A A . 24 CYS SG 1 1 9 4387 1 1 25 MET C C -10.919 0.576 1.191 1.00 . A A . 25 MET C 1 1 9 4388 1 1 25 MET CA C -10.143 0.621 -0.109 1.00 . A A . 25 MET CA 1 1 9 4389 1 1 25 MET CB C -10.710 -0.395 -1.103 1.00 . A A . 25 MET CB 1 1 9 4390 1 1 25 MET CE C -12.710 -2.666 -2.510 1.00 . A A . 25 MET CE 1 1 9 4391 1 1 25 MET CG C -12.175 -0.170 -1.433 1.00 . A A . 25 MET CG 1 1 9 4392 1 1 25 MET H H -8.490 0.030 1.062 1.00 . A A . 25 MET H 1 1 9 4393 1 1 25 MET HA H -10.220 1.615 -0.526 1.00 . A A . 25 MET HA 1 1 9 4394 1 1 25 MET HB2 H -10.143 -0.338 -2.020 1.00 . A A . 25 MET HB2 1 1 9 4395 1 1 25 MET HB3 H -10.606 -1.386 -0.685 1.00 . A A . 25 MET HB3 1 1 9 4396 1 1 25 MET HE1 H -11.750 -3.121 -2.706 1.00 . A A . 25 MET HE1 1 1 9 4397 1 1 25 MET HE2 H -13.473 -3.177 -3.080 1.00 . A A . 25 MET HE2 1 1 9 4398 1 1 25 MET HE3 H -12.937 -2.742 -1.457 1.00 . A A . 25 MET HE3 1 1 9 4399 1 1 25 MET HG2 H -12.778 -0.584 -0.639 1.00 . A A . 25 MET HG2 1 1 9 4400 1 1 25 MET HG3 H -12.355 0.893 -1.503 1.00 . A A . 25 MET HG3 1 1 9 4401 1 1 25 MET N N -8.741 0.343 0.168 1.00 . A A . 25 MET N 1 1 9 4402 1 1 25 MET O O -10.610 -0.230 2.063 1.00 . A A . 25 MET O 1 1 9 4403 1 1 25 MET SD S -12.663 -0.941 -2.989 1.00 . A A . 25 MET SD 1 1 9 4404 1 1 26 ASN C C -12.504 0.292 3.426 1.00 . A A . 26 ASN C 1 1 9 4405 1 1 26 ASN CA C -12.715 1.526 2.556 1.00 . A A . 26 ASN CA 1 1 9 4406 1 1 26 ASN CB C -14.204 1.682 2.257 1.00 . A A . 26 ASN CB 1 1 9 4407 1 1 26 ASN CG C -14.492 2.126 0.835 1.00 . A A . 26 ASN CG 1 1 9 4408 1 1 26 ASN H H -12.085 2.087 0.600 1.00 . A A . 26 ASN H 1 1 9 4409 1 1 26 ASN HA H -12.383 2.391 3.111 1.00 . A A . 26 ASN HA 1 1 9 4410 1 1 26 ASN HB2 H -14.692 0.736 2.426 1.00 . A A . 26 ASN HB2 1 1 9 4411 1 1 26 ASN HB3 H -14.614 2.414 2.936 1.00 . A A . 26 ASN HB3 1 1 9 4412 1 1 26 ASN HD21 H -13.808 3.949 1.239 1.00 . A A . 26 ASN HD21 1 1 9 4413 1 1 26 ASN HD22 H -14.368 3.699 -0.376 1.00 . A A . 26 ASN HD22 1 1 9 4414 1 1 26 ASN N N -11.908 1.457 1.330 1.00 . A A . 26 ASN N 1 1 9 4415 1 1 26 ASN ND2 N -14.193 3.385 0.536 1.00 . A A . 26 ASN ND2 1 1 9 4416 1 1 26 ASN O O -12.845 -0.826 3.039 1.00 . A A . 26 ASN O 1 1 9 4417 1 1 26 ASN OD1 O -14.976 1.347 0.014 1.00 . A A . 26 ASN OD1 1 1 9 4418 1 1 27 ARG C C -10.452 -1.411 5.012 1.00 . A A . 27 ARG C 1 1 9 4419 1 1 27 ARG CA C -11.616 -0.567 5.519 1.00 . A A . 27 ARG CA 1 1 9 4420 1 1 27 ARG CB C -12.839 -1.436 5.761 1.00 . A A . 27 ARG CB 1 1 9 4421 1 1 27 ARG CD C -14.525 -0.612 7.439 1.00 . A A . 27 ARG CD 1 1 9 4422 1 1 27 ARG CG C -13.257 -1.419 7.215 1.00 . A A . 27 ARG CG 1 1 9 4423 1 1 27 ARG CZ C -14.012 1.643 6.585 1.00 . A A . 27 ARG CZ 1 1 9 4424 1 1 27 ARG H H -11.659 1.424 4.812 1.00 . A A . 27 ARG H 1 1 9 4425 1 1 27 ARG HA H -11.336 -0.122 6.460 1.00 . A A . 27 ARG HA 1 1 9 4426 1 1 27 ARG HB2 H -13.658 -1.073 5.157 1.00 . A A . 27 ARG HB2 1 1 9 4427 1 1 27 ARG HB3 H -12.614 -2.455 5.482 1.00 . A A . 27 ARG HB3 1 1 9 4428 1 1 27 ARG HD2 H -15.375 -1.268 7.345 1.00 . A A . 27 ARG HD2 1 1 9 4429 1 1 27 ARG HD3 H -14.494 -0.204 8.437 1.00 . A A . 27 ARG HD3 1 1 9 4430 1 1 27 ARG HE H -15.279 0.357 5.732 1.00 . A A . 27 ARG HE 1 1 9 4431 1 1 27 ARG HG2 H -13.416 -2.425 7.538 1.00 . A A . 27 ARG HG2 1 1 9 4432 1 1 27 ARG HG3 H -12.460 -0.981 7.800 1.00 . A A . 27 ARG HG3 1 1 9 4433 1 1 27 ARG HH11 H -13.026 1.144 8.279 1.00 . A A . 27 ARG HH11 1 1 9 4434 1 1 27 ARG HH12 H -12.684 2.724 7.659 1.00 . A A . 27 ARG HH12 1 1 9 4435 1 1 27 ARG HH21 H -14.831 2.436 4.916 1.00 . A A . 27 ARG HH21 1 1 9 4436 1 1 27 ARG HH22 H -13.709 3.458 5.750 1.00 . A A . 27 ARG HH22 1 1 9 4437 1 1 27 ARG N N -11.915 0.511 4.585 1.00 . A A . 27 ARG N 1 1 9 4438 1 1 27 ARG NE N -14.665 0.488 6.485 1.00 . A A . 27 ARG NE 1 1 9 4439 1 1 27 ARG NH1 N -13.172 1.854 7.590 1.00 . A A . 27 ARG NH1 1 1 9 4440 1 1 27 ARG NH2 N -14.199 2.591 5.676 1.00 . A A . 27 ARG NH2 1 1 9 4441 1 1 27 ARG O O -10.351 -2.600 5.311 1.00 . A A . 27 ARG O 1 1 9 4442 1 1 28 LYS C C -7.321 -0.451 3.278 1.00 . A A . 28 LYS C 1 1 9 4443 1 1 28 LYS CA C -8.406 -1.455 3.677 1.00 . A A . 28 LYS CA 1 1 9 4444 1 1 28 LYS CB C -8.811 -2.305 2.469 1.00 . A A . 28 LYS CB 1 1 9 4445 1 1 28 LYS CD C -6.969 -3.967 2.881 1.00 . A A . 28 LYS CD 1 1 9 4446 1 1 28 LYS CE C -6.626 -5.435 3.082 1.00 . A A . 28 LYS CE 1 1 9 4447 1 1 28 LYS CG C -8.452 -3.776 2.609 1.00 . A A . 28 LYS CG 1 1 9 4448 1 1 28 LYS H H -9.720 0.174 4.042 1.00 . A A . 28 LYS H 1 1 9 4449 1 1 28 LYS HA H -8.008 -2.105 4.442 1.00 . A A . 28 LYS HA 1 1 9 4450 1 1 28 LYS HB2 H -9.880 -2.232 2.334 1.00 . A A . 28 LYS HB2 1 1 9 4451 1 1 28 LYS HB3 H -8.319 -1.920 1.587 1.00 . A A . 28 LYS HB3 1 1 9 4452 1 1 28 LYS HD2 H -6.407 -3.589 2.040 1.00 . A A . 28 LYS HD2 1 1 9 4453 1 1 28 LYS HD3 H -6.701 -3.419 3.772 1.00 . A A . 28 LYS HD3 1 1 9 4454 1 1 28 LYS HE2 H -6.614 -5.925 2.120 1.00 . A A . 28 LYS HE2 1 1 9 4455 1 1 28 LYS HE3 H -5.646 -5.504 3.532 1.00 . A A . 28 LYS HE3 1 1 9 4456 1 1 28 LYS HG2 H -9.015 -4.195 3.430 1.00 . A A . 28 LYS HG2 1 1 9 4457 1 1 28 LYS HG3 H -8.712 -4.288 1.695 1.00 . A A . 28 LYS HG3 1 1 9 4458 1 1 28 LYS HZ1 H -8.518 -6.237 3.461 1.00 . A A . 28 LYS HZ1 1 1 9 4459 1 1 28 LYS HZ2 H -7.775 -5.562 4.823 1.00 . A A . 28 LYS HZ2 1 1 9 4460 1 1 28 LYS HZ3 H -7.256 -7.061 4.234 1.00 . A A . 28 LYS HZ3 1 1 9 4461 1 1 28 LYS N N -9.574 -0.776 4.239 1.00 . A A . 28 LYS N 1 1 9 4462 1 1 28 LYS NZ N -7.613 -6.122 3.962 1.00 . A A . 28 LYS NZ 1 1 9 4463 1 1 28 LYS O O -7.611 0.602 2.710 1.00 . A A . 28 LYS O 1 1 9 4464 1 1 29 CYS C C -3.733 -0.740 2.944 1.00 . A A . 29 CYS C 1 1 9 4465 1 1 29 CYS CA C -4.932 0.072 3.322 1.00 . A A . 29 CYS CA 1 1 9 4466 1 1 29 CYS CB C -4.621 0.805 4.551 1.00 . A A . 29 CYS CB 1 1 9 4467 1 1 29 CYS H H -5.917 -1.612 4.072 1.00 . A A . 29 CYS H 1 1 9 4468 1 1 29 CYS HA H -5.188 0.712 2.537 1.00 . A A . 29 CYS HA 1 1 9 4469 1 1 29 CYS HB2 H -5.475 0.715 5.176 1.00 . A A . 29 CYS HB2 1 1 9 4470 1 1 29 CYS HB3 H -3.796 0.296 5.004 1.00 . A A . 29 CYS HB3 1 1 9 4471 1 1 29 CYS N N -6.075 -0.781 3.606 1.00 . A A . 29 CYS N 1 1 9 4472 1 1 29 CYS O O -2.579 -0.429 3.241 1.00 . A A . 29 CYS O 1 1 9 4473 1 1 29 CYS SG S -4.196 2.566 4.356 1.00 . A A . 29 CYS SG 1 1 9 4474 1 1 30 LYS C C -2.419 -2.363 0.608 1.00 . A A . 30 LYS C 1 1 9 4475 1 1 30 LYS CA C -3.143 -2.792 1.869 1.00 . A A . 30 LYS CA 1 1 9 4476 1 1 30 LYS CB C -3.863 -4.127 1.659 1.00 . A A . 30 LYS CB 1 1 9 4477 1 1 30 LYS CD C -2.703 -6.327 2.069 1.00 . A A . 30 LYS CD 1 1 9 4478 1 1 30 LYS CE C -3.408 -7.619 1.690 1.00 . A A . 30 LYS CE 1 1 9 4479 1 1 30 LYS CG C -2.984 -5.218 1.063 1.00 . A A . 30 LYS CG 1 1 9 4480 1 1 30 LYS H H -5.021 -1.874 2.206 1.00 . A A . 30 LYS H 1 1 9 4481 1 1 30 LYS HA H -2.401 -2.915 2.643 1.00 . A A . 30 LYS HA 1 1 9 4482 1 1 30 LYS HB2 H -4.231 -4.474 2.613 1.00 . A A . 30 LYS HB2 1 1 9 4483 1 1 30 LYS HB3 H -4.702 -3.969 1.000 1.00 . A A . 30 LYS HB3 1 1 9 4484 1 1 30 LYS HD2 H -1.639 -6.506 2.104 1.00 . A A . 30 LYS HD2 1 1 9 4485 1 1 30 LYS HD3 H -3.048 -6.012 3.044 1.00 . A A . 30 LYS HD3 1 1 9 4486 1 1 30 LYS HE2 H -3.650 -7.587 0.637 1.00 . A A . 30 LYS HE2 1 1 9 4487 1 1 30 LYS HE3 H -2.740 -8.447 1.877 1.00 . A A . 30 LYS HE3 1 1 9 4488 1 1 30 LYS HG2 H -3.485 -5.643 0.207 1.00 . A A . 30 LYS HG2 1 1 9 4489 1 1 30 LYS HG3 H -2.045 -4.783 0.753 1.00 . A A . 30 LYS HG3 1 1 9 4490 1 1 30 LYS HZ1 H -4.646 -7.234 3.328 1.00 . A A . 30 LYS HZ1 1 1 9 4491 1 1 30 LYS HZ2 H -4.754 -8.819 2.745 1.00 . A A . 30 LYS HZ2 1 1 9 4492 1 1 30 LYS HZ3 H -5.485 -7.554 1.894 1.00 . A A . 30 LYS HZ3 1 1 9 4493 1 1 30 LYS N N -4.077 -1.780 2.331 1.00 . A A . 30 LYS N 1 1 9 4494 1 1 30 LYS NZ N -4.661 -7.821 2.468 1.00 . A A . 30 LYS NZ 1 1 9 4495 1 1 30 LYS O O -2.715 -2.839 -0.481 1.00 . A A . 30 LYS O 1 1 9 4496 1 1 31 CYS C C -0.357 -1.940 -1.402 1.00 . A A . 31 CYS C 1 1 9 4497 1 1 31 CYS CA C -0.591 -0.951 -0.275 1.00 . A A . 31 CYS CA 1 1 9 4498 1 1 31 CYS CB C 0.765 -0.523 0.310 1.00 . A A . 31 CYS CB 1 1 9 4499 1 1 31 CYS H H -1.288 -1.180 1.719 1.00 . A A . 31 CYS H 1 1 9 4500 1 1 31 CYS HA H -1.052 -0.083 -0.710 1.00 . A A . 31 CYS HA 1 1 9 4501 1 1 31 CYS HB2 H 1.524 -0.628 -0.450 1.00 . A A . 31 CYS HB2 1 1 9 4502 1 1 31 CYS HB3 H 0.705 0.514 0.609 1.00 . A A . 31 CYS HB3 1 1 9 4503 1 1 31 CYS N N -1.449 -1.481 0.800 1.00 . A A . 31 CYS N 1 1 9 4504 1 1 31 CYS O O -0.835 -3.074 -1.401 1.00 . A A . 31 CYS O 1 1 9 4505 1 1 31 CYS SG S 1.305 -1.489 1.763 1.00 . A A . 31 CYS SG 1 1 9 4506 1 1 32 ASN C C 2.077 -2.842 -3.456 1.00 . A A . 32 ASN C 1 1 9 4507 1 1 32 ASN CA C 0.704 -2.200 -3.572 1.00 . A A . 32 ASN CA 1 1 9 4508 1 1 32 ASN CB C 0.710 -1.249 -4.744 1.00 . A A . 32 ASN CB 1 1 9 4509 1 1 32 ASN CG C 0.294 -1.903 -6.048 1.00 . A A . 32 ASN CG 1 1 9 4510 1 1 32 ASN H H 0.656 -0.517 -2.313 1.00 . A A . 32 ASN H 1 1 9 4511 1 1 32 ASN HA H -0.035 -2.959 -3.738 1.00 . A A . 32 ASN HA 1 1 9 4512 1 1 32 ASN HB2 H 0.037 -0.446 -4.530 1.00 . A A . 32 ASN HB2 1 1 9 4513 1 1 32 ASN HB3 H 1.698 -0.854 -4.850 1.00 . A A . 32 ASN HB3 1 1 9 4514 1 1 32 ASN HD21 H -1.359 -2.606 -5.197 1.00 . A A . 32 ASN HD21 1 1 9 4515 1 1 32 ASN HD22 H -1.145 -3.004 -6.865 1.00 . A A . 32 ASN HD22 1 1 9 4516 1 1 32 ASN N N 0.363 -1.448 -2.382 1.00 . A A . 32 ASN N 1 1 9 4517 1 1 32 ASN ND2 N -0.853 -2.571 -6.035 1.00 . A A . 32 ASN ND2 1 1 9 4518 1 1 32 ASN O O 2.773 -2.685 -2.454 1.00 . A A . 32 ASN O 1 1 9 4519 1 1 32 ASN OD1 O 0.996 -1.807 -7.055 1.00 . A A . 32 ASN OD1 1 1 9 4520 1 1 33 ARG C C 4.583 -3.553 -5.690 1.00 . A A . 33 ARG C 1 1 9 4521 1 1 33 ARG CA C 3.765 -4.182 -4.578 1.00 . A A . 33 ARG CA 1 1 9 4522 1 1 33 ARG CB C 3.622 -5.689 -4.798 1.00 . A A . 33 ARG CB 1 1 9 4523 1 1 33 ARG CD C 5.646 -6.403 -3.492 1.00 . A A . 33 ARG CD 1 1 9 4524 1 1 33 ARG CG C 4.950 -6.426 -4.844 1.00 . A A . 33 ARG CG 1 1 9 4525 1 1 33 ARG CZ C 7.989 -6.005 -4.150 1.00 . A A . 33 ARG CZ 1 1 9 4526 1 1 33 ARG H H 1.860 -3.596 -5.284 1.00 . A A . 33 ARG H 1 1 9 4527 1 1 33 ARG HA H 4.271 -3.996 -3.643 1.00 . A A . 33 ARG HA 1 1 9 4528 1 1 33 ARG HB2 H 3.032 -6.104 -3.993 1.00 . A A . 33 ARG HB2 1 1 9 4529 1 1 33 ARG HB3 H 3.108 -5.859 -5.733 1.00 . A A . 33 ARG HB3 1 1 9 4530 1 1 33 ARG HD2 H 5.578 -5.406 -3.084 1.00 . A A . 33 ARG HD2 1 1 9 4531 1 1 33 ARG HD3 H 5.148 -7.097 -2.832 1.00 . A A . 33 ARG HD3 1 1 9 4532 1 1 33 ARG HE H 7.319 -7.648 -3.235 1.00 . A A . 33 ARG HE 1 1 9 4533 1 1 33 ARG HG2 H 4.772 -7.452 -5.127 1.00 . A A . 33 ARG HG2 1 1 9 4534 1 1 33 ARG HG3 H 5.587 -5.954 -5.576 1.00 . A A . 33 ARG HG3 1 1 9 4535 1 1 33 ARG HH11 H 6.720 -4.498 -4.613 1.00 . A A . 33 ARG HH11 1 1 9 4536 1 1 33 ARG HH12 H 8.372 -4.243 -5.064 1.00 . A A . 33 ARG HH12 1 1 9 4537 1 1 33 ARG HH21 H 9.494 -7.314 -3.828 1.00 . A A . 33 ARG HH21 1 1 9 4538 1 1 33 ARG HH22 H 9.947 -5.842 -4.619 1.00 . A A . 33 ARG HH22 1 1 9 4539 1 1 33 ARG N N 2.463 -3.537 -4.514 1.00 . A A . 33 ARG N 1 1 9 4540 1 1 33 ARG NE N 7.056 -6.777 -3.596 1.00 . A A . 33 ARG NE 1 1 9 4541 1 1 33 ARG NH1 N 7.667 -4.818 -4.649 1.00 . A A . 33 ARG NH1 1 1 9 4542 1 1 33 ARG NH2 N 9.247 -6.421 -4.203 1.00 . A A . 33 ARG NH2 1 1 9 4543 1 1 33 ARG O O 4.742 -4.117 -6.772 1.00 . A A . 33 ARG O 1 1 9 4544 1 1 34 CYS C C 7.354 -1.598 -5.948 1.00 . A A . 34 CYS C 1 1 9 4545 1 1 34 CYS CA C 5.882 -1.602 -6.345 1.00 . A A . 34 CYS CA 1 1 9 4546 1 1 34 CYS CB C 5.357 -0.175 -6.433 1.00 . A A . 34 CYS CB 1 1 9 4547 1 1 34 CYS H H 4.898 -1.991 -4.510 1.00 . A A . 34 CYS H 1 1 9 4548 1 1 34 CYS HA H 5.784 -2.061 -7.306 1.00 . A A . 34 CYS HA 1 1 9 4549 1 1 34 CYS HB2 H 4.279 -0.195 -6.453 1.00 . A A . 34 CYS HB2 1 1 9 4550 1 1 34 CYS HB3 H 5.686 0.358 -5.565 1.00 . A A . 34 CYS HB3 1 1 9 4551 1 1 34 CYS N N 5.082 -2.367 -5.396 1.00 . A A . 34 CYS N 1 1 9 4552 1 1 34 CYS O O 8.181 -2.092 -6.742 1.00 . A A . 34 CYS O 1 1 9 4553 1 1 34 CYS OXT O 7.668 -1.098 -4.847 1.00 . A A . 34 CYS OXT 1 1 9 4554 1 1 34 CYS SG S 5.925 0.743 -7.901 1.00 . A A . 34 CYS SG 1 1 10 4555 1 1 1 VAL C C -8.309 1.397 -4.903 1.00 . A A . 1 VAL C 1 1 10 4556 1 1 1 VAL CA C -9.486 0.566 -5.401 1.00 . A A . 1 VAL CA 1 1 10 4557 1 1 1 VAL CB C -10.560 0.513 -4.299 1.00 . A A . 1 VAL CB 1 1 10 4558 1 1 1 VAL CG1 C -11.905 0.110 -4.881 1.00 . A A . 1 VAL CG1 1 1 10 4559 1 1 1 VAL CG2 C -10.143 -0.442 -3.190 1.00 . A A . 1 VAL CG2 1 1 10 4560 1 1 1 VAL H1 H -8.441 -1.168 -5.035 1.00 . A A . 1 VAL H1 1 1 10 4561 1 1 1 VAL H2 H -8.525 -0.718 -6.689 1.00 . A A . 1 VAL H2 1 1 10 4562 1 1 1 VAL H3 H -9.901 -1.384 -5.907 1.00 . A A . 1 VAL H3 1 1 10 4563 1 1 1 VAL HA H -9.912 1.050 -6.268 1.00 . A A . 1 VAL HA 1 1 10 4564 1 1 1 VAL HB H -10.660 1.501 -3.874 1.00 . A A . 1 VAL HB 1 1 10 4565 1 1 1 VAL HG11 H -12.697 0.607 -4.340 1.00 . A A . 1 VAL HG11 1 1 10 4566 1 1 1 VAL HG12 H -12.029 -0.960 -4.796 1.00 . A A . 1 VAL HG12 1 1 10 4567 1 1 1 VAL HG13 H -11.947 0.394 -5.923 1.00 . A A . 1 VAL HG13 1 1 10 4568 1 1 1 VAL HG21 H -10.975 -0.603 -2.521 1.00 . A A . 1 VAL HG21 1 1 10 4569 1 1 1 VAL HG22 H -9.317 -0.016 -2.640 1.00 . A A . 1 VAL HG22 1 1 10 4570 1 1 1 VAL HG23 H -9.840 -1.384 -3.623 1.00 . A A . 1 VAL HG23 1 1 10 4571 1 1 1 VAL N N -9.050 -0.799 -5.793 1.00 . A A . 1 VAL N 1 1 10 4572 1 1 1 VAL O O -7.437 0.895 -4.195 1.00 . A A . 1 VAL O 1 1 10 4573 1 1 2 SER C C -7.696 4.522 -3.775 1.00 . A A . 2 SER C 1 1 10 4574 1 1 2 SER CA C -7.221 3.574 -4.872 1.00 . A A . 2 SER CA 1 1 10 4575 1 1 2 SER CB C -6.718 4.377 -6.072 1.00 . A A . 2 SER CB 1 1 10 4576 1 1 2 SER H H -9.016 3.013 -5.844 1.00 . A A . 2 SER H 1 1 10 4577 1 1 2 SER HA H -6.410 2.975 -4.485 1.00 . A A . 2 SER HA 1 1 10 4578 1 1 2 SER HB2 H -5.749 4.793 -5.843 1.00 . A A . 2 SER HB2 1 1 10 4579 1 1 2 SER HB3 H -6.636 3.725 -6.929 1.00 . A A . 2 SER HB3 1 1 10 4580 1 1 2 SER HG H -7.213 5.994 -7.063 1.00 . A A . 2 SER HG 1 1 10 4581 1 1 2 SER N N -8.292 2.672 -5.279 1.00 . A A . 2 SER N 1 1 10 4582 1 1 2 SER O O -8.830 5.000 -3.801 1.00 . A A . 2 SER O 1 1 10 4583 1 1 2 SER OG O -7.605 5.436 -6.387 1.00 . A A . 2 SER OG 1 1 10 4584 1 1 3 CYS C C -6.639 7.091 -1.978 1.00 . A A . 3 CYS C 1 1 10 4585 1 1 3 CYS CA C -7.145 5.679 -1.706 1.00 . A A . 3 CYS CA 1 1 10 4586 1 1 3 CYS CB C -6.543 5.153 -0.402 1.00 . A A . 3 CYS CB 1 1 10 4587 1 1 3 CYS H H -5.931 4.375 -2.850 1.00 . A A . 3 CYS H 1 1 10 4588 1 1 3 CYS HA H -8.221 5.707 -1.609 1.00 . A A . 3 CYS HA 1 1 10 4589 1 1 3 CYS HB2 H -5.482 5.351 -0.399 1.00 . A A . 3 CYS HB2 1 1 10 4590 1 1 3 CYS HB3 H -7.000 5.668 0.431 1.00 . A A . 3 CYS HB3 1 1 10 4591 1 1 3 CYS N N -6.819 4.788 -2.814 1.00 . A A . 3 CYS N 1 1 10 4592 1 1 3 CYS O O -5.927 7.330 -2.954 1.00 . A A . 3 CYS O 1 1 10 4593 1 1 3 CYS SG S -6.771 3.364 -0.141 1.00 . A A . 3 CYS SG 1 1 10 4594 1 1 4 THR C C -6.951 10.220 -0.007 1.00 . A A . 4 THR C 1 1 10 4595 1 1 4 THR CA C -6.595 9.414 -1.253 1.00 . A A . 4 THR CA 1 1 10 4596 1 1 4 THR CB C -7.251 10.040 -2.485 1.00 . A A . 4 THR CB 1 1 10 4597 1 1 4 THR CG2 C -6.414 9.909 -3.739 1.00 . A A . 4 THR CG2 1 1 10 4598 1 1 4 THR H H -7.579 7.772 -0.351 1.00 . A A . 4 THR H 1 1 10 4599 1 1 4 THR HA H -5.523 9.427 -1.381 1.00 . A A . 4 THR HA 1 1 10 4600 1 1 4 THR HB H -7.408 11.093 -2.301 1.00 . A A . 4 THR HB 1 1 10 4601 1 1 4 THR HG1 H -8.378 8.536 -3.037 1.00 . A A . 4 THR HG1 1 1 10 4602 1 1 4 THR HG21 H -5.464 9.459 -3.492 1.00 . A A . 4 THR HG21 1 1 10 4603 1 1 4 THR HG22 H -6.250 10.888 -4.167 1.00 . A A . 4 THR HG22 1 1 10 4604 1 1 4 THR HG23 H -6.932 9.287 -4.454 1.00 . A A . 4 THR HG23 1 1 10 4605 1 1 4 THR N N -7.011 8.024 -1.108 1.00 . A A . 4 THR N 1 1 10 4606 1 1 4 THR O O -7.285 11.402 -0.093 1.00 . A A . 4 THR O 1 1 10 4607 1 1 4 THR OG1 O -8.509 9.441 -2.743 1.00 . A A . 4 THR OG1 1 1 10 4608 1 1 5 GLY C C -7.499 9.265 3.518 1.00 . A A . 5 GLY C 1 1 10 4609 1 1 5 GLY CA C -7.195 10.240 2.398 1.00 . A A . 5 GLY CA 1 1 10 4610 1 1 5 GLY H H -6.607 8.629 1.158 1.00 . A A . 5 GLY H 1 1 10 4611 1 1 5 GLY HA2 H -6.356 10.855 2.687 1.00 . A A . 5 GLY HA2 1 1 10 4612 1 1 5 GLY HA3 H -8.057 10.874 2.245 1.00 . A A . 5 GLY HA3 1 1 10 4613 1 1 5 GLY N N -6.879 9.571 1.150 1.00 . A A . 5 GLY N 1 1 10 4614 1 1 5 GLY O O -8.437 9.466 4.289 1.00 . A A . 5 GLY O 1 1 10 4615 1 1 6 SER C C -6.334 7.676 5.980 1.00 . A A . 6 SER C 1 1 10 4616 1 1 6 SER CA C -6.889 7.195 4.644 1.00 . A A . 6 SER CA 1 1 10 4617 1 1 6 SER CB C -6.209 5.887 4.235 1.00 . A A . 6 SER CB 1 1 10 4618 1 1 6 SER H H -5.970 8.100 2.965 1.00 . A A . 6 SER H 1 1 10 4619 1 1 6 SER HA H -7.948 7.021 4.749 1.00 . A A . 6 SER HA 1 1 10 4620 1 1 6 SER HB2 H -5.238 5.826 4.704 1.00 . A A . 6 SER HB2 1 1 10 4621 1 1 6 SER HB3 H -6.816 5.053 4.554 1.00 . A A . 6 SER HB3 1 1 10 4622 1 1 6 SER HG H -5.104 5.743 2.623 1.00 . A A . 6 SER HG 1 1 10 4623 1 1 6 SER N N -6.701 8.206 3.609 1.00 . A A . 6 SER N 1 1 10 4624 1 1 6 SER O O -6.021 8.856 6.145 1.00 . A A . 6 SER O 1 1 10 4625 1 1 6 SER OG O -6.039 5.816 2.830 1.00 . A A . 6 SER OG 1 1 10 4626 1 1 7 LYS C C -4.188 7.332 8.200 1.00 . A A . 7 LYS C 1 1 10 4627 1 1 7 LYS CA C -5.693 7.089 8.253 1.00 . A A . 7 LYS CA 1 1 10 4628 1 1 7 LYS CB C -6.007 5.967 9.244 1.00 . A A . 7 LYS CB 1 1 10 4629 1 1 7 LYS CD C -7.772 4.534 10.314 1.00 . A A . 7 LYS CD 1 1 10 4630 1 1 7 LYS CE C -7.005 3.224 10.226 1.00 . A A . 7 LYS CE 1 1 10 4631 1 1 7 LYS CG C -7.435 5.455 9.152 1.00 . A A . 7 LYS CG 1 1 10 4632 1 1 7 LYS H H -6.477 5.833 6.741 1.00 . A A . 7 LYS H 1 1 10 4633 1 1 7 LYS HA H -6.181 7.994 8.582 1.00 . A A . 7 LYS HA 1 1 10 4634 1 1 7 LYS HB2 H -5.338 5.140 9.057 1.00 . A A . 7 LYS HB2 1 1 10 4635 1 1 7 LYS HB3 H -5.842 6.332 10.247 1.00 . A A . 7 LYS HB3 1 1 10 4636 1 1 7 LYS HD2 H -7.516 5.027 11.239 1.00 . A A . 7 LYS HD2 1 1 10 4637 1 1 7 LYS HD3 H -8.831 4.322 10.296 1.00 . A A . 7 LYS HD3 1 1 10 4638 1 1 7 LYS HE2 H -7.534 2.554 9.565 1.00 . A A . 7 LYS HE2 1 1 10 4639 1 1 7 LYS HE3 H -6.023 3.424 9.823 1.00 . A A . 7 LYS HE3 1 1 10 4640 1 1 7 LYS HG2 H -8.111 6.297 9.168 1.00 . A A . 7 LYS HG2 1 1 10 4641 1 1 7 LYS HG3 H -7.553 4.912 8.226 1.00 . A A . 7 LYS HG3 1 1 10 4642 1 1 7 LYS HZ1 H -7.792 2.469 12.006 1.00 . A A . 7 LYS HZ1 1 1 10 4643 1 1 7 LYS HZ2 H -6.254 3.154 12.173 1.00 . A A . 7 LYS HZ2 1 1 10 4644 1 1 7 LYS HZ3 H -6.428 1.634 11.451 1.00 . A A . 7 LYS HZ3 1 1 10 4645 1 1 7 LYS N N -6.212 6.757 6.932 1.00 . A A . 7 LYS N 1 1 10 4646 1 1 7 LYS NZ N -6.860 2.575 11.558 1.00 . A A . 7 LYS NZ 1 1 10 4647 1 1 7 LYS O O -3.719 8.442 8.449 1.00 . A A . 7 LYS O 1 1 10 4648 1 1 8 ASP C C -1.369 5.039 7.406 1.00 . A A . 8 ASP C 1 1 10 4649 1 1 8 ASP CA C -1.984 6.382 7.787 1.00 . A A . 8 ASP CA 1 1 10 4650 1 1 8 ASP CB C -1.403 6.864 9.119 1.00 . A A . 8 ASP CB 1 1 10 4651 1 1 8 ASP CG C -0.243 7.823 8.931 1.00 . A A . 8 ASP CG 1 1 10 4652 1 1 8 ASP H H -3.870 5.426 7.685 1.00 . A A . 8 ASP H 1 1 10 4653 1 1 8 ASP HA H -1.746 7.104 7.019 1.00 . A A . 8 ASP HA 1 1 10 4654 1 1 8 ASP HB2 H -2.174 7.368 9.680 1.00 . A A . 8 ASP HB2 1 1 10 4655 1 1 8 ASP HB3 H -1.054 6.010 9.681 1.00 . A A . 8 ASP HB3 1 1 10 4656 1 1 8 ASP N N -3.437 6.285 7.873 1.00 . A A . 8 ASP N 1 1 10 4657 1 1 8 ASP O O -0.415 4.579 8.033 1.00 . A A . 8 ASP O 1 1 10 4658 1 1 8 ASP OD1 O -0.388 8.781 8.144 1.00 . A A . 8 ASP OD1 1 1 10 4659 1 1 8 ASP OD2 O 0.809 7.614 9.571 1.00 . A A . 8 ASP OD2 1 1 10 4660 1 1 9 CYS C C -0.746 3.247 4.562 1.00 . A A . 9 CYS C 1 1 10 4661 1 1 9 CYS CA C -1.431 3.122 5.909 1.00 . A A . 9 CYS CA 1 1 10 4662 1 1 9 CYS CB C -2.572 2.128 5.806 1.00 . A A . 9 CYS CB 1 1 10 4663 1 1 9 CYS H H -2.683 4.827 5.913 1.00 . A A . 9 CYS H 1 1 10 4664 1 1 9 CYS HA H -0.728 2.760 6.623 1.00 . A A . 9 CYS HA 1 1 10 4665 1 1 9 CYS HB2 H -3.343 2.416 6.494 1.00 . A A . 9 CYS HB2 1 1 10 4666 1 1 9 CYS HB3 H -2.959 2.155 4.807 1.00 . A A . 9 CYS HB3 1 1 10 4667 1 1 9 CYS N N -1.924 4.412 6.374 1.00 . A A . 9 CYS N 1 1 10 4668 1 1 9 CYS O O 0.445 2.975 4.426 1.00 . A A . 9 CYS O 1 1 10 4669 1 1 9 CYS SG S -2.102 0.405 6.177 1.00 . A A . 9 CYS SG 1 1 10 4670 1 1 10 TYR C C 0.317 4.616 2.235 1.00 . A A . 10 TYR C 1 1 10 4671 1 1 10 TYR CA C -0.993 3.831 2.218 1.00 . A A . 10 TYR CA 1 1 10 4672 1 1 10 TYR CB C -2.029 4.546 1.341 1.00 . A A . 10 TYR CB 1 1 10 4673 1 1 10 TYR CD1 C -1.196 4.070 -0.997 1.00 . A A . 10 TYR CD1 1 1 10 4674 1 1 10 TYR CD2 C -1.292 6.341 -0.275 1.00 . A A . 10 TYR CD2 1 1 10 4675 1 1 10 TYR CE1 C -0.709 4.477 -2.225 1.00 . A A . 10 TYR CE1 1 1 10 4676 1 1 10 TYR CE2 C -0.805 6.755 -1.500 1.00 . A A . 10 TYR CE2 1 1 10 4677 1 1 10 TYR CG C -1.495 4.993 -0.003 1.00 . A A . 10 TYR CG 1 1 10 4678 1 1 10 TYR CZ C -0.515 5.821 -2.470 1.00 . A A . 10 TYR CZ 1 1 10 4679 1 1 10 TYR H H -2.457 3.860 3.746 1.00 . A A . 10 TYR H 1 1 10 4680 1 1 10 TYR HA H -0.805 2.849 1.809 1.00 . A A . 10 TYR HA 1 1 10 4681 1 1 10 TYR HB2 H -2.858 3.879 1.160 1.00 . A A . 10 TYR HB2 1 1 10 4682 1 1 10 TYR HB3 H -2.386 5.421 1.864 1.00 . A A . 10 TYR HB3 1 1 10 4683 1 1 10 TYR HD1 H -1.349 3.019 -0.801 1.00 . A A . 10 TYR HD1 1 1 10 4684 1 1 10 TYR HD2 H -1.519 7.071 0.488 1.00 . A A . 10 TYR HD2 1 1 10 4685 1 1 10 TYR HE1 H -0.482 3.745 -2.985 1.00 . A A . 10 TYR HE1 1 1 10 4686 1 1 10 TYR HE2 H -0.653 7.808 -1.692 1.00 . A A . 10 TYR HE2 1 1 10 4687 1 1 10 TYR HH H 0.745 6.779 -3.560 1.00 . A A . 10 TYR HH 1 1 10 4688 1 1 10 TYR N N -1.514 3.662 3.567 1.00 . A A . 10 TYR N 1 1 10 4689 1 1 10 TYR O O 1.163 4.445 1.361 1.00 . A A . 10 TYR O 1 1 10 4690 1 1 10 TYR OH O -0.030 6.231 -3.691 1.00 . A A . 10 TYR OH 1 1 10 4691 1 1 11 ALA C C 2.888 5.442 3.765 1.00 . A A . 11 ALA C 1 1 10 4692 1 1 11 ALA CA C 1.685 6.286 3.354 1.00 . A A . 11 ALA CA 1 1 10 4693 1 1 11 ALA CB C 1.472 7.452 4.308 1.00 . A A . 11 ALA CB 1 1 10 4694 1 1 11 ALA H H -0.236 5.573 3.908 1.00 . A A . 11 ALA H 1 1 10 4695 1 1 11 ALA HA H 1.891 6.691 2.373 1.00 . A A . 11 ALA HA 1 1 10 4696 1 1 11 ALA HB1 H 1.282 8.351 3.742 1.00 . A A . 11 ALA HB1 1 1 10 4697 1 1 11 ALA HB2 H 2.356 7.587 4.914 1.00 . A A . 11 ALA HB2 1 1 10 4698 1 1 11 ALA HB3 H 0.627 7.243 4.947 1.00 . A A . 11 ALA HB3 1 1 10 4699 1 1 11 ALA N N 0.474 5.480 3.235 1.00 . A A . 11 ALA N 1 1 10 4700 1 1 11 ALA O O 3.794 5.219 2.961 1.00 . A A . 11 ALA O 1 1 10 4701 1 1 12 PRO C C 4.297 2.997 4.486 1.00 . A A . 12 PRO C 1 1 10 4702 1 1 12 PRO CA C 4.025 4.099 5.485 1.00 . A A . 12 PRO CA 1 1 10 4703 1 1 12 PRO CB C 3.499 3.500 6.788 1.00 . A A . 12 PRO CB 1 1 10 4704 1 1 12 PRO CD C 1.880 5.112 6.048 1.00 . A A . 12 PRO CD 1 1 10 4705 1 1 12 PRO CG C 2.472 4.462 7.266 1.00 . A A . 12 PRO CG 1 1 10 4706 1 1 12 PRO HA H 4.924 4.671 5.666 1.00 . A A . 12 PRO HA 1 1 10 4707 1 1 12 PRO HB2 H 3.070 2.528 6.593 1.00 . A A . 12 PRO HB2 1 1 10 4708 1 1 12 PRO HB3 H 4.310 3.406 7.495 1.00 . A A . 12 PRO HB3 1 1 10 4709 1 1 12 PRO HD2 H 0.964 4.616 5.763 1.00 . A A . 12 PRO HD2 1 1 10 4710 1 1 12 PRO HD3 H 1.698 6.158 6.239 1.00 . A A . 12 PRO HD3 1 1 10 4711 1 1 12 PRO HG2 H 1.708 3.938 7.820 1.00 . A A . 12 PRO HG2 1 1 10 4712 1 1 12 PRO HG3 H 2.940 5.200 7.885 1.00 . A A . 12 PRO HG3 1 1 10 4713 1 1 12 PRO N N 2.919 4.937 5.017 1.00 . A A . 12 PRO N 1 1 10 4714 1 1 12 PRO O O 5.442 2.664 4.179 1.00 . A A . 12 PRO O 1 1 10 4715 1 1 13 CYS C C 3.915 1.871 1.719 1.00 . A A . 13 CYS C 1 1 10 4716 1 1 13 CYS CA C 3.252 1.394 2.992 1.00 . A A . 13 CYS CA 1 1 10 4717 1 1 13 CYS CB C 1.850 0.923 2.671 1.00 . A A . 13 CYS CB 1 1 10 4718 1 1 13 CYS H H 2.333 2.795 4.281 1.00 . A A . 13 CYS H 1 1 10 4719 1 1 13 CYS HA H 3.809 0.577 3.395 1.00 . A A . 13 CYS HA 1 1 10 4720 1 1 13 CYS HB2 H 1.228 1.095 3.525 1.00 . A A . 13 CYS HB2 1 1 10 4721 1 1 13 CYS HB3 H 1.480 1.497 1.844 1.00 . A A . 13 CYS HB3 1 1 10 4722 1 1 13 CYS N N 3.206 2.455 3.980 1.00 . A A . 13 CYS N 1 1 10 4723 1 1 13 CYS O O 4.916 1.310 1.279 1.00 . A A . 13 CYS O 1 1 10 4724 1 1 13 CYS SG S 1.731 -0.837 2.223 1.00 . A A . 13 CYS SG 1 1 10 4725 1 1 14 ARG C C 5.380 3.657 -0.002 1.00 . A A . 14 ARG C 1 1 10 4726 1 1 14 ARG CA C 3.876 3.462 -0.112 1.00 . A A . 14 ARG CA 1 1 10 4727 1 1 14 ARG CB C 3.188 4.784 -0.456 1.00 . A A . 14 ARG CB 1 1 10 4728 1 1 14 ARG CD C 4.116 6.919 -1.412 1.00 . A A . 14 ARG CD 1 1 10 4729 1 1 14 ARG CG C 3.756 5.468 -1.690 1.00 . A A . 14 ARG CG 1 1 10 4730 1 1 14 ARG CZ C 3.093 8.915 -0.390 1.00 . A A . 14 ARG CZ 1 1 10 4731 1 1 14 ARG H H 2.541 3.308 1.528 1.00 . A A . 14 ARG H 1 1 10 4732 1 1 14 ARG HA H 3.679 2.746 -0.891 1.00 . A A . 14 ARG HA 1 1 10 4733 1 1 14 ARG HB2 H 2.140 4.593 -0.629 1.00 . A A . 14 ARG HB2 1 1 10 4734 1 1 14 ARG HB3 H 3.289 5.457 0.383 1.00 . A A . 14 ARG HB3 1 1 10 4735 1 1 14 ARG HD2 H 4.978 6.945 -0.763 1.00 . A A . 14 ARG HD2 1 1 10 4736 1 1 14 ARG HD3 H 4.356 7.404 -2.348 1.00 . A A . 14 ARG HD3 1 1 10 4737 1 1 14 ARG HE H 2.184 7.152 -0.616 1.00 . A A . 14 ARG HE 1 1 10 4738 1 1 14 ARG HG2 H 4.645 4.942 -2.005 1.00 . A A . 14 ARG HG2 1 1 10 4739 1 1 14 ARG HG3 H 3.019 5.434 -2.480 1.00 . A A . 14 ARG HG3 1 1 10 4740 1 1 14 ARG HH11 H 4.997 9.178 -1.018 1.00 . A A . 14 ARG HH11 1 1 10 4741 1 1 14 ARG HH12 H 4.256 10.566 -0.296 1.00 . A A . 14 ARG HH12 1 1 10 4742 1 1 14 ARG HH21 H 1.207 8.977 0.333 1.00 . A A . 14 ARG HH21 1 1 10 4743 1 1 14 ARG HH22 H 2.104 10.452 0.472 1.00 . A A . 14 ARG HH22 1 1 10 4744 1 1 14 ARG N N 3.343 2.910 1.126 1.00 . A A . 14 ARG N 1 1 10 4745 1 1 14 ARG NE N 3.019 7.641 -0.771 1.00 . A A . 14 ARG NE 1 1 10 4746 1 1 14 ARG NH1 N 4.207 9.609 -0.585 1.00 . A A . 14 ARG NH1 1 1 10 4747 1 1 14 ARG NH2 N 2.049 9.496 0.185 1.00 . A A . 14 ARG NH2 1 1 10 4748 1 1 14 ARG O O 6.117 3.468 -0.970 1.00 . A A . 14 ARG O 1 1 10 4749 1 1 15 LYS C C 7.978 2.870 1.264 1.00 . A A . 15 LYS C 1 1 10 4750 1 1 15 LYS CA C 7.250 4.195 1.439 1.00 . A A . 15 LYS CA 1 1 10 4751 1 1 15 LYS CB C 7.479 4.740 2.850 1.00 . A A . 15 LYS CB 1 1 10 4752 1 1 15 LYS CD C 7.674 7.240 2.692 1.00 . A A . 15 LYS CD 1 1 10 4753 1 1 15 LYS CE C 8.574 8.310 2.095 1.00 . A A . 15 LYS CE 1 1 10 4754 1 1 15 LYS CG C 8.421 5.932 2.895 1.00 . A A . 15 LYS CG 1 1 10 4755 1 1 15 LYS H H 5.194 4.124 1.932 1.00 . A A . 15 LYS H 1 1 10 4756 1 1 15 LYS HA H 7.626 4.904 0.719 1.00 . A A . 15 LYS HA 1 1 10 4757 1 1 15 LYS HB2 H 6.529 5.042 3.265 1.00 . A A . 15 LYS HB2 1 1 10 4758 1 1 15 LYS HB3 H 7.896 3.955 3.460 1.00 . A A . 15 LYS HB3 1 1 10 4759 1 1 15 LYS HD2 H 6.843 7.070 2.024 1.00 . A A . 15 LYS HD2 1 1 10 4760 1 1 15 LYS HD3 H 7.306 7.586 3.647 1.00 . A A . 15 LYS HD3 1 1 10 4761 1 1 15 LYS HE2 H 8.337 9.259 2.551 1.00 . A A . 15 LYS HE2 1 1 10 4762 1 1 15 LYS HE3 H 9.603 8.056 2.308 1.00 . A A . 15 LYS HE3 1 1 10 4763 1 1 15 LYS HG2 H 8.911 5.955 3.857 1.00 . A A . 15 LYS HG2 1 1 10 4764 1 1 15 LYS HG3 H 9.160 5.825 2.116 1.00 . A A . 15 LYS HG3 1 1 10 4765 1 1 15 LYS HZ1 H 8.588 7.506 0.166 1.00 . A A . 15 LYS HZ1 1 1 10 4766 1 1 15 LYS HZ2 H 9.058 9.129 0.236 1.00 . A A . 15 LYS HZ2 1 1 10 4767 1 1 15 LYS HZ3 H 7.426 8.716 0.398 1.00 . A A . 15 LYS HZ3 1 1 10 4768 1 1 15 LYS N N 5.831 4.007 1.194 1.00 . A A . 15 LYS N 1 1 10 4769 1 1 15 LYS NZ N 8.399 8.423 0.620 1.00 . A A . 15 LYS NZ 1 1 10 4770 1 1 15 LYS O O 9.043 2.806 0.651 1.00 . A A . 15 LYS O 1 1 10 4771 1 1 16 GLN C C 7.878 -0.068 0.284 1.00 . A A . 16 GLN C 1 1 10 4772 1 1 16 GLN CA C 7.961 0.475 1.710 1.00 . A A . 16 GLN CA 1 1 10 4773 1 1 16 GLN CB C 7.250 -0.479 2.670 1.00 . A A . 16 GLN CB 1 1 10 4774 1 1 16 GLN CD C 7.613 -2.225 4.460 1.00 . A A . 16 GLN CD 1 1 10 4775 1 1 16 GLN CG C 8.137 -1.604 3.179 1.00 . A A . 16 GLN CG 1 1 10 4776 1 1 16 GLN H H 6.528 1.926 2.279 1.00 . A A . 16 GLN H 1 1 10 4777 1 1 16 GLN HA H 9.000 0.545 1.994 1.00 . A A . 16 GLN HA 1 1 10 4778 1 1 16 GLN HB2 H 6.894 0.083 3.522 1.00 . A A . 16 GLN HB2 1 1 10 4779 1 1 16 GLN HB3 H 6.404 -0.919 2.162 1.00 . A A . 16 GLN HB3 1 1 10 4780 1 1 16 GLN HE21 H 8.978 -1.246 5.523 1.00 . A A . 16 GLN HE21 1 1 10 4781 1 1 16 GLN HE22 H 7.913 -2.262 6.425 1.00 . A A . 16 GLN HE22 1 1 10 4782 1 1 16 GLN HG2 H 8.193 -2.372 2.422 1.00 . A A . 16 GLN HG2 1 1 10 4783 1 1 16 GLN HG3 H 9.125 -1.209 3.365 1.00 . A A . 16 GLN HG3 1 1 10 4784 1 1 16 GLN N N 7.383 1.809 1.806 1.00 . A A . 16 GLN N 1 1 10 4785 1 1 16 GLN NE2 N 8.231 -1.875 5.582 1.00 . A A . 16 GLN NE2 1 1 10 4786 1 1 16 GLN O O 8.888 -0.460 -0.299 1.00 . A A . 16 GLN O 1 1 10 4787 1 1 16 GLN OE1 O 6.666 -3.009 4.440 1.00 . A A . 16 GLN OE1 1 1 10 4788 1 1 17 THR C C 7.024 0.336 -2.668 1.00 . A A . 17 THR C 1 1 10 4789 1 1 17 THR CA C 6.453 -0.606 -1.619 1.00 . A A . 17 THR CA 1 1 10 4790 1 1 17 THR CB C 4.960 -0.828 -1.872 1.00 . A A . 17 THR CB 1 1 10 4791 1 1 17 THR CG2 C 4.655 -1.342 -3.264 1.00 . A A . 17 THR CG2 1 1 10 4792 1 1 17 THR H H 5.894 0.225 0.243 1.00 . A A . 17 THR H 1 1 10 4793 1 1 17 THR HA H 6.961 -1.549 -1.697 1.00 . A A . 17 THR HA 1 1 10 4794 1 1 17 THR HB H 4.440 0.111 -1.744 1.00 . A A . 17 THR HB 1 1 10 4795 1 1 17 THR HG1 H 4.538 -1.421 -0.054 1.00 . A A . 17 THR HG1 1 1 10 4796 1 1 17 THR HG21 H 4.870 -0.570 -3.987 1.00 . A A . 17 THR HG21 1 1 10 4797 1 1 17 THR HG22 H 3.612 -1.614 -3.326 1.00 . A A . 17 THR HG22 1 1 10 4798 1 1 17 THR HG23 H 5.266 -2.208 -3.468 1.00 . A A . 17 THR HG23 1 1 10 4799 1 1 17 THR N N 6.665 -0.098 -0.269 1.00 . A A . 17 THR N 1 1 10 4800 1 1 17 THR O O 7.922 -0.028 -3.428 1.00 . A A . 17 THR O 1 1 10 4801 1 1 17 THR OG1 O 4.431 -1.759 -0.946 1.00 . A A . 17 THR OG1 1 1 10 4802 1 1 18 GLY C C 5.778 3.083 -4.472 1.00 . A A . 18 GLY C 1 1 10 4803 1 1 18 GLY CA C 6.920 2.520 -3.663 1.00 . A A . 18 GLY CA 1 1 10 4804 1 1 18 GLY H H 5.780 1.764 -2.097 1.00 . A A . 18 GLY H 1 1 10 4805 1 1 18 GLY HA2 H 7.410 3.320 -3.151 1.00 . A A . 18 GLY HA2 1 1 10 4806 1 1 18 GLY HA3 H 7.613 2.052 -4.324 1.00 . A A . 18 GLY HA3 1 1 10 4807 1 1 18 GLY N N 6.484 1.543 -2.710 1.00 . A A . 18 GLY N 1 1 10 4808 1 1 18 GLY O O 4.944 3.824 -3.954 1.00 . A A . 18 GLY O 1 1 10 4809 1 1 19 CYS C C 3.443 3.608 -6.017 1.00 . A A . 19 CYS C 1 1 10 4810 1 1 19 CYS CA C 4.744 3.168 -6.698 1.00 . A A . 19 CYS CA 1 1 10 4811 1 1 19 CYS CB C 4.461 2.076 -7.700 1.00 . A A . 19 CYS CB 1 1 10 4812 1 1 19 CYS H H 6.476 2.148 -6.069 1.00 . A A . 19 CYS H 1 1 10 4813 1 1 19 CYS HA H 5.153 3.989 -7.240 1.00 . A A . 19 CYS HA 1 1 10 4814 1 1 19 CYS HB2 H 3.550 2.316 -8.216 1.00 . A A . 19 CYS HB2 1 1 10 4815 1 1 19 CYS HB3 H 5.272 2.064 -8.404 1.00 . A A . 19 CYS HB3 1 1 10 4816 1 1 19 CYS N N 5.764 2.727 -5.749 1.00 . A A . 19 CYS N 1 1 10 4817 1 1 19 CYS O O 2.981 2.968 -5.071 1.00 . A A . 19 CYS O 1 1 10 4818 1 1 19 CYS SG S 4.292 0.406 -6.989 1.00 . A A . 19 CYS SG 1 1 10 4819 1 1 20 PRO C C 0.426 4.260 -5.988 1.00 . A A . 20 PRO C 1 1 10 4820 1 1 20 PRO CA C 1.590 5.246 -5.916 1.00 . A A . 20 PRO CA 1 1 10 4821 1 1 20 PRO CB C 1.292 6.483 -6.774 1.00 . A A . 20 PRO CB 1 1 10 4822 1 1 20 PRO CD C 3.318 5.539 -7.609 1.00 . A A . 20 PRO CD 1 1 10 4823 1 1 20 PRO CG C 2.091 6.296 -8.019 1.00 . A A . 20 PRO CG 1 1 10 4824 1 1 20 PRO HA H 1.732 5.549 -4.890 1.00 . A A . 20 PRO HA 1 1 10 4825 1 1 20 PRO HB2 H 0.235 6.530 -6.987 1.00 . A A . 20 PRO HB2 1 1 10 4826 1 1 20 PRO HB3 H 1.597 7.373 -6.243 1.00 . A A . 20 PRO HB3 1 1 10 4827 1 1 20 PRO HD2 H 3.672 4.921 -8.421 1.00 . A A . 20 PRO HD2 1 1 10 4828 1 1 20 PRO HD3 H 4.092 6.218 -7.283 1.00 . A A . 20 PRO HD3 1 1 10 4829 1 1 20 PRO HG2 H 1.521 5.727 -8.739 1.00 . A A . 20 PRO HG2 1 1 10 4830 1 1 20 PRO HG3 H 2.363 7.258 -8.429 1.00 . A A . 20 PRO HG3 1 1 10 4831 1 1 20 PRO N N 2.837 4.715 -6.488 1.00 . A A . 20 PRO N 1 1 10 4832 1 1 20 PRO O O -0.591 4.442 -5.317 1.00 . A A . 20 PRO O 1 1 10 4833 1 1 21 TYR C C -0.614 1.379 -5.703 1.00 . A A . 21 TYR C 1 1 10 4834 1 1 21 TYR CA C -0.465 2.226 -6.963 1.00 . A A . 21 TYR CA 1 1 10 4835 1 1 21 TYR CB C -0.135 1.336 -8.159 1.00 . A A . 21 TYR CB 1 1 10 4836 1 1 21 TYR CD1 C 0.539 3.262 -9.650 1.00 . A A . 21 TYR CD1 1 1 10 4837 1 1 21 TYR CD2 C 1.861 1.279 -9.707 1.00 . A A . 21 TYR CD2 1 1 10 4838 1 1 21 TYR CE1 C 1.365 3.844 -10.594 1.00 . A A . 21 TYR CE1 1 1 10 4839 1 1 21 TYR CE2 C 2.691 1.855 -10.651 1.00 . A A . 21 TYR CE2 1 1 10 4840 1 1 21 TYR CG C 0.774 1.972 -9.192 1.00 . A A . 21 TYR CG 1 1 10 4841 1 1 21 TYR CZ C 2.439 3.138 -11.091 1.00 . A A . 21 TYR CZ 1 1 10 4842 1 1 21 TYR H H 1.384 3.121 -7.322 1.00 . A A . 21 TYR H 1 1 10 4843 1 1 21 TYR HA H -1.398 2.733 -7.151 1.00 . A A . 21 TYR HA 1 1 10 4844 1 1 21 TYR HB2 H 0.343 0.437 -7.810 1.00 . A A . 21 TYR HB2 1 1 10 4845 1 1 21 TYR HB3 H -1.045 1.084 -8.645 1.00 . A A . 21 TYR HB3 1 1 10 4846 1 1 21 TYR HD1 H -0.302 3.814 -9.259 1.00 . A A . 21 TYR HD1 1 1 10 4847 1 1 21 TYR HD2 H 2.057 0.275 -9.362 1.00 . A A . 21 TYR HD2 1 1 10 4848 1 1 21 TYR HE1 H 1.166 4.849 -10.938 1.00 . A A . 21 TYR HE1 1 1 10 4849 1 1 21 TYR HE2 H 3.532 1.301 -11.040 1.00 . A A . 21 TYR HE2 1 1 10 4850 1 1 21 TYR HH H 2.962 3.474 -12.909 1.00 . A A . 21 TYR HH 1 1 10 4851 1 1 21 TYR N N 0.569 3.221 -6.804 1.00 . A A . 21 TYR N 1 1 10 4852 1 1 21 TYR O O 0.227 1.427 -4.805 1.00 . A A . 21 TYR O 1 1 10 4853 1 1 21 TYR OH O 3.263 3.713 -12.029 1.00 . A A . 21 TYR OH 1 1 10 4854 1 1 22 GLY C C -3.368 -0.784 -4.484 1.00 . A A . 22 GLY C 1 1 10 4855 1 1 22 GLY CA C -1.955 -0.244 -4.498 1.00 . A A . 22 GLY CA 1 1 10 4856 1 1 22 GLY H H -2.328 0.625 -6.396 1.00 . A A . 22 GLY H 1 1 10 4857 1 1 22 GLY HA2 H -1.274 -1.074 -4.514 1.00 . A A . 22 GLY HA2 1 1 10 4858 1 1 22 GLY HA3 H -1.790 0.324 -3.594 1.00 . A A . 22 GLY HA3 1 1 10 4859 1 1 22 GLY N N -1.697 0.610 -5.647 1.00 . A A . 22 GLY N 1 1 10 4860 1 1 22 GLY O O -4.247 -0.250 -5.161 1.00 . A A . 22 GLY O 1 1 10 4861 1 1 23 LYS C C -5.583 -1.983 -2.295 1.00 . A A . 23 LYS C 1 1 10 4862 1 1 23 LYS CA C -4.931 -2.419 -3.599 1.00 . A A . 23 LYS CA 1 1 10 4863 1 1 23 LYS CB C -4.892 -3.953 -3.693 1.00 . A A . 23 LYS CB 1 1 10 4864 1 1 23 LYS CD C -3.463 -5.989 -4.053 1.00 . A A . 23 LYS CD 1 1 10 4865 1 1 23 LYS CE C -2.453 -6.830 -3.291 1.00 . A A . 23 LYS CE 1 1 10 4866 1 1 23 LYS CG C -3.508 -4.562 -3.530 1.00 . A A . 23 LYS CG 1 1 10 4867 1 1 23 LYS H H -2.872 -2.208 -3.164 1.00 . A A . 23 LYS H 1 1 10 4868 1 1 23 LYS HA H -5.513 -2.032 -4.419 1.00 . A A . 23 LYS HA 1 1 10 4869 1 1 23 LYS HB2 H -5.529 -4.365 -2.926 1.00 . A A . 23 LYS HB2 1 1 10 4870 1 1 23 LYS HB3 H -5.277 -4.248 -4.659 1.00 . A A . 23 LYS HB3 1 1 10 4871 1 1 23 LYS HD2 H -4.442 -6.433 -3.944 1.00 . A A . 23 LYS HD2 1 1 10 4872 1 1 23 LYS HD3 H -3.189 -5.971 -5.098 1.00 . A A . 23 LYS HD3 1 1 10 4873 1 1 23 LYS HE2 H -1.463 -6.598 -3.653 1.00 . A A . 23 LYS HE2 1 1 10 4874 1 1 23 LYS HE3 H -2.517 -6.584 -2.241 1.00 . A A . 23 LYS HE3 1 1 10 4875 1 1 23 LYS HG2 H -2.795 -3.967 -4.081 1.00 . A A . 23 LYS HG2 1 1 10 4876 1 1 23 LYS HG3 H -3.247 -4.565 -2.482 1.00 . A A . 23 LYS HG3 1 1 10 4877 1 1 23 LYS HZ1 H -3.510 -8.584 -2.878 1.00 . A A . 23 LYS HZ1 1 1 10 4878 1 1 23 LYS HZ2 H -1.862 -8.831 -3.174 1.00 . A A . 23 LYS HZ2 1 1 10 4879 1 1 23 LYS HZ3 H -2.910 -8.500 -4.459 1.00 . A A . 23 LYS HZ3 1 1 10 4880 1 1 23 LYS N N -3.599 -1.835 -3.699 1.00 . A A . 23 LYS N 1 1 10 4881 1 1 23 LYS NZ N -2.701 -8.289 -3.463 1.00 . A A . 23 LYS NZ 1 1 10 4882 1 1 23 LYS O O -6.337 -2.734 -1.676 1.00 . A A . 23 LYS O 1 1 10 4883 1 1 24 CYS C C -7.247 0.251 -0.819 1.00 . A A . 24 CYS C 1 1 10 4884 1 1 24 CYS CA C -5.800 -0.202 -0.651 1.00 . A A . 24 CYS CA 1 1 10 4885 1 1 24 CYS CB C -4.912 0.961 -0.187 1.00 . A A . 24 CYS CB 1 1 10 4886 1 1 24 CYS H H -4.656 -0.219 -2.424 1.00 . A A . 24 CYS H 1 1 10 4887 1 1 24 CYS HA H -5.773 -0.979 0.097 1.00 . A A . 24 CYS HA 1 1 10 4888 1 1 24 CYS HB2 H -5.089 1.145 0.861 1.00 . A A . 24 CYS HB2 1 1 10 4889 1 1 24 CYS HB3 H -3.877 0.681 -0.320 1.00 . A A . 24 CYS HB3 1 1 10 4890 1 1 24 CYS N N -5.271 -0.760 -1.883 1.00 . A A . 24 CYS N 1 1 10 4891 1 1 24 CYS O O -7.567 1.038 -1.711 1.00 . A A . 24 CYS O 1 1 10 4892 1 1 24 CYS SG S -5.176 2.530 -1.080 1.00 . A A . 24 CYS SG 1 1 10 4893 1 1 25 MET C C -9.919 0.838 1.283 1.00 . A A . 25 MET C 1 1 10 4894 1 1 25 MET CA C -9.529 0.094 0.015 1.00 . A A . 25 MET CA 1 1 10 4895 1 1 25 MET CB C -10.385 -1.163 -0.144 1.00 . A A . 25 MET CB 1 1 10 4896 1 1 25 MET CE C -12.520 -3.360 2.132 1.00 . A A . 25 MET CE 1 1 10 4897 1 1 25 MET CG C -10.298 -2.115 1.038 1.00 . A A . 25 MET CG 1 1 10 4898 1 1 25 MET H H -7.793 -0.873 0.738 1.00 . A A . 25 MET H 1 1 10 4899 1 1 25 MET HA H -9.695 0.746 -0.831 1.00 . A A . 25 MET HA 1 1 10 4900 1 1 25 MET HB2 H -11.418 -0.869 -0.266 1.00 . A A . 25 MET HB2 1 1 10 4901 1 1 25 MET HB3 H -10.065 -1.693 -1.029 1.00 . A A . 25 MET HB3 1 1 10 4902 1 1 25 MET HE1 H -12.556 -4.249 2.744 1.00 . A A . 25 MET HE1 1 1 10 4903 1 1 25 MET HE2 H -13.494 -3.179 1.700 1.00 . A A . 25 MET HE2 1 1 10 4904 1 1 25 MET HE3 H -12.234 -2.516 2.741 1.00 . A A . 25 MET HE3 1 1 10 4905 1 1 25 MET HG2 H -9.271 -2.423 1.160 1.00 . A A . 25 MET HG2 1 1 10 4906 1 1 25 MET HG3 H -10.626 -1.594 1.926 1.00 . A A . 25 MET HG3 1 1 10 4907 1 1 25 MET N N -8.115 -0.253 0.050 1.00 . A A . 25 MET N 1 1 10 4908 1 1 25 MET O O -9.386 0.572 2.361 1.00 . A A . 25 MET O 1 1 10 4909 1 1 25 MET SD S -11.319 -3.586 0.822 1.00 . A A . 25 MET SD 1 1 10 4910 1 1 26 ASN C C -11.593 1.685 3.493 1.00 . A A . 26 ASN C 1 1 10 4911 1 1 26 ASN CA C -11.305 2.572 2.286 1.00 . A A . 26 ASN CA 1 1 10 4912 1 1 26 ASN CB C -12.560 3.378 1.941 1.00 . A A . 26 ASN CB 1 1 10 4913 1 1 26 ASN CG C -12.613 3.812 0.487 1.00 . A A . 26 ASN CG 1 1 10 4914 1 1 26 ASN H H -11.225 1.941 0.258 1.00 . A A . 26 ASN H 1 1 10 4915 1 1 26 ASN HA H -10.512 3.256 2.545 1.00 . A A . 26 ASN HA 1 1 10 4916 1 1 26 ASN HB2 H -13.428 2.775 2.150 1.00 . A A . 26 ASN HB2 1 1 10 4917 1 1 26 ASN HB3 H -12.589 4.262 2.561 1.00 . A A . 26 ASN HB3 1 1 10 4918 1 1 26 ASN HD21 H -13.742 2.240 0.033 1.00 . A A . 26 ASN HD21 1 1 10 4919 1 1 26 ASN HD22 H -13.359 3.294 -1.282 1.00 . A A . 26 ASN HD22 1 1 10 4920 1 1 26 ASN N N -10.847 1.776 1.146 1.00 . A A . 26 ASN N 1 1 10 4921 1 1 26 ASN ND2 N -13.308 3.037 -0.337 1.00 . A A . 26 ASN ND2 1 1 10 4922 1 1 26 ASN O O -12.370 0.734 3.412 1.00 . A A . 26 ASN O 1 1 10 4923 1 1 26 ASN OD1 O -12.036 4.832 0.110 1.00 . A A . 26 ASN OD1 1 1 10 4924 1 1 27 ARG C C -10.390 -0.080 5.776 1.00 . A A . 27 ARG C 1 1 10 4925 1 1 27 ARG CA C -11.116 1.255 5.846 1.00 . A A . 27 ARG CA 1 1 10 4926 1 1 27 ARG CB C -12.587 1.047 6.168 1.00 . A A . 27 ARG CB 1 1 10 4927 1 1 27 ARG CD C -13.222 0.735 8.588 1.00 . A A . 27 ARG CD 1 1 10 4928 1 1 27 ARG CG C -12.979 1.728 7.462 1.00 . A A . 27 ARG CG 1 1 10 4929 1 1 27 ARG CZ C -12.709 -1.635 9.039 1.00 . A A . 27 ARG CZ 1 1 10 4930 1 1 27 ARG H H -10.345 2.772 4.595 1.00 . A A . 27 ARG H 1 1 10 4931 1 1 27 ARG HA H -10.685 1.839 6.644 1.00 . A A . 27 ARG HA 1 1 10 4932 1 1 27 ARG HB2 H -13.186 1.456 5.367 1.00 . A A . 27 ARG HB2 1 1 10 4933 1 1 27 ARG HB3 H -12.789 -0.010 6.260 1.00 . A A . 27 ARG HB3 1 1 10 4934 1 1 27 ARG HD2 H -12.975 1.215 9.521 1.00 . A A . 27 ARG HD2 1 1 10 4935 1 1 27 ARG HD3 H -14.265 0.462 8.588 1.00 . A A . 27 ARG HD3 1 1 10 4936 1 1 27 ARG HE H -11.601 -0.421 7.909 1.00 . A A . 27 ARG HE 1 1 10 4937 1 1 27 ARG HG2 H -12.181 2.394 7.759 1.00 . A A . 27 ARG HG2 1 1 10 4938 1 1 27 ARG HG3 H -13.868 2.297 7.294 1.00 . A A . 27 ARG HG3 1 1 10 4939 1 1 27 ARG HH11 H -14.394 -0.960 9.933 1.00 . A A . 27 ARG HH11 1 1 10 4940 1 1 27 ARG HH12 H -14.013 -2.622 10.229 1.00 . A A . 27 ARG HH12 1 1 10 4941 1 1 27 ARG HH21 H -11.099 -2.607 8.299 1.00 . A A . 27 ARG HH21 1 1 10 4942 1 1 27 ARG HH22 H -12.142 -3.557 9.302 1.00 . A A . 27 ARG HH22 1 1 10 4943 1 1 27 ARG N N -10.952 2.007 4.608 1.00 . A A . 27 ARG N 1 1 10 4944 1 1 27 ARG NE N -12.410 -0.475 8.458 1.00 . A A . 27 ARG NE 1 1 10 4945 1 1 27 ARG NH1 N -13.794 -1.747 9.795 1.00 . A A . 27 ARG NH1 1 1 10 4946 1 1 27 ARG NH2 N -11.919 -2.686 8.866 1.00 . A A . 27 ARG NH2 1 1 10 4947 1 1 27 ARG O O -10.773 -1.044 6.437 1.00 . A A . 27 ARG O 1 1 10 4948 1 1 28 LYS C C -7.509 -1.166 3.685 1.00 . A A . 28 LYS C 1 1 10 4949 1 1 28 LYS CA C -8.529 -1.332 4.806 1.00 . A A . 28 LYS CA 1 1 10 4950 1 1 28 LYS CB C -9.425 -2.544 4.519 1.00 . A A . 28 LYS CB 1 1 10 4951 1 1 28 LYS CD C -7.868 -4.317 5.388 1.00 . A A . 28 LYS CD 1 1 10 4952 1 1 28 LYS CE C -7.874 -5.835 5.460 1.00 . A A . 28 LYS CE 1 1 10 4953 1 1 28 LYS CG C -8.654 -3.813 4.188 1.00 . A A . 28 LYS CG 1 1 10 4954 1 1 28 LYS H H -9.084 0.695 4.483 1.00 . A A . 28 LYS H 1 1 10 4955 1 1 28 LYS HA H -7.994 -1.500 5.729 1.00 . A A . 28 LYS HA 1 1 10 4956 1 1 28 LYS HB2 H -10.035 -2.741 5.388 1.00 . A A . 28 LYS HB2 1 1 10 4957 1 1 28 LYS HB3 H -10.069 -2.312 3.684 1.00 . A A . 28 LYS HB3 1 1 10 4958 1 1 28 LYS HD2 H -6.846 -3.975 5.306 1.00 . A A . 28 LYS HD2 1 1 10 4959 1 1 28 LYS HD3 H -8.312 -3.919 6.289 1.00 . A A . 28 LYS HD3 1 1 10 4960 1 1 28 LYS HE2 H -8.727 -6.205 4.911 1.00 . A A . 28 LYS HE2 1 1 10 4961 1 1 28 LYS HE3 H -6.966 -6.208 5.009 1.00 . A A . 28 LYS HE3 1 1 10 4962 1 1 28 LYS HG2 H -9.352 -4.577 3.882 1.00 . A A . 28 LYS HG2 1 1 10 4963 1 1 28 LYS HG3 H -7.967 -3.605 3.381 1.00 . A A . 28 LYS HG3 1 1 10 4964 1 1 28 LYS HZ1 H -7.575 -7.290 6.929 1.00 . A A . 28 LYS HZ1 1 1 10 4965 1 1 28 LYS HZ2 H -8.942 -6.329 7.186 1.00 . A A . 28 LYS HZ2 1 1 10 4966 1 1 28 LYS HZ3 H -7.402 -5.703 7.491 1.00 . A A . 28 LYS HZ3 1 1 10 4967 1 1 28 LYS N N -9.333 -0.119 4.973 1.00 . A A . 28 LYS N 1 1 10 4968 1 1 28 LYS NZ N -7.954 -6.323 6.865 1.00 . A A . 28 LYS NZ 1 1 10 4969 1 1 28 LYS O O -7.810 -1.398 2.514 1.00 . A A . 28 LYS O 1 1 10 4970 1 1 29 CYS C C -4.723 -1.878 2.573 1.00 . A A . 29 CYS C 1 1 10 4971 1 1 29 CYS CA C -5.234 -0.556 3.148 1.00 . A A . 29 CYS CA 1 1 10 4972 1 1 29 CYS CB C -4.154 0.145 3.941 1.00 . A A . 29 CYS CB 1 1 10 4973 1 1 29 CYS H H -6.109 -0.584 4.986 1.00 . A A . 29 CYS H 1 1 10 4974 1 1 29 CYS HA H -5.570 0.086 2.352 1.00 . A A . 29 CYS HA 1 1 10 4975 1 1 29 CYS HB2 H -3.315 0.214 3.346 1.00 . A A . 29 CYS HB2 1 1 10 4976 1 1 29 CYS HB3 H -4.495 1.134 4.203 1.00 . A A . 29 CYS HB3 1 1 10 4977 1 1 29 CYS N N -6.301 -0.761 4.057 1.00 . A A . 29 CYS N 1 1 10 4978 1 1 29 CYS O O -4.879 -2.932 3.190 1.00 . A A . 29 CYS O 1 1 10 4979 1 1 29 CYS SG S -3.663 -0.696 5.483 1.00 . A A . 29 CYS SG 1 1 10 4980 1 1 30 LYS C C -2.638 -2.630 -0.387 1.00 . A A . 30 LYS C 1 1 10 4981 1 1 30 LYS CA C -3.581 -3.008 0.745 1.00 . A A . 30 LYS CA 1 1 10 4982 1 1 30 LYS CB C -4.719 -3.886 0.220 1.00 . A A . 30 LYS CB 1 1 10 4983 1 1 30 LYS CD C -5.542 -5.427 2.031 1.00 . A A . 30 LYS CD 1 1 10 4984 1 1 30 LYS CE C -4.681 -5.666 3.261 1.00 . A A . 30 LYS CE 1 1 10 4985 1 1 30 LYS CG C -4.698 -5.303 0.772 1.00 . A A . 30 LYS CG 1 1 10 4986 1 1 30 LYS H H -4.011 -0.952 0.943 1.00 . A A . 30 LYS H 1 1 10 4987 1 1 30 LYS HA H -3.019 -3.560 1.485 1.00 . A A . 30 LYS HA 1 1 10 4988 1 1 30 LYS HB2 H -5.661 -3.433 0.489 1.00 . A A . 30 LYS HB2 1 1 10 4989 1 1 30 LYS HB3 H -4.651 -3.942 -0.857 1.00 . A A . 30 LYS HB3 1 1 10 4990 1 1 30 LYS HD2 H -6.102 -4.514 2.170 1.00 . A A . 30 LYS HD2 1 1 10 4991 1 1 30 LYS HD3 H -6.225 -6.255 1.914 1.00 . A A . 30 LYS HD3 1 1 10 4992 1 1 30 LYS HE2 H -3.775 -5.084 3.169 1.00 . A A . 30 LYS HE2 1 1 10 4993 1 1 30 LYS HE3 H -5.227 -5.345 4.135 1.00 . A A . 30 LYS HE3 1 1 10 4994 1 1 30 LYS HG2 H -5.088 -5.977 0.022 1.00 . A A . 30 LYS HG2 1 1 10 4995 1 1 30 LYS HG3 H -3.678 -5.573 1.004 1.00 . A A . 30 LYS HG3 1 1 10 4996 1 1 30 LYS HZ1 H -3.724 -7.409 2.618 1.00 . A A . 30 LYS HZ1 1 1 10 4997 1 1 30 LYS HZ2 H -5.178 -7.688 3.435 1.00 . A A . 30 LYS HZ2 1 1 10 4998 1 1 30 LYS HZ3 H -3.795 -7.246 4.301 1.00 . A A . 30 LYS HZ3 1 1 10 4999 1 1 30 LYS N N -4.111 -1.818 1.391 1.00 . A A . 30 LYS N 1 1 10 5000 1 1 30 LYS NZ N -4.319 -7.102 3.414 1.00 . A A . 30 LYS NZ 1 1 10 5001 1 1 30 LYS O O -3.034 -2.563 -1.543 1.00 . A A . 30 LYS O 1 1 10 5002 1 1 31 CYS C C -0.435 -2.726 -2.303 1.00 . A A . 31 CYS C 1 1 10 5003 1 1 31 CYS CA C -0.330 -2.008 -0.968 1.00 . A A . 31 CYS CA 1 1 10 5004 1 1 31 CYS CB C 1.036 -2.300 -0.343 1.00 . A A . 31 CYS CB 1 1 10 5005 1 1 31 CYS H H -1.164 -2.457 0.929 1.00 . A A . 31 CYS H 1 1 10 5006 1 1 31 CYS HA H -0.392 -0.951 -1.164 1.00 . A A . 31 CYS HA 1 1 10 5007 1 1 31 CYS HB2 H 0.900 -2.935 0.518 1.00 . A A . 31 CYS HB2 1 1 10 5008 1 1 31 CYS HB3 H 1.654 -2.812 -1.066 1.00 . A A . 31 CYS HB3 1 1 10 5009 1 1 31 CYS N N -1.388 -2.384 -0.022 1.00 . A A . 31 CYS N 1 1 10 5010 1 1 31 CYS O O -1.212 -3.661 -2.487 1.00 . A A . 31 CYS O 1 1 10 5011 1 1 31 CYS SG S 1.937 -0.815 0.204 1.00 . A A . 31 CYS SG 1 1 10 5012 1 1 32 ASN C C 1.525 -3.829 -4.692 1.00 . A A . 32 ASN C 1 1 10 5013 1 1 32 ASN CA C 0.437 -2.774 -4.575 1.00 . A A . 32 ASN CA 1 1 10 5014 1 1 32 ASN CB C 0.757 -1.640 -5.523 1.00 . A A . 32 ASN CB 1 1 10 5015 1 1 32 ASN CG C 0.160 -1.832 -6.903 1.00 . A A . 32 ASN CG 1 1 10 5016 1 1 32 ASN H H 0.931 -1.475 -3.003 1.00 . A A . 32 ASN H 1 1 10 5017 1 1 32 ASN HA H -0.508 -3.201 -4.841 1.00 . A A . 32 ASN HA 1 1 10 5018 1 1 32 ASN HB2 H 0.381 -0.726 -5.103 1.00 . A A . 32 ASN HB2 1 1 10 5019 1 1 32 ASN HB3 H 1.821 -1.567 -5.611 1.00 . A A . 32 ASN HB3 1 1 10 5020 1 1 32 ASN HD21 H -1.634 -2.166 -6.112 1.00 . A A . 32 ASN HD21 1 1 10 5021 1 1 32 ASN HD22 H -1.550 -2.233 -7.835 1.00 . A A . 32 ASN HD22 1 1 10 5022 1 1 32 ASN N N 0.367 -2.241 -3.231 1.00 . A A . 32 ASN N 1 1 10 5023 1 1 32 ASN ND2 N -1.140 -2.104 -6.955 1.00 . A A . 32 ASN ND2 1 1 10 5024 1 1 32 ASN O O 2.234 -4.125 -3.731 1.00 . A A . 32 ASN O 1 1 10 5025 1 1 32 ASN OD1 O 0.857 -1.737 -7.913 1.00 . A A . 32 ASN OD1 1 1 10 5026 1 1 33 ARG C C 3.753 -4.737 -7.073 1.00 . A A . 33 ARG C 1 1 10 5027 1 1 33 ARG CA C 2.691 -5.355 -6.181 1.00 . A A . 33 ARG CA 1 1 10 5028 1 1 33 ARG CB C 2.083 -6.591 -6.844 1.00 . A A . 33 ARG CB 1 1 10 5029 1 1 33 ARG CD C 3.741 -8.132 -5.752 1.00 . A A . 33 ARG CD 1 1 10 5030 1 1 33 ARG CG C 3.080 -7.719 -7.058 1.00 . A A . 33 ARG CG 1 1 10 5031 1 1 33 ARG CZ C 4.303 -10.512 -6.055 1.00 . A A . 33 ARG CZ 1 1 10 5032 1 1 33 ARG H H 1.081 -4.054 -6.616 1.00 . A A . 33 ARG H 1 1 10 5033 1 1 33 ARG HA H 3.155 -5.632 -5.246 1.00 . A A . 33 ARG HA 1 1 10 5034 1 1 33 ARG HB2 H 1.280 -6.961 -6.224 1.00 . A A . 33 ARG HB2 1 1 10 5035 1 1 33 ARG HB3 H 1.681 -6.309 -7.807 1.00 . A A . 33 ARG HB3 1 1 10 5036 1 1 33 ARG HD2 H 4.277 -7.284 -5.352 1.00 . A A . 33 ARG HD2 1 1 10 5037 1 1 33 ARG HD3 H 2.973 -8.434 -5.054 1.00 . A A . 33 ARG HD3 1 1 10 5038 1 1 33 ARG HE H 5.631 -9.024 -5.976 1.00 . A A . 33 ARG HE 1 1 10 5039 1 1 33 ARG HG2 H 2.561 -8.571 -7.472 1.00 . A A . 33 ARG HG2 1 1 10 5040 1 1 33 ARG HG3 H 3.841 -7.388 -7.748 1.00 . A A . 33 ARG HG3 1 1 10 5041 1 1 33 ARG HH11 H 2.323 -10.134 -5.882 1.00 . A A . 33 ARG HH11 1 1 10 5042 1 1 33 ARG HH12 H 2.745 -11.800 -6.097 1.00 . A A . 33 ARG HH12 1 1 10 5043 1 1 33 ARG HH21 H 6.187 -11.214 -6.259 1.00 . A A . 33 ARG HH21 1 1 10 5044 1 1 33 ARG HH22 H 4.938 -12.413 -6.310 1.00 . A A . 33 ARG HH22 1 1 10 5045 1 1 33 ARG N N 1.667 -4.360 -5.895 1.00 . A A . 33 ARG N 1 1 10 5046 1 1 33 ARG NE N 4.676 -9.239 -5.937 1.00 . A A . 33 ARG NE 1 1 10 5047 1 1 33 ARG NH1 N 3.018 -10.842 -6.008 1.00 . A A . 33 ARG NH1 1 1 10 5048 1 1 33 ARG NH2 N 5.217 -11.457 -6.222 1.00 . A A . 33 ARG NH2 1 1 10 5049 1 1 33 ARG O O 3.750 -4.911 -8.291 1.00 . A A . 33 ARG O 1 1 10 5050 1 1 34 CYS C C 6.961 -4.172 -7.247 1.00 . A A . 34 CYS C 1 1 10 5051 1 1 34 CYS CA C 5.713 -3.302 -7.139 1.00 . A A . 34 CYS CA 1 1 10 5052 1 1 34 CYS CB C 6.026 -2.009 -6.409 1.00 . A A . 34 CYS CB 1 1 10 5053 1 1 34 CYS H H 4.568 -3.888 -5.470 1.00 . A A . 34 CYS H 1 1 10 5054 1 1 34 CYS HA H 5.367 -3.058 -8.120 1.00 . A A . 34 CYS HA 1 1 10 5055 1 1 34 CYS HB2 H 5.278 -1.860 -5.653 1.00 . A A . 34 CYS HB2 1 1 10 5056 1 1 34 CYS HB3 H 6.987 -2.098 -5.945 1.00 . A A . 34 CYS HB3 1 1 10 5057 1 1 34 CYS N N 4.643 -3.990 -6.441 1.00 . A A . 34 CYS N 1 1 10 5058 1 1 34 CYS O O 8.036 -3.627 -7.574 1.00 . A A . 34 CYS O 1 1 10 5059 1 1 34 CYS OXT O 6.853 -5.393 -7.002 1.00 . A A . 34 CYS OXT 1 1 10 5060 1 1 34 CYS SG S 6.036 -0.524 -7.465 1.00 . A A . 34 CYS SG 1 1 11 5061 1 1 1 VAL C C -8.818 3.739 -5.724 1.00 . A A . 1 VAL C 1 1 11 5062 1 1 1 VAL CA C -8.484 4.161 -7.150 1.00 . A A . 1 VAL CA 1 1 11 5063 1 1 1 VAL CB C -8.215 5.678 -7.169 1.00 . A A . 1 VAL CB 1 1 11 5064 1 1 1 VAL CG1 C -7.555 6.088 -8.477 1.00 . A A . 1 VAL CG1 1 1 11 5065 1 1 1 VAL CG2 C -9.505 6.453 -6.948 1.00 . A A . 1 VAL CG2 1 1 11 5066 1 1 1 VAL H1 H -9.387 4.266 -8.995 1.00 . A A . 1 VAL H1 1 1 11 5067 1 1 1 VAL H2 H -10.473 4.128 -7.673 1.00 . A A . 1 VAL H2 1 1 11 5068 1 1 1 VAL H3 H -9.572 2.762 -8.192 1.00 . A A . 1 VAL H3 1 1 11 5069 1 1 1 VAL HA H -7.584 3.653 -7.462 1.00 . A A . 1 VAL HA 1 1 11 5070 1 1 1 VAL HB H -7.536 5.913 -6.361 1.00 . A A . 1 VAL HB 1 1 11 5071 1 1 1 VAL HG11 H -6.706 5.449 -8.667 1.00 . A A . 1 VAL HG11 1 1 11 5072 1 1 1 VAL HG12 H -7.226 7.114 -8.408 1.00 . A A . 1 VAL HG12 1 1 11 5073 1 1 1 VAL HG13 H -8.267 5.990 -9.284 1.00 . A A . 1 VAL HG13 1 1 11 5074 1 1 1 VAL HG21 H -9.289 7.369 -6.418 1.00 . A A . 1 VAL HG21 1 1 11 5075 1 1 1 VAL HG22 H -10.189 5.853 -6.365 1.00 . A A . 1 VAL HG22 1 1 11 5076 1 1 1 VAL HG23 H -9.953 6.686 -7.902 1.00 . A A . 1 VAL HG23 1 1 11 5077 1 1 1 VAL N N -9.577 3.797 -8.087 1.00 . A A . 1 VAL N 1 1 11 5078 1 1 1 VAL O O -9.956 3.880 -5.275 1.00 . A A . 1 VAL O 1 1 11 5079 1 1 2 SER C C -7.409 3.778 -2.659 1.00 . A A . 2 SER C 1 1 11 5080 1 1 2 SER CA C -8.010 2.776 -3.639 1.00 . A A . 2 SER CA 1 1 11 5081 1 1 2 SER CB C -7.379 1.396 -3.433 1.00 . A A . 2 SER CB 1 1 11 5082 1 1 2 SER H H -6.937 3.134 -5.429 1.00 . A A . 2 SER H 1 1 11 5083 1 1 2 SER HA H -9.072 2.706 -3.457 1.00 . A A . 2 SER HA 1 1 11 5084 1 1 2 SER HB2 H -6.545 1.480 -2.750 1.00 . A A . 2 SER HB2 1 1 11 5085 1 1 2 SER HB3 H -8.117 0.725 -3.017 1.00 . A A . 2 SER HB3 1 1 11 5086 1 1 2 SER HG H -6.029 1.189 -4.838 1.00 . A A . 2 SER HG 1 1 11 5087 1 1 2 SER N N -7.821 3.219 -5.016 1.00 . A A . 2 SER N 1 1 11 5088 1 1 2 SER O O -6.224 4.100 -2.734 1.00 . A A . 2 SER O 1 1 11 5089 1 1 2 SER OG O -6.911 0.857 -4.657 1.00 . A A . 2 SER OG 1 1 11 5090 1 1 3 CYS C C -7.215 6.482 -1.414 1.00 . A A . 3 CYS C 1 1 11 5091 1 1 3 CYS CA C -7.789 5.238 -0.744 1.00 . A A . 3 CYS CA 1 1 11 5092 1 1 3 CYS CB C -6.735 4.620 0.181 1.00 . A A . 3 CYS CB 1 1 11 5093 1 1 3 CYS H H -9.171 3.974 -1.735 1.00 . A A . 3 CYS H 1 1 11 5094 1 1 3 CYS HA H -8.648 5.525 -0.156 1.00 . A A . 3 CYS HA 1 1 11 5095 1 1 3 CYS HB2 H -5.762 4.734 -0.271 1.00 . A A . 3 CYS HB2 1 1 11 5096 1 1 3 CYS HB3 H -6.749 5.144 1.126 1.00 . A A . 3 CYS HB3 1 1 11 5097 1 1 3 CYS N N -8.236 4.269 -1.741 1.00 . A A . 3 CYS N 1 1 11 5098 1 1 3 CYS O O -6.929 6.478 -2.612 1.00 . A A . 3 CYS O 1 1 11 5099 1 1 3 CYS SG S -6.976 2.846 0.528 1.00 . A A . 3 CYS SG 1 1 11 5100 1 1 4 THR C C -6.071 9.709 -0.008 1.00 . A A . 4 THR C 1 1 11 5101 1 1 4 THR CA C -6.504 8.795 -1.150 1.00 . A A . 4 THR CA 1 1 11 5102 1 1 4 THR CB C -7.538 9.508 -2.024 1.00 . A A . 4 THR CB 1 1 11 5103 1 1 4 THR CG2 C -6.936 10.580 -2.906 1.00 . A A . 