NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | item_count |
369784 | 1bh4 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 214 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1bh4 # This FRED archive file contains, for PDB entry <1bh4>: # # - 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_1bh4 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1bh4 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3152.72 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 $CIRCULIN_A A . 1 1 stop_ save_ save_CIRCULIN_A _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "CIRCULIN A" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code CGESCVWIPCISAALGCSCKNKVCYRNGIP _Entity.Number_of_monomers 30 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 CYS . 1 1 2 GLY . 1 1 3 GLU . 1 1 4 SER . 1 1 5 CYS . 1 1 6 VAL . 1 1 7 TRP . 1 1 8 ILE . 1 1 9 PRO . 1 1 10 CYS . 1 1 11 ILE . 1 1 12 SER . 1 1 13 ALA . 1 1 14 ALA . 1 1 15 LEU . 1 1 16 GLY . 1 1 17 CYS . 1 1 18 SER . 1 1 19 CYS . 1 1 20 LYS . 1 1 21 ASN . 1 1 22 LYS . 1 1 23 VAL . 1 1 24 CYS . 1 1 25 TYR . 1 1 26 ARG . 1 1 27 ASN . 1 1 28 GLY . 1 1 29 ILE . 1 1 30 PRO . 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 CYS 1 1 1 1 GLY 2 2 1 1 GLU 3 3 1 1 SER 4 4 1 1 CYS 5 5 1 1 VAL 6 6 1 1 TRP 7 7 1 1 ILE 8 8 1 1 PRO 9 9 1 1 CYS 10 10 1 1 ILE 11 11 1 1 SER 12 12 1 1 ALA 13 13 1 1 ALA 14 14 1 1 LEU 15 15 1 1 GLY 16 16 1 1 CYS 17 17 1 1 SER 18 18 1 1 CYS 19 19 1 1 LYS 20 20 1 1 ASN 21 21 1 1 LYS 22 22 1 1 VAL 23 23 1 1 CYS 24 24 1 1 TYR 25 25 1 1 ARG 26 26 1 1 ASN 27 27 1 1 GLY 28 28 1 1 ILE 29 29 1 1 PRO 30 30 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 1 212 1 . . . 1 1 213 1 . . . 1 1 214 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 4 SER H . 1 . HN 1 1 1 1 2 1 1 4 SER HA . 1 . HA 1 1 2 1 1 1 1 4 SER H . 1 . HN 1 1 2 1 2 1 1 4 SER HB2 . 1 . HB2 1 1 3 1 1 1 1 4 SER H . 1 . HN 1 1 3 1 2 1 1 4 SER HB3 . 1 . HB1 1 1 4 1 1 1 1 4 SER HA . 1 . HA 1 1 4 1 2 1 1 5 CYS H . 2 . HN 1 1 5 1 1 1 1 4 SER HA . 1 . HA 1 1 5 1 2 1 1 23 VAL HA . 20 . HA 1 1 6 1 1 1 1 4 SER HA . 1 . HA 1 1 6 1 2 1 1 23 VAL MG1 . 20 . HG1* 1 1 7 1 1 1 1 4 SER HA . 1 . HA 1 1 7 1 2 1 1 23 VAL MG2 . 20 . HG2* 1 1 8 1 1 1 1 4 SER HA . 1 . HA 1 1 8 1 2 1 1 24 CYS H . 21 . HN 1 1 9 1 1 1 1 4 SER HB2 . 1 . HB2 1 1 9 1 2 1 1 5 CYS H . 2 . HN 1 1 10 1 1 1 1 4 SER HB2 . 1 . HB2 1 1 10 1 2 1 1 6 VAL H . 3 . HN 1 1 11 1 1 1 1 4 SER HB3 . 1 . HB1 1 1 11 1 2 1 1 5 CYS H . 2 . HN 1 1 12 1 1 1 1 4 SER HB3 . 1 . HB1 1 1 12 1 2 1 1 6 VAL H . 3 . HN 1 1 13 1 1 1 1 5 CYS H . 2 . HN 1 1 13 1 2 1 1 5 CYS HA . 2 . HA 1 1 14 1 1 1 1 5 CYS H . 2 . HN 1 1 14 1 2 1 1 5 CYS HB2 . 2 . HB2 1 1 15 1 1 1 1 5 CYS H . 2 . HN 1 1 15 1 2 1 1 5 CYS HB3 . 2 . HB1 1 1 16 1 1 1 1 5 CYS H . 2 . HN 1 1 16 1 2 1 1 23 VAL HA . 20 . HA 1 1 17 1 1 1 1 5 CYS HA . 2 . HA 1 1 17 1 2 1 1 5 CYS HB2 . 2 . HB2 1 1 18 1 1 1 1 5 CYS HA . 2 . HA 1 1 18 1 2 1 1 5 CYS HB3 . 2 . HB1 1 1 19 1 1 1 1 5 CYS HA . 2 . HA 1 1 19 1 2 1 1 6 VAL H . 3 . HN 1 1 20 1 1 1 1 5 CYS HA . 2 . HA 1 1 20 1 2 1 1 6 VAL QG . 3 . HG* 1 1 21 1 1 1 1 5 CYS HA . 2 . HA 1 1 21 1 2 1 1 7 TRP H . 4 . HN 1 1 22 1 1 1 1 5 CYS HA . 2 . HA 1 1 22 1 2 1 1 8 ILE H . 5 . HN 1 1 23 1 1 1 1 5 CYS HB2 . 2 . HB2 1 1 23 1 2 1 1 9 PRO HA . 6 . HA 1 1 24 1 1 1 1 5 CYS HB2 . 2 . HB2 1 1 24 1 2 1 1 10 CYS H . 7 . HN 1 1 25 1 1 1 1 5 CYS HB3 . 2 . HB1 1 1 25 1 2 1 1 9 PRO HA . 6 . HA 1 1 26 1 1 1 1 5 CYS HB3 . 2 . HB1 1 1 26 1 2 1 1 10 CYS H . 7 . HN 1 1 27 1 1 1 1 6 VAL H . 3 . HN 1 1 27 1 2 1 1 6 VAL HB . 3 . HB 1 1 28 1 1 1 1 6 VAL H . 3 . HN 1 1 28 1 2 1 1 7 TRP H . 4 . HN 1 1 29 1 1 1 1 6 VAL H . 3 . HN 1 1 29 1 2 1 1 8 ILE H . 5 . HN 1 1 30 1 1 1 1 6 VAL HA . 3 . HA 1 1 30 1 2 1 1 7 TRP H . 4 . HN 1 1 31 1 1 1 1 6 VAL HA . 3 . HA 1 1 31 1 2 1 1 22 LYS HB2 . 19 . HB2 1 1 32 1 1 1 1 6 VAL HA . 3 . HA 1 1 32 1 2 1 1 22 LYS HB3 . 19 . HB1 1 1 33 1 1 1 1 6 VAL HB . 3 . HB 1 1 33 1 2 1 1 7 TRP H . 4 . HN 1 1 34 1 1 1 1 6 VAL QG . 3 . HG* 1 1 34 1 2 1 1 7 TRP HA . 4 . HA 1 1 35 1 1 1 1 6 VAL MG1 . 3 . HG1* 1 1 35 1 2 1 1 7 TRP H . 4 . HN 1 1 36 1 1 1 1 6 VAL MG2 . 3 . HG2* 1 1 36 1 2 1 1 7 TRP H . 4 . HN 1 1 37 1 1 1 1 7 TRP H . 4 . HN 1 1 37 1 2 1 1 7 TRP HA . 4 . HA 1 1 38 1 1 1 1 7 TRP H . 4 . HN 1 1 38 1 2 1 1 7 TRP HB2 . 4 . HB2 1 1 39 1 1 1 1 7 TRP H . 4 . HN 1 1 39 1 2 1 1 7 TRP HB3 . 4 . HB1 1 1 40 1 1 1 1 7 TRP H . 4 . HN 1 1 40 1 2 1 1 8 ILE H . 5 . HN 1 1 41 1 1 1 1 7 TRP HA . 4 . HA 1 1 41 1 2 1 1 8 ILE H . 5 . HN 1 1 42 1 1 1 1 7 TRP QB . 4 . HB* 1 1 42 1 2 1 1 8 ILE MD . 5 . HD1* 1 1 43 1 1 1 1 7 TRP HB2 . 4 . HB2 1 1 43 1 2 1 1 8 ILE H . 5 . HN 1 1 44 1 1 1 1 7 TRP HB2 . 4 . HB2 1 1 44 1 2 1 1 8 ILE MG . 5 . HG2* 1 1 45 1 1 1 1 7 TRP HB3 . 4 . HB1 1 1 45 1 2 1 1 8 ILE H . 5 . HN 1 1 46 1 1 1 1 7 TRP HB3 . 4 . HB1 1 1 46 1 2 1 1 8 ILE MG . 5 . HG2* 1 1 47 1 1 1 1 8 ILE H . 5 . HN 1 1 47 1 2 1 1 8 ILE HA . 5 . HA 1 1 48 1 1 1 1 8 ILE H . 5 . HN 1 1 48 1 2 1 1 8 ILE HB . 5 . HB 1 1 49 1 1 1 1 8 ILE H . 5 . HN 1 1 49 1 2 1 1 8 ILE HG13 . 5 . HG11 1 1 50 1 1 1 1 8 ILE HA . 5 . HA 1 1 50 1 2 1 1 8 ILE HB . 5 . HB 1 1 51 1 1 1 1 8 ILE HA . 5 . HA 1 1 51 1 2 1 1 9 PRO HD2 . 6 . HD2 1 1 52 1 1 1 1 8 ILE HA . 5 . HA 1 1 52 1 2 1 1 9 PRO HD3 . 6 . HD1 1 1 53 1 1 1 1 8 ILE MG . 5 . HG2* 1 1 53 1 2 1 1 9 PRO HD2 . 6 . HD2 1 1 54 1 1 1 1 8 ILE MG . 5 . HG2* 1 1 54 1 2 1 1 9 PRO HD3 . 6 . HD1 1 1 55 1 1 1 1 9 PRO HA . 6 . HA 1 1 55 1 2 1 1 10 CYS H . 7 . HN 1 1 56 1 1 1 1 9 PRO HB2 . 6 . HB2 1 1 56 1 2 1 1 10 CYS H . 7 . HN 1 1 57 1 1 1 1 9 PRO QG . 6 . HG* 1 1 57 1 2 1 1 10 CYS H . 7 . HN 1 1 58 1 1 1 1 10 CYS H . 7 . HN 1 1 58 1 2 1 1 11 ILE H . 8 . HN 1 1 59 1 1 1 1 10 CYS H . 7 . HN 1 1 59 1 2 1 1 19 CYS QB . 16 . HB* 1 1 60 1 1 1 1 10 CYS HA . 7 . HA 1 1 60 1 2 1 1 10 CYS HB2 . 7 . HB2 1 1 61 1 1 1 1 10 CYS HA . 7 . HA 1 1 61 1 2 1 1 10 CYS HB3 . 7 . HB1 1 1 62 1 1 1 1 10 CYS HA . 7 . HA 1 1 62 1 2 1 1 11 ILE H . 8 . HN 1 1 63 1 1 1 1 10 CYS HA . 7 . HA 1 1 63 1 2 1 1 12 SER H . 9 . HN 1 1 64 1 1 1 1 10 CYS HB2 . 7 . HB2 1 1 64 1 2 1 1 11 ILE H . 8 . HN 1 1 65 1 1 1 1 10 CYS HB2 . 7 . HB2 1 1 65 1 2 1 1 12 SER H . 9 . HN 1 1 66 1 1 1 1 10 CYS HB2 . 7 . HB2 1 1 66 1 2 1 1 13 ALA H . 10 . HN 1 1 67 1 1 1 1 10 CYS HB3 . 7 . HB1 1 1 67 1 2 1 1 11 ILE H . 8 . HN 1 1 68 1 1 1 1 10 CYS HB3 . 7 . HB1 1 1 68 1 2 1 1 12 SER H . 9 . HN 1 1 69 1 1 1 1 10 CYS HB3 . 7 . HB1 1 1 69 1 2 1 1 13 ALA H . 10 . HN 1 1 70 1 1 1 1 11 ILE H . 8 . HN 1 1 70 1 2 1 1 11 ILE HB . 8 . HB 1 1 71 1 1 1 1 11 ILE H . 8 . HN 1 1 71 1 2 1 1 11 ILE QG . 8 . HG1* 1 1 72 1 1 1 1 11 ILE H . 8 . HN 1 1 72 1 2 1 1 12 SER H . 9 . HN 1 1 73 1 1 1 1 11 ILE HA . 8 . HA 1 1 73 1 2 1 1 11 ILE HB . 8 . HB 1 1 74 1 1 1 1 11 ILE HA . 8 . HA 1 1 74 1 2 1 1 12 SER H . 9 . HN 1 1 75 1 1 1 1 11 ILE HB . 8 . HB 1 1 75 1 2 1 1 12 SER H . 9 . HN 1 1 76 1 1 1 1 11 ILE MD . 8 . HD* 1 1 76 1 2 1 1 12 SER H . 9 . HN 1 1 77 1 1 1 1 11 ILE QG . 8 . HG1* 1 1 77 1 2 1 1 12 SER H . 9 . HN 1 1 78 1 1 1 1 12 SER H . 9 . HN 1 1 78 1 2 1 1 12 SER HA . 9 . HA 1 1 79 1 1 1 1 12 SER H . 9 . HN 1 1 79 1 2 1 1 12 SER HB2 . 9 . HB2 1 1 80 1 1 1 1 12 SER H . 9 . HN 1 1 80 1 2 1 1 12 SER HB3 . 9 . HB1 1 1 81 1 1 1 1 12 SER H . 9 . HN 1 1 81 1 2 1 1 13 ALA H . 10 . HN 1 1 82 1 1 1 1 12 SER HA . 9 . HA 1 1 82 1 2 1 1 13 ALA H . 10 . HN 1 1 83 1 1 1 1 12 SER HA . 9 . HA 1 1 83 1 2 1 1 15 LEU H . 12 . HN 1 1 84 1 1 1 1 12 SER HB2 . 9 . HB2 1 1 84 1 2 1 1 13 ALA H . 10 . HN 1 1 85 1 1 1 1 12 SER HB3 . 9 . HB1 1 1 85 1 2 1 1 13 ALA H . 10 . HN 1 1 86 1 1 1 1 13 ALA H . 10 . HN 1 1 86 1 2 1 1 13 ALA HA . 10 . HA 1 1 87 1 1 1 1 13 ALA H . 10 . HN 1 1 87 1 2 1 1 14 ALA H . 11 . HN 1 1 88 1 1 1 1 13 ALA HA . 10 . HA 1 1 88 1 2 1 1 14 ALA H . 11 . HN 1 1 89 1 1 1 1 13 ALA HA . 10 . HA 1 1 89 1 2 1 1 15 LEU H . 12 . HN 1 1 90 1 1 1 1 13 ALA HA . 