4 THR CG2 1 1 11 5104 1 1 4 THR H H -7.292 7.484 0.313 1.00 . A A . 4 THR H 1 1 11 5105 1 1 4 THR HA H -5.639 8.558 -1.752 1.00 . A A . 4 THR HA 1 1 11 5106 1 1 4 THR HB H -8.271 9.978 -1.385 1.00 . A A . 4 THR HB 1 1 11 5107 1 1 4 THR HG1 H -7.559 8.046 -3.327 1.00 . A A . 4 THR HG1 1 1 11 5108 1 1 4 THR HG21 H -5.879 10.393 -3.027 1.00 . A A . 4 THR HG21 1 1 11 5109 1 1 4 THR HG22 H -7.080 11.546 -2.446 1.00 . A A . 4 THR HG22 1 1 11 5110 1 1 4 THR HG23 H -7.417 10.563 -3.872 1.00 . A A . 4 THR HG23 1 1 11 5111 1 1 4 THR N N -7.048 7.544 -0.634 1.00 . A A . 4 THR N 1 1 11 5112 1 1 4 THR O O -6.149 10.932 -0.114 1.00 . A A . 4 THR O 1 1 11 5113 1 1 4 THR OG1 O -8.206 8.584 -2.865 1.00 . A A . 4 THR OG1 1 1 11 5114 1 1 5 GLY C C -5.176 9.059 3.509 1.00 . A A . 5 GLY C 1 1 11 5115 1 1 5 GLY CA C -5.178 9.875 2.232 1.00 . A A . 5 GLY CA 1 1 11 5116 1 1 5 GLY H H -5.579 8.125 1.111 1.00 . A A . 5 GLY H 1 1 11 5117 1 1 5 GLY HA2 H -4.178 10.238 2.047 1.00 . A A . 5 GLY HA2 1 1 11 5118 1 1 5 GLY HA3 H -5.839 10.719 2.359 1.00 . A A . 5 GLY HA3 1 1 11 5119 1 1 5 GLY N N -5.616 9.104 1.084 1.00 . A A . 5 GLY N 1 1 11 5120 1 1 5 GLY O O -4.132 8.564 3.936 1.00 . A A . 5 GLY O 1 1 11 5121 1 1 6 SER C C -5.546 8.699 6.436 1.00 . A A . 6 SER C 1 1 11 5122 1 1 6 SER CA C -6.479 8.154 5.357 1.00 . A A . 6 SER CA 1 1 11 5123 1 1 6 SER CB C -6.175 6.676 5.102 1.00 . A A . 6 SER CB 1 1 11 5124 1 1 6 SER H H -7.144 9.334 3.731 1.00 . A A . 6 SER H 1 1 11 5125 1 1 6 SER HA H -7.498 8.249 5.699 1.00 . A A . 6 SER HA 1 1 11 5126 1 1 6 SER HB2 H -5.152 6.467 5.375 1.00 . A A . 6 SER HB2 1 1 11 5127 1 1 6 SER HB3 H -6.839 6.067 5.697 1.00 . A A . 6 SER HB3 1 1 11 5128 1 1 6 SER HG H -7.187 6.714 3.425 1.00 . A A . 6 SER HG 1 1 11 5129 1 1 6 SER N N -6.347 8.918 4.121 1.00 . A A . 6 SER N 1 1 11 5130 1 1 6 SER O O -5.007 9.798 6.305 1.00 . A A . 6 SER O 1 1 11 5131 1 1 6 SER OG O -6.357 6.347 3.735 1.00 . A A . 6 SER OG 1 1 11 5132 1 1 7 LYS C C -3.040 8.433 8.130 1.00 . A A . 7 LYS C 1 1 11 5133 1 1 7 LYS CA C -4.489 8.330 8.595 1.00 . A A . 7 LYS CA 1 1 11 5134 1 1 7 LYS CB C -4.594 7.337 9.753 1.00 . A A . 7 LYS CB 1 1 11 5135 1 1 7 LYS CD C -7.079 6.977 9.864 1.00 . A A . 7 LYS CD 1 1 11 5136 1 1 7 LYS CE C -6.959 5.488 9.584 1.00 . A A . 7 LYS CE 1 1 11 5137 1 1 7 LYS CG C -5.852 7.508 10.589 1.00 . A A . 7 LYS CG 1 1 11 5138 1 1 7 LYS H H -5.812 7.057 7.545 1.00 . A A . 7 LYS H 1 1 11 5139 1 1 7 LYS HA H -4.815 9.302 8.934 1.00 . A A . 7 LYS HA 1 1 11 5140 1 1 7 LYS HB2 H -4.588 6.333 9.354 1.00 . A A . 7 LYS HB2 1 1 11 5141 1 1 7 LYS HB3 H -3.739 7.462 10.401 1.00 . A A . 7 LYS HB3 1 1 11 5142 1 1 7 LYS HD2 H -7.950 7.148 10.478 1.00 . A A . 7 LYS HD2 1 1 11 5143 1 1 7 LYS HD3 H -7.188 7.503 8.928 1.00 . A A . 7 LYS HD3 1 1 11 5144 1 1 7 LYS HE2 H -6.578 5.353 8.583 1.00 . A A . 7 LYS HE2 1 1 11 5145 1 1 7 LYS HE3 H -6.268 5.055 10.293 1.00 . A A . 7 LYS HE3 1 1 11 5146 1 1 7 LYS HG2 H -5.734 6.968 11.516 1.00 . A A . 7 LYS HG2 1 1 11 5147 1 1 7 LYS HG3 H -5.994 8.558 10.797 1.00 . A A . 7 LYS HG3 1 1 11 5148 1 1 7 LYS HZ1 H -8.132 3.763 9.686 1.00 . A A . 7 LYS HZ1 1 1 11 5149 1 1 7 LYS HZ2 H -8.888 5.060 8.908 1.00 . A A . 7 LYS HZ2 1 1 11 5150 1 1 7 LYS HZ3 H -8.737 5.057 10.592 1.00 . A A . 7 LYS HZ3 1 1 11 5151 1 1 7 LYS N N -5.357 7.923 7.498 1.00 . A A . 7 LYS N 1 1 11 5152 1 1 7 LYS NZ N -8.271 4.793 9.700 1.00 . A A . 7 LYS NZ 1 1 11 5153 1 1 7 LYS O O -2.416 9.489 8.240 1.00 . A A . 7 LYS O 1 1 11 5154 1 1 8 ASP C C -0.746 5.874 6.711 1.00 . A A . 8 ASP C 1 1 11 5155 1 1 8 ASP CA C -1.136 7.292 7.119 1.00 . A A . 8 ASP CA 1 1 11 5156 1 1 8 ASP CB C -0.173 7.811 8.191 1.00 . A A . 8 ASP CB 1 1 11 5157 1 1 8 ASP CG C 0.292 9.227 7.914 1.00 . A A . 8 ASP CG 1 1 11 5158 1 1 8 ASP H H -3.062 6.521 7.544 1.00 . A A . 8 ASP H 1 1 11 5159 1 1 8 ASP HA H -1.074 7.932 6.252 1.00 . A A . 8 ASP HA 1 1 11 5160 1 1 8 ASP HB2 H -0.670 7.798 9.150 1.00 . A A . 8 ASP HB2 1 1 11 5161 1 1 8 ASP HB3 H 0.694 7.168 8.231 1.00 . A A . 8 ASP HB3 1 1 11 5162 1 1 8 ASP N N -2.513 7.330 7.606 1.00 . A A . 8 ASP N 1 1 11 5163 1 1 8 ASP O O 0.009 5.201 7.412 1.00 . A A . 8 ASP O 1 1 11 5164 1 1 8 ASP OD1 O 0.988 9.435 6.897 1.00 . A A . 8 ASP OD1 1 1 11 5165 1 1 8 ASP OD2 O -0.040 10.128 8.712 1.00 . A A . 8 ASP OD2 1 1 11 5166 1 1 9 CYS C C -0.092 4.142 3.843 1.00 . A A . 9 CYS C 1 1 11 5167 1 1 9 CYS CA C -0.974 4.087 5.075 1.00 . A A . 9 CYS CA 1 1 11 5168 1 1 9 CYS CB C -2.260 3.350 4.746 1.00 . A A . 9 CYS CB 1 1 11 5169 1 1 9 CYS H H -1.866 6.007 5.060 1.00 . A A . 9 CYS H 1 1 11 5170 1 1 9 CYS HA H -0.461 3.556 5.840 1.00 . A A . 9 CYS HA 1 1 11 5171 1 1 9 CYS HB2 H -3.045 3.735 5.367 1.00 . A A . 9 CYS HB2 1 1 11 5172 1 1 9 CYS HB3 H -2.500 3.525 3.717 1.00 . A A . 9 CYS HB3 1 1 11 5173 1 1 9 CYS N N -1.268 5.426 5.574 1.00 . A A . 9 CYS N 1 1 11 5174 1 1 9 CYS O O 1.046 3.674 3.855 1.00 . A A . 9 CYS O 1 1 11 5175 1 1 9 CYS SG S -2.176 1.547 5.001 1.00 . A A . 9 CYS SG 1 1 11 5176 1 1 10 TYR C C 1.512 5.353 1.762 1.00 . A A . 10 TYR C 1 1 11 5177 1 1 10 TYR CA C 0.093 4.848 1.524 1.00 . A A . 10 TYR CA 1 1 11 5178 1 1 10 TYR CB C -0.644 5.814 0.592 1.00 . A A . 10 TYR CB 1 1 11 5179 1 1 10 TYR CD1 C -1.069 4.032 -1.143 1.00 . A A . 10 TYR CD1 1 1 11 5180 1 1 10 TYR CD2 C -2.815 5.586 -0.674 1.00 . A A . 10 TYR CD2 1 1 11 5181 1 1 10 TYR CE1 C -1.872 3.408 -2.078 1.00 . A A . 10 TYR CE1 1 1 11 5182 1 1 10 TYR CE2 C -3.624 4.966 -1.606 1.00 . A A . 10 TYR CE2 1 1 11 5183 1 1 10 TYR CG C -1.527 5.130 -0.426 1.00 . A A . 10 TYR CG 1 1 11 5184 1 1 10 TYR CZ C -3.147 3.878 -2.306 1.00 . A A . 10 TYR CZ 1 1 11 5185 1 1 10 TYR H H -1.543 5.071 2.846 1.00 . A A . 10 TYR H 1 1 11 5186 1 1 10 TYR HA H 0.139 3.875 1.061 1.00 . A A . 10 TYR HA 1 1 11 5187 1 1 10 TYR HB2 H -1.269 6.465 1.184 1.00 . A A . 10 TYR HB2 1 1 11 5188 1 1 10 TYR HB3 H 0.081 6.410 0.057 1.00 . A A . 10 TYR HB3 1 1 11 5189 1 1 10 TYR HD1 H -0.070 3.667 -0.962 1.00 . A A . 10 TYR HD1 1 1 11 5190 1 1 10 TYR HD2 H -3.185 6.439 -0.125 1.00 . A A . 10 TYR HD2 1 1 11 5191 1 1 10 TYR HE1 H -1.498 2.557 -2.624 1.00 . A A . 10 TYR HE1 1 1 11 5192 1 1 10 TYR HE2 H -4.623 5.335 -1.785 1.00 . A A . 10 TYR HE2 1 1 11 5193 1 1 10 TYR HH H -3.423 3.021 -4.005 1.00 . A A . 10 TYR HH 1 1 11 5194 1 1 10 TYR N N -0.631 4.719 2.781 1.00 . A A . 10 TYR N 1 1 11 5195 1 1 10 TYR O O 2.423 5.059 0.993 1.00 . A A . 10 TYR O 1 1 11 5196 1 1 10 TYR OH O -3.948 3.257 -3.236 1.00 . A A . 10 TYR OH 1 1 11 5197 1 1 11 ALA C C 3.975 5.649 3.668 1.00 . A A . 11 ALA C 1 1 11 5198 1 1 11 ALA CA C 2.990 6.697 3.153 1.00 . A A . 11 ALA CA 1 1 11 5199 1 1 11 ALA CB C 2.845 7.839 4.147 1.00 . A A . 11 ALA CB 1 1 11 5200 1 1 11 ALA H H 0.911 6.336 3.399 1.00 . A A . 11 ALA H 1 1 11 5201 1 1 11 ALA HA H 3.395 7.103 2.238 1.00 . A A . 11 ALA HA 1 1 11 5202 1 1 11 ALA HB1 H 2.687 8.764 3.613 1.00 . A A . 11 ALA HB1 1 1 11 5203 1 1 11 ALA HB2 H 3.743 7.916 4.742 1.00 . A A . 11 ALA HB2 1 1 11 5204 1 1 11 ALA HB3 H 2.001 7.648 4.794 1.00 . A A . 11 ALA HB3 1 1 11 5205 1 1 11 ALA N N 1.684 6.132 2.825 1.00 . A A . 11 ALA N 1 1 11 5206 1 1 11 ALA O O 4.946 5.320 2.989 1.00 . A A . 11 ALA O 1 1 11 5207 1 1 12 PRO C C 4.996 3.013 4.484 1.00 . A A . 12 PRO C 1 1 11 5208 1 1 12 PRO CA C 4.625 4.103 5.478 1.00 . A A . 12 PRO CA 1 1 11 5209 1 1 12 PRO CB C 3.795 3.522 6.636 1.00 . A A . 12 PRO CB 1 1 11 5210 1 1 12 PRO CD C 2.622 5.426 5.767 1.00 . A A . 12 PRO CD 1 1 11 5211 1 1 12 PRO CG C 2.436 4.137 6.514 1.00 . A A . 12 PRO CG 1 1 11 5212 1 1 12 PRO HA H 5.527 4.551 5.869 1.00 . A A . 12 PRO HA 1 1 11 5213 1 1 12 PRO HB2 H 3.747 2.447 6.540 1.00 . A A . 12 PRO HB2 1 1 11 5214 1 1 12 PRO HB3 H 4.259 3.781 7.576 1.00 . A A . 12 PRO HB3 1 1 11 5215 1 1 12 PRO HD2 H 1.735 5.670 5.202 1.00 . A A . 12 PRO HD2 1 1 11 5216 1 1 12 PRO HD3 H 2.877 6.226 6.446 1.00 . A A . 12 PRO HD3 1 1 11 5217 1 1 12 PRO HG2 H 1.783 3.477 5.964 1.00 . A A . 12 PRO HG2 1 1 11 5218 1 1 12 PRO HG3 H 2.034 4.328 7.496 1.00 . A A . 12 PRO HG3 1 1 11 5219 1 1 12 PRO N N 3.745 5.110 4.882 1.00 . A A . 12 PRO N 1 1 11 5220 1 1 12 PRO O O 6.053 2.392 4.586 1.00 . A A . 12 PRO O 1 1 11 5221 1 1 13 CYS C C 5.062 2.353 1.303 1.00 . A A . 13 CYS C 1 1 11 5222 1 1 13 CYS CA C 4.333 1.782 2.499 1.00 . A A . 13 CYS CA 1 1 11 5223 1 1 13 CYS CB C 3.006 1.205 2.046 1.00 . A A . 13 CYS CB 1 1 11 5224 1 1 13 CYS H H 3.288 3.321 3.498 1.00 . A A . 13 CYS H 1 1 11 5225 1 1 13 CYS HA H 4.924 1.001 2.921 1.00 . A A . 13 CYS HA 1 1 11 5226 1 1 13 CYS HB2 H 2.277 1.398 2.804 1.00 . A A . 13 CYS HB2 1 1 11 5227 1 1 13 CYS HB3 H 2.711 1.696 1.137 1.00 . A A . 13 CYS HB3 1 1 11 5228 1 1 13 CYS N N 4.113 2.791 3.521 1.00 . A A . 13 CYS N 1 1 11 5229 1 1 13 CYS O O 6.110 1.854 0.916 1.00 . A A . 13 CYS O 1 1 11 5230 1 1 13 CYS SG S 3.024 -0.589 1.726 1.00 . A A . 13 CYS SG 1 1 11 5231 1 1 14 ARG C C 6.598 4.213 -0.245 1.00 . A A . 14 ARG C 1 1 11 5232 1 1 14 ARG CA C 5.109 4.013 -0.459 1.00 . A A . 14 ARG CA 1 1 11 5233 1 1 14 ARG CB C 4.419 5.342 -0.792 1.00 . A A . 14 ARG CB 1 1 11 5234 1 1 14 ARG CD C 5.244 7.608 -1.513 1.00 . A A . 14 ARG CD 1 1 11 5235 1 1 14 ARG CG C 5.101 6.142 -1.893 1.00 . A A . 14 ARG CG 1 1 11 5236 1 1 14 ARG CZ C 3.831 9.626 -1.532 1.00 . A A . 14 ARG CZ 1 1 11 5237 1 1 14 ARG H H 3.658 3.757 1.064 1.00 . A A . 14 ARG H 1 1 11 5238 1 1 14 ARG HA H 4.981 3.322 -1.277 1.00 . A A . 14 ARG HA 1 1 11 5239 1 1 14 ARG HB2 H 3.407 5.136 -1.104 1.00 . A A . 14 ARG HB2 1 1 11 5240 1 1 14 ARG HB3 H 4.392 5.950 0.101 1.00 . A A . 14 ARG HB3 1 1 11 5241 1 1 14 ARG HD2 H 5.675 7.669 -0.525 1.00 . A A . 14 ARG HD2 1 1 11 5242 1 1 14 ARG HD3 H 5.902 8.087 -2.222 1.00 . A A . 14 ARG HD3 1 1 11 5243 1 1 14 ARG HE H 3.147 7.752 -1.497 1.00 . A A . 14 ARG HE 1 1 11 5244 1 1 14 ARG HG2 H 6.081 5.731 -2.074 1.00 . A A . 14 ARG HG2 1 1 11 5245 1 1 14 ARG HG3 H 4.509 6.071 -2.794 1.00 . A A . 14 ARG HG3 1 1 11 5246 1 1 14 ARG HH11 H 5.821 9.994 -1.555 1.00 . A A . 14 ARG HH11 1 1 11 5247 1 1 14 ARG HH12 H 4.805 11.398 -1.569 1.00 . A A . 14 ARG HH12 1 1 11 5248 1 1 14 ARG HH21 H 1.812 9.596 -1.515 1.00 . A A . 14 ARG HH21 1 1 11 5249 1 1 14 ARG HH22 H 2.529 11.172 -1.545 1.00 . A A . 14 ARG HH22 1 1 11 5250 1 1 14 ARG N N 4.500 3.398 0.711 1.00 . A A . 14 ARG N 1 1 11 5251 1 1 14 ARG NE N 3.958 8.302 -1.513 1.00 . A A . 14 ARG NE 1 1 11 5252 1 1 14 ARG NH1 N 4.908 10.403 -1.554 1.00 . A A . 14 ARG NH1 1 1 11 5253 1 1 14 ARG NH2 N 2.625 10.176 -1.530 1.00 . A A . 14 ARG NH2 1 1 11 5254 1 1 14 ARG O O 7.385 4.154 -1.189 1.00 . A A . 14 ARG O 1 1 11 5255 1 1 15 LYS C C 9.128 3.293 0.981 1.00 . A A . 15 LYS C 1 1 11 5256 1 1 15 LYS CA C 8.383 4.575 1.330 1.00 . A A . 15 LYS CA 1 1 11 5257 1 1 15 LYS CB C 8.555 4.907 2.814 1.00 . A A . 15 LYS CB 1 1 11 5258 1 1 15 LYS CD C 10.518 6.434 3.173 1.00 . A A . 15 LYS CD 1 1 11 5259 1 1 15 LYS CE C 11.033 7.738 2.586 1.00 . A A . 15 LYS CE 1 1 11 5260 1 1 15 LYS CG C 9.004 6.336 3.070 1.00 . A A . 15 LYS CG 1 1 11 5261 1 1 15 LYS H H 6.314 4.424 1.721 1.00 . A A . 15 LYS H 1 1 11 5262 1 1 15 LYS HA H 8.775 5.386 0.734 1.00 . A A . 15 LYS HA 1 1 11 5263 1 1 15 LYS HB2 H 7.611 4.754 3.316 1.00 . A A . 15 LYS HB2 1 1 11 5264 1 1 15 LYS HB3 H 9.291 4.239 3.239 1.00 . A A . 15 LYS HB3 1 1 11 5265 1 1 15 LYS HD2 H 10.803 6.382 4.213 1.00 . A A . 15 LYS HD2 1 1 11 5266 1 1 15 LYS HD3 H 10.960 5.608 2.635 1.00 . A A . 15 LYS HD3 1 1 11 5267 1 1 15 LYS HE2 H 10.243 8.473 2.629 1.00 . A A . 15 LYS HE2 1 1 11 5268 1 1 15 LYS HE3 H 11.871 8.077 3.177 1.00 . A A . 15 LYS HE3 1 1 11 5269 1 1 15 LYS HG2 H 8.668 6.959 2.255 1.00 . A A . 15 LYS HG2 1 1 11 5270 1 1 15 LYS HG3 H 8.566 6.680 3.995 1.00 . A A . 15 LYS HG3 1 1 11 5271 1 1 15 LYS HZ1 H 12.019 6.702 1.065 1.00 . A A . 15 LYS HZ1 1 1 11 5272 1 1 15 LYS HZ2 H 12.061 8.382 0.886 1.00 . A A . 15 LYS HZ2 1 1 11 5273 1 1 15 LYS HZ3 H 10.639 7.532 0.545 1.00 . A A . 15 LYS HZ3 1 1 11 5274 1 1 15 LYS N N 6.982 4.412 1.004 1.00 . A A . 15 LYS N 1 1 11 5275 1 1 15 LYS NZ N 11.468 7.577 1.172 1.00 . A A . 15 LYS NZ 1 1 11 5276 1 1 15 LYS O O 10.115 3.315 0.246 1.00 . A A . 15 LYS O 1 1 11 5277 1 1 16 GLN C C 9.013 0.389 -0.184 1.00 . A A . 16 GLN C 1 1 11 5278 1 1 16 GLN CA C 9.255 0.878 1.249 1.00 . A A . 16 GLN CA 1 1 11 5279 1 1 16 GLN CB C 8.764 -0.171 2.254 1.00 . A A . 16 GLN CB 1 1 11 5280 1 1 16 GLN CD C 6.808 -1.323 3.361 1.00 . A A . 16 GLN CD 1 1 11 5281 1 1 16 GLN CG C 7.252 -0.310 2.324 1.00 . A A . 16 GLN CG 1 1 11 5282 1 1 16 GLN H H 7.837 2.216 2.086 1.00 . A A . 16 GLN H 1 1 11 5283 1 1 16 GLN HA H 10.320 1.000 1.384 1.00 . A A . 16 GLN HA 1 1 11 5284 1 1 16 GLN HB2 H 9.177 -1.131 1.982 1.00 . A A . 16 GLN HB2 1 1 11 5285 1 1 16 GLN HB3 H 9.123 0.097 3.237 1.00 . A A . 16 GLN HB3 1 1 11 5286 1 1 16 GLN HE21 H 6.250 -2.583 1.928 1.00 . A A . 16 GLN HE21 1 1 11 5287 1 1 16 GLN HE22 H 6.011 -3.135 3.547 1.00 . A A . 16 GLN HE22 1 1 11 5288 1 1 16 GLN HG2 H 6.826 0.648 2.576 1.00 . A A . 16 GLN HG2 1 1 11 5289 1 1 16 GLN HG3 H 6.886 -0.624 1.358 1.00 . A A . 16 GLN HG3 1 1 11 5290 1 1 16 GLN N N 8.640 2.172 1.511 1.00 . A A . 16 GLN N 1 1 11 5291 1 1 16 GLN NE2 N 6.305 -2.462 2.898 1.00 . A A . 16 GLN NE2 1 1 11 5292 1 1 16 GLN O O 9.954 0.018 -0.886 1.00 . A A . 16 GLN O 1 1 11 5293 1 1 16 GLN OE1 O 6.917 -1.085 4.563 1.00 . A A . 16 GLN OE1 1 1 11 5294 1 1 17 THR C C 7.787 0.821 -3.047 1.00 . A A . 17 THR C 1 1 11 5295 1 1 17 THR CA C 7.385 -0.131 -1.930 1.00 . A A . 17 THR CA 1 1 11 5296 1 1 17 THR CB C 5.883 -0.420 -1.990 1.00 . A A . 17 THR CB 1 1 11 5297 1 1 17 THR CG2 C 5.020 0.823 -1.945 1.00 . A A . 17 THR CG2 1 1 11 5298 1 1 17 THR H H 7.031 0.647 -0.002 1.00 . A A . 17 THR H 1 1 11 5299 1 1 17 THR HA H 7.910 -1.057 -2.081 1.00 . A A . 17 THR HA 1 1 11 5300 1 1 17 THR HB H 5.614 -1.038 -1.145 1.00 . A A . 17 THR HB 1 1 11 5301 1 1 17 THR HG1 H 5.009 -1.881 -2.953 1.00 . A A . 17 THR HG1 1 1 11 5302 1 1 17 THR HG21 H 5.256 1.391 -1.059 1.00 . A A . 17 THR HG21 1 1 11 5303 1 1 17 THR HG22 H 3.979 0.537 -1.924 1.00 . A A . 17 THR HG22 1 1 11 5304 1 1 17 THR HG23 H 5.210 1.426 -2.820 1.00 . A A . 17 THR HG23 1 1 11 5305 1 1 17 THR N N 7.745 0.354 -0.602 1.00 . A A . 17 THR N 1 1 11 5306 1 1 17 THR O O 8.378 0.410 -4.046 1.00 . A A . 17 THR O 1 1 11 5307 1 1 17 THR OG1 O 5.560 -1.125 -3.171 1.00 . A A . 17 THR OG1 1 1 11 5308 1 1 18 GLY C C 6.435 3.641 -4.473 1.00 . A A . 18 GLY C 1 1 11 5309 1 1 18 GLY CA C 7.706 3.066 -3.902 1.00 . A A . 18 GLY CA 1 1 11 5310 1 1 18 GLY H H 6.939 2.342 -2.105 1.00 . A A . 18 GLY H 1 1 11 5311 1 1 18 GLY HA2 H 8.294 3.856 -3.485 1.00 . A A . 18 GLY HA2 1 1 11 5312 1 1 18 GLY HA3 H 8.255 2.594 -4.684 1.00 . A A . 18 GLY HA3 1 1 11 5313 1 1 18 GLY N N 7.424 2.083 -2.893 1.00 . A A . 18 GLY N 1 1 11 5314 1 1 18 GLY O O 5.701 4.343 -3.781 1.00 . A A . 18 GLY O 1 1 11 5315 1 1 19 CYS C C 3.797 4.002 -5.492 1.00 . A A . 19 CYS C 1 1 11 5316 1 1 19 CYS CA C 4.990 3.799 -6.436 1.00 . A A . 19 CYS CA 1 1 11 5317 1 1 19 CYS CB C 4.618 2.867 -7.563 1.00 . A A . 19 CYS CB 1 1 11 5318 1 1 19 CYS H H 6.814 2.784 -6.213 1.00 . A A . 19 CYS H 1 1 11 5319 1 1 19 CYS HA H 5.234 4.727 -6.881 1.00 . A A . 19 CYS HA 1 1 11 5320 1 1 19 CYS HB2 H 3.560 2.914 -7.693 1.00 . A A . 19 CYS HB2 1 1 11 5321 1 1 19 CYS HB3 H 5.094 3.237 -8.454 1.00 . A A . 19 CYS HB3 1 1 11 5322 1 1 19 CYS N N 6.180 3.335 -5.737 1.00 . A A . 19 CYS N 1 1 11 5323 1 1 19 CYS O O 3.666 3.307 -4.484 1.00 . A A . 19 CYS O 1 1 11 5324 1 1 19 CYS SG S 5.095 1.114 -7.354 1.00 . A A . 19 CYS SG 1 1 11 5325 1 1 20 PRO C C 0.618 4.292 -5.032 1.00 . A A . 20 PRO C 1 1 11 5326 1 1 20 PRO CA C 1.760 5.307 -4.958 1.00 . A A . 20 PRO CA 1 1 11 5327 1 1 20 PRO CB C 1.300 6.654 -5.514 1.00 . A A . 20 PRO CB 1 1 11 5328 1 1 20 PRO CD C 3.029 5.876 -6.968 1.00 . A A . 20 PRO CD 1 1 11 5329 1 1 20 PRO CG C 1.737 6.645 -6.937 1.00 . A A . 20 PRO CG 1 1 11 5330 1 1 20 PRO HA H 2.050 5.433 -3.926 1.00 . A A . 20 PRO HA 1 1 11 5331 1 1 20 PRO HB2 H 0.226 6.734 -5.429 1.00 . A A . 20 PRO HB2 1 1 11 5332 1 1 20 PRO HB3 H 1.771 7.455 -4.963 1.00 . A A . 20 PRO HB3 1 1 11 5333 1 1 20 PRO HD2 H 3.106 5.306 -7.882 1.00 . A A . 20 PRO HD2 1 1 11 5334 1 1 20 PRO HD3 H 3.869 6.547 -6.867 1.00 . A A . 20 PRO HD3 1 1 11 5335 1 1 20 PRO HG2 H 0.993 6.152 -7.546 1.00 . A A . 20 PRO HG2 1 1 11 5336 1 1 20 PRO HG3 H 1.896 7.657 -7.280 1.00 . A A . 20 PRO HG3 1 1 11 5337 1 1 20 PRO N N 2.926 4.982 -5.797 1.00 . A A . 20 PRO N 1 1 11 5338 1 1 20 PRO O O -0.442 4.516 -4.447 1.00 . A A . 20 PRO O 1 1 11 5339 1 1 21 TYR C C -0.439 1.455 -4.537 1.00 . A A . 21 TYR C 1 1 11 5340 1 1 21 TYR CA C -0.216 2.180 -5.863 1.00 . A A . 21 TYR CA 1 1 11 5341 1 1 21 TYR CB C 0.162 1.181 -6.949 1.00 . A A . 21 TYR CB 1 1 11 5342 1 1 21 TYR CD1 C 0.867 3.014 -8.544 1.00 . A A . 21 TYR CD1 1 1 11 5343 1 1 21 TYR CD2 C 2.081 0.963 -8.581 1.00 . A A . 21 TYR CD2 1 1 11 5344 1 1 21 TYR CE1 C 1.675 3.516 -9.546 1.00 . A A . 21 TYR CE1 1 1 11 5345 1 1 21 TYR CE2 C 2.892 1.457 -9.585 1.00 . A A . 21 TYR CE2 1 1 11 5346 1 1 21 TYR CG C 1.056 1.732 -8.043 1.00 . A A . 21 TYR CG 1 1 11 5347 1 1 21 TYR CZ C 2.685 2.733 -10.063 1.00 . A A . 21 TYR CZ 1 1 11 5348 1 1 21 TYR H H 1.657 3.038 -6.198 1.00 . A A . 21 TYR H 1 1 11 5349 1 1 21 TYR HA H -1.132 2.676 -6.146 1.00 . A A . 21 TYR HA 1 1 11 5350 1 1 21 TYR HB2 H 0.661 0.340 -6.499 1.00 . A A . 21 TYR HB2 1 1 11 5351 1 1 21 TYR HB3 H -0.733 0.848 -7.409 1.00 . A A . 21 TYR HB3 1 1 11 5352 1 1 21 TYR HD1 H 0.075 3.625 -8.136 1.00 . A A . 21 TYR HD1 1 1 11 5353 1 1 21 TYR HD2 H 2.242 -0.036 -8.203 1.00 . A A . 21 TYR HD2 1 1 11 5354 1 1 21 TYR HE1 H 1.513 4.516 -9.921 1.00 . A A . 21 TYR HE1 1 1 11 5355 1 1 21 TYR HE2 H 3.683 0.843 -9.991 1.00 . A A . 21 TYR HE2 1 1 11 5356 1 1 21 TYR HH H 3.561 2.581 -11.768 1.00 . A A . 21 TYR HH 1 1 11 5357 1 1 21 TYR N N 0.814 3.186 -5.741 1.00 . A A . 21 TYR N 1 1 11 5358 1 1 21 TYR O O 0.376 1.548 -3.619 1.00 . A A . 21 TYR O 1 1 11 5359 1 1 21 TYR OH O 3.491 3.229 -11.063 1.00 . A A . 21 TYR OH 1 1 11 5360 1 1 22 GLY C C -3.182 -0.773 -3.361 1.00 . A A . 22 GLY C 1 1 11 5361 1 1 22 GLY CA C -1.882 0.002 -3.236 1.00 . A A . 22 GLY CA 1 1 11 5362 1 1 22 GLY H H -2.161 0.706 -5.217 1.00 . A A . 22 GLY H 1 1 11 5363 1 1 22 GLY HA2 H -1.089 -0.684 -3.024 1.00 . A A . 22 GLY HA2 1 1 11 5364 1 1 22 GLY HA3 H -1.967 0.695 -2.417 1.00 . A A . 22 GLY HA3 1 1 11 5365 1 1 22 GLY N N -1.554 0.737 -4.449 1.00 . A A . 22 GLY N 1 1 11 5366 1 1 22 GLY O O -4.074 -0.366 -4.105 1.00 . A A . 22 GLY O 1 1 11 5367 1 1 23 LYS C C -5.456 -2.262 -1.517 1.00 . A A . 23 LYS C 1 1 11 5368 1 1 23 LYS CA C -4.542 -2.661 -2.671 1.00 . A A . 23 LYS CA 1 1 11 5369 1 1 23 LYS CB C -4.236 -4.161 -2.619 1.00 . A A . 23 LYS CB 1 1 11 5370 1 1 23 LYS CD C -4.135 -6.137 -4.170 1.00 . A A . 23 LYS CD 1 1 11 5371 1 1 23 LYS CE C -4.999 -7.343 -4.497 1.00 . A A . 23 LYS CE 1 1 11 5372 1 1 23 LYS CG C -4.973 -4.968 -3.676 1.00 . A A . 23 LYS CG 1 1 11 5373 1 1 23 LYS H H -2.593 -2.159 -2.022 1.00 . A A . 23 LYS H 1 1 11 5374 1 1 23 LYS HA H -5.036 -2.434 -3.601 1.00 . A A . 23 LYS HA 1 1 11 5375 1 1 23 LYS HB2 H -3.175 -4.305 -2.764 1.00 . A A . 23 LYS HB2 1 1 11 5376 1 1 23 LYS HB3 H -4.513 -4.541 -1.648 1.00 . A A . 23 LYS HB3 1 1 11 5377 1 1 23 LYS HD2 H -3.604 -5.835 -5.060 1.00 . A A . 23 LYS HD2 1 1 11 5378 1 1 23 LYS HD3 H -3.426 -6.409 -3.402 1.00 . A A . 23 LYS HD3 1 1 11 5379 1 1 23 LYS HE2 H -4.391 -8.233 -4.431 1.00 . A A . 23 LYS HE2 1 1 11 5380 1 1 23 LYS HE3 H -5.801 -7.401 -3.776 1.00 . A A . 23 LYS HE3 1 1 11 5381 1 1 23 LYS HG2 H -5.888 -5.350 -3.249 1.00 . A A . 23 LYS HG2 1 1 11 5382 1 1 23 LYS HG3 H -5.205 -4.324 -4.511 1.00 . A A . 23 LYS HG3 1 1 11 5383 1 1 23 LYS HZ1 H -5.659 -8.205 -6.281 1.00 . A A . 23 LYS HZ1 1 1 11 5384 1 1 23 LYS HZ2 H -4.976 -6.670 -6.474 1.00 . A A . 23 LYS HZ2 1 1 11 5385 1 1 23 LYS HZ3 H -6.529 -6.828 -5.822 1.00 . A A . 23 LYS HZ3 1 1 11 5386 1 1 23 LYS N N -3.313 -1.880 -2.621 1.00 . A A . 23 LYS N 1 1 11 5387 1 1 23 LYS NZ N -5.582 -7.255 -5.864 1.00 . A A . 23 LYS NZ 1 1 11 5388 1 1 23 LYS O O -6.513 -2.857 -1.306 1.00 . A A . 23 LYS O 1 1 11 5389 1 1 24 CYS C C -7.222 -0.432 0.003 1.00 . A A . 24 CYS C 1 1 11 5390 1 1 24 CYS CA C -5.772 -0.740 0.368 1.00 . A A . 24 CYS CA 1 1 11 5391 1 1 24 CYS CB C -5.075 0.507 0.921 1.00 . A A . 24 CYS CB 1 1 11 5392 1 1 24 CYS H H -4.175 -0.819 -0.999 1.00 . A A . 24 CYS H 1 1 11 5393 1 1 24 CYS HA H -5.765 -1.505 1.128 1.00 . A A . 24 CYS HA 1 1 11 5394 1 1 24 CYS HB2 H -5.476 0.735 1.892 1.00 . A A . 24 CYS HB2 1 1 11 5395 1 1 24 CYS HB3 H -4.019 0.302 1.017 1.00 . A A . 24 CYS HB3 1 1 11 5396 1 1 24 CYS N N -5.027 -1.245 -0.773 1.00 . A A . 24 CYS N 1 1 11 5397 1 1 24 CYS O O -7.496 0.357 -0.900 1.00 . A A . 24 CYS O 1 1 11 5398 1 1 24 CYS SG S -5.251 1.995 -0.120 1.00 . A A . 24 CYS SG 1 1 11 5399 1 1 25 MET C C -10.198 -0.150 1.680 1.00 . A A . 25 MET C 1 1 11 5400 1 1 25 MET CA C -9.569 -0.861 0.492 1.00 . A A . 25 MET CA 1 1 11 5401 1 1 25 MET CB C -10.266 -2.200 0.253 1.00 . A A . 25 MET CB 1 1 11 5402 1 1 25 MET CE C -11.279 -3.410 -3.212 1.00 . A A . 25 MET CE 1 1 11 5403 1 1 25 MET CG C -11.398 -2.126 -0.759 1.00 . A A . 25 MET CG 1 1 11 5404 1 1 25 MET H H -7.858 -1.676 1.430 1.00 . A A . 25 MET H 1 1 11 5405 1 1 25 MET HA H -9.686 -0.239 -0.383 1.00 . A A . 25 MET HA 1 1 11 5406 1 1 25 MET HB2 H -9.537 -2.913 -0.107 1.00 . A A . 25 MET HB2 1 1 11 5407 1 1 25 MET HB3 H -10.671 -2.555 1.188 1.00 . A A . 25 MET HB3 1 1 11 5408 1 1 25 MET HE1 H -10.210 -3.525 -3.310 1.00 . A A . 25 MET HE1 1 1 11 5409 1 1 25 MET HE2 H -11.559 -2.404 -3.487 1.00 . A A . 25 MET HE2 1 1 11 5410 1 1 25 MET HE3 H -11.779 -4.113 -3.863 1.00 . A A . 25 MET HE3 1 1 11 5411 1 1 25 MET HG2 H -12.285 -1.770 -0.259 1.00 . A A . 25 MET HG2 1 1 11 5412 1 1 25 MET HG3 H -11.121 -1.429 -1.537 1.00 . A A . 25 MET HG3 1 1 11 5413 1 1 25 MET N N -8.144 -1.062 0.721 1.00 . A A . 25 MET N 1 1 11 5414 1 1 25 MET O O -9.789 -0.349 2.824 1.00 . A A . 25 MET O 1 1 11 5415 1 1 25 MET SD S -11.761 -3.722 -1.516 1.00 . A A . 25 MET SD 1 1 11 5416 1 1 26 ASN C C -12.223 0.530 3.629 1.00 . A A . 26 ASN C 1 1 11 5417 1 1 26 ASN CA C -11.875 1.437 2.454 1.00 . A A . 26 ASN CA 1 1 11 5418 1 1 26 ASN CB C -13.152 2.102 1.932 1.00 . A A . 26 ASN CB 1 1 11 5419 1 1 26 ASN CG C -13.067 2.501 0.470 1.00 . A A . 26 ASN CG 1 1 11 5420 1 1 26 ASN H H -11.462 0.802 0.467 1.00 . A A . 26 ASN H 1 1 11 5421 1 1 26 ASN HA H -11.200 2.204 2.800 1.00 . A A . 26 ASN HA 1 1 11 5422 1 1 26 ASN HB2 H -13.973 1.415 2.053 1.00 . A A . 26 ASN HB2 1 1 11 5423 1 1 26 ASN HB3 H -13.348 2.989 2.516 1.00 . A A . 26 ASN HB3 1 1 11 5424 1 1 26 ASN HD21 H -13.439 4.396 0.941 1.00 . A A . 26 ASN HD21 1 1 11 5425 1 1 26 ASN HD22 H -13.208 4.072 -0.740 1.00 . A A . 26 ASN HD22 1 1 11 5426 1 1 26 ASN N N -11.191 0.685 1.401 1.00 . A A . 26 ASN N 1 1 11 5427 1 1 26 ASN ND2 N -13.258 3.786 0.196 1.00 . A A . 26 ASN ND2 1 1 11 5428 1 1 26 ASN O O -12.883 -0.496 3.466 1.00 . A A . 26 ASN O 1 1 11 5429 1 1 26 ASN OD1 O -12.833 1.664 -0.401 1.00 . A A . 26 ASN OD1 1 1 11 5430 1 1 27 ARG C C -11.137 -1.097 6.059 1.00 . A A . 27 ARG C 1 1 11 5431 1 1 27 ARG CA C -12.009 0.151 6.028 1.00 . A A . 27 ARG CA 1 1 11 5432 1 1 27 ARG CB C -13.488 -0.234 6.141 1.00 . A A . 27 ARG CB 1 1 11 5433 1 1 27 ARG CD C -14.565 -1.301 8.148 1.00 . A A . 27 ARG CD 1 1 11 5434 1 1 27 ARG CG C -14.069 -0.004 7.527 1.00 . A A . 27 ARG CG 1 1 11 5435 1 1 27 ARG CZ C -16.770 -0.562 8.963 1.00 . A A . 27 ARG CZ 1 1 11 5436 1 1 27 ARG H H -11.243 1.741 4.866 1.00 . A A . 27 ARG H 1 1 11 5437 1 1 27 ARG HA H -11.746 0.776 6.868 1.00 . A A . 27 ARG HA 1 1 11 5438 1 1 27 ARG HB2 H -14.055 0.353 5.434 1.00 . A A . 27 ARG HB2 1 1 11 5439 1 1 27 ARG HB3 H -13.596 -1.281 5.895 1.00 . A A . 27 ARG HB3 1 1 11 5440 1 1 27 ARG HD2 H -15.011 -1.908 7.375 1.00 . A A . 27 ARG HD2 1 1 11 5441 1 1 27 ARG HD3 H -13.723 -1.824 8.577 1.00 . A A . 27 ARG HD3 1 1 11 5442 1 1 27 ARG HE H -15.308 -1.286 10.114 1.00 . A A . 27 ARG HE 1 1 11 5443 1 1 27 ARG HG2 H -13.304 0.417 8.162 1.00 . A A . 27 ARG HG2 1 1 11 5444 1 1 27 ARG HG3 H -14.895 0.687 7.448 1.00 . A A . 27 ARG HG3 1 1 11 5445 1 1 27 ARG HH11 H -16.514 -0.384 6.965 1.00 . A A . 27 ARG HH11 1 1 11 5446 1 1 27 ARG HH12 H -18.055 0.128 7.564 1.00 . A A . 27 ARG HH12 1 1 11 5447 1 1 27 ARG HH21 H -17.336 -0.612 10.904 1.00 . A A . 27 ARG HH21 1 1 11 5448 1 1 27 ARG HH22 H -18.522 -0.001 9.800 1.00 . A A . 27 ARG HH22 1 1 11 5449 1 1 27 ARG N N -11.765 0.918 4.811 1.00 . A A . 27 ARG N 1 1 11 5450 1 1 27 ARG NE N -15.558 -1.062 9.193 1.00 . A A . 27 ARG NE 1 1 11 5451 1 1 27 ARG NH1 N -17.143 -0.247 7.729 1.00 . A A . 27 ARG NH1 1 1 11 5452 1 1 27 ARG NH2 N -17.612 -0.376 9.972 1.00 . A A . 27 ARG NH2 1 1 11 5453 1 1 27 ARG O O -11.503 -2.112 6.651 1.00 . A A . 27 ARG O 1 1 11 5454 1 1 28 LYS C C -7.914 -1.860 4.363 1.00 . A A . 28 LYS C 1 1 11 5455 1 1 28 LYS CA C -9.035 -2.128 5.364 1.00 . A A . 28 LYS CA 1 1 11 5456 1 1 28 LYS CB C -9.762 -3.425 4.993 1.00 . A A . 28 LYS CB 1 1 11 5457 1 1 28 LYS CD C -8.883 -5.380 6.305 1.00 . A A . 28 LYS CD 1 1 11 5458 1 1 28 LYS CE C -9.425 -6.735 6.730 1.00 . A A . 28 LYS CE 1 1 11 5459 1 1 28 LYS CG C -9.994 -4.351 6.177 1.00 . A A . 28 LYS CG 1 1 11 5460 1 1 28 LYS H H -9.746 -0.166 4.968 1.00 . A A . 28 LYS H 1 1 11 5461 1 1 28 LYS HA H -8.601 -2.238 6.346 1.00 . A A . 28 LYS HA 1 1 11 5462 1 1 28 LYS HB2 H -10.722 -3.177 4.565 1.00 . A A . 28 LYS HB2 1 1 11 5463 1 1 28 LYS HB3 H -9.177 -3.957 4.258 1.00 . A A . 28 LYS HB3 1 1 11 5464 1 1 28 LYS HD2 H -8.391 -5.484 5.350 1.00 . A A . 28 LYS HD2 1 1 11 5465 1 1 28 LYS HD3 H -8.172 -5.038 7.043 1.00 . A A . 28 LYS HD3 1 1 11 5466 1 1 28 LYS HE2 H -9.562 -6.733 7.801 1.00 . A A . 28 LYS HE2 1 1 11 5467 1 1 28 LYS HE3 H -10.377 -6.895 6.247 1.00 . A A . 28 LYS HE3 1 1 11 5468 1 1 28 LYS HG2 H -10.030 -3.761 7.081 1.00 . A A . 28 LYS HG2 1 1 11 5469 1 1 28 LYS HG3 H -10.934 -4.864 6.041 1.00 . A A . 28 LYS HG3 1 1 11 5470 1 1 28 LYS HZ1 H -8.921 -8.759 6.622 1.00 . A A . 28 LYS HZ1 1 1 11 5471 1 1 28 LYS HZ2 H -7.596 -7.736 6.863 1.00 . A A . 28 LYS HZ2 1 1 11 5472 1 1 28 LYS HZ3 H -8.321 -7.834 5.337 1.00 . A A . 28 LYS HZ3 1 1 11 5473 1 1 28 LYS N N -9.976 -1.008 5.415 1.00 . A A . 28 LYS N 1 1 11 5474 1 1 28 LYS NZ N -8.501 -7.844 6.363 1.00 . A A . 28 LYS NZ 1 1 11 5475 1 1 28 LYS O O -8.067 -2.099 3.165 1.00 . A A . 28 LYS O 1 1 11 5476 1 1 29 CYS C C -4.941 -2.345 3.573 1.00 . A A . 29 CYS C 1 1 11 5477 1 1 29 CYS CA C -5.638 -1.069 4.021 1.00 . A A . 29 CYS CA 1 1 11 5478 1 1 29 CYS CB C -4.651 -0.186 4.766 1.00 . A A . 29 CYS CB 1 1 11 5479 1 1 29 CYS H H -6.726 -1.198 5.823 1.00 . A A . 29 CYS H 1 1 11 5480 1 1 29 CYS HA H -5.988 -0.541 3.167 1.00 . A A . 29 CYS HA 1 1 11 5481 1 1 29 CYS HB2 H -5.198 0.496 5.387 1.00 . A A . 29 CYS HB2 1 1 11 5482 1 1 29 CYS HB3 H -4.037 -0.812 5.380 1.00 . A A . 29 CYS HB3 1 1 11 5483 1 1 29 CYS N N -6.787 -1.367 4.864 1.00 . A A . 29 CYS N 1 1 11 5484 1 1 29 CYS O O -5.140 -3.411 4.153 1.00 . A A . 29 CYS O 1 1 11 5485 1 1 29 CYS SG S -3.550 0.801 3.702 1.00 . A A . 29 CYS SG 1 1 11 5486 1 1 30 LYS C C -2.676 -3.013 0.706 1.00 . A A . 30 LYS C 1 1 11 5487 1 1 30 LYS CA C -3.365 -3.364 2.019 1.00 . A A . 30 LYS CA 1 1 11 5488 1 1 30 LYS CB C -4.276 -4.584 1.825 1.00 . A A . 30 LYS CB 1 1 11 5489 1 1 30 LYS CD C -6.613 -5.378 1.364 1.00 . A A . 30 LYS CD 1 1 11 5490 1 1 30 LYS CE C -6.421 -6.503 0.362 1.00 . A A . 30 LYS CE 1 1 11 5491 1 1 30 LYS CG C -5.599 -4.265 1.153 1.00 . A A . 30 LYS CG 1 1 11 5492 1 1 30 LYS H H -3.984 -1.344 2.129 1.00 . A A . 30 LYS H 1 1 11 5493 1 1 30 LYS HA H -2.604 -3.613 2.744 1.00 . A A . 30 LYS HA 1 1 11 5494 1 1 30 LYS HB2 H -3.758 -5.310 1.218 1.00 . A A . 30 LYS HB2 1 1 11 5495 1 1 30 LYS HB3 H -4.483 -5.019 2.791 1.00 . A A . 30 LYS HB3 1 1 11 5496 1 1 30 LYS HD2 H -6.495 -5.774 2.361 1.00 . A A . 30 LYS HD2 1 1 11 5497 1 1 30 LYS HD3 H -7.608 -4.972 1.251 1.00 . A A . 30 LYS HD3 1 1 11 5498 1 1 30 LYS HE2 H -7.375 -6.979 0.186 1.00 . A A . 30 LYS HE2 1 1 11 5499 1 1 30 LYS HE3 H -6.053 -6.086 -0.564 1.00 . A A . 30 LYS HE3 1 1 11 5500 1 1 30 LYS HG2 H -5.994 -3.351 1.568 1.00 . A A . 30 LYS HG2 1 1 11 5501 1 1 30 LYS HG3 H -5.432 -4.140 0.094 1.00 . A A . 30 LYS HG3 1 1 11 5502 1 1 30 LYS HZ1 H -4.493 -7.290 0.529 1.00 . A A . 30 LYS HZ1 1 1 11 5503 1 1 30 LYS HZ2 H -5.710 -8.464 0.484 1.00 . A A . 30 LYS HZ2 1 1 11 5504 1 1 30 LYS HZ3 H -5.463 -7.557 1.890 1.00 . A A . 30 LYS HZ3 1 1 11 5505 1 1 30 LYS N N -4.109 -2.225 2.542 1.00 . A A . 30 LYS N 1 1 11 5506 1 1 30 LYS NZ N -5.454 -7.525 0.850 1.00 . A A . 30 LYS NZ 1 1 11 5507 1 1 30 LYS O O -3.220 -3.234 -0.370 1.00 . A A . 30 LYS O 1 1 11 5508 1 1 31 CYS C C -0.744 -3.079 -1.472 1.00 . A A . 31 CYS C 1 1 11 5509 1 1 31 CYS CA C -0.642 -2.084 -0.330 1.00 . A A . 31 CYS CA 1 1 11 5510 1 1 31 CYS CB C 0.824 -1.942 0.102 1.00 . A A . 31 CYS CB 1 1 11 5511 1 1 31 CYS H H -1.115 -2.336 1.725 1.00 . A A . 31 CYS H 1 1 11 5512 1 1 31 CYS HA H -0.979 -1.133 -0.706 1.00 . A A . 31 CYS HA 1 1 11 5513 1 1 31 CYS HB2 H 1.259 -2.926 0.196 1.00 . A A . 31 CYS HB2 1 1 11 5514 1 1 31 CYS HB3 H 1.361 -1.388 -0.654 1.00 . A A . 31 CYS HB3 1 1 11 5515 1 1 31 CYS N N -1.469 -2.474 0.824 1.00 . A A . 31 CYS N 1 1 11 5516 1 1 31 CYS O O -1.353 -4.134 -1.362 1.00 . A A . 31 CYS O 1 1 11 5517 1 1 31 CYS SG S 1.055 -1.080 1.695 1.00 . A A . 31 CYS SG 1 1 11 5518 1 1 32 ASN C C 1.191 -3.974 -4.140 1.00 . A A . 32 ASN C 1 1 11 5519 1 1 32 ASN CA C -0.197 -3.470 -3.800 1.00 . A A . 32 ASN CA 1 1 11 5520 1 1 32 ASN CB C -0.685 -2.583 -4.911 1.00 . A A . 32 ASN CB 1 1 11 5521 1 1 32 ASN CG C -1.427 -3.335 -5.999 1.00 . A A . 32 ASN CG 1 1 11 5522 1 1 32 ASN H H 0.221 -1.797 -2.617 1.00 . A A . 32 ASN H 1 1 11 5523 1 1 32 ASN HA H -0.867 -4.299 -3.685 1.00 . A A . 32 ASN HA 1 1 11 5524 1 1 32 ASN HB2 H -1.335 -1.851 -4.486 1.00 . A A . 32 ASN HB2 1 1 11 5525 1 1 32 ASN HB3 H 0.162 -2.089 -5.339 1.00 . A A . 32 ASN HB3 1 1 11 5526 1 1 32 ASN HD21 H -3.056 -2.240 -5.679 1.00 . A A . 32 ASN HD21 1 1 11 5527 1 1 32 ASN HD22 H -3.187 -3.435 -6.919 1.00 . A A . 32 ASN HD22 1 1 11 5528 1 1 32 ASN N N -0.184 -2.683 -2.590 1.00 . A A . 32 ASN N 1 1 11 5529 1 1 32 ASN ND2 N -2.684 -2.967 -6.221 1.00 . A A . 32 ASN ND2 1 1 11 5530 1 1 32 ASN O O 2.160 -3.691 -3.436 1.00 . A A . 32 ASN O 1 1 11 5531 1 1 32 ASN OD1 O -0.878 -4.238 -6.632 1.00 . A A . 32 ASN OD1 1 1 11 5532 1 1 33 ARG C C 3.327 -4.083 -6.375 1.00 . A A . 33 ARG C 1 1 11 5533 1 1 33 ARG CA C 2.560 -5.205 -5.707 1.00 . A A . 33 ARG CA 1 1 11 5534 1 1 33 ARG CB C 2.375 -6.386 -6.661 1.00 . A A . 33 ARG CB 1 1 11 5535 1 1 33 ARG CD C 3.812 -8.074 -5.479 1.00 . A A . 33 ARG CD 1 1 11 5536 1 1 33 ARG CG C 3.596 -7.285 -6.760 1.00 . A A . 33 ARG CG 1 1 11 5537 1 1 33 ARG CZ C 5.796 -9.466 -5.927 1.00 . A A . 33 ARG CZ 1 1 11 5538 1 1 33 ARG H H 0.469 -4.856 -5.770 1.00 . A A . 33 ARG H 1 1 11 5539 1 1 33 ARG HA H 3.120 -5.516 -4.838 1.00 . A A . 33 ARG HA 1 1 11 5540 1 1 33 ARG HB2 H 1.542 -6.983 -6.320 1.00 . A A . 33 ARG HB2 1 1 11 5541 1 1 33 ARG HB3 H 2.154 -6.005 -7.647 1.00 . A A . 33 ARG HB3 1 1 11 5542 1 1 33 ARG HD2 H 3.500 -7.469 -4.641 1.00 . A A . 33 ARG HD2 1 1 11 5543 1 1 33 ARG HD3 H 3.210 -8.971 -5.519 1.00 . A A . 33 ARG HD3 1 1 11 5544 1 1 33 ARG HE H 5.745 -7.916 -4.670 1.00 . A A . 33 ARG HE 1 1 11 5545 1 1 33 ARG HG2 H 3.458 -7.976 -7.578 1.00 . A A . 33 ARG HG2 1 1 11 5546 1 1 33 ARG HG3 H 4.468 -6.674 -6.947 1.00 . A A . 33 ARG HG3 1 1 11 5547 1 1 33 ARG HH11 H 4.141 -10.010 -6.955 1.00 . A A . 33 ARG HH11 1 1 11 5548 1 1 33 ARG HH12 H 5.550 -10.972 -7.253 1.00 . A A . 33 ARG HH12 1 1 11 5549 1 1 33 ARG HH21 H 7.599 -9.181 -5.060 1.00 . A A . 33 ARG HH21 1 1 11 5550 1 1 33 ARG HH22 H 7.513 -10.502 -6.177 1.00 . A A . 33 ARG HH22 1 1 11 5551 1 1 33 ARG N N 1.280 -4.692 -5.245 1.00 . A A . 33 ARG N 1 1 11 5552 1 1 33 ARG NE N 5.212 -8.450 -5.296 1.00 . A A . 33 ARG NE 1 1 11 5553 1 1 33 ARG NH1 N 5.105 -10.210 -6.781 1.00 . A A . 33 ARG NH1 1 1 11 5554 1 1 33 ARG NH2 N 7.074 -9.739 -5.703 1.00 . A A . 33 ARG NH2 1 1 11 5555 1 1 33 ARG O O 3.492 -4.042 -7.595 1.00 . A A . 33 ARG O 1 1 11 5556 1 1 34 CYS C C 5.978 -2.109 -5.641 1.00 . A A . 34 CYS C 1 1 11 5557 1 1 34 CYS CA C 4.493 -1.988 -5.970 1.00 . A A . 34 CYS CA 1 1 11 5558 1 1 34 CYS CB C 3.880 -0.764 -5.299 1.00 . A A . 34 CYS CB 1 1 11 5559 1 1 34 CYS H H 3.562 -3.278 -4.586 1.00 . A A . 34 CYS H 1 1 11 5560 1 1 34 CYS HA H 4.374 -1.893 -7.029 1.00 . A A . 34 CYS HA 1 1 11 5561 1 1 34 CYS HB2 H 2.934 -0.553 -5.766 1.00 . A A . 34 CYS HB2 1 1 11 5562 1 1 34 CYS HB3 H 3.710 -0.998 -4.268 1.00 . A A . 34 CYS HB3 1 1 11 5563 1 1 34 CYS N N 3.761 -3.164 -5.537 1.00 . A A . 34 CYS N 1 1 11 5564 1 1 34 CYS O O 6.331 -2.971 -4.808 1.00 . A A . 34 CYS O 1 1 11 5565 1 1 34 CYS OXT O 6.777 -1.342 -6.218 1.00 . A A . 34 CYS OXT 1 1 11 5566 1 1 34 CYS SG S 4.884 0.756 -5.369 1.00 . A A . 34 CYS SG 1 1 12 5567 1 1 1 VAL C C -3.595 7.564 -7.094 1.00 . A A . 1 VAL C 1 1 12 5568 1 1 1 VAL CA C -3.455 8.858 -7.888 1.00 . A A . 1 VAL CA 1 1 12 5569 1 1 1 VAL CB C -2.835 8.536 -9.261 1.00 . A A . 1 VAL CB 1 1 12 5570 1 1 1 VAL CG1 C -2.872 9.759 -10.164 1.00 . A A . 1 VAL CG1 1 1 12 5571 1 1 1 VAL CG2 C -1.411 8.027 -9.096 1.00 . A A . 1 VAL CG2 1 1 12 5572 1 1 1 VAL H1 H -1.889 9.340 -6.645 1.00 . A A . 1 VAL H1 1 1 12 5573 1 1 1 VAL H2 H -3.270 10.347 -6.482 1.00 . A A . 1 VAL H2 1 1 12 5574 1 1 1 VAL H3 H -2.238 10.515 -7.843 1.00 . A A . 1 VAL H3 1 1 12 5575 1 1 1 VAL HA H -4.440 9.275 -8.049 1.00 . A A . 1 VAL HA 1 1 12 5576 1 1 1 VAL HB H -3.422 7.756 -9.724 1.00 . A A . 1 VAL HB 1 1 12 5577 1 1 1 VAL HG11 H -3.741 10.354 -9.928 1.00 . A A . 1 VAL HG11 1 1 12 5578 1 1 1 VAL HG12 H -2.920 9.443 -11.195 1.00 . A A . 1 VAL HG12 1 1 12 5579 1 1 1 VAL HG13 H -1.980 10.348 -10.009 1.00 . A A . 1 VAL HG13 1 1 12 5580 1 1 1 VAL HG21 H -0.884 8.653 -8.392 1.00 . A A . 1 VAL HG21 1 1 12 5581 1 1 1 VAL HG22 H -0.906 8.056 -10.051 1.00 . A A . 1 VAL HG22 1 1 12 5582 1 1 1 VAL HG23 H -1.431 7.011 -8.731 1.00 . A A . 1 VAL HG23 1 1 12 5583 1 1 1 VAL N N -2.639 9.854 -7.148 1.00 . A A . 1 VAL N 1 1 12 5584 1 1 1 VAL O O -2.644 7.109 -6.457 1.00 . A A . 1 VAL O 1 1 12 5585 1 1 2 SER C C -4.902 5.925 -4.917 1.00 . A A . 2 SER C 1 1 12 5586 1 1 2 SER CA C -5.053 5.732 -6.421 1.00 . A A . 2 SER CA 1 1 12 5587 1 1 2 SER CB C -4.110 4.627 -6.904 1.00 . A A . 2 SER CB 1 1 12 5588 1 1 2 SER H H -5.503 7.387 -7.662 1.00 . A A . 2 SER H 1 1 12 5589 1 1 2 SER HA H -6.071 5.441 -6.635 1.00 . A A . 2 SER HA 1 1 12 5590 1 1 2 SER HB2 H -3.087 4.937 -6.751 1.00 . A A . 2 SER HB2 1 1 12 5591 1 1 2 SER HB3 H -4.301 3.724 -6.341 1.00 . A A . 2 SER HB3 1 1 12 5592 1 1 2 SER HG H -4.749 3.511 -8.382 1.00 . A A . 2 SER HG 1 1 12 5593 1 1 2 SER N N -4.786 6.975 -7.137 1.00 . A A . 2 SER N 1 1 12 5594 1 1 2 SER O O -3.841 6.318 -4.433 1.00 . A A . 2 SER O 1 1 12 5595 1 1 2 SER OG O -4.304 4.355 -8.281 1.00 . A A . 2 SER OG 1 1 12 5596 1 1 3 CYS C C -5.642 7.212 -2.315 1.00 . A A . 3 CYS C 1 1 12 5597 1 1 3 CYS CA C -5.963 5.787 -2.729 1.00 . A A . 3 CYS CA 1 1 12 5598 1 1 3 CYS CB C -4.942 4.843 -2.098 1.00 . A A . 3 CYS CB 1 1 12 5599 1 1 3 CYS H H -6.790 5.335 -4.624 1.00 . A A . 3 CYS H 1 1 12 5600 1 1 3 CYS HA H -6.944 5.536 -2.359 1.00 . A A . 3 CYS HA 1 1 12 5601 1 1 3 CYS HB2 H -3.974 5.043 -2.523 1.00 . A A . 3 CYS HB2 1 1 12 5602 1 1 3 CYS HB3 H -4.903 5.029 -1.033 1.00 . A A . 3 CYS HB3 1 1 12 5603 1 1 3 CYS N N -5.972 5.645 -4.180 1.00 . A A . 3 CYS N 1 1 12 5604 1 1 3 CYS O O -5.421 8.088 -3.152 1.00 . A A . 3 CYS O 1 1 12 5605 1 1 3 CYS SG S -5.306 3.076 -2.340 1.00 . A A . 3 CYS SG 1 1 12 5606 1 1 4 THR C C -5.021 8.598 1.053 1.00 . A A . 4 THR C 1 1 12 5607 1 1 4 THR CA C -5.312 8.725 -0.439 1.00 . A A . 4 THR CA 1 1 12 5608 1 1 4 THR CB C -6.478 9.691 -0.665 1.00 . A A . 4 THR CB 1 1 12 5609 1 1 4 THR CG2 C -6.112 11.137 -0.409 1.00 . A A . 4 THR CG2 1 1 12 5610 1 1 4 THR H H -5.792 6.667 -0.412 1.00 . A A . 4 THR H 1 1 12 5611 1 1 4 THR HA H -4.433 9.111 -0.934 1.00 . A A . 4 THR HA 1 1 12 5612 1 1 4 THR HB H -7.284 9.429 0.006 1.00 . A A . 4 THR HB 1 1 12 5613 1 1 4 THR HG1 H -6.215 9.600 -2.604 1.00 . A A . 4 THR HG1 1 1 12 5614 1 1 4 THR HG21 H -6.352 11.392 0.613 1.00 . A A . 4 THR HG21 1 1 12 5615 1 1 4 THR HG22 H -6.671 11.773 -1.080 1.00 . A A . 4 THR HG22 1 1 12 5616 1 1 4 THR HG23 H -5.055 11.276 -0.577 1.00 . A A . 4 THR HG23 1 1 12 5617 1 1 4 THR N N -5.611 7.420 -1.010 1.00 . A A . 4 THR N 1 1 12 5618 1 1 4 THR O O -5.770 9.109 1.886 1.00 . A A . 4 THR O 1 1 12 5619 1 1 4 THR OG1 O -6.957 9.599 -1.995 1.00 . A A . 4 THR OG1 1 1 12 5620 1 1 5 GLY C C -3.870 8.887 3.660 1.00 . A A . 5 GLY C 1 1 12 5621 1 1 5 GLY CA C -3.540 7.702 2.770 1.00 . A A . 5 GLY CA 1 1 12 5622 1 1 5 GLY H H -3.381 7.516 0.662 1.00 . A A . 5 GLY H 1 1 12 5623 1 1 5 GLY HA2 H -4.053 6.831 3.150 1.00 . A A . 5 GLY HA2 1 1 12 5624 1 1 5 GLY HA3 H -2.476 7.522 2.809 1.00 . A A . 5 GLY HA3 1 1 12 5625 1 1 5 GLY N N -3.928 7.903 1.378 1.00 . A A . 5 GLY N 1 1 12 5626 1 1 5 GLY O O -3.222 9.932 3.582 1.00 . A A . 5 GLY O 1 1 12 5627 1 1 6 SER C C -4.895 9.498 6.820 1.00 . A A . 6 SER C 1 1 12 5628 1 1 6 SER CA C -5.314 9.785 5.403 1.00 . A A . 6 SER CA 1 1 12 5629 1 1 6 SER CB C -6.830 9.945 5.339 1.00 . A A . 6 SER CB 1 1 12 5630 1 1 6 SER H H -5.365 7.869 4.508 1.00 . A A . 6 SER H 1 1 12 5631 1 1 6 SER HA H -4.854 10.670 5.099 1.00 . A A . 6 SER HA 1 1 12 5632 1 1 6 SER HB2 H -7.248 9.118 4.783 1.00 . A A . 6 SER HB2 1 1 12 5633 1 1 6 SER HB3 H -7.232 9.939 6.342 1.00 . A A . 6 SER HB3 1 1 12 5634 1 1 6 SER HG H -6.771 11.207 3.843 1.00 . A A . 6 SER HG 1 1 12 5635 1 1 6 SER N N -4.886 8.723 4.500 1.00 . A A . 6 SER N 1 1 12 5636 1 1 6 SER O O -4.398 10.357 7.548 1.00 . A A . 6 SER O 1 1 12 5637 1 1 6 SER OG O -7.195 11.157 4.703 1.00 . A A . 6 SER OG 1 1 12 5638 1 1 7 LYS C C -3.297 7.663 8.687 1.00 . A A . 7 LYS C 1 1 12 5639 1 1 7 LYS CA C -4.803 7.768 8.499 1.00 . A A . 7 LYS CA 1 1 12 5640 1 1 7 LYS CB C -5.454 6.400 8.714 1.00 . A A . 7 LYS CB 1 1 12 5641 1 1 7 LYS CD C -7.906 6.589 8.200 1.00 . A A . 7 LYS CD 1 1 12 5642 1 1 7 LYS CE C -8.418 5.221 7.780 1.00 . A A . 7 LYS CE 1 1 12 5643 1 1 7 LYS CG C -6.856 6.478 9.294 1.00 . A A . 7 LYS CG 1 1 12 5644 1 1 7 LYS H H -5.517 7.699 6.506 1.00 . A A . 7 LYS H 1 1 12 5645 1 1 7 LYS HA H -5.198 8.463 9.225 1.00 . A A . 7 LYS HA 1 1 12 5646 1 1 7 LYS HB2 H -5.507 5.887 7.764 1.00 . A A . 7 LYS HB2 1 1 12 5647 1 1 7 LYS HB3 H -4.839 5.824 9.390 1.00 . A A . 7 LYS HB3 1 1 12 5648 1 1 7 LYS HD2 H -8.735 7.175 8.568 1.00 . A A . 7 LYS HD2 1 1 12 5649 1 1 7 LYS HD3 H -7.467 7.078 7.343 1.00 . A A . 7 LYS HD3 1 1 12 5650 1 1 7 LYS HE2 H -7.879 4.903 6.901 1.00 . A A . 7 LYS HE2 1 1 12 5651 1 1 7 LYS HE3 H -8.241 4.522 8.583 1.00 . A A . 7 LYS HE3 1 1 12 5652 1 1 7 LYS HG2 H -7.047 5.587 9.872 1.00 . A A . 7 LYS HG2 1 1 12 5653 1 1 7 LYS HG3 H -6.923 7.345 9.934 1.00 . A A . 7 LYS HG3 1 1 12 5654 1 1 7 LYS HZ1 H -10.083 4.606 6.677 1.00 . A A . 7 LYS HZ1 1 1 12 5655 1 1 7 LYS HZ2 H -10.171 6.207 7.213 1.00 . A A . 7 LYS HZ2 1 1 12 5656 1 1 7 LYS HZ3 H -10.422 4.938 8.301 1.00 . A A . 7 LYS HZ3 1 1 12 5657 1 1 7 LYS N N -5.120 8.278 7.173 1.00 . A A . 7 LYS N 1 1 12 5658 1 1 7 LYS NZ N -9.876 5.245 7.471 1.00 . A A . 7 LYS NZ 1 1 12 5659 1 1 7 LYS O O -2.714 8.372 9.508 1.00 . A A . 7 LYS O 1 1 12 5660 1 1 8 ASP C C -0.829 5.238 7.341 1.00 . A A . 8 ASP C 1 1 12 5661 1 1 8 ASP CA C -1.226 6.568 7.980 1.00 . A A . 8 ASP CA 1 1 12 5662 1 1 8 ASP CB C -0.735 6.613 9.435 1.00 . A A . 8 ASP CB 1 1 12 5663 1 1 8 ASP CG C -0.028 7.912 9.765 1.00 . A A . 8 ASP CG 1 1 12 5664 1 1 8 ASP H H -3.206 6.252 7.276 1.00 . A A . 8 ASP H 1 1 12 5665 1 1 8 ASP HA H -0.754 7.369 7.429 1.00 . A A . 8 ASP HA 1 1 12 5666 1 1 8 ASP HB2 H -1.582 6.508 10.096 1.00 . A A . 8 ASP HB2 1 1 12 5667 1 1 8 ASP HB3 H -0.049 5.797 9.605 1.00 . A A . 8 ASP HB3 1 1 12 5668 1 1 8 ASP N N -2.675 6.775 7.914 1.00 . A A . 8 ASP N 1 1 12 5669 1 1 8 ASP O O -0.004 4.501 7.883 1.00 . A A . 8 ASP O 1 1 12 5670 1 1 8 ASP OD1 O 1.002 8.208 9.122 1.00 . A A . 8 ASP OD1 1 1 12 5671 1 1 8 ASP OD2 O -0.502 8.634 10.666 1.00 . A A . 8 ASP OD2 1 1 12 5672 1 1 9 CYS C C -0.250 3.941 4.267 1.00 . A A . 9 CYS C 1 1 12 5673 1 1 9 CYS CA C -1.105 3.687 5.491 1.00 . A A . 9 CYS CA 1 1 12 5674 1 1 9 CYS CB C -2.377 2.968 5.081 1.00 . A A . 9 CYS CB 1 1 12 5675 1 1 9 CYS H H -2.063 5.552 5.797 1.00 . A A . 9 CYS H 1 1 12 5676 1 1 9 CYS HA H -0.562 3.064 6.162 1.00 . A A . 9 CYS HA 1 1 12 5677 1 1 9 CYS HB2 H -3.144 3.183 5.799 1.00 . A A . 9 CYS HB2 1 1 12 5678 1 1 9 CYS HB3 H -2.679 3.330 4.119 1.00 . A A . 9 CYS HB3 1 1 12 5679 1 1 9 CYS N N -1.414 4.931 6.188 1.00 . A A . 9 CYS N 1 1 12 5680 1 1 9 CYS O O 0.928 3.585 4.231 1.00 . A A . 9 CYS O 1 1 12 5681 1 1 9 CYS SG S -2.206 1.155 4.964 1.00 . A A . 9 CYS SG 1 1 12 5682 1 1 10 TYR C C 1.194 5.517 2.300 1.00 . A A . 10 TYR C 1 1 12 5683 1 1 10 TYR CA C -0.155 4.862 2.025 1.00 . A A . 10 TYR CA 1 1 12 5684 1 1 10 TYR CB C -1.012 5.777 1.148 1.00 . A A . 10 TYR CB 1 1 12 5685 1 1 10 TYR CD1 C -1.572 3.891 -0.432 1.00 . A A . 10 TYR CD1 1 1 12 5686 1 1 10 TYR CD2 C -1.173 6.051 -1.356 1.00 . A A . 10 TYR CD2 1 1 12 5687 1 1 10 TYR CE1 C -1.797 3.386 -1.698 1.00 . A A . 10 TYR CE1 1 1 12 5688 1 1 10 TYR CE2 C -1.398 5.554 -2.626 1.00 . A A . 10 TYR CE2 1 1 12 5689 1 1 10 TYR CG C -1.258 5.229 -0.240 1.00 . A A . 10 TYR CG 1 1 12 5690 1 1 10 TYR CZ C -1.708 4.220 -2.790 1.00 . A A . 10 TYR CZ 1 1 12 5691 1 1 10 TYR H H -1.793 4.814 3.362 1.00 . A A . 10 TYR H 1 1 12 5692 1 1 10 TYR HA H 0.011 3.932 1.502 1.00 . A A . 10 TYR HA 1 1 12 5693 1 1 10 TYR HB2 H -1.973 5.921 1.620 1.00 . A A . 10 TYR HB2 1 1 12 5694 1 1 10 TYR HB3 H -0.521 6.734 1.046 1.00 . A A . 10 TYR HB3 1 1 12 5695 1 1 10 TYR HD1 H -1.641 3.239 0.427 1.00 . A A . 10 TYR HD1 1 1 12 5696 1 1 10 TYR HD2 H -0.930 7.095 -1.223 1.00 . A A . 10 TYR HD2 1 1 12 5697 1 1 10 TYR HE1 H -2.040 2.341 -1.827 1.00 . A A . 10 TYR HE1 1 1 12 5698 1 1 10 TYR HE2 H -1.328 6.208 -3.482 1.00 . A A . 10 TYR HE2 1 1 12 5699 1 1 10 TYR HH H -2.655 4.201 -4.463 1.00 . A A . 10 TYR HH 1 1 12 5700 1 1 10 TYR N N -0.853 4.557 3.264 1.00 . A A . 10 TYR N 1 1 12 5701 1 1 10 TYR O O 2.109 5.432 1.487 1.00 . A A . 10 TYR O 1 1 12 5702 1 1 10 TYR OH O -1.933 3.721 -4.052 1.00 . A A . 10 TYR OH 1 1 12 5703 1 1 11 ALA C C 3.658 5.855 4.159 1.00 . A A . 11 ALA C 1 1 12 5704 1 1 11 ALA CA C 2.558 6.850 3.799 1.00 . A A . 11 ALA CA 1 1 12 5705 1 1 11 ALA CB C 2.337 7.862 4.913 1.00 . A A . 11 ALA CB 1 1 12 5706 1 1 11 ALA H H 0.545 6.220 4.062 1.00 . A A . 11 ALA H 1 1 12 5707 1 1 11 ALA HA H 2.883 7.383 2.919 1.00 . A A . 11 ALA HA 1 1 12 5708 1 1 11 ALA HB1 H 1.453 7.594 5.473 1.00 . A A . 11 ALA HB1 1 1 12 5709 1 1 11 ALA HB2 H 2.209 8.845 4.487 1.00 . A A . 11 ALA HB2 1 1 12 5710 1 1 11 ALA HB3 H 3.194 7.865 5.572 1.00 . A A . 11 ALA HB3 1 1 12 5711 1 1 11 ALA N N 1.310 6.181 3.444 1.00 . A A . 11 ALA N 1 1 12 5712 1 1 11 ALA O O 4.569 5.623 3.364 1.00 . A A . 11 ALA O 1 1 12 5713 1 1 12 PRO C C 4.807 3.199 4.702 1.00 . A A . 12 PRO C 1 1 12 5714 1 1 12 PRO CA C 4.596 4.255 5.776 1.00 . A A . 12 PRO CA 1 1 12 5715 1 1 12 PRO CB C 3.998 3.629 7.048 1.00 . A A . 12 PRO CB 1 1 12 5716 1 1 12 PRO CD C 2.548 5.411 6.370 1.00 . A A . 12 PRO CD 1 1 12 5717 1 1 12 PRO CG C 2.581 4.102 7.101 1.00 . A A . 12 PRO CG 1 1 12 5718 1 1 12 PRO HA H 5.539 4.728 6.009 1.00 . A A . 12 PRO HA 1 1 12 5719 1 1 12 PRO HB2 H 4.050 2.553 6.978 1.00 . A A . 12 PRO HB2 1 1 12 5720 1 1 12 PRO HB3 H 4.556 3.964 7.910 1.00 . A A . 12 PRO HB3 1 1 12 5721 1 1 12 PRO HD2 H 1.582 5.565 5.911 1.00 . A A . 12 PRO HD2 1 1 12 5722 1 1 12 PRO HD3 H 2.789 6.226 7.035 1.00 . A A . 12 PRO HD3 1 1 12 5723 1 1 12 PRO HG2 H 1.936 3.384 6.615 1.00 . A A . 12 PRO HG2 1 1 12 5724 1 1 12 PRO HG3 H 2.279 4.239 8.130 1.00 . A A . 12 PRO HG3 1 1 12 5725 1 1 12 PRO N N 3.593 5.235 5.355 1.00 . A A . 12 PRO N 1 1 12 5726 1 1 12 PRO O O 5.862 2.569 4.623 1.00 . A A . 12 PRO O 1 1 12 5727 1 1 13 CYS C C 4.617 2.607 1.613 1.00 . A A . 13 CYS C 1 1 12 5728 1 1 13 CYS CA C 3.825 2.072 2.781 1.00 . A A . 13 CYS CA 1 1 12 5729 1 1 13 CYS CB C 2.417 1.773 2.318 1.00 . A A . 13 CYS CB 1 1 12 5730 1 1 13 CYS H H 2.981 3.569 3.991 1.00 . A A . 13 CYS H 1 1 12 5731 1 1 13 CYS HA H 4.279 1.172 3.131 1.00 . A A . 13 CYS HA 1 1 12 5732 1 1 13 CYS HB2 H 1.752 1.890 3.147 1.00 . A A . 13 CYS HB2 1 1 12 5733 1 1 13 CYS HB3 H 2.154 2.479 1.555 1.00 . A A . 13 CYS HB3 1 1 12 5734 1 1 13 CYS N N 3.787 3.028 3.871 1.00 . A A . 13 CYS N 1 1 12 5735 1 1 13 CYS O O 5.607 2.013 1.199 1.00 . A A . 13 CYS O 1 1 12 5736 1 1 13 CYS SG S 2.179 0.105 1.630 1.00 . A A . 13 CYS SG 1 1 12 5737 1 1 14 ARG C C 6.337 4.432 0.192 1.00 . A A . 14 ARG C 1 1 12 5738 1 1 14 ARG CA C 4.847 4.325 -0.068 1.00 . A A . 14 ARG CA 1 1 12 5739 1 1 14 ARG CB C 4.267 5.685 -0.419 1.00 . A A . 14 ARG CB 1 1 12 5740 1 1 14 ARG CD C 2.154 6.933 -0.968 1.00 . A A . 14 ARG CD 1 1 12 5741 1 1 14 ARG CG C 2.903 5.615 -1.088 1.00 . A A . 14 ARG CG 1 1 12 5742 1 1 14 ARG CZ C 3.032 8.189 -2.897 1.00 . A A . 14 ARG CZ 1 1 12 5743 1 1 14 ARG H H 3.367 4.161 1.441 1.00 . A A . 14 ARG H 1 1 12 5744 1 1 14 ARG HA H 4.703 3.666 -0.898 1.00 . A A . 14 ARG HA 1 1 12 5745 1 1 14 ARG HB2 H 4.180 6.272 0.479 1.00 . A A . 14 ARG HB2 1 1 12 5746 1 1 14 ARG HB3 H 4.947 6.169 -1.097 1.00 . A A . 14 ARG HB3 1 1 12 5747 1 1 14 ARG HD2 H 1.197 6.834 -1.455 1.00 . A A . 14 ARG HD2 1 1 12 5748 1 1 14 ARG HD3 H 2.005 7.152 0.079 1.00 . A A . 14 ARG HD3 1 1 12 5749 1 1 14 ARG HE H 3.293 8.699 -0.986 1.00 . A A . 14 ARG HE 1 1 12 5750 1 1 14 ARG HG2 H 3.038 5.385 -2.134 1.00 . A A . 14 ARG HG2 1 1 12 5751 1 1 14 ARG HG3 H 2.322 4.836 -0.619 1.00 . A A . 14 ARG HG3 1 1 12 5752 1 1 14 ARG HH11 H 1.980 6.532 -3.384 1.00 . A A . 14 ARG HH11 1 1 12 5753 1 1 14 ARG HH12 H 2.608 7.432 -4.724 1.00 . A A . 14 ARG HH12 1 1 12 5754 1 1 14 ARG HH21 H 4.119 9.886 -2.746 1.00 . A A . 14 ARG HH21 1 1 12 5755 1 1 14 ARG HH22 H 3.823 9.337 -4.361 1.00 . A A . 14 ARG HH22 1 1 12 5756 1 1 14 ARG N N 4.170 3.732 1.071 1.00 . A A . 14 ARG N 1 1 12 5757 1 1 14 ARG NE N 2.888 8.037 -1.583 1.00 . A A . 14 ARG NE 1 1 12 5758 1 1 14 ARG NH1 N 2.496 7.312 -3.738 1.00 . A A . 14 ARG NH1 1 1 12 5759 1 1 14 ARG NH2 N 3.713 9.222 -3.374 1.00 . A A . 14 ARG NH2 1 1 12 5760 1 1 14 ARG O O 7.148 4.304 -0.723 1.00 . A A . 14 ARG O 1 1 12 5761 1 1 15 LYS C C 8.739 3.342 1.490 1.00 . A A . 15 LYS C 1 1 12 5762 1 1 15 LYS CA C 8.100 4.684 1.814 1.00 . A A . 15 LYS CA 1 1 12 5763 1 1 15 LYS CB C 8.261 5.012 3.301 1.00 . A A . 15 LYS CB 1 1 12 5764 1 1 15 LYS CD C 10.597 5.724 3.894 1.00 . A A . 15 LYS CD 1 1 12 5765 1 1 15 LYS CE C 11.635 6.734 3.433 1.00 . A A . 15 LYS CE 1 1 12 5766 1 1 15 LYS CG C 9.186 6.188 3.567 1.00 . A A . 15 LYS CG 1 1 12 5767 1 1 15 LYS H H 6.014 4.682 2.150 1.00 . A A . 15 LYS H 1 1 12 5768 1 1 15 LYS HA H 8.569 5.455 1.220 1.00 . A A . 15 LYS HA 1 1 12 5769 1 1 15 LYS HB2 H 7.291 5.245 3.713 1.00 . A A . 15 LYS HB2 1 1 12 5770 1 1 15 LYS HB3 H 8.660 4.146 3.809 1.00 . A A . 15 LYS HB3 1 1 12 5771 1 1 15 LYS HD2 H 10.685 5.594 4.962 1.00 . A A . 15 LYS HD2 1 1 12 5772 1 1 15 LYS HD3 H 10.779 4.782 3.398 1.00 . A A . 15 LYS HD3 1 1 12 5773 1 1 15 LYS HE2 H 11.168 7.705 3.359 1.00 . A A . 15 LYS HE2 1 1 12 5774 1 1 15 LYS HE3 H 12.430 6.773 4.164 1.00 . A A . 15 LYS HE3 1 1 12 5775 1 1 15 LYS HG2 H 9.219 6.815 2.688 1.00 . A A . 15 LYS HG2 1 1 12 5776 1 1 15 LYS HG3 H 8.800 6.755 4.402 1.00 . A A . 15 LYS HG3 1 1 12 5777 1 1 15 LYS HZ1 H 12.523 7.231 1.609 1.00 . A A . 15 LYS HZ1 1 1 12 5778 1 1 15 LYS HZ2 H 11.499 5.887 1.528 1.00 . A A . 15 LYS HZ2 1 1 12 5779 1 1 15 LYS HZ3 H 13.030 5.742 2.234 1.00 . A A . 15 LYS HZ3 1 1 12 5780 1 1 15 LYS N N 6.698 4.620 1.452 1.00 . A A . 15 LYS N 1 1 12 5781 1 1 15 LYS NZ N 12.213 6.373 2.109 1.00 . A A . 15 LYS NZ 1 1 12 5782 1 1 15 LYS O O 9.808 3.274 0.883 1.00 . A A . 15 LYS O 1 1 12 5783 1 1 16 GLN C C 8.396 0.555 0.147 1.00 . A A . 16 GLN C 1 1 12 5784 1 1 16 GLN CA C 8.516 0.919 1.628 1.00 . A A . 16 GLN CA 1 1 12 5785 1 1 16 GLN CB C 7.726 -0.081 2.473 1.00 . A A . 16 GLN CB 1 1 12 5786 1 1 16 GLN CD C 7.091 -2.522 2.350 1.00 . A A . 16 GLN CD 1 1 12 5787 1 1 16 GLN CG C 8.221 -1.513 2.343 1.00 . A A . 16 GLN CG 1 1 12 5788 1 1 16 GLN H H 7.189 2.398 2.350 1.00 . A A . 16 GLN H 1 1 12 5789 1 1 16 GLN HA H 9.557 0.870 1.913 1.00 . A A . 16 GLN HA 1 1 12 5790 1 1 16 GLN HB2 H 7.796 0.208 3.511 1.00 . A A . 16 GLN HB2 1 1 12 5791 1 1 16 GLN HB3 H 6.690 -0.051 2.170 1.00 . A A . 16 GLN HB3 1 1 12 5792 1 1 16 GLN HE21 H 7.636 -3.157 4.154 1.00 . A A . 16 GLN HE21 1 1 12 5793 1 1 16 GLN HE22 H 6.264 -3.948 3.463 1.00 . A A . 16 GLN HE22 1 1 12 5794 1 1 16 GLN HG2 H 8.764 -1.609 1.415 1.00 . A A . 16 GLN HG2 1 1 12 5795 1 1 16 GLN HG3 H 8.882 -1.727 3.170 1.00 . A A . 16 GLN HG3 1 1 12 5796 1 1 16 GLN N N 8.051 2.272 1.886 1.00 . A A . 16 GLN N 1 1 12 5797 1 1 16 GLN NE2 N 6.986 -3.286 3.432 1.00 . A A . 16 GLN NE2 1 1 12 5798 1 1 16 GLN O O 9.395 0.289 -0.521 1.00 . A A . 16 GLN O 1 1 12 5799 1 1 16 GLN OE1 O 6.319 -2.615 1.395 1.00 . A A . 16 GLN OE1 1 1 12 5800 1 1 17 THR C C 7.324 1.232 -2.723 1.00 . A A . 17 THR C 1 1 12 5801 1 1 17 THR CA C 6.888 0.155 -1.737 1.00 . A A . 17 THR CA 1 1 12 5802 1 1 17 THR CB C 5.399 -0.153 -1.919 1.00 . A A . 17 THR CB 1 1 12 5803 1 1 17 THR CG2 C 4.503 1.055 -1.748 1.00 . A A . 17 THR CG2 1 1 12 5804 1 1 17 THR H H 6.400 0.731 0.237 1.00 . A A . 17 THR H 1 1 12 5805 1 1 17 THR HA H 7.446 -0.738 -1.949 1.00 . A A . 17 THR HA 1 1 12 5806 1 1 17 THR HB H 5.103 -0.888 -1.184 1.00 . A A . 17 THR HB 1 1 12 5807 1 1 17 THR HG1 H 4.291 -1.112 -3.215 1.00 . A A . 17 THR HG1 1 1 12 5808 1 1 17 THR HG21 H 3.470 0.741 -1.755 1.00 . A A . 17 THR HG21 1 1 12 5809 1 1 17 THR HG22 H 4.674 1.748 -2.559 1.00 . A A . 17 THR HG22 1 1 12 5810 1 1 17 THR HG23 H 4.726 1.539 -0.808 1.00 . A A . 17 THR HG23 1 1 12 5811 1 1 17 THR N N 7.158 0.517 -0.350 1.00 . A A . 17 THR N 1 1 12 5812 1 1 17 THR O O 8.017 0.951 -3.701 1.00 . A A . 17 THR O 1 1 12 5813 1 1 17 THR OG1 O 5.153 -0.688 -3.205 1.00 . A A . 17 THR OG1 1 1 12 5814 1 1 18 GLY C C 6.558 3.419 -4.698 1.00 . A A . 18 GLY C 1 1 12 5815 1 1 18 GLY CA C 7.219 3.556 -3.350 1.00 . A A . 18 GLY CA 1 1 12 5816 1 1 18 GLY H H 6.336 2.609 -1.686 1.00 . A A . 18 GLY H 1 1 12 5817 1 1 18 GLY HA2 H 6.885 4.476 -2.894 1.00 . A A . 18 GLY HA2 1 1 12 5818 1 1 18 GLY HA3 H 8.270 3.606 -3.485 1.00 . A A . 18 GLY HA3 1 1 12 5819 1 1 18 GLY N N 6.893 2.455 -2.470 1.00 . A A . 18 GLY N 1 1 12 5820 1 1 18 GLY O O 7.036 2.698 -5.574 1.00 . A A . 18 GLY O 1 1 12 5821 1 1 19 CYS C C 3.210 4.537 -5.745 1.00 . A A . 19 CYS C 1 1 12 5822 1 1 19 CYS CA C 4.662 4.172 -6.059 1.00 . A A . 19 CYS CA 1 1 12 5823 1 1 19 CYS CB C 4.720 2.871 -6.832 1.00 . A A . 