10 . HA 1 1 90 1 2 1 1 17 CYS H . 14 . HN 1 1 91 1 1 1 1 13 ALA MB . 10 . HB* 1 1 91 1 2 1 1 14 ALA H . 11 . HN 1 1 92 1 1 1 1 14 ALA H . 11 . HN 1 1 92 1 2 1 1 15 LEU H . 12 . HN 1 1 93 1 1 1 1 15 LEU H . 12 . HN 1 1 93 1 2 1 1 15 LEU HA . 12 . HA 1 1 94 1 1 1 1 15 LEU H . 12 . HN 1 1 94 1 2 1 1 15 LEU HB2 . 12 . HB2 1 1 95 1 1 1 1 15 LEU H . 12 . HN 1 1 95 1 2 1 1 15 LEU HB3 . 12 . HB1 1 1 96 1 1 1 1 15 LEU H . 12 . HN 1 1 96 1 2 1 1 15 LEU HG . 12 . HG 1 1 97 1 1 1 1 15 LEU HA . 12 . HA 1 1 97 1 2 1 1 15 LEU HG . 12 . HG 1 1 98 1 1 1 1 15 LEU HA . 12 . HA 1 1 98 1 2 1 1 16 GLY H . 13 . HN 1 1 99 1 1 1 1 15 LEU HB2 . 12 . HB2 1 1 99 1 2 1 1 16 GLY H . 13 . HN 1 1 100 1 1 1 1 15 LEU HB3 . 12 . HB1 1 1 100 1 2 1 1 16 GLY H . 13 . HN 1 1 101 1 1 1 1 15 LEU QD . 12 . HD* 1 1 101 1 2 1 1 16 GLY H . 13 . HN 1 1 102 1 1 1 1 16 GLY H . 13 . HN 1 1 102 1 2 1 1 16 GLY HA2 . 13 . HA2 1 1 103 1 1 1 1 16 GLY H . 13 . HN 1 1 103 1 2 1 1 16 GLY HA3 . 13 . HA1 1 1 104 1 1 1 1 16 GLY H . 13 . HN 1 1 104 1 2 1 1 17 CYS H . 14 . HN 1 1 105 1 1 1 1 16 GLY HA2 . 13 . HA2 1 1 105 1 2 1 1 17 CYS H . 14 . HN 1 1 106 1 1 1 1 16 GLY HA3 . 13 . HA1 1 1 106 1 2 1 1 17 CYS H . 14 . HN 1 1 107 1 1 1 1 17 CYS H . 14 . HN 1 1 107 1 2 1 1 17 CYS HB2 . 14 . HB2 1 1 108 1 1 1 1 17 CYS H . 14 . HN 1 1 108 1 2 1 1 17 CYS HB3 . 14 . HB1 1 1 109 1 1 1 1 17 CYS H . 14 . HN 1 1 109 1 2 1 1 18 SER H . 15 . HN 1 1 110 1 1 1 1 17 CYS HA . 14 . HA 1 1 110 1 2 1 1 18 SER H . 15 . HN 1 1 111 1 1 1 1 17 CYS HB2 . 14 . HB2 1 1 111 1 2 1 1 18 SER H . 15 . HN 1 1 112 1 1 1 1 17 CYS HB2 . 14 . HB2 1 1 112 1 2 1 1 25 TYR H . 22 . HN 1 1 113 1 1 1 1 17 CYS HB3 . 14 . HB1 1 1 113 1 2 1 1 18 SER H . 15 . HN 1 1 114 1 1 1 1 18 SER H . 15 . HN 1 1 114 1 2 1 1 18 SER QB . 15 . HB* 1 1 115 1 1 1 1 18 SER H . 15 . HN 1 1 115 1 2 1 1 24 CYS HA . 21 . HA 1 1 116 1 1 1 1 18 SER H . 15 . HN 1 1 116 1 2 1 1 25 TYR H . 22 . HN 1 1 117 1 1 1 1 18 SER HA . 15 . HA 1 1 117 1 2 1 1 19 CYS H . 16 . HN 1 1 118 1 1 1 1 18 SER QB . 15 . HB* 1 1 118 1 2 1 1 19 CYS H . 16 . HN 1 1 119 1 1 1 1 19 CYS H . 16 . HN 1 1 119 1 2 1 1 19 CYS QB . 16 . HB* 1 1 120 1 1 1 1 19 CYS HA . 16 . HA 1 1 120 1 2 1 1 20 LYS H . 17 . HN 1 1 121 1 1 1 1 19 CYS HA . 16 . HA 1 1 121 1 2 1 1 23 VAL H . 20 . HN 1 1 122 1 1 1 1 19 CYS HA . 16 . HA 1 1 122 1 2 1 1 25 TYR H . 22 . HN 1 1 123 1 1 1 1 19 CYS QB . 16 . HB* 1 1 123 1 2 1 1 20 LYS H . 17 . HN 1 1 124 1 1 1 1 19 CYS QB . 16 . HB* 1 1 124 1 2 1 1 25 TYR H . 22 . HN 1 1 125 1 1 1 1 20 LYS H . 17 . HN 1 1 125 1 2 1 1 20 LYS QB . 17 . HB* 1 1 126 1 1 1 1 20 LYS H . 17 . HN 1 1 126 1 2 1 1 20 LYS QE . 17 . HE* 1 1 127 1 1 1 1 20 LYS H . 17 . HN 1 1 127 1 2 1 1 21 ASN H . 18 . HN 1 1 128 1 1 1 1 20 LYS H . 17 . HN 1 1 128 1 2 1 1 22 LYS H . 19 . HN 1 1 129 1 1 1 1 20 LYS H . 17 . HN 1 1 129 1 2 1 1 23 VAL H . 20 . HN 1 1 130 1 1 1 1 20 LYS H . 17 . HN 1 1 130 1 2 1 1 24 CYS HA . 21 . HA 1 1 131 1 1 1 1 20 LYS H . 17 . HN 1 1 131 1 2 1 1 25 TYR H . 22 . HN 1 1 132 1 1 1 1 20 LYS H . 17 . HN 1 1 132 1 2 1 1 25 TYR QD . 22 . HD* 1 1 133 1 1 1 1 20 LYS HA . 17 . HA 1 1 133 1 2 1 1 21 ASN H . 18 . HN 1 1 134 1 1 1 1 20 LYS HA . 17 . HA 1 1 134 1 2 1 1 22 LYS H . 19 . HN 1 1 135 1 1 1 1 20 LYS QB . 17 . HB* 1 1 135 1 2 1 1 21 ASN H . 18 . HN 1 1 136 1 1 1 1 20 LYS QD . 17 . HD* 1 1 136 1 2 1 1 21 ASN H . 18 . HN 1 1 137 1 1 1 1 20 LYS QG . 17 . HG* 1 1 137 1 2 1 1 21 ASN H . 18 . HN 1 1 138 1 1 1 1 21 ASN H . 18 . HN 1 1 138 1 2 1 1 21 ASN HA . 18 . HA 1 1 139 1 1 1 1 21 ASN H . 18 . HN 1 1 139 1 2 1 1 22 LYS H . 19 . HN 1 1 140 1 1 1 1 21 ASN HA . 18 . HA 1 1 140 1 2 1 1 22 LYS H . 19 . HN 1 1 141 1 1 1 1 21 ASN QB . 18 . HB* 1 1 141 1 2 1 1 22 LYS QD . 19 . HD* 1 1 142 1 1 1 1 21 ASN HB2 . 18 . HB2 1 1 142 1 2 1 1 22 LYS H . 19 . HN 1 1 143 1 1 1 1 21 ASN HB3 . 18 . HB1 1 1 143 1 2 1 1 22 LYS H . 19 . HN 1 1 144 1 1 1 1 22 LYS H . 19 . HN 1 1 144 1 2 1 1 22 LYS HA . 19 . HA 1 1 145 1 1 1 1 22 LYS H . 19 . HN 1 1 145 1 2 1 1 22 LYS QG . 19 . HG* 1 1 146 1 1 1 1 22 LYS H . 19 . HN 1 1 146 1 2 1 1 23 VAL H . 20 . HN 1 1 147 1 1 1 1 22 LYS HA . 19 . HA 1 1 147 1 2 1 1 22 LYS HB2 . 19 . HB2 1 1 148 1 1 1 1 22 LYS HA . 19 . HA 1 1 148 1 2 1 1 22 LYS HB3 . 19 . HB1 1 1 149 1 1 1 1 22 LYS HA . 19 . HA 1 1 149 1 2 1 1 22 LYS QG . 19 . HG* 1 1 150 1 1 1 1 22 LYS HA . 19 . HA 1 1 150 1 2 1 1 23 VAL H . 20 . HN 1 1 151 1 1 1 1 22 LYS QB . 19 . HB* 1 1 151 1 2 1 1 22 LYS HD2 . 19 . HD2 1 1 152 1 1 1 1 22 LYS QB . 19 . HB* 1 1 152 1 2 1 1 22 LYS HD3 . 19 . HD1 1 1 153 1 1 1 1 22 LYS HB2 . 19 . HB2 1 1 153 1 2 1 1 23 VAL H . 20 . HN 1 1 154 1 1 1 1 22 LYS HB3 . 19 . HB1 1 1 154 1 2 1 1 23 VAL H . 20 . HN 1 1 155 1 1 1 1 23 VAL H . 20 . HN 1 1 155 1 2 1 1 23 VAL HA . 20 . HA 1 1 156 1 1 1 1 23 VAL H . 20 . HN 1 1 156 1 2 1 1 23 VAL HB . 20 . HB 1 1 157 1 1 1 1 23 VAL H . 20 . HN 1 1 157 1 2 1 1 25 TYR QD . 22 . HD* 1 1 158 1 1 1 1 23 VAL H . 20 . HN 1 1 158 1 2 1 1 25 TYR QE . 22 . HE* 1 1 159 1 1 1 1 23 VAL HA . 20 . HA 1 1 159 1 2 1 1 24 CYS H . 21 . HN 1 1 160 1 1 1 1 23 VAL MG1 . 20 . HG1* 1 1 160 1 2 1 1 24 CYS H . 21 . HN 1 1 161 1 1 1 1 23 VAL MG1 . 20 . HG1* 1 1 161 1 2 1 1 25 TYR QD . 22 . HD* 1 1 162 1 1 1 1 23 VAL MG1 . 20 . HG1* 1 1 162 1 2 1 1 25 TYR QE . 22 . HE* 1 1 163 1 1 1 1 23 VAL MG2 . 20 . HG2* 1 1 163 1 2 1 1 24 CYS H . 21 . HN 1 1 164 1 1 1 1 23 VAL MG2 . 20 . HG2* 1 1 164 1 2 1 1 25 TYR QD . 22 . HD* 1 1 165 1 1 1 1 23 VAL MG2 . 20 . HG2* 1 1 165 1 2 1 1 25 TYR QE . 22 . HE* 1 1 166 1 1 1 1 24 CYS H . 21 . HN 1 1 166 1 2 1 1 24 CYS HB2 . 21 . HB2 1 1 167 1 1 1 1 24 CYS H . 21 . HN 1 1 167 1 2 1 1 24 CYS HB3 . 21 . HB1 1 1 168 1 1 1 1 24 CYS HA . 21 . HA 1 1 168 1 2 1 1 25 TYR H . 22 . HN 1 1 169 1 1 1 1 24 CYS HB2 . 21 . HB2 1 1 169 1 2 1 1 25 TYR H . 22 . HN 1 1 170 1 1 1 1 24 CYS HB3 . 21 . HB1 1 1 170 1 2 1 1 25 TYR H . 22 . HN 1 1 171 1 1 1 1 25 TYR H . 22 . HN 1 1 171 1 2 1 1 25 TYR HB2 . 22 . HB2 1 1 172 1 1 1 1 25 TYR H . 22 . HN 1 1 172 1 2 1 1 25 TYR HB3 . 22 . HB1 1 1 173 1 1 1 1 25 TYR HA . 22 . HA 1 1 173 1 2 1 1 26 ARG H . 23 . HN 1 1 174 1 1 1 1 25 TYR HA . 22 . HA 1 1 174 1 2 1 1 29 ILE H . 26 . HN 1 1 175 1 1 1 1 25 TYR HA . 22 . HA 1 1 175 1 2 1 1 30 PRO HA . 27 . HA 1 1 176 1 1 1 1 25 TYR HB2 . 22 . HB2 1 1 176 1 2 1 1 26 ARG H . 23 . HN 1 1 177 1 1 1 1 25 TYR HB2 . 22 . HB2 1 1 177 1 2 1 1 28 GLY H . 25 . HN 1 1 178 1 1 1 1 25 TYR HB2 . 22 . HB2 1 1 178 1 2 1 1 29 ILE H . 26 . HN 1 1 179 1 1 1 1 25 TYR HB3 . 22 . HB1 1 1 179 1 2 1 1 26 ARG H . 23 . HN 1 1 180 1 1 1 1 25 TYR HB3 . 22 . HB1 1 1 180 1 2 1 1 28 GLY H . 25 . HN 1 1 181 1 1 1 1 25 TYR HB3 . 22 . HB1 1 1 181 1 2 1 1 29 ILE H . 26 . HN 1 1 182 1 1 1 1 25 TYR QD . 22 . HD* 1 1 182 1 2 1 1 29 ILE HA . 26 . HA 1 1 183 1 1 1 1 25 TYR QD . 22 . HD* 1 1 183 1 2 1 1 30 PRO HA . 27 . HA 1 1 184 1 1 1 1 25 TYR QD . 22 . HD* 1 1 184 1 2 1 1 30 PRO HB2 . 27 . HB2 1 1 185 1 1 1 1 25 TYR QD . 22 . HD* 1 1 185 1 2 1 1 30 PRO HB3 . 27 . HB1 1 1 186 1 1 1 1 25 TYR QD . 22 . HD* 1 1 186 1 2 1 1 30 PRO HD2 . 27 . HD2 1 1 187 1 1 1 1 25 TYR QD . 22 . HD* 1 1 187 1 2 1 1 30 PRO HD3 . 27 . HD1 1 1 188 1 1 1 1 25 TYR QD . 22 . HD* 1 1 188 1 2 1 1 30 PRO QG . 27 . HG* 1 1 189 1 1 1 1 25 TYR QE . 22 . HE* 1 1 189 1 2 1 1 29 ILE H . 26 . HN 1 1 190 1 1 1 1 25 TYR QE . 22 . HE* 1 1 190 1 2 1 1 29 ILE HA . 26 . HA 1 1 191 1 1 1 1 25 TYR QE . 22 . HE* 1 1 191 1 2 1 1 30 PRO HA . 27 . HA 1 1 192 1 1 1 1 25 TYR QE . 22 . HE* 1 1 192 1 2 1 1 30 PRO HB2 . 27 . HB2 1 1 193 1 1 1 1 25 TYR QE . 22 . HE* 1 1 193 1 2 1 1 30 PRO HB3 . 27 . HB1 1 1 194 1 1 1 1 25 TYR QE . 22 . HE* 1 1 194 1 2 1 1 30 PRO HD2 . 27 . HD2 1 1 195 1 1 1 1 25 TYR QE . 22 . HE* 1 1 195 1 2 1 1 30 PRO HD3 . 27 . HD1 1 1 196 1 1 1 1 25 TYR QE . 22 . HE* 1 1 196 1 2 1 1 30 PRO QG . 27 . HG* 1 1 197 1 1 1 1 26 ARG H . 23 . HN 1 1 197 1 2 1 1 30 PRO HA . 