19 CYS CB 1 1 12 5824 1 1 19 CYS H H 5.188 4.687 -4.099 1.00 . A A . 19 CYS H 1 1 12 5825 1 1 19 CYS HA H 5.080 4.929 -6.674 1.00 . A A . 19 CYS HA 1 1 12 5826 1 1 19 CYS HB2 H 3.949 2.888 -7.579 1.00 . A A . 19 CYS HB2 1 1 12 5827 1 1 19 CYS HB3 H 5.676 2.826 -7.318 1.00 . A A . 19 CYS HB3 1 1 12 5828 1 1 19 CYS N N 5.462 4.137 -4.843 1.00 . A A . 19 CYS N 1 1 12 5829 1 1 19 CYS O O 2.655 4.090 -4.741 1.00 . A A . 19 CYS O 1 1 12 5830 1 1 19 CYS SG S 4.508 1.356 -5.839 1.00 . A A . 19 CYS SG 1 1 12 5831 1 1 20 PRO C C 0.174 4.672 -6.397 1.00 . A A . 20 PRO C 1 1 12 5832 1 1 20 PRO CA C 1.189 5.815 -6.386 1.00 . A A . 20 PRO CA 1 1 12 5833 1 1 20 PRO CB C 0.927 6.757 -7.567 1.00 . A A . 20 PRO CB 1 1 12 5834 1 1 20 PRO CD C 3.169 5.972 -7.799 1.00 . A A . 20 PRO CD 1 1 12 5835 1 1 20 PRO CG C 2.277 7.149 -8.062 1.00 . A A . 20 PRO CG 1 1 12 5836 1 1 20 PRO HA H 1.088 6.366 -5.463 1.00 . A A . 20 PRO HA 1 1 12 5837 1 1 20 PRO HB2 H 0.365 6.236 -8.329 1.00 . A A . 20 PRO HB2 1 1 12 5838 1 1 20 PRO HB3 H 0.369 7.617 -7.227 1.00 . A A . 20 PRO HB3 1 1 12 5839 1 1 20 PRO HD2 H 3.137 5.281 -8.630 1.00 . A A . 20 PRO HD2 1 1 12 5840 1 1 20 PRO HD3 H 4.180 6.300 -7.615 1.00 . A A . 20 PRO HD3 1 1 12 5841 1 1 20 PRO HG2 H 2.233 7.359 -9.121 1.00 . A A . 20 PRO HG2 1 1 12 5842 1 1 20 PRO HG3 H 2.630 8.015 -7.521 1.00 . A A . 20 PRO HG3 1 1 12 5843 1 1 20 PRO N N 2.578 5.373 -6.591 1.00 . A A . 20 PRO N 1 1 12 5844 1 1 20 PRO O O -0.979 4.862 -6.010 1.00 . A A . 20 PRO O 1 1 12 5845 1 1 21 TYR C C -0.642 1.821 -5.534 1.00 . A A . 21 TYR C 1 1 12 5846 1 1 21 TYR CA C -0.290 2.351 -6.924 1.00 . A A . 21 TYR CA 1 1 12 5847 1 1 21 TYR CB C 0.370 1.249 -7.748 1.00 . A A . 21 TYR CB 1 1 12 5848 1 1 21 TYR CD1 C 1.224 2.806 -9.550 1.00 . A A . 21 TYR CD1 1 1 12 5849 1 1 21 TYR CD2 C 2.683 1.092 -8.760 1.00 . A A . 21 TYR CD2 1 1 12 5850 1 1 21 TYR CE1 C 2.201 3.240 -10.425 1.00 . A A . 21 TYR CE1 1 1 12 5851 1 1 21 TYR CE2 C 3.666 1.522 -9.631 1.00 . A A . 21 TYR CE2 1 1 12 5852 1 1 21 TYR CG C 1.447 1.726 -8.703 1.00 . A A . 21 TYR CG 1 1 12 5853 1 1 21 TYR CZ C 3.420 2.596 -10.461 1.00 . A A . 21 TYR CZ 1 1 12 5854 1 1 21 TYR H H 1.504 3.390 -7.163 1.00 . A A . 21 TYR H 1 1 12 5855 1 1 21 TYR HA H -1.197 2.661 -7.418 1.00 . A A . 21 TYR HA 1 1 12 5856 1 1 21 TYR HB2 H 0.815 0.529 -7.083 1.00 . A A . 21 TYR HB2 1 1 12 5857 1 1 21 TYR HB3 H -0.383 0.774 -8.328 1.00 . A A . 21 TYR HB3 1 1 12 5858 1 1 21 TYR HD1 H 0.269 3.308 -9.518 1.00 . A A . 21 TYR HD1 1 1 12 5859 1 1 21 TYR HD2 H 2.871 0.251 -8.109 1.00 . A A . 21 TYR HD2 1 1 12 5860 1 1 21 TYR HE1 H 2.010 4.082 -11.074 1.00 . A A . 21 TYR HE1 1 1 12 5861 1 1 21 TYR HE2 H 4.620 1.017 -9.660 1.00 . A A . 21 TYR HE2 1 1 12 5862 1 1 21 TYR HH H 4.763 3.855 -11.015 1.00 . A A . 21 TYR HH 1 1 12 5863 1 1 21 TYR N N 0.590 3.495 -6.852 1.00 . A A . 21 TYR N 1 1 12 5864 1 1 21 TYR O O 0.026 2.132 -4.549 1.00 . A A . 21 TYR O 1 1 12 5865 1 1 21 TYR OH O 4.396 3.025 -11.330 1.00 . A A . 21 TYR OH 1 1 12 5866 1 1 22 GLY C C -3.488 -0.237 -4.318 1.00 . A A . 22 GLY C 1 1 12 5867 1 1 22 GLY CA C -2.129 0.426 -4.211 1.00 . A A . 22 GLY CA 1 1 12 5868 1 1 22 GLY H H -2.181 0.793 -6.296 1.00 . A A . 22 GLY H 1 1 12 5869 1 1 22 GLY HA2 H -1.408 -0.306 -3.900 1.00 . A A . 22 GLY HA2 1 1 12 5870 1 1 22 GLY HA3 H -2.175 1.204 -3.464 1.00 . A A . 22 GLY HA3 1 1 12 5871 1 1 22 GLY N N -1.696 1.008 -5.473 1.00 . A A . 22 GLY N 1 1 12 5872 1 1 22 GLY O O -4.367 0.266 -5.017 1.00 . A A . 22 GLY O 1 1 12 5873 1 1 23 LYS C C -5.711 -1.814 -2.337 1.00 . A A . 23 LYS C 1 1 12 5874 1 1 23 LYS CA C -4.974 -2.038 -3.647 1.00 . A A . 23 LYS CA 1 1 12 5875 1 1 23 LYS CB C -4.829 -3.541 -3.932 1.00 . A A . 23 LYS CB 1 1 12 5876 1 1 23 LYS CD C -3.271 -5.481 -4.264 1.00 . A A . 23 LYS CD 1 1 12 5877 1 1 23 LYS CE C -4.261 -6.483 -3.692 1.00 . A A . 23 LYS CE 1 1 12 5878 1 1 23 LYS CG C -3.451 -4.104 -3.643 1.00 . A A . 23 LYS CG 1 1 12 5879 1 1 23 LYS H H -2.969 -1.709 -3.050 1.00 . A A . 23 LYS H 1 1 12 5880 1 1 23 LYS HA H -5.548 -1.588 -4.441 1.00 . A A . 23 LYS HA 1 1 12 5881 1 1 23 LYS HB2 H -5.543 -4.079 -3.328 1.00 . A A . 23 LYS HB2 1 1 12 5882 1 1 23 LYS HB3 H -5.052 -3.717 -4.974 1.00 . A A . 23 LYS HB3 1 1 12 5883 1 1 23 LYS HD2 H -3.424 -5.407 -5.330 1.00 . A A . 23 LYS HD2 1 1 12 5884 1 1 23 LYS HD3 H -2.267 -5.826 -4.064 1.00 . A A . 23 LYS HD3 1 1 12 5885 1 1 23 LYS HE2 H -5.246 -6.038 -3.694 1.00 . A A . 23 LYS HE2 1 1 12 5886 1 1 23 LYS HE3 H -4.264 -7.363 -4.317 1.00 . A A . 23 LYS HE3 1 1 12 5887 1 1 23 LYS HG2 H -2.708 -3.437 -4.052 1.00 . A A . 23 LYS HG2 1 1 12 5888 1 1 23 LYS HG3 H -3.321 -4.181 -2.574 1.00 . A A . 23 LYS HG3 1 1 12 5889 1 1 23 LYS HZ1 H -4.592 -7.579 -1.946 1.00 . A A . 23 LYS HZ1 1 1 12 5890 1 1 23 LYS HZ2 H -3.932 -6.046 -1.676 1.00 . A A . 23 LYS HZ2 1 1 12 5891 1 1 23 LYS HZ3 H -2.957 -7.292 -2.274 1.00 . A A . 23 LYS HZ3 1 1 12 5892 1 1 23 LYS N N -3.683 -1.356 -3.612 1.00 . A A . 23 LYS N 1 1 12 5893 1 1 23 LYS NZ N -3.912 -6.877 -2.300 1.00 . A A . 23 LYS NZ 1 1 12 5894 1 1 23 LYS O O -6.382 -2.705 -1.819 1.00 . A A . 23 LYS O 1 1 12 5895 1 1 24 CYS C C -7.717 -0.136 -0.714 1.00 . A A . 24 CYS C 1 1 12 5896 1 1 24 CYS CA C -6.200 -0.231 -0.556 1.00 . A A . 24 CYS CA 1 1 12 5897 1 1 24 CYS CB C -5.607 1.095 -0.055 1.00 . A A . 24 CYS CB 1 1 12 5898 1 1 24 CYS H H -5.014 0.054 -2.275 1.00 . A A . 24 CYS H 1 1 12 5899 1 1 24 CYS HA H -5.981 -1.004 0.164 1.00 . A A . 24 CYS HA 1 1 12 5900 1 1 24 CYS HB2 H -5.677 1.130 1.019 1.00 . A A . 24 CYS HB2 1 1 12 5901 1 1 24 CYS HB3 H -4.563 1.135 -0.337 1.00 . A A . 24 CYS HB3 1 1 12 5902 1 1 24 CYS N N -5.568 -0.606 -1.809 1.00 . A A . 24 CYS N 1 1 12 5903 1 1 24 CYS O O -8.218 0.542 -1.611 1.00 . A A . 24 CYS O 1 1 12 5904 1 1 24 CYS SG S -6.415 2.596 -0.709 1.00 . A A . 24 CYS SG 1 1 12 5905 1 1 25 MET C C -10.462 -0.103 1.344 1.00 . A A . 25 MET C 1 1 12 5906 1 1 25 MET CA C -9.897 -0.818 0.126 1.00 . A A . 25 MET CA 1 1 12 5907 1 1 25 MET CB C -10.431 -2.250 0.064 1.00 . A A . 25 MET CB 1 1 12 5908 1 1 25 MET CE C -13.532 -4.160 0.290 1.00 . A A . 25 MET CE 1 1 12 5909 1 1 25 MET CG C -11.684 -2.397 -0.783 1.00 . A A . 25 MET CG 1 1 12 5910 1 1 25 MET H H -7.981 -1.344 0.854 1.00 . A A . 25 MET H 1 1 12 5911 1 1 25 MET HA H -10.208 -0.288 -0.762 1.00 . A A . 25 MET HA 1 1 12 5912 1 1 25 MET HB2 H -9.666 -2.891 -0.348 1.00 . A A . 25 MET HB2 1 1 12 5913 1 1 25 MET HB3 H -10.661 -2.581 1.067 1.00 . A A . 25 MET HB3 1 1 12 5914 1 1 25 MET HE1 H -13.229 -4.538 1.256 1.00 . A A . 25 MET HE1 1 1 12 5915 1 1 25 MET HE2 H -12.981 -4.673 -0.485 1.00 . A A . 25 MET HE2 1 1 12 5916 1 1 25 MET HE3 H -14.589 -4.330 0.153 1.00 . A A . 25 MET HE3 1 1 12 5917 1 1 25 MET HG2 H -11.731 -1.571 -1.478 1.00 . A A . 25 MET HG2 1 1 12 5918 1 1 25 MET HG3 H -11.625 -3.324 -1.333 1.00 . A A . 25 MET HG3 1 1 12 5919 1 1 25 MET N N -8.439 -0.822 0.163 1.00 . A A . 25 MET N 1 1 12 5920 1 1 25 MET O O -9.916 -0.200 2.443 1.00 . A A . 25 MET O 1 1 12 5921 1 1 25 MET SD S -13.194 -2.404 0.203 1.00 . A A . 25 MET SD 1 1 12 5922 1 1 26 ASN C C -12.327 0.510 3.481 1.00 . A A . 26 ASN C 1 1 12 5923 1 1 26 ASN CA C -12.200 1.362 2.226 1.00 . A A . 26 ASN CA 1 1 12 5924 1 1 26 ASN CB C -13.582 1.872 1.808 1.00 . A A . 26 ASN CB 1 1 12 5925 1 1 26 ASN CG C -14.274 0.965 0.806 1.00 . A A . 26 ASN CG 1 1 12 5926 1 1 26 ASN H H -11.941 0.661 0.239 1.00 . A A . 26 ASN H 1 1 12 5927 1 1 26 ASN HA H -11.573 2.212 2.452 1.00 . A A . 26 ASN HA 1 1 12 5928 1 1 26 ASN HB2 H -14.208 1.947 2.684 1.00 . A A . 26 ASN HB2 1 1 12 5929 1 1 26 ASN HB3 H -13.473 2.851 1.369 1.00 . A A . 26 ASN HB3 1 1 12 5930 1 1 26 ASN HD21 H -13.852 2.231 -0.668 1.00 . A A . 26 ASN HD21 1 1 12 5931 1 1 26 ASN HD22 H -14.724 0.812 -1.125 1.00 . A A . 26 ASN HD22 1 1 12 5932 1 1 26 ASN N N -11.559 0.620 1.141 1.00 . A A . 26 ASN N 1 1 12 5933 1 1 26 ASN ND2 N -14.284 1.378 -0.456 1.00 . A A . 26 ASN ND2 1 1 12 5934 1 1 26 ASN O O -12.897 -0.581 3.455 1.00 . A A . 26 ASN O 1 1 12 5935 1 1 26 ASN OD1 O -14.792 -0.092 1.163 1.00 . A A . 26 ASN OD1 1 1 12 5936 1 1 27 ARG C C -10.833 -0.845 5.852 1.00 . A A . 27 ARG C 1 1 12 5937 1 1 27 ARG CA C -11.812 0.320 5.857 1.00 . A A . 27 ARG CA 1 1 12 5938 1 1 27 ARG CB C -13.226 -0.177 6.171 1.00 . A A . 27 ARG CB 1 1 12 5939 1 1 27 ARG CD C -15.067 0.648 7.671 1.00 . A A . 27 ARG CD 1 1 12 5940 1 1 27 ARG CG C -13.655 0.089 7.604 1.00 . A A . 27 ARG CG 1 1 12 5941 1 1 27 ARG CZ C -16.006 -0.780 9.446 1.00 . A A . 27 ARG CZ 1 1 12 5942 1 1 27 ARG H H -11.337 1.890 4.521 1.00 . A A . 27 ARG H 1 1 12 5943 1 1 27 ARG HA H -11.508 1.019 6.619 1.00 . A A . 27 ARG HA 1 1 12 5944 1 1 27 ARG HB2 H -13.923 0.317 5.510 1.00 . A A . 27 ARG HB2 1 1 12 5945 1 1 27 ARG HB3 H -13.270 -1.242 5.996 1.00 . A A . 27 ARG HB3 1 1 12 5946 1 1 27 ARG HD2 H -15.028 1.711 7.480 1.00 . A A . 27 ARG HD2 1 1 12 5947 1 1 27 ARG HD3 H -15.667 0.169 6.911 1.00 . A A . 27 ARG HD3 1 1 12 5948 1 1 27 ARG HE H -15.872 1.209 9.529 1.00 . A A . 27 ARG HE 1 1 12 5949 1 1 27 ARG HG2 H -13.620 -0.837 8.158 1.00 . A A . 27 ARG HG2 1 1 12 5950 1 1 27 ARG HG3 H -12.974 0.802 8.047 1.00 . A A . 27 ARG HG3 1 1 12 5951 1 1 27 ARG HH11 H -15.347 -1.788 7.821 1.00 . A A . 27 ARG HH11 1 1 12 5952 1 1 27 ARG HH12 H -16.010 -2.769 9.084 1.00 . A A . 27 ARG HH12 1 1 12 5953 1 1 27 ARG HH21 H -16.745 -0.079 11.192 1.00 . A A . 27 ARG HH21 1 1 12 5954 1 1 27 ARG HH22 H -16.805 -1.799 10.998 1.00 . A A . 27 ARG HH22 1 1 12 5955 1 1 27 ARG N N -11.781 1.020 4.577 1.00 . A A . 27 ARG N 1 1 12 5956 1 1 27 ARG NE N -15.686 0.424 8.975 1.00 . A A . 27 ARG NE 1 1 12 5957 1 1 27 ARG NH1 N -15.768 -1.868 8.724 1.00 . A A . 27 ARG NH1 1 1 12 5958 1 1 27 ARG NH2 N -16.565 -0.896 10.643 1.00 . A A . 27 ARG NH2 1 1 12 5959 1 1 27 ARG O O -11.026 -1.840 6.552 1.00 . A A . 27 ARG O 1 1 12 5960 1 1 28 LYS C C -7.810 -1.467 3.783 1.00 . A A . 28 LYS C 1 1 12 5961 1 1 28 LYS CA C -8.750 -1.745 4.948 1.00 . A A . 28 LYS CA 1 1 12 5962 1 1 28 LYS CB C -9.389 -3.129 4.785 1.00 . A A . 28 LYS CB 1 1 12 5963 1 1 28 LYS CD C -8.135 -4.854 6.115 1.00 . A A . 28 LYS CD 1 1 12 5964 1 1 28 LYS CE C -8.341 -6.028 7.058 1.00 . A A . 28 LYS CE 1 1 12 5965 1 1 28 LYS CG C -9.366 -3.964 6.055 1.00 . A A . 28 LYS CG 1 1 12 5966 1 1 28 LYS H H -9.686 0.112 4.528 1.00 . A A . 28 LYS H 1 1 12 5967 1 1 28 LYS HA H -8.173 -1.730 5.861 1.00 . A A . 28 LYS HA 1 1 12 5968 1 1 28 LYS HB2 H -10.417 -3.004 4.481 1.00 . A A . 28 LYS HB2 1 1 12 5969 1 1 28 LYS HB3 H -8.858 -3.671 4.015 1.00 . A A . 28 LYS HB3 1 1 12 5970 1 1 28 LYS HD2 H -7.929 -5.233 5.125 1.00 . A A . 28 LYS HD2 1 1 12 5971 1 1 28 LYS HD3 H -7.295 -4.269 6.460 1.00 . A A . 28 LYS HD3 1 1 12 5972 1 1 28 LYS HE2 H -8.800 -5.666 7.967 1.00 . A A . 28 LYS HE2 1 1 12 5973 1 1 28 LYS HE3 H -8.998 -6.743 6.585 1.00 . A A . 28 LYS HE3 1 1 12 5974 1 1 28 LYS HG2 H -9.360 -3.302 6.909 1.00 . A A . 28 LYS HG2 1 1 12 5975 1 1 28 LYS HG3 H -10.250 -4.583 6.084 1.00 . A A . 28 LYS HG3 1 1 12 5976 1 1 28 LYS HZ1 H -6.379 -6.589 6.619 1.00 . A A . 28 LYS HZ1 1 1 12 5977 1 1 28 LYS HZ2 H -7.217 -7.713 7.565 1.00 . A A . 28 LYS HZ2 1 1 12 5978 1 1 28 LYS HZ3 H -6.651 -6.279 8.259 1.00 . A A . 28 LYS HZ3 1 1 12 5979 1 1 28 LYS N N -9.778 -0.710 5.055 1.00 . A A . 28 LYS N 1 1 12 5980 1 1 28 LYS NZ N -7.057 -6.699 7.399 1.00 . A A . 28 LYS NZ 1 1 12 5981 1 1 28 LYS O O -8.036 -1.920 2.661 1.00 . A A . 28 LYS O 1 1 12 5982 1 1 29 CYS C C -4.947 -1.577 2.649 1.00 . A A . 29 CYS C 1 1 12 5983 1 1 29 CYS CA C -5.769 -0.361 3.059 1.00 . A A . 29 CYS CA 1 1 12 5984 1 1 29 CYS CB C -4.888 0.767 3.605 1.00 . A A . 29 CYS CB 1 1 12 5985 1 1 29 CYS H H -6.638 -0.381 4.973 1.00 . A A . 29 CYS H 1 1 12 5986 1 1 29 CYS HA H -6.302 0.000 2.199 1.00 . A A . 29 CYS HA 1 1 12 5987 1 1 29 CYS HB2 H -5.258 1.698 3.223 1.00 . A A . 29 CYS HB2 1 1 12 5988 1 1 29 CYS HB3 H -4.977 0.773 4.674 1.00 . A A . 29 CYS HB3 1 1 12 5989 1 1 29 CYS N N -6.755 -0.713 4.063 1.00 . A A . 29 CYS N 1 1 12 5990 1 1 29 CYS O O -4.965 -2.608 3.321 1.00 . A A . 29 CYS O 1 1 12 5991 1 1 29 CYS SG S -3.108 0.683 3.204 1.00 . A A . 29 CYS SG 1 1 12 5992 1 1 30 LYS C C -2.688 -2.146 -0.259 1.00 . A A . 30 LYS C 1 1 12 5993 1 1 30 LYS CA C -3.409 -2.535 1.031 1.00 . A A . 30 LYS CA 1 1 12 5994 1 1 30 LYS CB C -4.265 -3.780 0.787 1.00 . A A . 30 LYS CB 1 1 12 5995 1 1 30 LYS CD C -4.477 -6.279 0.950 1.00 . A A . 30 LYS CD 1 1 12 5996 1 1 30 LYS CE C -5.290 -6.575 2.200 1.00 . A A . 30 LYS CE 1 1 12 5997 1 1 30 LYS CG C -3.564 -5.080 1.150 1.00 . A A . 30 LYS CG 1 1 12 5998 1 1 30 LYS H H -4.265 -0.596 1.050 1.00 . A A . 30 LYS H 1 1 12 5999 1 1 30 LYS HA H -2.670 -2.764 1.782 1.00 . A A . 30 LYS HA 1 1 12 6000 1 1 30 LYS HB2 H -5.166 -3.706 1.377 1.00 . A A . 30 LYS HB2 1 1 12 6001 1 1 30 LYS HB3 H -4.532 -3.821 -0.259 1.00 . A A . 30 LYS HB3 1 1 12 6002 1 1 30 LYS HD2 H -5.154 -6.072 0.134 1.00 . A A . 30 LYS HD2 1 1 12 6003 1 1 30 LYS HD3 H -3.873 -7.143 0.710 1.00 . A A . 30 LYS HD3 1 1 12 6004 1 1 30 LYS HE2 H -5.392 -7.645 2.302 1.00 . A A . 30 LYS HE2 1 1 12 6005 1 1 30 LYS HE3 H -4.762 -6.181 3.057 1.00 . A A . 30 LYS HE3 1 1 12 6006 1 1 30 LYS HG2 H -2.693 -5.196 0.522 1.00 . A A . 30 LYS HG2 1 1 12 6007 1 1 30 LYS HG3 H -3.261 -5.037 2.185 1.00 . A A . 30 LYS HG3 1 1 12 6008 1 1 30 LYS HZ1 H -6.945 -5.665 3.090 1.00 . A A . 30 LYS HZ1 1 1 12 6009 1 1 30 LYS HZ2 H -7.332 -6.649 1.771 1.00 . A A . 30 LYS HZ2 1 1 12 6010 1 1 30 LYS HZ3 H -6.634 -5.130 1.516 1.00 . A A . 30 LYS HZ3 1 1 12 6011 1 1 30 LYS N N -4.234 -1.446 1.538 1.00 . A A . 30 LYS N 1 1 12 6012 1 1 30 LYS NZ N -6.644 -5.962 2.140 1.00 . A A . 30 LYS NZ 1 1 12 6013 1 1 30 LYS O O -3.226 -2.304 -1.352 1.00 . A A . 30 LYS O 1 1 12 6014 1 1 31 CYS C C -0.709 -2.202 -2.411 1.00 . A A . 31 CYS C 1 1 12 6015 1 1 31 CYS CA C -0.613 -1.249 -1.238 1.00 . A A . 31 CYS CA 1 1 12 6016 1 1 31 CYS CB C 0.843 -1.169 -0.778 1.00 . A A . 31 CYS CB 1 1 12 6017 1 1 31 CYS H H -1.105 -1.567 0.799 1.00 . A A . 31 CYS H 1 1 12 6018 1 1 31 CYS HA H -0.913 -0.277 -1.585 1.00 . A A . 31 CYS HA 1 1 12 6019 1 1 31 CYS HB2 H 0.998 -1.870 0.028 1.00 . A A . 31 CYS HB2 1 1 12 6020 1 1 31 CYS HB3 H 1.490 -1.428 -1.604 1.00 . A A . 31 CYS HB3 1 1 12 6021 1 1 31 CYS N N -1.461 -1.654 -0.108 1.00 . A A . 31 CYS N 1 1 12 6022 1 1 31 CYS O O -1.350 -3.245 -2.352 1.00 . A A . 31 CYS O 1 1 12 6023 1 1 31 CYS SG S 1.342 0.476 -0.181 1.00 . A A . 31 CYS SG 1 1 12 6024 1 1 32 ASN C C 1.165 -3.454 -4.782 1.00 . A A . 32 ASN C 1 1 12 6025 1 1 32 ASN CA C -0.050 -2.544 -4.722 1.00 . A A . 32 ASN CA 1 1 12 6026 1 1 32 ASN CB C 0.005 -1.571 -5.875 1.00 . A A . 32 ASN CB 1 1 12 6027 1 1 32 ASN CG C -0.670 -2.093 -7.129 1.00 . A A . 32 ASN CG 1 1 12 6028 1 1 32 ASN H H 0.372 -0.920 -3.452 1.00 . A A . 32 ASN H 1 1 12 6029 1 1 32 ASN HA H -0.941 -3.133 -4.798 1.00 . A A . 32 ASN HA 1 1 12 6030 1 1 32 ASN HB2 H -0.476 -0.664 -5.577 1.00 . A A . 32 ASN HB2 1 1 12 6031 1 1 32 ASN HB3 H 1.032 -1.365 -6.092 1.00 . A A . 32 ASN HB3 1 1 12 6032 1 1 32 ASN HD21 H 0.994 -1.801 -8.176 1.00 . A A . 32 ASN HD21 1 1 12 6033 1 1 32 ASN HD22 H -0.343 -2.449 -9.057 1.00 . A A . 32 ASN HD22 1 1 12 6034 1 1 32 ASN N N -0.078 -1.790 -3.484 1.00 . A A . 32 ASN N 1 1 12 6035 1 1 32 ASN ND2 N 0.069 -2.117 -8.232 1.00 . A A . 32 ASN ND2 1 1 12 6036 1 1 32 ASN O O 1.992 -3.476 -3.871 1.00 . A A . 32 ASN O 1 1 12 6037 1 1 32 ASN OD1 O -1.842 -2.471 -7.106 1.00 . A A . 32 ASN OD1 1 1 12 6038 1 1 33 ARG C C 3.512 -4.333 -6.815 1.00 . A A . 33 ARG C 1 1 12 6039 1 1 33 ARG CA C 2.399 -5.078 -6.097 1.00 . A A . 33 ARG CA 1 1 12 6040 1 1 33 ARG CB C 1.973 -6.307 -6.902 1.00 . A A . 33 ARG CB 1 1 12 6041 1 1 33 ARG CD C 3.658 -7.794 -5.779 1.00 . A A . 33 ARG CD 1 1 12 6042 1 1 33 ARG CG C 3.087 -7.319 -7.106 1.00 . A A . 33 ARG CG 1 1 12 6043 1 1 33 ARG CZ C 6.053 -7.238 -5.960 1.00 . A A . 33 ARG CZ 1 1 12 6044 1 1 33 ARG H H 0.585 -4.096 -6.573 1.00 . A A . 33 ARG H 1 1 12 6045 1 1 33 ARG HA H 2.766 -5.388 -5.131 1.00 . A A . 33 ARG HA 1 1 12 6046 1 1 33 ARG HB2 H 1.161 -6.797 -6.385 1.00 . A A . 33 ARG HB2 1 1 12 6047 1 1 33 ARG HB3 H 1.626 -5.985 -7.873 1.00 . A A . 33 ARG HB3 1 1 12 6048 1 1 33 ARG HD2 H 2.910 -7.661 -5.013 1.00 . A A . 33 ARG HD2 1 1 12 6049 1 1 33 ARG HD3 H 3.906 -8.842 -5.864 1.00 . A A . 33 ARG HD3 1 1 12 6050 1 1 33 ARG HE H 4.770 -6.376 -4.697 1.00 . A A . 33 ARG HE 1 1 12 6051 1 1 33 ARG HG2 H 2.695 -8.169 -7.643 1.00 . A A . 33 ARG HG2 1 1 12 6052 1 1 33 ARG HG3 H 3.876 -6.858 -7.683 1.00 . A A . 33 ARG HG3 1 1 12 6053 1 1 33 ARG HH11 H 5.430 -8.688 -7.227 1.00 . A A . 33 ARG HH11 1 1 12 6054 1 1 33 ARG HH12 H 7.109 -8.280 -7.333 1.00 . A A . 33 ARG HH12 1 1 12 6055 1 1 33 ARG HH21 H 6.979 -5.837 -4.836 1.00 . A A . 33 ARG HH21 1 1 12 6056 1 1 33 ARG HH22 H 7.989 -6.662 -5.977 1.00 . A A . 33 ARG HH22 1 1 12 6057 1 1 33 ARG N N 1.273 -4.181 -5.882 1.00 . A A . 33 ARG N 1 1 12 6058 1 1 33 ARG NE N 4.859 -7.051 -5.402 1.00 . A A . 33 ARG NE 1 1 12 6059 1 1 33 ARG NH1 N 6.210 -8.144 -6.918 1.00 . A A . 33 ARG NH1 1 1 12 6060 1 1 33 ARG NH2 N 7.092 -6.521 -5.558 1.00 . A A . 33 ARG NH2 1 1 12 6061 1 1 33 ARG O O 3.653 -4.410 -8.035 1.00 . A A . 33 ARG O 1 1 12 6062 1 1 34 CYS C C 6.699 -3.571 -6.514 1.00 . A A . 34 CYS C 1 1 12 6063 1 1 34 CYS CA C 5.384 -2.801 -6.559 1.00 . A A . 34 CYS CA 1 1 12 6064 1 1 34 CYS CB C 5.498 -1.511 -5.766 1.00 . A A . 34 CYS CB 1 1 12 6065 1 1 34 CYS H H 4.099 -3.579 -5.071 1.00 . A A . 34 CYS H 1 1 12 6066 1 1 34 CYS HA H 5.156 -2.553 -7.574 1.00 . A A . 34 CYS HA 1 1 12 6067 1 1 34 CYS HB2 H 4.605 -1.396 -5.183 1.00 . A A . 34 CYS HB2 1 1 12 6068 1 1 34 CYS HB3 H 6.347 -1.578 -5.111 1.00 . A A . 34 CYS HB3 1 1 12 6069 1 1 34 CYS N N 4.284 -3.596 -6.033 1.00 . A A . 34 CYS N 1 1 12 6070 1 1 34 CYS O O 7.272 -3.826 -7.594 1.00 . A A . 34 CYS O 1 1 12 6071 1 1 34 CYS OXT O 7.146 -3.915 -5.400 1.00 . A A . 34 CYS OXT 1 1 12 6072 1 1 34 CYS SG S 5.685 -0.008 -6.780 1.00 . A A . 34 CYS SG 1 1 13 6073 1 1 1 VAL C C -11.842 4.372 -6.252 1.00 . A A . 1 VAL C 1 1 13 6074 1 1 1 VAL CA C -11.914 3.110 -7.106 1.00 . A A . 1 VAL CA 1 1 13 6075 1 1 1 VAL CB C -10.499 2.767 -7.607 1.00 . A A . 1 VAL CB 1 1 13 6076 1 1 1 VAL CG1 C -10.474 1.381 -8.234 1.00 . A A . 1 VAL CG1 1 1 13 6077 1 1 1 VAL CG2 C -10.013 3.816 -8.597 1.00 . A A . 1 VAL CG2 1 1 13 6078 1 1 1 VAL H1 H -13.791 3.518 -7.841 1.00 . A A . 1 VAL H1 1 1 13 6079 1 1 1 VAL H2 H -12.890 2.386 -8.765 1.00 . A A . 1 VAL H2 1 1 13 6080 1 1 1 VAL H3 H -12.503 4.056 -8.835 1.00 . A A . 1 VAL H3 1 1 13 6081 1 1 1 VAL HA H -12.264 2.294 -6.491 1.00 . A A . 1 VAL HA 1 1 13 6082 1 1 1 VAL HB H -9.828 2.766 -6.760 1.00 . A A . 1 VAL HB 1 1 13 6083 1 1 1 VAL HG11 H -11.312 0.807 -7.869 1.00 . A A . 1 VAL HG11 1 1 13 6084 1 1 1 VAL HG12 H -9.554 0.883 -7.970 1.00 . A A . 1 VAL HG12 1 1 13 6085 1 1 1 VAL HG13 H -10.540 1.471 -9.307 1.00 . A A . 1 VAL HG13 1 1 13 6086 1 1 1 VAL HG21 H -10.283 4.799 -8.240 1.00 . A A . 1 VAL HG21 1 1 13 6087 1 1 1 VAL HG22 H -10.473 3.644 -9.559 1.00 . A A . 1 VAL HG22 1 1 13 6088 1 1 1 VAL HG23 H -8.940 3.750 -8.694 1.00 . A A . 1 VAL HG23 1 1 13 6089 1 1 1 VAL N N -12.859 3.283 -8.239 1.00 . A A . 1 VAL N 1 1 13 6090 1 1 1 VAL O O -11.842 5.486 -6.775 1.00 . A A . 1 VAL O 1 1 13 6091 1 1 2 SER C C -11.100 4.883 -2.681 1.00 . A A . 2 SER C 1 1 13 6092 1 1 2 SER CA C -11.709 5.313 -4.012 1.00 . A A . 2 SER CA 1 1 13 6093 1 1 2 SER CB C -13.102 5.901 -3.781 1.00 . A A . 2 SER CB 1 1 13 6094 1 1 2 SER H H -11.786 3.275 -4.582 1.00 . A A . 2 SER H 1 1 13 6095 1 1 2 SER HA H -11.079 6.067 -4.456 1.00 . A A . 2 SER HA 1 1 13 6096 1 1 2 SER HB2 H -13.158 6.311 -2.784 1.00 . A A . 2 SER HB2 1 1 13 6097 1 1 2 SER HB3 H -13.284 6.685 -4.502 1.00 . A A . 2 SER HB3 1 1 13 6098 1 1 2 SER HG H -14.961 5.332 -4.025 1.00 . A A . 2 SER HG 1 1 13 6099 1 1 2 SER N N -11.781 4.188 -4.939 1.00 . A A . 2 SER N 1 1 13 6100 1 1 2 SER O O -11.606 3.978 -2.018 1.00 . A A . 2 SER O 1 1 13 6101 1 1 2 SER OG O -14.105 4.909 -3.923 1.00 . A A . 2 SER OG 1 1 13 6102 1 1 3 CYS C C -8.984 6.482 -0.272 1.00 . A A . 3 CYS C 1 1 13 6103 1 1 3 CYS CA C -9.331 5.224 -1.045 1.00 . A A . 3 CYS CA 1 1 13 6104 1 1 3 CYS CB C -8.050 4.430 -1.304 1.00 . A A . 3 CYS CB 1 1 13 6105 1 1 3 CYS H H -9.653 6.250 -2.868 1.00 . A A . 3 CYS H 1 1 13 6106 1 1 3 CYS HA H -9.992 4.626 -0.441 1.00 . A A . 3 CYS HA 1 1 13 6107 1 1 3 CYS HB2 H -7.514 4.885 -2.115 1.00 . A A . 3 CYS HB2 1 1 13 6108 1 1 3 CYS HB3 H -7.433 4.460 -0.419 1.00 . A A . 3 CYS HB3 1 1 13 6109 1 1 3 CYS N N -10.009 5.538 -2.296 1.00 . A A . 3 CYS N 1 1 13 6110 1 1 3 CYS O O -9.330 7.597 -0.662 1.00 . A A . 3 CYS O 1 1 13 6111 1 1 3 CYS SG S -8.324 2.680 -1.724 1.00 . A A . 3 CYS SG 1 1 13 6112 1 1 4 THR C C -6.497 7.024 2.308 1.00 . A A . 4 THR C 1 1 13 6113 1 1 4 THR CA C -7.855 7.354 1.699 1.00 . A A . 4 THR CA 1 1 13 6114 1 1 4 THR CB C -8.885 7.593 2.805 1.00 . A A . 4 THR CB 1 1 13 6115 1 1 4 THR CG2 C -9.092 6.390 3.700 1.00 . A A . 4 THR CG2 1 1 13 6116 1 1 4 THR H H -8.055 5.349 1.056 1.00 . A A . 4 THR H 1 1 13 6117 1 1 4 THR HA H -7.764 8.248 1.100 1.00 . A A . 4 THR HA 1 1 13 6118 1 1 4 THR HB H -9.835 7.836 2.351 1.00 . A A . 4 THR HB 1 1 13 6119 1 1 4 THR HG1 H -7.612 8.518 3.972 1.00 . A A . 4 THR HG1 1 1 13 6120 1 1 4 THR HG21 H -8.921 6.672 4.728 1.00 . A A . 4 THR HG21 1 1 13 6121 1 1 4 THR HG22 H -8.400 5.610 3.420 1.00 . A A . 4 THR HG22 1 1 13 6122 1 1 4 THR HG23 H -10.105 6.030 3.589 1.00 . A A . 4 THR HG23 1 1 13 6123 1 1 4 THR N N -8.289 6.271 0.827 1.00 . A A . 4 THR N 1 1 13 6124 1 1 4 THR O O -6.383 6.792 3.512 1.00 . A A . 4 THR O 1 1 13 6125 1 1 4 THR OG1 O -8.494 8.678 3.628 1.00 . A A . 4 THR OG1 1 1 13 6126 1 1 5 GLY C C -3.768 7.338 3.229 1.00 . A A . 5 GLY C 1 1 13 6127 1 1 5 GLY CA C -4.125 6.680 1.910 1.00 . A A . 5 GLY CA 1 1 13 6128 1 1 5 GLY H H -5.633 7.179 0.510 1.00 . A A . 5 GLY H 1 1 13 6129 1 1 5 GLY HA2 H -4.040 5.610 2.024 1.00 . A A . 5 GLY HA2 1 1 13 6130 1 1 5 GLY HA3 H -3.423 7.006 1.158 1.00 . A A . 5 GLY HA3 1 1 13 6131 1 1 5 GLY N N -5.472 6.994 1.459 1.00 . A A . 5 GLY N 1 1 13 6132 1 1 5 GLY O O -3.046 6.759 4.042 1.00 . A A . 5 GLY O 1 1 13 6133 1 1 6 SER C C -2.492 9.370 4.927 1.00 . A A . 6 SER C 1 1 13 6134 1 1 6 SER CA C -3.997 9.279 4.677 1.00 . A A . 6 SER CA 1 1 13 6135 1 1 6 SER CB C -4.691 8.597 5.859 1.00 . A A . 6 SER CB 1 1 13 6136 1 1 6 SER H H -4.841 8.960 2.761 1.00 . A A . 6 SER H 1 1 13 6137 1 1 6 SER HA H -4.391 10.278 4.566 1.00 . A A . 6 SER HA 1 1 13 6138 1 1 6 SER HB2 H -4.136 7.713 6.138 1.00 . A A . 6 SER HB2 1 1 13 6139 1 1 6 SER HB3 H -4.725 9.278 6.696 1.00 . A A . 6 SER HB3 1 1 13 6140 1 1 6 SER HG H -6.187 7.333 5.857 1.00 . A A . 6 SER HG 1 1 13 6141 1 1 6 SER N N -4.272 8.549 3.445 1.00 . A A . 6 SER N 1 1 13 6142 1 1 6 SER O O -1.693 9.210 4.004 1.00 . A A . 6 SER O 1 1 13 6143 1 1 6 SER OG O -6.013 8.216 5.523 1.00 . A A . 6 SER OG 1 1 13 6144 1 1 7 LYS C C -0.296 8.645 7.527 1.00 . A A . 7 LYS C 1 1 13 6145 1 1 7 LYS CA C -0.699 9.729 6.530 1.00 . A A . 7 LYS CA 1 1 13 6146 1 1 7 LYS CB C -0.406 11.111 7.119 1.00 . A A . 7 LYS CB 1 1 13 6147 1 1 7 LYS CD C -2.127 12.945 7.174 1.00 . A A . 7 LYS CD 1 1 13 6148 1 1 7 LYS CE C -3.432 12.166 7.159 1.00 . A A . 7 LYS CE 1 1 13 6149 1 1 7 LYS CG C -1.054 12.252 6.349 1.00 . A A . 7 LYS CG 1 1 13 6150 1 1 7 LYS H H -2.788 9.740 6.870 1.00 . A A . 7 LYS H 1 1 13 6151 1 1 7 LYS HA H -0.120 9.604 5.628 1.00 . A A . 7 LYS HA 1 1 13 6152 1 1 7 LYS HB2 H -0.765 11.139 8.137 1.00 . A A . 7 LYS HB2 1 1 13 6153 1 1 7 LYS HB3 H 0.663 11.268 7.120 1.00 . A A . 7 LYS HB3 1 1 13 6154 1 1 7 LYS HD2 H -1.784 13.032 8.194 1.00 . A A . 7 LYS HD2 1 1 13 6155 1 1 7 LYS HD3 H -2.301 13.930 6.765 1.00 . A A . 7 LYS HD3 1 1 13 6156 1 1 7 LYS HE2 H -4.254 12.865 7.095 1.00 . A A . 7 LYS HE2 1 1 13 6157 1 1 7 LYS HE3 H -3.442 11.520 6.292 1.00 . A A . 7 LYS HE3 1 1 13 6158 1 1 7 LYS HG2 H -0.295 12.973 6.087 1.00 . A A . 7 LYS HG2 1 1 13 6159 1 1 7 LYS HG3 H -1.503 11.856 5.451 1.00 . A A . 7 LYS HG3 1 1 13 6160 1 1 7 LYS HZ1 H -4.271 10.563 8.204 1.00 . A A . 7 LYS HZ1 1 1 13 6161 1 1 7 LYS HZ2 H -3.962 11.920 9.164 1.00 . A A . 7 LYS HZ2 1 1 13 6162 1 1 7 LYS HZ3 H -2.685 10.930 8.667 1.00 . A A . 7 LYS HZ3 1 1 13 6163 1 1 7 LYS N N -2.108 9.622 6.174 1.00 . A A . 7 LYS N 1 1 13 6164 1 1 7 LYS NZ N -3.600 11.337 8.384 1.00 . A A . 7 LYS NZ 1 1 13 6165 1 1 7 LYS O O 0.759 8.732 8.154 1.00 . A A . 7 LYS O 1 1 13 6166 1 1 8 ASP C C -0.858 5.176 7.906 1.00 . A A . 8 ASP C 1 1 13 6167 1 1 8 ASP CA C -0.855 6.533 8.601 1.00 . A A . 8 ASP CA 1 1 13 6168 1 1 8 ASP CB C -1.865 6.535 9.749 1.00 . A A . 8 ASP CB 1 1 13 6169 1 1 8 ASP CG C -1.418 7.395 10.914 1.00 . A A . 8 ASP CG 1 1 13 6170 1 1 8 ASP H H -1.968 7.605 7.152 1.00 . A A . 8 ASP H 1 1 13 6171 1 1 8 ASP HA H 0.125 6.702 9.002 1.00 . A A . 8 ASP HA 1 1 13 6172 1 1 8 ASP HB2 H -2.810 6.914 9.388 1.00 . A A . 8 ASP HB2 1 1 13 6173 1 1 8 ASP HB3 H -2.000 5.523 10.104 1.00 . A A . 8 ASP HB3 1 1 13 6174 1 1 8 ASP N N -1.139 7.623 7.673 1.00 . A A . 8 ASP N 1 1 13 6175 1 1 8 ASP O O -0.392 4.183 8.464 1.00 . A A . 8 ASP O 1 1 13 6176 1 1 8 ASP OD1 O -0.194 7.487 11.148 1.00 . A A . 8 ASP OD1 1 1 13 6177 1 1 8 ASP OD2 O -2.290 7.976 11.593 1.00 . A A . 8 ASP OD2 1 1 13 6178 1 1 9 CYS C C -0.579 3.965 4.684 1.00 . A A . 9 CYS C 1 1 13 6179 1 1 9 CYS CA C -1.446 3.898 5.928 1.00 . A A . 9 CYS CA 1 1 13 6180 1 1 9 CYS CB C -2.880 3.595 5.544 1.00 . A A . 9 CYS CB 1 1 13 6181 1 1 9 CYS H H -1.741 5.955 6.303 1.00 . A A . 9 CYS H 1 1 13 6182 1 1 9 CYS HA H -1.088 3.112 6.551 1.00 . A A . 9 CYS HA 1 1 13 6183 1 1 9 CYS HB2 H -3.530 4.030 6.281 1.00 . A A . 9 CYS HB2 1 1 13 6184 1 1 9 CYS HB3 H -3.080 4.036 4.589 1.00 . A A . 9 CYS HB3 1 1 13 6185 1 1 9 CYS N N -1.384 5.136 6.692 1.00 . A A . 9 CYS N 1 1 13 6186 1 1 9 CYS O O 0.461 3.311 4.601 1.00 . A A . 9 CYS O 1 1 13 6187 1 1 9 CYS SG S -3.267 1.815 5.432 1.00 . A A . 9 CYS SG 1 1 13 6188 1 1 10 TYR C C 1.146 5.403 2.736 1.00 . A A . 10 TYR C 1 1 13 6189 1 1 10 TYR CA C -0.273 4.909 2.471 1.00 . A A . 10 TYR CA 1 1 13 6190 1 1 10 TYR CB C -1.000 5.878 1.536 1.00 . A A . 10 TYR CB 1 1 13 6191 1 1 10 TYR CD1 C -2.562 4.035 0.789 1.00 . A A . 10 TYR CD1 1 1 13 6192 1 1 10 TYR CD2 C -1.936 5.697 -0.803 1.00 . A A . 10 TYR CD2 1 1 13 6193 1 1 10 TYR CE1 C -3.336 3.406 -0.167 1.00 . A A . 10 TYR CE1 1 1 13 6194 1 1 10 TYR CE2 C -2.710 5.074 -1.763 1.00 . A A . 10 TYR CE2 1 1 13 6195 1 1 10 TYR CG C -1.848 5.190 0.488 1.00 . A A . 10 TYR CG 1 1 13 6196 1 1 10 TYR CZ C -3.408 3.930 -1.440 1.00 . A A . 10 TYR CZ 1 1 13 6197 1 1 10 TYR H H -1.848 5.254 3.838 1.00 . A A . 10 TYR H 1 1 13 6198 1 1 10 TYR HA H -0.221 3.940 2.000 1.00 . A A . 10 TYR HA 1 1 13 6199 1 1 10 TYR HB2 H -1.648 6.512 2.121 1.00 . A A . 10 TYR HB2 1 1 13 6200 1 1 10 TYR HB3 H -0.271 6.489 1.025 1.00 . A A . 10 TYR HB3 1 1 13 6201 1 1 10 TYR HD1 H -2.505 3.629 1.788 1.00 . A A . 10 TYR HD1 1 1 13 6202 1 1 10 TYR HD2 H -1.388 6.593 -1.052 1.00 . A A . 10 TYR HD2 1 1 13 6203 1 1 10 TYR HE1 H -3.884 2.510 0.087 1.00 . A A . 10 TYR HE1 1 1 13 6204 1 1 10 TYR HE2 H -2.765 5.483 -2.761 1.00 . A A . 10 TYR HE2 1 1 13 6205 1 1 10 TYR HH H -3.726 3.332 -3.240 1.00 . A A . 10 TYR HH 1 1 13 6206 1 1 10 TYR N N -1.012 4.759 3.714 1.00 . A A . 10 TYR N 1 1 13 6207 1 1 10 TYR O O 2.017 5.275 1.882 1.00 . A A . 10 TYR O 1 1 13 6208 1 1 10 TYR OH O -4.179 3.306 -2.394 1.00 . A A . 10 TYR OH 1 1 13 6209 1 1 11 ALA C C 3.694 5.354 4.515 1.00 . A A . 11 ALA C 1 1 13 6210 1 1 11 ALA CA C 2.696 6.485 4.267 1.00 . A A . 11 ALA CA 1 1 13 6211 1 1 11 ALA CB C 2.611 7.410 5.472 1.00 . A A . 11 ALA CB 1 1 13 6212 1 1 11 ALA H H 0.639 6.052 4.564 1.00 . A A . 11 ALA H 1 1 13 6213 1 1 11 ALA HA H 3.050 7.064 3.427 1.00 . A A . 11 ALA HA 1 1 13 6214 1 1 11 ALA HB1 H 1.780 7.114 6.095 1.00 . A A . 11 ALA HB1 1 1 13 6215 1 1 11 ALA HB2 H 2.466 8.426 5.137 1.00 . A A . 11 ALA HB2 1 1 13 6216 1 1 11 ALA HB3 H 3.528 7.346 6.040 1.00 . A A . 11 ALA HB3 1 1 13 6217 1 1 11 ALA N N 1.373 5.975 3.915 1.00 . A A . 11 ALA N 1 1 13 6218 1 1 11 ALA O O 4.619 5.149 3.725 1.00 . A A . 11 ALA O 1 1 13 6219 1 1 12 PRO C C 4.564 2.504 4.813 1.00 . A A . 12 PRO C 1 1 13 6220 1 1 12 PRO CA C 4.418 3.491 5.961 1.00 . A A . 12 PRO CA 1 1 13 6221 1 1 12 PRO CB C 3.738 2.821 7.166 1.00 . A A . 12 PRO CB 1 1 13 6222 1 1 12 PRO CD C 2.453 4.759 6.613 1.00 . A A . 12 PRO CD 1 1 13 6223 1 1 12 PRO CG C 2.357 3.389 7.214 1.00 . A A . 12 PRO CG 1 1 13 6224 1 1 12 PRO HA H 5.395 3.850 6.250 1.00 . A A . 12 PRO HA 1 1 13 6225 1 1 12 PRO HB2 H 3.718 1.751 7.021 1.00 . A A . 12 PRO HB2 1 1 13 6226 1 1 12 PRO HB3 H 4.288 3.054 8.065 1.00 . A A . 12 PRO HB3 1 1 13 6227 1 1 12 PRO HD2 H 1.521 5.033 6.141 1.00 . A A . 12 PRO HD2 1 1 13 6228 1 1 12 PRO HD3 H 2.728 5.486 7.364 1.00 . A A . 12 PRO HD3 1 1 13 6229 1 1 12 PRO HG2 H 1.686 2.772 6.633 1.00 . A A . 12 PRO HG2 1 1 13 6230 1 1 12 PRO HG3 H 2.020 3.450 8.237 1.00 . A A . 12 PRO HG3 1 1 13 6231 1 1 12 PRO N N 3.523 4.601 5.619 1.00 . A A . 12 PRO N 1 1 13 6232 1 1 12 PRO O O 5.547 1.766 4.736 1.00 . A A . 12 PRO O 1 1 13 6233 1 1 13 CYS C C 4.264 2.257 1.575 1.00 . A A . 13 CYS C 1 1 13 6234 1 1 13 CYS CA C 3.599 1.601 2.776 1.00 . A A . 13 CYS CA 1 1 13 6235 1 1 13 CYS CB C 2.187 1.171 2.423 1.00 . A A . 13 CYS CB 1 1 13 6236 1 1 13 CYS H H 2.824 3.106 4.037 1.00 . A A . 13 CYS H 1 1 13 6237 1 1 13 CYS HA H 4.159 0.732 3.046 1.00 . A A . 13 CYS HA 1 1 13 6238 1 1 13 CYS HB2 H 1.518 1.555 3.169 1.00 . A A . 13 CYS HB2 1 1 13 6239 1 1 13 CYS HB3 H 1.929 1.581 1.465 1.00 . A A . 13 CYS HB3 1 1 13 6240 1 1 13 CYS N N 3.581 2.495 3.921 1.00 . A A . 13 CYS N 1 1 13 6241 1 1 13 CYS O O 5.117 1.654 0.929 1.00 . A A . 13 CYS O 1 1 13 6242 1 1 13 CYS SG S 1.951 -0.634 2.343 1.00 . A A . 13 CYS SG 1 1 13 6243 1 1 14 ARG C C 5.961 4.149 0.196 1.00 . A A . 14 ARG C 1 1 13 6244 1 1 14 ARG CA C 4.445 4.209 0.143 1.00 . A A . 14 ARG CA 1 1 13 6245 1 1 14 ARG CB C 3.968 5.664 0.111 1.00 . A A . 14 ARG CB 1 1 13 6246 1 1 14 ARG CD C 3.705 7.564 -1.515 1.00 . A A . 14 ARG CD 1 1 13 6247 1 1 14 ARG CG C 4.647 6.509 -0.956 1.00 . A A . 14 ARG CG 1 1 13 6248 1 1 14 ARG CZ C 4.905 9.694 -1.211 1.00 . A A . 14 ARG CZ 1 1 13 6249 1 1 14 ARG H H 3.192 3.930 1.820 1.00 . A A . 14 ARG H 1 1 13 6250 1 1 14 ARG HA H 4.113 3.705 -0.749 1.00 . A A . 14 ARG HA 1 1 13 6251 1 1 14 ARG HB2 H 2.905 5.676 -0.078 1.00 . A A . 14 ARG HB2 1 1 13 6252 1 1 14 ARG HB3 H 4.160 6.115 1.073 1.00 . A A . 14 ARG HB3 1 1 13 6253 1 1 14 ARG HD2 H 3.876 7.653 -2.577 1.00 . A A . 14 ARG HD2 1 1 13 6254 1 1 14 ARG HD3 H 2.688 7.248 -1.339 1.00 . A A . 14 ARG HD3 1 1 13 6255 1 1 14 ARG HE H 3.279 9.141 -0.194 1.00 . A A . 14 ARG HE 1 1 13 6256 1 1 14 ARG HG2 H 5.505 7.000 -0.521 1.00 . A A . 14 ARG HG2 1 1 13 6257 1 1 14 ARG HG3 H 4.970 5.864 -1.761 1.00 . A A . 14 ARG HG3 1 1 13 6258 1 1 14 ARG HH11 H 5.701 8.478 -2.617 1.00 . A A . 14 ARG HH11 1 1 13 6259 1 1 14 ARG HH12 H 6.526 9.983 -2.385 1.00 . A A . 14 ARG HH12 1 1 13 6260 1 1 14 ARG HH21 H 4.363 11.122 0.113 1.00 . A A . 14 ARG HH21 1 1 13 6261 1 1 14 ARG HH22 H 5.767 11.484 -0.835 1.00 . A A . 14 ARG HH22 1 1 13 6262 1 1 14 ARG N N 3.873 3.494 1.275 1.00 . A A . 14 ARG N 1 1 13 6263 1 1 14 ARG NE N 3.913 8.868 -0.890 1.00 . A A . 14 ARG NE 1 1 13 6264 1 1 14 ARG NH1 N 5.783 9.357 -2.148 1.00 . A A . 14 ARG NH1 1 1 13 6265 1 1 14 ARG NH2 N 5.021 10.862 -0.594 1.00 . A A . 14 ARG NH2 1 1 13 6266 1 1 14 ARG O O 6.625 4.046 -0.834 1.00 . A A . 14 ARG O 1 1 13 6267 1 1 15 LYS C C 8.437 2.791 0.939 1.00 . A A . 15 LYS C 1 1 13 6268 1 1 15 LYS CA C 7.949 4.095 1.563 1.00 . A A . 15 LYS CA 1 1 13 6269 1 1 15 LYS CB C 8.330 4.154 3.044 1.00 . A A . 15 LYS CB 1 1 13 6270 1 1 15 LYS CD C 10.471 5.466 2.953 1.00 . A A . 15 LYS CD 1 1 13 6271 1 1 15 LYS CE C 11.437 5.059 4.053 1.00 . A A . 15 LYS CE 1 1 13 6272 1 1 15 LYS CG C 9.031 5.443 3.439 1.00 . A A . 15 LYS CG 1 1 13 6273 1 1 15 LYS H H 5.932 4.248 2.196 1.00 . A A . 15 LYS H 1 1 13 6274 1 1 15 LYS HA H 8.398 4.927 1.042 1.00 . A A . 15 LYS HA 1 1 13 6275 1 1 15 LYS HB2 H 7.434 4.060 3.638 1.00 . A A . 15 LYS HB2 1 1 13 6276 1 1 15 LYS HB3 H 8.989 3.328 3.270 1.00 . A A . 15 LYS HB3 1 1 13 6277 1 1 15 LYS HD2 H 10.573 4.781 2.126 1.00 . A A . 15 LYS HD2 1 1 13 6278 1 1 15 LYS HD3 H 10.714 6.467 2.625 1.00 . A A . 15 LYS HD3 1 1 13 6279 1 1 15 LYS HE2 H 10.969 5.234 5.010 1.00 . A A . 15 LYS HE2 1 1 13 6280 1 1 15 LYS HE3 H 11.659 4.006 3.948 1.00 . A A . 15 LYS HE3 1 1 13 6281 1 1 15 LYS HG2 H 8.501 6.278 3.005 1.00 . A A . 15 LYS HG2 1 1 13 6282 1 1 15 LYS HG3 H 9.024 5.530 4.517 1.00 . A A . 15 LYS HG3 1 1 13 6283 1 1 15 LYS HZ1 H 13.060 6.022 4.949 1.00 . A A . 15 LYS HZ1 1 1 13 6284 1 1 15 LYS HZ2 H 12.556 6.734 3.500 1.00 . A A . 15 LYS HZ2 1 1 13 6285 1 1 15 LYS HZ3 H 13.431 5.287 3.471 1.00 . A A . 15 LYS HZ3 1 1 13 6286 1 1 15 LYS N N 6.508 4.183 1.402 1.00 . A A . 15 LYS N 1 1 13 6287 1 1 15 LYS NZ N 12.710 5.829 3.989 1.00 . A A . 15 LYS NZ 1 1 13 6288 1 1 15 LYS O O 9.401 2.773 0.174 1.00 . A A . 15 LYS O 1 1 13 6289 1 1 16 GLN C C 7.726 0.266 -0.746 1.00 . A A . 16 GLN C 1 1 13 6290 1 1 16 GLN CA C 8.073 0.386 0.741 1.00 . A A . 16 GLN CA 1 1 13 6291 1 1 16 GLN CB C 7.339 -0.697 1.533 1.00 . A A . 16 GLN CB 1 1 13 6292 1 1 16 GLN CD C 7.859 -3.006 0.650 1.00 . A A . 16 GLN CD 1 1 13 6293 1 1 16 GLN CG C 8.149 -1.970 1.717 1.00 . A A . 16 GLN CG 1 1 13 6294 1 1 16 GLN H H 6.974 1.793 1.875 1.00 . A A . 16 GLN H 1 1 13 6295 1 1 16 GLN HA H 9.136 0.243 0.860 1.00 . A A . 16 GLN HA 1 1 13 6296 1 1 16 GLN HB2 H 7.093 -0.308 2.510 1.00 . A A . 16 GLN HB2 1 1 13 6297 1 1 16 GLN HB3 H 6.426 -0.949 1.014 1.00 . A A . 16 GLN HB3 1 1 13 6298 1 1 16 GLN HE21 H 5.991 -3.196 1.308 1.00 . A A . 16 GLN HE21 1 1 13 6299 1 1 16 GLN HE22 H 6.415 -4.186 -0.043 1.00 . A A . 16 GLN HE22 1 1 13 6300 1 1 16 GLN HG2 H 9.199 -1.722 1.678 1.00 . A A . 16 GLN HG2 1 1 13 6301 1 1 16 GLN HG3 H 7.916 -2.394 2.683 1.00 . A A . 16 GLN HG3 1 1 13 6302 1 1 16 GLN N N 7.743 1.703 1.268 1.00 . A A . 16 GLN N 1 1 13 6303 1 1 16 GLN NE2 N 6.631 -3.514 0.638 1.00 . A A . 16 GLN NE2 1 1 13 6304 1 1 16 GLN O O 8.599 0.017 -1.578 1.00 . A A . 16 GLN O 1 1 13 6305 1 1 16 GLN OE1 O 8.725 -3.346 -0.156 1.00 . A A . 16 GLN OE1 1 1 13 6306 1 1 17 THR C C 6.417 1.471 -3.308 1.00 . A A . 17 THR C 1 1 13 6307 1 1 17 THR CA C 5.965 0.300 -2.443 1.00 . A A . 17 THR CA 1 1 13 6308 1 1 17 THR CB C 4.436 0.179 -2.460 1.00 . A A . 17 THR CB 1 1 13 6309 1 1 17 THR CG2 C 3.721 1.437 -2.017 1.00 . A A . 17 THR CG2 1 1 13 6310 1 1 17 THR H H 5.789 0.603 -0.357 1.00 . A A . 17 THR H 1 1 13 6311 1 1 17 THR HA H 6.384 -0.601 -2.851 1.00 . A A . 17 THR HA 1 1 13 6312 1 1 17 THR HB H 4.144 -0.617 -1.788 1.00 . A A . 17 THR HB 1 1 13 6313 1 1 17 THR HG1 H 3.075 -0.494 -3.696 1.00 . A A . 17 THR HG1 1 1 13 6314 1 1 17 THR HG21 H 4.112 1.756 -1.063 1.00 . A A . 17 THR HG21 1 1 13 6315 1 1 17 THR HG22 H 2.665 1.237 -1.925 1.00 . A A . 17 THR HG22 1 1 13 6316 1 1 17 THR HG23 H 3.878 2.217 -2.749 1.00 . A A . 17 THR HG23 1 1 13 6317 1 1 17 THR N N 6.440 0.418 -1.066 1.00 . A A . 17 THR N 1 1 13 6318 1 1 17 THR O O 6.976 1.282 -4.388 1.00 . A A . 17 THR O 1 1 13 6319 1 1 17 THR OG1 O 3.968 -0.143 -3.755 1.00 . A A . 17 THR OG1 1 1 13 6320 1 1 18 GLY C C 5.882 3.946 -4.918 1.00 . A A . 18 GLY C 1 1 13 6321 1 1 18 GLY CA C 6.535 3.871 -3.562 1.00 . A A . 18 GLY CA 1 1 13 6322 1 1 18 GLY H H 5.714 2.755 -1.964 1.00 . A A . 18 GLY H 1 1 13 6323 1 1 18 GLY HA2 H 6.235 4.735 -2.989 1.00 . A A . 18 GLY HA2 1 1 13 6324 1 1 18 GLY HA3 H 7.590 3.898 -3.689 1.00 . A A . 18 GLY HA3 1 1 13 6325 1 1 18 GLY N N 6.164 2.675 -2.828 1.00 . A A . 18 GLY N 1 1 13 6326 1 1 18 GLY O O 6.376 3.390 -5.900 1.00 . A A . 18 GLY O 1 1 13 6327 1 1 19 CYS C C 2.529 5.197 -5.787 1.00 . A A . 19 CYS C 1 1 13 6328 1 1 19 CYS CA C 3.984 4.900 -6.146 1.00 . A A . 19 CYS CA 1 1 13 6329 1 1 19 CYS CB C 4.063 3.759 -7.140 1.00 . A A . 19 CYS CB 1 1 13 6330 1 1 19 CYS H H 4.500 5.083 -4.124 1.00 . A A . 19 CYS H 1 1 13 6331 1 1 19 CYS HA H 4.395 5.759 -6.618 1.00 . A A . 19 CYS HA 1 1 13 6332 1 1 19 CYS HB2 H 3.274 3.882 -7.858 1.00 . A A . 19 CYS HB2 1 1 13 6333 1 1 19 CYS HB3 H 5.008 3.838 -7.645 1.00 . A A . 19 CYS HB3 1 1 13 6334 1 1 19 CYS N N 4.779 4.666 -4.949 1.00 . A A . 19 CYS N 1 1 13 6335 1 1 19 CYS O O 2.050 4.799 -4.725 1.00 . A A . 19 CYS O 1 1 13 6336 1 1 19 CYS SG S 3.928 2.080 -6.440 1.00 . A A . 19 CYS SG 1 1 13 6337 1 1 20 PRO C C -0.547 5.107 -6.368 1.00 . A A . 20 PRO C 1 1 13 6338 1 1 20 PRO CA C 0.407 6.299 -6.426 1.00 . A A . 20 PRO CA 1 1 13 6339 1 1 20 PRO CB C 0.067 7.192 -7.626 1.00 . A A . 20 PRO CB 1 1 13 6340 1 1 20 PRO CD C 2.314 6.456 -7.941 1.00 . A A . 20 PRO CD 1 1 13 6341 1 1 20 PRO CG C 1.057 6.822 -8.674 1.00 . A A . 20 PRO CG 1 1 13 6342 1 1 20 PRO HA H 0.307 6.873 -5.517 1.00 . A A . 20 PRO HA 1 1 13 6343 1 1 20 PRO HB2 H -0.945 6.992 -7.949 1.00 . A A . 20 PRO HB2 1 1 13 6344 1 1 20 PRO HB3 H 0.162 8.230 -7.344 1.00 . A A . 20 PRO HB3 1 1 13 6345 1 1 20 PRO HD2 H 2.863 5.702 -8.485 1.00 . A A . 20 PRO HD2 1 1 13 6346 1 1 20 PRO HD3 H 2.927 7.330 -7.780 1.00 . A A . 20 PRO HD3 1 1 13 6347 1 1 20 PRO HG2 H 0.693 5.978 -9.243 1.00 . A A . 20 PRO HG2 1 1 13 6348 1 1 20 PRO HG3 H 1.235 7.665 -9.327 1.00 . A A . 20 PRO HG3 1 1 13 6349 1 1 20 PRO N N 1.810 5.923 -6.663 1.00 . A A . 20 PRO N 1 1 13 6350 1 1 20 PRO O O -1.674 5.235 -5.891 1.00 . A A . 20 PRO O 1 1 13 6351 1 1 21 TYR C C -1.137 2.230 -5.454 1.00 . A A . 21 TYR C 1 1 13 6352 1 1 21 TYR CA C -0.928 2.767 -6.868 1.00 . A A . 21 TYR CA 1 1 13 6353 1 1 21 TYR CB C -0.277 1.700 -7.744 1.00 . A A . 21 TYR CB 1 1 13 6354 1 1 21 TYR CD1 C 0.364 3.286 -9.605 1.00 . A A . 21 TYR CD1 1 1 13 6355 1 1 21 TYR CD2 C 1.972 1.674 -8.898 1.00 . A A . 21 TYR CD2 1 1 13 6356 1 1 21 TYR CE1 C 1.258 3.771 -10.541 1.00 . A A . 21 TYR CE1 1 1 13 6357 1 1 21 TYR CE2 C 2.870 2.155 -9.832 1.00 . A A . 21 TYR CE2 1 1 13 6358 1 1 21 TYR CG C 0.706 2.231 -8.768 1.00 . A A . 21 TYR CG 1 1 13 6359 1 1 21 TYR CZ C 2.508 3.203 -10.651 1.00 . A A . 21 TYR CZ 1 1 13 6360 1 1 21 TYR H H 0.787 3.898 -7.240 1.00 . A A . 21 TYR H 1 1 13 6361 1 1 21 TYR HA H -1.887 3.028 -7.288 1.00 . A A . 21 TYR HA 1 1 13 6362 1 1 21 TYR HB2 H 0.247 1.002 -7.115 1.00 . A A . 21 TYR HB2 1 1 13 6363 1 1 21 TYR HB3 H -1.045 1.191 -8.272 1.00 . A A . 21 TYR HB3 1 1 13 6364 1 1 21 TYR HD1 H -0.615 3.731 -9.516 1.00 . A A . 21 TYR HD1 1 1 13 6365 1 1 21 TYR HD2 H 2.253 0.853 -8.255 1.00 . A A . 21 TYR HD2 1 1 13 6366 1 1 21 TYR HE1 H 0.974 4.593 -11.183 1.00 . A A . 21 TYR HE1 1 1 13 6367 1 1 21 TYR HE2 H 3.850 1.708 -9.918 1.00 . A A . 21 TYR HE2 1 1 13 6368 1 1 21 TYR HH H 4.283 3.695 -11.205 1.00 . A A . 21 TYR HH 1 1 13 6369 1 1 21 TYR N N -0.106 3.956 -6.861 1.00 . A A . 21 TYR N 1 1 13 6370 1 1 21 TYR O O -0.409 2.588 -4.528 1.00 . A A . 21 TYR O 1 1 13 6371 1 1 21 TYR OH O 3.400 3.683 -11.583 1.00 . A A . 21 TYR OH 1 1 13 6372 1 1 22 GLY C C -3.410 -0.364 -4.072 1.00 . A A . 22 GLY C 1 1 13 6373 1 1 22 GLY CA C -2.426 0.787 -3.996 1.00 . A A . 22 GLY CA 1 1 13 6374 1 1 22 GLY H H -2.680 1.116 -6.074 1.00 . A A . 22 GLY H 1 1 13 6375 1 1 22 GLY HA2 H -1.511 0.430 -3.570 1.00 . A A . 22 GLY HA2 1 1 13 6376 1 1 22 GLY HA3 H -2.826 1.550 -3.352 1.00 . A A . 22 GLY HA3 1 1 13 6377 1 1 22 GLY N N -2.137 1.366 -5.298 1.00 . A A . 22 GLY N 1 1 13 6378 1 1 22 GLY O O -4.267 -0.395 -4.954 1.00 . A A . 22 GLY O 1 1 13 6379 1 1 23 LYS C C -5.305 -2.237 -2.082 1.00 . A A . 23 LYS C 1 1 13 6380 1 1 23 LYS CA C -4.201 -2.455 -3.111 1.00 . A A . 23 LYS CA 1 1 13 6381 1 1 23 LYS CB C -3.428 -3.737 -2.789 1.00 . A A . 23 LYS CB 1 1 13 6382 1 1 23 LYS CD C -3.800 -6.222 -2.752 1.00 . A A . 23 LYS CD 1 1 13 6383 1 1 23 LYS CE C -2.356 -6.680 -2.621 1.00 . A A . 23 LYS CE 1 1 13 6384 1 1 23 LYS CG C -3.907 -4.947 -3.574 1.00 . A A . 23 LYS CG 1 1 13 6385 1 1 23 LYS H H -2.610 -1.234 -2.452 1.00 . A A . 23 LYS H 1 1 13 6386 1 1 23 LYS HA H -4.645 -2.547 -4.088 1.00 . A A . 23 LYS HA 1 1 13 6387 1 1 23 LYS HB2 H -2.383 -3.579 -3.013 1.00 . A A . 23 LYS HB2 1 1 13 6388 1 1 23 LYS HB3 H -3.533 -3.953 -1.737 1.00 . A A . 23 LYS HB3 1 1 13 6389 1 1 23 LYS HD2 H -4.199 -6.037 -1.766 1.00 . A A . 23 LYS HD2 1 1 13 6390 1 1 23 LYS HD3 H -4.373 -6.999 -3.235 1.00 . A A . 23 LYS HD3 1 1 13 6391 1 1 23 LYS HE2 H -2.104 -7.285 -3.480 1.00 . A A . 23 LYS HE2 1 1 13 6392 1 1 23 LYS HE3 H -1.717 -5.810 -2.594 1.00 . A A . 23 LYS HE3 1 1 13 6393 1 1 23 LYS HG2 H -4.938 -4.798 -3.855 1.00 . A A . 23 LYS HG2 1 1 13 6394 1 1 23 LYS HG3 H -3.301 -5.050 -4.463 1.00 . A A . 23 LYS HG3 1 1 13 6395 1 1 23 LYS HZ1 H -1.266 -8.042 -1.471 1.00 . A A . 23 LYS HZ1 1 1 13 6396 1 1 23 LYS HZ2 H -2.939 -8.124 -1.229 1.00 . A A . 23 LYS HZ2 1 1 13 6397 1 1 23 LYS HZ3 H -2.050 -6.850 -0.561 1.00 . A A . 23 LYS HZ3 1 1 13 6398 1 1 23 LYS N N -3.299 -1.312 -3.139 1.00 . A A . 23 LYS N 1 1 13 6399 1 1 23 LYS NZ N -2.138 -7.480 -1.384 1.00 . A A . 23 LYS NZ 1 1 13 6400 1 1 23 LYS O O -6.003 -3.173 -1.694 1.00 . A A . 23 LYS O 1 1 13 6401 1 1 24 CYS C C -7.860 -0.970 -1.159 1.00 . A A . 24 CYS C 1 1 13 6402 1 1 24 CYS CA C -6.458 -0.633 -0.656 1.00 . A A . 24 CYS CA 1 1 13 6403 1 1 24 CYS CB C -6.337 0.860 -0.311 1.00 . A A . 24 CYS CB 1 1 13 6404 1 1 24 CYS H H -4.860 -0.289 -1.989 1.00 . A A . 24 CYS H 1 1 13 6405 1 1 24 CYS HA H -6.264 -1.212 0.235 1.00 . A A . 24 CYS HA 1 1 13 6406 1 1 24 CYS HB2 H -5.729 0.964 0.575 1.00 . A A . 24 CYS HB2 1 1 13 6407 1 1 24 CYS HB3 H -5.849 1.369 -1.128 1.00 . A A . 24 CYS HB3 1 1 13 6408 1 1 24 CYS N N -5.450 -0.990 -1.643 1.00 . A A . 24 CYS N 1 1 13 6409 1 1 24 CYS O O -8.313 -0.447 -2.178 1.00 . A A . 24 CYS O 1 1 13 6410 1 1 24 CYS SG S -7.921 1.712 0.015 1.00 . A A . 24 CYS SG 1 1 13 6411 1 1 25 MET C C -10.799 -2.050 0.439 1.00 . A A . 25 MET C 1 1 13 6412 1 1 25 MET CA C -9.897 -2.249 -0.761 1.00 . A A . 25 MET CA 1 1 13 6413 1 1 25 MET CB C -9.922 -3.713 -1.204 1.00 . A A . 25 MET CB 1 1 13 6414 1 1 25 MET CE C -10.360 -6.711 -2.413 1.00 . A A . 25 MET CE 1 1 13 6415 1 1 25 MET CG C -11.042 -4.035 -2.179 1.00 . A A . 25 MET CG 1 1 13 6416 1 1 25 MET H H -8.122 -2.206 0.385 1.00 . A A . 25 MET H 1 1 13 6417 1 1 25 MET HA H -10.258 -1.626 -1.565 1.00 . A A . 25 MET HA 1 1 13 6418 1 1 25 MET HB2 H -8.981 -3.950 -1.678 1.00 . A A . 25 MET HB2 1 1 13 6419 1 1 25 MET HB3 H -10.043 -4.339 -0.331 1.00 . A A . 25 MET HB3 1 1 13 6420 1 1 25 MET HE1 H -9.604 -6.101 -2.886 1.00 . A A . 25 MET HE1 1 1 13 6421 1 1 25 MET HE2 H -10.705 -7.461 -3.109 1.00 . A A . 25 MET HE2 1 1 13 6422 1 1 25 MET HE3 H -9.943 -7.193 -1.542 1.00 . A A . 25 MET HE3 1 1 13 6423 1 1 25 MET HG2 H -11.828 -3.304 -2.058 1.00 . A A . 25 MET HG2 1 1 13 6424 1 1 25 MET HG3 H -10.653 -3.978 -3.185 1.00 . A A . 25 MET HG3 1 1 13 6425 1 1 25 MET N N -8.540 -1.838 -0.423 1.00 . A A . 25 MET N 1 1 13 6426 1 1 25 MET O O -10.369 -2.189 1.592 1.00 . A A . 25 MET O 1 1 13 6427 1 1 25 MET SD S -11.738 -5.678 -1.921 1.00 . A A . 25 MET SD 1 1 13 6428 1 1 26 ASN C C -12.341 -0.426 2.204 1.00 . A A . 26 ASN C 1 1 13 6429 1 1 26 ASN CA C -12.938 -1.469 1.315 1.00 . A A . 26 ASN CA 1 1 13 6430 1 1 26 ASN CB C -13.134 -2.778 2.095 1.00 . A A . 26 ASN CB 1 1 13 6431 1 1 26 ASN CG C -13.386 -3.964 1.183 1.00 . A A . 26 ASN CG 1 1 13 6432 1 1 26 ASN H H -12.353 -1.568 -0.728 1.00 . A A . 26 ASN H 1 1 13 6433 1 1 26 ASN HA H -13.892 -1.110 1.002 1.00 . A A . 26 ASN HA 1 1 13 6434 1 1 26 ASN HB2 H -12.246 -2.978 2.676 1.00 . A A . 26 ASN HB2 1 1 13 6435 1 1 26 ASN HB3 H -13.978 -2.671 2.759 1.00 . A A . 26 ASN HB3 1 1 13 6436 1 1 26 ASN HD21 H -12.446 -5.171 2.453 1.00 . A A . 26 ASN HD21 1 1 13 6437 1 1 26 ASN HD22 H -13.069 -5.920 1.027 1.00 . A A . 26 ASN HD22 1 1 13 6438 1 1 26 ASN N N -12.048 -1.694 0.195 1.00 . A A . 26 ASN N 1 1 13 6439 1 1 26 ASN ND2 N -12.920 -5.137 1.597 1.00 . A A . 26 ASN ND2 1 1 13 6440 1 1 26 ASN O O -11.340 0.215 1.882 1.00 . A A . 26 ASN O 1 1 13 6441 1 1 26 ASN OD1 O -13.994 -3.828 0.122 1.00 . A A . 26 ASN OD1 1 1 13 6442 1 1 27 ARG C C -11.184 0.114 4.931 1.00 . A A . 27 ARG C 1 1 13 6443 1 1 27 ARG CA C -12.491 0.618 4.351 1.00 . A A . 27 ARG CA 1 1 13 6444 1 1 27 ARG CB C -13.544 0.802 5.445 1.00 . A A . 27 ARG CB 1 1 13 6445 1 1 27 ARG CD C -13.630 2.619 7.182 1.00 . A A . 27 ARG CD 1 1 13 6446 1 1 27 ARG CG C -13.877 2.259 5.726 1.00 . A A . 27 ARG CG 1 1 13 6447 1 1 27 ARG CZ C -15.927 2.574 8.077 1.00 . A A . 27 ARG CZ 1 1 13 6448 1 1 27 ARG H H -13.695 -0.886 3.482 1.00 . A A . 27 ARG H 1 1 13 6449 1 1 27 ARG HA H -12.300 1.550 3.868 1.00 . A A . 27 ARG HA 1 1 13 6450 1 1 27 ARG HB2 H -14.452 0.299 5.142 1.00 . A A . 27 ARG HB2 1 1 13 6451 1 1 27 ARG HB3 H -13.182 0.353 6.358 1.00 . A A . 27 ARG HB3 1 1 13 6452 1 1 27 ARG HD2 H -12.683 2.201 7.487 1.00 . A A . 27 ARG HD2 1 1 13 6453 1 1 27 ARG HD3 H -13.594 3.695 7.271 1.00 . A A . 27 ARG HD3 1 1 13 6454 1 1 27 ARG HE H -14.445 1.372 8.664 1.00 . A A . 27 ARG HE 1 1 13 6455 1 1 27 ARG HG2 H -13.258 2.886 5.101 1.00 . A A . 27 ARG HG2 1 1 13 6456 1 1 27 ARG HG3 H -14.916 2.431 5.491 1.00 . A A . 27 ARG HG3 1 1 13 6457 1 1 27 ARG HH11 H -15.613 3.966 6.643 1.00 . A A . 27 ARG HH11 1 1 13 6458 1 1 27 ARG HH12 H -17.220 3.913 7.288 1.00 . A A . 27 ARG HH12 1 1 13 6459 1 1 27 ARG HH21 H -16.557 1.302 9.515 1.00 . A A . 27 ARG HH21 1 1 13 6460 1 1 27 ARG HH22 H -17.755 2.401 8.919 1.00 . A A . 27 ARG HH22 1 1 13 6461 1 1 27 ARG N N -12.945 -0.307 3.331 1.00 . A A . 27 ARG N 1 1 13 6462 1 1 27 ARG NE N -14.681 2.105 8.058 1.00 . A A . 27 ARG NE 1 1 13 6463 1 1 27 ARG NH1 N -16.282 3.566 7.270 1.00 . A A . 27 ARG NH1 1 1 13 6464 1 1 27 ARG NH2 N -16.819 2.050 8.905 1.00 . A A . 27 ARG NH2 1 1 13 6465 1 1 27 ARG O O -10.677 0.621 5.932 1.00 . A A . 27 ARG O 1 1 13 6466 1 1 28 LYS C C -8.290 -1.194 3.629 1.00 . A A . 28 LYS C 1 1 13 6467 1 1 28 LYS CA C -9.386 -1.510 4.649 1.00 . A A . 28 LYS CA 1 1 13 6468 1 1 28 LYS CB C -9.555 -3.025 4.781 1.00 . A A . 28 LYS CB 1 1 13 6469 1 1 28 LYS CD C -7.324 -3.864 5.578 1.00 . A A . 28 LYS CD 1 1 13 6470 1 1 28 LYS CE C -6.485 -4.174 6.806 1.00 . A A . 28 LYS CE 1 1 13 6471 1 1 28 LYS CG C -8.779 -3.624 5.943 1.00 . A A . 28 LYS CG 1 1 13 6472 1 1 28 LYS H H -11.135 -1.221 3.466 1.00 . A A . 28 LYS H 1 1 13 6473 1 1 28 LYS HA H -9.098 -1.104 5.607 1.00 . A A . 28 LYS HA 1 1 13 6474 1 1 28 LYS HB2 H -10.603 -3.248 4.923 1.00 . A A . 28 LYS HB2 1 1 13 6475 1 1 28 LYS HB3 H -9.216 -3.495 3.870 1.00 . A A . 28 LYS HB3 1 1 13 6476 1 1 28 LYS HD2 H -7.267 -4.699 4.894 1.00 . A A . 28 LYS HD2 1 1 13 6477 1 1 28 LYS HD3 H -6.933 -2.978 5.098 1.00 . A A . 28 LYS HD3 1 1 13 6478 1 1 28 LYS HE2 H -6.703 -3.444 7.570 1.00 . A A . 28 LYS HE2 1 1 13 6479 1 1 28 LYS HE3 H -6.746 -5.159 7.165 1.00 . A A . 28 LYS HE3 1 1 13 6480 1 1 28 LYS HG2 H -8.822 -2.944 6.781 1.00 . A A . 28 LYS HG2 1 1 13 6481 1 1 28 LYS HG3 H -9.233 -4.565 6.219 1.00 . A A . 28 LYS HG3 1 1 13 6482 1 1 28 LYS HZ1 H -4.781 -3.248 6.029 1.00 . A A . 28 LYS HZ1 1 1 13 6483 1 1 28 LYS HZ2 H -4.770 -4.933 5.884 1.00 . A A . 28 LYS HZ2 1 1 13 6484 1 1 28 LYS HZ3 H -4.478 -4.212 7.386 1.00 . A A . 28 LYS HZ3 1 1 13 6485 1 1 28 LYS N N -10.651 -0.892 4.261 1.00 . A A . 28 LYS N 1 1 13 6486 1 1 28 LYS NZ N -5.026 -4.139 6.505 1.00 . A A . 28 LYS NZ 1 1 13 6487 1 1 28 LYS O O -8.247 -1.777 2.545 1.00 . A A . 28 LYS O 1 1 13 6488 1 1 29 CYS C C -5.292 -0.973 2.953 1.00 . A A . 29 CYS C 1 1 13 6489 1 1 29 CYS CA C -6.324 0.139 3.100 1.00 . A A . 29 CYS CA 1 1 13 6490 1 1 29 CYS CB C -5.690 1.426 3.643 1.00 . A A . 29 CYS CB 1 1 13 6491 1 1 29 CYS H H -7.494 0.176 4.848 1.00 . A A . 29 CYS H 1 1 13 6492 1 1 29 CYS HA H -6.751 0.345 2.134 1.00 . A A . 29 CYS HA 1 1 13 6493 1 1 29 CYS HB2 H -6.112 2.259 3.115 1.00 . A A . 29 CYS HB2 1 1 13 6494 1 1 29 CYS HB3 H -5.943 1.511 4.682 1.00 . A A . 29 CYS HB3 1 1 13 6495 1 1 29 CYS N N -7.408 -0.262 3.980 1.00 . A A . 29 CYS N 1 1 13 6496 1 1 29 CYS O O -5.269 -1.925 3.733 1.00 . A A . 29 CYS O 1 1 13 6497 1 1 29 CYS SG S -3.872 1.559 3.508 1.00 . A A . 29 CYS SG 1 1 13 6498 1 1 30 LYS C C -2.674 -1.518 0.370 1.00 . A A . 30 LYS C 1 1 13 6499 1 1 30 LYS CA C -3.399 -1.823 1.675 1.00 . A A . 30 LYS CA 1 1 13 6500 1 1 30 LYS CB C -3.991 -3.236 1.627 1.00 . A A . 30 LYS CB 1 1 13 6501 1 1 30 LYS CD C -4.899 -4.954 3.221 1.00 . A A . 30 LYS CD 1 1 13 6502 1 1 30 LYS CE C -4.430 -6.298 3.752 1.00 . A A . 30 LYS CE 1 1 13 6503 1 1 30 LYS CG C -3.725 -4.048 2.884 1.00 . A A . 30 LYS CG 1 1 13 6504 1 1 30 LYS H H -4.514 -0.052 1.365 1.00 . A A . 30 LYS H 1 1 13 6505 1 1 30 LYS HA H -2.683 -1.770 2.481 1.00 . A A . 30 LYS HA 1 1 13 6506 1 1 30 LYS HB2 H -5.060 -3.161 1.493 1.00 . A A . 30 LYS HB2 1 1 13 6507 1 1 30 LYS HB3 H -3.567 -3.765 0.786 1.00 . A A . 30 LYS HB3 1 1 13 6508 1 1 30 LYS HD2 H -5.508 -4.473 3.973 1.00 . A A . 30 LYS HD2 1 1 13 6509 1 1 30 LYS HD3 H -5.485 -5.113 2.328 1.00 . A A . 30 LYS HD3 1 1 13 6510 1 1 30 LYS HE2 H -3.764 -6.131 4.584 1.00 . A A . 30 LYS HE2 1 1 13 6511 1 1 30 LYS HE3 H -5.292 -6.859 4.088 1.00 . A A . 30 LYS HE3 1 1 13 6512 1 1 30 LYS HG2 H -2.847 -4.657 2.728 1.00 . A A . 30 LYS HG2 1 1 13 6513 1 1 30 LYS HG3 H -3.555 -3.372 3.709 1.00 . A A . 30 LYS HG3 1 1 13 6514 1 1 30 LYS HZ1 H -4.369 -7.756 2.256 1.00 . A A . 30 LYS HZ1 1 1 13 6515 1 1 30 LYS HZ2 H -2.935 -7.624 3.143 1.00 . A A . 30 LYS HZ2 1 1 13 6516 1 1 30 LYS HZ3 H -3.324 -6.452 1.987 1.00 . A A . 30 LYS HZ3 1 1 13 6517 1 1 30 LYS N N -4.441 -0.838 1.942 1.00 . A A . 30 LYS N 1 1 13 6518 1 1 30 LYS NZ N -3.715 -7.088 2.712 1.00 . A A . 30 LYS NZ 1 1 13 6519 1 1 30 LYS O O -3.026 -2.038 -0.685 1.00 . A A . 30 LYS O 1 1 13 6520 1 1 31 CYS C C -0.595 -1.402 -1.659 1.00 . A A . 31 CYS C 1 1 13 6521 1 1 31 CYS CA C -0.828 -0.268 -0.677 1.00 . A A . 31 CYS CA 1 1 13 6522 1 1 31 CYS CB C 0.515 0.274 -0.179 1.00 . A A . 31 CYS CB 1 1 13 6523 1 1 31 CYS H H -1.446 -0.304 1.352 1.00 . A A . 31 CYS H 1 1 13 6524 1 1 31 CYS HA H -1.334 0.521 -1.211 1.00 . A A . 31 CYS HA 1 1 13 6525 1 1 31 CYS HB2 H 0.984 0.834 -0.974 1.00 . A A . 31 CYS HB2 1 1 13 6526 1 1 31 CYS HB3 H 0.337 0.933 0.657 1.00 . A A . 31 CYS HB3 1 1 13 6527 1 1 31 CYS N N -1.655 -0.672 0.469 1.00 . A A . 31 CYS N 1 1 13 6528 1 1 31 CYS O O -0.891 -2.562 -1.396 1.00 . A A . 31 CYS O 1 1 13 6529 1 1 31 CYS SG S 1.696 -1.007 0.365 1.00 . A A . 31 CYS SG 1 1 13 6530 1 1 32 ASN C C 1.588 -2.516 -3.806 1.00 . A A . 32 ASN C 1 1 13 6531 1 1 32 ASN CA C 0.175 -1.958 -3.890 1.00 . A A . 32 ASN CA 1 1 13 6532 1 1 32 ASN CB C -0.005 -1.241 -5.209 1.00 . A A . 32 ASN CB 1 1 13 6533 1 1 32 ASN CG C -0.439 -2.160 -6.333 1.00 . A A . 32 ASN CG 1 1 13 6534 1 1 32 ASN H H 0.074 -0.071 -2.963 1.00 . A A . 32 ASN H 1 1 13 6535 1 1 32 ASN HA H -0.527 -2.766 -3.834 1.00 . A A . 32 ASN HA 1 1 13 6536 1 1 32 ASN HB2 H -0.744 -0.476 -5.084 1.00 . A A . 32 ASN HB2 1 1 13 6537 1 1 32 ASN HB3 H 0.927 -0.786 -5.473 1.00 . A A . 