27 . HA 1 1 198 1 1 1 1 26 ARG HA . 23 . HA 1 1 198 1 2 1 1 27 ASN H . 24 . HN 1 1 199 1 1 1 1 27 ASN H . 24 . HN 1 1 199 1 2 1 1 27 ASN HA . 24 . HA 1 1 200 1 1 1 1 27 ASN H . 24 . HN 1 1 200 1 2 1 1 28 GLY H . 25 . HN 1 1 201 1 1 1 1 27 ASN H . 24 . HN 1 1 201 1 2 1 1 29 ILE H . 26 . HN 1 1 202 1 1 1 1 27 ASN HA . 24 . HA 1 1 202 1 2 1 1 28 GLY H . 25 . HN 1 1 203 1 1 1 1 28 GLY H . 25 . HN 1 1 203 1 2 1 1 28 GLY HA2 . 25 . HA2 1 1 204 1 1 1 1 28 GLY H . 25 . HN 1 1 204 1 2 1 1 28 GLY HA3 . 25 . HA1 1 1 205 1 1 1 1 28 GLY H . 25 . HN 1 1 205 1 2 1 1 29 ILE H . 26 . HN 1 1 206 1 1 1 1 28 GLY HA2 . 25 . HA2 1 1 206 1 2 1 1 29 ILE H . 26 . HN 1 1 207 1 1 1 1 28 GLY HA3 . 25 . HA1 1 1 207 1 2 1 1 29 ILE H . 26 . HN 1 1 208 1 1 1 1 29 ILE H . 26 . HN 1 1 208 1 2 1 1 29 ILE HB . 26 . HB 1 1 209 1 1 1 1 29 ILE H . 26 . HN 1 1 209 1 2 1 1 29 ILE HG12 . 26 . HG12 1 1 210 1 1 1 1 29 ILE H . 26 . HN 1 1 210 1 2 1 1 29 ILE HG13 . 26 . HG11 1 1 211 1 1 1 1 29 ILE HA . 26 . HA 1 1 211 1 2 1 1 29 ILE HB . 26 . HB 1 1 212 1 1 1 1 29 ILE HA . 26 . HA 1 1 212 1 2 1 1 30 PRO HD2 . 27 . HD2 1 1 213 1 1 1 1 29 ILE HA . 26 . HA 1 1 213 1 2 1 1 30 PRO HD3 . 27 . HD1 1 1 214 1 1 1 1 29 ILE MG . 26 . HG2* 1 1 214 1 2 1 1 30 PRO QD . 27 . HD* 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 . . . . . 0.0 0.0 2.7 1 1 2 1 . . . . . 0.0 0.0 3.5 1 1 3 1 . . . . . 0.0 0.0 3.5 1 1 4 1 . . . . . 0.0 0.0 2.7 1 1 5 1 . . . . . 0.0 0.0 3.5 1 1 6 1 . . . . . 0.0 0.0 7.5 1 1 7 1 . . . . . 0.0 0.0 7.5 1 1 8 1 . . . . . 0.0 0.0 3.5 1 1 9 1 . . . . . 0.0 0.0 3.5 1 1 10 1 . . . . . 0.0 0.0 5.0 1 1 11 1 . . . . . 0.0 0.0 3.5 1 1 12 1 . . . . . 0.0 0.0 5.0 1 1 13 1 . . . . . 0.0 0.0 2.7 1 1 14 1 . . . . . 0.0 0.0 3.5 1 1 15 1 . . . . . 0.0 0.0 3.5 1 1 16 1 . . . . . 0.0 0.0 3.5 1 1 17 1 . . . . . 0.0 0.0 2.7 1 1 18 1 . . . . . 0.0 0.0 2.7 1 1 19 1 . . . . . 0.0 0.0 2.7 1 1 20 1 . . . . . 0.0 0.0 7.5 1 1 21 1 . . . . . 0.0 0.0 5.0 1 1 22 1 . . . . . 0.0 0.0 3.5 1 1 23 1 . . . . . 0.0 0.0 5.0 1 1 24 1 . . . . . 0.0 0.0 5.0 1 1 25 1 . . . . . 0.0 0.0 5.0 1 1 26 1 . . . . . 0.0 0.0 5.0 1 1 27 1 . . . . . 0.0 0.0 2.7 1 1 28 1 . . . . . 0.0 0.0 3.5 1 1 29 1 . . . . . 0.0 0.0 5.0 1 1 30 1 . . . . . 0.0 0.0 3.5 1 1 31 1 . . . . . 0.0 0.0 5.0 1 1 32 1 . . . . . 0.0 0.0 5.0 1 1 33 1 . . . . . 0.0 0.0 2.7 1 1 34 1 . . . . . 0.0 0.0 7.5 1 1 35 1 . . . . . 0.0 0.0 6.5 1 1 36 1 . . . . . 0.0 0.0 6.5 1 1 37 1 . . . . . 0.0 0.0 2.7 1 1 38 1 . . . . . 0.0 0.0 2.7 1 1 39 1 . . . . . 0.0 0.0 2.7 1 1 40 1 . . . . . 0.0 0.0 2.7 1 1 41 1 . . . . . 0.0 0.0 3.5 1 1 42 1 . . . . . 0.0 0.0 7.5 1 1 43 1 . . . . . 0.0 0.0 3.5 1 1 44 1 . . . . . 0.0 0.0 6.5 1 1 45 1 . . . . . 0.0 0.0 3.5 1 1 46 1 . . . . . 0.0 0.0 6.5 1 1 47 1 . . . . . 0.0 0.0 2.7 1 1 48 1 . . . . . 0.0 0.0 3.5 1 1 49 1 . . . . . 0.0 0.0 5.0 1 1 50 1 . . . . . 0.0 0.0 2.7 1 1 51 1 . . . . . 0.0 0.0 2.7 1 1 52 1 . . . . . 0.0 0.0 2.7 1 1 53 1 . . . . . 0.0 0.0 7.5 1 1 54 1 . . . . . 0.0 0.0 7.5 1 1 55 1 . . . . . 0.0 0.0 2.7 1 1 56 1 . . . . . 0.0 0.0 3.5 1 1 57 1 . . . . . 0.0 0.0 6.0 1 1 58 1 . . . . . 0.0 0.0 5.0 1 1 59 1 . . . . . 0.0 0.0 6.0 1 1 60 1 . . . . . 0.0 0.0 2.7 1 1 61 1 . . . . . 0.0 0.0 2.7 1 1 62 1 . . . . . 0.0 0.0 2.7 1 1 63 1 . . . . . 0.0 0.0 5.0 1 1 64 1 . . . . . 0.0 0.0 5.0 1 1 65 1 . . . . . 0.0 0.0 5.0 1 1 66 1 . . . . . 0.0 0.0 5.0 1 1 67 1 . . . . . 0.0 0.0 5.0 1 1 68 1 . . . . . 0.0 0.0 5.0 1 1 69 1 . . . . . 0.0 0.0 5.0 1 1 70 1 . . . . . 0.0 0.0 3.5 1 1 71 1 . . . . . 0.0 0.0 5.0 1 1 72 1 . . . . . 0.0 0.0 3.5 1 1 73 1 . . . . . 0.0 0.0 2.7 1 1 74 1 . . . . . 0.0 0.0 3.5 1 1 75 1 . . . . . 0.0 0.0 2.7 1 1 76 1 . . . . . 0.0 0.0 5.5 1 1 77 1 . . . . . 0.0 0.0 6.5 1 1 78 1 . . . . . 0.0 0.0 2.7 1 1 79 1 . . . . . 0.0 0.0 3.5 1 1 80 1 . . . . . 0.0 0.0 3.5 1 1 81 1 . . . . . 0.0 0.0 3.5 1 1 82 1 . . . . . 0.0 0.0 3.5 1 1 83 1 . . . . . 0.0 0.0 5.0 1 1 84 1 . . . . . 0.0 0.0 3.5 1 1 85 1 . . . . . 0.0 0.0 3.5 1 1 86 1 . . . . . 0.0 0.0 2.7 1 1 87 1 . . . . . 0.0 0.0 3.5 1 1 88 1 . . . . . 0.0 0.0 3.5 1 1 89 1 . . . . . 0.0 0.0 5.0 1 1 90 1 . . . . . 0.0 0.0 3.5 1 1 91 1 . . . . . 0.0 0.0 5.0 1 1 92 1 . . . . . 0.0 0.0 3.5 1 1 93 1 . . . . . 0.0 0.0 2.7 1 1 94 1 . . . . . 0.0 0.0 3.5 1 1 95 1 . . . . . 0.0 0.0 3.5 1 1 96 1 . . . . . 0.0 0.0 3.5 1 1 97 1 . . . . . 0.0 0.0 3.5 1 1 98 1 . . . . . 0.0 0.0 3.5 1 1 99 1 . . . . . 0.0 0.0 5.0 1 1 100 1 . . . . . 0.0 0.0 5.0 1 1 101 1 . . . . . 0.0 0.0 8.0 1 1 102 1 . . . . . 0.0 0.0 2.7 1 1 103 1 . . . . . 0.0 0.0 2.7 1 1 104 1 . . . . . 0.0 0.0 3.5 1 1 105 1 . . . . . 0.0 0.0 3.5 1 1 106 1 . . . . . 0.0 0.0 3.5 1 1 107 1 . . . . . 0.0 0.0 3.5 1 1 108 1 . . . . . 0.0 0.0 3.5 1 1 109 1 . . . . . 0.0 0.0 5.0 1 1 110 1 . . . . . 0.0 0.0 2.7 1 1 111 1 . . . . . 0.0 0.0 5.0 1 1 112 1 . . . . . 0.0 0.0 5.0 1 1 113 1 . . . . . 0.0 0.0 5.0 1 1 114 1 . . . . . 0.0 0.0 3.7 1 1 115 1 . . . . . 0.0 0.0 5.0 1 1 116 1 . . . . . 0.0 0.0 5.0 1 1 117 1 . . . . . 0.0 0.0 2.7 1 1 118 1 . . . . . 0.0 0.0 3.7 1 1 119 1 . . . . . 0.0 0.0 3.7 1 1 120 1 . . . . . 0.0 0.0 2.7 1 1 121 1 . . . . . 0.0 0.0 5.0 1 1 122 1 . . . . . 0.0 0.0 5.0 1 1 123 1 . . . . . 0.0 0.0 6.0 1 1 124 1 . . . . . 0.0 0.0 6.0 1 1 125 1 . . . . . 0.0 0.0 3.7 1 1 126 1 . . . . . 0.0 0.0 7.0 1 1 127 1 . . . . . 0.0 0.0 5.0 1 1 128 1 . . . . . 0.0 0.0 5.0 1 1 129 1 . . . . . 0.0 0.0 3.5 1 1 130 1 . . . . . 0.0 0.0 3.5 1 1 131 1 . . . . . 0.0 0.0 5.0 1 1 132 1 . . . . . 0.0 0.0 7.0 1 1 133 1 . . . . . 0.0 0.0 2.7 1 1 134 1 . . . . . 0.0 0.0 5.0 1 1 135 1 . . . . . 0.0 0.0 6.0 1 1 136 1 . . . . . 0.0 0.0 6.0 1 1 137 1 . . . . . 0.0 0.0 6.0 1 1 138 1 . . . . . 0.0 0.0 2.7 1 1 139 1 . . . . . 0.0 0.0 3.5 1 1 140 1 . . . . . 0.0 0.0 2.7 1 1 141 1 . . . . . 0.0 0.0 7.0 1 1 142 1 . . . . . 0.0 0.0 5.0 1 1 143 1 . . . . . 0.0 0.0 5.0 1 1 144 1 . . . . . 0.0 0.0 2.7 1 1 145 1 . . . . . 0.0 0.0 3.7 1 1 146 1 . . . . . 0.0 0.0 3.5 1 1 147 1 . . . . . 0.0 0.0 2.7 1 1 148 1 . . . . . 0.0 0.0 2.7 1 1 149 1 . . . . . 0.0 0.0 3.7 1 1 150 1 . . . . . 0.0 0.0 3.5 1 1 151 1 . . . . . 0.0 0.0 3.7 1 1 152 1 . . . . . 0.0 0.0 3.7 1 1 153 1 . . . . . 0.0 0.0 5.0 1 1 154 1 . . . . . 0.0 0.0 5.0 1 1 155 1 . . . . . 0.0 0.0 2.7 1 1 156 1 . . . . . 0.0 0.0 2.7 1 1 157 1 . . . . . 0.0 0.0 7.0 1 1 158 1 . . . . . 0.0 0.0 7.0 1 1 159 1 . . . . . 0.0 0.0 2.7 1 1 160 1 . . . . . 0.0 0.0 5.0 1 1 161 1 . . . . . 0.0 0.0 8.5 1 1 162 1 . . . . . 0.0 0.0 7.0 1 1 163 1 . . . . . 0.0 0.0 5.0 1 1 164 1 . . . . . 0.0 0.0 8.5 1 1 165 1 . . . . . 0.0 0.0 7.0 1 1 166 1 . . . . . 0.0 0.0 3.5 1 1 167 1 . . . . . 0.0 0.0 3.5 1 1 168 1 . . . . . 0.0 0.0 2.7 1 1 169 1 . . . . . 0.0 0.0 5.0 1 1 170 1 . . . . . 0.0 0.0 5.0 1 1 171 1 . . . . . 0.0 0.0 3.5 1 1 172 1 . . . . . 0.0 0.0 3.5 1 1 173 1 . . . . . 0.0 0.0 2.7 1 1 174 1 . . . . . 0.0 0.0 5.0 1 1 175 1 . . . . . 0.0 0.0 3.5 1 1 176 1 . . . . . 0.0 0.0 3.5 1 1 177 1 . . . . . 0.0 0.0 3.5 1 1 178 1 . . . . . 0.0 0.0 5.0 1 1 179 1 . . . . . 0.0 0.0 3.5 1 1 180 1 . . . . . 0.0 0.0 3.5 1 1 181 1 . . . . . 0.0 0.0 5.0 1 1 182 1 . . . . . 0.0 0.0 7.0 1 1 183 1 . . . . . 0.0 0.0 4.7 1 1 184 1 . . . . . 0.0 0.0 5.5 1 1 185 1 . . . . . 0.0 0.0 5.5 1 1 186 1 . . . . . 0.0 0.0 7.0 1 1 187 1 . . . . . 0.0 0.0 7.0 1 1 188 1 . . . . . 0.0 0.0 6.5 1 1 189 1 . . . . . 0.0 0.0 7.0 1 1 190 1 . . . . . 0.0 0.0 7.0 1 1 191 1 . . . . . 0.0 0.0 5.5 1 1 192 1 . . . . . 0.0 0.0 5.5 1 1 193 1 . . . . . 0.0 0.0 5.5 1 1 194 1 . . . . . 0.0 0.0 7.0 1 1 195 1 . . . . . 0.0 0.0 7.0 1 1 196 1 . . . . . 0.0 0.0 5.7 1 1 197 1 . . . . . 0.0 0.0 5.0 1 1 198 1 . . . . . 0.0 0.0 2.7 1 1 199 1 . . . . . 0.0 0.0 2.7 1 1 200 1 . . . . . 0.0 0.0 3.5 1 1 201 1 . . . . . 0.0 0.0 5.0 1 1 202 1 . . . . . 0.0 0.0 2.7 1 1 203 1 . . . . . 0.0 0.0 2.7 1 1 204 1 . . . . . 0.0 0.0 2.7 1 1 205 1 . . . . . 0.0 0.0 3.5 1 1 206 1 . . . . . 0.0 0.0 3.5 1 1 207 1 . . . . . 0.0 0.0 3.5 1 1 208 1 . . . . . 0.0 0.0 2.7 1 1 209 1 . . . . . 0.0 0.0 5.0 1 1 210 1 . . . . . 0.0 0.0 5.0 1 1 211 1 . . . . . 0.0 0.0 2.7 1 1 212 1 . . . . . 0.0 0.0 3.5 1 1 213 1 . . . . . 0.0 0.0 3.5 1 1 214 1 . . . . . 0.0 0.0 5.0 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 CYS C C 4.144 -0.755 -6.050 1.00 . A A . 1 CYS C 1 1 1 2 1 1 1 CYS CA C 4.924 0.473 -5.576 1.00 . A A . 1 CYS CA 1 1 1 3 1 1 1 CYS CB C 4.951 0.534 -4.052 1.00 . A A . 1 CYS CB 1 1 1 4 1 1 1 CYS HA H 5.930 0.435 -5.970 1.00 . A A . 1 CYS HA 1 1 1 5 1 1 1 CYS HB2 H 4.160 1.189 -3.745 1.00 . A A . 1 CYS HB2 1 1 1 6 1 1 1 CYS HB3 H 4.719 -0.445 -3.658 1.00 . A A . 1 CYS HB3 1 1 1 7 1 1 1 CYS N N 4.231 1.693 -6.088 1.00 . A A . 1 CYS N 1 1 1 8 1 1 1 CYS O O 4.730 -1.718 -6.507 1.00 . A A . 1 CYS O 1 1 1 9 1 1 1 CYS SG S 6.443 1.111 -3.208 1.00 . A A . 1 CYS SG 1 1 1 10 1 1 2 GLY C C 0.644 -1.265 -6.874 1.00 . A A . 2 GLY C 1 1 1 11 1 1 2 GLY CA C 1.968 -1.800 -6.343 1.00 . A A . 2 GLY CA 1 1 1 12 1 1 2 GLY H H 2.419 0.126 -5.541 1.00 . A A . 2 GLY H 1 1 1 13 1 1 2 GLY HA2 H 2.453 -2.366 -7.125 1.00 . A A . 2 GLY HA2 1 1 1 14 1 1 2 GLY HA3 H 1.782 -2.444 -5.494 1.00 . A A . 2 GLY HA3 1 1 1 15 1 1 2 GLY N N 2.840 -0.675 -5.919 1.00 . A A . 2 GLY N 1 1 1 16 1 1 2 GLY O O 0.513 -1.024 -8.059 1.00 . A A . 2 GLY O 1 1 1 17 1 1 3 GLU C C -2.597 -0.575 -5.102 1.00 . A A . 3 GLU C 1 1 1 18 1 1 3 GLU CA C -1.655 -0.577 -6.314 1.00 . A A . 3 GLU CA 1 1 1 19 1 1 3 GLU CB C -2.298 -1.462 -7.404 1.00 . A A . 3 GLU CB 1 1 1 20 1 1 3 GLU CD C -4.412 -1.283 -8.754 1.00 . A A . 3 GLU CD 1 1 1 21 1 1 3 GLU CG C -3.075 -0.596 -8.427 1.00 . A A . 3 GLU CG 1 1 1 22 1 1 3 GLU H H -0.059 -1.287 -5.036 1.00 . A A . 3 GLU H 1 1 1 23 1 1 3 GLU HA H -1.546 0.441 -6.654 1.00 . A A . 3 GLU HA 1 1 1 24 1 1 3 GLU HB2 H -1.532 -2.017 -7.905 1.00 . A A . 3 GLU HB2 1 1 1 25 1 1 3 GLU HB3 H -2.952 -2.184 -6.935 1.00 . A A . 3 GLU HB3 1 1 1 26 1 1 3 GLU HG2 H -3.277 0.391 -8.037 1.00 . A A . 3 GLU HG2 1 1 1 27 1 1 3 GLU HG3 H -2.495 -0.492 -9.332 1.00 . A A . 3 GLU HG3 1 1 1 28 1 1 3 GLU N N -0.285 -1.088 -5.966 1.00 . A A . 3 GLU N 1 1 1 29 1 1 3 GLU O O -2.192 -0.823 -3.985 1.00 . A A . 3 GLU O 1 1 1 30 1 1 3 GLU OE1 O -5.322 -1.109 -7.959 1.00 . A A . 3 GLU OE1 1 1 1 31 1 1 3 GLU OE2 O -4.452 -1.945 -9.778 1.00 . A A . 3 GLU OE2 1 1 1 32 1 1 4 SER C C -4.917 -1.468 -3.407 1.00 . A A . 4 SER C 1 1 1 33 1 1 4 SER CA C -4.897 -0.254 -4.328 1.00 . A A . 4 SER CA 1 1 1 34 1 1 4 SER CB C -6.282 -0.118 -4.980 1.00 . A A . 4 SER CB 1 1 1 35 1 1 4 SER H H -4.102 -0.122 -6.310 1.00 . A A . 4 SER H 1 1 1 36 1 1 4 SER HA H -4.693 0.601 -3.715 1.00 . A A . 4 SER HA 1 1 1 37 1 1 4 SER HB2 H -6.609 -1.053 -5.399 1.00 . A A . 4 SER HB2 1 1 1 38 1 1 4 SER HB3 H -7.005 0.235 -4.264 1.00 . A A . 4 SER HB3 1 1 1 39 1 1 4 SER HG H -5.438 0.577 -6.596 1.00 . A A . 4 SER HG 1 1 1 40 1 1 4 SER N N -3.846 -0.301 -5.383 1.00 . A A . 4 SER N 1 1 1 41 1 1 4 SER O O -4.606 -2.579 -3.793 1.00 . A A . 4 SER O 1 1 1 42 1 1 4 SER OG O -6.136 0.861 -6.001 1.00 . A A . 4 SER OG 1 1 1 43 1 1 5 CYS C C -6.791 -2.090 -0.446 1.00 . A A . 5 CYS C 1 1 1 44 1 1 5 CYS CA C -5.403 -2.156 -1.101 1.00 . A A . 5 CYS CA 1 1 1 45 1 1 5 CYS CB C -4.270 -1.827 -0.118 1.00 . A A . 5 CYS CB 1 1 1 46 1 1 5 CYS H H -5.524 -0.231 -2.012 1.00 . A A . 5 CYS H 1 1 1 47 1 1 5 CYS HA H -5.278 -3.129 -1.533 1.00 . A A . 5 CYS HA 1 1 1 48 1 1 5 CYS HB2 H -4.551 -2.149 0.872 1.00 . A A . 5 CYS HB2 1 1 1 49 1 1 5 CYS HB3 H -3.400 -2.394 -0.405 1.00 . A A . 5 CYS HB3 1 1 1 50 1 1 5 CYS N N -5.298 -1.160 -2.198 1.00 . A A . 5 CYS N 1 1 1 51 1 1 5 CYS O O -6.941 -2.257 0.751 1.00 . A A . 5 CYS O 1 1 1 52 1 1 5 CYS SG S -3.814 -0.078 -0.005 1.00 . A A . 5 CYS SG 1 1 1 53 1 1 6 VAL C C -9.678 -3.113 -0.293 1.00 . A A . 6 VAL C 1 1 1 54 1 1 6 VAL CA C -9.187 -1.749 -0.802 1.00 . A A . 6 VAL CA 1 1 1 55 1 1 6 VAL CB C -10.069 -1.256 -1.984 1.00 . A A . 6 VAL CB 1 1 1 56 1 1 6 VAL CG1 C -11.550 -1.167 -1.547 1.00 . A A . 6 VAL CG1 1 1 1 57 1 1 6 VAL CG2 C -9.600 0.146 -2.423 1.00 . A A . 6 VAL CG2 1 1 1 58 1 1 6 VAL H H -7.566 -1.732 -2.228 1.00 . A A . 6 VAL H 1 1 1 59 1 1 6 VAL HA H -9.231 -1.042 0.012 1.00 . A A . 6 VAL HA 1 1 1 60 1 1 6 VAL HB H -9.981 -1.938 -2.818 1.00 . A A . 6 VAL HB 1 1 1 61 1 1 6 VAL HG11 H -11.637 -0.620 -0.619 1.00 . A A . 6 VAL HG11 1 1 1 62 1 1 6 VAL HG12 H -12.132 -0.660 -2.305 1.00 . A A . 6 VAL HG12 1 1 1 63 1 1 6 VAL HG13 H -11.958 -2.157 -1.409 1.00 . A A . 6 VAL HG13 1 1 1 64 1 1 6 VAL HG21 H -8.563 0.112 -2.722 1.00 . A A . 6 VAL HG21 1 1 1 65 1 1 6 VAL HG22 H -10.189 0.489 -3.262 1.00 . A A . 6 VAL HG22 1 1 1 66 1 1 6 VAL HG23 H -9.705 0.851 -1.612 1.00 . A A . 6 VAL HG23 1 1 1 67 1 1 6 VAL N N -7.771 -1.848 -1.276 1.00 . A A . 6 VAL N 1 1 1 68 1 1 6 VAL O O -10.054 -3.248 0.856 1.00 . A A . 6 VAL O 1 1 1 69 1 1 7 TRP C C -9.160 -6.130 0.177 1.00 . A A . 7 TRP C 1 1 1 70 1 1 7 TRP CA C -10.104 -5.456 -0.826 1.00 . A A . 7 TRP CA 1 1 1 71 1 1 7 TRP CB C -10.178 -6.279 -2.120 1.00 . A A . 7 TRP CB 1 1 1 72 1 1 7 TRP CD1 C -10.560 -8.812 -1.790 1.00 . A A . 7 TRP CD1 1 1 1 73 1 1 7 TRP CD2 C -12.386 -7.557 -1.703 1.00 . A A . 7 TRP CD2 1 1 1 74 1 1 7 TRP CE2 C -12.774 -8.882 -1.506 1.00 . A A . 7 TRP CE2 1 1 1 75 1 1 7 TRP CE3 C -13.346 -6.545 -1.698 1.00 . A A . 7 TRP CE3 1 1 1 76 1 1 7 TRP CG C -11.032 -7.531 -1.875 1.00 . A A . 7 TRP CG 1 1 1 77 1 1 7 TRP CH2 C -15.073 -8.181 -1.297 1.00 . A A . 7 TRP CH2 1 1 1 78 1 1 7 TRP CZ2 C -14.116 -9.193 -1.304 1.00 . A A . 7 TRP CZ2 1 1 1 79 1 1 7 TRP CZ3 C -14.689 -6.858 -1.495 1.00 . A A . 7 TRP CZ3 1 1 1 80 1 1 7 TRP H H -9.338 -3.897 -2.080 1.00 . A A . 7 TRP H 1 1 1 81 1 1 7 TRP HA H -11.083 -5.373 -0.386 1.00 . A A . 7 TRP HA 1 1 1 82 1 1 7 TRP HB2 H -10.632 -5.692 -2.904 1.00 . A A . 7 TRP HB2 1 1 1 83 1 1 7 TRP HB3 H -9.191 -6.579 -2.443 1.00 . A A . 7 TRP HB3 1 1 1 84 1 1 7 TRP HD1 H -9.539 -9.150 -1.878 1.00 . A A . 7 TRP HD1 1 1 1 85 1 1 7 TRP HE1 H -11.588 -10.508 -1.470 1.00 . A A . 7 TRP HE1 1 1 1 86 1 1 7 TRP HE3 H -13.052 -5.517 -1.850 1.00 . A A . 7 TRP HE3 1 1 1 87 1 1 7 TRP HH2 H -16.113 -8.424 -1.141 1.00 . A A . 7 TRP HH2 1 1 1 88 1 1 7 TRP HZ2 H -14.414 -10.220 -1.151 1.00 . A A . 7 TRP HZ2 1 1 1 89 1 1 7 TRP HZ3 H -15.432 -6.074 -1.491 1.00 . A A . 7 TRP HZ3 1 1 1 90 1 1 7 TRP N N -9.655 -4.079 -1.174 1.00 . A A . 7 TRP N 1 1 1 91 1 1 7 TRP NE1 N -11.633 -9.535 -1.574 1.00 . A A . 7 TRP NE1 1 1 1 92 1 1 7 TRP O O -9.599 -6.641 1.188 1.00 . A A . 7 TRP O 1 1 1 93 1 1 8 ILE C C -5.664 -5.733 0.898 1.00 . A A . 8 ILE C 1 1 1 94 1 1 8 ILE CA C -6.842 -6.712 0.708 1.00 . A A . 8 ILE CA 1 1 1 95 1 1 8 ILE CB C -6.328 -8.033 0.049 1.00 . A A . 8 ILE CB 1 1 1 96 1 1 8 ILE CD1 C -5.542 -6.969 -2.145 1.00 . A A . 8 ILE CD1 1 1 1 97 1 1 8 ILE CG1 C -6.455 -8.037 -1.510 1.00 . A A . 8 ILE CG1 1 1 1 98 1 1 8 ILE CG2 C -7.137 -9.220 0.611 1.00 . A A . 8 ILE CG2 1 1 1 99 1 1 8 ILE H H -7.619 -5.677 -0.981 1.00 . A A . 8 ILE H 1 1 1 100 1 1 8 ILE HA H -7.281 -6.912 1.666 1.00 . A A . 8 ILE HA 1 1 1 101 1 1 8 ILE HB H -5.290 -8.165 0.306 1.00 . A A . 8 ILE HB 1 1 1 102 1 1 8 ILE HD11 H -4.620 -6.871 -1.591 1.00 . A A . 8 ILE HD11 1 1 1 103 1 1 8 ILE HD12 H -5.304 -7.252 -3.160 1.00 . A A . 8 ILE HD12 1 1 1 104 1 1 8 ILE HD13 H -6.044 -6.013 -2.166 1.00 . A A . 8 ILE HD13 1 1 1 105 1 1 8 ILE HG12 H -6.158 -9.006 -1.884 1.00 . A A . 8 ILE HG12 1 1 1 106 1 1 8 ILE HG13 H -7.479 -7.867 -1.806 1.00 . A A . 8 ILE HG13 1 1 1 107 1 1 8 ILE HG21 H -7.016 -9.278 1.683 1.00 . A A . 8 ILE HG21 1 1 1 108 1 1 8 ILE HG22 H -8.186 -9.100 0.383 1.00 . A A . 8 ILE HG22 1 1 1 109 1 1 8 ILE HG23 H -6.789 -10.146 0.175 1.00 . A A . 8 ILE HG23 1 1 1 110 1 1 8 ILE N N -7.894 -6.103 -0.151 1.00 . A A . 