32 ASN HB3 1 1 13 6538 1 1 32 ASN HD21 H 1.150 -1.639 -7.409 1.00 . A A . 32 ASN HD21 1 1 13 6539 1 1 32 ASN HD22 H 0.088 -2.784 -8.146 1.00 . A A . 32 ASN HD22 1 1 13 6540 1 1 32 ASN N N -0.095 -1.025 -2.815 1.00 . A A . 32 ASN N 1 1 13 6541 1 1 32 ASN ND2 N 0.346 -2.198 -7.404 1.00 . A A . 32 ASN ND2 1 1 13 6542 1 1 32 ASN O O 2.370 -2.147 -2.929 1.00 . A A . 32 ASN O 1 1 13 6543 1 1 32 ASN OD1 O -1.469 -2.829 -6.241 1.00 . A A . 32 ASN OD1 1 1 13 6544 1 1 33 ARG C C 3.997 -3.425 -5.996 1.00 . A A . 33 ARG C 1 1 13 6545 1 1 33 ARG CA C 3.226 -4.003 -4.818 1.00 . A A . 33 ARG CA 1 1 13 6546 1 1 33 ARG CB C 3.111 -5.523 -4.954 1.00 . A A . 33 ARG CB 1 1 13 6547 1 1 33 ARG CD C 5.562 -6.064 -4.845 1.00 . A A . 33 ARG CD 1 1 13 6548 1 1 33 ARG CG C 4.198 -6.284 -4.213 1.00 . A A . 33 ARG CG 1 1 13 6549 1 1 33 ARG CZ C 5.931 -8.124 -6.146 1.00 . A A . 33 ARG CZ 1 1 13 6550 1 1 33 ARG H H 1.232 -3.625 -5.417 1.00 . A A . 33 ARG H 1 1 13 6551 1 1 33 ARG HA H 3.755 -3.764 -3.907 1.00 . A A . 33 ARG HA 1 1 13 6552 1 1 33 ARG HB2 H 2.152 -5.837 -4.567 1.00 . A A . 33 ARG HB2 1 1 13 6553 1 1 33 ARG HB3 H 3.168 -5.784 -6.001 1.00 . A A . 33 ARG HB3 1 1 13 6554 1 1 33 ARG HD2 H 5.683 -5.011 -5.052 1.00 . A A . 33 ARG HD2 1 1 13 6555 1 1 33 ARG HD3 H 6.323 -6.383 -4.148 1.00 . A A . 33 ARG HD3 1 1 13 6556 1 1 33 ARG HE H 5.656 -6.310 -6.930 1.00 . A A . 33 ARG HE 1 1 13 6557 1 1 33 ARG HG2 H 4.227 -5.944 -3.189 1.00 . A A . 33 ARG HG2 1 1 13 6558 1 1 33 ARG HG3 H 3.964 -7.339 -4.238 1.00 . A A . 33 ARG HG3 1 1 13 6559 1 1 33 ARG HH11 H 5.923 -8.389 -4.140 1.00 . A A . 33 ARG HH11 1 1 13 6560 1 1 33 ARG HH12 H 6.179 -9.823 -5.077 1.00 . A A . 33 ARG HH12 1 1 13 6561 1 1 33 ARG HH21 H 5.994 -8.194 -8.164 1.00 . A A . 33 ARG HH21 1 1 13 6562 1 1 33 ARG HH22 H 6.221 -9.712 -7.361 1.00 . A A . 33 ARG HH22 1 1 13 6563 1 1 33 ARG N N 1.906 -3.393 -4.745 1.00 . A A . 33 ARG N 1 1 13 6564 1 1 33 ARG NE N 5.716 -6.812 -6.091 1.00 . A A . 33 ARG NE 1 1 13 6565 1 1 33 ARG NH1 N 6.018 -8.837 -5.029 1.00 . A A . 33 ARG NH1 1 1 13 6566 1 1 33 ARG NH2 N 6.059 -8.726 -7.321 1.00 . A A . 33 ARG NH2 1 1 13 6567 1 1 33 ARG O O 3.909 -3.923 -7.118 1.00 . A A . 33 ARG O 1 1 13 6568 1 1 34 CYS C C 6.795 -2.444 -7.072 1.00 . A A . 34 CYS C 1 1 13 6569 1 1 34 CYS CA C 5.511 -1.685 -6.751 1.00 . A A . 34 CYS CA 1 1 13 6570 1 1 34 CYS CB C 5.825 -0.282 -6.280 1.00 . A A . 34 CYS CB 1 1 13 6571 1 1 34 CYS H H 4.755 -2.004 -4.818 1.00 . A A . 34 CYS H 1 1 13 6572 1 1 34 CYS HA H 4.912 -1.617 -7.633 1.00 . A A . 34 CYS HA 1 1 13 6573 1 1 34 CYS HB2 H 5.294 -0.106 -5.367 1.00 . A A . 34 CYS HB2 1 1 13 6574 1 1 34 CYS HB3 H 6.876 -0.207 -6.096 1.00 . A A . 34 CYS HB3 1 1 13 6575 1 1 34 CYS N N 4.737 -2.358 -5.729 1.00 . A A . 34 CYS N 1 1 13 6576 1 1 34 CYS O O 6.917 -2.944 -8.209 1.00 . A A . 34 CYS O 1 1 13 6577 1 1 34 CYS OXT O 7.666 -2.532 -6.182 1.00 . A A . 34 CYS OXT 1 1 13 6578 1 1 34 CYS SG S 5.353 1.035 -7.446 1.00 . A A . 34 CYS SG 1 1 14 6579 1 1 1 VAL C C -5.914 4.217 -7.527 1.00 . A A . 1 VAL C 1 1 14 6580 1 1 1 VAL CA C -4.563 4.470 -8.186 1.00 . A A . 1 VAL CA 1 1 14 6581 1 1 1 VAL CB C -4.524 5.921 -8.702 1.00 . A A . 1 VAL CB 1 1 14 6582 1 1 1 VAL CG1 C -3.119 6.292 -9.149 1.00 . A A . 1 VAL CG1 1 1 14 6583 1 1 1 VAL CG2 C -5.520 6.110 -9.835 1.00 . A A . 1 VAL CG2 1 1 14 6584 1 1 1 VAL H1 H -3.408 3.753 -9.729 1.00 . A A . 1 VAL H1 1 1 14 6585 1 1 1 VAL H2 H -5.100 3.577 -9.959 1.00 . A A . 1 VAL H2 1 1 14 6586 1 1 1 VAL H3 H -4.268 2.550 -8.863 1.00 . A A . 1 VAL H3 1 1 14 6587 1 1 1 VAL HA H -3.786 4.353 -7.443 1.00 . A A . 1 VAL HA 1 1 14 6588 1 1 1 VAL HB H -4.805 6.577 -7.891 1.00 . A A . 1 VAL HB 1 1 14 6589 1 1 1 VAL HG11 H -3.102 7.323 -9.467 1.00 . A A . 1 VAL HG11 1 1 14 6590 1 1 1 VAL HG12 H -2.822 5.657 -9.970 1.00 . A A . 1 VAL HG12 1 1 14 6591 1 1 1 VAL HG13 H -2.432 6.159 -8.325 1.00 . A A . 1 VAL HG13 1 1 14 6592 1 1 1 VAL HG21 H -5.152 5.619 -10.725 1.00 . A A . 1 VAL HG21 1 1 14 6593 1 1 1 VAL HG22 H -5.643 7.165 -10.034 1.00 . A A . 1 VAL HG22 1 1 14 6594 1 1 1 VAL HG23 H -6.471 5.682 -9.556 1.00 . A A . 1 VAL HG23 1 1 14 6595 1 1 1 VAL N N -4.312 3.500 -9.283 1.00 . A A . 1 VAL N 1 1 14 6596 1 1 1 VAL O O -6.904 3.940 -8.206 1.00 . A A . 1 VAL O 1 1 14 6597 1 1 2 SER C C -7.038 4.591 -4.017 1.00 . A A . 2 SER C 1 1 14 6598 1 1 2 SER CA C -7.180 4.095 -5.451 1.00 . A A . 2 SER CA 1 1 14 6599 1 1 2 SER CB C -7.549 2.609 -5.458 1.00 . A A . 2 SER CB 1 1 14 6600 1 1 2 SER H H -5.127 4.537 -5.718 1.00 . A A . 2 SER H 1 1 14 6601 1 1 2 SER HA H -7.966 4.654 -5.936 1.00 . A A . 2 SER HA 1 1 14 6602 1 1 2 SER HB2 H -6.912 2.086 -6.155 1.00 . A A . 2 SER HB2 1 1 14 6603 1 1 2 SER HB3 H -7.413 2.202 -4.468 1.00 . A A . 2 SER HB3 1 1 14 6604 1 1 2 SER HG H -9.465 2.463 -5.074 1.00 . A A . 2 SER HG 1 1 14 6605 1 1 2 SER N N -5.949 4.313 -6.202 1.00 . A A . 2 SER N 1 1 14 6606 1 1 2 SER O O -5.979 4.451 -3.405 1.00 . A A . 2 SER O 1 1 14 6607 1 1 2 SER OG O -8.899 2.422 -5.848 1.00 . A A . 2 SER OG 1 1 14 6608 1 1 3 CYS C C -6.888 6.486 -1.781 1.00 . A A . 3 CYS C 1 1 14 6609 1 1 3 CYS CA C -8.148 5.701 -2.122 1.00 . A A . 3 CYS CA 1 1 14 6610 1 1 3 CYS CB C -8.361 4.585 -1.089 1.00 . A A . 3 CYS CB 1 1 14 6611 1 1 3 CYS H H -8.926 5.244 -4.041 1.00 . A A . 3 CYS H 1 1 14 6612 1 1 3 CYS HA H -8.984 6.381 -2.060 1.00 . A A . 3 CYS HA 1 1 14 6613 1 1 3 CYS HB2 H -7.976 4.915 -0.136 1.00 . A A . 3 CYS HB2 1 1 14 6614 1 1 3 CYS HB3 H -9.420 4.398 -0.992 1.00 . A A . 3 CYS HB3 1 1 14 6615 1 1 3 CYS N N -8.119 5.171 -3.490 1.00 . A A . 3 CYS N 1 1 14 6616 1 1 3 CYS O O -5.975 6.627 -2.594 1.00 . A A . 3 CYS O 1 1 14 6617 1 1 3 CYS SG S -7.552 2.998 -1.479 1.00 . A A . 3 CYS SG 1 1 14 6618 1 1 4 THR C C -5.171 7.202 1.212 1.00 . A A . 4 THR C 1 1 14 6619 1 1 4 THR CA C -5.726 7.786 -0.086 1.00 . A A . 4 THR CA 1 1 14 6620 1 1 4 THR CB C -6.137 9.244 0.129 1.00 . A A . 4 THR CB 1 1 14 6621 1 1 4 THR CG2 C -7.157 9.424 1.232 1.00 . A A . 4 THR CG2 1 1 14 6622 1 1 4 THR H H -7.628 6.861 0.028 1.00 . A A . 4 THR H 1 1 14 6623 1 1 4 THR HA H -4.955 7.746 -0.841 1.00 . A A . 4 THR HA 1 1 14 6624 1 1 4 THR HB H -6.569 9.623 -0.787 1.00 . A A . 4 THR HB 1 1 14 6625 1 1 4 THR HG1 H -4.468 9.585 1.097 1.00 . A A . 4 THR HG1 1 1 14 6626 1 1 4 THR HG21 H -6.783 10.130 1.958 1.00 . A A . 4 THR HG21 1 1 14 6627 1 1 4 THR HG22 H -7.336 8.473 1.715 1.00 . A A . 4 THR HG22 1 1 14 6628 1 1 4 THR HG23 H -8.081 9.793 0.811 1.00 . A A . 4 THR HG23 1 1 14 6629 1 1 4 THR N N -6.860 7.005 -0.563 1.00 . A A . 4 THR N 1 1 14 6630 1 1 4 THR O O -4.536 7.906 1.997 1.00 . A A . 4 THR O 1 1 14 6631 1 1 4 THR OG1 O -5.011 10.042 0.451 1.00 . A A . 4 THR OG1 1 1 14 6632 1 1 5 GLY C C -5.481 5.883 3.893 1.00 . A A . 5 GLY C 1 1 14 6633 1 1 5 GLY CA C -4.929 5.257 2.627 1.00 . A A . 5 GLY CA 1 1 14 6634 1 1 5 GLY H H -5.922 5.401 0.765 1.00 . A A . 5 GLY H 1 1 14 6635 1 1 5 GLY HA2 H -5.219 4.217 2.598 1.00 . A A . 5 GLY HA2 1 1 14 6636 1 1 5 GLY HA3 H -3.851 5.319 2.649 1.00 . A A . 5 GLY HA3 1 1 14 6637 1 1 5 GLY N N -5.412 5.913 1.427 1.00 . A A . 5 GLY N 1 1 14 6638 1 1 5 GLY O O -5.885 7.046 3.894 1.00 . A A . 5 GLY O 1 1 14 6639 1 1 6 SER C C -5.193 6.800 6.730 1.00 . A A . 6 SER C 1 1 14 6640 1 1 6 SER CA C -6.000 5.595 6.253 1.00 . A A . 6 SER CA 1 1 14 6641 1 1 6 SER CB C -5.948 4.480 7.299 1.00 . A A . 6 SER CB 1 1 14 6642 1 1 6 SER H H -5.159 4.192 4.910 1.00 . A A . 6 SER H 1 1 14 6643 1 1 6 SER HA H -7.026 5.897 6.112 1.00 . A A . 6 SER HA 1 1 14 6644 1 1 6 SER HB2 H -5.013 4.539 7.839 1.00 . A A . 6 SER HB2 1 1 14 6645 1 1 6 SER HB3 H -6.769 4.599 7.990 1.00 . A A . 6 SER HB3 1 1 14 6646 1 1 6 SER HG H -6.735 3.217 6.026 1.00 . A A . 6 SER HG 1 1 14 6647 1 1 6 SER N N -5.496 5.110 4.973 1.00 . A A . 6 SER N 1 1 14 6648 1 1 6 SER O O -4.451 7.407 5.957 1.00 . A A . 6 SER O 1 1 14 6649 1 1 6 SER OG O -6.043 3.203 6.691 1.00 . A A . 6 SER OG 1 1 14 6650 1 1 7 LYS C C -3.120 8.145 8.361 1.00 . A A . 7 LYS C 1 1 14 6651 1 1 7 LYS CA C -4.625 8.274 8.585 1.00 . A A . 7 LYS CA 1 1 14 6652 1 1 7 LYS CB C -4.922 8.379 10.082 1.00 . A A . 7 LYS CB 1 1 14 6653 1 1 7 LYS CD C -5.452 6.728 11.903 1.00 . A A . 7 LYS CD 1 1 14 6654 1 1 7 LYS CE C -6.234 5.528 11.395 1.00 . A A . 7 LYS CE 1 1 14 6655 1 1 7 LYS CG C -4.420 7.191 10.887 1.00 . A A . 7 LYS CG 1 1 14 6656 1 1 7 LYS H H -5.947 6.619 8.573 1.00 . A A . 7 LYS H 1 1 14 6657 1 1 7 LYS HA H -4.974 9.170 8.095 1.00 . A A . 7 LYS HA 1 1 14 6658 1 1 7 LYS HB2 H -4.453 9.272 10.468 1.00 . A A . 7 LYS HB2 1 1 14 6659 1 1 7 LYS HB3 H -5.991 8.455 10.220 1.00 . A A . 7 LYS HB3 1 1 14 6660 1 1 7 LYS HD2 H -4.945 6.454 12.816 1.00 . A A . 7 LYS HD2 1 1 14 6661 1 1 7 LYS HD3 H -6.139 7.539 12.099 1.00 . A A . 7 LYS HD3 1 1 14 6662 1 1 7 LYS HE2 H -6.174 5.504 10.318 1.00 . A A . 7 LYS HE2 1 1 14 6663 1 1 7 LYS HE3 H -5.792 4.629 11.800 1.00 . A A . 7 LYS HE3 1 1 14 6664 1 1 7 LYS HG2 H -4.205 6.376 10.212 1.00 . A A . 7 LYS HG2 1 1 14 6665 1 1 7 LYS HG3 H -3.517 7.478 11.407 1.00 . A A . 7 LYS HG3 1 1 14 6666 1 1 7 LYS HZ1 H -7.818 5.031 12.663 1.00 . A A . 7 LYS HZ1 1 1 14 6667 1 1 7 LYS HZ2 H -8.268 5.203 11.042 1.00 . A A . 7 LYS HZ2 1 1 14 6668 1 1 7 LYS HZ3 H -7.946 6.574 11.979 1.00 . A A . 7 LYS HZ3 1 1 14 6669 1 1 7 LYS N N -5.341 7.141 8.006 1.00 . A A . 7 LYS N 1 1 14 6670 1 1 7 LYS NZ N -7.667 5.588 11.798 1.00 . A A . 7 LYS NZ 1 1 14 6671 1 1 7 LYS O O -2.398 9.142 8.352 1.00 . A A . 7 LYS O 1 1 14 6672 1 1 8 ASP C C -1.007 5.236 7.459 1.00 . A A . 8 ASP C 1 1 14 6673 1 1 8 ASP CA C -1.235 6.659 7.959 1.00 . A A . 8 ASP CA 1 1 14 6674 1 1 8 ASP CB C -0.449 6.891 9.248 1.00 . A A . 8 ASP CB 1 1 14 6675 1 1 8 ASP CG C 0.875 7.586 9.003 1.00 . A A . 8 ASP CG 1 1 14 6676 1 1 8 ASP H H -3.276 6.157 8.199 1.00 . A A . 8 ASP H 1 1 14 6677 1 1 8 ASP HA H -0.887 7.351 7.207 1.00 . A A . 8 ASP HA 1 1 14 6678 1 1 8 ASP HB2 H -1.039 7.502 9.913 1.00 . A A . 8 ASP HB2 1 1 14 6679 1 1 8 ASP HB3 H -0.256 5.939 9.718 1.00 . A A . 8 ASP HB3 1 1 14 6680 1 1 8 ASP N N -2.653 6.913 8.181 1.00 . A A . 8 ASP N 1 1 14 6681 1 1 8 ASP O O -0.274 4.458 8.069 1.00 . A A . 8 ASP O 1 1 14 6682 1 1 8 ASP OD1 O 0.884 8.831 8.912 1.00 . A A . 8 ASP OD1 1 1 14 6683 1 1 8 ASP OD2 O 1.904 6.885 8.904 1.00 . A A . 8 ASP OD2 1 1 14 6684 1 1 9 CYS C C -0.663 3.609 4.505 1.00 . A A . 9 CYS C 1 1 14 6685 1 1 9 CYS CA C -1.520 3.575 5.757 1.00 . A A . 9 CYS CA 1 1 14 6686 1 1 9 CYS CB C -2.890 3.013 5.422 1.00 . A A . 9 CYS CB 1 1 14 6687 1 1 9 CYS H H -2.215 5.569 5.912 1.00 . A A . 9 CYS H 1 1 14 6688 1 1 9 CYS HA H -1.055 2.941 6.472 1.00 . A A . 9 CYS HA 1 1 14 6689 1 1 9 CYS HB2 H -3.606 3.412 6.116 1.00 . A A . 9 CYS HB2 1 1 14 6690 1 1 9 CYS HB3 H -3.151 3.319 4.429 1.00 . A A . 9 CYS HB3 1 1 14 6691 1 1 9 CYS N N -1.645 4.904 6.346 1.00 . A A . 9 CYS N 1 1 14 6692 1 1 9 CYS O O 0.445 3.074 4.477 1.00 . A A . 9 CYS O 1 1 14 6693 1 1 9 CYS SG S -2.998 1.195 5.491 1.00 . A A . 9 CYS SG 1 1 14 6694 1 1 10 TYR C C 0.963 4.829 2.422 1.00 . A A . 10 TYR C 1 1 14 6695 1 1 10 TYR CA C -0.477 4.364 2.207 1.00 . A A . 10 TYR CA 1 1 14 6696 1 1 10 TYR CB C -1.206 5.360 1.300 1.00 . A A . 10 TYR CB 1 1 14 6697 1 1 10 TYR CD1 C -0.689 4.558 -1.039 1.00 . A A . 10 TYR CD1 1 1 14 6698 1 1 10 TYR CD2 C -2.955 4.501 -0.302 1.00 . A A . 10 TYR CD2 1 1 14 6699 1 1 10 TYR CE1 C -1.071 4.048 -2.264 1.00 . A A . 10 TYR CE1 1 1 14 6700 1 1 10 TYR CE2 C -3.346 3.992 -1.526 1.00 . A A . 10 TYR CE2 1 1 14 6701 1 1 10 TYR CG C -1.623 4.792 -0.037 1.00 . A A . 10 TYR CG 1 1 14 6702 1 1 10 TYR CZ C -2.400 3.768 -2.503 1.00 . A A . 10 TYR CZ 1 1 14 6703 1 1 10 TYR H H -2.073 4.653 3.564 1.00 . A A . 10 TYR H 1 1 14 6704 1 1 10 TYR HA H -0.469 3.395 1.732 1.00 . A A . 10 TYR HA 1 1 14 6705 1 1 10 TYR HB2 H -2.096 5.704 1.801 1.00 . A A . 10 TYR HB2 1 1 14 6706 1 1 10 TYR HB3 H -0.559 6.206 1.112 1.00 . A A . 10 TYR HB3 1 1 14 6707 1 1 10 TYR HD1 H 0.351 4.778 -0.847 1.00 . A A . 10 TYR HD1 1 1 14 6708 1 1 10 TYR HD2 H -3.693 4.677 0.466 1.00 . A A . 10 TYR HD2 1 1 14 6709 1 1 10 TYR HE1 H -0.330 3.872 -3.030 1.00 . A A . 10 TYR HE1 1 1 14 6710 1 1 10 TYR HE2 H -4.386 3.773 -1.713 1.00 . A A . 10 TYR HE2 1 1 14 6711 1 1 10 TYR HH H -3.131 3.975 -4.269 1.00 . A A . 10 TYR HH 1 1 14 6712 1 1 10 TYR N N -1.185 4.246 3.472 1.00 . A A . 10 TYR N 1 1 14 6713 1 1 10 TYR O O 1.838 4.557 1.608 1.00 . A A . 10 TYR O 1 1 14 6714 1 1 10 TYR OH O -2.784 3.265 -3.725 1.00 . A A . 10 TYR OH 1 1 14 6715 1 1 11 ALA C C 3.518 4.997 4.236 1.00 . A A . 11 ALA C 1 1 14 6716 1 1 11 ALA CA C 2.520 6.079 3.823 1.00 . A A . 11 ALA CA 1 1 14 6717 1 1 11 ALA CB C 2.424 7.153 4.897 1.00 . A A . 11 ALA CB 1 1 14 6718 1 1 11 ALA H H 0.445 5.743 4.128 1.00 . A A . 11 ALA H 1 1 14 6719 1 1 11 ALA HA H 2.890 6.546 2.923 1.00 . A A . 11 ALA HA 1 1 14 6720 1 1 11 ALA HB1 H 1.581 6.946 5.539 1.00 . A A . 11 ALA HB1 1 1 14 6721 1 1 11 ALA HB2 H 2.293 8.117 4.429 1.00 . A A . 11 ALA HB2 1 1 14 6722 1 1 11 ALA HB3 H 3.331 7.157 5.483 1.00 . A A . 11 ALA HB3 1 1 14 6723 1 1 11 ALA N N 1.192 5.549 3.517 1.00 . A A . 11 ALA N 1 1 14 6724 1 1 11 ALA O O 4.488 4.733 3.520 1.00 . A A . 11 ALA O 1 1 14 6725 1 1 12 PRO C C 4.604 2.319 4.850 1.00 . A A . 12 PRO C 1 1 14 6726 1 1 12 PRO CA C 4.209 3.325 5.918 1.00 . A A . 12 PRO CA 1 1 14 6727 1 1 12 PRO CB C 3.393 2.642 7.027 1.00 . A A . 12 PRO CB 1 1 14 6728 1 1 12 PRO CD C 2.202 4.603 6.330 1.00 . A A . 12 PRO CD 1 1 14 6729 1 1 12 PRO CG C 2.031 3.257 6.971 1.00 . A A . 12 PRO CG 1 1 14 6730 1 1 12 PRO HA H 5.102 3.758 6.345 1.00 . A A . 12 PRO HA 1 1 14 6731 1 1 12 PRO HB2 H 3.349 1.579 6.840 1.00 . A A . 12 PRO HB2 1 1 14 6732 1 1 12 PRO HB3 H 3.865 2.822 7.983 1.00 . A A . 12 PRO HB3 1 1 14 6733 1 1 12 PRO HD2 H 1.306 4.888 5.798 1.00 . A A . 12 PRO HD2 1 1 14 6734 1 1 12 PRO HD3 H 2.464 5.347 7.066 1.00 . A A . 12 PRO HD3 1 1 14 6735 1 1 12 PRO HG2 H 1.375 2.639 6.379 1.00 . A A . 12 PRO HG2 1 1 14 6736 1 1 12 PRO HG3 H 1.640 3.366 7.969 1.00 . A A . 12 PRO HG3 1 1 14 6737 1 1 12 PRO N N 3.312 4.364 5.406 1.00 . A A . 12 PRO N 1 1 14 6738 1 1 12 PRO O O 5.684 1.731 4.906 1.00 . A A . 12 PRO O 1 1 14 6739 1 1 13 CYS C C 4.569 1.855 1.576 1.00 . A A . 13 CYS C 1 1 14 6740 1 1 13 CYS CA C 3.990 1.175 2.807 1.00 . A A . 13 CYS CA 1 1 14 6741 1 1 13 CYS CB C 2.731 0.421 2.430 1.00 . A A . 13 CYS CB 1 1 14 6742 1 1 13 CYS H H 2.876 2.613 3.892 1.00 . A A . 13 CYS H 1 1 14 6743 1 1 13 CYS HA H 4.704 0.466 3.169 1.00 . A A . 13 CYS HA 1 1 14 6744 1 1 13 CYS HB2 H 1.951 0.694 3.113 1.00 . A A . 13 CYS HB2 1 1 14 6745 1 1 13 CYS HB3 H 2.447 0.695 1.432 1.00 . A A . 13 CYS HB3 1 1 14 6746 1 1 13 CYS N N 3.724 2.120 3.880 1.00 . A A . 13 CYS N 1 1 14 6747 1 1 13 CYS O O 5.559 1.389 1.019 1.00 . A A . 13 CYS O 1 1 14 6748 1 1 13 CYS SG S 2.918 -1.392 2.481 1.00 . A A . 13 CYS SG 1 1 14 6749 1 1 14 ARG C C 5.926 3.848 0.003 1.00 . A A . 14 ARG C 1 1 14 6750 1 1 14 ARG CA C 4.421 3.663 -0.044 1.00 . A A . 14 ARG CA 1 1 14 6751 1 1 14 ARG CB C 3.721 5.019 -0.189 1.00 . A A . 14 ARG CB 1 1 14 6752 1 1 14 ARG CD C 3.663 7.270 -1.306 1.00 . A A . 14 ARG CD 1 1 14 6753 1 1 14 ARG CG C 4.277 5.880 -1.313 1.00 . A A . 14 ARG CG 1 1 14 6754 1 1 14 ARG CZ C 3.412 9.186 -2.834 1.00 . A A . 14 ARG CZ 1 1 14 6755 1 1 14 ARG H H 3.161 3.281 1.617 1.00 . A A . 14 ARG H 1 1 14 6756 1 1 14 ARG HA H 4.183 3.049 -0.896 1.00 . A A . 14 ARG HA 1 1 14 6757 1 1 14 ARG HB2 H 2.673 4.849 -0.384 1.00 . A A . 14 ARG HB2 1 1 14 6758 1 1 14 ARG HB3 H 3.823 5.565 0.738 1.00 . A A . 14 ARG HB3 1 1 14 6759 1 1 14 ARG HD2 H 2.616 7.186 -1.056 1.00 . A A . 14 ARG HD2 1 1 14 6760 1 1 14 ARG HD3 H 4.164 7.867 -0.558 1.00 . A A . 14 ARG HD3 1 1 14 6761 1 1 14 ARG HE H 4.175 7.413 -3.340 1.00 . A A . 14 ARG HE 1 1 14 6762 1 1 14 ARG HG2 H 5.346 5.969 -1.190 1.00 . A A . 14 ARG HG2 1 1 14 6763 1 1 14 ARG HG3 H 4.060 5.404 -2.259 1.00 . A A . 14 ARG HG3 1 1 14 6764 1 1 14 ARG HH11 H 2.770 9.530 -0.947 1.00 . A A . 14 ARG HH11 1 1 14 6765 1 1 14 ARG HH12 H 2.605 10.862 -2.041 1.00 . A A . 14 ARG HH12 1 1 14 6766 1 1 14 ARG HH21 H 3.958 9.163 -4.780 1.00 . A A . 14 ARG HH21 1 1 14 6767 1 1 14 ARG HH22 H 3.278 10.654 -4.217 1.00 . A A . 14 ARG HH22 1 1 14 6768 1 1 14 ARG N N 3.949 2.951 1.141 1.00 . A A . 14 ARG N 1 1 14 6769 1 1 14 ARG NE N 3.790 7.931 -2.602 1.00 . A A . 14 ARG NE 1 1 14 6770 1 1 14 ARG NH1 N 2.885 9.920 -1.861 1.00 . A A . 14 ARG NH1 1 1 14 6771 1 1 14 ARG NH2 N 3.561 9.711 -4.043 1.00 . A A . 14 ARG NH2 1 1 14 6772 1 1 14 ARG O O 6.594 3.853 -1.030 1.00 . A A . 14 ARG O 1 1 14 6773 1 1 15 LYS C C 8.595 2.881 0.835 1.00 . A A . 15 LYS C 1 1 14 6774 1 1 15 LYS CA C 7.895 4.123 1.373 1.00 . A A . 15 LYS CA 1 1 14 6775 1 1 15 LYS CB C 8.247 4.337 2.847 1.00 . A A . 15 LYS CB 1 1 14 6776 1 1 15 LYS CD C 7.586 6.751 3.076 1.00 . A A . 15 LYS CD 1 1 14 6777 1 1 15 LYS CE C 8.106 8.169 2.913 1.00 . A A . 15 LYS CE 1 1 14 6778 1 1 15 LYS CG C 8.724 5.746 3.160 1.00 . A A . 15 LYS CG 1 1 14 6779 1 1 15 LYS H H 5.878 3.943 2.000 1.00 . A A . 15 LYS H 1 1 14 6780 1 1 15 LYS HA H 8.212 4.983 0.800 1.00 . A A . 15 LYS HA 1 1 14 6781 1 1 15 LYS HB2 H 7.372 4.135 3.446 1.00 . A A . 15 LYS HB2 1 1 14 6782 1 1 15 LYS HB3 H 9.030 3.646 3.125 1.00 . A A . 15 LYS HB3 1 1 14 6783 1 1 15 LYS HD2 H 6.966 6.506 2.226 1.00 . A A . 15 LYS HD2 1 1 14 6784 1 1 15 LYS HD3 H 7.000 6.693 3.981 1.00 . A A . 15 LYS HD3 1 1 14 6785 1 1 15 LYS HE2 H 9.121 8.213 3.284 1.00 . A A . 15 LYS HE2 1 1 14 6786 1 1 15 LYS HE3 H 8.097 8.425 1.863 1.00 . A A . 15 LYS HE3 1 1 14 6787 1 1 15 LYS HG2 H 9.133 5.764 4.159 1.00 . A A . 15 LYS HG2 1 1 14 6788 1 1 15 LYS HG3 H 9.491 6.023 2.450 1.00 . A A . 15 LYS HG3 1 1 14 6789 1 1 15 LYS HZ1 H 7.785 10.058 3.745 1.00 . A A . 15 LYS HZ1 1 1 14 6790 1 1 15 LYS HZ2 H 7.067 8.796 4.612 1.00 . A A . 15 LYS HZ2 1 1 14 6791 1 1 15 LYS HZ3 H 6.380 9.319 3.158 1.00 . A A . 15 LYS HZ3 1 1 14 6792 1 1 15 LYS N N 6.460 3.973 1.207 1.00 . A A . 15 LYS N 1 1 14 6793 1 1 15 LYS NZ N 7.276 9.155 3.659 1.00 . A A . 15 LYS NZ 1 1 14 6794 1 1 15 LYS O O 9.514 2.969 0.020 1.00 . A A . 15 LYS O 1 1 14 6795 1 1 16 GLN C C 8.317 0.120 -0.582 1.00 . A A . 16 GLN C 1 1 14 6796 1 1 16 GLN CA C 8.690 0.444 0.866 1.00 . A A . 16 GLN CA 1 1 14 6797 1 1 16 GLN CB C 8.207 -0.677 1.789 1.00 . A A . 16 GLN CB 1 1 14 6798 1 1 16 GLN CD C 10.517 -1.208 2.661 1.00 . A A . 16 GLN CD 1 1 14 6799 1 1 16 GLN CG C 9.081 -0.875 3.016 1.00 . A A . 16 GLN CG 1 1 14 6800 1 1 16 GLN H H 7.393 1.724 1.937 1.00 . A A . 16 GLN H 1 1 14 6801 1 1 16 GLN HA H 9.765 0.512 0.938 1.00 . A A . 16 GLN HA 1 1 14 6802 1 1 16 GLN HB2 H 7.205 -0.448 2.120 1.00 . A A . 16 GLN HB2 1 1 14 6803 1 1 16 GLN HB3 H 8.190 -1.603 1.232 1.00 . A A . 16 GLN HB3 1 1 14 6804 1 1 16 GLN HE21 H 9.912 -2.737 1.542 1.00 . A A . 16 GLN HE21 1 1 14 6805 1 1 16 GLN HE22 H 11.621 -2.487 1.612 1.00 . A A . 16 GLN HE22 1 1 14 6806 1 1 16 GLN HG2 H 9.073 0.034 3.599 1.00 . A A . 16 GLN HG2 1 1 14 6807 1 1 16 GLN HG3 H 8.675 -1.684 3.606 1.00 . A A . 16 GLN HG3 1 1 14 6808 1 1 16 GLN N N 8.136 1.720 1.295 1.00 . A A . 16 GLN N 1 1 14 6809 1 1 16 GLN NE2 N 10.702 -2.249 1.858 1.00 . A A . 16 GLN NE2 1 1 14 6810 1 1 16 GLN O O 9.188 -0.143 -1.411 1.00 . A A . 16 GLN O 1 1 14 6811 1 1 16 GLN OE1 O 11.450 -0.538 3.104 1.00 . A A . 16 GLN OE1 1 1 14 6812 1 1 17 THR C C 6.851 0.903 -3.218 1.00 . A A . 17 THR C 1 1 14 6813 1 1 17 THR CA C 6.529 -0.199 -2.214 1.00 . A A . 17 THR CA 1 1 14 6814 1 1 17 THR CB C 5.020 -0.449 -2.183 1.00 . A A . 17 THR CB 1 1 14 6815 1 1 17 THR CG2 C 4.253 0.619 -1.439 1.00 . A A . 17 THR CG2 1 1 14 6816 1 1 17 THR H H 6.364 0.327 -0.172 1.00 . A A . 17 THR H 1 1 14 6817 1 1 17 THR HA H 7.020 -1.106 -2.531 1.00 . A A . 17 THR HA 1 1 14 6818 1 1 17 THR HB H 4.831 -1.394 -1.694 1.00 . A A . 17 THR HB 1 1 14 6819 1 1 17 THR HG1 H 3.862 -1.236 -3.553 1.00 . A A . 17 THR HG1 1 1 14 6820 1 1 17 THR HG21 H 3.528 1.070 -2.101 1.00 . A A . 17 THR HG21 1 1 14 6821 1 1 17 THR HG22 H 4.940 1.373 -1.090 1.00 . A A . 17 THR HG22 1 1 14 6822 1 1 17 THR HG23 H 3.744 0.176 -0.596 1.00 . A A . 17 THR HG23 1 1 14 6823 1 1 17 THR N N 7.015 0.118 -0.874 1.00 . A A . 17 THR N 1 1 14 6824 1 1 17 THR O O 6.690 0.712 -4.423 1.00 . A A . 17 THR O 1 1 14 6825 1 1 17 THR OG1 O 4.495 -0.518 -3.497 1.00 . A A . 17 THR OG1 1 1 14 6826 1 1 18 GLY C C 6.387 3.670 -4.335 1.00 . A A . 18 GLY C 1 1 14 6827 1 1 18 GLY CA C 7.611 3.145 -3.627 1.00 . A A . 18 GLY CA 1 1 14 6828 1 1 18 GLY H H 7.404 2.168 -1.766 1.00 . A A . 18 GLY H 1 1 14 6829 1 1 18 GLY HA2 H 8.060 3.943 -3.082 1.00 . A A . 18 GLY HA2 1 1 14 6830 1 1 18 GLY HA3 H 8.310 2.790 -4.366 1.00 . A A . 18 GLY HA3 1 1 14 6831 1 1 18 GLY N N 7.295 2.055 -2.730 1.00 . A A . 18 GLY N 1 1 14 6832 1 1 18 GLY O O 5.598 4.421 -3.763 1.00 . A A . 18 GLY O 1 1 14 6833 1 1 19 CYS C C 3.909 4.113 -5.678 1.00 . A A . 19 CYS C 1 1 14 6834 1 1 19 CYS CA C 5.152 3.660 -6.454 1.00 . A A . 19 CYS CA 1 1 14 6835 1 1 19 CYS CB C 4.792 2.524 -7.381 1.00 . A A . 19 CYS CB 1 1 14 6836 1 1 19 CYS H H 6.949 2.688 -5.944 1.00 . A A . 19 CYS H 1 1 14 6837 1 1 19 CYS HA H 5.500 4.460 -7.065 1.00 . A A . 19 CYS HA 1 1 14 6838 1 1 19 CYS HB2 H 3.854 2.753 -7.852 1.00 . A A . 19 CYS HB2 1 1 14 6839 1 1 19 CYS HB3 H 5.558 2.460 -8.130 1.00 . A A . 19 CYS HB3 1 1 14 6840 1 1 19 CYS N N 6.258 3.267 -5.586 1.00 . A A . 19 CYS N 1 1 14 6841 1 1 19 CYS O O 3.554 3.518 -4.659 1.00 . A A . 19 CYS O 1 1 14 6842 1 1 19 CYS SG S 4.639 0.898 -6.572 1.00 . A A . 19 CYS SG 1 1 14 6843 1 1 20 PRO C C 0.836 4.769 -5.508 1.00 . A A . 20 PRO C 1 1 14 6844 1 1 20 PRO CA C 2.035 5.720 -5.485 1.00 . A A . 20 PRO CA 1 1 14 6845 1 1 20 PRO CB C 1.710 6.989 -6.288 1.00 . A A . 20 PRO CB 1 1 14 6846 1 1 20 PRO CD C 3.587 5.958 -7.344 1.00 . A A . 20 PRO CD 1 1 14 6847 1 1 20 PRO CG C 2.937 7.284 -7.083 1.00 . A A . 20 PRO CG 1 1 14 6848 1 1 20 PRO HA H 2.246 5.994 -4.462 1.00 . A A . 20 PRO HA 1 1 14 6849 1 1 20 PRO HB2 H 0.863 6.802 -6.930 1.00 . A A . 20 PRO HB2 1 1 14 6850 1 1 20 PRO HB3 H 1.479 7.796 -5.609 1.00 . A A . 20 PRO HB3 1 1 14 6851 1 1 20 PRO HD2 H 3.179 5.505 -8.236 1.00 . A A . 20 PRO HD2 1 1 14 6852 1 1 20 PRO HD3 H 4.656 6.074 -7.430 1.00 . A A . 20 PRO HD3 1 1 14 6853 1 1 20 PRO HG2 H 2.666 7.759 -8.014 1.00 . A A . 20 PRO HG2 1 1 14 6854 1 1 20 PRO HG3 H 3.599 7.920 -6.514 1.00 . A A . 20 PRO HG3 1 1 14 6855 1 1 20 PRO N N 3.234 5.181 -6.146 1.00 . A A . 20 PRO N 1 1 14 6856 1 1 20 PRO O O -0.198 5.062 -4.909 1.00 . A A . 20 PRO O 1 1 14 6857 1 1 21 TYR C C -0.359 1.987 -4.963 1.00 . A A . 21 TYR C 1 1 14 6858 1 1 21 TYR CA C -0.115 2.687 -6.298 1.00 . A A . 21 TYR CA 1 1 14 6859 1 1 21 TYR CB C 0.204 1.653 -7.375 1.00 . A A . 21 TYR CB 1 1 14 6860 1 1 21 TYR CD1 C 1.015 3.399 -9.017 1.00 . A A . 21 TYR CD1 1 1 14 6861 1 1 21 TYR CD2 C 2.159 1.309 -8.941 1.00 . A A . 21 TYR CD2 1 1 14 6862 1 1 21 TYR CE1 C 1.868 3.834 -10.014 1.00 . A A . 21 TYR CE1 1 1 14 6863 1 1 21 TYR CE2 C 3.016 1.737 -9.937 1.00 . A A . 21 TYR CE2 1 1 14 6864 1 1 21 TYR CG C 1.146 2.131 -8.464 1.00 . A A . 21 TYR CG 1 1 14 6865 1 1 21 TYR CZ C 2.867 3.000 -10.470 1.00 . A A . 21 TYR CZ 1 1 14 6866 1 1 21 TYR H H 1.788 3.451 -6.676 1.00 . A A . 21 TYR H 1 1 14 6867 1 1 21 TYR HA H -1.010 3.220 -6.580 1.00 . A A . 21 TYR HA 1 1 14 6868 1 1 21 TYR HB2 H 0.645 0.784 -6.915 1.00 . A A . 21 TYR HB2 1 1 14 6869 1 1 21 TYR HB3 H -0.706 1.376 -7.844 1.00 . A A . 21 TYR HB3 1 1 14 6870 1 1 21 TYR HD1 H 0.232 4.050 -8.658 1.00 . A A . 21 TYR HD1 1 1 14 6871 1 1 21 TYR HD2 H 2.275 0.321 -8.520 1.00 . A A . 21 TYR HD2 1 1 14 6872 1 1 21 TYR HE1 H 1.751 4.824 -10.431 1.00 . A A . 21 TYR HE1 1 1 14 6873 1 1 21 TYR HE2 H 3.798 1.084 -10.294 1.00 . A A . 21 TYR HE2 1 1 14 6874 1 1 21 TYR HH H 3.979 4.337 -11.290 1.00 . A A . 21 TYR HH 1 1 14 6875 1 1 21 TYR N N 0.963 3.642 -6.203 1.00 . A A . 21 TYR N 1 1 14 6876 1 1 21 TYR O O 0.470 2.044 -4.055 1.00 . A A . 21 TYR O 1 1 14 6877 1 1 21 TYR OH O 3.718 3.430 -11.462 1.00 . A A . 21 TYR OH 1 1 14 6878 1 1 22 GLY C C -3.045 -0.309 -3.829 1.00 . A A . 22 GLY C 1 1 14 6879 1 1 22 GLY CA C -1.862 0.620 -3.636 1.00 . A A . 22 GLY CA 1 1 14 6880 1 1 22 GLY H H -2.127 1.319 -5.618 1.00 . A A . 22 GLY H 1 1 14 6881 1 1 22 GLY HA2 H -1.016 0.043 -3.310 1.00 . A A . 22 GLY HA2 1 1 14 6882 1 1 22 GLY HA3 H -2.105 1.340 -2.872 1.00 . A A . 22 GLY HA3 1 1 14 6883 1 1 22 GLY N N -1.510 1.326 -4.857 1.00 . A A . 22 GLY N 1 1 14 6884 1 1 22 GLY O O -3.901 -0.058 -4.677 1.00 . A A . 22 GLY O 1 1 14 6885 1 1 23 LYS C C -5.304 -1.962 -2.116 1.00 . A A . 23 LYS C 1 1 14 6886 1 1 23 LYS CA C -4.218 -2.315 -3.130 1.00 . A A . 23 LYS CA 1 1 14 6887 1 1 23 LYS CB C -3.731 -3.750 -2.910 1.00 . A A . 23 LYS CB 1 1 14 6888 1 1 23 LYS CD C -4.422 -6.139 -3.272 1.00 . A A . 23 LYS CD 1 1 14 6889 1 1 23 LYS CE C -3.097 -6.878 -3.359 1.00 . A A . 23 LYS CE 1 1 14 6890 1 1 23 LYS CG C -4.328 -4.751 -3.886 1.00 . A A . 23 LYS CG 1 1 14 6891 1 1 23 LYS H H -2.418 -1.521 -2.365 1.00 . A A . 23 LYS H 1 1 14 6892 1 1 23 LYS HA H -4.632 -2.233 -4.123 1.00 . A A . 23 LYS HA 1 1 14 6893 1 1 23 LYS HB2 H -2.657 -3.774 -3.017 1.00 . A A . 23 LYS HB2 1 1 14 6894 1 1 23 LYS HB3 H -3.992 -4.059 -1.908 1.00 . A A . 23 LYS HB3 1 1 14 6895 1 1 23 LYS HD2 H -4.703 -6.045 -2.235 1.00 . A A . 23 LYS HD2 1 1 14 6896 1 1 23 LYS HD3 H -5.175 -6.705 -3.801 1.00 . A A . 23 LYS HD3 1 1 14 6897 1 1 23 LYS HE2 H -3.293 -7.924 -3.537 1.00 . A A . 23 LYS HE2 1 1 14 6898 1 1 23 LYS HE3 H -2.528 -6.473 -4.183 1.00 . A A . 23 LYS HE3 1 1 14 6899 1 1 23 LYS HG2 H -5.319 -4.423 -4.163 1.00 . A A . 23 LYS HG2 1 1 14 6900 1 1 23 LYS HG3 H -3.703 -4.797 -4.765 1.00 . A A . 23 LYS HG3 1 1 14 6901 1 1 23 LYS HZ1 H -1.651 -5.931 -2.183 1.00 . A A . 23 LYS HZ1 1 1 14 6902 1 1 23 LYS HZ2 H -1.746 -7.602 -1.940 1.00 . A A . 23 LYS HZ2 1 1 14 6903 1 1 23 LYS HZ3 H -2.935 -6.586 -1.296 1.00 . A A . 23 LYS HZ3 1 1 14 6904 1 1 23 LYS N N -3.111 -1.375 -3.033 1.00 . A A . 23 LYS N 1 1 14 6905 1 1 23 LYS NZ N -2.301 -6.740 -2.108 1.00 . A A . 23 LYS NZ 1 1 14 6906 1 1 23 LYS O O -6.239 -2.731 -1.896 1.00 . A A . 23 LYS O 1 1 14 6907 1 1 24 CYS C C -7.540 -0.301 -1.077 1.00 . A A . 24 CYS C 1 1 14 6908 1 1 24 CYS CA C -6.123 -0.315 -0.507 1.00 . A A . 24 CYS CA 1 1 14 6909 1 1 24 CYS CB C -5.704 1.080 -0.011 1.00 . A A . 24 CYS CB 1 1 14 6910 1 1 24 CYS H H -4.400 -0.220 -1.721 1.00 . A A . 24 CYS H 1 1 14 6911 1 1 24 CYS HA H -6.096 -0.999 0.326 1.00 . A A . 24 CYS HA 1 1 14 6912 1 1 24 CYS HB2 H -5.138 0.969 0.901 1.00 . A A . 24 CYS HB2 1 1 14 6913 1 1 24 CYS HB3 H -5.073 1.540 -0.757 1.00 . A A . 24 CYS HB3 1 1 14 6914 1 1 24 CYS N N -5.167 -0.787 -1.500 1.00 . A A . 24 CYS N 1 1 14 6915 1 1 24 CYS O O -7.777 0.190 -2.180 1.00 . A A . 24 CYS O 1 1 14 6916 1 1 24 CYS SG S -7.079 2.232 0.342 1.00 . A A . 24 CYS SG 1 1 14 6917 1 1 25 MET C C -10.755 -0.932 0.523 1.00 . A A . 25 MET C 1 1 14 6918 1 1 25 MET CA C -9.874 -0.906 -0.707 1.00 . A A . 25 MET CA 1 1 14 6919 1 1 25 MET CB C -10.133 -2.142 -1.571 1.00 . A A . 25 MET CB 1 1 14 6920 1 1 25 MET CE C -10.187 -4.642 -3.234 1.00 . A A . 25 MET CE 1 1 14 6921 1 1 25 MET CG C -9.996 -1.882 -3.063 1.00 . A A . 25 MET CG 1 1 14 6922 1 1 25 MET H H -8.214 -1.219 0.565 1.00 . A A . 25 MET H 1 1 14 6923 1 1 25 MET HA H -10.109 -0.018 -1.276 1.00 . A A . 25 MET HA 1 1 14 6924 1 1 25 MET HB2 H -9.430 -2.913 -1.295 1.00 . A A . 25 MET HB2 1 1 14 6925 1 1 25 MET HB3 H -11.136 -2.497 -1.380 1.00 . A A . 25 MET HB3 1 1 14 6926 1 1 25 MET HE1 H -11.220 -4.585 -3.547 1.00 . A A . 25 MET HE1 1 1 14 6927 1 1 25 MET HE2 H -10.134 -4.588 -2.158 1.00 . A A . 25 MET HE2 1 1 14 6928 1 1 25 MET HE3 H -9.761 -5.576 -3.571 1.00 . A A . 25 MET HE3 1 1 14 6929 1 1 25 MET HG2 H -10.977 -1.686 -3.472 1.00 . A A . 25 MET HG2 1 1 14 6930 1 1 25 MET HG3 H -9.367 -1.016 -3.207 1.00 . A A . 25 MET HG3 1 1 14 6931 1 1 25 MET N N -8.474 -0.845 -0.306 1.00 . A A . 25 MET N 1 1 14 6932 1 1 25 MET O O -10.379 -1.477 1.568 1.00 . A A . 25 MET O 1 1 14 6933 1 1 25 MET SD S -9.271 -3.277 -3.946 1.00 . A A . 25 MET SD 1 1 14 6934 1 1 26 ASN C C -12.055 0.293 2.741 1.00 . A A . 26 ASN C 1 1 14 6935 1 1 26 ASN CA C -12.796 -0.307 1.588 1.00 . A A . 26 ASN CA 1 1 14 6936 1 1 26 ASN CB C -13.232 -1.738 1.931 1.00 . A A . 26 ASN CB 1 1 14 6937 1 1 26 ASN CG C -13.661 -2.524 0.705 1.00 . A A . 26 ASN CG 1 1 14 6938 1 1 26 ASN H H -12.187 0.116 -0.406 1.00 . A A . 26 ASN H 1 1 14 6939 1 1 26 ASN HA H -13.665 0.288 1.425 1.00 . A A . 26 ASN HA 1 1 14 6940 1 1 26 ASN HB2 H -12.409 -2.258 2.397 1.00 . A A . 26 ASN HB2 1 1 14 6941 1 1 26 ASN HB3 H -14.065 -1.699 2.618 1.00 . A A . 26 ASN HB3 1 1 14 6942 1 1 26 ASN HD21 H -15.570 -2.111 1.077 1.00 . A A . 26 ASN HD21 1 1 14 6943 1 1 26 ASN HD22 H -15.269 -3.077 -0.325 1.00 . A A . 26 ASN HD22 1 1 14 6944 1 1 26 ASN N N -11.927 -0.325 0.430 1.00 . A A . 26 ASN N 1 1 14 6945 1 1 26 ASN ND2 N -14.965 -2.576 0.461 1.00 . A A . 26 ASN ND2 1 1 14 6946 1 1 26 ASN O O -10.950 0.819 2.608 1.00 . A A . 26 ASN O 1 1 14 6947 1 1 26 ASN OD1 O -12.828 -3.076 -0.014 1.00 . A A . 26 ASN OD1 1 1 14 6948 1 1 27 ARG C C -10.919 -0.256 5.479 1.00 . A A . 27 ARG C 1 1 14 6949 1 1 27 ARG CA C -12.089 0.633 5.106 1.00 . A A . 27 ARG CA 1 1 14 6950 1 1 27 ARG CB C -13.132 0.668 6.224 1.00 . A A . 27 ARG CB 1 1 14 6951 1 1 27 ARG CD C -13.556 2.288 8.100 1.00 . A A . 27 ARG CD 1 1 14 6952 1 1 27 ARG CG C -13.574 2.075 6.596 1.00 . A A . 27 ARG CG 1 1 14 6953 1 1 27 ARG CZ C -14.414 3.958 9.696 1.00 . A A . 27 ARG CZ 1 1 14 6954 1 1 27 ARG H H -13.507 -0.298 3.846 1.00 . A A . 27 ARG H 1 1 14 6955 1 1 27 ARG HA H -11.715 1.616 4.927 1.00 . A A . 27 ARG HA 1 1 14 6956 1 1 27 ARG HB2 H -14.003 0.113 5.907 1.00 . A A . 27 ARG HB2 1 1 14 6957 1 1 27 ARG HB3 H -12.717 0.199 7.105 1.00 . A A . 27 ARG HB3 1 1 14 6958 1 1 27 ARG HD2 H -13.844 1.367 8.586 1.00 . A A . 27 ARG HD2 1 1 14 6959 1 1 27 ARG HD3 H -12.553 2.553 8.401 1.00 . A A . 27 ARG HD3 1 1 14 6960 1 1 27 ARG HE H -15.167 3.620 7.878 1.00 . A A . 27 ARG HE 1 1 14 6961 1 1 27 ARG HG2 H -12.903 2.784 6.134 1.00 . A A . 27 ARG HG2 1 1 14 6962 1 1 27 ARG HG3 H -14.577 2.234 6.229 1.00 . A A . 27 ARG HG3 1 1 14 6963 1 1 27 ARG HH11 H -12.827 2.898 10.366 1.00 . A A . 27 ARG HH11 1 1 14 6964 1 1 27 ARG HH12 H -13.449 4.079 11.468 1.00 . A A . 27 ARG HH12 1 1 14 6965 1 1 27 ARG HH21 H -15.986 5.173 9.328 1.00 . A A . 27 ARG HH21 1 1 14 6966 1 1 27 ARG HH22 H -15.243 5.371 10.880 1.00 . A A . 27 ARG HH22 1 1 14 6967 1 1 27 ARG N N -12.665 0.161 3.863 1.00 . A A . 27 ARG N 1 1 14 6968 1 1 27 ARG NE N -14.472 3.348 8.514 1.00 . A A . 27 ARG NE 1 1 14 6969 1 1 27 ARG NH1 N -13.487 3.617 10.583 1.00 . A A . 27 ARG NH1 1 1 14 6970 1 1 27 ARG NH2 N -15.286 4.913 9.992 1.00 . A A . 27 ARG NH2 1 1 14 6971 1 1 27 ARG O O -10.374 -0.187 6.580 1.00 . A A . 27 ARG O 1 1 14 6972 1 1 28 LYS C C -8.324 -1.714 3.665 1.00 . A A . 28 LYS C 1 1 14 6973 1 1 28 LYS CA C -9.431 -2.014 4.675 1.00 . A A . 28 LYS CA 1 1 14 6974 1 1 28 LYS CB C -9.912 -3.457 4.513 1.00 . A A . 28 LYS CB 1 1 14 6975 1 1 28 LYS CD C -7.881 -4.916 4.761 1.00 . A A . 28 LYS CD 1 1 14 6976 1 1 28 LYS CE C -7.484 -6.298 5.256 1.00 . A A . 28 LYS CE 1 1 14 6977 1 1 28 LYS CG C -9.178 -4.447 5.402 1.00 . A A . 28 LYS CG 1 1 14 6978 1 1 28 LYS H H -11.048 -1.058 3.668 1.00 . A A . 28 LYS H 1 1 14 6979 1 1 28 LYS HA H -9.031 -1.886 5.670 1.00 . A A . 28 LYS HA 1 1 14 6980 1 1 28 LYS HB2 H -10.964 -3.503 4.752 1.00 . A A . 28 LYS HB2 1 1 14 6981 1 1 28 LYS HB3 H -9.772 -3.757 3.484 1.00 . A A . 28 LYS HB3 1 1 14 6982 1 1 28 LYS HD2 H -8.013 -4.953 3.690 1.00 . A A . 28 LYS HD2 1 1 14 6983 1 1 28 LYS HD3 H -7.097 -4.216 5.005 1.00 . A A . 28 LYS HD3 1 1 14 6984 1 1 28 LYS HE2 H -6.482 -6.513 4.916 1.00 . A A . 28 LYS HE2 1 1 14 6985 1 1 28 LYS HE3 H -7.506 -6.299 6.336 1.00 . A A . 28 LYS HE3 1 1 14 6986 1 1 28 LYS HG2 H -8.950 -3.970 6.343 1.00 . A A . 28 LYS HG2 1 1 14 6987 1 1 28 LYS HG3 H -9.815 -5.302 5.573 1.00 . A A . 28 LYS HG3 1 1 14 6988 1 1 28 LYS HZ1 H -8.016 -7.781 3.885 1.00 . A A . 28 LYS HZ1 1 1 14 6989 1 1 28 LYS HZ2 H -9.335 -6.946 4.535 1.00 . A A . 28 LYS HZ2 1 1 14 6990 1 1 28 LYS HZ3 H -8.521 -8.099 5.468 1.00 . A A . 28 LYS HZ3 1 1 14 6991 1 1 28 LYS N N -10.547 -1.084 4.519 1.00 . A A . 28 LYS N 1 1 14 6992 1 1 28 LYS NZ N -8.403 -7.355 4.750 1.00 . A A . 28 LYS NZ 1 1 14 6993 1 1 28 LYS O O -8.340 -2.207 2.537 1.00 . A A . 28 LYS O 1 1 14 6994 1 1 29 CYS C C -5.317 -1.694 2.988 1.00 . A A . 29 CYS C 1 1 14 6995 1 1 29 CYS CA C -6.254 -0.516 3.227 1.00 . A A . 29 CYS CA 1 1 14 6996 1 1 29 CYS CB C -5.510 0.668 3.856 1.00 . A A . 29 CYS CB 1 1 14 6997 1 1 29 CYS H H -7.412 -0.529 4.986 1.00 . A A . 29 CYS H 1 1 14 6998 1 1 29 CYS HA H -6.664 -0.202 2.285 1.00 . A A . 29 CYS HA 1 1 14 6999 1 1 29 CYS HB2 H -5.886 1.573 3.421 1.00 . A A . 29 CYS HB2 1 1 14 7000 1 1 29 CYS HB3 H -5.718 0.676 4.910 1.00 . A A . 29 CYS HB3 1 1 14 7001 1 1 29 CYS N N -7.366 -0.895 4.082 1.00 . A A . 29 CYS N 1 1 14 7002 1 1 29 CYS O O -5.357 -2.695 3.702 1.00 . A A . 29 CYS O 1 1 14 7003 1 1 29 CYS SG S -3.693 0.682 3.651 1.00 . A A . 29 CYS SG 1 1 14 7004 1 1 30 LYS C C -2.653 -2.176 0.437 1.00 . A A . 30 LYS C 1 1 14 7005 1 1 30 LYS CA C -3.502 -2.589 1.637 1.00 . A A . 30 LYS CA 1 1 14 7006 1 1 30 LYS CB C -4.206 -3.919 1.350 1.00 . A A . 30 LYS CB 1 1 14 7007 1 1 30 LYS CD C -6.705 -4.201 1.292 1.00 . A A . 30 LYS CD 1 1 14 7008 1 1 30 LYS CE C -7.031 -5.668 1.066 1.00 . A A . 30 LYS CE 1 1 14 7009 1 1 30 LYS CG C -5.469 -3.779 0.515 1.00 . A A . 30 LYS CG 1 1 14 7010 1 1 30 LYS H H -4.483 -0.721 1.461 1.00 . A A . 30 LYS H 1 1 14 7011 1 1 30 LYS HA H -2.849 -2.718 2.487 1.00 . A A . 30 LYS HA 1 1 14 7012 1 1 30 LYS HB2 H -3.523 -4.567 0.824 1.00 . A A . 30 LYS HB2 1 1 14 7013 1 1 30 LYS HB3 H -4.472 -4.379 2.291 1.00 . A A . 30 LYS HB3 1 1 14 7014 1 1 30 LYS HD2 H -6.530 -4.039 2.345 1.00 . A A . 30 LYS HD2 1 1 14 7015 1 1 30 LYS HD3 H -7.543 -3.602 0.968 1.00 . A A . 30 LYS HD3 1 1 14 7016 1 1 30 LYS HE2 H -6.135 -6.251 1.218 1.00 . A A . 30 LYS HE2 1 1 14 7017 1 1 30 LYS HE3 H -7.782 -5.972 1.781 1.00 . A A . 30 LYS HE3 1 1 14 7018 1 1 30 LYS HG2 H -5.577 -2.749 0.218 1.00 . A A . 30 LYS HG2 1 1 14 7019 1 1 30 LYS HG3 H -5.376 -4.401 -0.364 1.00 . A A . 30 LYS HG3 1 1 14 7020 1 1 30 LYS HZ1 H -8.572 -5.777 -0.339 1.00 . A A . 30 LYS HZ1 1 1 14 7021 1 1 30 LYS HZ2 H -7.331 -6.896 -0.598 1.00 . A A . 30 LYS HZ2 1 1 14 7022 1 1 30 LYS HZ3 H -7.092 -5.267 -0.983 1.00 . A A . 30 LYS HZ3 1 1 14 7023 1 1 30 LYS N N -4.466 -1.552 1.980 1.00 . A A . 30 LYS N 1 1 14 7024 1 1 30 LYS NZ N -7.543 -5.919 -0.310 1.00 . A A . 30 LYS NZ 1 1 14 7025 1 1 30 LYS O O -3.004 -2.445 -0.706 1.00 . A A . 30 LYS O 1 1 14 7026 1 1 31 CYS C C -0.435 -2.022 -1.454 1.00 . A A . 31 CYS C 1 1 14 7027 1 1 31 CYS CA C -0.576 -1.058 -0.288 1.00 . A A . 31 CYS CA 1 1 14 7028 1 1 31 CYS CB C 0.791 -0.839 0.364 1.00 . A A . 31 CYS CB 1 1 14 7029 1 1 31 CYS H H -1.328 -1.351 1.670 1.00 . A A . 31 CYS H 1 1 14 7030 1 1 31 CYS HA H -0.917 -0.118 -0.686 1.00 . A A . 31 CYS HA 1 1 14 7031 1 1 31 CYS HB2 H 1.553 -0.846 -0.400 1.00 . A A . 31 CYS HB2 1 1 14 7032 1 1 31 CYS HB3 H 0.792 0.120 0.859 1.00 . A A . 31 CYS HB3 1 1 14 7033 1 1 31 CYS N N -1.530 -1.525 0.728 1.00 . A A . 31 CYS N 1 1 14 7034 1 1 31 CYS O O -0.923 -3.149 -1.432 1.00 . A A . 31 CYS O 1 1 14 7035 1 1 31 CYS SG S 1.232 -2.104 1.602 1.00 . A A . 31 CYS SG 1 1 14 7036 1 1 32 ASN C C 1.693 -3.147 -3.601 1.00 . A A . 32 ASN C 1 1 14 7037 1 1 32 ASN CA C 0.443 -2.285 -3.703 1.00 . A A . 32 ASN CA 1 1 14 7038 1 1 32 ASN CB C 0.599 -1.318 -4.858 1.00 . A A . 32 ASN CB 1 1 14 7039 1 1 32 ASN CG C 0.161 -1.902 -6.187 1.00 . A A . 32 ASN CG 1 1 14 7040 1 1 32 ASN H H 0.540 -0.606 -2.435 1.00 . A A . 32 ASN H 1 1 14 7041 1 1 32 ASN HA H -0.405 -2.912 -3.886 1.00 . A A . 32 ASN HA 1 1 14 7042 1 1 32 ASN HB2 H 0.011 -0.443 -4.659 1.00 . A A . 32 ASN HB2 1 1 14 7043 1 1 32 ASN HB3 H 1.628 -1.038 -4.924 1.00 . A A . 32 ASN HB3 1 1 14 7044 1 1 32 ASN HD21 H -1.713 -2.039 -5.539 1.00 . A A . 32 ASN HD21 1 1 14 7045 1 1 32 ASN HD22 H -1.436 -2.585 -7.155 1.00 . A A . 32 ASN HD22 1 1 14 7046 1 1 32 ASN N N 0.217 -1.530 -2.485 1.00 . A A . 32 ASN N 1 1 14 7047 1 1 32 ASN ND2 N -1.126 -2.206 -6.306 1.00 . A A . 32 ASN ND2 1 1 14 7048 1 1 32 ASN O O 2.401 -3.129 -2.594 1.00 . A A . 32 ASN O 1 1 14 7049 1 1 32 ASN OD1 O 0.971 -2.076 -7.098 1.00 . A A . 32 ASN OD1 1 1 14 7050 1 1 33 ARG C C 4.047 -4.284 -5.866 1.00 . A A . 33 ARG C 1 1 14 7051 1 1 33 ARG CA C 3.132 -4.746 -4.741 1.00 . A A . 33 ARG CA 1 1 14 7052 1 1 33 ARG CB C 2.717 -6.202 -4.958 1.00 . A A . 33 ARG CB 1 1 14 7053 1 1 33 ARG CD C 4.375 -7.226 -3.371 1.00 . A A . 33 ARG CD 1 1 14 7054 1 1 33 ARG CG C 3.861 -7.190 -4.802 1.00 . A A . 33 ARG CG 1 1 14 7055 1 1 33 ARG CZ C 5.909 -9.155 -3.408 1.00 . A A . 33 ARG CZ 1 1 14 7056 1 1 33 ARG H H 1.356 -3.831 -5.437 1.00 . A A . 33 ARG H 1 1 14 7057 1 1 33 ARG HA H 3.667 -4.661 -3.806 1.00 . A A . 33 ARG HA 1 1 14 7058 1 1 33 ARG HB2 H 1.950 -6.457 -4.242 1.00 . A A . 33 ARG HB2 1 1 14 7059 1 1 33 ARG HB3 H 2.315 -6.305 -5.954 1.00 . A A . 33 ARG HB3 1 1 14 7060 1 1 33 ARG HD2 H 5.217 -6.555 -3.287 1.00 . A A . 33 ARG HD2 1 1 14 7061 1 1 33 ARG HD3 H 3.585 -6.896 -2.711 1.00 . A A . 33 ARG HD3 1 1 14 7062 1 1 33 ARG HE H 4.220 -9.057 -2.351 1.00 . A A . 33 ARG HE 1 1 14 7063 1 1 33 ARG HG2 H 3.513 -8.176 -5.073 1.00 . A A . 33 ARG HG2 1 1 14 7064 1 1 33 ARG HG3 H 4.669 -6.898 -5.457 1.00 . A A . 33 ARG HG3 1 1 14 7065 1 1 33 ARG HH11 H 6.488 -7.600 -4.567 1.00 . A A . 33 ARG HH11 1 1 14 7066 1 1 33 ARG HH12 H 7.550 -8.968 -4.576 1.00 . A A . 33 ARG HH12 1 1 14 7067 1 1 33 ARG HH21 H 5.614 -10.858 -2.361 1.00 . A A . 33 ARG HH21 1 1 14 7068 1 1 33 ARG HH22 H 7.054 -10.818 -3.324 1.00 . A A . 33 ARG HH22 1 1 14 7069 1 1 33 ARG N N 1.960 -3.882 -4.668 1.00 . A A . 33 ARG N 1 1 14 7070 1 1 33 ARG NE N 4.796 -8.568 -2.974 1.00 . A A . 33 ARG NE 1 1 14 7071 1 1 33 ARG NH1 N 6.714 -8.522 -4.253 1.00 . A A . 33 ARG NH1 1 1 14 7072 1 1 33 ARG NH2 N 6.218 -10.377 -2.998 1.00 . A A . 33 ARG NH2 1 1 14 7073 1 1 33 ARG O O 3.920 -4.725 -7.009 1.00 . A A . 33 ARG O 1 1 14 7074 1 1 34 CYS C C 7.046 -3.782 -6.762 1.00 . A A . 34 CYS C 1 1 14 7075 1 1 34 CYS CA C 5.886 -2.827 -6.499 1.00 . A A . 34 CYS CA 1 1 14 7076 1 1 34 CYS CB C 6.399 -1.495 -5.991 1.00 . A A . 34 CYS CB 1 1 14 7077 1 1 34 CYS H H 4.994 -3.062 -4.606 1.00 . A A . 34 CYS H 1 1 14 7078 1 1 34 CYS HA H 5.356 -2.658 -7.411 1.00 . A A . 34 CYS HA 1 1 14 7079 1 1 34 CYS HB2 H 5.821 -1.218 -5.130 1.00 . A A . 34 CYS HB2 1 1 14 7080 1 1 34 CYS HB3 H 7.427 -1.604 -5.707 1.00 . A A . 34 CYS HB3 1 1 14 7081 1 1 34 CYS N N 4.954 -3.378 -5.532 1.00 . A A . 34 CYS N 1 1 14 7082 1 1 34 CYS O O 7.713 -4.186 -5.787 1.00 . A A . 34 CYS O 1 1 14 7083 1 1 34 CYS OXT O 7.278 -4.118 -7.943 1.00 . A A . 34 CYS OXT 1 1 14 7084 1 1 34 CYS SG S 6.280 -0.129 -7.191 1.00 . A A . 34 CYS SG 1 1 15 7085 1 1 1 VAL C C -8.461 2.105 -4.754 1.00 . A A . 1 VAL C 1 1 15 7086 1 1 1 VAL CA C -9.714 1.254 -4.929 1.00 . A A . 1 VAL CA 1 1 15 7087 1 1 1 VAL CB C -10.083 0.626 -3.572 1.00 . A A . 1 VAL CB 1 1 15 7088 1 1 1 VAL CG1 C -11.527 0.151 -3.576 1.00 . A A . 1 VAL CG1 1 1 15 7089 1 1 1 VAL CG2 C -9.137 -0.519 -3.240 1.00 . A A . 1 VAL CG2 1 1 15 7090 1 1 1 VAL H1 H -9.532 0.682 -6.896 1.00 . A A . 1 VAL H1 1 1 15 7091 1 1 1 VAL H2 H -10.288 -0.476 -5.880 1.00 . A A . 1 VAL H2 1 1 15 7092 1 1 1 VAL H3 H -8.591 -0.236 -5.795 1.00 . A A . 1 VAL H3 1 1 15 7093 1 1 1 VAL HA H -10.529 1.893 -5.240 1.00 . A A . 1 VAL HA 1 1 15 7094 1 1 1 VAL HB H -9.978 1.383 -2.807 1.00 . A A . 1 VAL HB 1 1 15 7095 1 1 1 VAL HG11 H -12.154 0.912 -4.016 1.00 . A A . 1 VAL HG11 1 1 15 7096 1 1 1 VAL HG12 H -11.848 -0.038 -2.563 1.00 . A A . 1 VAL HG12 1 1 15 7097 1 1 1 VAL HG13 H -11.606 -0.757 -4.155 1.00 . A A . 1 VAL HG13 1 1 15 7098 1 1 1 VAL HG21 H -9.325 -0.860 -2.232 1.00 . A A . 1 VAL HG21 1 1 15 7099 1 1 1 VAL HG22 H -8.116 -0.178 -3.321 1.00 . A A . 1 VAL HG22 1 1 15 7100 1 1 1 VAL HG23 H -9.302 -1.333 -3.932 1.00 . A A . 1 VAL HG23 1 1 15 7101 1 1 1 VAL N N -9.513 0.212 -5.969 1.00 . A A . 1 VAL N 1 1 15 7102 1 1 1 VAL O O -7.342 1.591 -4.768 1.00 . A A . 1 VAL O 1 1 15 7103 1 1 2 SER C C -7.448 4.803 -2.967 1.00 . A A . 2 SER C 1 1 15 7104 1 1 2 SER CA C -7.540 4.332 -4.415 1.00 . A A . 2 SER CA 1 1 15 7105 1 1 2 SER CB C -7.694 5.536 -5.346 1.00 . A A . 2 SER CB 1 1 15 7106 1 1 2 SER H H -9.571 3.760 -4.591 1.00 . A A . 2 SER H 1 1 15 7107 1 1 2 SER HA H -6.632 3.806 -4.669 1.00 . A A . 2 SER HA 1 1 15 7108 1 1 2 SER HB2 H -7.059 6.338 -5.003 1.00 . A A . 2 SER HB2 1 1 15 7109 1 1 2 SER HB3 H -7.407 5.253 -6.348 1.00 . A A . 2 SER HB3 1 1 15 7110 1 1 2 SER HG H -9.142 6.702 -4.728 1.00 . A A . 2 SER HG 1 1 15 7111 1 1 2 SER N N -8.656 3.410 -4.592 1.00 . A A . 2 SER N 1 1 15 7112 1 1 2 SER O O -8.463 5.083 -2.329 1.00 . A A . 2 SER O 1 1 15 7113 1 1 2 SER OG O -9.035 5.996 -5.369 1.00 . A A . 2 SER OG 1 1 15 7114 1 1 3 CYS C C -5.971 6.849 -0.992 1.00 . A A . 3 CYS C 1 1 15 7115 1 1 3 CYS CA C -6.000 5.326 -1.082 1.00 . A A . 3 CYS CA 1 1 15 7116 1 1 3 CYS CB C -4.690 4.747 -0.547 1.00 . A A . 3 CYS CB 1 1 15 7117 1 1 3 CYS H H -5.455 4.652 -3.014 1.00 . A A . 3 CYS H 1 1 15 7118 1 1 3 CYS HA H -6.817 4.960 -0.479 1.00 . A A . 3 CYS HA 1 1 15 7119 1 1 3 CYS HB2 H -3.863 5.272 -1.000 1.00 . A A . 3 CYS HB2 1 1 15 7120 1 1 3 CYS HB3 H -4.656 4.892 0.519 1.00 . A A . 3 CYS HB3 1 1 15 7121 1 1 3 CYS N N -6.225 4.889 -2.455 1.00 . A A . 3 CYS N 1 1 15 7122 1 1 3 CYS O O -6.007 7.542 -2.009 1.00 . A A . 3 CYS O 1 1 15 7123 1 1 3 CYS SG S -4.468 2.967 -0.874 1.00 . A A . 3 CYS SG 1 1 15 7124 1 1 4 THR C C -5.176 9.149 1.771 1.00 . A A . 4 THR C 1 1 15 7125 1 1 4 THR CA C -5.876 8.804 0.456 1.00 . A A . 4 THR CA 1 1 15 7126 1 1 4 THR CB C -7.298 9.369 0.458 1.00 . A A . 4 THR CB 1 1 15 7127 1 1 4 THR CG2 C -8.218 8.672 1.437 1.00 . A A . 4 THR CG2 1 1 15 7128 1 1 4 THR H H -5.884 6.756 1.001 1.00 . A A . 4 THR H 1 1 15 7129 1 1 4 THR HA H -5.325 9.251 -0.357 1.00 . A A . 4 THR HA 1 1 15 7130 1 1 4 THR HB H -7.720 9.255 -0.531 1.00 . A A . 4 THR HB 1 1 15 7131 1 1 4 THR HG1 H -7.036 10.858 1.702 1.00 . A A . 4 THR HG1 1 1 15 7132 1 1 4 THR HG21 H -8.719 9.409 2.046 1.00 . A A . 4 THR HG21 1 1 15 7133 1 1 4 THR HG22 H -7.639 8.015 2.070 1.00 . A A . 4 THR HG22 1 1 15 7134 1 1 4 THR HG23 H -8.952 8.095 0.895 1.00 . A A . 4 THR HG23 1 1 15 7135 1 1 4 THR N N -5.907 7.362 0.232 1.00 . A A . 4 THR N 1 1 15 7136 1 1 4 THR O O -5.754 9.799 2.643 1.00 . A A . 4 THR O 1 1 15 7137 1 1 4 THR OG1 O -7.290 10.747 0.783 1.00 . A A . 4 THR OG1 1 1 15 7138 1 1 5 GLY C C -3.831 8.467 4.368 1.00 . A A . 5 GLY C 1 1 15 7139 1 1 5 GLY CA C -3.161 8.996 3.112 1.00 . A A . 5 GLY CA 1 1 15 7140 1 1 5 GLY H H -3.515 8.207 1.172 1.00 . A A . 5 GLY H 1 1 15 7141 1 1 5 GLY HA2 H -2.187 8.541 3.020 1.00 . A A . 5 GLY HA2 1 1 15 7142 1 1 5 GLY HA3 H -3.040 10.065 3.206 1.00 . A A . 5 GLY HA3 1 1 15 7143 1 1 5 GLY N N -3.926 8.716 1.903 1.00 . A A . 5 GLY N 1 1 15 7144 1 1 5 GLY O O -3.551 7.350 4.804 1.00 . A A . 5 GLY O 1 1 15 7145 1 1 6 SER C C -4.483 8.714 7.343 1.00 . A A . 6 SER C 1 1 15 7146 1 1 6 SER CA C -5.436 8.870 6.156 1.00 . A A . 6 SER CA 1 1 15 7147 1 1 6 SER CB C -6.219 7.569 5.895 1.00 . A A . 6 SER CB 1 1 15 7148 1 1 6 SER H H -4.902 10.144 4.550 1.00 . A A . 6 SER H 1 1 15 7149 1 1 6 SER HA H -6.140 9.654 6.388 1.00 . A A . 6 SER HA 1 1 15 7150 1 1 6 SER HB2 H -7.257 7.801 5.783 1.00 . A A . 6 SER HB2 1 1 15 7151 1 1 6 SER HB3 H -5.852 7.110 4.996 1.00 . A A . 6 SER HB3 1 1 15 7152 1 1 6 SER HG H -6.802 5.984 6.886 1.00 . A A . 6 SER HG 1 1 15 7153 1 1 6 SER N N -4.719 9.267 4.948 1.00 . A A . 6 SER N 1 1 15 7154 1 1 6 SER O O -3.629 9.566 7.590 1.00 . A A . 6 SER O 1 1 15 7155 1 1 6 SER OG O -6.100 6.635 6.953 1.00 . A A . 6 SER OG 1 1 15 7156 1 1 7 LYS C C -2.340 7.381 8.939 1.00 . A A . 7 LYS C 1 1 15 7157 1 1 7 LYS CA C -3.837 7.326 9.248 1.00 . A A . 7 LYS CA 1 1 15 7158 1 1 7 LYS CB C -4.198 5.946 9.802 1.00 . A A . 7 LYS CB 1 1 15 7159 1 1 7 LYS CD C -5.081 4.006 8.464 1.00 . A A . 7 LYS CD 1 1 15 7160 1 1 7 LYS CE C -5.734 3.349 9.669 1.00 . A A . 7 LYS CE 1 1 15 7161 1 1 7 LYS CG C -3.848 4.802 8.863 1.00 . A A . 7 LYS CG 1 1 15 7162 1 1 7 LYS H H -5.365 6.999 7.809 1.00 . A A . 7 LYS H 1 1 15 7163 1 1 7 LYS HA H -4.060 8.069 9.999 1.00 . A A . 7 LYS HA 1 1 15 7164 1 1 7 LYS HB2 H -3.670 5.794 10.731 1.00 . A A . 7 LYS HB2 1 1 15 7165 1 1 7 LYS HB3 H -5.261 5.916 9.993 1.00 . A A . 7 LYS HB3 1 1 15 7166 1 1 7 LYS HD2 H -5.793 4.672 8.000 1.00 . A A . 7 LYS HD2 1 1 15 7167 1 1 7 LYS HD3 H -4.791 3.239 7.761 1.00 . A A . 7 LYS HD3 1 1 15 7168 1 1 7 LYS HE2 H -5.419 3.870 10.561 1.00 . A A . 7 LYS HE2 1 1 15 7169 1 1 7 LYS HE3 H -6.807 3.427 9.568 1.00 . A A . 7 LYS HE3 1 1 15 7170 1 1 7 LYS HG2 H -3.391 5.207 7.972 1.00 . A A . 7 LYS HG2 1 1 15 7171 1 1 7 LYS HG3 H -3.150 4.143 9.359 1.00 . A A . 7 LYS HG3 1 1 15 7172 1 1 7 LYS HZ1 H -6.166 1.364 10.154 1.00 . A A . 7 LYS HZ1 1 1 15 7173 1 1 7 LYS HZ2 H -4.559 1.805 10.444 1.00 . A A . 7 LYS HZ2 1 1 15 7174 1 1 7 LYS HZ3 H -5.088 1.535 8.860 1.00 . A A . 7 LYS HZ3 1 1 15 7175 1 1 7 LYS N N -4.652 7.624 8.072 1.00 . A A . 7 LYS N 1 1 15 7176 1 1 7 LYS NZ N -5.361 1.913 9.790 1.00 . A A . 7 LYS NZ 1 1 15 7177 1 1 7 LYS O O -1.525 7.511 9.852 1.00 . A A . 7 LYS O 1 1 15 7178 1 1 8 ASP C C -0.072 5.891 6.953 1.00 . A A . 8 ASP C 1 1 15 7179 1 1 8 ASP CA C -0.591 7.302 7.206 1.00 . A A . 8 ASP CA 1 1 15 7180 1 1 8 ASP CB C 0.314 8.019 8.213 1.00 . A A . 8 ASP CB 1 1 15 7181 1 1 8 ASP CG C 1.595 8.528 7.581 1.00 . A A . 8 ASP CG 1 1 15 7182 1 1 8 ASP H H -2.693 7.161 6.982 1.00 . A A . 8 ASP H 1 1 15 7183 1 1 8 ASP HA H -0.565 7.843 6.272 1.00 . A A . 8 ASP HA 1 1 15 7184 1 1 8 ASP HB2 H -0.218 8.860 8.630 1.00 . A A . 8 ASP HB2 1 1 15 7185 1 1 8 ASP HB3 H 0.572 7.333 9.006 1.00 . A A . 8 ASP HB3 1 1 15 7186 1 1 8 ASP N N -1.990 7.272 7.653 1.00 . A A . 8 ASP N 1 1 15 7187 1 1 8 ASP O O 1.031 5.535 7.369 1.00 . A A . 8 ASP O 1 1 15 7188 1 1 8 ASP OD1 O 1.520 9.468 6.762 1.00 . A A . 8 ASP OD1 1 1 15 7189 1 1 8 ASP OD2 O 2.672 7.986 7.905 1.00 . A A . 8 ASP OD2 1 1 15 7190 1 1 9 CYS C C 0.218 3.682 4.600 1.00 . A A . 9 CYS C 1 1 15 7191 1 1 9 CYS CA C -0.516 3.725 5.923 1.00 . A A . 9 CYS CA 1 1 15 7192 1 1 9 CYS CB C -1.769 2.871 5.808 1.00 . A A . 9 CYS CB 1 1 15 7193 1 1 9 CYS H H -1.737 5.450 5.952 1.00 . A A . 9 CYS H 1 1 15 7194 1 1 9 CYS HA H 0.110 3.334 6.690 1.00 . A A . 9 CYS HA 1 1 15 7195 1 1 9 CYS HB2 H -2.421 3.095 6.627 1.00 . A A . 9 CYS HB2 1 1 15 7196 1 1 9 CYS HB3 H -2.262 3.124 4.894 1.00 . A A . 9 CYS HB3 1 1 15 7197 1 1 9 CYS N N -0.876 5.097 6.257 1.00 . A A . 9 CYS N 1 1 15 7198 1 1 9 CYS O O 1.398 3.341 4.520 1.00 . A A . 9 CYS O 1 1 15 7199 1 1 9 CYS SG S -1.468 1.073 5.792 1.00 . A A . 9 CYS SG 1 1 15 7200 1 1 10 TYR C C 1.285 4.856 2.104 1.00 . A A . 10 TYR C 1 1 15 7201 1 1 10 TYR CA C -0.011 4.054 2.203 1.00 . A A . 10 TYR CA 1 1 15 7202 1 1 10 TYR CB C -1.066 4.636 1.251 1.00 . A A . 10 TYR CB 1 1 15 7203 1 1 10 TYR CD1 C -3.142 3.470 2.097 1.00 . A A . 10 TYR CD1 1 1 15 7204 1 1 10 TYR CD2 C -3.092 5.852 2.145 1.00 . A A . 10 TYR CD2 1 1 15 7205 1 1 10 TYR CE1 C -4.409 3.481 2.647 1.00 . A A . 10 TYR CE1 1 1 15 7206 1 1 10 TYR CE2 C -4.360 5.870 2.697 1.00 . A A . 10 TYR CE2 1 1 15 7207 1 1 10 TYR CG C -2.463 4.655 1.836 1.00 . A A . 10 TYR CG 1 1 15 7208 1 1 10 TYR CZ C -5.013 4.682 2.945 1.00 . A A . 10 TYR CZ 1 1 15 7209 1 1 10 TYR H H -1.454 4.283 3.736 1.00 . A A . 10 TYR H 1 1 15 7210 1 1 10 TYR HA H 0.193 3.034 1.914 1.00 . A A . 10 TYR HA 1 1 15 7211 1 1 10 TYR HB2 H -0.797 5.651 1.003 1.00 . A A . 10 TYR HB2 1 1 15 7212 1 1 10 TYR HB3 H -1.091 4.044 0.348 1.00 . A A . 10 TYR HB3 1 1 15 7213 1 1 10 TYR HD1 H -2.665 2.530 1.863 1.00 . A A . 10 TYR HD1 1 1 15 7214 1 1 10 TYR HD2 H -2.578 6.780 1.949 1.00 . A A . 10 TYR HD2 1 1 15 7215 1 1 10 TYR HE1 H -4.921 2.550 2.841 1.00 . A A . 10 TYR HE1 1 1 15 7216 1 1 10 TYR HE2 H -4.835 6.811 2.929 1.00 . A A . 10 TYR HE2 1 1 15 7217 1 1 10 TYR HH H -6.351 3.990 4.140 1.00 . A A . 10 TYR HH 1 1 15 7218 1 1 10 TYR N N -0.521 4.033 3.569 1.00 . A A . 10 TYR N 1 1 15 7219 1 1 10 TYR O O 2.063 4.667 1.172 1.00 . A A . 10 TYR O 1 1 15 7220 1 1 10 TYR OH O -6.275 4.697 3.494 1.00 . A A . 10 TYR OH 1 1 15 7221 1 1 11 ALA C C 3.962 5.752 3.410 1.00 . A A . 11 ALA C 1 1 15 7222 1 1 11 ALA CA C 2.726 6.571 3.050 1.00 . A A . 11 ALA CA 1 1 15 7223 1 1 11 ALA CB C 2.576 7.783 3.959 1.00 . A A . 11 ALA CB 1 1 15 7224 1 1 11 ALA H H 0.856 5.873 3.779 1.00 . A A . 11 ALA H 1 1 15 7225 1 1 11 ALA HA H 2.860 6.926 2.039 1.00 . A A . 11 ALA HA 1 1 15 7226 1 1 11 ALA HB1 H 3.513 7.978 4.457 1.00 . A A . 11 ALA HB1 1 1 15 7227 1 1 11 ALA HB2 H 1.809 7.587 4.696 1.00 . A A . 11 ALA HB2 1 1 15 7228 1 1 11 ALA HB3 H 2.295 8.643 3.369 1.00 . A A . 11 ALA HB3 1 1 15 7229 1 1 11 ALA N N 1.512 5.757 3.056 1.00 . A A . 11 ALA N 1 1 15 7230 1 1 11 ALA O O 4.742 5.388 2.530 1.00 . A A . 11 ALA O 1 1 15 7231 1 1 12 PRO C C 5.456 3.391 4.268 1.00 . A A . 12 PRO C 1 1 15 7232 1 1 12 PRO CA C 5.310 4.628 5.140 1.00 . A A . 12 PRO CA 1 1 15 7233 1 1 12 PRO CB C 4.972 4.241 6.589 1.00 . A A . 12 PRO CB 1 1 15 7234 1 1 12 PRO CD C 3.293 5.776 5.834 1.00 . A A . 12 PRO CD 1 1 15 7235 1 1 12 PRO CG C 3.552 4.658 6.801 1.00 . A A . 12 PRO CG 1 1 15 7236 1 1 12 PRO HA H 6.226 5.200 5.113 1.00 . A A . 12 PRO HA 1 1 15 7237 1 1 12 PRO HB2 H 5.091 3.175 6.715 1.00 . A A . 12 PRO HB2 1 1 15 7238 1 1 12 PRO HB3 H 5.637 4.761 7.263 1.00 . A A . 12 PRO HB3 1 1 15 7239 1 1 12 PRO HD2 H 2.255 5.788 5.536 1.00 . A A . 12 PRO HD2 1 1 15 7240 1 1 12 PRO HD3 H 3.579 6.725 6.263 1.00 . A A . 12 PRO HD3 1 1 15 7241 1 1 12 PRO HG2 H 2.892 3.827 6.598 1.00 . A A . 12 PRO HG2 1 1 15 7242 1 1 12 PRO HG3 H 3.419 5.003 7.816 1.00 . A A . 12 PRO HG3 1 1 15 7243 1 1 12 PRO N N 4.162 5.426 4.706 1.00 . A A . 12 PRO N 1 1 15 7244 1 1 12 PRO O O 6.555 2.874 4.065 1.00 . A A . 12 PRO O 1 1 15 7245 1 1 13 CYS C C 4.834 2.140 1.508 1.00 . A A . 13 CYS C 1 1 15 7246 1 1 13 CYS CA C 4.274 1.794 2.862 1.00 . A A . 13 CYS CA 1 1 15 7247 1 1 13 CYS CB C 2.838 1.352 2.690 1.00 . A A . 13 CYS CB 1 1 15 7248 1 1 13 CYS H H 3.491 3.420 3.937 1.00 . A A . 13 CYS H 1 1 15 7249 1 1 13 CYS HA H 4.845 1.001 3.291 1.00 . A A . 13 CYS HA 1 1 15 7250 1 1 13 CYS HB2 H 2.327 1.461 3.621 1.00 . A A . 13 CYS HB2 1 1 15 7251 1 1 13 CYS HB3 H 2.379 1.993 1.965 1.00 . A A . 13 CYS HB3 1 1 15 7252 1 1 13 CYS N N 4.325 2.945 3.740 1.00 . A A . 13 CYS N 1 1 15 7253 1 1 13 CYS O O 5.822 1.570 1.069 1.00 . A A . 13 CYS O 1 1 15 7254 1 1 13 CYS SG S 2.625 -0.361 2.113 1.00 . A A . 13 CYS SG 1 1 15 7255 1 1 14 ARG C C 6.107 3.689 -0.514 1.00 . A A . 14 ARG C 1 1 15 7256 1 1 14 ARG CA C 4.602 3.518 -0.474 1.00 . A A . 14 ARG CA 1 1 15 7257 1 1 14 ARG CB C 3.898 4.818 -0.872 1.00 . A A . 14 ARG CB 1 1 15 7258 1 1 14 ARG CD C 3.714 6.731 -2.490 1.00 . A A . 