8 ILE N 1 1 1 111 1 1 8 ILE O O -5.434 -4.899 0.045 1.00 . A A . 8 ILE O 1 1 1 112 1 1 9 PRO C C -2.534 -5.626 1.379 1.00 . A A . 9 PRO C 1 1 1 113 1 1 9 PRO CA C -3.691 -5.066 2.226 1.00 . A A . 9 PRO CA 1 1 1 114 1 1 9 PRO CB C -3.418 -5.172 3.721 1.00 . A A . 9 PRO CB 1 1 1 115 1 1 9 PRO CD C -5.267 -6.741 3.149 1.00 . A A . 9 PRO CD 1 1 1 116 1 1 9 PRO CG C -4.224 -6.383 4.227 1.00 . A A . 9 PRO CG 1 1 1 117 1 1 9 PRO HA H -3.862 -4.035 1.953 1.00 . A A . 9 PRO HA 1 1 1 118 1 1 9 PRO HB2 H -2.365 -5.316 3.918 1.00 . A A . 9 PRO HB2 1 1 1 119 1 1 9 PRO HB3 H -3.747 -4.274 4.224 1.00 . A A . 9 PRO HB3 1 1 1 120 1 1 9 PRO HD2 H -5.182 -7.773 2.844 1.00 . A A . 9 PRO HD2 1 1 1 121 1 1 9 PRO HD3 H -6.267 -6.534 3.503 1.00 . A A . 9 PRO HD3 1 1 1 122 1 1 9 PRO HG2 H -3.563 -7.222 4.392 1.00 . A A . 9 PRO HG2 1 1 1 123 1 1 9 PRO HG3 H -4.719 -6.140 5.156 1.00 . A A . 9 PRO HG3 1 1 1 124 1 1 9 PRO N N -4.946 -5.845 1.995 1.00 . A A . 9 PRO N 1 1 1 125 1 1 9 PRO O O -2.638 -6.699 0.816 1.00 . A A . 9 PRO O 1 1 1 126 1 1 10 CYS C C 0.664 -6.157 1.402 1.00 . A A . 10 CYS C 1 1 1 127 1 1 10 CYS CA C -0.259 -5.281 0.539 1.00 . A A . 10 CYS CA 1 1 1 128 1 1 10 CYS CB C 0.493 -4.015 0.076 1.00 . A A . 10 CYS CB 1 1 1 129 1 1 10 CYS H H -1.461 -4.015 1.804 1.00 . A A . 10 CYS H 1 1 1 130 1 1 10 CYS HA H -0.558 -5.843 -0.329 1.00 . A A . 10 CYS HA 1 1 1 131 1 1 10 CYS HB2 H 1.503 -4.054 0.447 1.00 . A A . 10 CYS HB2 1 1 1 132 1 1 10 CYS HB3 H 0.551 -4.044 -1.002 1.00 . A A . 10 CYS HB3 1 1 1 133 1 1 10 CYS N N -1.467 -4.868 1.323 1.00 . A A . 10 CYS N 1 1 1 134 1 1 10 CYS O O 0.393 -6.392 2.564 1.00 . A A . 10 CYS O 1 1 1 135 1 1 10 CYS SG S -0.193 -2.400 0.524 1.00 . A A . 10 CYS SG 1 1 1 136 1 1 11 ILE C C 4.100 -6.779 1.364 1.00 . A A . 11 ILE C 1 1 1 137 1 1 11 ILE CA C 2.737 -7.473 1.474 1.00 . A A . 11 ILE CA 1 1 1 138 1 1 11 ILE CB C 2.769 -8.878 0.787 1.00 . A A . 11 ILE CB 1 1 1 139 1 1 11 ILE CD1 C 3.247 -9.843 -1.509 1.00 . A A . 11 ILE CD1 1 1 1 140 1 1 11 ILE CG1 C 2.406 -8.813 -0.736 1.00 . A A . 11 ILE CG1 1 1 1 141 1 1 11 ILE CG2 C 1.769 -9.806 1.507 1.00 . A A . 11 ILE CG2 1 1 1 142 1 1 11 ILE H H 1.878 -6.379 -0.150 1.00 . A A . 11 ILE H 1 1 1 143 1 1 11 ILE HA H 2.489 -7.567 2.521 1.00 . A A . 11 ILE HA 1 1 1 144 1 1 11 ILE HB H 3.762 -9.284 0.900 1.00 . A A . 11 ILE HB 1 1 1 145 1 1 11 ILE HD11 H 3.070 -10.836 -1.123 1.00 . A A . 11 ILE HD11 1 1 1 146 1 1 11 ILE HD12 H 2.982 -9.824 -2.556 1.00 . A A . 11 ILE HD12 1 1 1 147 1 1 11 ILE HD13 H 4.297 -9.612 -1.413 1.00 . A A . 11 ILE HD13 1 1 1 148 1 1 11 ILE HG12 H 1.357 -9.027 -0.883 1.00 . A A . 11 ILE HG12 1 1 1 149 1 1 11 ILE HG13 H 2.605 -7.834 -1.146 1.00 . A A . 11 ILE HG13 1 1 1 150 1 1 11 ILE HG21 H 0.774 -9.387 1.468 1.00 . A A . 11 ILE HG21 1 1 1 151 1 1 11 ILE HG22 H 1.756 -10.778 1.036 1.00 . A A . 11 ILE HG22 1 1 1 152 1 1 11 ILE HG23 H 2.054 -9.928 2.541 1.00 . A A . 11 ILE HG23 1 1 1 153 1 1 11 ILE N N 1.730 -6.609 0.789 1.00 . A A . 11 ILE N 1 1 1 154 1 1 11 ILE O O 4.587 -6.220 2.328 1.00 . A A . 11 ILE O 1 1 1 155 1 1 12 SER C C 5.878 -4.681 0.121 1.00 . A A . 12 SER C 1 1 1 156 1 1 12 SER CA C 5.999 -6.197 -0.064 1.00 . A A . 12 SER CA 1 1 1 157 1 1 12 SER CB C 6.426 -6.524 -1.494 1.00 . A A . 12 SER CB 1 1 1 158 1 1 12 SER H H 4.237 -7.298 -0.546 1.00 . A A . 12 SER H 1 1 1 159 1 1 12 SER HA H 6.708 -6.594 0.644 1.00 . A A . 12 SER HA 1 1 1 160 1 1 12 SER HB2 H 5.652 -6.284 -2.208 1.00 . A A . 12 SER HB2 1 1 1 161 1 1 12 SER HB3 H 7.340 -6.018 -1.754 1.00 . A A . 12 SER HB3 1 1 1 162 1 1 12 SER HG H 7.330 -8.128 -2.115 1.00 . A A . 12 SER HG 1 1 1 163 1 1 12 SER N N 4.675 -6.832 0.189 1.00 . A A . 12 SER N 1 1 1 164 1 1 12 SER O O 6.737 -4.046 0.701 1.00 . A A . 12 SER O 1 1 1 165 1 1 12 SER OG O 6.641 -7.928 -1.479 1.00 . A A . 12 SER OG 1 1 1 166 1 1 13 ALA C C 3.910 -2.315 1.066 1.00 . A A . 13 ALA C 1 1 1 167 1 1 13 ALA CA C 4.507 -2.701 -0.302 1.00 . A A . 13 ALA CA 1 1 1 168 1 1 13 ALA CB C 3.536 -2.337 -1.436 1.00 . A A . 13 ALA CB 1 1 1 169 1 1 13 ALA H H 4.151 -4.738 -0.846 1.00 . A A . 13 ALA H 1 1 1 170 1 1 13 ALA HA H 5.434 -2.176 -0.440 1.00 . A A . 13 ALA HA 1 1 1 171 1 1 13 ALA HB1 H 3.975 -2.587 -2.391 1.00 . A A . 13 ALA HB1 1 1 1 172 1 1 13 ALA HB2 H 2.611 -2.882 -1.326 1.00 . A A . 13 ALA HB2 1 1 1 173 1 1 13 ALA HB3 H 3.324 -1.279 -1.420 1.00 . A A . 13 ALA HB3 1 1 1 174 1 1 13 ALA N N 4.791 -4.159 -0.391 1.00 . A A . 13 ALA N 1 1 1 175 1 1 13 ALA O O 3.429 -1.212 1.240 1.00 . A A . 13 ALA O 1 1 1 176 1 1 14 ALA C C 4.557 -2.473 4.252 1.00 . A A . 14 ALA C 1 1 1 177 1 1 14 ALA CA C 3.413 -2.982 3.366 1.00 . A A . 14 ALA CA 1 1 1 178 1 1 14 ALA CB C 2.840 -4.289 3.931 1.00 . A A . 14 ALA CB 1 1 1 179 1 1 14 ALA H H 4.354 -4.110 1.794 1.00 . A A . 14 ALA H 1 1 1 180 1 1 14 ALA HA H 2.637 -2.230 3.317 1.00 . A A . 14 ALA HA 1 1 1 181 1 1 14 ALA HB1 H 2.317 -4.825 3.154 1.00 . A A . 14 ALA HB1 1 1 1 182 1 1 14 ALA HB2 H 3.627 -4.922 4.318 1.00 . A A . 14 ALA HB2 1 1 1 183 1 1 14 ALA HB3 H 2.146 -4.072 4.729 1.00 . A A . 14 ALA HB3 1 1 1 184 1 1 14 ALA N N 3.958 -3.238 1.996 1.00 . A A . 14 ALA N 1 1 1 185 1 1 14 ALA O O 4.432 -1.455 4.905 1.00 . A A . 14 ALA O 1 1 1 186 1 1 15 LEU C C 7.534 -1.608 4.451 1.00 . A A . 15 LEU C 1 1 1 187 1 1 15 LEU CA C 6.840 -2.843 5.047 1.00 . A A . 15 LEU CA 1 1 1 188 1 1 15 LEU CB C 7.832 -4.050 5.089 1.00 . A A . 15 LEU CB 1 1 1 189 1 1 15 LEU CD1 C 9.338 -4.993 3.266 1.00 . A A . 15 LEU CD1 1 1 1 190 1 1 15 LEU CD2 C 7.245 -6.229 3.923 1.00 . A A . 15 LEU CD2 1 1 1 191 1 1 15 LEU CG C 7.877 -4.834 3.739 1.00 . A A . 15 LEU CG 1 1 1 192 1 1 15 LEU H H 5.671 -4.018 3.695 1.00 . A A . 15 LEU H 1 1 1 193 1 1 15 LEU HA H 6.512 -2.622 6.044 1.00 . A A . 15 LEU HA 1 1 1 194 1 1 15 LEU HB2 H 8.816 -3.675 5.330 1.00 . A A . 15 LEU HB2 1 1 1 195 1 1 15 LEU HB3 H 7.532 -4.708 5.892 1.00 . A A . 15 LEU HB3 1 1 1 196 1 1 15 LEU HD11 H 9.925 -5.508 4.014 1.00 . A A . 15 LEU HD11 1 1 1 197 1 1 15 LEU HD12 H 9.373 -5.560 2.347 1.00 . A A . 15 LEU HD12 1 1 1 198 1 1 15 LEU HD13 H 9.777 -4.022 3.088 1.00 . A A . 15 LEU HD13 1 1 1 199 1 1 15 LEU HD21 H 6.246 -6.132 4.322 1.00 . A A . 15 LEU HD21 1 1 1 200 1 1 15 LEU HD22 H 7.189 -6.739 2.973 1.00 . A A . 15 LEU HD22 1 1 1 201 1 1 15 LEU HD23 H 7.836 -6.825 4.604 1.00 . A A . 15 LEU HD23 1 1 1 202 1 1 15 LEU HG H 7.329 -4.301 2.983 1.00 . A A . 15 LEU HG 1 1 1 203 1 1 15 LEU N N 5.642 -3.209 4.239 1.00 . A A . 15 LEU N 1 1 1 204 1 1 15 LEU O O 7.551 -0.561 5.072 1.00 . A A . 15 LEU O 1 1 1 205 1 1 16 GLY C C 7.781 0.481 2.322 1.00 . A A . 16 GLY C 1 1 1 206 1 1 16 GLY CA C 8.782 -0.645 2.577 1.00 . A A . 16 GLY CA 1 1 1 207 1 1 16 GLY H H 8.029 -2.635 2.829 1.00 . A A . 16 GLY H 1 1 1 208 1 1 16 GLY HA2 H 9.585 -0.297 3.204 1.00 . A A . 16 GLY HA2 1 1 1 209 1 1 16 GLY HA3 H 9.178 -0.999 1.637 1.00 . A A . 16 GLY HA3 1 1 1 210 1 1 16 GLY N N 8.079 -1.766 3.270 1.00 . A A . 16 GLY N 1 1 1 211 1 1 16 GLY O O 7.791 1.489 3.001 1.00 . A A . 16 GLY O 1 1 1 212 1 1 17 CYS C C 4.791 1.220 2.051 1.00 . A A . 17 CYS C 1 1 1 213 1 1 17 CYS CA C 5.902 1.272 0.982 1.00 . A A . 17 CYS CA 1 1 1 214 1 1 17 CYS CB C 5.349 0.920 -0.412 1.00 . A A . 17 CYS CB 1 1 1 215 1 1 17 CYS H H 6.995 -0.579 0.840 1.00 . A A . 17 CYS H 1 1 1 216 1 1 17 CYS HA H 6.344 2.257 0.978 1.00 . A A . 17 CYS HA 1 1 1 217 1 1 17 CYS HB2 H 4.422 0.378 -0.314 1.00 . A A . 17 CYS HB2 1 1 1 218 1 1 17 CYS HB3 H 5.116 1.849 -0.906 1.00 . A A . 17 CYS HB3 1 1 1 219 1 1 17 CYS N N 6.941 0.261 1.342 1.00 . A A . 17 CYS N 1 1 1 220 1 1 17 CYS O O 4.937 0.537 3.046 1.00 . A A . 17 CYS O 1 1 1 221 1 1 17 CYS SG S 6.415 -0.019 -1.536 1.00 . A A . 17 CYS SG 1 1 1 222 1 1 18 SER C C 1.231 2.132 2.128 1.00 . A A . 18 SER C 1 1 1 223 1 1 18 SER CA C 2.586 1.937 2.816 1.00 . A A . 18 SER CA 1 1 1 224 1 1 18 SER CB C 2.812 3.076 3.827 1.00 . A A . 