14 ARG CD 1 1 15 7259 1 1 14 ARG CG C 4.384 5.400 -2.190 1.00 . A A . 14 ARG CG 1 1 15 7260 1 1 14 ARG CZ C 5.511 8.403 -2.272 1.00 . A A . 14 ARG CZ 1 1 15 7261 1 1 14 ARG H H 3.397 3.495 1.271 1.00 . A A . 14 ARG H 1 1 15 7262 1 1 14 ARG HA H 4.335 2.738 -1.167 1.00 . A A . 14 ARG HA 1 1 15 7263 1 1 14 ARG HB2 H 2.839 4.624 -0.958 1.00 . A A . 14 ARG HB2 1 1 15 7264 1 1 14 ARG HB3 H 4.059 5.552 -0.097 1.00 . A A . 14 ARG HB3 1 1 15 7265 1 1 14 ARG HD2 H 3.733 6.896 -3.557 1.00 . A A . 14 ARG HD2 1 1 15 7266 1 1 14 ARG HD3 H 2.689 6.688 -2.152 1.00 . A A . 14 ARG HD3 1 1 15 7267 1 1 14 ARG HE H 3.981 8.196 -1.007 1.00 . A A . 14 ARG HE 1 1 15 7268 1 1 14 ARG HG2 H 5.451 5.550 -2.134 1.00 . A A . 14 ARG HG2 1 1 15 7269 1 1 14 ARG HG3 H 4.157 4.704 -2.984 1.00 . A A . 14 ARG HG3 1 1 15 7270 1 1 14 ARG HH11 H 5.683 7.194 -3.884 1.00 . A A . 14 ARG HH11 1 1 15 7271 1 1 14 ARG HH12 H 6.934 8.378 -3.707 1.00 . A A . 14 ARG HH12 1 1 15 7272 1 1 14 ARG HH21 H 5.625 9.754 -0.774 1.00 . A A . 14 ARG HH21 1 1 15 7273 1 1 14 ARG HH22 H 6.902 9.831 -1.942 1.00 . A A . 14 ARG HH22 1 1 15 7274 1 1 14 ARG N N 4.181 3.084 0.851 1.00 . A A . 14 ARG N 1 1 15 7275 1 1 14 ARG NE N 4.387 7.845 -1.827 1.00 . A A . 14 ARG NE 1 1 15 7276 1 1 14 ARG NH1 N 6.090 7.955 -3.378 1.00 . A A . 14 ARG NH1 1 1 15 7277 1 1 14 ARG NH2 N 6.057 9.413 -1.608 1.00 . A A . 14 ARG NH2 1 1 15 7278 1 1 14 ARG O O 6.751 3.412 -1.525 1.00 . A A . 14 ARG O 1 1 15 7279 1 1 15 LYS C C 8.765 2.911 0.457 1.00 . A A . 15 LYS C 1 1 15 7280 1 1 15 LYS CA C 8.106 4.263 0.707 1.00 . A A . 15 LYS CA 1 1 15 7281 1 1 15 LYS CB C 8.497 4.804 2.085 1.00 . A A . 15 LYS CB 1 1 15 7282 1 1 15 LYS CD C 7.946 7.198 1.563 1.00 . A A . 15 LYS CD 1 1 15 7283 1 1 15 LYS CE C 7.098 7.723 2.711 1.00 . A A . 15 LYS CE 1 1 15 7284 1 1 15 LYS CG C 9.012 6.233 2.054 1.00 . A A . 15 LYS CG 1 1 15 7285 1 1 15 LYS H H 6.101 4.287 1.394 1.00 . A A . 15 LYS H 1 1 15 7286 1 1 15 LYS HA H 8.423 4.960 -0.056 1.00 . A A . 15 LYS HA 1 1 15 7287 1 1 15 LYS HB2 H 7.632 4.769 2.730 1.00 . A A . 15 LYS HB2 1 1 15 7288 1 1 15 LYS HB3 H 9.271 4.174 2.502 1.00 . A A . 15 LYS HB3 1 1 15 7289 1 1 15 LYS HD2 H 8.426 8.033 1.074 1.00 . A A . 15 LYS HD2 1 1 15 7290 1 1 15 LYS HD3 H 7.306 6.686 0.859 1.00 . A A . 15 LYS HD3 1 1 15 7291 1 1 15 LYS HE2 H 6.331 6.997 2.936 1.00 . A A . 15 LYS HE2 1 1 15 7292 1 1 15 LYS HE3 H 7.730 7.857 3.577 1.00 . A A . 15 LYS HE3 1 1 15 7293 1 1 15 LYS HG2 H 9.311 6.520 3.051 1.00 . A A . 15 LYS HG2 1 1 15 7294 1 1 15 LYS HG3 H 9.864 6.284 1.391 1.00 . A A . 15 LYS HG3 1 1 15 7295 1 1 15 LYS HZ1 H 7.075 9.810 2.643 1.00 . A A . 15 LYS HZ1 1 1 15 7296 1 1 15 LYS HZ2 H 5.553 9.117 2.891 1.00 . A A . 15 LYS HZ2 1 1 15 7297 1 1 15 LYS HZ3 H 6.261 9.074 1.356 1.00 . A A . 15 LYS HZ3 1 1 15 7298 1 1 15 LYS N N 6.667 4.108 0.609 1.00 . A A . 15 LYS N 1 1 15 7299 1 1 15 LYS NZ N 6.452 9.022 2.377 1.00 . A A . 15 LYS NZ 1 1 15 7300 1 1 15 LYS O O 9.666 2.788 -0.373 1.00 . A A . 15 LYS O 1 1 15 7301 1 1 16 GLN C C 8.383 -0.090 -0.303 1.00 . A A . 16 GLN C 1 1 15 7302 1 1 16 GLN CA C 8.807 0.539 1.028 1.00 . A A . 16 GLN CA 1 1 15 7303 1 1 16 GLN CB C 8.329 -0.337 2.188 1.00 . A A . 16 GLN CB 1 1 15 7304 1 1 16 GLN CD C 9.373 -1.627 4.092 1.00 . A A . 16 GLN CD 1 1 15 7305 1 1 16 GLN CG C 9.327 -1.409 2.593 1.00 . A A . 16 GLN CG 1 1 15 7306 1 1 16 GLN H H 7.552 2.055 1.812 1.00 . A A . 16 GLN H 1 1 15 7307 1 1 16 GLN HA H 9.884 0.593 1.056 1.00 . A A . 16 GLN HA 1 1 15 7308 1 1 16 GLN HB2 H 8.142 0.293 3.046 1.00 . A A . 16 GLN HB2 1 1 15 7309 1 1 16 GLN HB3 H 7.408 -0.823 1.903 1.00 . A A . 16 GLN HB3 1 1 15 7310 1 1 16 GLN HE21 H 7.415 -1.967 4.128 1.00 . A A . 16 GLN HE21 1 1 15 7311 1 1 16 GLN HE22 H 8.220 -2.058 5.653 1.00 . A A . 16 GLN HE22 1 1 15 7312 1 1 16 GLN HG2 H 9.050 -2.338 2.118 1.00 . A A . 16 GLN HG2 1 1 15 7313 1 1 16 GLN HG3 H 10.311 -1.112 2.256 1.00 . A A . 16 GLN HG3 1 1 15 7314 1 1 16 GLN N N 8.289 1.893 1.175 1.00 . A A . 16 GLN N 1 1 15 7315 1 1 16 GLN NE2 N 8.219 -1.913 4.685 1.00 . A A . 16 GLN NE2 1 1 15 7316 1 1 16 GLN O O 9.222 -0.527 -1.091 1.00 . A A . 16 GLN O 1 1 15 7317 1 1 16 GLN OE1 O 10.433 -1.540 4.712 1.00 . A A . 16 GLN OE1 1 1 15 7318 1 1 17 THR C C 6.764 0.084 -2.986 1.00 . A A . 17 THR C 1 1 15 7319 1 1 17 THR CA C 6.512 -0.756 -1.736 1.00 . A A . 17 THR CA 1 1 15 7320 1 1 17 THR CB C 5.008 -0.978 -1.553 1.00 . A A . 17 THR CB 1 1 15 7321 1 1 17 THR CG2 C 4.210 0.307 -1.506 1.00 . A A . 17 THR CG2 1 1 15 7322 1 1 17 THR H H 6.453 0.194 0.144 1.00 . A A . 17 THR H 1 1 15 7323 1 1 17 THR HA H 6.985 -1.718 -1.869 1.00 . A A . 17 THR HA 1 1 15 7324 1 1 17 THR HB H 4.844 -1.501 -0.622 1.00 . A A . 17 THR HB 1 1 15 7325 1 1 17 THR HG1 H 4.272 -2.644 -2.271 1.00 . A A . 17 THR HG1 1 1 15 7326 1 1 17 THR HG21 H 4.175 0.672 -0.490 1.00 . A A . 17 THR HG21 1 1 15 7327 1 1 17 THR HG22 H 3.206 0.121 -1.856 1.00 . A A . 17 THR HG22 1 1 15 7328 1 1 17 THR HG23 H 4.680 1.047 -2.137 1.00 . A A . 17 THR HG23 1 1 15 7329 1 1 17 THR N N 7.069 -0.157 -0.528 1.00 . A A . 17 THR N 1 1 15 7330 1 1 17 THR O O 6.425 -0.334 -4.090 1.00 . A A . 17 THR O 1 1 15 7331 1 1 17 THR OG1 O 4.481 -1.768 -2.604 1.00 . A A . 17 THR OG1 1 1 15 7332 1 1 18 GLY C C 6.282 2.519 -4.640 1.00 . A A . 18 GLY C 1 1 15 7333 1 1 18 GLY CA C 7.573 2.114 -3.977 1.00 . A A . 18 GLY CA 1 1 15 7334 1 1 18 GLY H H 7.572 1.583 -1.928 1.00 . A A . 18 GLY H 1 1 15 7335 1 1 18 GLY HA2 H 8.104 2.996 -3.677 1.00 . A A . 18 GLY HA2 1 1 15 7336 1 1 18 GLY HA3 H 8.173 1.568 -4.686 1.00 . A A . 18 GLY HA3 1 1 15 7337 1 1 18 GLY N N 7.333 1.273 -2.822 1.00 . A A . 18 GLY N 1 1 15 7338 1 1 18 GLY O O 5.480 3.242 -4.049 1.00 . A A . 18 GLY O 1 1 15 7339 1 1 19 CYS C C 3.765 2.961 -5.783 1.00 . A A . 19 CYS C 1 1 15 7340 1 1 19 CYS CA C 4.871 2.324 -6.633 1.00 . A A . 19 CYS CA 1 1 15 7341 1 1 19 CYS CB C 4.375 1.111 -7.297 1.00 . A A . 19 CYS CB 1 1 15 7342 1 1 19 CYS H H 6.772 1.470 -6.251 1.00 . A A . 19 CYS H 1 1 15 7343 1 1 19 CYS HA H 5.105 2.958 -7.396 1.00 . A A . 19 CYS HA 1 1 15 7344 1 1 19 CYS HB2 H 4.200 0.409 -6.566 1.00 . A A . 19 CYS HB2 1 1 15 7345 1 1 19 CYS HB3 H 3.469 1.385 -7.781 1.00 . A A . 19 CYS HB3 1 1 15 7346 1 1 19 CYS N N 6.082 2.038 -5.863 1.00 . A A . 19 CYS N 1 1 15 7347 1 1 19 CYS O O 3.220 2.326 -4.880 1.00 . A A . 19 CYS O 1 1 15 7348 1 1 19 CYS SG S 5.484 0.395 -8.567 1.00 . A A . 19 CYS SG 1 1 15 7349 1 1 20 PRO C C 1.109 4.270 -5.102 1.00 . A A . 20 PRO C 1 1 15 7350 1 1 20 PRO CA C 2.438 5.002 -5.285 1.00 . A A . 20 PRO CA 1 1 15 7351 1 1 20 PRO CB C 2.234 6.256 -6.133 1.00 . A A . 20 PRO CB 1 1 15 7352 1 1 20 PRO CD C 4.081 5.081 -7.085 1.00 . A A . 20 PRO CD 1 1 15 7353 1 1 20 PRO CG C 3.541 6.458 -6.815 1.00 . A A . 20 PRO CG 1 1 15 7354 1 1 20 PRO HA H 2.814 5.289 -4.315 1.00 . A A . 20 PRO HA 1 1 15 7355 1 1 20 PRO HB2 H 1.437 6.090 -6.843 1.00 . A A . 20 PRO HB2 1 1 15 7356 1 1 20 PRO HB3 H 1.989 7.092 -5.495 1.00 . A A . 20 PRO HB3 1 1 15 7357 1 1 20 PRO HD2 H 3.792 4.749 -8.070 1.00 . A A . 20 PRO HD2 1 1 15 7358 1 1 20 PRO HD3 H 5.155 5.070 -6.983 1.00 . A A . 20 PRO HD3 1 1 15 7359 1 1 20 PRO HG2 H 3.393 6.992 -7.741 1.00 . A A . 20 PRO HG2 1 1 15 7360 1 1 20 PRO HG3 H 4.212 7.004 -6.168 1.00 . A A . 20 PRO HG3 1 1 15 7361 1 1 20 PRO N N 3.449 4.246 -6.043 1.00 . A A . 20 PRO N 1 1 15 7362 1 1 20 PRO O O 0.337 4.600 -4.203 1.00 . A A . 20 PRO O 1 1 15 7363 1 1 21 TYR C C -0.462 1.662 -4.650 1.00 . A A . 21 TYR C 1 1 15 7364 1 1 21 TYR CA C -0.408 2.561 -5.884 1.00 . A A . 21 TYR CA 1 1 15 7365 1 1 21 TYR CB C -0.575 1.729 -7.148 1.00 . A A . 21 TYR CB 1 1 15 7366 1 1 21 TYR CD1 C -0.468 3.442 -9.002 1.00 . A A . 21 TYR CD1 1 1 15 7367 1 1 21 TYR CD2 C 1.235 1.776 -8.915 1.00 . A A . 21 TYR CD2 1 1 15 7368 1 1 21 TYR CE1 C 0.121 3.993 -10.123 1.00 . A A . 21 TYR CE1 1 1 15 7369 1 1 21 TYR CE2 C 1.831 2.323 -10.037 1.00 . A A . 21 TYR CE2 1 1 15 7370 1 1 21 TYR CG C 0.077 2.326 -8.380 1.00 . A A . 21 TYR CG 1 1 15 7371 1 1 21 TYR CZ C 1.270 3.431 -10.636 1.00 . A A . 21 TYR CZ 1 1 15 7372 1 1 21 TYR H H 1.456 3.077 -6.669 1.00 . A A . 21 TYR H 1 1 15 7373 1 1 21 TYR HA H -1.216 3.274 -5.829 1.00 . A A . 21 TYR HA 1 1 15 7374 1 1 21 TYR HB2 H -0.160 0.749 -6.988 1.00 . A A . 21 TYR HB2 1 1 15 7375 1 1 21 TYR HB3 H -1.612 1.641 -7.349 1.00 . A A . 21 TYR HB3 1 1 15 7376 1 1 21 TYR HD1 H -1.368 3.881 -8.597 1.00 . A A . 21 TYR HD1 1 1 15 7377 1 1 21 TYR HD2 H 1.672 0.908 -8.443 1.00 . A A . 21 TYR HD2 1 1 15 7378 1 1 21 TYR HE1 H -0.318 4.861 -10.593 1.00 . A A . 21 TYR HE1 1 1 15 7379 1 1 21 TYR HE2 H 2.731 1.884 -10.438 1.00 . A A . 21 TYR HE2 1 1 15 7380 1 1 21 TYR HH H 1.345 3.751 -12.530 1.00 . A A . 21 TYR HH 1 1 15 7381 1 1 21 TYR N N 0.830 3.297 -5.958 1.00 . A A . 21 TYR N 1 1 15 7382 1 1 21 TYR O O 0.547 1.432 -3.983 1.00 . A A . 21 TYR O 1 1 15 7383 1 1 21 TYR OH O 1.860 3.977 -11.752 1.00 . A A . 21 TYR OH 1 1 15 7384 1 1 22 GLY C C -3.121 -0.541 -3.347 1.00 . A A . 22 GLY C 1 1 15 7385 1 1 22 GLY CA C -1.864 0.297 -3.209 1.00 . A A . 22 GLY CA 1 1 15 7386 1 1 22 GLY H H -2.419 1.392 -4.934 1.00 . A A . 22 GLY H 1 1 15 7387 1 1 22 GLY HA2 H -1.016 -0.353 -3.105 1.00 . A A . 22 GLY HA2 1 1 15 7388 1 1 22 GLY HA3 H -1.946 0.905 -2.322 1.00 . A A . 22 GLY HA3 1 1 15 7389 1 1 22 GLY N N -1.660 1.165 -4.359 1.00 . A A . 22 GLY N 1 1 15 7390 1 1 22 GLY O O -4.055 -0.143 -4.044 1.00 . A A . 22 GLY O 1 1 15 7391 1 1 23 LYS C C -5.265 -2.238 -1.548 1.00 . A A . 23 LYS C 1 1 15 7392 1 1 23 LYS CA C -4.355 -2.537 -2.736 1.00 . A A . 23 LYS CA 1 1 15 7393 1 1 23 LYS CB C -3.970 -4.019 -2.763 1.00 . A A . 23 LYS CB 1 1 15 7394 1 1 23 LYS CD C -4.281 -6.278 -3.819 1.00 . A A . 23 LYS CD 1 1 15 7395 1 1 23 LYS CE C -5.018 -7.078 -4.881 1.00 . A A . 23 LYS CE 1 1 15 7396 1 1 23 LYS CG C -4.686 -4.813 -3.844 1.00 . A A . 23 LYS CG 1 1 15 7397 1 1 23 LYS H H -2.419 -1.962 -2.107 1.00 . A A . 23 LYS H 1 1 15 7398 1 1 23 LYS HA H -4.880 -2.292 -3.644 1.00 . A A . 23 LYS HA 1 1 15 7399 1 1 23 LYS HB2 H -2.907 -4.100 -2.931 1.00 . A A . 23 LYS HB2 1 1 15 7400 1 1 23 LYS HB3 H -4.208 -4.460 -1.805 1.00 . A A . 23 LYS HB3 1 1 15 7401 1 1 23 LYS HD2 H -3.219 -6.352 -3.999 1.00 . A A . 23 LYS HD2 1 1 15 7402 1 1 23 LYS HD3 H -4.511 -6.688 -2.847 1.00 . A A . 23 LYS HD3 1 1 15 7403 1 1 23 LYS HE2 H -5.129 -8.094 -4.535 1.00 . A A . 23 LYS HE2 1 1 15 7404 1 1 23 LYS HE3 H -5.994 -6.640 -5.030 1.00 . A A . 23 LYS HE3 1 1 15 7405 1 1 23 LYS HG2 H -5.751 -4.741 -3.684 1.00 . A A . 23 LYS HG2 1 1 15 7406 1 1 23 LYS HG3 H -4.435 -4.395 -4.808 1.00 . A A . 23 LYS HG3 1 1 15 7407 1 1 23 LYS HZ1 H -4.695 -7.800 -6.814 1.00 . A A . 23 LYS HZ1 1 1 15 7408 1 1 23 LYS HZ2 H -3.283 -7.311 -6.021 1.00 . A A . 23 LYS HZ2 1 1 15 7409 1 1 23 LYS HZ3 H -4.354 -6.152 -6.632 1.00 . A A . 23 LYS HZ3 1 1 15 7410 1 1 23 LYS N N -3.171 -1.691 -2.673 1.00 . A A . 23 LYS N 1 1 15 7411 1 1 23 LYS NZ N -4.286 -7.085 -6.178 1.00 . A A . 23 LYS NZ 1 1 15 7412 1 1 23 LYS O O -6.251 -2.934 -1.310 1.00 . A A . 23 LYS O 1 1 15 7413 1 1 24 CYS C C -7.151 -0.586 0.022 1.00 . A A . 24 CYS C 1 1 15 7414 1 1 24 CYS CA C -5.667 -0.757 0.358 1.00 . A A . 24 CYS CA 1 1 15 7415 1 1 24 CYS CB C -5.062 0.551 0.892 1.00 . A A . 24 CYS CB 1 1 15 7416 1 1 24 CYS H H -4.115 -0.677 -1.061 1.00 . A A . 24 CYS H 1 1 15 7417 1 1 24 CYS HA H -5.569 -1.517 1.119 1.00 . A A . 24 CYS HA 1 1 15 7418 1 1 24 CYS HB2 H -5.116 0.549 1.968 1.00 . A A . 24 CYS HB2 1 1 15 7419 1 1 24 CYS HB3 H -4.021 0.593 0.596 1.00 . A A . 24 CYS HB3 1 1 15 7420 1 1 24 CYS N N -4.913 -1.186 -0.809 1.00 . A A . 24 CYS N 1 1 15 7421 1 1 24 CYS O O -7.503 0.058 -0.966 1.00 . A A . 24 CYS O 1 1 15 7422 1 1 24 CYS SG S -5.872 2.078 0.294 1.00 . A A . 24 CYS SG 1 1 15 7423 1 1 25 MET C C -10.112 -0.320 1.781 1.00 . A A . 25 MET C 1 1 15 7424 1 1 25 MET CA C -9.453 -1.081 0.640 1.00 . A A . 25 MET CA 1 1 15 7425 1 1 25 MET CB C -10.062 -2.480 0.522 1.00 . A A . 25 MET CB 1 1 15 7426 1 1 25 MET CE C -12.723 -4.627 -1.322 1.00 . A A . 25 MET CE 1 1 15 7427 1 1 25 MET CG C -11.447 -2.491 -0.104 1.00 . A A . 25 MET CG 1 1 15 7428 1 1 25 MET H H -7.670 -1.669 1.619 1.00 . A A . 25 MET H 1 1 15 7429 1 1 25 MET HA H -9.626 -0.542 -0.281 1.00 . A A . 25 MET HA 1 1 15 7430 1 1 25 MET HB2 H -9.411 -3.092 -0.084 1.00 . A A . 25 MET HB2 1 1 15 7431 1 1 25 MET HB3 H -10.132 -2.913 1.509 1.00 . A A . 25 MET HB3 1 1 15 7432 1 1 25 MET HE1 H -13.065 -3.829 -1.965 1.00 . A A . 25 MET HE1 1 1 15 7433 1 1 25 MET HE2 H -13.489 -5.386 -1.254 1.00 . A A . 25 MET HE2 1 1 15 7434 1 1 25 MET HE3 H -11.824 -5.059 -1.732 1.00 . A A . 25 MET HE3 1 1 15 7435 1 1 25 MET HG2 H -11.992 -1.628 0.247 1.00 . A A . 25 MET HG2 1 1 15 7436 1 1 25 MET HG3 H -11.342 -2.436 -1.178 1.00 . A A . 25 MET HG3 1 1 15 7437 1 1 25 MET N N -8.012 -1.169 0.848 1.00 . A A . 25 MET N 1 1 15 7438 1 1 25 MET O O -9.709 -0.448 2.935 1.00 . A A . 25 MET O 1 1 15 7439 1 1 25 MET SD S -12.384 -3.973 0.310 1.00 . A A . 25 MET SD 1 1 15 7440 1 1 26 ASN C C -11.995 0.499 3.762 1.00 . A A . 26 ASN C 1 1 15 7441 1 1 26 ASN CA C -11.841 1.273 2.455 1.00 . A A . 26 ASN CA 1 1 15 7442 1 1 26 ASN CB C -13.228 1.701 1.958 1.00 . A A . 26 ASN CB 1 1 15 7443 1 1 26 ASN CG C -13.333 1.772 0.445 1.00 . A A . 26 ASN CG 1 1 15 7444 1 1 26 ASN H H -11.391 0.537 0.510 1.00 . A A . 26 ASN H 1 1 15 7445 1 1 26 ASN HA H -11.253 2.159 2.650 1.00 . A A . 26 ASN HA 1 1 15 7446 1 1 26 ASN HB2 H -13.957 0.996 2.319 1.00 . A A . 26 ASN HB2 1 1 15 7447 1 1 26 ASN HB3 H -13.456 2.678 2.360 1.00 . A A . 26 ASN HB3 1 1 15 7448 1 1 26 ASN HD21 H -12.407 3.532 0.437 1.00 . A A . 26 ASN HD21 1 1 15 7449 1 1 26 ASN HD22 H -12.873 2.922 -1.110 1.00 . A A . 26 ASN HD22 1 1 15 7450 1 1 26 ASN N N -11.125 0.478 1.450 1.00 . A A . 26 ASN N 1 1 15 7451 1 1 26 ASN ND2 N -12.819 2.851 -0.135 1.00 . A A . 26 ASN ND2 1 1 15 7452 1 1 26 ASN O O -12.579 -0.585 3.791 1.00 . A A . 26 ASN O 1 1 15 7453 1 1 26 ASN OD1 O -13.868 0.867 -0.194 1.00 . A A . 26 ASN OD1 1 1 15 7454 1 1 27 ARG C C -10.524 -0.728 6.226 1.00 . A A . 27 ARG C 1 1 15 7455 1 1 27 ARG CA C -11.510 0.432 6.150 1.00 . A A . 27 ARG CA 1 1 15 7456 1 1 27 ARG CB C -12.927 -0.060 6.458 1.00 . A A . 27 ARG CB 1 1 15 7457 1 1 27 ARG CD C -14.806 0.823 7.876 1.00 . A A . 27 ARG CD 1 1 15 7458 1 1 27 ARG CG C -13.390 0.274 7.868 1.00 . A A . 27 ARG CG 1 1 15 7459 1 1 27 ARG CZ C -17.052 0.017 7.259 1.00 . A A . 27 ARG CZ 1 1 15 7460 1 1 27 ARG H H -10.996 1.918 4.736 1.00 . A A . 27 ARG H 1 1 15 7461 1 1 27 ARG HA H -11.229 1.174 6.882 1.00 . A A . 27 ARG HA 1 1 15 7462 1 1 27 ARG HB2 H -13.614 0.396 5.759 1.00 . A A . 27 ARG HB2 1 1 15 7463 1 1 27 ARG HB3 H -12.961 -1.132 6.335 1.00 . A A . 27 ARG HB3 1 1 15 7464 1 1 27 ARG HD2 H -14.996 1.281 8.835 1.00 . A A . 27 ARG HD2 1 1 15 7465 1 1 27 ARG HD3 H -14.894 1.568 7.098 1.00 . A A . 27 ARG HD3 1 1 15 7466 1 1 27 ARG HE H -15.521 -1.151 7.786 1.00 . A A . 27 ARG HE 1 1 15 7467 1 1 27 ARG HG2 H -13.358 -0.622 8.468 1.00 . A A . 27 ARG HG2 1 1 15 7468 1 1 27 ARG HG3 H -12.723 1.014 8.287 1.00 . A A . 27 ARG HG3 1 1 15 7469 1 1 27 ARG HH11 H -16.838 2.027 7.198 1.00 . A A . 27 ARG HH11 1 1 15 7470 1 1 27 ARG HH12 H -18.407 1.434 6.769 1.00 . A A . 27 ARG HH12 1 1 15 7471 1 1 27 ARG HH21 H -17.584 -1.932 7.221 1.00 . A A . 27 ARG HH21 1 1 15 7472 1 1 27 ARG HH22 H -18.832 -0.814 6.782 1.00 . A A . 27 ARG HH22 1 1 15 7473 1 1 27 ARG N N -11.454 1.061 4.834 1.00 . A A . 27 ARG N 1 1 15 7474 1 1 27 ARG NE N -15.801 -0.222 7.645 1.00 . A A . 27 ARG NE 1 1 15 7475 1 1 27 ARG NH1 N -17.466 1.261 7.059 1.00 . A A . 27 ARG NH1 1 1 15 7476 1 1 27 ARG NH2 N -17.892 -0.993 7.072 1.00 . A A . 27 ARG NH2 1 1 15 7477 1 1 27 ARG O O -10.754 -1.709 6.935 1.00 . A A . 27 ARG O 1 1 15 7478 1 1 28 LYS C C -7.236 -1.259 4.558 1.00 . A A . 28 LYS C 1 1 15 7479 1 1 28 LYS CA C -8.399 -1.648 5.464 1.00 . A A . 28 LYS CA 1 1 15 7480 1 1 28 LYS CB C -8.999 -2.975 4.998 1.00 . A A . 28 LYS CB 1 1 15 7481 1 1 28 LYS CD C -7.270 -4.794 4.861 1.00 . A A . 28 LYS CD 1 1 15 7482 1 1 28 LYS CE C -7.793 -5.831 3.880 1.00 . A A . 28 LYS CE 1 1 15 7483 1 1 28 LYS CG C -8.396 -4.190 5.685 1.00 . A A . 28 LYS CG 1 1 15 7484 1 1 28 LYS H H -9.304 0.199 4.941 1.00 . A A . 28 LYS H 1 1 15 7485 1 1 28 LYS HA H -8.024 -1.767 6.470 1.00 . A A . 28 LYS HA 1 1 15 7486 1 1 28 LYS HB2 H -10.061 -2.968 5.196 1.00 . A A . 28 LYS HB2 1 1 15 7487 1 1 28 LYS HB3 H -8.841 -3.075 3.934 1.00 . A A . 28 LYS HB3 1 1 15 7488 1 1 28 LYS HD2 H -6.779 -4.007 4.309 1.00 . A A . 28 LYS HD2 1 1 15 7489 1 1 28 LYS HD3 H -6.562 -5.265 5.528 1.00 . A A . 28 LYS HD3 1 1 15 7490 1 1 28 LYS HE2 H -8.727 -5.481 3.469 1.00 . A A . 28 LYS HE2 1 1 15 7491 1 1 28 LYS HE3 H -7.073 -5.950 3.084 1.00 . A A . 28 LYS HE3 1 1 15 7492 1 1 28 LYS HG2 H -8.004 -3.891 6.645 1.00 . A A . 28 LYS HG2 1 1 15 7493 1 1 28 LYS HG3 H -9.167 -4.933 5.824 1.00 . A A . 28 LYS HG3 1 1 15 7494 1 1 28 LYS HZ1 H -8.802 -7.086 5.211 1.00 . A A . 28 LYS HZ1 1 1 15 7495 1 1 28 LYS HZ2 H -7.159 -7.448 5.042 1.00 . A A . 28 LYS HZ2 1 1 15 7496 1 1 28 LYS HZ3 H -8.247 -7.869 3.818 1.00 . A A . 28 LYS HZ3 1 1 15 7497 1 1 28 LYS N N -9.425 -0.608 5.486 1.00 . A A . 28 LYS N 1 1 15 7498 1 1 28 LYS NZ N -8.015 -7.151 4.533 1.00 . A A . 28 LYS NZ 1 1 15 7499 1 1 28 LYS O O -7.419 -0.608 3.530 1.00 . A A . 28 LYS O 1 1 15 7500 1 1 29 CYS C C -4.287 -2.618 3.531 1.00 . A A . 29 CYS C 1 1 15 7501 1 1 29 CYS CA C -4.840 -1.371 4.191 1.00 . A A . 29 CYS CA 1 1 15 7502 1 1 29 CYS CB C -3.779 -0.759 5.088 1.00 . A A . 29 CYS CB 1 1 15 7503 1 1 29 CYS H H -5.957 -2.171 5.770 1.00 . A A . 29 CYS H 1 1 15 7504 1 1 29 CYS HA H -5.102 -0.668 3.444 1.00 . A A . 29 CYS HA 1 1 15 7505 1 1 29 CYS HB2 H -4.267 -0.221 5.869 1.00 . A A . 29 CYS HB2 1 1 15 7506 1 1 29 CYS HB3 H -3.195 -1.552 5.511 1.00 . A A . 29 CYS HB3 1 1 15 7507 1 1 29 CYS N N -6.037 -1.665 4.950 1.00 . A A . 29 CYS N 1 1 15 7508 1 1 29 CYS O O -4.566 -3.740 3.955 1.00 . A A . 29 CYS O 1 1 15 7509 1 1 29 CYS SG S -2.633 0.396 4.267 1.00 . A A . 29 CYS SG 1 1 15 7510 1 1 30 LYS C C -2.245 -3.023 0.467 1.00 . A A . 30 LYS C 1 1 15 7511 1 1 30 LYS CA C -2.857 -3.507 1.772 1.00 . A A . 30 LYS CA 1 1 15 7512 1 1 30 LYS CB C -3.850 -4.646 1.499 1.00 . A A . 30 LYS CB 1 1 15 7513 1 1 30 LYS CD C -6.016 -5.203 0.357 1.00 . A A . 30 LYS CD 1 1 15 7514 1 1 30 LYS CE C -7.519 -5.071 0.545 1.00 . A A . 30 LYS CE 1 1 15 7515 1 1 30 LYS CG C -5.260 -4.177 1.185 1.00 . A A . 30 LYS CG 1 1 15 7516 1 1 30 LYS H H -3.293 -1.484 2.231 1.00 . A A . 30 LYS H 1 1 15 7517 1 1 30 LYS HA H -2.056 -3.885 2.391 1.00 . A A . 30 LYS HA 1 1 15 7518 1 1 30 LYS HB2 H -3.493 -5.224 0.660 1.00 . A A . 30 LYS HB2 1 1 15 7519 1 1 30 LYS HB3 H -3.892 -5.284 2.370 1.00 . A A . 30 LYS HB3 1 1 15 7520 1 1 30 LYS HD2 H -5.781 -5.055 -0.685 1.00 . A A . 30 LYS HD2 1 1 15 7521 1 1 30 LYS HD3 H -5.710 -6.193 0.661 1.00 . A A . 30 LYS HD3 1 1 15 7522 1 1 30 LYS HE2 H -7.710 -4.595 1.495 1.00 . A A . 30 LYS HE2 1 1 15 7523 1 1 30 LYS HE3 H -7.916 -4.458 -0.249 1.00 . A A . 30 LYS HE3 1 1 15 7524 1 1 30 LYS HG2 H -5.790 -4.014 2.111 1.00 . A A . 30 LYS HG2 1 1 15 7525 1 1 30 LYS HG3 H -5.204 -3.254 0.634 1.00 . A A . 30 LYS HG3 1 1 15 7526 1 1 30 LYS HZ1 H -9.188 -6.284 0.216 1.00 . A A . 30 LYS HZ1 1 1 15 7527 1 1 30 LYS HZ2 H -8.189 -6.820 1.472 1.00 . A A . 30 LYS HZ2 1 1 15 7528 1 1 30 LYS HZ3 H -7.714 -7.035 -0.137 1.00 . A A . 30 LYS HZ3 1 1 15 7529 1 1 30 LYS N N -3.484 -2.409 2.500 1.00 . A A . 30 LYS N 1 1 15 7530 1 1 30 LYS NZ N -8.200 -6.395 0.523 1.00 . A A . 30 LYS NZ 1 1 15 7531 1 1 30 LYS O O -2.824 -3.175 -0.601 1.00 . A A . 30 LYS O 1 1 15 7532 1 1 31 CYS C C -0.414 -2.774 -1.794 1.00 . A A . 31 CYS C 1 1 15 7533 1 1 31 CYS CA C -0.292 -1.918 -0.543 1.00 . A A . 31 CYS CA 1 1 15 7534 1 1 31 CYS CB C 1.181 -1.802 -0.146 1.00 . A A . 31 CYS CB 1 1 15 7535 1 1 31 CYS H H -0.684 -2.364 1.490 1.00 . A A . 31 CYS H 1 1 15 7536 1 1 31 CYS HA H -0.654 -0.933 -0.789 1.00 . A A . 31 CYS HA 1 1 15 7537 1 1 31 CYS HB2 H 1.372 -2.452 0.695 1.00 . A A . 31 CYS HB2 1 1 15 7538 1 1 31 CYS HB3 H 1.798 -2.110 -0.978 1.00 . A A . 31 CYS HB3 1 1 15 7539 1 1 31 CYS N N -1.061 -2.443 0.591 1.00 . A A . 31 CYS N 1 1 15 7540 1 1 31 CYS O O -0.965 -3.869 -1.786 1.00 . A A . 31 CYS O 1 1 15 7541 1 1 31 CYS SG S 1.687 -0.120 0.328 1.00 . A A . 31 CYS SG 1 1 15 7542 1 1 32 ASN C C 1.390 -3.526 -4.468 1.00 . A A . 32 ASN C 1 1 15 7543 1 1 32 ASN CA C 0.071 -2.835 -4.180 1.00 . A A . 32 ASN CA 1 1 15 7544 1 1 32 ASN CB C -0.172 -1.747 -5.208 1.00 . A A . 32 ASN CB 1 1 15 7545 1 1 32 ASN CG C -0.994 -2.218 -6.392 1.00 . A A . 32 ASN CG 1 1 15 7546 1 1 32 ASN H H 0.471 -1.315 -2.793 1.00 . A A . 32 ASN H 1 1 15 7547 1 1 32 ASN HA H -0.717 -3.554 -4.240 1.00 . A A . 32 ASN HA 1 1 15 7548 1 1 32 ASN HB2 H -0.692 -0.936 -4.733 1.00 . A A . 32 ASN HB2 1 1 15 7549 1 1 32 ASN HB3 H 0.776 -1.394 -5.553 1.00 . A A . 32 ASN HB3 1 1 15 7550 1 1 32 ASN HD21 H 0.081 -1.084 -7.622 1.00 . A A . 32 ASN HD21 1 1 15 7551 1 1 32 ASN HD22 H -1.179 -2.005 -8.360 1.00 . A A . 32 ASN HD22 1 1 15 7552 1 1 32 ASN N N 0.088 -2.213 -2.873 1.00 . A A . 32 ASN N 1 1 15 7553 1 1 32 ASN ND2 N -0.664 -1.718 -7.577 1.00 . A A . 32 ASN ND2 1 1 15 7554 1 1 32 ASN O O 2.229 -3.709 -3.586 1.00 . A A . 32 ASN O 1 1 15 7555 1 1 32 ASN OD1 O -1.913 -3.022 -6.245 1.00 . A A . 32 ASN OD1 1 1 15 7556 1 1 33 ARG C C 3.941 -3.602 -6.140 1.00 . A A . 33 ARG C 1 1 15 7557 1 1 33 ARG CA C 2.769 -4.544 -6.186 1.00 . A A . 33 ARG CA 1 1 15 7558 1 1 33 ARG CB C 2.575 -5.117 -7.595 1.00 . A A . 33 ARG CB 1 1 15 7559 1 1 33 ARG CD C 2.108 -2.802 -8.337 1.00 . A A . 33 ARG CD 1 1 15 7560 1 1 33 ARG CG C 2.779 -4.107 -8.695 1.00 . A A . 33 ARG CG 1 1 15 7561 1 1 33 ARG CZ C 2.506 -1.485 -10.379 1.00 . A A . 33 ARG CZ 1 1 15 7562 1 1 33 ARG H H 0.836 -3.699 -6.353 1.00 . A A . 33 ARG H 1 1 15 7563 1 1 33 ARG HA H 3.009 -5.331 -5.552 1.00 . A A . 33 ARG HA 1 1 15 7564 1 1 33 ARG HB2 H 3.278 -5.924 -7.743 1.00 . A A . 33 ARG HB2 1 1 15 7565 1 1 33 ARG HB3 H 1.571 -5.508 -7.676 1.00 . A A . 33 ARG HB3 1 1 15 7566 1 1 33 ARG HD2 H 1.058 -2.882 -8.562 1.00 . A A . 33 ARG HD2 1 1 15 7567 1 1 33 ARG HD3 H 2.240 -2.644 -7.275 1.00 . A A . 33 ARG HD3 1 1 15 7568 1 1 33 ARG HE H 3.215 -1.031 -8.568 1.00 . A A . 33 ARG HE 1 1 15 7569 1 1 33 ARG HG2 H 3.837 -3.939 -8.816 1.00 . A A . 33 ARG HG2 1 1 15 7570 1 1 33 ARG HG3 H 2.357 -4.487 -9.610 1.00 . A A . 33 ARG HG3 1 1 15 7571 1 1 33 ARG HH11 H 1.338 -3.115 -10.645 1.00 . A A . 33 ARG HH11 1 1 15 7572 1 1 33 ARG HH12 H 1.647 -2.184 -12.071 1.00 . A A . 33 ARG HH12 1 1 15 7573 1 1 33 ARG HH21 H 3.629 0.192 -10.449 1.00 . A A . 33 ARG HH21 1 1 15 7574 1 1 33 ARG HH22 H 2.946 -0.306 -11.960 1.00 . A A . 33 ARG HH22 1 1 15 7575 1 1 33 ARG N N 1.557 -3.887 -5.722 1.00 . A A . 33 ARG N 1 1 15 7576 1 1 33 ARG NE N 2.674 -1.675 -9.072 1.00 . A A . 33 ARG NE 1 1 15 7577 1 1 33 ARG NH1 N 1.770 -2.331 -11.090 1.00 . A A . 33 ARG NH1 1 1 15 7578 1 1 33 ARG NH2 N 3.074 -0.448 -10.978 1.00 . A A . 33 ARG NH2 1 1 15 7579 1 1 33 ARG O O 3.824 -2.433 -5.767 1.00 . A A . 33 ARG O 1 1 15 7580 1 1 34 CYS C C 6.608 -2.687 -5.296 1.00 . A A . 34 CYS C 1 1 15 7581 1 1 34 CYS CA C 6.289 -3.412 -6.605 1.00 . A A . 34 CYS CA 1 1 15 7582 1 1 34 CYS CB C 6.131 -2.491 -7.771 1.00 . A A . 34 CYS CB 1 1 15 7583 1 1 34 CYS H H 5.038 -5.026 -6.858 1.00 . A A . 34 CYS H 1 1 15 7584 1 1 34 CYS HA H 7.079 -4.114 -6.819 1.00 . A A . 34 CYS HA 1 1 15 7585 1 1 34 CYS HB2 H 6.606 -2.957 -8.605 1.00 . A A . 34 CYS HB2 1 1 15 7586 1 1 34 CYS HB3 H 5.075 -2.427 -7.976 1.00 . A A . 34 CYS HB3 1 1 15 7587 1 1 34 CYS N N 5.058 -4.134 -6.545 1.00 . A A . 34 CYS N 1 1 15 7588 1 1 34 CYS O O 7.711 -2.109 -5.196 1.00 . A A . 34 CYS O 1 1 15 7589 1 1 34 CYS OXT O 5.764 -2.718 -4.379 1.00 . A A . 34 CYS OXT 1 1 15 7590 1 1 34 CYS SG S 6.789 -0.795 -7.557 1.00 . A A . 34 CYS SG 1 1 16 7591 1 1 1 VAL C C -8.337 2.511 -6.208 1.00 . A A . 1 VAL C 1 1 16 7592 1 1 1 VAL CA C -8.501 1.063 -6.657 1.00 . A A . 1 VAL CA 1 1 16 7593 1 1 1 VAL CB C -8.302 0.989 -8.182 1.00 . A A . 1 VAL CB 1 1 16 7594 1 1 1 VAL CG1 C -8.139 -0.455 -8.631 1.00 . A A . 1 VAL CG1 1 1 16 7595 1 1 1 VAL CG2 C -9.465 1.652 -8.905 1.00 . A A . 1 VAL CG2 1 1 16 7596 1 1 1 VAL H1 H -10.555 1.162 -6.645 1.00 . A A . 1 VAL H1 1 1 16 7597 1 1 1 VAL H2 H -9.862 0.505 -5.219 1.00 . A A . 1 VAL H2 1 1 16 7598 1 1 1 VAL H3 H -9.917 -0.428 -6.658 1.00 . A A . 1 VAL H3 1 1 16 7599 1 1 1 VAL HA H -7.737 0.463 -6.184 1.00 . A A . 1 VAL HA 1 1 16 7600 1 1 1 VAL HB H -7.399 1.524 -8.433 1.00 . A A . 1 VAL HB 1 1 16 7601 1 1 1 VAL HG11 H -7.541 -0.487 -9.530 1.00 . A A . 1 VAL HG11 1 1 16 7602 1 1 1 VAL HG12 H -9.111 -0.883 -8.829 1.00 . A A . 1 VAL HG12 1 1 16 7603 1 1 1 VAL HG13 H -7.649 -1.021 -7.852 1.00 . A A . 1 VAL HG13 1 1 16 7604 1 1 1 VAL HG21 H -9.119 2.065 -9.840 1.00 . A A . 1 VAL HG21 1 1 16 7605 1 1 1 VAL HG22 H -9.869 2.442 -8.288 1.00 . A A . 1 VAL HG22 1 1 16 7606 1 1 1 VAL HG23 H -10.234 0.918 -9.098 1.00 . A A . 1 VAL HG23 1 1 16 7607 1 1 1 VAL N N -9.829 0.526 -6.259 1.00 . A A . 1 VAL N 1 1 16 7608 1 1 1 VAL O O -9.266 3.311 -6.308 1.00 . A A . 1 VAL O 1 1 16 7609 1 1 2 SER C C -7.751 4.564 -4.068 1.00 . A A . 2 SER C 1 1 16 7610 1 1 2 SER CA C -6.859 4.192 -5.248 1.00 . A A . 2 SER CA 1 1 16 7611 1 1 2 SER CB C -7.052 5.198 -6.384 1.00 . A A . 2 SER CB 1 1 16 7612 1 1 2 SER H H -6.446 2.157 -5.660 1.00 . A A . 2 SER H 1 1 16 7613 1 1 2 SER HA H -5.829 4.219 -4.927 1.00 . A A . 2 SER HA 1 1 16 7614 1 1 2 SER HB2 H -8.107 5.326 -6.575 1.00 . A A . 2 SER HB2 1 1 16 7615 1 1 2 SER HB3 H -6.621 6.147 -6.099 1.00 . A A . 2 SER HB3 1 1 16 7616 1 1 2 SER HG H -7.062 4.273 -8.110 1.00 . A A . 2 SER HG 1 1 16 7617 1 1 2 SER N N -7.148 2.840 -5.713 1.00 . A A . 2 SER N 1 1 16 7618 1 1 2 SER O O -8.977 4.551 -4.174 1.00 . A A . 2 SER O 1 1 16 7619 1 1 2 SER OG O -6.426 4.751 -7.574 1.00 . A A . 2 SER OG 1 1 16 7620 1 1 3 CYS C C -7.298 6.545 -1.129 1.00 . A A . 3 CYS C 1 1 16 7621 1 1 3 CYS CA C -7.862 5.272 -1.740 1.00 . A A . 3 CYS CA 1 1 16 7622 1 1 3 CYS CB C -7.829 4.144 -0.702 1.00 . A A . 3 CYS CB 1 1 16 7623 1 1 3 CYS H H -6.146 4.887 -2.919 1.00 . A A . 3 CYS H 1 1 16 7624 1 1 3 CYS HA H -8.888 5.452 -2.024 1.00 . A A . 3 CYS HA 1 1 16 7625 1 1 3 CYS HB2 H -7.856 4.578 0.287 1.00 . A A . 3 CYS HB2 1 1 16 7626 1 1 3 CYS HB3 H -8.699 3.520 -0.835 1.00 . A A . 3 CYS HB3 1 1 16 7627 1 1 3 CYS N N -7.125 4.895 -2.942 1.00 . A A . 3 CYS N 1 1 16 7628 1 1 3 CYS O O -6.285 7.075 -1.586 1.00 . A A . 3 CYS O 1 1 16 7629 1 1 3 CYS SG S -6.354 3.074 -0.791 1.00 . A A . 3 CYS SG 1 1 16 7630 1 1 4 THR C C -8.193 8.347 1.973 1.00 . A A . 4 THR C 1 1 16 7631 1 1 4 THR CA C -7.537 8.241 0.600 1.00 . A A . 4 THR CA 1 1 16 7632 1 1 4 THR CB C -7.874 9.476 -0.237 1.00 . A A . 4 THR CB 1 1 16 7633 1 1 4 THR CG2 C -6.810 10.551 -0.170 1.00 . A A . 4 THR CG2 1 1 16 7634 1 1 4 THR H H -8.763 6.554 0.225 1.00 . A A . 4 THR H 1 1 16 7635 1 1 4 THR HA H -6.466 8.188 0.731 1.00 . A A . 4 THR HA 1 1 16 7636 1 1 4 THR HB H -8.798 9.904 0.125 1.00 . A A . 4 THR HB 1 1 16 7637 1 1 4 THR HG1 H -7.201 8.886 -1.980 1.00 . A A . 4 THR HG1 1 1 16 7638 1 1 4 THR HG21 H -6.869 11.172 -1.052 1.00 . A A . 4 THR HG21 1 1 16 7639 1 1 4 THR HG22 H -5.835 10.089 -0.120 1.00 . A A . 4 THR HG22 1 1 16 7640 1 1 4 THR HG23 H -6.966 11.159 0.708 1.00 . A A . 4 THR HG23 1 1 16 7641 1 1 4 THR N N -7.964 7.028 -0.087 1.00 . A A . 4 THR N 1 1 16 7642 1 1 4 THR O O -8.438 9.446 2.471 1.00 . A A . 4 THR O 1 1 16 7643 1 1 4 THR OG1 O -8.049 9.130 -1.599 1.00 . A A . 4 THR OG1 1 1 16 7644 1 1 5 GLY C C -8.098 6.947 5.003 1.00 . A A . 5 GLY C 1 1 16 7645 1 1 5 GLY CA C -9.099 7.185 3.889 1.00 . A A . 5 GLY CA 1 1 16 7646 1 1 5 GLY H H -8.256 6.353 2.134 1.00 . A A . 5 GLY H 1 1 16 7647 1 1 5 GLY HA2 H -9.586 8.134 4.054 1.00 . A A . 5 GLY HA2 1 1 16 7648 1 1 5 GLY HA3 H -9.842 6.402 3.914 1.00 . A A . 5 GLY HA3 1 1 16 7649 1 1 5 GLY N N -8.474 7.199 2.580 1.00 . A A . 5 GLY N 1 1 16 7650 1 1 5 GLY O O -8.295 7.398 6.131 1.00 . A A . 5 GLY O 1 1 16 7651 1 1 6 SER C C -5.375 7.224 6.217 1.00 . A A . 6 SER C 1 1 16 7652 1 1 6 SER CA C -5.984 5.938 5.664 1.00 . A A . 6 SER CA 1 1 16 7653 1 1 6 SER CB C -4.894 5.069 5.032 1.00 . A A . 6 SER CB 1 1 16 7654 1 1 6 SER H H -6.922 5.905 3.767 1.00 . A A . 6 SER H 1 1 16 7655 1 1 6 SER HA H -6.441 5.392 6.476 1.00 . A A . 6 SER HA 1 1 16 7656 1 1 6 SER HB2 H -4.277 5.680 4.389 1.00 . A A . 6 SER HB2 1 1 16 7657 1 1 6 SER HB3 H -4.284 4.638 5.811 1.00 . A A . 6 SER HB3 1 1 16 7658 1 1 6 SER HG H -6.082 3.529 4.799 1.00 . A A . 6 SER HG 1 1 16 7659 1 1 6 SER N N -7.021 6.235 4.684 1.00 . A A . 6 SER N 1 1 16 7660 1 1 6 SER O O -5.941 8.306 6.062 1.00 . A A . 6 SER O 1 1 16 7661 1 1 6 SER OG O -5.458 4.023 4.261 1.00 . A A . 6 SER OG 1 1 16 7662 1 1 7 LYS C C -2.026 8.038 7.479 1.00 . A A . 7 LYS C 1 1 16 7663 1 1 7 LYS CA C -3.537 8.255 7.434 1.00 . A A . 7 LYS CA 1 1 16 7664 1 1 7 LYS CB C -4.078 8.553 8.837 1.00 . A A . 7 LYS CB 1 1 16 7665 1 1 7 LYS CD C -4.348 6.223 9.759 1.00 . A A . 7 LYS CD 1 1 16 7666 1 1 7 LYS CE C -5.859 6.383 9.828 1.00 . A A . 7 LYS CE 1 1 16 7667 1 1 7 LYS CG C -3.636 7.560 9.903 1.00 . A A . 7 LYS CG 1 1 16 7668 1 1 7 LYS H H -3.816 6.213 6.951 1.00 . A A . 7 LYS H 1 1 16 7669 1 1 7 LYS HA H -3.741 9.103 6.796 1.00 . A A . 7 LYS HA 1 1 16 7670 1 1 7 LYS HB2 H -3.745 9.536 9.135 1.00 . A A . 7 LYS HB2 1 1 16 7671 1 1 7 LYS HB3 H -5.157 8.548 8.798 1.00 . A A . 7 LYS HB3 1 1 16 7672 1 1 7 LYS HD2 H -4.086 5.787 8.807 1.00 . A A . 7 LYS HD2 1 1 16 7673 1 1 7 LYS HD3 H -4.028 5.569 10.556 1.00 . A A . 7 LYS HD3 1 1 16 7674 1 1 7 LYS HE2 H -6.201 6.845 8.914 1.00 . A A . 7 LYS HE2 1 1 16 7675 1 1 7 LYS HE3 H -6.308 5.406 9.926 1.00 . A A . 7 LYS HE3 1 1 16 7676 1 1 7 LYS HG2 H -2.573 7.400 9.818 1.00 . A A . 7 LYS HG2 1 1 16 7677 1 1 7 LYS HG3 H -3.861 7.971 10.877 1.00 . A A . 7 LYS HG3 1 1 16 7678 1 1 7 LYS HZ1 H -5.728 6.970 11.828 1.00 . A A . 7 LYS HZ1 1 1 16 7679 1 1 7 LYS HZ2 H -7.287 7.085 11.180 1.00 . A A . 7 LYS HZ2 1 1 16 7680 1 1 7 LYS HZ3 H -6.114 8.232 10.767 1.00 . A A . 7 LYS HZ3 1 1 16 7681 1 1 7 LYS N N -4.218 7.100 6.861 1.00 . A A . 7 LYS N 1 1 16 7682 1 1 7 LYS NZ N -6.276 7.227 10.981 1.00 . A A . 7 LYS NZ 1 1 16 7683 1 1 7 LYS O O -1.251 8.954 7.206 1.00 . A A . 7 LYS O 1 1 16 7684 1 1 8 ASP C C 0.082 5.118 7.305 1.00 . A A . 8 ASP C 1 1 16 7685 1 1 8 ASP CA C -0.193 6.493 7.905 1.00 . A A . 8 ASP CA 1 1 16 7686 1 1 8 ASP CB C 0.280 6.533 9.360 1.00 . A A . 8 ASP CB 1 1 16 7687 1 1 8 ASP CG C 1.786 6.659 9.475 1.00 . A A . 8 ASP CG 1 1 16 7688 1 1 8 ASP H H -2.274 6.132 8.035 1.00 . A A . 8 ASP H 1 1 16 7689 1 1 8 ASP HA H 0.350 7.236 7.340 1.00 . A A . 8 ASP HA 1 1 16 7690 1 1 8 ASP HB2 H -0.172 7.379 9.856 1.00 . A A . 8 ASP HB2 1 1 16 7691 1 1 8 ASP HB3 H -0.027 5.624 9.856 1.00 . A A . 8 ASP HB3 1 1 16 7692 1 1 8 ASP N N -1.612 6.822 7.826 1.00 . A A . 8 ASP N 1 1 16 7693 1 1 8 ASP O O 0.861 4.336 7.850 1.00 . A A . 8 ASP O 1 1 16 7694 1 1 8 ASP OD1 O 2.470 5.614 9.499 1.00 . A A . 8 ASP OD1 1 1 16 7695 1 1 8 ASP OD2 O 2.283 7.804 9.541 1.00 . A A . 8 ASP OD2 1 1 16 7696 1 1 9 CYS C C 0.472 3.699 4.259 1.00 . A A . 9 CYS C 1 1 16 7697 1 1 9 CYS CA C -0.380 3.548 5.505 1.00 . A A . 9 CYS CA 1 1 16 7698 1 1 9 CYS CB C -1.726 2.946 5.136 1.00 . A A . 9 CYS CB 1 1 16 7699 1 1 9 CYS H H -1.168 5.493 5.789 1.00 . A A . 9 CYS H 1 1 16 7700 1 1 9 CYS HA H 0.113 2.891 6.179 1.00 . A A . 9 CYS HA 1 1 16 7701 1 1 9 CYS HB2 H -2.462 3.288 5.840 1.00 . A A . 9 CYS HB2 1 1 16 7702 1 1 9 CYS HB3 H -1.991 3.279 4.153 1.00 . A A . 9 CYS HB3 1 1 16 7703 1 1 9 CYS N N -0.560 4.829 6.177 1.00 . A A . 9 CYS N 1 1 16 7704 1 1 9 CYS O O 1.599 3.207 4.197 1.00 . A A . 9 CYS O 1 1 16 7705 1 1 9 CYS SG S -1.759 1.122 5.134 1.00 . A A . 9 CYS SG 1 1 16 7706 1 1 10 TYR C C 2.025 5.173 2.257 1.00 . A A . 10 TYR C 1 1 16 7707 1 1 10 TYR CA C 0.627 4.610 2.014 1.00 . A A . 10 TYR CA 1 1 16 7708 1 1 10 TYR CB C -0.170 5.575 1.133 1.00 . A A . 10 TYR CB 1 1 16 7709 1 1 10 TYR CD1 C -0.548 3.824 -0.641 1.00 . A A . 10 TYR CD1 1 1 16 7710 1 1 10 TYR CD2 C -2.349 5.292 -0.109 1.00 . A A . 10 TYR CD2 1 1 16 7711 1 1 10 TYR CE1 C -1.337 3.190 -1.580 1.00 . A A . 10 TYR CE1 1 1 16 7712 1 1 10 TYR CE2 C -3.145 4.663 -1.046 1.00 . A A . 10 TYR CE2 1 1 16 7713 1 1 10 TYR CG C -1.039 4.884 0.108 1.00 . A A . 10 TYR CG 1 1 16 7714 1 1 10 TYR CZ C -2.635 3.612 -1.779 1.00 . A A . 10 TYR CZ 1 1 16 7715 1 1 10 TYR H H -0.978 4.750 3.384 1.00 . A A . 10 TYR H 1 1 16 7716 1 1 10 TYR HA H 0.715 3.662 1.506 1.00 . A A . 10 TYR HA 1 1 16 7717 1 1 10 TYR HB2 H -0.812 6.176 1.760 1.00 . A A . 10 TYR HB2 1 1 16 7718 1 1 10 TYR HB3 H 0.516 6.221 0.605 1.00 . A A . 10 TYR HB3 1 1 16 7719 1 1 10 TYR HD1 H 0.468 3.496 -0.483 1.00 . A A . 10 TYR HD1 1 1 16 7720 1 1 10 TYR HD2 H -2.745 6.115 0.467 1.00 . A A . 10 TYR HD2 1 1 16 7721 1 1 10 TYR HE1 H -0.936 2.368 -2.153 1.00 . A A . 10 TYR HE1 1 1 16 7722 1 1 10 TYR HE2 H -4.161 4.994 -1.201 1.00 . A A . 10 TYR HE2 1 1 16 7723 1 1 10 TYR HH H -2.953 2.931 -3.549 1.00 . A A . 10 TYR HH 1 1 16 7724 1 1 10 TYR N N -0.075 4.385 3.269 1.00 . A A . 10 TYR N 1 1 16 7725 1 1 10 TYR O O 2.913 5.029 1.419 1.00 . A A . 10 TYR O 1 1 16 7726 1 1 10 TYR OH O -3.425 2.983 -2.714 1.00 . A A . 10 TYR OH 1 1 16 7727 1 1 11 ALA C C 4.562 5.368 4.062 1.00 . A A . 11 ALA C 1 1 16 7728 1 1 11 ALA CA C 3.505 6.421 3.730 1.00 . A A . 11 ALA CA 1 1 16 7729 1 1 11 ALA CB C 3.361 7.423 4.865 1.00 . A A . 11 ALA CB 1 1 16 7730 1 1 11 ALA H H 1.465 5.916 4.032 1.00 . A A . 11 ALA H 1 1 16 7731 1 1 11 ALA HA H 3.839 6.956 2.854 1.00 . A A . 11 ALA HA 1 1 16 7732 1 1 11 ALA HB1 H 3.186 8.408 4.456 1.00 . A A . 11 ALA HB1 1 1 16 7733 1 1 11 ALA HB2 H 4.265 7.433 5.455 1.00 . A A . 11 ALA HB2 1 1 16 7734 1 1 11 ALA HB3 H 2.527 7.141 5.491 1.00 . A A . 11 ALA HB3 1 1 16 7735 1 1 11 ALA N N 2.212 5.827 3.399 1.00 . A A . 11 ALA N 1 1 16 7736 1 1 11 ALA O O 5.496 5.155 3.287 1.00 . A A . 11 ALA O 1 1 16 7737 1 1 12 PRO C C 5.633 2.633 4.545 1.00 . A A . 12 PRO C 1 1 16 7738 1 1 12 PRO CA C 5.394 3.664 5.639 1.00 . A A . 12 PRO CA 1 1 16 7739 1 1 12 PRO CB C 4.730 3.012 6.862 1.00 . A A . 12 PRO CB 1 1 16 7740 1 1 12 PRO CD C 3.364 4.862 6.207 1.00 . A A . 12 PRO CD 1 1 16 7741 1 1 12 PRO CG C 3.325 3.522 6.878 1.00 . A A . 12 PRO CG 1 1 16 7742 1 1 12 PRO HA H 6.339 4.101 5.929 1.00 . A A . 12 PRO HA 1 1 16 7743 1 1 12 PRO HB2 H 4.756 1.937 6.756 1.00 . A A . 12 PRO HB2 1 1 16 7744 1 1 12 PRO HB3 H 5.261 3.300 7.757 1.00 . A A . 12 PRO HB3 1 1 16 7745 1 1 12 PRO HD2 H 2.421 5.074 5.724 1.00 . A A . 12 PRO HD2 1 1 16 7746 1 1 12 PRO HD3 H 3.612 5.637 6.918 1.00 . A A . 12 PRO HD3 1 1 16 7747 1 1 12 PRO HG2 H 2.684 2.848 6.331 1.00 . A A . 12 PRO HG2 1 1 16 7748 1 1 12 PRO HG3 H 2.984 3.622 7.897 1.00 . A A . 12 PRO HG3 1 1 16 7749 1 1 12 PRO N N 4.437 4.692 5.220 1.00 . A A . 12 PRO N 1 1 16 7750 1 1 12 PRO O O 6.665 1.962 4.520 1.00 . A A . 12 PRO O 1 1 16 7751 1 1 13 CYS C C 5.422 2.188 1.332 1.00 . A A . 13 CYS C 1 1 16 7752 1 1 13 CYS CA C 4.757 1.569 2.543 1.00 . A A . 13 CYS CA 1 1 16 7753 1 1 13 CYS CB C 3.373 1.090 2.160 1.00 . A A . 13 CYS CB 1 1 16 7754 1 1 13 CYS H H 3.868 3.075 3.721 1.00 . A A . 13 CYS H 1 1 16 7755 1 1 13 CYS HA H 5.334 0.731 2.867 1.00 . A A . 13 CYS HA 1 1 16 7756 1 1 13 CYS HB2 H 2.703 1.318 2.963 1.00 . A A . 13 CYS HB2 1 1 16 7757 1 1 13 CYS HB3 H 3.058 1.611 1.275 1.00 . A A . 13 CYS HB3 1 1 16 7758 1 1 13 CYS N N 4.667 2.514 3.643 1.00 . A A . 13 CYS N 1 1 16 7759 1 1 13 CYS O O 6.363 1.627 0.779 1.00 . A A . 13 CYS O 1 1 16 7760 1 1 13 CYS SG S 3.259 -0.696 1.825 1.00 . A A . 13 CYS SG 1 1 16 7761 1 1 14 ARG C C 6.982 4.083 -0.167 1.00 . A A . 14 ARG C 1 1 16 7762 1 1 14 ARG CA C 5.470 4.015 -0.257 1.00 . A A . 14 ARG CA 1 1 16 7763 1 1 14 ARG CB C 4.874 5.415 -0.413 1.00 . A A . 14 ARG CB 1 1 16 7764 1 1 14 ARG CD C 5.085 7.683 -1.476 1.00 . A A . 14 ARG CD 1 1 16 7765 1 1 14 ARG CG C 5.482 6.217 -1.553 1.00 . A A . 14 ARG CG 1 1 16 7766 1 1 14 ARG CZ C 2.832 7.774 -2.472 1.00 . A A . 14 ARG CZ 1 1 16 7767 1 1 14 ARG H H 4.161 3.742 1.385 1.00 . A A . 14 ARG H 1 1 16 7768 1 1 14 ARG HA H 5.208 3.418 -1.115 1.00 . A A . 14 ARG HA 1 1 16 7769 1 1 14 ARG HB2 H 3.814 5.321 -0.596 1.00 . A A . 14 ARG HB2 1 1 16 7770 1 1 14 ARG HB3 H 5.025 5.963 0.504 1.00 . A A . 14 ARG HB3 1 1 16 7771 1 1 14 ARG HD2 H 5.527 8.117 -0.593 1.00 . A A . 14 ARG HD2 1 1 16 7772 1 1 14 ARG HD3 H 5.460 8.191 -2.353 1.00 . A A . 14 ARG HD3 1 1 16 7773 1 1 14 ARG HE H 3.239 8.040 -0.537 1.00 . A A . 14 ARG HE 1 1 16 7774 1 1 14 ARG HG2 H 6.557 6.144 -1.500 1.00 . A A . 14 ARG HG2 1 1 16 7775 1 1 14 ARG HG3 H 5.137 5.809 -2.492 1.00 . A A . 14 ARG HG3 1 1 16 7776 1 1 14 ARG HH11 H 4.317 7.395 -3.792 1.00 . A A . 14 ARG HH11 1 1 16 7777 1 1 14 ARG HH12 H 2.724 7.464 -4.467 1.00 . A A . 14 ARG HH12 1 1 16 7778 1 1 14 ARG HH21 H 1.143 8.131 -1.422 1.00 . A A . 14 ARG HH21 1 1 16 7779 1 1 14 ARG HH22 H 0.922 7.883 -3.122 1.00 . A A . 14 ARG HH22 1 1 16 7780 1 1 14 ARG N N 4.920 3.343 0.909 1.00 . A A . 14 ARG N 1 1 16 7781 1 1 14 ARG NE N 3.635 7.855 -1.413 1.00 . A A . 14 ARG NE 1 1 16 7782 1 1 14 ARG NH1 N 3.332 7.523 -3.676 1.00 . A A . 14 ARG NH1 1 1 16 7783 1 1 14 ARG NH2 N 1.525 7.943 -2.326 1.00 . A A . 14 ARG NH2 1 1 16 7784 1 1 14 ARG O O 7.680 3.972 -1.174 1.00 . A A . 14 ARG O 1 1 16 7785 1 1 15 LYS C C 9.524 2.960 0.742 1.00 . A A . 15 LYS C 1 1 16 7786 1 1 15 LYS CA C 8.925 4.263 1.253 1.00 . A A . 15 LYS CA 1 1 16 7787 1 1 15 LYS CB C 9.255 4.458 2.736 1.00 . A A . 15 LYS CB 1 1 16 7788 1 1 15 LYS CD C 8.844 6.936 2.812 1.00 . A A . 15 LYS CD 1 1 16 7789 1 1 15 LYS CE C 9.056 8.093 3.777 1.00 . A A . 15 LYS CE 1 1 16 7790 1 1 15 LYS CG C 9.849 5.821 3.052 1.00 . A A . 15 LYS CG 1 1 16 7791 1 1 15 LYS H H 6.886 4.283 1.820 1.00 . A A . 15 LYS H 1 1 16 7792 1 1 15 LYS HA H 9.327 5.088 0.682 1.00 . A A . 15 LYS HA 1 1 16 7793 1 1 15 LYS HB2 H 8.348 4.343 3.311 1.00 . A A . 15 LYS HB2 1 1 16 7794 1 1 15 LYS HB3 H 9.962 3.701 3.040 1.00 . A A . 15 LYS HB3 1 1 16 7795 1 1 15 LYS HD2 H 8.958 7.298 1.801 1.00 . A A . 15 LYS HD2 1 1 16 7796 1 1 15 LYS HD3 H 7.847 6.544 2.948 1.00 . A A . 15 LYS HD3 1 1 16 7797 1 1 15 LYS HE2 H 10.115 8.213 3.946 1.00 . A A . 15 LYS HE2 1 1 16 7798 1 1 15 LYS HE3 H 8.658 8.993 3.331 1.00 . A A . 15 LYS HE3 1 1 16 7799 1 1 15 LYS HG2 H 10.151 5.839 4.088 1.00 . A A . 15 LYS HG2 1 1 16 7800 1 1 15 LYS HG3 H 10.711 5.981 2.421 1.00 . A A . 15 LYS HG3 1 1 16 7801 1 1 15 LYS HZ1 H 8.584 8.641 5.736 1.00 . A A . 15 LYS HZ1 1 1 16 7802 1 1 15 LYS HZ2 H 8.720 6.971 5.507 1.00 . A A . 15 LYS HZ2 1 1 16 7803 1 1 15 LYS HZ3 H 7.352 7.792 4.946 1.00 . A A . 15 LYS HZ3 1 1 16 7804 1 1 15 LYS N N 7.489 4.227 1.048 1.00 . A A . 15 LYS N 1 1 16 7805 1 1 15 LYS NZ N 8.380 7.858 5.082 1.00 . A A . 15 LYS NZ 1 1 16 7806 1 1 15 LYS O O 10.494 2.959 -0.015 1.00 . A A . 15 LYS O 1 1 16 7807 1 1 16 GLN C C 9.029 0.281 -0.748 1.00 . A A . 16 GLN C 1 1 16 7808 1 1 16 GLN CA C 9.353 0.532 0.726 1.00 . A A . 16 GLN CA 1 1 16 7809 1 1 16 GLN CB C 8.699 -0.548 1.592 1.00 . A A . 16 GLN CB 1 1 16 7810 1 1 16 GLN CD C 9.784 0.349 3.689 1.00 . A A . 16 GLN CD 1 1 16 7811 1 1 16 GLN CG C 9.487 -0.877 2.849 1.00 . A A . 16 GLN CG 1 1 16 7812 1 1 16 GLN H H 8.128 1.924 1.742 1.00 . A A . 16 GLN H 1 1 16 7813 1 1 16 GLN HA H 10.423 0.484 0.859 1.00 . A A . 16 GLN HA 1 1 16 7814 1 1 16 GLN HB2 H 7.717 -0.210 1.887 1.00 . A A . 16 GLN HB2 1 1 16 7815 1 1 16 GLN HB3 H 8.600 -1.450 1.007 1.00 . A A . 16 GLN HB3 1 1 16 7816 1 1 16 GLN HE21 H 11.617 0.458 2.925 1.00 . A A . 16 GLN HE21 1 1 16 7817 1 1 16 GLN HE22 H 11.214 1.674 4.083 1.00 . A A . 16 GLN HE22 1 1 16 7818 1 1 16 GLN HG2 H 8.914 -1.572 3.445 1.00 . A A . 16 GLN HG2 1 1 16 7819 1 1 16 GLN HG3 H 10.422 -1.336 2.562 1.00 . A A . 16 GLN HG3 1 1 16 7820 1 1 16 GLN N N 8.912 1.851 1.150 1.00 . A A . 16 GLN N 1 1 16 7821 1 1 16 GLN NE2 N 10.994 0.880 3.552 1.00 . A A . 16 GLN NE2 1 1 16 7822 1 1 16 GLN O O 9.926 0.069 -1.564 1.00 . A A . 16 GLN O 1 1 16 7823 1 1 16 GLN OE1 O 8.938 0.814 4.452 1.00 . A A . 16 GLN OE1 1 1 16 7824 1 1 17 THR C C 7.596 1.200 -3.367 1.00 . A A . 17 THR C 1 1 16 7825 1 1 17 THR CA C 7.276 0.041 -2.433 1.00 . A A . 17 THR CA 1 1 16 7826 1 1 17 THR CB C 5.768 -0.229 -2.429 1.00 . A A . 17 THR CB 1 1 16 7827 1 1 17 THR CG2 C 5.405 -1.605 -2.942 1.00 . A A . 17 THR CG2 1 1 16 7828 1 1 17 THR H H 7.065 0.457 -0.378 1.00 . A A . 17 THR H 1 1 16 7829 1 1 17 THR HA H 7.780 -0.836 -2.794 1.00 . A A . 17 THR HA 1 1 16 7830 1 1 17 THR HB H 5.280 0.499 -3.058 1.00 . A A . 17 THR HB 1 1 16 7831 1 1 17 THR HG1 H 4.718 0.697 -1.059 1.00 . A A . 17 THR HG1 1 1 16 7832 1 1 17 THR HG21 H 5.412 -2.308 -2.123 1.00 . A A . 17 THR HG21 1 1 16 7833 1 1 17 THR HG22 H 6.124 -1.912 -3.687 1.00 . A A . 17 THR HG22 1 1 16 7834 1 1 17 THR HG23 H 4.420 -1.576 -3.383 1.00 . A A . 17 THR HG23 1 1 16 7835 1 1 17 THR N N 7.735 0.287 -1.074 1.00 . A A . 17 THR N 1 1 16 7836 1 1 17 THR O O 8.286 1.035 -4.373 1.00 . A A . 17 THR O 1 1 16 7837 1 1 17 THR OG1 O 5.238 -0.107 -1.121 1.00 . A A . 17 THR OG1 1 1 16 7838 1 1 18 GLY C C 6.410 3.532 -5.078 1.00 . A A . 18 GLY C 1 1 16 7839 1 1 18 GLY CA C 7.268 3.542 -3.840 1.00 . A A . 18 GLY CA 1 1 16 7840 1 1 18 GLY H H 6.521 2.419 -2.228 1.00 . A A . 18 GLY H 1 1 16 7841 1 1 18 GLY HA2 H 7.020 4.413 -3.253 1.00 . A A . 18 GLY HA2 1 1 16 7842 1 1 18 GLY HA3 H 8.286 3.603 -4.125 1.00 . A A . 18 GLY HA3 1 1 16 7843 1 1 18 GLY N N 7.067 2.363 -3.030 1.00 . A A . 18 GLY N 1 1 16 7844 1 1 18 GLY O O 6.740 2.895 -6.078 1.00 . A A . 18 GLY O 1 1 16 7845 1 1 19 CYS C C 2.955 4.728 -5.487 1.00 . A A . 19 CYS C 1 1 16 7846 1 1 19 CYS CA C 4.338 4.400 -6.056 1.00 . A A . 19 CYS CA 1 1 16 7847 1 1 19 CYS CB C 4.262 3.171 -6.937 1.00 . A A . 19 CYS CB 1 1 16 7848 1 1 19 CYS H H 5.161 4.733 -4.160 1.00 . A A . 19 CYS H 1 1 16 7849 1 1 19 CYS HA H 4.664 5.209 -6.659 1.00 . A A . 19 CYS HA 1 1 16 7850 1 1 19 CYS HB2 H 3.391 3.256 -7.561 1.00 . A A . 19 CYS HB2 1 1 16 7851 1 1 19 CYS HB3 H 5.138 3.163 -7.557 1.00 . A A . 19 CYS HB3 1 1 16 7852 1 1 19 CYS N N 5.313 4.257 -4.986 1.00 . A A . 19 CYS N 1 1 16 7853 1 1 19 CYS O O 2.533 4.139 -4.493 1.00 . A A . 19 CYS O 1 1 16 7854 1 1 19 CYS SG S 4.169 1.580 -6.050 1.00 . A A . 19 CYS SG 1 1 16 7855 1 1 20 PRO C C -0.121 4.968 -5.624 1.00 . A A . 20 PRO C 1 1 16 7856 1 1 20 PRO CA C 0.903 6.102 -5.635 1.00 . A A . 20 PRO CA 1 1 16 7857 1 1 20 PRO CB C 0.484 7.177 -6.645 1.00 . A A . 20 PRO CB 1 1 16 7858 1 1 20 PRO CD C 2.668 6.457 -7.281 1.00 . A A . 20 PRO CD 1 1 16 7859 1 1 20 PRO CG C 1.755 7.647 -7.262 1.00 . A A . 20 PRO CG 1 1 16 7860 1 1 20 PRO HA H 0.954 6.541 -4.650 1.00 . A A . 20 PRO HA 1 1 16 7861 1 1 20 PRO HB2 H -0.176 6.743 -7.383 1.00 . A A . 20 PRO HB2 1 1 16 7862 1 1 20 PRO HB3 H -0.024 7.978 -6.130 1.00 . A A . 20 PRO HB3 1 1 16 7863 1 1 20 PRO HD2 H 2.529 5.887 -8.188 1.00 . A A . 20 PRO HD2 1 1 16 7864 1 1 20 PRO HD3 H 3.697 6.770 -7.182 1.00 . A A . 20 PRO HD3 1 1 16 7865 1 1 20 PRO HG2 H 1.568 7.993 -8.269 1.00 . A A . 20 PRO HG2 1 1 16 7866 1 1 20 PRO HG3 H 2.182 8.439 -6.665 1.00 . A A . 20 PRO HG3 1 1 16 7867 1 1 20 PRO N N 2.236 5.687 -6.101 1.00 . A A . 20 PRO N 1 1 16 7868 1 1 20 PRO O O -1.187 5.096 -5.023 1.00 . A A . 20 PRO O 1 1 16 7869 1 1 21 TYR C C -0.829 2.021 -5.032 1.00 . A A . 21 TYR C 1 1 16 7870 1 1 21 TYR CA C -0.710 2.738 -6.377 1.00 . A A . 21 TYR CA 1 1 16 7871 1 1 21 TYR CB C -0.217 1.764 -7.443 1.00 . A A . 21 TYR CB 1 1 16 7872 1 1 21 TYR CD1 C 0.342 3.557 -9.137 1.00 . A A . 21 TYR CD1 1 1 16 7873 1 1 21 TYR CD2 C 1.887 1.766 -8.844 1.00 . A A . 21 TYR CD2 1 1 16 7874 1 1 21 TYR CE1 C 1.165 4.115 -10.098 1.00 . A A . 21 TYR CE1 1 1 16 7875 1 1 21 TYR CE2 C 2.716 2.317 -9.803 1.00 . A A . 21 TYR CE2 1 1 16 7876 1 1 21 TYR CG C 0.689 2.375 -8.495 1.00 . A A . 21 TYR CG 1 1 16 7877 1 1 21 TYR CZ C 2.350 3.492 -10.427 1.00 . A A . 21 TYR CZ 1 1 16 7878 1 1 21 TYR H H 1.035 3.812 -6.778 1.00 . A A . 21 TYR H 1 1 16 7879 1 1 21 TYR HA H -1.683 3.107 -6.663 1.00 . A A . 21 TYR HA 1 1 16 7880 1 1 21 TYR HB2 H 0.324 0.964 -6.969 1.00 . A A . 21 TYR HB2 1 1 16 7881 1 1 21 TYR HB3 H -1.066 1.366 -7.946 1.00 . A A . 21 TYR HB3 1 1 16 7882 1 1 21 TYR HD1 H -0.587 4.043 -8.877 1.00 . A A . 21 TYR HD1 1 1 16 7883 1 1 21 TYR HD2 H 2.170 0.846 -8.354 1.00 . A A . 21 TYR HD2 1 1 16 7884 1 1 21 TYR HE1 H 0.878 5.034 -10.585 1.00 . A A . 21 TYR HE1 1 1 16 7885 1 1 21 TYR HE2 H 3.644 1.829 -10.059 1.00 . A A . 21 TYR HE2 1 1 16 7886 1 1 21 TYR HH H 4.057 4.142 -11.025 1.00 . A A . 21 TYR HH 1 1 16 7887 1 1 21 TYR N N 0.189 3.867 -6.302 1.00 . A A . 21 TYR N 1 1 16 7888 1 1 21 TYR O O 0.000 2.204 -4.141 1.00 . A A . 21 TYR O 1 1 16 7889 1 1 21 TYR OH O 3.172 4.044 -11.381 1.00 . A A . 21 TYR OH 1 1 16 7890 1 1 22 GLY C C -3.349 -0.402 -3.756 1.00 . A A . 22 GLY C 1 1 16 7891 1 1 22 GLY CA C -2.096 0.446 -3.679 1.00 . A A . 22 GLY CA 1 1 16 7892 1 1 22 GLY H H -2.487 1.093 -5.658 1.00 . A A . 22 GLY H 1 1 16 7893 1 1 22 GLY HA2 H -1.252 -0.195 -3.499 1.00 . A A . 22 GLY HA2 1 1 16 7894 1 1 22 GLY HA3 H -2.189 1.134 -2.855 1.00 . A A . 22 GLY HA3 1 1 16 7895 1 1 22 GLY N N -1.869 1.198 -4.906 1.00 . A A . 22 GLY N 1 1 16 7896 1 1 22 GLY O O -4.273 -0.076 -4.500 1.00 . A A . 22 GLY O 1 1 16 7897 1 1 23 LYS C C -5.463 -2.029 -1.785 1.00 . A A . 23 LYS C 1 1 16 7898 1 1 23 LYS CA C -4.571 -2.347 -2.982 1.00 . A A . 23 LYS CA 1 1 16 7899 1 1 23 LYS CB C -4.156 -3.823 -2.961 1.00 . A A . 23 LYS CB 1 1 16 7900 1 1 23 LYS CD C -6.010 -5.425 -3.524 1.00 . A A . 23 LYS CD 1 1 16 7901 1 1 23 LYS CE C -5.661 -6.880 -3.256 1.00 . A A . 23 LYS CE 1 1 16 7902 1 1 23 LYS CG C -4.812 -4.653 -4.053 1.00 . A A . 23 LYS CG 1 1 16 7903 1 1 23 LYS H H -2.648 -1.698 -2.390 1.00 . A A . 23 LYS H 1 1 16 7904 1 1 23 LYS HA H -5.121 -2.149 -3.886 1.00 . A A . 23 LYS HA 1 1 16 7905 1 1 23 LYS HB2 H -3.086 -3.885 -3.085 1.00 . A A . 23 LYS HB2 1 1 16 7906 1 1 23 LYS HB3 H -4.424 -4.248 -2.005 1.00 . A A . 23 LYS HB3 1 1 16 7907 1 1 23 LYS HD2 H -6.343 -4.969 -2.604 1.00 . A A . 23 LYS HD2 1 1 16 7908 1 1 23 LYS HD3 H -6.804 -5.383 -4.257 1.00 . A A . 23 LYS HD3 1 1 16 7909 1 1 23 LYS HE2 H -5.935 -7.468 -4.119 1.00 . A A . 23 LYS HE2 1 1 16 7910 1 1 23 LYS HE3 H -4.596 -6.957 -3.092 1.00 . A A . 23 LYS HE3 1 1 16 7911 1 1 23 LYS HG2 H -5.141 -3.995 -4.843 1.00 . A A . 23 LYS HG2 1 1 16 7912 1 1 23 LYS HG3 H -4.087 -5.353 -4.442 1.00 . A A . 23 LYS HG3 1 1 16 7913 1 1 23 LYS HZ1 H -6.653 -8.401 -2.223 1.00 . A A . 23 LYS HZ1 1 1 16 7914 1 1 23 LYS HZ2 H -7.230 -6.849 -1.877 1.00 . A A . 23 LYS HZ2 1 1 16 7915 1 1 23 LYS HZ3 H -5.757 -7.368 -1.227 1.00 . A A . 23 LYS HZ3 1 1 16 7916 1 1 23 LYS N N -3.399 -1.486 -2.982 1.00 . A A . 23 LYS N 1 1 16 7917 1 1 23 LYS NZ N -6.376 -7.411 -2.062 1.00 . A A . 23 LYS NZ 1 1 16 7918 1 1 23 LYS O O -6.470 -2.697 -1.551 1.00 . A A . 23 LYS O 1 1 16 7919 1 1 24 CYS C C -7.305 -0.383 -0.170 1.00 . A A . 24 CYS C 1 1 16 7920 1 1 24 CYS CA C -5.823 -0.575 0.148 1.00 . A A . 24 CYS CA 1 1 16 7921 1 1 24 CYS CB C -5.195 0.710 0.717 1.00 . A A . 24 CYS CB 1 1 16 7922 1 1 24 CYS H H -4.266 -0.510 -1.271 1.00 . A A . 24 CYS H 1 1 16 7923 1 1 24 CYS HA H -5.734 -1.354 0.888 1.00 . A A . 24 CYS HA 1 1 16 7924 1 1 24 CYS HB2 H -4.738 0.479 1.666 1.00 . A A . 24 CYS HB2 1 1 16 7925 1 1 24 CYS HB3 H -4.427 1.050 0.035 1.00 . A A . 24 CYS HB3 1 1 16 7926 1 1 24 CYS N N -5.079 -0.999 -1.029 1.00 . A A . 24 CYS N 1 1 16 7927 1 1 24 CYS O O -7.678 0.474 -0.973 1.00 . A A . 24 CYS O 1 1 16 7928 1 1 24 CYS SG S -6.346 2.103 0.991 1.00 . A A . 24 CYS SG 1 1 16 7929 1 1 25 MET C C -10.237 -0.457 1.493 1.00 . A A . 25 MET C 1 1 16 7930 1 1 25 MET CA C -9.584 -1.111 0.287 1.00 . A A . 25 MET CA 1 1 16 7931 1 1 25 MET CB C -10.167 -2.509 0.066 1.00 . A A . 25 MET CB 1 1 16 7932 1 1 25 MET CE C -11.490 -3.838 -3.522 1.00 . A A . 25 MET CE 1 1 16 7933 1 1 25 MET CG C -9.972 -3.032 -1.348 1.00 . A A . 25 MET CG 1 1 16 7934 1 1 25 MET H H -7.779 -1.842 1.106 1.00 . A A . 25 MET H 1 1 16 7935 1 1 25 MET HA H -9.779 -0.503 -0.585 1.00 . A A . 25 MET HA 1 1 16 7936 1 1 25 MET HB2 H -9.693 -3.196 0.751 1.00 . A A . 25 MET HB2 1 1 16 7937 1 1 25 MET HB3 H -11.226 -2.480 0.274 1.00 . A A . 25 MET HB3 1 1 16 7938 1 1 25 MET HE1 H -11.409 -4.730 -2.917 1.00 . A A . 25 MET HE1 1 1 16 7939 1 1 25 MET HE2 H -10.754 -3.871 -4.311 1.00 . A A . 25 MET HE2 1 1 16 7940 1 1 25 MET HE3 H -12.479 -3.784 -3.952 1.00 . A A . 25 MET HE3 1 1 16 7941 1 1 25 MET HG2 H -8.992 -2.740 -1.693 1.00 . A A . 25 MET HG2 1 1 16 7942 1 1 25 MET HG3 H -10.040 -4.110 -1.329 1.00 . A A . 25 MET HG3 1 1 16 7943 1 1 25 MET N N -8.142 -1.186 0.477 1.00 . A A . 25 MET N 1 1 16 7944 1 1 25 MET O O -9.777 -0.618 2.623 1.00 . A A . 25 MET O 1 1 16 7945 1 1 25 MET SD S -11.204 -2.396 -2.500 1.00 . A A . 25 MET SD 1 1 16 7946 1 1 26 ASN C C -12.223 0.070 3.522 1.00 . A A . 26 ASN C 1 1 16 7947 1 1 26 ASN CA C -12.017 0.987 2.320 1.00 . A A . 26 ASN CA 1 1 16 7948 1 1 26 ASN CB C -13.378 1.514 1.850 1.00 . A A . 26 ASN CB 1 1 16 7949 1 1 26 ASN CG C -13.440 1.782 0.357 1.00 . A A . 26 ASN CG 1 1 16 7950 1 1 26 ASN H H -11.609 0.385 0.320 1.00 . A A . 26 ASN H 1 1 16 7951 1 1 26 ASN HA H -11.409 1.824 2.627 1.00 . A A . 26 ASN HA 1 1 16 7952 1 1 26 ASN HB2 H -14.134 0.788 2.098 1.00 . A A . 26 ASN HB2 1 1 16 7953 1 1 26 ASN HB3 H -13.594 2.436 2.370 1.00 . A A . 26 ASN HB3 1 1 16 7954 1 1 26 ASN HD21 H -12.892 3.672 0.649 1.00 . A A . 26 ASN HD21 1 1 16 7955 1 1 26 ASN HD22 H -13.168 3.216 -0.994 1.00 . A A . 26 ASN HD22 1 1 16 7956 1 1 26 ASN N N -11.303 0.293 1.245 1.00 . A A . 26 ASN N 1 1 16 7957 1 1 26 ASN ND2 N -13.136 3.014 -0.036 1.00 . A A . 26 ASN ND2 1 1 16 7958 1 1 26 ASN O O -12.845 -0.987 3.416 1.00 . A A . 26 ASN O 1 1 16 7959 1 1 26 ASN OD1 O -13.757 0.893 -0.433 1.00 . A A . 26 ASN OD1 1 1 16 7960 1 1 27 ARG C C -10.847 -1.471 5.880 1.00 . A A . 27 ARG C 1 1 16 7961 1 1 27 ARG CA C -11.797 -0.280 5.899 1.00 . A A . 27 ARG CA 1 1 16 7962 1 1 27 ARG CB C -13.236 -0.757 6.119 1.00 . A A . 27 ARG CB 1 1 16 7963 1 1 27 ARG CD C -15.125 0.021 7.585 1.00 . A A . 27 ARG CD 1 1 16 7964 1 1 27 ARG CG C -13.723 -0.566 7.546 1.00 . A A . 27 ARG CG 1 1 16 7965 1 1 27 ARG CZ C -17.376 -0.649 6.839 1.00 . A A . 27 ARG CZ 1 1 16 7966 1 1 27 ARG H H -11.206 1.335 4.670 1.00 . A A . 27 ARG H 1 1 16 7967 1 1 27 ARG HA H -11.516 0.370 6.712 1.00 . A A . 27 ARG HA 1 1 16 7968 1 1 27 ARG HB2 H -13.890 -0.205 5.460 1.00 . A A . 27 ARG HB2 1 1 16 7969 1 1 27 ARG HB3 H -13.297 -1.807 5.878 1.00 . A A . 27 ARG HB3 1 1 16 7970 1 1 27 ARG HD2 H -15.325 0.379 8.584 1.00 . A A . 27 ARG HD2 1 1 16 7971 1 1 27 ARG HD3 H -15.174 0.847 6.891 1.00 . A A . 27 ARG HD3 1 1 16 7972 1 1 27 ARG HE H -15.890 -1.911 7.268 1.00 . A A . 27 ARG HE 1 1 16 7973 1 1 27 ARG HG2 H -13.731 -1.523 8.045 1.00 . A A . 27 ARG HG2 1 1 16 7974 1 1 27 ARG HG3 H -13.049 0.103 8.060 1.00 . A A . 27 ARG HG3 1 1 16 7975 1 1 27 ARG HH11 H -17.107 1.350 7.000 1.00 . A A . 27 ARG HH11 1 1 16 7976 1 1 27 ARG HH12 H -18.681 0.852 6.477 1.00 . A A . 27 ARG HH12 1 1 16 7977 1 1 27 ARG HH21 H -17.961 -2.566 6.580 1.00 . A A . 27 ARG HH21 1 1 16 7978 1 1 27 ARG HH22 H -19.167 -1.370 6.239 1.00 . A A . 27 ARG HH22 1 1 16 7979 1 1 27 ARG N N -11.690 0.488 4.662 1.00 . A A . 27 ARG N 1 1 16 7980 1 1 27 ARG NE N -16.142 -0.964 7.223 1.00 . A A . 27 ARG NE 1 1 16 7981 1 1 27 ARG NH1 N -17.752 0.623 6.766 1.00 . A A . 27 ARG NH1 1 1 16 7982 1 1 27 ARG NH2 N -18.238 -1.606 6.527 1.00 . A A . 27 ARG NH2 1 1 16 7983 1 1 27 ARG O O -11.113 -2.501 6.499 1.00 . A A . 27 ARG O 1 1 16 7984 1 1 28 LYS C C -7.611 -1.998 4.108 1.00 . A A . 28 LYS C 1 1 16 7985 1 1 28 LYS CA C -8.735 -2.381 5.069 1.00 . A A . 28 LYS CA 1 1 16 7986 1 1 28 LYS CB C -9.386 -3.688 4.605 1.00 . A A . 28 LYS CB 1 1 16 7987 1 1 28 LYS CD C -9.494 -4.789 6.861 1.00 . A A . 28 LYS CD 1 1 16 7988 1 1 28 LYS CE C -10.954 -5.203 6.962 1.00 . A A . 28 LYS CE 1 1 16 7989 1 1 28 LYS CG C -8.982 -4.897 5.434 1.00 . A A . 28 LYS CG 1 1 16 7990 1 1 28 LYS H H -9.583 -0.467 4.701 1.00 . A A . 28 LYS H 1 1 16 7991 1 1 28 LYS HA H -8.314 -2.531 6.051 1.00 . A A . 28 LYS HA 1 1 16 7992 1 1 28 LYS HB2 H -10.460 -3.584 4.662 1.00 . A A . 28 LYS HB2 1 1 16 7993 1 1 28 LYS HB3 H -9.107 -3.874 3.578 1.00 . A A . 28 LYS HB3 1 1 16 7994 1 1 28 LYS HD2 H -8.904 -5.434 7.494 1.00 . A A . 28 LYS HD2 1 1 16 7995 1 1 28 LYS HD3 H -9.395 -3.766 7.192 1.00 . A A . 28 LYS HD3 1 1 16 7996 1 1 28 LYS HE2 H -11.503 -4.735 6.159 1.00 . A A . 28 LYS HE2 1 1 16 7997 1 1 28 LYS HE3 H -11.018 -6.276 6.864 1.00 . A A . 28 LYS HE3 1 1 16 7998 1 1 28 LYS HG2 H -9.394 -5.786 4.981 1.00 . A A . 28 LYS HG2 1 1 16 7999 1 1 28 LYS HG3 H -7.904 -4.964 5.451 1.00 . A A . 28 LYS HG3 1 1 16 8000 1 1 28 LYS HZ1 H -12.536 -5.142 8.324 1.00 . A A . 28 LYS HZ1 1 1 16 8001 1 1 28 LYS HZ2 H -11.561 -3.760 8.346 1.00 . A A . 28 LYS HZ2 1 1 16 8002 1 1 28 LYS HZ3 H -11.010 -5.196 9.050 1.00 . A A . 28 LYS HZ3 1 1 16 8003 1 1 28 LYS N N -9.735 -1.318 5.168 1.00 . A A . 28 LYS N 1 1 16 8004 1 1 28 LYS NZ N -11.557 -4.797 8.262 1.00 . A A . 28 LYS NZ 1 1 16 8005 1 1 28 LYS O O -7.777 -2.054 2.891 1.00 . A A . 28 LYS O 1 1 16 8006 1 1 29 CYS C C -4.652 -2.439 3.227 1.00 . A A . 29 CYS C 1 1 16 8007 1 1 29 CYS CA C -5.316 -1.226 3.860 1.00 . A A . 29 CYS CA 1 1 16 8008 1 1 29 CYS CB C -4.299 -0.484 4.710 1.00 . A A . 29 CYS CB 1 1 16 8009 1 1 29 CYS H H -6.392 -1.588 5.637 1.00 . A A . 29 CYS H 1 1 16 8010 1 1 29 CYS HA H -5.659 -0.571 3.093 1.00 . A A . 29 CYS HA 1 1 16 8011 1 1 29 CYS HB2 H -4.821 0.092 5.446 1.00 . A A . 29 CYS HB2 1 1 16 8012 1 1 29 CYS HB3 H -3.675 -1.205 5.196 1.00 . A A . 29 CYS HB3 1 1 16 8013 1 1 29 CYS N N -6.466 -1.612 4.664 1.00 . A A . 29 CYS N 1 1 16 8014 1 1 29 CYS O O -4.835 -3.570 3.676 1.00 . A A . 29 CYS O 1 1 16 8015 1 1 29 CYS SG S -3.213 0.657 3.791 1.00 . A A . 29 CYS SG 1 1 16 8016 1 1 30 LYS C C -2.444 -2.682 0.257 1.00 . A A . 30 LYS C 1 1 16 8017 1 1 30 LYS CA C -3.145 -3.243 1.487 1.00 . A A . 30 LYS CA 1 1 16 8018 1 1 30 LYS CB C -4.071 -4.404 1.090 1.00 . A A . 30 LYS CB 1 1 16 8019 1 1 30 LYS CD C -6.249 -5.009 -0.005 1.00 . A A . 30 LYS CD 1 1 16 8020 1 1 30 LYS CE C -6.702 -6.226 0.785 1.00 . A A . 30 LYS CE 1 1 16 8021 1 1 30 LYS CG C -5.524 -4.009 0.880 1.00 . A A . 30 LYS CG 1 1 16 8022 1 1 30 LYS H H -3.755 -1.257 1.896 1.00 . A A . 30 LYS H 1 1 16 8023 1 1 30 LYS HA H -2.390 -3.618 2.162 1.00 . A A . 30 LYS HA 1 1 16 8024 1 1 30 LYS HB2 H -3.706 -4.837 0.171 1.00 . A A . 30 LYS HB2 1 1 16 8025 1 1 30 LYS HB3 H -4.035 -5.155 1.867 1.00 . A A . 30 LYS HB3 1 1 16 8026 1 1 30 LYS HD2 H -7.115 -4.531 -0.438 1.00 . A A . 30 LYS HD2 1 1 16 8027 1 1 30 LYS HD3 H -5.582 -5.330 -0.792 1.00 . A A . 30 LYS HD3 1 1 16 8028 1 1 30 LYS HE2 H -7.236 -6.892 0.123 1.00 . A A . 30 LYS HE2 1 1 16 8029 1 1 30 LYS HE3 H -5.831 -6.731 1.176 1.00 . A A . 30 LYS HE3 1 1 16 8030 1 1 30 LYS HG2 H -6.019 -3.968 1.838 1.00 . A A . 30 LYS HG2 1 1 16 8031 1 1 30 LYS HG3 H -5.557 -3.040 0.414 1.00 . A A . 30 LYS HG3 1 1 16 8032 1 1 30 LYS HZ1 H -8.108 -6.690 2.259 1.00 . A A . 30 LYS HZ1 1 1 16 8033 1 1 30 LYS HZ2 H -8.286 -5.140 1.608 1.00 . A A . 30 LYS HZ2 1 1 16 8034 1 1 30 LYS HZ3 H -7.034 -5.460 2.700 1.00 . A A . 30 LYS HZ3 1 1 16 8035 1 1 30 LYS N N -3.867 -2.187 2.190 1.00 . A A . 30 LYS N 1 1 16 8036 1 1 30 LYS NZ N -7.595 -5.853 1.917 1.00 . A A . 30 LYS NZ 1 1 16 8037 1 1 30 LYS O O -2.978 -2.711 -0.845 1.00 . A A . 30 LYS O 1 1 16 8038 1 1 31 CYS C C -0.476 -2.359 -1.881 1.00 . A A . 31 CYS C 1 1 16 8039 1 1 31 CYS CA C -0.403 -1.584 -0.579 1.00 . A A . 31 CYS CA 1 1 16 8040 1 1 31 CYS CB C 1.056 -1.515 -0.111 1.00 . A A . 31 CYS CB 1 1 16 8041 1 1 31 CYS H H -0.895 -2.188 1.392 1.00 . A A . 31 CYS H 1 1 16 8042 1 1 31 CYS HA H -0.741 -0.582 -0.782 1.00 . A A . 31 CYS HA 1 1 16 8043 1 1 31 CYS HB2 H 1.507 -2.489 -0.220 1.00 . A A . 31 CYS HB2 1 1 16 8044 1 1 31 CYS HB3 H 1.589 -0.806 -0.727 1.00 . A A . 31 CYS HB3 1 1 16 8045 1 1 31 CYS N N -1.239 -2.171 0.478 1.00 . A A . 31 CYS N 1 1 16 8046 1 1 31 CYS O O -1.039 -3.447 -1.963 1.00 . A A . 31 CYS O 1 1 16 8047 1 1 31 CYS SG S 1.264 -1.004 1.630 1.00 . A A . 31 CYS SG 1 1 16 8048 1 1 32 ASN C C 1.300 -3.253 -4.402 1.00 . A A . 32 ASN C 1 1 16 8049 1 1 32 ASN CA C 0.117 -2.314 -4.237 1.00 . A A . 32 ASN CA 1 1 16 8050 1 1 32 ASN CB C 0.244 -1.192 -5.246 1.00 . A A . 32 ASN CB 1 1 16 8051 1 1 32 ASN CG C -0.396 -1.515 -6.582 1.00 . A A . 32 ASN CG 1 1 16 8052 1 1 32 ASN H H 0.477 -0.861 -2.756 1.00 . A A . 32 ASN H 1 1 16 8053 1 1 32 ASN HA H -0.793 -2.849 -4.417 1.00 . A A . 32 ASN HA 1 1 16 8054 1 1 32 ASN HB2 H -0.217 -0.314 -4.848 1.00 . A A . 32 ASN HB2 1 1 16 8055 1 1 32 ASN HB3 H 1.284 -0.997 -5.399 1.00 . A A . 32 ASN HB3 1 1 16 8056 1 1 32 ASN HD21 H 1.394 -1.625 -7.441 1.00 . A A . 32 ASN HD21 1 1 16 8057 1 1 32 ASN HD22 H 0.044 -1.915 -8.479 1.00 . A A . 32 ASN HD22 1 1 16 8058 1 1 32 ASN N N 0.085 -1.747 -2.903 1.00 . A A . 32 ASN N 1 1 16 8059 1 1 32 ASN ND2 N 0.431 -1.704 -7.604 1.00 . A A . 32 ASN ND2 1 1 16 8060 1 1 32 ASN O O 2.109 -3.428 -3.490 1.00 . A A . 32 ASN O 1 1 16 8061 1 1 32 ASN OD1 O -1.620 -1.595 -6.694 1.00 . A A . 32 ASN OD1 1 1 16 8062 1 1 33 ARG C C 3.521 -3.981 -6.769 1.00 . A A . 33 ARG C 1 1 16 8063 1 1 33 ARG CA C 2.510 -4.720 -5.913 1.00 . A A . 33 ARG CA 1 1 16 8064 1 1 33 ARG CB C 2.005 -5.971 -6.634 1.00 . A A . 33 ARG CB 1 1 16 8065 1 1 33 ARG CD C 4.136 -7.286 -6.838 1.00 . A A . 33 ARG CD 1 1 16 8066 1 1 33 ARG CG C 2.741 -7.241 -6.238 1.00 . A A . 33 ARG CG 1 1 16 8067 1 1 33 ARG CZ C 6.392 -7.944 -6.097 1.00 . A A . 33 ARG CZ 1 1 16 8068 1 1 33 ARG H H 0.740 -3.618 -6.275 1.00 . A A . 33 ARG H 1 1 16 8069 1 1 33 ARG HA H 2.990 -5.002 -4.989 1.00 . A A . 33 ARG HA 1 1 16 8070 1 1 33 ARG HB2 H 0.956 -6.103 -6.410 1.00 . A A . 33 ARG HB2 1 1 16 8071 1 1 33 ARG HB3 H 2.121 -5.831 -7.699 1.00 . A A . 33 ARG HB3 1 1 16 8072 1 1 33 ARG HD2 H 4.082 -7.754 -7.809 1.00 . A A . 33 ARG HD2 1 1 16 8073 1 1 33 ARG HD3 H 4.500 -6.275 -6.947 1.00 . A A . 33 ARG HD3 1 1 16 8074 1 1 33 ARG HE H 4.687 -8.645 -5.333 1.00 . A A . 33 ARG HE 1 1 16 8075 1 1 33 ARG HG2 H 2.822 -7.277 -5.161 1.00 . A A . 33 ARG HG2 1 1 16 8076 1 1 33 ARG HG3 H 2.179 -8.094 -6.588 1.00 . A A . 33 ARG HG3 1 1 16 8077 1 1 33 ARG HH11 H 6.366 -6.588 -7.597 1.00 . A A . 33 ARG HH11 1 1 16 8078 1 1 33 ARG HH12 H 7.939 -7.067 -7.058 1.00 . A A . 33 ARG HH12 1 1 16 8079 1 1 33 ARG HH21 H 6.756 -9.278 -4.622 1.00 . A A . 33 ARG HH21 1 1 16 8080 1 1 33 ARG HH22 H 8.162 -8.594 -5.369 1.00 . A A . 33 ARG HH22 1 1 16 8081 1 1 33 ARG N N 1.408 -3.825 -5.590 1.00 . A A . 33 ARG N 1 1 16 8082 1 1 33 ARG NE N 5.068 -8.038 -6.001 1.00 . A A . 33 ARG NE 1 1 16 8083 1 1 33 ARG NH1 N 6.945 -7.133 -6.991 1.00 . A A . 33 ARG NH1 1 1 16 8084 1 1 33 ARG NH2 N 7.167 -8.664 -5.298 1.00 . A A . 33 ARG NH2 1 1 16 8085 1 1 33 ARG O O 3.538 -4.103 -7.995 1.00 . A A . 33 ARG O 1 1 16 8086 1 1 34 CYS C C 6.680 -3.156 -6.887 1.00 . A A . 34 CYS C 1 1 16 8087 1 1 34 CYS CA C 5.364 -2.395 -6.761 1.00 . A A . 34 CYS CA 1 1 16 8088 1 1 34 CYS CB C 5.567 -1.107 -5.985 1.00 . A A . 34 CYS CB 1 1 16 8089 1 1 34 CYS H H 4.260 -3.143 -5.126 1.00 . A A . 34 CYS H 1 1 16 8090 1 1 34 CYS HA H 5.006 -2.146 -7.737 1.00 . A A . 34 CYS HA 1 1 16 8091 1 1 34 CYS HB2 H 4.781 -1.025 -5.259 1.00 . A A . 34 CYS HB2 1 1 16 8092 1 1 34 CYS HB3 H 6.514 -1.150 -5.481 1.00 . A A . 34 CYS HB3 1 1 16 8093 1 1 34 CYS N N 4.348 -3.195 -6.100 1.00 . A A . 34 CYS N 1 1 16 8094 1 1 34 CYS O O 7.290 -3.458 -5.840 1.00 . A A . 34 CYS O 1 1 16 8095 1 1 34 CYS OXT O 7.088 -3.445 -8.032 1.00 . A A . 34 CYS OXT 1 1 16 8096 1 1 34 CYS SG S 5.530 0.407 -6.999 1.00 . A A . 34 CYS SG 1 1 17 8097 1 1 1 VAL C C -8.799 0.631 -6.851 1.00 . A A . 1 VAL C 1 1 17 8098 1 1 1 VAL CA C -10.183 0.022 -6.660 1.00 . A A . 1 VAL CA 1 1 17 8099 1 1 1 VAL CB C -10.187 -0.808 -5.363 1.00 . A A . 1 VAL CB 1 1 17 8100 1 1 1 VAL CG1 C -11.612 -1.060 -4.894 1.00 . A A . 1 VAL CG1 1 1 17 8101 1 1 1 VAL CG2 C -9.445 -2.120 -5.565 1.00 . A A . 1 VAL CG2 1 1 17 8102 1 1 1 VAL H1 H -10.969 -0.173 -8.551 1.00 . A A . 1 VAL H1 1 1 17 8103 1 1 1 VAL H2 H -11.273 -1.502 -7.509 1.00 . A A . 1 VAL H2 1 1 17 8104 1 1 1 VAL H3 H -9.711 -1.277 -8.184 1.00 . A A . 1 VAL H3 1 1 17 8105 1 1 1 VAL HA H -10.904 0.819 -6.557 1.00 . A A . 1 VAL HA 1 1 17 8106 1 1 1 VAL HB H -9.675 -0.244 -4.597 1.00 . A A . 1 VAL HB 1 1 17 8107 1 1 1 VAL HG11 H -12.037 -0.139 -4.523 1.00 . A A . 1 VAL HG11 1 1 17 8108 1 1 1 VAL HG12 H -11.607 -1.798 -4.106 1.00 . A A . 1 VAL HG12 1 1 17 8109 1 1 1 VAL HG13 H -12.204 -1.421 -5.722 1.00 . A A . 1 VAL HG13 1 1 17 8110 1 1 1 VAL HG21 H -9.871 -2.649 -6.405 1.00 . A A . 1 VAL HG21 1 1 17 8111 1 1 1 VAL HG22 H -9.533 -2.725 -4.675 1.00 . A A . 1 VAL HG22 1 1 17 8112 1 1 1 VAL HG23 H -8.402 -1.917 -5.760 1.00 . A A . 1 VAL HG23 1 1 17 8113 1 1 1 VAL N N -10.569 -0.807 -7.831 1.00 . A A . 1 VAL N 1 1 17 8114 1 1 1 VAL O O -7.887 -0.021 -7.359 1.00 . A A . 1 VAL O 1 1 17 8115 1 1 2 SER C C -7.358 3.845 -5.709 1.00 . A A . 2 SER C 1 1 17 8116 1 1 2 SER CA C -7.375 2.585 -6.567 1.00 . A A . 2 SER CA 1 1 17 8117 1 1 2 SER CB C -7.109 2.945 -8.029 1.00 . A A . 2 SER CB 1 1 17 8118 1 1 2 SER H H -9.413 2.354 -6.045 1.00 . A A . 2 SER H 1 1 17 8119 1 1 2 SER HA H -6.597 1.919 -6.223 1.00 . A A . 2 SER HA 1 1 17 8120 1 1 2 SER HB2 H -8.022 3.305 -8.481 1.00 . A A . 2 SER HB2 1 1 17 8121 1 1 2 SER HB3 H -6.356 3.718 -8.076 1.00 . A A . 2 SER HB3 1 1 17 8122 1 1 2 SER HG H -5.824 1.510 -8.387 1.00 . A A . 2 SER HG 1 1 17 8123 1 1 2 SER N N -8.649 1.887 -6.441 1.00 . A A . 2 SER N 1 1 17 8124 1 1 2 SER O O -8.348 4.574 -5.639 1.00 . A A . 2 SER O 1 1 17 8125 1 1 2 SER OG O -6.654 1.819 -8.758 1.00 . A A . 2 SER OG 1 1 17 8126 1 1 3 CYS C C -4.783 6.007 -4.502 1.00 . A A . 3 CYS C 1 1 17 8127 1 1 3 CYS CA C -6.082 5.270 -4.202 1.00 . A A . 3 CYS CA 1 1 17 8128 1 1 3 CYS CB C -6.124 4.878 -2.721 1.00 . A A . 3 CYS CB 1 1 17 8129 1 1 3 CYS H H -5.473 3.478 -5.152 1.00 . A A . 3 CYS H 1 1 17 8130 1 1 3 CYS HA H -6.908 5.933 -4.410 1.00 . A A . 3 CYS HA 1 1 17 8131 1 1 3 CYS HB2 H -5.486 5.547 -2.163 1.00 . A A . 3 CYS HB2 1 1 17 8132 1 1 3 CYS HB3 H -7.137 4.976 -2.362 1.00 . A A . 3 CYS HB3 1 1 17 8133 1 1 3 CYS N N -6.227 4.096 -5.057 1.00 . A A . 3 CYS N 1 1 17 8134 1 1 3 CYS O O -3.964 5.549 -5.299 1.00 . A A . 3 CYS O 1 1 17 8135 1 1 3 CYS SG S -5.570 3.176 -2.368 1.00 . A A . 3 CYS SG 1 1 17 8136 1 1 4 THR C C -3.051 8.718 -2.770 1.00 . A A . 4 THR C 1 1 17 8137 1 1 4 THR CA C -3.408 7.961 -4.046 1.00 . A A . 4 THR CA 1 1 17 8138 1 1 4 THR CB C -3.612 8.948 -5.197 1.00 . A A . 4 THR CB 1 1 17 8139 1 1 4 THR CG2 C -2.339 9.254 -5.955 1.00 . A A . 4 THR CG2 1 1 17 8140 1 1 4 THR H H -5.298 7.458 -3.233 1.00 . A A . 4 THR H 1 1 17 8141 1 1 4 THR HA H -2.595 7.296 -4.295 1.00 . A A . 4 THR HA 1 1 17 8142 1 1 4 THR HB H -3.991 9.877 -4.798 1.00 . A A . 4 THR HB 1 1 17 8143 1 1 4 THR HG1 H -4.294 7.563 -6.403 1.00 . A A . 4 THR HG1 1 1 17 8144 1 1 4 THR HG21 H -1.507 8.760 -5.477 1.00 . A A . 4 THR HG21 1 1 17 8145 1 1 4 THR HG22 H -2.170 10.321 -5.959 1.00 . A A . 4 THR HG22 1 1 17 8146 1 1 4 THR HG23 H -2.432 8.901 -6.972 1.00 . A A . 4 THR HG23 1 1 17 8147 1 1 4 THR N N -4.605 7.151 -3.856 1.00 . A A . 4 THR N 1 1 17 8148 1 1 4 THR O O -2.482 9.809 -2.823 1.00 . A A . 4 THR O 1 1 17 8149 1 1 4 THR OG1 O -4.555 8.444 -6.126 1.00 . A A . 4 THR OG1 1 1 17 8150 1 1 5 GLY C C -4.133 8.460 0.705 1.00 . A A . 5 GLY C 1 1 17 8151 1 1 5 GLY CA C -3.092 8.768 -0.355 1.00 . A A . 5 GLY CA 1 1 17 8152 1 1 5 GLY H H -3.838 7.263 -1.644 1.00 . A A . 5 GLY H 1 1 17 8153 1 1 5 GLY HA2 H -2.129 8.424 -0.008 1.00 . A A . 5 GLY HA2 1 1 17 8154 1 1 5 GLY HA3 H -3.050 9.837 -0.501 1.00 . A A . 5 GLY HA3 1 1 17 8155 1 1 5 GLY N N -3.388 8.132 -1.626 1.00 . A A . 5 GLY N 1 1 17 8156 1 1 5 GLY O O -5.292 8.195 0.388 1.00 . A A . 5 GLY O 1 1 17 8157 1 1 6 SER C C -4.253 9.061 4.297 1.00 . A A . 6 SER C 1 1 17 8158 1 1 6 SER CA C -4.620 8.220 3.078 1.00 . A A . 6 SER CA 1 1 17 8159 1 1 6 SER CB C -4.581 6.735 3.438 1.00 . A A . 6 SER CB 1 1 17 8160 1 1 6 SER H H -2.780 8.715 2.155 1.00 . A A . 6 SER H 1 1 17 8161 1 1 6 SER HA H -5.619 8.480 2.765 1.00 . A A . 6 SER HA 1 1 17 8162 1 1 6 SER HB2 H -3.784 6.557 4.146 1.00 . A A . 6 SER HB2 1 1 17 8163 1 1 6 SER HB3 H -5.524 6.448 3.880 1.00 . A A . 6 SER HB3 1 1 17 8164 1 1 6 SER HG H -5.136 5.410 2.105 1.00 . A A . 6 SER HG 1 1 17 8165 1 1 6 SER N N -3.717 8.497 1.967 1.00 . A A . 6 SER N 1 1 17 8166 1 1 6 SER O O -3.354 9.900 4.237 1.00 . A A . 6 SER O 1 1 17 8167 1 1 6 SER OG O -4.353 5.936 2.289 1.00 . A A . 6 SER OG 1 1 17 8168 1 1 7 LYS C C -3.319 9.243 7.193 1.00 . A A . 7 LYS C 1 1 17 8169 1 1 7 LYS CA C -4.702 9.567 6.635 1.00 . A A . 7 LYS CA 1 1 17 8170 1 1 7 LYS CB C -5.776 9.244 7.678 1.00 . A A . 7 LYS CB 1 1 17 8171 1 1 7 LYS CD C -7.301 7.399 8.440 1.00 . A A . 7 LYS CD 1 1 17 8172 1 1 7 LYS CE C -8.134 6.882 7.277 1.00 . A A . 7 LYS CE 1 1 17 8173 1 1 7 LYS CG C -5.893 7.762 7.997 1.00 . A A . 7 LYS CG 1 1 17 8174 1 1 7 LYS H H -5.659 8.148 5.388 1.00 . A A . 7 LYS H 1 1 17 8175 1 1 7 LYS HA H -4.745 10.621 6.404 1.00 . A A . 7 LYS HA 1 1 17 8176 1 1 7 LYS HB2 H -5.542 9.769 8.592 1.00 . A A . 7 LYS HB2 1 1 17 8177 1 1 7 LYS HB3 H -6.731 9.588 7.311 1.00 . A A . 7 LYS HB3 1 1 17 8178 1 1 7 LYS HD2 H -7.243 6.631 9.197 1.00 . A A . 7 LYS HD2 1 1 17 8179 1 1 7 LYS HD3 H -7.777 8.277 8.851 1.00 . A A . 7 LYS HD3 1 1 17 8180 1 1 7 LYS HE2 H -7.977 7.525 6.425 1.00 . A A . 7 LYS HE2 1 1 17 8181 1 1 7 LYS HE3 H -7.811 5.880 7.036 1.00 . A A . 7 LYS HE3 1 1 17 8182 1 1 7 LYS HG2 H -5.646 7.193 7.113 1.00 . A A . 7 LYS HG2 1 1 17 8183 1 1 7 LYS HG3 H -5.202 7.520 8.789 1.00 . A A . 7 LYS HG3 1 1 17 8184 1 1 7 LYS HZ1 H -9.721 6.771 8.632 1.00 . A A . 7 LYS HZ1 1 1 17 8185 1 1 7 LYS HZ2 H -10.045 6.051 7.136 1.00 . A A . 7 LYS HZ2 1 1 17 8186 1 1 7 LYS HZ3 H -10.041 7.736 7.278 1.00 . A A . 7 LYS HZ3 1 1 17 8187 1 1 7 LYS N N -4.954 8.829 5.402 1.00 . A A . 7 LYS N 1 1 17 8188 1 1 7 LYS NZ N -9.587 6.858 7.604 1.00 . A A . 7 LYS NZ 1 1 17 8189 1 1 7 LYS O O -2.550 10.144 7.530 1.00 . A A . 7 LYS O 1 1 17 8190 1 1 8 ASP C C -1.382 6.106 7.334 1.00 . A A . 8 ASP C 1 1 17 8191 1 1 8 ASP CA C -1.716 7.516 7.806 1.00 . A A . 8 ASP CA 1 1 17 8192 1 1 8 ASP CB C -1.709 7.558 9.331 1.00 . A A . 8 ASP CB 1 1 17 8193 1 1 8 ASP CG C -3.026 7.112 9.936 1.00 . A A . 8 ASP CG 1 1 17 8194 1 1 8 ASP H H -3.662 7.283 7.004 1.00 . A A . 8 ASP H 1 1 17 8195 1 1 8 ASP HA H -0.963 8.194 7.433 1.00 . A A . 8 ASP HA 1 1 17 8196 1 1 8 ASP HB2 H -0.931 6.905 9.691 1.00 . A A . 8 ASP HB2 1 1 17 8197 1 1 8 ASP HB3 H -1.507 8.568 9.653 1.00 . A A . 8 ASP HB3 1 1 17 8198 1 1 8 ASP N N -3.009 7.954 7.287 1.00 . A A . 8 ASP N 1 1 17 8199 1 1 8 ASP O O -0.643 5.376 7.995 1.00 . A A . 8 ASP O 1 1 17 8200 1 1 8 ASP OD1 O -3.504 6.015 9.577 1.00 . A A . 8 ASP OD1 1 1 17 8201 1 1 8 ASP OD2 O -3.580 7.859 10.770 1.00 . A A . 8 ASP OD2 1 1 17 8202 1 1 9 CYS C C -0.816 4.490 4.392 1.00 . A A . 9 CYS C 1 1 17 8203 1 1 9 CYS CA C -1.699 4.410 5.621 1.00 . A A . 9 CYS CA 1 1 17 8204 1 1 9 CYS CB C -3.015 3.753 5.253 1.00 . A A . 9 CYS CB 1 1 17 8205 1 1 9 CYS H H -2.509 6.361 5.717 1.00 . A A . 9 CYS H 1 1 17 8206 1 1 9 CYS HA H -1.213 3.814 6.359 1.00 . A A . 9 CYS HA 1 1 17 8207 1 1 9 CYS HB2 H -3.780 4.120 5.910 1.00 . A A . 9 CYS HB2 1 1 17 8208 1 1 9 CYS HB3 H -3.258 4.018 4.243 1.00 . A A . 9 CYS HB3 1 1 17 8209 1 1 9 CYS N N -1.932 5.732 6.190 1.00 . A A . 9 CYS N 1 1 17 8210 1 1 9 CYS O O 0.302 3.975 4.377 1.00 . A A . 9 CYS O 1 1 17 8211 1 1 9 CYS SG S -3.002 1.933 5.363 1.00 . A A . 9 CYS SG 1 1 17 8212 1 1 10 TYR C C 0.822 5.762 2.361 1.00 . A A . 10 TYR C 1 1 17 8213 1 1 10 TYR CA C -0.607 5.294 2.109 1.00 . A A . 10 TYR CA 1 1 17 8214 1 1 10 TYR CB C -1.330 6.289 1.198 1.00 . A A . 10 TYR CB 1 1 17 8215 1 1 10 TYR CD1 C -2.224 4.573 -0.422 1.00 . A A . 10 TYR CD1 1 1 17 8216 1 1 10 TYR CD2 C -1.096 6.477 -1.309 1.00 . A A . 10 TYR CD2 1 1 17 8217 1 1 10 TYR CE1 C -2.431 4.095 -1.701 1.00 . A A . 10 TYR CE1 1 1 17 8218 1 1 10 TYR CE2 C -1.300 6.005 -2.592 1.00 . A A . 10 TYR CE2 1 1 17 8219 1 1 10 TYR CG C -1.554 5.771 -0.204 1.00 . A A . 10 TYR CG 1 1 17 8220 1 1 10 TYR CZ C -1.967 4.814 -2.782 1.00 . A A . 10 TYR CZ 1 1 17 8221 1 1 10 TYR H H -2.232 5.520 3.445 1.00 . A A . 10 TYR H 1 1 17 8222 1 1 10 TYR HA H -0.577 4.332 1.622 1.00 . A A . 10 TYR HA 1 1 17 8223 1 1 10 TYR HB2 H -2.294 6.521 1.623 1.00 . A A . 10 TYR HB2 1 1 17 8224 1 1 10 TYR HB3 H -0.745 7.196 1.127 1.00 . A A . 10 TYR HB3 1 1 17 8225 1 1 10 TYR HD1 H -2.585 4.013 0.427 1.00 . A A . 10 TYR HD1 1 1 17 8226 1 1 10 TYR HD2 H -0.573 7.410 -1.156 1.00 . A A . 10 TYR HD2 1 1 17 8227 1 1 10 TYR HE1 H -2.953 3.162 -1.850 1.00 . A A . 10 TYR HE1 1 1 17 8228 1 1 10 TYR HE2 H -0.935 6.569 -3.438 1.00 . A A . 10 TYR HE2 1 1 17 8229 1 1 10 TYR HH H -3.068 4.004 -4.135 1.00 . A A . 10 TYR HH 1 1 17 8230 1 1 10 TYR N N -1.334 5.138 3.361 1.00 . A A . 10 TYR N 1 1 17 8231 1 1 10 TYR O O 1.717 5.494 1.566 1.00 . A A . 10 TYR O 1 1 17 8232 1 1 10 TYR OH O -2.172 4.340 -4.058 1.00 . A A . 10 TYR OH 1 1 17 8233 1 1 11 ALA C C 3.294 5.837 4.242 1.00 . A A . 11 ALA C 1 1 17 8234 1 1 11 ALA CA C 2.356 6.965 3.815 1.00 . A A . 11 ALA CA 1 1 17 8235 1 1 11 ALA CB C 2.263 8.032 4.896 1.00 . A A . 11 ALA CB 1 1 17 8236 1 1 11 ALA H H 0.272 6.647 4.070 1.00 . A A . 11 ALA H 1 1 17 8237 1 1 11 ALA HA H 2.769 7.423 2.928 1.00 . A A . 11 ALA HA 1 1 17 8238 1 1 11 ALA HB1 H 3.127 7.967 5.541 1.00 . A A . 11 ALA HB1 1 1 17 8239 1 1 11 ALA HB2 H 1.366 7.878 5.478 1.00 . A A . 11 ALA HB2 1 1 17 8240 1 1 11 ALA HB3 H 2.228 9.009 4.436 1.00 . A A . 11 ALA HB3 1 1 17 8241 1 1 11 ALA N N 1.029 6.464 3.469 1.00 . A A . 11 ALA N 1 1 17 8242 1 1 11 ALA O O 4.240 5.503 3.525 1.00 . A A . 11 ALA O 1 1 17 8243 1 1 12 PRO C C 4.012 3.003 4.916 1.00 . A A . 12 PRO C 1 1 17 8244 1 1 12 PRO CA C 3.879 4.133 5.927 1.00 . A A . 12 PRO CA 1 1 17 8245 1 1 12 PRO CB C 3.134 3.651 7.182 1.00 . A A . 12 PRO CB 1 1 17 8246 1 1 12 PRO CD C 1.945 5.542 6.335 1.00 . A A . 12 PRO CD 1 1 17 8247 1 1 12 PRO CG C 1.776 4.262 7.100 1.00 . A A . 12 PRO CG 1 1 17 8248 1 1 12 PRO HA H 4.864 4.483 6.201 1.00 . A A . 12 PRO HA 1 1 17 8249 1 1 12 PRO HB2 H 3.080 2.572 7.177 1.00 . A A . 12 PRO HB2 1 1 17 8250 1 1 12 PRO HB3 H 3.662 3.984 8.064 1.00 . A A . 12 PRO HB3 1 1 17 8251 1 1 12 PRO HD2 H 1.042 5.781 5.792 1.00 . A A . 12 PRO HD2 1 1 17 8252 1 1 12 PRO HD3 H 2.215 6.349 7.001 1.00 . A A . 12 PRO HD3 1 1 17 8253 1 1 12 PRO HG2 H 1.105 3.599 6.575 1.00 . A A . 12 PRO HG2 1 1 17 8254 1 1 12 PRO HG3 H 1.404 4.465 8.093 1.00 . A A . 12 PRO HG3 1 1 17 8255 1 1 12 PRO N N 3.047 5.227 5.418 1.00 . A A . 12 PRO N 1 1 17 8256 1 1 12 PRO O O 4.960 2.219 4.964 1.00 . A A . 12 PRO O 1 1 17 8257 1 1 13 CYS C C 3.811 2.361 1.735 1.00 . A A . 13 CYS C 1 1 17 8258 1 1 13 CYS CA C 3.061 1.896 2.974 1.00 . A A . 13 CYS CA 1 1 17 8259 1 1 13 CYS CB C 1.639 1.509 2.614 1.00 . A A . 13 CYS CB 1 1 17 8260 1 1 13 CYS H H 2.325 3.580 4.012 1.00 . A A . 13 CYS H 1 1 17 8261 1 1 13 CYS HA H 3.557 1.037 3.372 1.00 . A A . 13 CYS HA 1 1 17 8262 1 1 13 CYS HB2 H 0.971 2.018 3.280 1.00 . A A . 13 CYS HB2 1 1 17 8263 1 1 13 CYS HB3 H 1.441 1.816 1.606 1.00 . A A . 13 CYS HB3 1 1 17 8264 1 1 13 CYS N N 3.054 2.926 3.999 1.00 . A A . 13 CYS N 1 1 17 8265 1 1 13 CYS O O 4.650 1.637 1.207 1.00 . A A . 13 CYS O 1 1 17 8266 1 1 13 CYS SG S 1.287 -0.277 2.740 1.00 . A A . 13 CYS SG 1 1 17 8267 1 1 14 ARG C C 5.681 3.963 0.225 1.00 . A A . 14 ARG C 1 1 17 8268 1 1 14 ARG CA C 4.174 4.115 0.095 1.00 . A A . 14 ARG CA 1 1 17 8269 1 1 14 ARG CB C 3.803 5.587 -0.113 1.00 . A A . 14 ARG CB 1 1 17 8270 1 1 14 ARG CD C 5.692 7.154 -0.662 1.00 . A A . 14 ARG CD 1 1 17 8271 1 1 14 ARG CG C 4.591 6.268 -1.222 1.00 . A A . 14 ARG CG 1 1 17 8272 1 1 14 ARG CZ C 6.390 8.391 -2.676 1.00 . A A . 14 ARG CZ 1 1 17 8273 1 1 14 ARG H H 2.840 4.111 1.731 1.00 . A A . 14 ARG H 1 1 17 8274 1 1 14 ARG HA H 3.840 3.542 -0.753 1.00 . A A . 14 ARG HA 1 1 17 8275 1 1 14 ARG HB2 H 2.754 5.649 -0.360 1.00 . A A . 14 ARG HB2 1 1 17 8276 1 1 14 ARG HB3 H 3.979 6.124 0.807 1.00 . A A . 14 ARG HB3 1 1 17 8277 1 1 14 ARG HD2 H 5.437 7.427 0.350 1.00 . A A . 14 ARG HD2 1 1 17 8278 1 1 14 ARG HD3 H 6.618 6.597 -0.662 1.00 . A A . 14 ARG HD3 1 1 17 8279 1 1 14 ARG HE H 5.589 9.218 -1.046 1.00 . A A . 14 ARG HE 1 1 17 8280 1 1 14 ARG HG2 H 5.036 5.513 -1.851 1.00 . A A . 14 ARG HG2 1 1 17 8281 1 1 14 ARG HG3 H 3.916 6.876 -1.809 1.00 . A A . 14 ARG HG3 1 1 17 8282 1 1 14 ARG HH11 H 6.689 6.393 -2.775 1.00 . A A . 14 ARG HH11 1 1 17 8283 1 1 14 ARG HH12 H 7.170 7.285 -4.178 1.00 . A A . 14 ARG HH12 1 1 17 8284 1 1 14 ARG HH21 H 6.222 10.394 -2.890 1.00 . A A . 14 ARG HH21 1 1 17 8285 1 1 14 ARG HH22 H 6.906 9.557 -4.244 1.00 . A A . 14 ARG HH22 1 1 17 8286 1 1 14 ARG N N 3.512 3.573 1.272 1.00 . A A . 14 ARG N 1 1 17 8287 1 1 14 ARG NE N 5.870 8.371 -1.451 1.00 . A A . 14 ARG NE 1 1 17 8288 1 1 14 ARG NH1 N 6.782 7.264 -3.257 1.00 . A A . 14 ARG NH1 1 1 17 8289 1 1 14 ARG NH2 N 6.517 9.541 -3.323 1.00 . A A . 14 ARG NH2 1 1 17 8290 1 1 14 ARG O O 6.375 3.671 -0.747 1.00 . A A . 14 ARG O 1 1 17 8291 1 1 15 LYS C C 8.062 2.601 1.308 1.00 . A A . 15 LYS C 1 1 17 8292 1 1 15 LYS CA C 7.602 4.002 1.701 1.00 . A A . 15 LYS CA 1 1 17 8293 1 1 15 LYS CB C 7.901 4.260 3.179 1.00 . A A . 15 LYS CB 1 1 17 8294 1 1 15 LYS CD C 10.033 5.545 2.838 1.00 . A A . 15 LYS CD 1 1 17 8295 1 1 15 LYS CE C 10.077 6.243 1.488 1.00 . A A . 15 LYS CE 1 1 17 8296 1 1 15 LYS CG C 8.634 5.567 3.431 1.00 . A A . 15 LYS CG 1 1 17 8297 1 1 15 LYS H H 5.571 4.364 2.183 1.00 . A A . 15 LYS H 1 1 17 8298 1 1 15 LYS HA H 8.127 4.727 1.098 1.00 . A A . 15 LYS HA 1 1 17 8299 1 1 15 LYS HB2 H 6.970 4.282 3.724 1.00 . A A . 15 LYS HB2 1 1 17 8300 1 1 15 LYS HB3 H 8.510 3.451 3.559 1.00 . A A . 15 LYS HB3 1 1 17 8301 1 1 15 LYS HD2 H 10.708 6.049 3.514 1.00 . A A . 15 LYS HD2 1 1 17 8302 1 1 15 LYS HD3 H 10.345 4.518 2.714 1.00 . A A . 15 LYS HD3 1 1 17 8303 1 1 15 LYS HE2 H 9.992 5.499 0.710 1.00 . A A . 15 LYS HE2 1 1 17 8304 1 1 15 LYS HE3 H 9.244 6.926 1.423 1.00 . A A . 15 LYS HE3 1 1 17 8305 1 1 15 LYS HG2 H 8.076 6.374 2.981 1.00 . A A . 15 LYS HG2 1 1 17 8306 1 1 15 LYS HG3 H 8.706 5.727 4.498 1.00 . A A . 15 LYS HG3 1 1 17 8307 1 1 15 LYS HZ1 H 11.684 7.366 2.209 1.00 . A A . 15 LYS HZ1 1 1 17 8308 1 1 15 LYS HZ2 H 11.185 7.805 0.654 1.00 . A A . 15 LYS HZ2 1 1 17 8309 1 1 15 LYS HZ3 H 12.072 6.384 0.886 1.00 . A A . 15 LYS HZ3 1 1 17 8310 1 1 15 LYS N N 6.178 4.144 1.441 1.00 . A A . 15 LYS N 1 1 17 8311 1 1 15 LYS NZ N 11.343 7.003 1.296 1.00 . A A . 15 LYS NZ 1 1 17 8312 1 1 15 LYS O O 9.074 2.433 0.629 1.00 . A A . 15 LYS O 1 1 17 8313 1 1 16 GLN C C 7.384 -0.113 -0.043 1.00 . A A . 16 GLN C 1 1 17 8314 1 1 16 GLN CA C 7.618 0.207 1.434 1.00 . A A . 16 GLN CA 1 1 17 8315 1 1 16 GLN CB C 6.779 -0.729 2.306 1.00 . A A . 16 GLN CB 1 1 17 8316 1 1 16 GLN CD C 6.587 -3.116 3.111 1.00 . A A . 16 GLN CD 1 1 17 8317 1 1 16 GLN CG C 7.523 -1.981 2.744 1.00 . A A . 16 GLN CG 1 1 17 8318 1 1 16 GLN H H 6.500 1.798 2.276 1.00 . A A . 16 GLN H 1 1 17 8319 1 1 16 GLN HA H 8.662 0.050 1.662 1.00 . A A . 16 GLN HA 1 1 17 8320 1 1 16 GLN HB2 H 6.467 -0.195 3.190 1.00 . A A . 16 GLN HB2 1 1 17 8321 1 1 16 GLN HB3 H 5.905 -1.032 1.751 1.00 . A A . 16 GLN HB3 1 1 17 8322 1 1 16 GLN HE21 H 6.182 -2.253 4.856 1.00 . A A . 16 GLN HE21 1 1 17 8323 1 1 16 GLN HE22 H 5.378 -3.752 4.556 1.00 . A A . 16 GLN HE22 1 1 17 8324 1 1 16 GLN HG2 H 8.160 -2.307 1.936 1.00 . A A . 16 GLN HG2 1 1 17 8325 1 1 16 GLN HG3 H 8.129 -1.741 3.605 1.00 . A A . 16 GLN HG3 1 1 17 8326 1 1 16 GLN N N 7.302 1.597 1.740 1.00 . A A . 16 GLN N 1 1 17 8327 1 1 16 GLN NE2 N 5.989 -3.032 4.294 1.00 . A A . 16 GLN NE2 1 1 17 8328 1 1 16 GLN O O 8.280 -0.605 -0.729 1.00 . A A . 16 GLN O 1 1 17 8329 1 1 16 GLN OE1 O 6.403 -4.058 2.339 1.00 . A A . 16 GLN OE1 1 1 17 8330 1 1 17 THR C C 6.510 0.835 -2.860 1.00 . A A . 17 THR C 1 1 17 8331 1 1 17 THR CA C 5.807 -0.112 -1.903 1.00 . A A . 17 THR CA 1 1 17 8332 1 1 17 THR CB C 4.289 0.003 -2.074 1.00 . A A . 17 THR CB 1 1 17 8333 1 1 17 THR CG2 C 3.829 -0.113 -3.513 1.00 . A A . 17 THR CG2 1 1 17 8334 1 1 17 THR H H 5.499 0.543 0.077 1.00 . A A . 17 THR H 1 1 17 8335 1 1 17 THR HA H 6.107 -1.118 -2.134 1.00 . A A . 17 THR HA 1 1 17 8336 1 1 17 THR HB H 3.970 0.967 -1.704 1.00 . A A . 17 THR HB 1 1 17 8337 1 1 17 THR HG1 H 4.185 -1.772 -1.245 1.00 . A A . 17 THR HG1 1 1 17 8338 1 1 17 THR HG21 H 2.764 0.056 -3.565 1.00 . A A . 17 THR HG21 1 1 17 8339 1 1 17 THR HG22 H 4.055 -1.101 -3.883 1.00 . A A . 17 THR HG22 1 1 17 8340 1 1 17 THR HG23 H 4.340 0.623 -4.115 1.00 . A A . 17 THR HG23 1 1 17 8341 1 1 17 THR N N 6.171 0.157 -0.518 1.00 . A A . 17 THR N 1 1 17 8342 1 1 17 THR O O 7.314 0.419 -3.695 1.00 . A A . 17 THR O 1 1 17 8343 1 1 17 THR OG1 O 3.620 -1.000 -1.329 1.00 . A A . 17 THR OG1 1 1 17 8344 1 1 18 GLY C C 5.724 3.825 -4.423 1.00 . A A . 18 GLY C 1 1 17 8345 1 1 18 GLY CA C 6.761 3.109 -3.595 1.00 . A A . 18 GLY CA 1 1 17 8346 1 1 18 GLY H H 5.541 2.370 -2.072 1.00 . A A . 18 GLY H 1 1 17 8347 1 1 18 GLY HA2 H 7.288 3.826 -3.003 1.00 . A A . 18 GLY HA2 1 1 17 8348 1 1 18 GLY HA3 H 7.450 2.626 -4.249 1.00 . A A . 18 GLY HA3 1 1 17 8349 1 1 18 GLY N N 6.184 2.111 -2.740 1.00 . A A . 18 GLY N 1 1 17 8350 1 1 18 GLY O O 4.954 4.637 -3.910 1.00 . A A . 18 GLY O 1 1 17 8351 1 1 19 CYS C C 3.501 4.599 -6.059 1.00 . A A . 19 CYS C 1 1 17 8352 1 1 19 CYS CA C 4.812 4.105 -6.684 1.00 . A A . 19 CYS CA 1 1 17 8353 1 1 19 CYS CB C 4.520 3.120 -7.786 1.00 . A A . 19 CYS CB 1 1 17 8354 1 1 19 CYS H H 6.388 2.881 -6.023 1.00 . A A . 19 CYS H 1 1 17 8355 1 1 19 CYS HA H 5.316 4.926 -7.132 1.00 . A A . 19 CYS HA 1 1 17 8356 1 1 19 CYS HB2 H 3.623 3.430 -8.286 1.00 . A A . 19 CYS HB2 1 1 17 8357 1 1 19 CYS HB3 H 5.339 3.156 -8.480 1.00 . A A . 19 CYS HB3 1 1 17 8358 1 1 19 CYS N N 5.728 3.520 -5.711 1.00 . A A . 19 CYS N 1 1 17 8359 1 1 19 CYS O O 2.993 4.007 -5.107 1.00 . A A . 19 CYS O 1 1 17 8360 1 1 19 CYS SG S 4.305 1.393 -7.243 1.00 . A A . 19 CYS SG 1 1 17 8361 1 1 20 PRO C C 0.519 5.317 -6.041 1.00 . A A . 20 PRO C 1 1 17 8362 1 1 20 PRO CA C 1.694 6.296 -6.083 1.00 . A A . 20 PRO CA 1 1 17 8363 1 1 20 PRO CB C 1.402 7.422 -7.077 1.00 . A A . 20 PRO CB 1 1 17 8364 1 1 20 PRO CD C 3.493 6.472 -7.723 1.00 . A A . 20 PRO CD 1 1 17 8365 1 1 20 PRO CG C 2.724 7.762 -7.670 1.00 . A A . 20 PRO CG 1 1 17 8366 1 1 20 PRO HA H 1.835 6.718 -5.100 1.00 . A A . 20 PRO HA 1 1 17 8367 1 1 20 PRO HB2 H 0.709 7.072 -7.828 1.00 . A A . 20 PRO HB2 1 1 17 8368 1 1 20 PRO HB3 H 0.976 8.266 -6.554 1.00 . A A . 20 PRO HB3 1 1 17 8369 1 1 20 PRO HD2 H 3.313 5.964 -8.659 1.00 . A A . 20 PRO HD2 1 1 17 8370 1 1 20 PRO HD3 H 4.547 6.658 -7.587 1.00 . A A . 20 PRO HD3 1 1 17 8371 1 1 20 PRO HG2 H 2.589 8.159 -8.666 1.00 . A A . 20 PRO HG2 1 1 17 8372 1 1 20 PRO HG3 H 3.235 8.478 -7.045 1.00 . A A . 20 PRO HG3 1 1 17 8373 1 1 20 PRO N N 2.943 5.704 -6.591 1.00 . A A . 20 PRO N 1 1 17 8374 1 1 20 PRO O O -0.499 5.597 -5.408 1.00 . A A . 20 PRO O 1 1 17 8375 1 1 21 TYR C C -0.583 2.525 -5.394 1.00 . A A . 21 TYR C 1 1 17 8376 1 1 21 TYR CA C -0.410 3.197 -6.754 1.00 . A A . 21 TYR CA 1 1 17 8377 1 1 21 TYR CB C -0.099 2.149 -7.819 1.00 . A A . 21 TYR CB 1 1 17 8378 1 1 21 TYR CD1 C 0.659 3.829 -9.550 1.00 . A A . 21 TYR CD1 1 1 17 8379 1 1 21 TYR CD2 C 1.923 1.823 -9.301 1.00 . A A . 21 TYR CD2 1 1 17 8380 1 1 21 TYR CE1 C 1.518 4.251 -10.547 1.00 . A A . 21 TYR CE1 1 1 17 8381 1 1 21 TYR CE2 C 2.787 2.239 -10.298 1.00 . A A . 21 TYR CE2 1 1 17 8382 1 1 21 TYR CG C 0.848 2.610 -8.911 1.00 . A A . 21 TYR CG 1 1 17 8383 1 1 21 TYR CZ C 2.579 3.453 -10.918 1.00 . A A . 21 TYR CZ 1 1 17 8384 1 1 21 TYR H H 1.460 3.999 -7.217 1.00 . A A . 21 TYR H 1 1 17 8385 1 1 21 TYR HA H -1.327 3.701 -7.014 1.00 . A A . 21 TYR HA 1 1 17 8386 1 1 21 TYR HB2 H 0.338 1.285 -7.347 1.00 . A A . 21 TYR HB2 1 1 17 8387 1 1 21 TYR HB3 H -1.012 1.870 -8.285 1.00 . A A . 21 TYR HB3 1 1 17 8388 1 1 21 TYR HD1 H -0.173 4.453 -9.258 1.00 . A A . 21 TYR HD1 1 1 17 8389 1 1 21 TYR HD2 H 2.084 0.873 -8.814 1.00 . A A . 21 TYR HD2 1 1 17 8390 1 1 21 TYR HE1 H 1.355 5.202 -11.032 1.00 . A A . 21 TYR HE1 1 1 17 8391 1 1 21 TYR HE2 H 3.618 1.613 -10.587 1.00 . A A . 21 TYR HE2 1 1 17 8392 1 1 21 TYR HH H 3.676 3.121 -12.461 1.00 . A A . 21 TYR HH 1 1 17 8393 1 1 21 TYR N N 0.648 4.181 -6.719 1.00 . A A . 21 TYR N 1 1 17 8394 1 1 21 TYR O O 0.291 2.609 -4.531 1.00 . A A . 21 TYR O 1 1 17 8395 1 1 21 TYR OH O 3.436 3.869 -11.910 1.00 . A A . 21 TYR OH 1 1 17 8396 1 1 22 GLY C C -3.098 0.149 -4.075 1.00 . A A . 22 GLY C 1 1 17 8397 1 1 22 GLY CA C -1.995 1.183 -3.955 1.00 . A A . 22 GLY CA 1 1 17 8398 1 1 22 GLY H H -2.379 1.828 -5.937 1.00 . A A . 22 GLY H 1 1 17 8399 1 1 22 GLY HA2 H -1.099 0.697 -3.621 1.00 . A A . 22 GLY HA2 1 1 17 8400 1 1 22 GLY HA3 H -2.284 1.917 -3.220 1.00 . A A . 22 GLY HA3 1 1 17 8401 1 1 22 GLY N N -1.720 1.859 -5.212 1.00 . A A . 22 GLY N 1 1 17 8402 1 1 22 GLY O O -3.981 0.274 -4.924 1.00 . A A . 22 GLY O 1 1 17 8403 1 1 23 LYS C C -5.119 -1.663 -2.145 1.00 . A A . 23 LYS C 1 1 17 8404 1 1 23 LYS CA C -4.078 -1.912 -3.235 1.00 . A A . 23 LYS CA 1 1 17 8405 1 1 23 LYS CB C -3.436 -3.287 -3.043 1.00 . A A . 23 LYS CB 1 1 17 8406 1 1 23 LYS CD C -3.927 -5.745 -3.224 1.00 . A A . 23 LYS CD 1 1 17 8407 1 1 23 LYS CE C -5.174 -6.136 -2.447 1.00 . A A . 23 LYS CE 1 1 17 8408 1 1 23 LYS CG C -4.084 -4.382 -3.877 1.00 . A A . 23 LYS CG 1 1 17 8409 1 1 23 LYS H H -2.346 -0.916 -2.553 1.00 . A A . 23 LYS H 1 1 17 8410 1 1 23 LYS HA H -4.563 -1.879 -4.195 1.00 . A A . 23 LYS HA 1 1 17 8411 1 1 23 LYS HB2 H -2.393 -3.227 -3.316 1.00 . A A . 23 LYS HB2 1 1 17 8412 1 1 23 LYS HB3 H -3.513 -3.565 -2.002 1.00 . A A . 23 LYS HB3 1 1 17 8413 1 1 23 LYS HD2 H -3.749 -6.483 -3.992 1.00 . A A . 23 LYS HD2 1 1 17 8414 1 1 23 LYS HD3 H -3.087 -5.715 -2.546 1.00 . A A . 23 LYS HD3 1 1 17 8415 1 1 23 LYS HE2 H -5.365 -5.386 -1.694 1.00 . A A . 23 LYS HE2 1 1 17 8416 1 1 23 LYS HE3 H -6.009 -6.181 -3.130 1.00 . A A . 23 LYS HE3 1 1 17 8417 1 1 23 LYS HG2 H -5.136 -4.164 -3.985 1.00 . A A . 23 LYS HG2 1 1 17 8418 1 1 23 LYS HG3 H -3.617 -4.402 -4.850 1.00 . A A . 23 LYS HG3 1 1 17 8419 1 1 23 LYS HZ1 H -4.694 -7.332 -0.803 1.00 . A A . 23 LYS HZ1 1 1 17 8420 1 1 23 LYS HZ2 H -4.328 -8.040 -2.295 1.00 . A A . 23 LYS HZ2 1 1 17 8421 1 1 23 LYS HZ3 H -5.934 -7.961 -1.769 1.00 . A A . 23 LYS HZ3 1 1 17 8422 1 1 23 LYS N N -3.060 -0.871 -3.216 1.00 . A A . 23 LYS N 1 1 17 8423 1 1 23 LYS NZ N -5.022 -7.460 -1.782 1.00 . A A . 23 LYS NZ 1 1 17 8424 1 1 23 LYS O O -5.944 -2.527 -1.851 1.00 . A A . 23 LYS O 1 1 17 8425 1 1 24 CYS C C -7.438 -0.204 -0.955 1.00 . A A . 24 CYS C 1 1 17 8426 1 1 24 CYS CA C -5.988 -0.107 -0.483 1.00 . A A . 24 CYS CA 1 1 17 8427 1 1 24 CYS CB C -5.659 1.306 0.030 1.00 . A A . 24 CYS CB 1 1 17 8428 1 1 24 CYS H H -4.380 0.169 -1.820 1.00 . A A . 24 CYS H 1 1 17 8429 1 1 24 CYS HA H -5.847 -0.808 0.326 1.00 . A A . 24 CYS HA 1 1 17 8430 1 1 24 CYS HB2 H -5.826 1.339 1.094 1.00 . A A . 24 CYS HB2 1 1 17 8431 1 1 24 CYS HB3 H -4.615 1.510 -0.166 1.00 . A A . 24 CYS HB3 1 1 17 8432 1 1 24 CYS N N -5.064 -0.475 -1.545 1.00 . A A . 24 CYS N 1 1 17 8433 1 1 24 CYS O O -7.803 0.334 -2.001 1.00 . A A . 24 CYS O 1 1 17 8434 1 1 24 CYS SG S -6.636 2.655 -0.720 1.00 . A A . 24 CYS SG 1 1 17 8435 1 1 25 MET C C -10.473 -1.211 0.778 1.00 . A A . 25 MET C 1 1 17 8436 1 1 25 MET CA C -9.667 -1.078 -0.496 1.00 . A A . 25 MET CA 1 1 17 8437 1 1 25 MET CB C -9.864 -2.314 -1.376 1.00 . A A . 25 MET CB 1 1 17 8438 1 1 25 MET CE C -8.499 -6.069 -1.782 1.00 . A A . 25 MET CE 1 1 17 8439 1 1 25 MET CG C -9.205 -3.566 -0.823 1.00 . A A . 25 MET CG 1 1 17 8440 1 1 25 MET H H -7.900 -1.306 0.648 1.00 . A A . 25 MET H 1 1 17 8441 1 1 25 MET HA H -10.013 -0.203 -1.027 1.00 . A A . 25 MET HA 1 1 17 8442 1 1 25 MET HB2 H -10.922 -2.504 -1.476 1.00 . A A . 25 MET HB2 1 1 17 8443 1 1 25 MET HB3 H -9.448 -2.116 -2.353 1.00 . A A . 25 MET HB3 1 1 17 8444 1 1 25 MET HE1 H -8.494 -6.932 -1.134 1.00 . A A . 25 MET HE1 1 1 17 8445 1 1 25 MET HE2 H -7.614 -5.477 -1.601 1.00 . A A . 25 MET HE2 1 1 17 8446 1 1 25 MET HE3 H -8.511 -6.392 -2.812 1.00 . A A . 25 MET HE3 1 1 17 8447 1 1 25 MET HG2 H -8.161 -3.559 -1.099 1.00 . A A . 25 MET HG2 1 1 17 8448 1 1 25 MET HG3 H -9.291 -3.556 0.254 1.00 . A A . 25 MET HG3 1 1 17 8449 1 1 25 MET N N -8.255 -0.899 -0.174 1.00 . A A . 25 MET N 1 1 17 8450 1 1 25 MET O O -9.986 -1.723 1.793 1.00 . A A . 25 MET O 1 1 17 8451 1 1 25 MET SD S -9.956 -5.081 -1.449 1.00 . A A . 25 MET SD 1 1 17 8452 1 1 26 ASN C C -11.783 -0.158 3.077 1.00 . A A . 26 ASN C 1 1 17 8453 1 1 26 ASN CA C -12.513 -0.817 1.951 1.00 . A A . 26 ASN CA 1 1 17 8454 1 1 26 ASN CB C -12.784 -2.289 2.289 1.00 . A A . 26 ASN CB 1 1 17 8455 1 1 26 ASN CG C -13.190 -3.099 1.072 1.00 . A A . 26 ASN CG 1 1 17 8456 1 1 26 ASN H H -12.053 -0.312 -0.064 1.00 . A A . 26 ASN H 1 1 17 8457 1 1 26 ASN HA H -13.446 -0.312 1.840 1.00 . A A . 26 ASN HA 1 1 17 8458 1 1 26 ASN HB2 H -11.890 -2.727 2.706 1.00 . A A . 26 ASN HB2 1 1 17 8459 1 1 26 ASN HB3 H -13.580 -2.345 3.017 1.00 . A A . 26 ASN HB3 1 1 17 8460 1 1 26 ASN HD21 H -14.414 -1.646 0.483 1.00 . A A . 26 ASN HD21 1 1 17 8461 1 1 26 ASN HD22 H -14.357 -3.039 -0.537 1.00 . A A . 26 ASN HD22 1 1 17 8462 1 1 26 ASN N N -11.705 -0.731 0.752 1.00 . A A . 26 ASN N 1 1 17 8463 1 1 26 ASN ND2 N -14.076 -2.537 0.257 1.00 . A A . 26 ASN ND2 1 1 17 8464 1 1 26 ASN O O -10.745 0.479 2.902 1.00 . A A . 26 ASN O 1 1 17 8465 1 1 26 ASN OD1 O -12.713 -4.214 0.866 1.00 . A A . 26 ASN OD1 1 1 17 8466 1 1 27 ARG C C -10.458 -0.608 5.737 1.00 . A A . 27 ARG C 1 1 17 8467 1 1 27 ARG CA C -11.738 0.149 5.447 1.00 . A A . 27 ARG CA 1 1 17 8468 1 1 27 ARG CB C -12.717 0.047 6.619 1.00 . A A . 27 ARG CB 1 1 17 8469 1 1 27 ARG CD C -13.212 1.574 8.554 1.00 . A A . 27 ARG CD 1 1 17 8470 1 1 27 ARG CG C -13.289 1.388 7.047 1.00 . A A . 27 ARG CG 1 1 17 8471 1 1 27 ARG CZ C -15.528 1.045 9.206 1.00 . A A . 27 ARG CZ 1 1 17 8472 1 1 27 ARG H H -13.114 -0.905 4.240 1.00 . A A . 27 ARG H 1 1 17 8473 1 1 27 ARG HA H -11.486 1.171 5.271 1.00 . A A . 27 ARG HA 1 1 17 8474 1 1 27 ARG HB2 H -13.538 -0.595 6.332 1.00 . A A . 27 ARG HB2 1 1 17 8475 1 1 27 ARG HB3 H -12.206 -0.391 7.464 1.00 . A A . 27 ARG HB3 1 1 17 8476 1 1 27 ARG HD2 H -12.232 1.266 8.890 1.00 . A A . 27 ARG HD2 1 1 17 8477 1 1 27 ARG HD3 H -13.358 2.618 8.782 1.00 . A A . 27 ARG HD3 1 1 17 8478 1 1 27 ARG HE H -13.914 0.028 9.792 1.00 . A A . 27 ARG HE 1 1 17 8479 1 1 27 ARG HG2 H -12.728 2.177 6.569 1.00 . A A . 27 ARG HG2 1 1 17 8480 1 1 27 ARG HG3 H -14.322 1.442 6.739 1.00 . A A . 27 ARG HG3 1 1 17 8481 1 1 27 ARG HH11 H -15.346 2.647 7.983 1.00 . A A . 27 ARG HH11 1 1 17 8482 1 1 27 ARG HH12 H -16.965 2.254 8.457 1.00 . A A . 27 ARG HH12 1 1 17 8483 1 1 27 ARG HH21 H -16.042 -0.491 10.415 1.00 . A A . 27 ARG HH21 1 1 17 8484 1 1 27 ARG HH22 H -17.361 0.474 9.838 1.00 . A A . 27 ARG HH22 1 1 17 8485 1 1 27 ARG N N -12.323 -0.364 4.224 1.00 . A A . 27 ARG N 1 1 17 8486 1 1 27 ARG NE N -14.223 0.788 9.255 1.00 . A A . 27 ARG NE 1 1 17 8487 1 1 27 ARG NH1 N -15.983 2.066 8.490 1.00 . A A . 27 ARG NH1 1 1 17 8488 1 1 27 ARG NH2 N -16.380 0.280 9.874 1.00 . A A . 27 ARG NH2 1 1 17 8489 1 1 27 ARG O O -9.859 -0.490 6.807 1.00 . A A . 27 ARG O 1 1 17 8490 1 1 28 LYS C C -7.832 -1.748 3.750 1.00 . A A . 28 LYS C 1 1 17 8491 1 1 28 LYS CA C -8.834 -2.180 4.819 1.00 . A A . 28 LYS CA 1 1 17 8492 1 1 28 LYS CB C -9.160 -3.666 4.665 1.00 . A A . 28 LYS CB 1 1 17 8493 1 1 28 LYS CD C -7.669 -4.856 6.300 1.00 . A A . 28 LYS CD 1 1 17 8494 1 1 28 LYS CE C -7.171 -6.278 6.508 1.00 . A A . 28 LYS CE 1 1 17 8495 1 1 28 LYS CG C -7.953 -4.574 4.833 1.00 . A A . 28 LYS CG 1 1 17 8496 1 1 28 LYS H H -10.603 -1.398 3.925 1.00 . A A . 28 LYS H 1 1 17 8497 1 1 28 LYS HA H -8.389 -2.013 5.788 1.00 . A A . 28 LYS HA 1 1 17 8498 1 1 28 LYS HB2 H -9.896 -3.939 5.407 1.00 . A A . 28 LYS HB2 1 1 17 8499 1 1 28 LYS HB3 H -9.574 -3.832 3.681 1.00 . A A . 28 LYS HB3 1 1 17 8500 1 1 28 LYS HD2 H -6.915 -4.167 6.650 1.00 . A A . 28 LYS HD2 1 1 17 8501 1 1 28 LYS HD3 H -8.578 -4.716 6.866 1.00 . A A . 28 LYS HD3 1 1 17 8502 1 1 28 LYS HE2 H -6.766 -6.361 7.504 1.00 . A A . 28 LYS HE2 1 1 17 8503 1 1 28 LYS HE3 H -8.004 -6.957 6.399 1.00 . A A . 28 LYS HE3 1 1 17 8504 1 1 28 LYS HG2 H -8.144 -5.509 4.328 1.00 . A A . 28 LYS HG2 1 1 17 8505 1 1 28 LYS HG3 H -7.090 -4.095 4.394 1.00 . A A . 28 LYS HG3 1 1 17 8506 1 1 28 LYS HZ1 H -5.626 -7.510 5.832 1.00 . A A . 28 LYS HZ1 1 1 17 8507 1 1 28 LYS HZ2 H -5.419 -5.877 5.442 1.00 . A A . 28 LYS HZ2 1 1 17 8508 1 1 28 LYS HZ3 H -6.540 -6.815 4.590 1.00 . A A . 28 LYS HZ3 1 1 17 8509 1 1 28 LYS N N -10.053 -1.379 4.743 1.00 . A A . 28 LYS N 1 1 17 8510 1 1 28 LYS NZ N -6.115 -6.645 5.524 1.00 . A A . 28 LYS NZ 1 1 17 8511 1 1 28 LYS O O -7.818 -2.275 2.635 1.00 . A A . 28 LYS O 1 1 17 8512 1 1 29 CYS C C -4.891 -1.283 2.950 1.00 . A A . 29 CYS C 1 1 17 8513 1 1 29 CYS CA C -5.993 -0.259 3.196 1.00 . A A . 29 CYS CA 1 1 17 8514 1 1 29 CYS CB C -5.429 1.047 3.767 1.00 . A A . 29 CYS CB 1 1 17 8515 1 1 29 CYS H H -7.068 -0.399 4.999 1.00 . A A . 29 CYS H 1 1 17 8516 1 1 29 CYS HA H -6.481 -0.044 2.263 1.00 . A A . 29 CYS HA 1 1 17 8517 1 1 29 CYS HB2 H -5.947 1.867 3.311 1.00 . A A . 29 CYS HB2 1 1 17 8518 1 1 29 CYS HB3 H -5.621 1.062 4.824 1.00 . A A . 29 CYS HB3 1 1 17 8519 1 1 29 CYS N N -7.000 -0.780 4.103 1.00 . A A . 29 CYS N 1 1 17 8520 1 1 29 CYS O O -4.760 -2.262 3.685 1.00 . A A . 29 CYS O 1 1 17 8521 1 1 29 CYS SG S -3.639 1.331 3.530 1.00 . A A . 29 CYS SG 1 1 17 8522 1 1 30 LYS C C -2.317 -1.494 0.266 1.00 . A A . 30 LYS C 1 1 17 8523 1 1 30 LYS CA C -2.997 -1.931 1.562 1.00 . A A . 30 LYS CA 1 1 17 8524 1 1 30 LYS CB C -3.492 -3.375 1.425 1.00 . A A . 30 LYS CB 1 1 17 8525 1 1 30 LYS CD C -5.912 -4.063 1.360 1.00 . A A . 30 LYS CD 1 1 17 8526 1 1 30 LYS CE C -5.738 -5.544 1.659 1.00 . A A . 30 LYS CE 1 1 17 8527 1 1 30 LYS CG C -4.738 -3.514 0.564 1.00 . A A . 30 LYS CG 1 1 17 8528 1 1 30 LYS H H -4.256 -0.234 1.376 1.00 . A A . 30 LYS H 1 1 17 8529 1 1 30 LYS HA H -2.274 -1.887 2.361 1.00 . A A . 30 LYS HA 1 1 17 8530 1 1 30 LYS HB2 H -2.708 -3.970 0.983 1.00 . A A . 30 LYS HB2 1 1 17 8531 1 1 30 LYS HB3 H -3.713 -3.761 2.409 1.00 . A A . 30 LYS HB3 1 1 17 8532 1 1 30 LYS HD2 H -5.985 -3.525 2.294 1.00 . A A . 30 LYS HD2 1 1 17 8533 1 1 30 LYS HD3 H -6.818 -3.923 0.791 1.00 . A A . 30 LYS HD3 1 1 17 8534 1 1 30 LYS HE2 H -6.707 -5.972 1.863 1.00 . A A . 30 LYS HE2 1 1 17 8535 1 1 30 LYS HE3 H -5.308 -6.024 0.792 1.00 . A A . 30 LYS HE3 1 1 17 8536 1 1 30 LYS HG2 H -5.004 -2.544 0.175 1.00 . A A . 30 LYS HG2 1 1 17 8537 1 1 30 LYS HG3 H -4.524 -4.186 -0.253 1.00 . A A . 30 LYS HG3 1 1 17 8538 1 1 30 LYS HZ1 H -5.003 -5.035 3.547 1.00 . A A . 30 LYS HZ1 1 1 17 8539 1 1 30 LYS HZ2 H -3.853 -5.752 2.535 1.00 . A A . 30 LYS HZ2 1 1 17 8540 1 1 30 LYS HZ3 H -5.053 -6.701 3.256 1.00 . A A . 30 LYS HZ3 1 1 17 8541 1 1 30 LYS N N -4.098 -1.039 1.912 1.00 . A A . 30 LYS N 1 1 17 8542 1 1 30 LYS NZ N -4.850 -5.774 2.832 1.00 . A A . 30 LYS NZ 1 1 17 8543 1 1 30 LYS O O -2.790 -1.796 -0.826 1.00 . A A . 30 LYS O 1 1 17 8544 1 1 31 CYS C C -0.307 -1.331 -1.840 1.00 . A A . 31 CYS C 1 1 17 8545 1 1 31 CYS CA C -0.415 -0.301 -0.734 1.00 . A A . 31 CYS CA 1 1 17 8546 1 1 31 CYS CB C 0.986 0.114 -0.278 1.00 . A A . 31 CYS CB 1 1 17 8547 1 1 31 CYS H H -0.883 -0.588 1.312 1.00 . A A . 31 CYS H 1 1 17 8548 1 1 31 CYS HA H -0.902 0.563 -1.152 1.00 . A A . 31 CYS HA 1 1 17 8549 1 1 31 CYS HB2 H 1.631 0.174 -1.141 1.00 . A A . 31 CYS HB2 1 1 17 8550 1 1 31 CYS HB3 H 0.927 1.085 0.186 1.00 . A A . 31 CYS HB3 1 1 17 8551 1 1 31 CYS N N -1.198 -0.787 0.408 1.00 . A A . 31 CYS N 1 1 17 8552 1 1 31 CYS O O -0.712 -2.481 -1.703 1.00 . A A . 31 CYS O 1 1 17 8553 1 1 31 CYS SG S 1.768 -1.027 0.913 1.00 . A A . 31 CYS SG 1 1 17 8554 1 1 32 ASN C C 1.652 -2.510 -4.076 1.00 . A A . 32 ASN C 1 1 17 8555 1 1 32 ASN CA C 0.375 -1.687 -4.141 1.00 . A A . 32 ASN CA 1 1 17 8556 1 1 32 ASN CB C 0.412 -0.786 -5.358 1.00 . A A . 32 ASN CB 1 1 17 8557 1 1 32 ASN CG C -0.075 -1.470 -6.621 1.00 . A A . 32 ASN CG 1 1 17 8558 1 1 32 ASN H H 0.465 0.077 -2.990 1.00 . A A . 32 ASN H 1 1 17 8559 1 1 32 ASN HA H -0.464 -2.348 -4.225 1.00 . A A . 32 ASN HA 1 1 17 8560 1 1 32 ASN HB2 H -0.207 0.071 -5.172 1.00 . A A . 32 ASN HB2 1 1 17 8561 1 1 32 ASN HB3 H 1.421 -0.463 -5.505 1.00 . A A . 32 ASN HB3 1 1 17 8562 1 1 32 ASN HD21 H 1.772 -1.479 -7.357 1.00 . A A . 32 ASN HD21 1 1 17 8563 1 1 32 ASN HD22 H 0.557 -2.177 -8.368 1.00 . A A . 32 ASN HD22 1 1 17 8564 1 1 32 ASN N N 0.209 -0.869 -2.955 1.00 . A A . 32 ASN N 1 1 17 8565 1 1 32 ASN ND2 N 0.844 -1.735 -7.542 1.00 . A A . 32 ASN ND2 1 1 17 8566 1 1 32 ASN O O 2.422 -2.419 -3.119 1.00 . A A . 32 ASN O 1 1 17 8567 1 1 32 ASN OD1 O -1.263 -1.757 -6.767 1.00 . A A . 32 ASN OD1 1 1 17 8568 1 1 33 ARG C C 4.025 -3.561 -6.230 1.00 . A A . 33 ARG C 1 1 17 8569 1 1 33 ARG CA C 3.057 -4.142 -5.208 1.00 . A A . 33 ARG CA 1 1 17 8570 1 1 33 ARG CB C 2.675 -5.572 -5.595 1.00 . A A . 33 ARG CB 1 1 17 8571 1 1 33 ARG CD C 4.931 -6.665 -5.774 1.00 . A A . 33 ARG CD 1 1 17 8572 1 1 33 ARG CG C 3.609 -6.626 -5.024 1.00 . A A . 33 ARG CG 1 1 17 8573 1 1 33 ARG CZ C 5.117 -9.008 -6.514 1.00 . A A . 33 ARG CZ 1 1 17 8574 1 1 33 ARG H H 1.215 -3.313 -5.840 1.00 . A A . 33 ARG H 1 1 17 8575 1 1 33 ARG HA H 3.538 -4.150 -4.241 1.00 . A A . 33 ARG HA 1 1 17 8576 1 1 33 ARG HB2 H 1.676 -5.774 -5.237 1.00 . A A . 33 ARG HB2 1 1 17 8577 1 1 33 ARG HB3 H 2.686 -5.656 -6.671 1.00 . A A . 33 ARG HB3 1 1 17 8578 1 1 33 ARG HD2 H 4.756 -6.374 -6.800 1.00 . A A . 33 ARG HD2 1 1 17 8579 1 1 33 ARG HD3 H 5.612 -5.965 -5.313 1.00 . A A . 33 ARG HD3 1 1 17 8580 1 1 33 ARG HE H 6.286 -8.143 -5.147 1.00 . A A . 33 ARG HE 1 1 17 8581 1 1 33 ARG HG2 H 3.803 -6.398 -3.987 1.00 . A A . 33 ARG HG2 1 1 17 8582 1 1 33 ARG HG3 H 3.133 -7.593 -5.100 1.00 . A A . 33 ARG HG3 1 1 17 8583 1 1 33 ARG HH11 H 3.640 -7.959 -7.416 1.00 . A A . 33 ARG HH11 1 1 17 8584 1 1 33 ARG HH12 H 3.792 -9.609 -7.918 1.00 . A A . 33 ARG HH12 1 1 17 8585 1 1 33 ARG HH21 H 6.487 -10.314 -5.807 1.00 . A A . 33 ARG HH21 1 1 17 8586 1 1 33 ARG HH22 H 5.408 -10.947 -7.004 1.00 . A A . 33 ARG HH22 1 1 17 8587 1 1 33 ARG N N 1.869 -3.302 -5.113 1.00 . A A . 33 ARG N 1 1 17 8588 1 1 33 ARG NE N 5.532 -7.996 -5.757 1.00 . A A . 33 ARG NE 1 1 17 8589 1 1 33 ARG NH1 N 4.099 -8.846 -7.351 1.00 . A A . 33 ARG NH1 1 1 17 8590 1 1 33 ARG NH2 N 5.720 -10.186 -6.436 1.00 . A A . 33 ARG NH2 1 1 17 8591 1 1 33 ARG O O 3.931 -3.843 -7.425 1.00 . A A . 33 ARG O 1 1 17 8592 1 1 34 CYS C C 7.222 -2.897 -6.675 1.00 . A A . 34 CYS C 1 1 17 8593 1 1 34 CYS CA C 5.926 -2.096 -6.613 1.00 . A A . 34 CYS CA 1 1 17 8594 1 1 34 CYS CB C 6.199 -0.688 -6.115 1.00 . A A . 34 CYS CB 1 1 17 8595 1 1 34 CYS H H 4.962 -2.545 -4.790 1.00 . A A . 34 CYS H 1 1 17 8596 1 1 34 CYS HA H 5.507 -2.029 -7.594 1.00 . A A . 34 CYS HA 1 1 17 8597 1 1 34 CYS HB2 H 5.446 -0.434 -5.391 1.00 . A A . 34 CYS HB2 1 1 17 8598 1 1 34 CYS HB3 H 7.165 -0.664 -5.649 1.00 . A A . 34 CYS HB3 1 1 17 8599 1 1 34 CYS N N 4.947 -2.736 -5.750 1.00 . A A . 34 CYS N 1 1 17 8600 1 1 34 CYS O O 7.749 -3.253 -5.600 1.00 . A A . 34 CYS O 1 1 17 8601 1 1 34 CYS OXT O 7.699 -3.164 -7.799 1.00 . A A . 34 CYS OXT 1 1 17 8602 1 1 34 CYS SG S 6.164 0.591 -7.413 1.00 . A A . 34 CYS SG 1 1 18 8603 1 1 1 VAL C C -5.433 1.360 -6.458 1.00 . A A . 1 VAL C 1 1 18 8604 1 1 1 VAL CA C -6.444 0.618 -7.324 1.00 . A A . 1 VAL CA 1 1 18 8605 1 1 1 VAL CB C -6.965 -0.605 -6.546 1.00 . A A . 1 VAL CB 1 1 18 8606 1 1 1 VAL CG1 C -8.261 -1.115 -7.159 1.00 . A A . 1 VAL CG1 1 1 18 8607 1 1 1 VAL CG2 C -5.914 -1.703 -6.512 1.00 . A A . 1 VAL CG2 1 1 18 8608 1 1 1 VAL H1 H -4.885 -0.139 -8.430 1.00 . A A . 1 VAL H1 1 1 18 8609 1 1 1 VAL H2 H -5.817 1.057 -9.233 1.00 . A A . 1 VAL H2 1 1 18 8610 1 1 1 VAL H3 H -6.441 -0.530 -9.031 1.00 . A A . 1 VAL H3 1 1 18 8611 1 1 1 VAL HA H -7.279 1.275 -7.526 1.00 . A A . 1 VAL HA 1 1 18 8612 1 1 1 VAL HB H -7.170 -0.299 -5.530 1.00 . A A . 1 VAL HB 1 1 18 8613 1 1 1 VAL HG11 H -8.647 -1.925 -6.558 1.00 . A A . 1 VAL HG11 1 1 18 8614 1 1 1 VAL HG12 H -8.070 -1.470 -8.161 1.00 . A A . 1 VAL HG12 1 1 18 8615 1 1 1 VAL HG13 H -8.984 -0.314 -7.191 1.00 . A A . 1 VAL HG13 1 1 18 8616 1 1 1 VAL HG21 H -5.985 -2.240 -5.578 1.00 . A A . 1 VAL HG21 1 1 18 8617 1 1 1 VAL HG22 H -4.931 -1.264 -6.600 1.00 . A A . 1 VAL HG22 1 1 18 8618 1 1 1 VAL HG23 H -6.078 -2.386 -7.332 1.00 . A A . 1 VAL HG23 1 1 18 8619 1 1 1 VAL N N -5.843 0.215 -8.622 1.00 . A A . 1 VAL N 1 1 18 8620 1 1 1 VAL O O -4.259 0.993 -6.404 1.00 . A A . 1 VAL O 1 1 18 8621 1 1 2 SER C C -5.856 4.114 -4.013 1.00 . A A . 2 SER C 1 1 18 8622 1 1 2 SER CA C -5.032 3.199 -4.914 1.00 . A A . 2 SER CA 1 1 18 8623 1 1 2 SER CB C -4.060 4.030 -5.754 1.00 . A A . 2 SER CB 1 1 18 8624 1 1 2 SER H H -6.842 2.648 -5.864 1.00 . A A . 2 SER H 1 1 18 8625 1 1 2 SER HA H -4.467 2.518 -4.295 1.00 . A A . 2 SER HA 1 1 18 8626 1 1 2 SER HB2 H -3.482 4.670 -5.103 1.00 . A A . 2 SER HB2 1 1 18 8627 1 1 2 SER HB3 H -3.396 3.370 -6.291 1.00 . A A . 2 SER HB3 1 1 18 8628 1 1 2 SER HG H -5.203 5.550 -6.224 1.00 . A A . 2 SER HG 1 1 18 8629 1 1 2 SER N N -5.896 2.406 -5.780 1.00 . A A . 2 SER N 1 1 18 8630 1 1 2 SER O O -6.795 4.767 -4.469 1.00 . A A . 2 SER O 1 1 18 8631 1 1 2 SER OG O -4.755 4.839 -6.687 1.00 . A A . 2 SER OG 1 1 18 8632 1 1 3 CYS C C -5.416 6.260 -1.468 1.00 . A A . 3 CYS C 1 1 18 8633 1 1 3 CYS CA C -6.204 4.991 -1.770 1.00 . A A . 3 CYS CA 1 1 18 8634 1 1 3 CYS CB C -6.457 4.213 -0.477 1.00 . A A . 3 CYS CB 1 1 18 8635 1 1 3 CYS H H -4.740 3.612 -2.432 1.00 . A A . 3 CYS H 1 1 18 8636 1 1 3 CYS HA H -7.154 5.267 -2.205 1.00 . A A . 3 CYS HA 1 1 18 8637 1 1 3 CYS HB2 H -5.538 4.158 0.086 1.00 . A A . 3 CYS HB2 1 1 18 8638 1 1 3 CYS HB3 H -7.200 4.735 0.108 1.00 . A A . 3 CYS HB3 1 1 18 8639 1 1 3 CYS N N -5.497 4.155 -2.735 1.00 . A A . 3 CYS N 1 1 18 8640 1 1 3 CYS O O -4.271 6.409 -1.897 1.00 . A A . 3 CYS O 1 1 18 8641 1 1 3 CYS SG S -7.050 2.510 -0.738 1.00 . A A . 3 CYS SG 1 1 18 8642 1 1 4 THR C C -6.224 9.187 0.667 1.00 . A A . 4 THR C 1 1 18 8643 1 1 4 THR CA C -5.394 8.431 -0.366 1.00 . A A . 4 THR CA 1 1 18 8644 1 1 4 THR CB C -5.189 9.298 -1.609 1.00 . A A . 4 THR CB 1 1 18 8645 1 1 4 THR CG2 C -3.846 9.087 -2.272 1.00 . A A . 4 THR CG2 1 1 18 8646 1 1 4 THR H H -6.947 6.992 -0.415 1.00 . A A . 4 THR H 1 1 18 8647 1 1 4 THR HA H -4.430 8.200 0.064 1.00 . A A . 4 THR HA 1 1 18 8648 1 1 4 THR HB H -5.256 10.339 -1.324 1.00 . A A . 4 THR HB 1 1 18 8649 1 1 4 THR HG1 H -6.060 8.163 -2.946 1.00 . A A . 4 THR HG1 1 1 18 8650 1 1 4 THR HG21 H -3.209 8.507 -1.621 1.00 . A A . 4 THR HG21 1 1 18 8651 1 1 4 THR HG22 H -3.385 10.044 -2.467 1.00 . A A . 4 THR HG22 1 1 18 8652 1 1 4 THR HG23 H -3.984 8.557 -3.204 1.00 . A A . 4 THR HG23 1 1 18 8653 1 1 4 THR N N -6.035 7.172 -0.727 1.00 . A A . 4 THR N 1 1 18 8654 1 1 4 THR O O -6.267 10.417 0.663 1.00 . A A . 4 THR O 1 1 18 8655 1 1 4 THR OG1 O -6.193 9.037 -2.574 1.00 . A A . 4 THR OG1 1 1 18 8656 1 1 5 GLY C C -7.788 8.223 3.834 1.00 . A A . 5 GLY C 1 1 18 8657 1 1 5 GLY CA C -7.702 9.062 2.575 1.00 . A A . 5 GLY CA 1 1 18 8658 1 1 5 GLY H H -6.810 7.467 1.505 1.00 . A A . 5 GLY H 1 1 18 8659 1 1 5 GLY HA2 H -7.281 10.025 2.826 1.00 . A A . 5 GLY HA2 1 1 18 8660 1 1 5 GLY HA3 H -8.698 9.208 2.184 1.00 . A A . 5 GLY HA3 1 1 18 8661 1 1 5 GLY N N -6.883 8.444 1.550 1.00 . A A . 5 GLY N 1 1 18 8662 1 1 5 GLY O O -8.764 8.308 4.579 1.00 . A A . 5 GLY O 1 1 18 8663 1 1 6 SER C C -6.237 7.324 6.471 1.00 . A A . 6 SER C 1 1 18 8664 1 1 6 SER CA C -6.730 6.551 5.251 1.00 . A A . 6 SER CA 1 1 18 8665 1 1 6 SER CB C -5.826 5.342 5.001 1.00 . A A . 6 SER CB 1 1 18 8666 1 1 6 SER H H -6.014 7.386 3.442 1.00 . A A . 6 SER H 1 1 18 8667 1 1 6 SER HA H -7.735 6.206 5.440 1.00 . A A . 6 SER HA 1 1 18 8668 1 1 6 SER HB2 H -4.826 5.566 5.339 1.00 . A A . 6 SER HB2 1 1 18 8669 1 1 6 SER HB3 H -6.208 4.491 5.546 1.00 . A A . 6 SER HB3 1 1 18 8670 1 1 6 SER HG H -5.087 5.529 3.197 1.00 . A A . 6 SER HG 1 1 18 8671 1 1 6 SER N N -6.764 7.409 4.073 1.00 . A A . 6 SER N 1 1 18 8672 1 1 6 SER O O -6.108 8.547 6.432 1.00 . A A . 6 SER O 1 1 18 8673 1 1 6 SER OG O -5.779 5.018 3.622 1.00 . A A . 6 SER OG 1 1 18 8674 1 1 7 LYS C C -3.978 7.456 8.723 1.00 . A A . 7 LYS C 1 1 18 8675 1 1 7 LYS CA C -5.484 7.220 8.782 1.00 . A A . 7 LYS CA 1 1 18 8676 1 1 7 LYS CB C -5.829 6.343 9.987 1.00 . A A . 7 LYS CB 1 1 18 8677 1 1 7 LYS CD C -5.710 4.064 11.037 1.00 . A A . 7 LYS CD 1 1 18 8678 1 1 7 LYS CE C -5.634 2.605 10.615 1.00 . A A . 7 LYS CE 1 1 18 8679 1 1 7 LYS CG C -5.150 4.983 9.964 1.00 . A A . 7 LYS CG 1 1 18 8680 1 1 7 LYS H H -6.085 5.630 7.522 1.00 . A A . 7 LYS H 1 1 18 8681 1 1 7 LYS HA H -5.981 8.174 8.889 1.00 . A A . 7 LYS HA 1 1 18 8682 1 1 7 LYS HB2 H -5.529 6.856 10.889 1.00 . A A . 7 LYS HB2 1 1 18 8683 1 1 7 LYS HB3 H -6.897 6.188 10.011 1.00 . A A . 7 LYS HB3 1 1 18 8684 1 1 7 LYS HD2 H -5.141 4.195 11.945 1.00 . A A . 7 LYS HD2 1 1 18 8685 1 1 7 LYS HD3 H -6.743 4.323 11.217 1.00 . A A . 7 LYS HD3 1 1 18 8686 1 1 7 LYS HE2 H -6.526 2.099 10.951 1.00 . A A . 7 LYS HE2 1 1 18 8687 1 1 7 LYS HE3 H -5.577 2.557 9.538 1.00 . A A . 7 LYS HE3 1 1 18 8688 1 1 7 LYS HG2 H -5.307 4.530 8.997 1.00 . A A . 7 LYS HG2 1 1 18 8689 1 1 7 LYS HG3 H -4.092 5.118 10.134 1.00 . A A . 7 LYS HG3 1 1 18 8690 1 1 7 LYS HZ1 H -4.337 2.176 12.196 1.00 . A A . 