18 SER CB 1 1 1 225 1 1 18 SER H H 3.645 2.463 1.006 1.00 . A A . 18 SER H 1 1 1 226 1 1 18 SER HA H 2.566 0.988 3.333 1.00 . A A . 18 SER HA 1 1 1 227 1 1 18 SER HB2 H 3.054 4.005 3.333 1.00 . A A . 18 SER HB2 1 1 1 228 1 1 18 SER HB3 H 1.961 3.209 4.478 1.00 . A A . 18 SER HB3 1 1 1 229 1 1 18 SER HG H 4.700 2.655 4.034 1.00 . A A . 18 SER HG 1 1 1 230 1 1 18 SER N N 3.713 1.932 1.826 1.00 . A A . 18 SER N 1 1 1 231 1 1 18 SER O O 1.107 2.922 1.210 1.00 . A A . 18 SER O 1 1 1 232 1 1 18 SER OG O 3.925 2.648 4.601 1.00 . A A . 18 SER OG 1 1 1 233 1 1 19 CYS C C -1.850 2.721 2.585 1.00 . A A . 19 CYS C 1 1 1 234 1 1 19 CYS CA C -1.117 1.507 2.005 1.00 . A A . 19 CYS CA 1 1 1 235 1 1 19 CYS CB C -1.922 0.237 2.311 1.00 . A A . 19 CYS CB 1 1 1 236 1 1 19 CYS H H 0.412 0.780 3.338 1.00 . A A . 19 CYS H 1 1 1 237 1 1 19 CYS HA H -1.032 1.620 0.936 1.00 . A A . 19 CYS HA 1 1 1 238 1 1 19 CYS HB2 H -1.516 -0.566 1.716 1.00 . A A . 19 CYS HB2 1 1 1 239 1 1 19 CYS HB3 H -1.792 -0.019 3.352 1.00 . A A . 19 CYS HB3 1 1 1 240 1 1 19 CYS N N 0.250 1.400 2.596 1.00 . A A . 19 CYS N 1 1 1 241 1 1 19 CYS O O -2.142 2.771 3.764 1.00 . A A . 19 CYS O 1 1 1 242 1 1 19 CYS SG S -3.697 0.336 1.968 1.00 . A A . 19 CYS SG 1 1 1 243 1 1 20 LYS C C -3.683 5.378 0.934 1.00 . A A . 20 LYS C 1 1 1 244 1 1 20 LYS CA C -2.827 4.916 2.119 1.00 . A A . 20 LYS CA 1 1 1 245 1 1 20 LYS CB C -1.781 5.993 2.487 1.00 . A A . 20 LYS CB 1 1 1 246 1 1 20 LYS CD C -2.749 8.346 2.291 1.00 . A A . 20 LYS CD 1 1 1 247 1 1 20 LYS CE C -1.577 9.344 2.329 1.00 . A A . 20 LYS CE 1 1 1 248 1 1 20 LYS CG C -2.466 7.160 3.251 1.00 . A A . 20 LYS CG 1 1 1 249 1 1 20 LYS H H -1.840 3.550 0.787 1.00 . A A . 20 LYS H 1 1 1 250 1 1 20 LYS HA H -3.474 4.703 2.958 1.00 . A A . 20 LYS HA 1 1 1 251 1 1 20 LYS HB2 H -1.030 5.551 3.127 1.00 . A A . 20 LYS HB2 1 1 1 252 1 1 20 LYS HB3 H -1.290 6.352 1.594 1.00 . A A . 20 LYS HB3 1 1 1 253 1 1 20 LYS HD2 H -2.885 7.994 1.280 1.00 . A A . 20 LYS HD2 1 1 1 254 1 1 20 LYS HD3 H -3.654 8.848 2.600 1.00 . A A . 20 LYS HD3 1 1 1 255 1 1 20 LYS HE2 H -0.632 8.826 2.264 1.00 . A A . 20 LYS HE2 1 1 1 256 1 1 20 LYS HE3 H -1.653 10.035 1.502 1.00 . A A . 20 LYS HE3 1 1 1 257 1 1 20 LYS HG2 H -3.400 6.829 3.683 1.00 . A A . 20 LYS HG2 1 1 1 258 1 1 20 LYS HG3 H -1.824 7.479 4.059 1.00 . A A . 20 LYS HG3 1 1 1 259 1 1 20 LYS HZ1 H -2.145 9.591 4.318 1.00 . A A . 20 LYS HZ1 1 1 1 260 1 1 20 LYS HZ2 H -0.639 10.278 3.937 1.00 . A A . 20 LYS HZ2 1 1 1 261 1 1 20 LYS HZ3 H -2.072 11.039 3.433 1.00 . A A . 20 LYS HZ3 1 1 1 262 1 1 20 LYS N N -2.116 3.666 1.719 1.00 . A A . 20 LYS N 1 1 1 263 1 1 20 LYS NZ N -1.610 10.122 3.601 1.00 . A A . 20 LYS NZ 1 1 1 264 1 1 20 LYS O O -3.227 5.373 -0.193 1.00 . A A . 20 LYS O 1 1 1 265 1 1 21 ASN C C -5.930 5.257 -0.979 1.00 . A A . 21 ASN C 1 1 1 266 1 1 21 ASN CA C -5.873 6.237 0.208 1.00 . A A . 21 ASN CA 1 1 1 267 1 1 21 ASN CB C -5.438 7.654 -0.261 1.00 . A A . 21 ASN CB 1 1 1 268 1 1 21 ASN CG C -6.611 8.329 -0.985 1.00 . A A . 21 ASN CG 1 1 1 269 1 1 21 ASN H H -5.181 5.731 2.180 1.00 . A A . 21 ASN H 1 1 1 270 1 1 21 ASN HA H -6.853 6.283 0.663 1.00 . A A . 21 ASN HA 1 1 1 271 1 1 21 ASN HB2 H -5.168 8.258 0.592 1.00 . A A . 21 ASN HB2 1 1 1 272 1 1 21 ASN HB3 H -4.594 7.602 -0.933 1.00 . A A . 21 ASN HB3 1 1 1 273 1 1 21 ASN HD21 H -6.133 7.563 -2.754 1.00 . A A . 21 ASN HD21 1 1 1 274 1 1 21 ASN HD22 H -7.509 8.557 -2.741 1.00 . A A . 21 ASN HD22 1 1 1 275 1 1 21 ASN N N -4.900 5.759 1.242 1.00 . A A . 21 ASN N 1 1 1 276 1 1 21 ASN ND2 N -6.763 8.133 -2.266 1.00 . A A . 21 ASN ND2 1 1 1 277 1 1 21 ASN O O -5.507 5.564 -2.077 1.00 . A A . 21 ASN O 1 1 1 278 1 1 21 ASN OD1 O -7.397 9.038 -0.391 1.00 . A A . 21 ASN OD1 1 1 1 279 1 1 22 LYS C C -5.457 2.812 -2.671 1.00 . A A . 22 LYS C 1 1 1 280 1 1 22 LYS CA C -6.623 2.980 -1.673 1.00 . A A . 22 LYS CA 1 1 1 281 1 1 22 LYS CB C -7.969 3.213 -2.435 1.00 . A A . 22 LYS CB 1 1 1 282 1 1 22 LYS CD C -9.019 4.442 -4.396 1.00 . A A . 22 LYS CD 1 1 1 283 1 1 22 LYS CE C -8.588 3.487 -5.537 1.00 . A A . 22 LYS CE 1 1 1 284 1 1 22 LYS CG C -7.945 4.509 -3.291 1.00 . A A . 22 LYS CG 1 1 1 285 1 1 22 LYS H H -6.767 3.948 0.237 1.00 . A A . 22 LYS H 1 1 1 286 1 1 22 LYS HA H -6.708 2.059 -1.114 1.00 . A A . 22 LYS HA 1 1 1 287 1 1 22 LYS HB2 H -8.158 2.358 -3.066 1.00 . A A . 22 LYS HB2 1 1 1 288 1 1 22 LYS HB3 H -8.772 3.280 -1.717 1.00 . A A . 22 LYS HB3 1 1 1 289 1 1 22 LYS HD2 H -9.954 4.104 -3.972 1.00 . A A . 22 LYS HD2 1 1 1 290 1 1 22 LYS HD3 H -9.167 5.434 -4.798 1.00 . A A . 22 LYS HD3 1 1 1 291 1 1 22 LYS HE2 H -8.535 2.467 -5.186 1.00 . A A . 22 LYS HE2 1 1 1 292 1 1 22 LYS HE3 H -9.308 3.536 -6.340 1.00 . A A . 22 LYS HE3 1 1 1 293 1 1 22 LYS HG2 H -8.156 5.357 -2.654 1.00 . A A . 22 LYS HG2 1 1 1 294 1 1 22 LYS HG3 H -6.979 4.662 -3.745 1.00 . A A . 22 LYS HG3 1 1 1 295 1 1 22 LYS HZ1 H -7.015 4.837 -5.767 1.00 . A A . 22 LYS HZ1 1 1 1 296 1 1 22 LYS HZ2 H -6.534 3.209 -5.734 1.00 . A A . 22 LYS HZ2 1 1 1 297 1 1 22 LYS HZ3 H -7.281 3.845 -7.120 1.00 . A A . 22 LYS HZ3 1 1 1 298 1 1 22 LYS N N -6.461 4.096 -0.682 1.00 . A A . 22 LYS N 1 1 1 299 1 1 22 LYS NZ N -7.254 3.874 -6.080 1.00 . A A . 22 LYS NZ 1 1 1 300 1 1 22 LYS O O -5.672 2.603 -3.849 1.00 . A A . 22 LYS O 1 1 1 301 1 1 23 VAL C C -1.874 2.239 -2.150 1.00 . A A . 23 VAL C 1 1 1 302 1 1 23 VAL CA C -3.035 2.777 -3.014 1.00 . A A . 23 VAL CA 1 1 1 303 1 1 23 VAL CB C -2.766 4.196 -3.632 1.00 . A A . 23 VAL CB 1 1 1 304 1 1 23 VAL CG1 C -1.465 4.859 -3.129 1.00 . A A . 23 VAL CG1 1 1 1 305 1 1 23 VAL CG2 C -2.745 4.078 -5.166 1.00 . A A . 23 VAL CG2 1 1 1 306 1 1 23 VAL H H -4.122 3.113 -1.224 1.00 . A A . 23 VAL H 1 1 1 307 1 1 23 VAL HA H -3.257 2.041 -3.763 1.00 . A A . 23 VAL HA 1 1 1 308 1 1 23 VAL HB H -3.583 4.846 -3.358 1.00 . A A . 23 VAL HB 1 1 1 309 1 1 23 VAL HG11 H -0.637 4.180 -3.240 1.00 . A A . 23 VAL HG11 1 1 1 310 1 1 23 VAL HG12 H -1.262 5.758 -3.691 1.00 . A A . 23 VAL HG12 1 1 1 311 1 1 23 VAL HG13 H -1.560 5.123 -2.087 1.00 . A A . 23 VAL HG13 1 1 1 312 1 1 23 VAL HG21 H -2.052 3.309 -5.470 1.00 . A A . 23 VAL HG21 1 1 1 313 1 1 23 VAL HG22 H -3.728 3.817 -5.528 1.00 . A A . 23 VAL HG22 1 1 1 314 1 1 23 VAL HG23 H -2.454 5.016 -5.615 1.00 . A A . 23 VAL HG23 1 1 1 315 1 1 23 VAL N N -4.250 2.924 -2.169 1.00 . A A . 23 VAL N 1 1 1 316 1 1 23 VAL O O -1.683 2.725 -1.052 1.00 . A A . 23 VAL O 1 1 1 317 1 1 24 CYS C C 1.312 1.332 -2.365 1.00 . A A . 24 CYS C 1 1 1 318 1 1 24 CYS CA C 0.010 0.704 -1.854 1.00 . A A . 24 CYS CA 1 1 1 319 1 1 24 CYS CB C 0.042 -0.824 -2.041 1.00 . A A . 24 CYS CB 1 1 1 320 1 1 24 CYS H H -1.317 0.904 -3.539 1.00 . A A . 24 CYS H 1 1 1 321 1 1 24 CYS HA H -0.104 0.942 -0.809 1.00 . A A . 24 CYS HA 1 1 1 322 1 1 24 CYS HB2 H -0.042 -1.062 -3.089 1.00 . A A . 24 CYS HB2 1 1 1 323 1 1 24 CYS HB3 H 1.007 -1.174 -1.719 1.00 . A A . 24 CYS HB3 1 1 1 324 1 1 24 CYS N N -1.135 1.271 -2.645 1.00 . A A . 24 CYS N 1 1 1 325 1 1 24 CYS O O 2.229 0.642 -2.760 1.00 . A A . 24 CYS O 1 1 1 326 1 1 24 CYS SG S -1.179 -1.800 -1.133 1.00 . A A . 24 CYS SG 1 1 1 327 1 1 25 TYR C C 3.395 3.864 -1.622 1.00 . A A . 25 TYR C 1 1 1 328 1 1 25 TYR CA C 2.526 3.419 -2.796 1.00 . A A . 25 TYR CA 1 1 1 329 1 1 25 TYR CB C 2.032 4.647 -3.562 1.00 . A A . 25 TYR CB 1 1 1 330 1 1 25 TYR CD1 C 1.083 2.966 -5.289 1.00 . A A . 25 TYR CD1 1 1 1 331 1 1 25 TYR CD2 C 0.756 5.295 -5.629 1.00 . A A . 25 TYR CD2 1 1 1 332 1 1 25 TYR CE1 C 0.393 2.698 -6.447 1.00 . A A . 25 TYR CE1 1 1 1 333 1 1 25 TYR CE2 C 0.065 5.025 -6.789 1.00 . A A . 25 TYR CE2 1 1 1 334 1 1 25 TYR CG C 1.276 4.274 -4.860 1.00 . A A . 25 TYR CG 1 1 1 335 1 1 25 TYR CZ C -0.122 3.724 -7.208 1.00 . A A . 25 TYR CZ 1 1 1 336 1 1 25 TYR H H 0.559 3.126 -1.991 1.00 . A A . 25 TYR H 1 1 1 337 1 1 25 TYR HA H 3.120 2.825 -3.470 1.00 . A A . 