7 LYS HZ1 1 1 18 8691 1 1 7 LYS HZ2 H -3.584 2.206 10.683 1.00 . A A . 7 LYS HZ2 1 1 18 8692 1 1 7 LYS HZ3 H -4.553 0.889 11.118 1.00 . A A . 7 LYS HZ3 1 1 18 8693 1 1 7 LYS N N -5.962 6.601 7.552 1.00 . A A . 7 LYS N 1 1 18 8694 1 1 7 LYS NZ N -4.444 1.921 11.194 1.00 . A A . 7 LYS NZ 1 1 18 8695 1 1 7 LYS O O -3.494 8.536 9.058 1.00 . A A . 7 LYS O 1 1 18 8696 1 1 8 ASP C C -1.194 5.219 7.684 1.00 . A A . 8 ASP C 1 1 18 8697 1 1 8 ASP CA C -1.788 6.529 8.192 1.00 . A A . 8 ASP CA 1 1 18 8698 1 1 8 ASP CB C -1.182 6.886 9.550 1.00 . A A . 8 ASP CB 1 1 18 8699 1 1 8 ASP CG C -0.041 7.876 9.432 1.00 . A A . 8 ASP CG 1 1 18 8700 1 1 8 ASP H H -3.684 5.598 8.042 1.00 . A A . 8 ASP H 1 1 18 8701 1 1 8 ASP HA H -1.556 7.313 7.487 1.00 . A A . 8 ASP HA 1 1 18 8702 1 1 8 ASP HB2 H -1.948 7.320 10.174 1.00 . A A . 8 ASP HB2 1 1 18 8703 1 1 8 ASP HB3 H -0.808 5.987 10.016 1.00 . A A . 8 ASP HB3 1 1 18 8704 1 1 8 ASP N N -3.240 6.435 8.295 1.00 . A A . 8 ASP N 1 1 18 8705 1 1 8 ASP O O -0.275 4.665 8.289 1.00 . A A . 8 ASP O 1 1 18 8706 1 1 8 ASP OD1 O 1.077 7.454 9.068 1.00 . A A . 8 ASP OD1 1 1 18 8707 1 1 8 ASP OD2 O -0.265 9.076 9.703 1.00 . A A . 8 ASP OD2 1 1 18 8708 1 1 9 CYS C C -0.487 3.735 4.699 1.00 . A A . 9 CYS C 1 1 18 8709 1 1 9 CYS CA C -1.251 3.482 5.982 1.00 . A A . 9 CYS CA 1 1 18 8710 1 1 9 CYS CB C -2.417 2.556 5.691 1.00 . A A . 9 CYS CB 1 1 18 8711 1 1 9 CYS H H -2.457 5.215 6.139 1.00 . A A . 9 CYS H 1 1 18 8712 1 1 9 CYS HA H -0.605 3.009 6.682 1.00 . A A . 9 CYS HA 1 1 18 8713 1 1 9 CYS HB2 H -3.189 2.733 6.415 1.00 . A A . 9 CYS HB2 1 1 18 8714 1 1 9 CYS HB3 H -2.792 2.778 4.712 1.00 . A A . 9 CYS HB3 1 1 18 8715 1 1 9 CYS N N -1.726 4.728 6.572 1.00 . A A . 9 CYS N 1 1 18 8716 1 1 9 CYS O O 0.715 3.485 4.617 1.00 . A A . 9 CYS O 1 1 18 8717 1 1 9 CYS SG S -1.996 0.783 5.735 1.00 . A A . 9 CYS SG 1 1 18 8718 1 1 10 TYR C C 0.722 5.249 2.562 1.00 . A A . 10 TYR C 1 1 18 8719 1 1 10 TYR CA C -0.608 4.523 2.402 1.00 . A A . 10 TYR CA 1 1 18 8720 1 1 10 TYR CB C -1.568 5.369 1.562 1.00 . A A . 10 TYR CB 1 1 18 8721 1 1 10 TYR CD1 C -2.192 3.495 -0.010 1.00 . A A . 10 TYR CD1 1 1 18 8722 1 1 10 TYR CD2 C -1.652 5.619 -0.948 1.00 . A A . 10 TYR CD2 1 1 18 8723 1 1 10 TYR CE1 C -2.413 2.988 -1.275 1.00 . A A . 10 TYR CE1 1 1 18 8724 1 1 10 TYR CE2 C -1.872 5.119 -2.217 1.00 . A A . 10 TYR CE2 1 1 18 8725 1 1 10 TYR CG C -1.809 4.817 0.176 1.00 . A A . 10 TYR CG 1 1 18 8726 1 1 10 TYR CZ C -2.251 3.803 -2.376 1.00 . A A . 10 TYR CZ 1 1 18 8727 1 1 10 TYR H H -2.153 4.405 3.842 1.00 . A A . 10 TYR H 1 1 18 8728 1 1 10 TYR HA H -0.435 3.584 1.898 1.00 . A A . 10 TYR HA 1 1 18 8729 1 1 10 TYR HB2 H -2.522 5.423 2.066 1.00 . A A . 10 TYR HB2 1 1 18 8730 1 1 10 TYR HB3 H -1.165 6.366 1.458 1.00 . A A . 10 TYR HB3 1 1 18 8731 1 1 10 TYR HD1 H -2.319 2.859 0.854 1.00 . A A . 10 TYR HD1 1 1 18 8732 1 1 10 TYR HD2 H -1.355 6.649 -0.820 1.00 . A A . 10 TYR HD2 1 1 18 8733 1 1 10 TYR HE1 H -2.711 1.956 -1.399 1.00 . A A . 10 TYR HE1 1 1 18 8734 1 1 10 TYR HE2 H -1.745 5.758 -3.078 1.00 . A A . 10 TYR HE2 1 1 18 8735 1 1 10 TYR HH H -1.822 3.665 -4.244 1.00 . A A . 10 TYR HH 1 1 18 8736 1 1 10 TYR N N -1.200 4.231 3.700 1.00 . A A . 10 TYR N 1 1 18 8737 1 1 10 TYR O O 1.609 5.129 1.721 1.00 . A A . 10 TYR O 1 1 18 8738 1 1 10 TYR OH O -2.471 3.300 -3.638 1.00 . A A . 10 TYR OH 1 1 18 8739 1 1 11 ALA C C 3.224 5.824 4.316 1.00 . A A . 11 ALA C 1 1 18 8740 1 1 11 ALA CA C 2.078 6.747 3.909 1.00 . A A . 11 ALA CA 1 1 18 8741 1 1 11 ALA CB C 1.847 7.834 4.949 1.00 . A A . 11 ALA CB 1 1 18 8742 1 1 11 ALA H H 0.102 6.059 4.285 1.00 . A A . 11 ALA H 1 1 18 8743 1 1 11 ALA HA H 2.360 7.223 2.982 1.00 . A A . 11 ALA HA 1 1 18 8744 1 1 11 ALA HB1 H 2.733 7.948 5.555 1.00 . A A . 11 ALA HB1 1 1 18 8745 1 1 11 ALA HB2 H 1.013 7.559 5.578 1.00 . A A . 11 ALA HB2 1 1 18 8746 1 1 11 ALA HB3 H 1.629 8.768 4.450 1.00 . A A . 11 ALA HB3 1 1 18 8747 1 1 11 ALA N N 0.850 6.005 3.645 1.00 . A A . 11 ALA N 1 1 18 8748 1 1 11 ALA O O 4.126 5.565 3.519 1.00 . A A . 11 ALA O 1 1 18 8749 1 1 12 PRO C C 4.482 3.256 5.043 1.00 . A A . 12 PRO C 1 1 18 8750 1 1 12 PRO CA C 4.254 4.390 6.033 1.00 . A A . 12 PRO CA 1 1 18 8751 1 1 12 PRO CB C 3.710 3.851 7.365 1.00 . A A . 12 PRO CB 1 1 18 8752 1 1 12 PRO CD C 2.177 5.514 6.580 1.00 . A A . 12 PRO CD 1 1 18 8753 1 1 12 PRO CG C 2.277 4.271 7.413 1.00 . A A . 12 PRO CG 1 1 18 8754 1 1 12 PRO HA H 5.185 4.913 6.200 1.00 . A A . 12 PRO HA 1 1 18 8755 1 1 12 PRO HB2 H 3.804 2.775 7.385 1.00 . A A . 12 PRO HB2 1 1 18 8756 1 1 12 PRO HB3 H 4.271 4.279 8.182 1.00 . A A . 12 PRO HB3 1 1 18 8757 1 1 12 PRO HD2 H 1.197 5.595 6.133 1.00 . A A . 12 PRO HD2 1 1 18 8758 1 1 12 PRO HD3 H 2.400 6.389 7.173 1.00 . A A . 12 PRO HD3 1 1 18 8759 1 1 12 PRO HG2 H 1.653 3.492 7.000 1.00 . A A . 12 PRO HG2 1 1 18 8760 1 1 12 PRO HG3 H 1.990 4.479 8.434 1.00 . A A . 12 PRO HG3 1 1 18 8761 1 1 12 PRO N N 3.207 5.296 5.558 1.00 . A A . 12 PRO N 1 1 18 8762 1 1 12 PRO O O 5.567 2.681 4.969 1.00 . A A . 12 PRO O 1 1 18 8763 1 1 13 CYS C C 4.209 2.400 2.034 1.00 . A A . 13 CYS C 1 1 18 8764 1 1 13 CYS CA C 3.491 1.918 3.271 1.00 . A A . 13 CYS CA 1 1 18 8765 1 1 13 CYS CB C 2.089 1.503 2.886 1.00 . A A . 13 CYS CB 1 1 18 8766 1 1 13 CYS H H 2.609 3.467 4.387 1.00 . A A . 13 CYS H 1 1 18 8767 1 1 13 CYS HA H 4.007 1.075 3.675 1.00 . A A . 13 CYS HA 1 1 18 8768 1 1 13 CYS HB2 H 1.450 1.632 3.732 1.00 . A A . 13 CYS HB2 1 1 18 8769 1 1 13 CYS HB3 H 1.754 2.143 2.092 1.00 . A A . 13 CYS HB3 1 1 18 8770 1 1 13 CYS N N 3.440 2.960 4.277 1.00 . A A . 13 CYS N 1 1 18 8771 1 1 13 CYS O O 5.200 1.816 1.609 1.00 . A A . 13 CYS O 1 1 18 8772 1 1 13 CYS SG S 1.940 -0.216 2.309 1.00 . A A . 13 CYS SG 1 1 18 8773 1 1 14 ARG C C 5.780 4.160 0.390 1.00 . A A . 14 ARG C 1 1 18 8774 1 1 14 ARG CA C 4.273 4.031 0.242 1.00 . A A . 14 ARG CA 1 1 18 8775 1 1 14 ARG CB C 3.647 5.387 -0.087 1.00 . A A . 14 ARG CB 1 1 18 8776 1 1 14 ARG CD C 4.047 7.569 -1.267 1.00 . A A . 14 ARG CD 1 1 18 8777 1 1 14 ARG CG C 4.251 6.064 -1.308 1.00 . A A . 14 ARG CG 1 1 18 8778 1 1 14 ARG CZ C 3.233 9.317 -2.802 1.00 . A A . 14 ARG CZ 1 1 18 8779 1 1 14 ARG H H 2.889 3.886 1.843 1.00 . A A . 14 ARG H 1 1 18 8780 1 1 14 ARG HA H 4.067 3.341 -0.558 1.00 . A A . 14 ARG HA 1 1 18 8781 1 1 14 ARG HB2 H 2.594 5.243 -0.269 1.00 . A A . 14 ARG HB2 1 1 18 8782 1 1 14 ARG HB3 H 3.771 6.043 0.762 1.00 . A A . 14 ARG HB3 1 1 18 8783 1 1 14 ARG HD2 H 3.209 7.789 -0.622 1.00 . A A . 14 ARG HD2 1 1 18 8784 1 1 14 ARG HD3 H 4.939 8.029 -0.866 1.00 . A A . 14 ARG HD3 1 1 18 8785 1 1 14 ARG HE H 4.025 7.575 -3.369 1.00 . A A . 14 ARG HE 1 1 18 8786 1 1 14 ARG HG2 H 5.310 5.855 -1.338 1.00 . A A . 14 ARG HG2 1 1 18 8787 1 1 14 ARG HG3 H 3.778 5.669 -2.196 1.00 . A A . 14 ARG HG3 1 1 18 8788 1 1 14 ARG HH11 H 3.044 9.770 -0.840 1.00 . A A . 14 ARG HH11 1 1 18 8789 1 1 14 ARG HH12 H 2.480 10.983 -1.941 1.00 . A A . 14 ARG HH12 1 1 18 8790 1 1 14 ARG HH21 H 3.284 9.168 -4.817 1.00 . A A . 14 ARG HH21 1 1 18 8791 1 1 14 ARG HH22 H 2.615 10.641 -4.199 1.00 . A A . 14 ARG HH22 1 1 18 8792 1 1 14 ARG N N 3.689 3.471 1.452 1.00 . A A . 14 ARG N 1 1 18 8793 1 1 14 ARG NE N 3.782 8.122 -2.593 1.00 . A A . 14 ARG NE 1 1 18 8794 1 1 14 ARG NH1 N 2.891 10.086 -1.776 1.00 . A A . 14 ARG NH1 1 1 18 8795 1 1 14 ARG NH2 N 3.027 9.744 -4.041 1.00 . A A . 14 ARG NH2 1 1 18 8796 1 1 14 ARG O O 6.528 3.966 -0.567 1.00 . A A . 14 ARG O 1 1 18 8797 1 1 15 LYS C C 8.306 3.219 1.656 1.00 . A A . 15 LYS C 1 1 18 8798 1 1 15 LYS CA C 7.638 4.569 1.880 1.00 . A A . 15 LYS CA 1 1 18 8799 1 1 15 LYS CB C 7.869 5.046 3.316 1.00 . A A . 15 LYS CB 1 1 18 8800 1 1 15 LYS CD C 10.152 5.945 2.777 1.00 . A A . 15 LYS CD 1 1 18 8801 1 1 15 LYS CE C 10.920 7.224 2.486 1.00 . A A . 15 LYS CE 1 1 18 8802 1 1 15 LYS CG C 8.806 6.238 3.418 1.00 . A A . 15 LYS CG 1 1 18 8803 1 1 15 LYS H H 5.571 4.575 2.333 1.00 . A A . 15 LYS H 1 1 18 8804 1 1 15 LYS HA H 8.057 5.290 1.193 1.00 . A A . 15 LYS HA 1 1 18 8805 1 1 15 LYS HB2 H 6.919 5.324 3.749 1.00 . A A . 15 LYS HB2 1 1 18 8806 1 1 15 LYS HB3 H 8.292 4.234 3.889 1.00 . A A . 15 LYS HB3 1 1 18 8807 1 1 15 LYS HD2 H 10.735 5.332 3.450 1.00 . A A . 15 LYS HD2 1 1 18 8808 1 1 15 LYS HD3 H 9.992 5.413 1.851 1.00 . A A . 15 LYS HD3 1 1 18 8809 1 1 15 LYS HE2 H 11.268 7.641 3.420 1.00 . A A . 15 LYS HE2 1 1 18 8810 1 1 15 LYS HE3 H 11.770 6.985 1.863 1.00 . A A . 15 LYS HE3 1 1 18 8811 1 1 15 LYS HG2 H 8.356 7.081 2.917 1.00 . A A . 15 LYS HG2 1 1 18 8812 1 1 15 LYS HG3 H 8.957 6.475 4.461 1.00 . A A . 15 LYS HG3 1 1 18 8813 1 1 15 LYS HZ1 H 10.677 8.921 1.293 1.00 . A A . 15 LYS HZ1 1 1 18 8814 1 1 15 LYS HZ2 H 9.485 8.741 2.478 1.00 . A A . 15 LYS HZ2 1 1 18 8815 1 1 15 LYS HZ3 H 9.458 7.764 1.097 1.00 . A A . 15 LYS HZ3 1 1 18 8816 1 1 15 LYS N N 6.217 4.454 1.604 1.00 . A A . 15 LYS N 1 1 18 8817 1 1 15 LYS NZ N 10.076 8.233 1.789 1.00 . A A . 15 LYS NZ 1 1 18 8818 1 1 15 LYS O O 9.363 3.129 1.031 1.00 . A A . 15 LYS O 1 1 18 8819 1 1 16 GLN C C 8.055 0.319 0.575 1.00 . A A . 16 GLN C 1 1 18 8820 1 1 16 GLN CA C 8.180 0.812 2.017 1.00 . A A . 16 GLN CA 1 1 18 8821 1 1 16 GLN CB C 7.436 -0.139 2.957 1.00 . A A . 16 GLN CB 1 1 18 8822 1 1 16 GLN CD C 8.686 -2.254 2.369 1.00 . A A . 16 GLN CD 1 1 18 8823 1 1 16 GLN CG C 8.295 -1.284 3.468 1.00 . A A . 16 GLN CG 1 1 18 8824 1 1 16 GLN H H 6.820 2.306 2.645 1.00 . A A . 16 GLN H 1 1 18 8825 1 1 16 GLN HA H 9.224 0.824 2.289 1.00 . A A . 16 GLN HA 1 1 18 8826 1 1 16 GLN HB2 H 7.079 0.422 3.808 1.00 . A A . 16 GLN HB2 1 1 18 8827 1 1 16 GLN HB3 H 6.591 -0.557 2.432 1.00 . A A . 16 GLN HB3 1 1 18 8828 1 1 16 GLN HE21 H 10.500 -1.446 2.268 1.00 . A A . 16 GLN HE21 1 1 18 8829 1 1 16 GLN HE22 H 10.199 -2.754 1.180 1.00 . A A . 16 GLN HE22 1 1 18 8830 1 1 16 GLN HG2 H 9.195 -0.877 3.904 1.00 . A A . 16 GLN HG2 1 1 18 8831 1 1 16 GLN HG3 H 7.742 -1.822 4.223 1.00 . A A . 16 GLN HG3 1 1 18 8832 1 1 16 GLN N N 7.667 2.167 2.165 1.00 . A A . 16 GLN N 1 1 18 8833 1 1 16 GLN NE2 N 9.920 -2.140 1.891 1.00 . A A . 16 GLN NE2 1 1 18 8834 1 1 16 GLN O O 9.044 -0.072 -0.044 1.00 . A A . 16 GLN O 1 1 18 8835 1 1 16 GLN OE1 O 7.889 -3.096 1.956 1.00 . A A . 16 GLN OE1 1 1 18 8836 1 1 17 THR C C 7.120 0.823 -2.343 1.00 . A A . 17 THR C 1 1 18 8837 1 1 17 THR CA C 6.568 -0.138 -1.304 1.00 . A A . 17 THR CA 1 1 18 8838 1 1 17 THR CB C 5.064 -0.323 -1.516 1.00 . A A . 17 THR CB 1 1 18 8839 1 1 17 THR CG2 C 4.726 -1.033 -2.809 1.00 . A A . 17 THR CG2 1 1 18 8840 1 1 17 THR H H 6.077 0.642 0.595 1.00 . A A . 17 THR H 1 1 18 8841 1 1 17 THR HA H 7.053 -1.088 -1.425 1.00 . A A . 17 THR HA 1 1 18 8842 1 1 17 THR HB H 4.592 0.649 -1.539 1.00 . A A . 17 THR HB 1 1 18 8843 1 1 17 THR HG1 H 4.495 -0.540 0.345 1.00 . A A . 17 THR HG1 1 1 18 8844 1 1 17 THR HG21 H 5.511 -1.734 -3.051 1.00 . A A . 17 THR HG21 1 1 18 8845 1 1 17 THR HG22 H 4.632 -0.308 -3.603 1.00 . A A . 17 THR HG22 1 1 18 8846 1 1 17 THR HG23 H 3.793 -1.565 -2.694 1.00 . A A . 17 THR HG23 1 1 18 8847 1 1 17 THR N N 6.828 0.323 0.053 1.00 . A A . 17 THR N 1 1 18 8848 1 1 17 THR O O 7.993 0.470 -3.136 1.00 . A A . 17 THR O 1 1 18 8849 1 1 17 THR OG1 O 4.496 -1.070 -0.456 1.00 . A A . 17 THR OG1 1 1 18 8850 1 1 18 GLY C C 5.842 3.609 -4.052 1.00 . A A . 18 GLY C 1 1 18 8851 1 1 18 GLY CA C 7.004 3.031 -3.283 1.00 . A A . 18 GLY CA 1 1 18 8852 1 1 18 GLY H H 5.901 2.244 -1.704 1.00 . A A . 18 GLY H 1 1 18 8853 1 1 18 GLY HA2 H 7.505 3.819 -2.768 1.00 . A A . 18 GLY HA2 1 1 18 8854 1 1 18 GLY HA3 H 7.680 2.576 -3.969 1.00 . A A . 18 GLY HA3 1 1 18 8855 1 1 18 GLY N N 6.588 2.033 -2.341 1.00 . A A . 18 GLY N 1 1 18 8856 1 1 18 GLY O O 5.046 4.375 -3.511 1.00 . A A . 18 GLY O 1 1 18 8857 1 1 19 CYS C C 3.436 4.093 -5.513 1.00 . A A . 19 CYS C 1 1 18 8858 1 1 19 CYS CA C 4.726 3.687 -6.232 1.00 . A A . 19 CYS CA 1 1 18 8859 1 1 19 CYS CB C 4.429 2.616 -7.251 1.00 . A A . 19 CYS CB 1 1 18 8860 1 1 19 CYS H H 6.456 2.641 -5.658 1.00 . A A . 19 CYS H 1 1 18 8861 1 1 19 CYS HA H 5.113 4.524 -6.764 1.00 . A A . 19 CYS HA 1 1 18 8862 1 1 19 CYS HB2 H 3.613 2.949 -7.863 1.00 . A A . 19 CYS HB2 1 1 18 8863 1 1 19 CYS HB3 H 5.302 2.492 -7.863 1.00 . A A . 19 CYS HB3 1 1 18 8864 1 1 19 CYS N N 5.770 3.237 -5.319 1.00 . A A . 19 CYS N 1 1 18 8865 1 1 19 CYS O O 3.054 3.484 -4.513 1.00 . A A . 19 CYS O 1 1 18 8866 1 1 19 CYS SG S 3.988 0.993 -6.546 1.00 . A A . 19 CYS SG 1 1 18 8867 1 1 20 PRO C C 0.386 4.580 -5.411 1.00 . A A . 20 PRO C 1 1 18 8868 1 1 20 PRO CA C 1.501 5.625 -5.414 1.00 . A A . 20 PRO CA 1 1 18 8869 1 1 20 PRO CB C 1.113 6.816 -6.301 1.00 . A A . 20 PRO CB 1 1 18 8870 1 1 20 PRO CD C 3.130 5.916 -7.201 1.00 . A A . 20 PRO CD 1 1 18 8871 1 1 20 PRO CG C 1.851 6.605 -7.577 1.00 . A A . 20 PRO CG 1 1 18 8872 1 1 20 PRO HA H 1.663 5.970 -4.403 1.00 . A A . 20 PRO HA 1 1 18 8873 1 1 20 PRO HB2 H 0.043 6.815 -6.458 1.00 . A A . 20 PRO HB2 1 1 18 8874 1 1 20 PRO HB3 H 1.410 7.735 -5.820 1.00 . A A . 20 PRO HB3 1 1 18 8875 1 1 20 PRO HD2 H 3.461 5.269 -8.002 1.00 . A A . 20 PRO HD2 1 1 18 8876 1 1 20 PRO HD3 H 3.894 6.640 -6.958 1.00 . A A . 20 PRO HD3 1 1 18 8877 1 1 20 PRO HG2 H 1.268 5.983 -8.241 1.00 . A A . 20 PRO HG2 1 1 18 8878 1 1 20 PRO HG3 H 2.060 7.557 -8.041 1.00 . A A . 20 PRO HG3 1 1 18 8879 1 1 20 PRO N N 2.748 5.134 -6.014 1.00 . A A . 20 PRO N 1 1 18 8880 1 1 20 PRO O O -0.622 4.745 -4.723 1.00 . A A . 20 PRO O 1 1 18 8881 1 1 21 TYR C C -0.504 1.669 -4.967 1.00 . A A . 21 TYR C 1 1 18 8882 1 1 21 TYR CA C -0.428 2.464 -6.268 1.00 . A A . 21 TYR CA 1 1 18 8883 1 1 21 TYR CB C -0.089 1.534 -7.430 1.00 . A A . 21 TYR CB 1 1 18 8884 1 1 21 TYR CD1 C 0.489 3.401 -9.033 1.00 . A A . 21 TYR CD1 1 1 18 8885 1 1 21 TYR CD2 C 1.897 1.478 -8.993 1.00 . A A . 21 TYR CD2 1 1 18 8886 1 1 21 TYR CE1 C 1.281 3.964 -10.016 1.00 . A A . 21 TYR CE1 1 1 18 8887 1 1 21 TYR CE2 C 2.694 2.034 -9.976 1.00 . A A . 21 TYR CE2 1 1 18 8888 1 1 21 TYR CG C 0.783 2.150 -8.506 1.00 . A A . 21 TYR CG 1 1 18 8889 1 1 21 TYR CZ C 2.381 3.277 -10.483 1.00 . A A . 21 TYR CZ 1 1 18 8890 1 1 21 TYR H H 1.366 3.426 -6.717 1.00 . A A . 21 TYR H 1 1 18 8891 1 1 21 TYR HA H -1.387 2.922 -6.454 1.00 . A A . 21 TYR HA 1 1 18 8892 1 1 21 TYR HB2 H 0.422 0.665 -7.049 1.00 . A A . 21 TYR HB2 1 1 18 8893 1 1 21 TYR HB3 H -0.999 1.234 -7.890 1.00 . A A . 21 TYR HB3 1 1 18 8894 1 1 21 TYR HD1 H -0.373 3.937 -8.665 1.00 . A A . 21 TYR HD1 1 1 18 8895 1 1 21 TYR HD2 H 2.139 0.504 -8.593 1.00 . A A . 21 TYR HD2 1 1 18 8896 1 1 21 TYR HE1 H 1.036 4.939 -10.414 1.00 . A A . 21 TYR HE1 1 1 18 8897 1 1 21 TYR HE2 H 3.554 1.495 -10.342 1.00 . A A . 21 TYR HE2 1 1 18 8898 1 1 21 TYR HH H 3.414 3.160 -12.102 1.00 . A A . 21 TYR HH 1 1 18 8899 1 1 21 TYR N N 0.560 3.513 -6.182 1.00 . A A . 21 TYR N 1 1 18 8900 1 1 21 TYR O O 0.396 1.740 -4.129 1.00 . A A . 21 TYR O 1 1 18 8901 1 1 21 TYR OH O 3.171 3.835 -11.463 1.00 . A A . 21 TYR OH 1 1 18 8902 1 1 22 GLY C C -2.964 -0.815 -3.707 1.00 . A A . 22 GLY C 1 1 18 8903 1 1 22 GLY CA C -1.766 0.110 -3.609 1.00 . A A . 22 GLY CA 1 1 18 8904 1 1 22 GLY H H -2.267 0.896 -5.511 1.00 . A A . 22 GLY H 1 1 18 8905 1 1 22 GLY HA2 H -0.882 -0.479 -3.452 1.00 . A A . 22 GLY HA2 1 1 18 8906 1 1 22 GLY HA3 H -1.898 0.765 -2.765 1.00 . A A . 22 GLY HA3 1 1 18 8907 1 1 22 GLY N N -1.585 0.912 -4.808 1.00 . A A . 22 GLY N 1 1 18 8908 1 1 22 GLY O O -3.918 -0.523 -4.429 1.00 . A A . 22 GLY O 1 1 18 8909 1 1 23 LYS C C -4.997 -2.567 -1.825 1.00 . A A . 23 LYS C 1 1 18 8910 1 1 23 LYS CA C -4.042 -2.868 -2.978 1.00 . A A . 23 LYS CA 1 1 18 8911 1 1 23 LYS CB C -3.529 -4.307 -2.880 1.00 . A A . 23 LYS CB 1 1 18 8912 1 1 23 LYS CD C -5.367 -6.011 -3.050 1.00 . A A . 23 LYS CD 1 1 18 8913 1 1 23 LYS CE C -6.109 -6.972 -3.966 1.00 . A A . 23 LYS CE 1 1 18 8914 1 1 23 LYS CG C -4.261 -5.278 -3.792 1.00 . A A . 23 LYS CG 1 1 18 8915 1 1 23 LYS H H -2.161 -2.103 -2.398 1.00 . A A . 23 LYS H 1 1 18 8916 1 1 23 LYS HA H -4.571 -2.745 -3.910 1.00 . A A . 23 LYS HA 1 1 18 8917 1 1 23 LYS HB2 H -2.481 -4.322 -3.142 1.00 . A A . 23 LYS HB2 1 1 18 8918 1 1 23 LYS HB3 H -3.640 -4.649 -1.861 1.00 . A A . 23 LYS HB3 1 1 18 8919 1 1 23 LYS HD2 H -4.932 -6.571 -2.236 1.00 . A A . 23 LYS HD2 1 1 18 8920 1 1 23 LYS HD3 H -6.067 -5.287 -2.659 1.00 . A A . 23 LYS HD3 1 1 18 8921 1 1 23 LYS HE2 H -5.470 -7.219 -4.801 1.00 . A A . 23 LYS HE2 1 1 18 8922 1 1 23 LYS HE3 H -6.341 -7.870 -3.412 1.00 . A A . 23 LYS HE3 1 1 18 8923 1 1 23 LYS HG2 H -4.696 -4.727 -4.613 1.00 . A A . 23 LYS HG2 1 1 18 8924 1 1 23 LYS HG3 H -3.555 -6.000 -4.174 1.00 . A A . 23 LYS HG3 1 1 18 8925 1 1 23 LYS HZ1 H -7.588 -6.765 -5.426 1.00 . A A . 23 LYS HZ1 1 1 18 8926 1 1 23 LYS HZ2 H -7.283 -5.348 -4.555 1.00 . A A . 23 LYS HZ2 1 1 18 8927 1 1 23 LYS HZ3 H -8.162 -6.605 -3.842 1.00 . A A . 23 LYS HZ3 1 1 18 8928 1 1 23 LYS N N -2.932 -1.926 -2.969 1.00 . A A . 23 LYS N 1 1 18 8929 1 1 23 LYS NZ N -7.374 -6.381 -4.484 1.00 . A A . 23 LYS NZ 1 1 18 8930 1 1 23 LYS O O -5.890 -3.357 -1.518 1.00 . A A . 23 LYS O 1 1 18 8931 1 1 24 CYS C C -7.096 -0.991 -0.449 1.00 . A A . 24 CYS C 1 1 18 8932 1 1 24 CYS CA C -5.616 -0.985 -0.071 1.00 . A A . 24 CYS CA 1 1 18 8933 1 1 24 CYS CB C -5.161 0.412 0.390 1.00 . A A . 24 CYS CB 1 1 18 8934 1 1 24 CYS H H -4.064 -0.832 -1.487 1.00 . A A . 24 CYS H 1 1 18 8935 1 1 24 CYS HA H -5.464 -1.686 0.735 1.00 . A A . 24 CYS HA 1 1 18 8936 1 1 24 CYS HB2 H -4.471 0.298 1.213 1.00 . A A . 24 CYS HB2 1 1 18 8937 1 1 24 CYS HB3 H -4.646 0.896 -0.426 1.00 . A A . 24 CYS HB3 1 1 18 8938 1 1 24 CYS N N -4.793 -1.414 -1.192 1.00 . A A . 24 CYS N 1 1 18 8939 1 1 24 CYS O O -7.524 -0.268 -1.349 1.00 . A A . 24 CYS O 1 1 18 8940 1 1 24 CYS SG S -6.493 1.530 0.950 1.00 . A A . 24 CYS SG 1 1 18 8941 1 1 25 MET C C -10.081 -1.158 1.062 1.00 . A A . 25 MET C 1 1 18 8942 1 1 25 MET CA C -9.302 -1.916 -0.001 1.00 . A A . 25 MET CA 1 1 18 8943 1 1 25 MET CB C -9.736 -3.383 -0.023 1.00 . A A . 25 MET CB 1 1 18 8944 1 1 25 MET CE C -11.132 -5.165 -3.426 1.00 . A A . 25 MET CE 1 1 18 8945 1 1 25 MET CG C -9.628 -4.029 -1.395 1.00 . A A . 25 MET CG 1 1 18 8946 1 1 25 MET H H -7.469 -2.363 0.954 1.00 . A A . 25 MET H 1 1 18 8947 1 1 25 MET HA H -9.509 -1.472 -0.964 1.00 . A A . 25 MET HA 1 1 18 8948 1 1 25 MET HB2 H -9.116 -3.940 0.664 1.00 . A A . 25 MET HB2 1 1 18 8949 1 1 25 MET HB3 H -10.765 -3.447 0.300 1.00 . A A . 25 MET HB3 1 1 18 8950 1 1 25 MET HE1 H -11.301 -4.130 -3.681 1.00 . A A . 25 MET HE1 1 1 18 8951 1 1 25 MET HE2 H -11.994 -5.751 -3.711 1.00 . A A . 25 MET HE2 1 1 18 8952 1 1 25 MET HE3 H -10.261 -5.528 -3.951 1.00 . A A . 25 MET HE3 1 1 18 8953 1 1 25 MET HG2 H -9.753 -3.266 -2.149 1.00 . A A . 25 MET HG2 1 1 18 8954 1 1 25 MET HG3 H -8.647 -4.472 -1.493 1.00 . A A . 25 MET HG3 1 1 18 8955 1 1 25 MET N N -7.871 -1.813 0.248 1.00 . A A . 25 MET N 1 1 18 8956 1 1 25 MET O O -9.685 -1.125 2.228 1.00 . A A . 25 MET O 1 1 18 8957 1 1 25 MET SD S -10.869 -5.310 -1.660 1.00 . A A . 25 MET SD 1 1 18 8958 1 1 26 ASN C C -12.193 -0.482 2.904 1.00 . A A . 26 ASN C 1 1 18 8959 1 1 26 ASN CA C -12.021 0.234 1.571 1.00 . A A . 26 ASN CA 1 1 18 8960 1 1 26 ASN CB C -13.395 0.530 0.963 1.00 . A A . 26 ASN CB 1 1 18 8961 1 1 26 ASN CG C -13.825 -0.493 -0.074 1.00 . A A . 26 ASN CG 1 1 18 8962 1 1 26 ASN H H -11.435 -0.599 -0.294 1.00 . A A . 26 ASN H 1 1 18 8963 1 1 26 ASN HA H -11.517 1.172 1.753 1.00 . A A . 26 ASN HA 1 1 18 8964 1 1 26 ASN HB2 H -14.132 0.540 1.751 1.00 . A A . 26 ASN HB2 1 1 18 8965 1 1 26 ASN HB3 H -13.364 1.500 0.496 1.00 . A A . 26 ASN HB3 1 1 18 8966 1 1 26 ASN HD21 H -13.746 0.886 -1.504 1.00 . A A . 26 ASN HD21 1 1 18 8967 1 1 26 ASN HD22 H -14.216 -0.697 -2.012 1.00 . A A . 26 ASN HD22 1 1 18 8968 1 1 26 ASN N N -11.183 -0.539 0.651 1.00 . A A . 26 ASN N 1 1 18 8969 1 1 26 ASN ND2 N -13.941 -0.058 -1.323 1.00 . A A . 26 ASN ND2 1 1 18 8970 1 1 26 ASN O O -12.707 -1.599 2.965 1.00 . A A . 26 ASN O 1 1 18 8971 1 1 26 ASN OD1 O -14.048 -1.661 0.245 1.00 . A A . 26 ASN OD1 1 1 18 8972 1 1 27 ARG C C -10.785 -1.466 5.523 1.00 . A A . 27 ARG C 1 1 18 8973 1 1 27 ARG CA C -11.830 -0.381 5.311 1.00 . A A . 27 ARG CA 1 1 18 8974 1 1 27 ARG CB C -13.215 -0.916 5.594 1.00 . A A . 27 ARG CB 1 1 18 8975 1 1 27 ARG CD C -13.598 1.228 6.875 1.00 . A A . 27 ARG CD 1 1 18 8976 1 1 27 ARG CG C -13.819 -0.278 6.827 1.00 . A A . 27 ARG CG 1 1 18 8977 1 1 27 ARG CZ C -12.322 2.852 8.219 1.00 . A A . 27 ARG CZ 1 1 18 8978 1 1 27 ARG H H -11.342 1.055 3.839 1.00 . A A . 27 ARG H 1 1 18 8979 1 1 27 ARG HA H -11.653 0.414 6.010 1.00 . A A . 27 ARG HA 1 1 18 8980 1 1 27 ARG HB2 H -13.855 -0.710 4.747 1.00 . A A . 27 ARG HB2 1 1 18 8981 1 1 27 ARG HB3 H -13.162 -1.983 5.752 1.00 . A A . 27 ARG HB3 1 1 18 8982 1 1 27 ARG HD2 H -13.301 1.567 5.893 1.00 . A A . 27 ARG HD2 1 1 18 8983 1 1 27 ARG HD3 H -14.525 1.706 7.154 1.00 . A A . 27 ARG HD3 1 1 18 8984 1 1 27 ARG HE H -12.020 0.878 8.218 1.00 . A A . 27 ARG HE 1 1 18 8985 1 1 27 ARG HG2 H -14.853 -0.458 6.812 1.00 . A A . 27 ARG HG2 1 1 18 8986 1 1 27 ARG HG3 H -13.382 -0.726 7.707 1.00 . A A . 27 ARG HG3 1 1 18 8987 1 1 27 ARG HH11 H -13.762 3.673 7.061 1.00 . A A . 27 ARG HH11 1 1 18 8988 1 1 27 ARG HH12 H -12.850 4.793 8.016 1.00 . A A . 27 ARG HH12 1 1 18 8989 1 1 27 ARG HH21 H -10.820 2.350 9.476 1.00 . A A . 27 ARG HH21 1 1 18 8990 1 1 27 ARG HH22 H -11.179 4.042 9.386 1.00 . A A . 27 ARG HH22 1 1 18 8991 1 1 27 ARG N N -11.747 0.174 3.967 1.00 . A A . 27 ARG N 1 1 18 8992 1 1 27 ARG NE N -12.563 1.600 7.836 1.00 . A A . 27 ARG NE 1 1 18 8993 1 1 27 ARG NH1 N -13.036 3.854 7.724 1.00 . A A . 27 ARG NH1 1 1 18 8994 1 1 27 ARG NH2 N -11.362 3.102 9.099 1.00 . A A . 27 ARG NH2 1 1 18 8995 1 1 27 ARG O O -10.986 -2.398 6.302 1.00 . A A . 27 ARG O 1 1 18 8996 1 1 28 LYS C C -7.477 -2.004 3.903 1.00 . A A . 28 LYS C 1 1 18 8997 1 1 28 LYS CA C -8.572 -2.299 4.924 1.00 . A A . 28 LYS CA 1 1 18 8998 1 1 28 LYS CB C -9.097 -3.725 4.729 1.00 . A A . 28 LYS CB 1 1 18 8999 1 1 28 LYS CD C -8.052 -5.412 6.271 1.00 . A A . 28 LYS CD 1 1 18 9000 1 1 28 LYS CE C -8.045 -6.588 5.308 1.00 . A A . 28 LYS CE 1 1 18 9001 1 1 28 LYS CG C -9.245 -4.501 6.027 1.00 . A A . 28 LYS CG 1 1 18 9002 1 1 28 LYS H H -9.572 -0.562 4.219 1.00 . A A . 28 LYS H 1 1 18 9003 1 1 28 LYS HA H -8.151 -2.213 5.914 1.00 . A A . 28 LYS HA 1 1 18 9004 1 1 28 LYS HB2 H -10.064 -3.677 4.251 1.00 . A A . 28 LYS HB2 1 1 18 9005 1 1 28 LYS HB3 H -8.416 -4.263 4.088 1.00 . A A . 28 LYS HB3 1 1 18 9006 1 1 28 LYS HD2 H -7.144 -4.843 6.136 1.00 . A A . 28 LYS HD2 1 1 18 9007 1 1 28 LYS HD3 H -8.098 -5.786 7.284 1.00 . A A . 28 LYS HD3 1 1 18 9008 1 1 28 LYS HE2 H -8.507 -7.436 5.792 1.00 . A A . 28 LYS HE2 1 1 18 9009 1 1 28 LYS HE3 H -8.613 -6.322 4.430 1.00 . A A . 28 LYS HE3 1 1 18 9010 1 1 28 LYS HG2 H -9.324 -3.802 6.846 1.00 . A A . 28 LYS HG2 1 1 18 9011 1 1 28 LYS HG3 H -10.141 -5.101 5.976 1.00 . A A . 28 LYS HG3 1 1 18 9012 1 1 28 LYS HZ1 H -6.695 -7.636 4.107 1.00 . A A . 28 LYS HZ1 1 1 18 9013 1 1 28 LYS HZ2 H -6.158 -7.398 5.693 1.00 . A A . 28 LYS HZ2 1 1 18 9014 1 1 28 LYS HZ3 H -6.140 -6.114 4.594 1.00 . A A . 28 LYS HZ3 1 1 18 9015 1 1 28 LYS N N -9.665 -1.332 4.821 1.00 . A A . 28 LYS N 1 1 18 9016 1 1 28 LYS NZ N -6.662 -6.960 4.897 1.00 . A A . 28 LYS NZ 1 1 18 9017 1 1 28 LYS O O -7.556 -2.429 2.751 1.00 . A A . 28 LYS O 1 1 18 9018 1 1 29 CYS C C -4.492 -2.139 3.148 1.00 . A A . 29 CYS C 1 1 18 9019 1 1 29 CYS CA C -5.342 -0.918 3.477 1.00 . A A . 29 CYS CA 1 1 18 9020 1 1 29 CYS CB C -4.516 0.178 4.158 1.00 . A A . 29 CYS CB 1 1 18 9021 1 1 29 CYS H H -6.451 -0.961 5.262 1.00 . A A . 29 CYS H 1 1 18 9022 1 1 29 CYS HA H -5.751 -0.524 2.565 1.00 . A A . 29 CYS HA 1 1 18 9023 1 1 29 CYS HB2 H -4.823 1.127 3.764 1.00 . A A . 29 CYS HB2 1 1 18 9024 1 1 29 CYS HB3 H -4.731 0.156 5.211 1.00 . A A . 29 CYS HB3 1 1 18 9025 1 1 29 CYS N N -6.455 -1.274 4.337 1.00 . A A . 29 CYS N 1 1 18 9026 1 1 29 CYS O O -4.602 -3.182 3.793 1.00 . A A . 29 CYS O 1 1 18 9027 1 1 29 CYS SG S -2.702 0.071 3.968 1.00 . A A . 29 CYS SG 1 1 18 9028 1 1 30 LYS C C -2.081 -2.755 0.381 1.00 . A A . 30 LYS C 1 1 18 9029 1 1 30 LYS CA C -2.764 -3.081 1.706 1.00 . A A . 30 LYS CA 1 1 18 9030 1 1 30 LYS CB C -3.551 -4.391 1.575 1.00 . A A . 30 LYS CB 1 1 18 9031 1 1 30 LYS CD C -2.205 -6.341 2.412 1.00 . A A . 30 LYS CD 1 1 18 9032 1 1 30 LYS CE C -1.822 -7.158 3.634 1.00 . A A . 30 LYS CE 1 1 18 9033 1 1 30 LYS CG C -3.319 -5.357 2.726 1.00 . A A . 30 LYS CG 1 1 18 9034 1 1 30 LYS H H -3.604 -1.137 1.670 1.00 . A A . 30 LYS H 1 1 18 9035 1 1 30 LYS HA H -2.004 -3.207 2.463 1.00 . A A . 30 LYS HA 1 1 18 9036 1 1 30 LYS HB2 H -4.605 -4.161 1.533 1.00 . A A . 30 LYS HB2 1 1 18 9037 1 1 30 LYS HB3 H -3.262 -4.883 0.658 1.00 . A A . 30 LYS HB3 1 1 18 9038 1 1 30 LYS HD2 H -2.539 -7.012 1.634 1.00 . A A . 30 LYS HD2 1 1 18 9039 1 1 30 LYS HD3 H -1.340 -5.793 2.069 1.00 . A A . 30 LYS HD3 1 1 18 9040 1 1 30 LYS HE2 H -0.846 -7.590 3.471 1.00 . A A . 30 LYS HE2 1 1 18 9041 1 1 30 LYS HE3 H -1.785 -6.503 4.492 1.00 . A A . 30 LYS HE3 1 1 18 9042 1 1 30 LYS HG2 H -3.050 -4.793 3.607 1.00 . A A . 30 LYS HG2 1 1 18 9043 1 1 30 LYS HG3 H -4.231 -5.906 2.911 1.00 . A A . 30 LYS HG3 1 1 18 9044 1 1 30 LYS HZ1 H -2.975 -8.791 3.030 1.00 . A A . 30 LYS HZ1 1 1 18 9045 1 1 30 LYS HZ2 H -3.696 -7.856 4.240 1.00 . A A . 30 LYS HZ2 1 1 18 9046 1 1 30 LYS HZ3 H -2.421 -8.898 4.625 1.00 . A A . 30 LYS HZ3 1 1 18 9047 1 1 30 LYS N N -3.642 -1.997 2.136 1.00 . A A . 30 LYS N 1 1 18 9048 1 1 30 LYS NZ N -2.796 -8.252 3.901 1.00 . A A . 30 LYS NZ 1 1 18 9049 1 1 30 LYS O O -2.614 -3.041 -0.686 1.00 . A A . 30 LYS O 1 1 18 9050 1 1 31 CYS C C -0.209 -2.782 -1.843 1.00 . A A . 31 CYS C 1 1 18 9051 1 1 31 CYS CA C -0.086 -1.789 -0.699 1.00 . A A . 31 CYS CA 1 1 18 9052 1 1 31 CYS CB C 1.384 -1.673 -0.293 1.00 . A A . 31 CYS CB 1 1 18 9053 1 1 31 CYS H H -0.541 -1.969 1.363 1.00 . A A . 31 CYS H 1 1 18 9054 1 1 31 CYS HA H -0.416 -0.829 -1.062 1.00 . A A . 31 CYS HA 1 1 18 9055 1 1 31 CYS HB2 H 1.585 -2.373 0.503 1.00 . A A . 31 CYS HB2 1 1 18 9056 1 1 31 CYS HB3 H 2.005 -1.916 -1.143 1.00 . A A . 31 CYS HB3 1 1 18 9057 1 1 31 CYS N N -0.893 -2.162 0.472 1.00 . A A . 31 CYS N 1 1 18 9058 1 1 31 CYS O O -0.709 -3.891 -1.689 1.00 . A A . 31 CYS O 1 1 18 9059 1 1 31 CYS SG S 1.868 -0.018 0.290 1.00 . A A . 31 CYS SG 1 1 18 9060 1 1 32 ASN C C 1.495 -3.885 -4.423 1.00 . A A . 32 ASN C 1 1 18 9061 1 1 32 ASN CA C 0.190 -3.136 -4.212 1.00 . A A . 32 ASN CA 1 1 18 9062 1 1 32 ASN CB C -0.056 -2.218 -5.387 1.00 . A A . 32 ASN CB 1 1 18 9063 1 1 32 ASN CG C -0.800 -2.891 -6.523 1.00 . A A . 32 ASN CG 1 1 18 9064 1 1 32 ASN H H 0.584 -1.427 -3.056 1.00 . A A . 32 ASN H 1 1 18 9065 1 1 32 ASN HA H -0.617 -3.838 -4.140 1.00 . A A . 32 ASN HA 1 1 18 9066 1 1 32 ASN HB2 H -0.630 -1.381 -5.048 1.00 . A A . 32 ASN HB2 1 1 18 9067 1 1 32 ASN HB3 H 0.890 -1.872 -5.745 1.00 . A A . 32 ASN HB3 1 1 18 9068 1 1 32 ASN HD21 H -1.443 -1.128 -7.179 1.00 . A A . 32 ASN HD21 1 1 18 9069 1 1 32 ASN HD22 H -1.957 -2.502 -8.092 1.00 . A A . 32 ASN HD22 1 1 18 9070 1 1 32 ASN N N 0.233 -2.340 -3.004 1.00 . A A . 32 ASN N 1 1 18 9071 1 1 32 ASN ND2 N -1.467 -2.093 -7.348 1.00 . A A . 32 ASN ND2 1 1 18 9072 1 1 32 ASN O O 2.435 -3.761 -3.638 1.00 . A A . 32 ASN O 1 1 18 9073 1 1 32 ASN OD1 O -0.775 -4.115 -6.658 1.00 . A A . 32 ASN OD1 1 1 18 9074 1 1 33 ARG C C 3.770 -4.566 -6.564 1.00 . A A . 33 ARG C 1 1 18 9075 1 1 33 ARG CA C 2.735 -5.424 -5.833 1.00 . A A . 33 ARG CA 1 1 18 9076 1 1 33 ARG CB C 2.374 -6.694 -6.614 1.00 . A A . 33 ARG CB 1 1 18 9077 1 1 33 ARG CD C 1.403 -5.184 -8.335 1.00 . A A . 33 ARG CD 1 1 18 9078 1 1 33 ARG CG C 2.156 -6.472 -8.088 1.00 . A A . 33 ARG CG 1 1 18 9079 1 1 33 ARG CZ C 0.842 -3.805 -10.302 1.00 . A A . 33 ARG CZ 1 1 18 9080 1 1 33 ARG H H 0.754 -4.699 -6.076 1.00 . A A . 33 ARG H 1 1 18 9081 1 1 33 ARG HA H 3.168 -5.714 -4.929 1.00 . A A . 33 ARG HA 1 1 18 9082 1 1 33 ARG HB2 H 3.171 -7.412 -6.496 1.00 . A A . 33 ARG HB2 1 1 18 9083 1 1 33 ARG HB3 H 1.467 -7.109 -6.197 1.00 . A A . 33 ARG HB3 1 1 18 9084 1 1 33 ARG HD2 H 0.346 -5.375 -8.230 1.00 . A A . 33 ARG HD2 1 1 18 9085 1 1 33 ARG HD3 H 1.715 -4.470 -7.585 1.00 . A A . 33 ARG HD3 1 1 18 9086 1 1 33 ARG HE H 2.501 -4.895 -10.102 1.00 . A A . 33 ARG HE 1 1 18 9087 1 1 33 ARG HG2 H 3.118 -6.415 -8.566 1.00 . A A . 33 ARG HG2 1 1 18 9088 1 1 33 ARG HG3 H 1.593 -7.297 -8.489 1.00 . A A . 33 ARG HG3 1 1 18 9089 1 1 33 ARG HH11 H -0.548 -3.762 -8.833 1.00 . A A . 33 ARG HH11 1 1 18 9090 1 1 33 ARG HH12 H -0.912 -2.803 -10.228 1.00 . A A . 33 ARG HH12 1 1 18 9091 1 1 33 ARG HH21 H 2.021 -3.635 -11.935 1.00 . A A . 33 ARG HH21 1 1 18 9092 1 1 33 ARG HH22 H 0.544 -2.732 -11.988 1.00 . A A . 33 ARG HH22 1 1 18 9093 1 1 33 ARG N N 1.541 -4.654 -5.497 1.00 . A A . 33 ARG N 1 1 18 9094 1 1 33 ARG NE N 1.665 -4.633 -9.663 1.00 . A A . 33 ARG NE 1 1 18 9095 1 1 33 ARG NH1 N -0.300 -3.425 -9.741 1.00 . A A . 33 ARG NH1 1 1 18 9096 1 1 33 ARG NH2 N 1.162 -3.353 -11.507 1.00 . A A . 33 ARG NH2 1 1 18 9097 1 1 33 ARG O O 3.901 -4.598 -7.786 1.00 . A A . 33 ARG O 1 1 18 9098 1 1 34 CYS C C 6.926 -3.481 -6.106 1.00 . A A . 34 CYS C 1 1 18 9099 1 1 34 CYS CA C 5.531 -2.906 -6.322 1.00 . A A . 34 CYS CA 1 1 18 9100 1 1 34 CYS CB C 5.424 -1.532 -5.681 1.00 . A A . 34 CYS CB 1 1 18 9101 1 1 34 CYS H H 4.349 -3.813 -4.815 1.00 . A A . 34 CYS H 1 1 18 9102 1 1 34 CYS HA H 5.354 -2.800 -7.370 1.00 . A A . 34 CYS HA 1 1 18 9103 1 1 34 CYS HB2 H 4.449 -1.435 -5.242 1.00 . A A . 34 CYS HB2 1 1 18 9104 1 1 34 CYS HB3 H 6.174 -1.446 -4.915 1.00 . A A . 34 CYS HB3 1 1 18 9105 1 1 34 CYS N N 4.504 -3.790 -5.782 1.00 . A A . 34 CYS N 1 1 18 9106 1 1 34 CYS O O 7.373 -3.526 -4.941 1.00 . A A . 34 CYS O 1 1 18 9107 1 1 34 CYS OXT O 7.560 -3.882 -7.105 1.00 . A A . 34 CYS OXT 1 1 18 9108 1 1 34 CYS SG S 5.646 -0.142 -6.839 1.00 . A A . 34 CYS SG 1 1 19 9109 1 1 1 VAL C C -2.896 10.733 -1.385 1.00 . A A . 1 VAL C 1 1 19 9110 1 1 1 VAL CA C -1.933 11.054 -2.523 1.00 . A A . 1 VAL CA 1 1 19 9111 1 1 1 VAL CB C -1.476 12.519 -2.389 1.00 . A A . 1 VAL CB 1 1 19 9112 1 1 1 VAL CG1 C -0.254 12.779 -3.255 1.00 . A A . 1 VAL CG1 1 1 19 9113 1 1 1 VAL CG2 C -2.608 13.466 -2.755 1.00 . A A . 1 VAL CG2 1 1 19 9114 1 1 1 VAL H1 H -1.967 11.249 -4.569 1.00 . A A . 1 VAL H1 1 1 19 9115 1 1 1 VAL H2 H -3.514 11.227 -3.827 1.00 . A A . 1 VAL H2 1 1 19 9116 1 1 1 VAL H3 H -2.614 9.775 -3.982 1.00 . A A . 1 VAL H3 1 1 19 9117 1 1 1 VAL HA H -1.064 10.418 -2.434 1.00 . A A . 1 VAL HA 1 1 19 9118 1 1 1 VAL HB H -1.205 12.698 -1.359 1.00 . A A . 1 VAL HB 1 1 19 9119 1 1 1 VAL HG11 H -0.514 12.646 -4.295 1.00 . A A . 1 VAL HG11 1 1 19 9120 1 1 1 VAL HG12 H 0.530 12.085 -2.989 1.00 . A A . 1 VAL HG12 1 1 19 9121 1 1 1 VAL HG13 H 0.092 13.789 -3.097 1.00 . A A . 1 VAL HG13 1 1 19 9122 1 1 1 VAL HG21 H -2.517 14.377 -2.181 1.00 . A A . 1 VAL HG21 1 1 19 9123 1 1 1 VAL HG22 H -3.556 12.997 -2.536 1.00 . A A . 1 VAL HG22 1 1 19 9124 1 1 1 VAL HG23 H -2.558 13.700 -3.808 1.00 . A A . 1 VAL HG23 1 1 19 9125 1 1 1 VAL N N -2.564 10.804 -3.844 1.00 . A A . 1 VAL N 1 1 19 9126 1 1 1 VAL O O -4.084 11.045 -1.458 1.00 . A A . 1 VAL O 1 1 19 9127 1 1 2 SER C C -4.272 8.743 0.436 1.00 . A A . 2 SER C 1 1 19 9128 1 1 2 SER CA C -3.185 9.742 0.823 1.00 . A A . 2 SER CA 1 1 19 9129 1 1 2 SER CB C -3.817 10.989 1.447 1.00 . A A . 2 SER CB 1 1 19 9130 1 1 2 SER H H -1.420 9.887 -0.336 1.00 . A A . 2 SER H 1 1 19 9131 1 1 2 SER HA H -2.533 9.279 1.549 1.00 . A A . 2 SER HA 1 1 19 9132 1 1 2 SER HB2 H -4.013 10.804 2.493 1.00 . A A . 2 SER HB2 1 1 19 9133 1 1 2 SER HB3 H -3.135 11.821 1.351 1.00 . A A . 2 SER HB3 1 1 19 9134 1 1 2 SER HG H -5.179 12.269 0.863 1.00 . A A . 2 SER HG 1 1 19 9135 1 1 2 SER N N -2.374 10.108 -0.334 1.00 . A A . 2 SER N 1 1 19 9136 1 1 2 SER O O -5.057 8.988 -0.480 1.00 . A A . 2 SER O 1 1 19 9137 1 1 2 SER OG O -5.038 11.322 0.808 1.00 . A A . 2 SER OG 1 1 19 9138 1 1 3 CYS C C -6.709 7.109 1.036 1.00 . A A . 3 CYS C 1 1 19 9139 1 1 3 CYS CA C -5.300 6.579 0.869 1.00 . A A . 3 CYS CA 1 1 19 9140 1 1 3 CYS CB C -5.097 5.378 1.795 1.00 . A A . 3 CYS CB 1 1 19 9141 1 1 3 CYS H H -3.657 7.478 1.856 1.00 . A A . 3 CYS H 1 1 19 9142 1 1 3 CYS HA H -5.184 6.252 -0.150 1.00 . A A . 3 CYS HA 1 1 19 9143 1 1 3 CYS HB2 H -4.830 5.732 2.771 1.00 . A A . 3 CYS HB2 1 1 19 9144 1 1 3 CYS HB3 H -6.021 4.827 1.866 1.00 . A A . 3 CYS HB3 1 1 19 9145 1 1 3 CYS N N -4.310 7.616 1.139 1.00 . A A . 3 CYS N 1 1 19 9146 1 1 3 CYS O O -6.933 8.300 1.247 1.00 . A A . 3 CYS O 1 1 19 9147 1 1 3 CYS SG S -3.809 4.218 1.241 1.00 . A A . 3 CYS SG 1 1 19 9148 1 1 4 THR C C -9.517 6.345 2.527 1.00 . A A . 4 THR C 1 1 19 9149 1 1 4 THR CA C -9.063 6.503 1.077 1.00 . A A . 4 THR CA 1 1 19 9150 1 1 4 THR CB C -9.887 5.596 0.161 1.00 . A A . 4 THR CB 1 1 19 9151 1 1 4 THR CG2 C -9.282 5.436 -1.219 1.00 . A A . 4 THR CG2 1 1 19 9152 1 1 4 THR H H -7.371 5.267 0.772 1.00 . A A . 4 THR H 1 1 19 9153 1 1 4 THR HA H -9.206 7.530 0.777 1.00 . A A . 4 THR HA 1 1 19 9154 1 1 4 THR HB H -10.874 6.019 0.043 1.00 . A A . 4 THR HB 1 1 19 9155 1 1 4 THR HG1 H -10.552 4.351 1.519 1.00 . A A . 4 THR HG1 1 1 19 9156 1 1 4 THR HG21 H -9.469 6.326 -1.800 1.00 . A A . 4 THR HG21 1 1 19 9157 1 1 4 THR HG22 H -9.727 4.583 -1.711 1.00 . A A . 4 THR HG22 1 1 19 9158 1 1 4 THR HG23 H -8.215 5.283 -1.129 1.00 . A A . 4 THR HG23 1 1 19 9159 1 1 4 THR N N -7.646 6.190 0.940 1.00 . A A . 4 THR N 1 1 19 9160 1 1 4 THR O O -10.701 6.148 2.803 1.00 . A A . 4 THR O 1 1 19 9161 1 1 4 THR OG1 O -10.020 4.302 0.723 1.00 . A A . 4 THR OG1 1 1 19 9162 1 1 5 GLY C C -7.713 6.799 5.718 1.00 . A A . 5 GLY C 1 1 19 9163 1 1 5 GLY CA C -8.862 6.309 4.861 1.00 . A A . 5 GLY CA 1 1 19 9164 1 1 5 GLY H H -7.641 6.597 3.167 1.00 . A A . 5 GLY H 1 1 19 9165 1 1 5 GLY HA2 H -9.745 6.889 5.089 1.00 . A A . 5 GLY HA2 1 1 19 9166 1 1 5 GLY HA3 H -9.053 5.270 5.089 1.00 . A A . 5 GLY HA3 1 1 19 9167 1 1 5 GLY N N -8.563 6.437 3.449 1.00 . A A . 5 GLY N 1 1 19 9168 1 1 5 GLY O O -6.681 6.136 5.818 1.00 . A A . 5 GLY O 1 1 19 9169 1 1 6 SER C C -5.729 9.138 6.284 1.00 . A A . 6 SER C 1 1 19 9170 1 1 6 SER CA C -6.840 8.563 7.157 1.00 . A A . 6 SER CA 1 1 19 9171 1 1 6 SER CB C -6.265 7.529 8.129 1.00 . A A . 6 SER CB 1 1 19 9172 1 1 6 SER H H -8.723 8.459 6.190 1.00 . A A . 6 SER H 1 1 19 9173 1 1 6 SER HA H -7.289 9.367 7.722 1.00 . A A . 6 SER HA 1 1 19 9174 1 1 6 SER HB2 H -5.377 7.091 7.701 1.00 . A A . 6 SER HB2 1 1 19 9175 1 1 6 SER HB3 H -6.014 8.015 9.061 1.00 . A A . 6 SER HB3 1 1 19 9176 1 1 6 SER HG H -6.796 5.645 8.217 1.00 . A A . 6 SER HG 1 1 19 9177 1 1 6 SER N N -7.882 7.972 6.321 1.00 . A A . 6 SER N 1 1 19 9178 1 1 6 SER O O -5.771 9.026 5.059 1.00 . A A . 6 SER O 1 1 19 9179 1 1 6 SER OG O -7.201 6.498 8.391 1.00 . A A . 6 SER OG 1 1 19 9180 1 1 7 LYS C C -2.286 9.894 6.764 1.00 . A A . 7 LYS C 1 1 19 9181 1 1 7 LYS CA C -3.623 10.349 6.186 1.00 . A A . 7 LYS CA 1 1 19 9182 1 1 7 LYS CB C -3.719 11.877 6.225 1.00 . A A . 7 LYS CB 1 1 19 9183 1 1 7 LYS CD C -5.962 12.469 5.251 1.00 . A A . 7 LYS CD 1 1 19 9184 1 1 7 LYS CE C -6.661 11.494 4.316 1.00 . A A . 7 LYS CE 1 1 19 9185 1 1 7 LYS CG C -4.455 12.469 5.035 1.00 . A A . 7 LYS CG 1 1 19 9186 1 1 7 LYS H H -4.756 9.816 7.894 1.00 . A A . 7 LYS H 1 1 19 9187 1 1 7 LYS HA H -3.687 10.020 5.160 1.00 . A A . 7 LYS HA 1 1 19 9188 1 1 7 LYS HB2 H -4.240 12.170 7.125 1.00 . A A . 7 LYS HB2 1 1 19 9189 1 1 7 LYS HB3 H -2.722 12.290 6.246 1.00 . A A . 7 LYS HB3 1 1 19 9190 1 1 7 LYS HD2 H -6.171 12.184 6.271 1.00 . A A . 7 LYS HD2 1 1 19 9191 1 1 7 LYS HD3 H -6.342 13.463 5.068 1.00 . A A . 7 LYS HD3 1 1 19 9192 1 1 7 LYS HE2 H -5.916 10.885 3.825 1.00 . A A . 7 LYS HE2 1 1 19 9193 1 1 7 LYS HE3 H -7.313 10.860 4.900 1.00 . A A . 7 LYS HE3 1 1 19 9194 1 1 7 LYS HG2 H -4.124 13.487 4.890 1.00 . A A . 7 LYS HG2 1 1 19 9195 1 1 7 LYS HG3 H -4.225 11.886 4.155 1.00 . A A . 7 LYS HG3 1 1 19 9196 1 1 7 LYS HZ1 H -6.845 12.592 2.549 1.00 . A A . 7 LYS HZ1 1 1 19 9197 1 1 7 LYS HZ2 H -8.008 12.973 3.716 1.00 . A A . 7 LYS HZ2 1 1 19 9198 1 1 7 LYS HZ3 H -8.134 11.534 2.835 1.00 . A A . 7 LYS HZ3 1 1 19 9199 1 1 7 LYS N N -4.738 9.756 6.916 1.00 . A A . 7 LYS N 1 1 19 9200 1 1 7 LYS NZ N -7.469 12.198 3.282 1.00 . A A . 7 LYS NZ 1 1 19 9201 1 1 7 LYS O O -1.387 10.704 6.988 1.00 . A A . 7 LYS O 1 1 19 9202 1 1 8 ASP C C -0.738 6.583 7.159 1.00 . A A . 8 ASP C 1 1 19 9203 1 1 8 ASP CA C -0.930 8.043 7.560 1.00 . A A . 8 ASP CA 1 1 19 9204 1 1 8 ASP CB C -0.936 8.165 9.086 1.00 . A A . 8 ASP CB 1 1 19 9205 1 1 8 ASP CG C 0.436 8.484 9.644 1.00 . A A . 8 ASP CG 1 1 19 9206 1 1 8 ASP H H -2.913 7.995 6.812 1.00 . A A . 8 ASP H 1 1 19 9207 1 1 8 ASP HA H -0.107 8.621 7.168 1.00 . A A . 8 ASP HA 1 1 19 9208 1 1 8 ASP HB2 H -1.614 8.954 9.374 1.00 . A A . 8 ASP HB2 1 1 19 9209 1 1 8 ASP HB3 H -1.273 7.233 9.514 1.00 . A A . 8 ASP HB3 1 1 19 9210 1 1 8 ASP N N -2.162 8.594 7.007 1.00 . A A . 8 ASP N 1 1 19 9211 1 1 8 ASP O O -0.059 5.829 7.855 1.00 . A A . 8 ASP O 1 1 19 9212 1 1 8 ASP OD1 O 1.262 7.554 9.756 1.00 . A A . 8 ASP OD1 1 1 19 9213 1 1 8 ASP OD2 O 0.685 9.664 9.971 1.00 . A A . 8 ASP OD2 1 1 19 9214 1 1 9 CYS C C -0.416 4.726 4.283 1.00 . A A . 9 CYS C 1 1 19 9215 1 1 9 CYS CA C -1.216 4.809 5.569 1.00 . A A . 9 CYS CA 1 1 19 9216 1 1 9 CYS CB C -2.587 4.203 5.356 1.00 . A A . 9 CYS CB 1 1 19 9217 1 1 9 CYS H H -1.871 6.819 5.521 1.00 . A A . 9 CYS H 1 1 19 9218 1 1 9 CYS HA H -0.711 4.250 6.322 1.00 . A A . 9 CYS HA 1 1 19 9219 1 1 9 CYS HB2 H -3.286 4.698 6.004 1.00 . A A . 9 CYS HB2 1 1 19 9220 1 1 9 CYS HB3 H -2.875 4.357 4.336 1.00 . A A . 9 CYS HB3 1 1 19 9221 1 1 9 CYS N N -1.337 6.182 6.039 1.00 . A A . 9 CYS N 1 1 19 9222 1 1 9 CYS O O 0.682 4.170 4.255 1.00 . A A . 9 CYS O 1 1 19 9223 1 1 9 CYS SG S -2.665 2.415 5.700 1.00 . A A . 9 CYS SG 1 1 19 9224 1 1 10 TYR C C 1.145 5.683 2.044 1.00 . A A . 10 TYR C 1 1 19 9225 1 1 10 TYR CA C -0.318 5.268 1.915 1.00 . A A . 10 TYR CA 1 1 19 9226 1 1 10 TYR CB C -1.046 6.208 0.945 1.00 . A A . 10 TYR CB 1 1 19 9227 1 1 10 TYR CD1 C -0.712 4.509 -0.903 1.00 . A A . 10 TYR CD1 1 1 19 9228 1 1 10 TYR CD2 C -2.559 6.007 -1.069 1.00 . A A . 10 TYR CD2 1 1 19 9229 1 1 10 TYR CE1 C -1.076 3.922 -2.099 1.00 . A A . 10 TYR CE1 1 1 19 9230 1 1 10 TYR CE2 C -2.930 5.424 -2.266 1.00 . A A . 10 TYR CE2 1 1 19 9231 1 1 10 TYR CG C -1.447 5.561 -0.366 1.00 . A A . 10 TYR CG 1 1 19 9232 1 1 10 TYR CZ C -2.186 4.382 -2.776 1.00 . A A . 10 TYR CZ 1 1 19 9233 1 1 10 TYR H H -1.853 5.705 3.305 1.00 . A A . 10 TYR H 1 1 19 9234 1 1 10 TYR HA H -0.363 4.261 1.531 1.00 . A A . 10 TYR HA 1 1 19 9235 1 1 10 TYR HB2 H -1.945 6.572 1.419 1.00 . A A . 10 TYR HB2 1 1 19 9236 1 1 10 TYR HB3 H -0.403 7.047 0.718 1.00 . A A . 10 TYR HB3 1 1 19 9237 1 1 10 TYR HD1 H 0.156 4.150 -0.371 1.00 . A A . 10 TYR HD1 1 1 19 9238 1 1 10 TYR HD2 H -3.139 6.823 -0.668 1.00 . A A . 10 TYR HD2 1 1 19 9239 1 1 10 TYR HE1 H -0.493 3.106 -2.499 1.00 . A A . 10 TYR HE1 1 1 19 9240 1 1 10 TYR HE2 H -3.799 5.785 -2.795 1.00 . A A . 10 TYR HE2 1 1 19 9241 1 1 10 TYR HH H -3.183 3.097 -3.800 1.00 . A A . 10 TYR HH 1 1 19 9242 1 1 10 TYR N N -0.975 5.279 3.215 1.00 . A A . 10 TYR N 1 1 19 9243 1 1 10 TYR O O 1.986 5.280 1.245 1.00 . A A . 10 TYR O 1 1 19 9244 1 1 10 TYR OH O -2.552 3.801 -3.968 1.00 . A A . 10 TYR OH 1 1 19 9245 1 1 11 ALA C C 3.718 5.855 3.793 1.00 . A A . 11 ALA C 1 1 19 9246 1 1 11 ALA CA C 2.802 6.968 3.284 1.00 . A A . 11 ALA CA 1 1 19 9247 1 1 11 ALA CB C 2.804 8.151 4.242 1.00 . A A . 11 ALA CB 1 1 19 9248 1 1 11 ALA H H 0.721 6.783 3.663 1.00 . A A . 11 ALA H 1 1 19 9249 1 1 11 ALA HA H 3.188 7.309 2.334 1.00 . A A . 11 ALA HA 1 1 19 9250 1 1 11 ALA HB1 H 3.701 8.127 4.841 1.00 . A A . 11 ALA HB1 1 1 19 9251 1 1 11 ALA HB2 H 1.939 8.093 4.887 1.00 . A A . 11 ALA HB2 1 1 19 9252 1 1 11 ALA HB3 H 2.771 9.071 3.678 1.00 . A A . 11 ALA HB3 1 1 19 9253 1 1 11 ALA N N 1.439 6.496 3.055 1.00 . A A . 11 ALA N 1 1 19 9254 1 1 11 ALA O O 4.618 5.413 3.079 1.00 . A A . 11 ALA O 1 1 19 9255 1 1 12 PRO C C 4.412 3.100 4.728 1.00 . A A . 12 PRO C 1 1 19 9256 1 1 12 PRO CA C 4.327 4.325 5.628 1.00 . A A . 12 PRO CA 1 1 19 9257 1 1 12 PRO CB C 3.609 3.981 6.941 1.00 . A A . 12 PRO CB 1 1 19 9258 1 1 12 PRO CD C 2.464 5.842 5.966 1.00 . A A . 12 PRO CD 1 1 19 9259 1 1 12 PRO CG C 2.277 4.653 6.860 1.00 . A A . 12 PRO CG 1 1 19 9260 1 1 12 PRO HA H 5.326 4.677 5.844 1.00 . A A . 12 PRO HA 1 1 19 9261 1 1 12 PRO HB2 H 3.503 2.909 7.025 1.00 . A A . 12 PRO HB2 1 1 19 9262 1 1 12 PRO HB3 H 4.185 4.355 7.775 1.00 . A A . 12 PRO HB3 1 1 19 9263 1 1 12 PRO HD2 H 1.548 6.070 5.439 1.00 . A A . 12 PRO HD2 1 1 19 9264 1 1 12 PRO HD3 H 2.799 6.697 6.534 1.00 . A A . 12 PRO HD3 1 1 19 9265 1 1 12 PRO HG2 H 1.550 3.976 6.437 1.00 . A A . 12 PRO HG2 1 1 19 9266 1 1 12 PRO HG3 H 1.967 4.969 7.845 1.00 . A A . 12 PRO HG3 1 1 19 9267 1 1 12 PRO N N 3.508 5.386 5.038 1.00 . A A . 12 PRO N 1 1 19 9268 1 1 12 PRO O O 5.354 2.314 4.819 1.00 . A A . 12 PRO O 1 1 19 9269 1 1 13 CYS C C 4.085 2.152 1.632 1.00 . A A . 13 CYS C 1 1 19 9270 1 1 13 CYS CA C 3.386 1.817 2.941 1.00 . A A . 13 CYS CA 1 1 19 9271 1 1 13 CYS CB C 1.951 1.397 2.682 1.00 . A A . 13 CYS CB 1 1 19 9272 1 1 13 CYS H H 2.698 3.605 3.832 1.00 . A A . 13 CYS H 1 1 19 9273 1 1 13 CYS HA H 3.898 1.003 3.404 1.00 . A A . 13 CYS HA 1 1 19 9274 1 1 13 CYS HB2 H 1.308 1.980 3.312 1.00 . A A . 13 CYS HB2 1 1 19 9275 1 1 13 CYS HB3 H 1.714 1.588 1.654 1.00 . A A . 13 CYS HB3 1 1 19 9276 1 1 13 CYS N N 3.422 2.945 3.858 1.00 . A A . 13 CYS N 1 1 19 9277 1 1 13 CYS O O 4.906 1.376 1.150 1.00 . A A . 13 CYS O 1 1 19 9278 1 1 13 CYS SG S 1.608 -0.362 3.023 1.00 . A A . 13 CYS SG 1 1 19 9279 1 1 14 ARG C C 5.895 3.592 -0.111 1.00 . A A . 14 ARG C 1 1 19 9280 1 1 14 ARG CA C 4.381 3.719 -0.200 1.00 . A A . 14 ARG CA 1 1 19 9281 1 1 14 ARG CB C 3.987 5.156 -0.556 1.00 . A A . 14 ARG CB 1 1 19 9282 1 1 14 ARG CD C 5.266 7.081 -1.551 1.00 . A A . 14 ARG CD 1 1 19 9283 1 1 14 ARG CG C 4.685 5.697 -1.796 1.00 . A A . 14 ARG CG 1 1 19 9284 1 1 14 ARG CZ C 5.238 8.042 -3.819 1.00 . A A . 14 ARG CZ 1 1 19 9285 1 1 14 ARG H H 3.107 3.895 1.477 1.00 . A A . 14 ARG H 1 1 19 9286 1 1 14 ARG HA H 4.022 3.055 -0.965 1.00 . A A . 14 ARG HA 1 1 19 9287 1 1 14 ARG HB2 H 2.922 5.189 -0.729 1.00 . A A . 14 ARG HB2 1 1 19 9288 1 1 14 ARG HB3 H 4.227 5.799 0.278 1.00 . A A . 14 ARG HB3 1 1 19 9289 1 1 14 ARG HD2 H 4.469 7.744 -1.247 1.00 . A A . 14 ARG HD2 1 1 19 9290 1 1 14 ARG HD3 H 5.999 7.015 -0.760 1.00 . A A . 14 ARG HD3 1 1 19 9291 1 1 14 ARG HE H 6.884 7.683 -2.750 1.00 . A A . 14 ARG HE 1 1 19 9292 1 1 14 ARG HG2 H 5.484 5.027 -2.069 1.00 . A A . 14 ARG HG2 1 1 19 9293 1 1 14 ARG HG3 H 3.969 5.755 -2.602 1.00 . A A . 14 ARG HG3 1 1 19 9294 1 1 14 ARG HH11 H 3.408 7.618 -3.067 1.00 . A A . 14 ARG HH11 1 1 19 9295 1 1 14 ARG HH12 H 3.416 8.295 -4.661 1.00 . A A . 14 ARG HH12 1 1 19 9296 1 1 14 ARG HH21 H 6.895 8.574 -4.846 1.00 . A A . 14 ARG HH21 1 1 19 9297 1 1 14 ARG HH22 H 5.396 8.838 -5.671 1.00 . A A . 14 ARG HH22 1 1 19 9298 1 1 14 ARG N N 3.765 3.309 1.054 1.00 . A A . 14 ARG N 1 1 19 9299 1 1 14 ARG NE N 5.905 7.626 -2.746 1.00 . A A . 14 ARG NE 1 1 19 9300 1 1 14 ARG NH1 N 3.913 7.980 -3.851 1.00 . A A . 14 ARG NH1 1 1 19 9301 1 1 14 ARG NH2 N 5.897 8.524 -4.864 1.00 . A A . 14 ARG NH2 1 1 19 9302 1 1 14 ARG O O 6.561 3.267 -1.094 1.00 . A A . 14 ARG O 1 1 19 9303 1 1 15 LYS C C 8.324 2.296 1.039 1.00 . A A . 15 LYS C 1 1 19 9304 1 1 15 LYS CA C 7.863 3.726 1.297 1.00 . A A . 15 LYS CA 1 1 19 9305 1 1 15 LYS CB C 8.217 4.145 2.726 1.00 . A A . 15 LYS CB 1 1 19 9306 1 1 15 LYS CD C 7.975 6.629 3.018 1.00 . A A . 15 LYS CD 1 1 19 9307 1 1 15 LYS CE C 8.707 7.922 3.338 1.00 . A A . 15 LYS CE 1 1 19 9308 1 1 15 LYS CG C 8.945 5.477 2.807 1.00 . A A . 15 LYS CG 1 1 19 9309 1 1 15 LYS H H 5.845 4.079 1.827 1.00 . A A . 15 LYS H 1 1 19 9310 1 1 15 LYS HA H 8.359 4.386 0.600 1.00 . A A . 15 LYS HA 1 1 19 9311 1 1 15 LYS HB2 H 7.307 4.221 3.301 1.00 . A A . 15 LYS HB2 1 1 19 9312 1 1 15 LYS HB3 H 8.849 3.388 3.167 1.00 . A A . 15 LYS HB3 1 1 19 9313 1 1 15 LYS HD2 H 7.395 6.769 2.118 1.00 . A A . 15 LYS HD2 1 1 19 9314 1 1 15 LYS HD3 H 7.316 6.385 3.839 1.00 . A A . 15 LYS HD3 1 1 19 9315 1 1 15 LYS HE2 H 8.135 8.474 4.068 1.00 . A A . 15 LYS HE2 1 1 19 9316 1 1 15 LYS HE3 H 9.676 7.679 3.749 1.00 . A A . 15 LYS HE3 1 1 19 9317 1 1 15 LYS HG2 H 9.639 5.448 3.633 1.00 . A A . 15 LYS HG2 1 1 19 9318 1 1 15 LYS HG3 H 9.485 5.638 1.885 1.00 . A A . 15 LYS HG3 1 1 19 9319 1 1 15 LYS HZ1 H 8.006 8.816 1.585 1.00 . A A . 15 LYS HZ1 1 1 19 9320 1 1 15 LYS HZ2 H 9.636 8.371 1.522 1.00 . A A . 15 LYS HZ2 1 1 19 9321 1 1 15 LYS HZ3 H 9.167 9.733 2.406 1.00 . A A . 15 LYS HZ3 1 1 19 9322 1 1 15 LYS N N 6.429 3.834 1.079 1.00 . A A . 15 LYS N 1 1 19 9323 1 1 15 LYS NZ N 8.892 8.769 2.127 1.00 . A A . 15 LYS NZ 1 1 19 9324 1 1 15 LYS O O 9.306 2.065 0.334 1.00 . A A . 15 LYS O 1 1 19 9325 1 1 16 GLN C C 7.631 -0.547 0.020 1.00 . A A . 16 GLN C 1 1 19 9326 1 1 16 GLN CA C 7.927 -0.075 1.442 1.00 . A A . 16 GLN CA 1 1 19 9327 1 1 16 GLN CB C 7.144 -0.924 2.445 1.00 . A A . 16 GLN CB 1 1 19 9328 1 1 16 GLN CD C 7.706 -2.340 4.460 1.00 . A A . 16 GLN CD 1 1 19 9329 1 1 16 GLN CG C 7.927 -2.114 2.977 1.00 . A A . 16 GLN CG 1 1 19 9330 1 1 16 GLN H H 6.823 1.584 2.161 1.00 . A A . 16 GLN H 1 1 19 9331 1 1 16 GLN HA H 8.984 -0.193 1.633 1.00 . A A . 16 GLN HA 1 1 19 9332 1 1 16 GLN HB2 H 6.863 -0.302 3.283 1.00 . A A . 16 GLN HB2 1 1 19 9333 1 1 16 GLN HB3 H 6.250 -1.293 1.965 1.00 . A A . 16 GLN HB3 1 1 19 9334 1 1 16 GLN HE21 H 8.183 -0.449 4.846 1.00 . A A . 16 GLN HE21 1 1 19 9335 1 1 16 GLN HE22 H 7.772 -1.415 6.218 1.00 . A A . 16 GLN HE22 1 1 19 9336 1 1 16 GLN HG2 H 7.617 -2.999 2.443 1.00 . A A . 16 GLN HG2 1 1 19 9337 1 1 16 GLN HG3 H 8.979 -1.940 2.807 1.00 . A A . 16 GLN HG3 1 1 19 9338 1 1 16 GLN N N 7.601 1.336 1.612 1.00 . A A . 16 GLN N 1 1 19 9339 1 1 16 GLN NE2 N 7.907 -1.297 5.255 1.00 . A A . 16 GLN NE2 1 1 19 9340 1 1 16 GLN O O 8.481 -1.148 -0.636 1.00 . A A . 16 GLN O 1 1 19 9341 1 1 16 GLN OE1 O 7.358 -3.442 4.885 1.00 . A A . 16 GLN OE1 1 1 19 9342 1 1 17 THR C C 6.700 0.129 -2.856 1.00 . A A . 17 THR C 1 1 19 9343 1 1 17 THR CA C 5.990 -0.682 -1.780 1.00 . A A . 17 THR CA 1 1 19 9344 1 1 17 THR CB C 4.473 -0.521 -1.917 1.00 . A A . 17 THR CB 1 1 19 9345 1 1 17 THR CG2 C 3.965 -0.709 -3.331 1.00 . A A . 17 THR CG2 1 1 19 9346 1 1 17 THR H H 5.779 0.200 0.126 1.00 . A A . 17 THR H 1 1 19 9347 1 1 17 THR HA H 6.243 -1.717 -1.908 1.00 . A A . 17 THR HA 1 1 19 9348 1 1 17 THR HB H 4.198 0.473 -1.597 1.00 . A A . 17 THR HB 1 1 19 9349 1 1 17 THR HG1 H 4.220 -1.490 -0.233 1.00 . A A . 17 THR HG1 1 1 19 9350 1 1 17 THR HG21 H 2.904 -0.506 -3.364 1.00 . A A . 17 THR HG21 1 1 19 9351 1 1 17 THR HG22 H 4.147 -1.724 -3.647 1.00 . A A . 17 THR HG22 1 1 19 9352 1 1 17 THR HG23 H 4.481 -0.029 -3.992 1.00 . A A . 17 THR HG23 1 1 19 9353 1 1 17 THR N N 6.413 -0.278 -0.445 1.00 . A A . 17 THR N 1 1 19 9354 1 1 17 THR O O 7.444 -0.413 -3.673 1.00 . A A . 17 THR O 1 1 19 9355 1 1 17 THR OG1 O 3.796 -1.455 -1.094 1.00 . A A . 17 THR OG1 1 1 19 9356 1 1 18 GLY C C 6.003 3.091 -4.587 1.00 . A A . 18 GLY C 1 1 19 9357 1 1 18 GLY CA C 7.038 2.303 -3.820 1.00 . A A . 18 GLY CA 1 1 19 9358 1 1 18 GLY H H 5.850 1.786 -2.191 1.00 . A A . 18 GLY H 1 1 19 9359 1 1 18 GLY HA2 H 7.698 2.984 -3.327 1.00 . A A . 18 GLY HA2 1 1 19 9360 1 1 18 GLY HA3 H 7.598 1.709 -4.507 1.00 . A A . 18 GLY HA3 1 1 19 9361 1 1 18 GLY N N 6.447 1.426 -2.852 1.00 . A A . 18 GLY N 1 1 19 9362 1 1 18 GLY O O 5.337 3.963 -4.032 1.00 . A A . 18 GLY O 1 1 19 9363 1 1 19 CYS C C 3.725 4.003 -6.061 1.00 . A A . 19 CYS C 1 1 19 9364 1 1 19 CYS CA C 4.954 3.429 -6.776 1.00 . A A . 19 CYS CA 1 1 19 9365 1 1 19 CYS CB C 4.524 2.474 -7.861 1.00 . A A . 19 CYS CB 1 1 19 9366 1 1 19 CYS H H 6.473 2.087 -6.224 1.00 . A A . 19 CYS H 1 1 19 9367 1 1 19 CYS HA H 5.479 4.219 -7.255 1.00 . A A . 19 CYS HA 1 1 19 9368 1 1 19 CYS HB2 H 3.615 2.842 -8.294 1.00 . A A . 19 CYS HB2 1 1 19 9369 1 1 19 CYS HB3 H 5.293 2.467 -8.611 1.00 . A A . 19 CYS HB3 1 1 19 9370 1 1 19 CYS N N 5.891 2.777 -5.870 1.00 . A A . 19 CYS N 1 1 19 9371 1 1 19 CYS O O 3.246 3.438 -5.077 1.00 . A A . 19 CYS O 1 1 19 9372 1 1 19 CYS SG S 4.244 0.756 -7.314 1.00 . A A . 19 CYS SG 1 1 19 9373 1 1 20 PRO C C 0.812 4.906 -5.809 1.00 . A A . 20 PRO C 1 1 19 9374 1 1 20 PRO CA C 2.035 5.813 -5.954 1.00 . A A . 20 PRO CA 1 1 19 9375 1 1 20 PRO CB C 1.734 6.947 -6.938 1.00 . A A . 20 PRO CB 1 1 19 9376 1 1 20 PRO CD C 3.724 5.885 -7.716 1.00 . A A . 20 PRO CD 1 1 19 9377 1 1 20 PRO CG C 3.028 7.213 -7.621 1.00 . A A . 20 PRO CG 1 1 19 9378 1 1 20 PRO HA H 2.277 6.234 -4.990 1.00 . A A . 20 PRO HA 1 1 19 9379 1 1 20 PRO HB2 H 0.975 6.627 -7.638 1.00 . A A . 20 PRO HB2 1 1 19 9380 1 1 20 PRO HB3 H 1.388 7.815 -6.396 1.00 . A A . 20 PRO HB3 1 1 19 9381 1 1 20 PRO HD2 H 3.461 5.386 -8.638 1.00 . A A . 20 PRO HD2 1 1 19 9382 1 1 20 PRO HD3 H 4.793 6.014 -7.645 1.00 . A A . 20 PRO HD3 1 1 19 9383 1 1 20 PRO HG2 H 2.847 7.614 -8.608 1.00 . A A . 20 PRO HG2 1 1 19 9384 1 1 20 PRO HG3 H 3.618 7.904 -7.037 1.00 . A A . 20 PRO HG3 1 1 19 9385 1 1 20 PRO N N 3.205 5.144 -6.550 1.00 . A A . 20 PRO N 1 1 19 9386 1 1 20 PRO O O -0.133 5.247 -5.099 1.00 . A A . 20 PRO O 1 1 19 9387 1 1 21 TYR C C -0.396 2.181 -5.057 1.00 . A A . 21 TYR C 1 1 19 9388 1 1 21 TYR CA C -0.291 2.841 -6.431 1.00 . A A . 21 TYR CA 1 1 19 9389 1 1 21 TYR CB C -0.127 1.775 -7.512 1.00 . A A . 21 TYR CB 1 1 19 9390 1 1 21 TYR CD1 C 0.567 3.416 -9.305 1.00 . A A . 21 TYR CD1 1 1 19 9391 1 1 21 TYR CD2 C 1.737 1.344 -9.165 1.00 . A A . 21 TYR CD2 1 1 19 9392 1 1 21 TYR CE1 C 1.357 3.794 -10.374 1.00 . A A . 21 TYR CE1 1 1 19 9393 1 1 21 TYR CE2 C 2.530 1.715 -10.234 1.00 . A A . 21 TYR CE2 1 1 19 9394 1 1 21 TYR CG C 0.744 2.187 -8.683 1.00 . A A . 21 TYR CG 1 1 19 9395 1 1 21 TYR CZ C 2.337 2.940 -10.835 1.00 . A A . 21 TYR CZ 1 1 19 9396 1 1 21 TYR H H 1.576 3.534 -7.049 1.00 . A A . 21 TYR H 1 1 19 9397 1 1 21 TYR HA H -1.196 3.396 -6.622 1.00 . A A . 21 TYR HA 1 1 19 9398 1 1 21 TYR HB2 H 0.306 0.891 -7.074 1.00 . A A . 21 TYR HB2 1 1 19 9399 1 1 21 TYR HB3 H -1.089 1.542 -7.896 1.00 . A A . 21 TYR HB3 1 1 19 9400 1 1 21 TYR HD1 H -0.201 4.084 -8.942 1.00 . A A . 21 TYR HD1 1 1 19 9401 1 1 21 TYR HD2 H 1.887 0.385 -8.692 1.00 . A A . 21 TYR HD2 1 1 19 9402 1 1 21 TYR HE1 H 1.205 4.755 -10.845 1.00 . A A . 21 TYR HE1 1 1 19 9403 1 1 21 TYR HE2 H 3.298 1.045 -10.595 1.00 . A A . 21 TYR HE2 1 1 19 9404 1 1 21 TYR HH H 4.042 3.106 -11.707 1.00 . A A . 21 TYR HH 1 1 19 9405 1 1 21 TYR N N 0.819 3.762 -6.487 1.00 . A A . 21 TYR N 1 1 19 9406 1 1 21 TYR O O 0.543 2.224 -4.262 1.00 . A A . 21 TYR O 1 1 19 9407 1 1 21 TYR OH O 3.125 3.313 -11.900 1.00 . A A . 21 TYR OH 1 1 19 9408 1 1 22 GLY C C -2.997 0.020 -3.531 1.00 . A A . 22 GLY C 1 1 19 9409 1 1 22 GLY CA C -1.772 0.913 -3.513 1.00 . A A . 22 GLY CA 1 1 19 9410 1 1 22 GLY H H -2.259 1.577 -5.465 1.00 . A A . 22 GLY H 1 1 19 9411 1 1 22 GLY HA2 H -0.911 0.320 -3.272 1.00 . A A . 22 GLY HA2 1 1 19 9412 1 1 22 GLY HA3 H -1.902 1.665 -2.750 1.00 . A A . 22 GLY HA3 1 1 19 9413 1 1 22 GLY N N -1.550 1.575 -4.790 1.00 . A A . 22 GLY N 1 1 19 9414 1 1 22 GLY O O -3.903 0.227 -4.337 1.00 . A A . 22 GLY O 1 1 19 9415 1 1 23 LYS C C -5.055 -1.488 -1.352 1.00 . A A . 23 LYS C 1 1 19 9416 1 1 23 LYS CA C -4.198 -1.850 -2.559 1.00 . A A . 23 LYS CA 1 1 19 9417 1 1 23 LYS CB C -3.751 -3.314 -2.481 1.00 . A A . 23 LYS CB 1 1 19 9418 1 1 23 LYS CD C -4.227 -5.525 -3.573 1.00 . A A . 23 LYS CD 1 1 19 9419 1 1 23 LYS CE C -3.058 -6.283 -2.965 1.00 . A A . 23 LYS CE 1 1 19 9420 1 1 23 LYS CG C -3.885 -4.061 -3.797 1.00 . A A . 23 LYS CG 1 1 19 9421 1 1 23 LYS H H -2.316 -1.081 -1.987 1.00 . A A . 23 LYS H 1 1 19 9422 1 1 23 LYS HA H -4.777 -1.706 -3.455 1.00 . A A . 23 LYS HA 1 1 19 9423 1 1 23 LYS HB2 H -2.715 -3.346 -2.178 1.00 . A A . 23 LYS HB2 1 1 19 9424 1 1 23 LYS HB3 H -4.349 -3.823 -1.740 1.00 . A A . 23 LYS HB3 1 1 19 9425 1 1 23 LYS HD2 H -5.072 -5.590 -2.905 1.00 . A A . 23 LYS HD2 1 1 19 9426 1 1 23 LYS HD3 H -4.482 -5.975 -4.522 1.00 . A A . 23 LYS HD3 1 1 19 9427 1 1 23 LYS HE2 H -2.153 -6.001 -3.484 1.00 . A A . 23 LYS HE2 1 1 19 9428 1 1 23 LYS HE3 H -2.974 -6.013 -1.923 1.00 . A A . 23 LYS HE3 1 1 19 9429 1 1 23 LYS HG2 H -4.670 -3.604 -4.381 1.00 . A A . 23 LYS HG2 1 1 19 9430 1 1 23 LYS HG3 H -2.951 -3.996 -4.334 1.00 . A A . 23 LYS HG3 1 1 19 9431 1 1 23 LYS HZ1 H -2.749 -8.117 -3.916 1.00 . A A . 23 LYS HZ1 1 1 19 9432 1 1 23 LYS HZ2 H -4.247 -7.991 -3.142 1.00 . A A . 23 LYS HZ2 1 1 19 9433 1 1 23 LYS HZ3 H -2.843 -8.226 -2.230 1.00 . A A . 23 LYS HZ3 1 1 19 9434 1 1 23 LYS N N -3.048 -0.964 -2.629 1.00 . A A . 23 LYS N 1 1 19 9435 1 1 23 LYS NZ N -3.236 -7.758 -3.071 1.00 . A A . 23 LYS NZ 1 1 19 9436 1 1 23 LYS O O -5.891 -2.273 -0.905 1.00 . A A . 23 LYS O 1 1 19 9437 1 1 24 CYS C C -6.959 0.654 -0.050 1.00 . A A . 24 CYS C 1 1 19 9438 1 1 24 CYS CA C -5.553 0.204 0.331 1.00 . A A . 24 CYS CA 1 1 19 9439 1 1 24 CYS CB C -4.776 1.354 0.981 1.00 . A A . 24 CYS CB 1 1 19 9440 1 1 24 CYS H H -4.143 0.287 -1.230 1.00 . A A . 24 CYS H 1 1 19 9441 1 1 24 CYS HA H -5.632 -0.607 1.039 1.00 . A A . 24 CYS HA 1 1 19 9442 1 1 24 CYS HB2 H -5.181 1.543 1.961 1.00 . A A . 24 CYS HB2 1 1 19 9443 1 1 24 CYS HB3 H -3.741 1.064 1.079 1.00 . A A . 24 CYS HB3 1 1 19 9444 1 1 24 CYS N N -4.827 -0.286 -0.827 1.00 . A A . 24 CYS N 1 1 19 9445 1 1 24 CYS O O -7.185 1.183 -1.138 1.00 . A A . 24 CYS O 1 1 19 9446 1 1 24 CYS SG S -4.821 2.921 0.050 1.00 . A A . 24 CYS SG 1 1 19 9447 1 1 25 MET C C -9.978 1.069 1.970 1.00 . A A . 25 MET C 1 1 19 9448 1 1 25 MET CA C -9.290 0.804 0.644 1.00 . A A . 25 MET CA 1 1 19 9449 1 1 25 MET CB C -10.024 -0.301 -0.117 1.00 . A A . 25 MET CB 1 1 19 9450 1 1 25 MET CE C -10.275 -3.675 -1.452 1.00 . A A . 25 MET CE 1 1 19 9451 1 1 25 MET CG C -9.744 -1.697 0.415 1.00 . A A . 25 MET CG 1 1 19 9452 1 1 25 MET H H -7.646 0.006 1.704 1.00 . A A . 25 MET H 1 1 19 9453 1 1 25 MET HA H -9.311 1.711 0.058 1.00 . A A . 25 MET HA 1 1 19 9454 1 1 25 MET HB2 H -11.087 -0.122 -0.053 1.00 . A A . 25 MET HB2 1 1 19 9455 1 1 25 MET HB3 H -9.725 -0.268 -1.155 1.00 . A A . 25 MET HB3 1 1 19 9456 1 1 25 MET HE1 H -10.775 -3.352 -2.352 1.00 . A A . 25 MET HE1 1 1 19 9457 1 1 25 MET HE2 H -10.364 -4.747 -1.355 1.00 . A A . 25 MET HE2 1 1 19 9458 1 1 25 MET HE3 H -9.230 -3.405 -1.503 1.00 . A A . 25 MET HE3 1 1 19 9459 1 1 25 MET HG2 H -8.802 -2.039 0.012 1.00 . A A . 25 MET HG2 1 1 19 9460 1 1 25 MET HG3 H -9.677 -1.649 1.493 1.00 . A A . 25 MET HG3 1 1 19 9461 1 1 25 MET N N -7.897 0.432 0.860 1.00 . A A . 25 MET N 1 1 19 9462 1 1 25 MET O O -9.628 0.480 2.993 1.00 . A A . 25 MET O 1 1 19 9463 1 1 25 MET SD S -11.027 -2.882 -0.033 1.00 . A A . 25 MET SD 1 1 19 9464 1 1 26 ASN C C -12.047 1.092 3.976 1.00 . A A . 26 ASN C 1 1 19 9465 1 1 26 ASN CA C -11.698 2.330 3.154 1.00 . A A . 26 ASN CA 1 1 19 9466 1 1 26 ASN CB C -12.987 3.094 2.825 1.00 . A A . 26 ASN CB 1 1 19 9467 1 1 26 ASN CG C -12.960 3.774 1.467 1.00 . A A . 26 ASN CG 1 1 19 9468 1 1 26 ASN H H -11.169 2.403 1.095 1.00 . A A . 26 ASN H 1 1 19 9469 1 1 26 ASN HA H -11.060 2.967 3.751 1.00 . A A . 26 ASN HA 1 1 19 9470 1 1 26 ASN HB2 H -13.813 2.403 2.843 1.00 . A A . 26 ASN HB2 1 1 19 9471 1 1 26 ASN HB3 H -13.146 3.850 3.580 1.00 . A A . 26 ASN HB3 1 1 19 9472 1 1 26 ASN HD21 H -13.628 2.115 0.596 1.00 . A A . 26 ASN HD21 1 1 19 9473 1 1 26 ASN HD22 H -13.343 3.454 -0.458 1.00 . A A . 26 ASN HD22 1 1 19 9474 1 1 26 ASN N N -10.953 1.968 1.945 1.00 . A A . 26 ASN N 1 1 19 9475 1 1 26 ASN ND2 N -13.350 3.040 0.431 1.00 . A A . 26 ASN ND2 1 1 19 9476 1 1 26 ASN O O -12.753 0.199 3.508 1.00 . A A . 26 ASN O 1 1 19 9477 1 1 26 ASN OD1 O -12.594 4.943 1.352 1.00 . A A . 26 ASN OD1 1 1 19 9478 1 1 27 ARG C C -10.932 -1.268 5.730 1.00 . A A . 27 ARG C 1 1 19 9479 1 1 27 ARG CA C -11.786 -0.065 6.108 1.00 . A A . 27 ARG CA 1 1 19 9480 1 1 27 ARG CB C -13.269 -0.450 6.113 1.00 . A A . 27 ARG CB 1 1 19 9481 1 1 27 ARG CD C -14.331 -2.110 7.675 1.00 . A A . 27 ARG CD 1 1 19 9482 1 1 27 ARG CG C -13.829 -0.686 7.506 1.00 . A A . 27 ARG CG 1 1 19 9483 1 1 27 ARG CZ C -14.994 -2.269 10.043 1.00 . A A . 27 ARG CZ 1 1 19 9484 1 1 27 ARG H H -10.988 1.797 5.505 1.00 . A A . 27 ARG H 1 1 19 9485 1 1 27 ARG HA H -11.506 0.254 7.100 1.00 . A A . 27 ARG HA 1 1 19 9486 1 1 27 ARG HB2 H -13.836 0.345 5.650 1.00 . A A . 27 ARG HB2 1 1 19 9487 1 1 27 ARG HB3 H -13.397 -1.355 5.537 1.00 . A A . 27 ARG HB3 1 1 19 9488 1 1 27 ARG HD2 H -14.788 -2.429 6.750 1.00 . A A . 27 ARG HD2 1 1 19 9489 1 1 27 ARG HD3 H -13.490 -2.750 7.899 1.00 . A A . 27 ARG HD3 1 1 19 9490 1 1 27 ARG HE H -16.258 -2.265 8.500 1.00 . A A . 27 ARG HE 1 1 19 9491 1 1 27 ARG HG2 H -13.051 -0.501 8.232 1.00 . A A . 27 ARG HG2 1 1 19 9492 1 1 27 ARG HG3 H -14.648 -0.002 7.674 1.00 . A A . 27 ARG HG3 1 1 19 9493 1 1 27 ARG HH11 H -12.998 -2.138 9.738 1.00 . A A . 27 ARG HH11 1 1 19 9494 1 1 27 ARG HH12 H -13.490 -2.251 11.395 1.00 . A A . 27 ARG HH12 1 1 19 9495 1 1 27 ARG HH21 H -16.907 -2.411 10.677 1.00 . A A . 27 ARG HH21 1 1 19 9496 1 1 27 ARG HH22 H -15.709 -2.406 11.928 1.00 . A A . 27 ARG HH22 1 1 19 9497 1 1 27 ARG N N -11.543 1.054 5.202 1.00 . A A . 27 ARG N 1 1 19 9498 1 1 27 ARG NE N -15.312 -2.222 8.752 1.00 . A A . 27 ARG NE 1 1 19 9499 1 1 27 ARG NH1 N -13.722 -2.215 10.422 1.00 . A A . 27 ARG NH1 1 1 19 9500 1 1 27 ARG NH2 N -15.948 -2.370 10.957 1.00 . A A . 27 ARG NH2 1 1 19 9501 1 1 27 ARG O O -11.317 -2.413 5.965 1.00 . A A . 27 ARG O 1 1 19 9502 1 1 28 LYS C C -7.695 -1.520 3.910 1.00 . A A . 28 LYS C 1 1 19 9503 1 1 28 LYS CA C -8.849 -2.065 4.742 1.00 . A A . 28 LYS CA 1 1 19 9504 1 1 28 LYS CB C -9.594 -3.149 3.957 1.00 . A A . 28 LYS CB 1 1 19 9505 1 1 28 LYS CD C -8.778 -5.449 4.552 1.00 . A A . 28 LYS CD 1 1 19 9506 1 1 28 LYS CE C -9.150 -6.779 5.190 1.00 . A A . 28 LYS CE 1 1 19 9507 1 1 28 LYS CG C -9.865 -4.407 4.766 1.00 . A A . 28 LYS CG 1 1 19 9508 1 1 28 LYS H H -9.518 -0.062 4.996 1.00 . A A . 28 LYS H 1 1 19 9509 1 1 28 LYS HA H -8.439 -2.501 5.641 1.00 . A A . 28 LYS HA 1 1 19 9510 1 1 28 LYS HB2 H -10.542 -2.751 3.626 1.00 . A A . 28 LYS HB2 1 1 19 9511 1 1 28 LYS HB3 H -9.007 -3.422 3.093 1.00 . A A . 28 LYS HB3 1 1 19 9512 1 1 28 LYS HD2 H -8.637 -5.597 3.493 1.00 . A A . 28 LYS HD2 1 1 19 9513 1 1 28 LYS HD3 H -7.859 -5.093 4.994 1.00 . A A . 28 LYS HD3 1 1 19 9514 1 1 28 LYS HE2 H -10.221 -6.903 5.135 1.00 . A A . 28 LYS HE2 1 1 19 9515 1 1 28 LYS HE3 H -8.668 -7.574 4.640 1.00 . A A . 28 LYS HE3 1 1 19 9516 1 1 28 LYS HG2 H -9.901 -4.150 5.813 1.00 . A A . 28 LYS HG2 1 1 19 9517 1 1 28 LYS HG3 H -10.814 -4.822 4.461 1.00 . A A . 28 LYS HG3 1 1 19 9518 1 1 28 LYS HZ1 H -9.257 -7.595 7.110 1.00 . A A . 28 LYS HZ1 1 1 19 9519 1 1 28 LYS HZ2 H -8.906 -5.941 7.087 1.00 . A A . 28 LYS HZ2 1 1 19 9520 1 1 28 LYS HZ3 H -7.710 -7.063 6.676 1.00 . A A . 28 LYS HZ3 1 1 19 9521 1 1 28 LYS N N -9.767 -0.998 5.149 1.00 . A A . 28 LYS N 1 1 19 9522 1 1 28 LYS NZ N -8.727 -6.849 6.616 1.00 . A A . 28 LYS NZ 1 1 19 9523 1 1 28 LYS O O -7.755 -1.493 2.682 1.00 . A A . 28 LYS O 1 1 19 9524 1 1 29 CYS C C -4.543 -1.681 3.470 1.00 . A A . 29 CYS C 1 1 19 9525 1 1 29 CYS CA C -5.456 -0.564 3.946 1.00 . A A . 29 CYS CA 1 1 19 9526 1 1 29 CYS CB C -4.697 0.332 4.906 1.00 . A A . 29 CYS CB 1 1 19 9527 1 1 29 CYS H H -6.660 -1.158 5.567 1.00 . A A . 29 CYS H 1 1 19 9528 1 1 29 CYS HA H -5.773 0.017 3.115 1.00 . A A . 29 CYS HA 1 1 19 9529 1 1 29 CYS HB2 H -5.399 0.813 5.549 1.00 . A A . 29 CYS HB2 1 1 19 9530 1 1 29 CYS HB3 H -4.039 -0.280 5.489 1.00 . A A . 29 CYS HB3 1 1 19 9531 1 1 29 CYS N N -6.641 -1.099 4.596 1.00 . A A . 29 CYS N 1 1 19 9532 1 1 29 CYS O O -4.642 -2.815 3.939 1.00 . A A . 29 CYS O 1 1 19 9533 1 1 29 CYS SG S -3.692 1.638 4.129 1.00 . A A . 29 CYS SG 1 1 19 9534 1 1 30 LYS C C -2.079 -1.833 0.701 1.00 . A A . 30 LYS C 1 1 19 9535 1 1 30 LYS CA C -2.691 -2.319 2.010 1.00 . A A . 30 LYS CA 1 1 19 9536 1 1 30 LYS CB C -3.356 -3.683 1.784 1.00 . A A . 30 LYS CB 1 1 19 9537 1 1 30 LYS CD C -5.757 -4.402 2.008 1.00 . A A . 30 LYS CD 1 1 19 9538 1 1 30 LYS CE C -6.781 -5.081 1.113 1.00 . A A . 30 LYS CE 1 1 19 9539 1 1 30 LYS CG C -4.755 -3.595 1.195 1.00 . A A . 30 LYS CG 1 1 19 9540 1 1 30 LYS H H -3.614 -0.423 2.232 1.00 . A A . 30 LYS H 1 1 19 9541 1 1 30 LYS HA H -1.900 -2.434 2.735 1.00 . A A . 30 LYS HA 1 1 19 9542 1 1 30 LYS HB2 H -2.741 -4.259 1.109 1.00 . A A . 30 LYS HB2 1 1 19 9543 1 1 30 LYS HB3 H -3.416 -4.201 2.729 1.00 . A A . 30 LYS HB3 1 1 19 9544 1 1 30 LYS HD2 H -5.226 -5.157 2.567 1.00 . A A . 30 LYS HD2 1 1 19 9545 1 1 30 LYS HD3 H -6.268 -3.739 2.689 1.00 . A A . 30 LYS HD3 1 1 19 9546 1 1 30 LYS HE2 H -6.263 -5.571 0.303 1.00 . A A . 30 LYS HE2 1 1 19 9547 1 1 30 LYS HE3 H -7.317 -5.816 1.695 1.00 . A A . 30 LYS HE3 1 1 19 9548 1 1 30 LYS HG2 H -5.068 -2.562 1.183 1.00 . A A . 30 LYS HG2 1 1 19 9549 1 1 30 LYS HG3 H -4.734 -3.978 0.186 1.00 . A A . 30 LYS HG3 1 1 19 9550 1 1 30 LYS HZ1 H -8.617 -4.602 0.239 1.00 . A A . 30 LYS HZ1 1 1 19 9551 1 1 30 LYS HZ2 H -7.338 -3.620 -0.273 1.00 . A A . 30 LYS HZ2 1 1 19 9552 1 1 30 LYS HZ3 H -8.012 -3.399 1.263 1.00 . A A . 30 LYS HZ3 1 1 19 9553 1 1 30 LYS N N -3.644 -1.348 2.548 1.00 . A A . 30 LYS N 1 1 19 9554 1 1 30 LYS NZ N -7.755 -4.108 0.546 1.00 . A A . 30 LYS NZ 1 1 19 9555 1 1 30 LYS O O -2.633 -2.058 -0.368 1.00 . A A . 30 LYS O 1 1 19 9556 1 1 31 CYS C C -0.184 -1.679 -1.508 1.00 . A A . 31 CYS C 1 1 19 9557 1 1 31 CYS CA C -0.201 -0.675 -0.376 1.00 . A A . 31 CYS CA 1 1 19 9558 1 1 31 CYS CB C 1.238 -0.288 -0.010 1.00 . A A . 31 CYS CB 1 1 19 9559 1 1 31 CYS H H -0.539 -1.047 1.689 1.00 . A A . 31 CYS H 1 1 19 9560 1 1 31 CYS HA H -0.697 0.203 -0.748 1.00 . A A . 31 CYS HA 1 1 19 9561 1 1 31 CYS HB2 H 1.852 -0.359 -0.895 1.00 . A A . 31 CYS HB2 1 1 19 9562 1 1 31 CYS HB3 H 1.245 0.732 0.338 1.00 . A A . 31 CYS HB3 1 1 19 9563 1 1 31 CYS N N -0.922 -1.182 0.800 1.00 . A A . 31 CYS N 1 1 19 9564 1 1 31 CYS O O -0.692 -2.789 -1.405 1.00 . A A . 31 CYS O 1 1 19 9565 1 1 31 CYS SG S 2.018 -1.322 1.278 1.00 . A A . 31 CYS SG 1 1 19 9566 1 1 32 ASN C C 1.673 -2.939 -3.792 1.00 . A A . 32 ASN C 1 1 19 9567 1 1 32 ASN CA C 0.460 -2.021 -3.816 1.00 . A A . 32 ASN CA 1 1 19 9568 1 1 32 ASN CB C 0.555 -1.089 -5.005 1.00 . A A . 32 ASN CB 1 1 19 9569 1 1 32 ASN CG C 0.010 -1.693 -6.283 1.00 . A A . 32 ASN CG 1 1 19 9570 1 1 32 ASN H H 0.701 -0.308 -2.608 1.00 . A A . 32 ASN H 1 1 19 9571 1 1 32 ASN HA H -0.428 -2.613 -3.911 1.00 . A A . 32 ASN HA 1 1 19 9572 1 1 32 ASN HB2 H 0.004 -0.196 -4.787 1.00 . A A . 32 ASN HB2 1 1 19 9573 1 1 32 ASN HB3 H 1.585 -0.836 -5.152 1.00 . A A . 32 ASN HB3 1 1 19 9574 1 1 32 ASN HD21 H -1.715 -2.103 -5.383 1.00 . A A . 32 ASN HD21 1 1 19 9575 1 1 32 ASN HD22 H -1.607 -2.566 -7.044 1.00 . A A . 32 ASN HD22 1 1 19 9576 1 1 32 ASN N N 0.369 -1.230 -2.605 1.00 . A A . 32 ASN N 1 1 19 9577 1 1 32 ASN ND2 N -1.229 -2.169 -6.232 1.00 . A A . 32 ASN ND2 1 1 19 9578 1 1 32 ASN O O 2.458 -2.934 -2.844 1.00 . A A . 32 ASN O 1 1 19 9579 1 1 32 ASN OD1 O 0.694 -1.733 -7.306 1.00 . A A . 32 ASN OD1 1 1 19 9580 1 1 33 ARG C C 3.871 -4.156 -6.094 1.00 . A A . 33 ARG C 1 1 19 9581 1 1 33 ARG CA C 2.938 -4.636 -4.992 1.00 . A A . 33 ARG CA 1 1 19 9582 1 1 33 ARG CB C 2.439 -6.049 -5.299 1.00 . A A . 33 ARG CB 1 1 19 9583 1 1 33 ARG CD C 3.106 -7.132 -3.132 1.00 . A A . 33 ARG CD 1 1 19 9584 1 1 33 ARG CG C 3.266 -7.143 -4.644 1.00 . A A . 33 ARG CG 1 1 19 9585 1 1 33 ARG CZ C 1.998 -9.268 -2.602 1.00 . A A . 33 ARG CZ 1 1 19 9586 1 1 33 ARG H H 1.156 -3.654 -5.573 1.00 . A A . 33 ARG H 1 1 19 9587 1 1 33 ARG HA H 3.481 -4.643 -4.059 1.00 . A A . 33 ARG HA 1 1 19 9588 1 1 33 ARG HB2 H 1.420 -6.142 -4.953 1.00 . A A . 33 ARG HB2 1 1 19 9589 1 1 33 ARG HB3 H 2.461 -6.203 -6.368 1.00 . A A . 33 ARG HB3 1 1 19 9590 1 1 33 ARG HD2 H 4.007 -7.523 -2.684 1.00 . A A . 33 ARG HD2 1 1 19 9591 1 1 33 ARG HD3 H 2.957 -6.113 -2.806 1.00 . A A . 33 ARG HD3 1 1 19 9592 1 1 33 ARG HE H 1.144 -7.470 -2.461 1.00 . A A . 33 ARG HE 1 1 19 9593 1 1 33 ARG HG2 H 2.945 -8.101 -5.022 1.00 . A A . 33 ARG HG2 1 1 19 9594 1 1 33 ARG HG3 H 4.307 -6.988 -4.888 1.00 . A A . 33 ARG HG3 1 1 19 9595 1 1 33 ARG HH11 H 3.916 -9.449 -3.217 1.00 . A A . 33 ARG HH11 1 1 19 9596 1 1 33 ARG HH12 H 3.115 -10.937 -2.838 1.00 . A A . 33 ARG HH12 1 1 19 9597 1 1 33 ARG HH21 H 0.088 -9.426 -1.961 1.00 . A A . 33 ARG HH21 1 1 19 9598 1 1 33 ARG HH22 H 0.942 -10.924 -2.125 1.00 . A A . 33 ARG HH22 1 1 19 9599 1 1 33 ARG N N 1.818 -3.715 -4.855 1.00 . A A . 33 ARG N 1 1 19 9600 1 1 33 ARG NE N 1.971 -7.941 -2.696 1.00 . A A . 33 ARG NE 1 1 19 9601 1 1 33 ARG NH1 N 3.101 -9.940 -2.912 1.00 . A A . 33 ARG NH1 1 1 19 9602 1 1 33 ARG NH2 N 0.921 -9.926 -2.196 1.00 . A A . 33 ARG NH2 1 1 19 9603 1 1 33 ARG O O 3.705 -4.502 -7.264 1.00 . A A . 33 ARG O 1 1 19 9604 1 1 34 CYS C C 7.068 -3.630 -6.719 1.00 . A A . 34 CYS C 1 1 19 9605 1 1 34 CYS CA C 5.800 -2.785 -6.650 1.00 . A A . 34 CYS CA 1 1 19 9606 1 1 34 CYS CB C 6.132 -1.361 -6.249 1.00 . A A . 34 CYS CB 1 1 19 9607 1 1 34 CYS H H 4.913 -3.097 -4.764 1.00 . A A . 34 CYS H 1 1 19 9608 1 1 34 CYS HA H 5.339 -2.764 -7.615 1.00 . A A . 34 CYS HA 1 1 19 9609 1 1 34 CYS HB2 H 5.434 -1.052 -5.494 1.00 . A A . 34 CYS HB2 1 1 19 9610 1 1 34 CYS HB3 H 7.126 -1.336 -5.846 1.00 . A A . 34 CYS HB3 1 1 19 9611 1 1 34 CYS N N 4.843 -3.341 -5.709 1.00 . A A . 34 CYS N 1 1 19 9612 1 1 34 CYS O O 7.509 -3.943 -7.845 1.00 . A A . 34 CYS O 1 1 19 9613 1 1 34 CYS OXT O 7.610 -3.972 -5.647 1.00 . A A . 34 CYS OXT 1 1 19 9614 1 1 34 CYS SG S 6.038 -0.153 -7.608 1.00 . A A . 34 CYS SG 1 1 20 9615 1 1 1 VAL C C -11.714 5.277 -3.613 1.00 . A A . 1 VAL C 1 1 20 9616 1 1 1 VAL CA C -11.167 6.294 -4.563 1.00 . A A . 1 VAL CA 1 1 20 9617 1 1 1 VAL CB C -11.551 5.864 -5.944 1.00 . A A . 1 VAL CB 1 1 20 9618 1 1 1 VAL CG1 C -13.064 5.829 -6.128 1.00 . A A . 1 VAL CG1 1 1 20 9619 1 1 1 VAL CG2 C -10.878 6.715 -7.010 1.00 . A A . 1 VAL CG2 1 1 20 9620 1 1 1 VAL H1 H -9.458 6.841 -3.533 1.00 . A A . 1 VAL H1 1 1 20 9621 1 1 1 VAL H2 H -9.359 7.043 -5.230 1.00 . A A . 1 VAL H2 1 1 20 9622 1 1 1 VAL H3 H -9.268 5.472 -4.549 1.00 . A A . 1 VAL H3 1 1 20 9623 1 1 1 VAL HA H -11.569 7.201 -4.309 1.00 . A A . 1 VAL HA 1 1 20 9624 1 1 1 VAL HB H -11.163 4.866 -6.005 1.00 . A A . 1 VAL HB 1 1 20 9625 1 1 1 VAL HG11 H -13.518 6.594 -5.517 1.00 . A A . 1 VAL HG11 1 1 20 9626 1 1 1 VAL HG12 H -13.440 4.861 -5.831 1.00 . A A . 1 VAL HG12 1 1 20 9627 1 1 1 VAL HG13 H -13.304 6.006 -7.166 1.00 . A A . 1 VAL HG13 1 1 20 9628 1 1 1 VAL HG21 H -10.658 7.691 -6.606 1.00 . A A . 1 VAL HG21 1 1 20 9629 1 1 1 VAL HG22 H -11.539 6.817 -7.859 1.00 . A A . 1 VAL HG22 1 1 20 9630 1 1 1 VAL HG23 H -9.961 6.239 -7.324 1.00 . A A . 1 VAL HG23 1 1 20 9631 1 1 1 VAL N N -9.678 6.423 -4.459 1.00 . A A . 1 VAL N 1 1 20 9632 1 1 1 VAL O O -12.854 4.816 -3.662 1.00 . A A . 1 VAL O 1 1 20 9633 1 1 2 SER C C -9.764 3.999 -0.812 1.00 . A A . 2 SER C 1 1 20 9634 1 1 2 SER CA C -11.005 4.031 -1.698 1.00 . A A . 2 SER CA 1 1 20 9635 1 1 2 SER CB C -11.283 2.635 -2.257 1.00 . A A . 2 SER CB 1 1 20 9636 1 1 2 SER H H -10.029 5.466 -2.932 1.00 . A A . 2 SER H 1 1 20 9637 1 1 2 SER HA H -11.849 4.347 -1.104 1.00 . A A . 2 SER HA 1 1 20 9638 1 1 2 SER HB2 H -10.619 2.441 -3.086 1.00 . A A . 2 SER HB2 1 1 20 9639 1 1 2 SER HB3 H -11.116 1.900 -1.483 1.00 . A A . 2 SER HB3 1 1 20 9640 1 1 2 SER HG H -12.715 2.985 -3.547 1.00 . A A . 2 SER HG 1 1 20 9641 1 1 2 SER N N -10.841 4.989 -2.787 1.00 . A A . 2 SER N 1 1 20 9642 1 1 2 SER O O -8.638 4.050 -1.303 1.00 . A A . 2 SER O 1 1 20 9643 1 1 2 SER OG O -12.621 2.524 -2.711 1.00 . A A . 2 SER OG 1 1 20 9644 1 1 3 CYS C C -9.394 3.959 2.881 1.00 . A A . 3 CYS C 1 1 20 9645 1 1 3 CYS CA C -8.886 3.873 1.464 1.00 . A A . 3 CYS CA 1 1 20 9646 1 1 3 CYS CB C -7.884 5.007 1.225 1.00 . A A . 3 CYS CB 1 1 20 9647 1 1 3 CYS H H -10.905 3.877 0.825 1.00 . A A . 3 CYS H 1 1 20 9648 1 1 3 CYS HA H -8.368 2.939 1.361 1.00 . A A . 3 CYS HA 1 1 20 9649 1 1 3 CYS HB2 H -8.129 5.503 0.321 1.00 . A A . 3 CYS HB2 1 1 20 9650 1 1 3 CYS HB3 H -7.947 5.714 2.039 1.00 . A A . 3 CYS HB3 1 1 20 9651 1 1 3 CYS N N -9.981 3.913 0.498 1.00 . A A . 3 CYS N 1 1 20 9652 1 1 3 CYS O O -10.576 3.776 3.169 1.00 . A A . 3 CYS O 1 1 20 9653 1 1 3 CYS SG S -6.150 4.457 1.108 1.00 . A A . 3 CYS SG 1 1 20 9654 1 1 4 THR C C -9.042 5.818 5.557 1.00 . A A . 4 THR C 1 1 20 9655 1 1 4 THR CA C -8.722 4.373 5.178 1.00 . A A . 4 THR CA 1 1 20 9656 1 1 4 THR CB C -7.520 3.877 5.984 1.00 . A A . 4 THR CB 1 1 20 9657 1 1 4 THR CG2 C -6.213 4.512 5.562 1.00 . A A . 4 THR CG2 1 1 20 9658 1 1 4 THR H H -7.547 4.367 3.401 1.00 . A A . 4 THR H 1 1 20 9659 1 1 4 THR HA H -9.576 3.757 5.411 1.00 . A A . 4 THR HA 1 1 20 9660 1 1 4 THR HB H -7.426 2.809 5.850 1.00 . A A . 4 THR HB 1 1 20 9661 1 1 4 THR HG1 H -8.588 3.886 7.626 1.00 . A A . 4 THR HG1 1 1 20 9662 1 1 4 THR HG21 H -5.943 4.161 4.577 1.00 . A A . 4 THR HG21 1 1 20 9663 1 1 4 THR HG22 H -5.437 4.244 6.264 1.00 . A A . 4 THR HG22 1 1 20 9664 1 1 4 THR HG23 H -6.324 5.587 5.542 1.00 . A A . 4 THR HG23 1 1 20 9665 1 1 4 THR N N -8.456 4.243 3.749 1.00 . A A . 4 THR N 1 1 20 9666 1 1 4 THR O O -8.871 6.219 6.708 1.00 . A A . 4 THR O 1 1 20 9667 1 1 4 THR OG1 O -7.698 4.138 7.365 1.00 . A A . 4 THR OG1 1 1 20 9668 1 1 5 GLY C C -8.754 8.742 5.558 1.00 . A A . 5 GLY C 1 1 20 9669 1 1 5 GLY CA C -9.856 7.984 4.841 1.00 . A A . 5 GLY CA 1 1 20 9670 1 1 5 GLY H H -9.635 6.223 3.690 1.00 . A A . 5 GLY H 1 1 20 9671 1 1 5 GLY HA2 H -10.057 8.472 3.899 1.00 . A A . 5 GLY HA2 1 1 20 9672 1 1 5 GLY HA3 H -10.750 8.016 5.446 1.00 . A A . 5 GLY HA3 1 1 20 9673 1 1 5 GLY N N -9.514 6.596 4.585 1.00 . A A . 5 GLY N 1 1 20 9674 1 1 5 GLY O O -9.020 9.718 6.261 1.00 . A A . 5 GLY O 1 1 20 9675 1 1 6 SER C C -5.276 9.235 5.001 1.00 . A A . 6 SER C 1 1 20 9676 1 1 6 SER CA C -6.373 8.941 6.018 1.00 . A A . 6 SER CA 1 1 20 9677 1 1 6 SER CB C -5.821 8.059 7.139 1.00 . A A . 6 SER CB 1 1 20 9678 1 1 6 SER H H -7.366 7.514 4.809 1.00 . A A . 6 SER H 1 1 20 9679 1 1 6 SER HA H -6.714 9.874 6.441 1.00 . A A . 6 SER HA 1 1 20 9680 1 1 6 SER HB2 H -5.041 7.424 6.744 1.00 . A A . 6 SER HB2 1 1 20 9681 1 1 6 SER HB3 H -5.413 8.686 7.919 1.00 . A A . 6 SER HB3 1 1 20 9682 1 1 6 SER HG H -7.629 7.765 7.832 1.00 . A A . 6 SER HG 1 1 20 9683 1 1 6 SER N N -7.515 8.296 5.381 1.00 . A A . 6 SER N 1 1 20 9684 1 1 6 SER O O -5.412 8.924 3.817 1.00 . A A . 6 SER O 1 1 20 9685 1 1 6 SER OG O -6.836 7.242 7.694 1.00 . A A . 6 SER OG 1 1 20 9686 1 1 7 LYS C C -1.750 9.676 5.200 1.00 . A A . 7 LYS C 1 1 20 9687 1 1 7 LYS CA C -3.064 10.171 4.604 1.00 . A A . 7 LYS CA 1 1 20 9688 1 1 7 LYS CB C -2.999 11.683 4.381 1.00 . A A . 7 LYS CB 1 1 20 9689 1 1 7 LYS CD C -1.793 12.566 6.401 1.00 . A A . 7 LYS CD 1 1 20 9690 1 1 7 LYS CE C -1.732 11.558 7.536 1.00 . A A . 7 LYS CE 1 1 20 9691 1 1 7 LYS CG C -3.119 12.492 5.661 1.00 . A A . 7 LYS CG 1 1 20 9692 1 1 7 LYS H H -4.138 10.055 6.424 1.00 . A A . 7 LYS H 1 1 20 9693 1 1 7 LYS HA H -3.221 9.682 3.654 1.00 . A A . 7 LYS HA 1 1 20 9694 1 1 7 LYS HB2 H -2.057 11.926 3.913 1.00 . A A . 7 LYS HB2 1 1 20 9695 1 1 7 LYS HB3 H -3.804 11.972 3.720 1.00 . A A . 7 LYS HB3 1 1 20 9696 1 1 7 LYS HD2 H -0.992 12.359 5.706 1.00 . A A . 7 LYS HD2 1 1 20 9697 1 1 7 LYS HD3 H -1.673 13.560 6.806 1.00 . A A . 7 LYS HD3 1 1 20 9698 1 1 7 LYS HE2 H -2.442 10.768 7.339 1.00 . A A . 7 LYS HE2 1 1 20 9699 1 1 7 LYS HE3 H -0.736 11.141 7.577 1.00 . A A . 7 LYS HE3 1 1 20 9700 1 1 7 LYS HG2 H -3.437 13.495 5.413 1.00 . A A . 7 LYS HG2 1 1 20 9701 1 1 7 LYS HG3 H -3.853 12.028 6.303 1.00 . A A . 7 LYS HG3 1 1 20 9702 1 1 7 LYS HZ1 H -2.574 11.506 9.447 1.00 . A A . 7 LYS HZ1 1 1 20 9703 1 1 7 LYS HZ2 H -2.639 13.027 8.711 1.00 . A A . 7 LYS HZ2 1 1 20 9704 1 1 7 LYS HZ3 H -1.176 12.454 9.339 1.00 . A A . 7 LYS HZ3 1 1 20 9705 1 1 7 LYS N N -4.188 9.835 5.471 1.00 . A A . 7 LYS N 1 1 20 9706 1 1 7 LYS NZ N -2.053 12.180 8.851 1.00 . A A . 7 LYS NZ 1 1 20 9707 1 1 7 LYS O O -0.692 10.261 4.966 1.00 . A A . 7 LYS O 1 1 20 9708 1 1 8 ASP C C -0.537 6.528 6.307 1.00 . A A . 8 ASP C 1 1 20 9709 1 1 8 ASP CA C -0.640 8.022 6.599 1.00 . A A . 8 ASP CA 1 1 20 9710 1 1 8 ASP CB C -0.676 8.256 8.110 1.00 . A A . 8 ASP CB 1 1 20 9711 1 1 8 ASP CG C 0.656 7.959 8.773 1.00 . A A . 8 ASP CG 1 1 20 9712 1 1 8 ASP H H -2.695 8.172 6.119 1.00 . A A . 8 ASP H 1 1 20 9713 1 1 8 ASP HA H 0.226 8.517 6.187 1.00 . A A . 8 ASP HA 1 1 20 9714 1 1 8 ASP HB2 H -0.930 9.288 8.302 1.00 . A A . 8 ASP HB2 1 1 20 9715 1 1 8 ASP HB3 H -1.427 7.616 8.549 1.00 . A A . 8 ASP HB3 1 1 20 9716 1 1 8 ASP N N -1.824 8.595 5.970 1.00 . A A . 8 ASP N 1 1 20 9717 1 1 8 ASP O O 0.037 5.770 7.090 1.00 . A A . 8 ASP O 1 1 20 9718 1 1 8 ASP OD1 O 1.533 8.848 8.766 1.00 . A A . 8 ASP OD1 1 1 20 9719 1 1 8 ASP OD2 O 0.821 6.838 9.298 1.00 . A A . 8 ASP OD2 1 1 20 9720 1 1 9 CYS C C -0.134 4.494 3.599 1.00 . A A . 9 CYS C 1 1 20 9721 1 1 9 CYS CA C -1.064 4.707 4.780 1.00 . A A . 9 CYS CA 1 1 20 9722 1 1 9 CYS CB C -2.459 4.227 4.427 1.00 . A A . 9 CYS CB 1 1 20 9723 1 1 9 CYS H H -1.537 6.760 4.590 1.00 . A A . 9 CYS H 1 1 20 9724 1 1 9 CYS HA H -0.708 4.139 5.609 1.00 . A A . 9 CYS HA 1 1 20 9725 1 1 9 CYS HB2 H -3.174 4.821 4.964 1.00 . A A . 9 CYS HB2 1 1 20 9726 1 1 9 CYS HB3 H -2.609 4.353 3.373 1.00 . A A . 9 CYS HB3 1 1 20 9727 1 1 9 CYS N N -1.095 6.109 5.174 1.00 . A A . 9 CYS N 1 1 20 9728 1 1 9 CYS O O 0.897 3.832 3.713 1.00 . A A . 9 CYS O 1 1 20 9729 1 1 9 CYS SG S -2.769 2.478 4.831 1.00 . A A . 9 CYS SG 1 1 20 9730 1 1 10 TYR C C 1.749 5.347 1.518 1.00 . A A . 10 TYR C 1 1 20 9731 1 1 10 TYR CA C 0.300 4.945 1.252 1.00 . A A . 10 TYR CA 1 1 20 9732 1 1 10 TYR CB C -0.285 5.820 0.139 1.00 . A A . 10 TYR CB 1 1 20 9733 1 1 10 TYR CD1 C -2.056 4.025 -0.140 1.00 . A A . 10 TYR CD1 1 1 20 9734 1 1 10 TYR CD2 C -1.951 5.773 -1.758 1.00 . A A . 10 TYR CD2 1 1 20 9735 1 1 10 TYR CE1 C -3.119 3.459 -0.816 1.00 . A A . 10 TYR CE1 1 1 20 9736 1 1 10 TYR CE2 C -3.013 5.211 -2.439 1.00 . A A . 10 TYR CE2 1 1 20 9737 1 1 10 TYR CG C -1.452 5.192 -0.598 1.00 . A A . 10 TYR CG 1 1 20 9738 1 1 10 TYR CZ C -3.594 4.055 -1.964 1.00 . A A . 10 TYR CZ 1 1 20 9739 1 1 10 TYR H H -1.337 5.582 2.436 1.00 . A A . 10 TYR H 1 1 20 9740 1 1 10 TYR HA H 0.276 3.913 0.936 1.00 . A A . 10 TYR HA 1 1 20 9741 1 1 10 TYR HB2 H -0.630 6.748 0.569 1.00 . A A . 10 TYR HB2 1 1 20 9742 1 1 10 TYR HB3 H 0.488 6.031 -0.584 1.00 . A A . 10 TYR HB3 1 1 20 9743 1 1 10 TYR HD1 H -1.683 3.560 0.761 1.00 . A A . 10 TYR HD1 1 1 20 9744 1 1 10 TYR HD2 H -1.494 6.678 -2.129 1.00 . A A . 10 TYR HD2 1 1 20 9745 1 1 10 TYR HE1 H -3.573 2.553 -0.443 1.00 . A A . 10 TYR HE1 1 1 20 9746 1 1 10 TYR HE2 H -3.386 5.678 -3.340 1.00 . A A . 10 TYR HE2 1 1 20 9747 1 1 10 TYR HH H -5.430 4.045 -2.534 1.00 . A A . 10 TYR HH 1 1 20 9748 1 1 10 TYR N N -0.503 5.064 2.462 1.00 . A A . 10 TYR N 1 1 20 9749 1 1 10 TYR O O 2.658 4.933 0.800 1.00 . A A . 10 TYR O 1 1 20 9750 1 1 10 TYR OH O -4.653 3.492 -2.640 1.00 . A A . 10 TYR OH 1 1 20 9751 1 1 11 ALA C C 4.151 5.501 3.487 1.00 . A A . 11 ALA C 1 1 20 9752 1 1 11 ALA CA C 3.294 6.624 2.903 1.00 . A A . 11 ALA CA 1 1 20 9753 1 1 11 ALA CB C 3.211 7.792 3.875 1.00 . A A . 11 ALA CB 1 1 20 9754 1 1 11 ALA H H 1.191 6.462 3.084 1.00 . A A . 11 ALA H 1 1 20 9755 1 1 11 ALA HA H 3.766 6.977 1.998 1.00 . A A . 11 ALA HA 1 1 20 9756 1 1 11 ALA HB1 H 2.346 7.672 4.509 1.00 . A A . 11 ALA HB1 1 1 20 9757 1 1 11 ALA HB2 H 3.127 8.715 3.322 1.00 . A A . 11 ALA HB2 1 1 20 9758 1 1 11 ALA HB3 H 4.103 7.817 4.484 1.00 . A A . 11 ALA HB3 1 1 20 9759 1 1 11 ALA N N 1.957 6.162 2.550 1.00 . A A . 11 ALA N 1 1 20 9760 1 1 11 ALA O O 5.155 5.108 2.892 1.00 . A A . 11 ALA O 1 1 20 9761 1 1 12 PRO C C 4.802 2.728 4.385 1.00 . A A . 12 PRO C 1 1 20 9762 1 1 12 PRO CA C 4.524 3.897 5.323 1.00 . A A . 12 PRO CA 1 1 20 9763 1 1 12 PRO CB C 3.616 3.457 6.483 1.00 . A A . 12 PRO CB 1 1 20 9764 1 1 12 PRO CD C 2.601 5.370 5.452 1.00 . A A . 12 PRO CD 1 1 20 9765 1 1 12 PRO CG C 2.305 4.137 6.257 1.00 . A A . 12 PRO CG 1 1 20 9766 1 1 12 PRO HA H 5.460 4.262 5.718 1.00 . A A . 12 PRO HA 1 1 20 9767 1 1 12 PRO HB2 H 3.507 2.383 6.468 1.00 . A A . 12 PRO HB2 1 1 20 9768 1 1 12 PRO HB3 H 4.058 3.761 7.420 1.00 . A A . 12 PRO HB3 1 1 20 9769 1 1 12 PRO HD2 H 1.767 5.613 4.810 1.00 . A A . 12 PRO HD2 1 1 20 9770 1 1 12 PRO HD3 H 2.836 6.201 6.102 1.00 . A A . 12 PRO HD3 1 1 20 9771 1 1 12 PRO HG2 H 1.643 3.483 5.712 1.00 . A A . 12 PRO HG2 1 1 20 9772 1 1 12 PRO HG3 H 1.866 4.407 7.207 1.00 . A A . 12 PRO HG3 1 1 20 9773 1 1 12 PRO N N 3.774 4.970 4.666 1.00 . A A . 12 PRO N 1 1 20 9774 1 1 12 PRO O O 5.779 1.999 4.558 1.00 . A A . 12 PRO O 1 1 20 9775 1 1 13 CYS C C 4.929 1.933 1.229 1.00 . A A . 13 CYS C 1 1 20 9776 1 1 13 CYS CA C 4.102 1.480 2.421 1.00 . A A . 13 CYS CA 1 1 20 9777 1 1 13 CYS CB C 2.750 0.974 1.950 1.00 . A A . 13 CYS CB 1 1 20 9778 1 1 13 CYS H H 3.183 3.173 3.299 1.00 . A A . 13 CYS H 1 1 20 9779 1 1 13 CYS HA H 4.617 0.676 2.902 1.00 . A A . 13 CYS HA 1 1 20 9780 1 1 13 CYS HB2 H 2.036 1.770 2.035 1.00 . A A . 13 CYS HB2 1 1 20 9781 1 1 13 CYS HB3 H 2.834 0.678 0.920 1.00 . A A . 13 CYS HB3 1 1 20 9782 1 1 13 CYS N N 3.941 2.558 3.388 1.00 . A A . 13 CYS N 1 1 20 9783 1 1 13 CYS O O 5.865 1.248 0.821 1.00 . A A . 13 CYS O 1 1 20 9784 1 1 13 CYS SG S 2.108 -0.451 2.886 1.00 . A A . 13 CYS SG 1 1 20 9785 1 1 14 ARG C C 6.807 3.596 -0.204 1.00 . A A . 14 ARG C 1 1 20 9786 1 1 14 ARG CA C 5.312 3.612 -0.476 1.00 . A A . 14 ARG CA 1 1 20 9787 1 1 14 ARG CB C 4.842 5.028 -0.816 1.00 . A A . 14 ARG CB 1 1 20 9788 1 1 14 ARG CD C 6.120 7.066 -1.554 1.00 . A A . 14 ARG CD 1 1 20 9789 1 1 14 ARG CG C 5.628 5.681 -1.944 1.00 . A A . 14 ARG CG 1 1 20 9790 1 1 14 ARG CZ C 6.076 9.331 -2.524 1.00 . A A . 14 ARG CZ 1 1 20 9791 1 1 14 ARG H H 3.834 3.597 1.029 1.00 . A A . 14 ARG H 1 1 20 9792 1 1 14 ARG HA H 5.108 2.960 -1.307 1.00 . A A . 14 ARG HA 1 1 20 9793 1 1 14 ARG HB2 H 3.805 4.986 -1.110 1.00 . A A . 14 ARG HB2 1 1 20 9794 1 1 14 ARG HB3 H 4.934 5.646 0.064 1.00 . A A . 14 ARG HB3 1 1 20 9795 1 1 14 ARG HD2 H 5.512 7.435 -0.741 1.00 . A A . 14 ARG HD2 1 1 20 9796 1 1 14 ARG HD3 H 7.147 6.990 -1.227 1.00 . A A . 14 ARG HD3 1 1 20 9797 1 1 14 ARG HE H 5.970 7.636 -3.571 1.00 . A A . 14 ARG HE 1 1 20 9798 1 1 14 ARG HG2 H 6.479 5.062 -2.182 1.00 . A A . 14 ARG HG2 1 1 20 9799 1 1 14 ARG HG3 H 4.990 5.768 -2.811 1.00 . A A . 14 ARG HG3 1 1 20 9800 1 1 14 ARG HH11 H 6.233 9.286 -0.508 1.00 . A A . 14 ARG HH11 1 1 20 9801 1 1 14 ARG HH12 H 6.200 10.866 -1.215 1.00 . A A . 14 ARG HH12 1 1 20 9802 1 1 14 ARG HH21 H 5.926 9.714 -4.503 1.00 . A A . 14 ARG HH21 1 1 20 9803 1 1 14 ARG HH22 H 6.025 11.109 -3.482 1.00 . A A . 14 ARG HH22 1 1 20 9804 1 1 14 ARG N N 4.586 3.089 0.668 1.00 . A A . 14 ARG N 1 1 20 9805 1 1 14 ARG NE N 6.046 8.008 -2.668 1.00 . A A . 14 ARG NE 1 1 20 9806 1 1 14 ARG NH1 N 6.178 9.872 -1.316 1.00 . A A . 14 ARG NH1 1 1 20 9807 1 1 14 ARG NH2 N 6.003 10.115 -3.591 1.00 . A A . 14 ARG NH2 1 1 20 9808 1 1 14 ARG O O 7.608 3.317 -1.092 1.00 . A A . 14 ARG O 1 1 20 9809 1 1 15 LYS C C 9.164 2.480 1.108 1.00 . A A . 15 LYS C 1 1 20 9810 1 1 15 LYS CA C 8.580 3.850 1.423 1.00 . A A . 15 LYS CA 1 1 20 9811 1 1 15 LYS CB C 8.736 4.167 2.912 1.00 . A A . 15 LYS CB 1 1 20 9812 1 1 15 LYS CD C 8.373 6.653 2.913 1.00 . A A . 15 LYS CD 1 1 20 9813 1 1 15 LYS CE C 9.071 7.882 2.352 1.00 . A A . 15 LYS CE 1 1 20 9814 1 1 15 LYS CG C 9.358 5.527 3.182 1.00 . A A . 15 LYS CG 1 1 20 9815 1 1 15 LYS H H 6.496 4.063 1.717 1.00 . A A . 15 LYS H 1 1 20 9816 1 1 15 LYS HA H 9.097 4.598 0.841 1.00 . A A . 15 LYS HA 1 1 20 9817 1 1 15 LYS HB2 H 7.761 4.142 3.377 1.00 . A A . 15 LYS HB2 1 1 20 9818 1 1 15 LYS HB3 H 9.361 3.412 3.367 1.00 . A A . 15 LYS HB3 1 1 20 9819 1 1 15 LYS HD2 H 7.638 6.312 2.199 1.00 . A A . 15 LYS HD2 1 1 20 9820 1 1 15 LYS HD3 H 7.884 6.920 3.839 1.00 . A A . 15 LYS HD3 1 1 20 9821 1 1 15 LYS HE2 H 8.362 8.693 2.305 1.00 . A A . 15 LYS HE2 1 1 20 9822 1 1 15 LYS HE3 H 9.883 8.151 3.011 1.00 . A A . 15 LYS HE3 1 1 20 9823 1 1 15 LYS HG2 H 9.666 5.573 4.216 1.00 . A A . 15 LYS HG2 1 1 20 9824 1 1 15 LYS HG3 H 10.218 5.652 2.542 1.00 . A A . 15 LYS HG3 1 1 20 9825 1 1 15 LYS HZ1 H 10.541 7.166 1.051 1.00 . A A . 15 LYS HZ1 1 1 20 9826 1 1 15 LYS HZ2 H 9.732 8.537 0.481 1.00 . A A . 15 LYS HZ2 1 1 20 9827 1 1 15 LYS HZ3 H 8.967 7.030 0.447 1.00 . A A . 15 LYS HZ3 1 1 20 9828 1 1 15 LYS N N 7.179 3.869 1.041 1.00 . A A . 15 LYS N 1 1 20 9829 1 1 15 LYS NZ N 9.616 7.636 0.988 1.00 . A A . 15 LYS NZ 1 1 20 9830 1 1 15 LYS O O 10.228 2.367 0.500 1.00 . A A . 15 LYS O 1 1 20 9831 1 1 16 GLN C C 8.739 -0.281 -0.222 1.00 . A A . 16 GLN C 1 1 20 9832 1 1 16 GLN CA C 8.865 0.070 1.261 1.00 . A A . 16 GLN CA 1 1 20 9833 1 1 16 GLN CB C 8.035 -0.905 2.099 1.00 . A A . 16 GLN CB 1 1 20 9834 1 1 16 GLN CD C 8.882 0.089 4.261 1.00 . A A . 16 GLN CD 1 1 20 9835 1 1 16 GLN CG C 8.624 -1.180 3.473 1.00 . A A . 16 GLN CG 1 1 20 9836 1 1 16 GLN H H 7.587 1.597 1.980 1.00 . A A . 16 GLN H 1 1 20 9837 1 1 16 GLN HA H 9.901 -0.013 1.551 1.00 . A A . 16 GLN HA 1 1 20 9838 1 1 16 GLN HB2 H 7.045 -0.495 2.232 1.00 . A A . 16 GLN HB2 1 1 20 9839 1 1 16 GLN HB3 H 7.958 -1.842 1.569 1.00 . A A . 16 GLN HB3 1 1 20 9840 1 1 16 GLN HE21 H 10.671 -0.585 4.808 1.00 . A A . 16 GLN HE21 1 1 20 9841 1 1 16 GLN HE22 H 10.243 0.979 5.406 1.00 . A A . 16 GLN HE22 1 1 20 9842 1 1 16 GLN HG2 H 7.935 -1.796 4.030 1.00 . A A . 16 GLN HG2 1 1 20 9843 1 1 16 GLN HG3 H 9.559 -1.707 3.350 1.00 . A A . 16 GLN HG3 1 1 20 9844 1 1 16 GLN N N 8.440 1.438 1.513 1.00 . A A . 16 GLN N 1 1 20 9845 1 1 16 GLN NE2 N 10.050 0.169 4.888 1.00 . A A . 16 GLN NE2 1 1 20 9846 1 1 16 GLN O O 9.726 -0.607 -0.880 1.00 . A A . 16 GLN O 1 1 20 9847 1 1 16 GLN OE1 O 8.043 0.988 4.305 1.00 . A A . 16 GLN OE1 1 1 20 9848 1 1 17 THR C C 7.766 0.522 -3.070 1.00 . A A . 17 THR C 1 1 20 9849 1 1 17 THR CA C 7.230 -0.545 -2.123 1.00 . A A . 17 THR CA 1 1 20 9850 1 1 17 THR CB C 5.723 -0.713 -2.313 1.00 . A A . 17 THR CB 1 1 20 9851 1 1 17 THR CG2 C 5.321 -2.118 -2.700 1.00 . A A . 17 THR CG2 1 1 20 9852 1 1 17 THR H H 6.761 0.041 -0.158 1.00 . A A . 17 THR H 1 1 20 9853 1 1 17 THR HA H 7.714 -1.478 -2.349 1.00 . A A . 17 THR HA 1 1 20 9854 1 1 17 THR HB H 5.393 -0.045 -3.091 1.00 . A A . 17 THR HB 1 1 20 9855 1 1 17 THR HG1 H 4.375 0.298 -1.314 1.00 . A A . 17 THR HG1 1 1 20 9856 1 1 17 THR HG21 H 5.602 -2.802 -1.913 1.00 . A A . 17 THR HG21 1 1 20 9857 1 1 17 THR HG22 H 5.821 -2.397 -3.615 1.00 . A A . 17 THR HG22 1 1 20 9858 1 1 17 THR HG23 H 4.252 -2.159 -2.846 1.00 . A A . 17 THR HG23 1 1 20 9859 1 1 17 THR N N 7.509 -0.224 -0.732 1.00 . A A . 17 THR N 1 1 20 9860 1 1 17 THR O O 8.656 0.268 -3.881 1.00 . A A . 17 THR O 1 1 20 9861 1 1 17 THR OG1 O 5.026 -0.382 -1.125 1.00 . A A . 17 THR OG1 1 1 20 9862 1 1 18 GLY C C 6.711 2.964 -5.008 1.00 . A A . 18 GLY C 1 1 20 9863 1 1 18 GLY CA C 7.592 2.818 -3.795 1.00 . A A . 18 GLY CA 1 1 20 9864 1 1 18 GLY H H 6.502 1.839 -2.300 1.00 . A A . 18 GLY H 1 1 20 9865 1 1 18 GLY HA2 H 7.539 3.729 -3.219 1.00 . A A . 18 GLY HA2 1 1 20 9866 1 1 18 GLY HA3 H 8.587 2.675 -4.109 1.00 . A A . 18 GLY HA3 1 1 20 9867 1 1 18 GLY N N 7.199 1.712 -2.958 1.00 . A A . 18 GLY N 1 1 20 9868 1 1 18 GLY O O 6.900 2.294 -6.022 1.00 . A A . 18 GLY O 1 1 20 9869 1 1 19 CYS C C 3.505 4.743 -5.313 1.00 . A A . 19 CYS C 1 1 20 9870 1 1 19 CYS CA C 4.792 4.189 -5.921 1.00 . A A . 19 CYS CA 1 1 20 9871 1 1 19 CYS CB C 4.484 3.008 -6.815 1.00 . A A . 19 CYS CB 1 1 20 9872 1 1 19 CYS H H 5.714 4.354 -4.049 1.00 . A A . 19 CYS H 1 1 20 9873 1 1 19 CYS HA H 5.235 4.943 -6.526 1.00 . A A . 19 CYS HA 1 1 20 9874 1 1 19 CYS HB2 H 3.621 3.249 -7.408 1.00 . A A . 19 CYS HB2 1 1 20 9875 1 1 19 CYS HB3 H 5.325 2.864 -7.465 1.00 . A A . 19 CYS HB3 1 1 20 9876 1 1 19 CYS N N 5.757 3.867 -4.880 1.00 . A A . 19 CYS N 1 1 20 9877 1 1 19 CYS O O 3.197 4.479 -4.151 1.00 . A A . 19 CYS O 1 1 20 9878 1 1 19 CYS SG S 4.150 1.439 -5.948 1.00 . A A . 19 CYS SG 1 1 20 9879 1 1 20 PRO C C 0.314 5.170 -5.572 1.00 . A A . 20 PRO C 1 1 20 9880 1 1 20 PRO CA C 1.493 6.144 -5.608 1.00 . A A . 20 PRO CA 1 1 20 9881 1 1 20 PRO CB C 1.237 7.246 -6.634 1.00 . A A . 20 PRO CB 1 1 20 9882 1 1 20 PRO CD C 3.045 5.921 -7.479 1.00 . A A . 20 PRO CD 1 1 20 9883 1 1 20 PRO CG C 1.847 6.735 -7.893 1.00 . A A . 20 PRO CG 1 1 20 9884 1 1 20 PRO HA H 1.619 6.586 -4.632 1.00 . A A . 20 PRO HA 1 1 20 9885 1 1 20 PRO HB2 H 0.173 7.401 -6.742 1.00 . A A . 20 PRO HB2 1 1 20 9886 1 1 20 PRO HB3 H 1.709 8.161 -6.310 1.00 . A A . 20 PRO HB3 1 1 20 9887 1 1 20 PRO HD2 H 3.140 5.047 -8.106 1.00 . A A . 20 PRO HD2 1 1 20 9888 1 1 20 PRO HD3 H 3.942 6.520 -7.525 1.00 . A A . 20 PRO HD3 1 1 20 9889 1 1 20 PRO HG2 H 1.137 6.115 -8.420 1.00 . A A . 20 PRO HG2 1 1 20 9890 1 1 20 PRO HG3 H 2.155 7.564 -8.513 1.00 . A A . 20 PRO HG3 1 1 20 9891 1 1 20 PRO N N 2.741 5.537 -6.086 1.00 . A A . 20 PRO N 1 1 20 9892 1 1 20 PRO O O -0.741 5.489 -5.023 1.00 . A A . 20 PRO O 1 1 20 9893 1 1 21 TYR C C -0.820 2.404 -4.818 1.00 . A A . 21 TYR C 1 1 20 9894 1 1 21 TYR CA C -0.562 2.999 -6.202 1.00 . A A . 21 TYR CA 1 1 20 9895 1 1 21 TYR CB C -0.178 1.892 -7.182 1.00 . A A . 21 TYR CB 1 1 20 9896 1 1 21 TYR CD1 C 0.710 3.435 -8.976 1.00 . A A . 21 TYR CD1 1 1 20 9897 1 1 21 TYR CD2 C 1.993 1.505 -8.418 1.00 . A A . 21 TYR CD2 1 1 20 9898 1 1 21 TYR CE1 C 1.656 3.796 -9.918 1.00 . A A . 21 TYR CE1 1 1 20 9899 1 1 21 TYR CE2 C 2.943 1.859 -9.357 1.00 . A A . 21 TYR CE2 1 1 20 9900 1 1 21 TYR CG C 0.862 2.285 -8.212 1.00 . A A . 21 TYR CG 1 1 20 9901 1 1 21 TYR CZ C 2.770 3.005 -10.104 1.00 . A A . 21 TYR CZ 1 1 20 9902 1 1 21 TYR H H 1.332 3.784 -6.595 1.00 . A A . 21 TYR H 1 1 20 9903 1 1 21 TYR HA H -1.463 3.478 -6.551 1.00 . A A . 21 TYR HA 1 1 20 9904 1 1 21 TYR HB2 H 0.208 1.051 -6.631 1.00 . A A . 21 TYR HB2 1 1 20 9905 1 1 21 TYR HB3 H -1.053 1.596 -7.709 1.00 . A A . 21 TYR HB3 1 1 20 9906 1 1 21 TYR HD1 H -0.163 4.053 -8.828 1.00 . A A . 21 TYR HD1 1 1 20 9907 1 1 21 TYR HD2 H 2.126 0.608 -7.831 1.00 . A A . 21 TYR HD2 1 1 20 9908 1 1 21 TYR HE1 H 1.520 4.694 -10.503 1.00 . A A . 21 TYR HE1 1 1 20 9909 1 1 21 TYR HE2 H 3.815 1.239 -9.503 1.00 . A A . 21 TYR HE2 1 1 20 9910 1 1 21 TYR HH H 3.838 4.312 -11.023 1.00 . A A . 21 TYR HH 1 1 20 9911 1 1 21 TYR N N 0.486 3.992 -6.163 1.00 . A A . 21 TYR N 1 1 20 9912 1 1 21 TYR O O 0.007 2.526 -3.914 1.00 . A A . 21 TYR O 1 1 20 9913 1 1 21 TYR OH O 3.713 3.361 -11.041 1.00 . A A . 21 TYR OH 1 1 20 9914 1 1 22 GLY C C -3.523 0.217 -3.516 1.00 . A A . 22 GLY C 1 1 20 9915 1 1 22 GLY CA C -2.325 1.138 -3.399 1.00 . A A . 22 GLY CA 1 1 20 9916 1 1 22 GLY H H -2.586 1.687 -5.429 1.00 . A A . 22 GLY H 1 1 20 9917 1 1 22 GLY HA2 H -1.486 0.573 -3.045 1.00 . A A . 22 GLY HA2 1 1 20 9918 1 1 22 GLY HA3 H -2.546 1.911 -2.683 1.00 . A A . 22 GLY HA3 1 1 20 9919 1 1 22 GLY N N -1.972 1.753 -4.668 1.00 . A A . 22 GLY N 1 1 20 9920 1 1 22 GLY O O -4.397 0.438 -4.355 1.00 . A A . 22 GLY O 1 1 20 9921 1 1 23 LYS C C -5.686 -1.411 -1.577 1.00 . A A . 23 LYS C 1 1 20 9922 1 1 23 LYS CA C -4.704 -1.741 -2.696 1.00 . A A . 23 LYS CA 1 1 20 9923 1 1 23 LYS CB C -4.212 -3.185 -2.566 1.00 . A A . 23 LYS CB 1 1 20 9924 1 1 23 LYS CD C -4.150 -5.462 -3.626 1.00 . A A . 23 LYS CD 1 1 20 9925 1 1 23 LYS CE C -4.516 -6.425 -2.509 1.00 . A A . 23 LYS CE 1 1 20 9926 1 1 23 LYS CG C -4.912 -4.153 -3.505 1.00 . A A . 23 LYS CG 1 1 20 9927 1 1 23 LYS H H -2.876 -0.942 -2.006 1.00 . A A . 23 LYS H 1 1 20 9928 1 1 23 LYS HA H -5.202 -1.623 -3.643 1.00 . A A . 23 LYS HA 1 1 20 9929 1 1 23 LYS HB2 H -3.154 -3.213 -2.778 1.00 . A A . 23 LYS HB2 1 1 20 9930 1 1 23 LYS HB3 H -4.375 -3.520 -1.552 1.00 . A A . 23 LYS HB3 1 1 20 9931 1 1 23 LYS HD2 H -4.387 -5.920 -4.575 1.00 . A A . 23 LYS HD2 1 1 20 9932 1 1 23 LYS HD3 H -3.091 -5.256 -3.579 1.00 . A A . 23 LYS HD3 1 1 20 9933 1 1 23 LYS HE2 H -5.500 -6.173 -2.142 1.00 . A A . 23 LYS HE2 1 1 20 9934 1 1 23 LYS HE3 H -4.527 -7.430 -2.906 1.00 . A A . 23 LYS HE3 1 1 20 9935 1 1 23 LYS HG2 H -5.901 -4.358 -3.124 1.00 . A A . 23 LYS HG2 1 1 20 9936 1 1 23 LYS HG3 H -4.989 -3.700 -4.483 1.00 . A A . 23 LYS HG3 1 1 20 9937 1 1 23 LYS HZ1 H -2.720 -6.957 -1.584 1.00 . A A . 23 LYS HZ1 1 1 20 9938 1 1 23 LYS HZ2 H -3.996 -6.699 -0.505 1.00 . A A . 23 LYS HZ2 1 1 20 9939 1 1 23 LYS HZ3 H -3.230 -5.381 -1.236 1.00 . A A . 23 LYS HZ3 1 1 20 9940 1 1 23 LYS N N -3.583 -0.814 -2.669 1.00 . A A . 23 LYS N 1 1 20 9941 1 1 23 LYS NZ N -3.548 -6.361 -1.380 1.00 . A A . 23 LYS NZ 1 1 20 9942 1 1 23 LYS O O -6.664 -2.126 -1.359 1.00 . A A . 23 LYS O 1 1 20 9943 1 1 24 CYS C C -7.708 0.230 -0.180 1.00 . A A . 24 CYS C 1 1 20 9944 1 1 24 CYS CA C -6.241 0.125 0.236 1.00 . A A . 24 CYS CA 1 1 20 9945 1 1 24 CYS CB C -5.720 1.466 0.765 1.00 . A A . 24 CYS CB 1 1 20 9946 1 1 24 CYS H H -4.610 0.202 -1.092 1.00 . A A . 24 CYS H 1 1 20 9947 1 1 24 CYS HA H -6.161 -0.610 1.021 1.00 . A A . 24 CYS HA 1 1 20 9948 1 1 24 CYS HB2 H -6.081 1.612 1.766 1.00 . A A . 24 CYS HB2 1 1 20 9949 1 1 24 CYS HB3 H -4.641 1.435 0.785 1.00 . A A . 24 CYS HB3 1 1 20 9950 1 1 24 CYS N N -5.407 -0.320 -0.867 1.00 . A A . 24 CYS N 1 1 20 9951 1 1 24 CYS O O -8.051 0.929 -1.133 1.00 . A A . 24 CYS O 1 1 20 9952 1 1 24 CYS SG S -6.208 2.923 -0.221 1.00 . A A . 24 CYS SG 1 1 20 9953 1 1 25 MET C C -10.768 0.137 1.427 1.00 . A A . 25 MET C 1 1 20 9954 1 1 25 MET CA C -9.998 -0.471 0.265 1.00 . A A . 25 MET CA 1 1 20 9955 1 1 25 MET CB C -10.493 -1.893 -0.004 1.00 . A A . 25 MET CB 1 1 20 9956 1 1 25 MET CE C -12.024 -3.891 -2.672 1.00 . A A . 25 MET CE 1 1 20 9957 1 1 25 MET CG C -11.840 -1.945 -0.707 1.00 . A A . 25 MET CG 1 1 20 9958 1 1 25 MET H H -8.231 -1.015 1.292 1.00 . A A . 25 MET H 1 1 20 9959 1 1 25 MET HA H -10.165 0.134 -0.614 1.00 . A A . 25 MET HA 1 1 20 9960 1 1 25 MET HB2 H -9.768 -2.403 -0.622 1.00 . A A . 25 MET HB2 1 1 20 9961 1 1 25 MET HB3 H -10.582 -2.415 0.937 1.00 . A A . 25 MET HB3 1 1 20 9962 1 1 25 MET HE1 H -12.619 -4.702 -3.065 1.00 . A A . 25 MET HE1 1 1 20 9963 1 1 25 MET HE2 H -10.975 -4.137 -2.761 1.00 . A A . 25 MET HE2 1 1 20 9964 1 1 25 MET HE3 H -12.230 -2.989 -3.230 1.00 . A A . 25 MET HE3 1 1 20 9965 1 1 25 MET HG2 H -12.562 -1.407 -0.113 1.00 . A A . 25 MET HG2 1 1 20 9966 1 1 25 MET HG3 H -11.745 -1.470 -1.672 1.00 . A A . 25 MET HG3 1 1 20 9967 1 1 25 MET N N -8.568 -0.476 0.546 1.00 . A A . 25 MET N 1 1 20 9968 1 1 25 MET O O -10.389 -0.019 2.588 1.00 . A A . 25 MET O 1 1 20 9969 1 1 25 MET SD S -12.432 -3.631 -0.948 1.00 . A A . 25 MET SD 1 1 20 9970 1 1 26 ASN C C -12.930 0.563 3.308 1.00 . A A . 26 ASN C 1 1 20 9971 1 1 26 ASN CA C -12.678 1.486 2.123 1.00 . A A . 26 ASN CA 1 1 20 9972 1 1 26 ASN CB C -14.016 1.948 1.537 1.00 . A A . 26 ASN CB 1 1 20 9973 1 1 26 ASN CG C -14.493 1.082 0.386 1.00 . A A . 26 ASN CG 1 1 20 9974 1 1 26 ASN H H -12.089 0.931 0.159 1.00 . A A . 26 ASN H 1 1 20 9975 1 1 26 ASN HA H -12.140 2.353 2.476 1.00 . A A . 26 ASN HA 1 1 20 9976 1 1 26 ASN HB2 H -14.766 1.923 2.313 1.00 . A A . 26 ASN HB2 1 1 20 9977 1 1 26 ASN HB3 H -13.908 2.961 1.184 1.00 . A A . 26 ASN HB3 1 1 20 9978 1 1 26 ASN HD21 H -15.813 0.187 1.574 1.00 . A A . 26 ASN HD21 1 1 20 9979 1 1 26 ASN HD22 H -15.792 -0.356 -0.067 1.00 . A A . 26 ASN HD22 1 1 20 9980 1 1 26 ASN N N -11.848 0.839 1.106 1.00 . A A . 26 ASN N 1 1 20 9981 1 1 26 ASN ND2 N -15.464 0.218 0.659 1.00 . A A . 26 ASN ND2 1 1 20 9982 1 1 26 ASN O O -13.447 -0.543 3.155 1.00 . A A . 26 ASN O 1 1 20 9983 1 1 26 ASN OD1 O -13.996 1.190 -0.736 1.00 . A A . 26 ASN OD1 1 1 20 9984 1 1 27 ARG C C -11.687 -0.850 5.802 1.00 . A A . 27 ARG C 1 1 20 9985 1 1 27 ARG CA C -12.720 0.266 5.720 1.00 . A A . 27 ARG CA 1 1 20 9986 1 1 27 ARG CB C -14.134 -0.314 5.810 1.00 . A A . 27 ARG CB 1 1 20 9987 1 1 27 ARG CD C -15.104 -1.477 7.818 1.00 . A A . 27 ARG CD 1 1 20 9988 1 1 27 ARG CG C -14.775 -0.138 7.178 1.00 . A A . 27 ARG CG 1 1 20 9989 1 1 27 ARG CZ C -16.392 -2.272 9.764 1.00 . A A . 27 ARG CZ 1 1 20 9990 1 1 27 ARG H H -12.140 1.920 4.534 1.00 . A A . 27 ARG H 1 1 20 9991 1 1 27 ARG HA H -12.564 0.939 6.549 1.00 . A A . 27 ARG HA 1 1 20 9992 1 1 27 ARG HB2 H -14.759 0.177 5.078 1.00 . A A . 27 ARG HB2 1 1 20 9993 1 1 27 ARG HB3 H -14.094 -1.369 5.586 1.00 . A A . 27 ARG HB3 1 1 20 9994 1 1 27 ARG HD2 H -15.431 -2.160 7.048 1.00 . A A . 27 ARG HD2 1 1 20 9995 1 1 27 ARG HD3 H -14.213 -1.866 8.288 1.00 . A A . 27 ARG HD3 1 1 20 9996 1 1 27 ARG HE H -16.720 -0.556 8.798 1.00 . A A . 27 ARG HE 1 1 20 9997 1 1 27 ARG HG2 H -14.089 0.396 7.818 1.00 . A A . 27 ARG HG2 1 1 20 9998 1 1 27 ARG HG3 H -15.685 0.433 7.066 1.00 . A A . 27 ARG HG3 1 1 20 9999 1 1 27 ARG HH11 H -14.912 -3.518 9.173 1.00 . A A . 27 ARG HH11 1 1 20 10000 1 1 27 ARG HH12 H -15.832 -4.053 10.538 1.00 . A A . 27 ARG HH12 1 1 20 10001 1 1 27 ARG HH21 H -17.931 -1.259 10.595 1.00 . A A . 27 ARG HH21 1 1 20 10002 1 1 27 ARG HH22 H -17.546 -2.771 11.345 1.00 . A A . 27 ARG HH22 1 1 20 10003 1 1 27 ARG N N -12.550 1.033 4.490 1.00 . A A . 27 ARG N 1 1 20 10004 1 1 27 ARG NE N -16.157 -1.358 8.823 1.00 . A A . 27 ARG NE 1 1 20 10005 1 1 27 ARG NH1 N -15.651 -3.371 9.829 1.00 . A A . 27 ARG NH1 1 1 20 10006 1 1 27 ARG NH2 N -17.369 -2.085 10.639 1.00 . A A . 27 ARG NH2 1 1 20 10007 1 1 27 ARG O O -11.931 -1.894 6.410 1.00 . A A . 27 ARG O 1 1 20 10008 1 1 28 LYS C C -8.343 -1.205 4.213 1.00 . A A . 28 LYS C 1 1 20 10009 1 1 28 LYS CA C -9.449 -1.604 5.186 1.00 . A A . 28 LYS CA 1 1 20 10010 1 1 28 LYS CB C -9.984 -2.993 4.823 1.00 . A A . 28 LYS CB 1 1 20 10011 1 1 28 LYS CD C -8.917 -4.829 6.166 1.00 . A A . 28 LYS CD 1 1 20 10012 1 1 28 LYS CE C -9.275 -6.124 6.877 1.00 . A A . 28 LYS CE 1 1 20 10013 1 1 28 LYS CG C -10.127 -3.921 6.018 1.00 . A A . 28 LYS CG 1 1 20 10014 1 1 28 LYS H H -10.405 0.235 4.724 1.00 . A A . 28 LYS H 1 1 20 10015 1 1 28 LYS HA H -9.036 -1.638 6.183 1.00 . A A . 28 LYS HA 1 1 20 10016 1 1 28 LYS HB2 H -10.955 -2.884 4.362 1.00 . A A . 28 LYS HB2 1 1 20 10017 1 1 28 LYS HB3 H -9.311 -3.455 4.116 1.00 . A A . 28 LYS HB3 1 1 20 10018 1 1 28 LYS HD2 H -8.532 -5.064 5.185 1.00 . A A . 28 LYS HD2 1 1 20 10019 1 1 28 LYS HD3 H -8.159 -4.312 6.738 1.00 . A A . 28 LYS HD3 1 1 20 10020 1 1 28 LYS HE2 H -9.168 -5.977 7.941 1.00 . A A . 28 LYS HE2 1 1 20 10021 1 1 28 LYS HE3 H -10.302 -6.371 6.650 1.00 . A A . 28 LYS HE3 1 1 20 10022 1 1 28 LYS HG2 H -10.229 -3.327 6.913 1.00 . A A . 28 LYS HG2 1 1 20 10023 1 1 28 LYS HG3 H -11.010 -4.530 5.886 1.00 . A A . 28 LYS HG3 1 1 20 10024 1 1 28 LYS HZ1 H -7.410 -6.936 6.403 1.00 . A A . 28 LYS HZ1 1 1 20 10025 1 1 28 LYS HZ2 H -8.689 -7.596 5.516 1.00 . A A . 28 LYS HZ2 1 1 20 10026 1 1 28 LYS HZ3 H -8.469 -8.034 7.135 1.00 . A A . 28 LYS HZ3 1 1 20 10027 1 1 28 LYS N N -10.533 -0.620 5.187 1.00 . A A . 28 LYS N 1 1 20 10028 1 1 28 LYS NZ N -8.400 -7.251 6.453 1.00 . A A . 28 LYS NZ 1 1 20 10029 1 1 28 LYS O O -8.424 -1.485 3.017 1.00 . A A . 28 LYS O 1 1 20 10030 1 1 29 CYS C C -5.304 -1.294 3.531 1.00 . A A . 29 CYS C 1 1 20 10031 1 1 29 CYS CA C -6.186 -0.118 3.920 1.00 . A A . 29 CYS CA 1 1 20 10032 1 1 29 CYS CB C -5.355 0.909 4.670 1.00 . A A . 29 CYS CB 1 1 20 10033 1 1 29 CYS H H -7.305 -0.360 5.692 1.00 . A A . 29 CYS H 1 1 20 10034 1 1 29 CYS HA H -6.578 0.336 3.040 1.00 . A A . 29 CYS HA 1 1 20 10035 1 1 29 CYS HB2 H -6.011 1.552 5.227 1.00 . A A . 29 CYS HB2 1 1 20 10036 1 1 29 CYS HB3 H -4.710 0.387 5.345 1.00 . A A . 29 CYS HB3 1 1 20 10037 1 1 29 CYS N N -7.311 -0.552 4.735 1.00 . A A . 29 CYS N 1 1 20 10038 1 1 29 CYS O O -5.376 -2.363 4.134 1.00 . A A . 29 CYS O 1 1 20 10039 1 1 29 CYS SG S -4.311 1.964 3.615 1.00 . A A . 29 CYS SG 1 1 20 10040 1 1 30 LYS C C -2.847 -1.708 0.773 1.00 . A A . 30 LYS C 1 1 20 10041 1 1 30 LYS CA C -3.547 -2.121 2.063 1.00 . A A . 30 LYS CA 1 1 20 10042 1 1 30 LYS CB C -4.279 -3.454 1.861 1.00 . A A . 30 LYS CB 1 1 20 10043 1 1 30 LYS CD C -6.489 -4.544 1.382 1.00 . A A . 30 LYS CD 1 1 20 10044 1 1 30 LYS CE C -7.681 -4.565 0.438 1.00 . A A . 30 LYS CE 1 1 20 10045 1 1 30 LYS CG C -5.614 -3.325 1.148 1.00 . A A . 30 LYS CG 1 1 20 10046 1 1 30 LYS H H -4.440 -0.204 2.093 1.00 . A A . 30 LYS H 1 1 20 10047 1 1 30 LYS HA H -2.795 -2.254 2.829 1.00 . A A . 30 LYS HA 1 1 20 10048 1 1 30 LYS HB2 H -3.649 -4.109 1.278 1.00 . A A . 30 LYS HB2 1 1 20 10049 1 1 30 LYS HB3 H -4.453 -3.905 2.826 1.00 . A A . 30 LYS HB3 1 1 20 10050 1 1 30 LYS HD2 H -5.900 -5.435 1.220 1.00 . A A . 30 LYS HD2 1 1 20 10051 1 1 30 LYS HD3 H -6.848 -4.529 2.400 1.00 . A A . 30 LYS HD3 1 1 20 10052 1 1 30 LYS HE2 H -8.543 -4.931 0.974 1.00 . A A . 30 LYS HE2 1 1 20 10053 1 1 30 LYS HE3 H -7.870 -3.558 0.096 1.00 . A A . 30 LYS HE3 1 1 20 10054 1 1 30 LYS HG2 H -6.128 -2.451 1.520 1.00 . A A . 30 LYS HG2 1 1 20 10055 1 1 30 LYS HG3 H -5.436 -3.218 0.090 1.00 . A A . 30 LYS HG3 1 1 20 10056 1 1 30 LYS HZ1 H -7.097 -4.872 -1.544 1.00 . A A . 30 LYS HZ1 1 1 20 10057 1 1 30 LYS HZ2 H -8.320 -5.917 -1.022 1.00 . A A . 30 LYS HZ2 1 1 20 10058 1 1 30 LYS HZ3 H -6.725 -6.161 -0.514 1.00 . A A . 30 LYS HZ3 1 1 20 10059 1 1 30 LYS N N -4.459 -1.083 2.527 1.00 . A A . 30 LYS N 1 1 20 10060 1 1 30 LYS NZ N -7.438 -5.440 -0.743 1.00 . A A . 30 LYS NZ 1 1 20 10061 1 1 30 LYS O O -3.340 -1.966 -0.321 1.00 . A A . 30 LYS O 1 1 20 10062 1 1 31 CYS C C -0.877 -1.597 -1.359 1.00 . A A . 31 CYS C 1 1 20 10063 1 1 31 CYS CA C -0.865 -0.615 -0.203 1.00 . A A . 31 CYS CA 1 1 20 10064 1 1 31 CYS CB C 0.577 -0.377 0.258 1.00 . A A . 31 CYS CB 1 1 20 10065 1 1 31 CYS H H -1.367 -0.905 1.837 1.00 . A A . 31 CYS H 1 1 20 10066 1 1 31 CYS HA H -1.260 0.317 -0.574 1.00 . A A . 31 CYS HA 1 1 20 10067 1 1 31 CYS HB2 H 1.231 -0.415 -0.601 1.00 . A A . 31 CYS HB2 1 1 20 10068 1 1 31 CYS HB3 H 0.642 0.603 0.708 1.00 . A A . 31 CYS HB3 1 1 20 10069 1 1 31 CYS N N -1.687 -1.071 0.927 1.00 . A A . 31 CYS N 1 1 20 10070 1 1 31 CYS O O -1.388 -2.707 -1.265 1.00 . A A . 31 CYS O 1 1 20 10071 1 1 31 CYS SG S 1.194 -1.589 1.473 1.00 . A A . 31 CYS SG 1 1 20 10072 1 1 32 ASN C C 0.898 -2.881 -3.684 1.00 . A A . 32 ASN C 1 1 20 10073 1 1 32 ASN CA C -0.283 -1.923 -3.686 1.00 . A A . 32 ASN CA 1 1 20 10074 1 1 32 ASN CB C -0.164 -0.986 -4.869 1.00 . A A . 32 ASN CB 1 1 20 10075 1 1 32 ASN CG C -0.735 -1.564 -6.148 1.00 . A A . 32 ASN CG 1 1 20 10076 1 1 32 ASN H H 0.007 -0.222 -2.469 1.00 . A A . 32 ASN H 1 1 20 10077 1 1 32 ASN HA H -1.192 -2.482 -3.777 1.00 . A A . 32 ASN HA 1 1 20 10078 1 1 32 ASN HB2 H -0.682 -0.078 -4.642 1.00 . A A . 32 ASN HB2 1 1 20 10079 1 1 32 ASN HB3 H 0.872 -0.766 -5.019 1.00 . A A . 32 ASN HB3 1 1 20 10080 1 1 32 ASN HD21 H 0.987 -1.245 -7.090 1.00 . A A . 32 ASN HD21 1 1 20 10081 1 1 32 ASN HD22 H -0.266 -1.962 -8.039 1.00 . A A . 32 ASN HD22 1 1 20 10082 1 1 32 ASN N N -0.340 -1.139 -2.466 1.00 . A A . 32 ASN N 1 1 20 10083 1 1 32 ASN ND2 N 0.078 -1.593 -7.198 1.00 . A A . 32 ASN ND2 1 1 20 10084 1 1 32 ASN O O 1.710 -2.893 -2.759 1.00 . A A . 32 ASN O 1 1 20 10085 1 1 32 ASN OD1 O -1.892 -1.980 -6.193 1.00 . A A . 32 ASN OD1 1 1 20 10086 1 1 33 ARG C C 3.054 -4.107 -5.959 1.00 . A A . 33 ARG C 1 1 20 10087 1 1 33 ARG CA C 2.081 -4.618 -4.911 1.00 . A A . 33 ARG CA 1 1 20 10088 1 1 33 ARG CB C 1.543 -5.994 -5.309 1.00 . A A . 33 ARG CB 1 1 20 10089 1 1 33 ARG CD C 3.467 -7.198 -4.231 1.00 . A A . 33 ARG CD 1 1 20 10090 1 1 33 ARG CG C 2.628 -7.043 -5.488 1.00 . A A . 33 ARG CG 1 1 20 10091 1 1 33 ARG CZ C 5.776 -6.793 -4.994 1.00 . A A . 33 ARG CZ 1 1 20 10092 1 1 33 ARG H H 0.317 -3.584 -5.453 1.00 . A A . 33 ARG H 1 1 20 10093 1 1 33 ARG HA H 2.601 -4.693 -3.967 1.00 . A A . 33 ARG HA 1 1 20 10094 1 1 33 ARG HB2 H 0.864 -6.338 -4.542 1.00 . A A . 33 ARG HB2 1 1 20 10095 1 1 33 ARG HB3 H 1.003 -5.901 -6.239 1.00 . A A . 33 ARG HB3 1 1 20 10096 1 1 33 ARG HD2 H 2.888 -6.862 -3.384 1.00 . A A . 33 ARG HD2 1 1 20 10097 1 1 33 ARG HD3 H 3.715 -8.241 -4.106 1.00 . A A . 33 ARG HD3 1 1 20 10098 1 1 33 ARG HE H 4.736 -5.578 -3.799 1.00 . A A . 33 ARG HE 1 1 20 10099 1 1 33 ARG HG2 H 2.165 -7.990 -5.719 1.00 . A A . 33 ARG HG2 1 1 20 10100 1 1 33 ARG HG3 H 3.270 -6.745 -6.305 1.00 . A A . 33 ARG HG3 1 1 20 10101 1 1 33 ARG HH11 H 4.954 -8.509 -5.682 1.00 . A A . 33 ARG HH11 1 1 20 10102 1 1 33 ARG HH12 H 6.576 -8.200 -6.204 1.00 . A A . 33 ARG HH12 1 1 20 10103 1 1 33 ARG HH21 H 6.869 -5.171 -4.485 1.00 . A A . 33 ARG HH21 1 1 20 10104 1 1 33 ARG HH22 H 7.664 -6.307 -5.524 1.00 . A A . 33 ARG HH22 1 1 20 10105 1 1 33 ARG N N 0.992 -3.664 -4.749 1.00 . A A . 33 ARG N 1 1 20 10106 1 1 33 ARG NE N 4.703 -6.421 -4.299 1.00 . A A . 33 ARG NE 1 1 20 10107 1 1 33 ARG NH1 N 5.768 -7.928 -5.682 1.00 . A A . 33 ARG NH1 1 1 20 10108 1 1 33 ARG NH2 N 6.858 -6.027 -5.001 1.00 . A A . 33 ARG NH2 1 1 20 10109 1 1 33 ARG O O 2.972 -4.457 -7.136 1.00 . A A . 33 ARG O 1 1 20 10110 1 1 34 CYS C C 6.160 -3.568 -6.571 1.00 . A A . 34 CYS C 1 1 20 10111 1 1 34 CYS CA C 4.954 -2.653 -6.380 1.00 . A A . 34 CYS CA 1 1 20 10112 1 1 34 CYS CB C 5.381 -1.324 -5.790 1.00 . A A . 34 CYS CB 1 1 20 10113 1 1 34 CYS H H 3.957 -3.014 -4.563 1.00 . A A . 34 CYS H 1 1 20 10114 1 1 34 CYS HA H 4.497 -2.469 -7.328 1.00 . A A . 34 CYS HA 1 1 20 10115 1 1 34 CYS HB2 H 4.736 -1.101 -4.961 1.00 . A A . 34 CYS HB2 1 1 20 10116 1 1 34 CYS HB3 H 6.389 -1.408 -5.442 1.00 . A A . 34 CYS HB3 1 1 20 10117 1 1 34 CYS N N 3.962 -3.255 -5.512 1.00 . A A . 34 CYS N 1 1 20 10118 1 1 34 CYS O O 7.070 -3.532 -5.716 1.00 . A A . 34 CYS O 1 1 20 10119 1 1 34 CYS OXT O 6.183 -4.313 -7.573 1.00 . A A . 34 CYS OXT 1 1 20 10120 1 1 34 CYS SG S 5.290 0.081 -6.944 1.00 . A A . 34 CYS SG 1 1 stop_ save_
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