25 TYR HA 1 1 1 338 1 1 25 TYR HB2 H 1.377 5.222 -2.928 1.00 . A A . 25 TYR HB2 1 1 1 339 1 1 25 TYR HB3 H 2.866 5.276 -3.816 1.00 . A A . 25 TYR HB3 1 1 1 340 1 1 25 TYR HD1 H 1.473 2.133 -4.728 1.00 . A A . 25 TYR HD1 1 1 1 341 1 1 25 TYR HD2 H 0.892 6.321 -5.320 1.00 . A A . 25 TYR HD2 1 1 1 342 1 1 25 TYR HE1 H 0.258 1.673 -6.752 1.00 . A A . 25 TYR HE1 1 1 1 343 1 1 25 TYR HE2 H -0.333 5.844 -7.369 1.00 . A A . 25 TYR HE2 1 1 1 344 1 1 25 TYR HH H -1.417 2.723 -8.189 1.00 . A A . 25 TYR HH 1 1 1 345 1 1 25 TYR N N 1.337 2.640 -2.330 1.00 . A A . 25 TYR N 1 1 1 346 1 1 25 TYR O O 2.989 3.781 -0.480 1.00 . A A . 25 TYR O 1 1 1 347 1 1 25 TYR OH O -0.815 3.450 -8.369 1.00 . A A . 25 TYR OH 1 1 1 348 1 1 26 ARG C C 5.313 6.326 -0.765 1.00 . A A . 26 ARG C 1 1 1 349 1 1 26 ARG CA C 5.525 4.808 -0.898 1.00 . A A . 26 ARG CA 1 1 1 350 1 1 26 ARG CB C 6.965 4.469 -1.354 1.00 . A A . 26 ARG CB 1 1 1 351 1 1 26 ARG CD C 9.033 3.410 -0.344 1.00 . A A . 26 ARG CD 1 1 1 352 1 1 26 ARG CG C 7.928 4.475 -0.141 1.00 . A A . 26 ARG CG 1 1 1 353 1 1 26 ARG CZ C 10.489 3.945 1.563 1.00 . A A . 26 ARG CZ 1 1 1 354 1 1 26 ARG H H 4.829 4.368 -2.893 1.00 . A A . 26 ARG H 1 1 1 355 1 1 26 ARG HA H 5.292 4.336 0.046 1.00 . A A . 26 ARG HA 1 1 1 356 1 1 26 ARG HB2 H 6.964 3.496 -1.825 1.00 . A A . 26 ARG HB2 1 1 1 357 1 1 26 ARG HB3 H 7.304 5.198 -2.075 1.00 . A A . 26 ARG HB3 1 1 1 358 1 1 26 ARG HD2 H 8.755 2.477 0.124 1.00 . A A . 26 ARG HD2 1 1 1 359 1 1 26 ARG HD3 H 9.210 3.233 -1.395 1.00 . A A . 26 ARG HD3 1 1 1 360 1 1 26 ARG HE H 11.028 4.217 -0.323 1.00 . A A . 26 ARG HE 1 1 1 361 1 1 26 ARG HG2 H 8.376 5.454 -0.048 1.00 . A A . 26 ARG HG2 1 1 1 362 1 1 26 ARG HG3 H 7.393 4.261 0.774 1.00 . A A . 26 ARG HG3 1 1 1 363 1 1 26 ARG HH11 H 8.683 3.205 2.018 1.00 . A A . 26 ARG HH11 1 1 1 364 1 1 26 ARG HH12 H 9.704 3.575 3.367 1.00 . A A . 26 ARG HH12 1 1 1 365 1 1 26 ARG HH21 H 12.333 4.695 1.365 1.00 . A A . 26 ARG HH21 1 1 1 366 1 1 26 ARG HH22 H 11.801 4.433 2.994 1.00 . A A . 26 ARG HH22 1 1 1 367 1 1 26 ARG N N 4.573 4.331 -1.948 1.00 . A A . 26 ARG N 1 1 1 368 1 1 26 ARG NE N 10.307 3.909 0.265 1.00 . A A . 26 ARG NE 1 1 1 369 1 1 26 ARG NH1 N 9.552 3.543 2.380 1.00 . A A . 26 ARG NH1 1 1 1 370 1 1 26 ARG NH2 N 11.630 4.392 2.009 1.00 . A A . 26 ARG NH2 1 1 1 371 1 1 26 ARG O O 6.246 7.096 -0.630 1.00 . A A . 26 ARG O 1 1 1 372 1 1 27 ASN C C 4.295 8.983 -1.783 1.00 . A A . 27 ASN C 1 1 1 373 1 1 27 ASN CA C 3.615 8.117 -0.707 1.00 . A A . 27 ASN CA 1 1 1 374 1 1 27 ASN CB C 3.959 8.623 0.723 1.00 . A A . 27 ASN CB 1 1 1 375 1 1 27 ASN CG C 3.021 9.779 1.090 1.00 . A A . 27 ASN CG 1 1 1 376 1 1 27 ASN H H 3.368 6.001 -0.921 1.00 . A A . 27 ASN H 1 1 1 377 1 1 27 ASN HA H 2.550 8.148 -0.879 1.00 . A A . 27 ASN HA 1 1 1 378 1 1 27 ASN HB2 H 3.823 7.829 1.443 1.00 . A A . 27 ASN HB2 1 1 1 379 1 1 27 ASN HB3 H 4.980 8.968 0.777 1.00 . A A . 27 ASN HB3 1 1 1 380 1 1 27 ASN HD21 H 1.526 8.573 1.591 1.00 . A A . 27 ASN HD21 1 1 1 381 1 1 27 ASN HD22 H 1.203 10.231 1.752 1.00 . A A . 27 ASN HD22 1 1 1 382 1 1 27 ASN N N 4.053 6.692 -0.813 1.00 . A A . 27 ASN N 1 1 1 383 1 1 27 ASN ND2 N 1.816 9.505 1.513 1.00 . A A . 27 ASN ND2 1 1 1 384 1 1 27 ASN O O 4.691 10.106 -1.533 1.00 . A A . 27 ASN O 1 1 1 385 1 1 27 ASN OD1 O 3.374 10.938 0.997 1.00 . A A . 27 ASN OD1 1 1 1 386 1 1 28 GLY C C 5.338 8.266 -5.311 1.00 . A A . 28 GLY C 1 1 1 387 1 1 28 GLY CA C 5.042 9.147 -4.090 1.00 . A A . 28 GLY CA 1 1 1 388 1 1 28 GLY H H 4.066 7.513 -3.103 1.00 . A A . 28 GLY H 1 1 1 389 1 1 28 GLY HA2 H 4.388 9.951 -4.388 1.00 . A A . 28 GLY HA2 1 1 1 390 1 1 28 GLY HA3 H 5.973 9.555 -3.736 1.00 . A A . 28 GLY HA3 1 1 1 391 1 1 28 GLY N N 4.404 8.417 -2.961 1.00 . A A . 28 GLY N 1 1 1 392 1 1 28 GLY O O 5.250 8.738 -6.428 1.00 . A A . 28 GLY O 1 1 1 393 1 1 29 ILE C C 4.930 4.955 -6.273 1.00 . A A . 29 ILE C 1 1 1 394 1 1 29 ILE CA C 5.990 6.075 -6.188 1.00 . A A . 29 ILE CA 1 1 1 395 1 1 29 ILE CB C 7.413 5.489 -5.929 1.00 . A A . 29 ILE CB 1 1 1 396 1 1 29 ILE CD1 C 9.497 4.598 -7.073 1.00 . A A . 29 ILE CD1 1 1 1 397 1 1 29 ILE CG1 C 8.001 4.922 -7.252 1.00 . A A . 29 ILE CG1 1 1 1 398 1 1 29 ILE CG2 C 7.383 4.381 -4.845 1.00 . A A . 29 ILE CG2 1 1 1 399 1 1 29 ILE H H 5.722 6.700 -4.147 1.00 . A A . 29 ILE H 1 1 1 400 1 1 29 ILE HA H 6.011 6.629 -7.113 1.00 . A A . 29 ILE HA 1 1 1 401 1 1 29 ILE HB H 8.042 6.294 -5.575 1.00 . A A . 29 ILE HB 1 1 1 402 1 1 29 ILE HD11 H 10.016 5.439 -6.637 1.00 . A A . 29 ILE HD11 1 1 1 403 1 1 29 ILE HD12 H 9.621 3.738 -6.432 1.00 . A A . 29 ILE HD12 1 1 1 404 1 1 29 ILE HD13 H 9.939 4.380 -8.035 1.00 . A A . 29 ILE HD13 1 1 1 405 1 1 29 ILE HG12 H 7.471 4.028 -7.544 1.00 . A A . 29 ILE HG12 1 1 1 406 1 1 29 ILE HG13 H 7.899 5.655 -8.039 1.00 . A A . 29 ILE HG13 1 1 1 407 1 1 29 ILE HG21 H 6.698 4.654 -4.058 1.00 . A A . 29 ILE HG21 1 1 1 408 1 1 29 ILE HG22 H 7.064 3.441 -5.271 1.00 . A A . 29 ILE HG22 1 1 1 409 1 1 29 ILE HG23 H 8.366 4.254 -4.419 1.00 . A A . 29 ILE HG23 1 1 1 410 1 1 29 ILE N N 5.676 7.022 -5.070 1.00 . A A . 29 ILE N 1 1 1 411 1 1 29 ILE O O 4.521 4.445 -5.248 1.00 . A A . 29 ILE O 1 1 1 412 1 1 30 PRO C C 4.434 2.134 -7.302 1.00 . A A . 30 PRO C 1 1 1 413 1 1 30 PRO CA C 3.639 3.398 -7.653 1.00 . A A . 30 PRO CA 1 1 1 414 1 1 30 PRO CB C 3.185 3.433 -9.118 1.00 . A A . 30 PRO CB 1 1 1 415 1 1 30 PRO CD C 4.805 5.293 -8.748 1.00 . A A . 30 PRO CD 1 1 1 416 1 1 30 PRO CG C 3.954 4.574 -9.810 1.00 . A A . 30 PRO CG 1 1 1 417 1 1 30 PRO HA H 2.796 3.480 -6.989 1.00 . A A . 30 PRO HA 1 1 1 418 1 1 30 PRO HB2 H 3.387 2.496 -9.617 1.00 . A A . 30 PRO HB2 1 1 1 419 1 1 30 PRO HB3 H 2.122 3.621 -9.159 1.00 . A A . 30 PRO HB3 1 1 1 420 1 1 30 PRO HD2 H 5.858 5.208 -8.969 1.00 . A A . 30 PRO HD2 1 1 1 421 1 1 30 PRO HD3 H 4.524 6.333 -8.665 1.00 . A A . 30 PRO HD3 1 1 1 422 1 1 30 PRO HG2 H 4.593 4.171 -10.583 1.00 . A A . 30 PRO HG2 1 1 1 423 1 1 30 PRO HG3 H 3.258 5.269 -10.258 1.00 . A A . 30 PRO HG3 1 1 1 424 1 1 30 PRO N N 4.504 4.592 -7.465 1.00 . A A . 30 PRO N 1 1 1 425 1 1 30 PRO O O 5.185 1.613 -8.104 1.00 . A A . 30 PRO O 1 1 2 426 1 1 1 CYS C C 4.177 -1.212 -5.782 1.00 . A A . 1 CYS C 1 1 2 427 1 1 1 CYS CA C 5.021 -0.029 -5.306 1.00 . A A . 1 CYS CA 1 1 2 428 1 1 1 CYS CB C 4.971 0.107 -3.788 1.00 . A A . 1 CYS CB 1 1 2 429 1 1 1 CYS HA H 6.040 -0.148 -5.645 1.00 . A A . 1 CYS HA 1 1 2 430 1 1 1 CYS HB2 H 4.209 0.829 -3.556 1.00 . A A . 1 CYS HB2 1 1 2 431 1 1 1 CYS HB3 H 4.662 -0.836 -3.359 1.00 . A A . 1 CYS HB3 1 1 2 432 1 1 1 CYS N N 4.431 1.203 -5.905 1.00 . A A . 1 CYS N 1 1 2 433 1 1 1 CYS O O 4.709 -2.233 -6.176 1.00 . A A . 1 CYS O 1 1 2 434 1 1 1 CYS SG S 6.450 0.638 -2.895 1.00 . A A . 1 CYS SG 1 1 2 435 1 1 2 GLY C C 0.669 -1.442 -6.698 1.00 . A A . 2 GLY C 1 1 2 436 1 1 2 GLY CA C 1.941 -2.089 -6.161 1.00 . A A . 2 GLY CA 1 1 2 437 1 1 2 GLY H H 2.504 -0.182 -5.395 1.00 . A A . 2 GLY H 1 1 2 438 1 1 2 GLY HA2 H 2.393 -2.675 -6.946 1.00 . A A . 2 GLY HA2 1 1 2 439 1 1 2 GLY HA3 H 1.702 -2.723 -5.320 1.00 . A A . 2 GLY HA3 1 1 2 440 1 1 2 GLY N N 2.880 -1.025 -5.726 1.00 . A A . 2 GLY N 1 1 2 441 1 1 2 GLY O O 0.579 -1.138 -7.872 1.00 . A A . 2 GLY O 1 1 2 442 1 1 3 GLU C C -2.522 -0.734 -4.880 1.00 . A A . 3 GLU C 1 1 2 443 1 1 3 GLU CA C -1.596 -0.637 -6.104 1.00 . A A . 3 GLU CA 1 1 2 444 1 1 3 GLU CB C -2.275 -1.379 -7.284 1.00 . A A . 3 GLU CB 1 1 2 445 1 1 3 GLU CD C -4.339 -1.030 -8.686 1.00 . A A . 3 GLU CD 1 1 2 446 1 1 3 GLU CG C -3.050 -0.368 -8.166 1.00 . A A . 3 GLU CG 1 1 2 447 1 1 3 GLU H H -0.053 -1.512 -4.878 1.00 . A A . 3 GLU H 1 1 2 448 1 1 3 GLU HA H -1.444 0.406 -6.330 1.00 . A A . 3 GLU HA 1 1 2 449 1 1 3 GLU HB2 H -1.545 -1.884 -7.882 1.00 . A A . 3 GLU HB2 1 1 2 450 1 1 3 GLU HB3 H -2.941 -2.134 -6.893 1.00 . A A . 3 GLU HB3 1 1 2 451 1 1 3 GLU HG2 H -3.317 0.517 -7.607 1.00 . A A . 3 GLU HG2 1 1 2 452 1 1 3 GLU HG3 H -2.435 -0.069 -9.003 1.00 . A A . 3 GLU HG3 1 1 2 453 1 1 3 GLU N N -0.260 -1.250 -5.795 1.00 . A A . 3 GLU N 1 1 2 454 1 1 3 GLU O O -2.071 -1.008 -3.786 1.00 . A A . 3 GLU O 1 1 2 455 1 1 3 GLU OE1 O -5.255 -1.130 -7.886 1.00 . A A . 3 GLU OE1 1 1 2 456 1 1 3 GLU OE2 O -4.336 -1.402 -9.849 1.00 . A A . 3 GLU OE2 1 1 2 457 1 1 4 SER C C -4.665 -1.717 -3.054 1.00 . A A . 4 SER C 1 1 2 458 1 1 4 SER CA C -4.830 -0.562 -4.041 1.00 . A A . 4 SER CA 1 1 2 459 1 1 4 SER CB C -6.223 -0.661 -4.672 1.00 . A A . 4 SER CB 1 1 2 460 1 1 4 SER H H -4.079 -0.301 -6.028 1.00 . A A . 4 SER H 1 1 2 461 1 1 4 SER HA H -4.771 0.351 -3.477 1.00 . A A . 4 SER HA 1 1 2 462 1 1 4 SER HB2 H -6.398 -1.648 -5.064 1.00 . A A . 4 SER HB2 1 1 2 463 1 1 4 SER HB3 H -6.986 -0.411 -3.954 1.00 . A A . 4 SER HB3 1 1 2 464 1 1 4 SER HG H -5.644 1.017 -5.490 1.00 . A A . 4 SER HG 1 1 2 465 1 1 4 SER N N -3.794 -0.509 -5.116 1.00 . A A . 4 SER N 1 1 2 466 1 1 4 SER O O -4.228 -2.803 -3.382 1.00 . A A . 4 SER O 1 1 2 467 1 1 4 SER OG O -6.242 0.301 -5.719 1.00 . A A . 4 SER OG 1 1 2 468 1 1 5 CYS C C -6.252 -2.054 0.168 1.00 . A A . 5 CYS C 1 1 2 469 1 1 5 CYS CA C -5.000 -2.300 -0.691 1.00 . A A . 5 CYS CA 1 1 2 470 1 1 5 CYS CB C -3.694 -1.972 0.038 1.00 . A A . 5 CYS CB 1 1 2 471 1 1 5 CYS H H -5.387 -0.482 -1.716 1.00 . A A . 5 CYS H 1 1 2 472 1 1 5 CYS HA H -5.030 -3.309 -1.056 1.00 . A A . 5 CYS HA 1 1 2 473 1 1 5 CYS HB2 H -3.805 -2.194 1.086 1.00 . A A . 5 CYS HB2 1 1 2 474 1 1 5 CYS HB3 H -2.907 -2.596 -0.358 1.00 . A A . 5 CYS HB3 1 1 2 475 1 1 5 CYS N N -5.049 -1.383 -1.855 1.00 . A A . 5 CYS N 1 1 2 476 1 1 5 CYS O O -6.225 -2.145 1.381 1.00 . A A . 5 CYS O 1 1 2 477 1 1 5 CYS SG S -3.172 -0.245 -0.119 1.00 . A A . 5 CYS SG 1 1 2 478 1 1 6 VAL C C -9.222 -2.763 0.735 1.00 . A A . 6 VAL C 1 1 2 479 1 1 6 VAL CA C -8.633 -1.473 0.142 1.00 . A A . 6 VAL CA 1 1 2 480 1 1 6 VAL CB C -9.604 -0.871 -0.912 1.00 . A A . 6 VAL CB 1 1 2 481 1 1 6 VAL CG1 C -10.977 -0.574 -0.263 1.00 . A A . 6 VAL CG1 1 1 2 482 1 1 6 VAL CG2 C -9.014 0.446 -1.454 1.00 . A A . 6 VAL CG2 1 1 2 483 1 1 6 VAL H H -7.253 -1.706 -1.498 1.00 . A A . 6 VAL H 1 1 2 484 1 1 6 VAL HA H -8.476 -0.753 0.931 1.00 . A A . 6 VAL HA 1 1 2 485 1 1 6 VAL HB H -9.734 -1.564 -1.730 1.00 . A A . 6 VAL HB 1 1 2 486 1 1 6 VAL HG11 H -10.851 -0.001 0.644 1.00 . A A . 6 VAL HG11 1 1 2 487 1 1 6 VAL HG12 H -11.599 -0.013 -0.944 1.00 . A A . 6 VAL HG12 1 1 2 488 1 1 6 VAL HG13 H -11.483 -1.497 -0.022 1.00 . A A . 6 VAL HG13 1 1 2 489 1 1 6 VAL HG21 H -8.858 1.147 -0.648 1.00 . A A . 6 VAL HG21 1 1 2 490 1 1 6 VAL HG22 H -8.068 0.261 -1.943 1.00 . A A . 6 VAL HG22 1 1 2 491 1 1 6 VAL HG23 H -9.691 0.885 -2.172 1.00 . A A . 6 VAL HG23 1 1 2 492 1 1 6 VAL N N -7.321 -1.750 -0.522 1.00 . A A . 6 VAL N 1 1 2 493 1 1 6 VAL O O -9.432 -2.862 1.928 1.00 . A A . 6 VAL O 1 1 2 494 1 1 7 TRP C C -9.099 -5.809 1.184 1.00 . A A . 7 TRP C 1 1 2 495 1 1 7 TRP CA C -10.042 -5.020 0.272 1.00 . A A . 7 TRP CA 1 1 2 496 1 1 7 TRP CB C -10.344 -5.839 -0.994 1.00 . A A . 7 TRP CB 1 1 2 497 1 1 7 TRP CD1 C -10.898 -8.326 -0.571 1.00 . A A . 7 TRP CD1 1 1 2 498 1 1 7 TRP CD2 C -12.593 -6.921 -0.325 1.00 . A A . 7 TRP CD2 1 1 2 499 1 1 7 TRP CE2 C -13.069 -8.205 -0.060 1.00 . A A . 7 TRP CE2 1 1 2 500 1 1 7 TRP CE3 C -13.460 -5.832 -0.243 1.00 . A A . 7 TRP CE3 1 1 2 501 1 1 7 TRP CG C -11.268 -7.012 -0.635 1.00 . A A . 7 TRP CG 1 1 2 502 1 1 7 TRP CH2 C -15.266 -7.308 0.368 1.00 . A A . 7 TRP CH2 1 1 2 503 1 1 7 TRP CZ2 C -14.403 -8.399 0.286 1.00 . A A . 7 TRP CZ2 1 1 2 504 1 1 7 TRP CZ3 C -14.794 -6.026 0.103 1.00 . A A . 7 TRP CZ3 1 1 2 505 1 1 7 TRP H H -9.267 -3.552 -1.081 1.00 . A A . 7 TRP H 1 1 2 506 1 1 7 TRP HA H -10.958 -4.819 0.801 1.00 . A A . 7 TRP HA 1 1 2 507 1 1 7 TRP HB2 H -10.828 -5.215 -1.728 1.00 . A A . 7 TRP HB2 1 1 2 508 1 1 7 TRP HB3 H -9.432 -6.228 -1.425 1.00 . A A . 7 TRP HB3 1 1 2 509 1 1 7 TRP HD1 H -9.923 -8.752 -0.757 1.00 . A A . 7 TRP HD1 1 1 2 510 1 1 7 TRP HE1 H -12.024 -9.924 -0.111 1.00 . A A . 7 TRP HE1 1 1 2 511 1 1 7 TRP HE3 H -13.096 -4.835 -0.447 1.00 . A A . 7 TRP HE3 1 1 2 512 1 1 7 TRP HH2 H -16.302 -7.459 0.636 1.00 . A A . 7 TRP HH2 1 1 2 513 1 1 7 TRP HZ2 H -14.768 -9.395 0.491 1.00 . A A . 7 TRP HZ2 1 1 2 514 1 1 7 TRP HZ3 H -15.463 -5.180 0.167 1.00 . A A . 7 TRP HZ3 1 1 2 515 1 1 7 TRP N N -9.466 -3.709 -0.138 1.00 . A A . 7 TRP N 1 1 2 516 1 1 7 TRP NE1 N -11.999 -8.953 -0.231 1.00 . A A . 7 TRP NE1 1 1 2 517 1 1 7 TRP O O -9.499 -6.284 2.229 1.00 . A A . 7 TRP O 1 1 2 518 1 1 8 ILE C C -5.529 -5.812 1.578 1.00 . A A . 8 ILE C 1 1 2 519 1 1 8 ILE CA C -6.822 -6.649 1.493 1.00 . A A . 8 ILE CA 1 1 2 520 1 1 8 ILE CB C -6.535 -8.008 0.776 1.00 . A A . 8 ILE CB 1 1 2 521 1 1 8 ILE CD1 C -5.747 -6.990 -1.436 1.00 . A A . 8 ILE CD1 1 1 2 522 1 1 8 ILE CG1 C -6.759 -7.946 -0.768 1.00 . A A . 8 ILE CG1 1 1 2 523 1 1 8 ILE CG2 C -7.454 -9.100 1.365 1.00 . A A . 8 ILE CG2 1 1 2 524 1 1 8 ILE H H -7.631 -5.507 -0.110 1.00 . A A . 8 ILE H 1 1 2 525 1 1 8 ILE HA H -7.188 -6.808 2.489 1.00 . A A . 8 ILE HA 1 1 2 526 1 1 8 ILE HB H -5.510 -8.282 0.954 1.00 . A A . 8 ILE HB 1 1 2 527 1 1 8 ILE HD11 H -4.793 -7.026 -0.930 1.00 . A A . 8 ILE HD11 1 1 2 528 1 1 8 ILE HD12 H -5.603 -7.277 -2.467 1.00 . A A . 8 ILE HD12 1 1 2 529 1 1 8 ILE HD13 H -6.120 -5.978 -1.412 1.00 . A A . 8 ILE HD13 1 1 2 530 1 1 8 ILE HG12 H -6.622 -8.933 -1.185 1.00 . A A . 8 ILE HG12 1 1 2 531 1 1 8 ILE HG13 H -7.764 -7.627 -0.995 1.00 . A A . 8 ILE HG13 1 1 2 532 1 1 8 ILE HG21 H -7.282 -9.204 2.427 1.00 . A A . 8 ILE HG21 1 1 2 533 1 1 8 ILE HG22 H -8.492 -8.848 1.204 1.00 . A A . 8 ILE HG22 1 1 2 534 1 1 8 ILE HG23 H -7.250 -10.049 0.889 1.00 . A A . 8 ILE HG23 1 1 2 535 1 1 8 ILE N N -7.875 -5.916 0.740 1.00 . A A . 8 ILE N 1 1 2 536 1 1 8 ILE O O -5.358 -4.887 0.810 1.00 . A A . 8 ILE O 1 1 2 537 1 1 9 PRO C C -2.473 -5.971 1.332 1.00 . A A . 9 PRO C 1 1 2 538 1 1 9 PRO CA C -3.288 -5.545 2.563 1.00 . A A . 9 PRO CA 1 1 2 539 1 1 9 PRO CB C -2.669 -6.042 3.869 1.00 . A A . 9 PRO CB 1 1 2 540 1 1 9 PRO CD C -4.887 -7.147 3.588 1.00 . A A . 9 PRO CD 1 1 2 541 1 1 9 PRO CG C -3.597 -7.139 4.425 1.00 . A A . 9 PRO CG 1 1 2 542 1 1 9 PRO HA H -3.380 -4.469 2.577 1.00 . A A . 9 PRO HA 1 1 2 543 1 1 9 PRO HB2 H -1.680 -6.444 3.701 1.00 . A A . 9 PRO HB2 1 1 2 544 1 1 9 PRO HB3 H -2.596 -5.228 4.576 1.00 . A A . 9 PRO HB3 1 1 2 545 1 1 9 PRO HD2 H -5.062 -8.122 3.157 1.00 . A A . 9 PRO HD2 1 1 2 546 1 1 9 PRO HD3 H -5.737 -6.843 4.182 1.00 . A A . 9 PRO HD3 1 1 2 547 1 1 9 PRO HG2 H -3.108 -8.100 4.359 1.00 . A A . 9 PRO HG2 1 1 2 548 1 1 9 PRO HG3 H -3.829 -6.936 5.460 1.00 . A A . 9 PRO HG3 1 1 2 549 1 1 9 PRO N N -4.652 -6.148 2.501 1.00 . A A . 9 PRO N 1 1 2 550 1 1 9 PRO O O -2.709 -7.023 0.768 1.00 . A A . 9 PRO O 1 1 2 551 1 1 10 CYS C C 0.280 -6.609 0.033 1.00 . A A . 10 CYS C 1 1 2 552 1 1 10 CYS CA C -0.673 -5.436 -0.227 1.00 . A A . 10 CYS CA 1 1 2 553 1 1 10 CYS CB C 0.155 -4.190 -0.587 1.00 . A A . 10 CYS CB 1 1 2 554 1 1 10 CYS H H -1.400 -4.306 1.462 1.00 . A A . 10 CYS H 1 1 2 555 1 1 10 CYS HA H -1.302 -5.683 -1.067 1.00 . A A . 10 CYS HA 1 1 2 556 1 1 10 CYS HB2 H 1.196 -4.469 -0.633 1.00 . A A . 10 CYS HB2 1 1 2 557 1 1 10 CYS HB3 H -0.125 -3.888 -1.584 1.00 . A A . 10 CYS HB3 1 1 2 558 1 1 10 CYS N N -1.536 -5.135 0.958 1.00 . A A . 10 CYS N 1 1 2 559 1 1 10 CYS O O 0.472 -7.031 1.158 1.00 . A A . 10 CYS O 1 1 2 560 1 1 10 CYS SG S 0.050 -2.718 0.458 1.00 . A A . 10 CYS SG 1 1 2 561 1 1 11 ILE C C 3.226 -7.682 -0.799 1.00 . A A . 11 ILE C 1 1 2 562 1 1 11 ILE CA C 1.805 -8.236 -0.981 1.00 . A A . 11 ILE CA 1 1 2 563 1 1 11 ILE CB C 1.708 -9.048 -2.287 1.00 . A A . 11 ILE CB 1 1 2 564 1 1 11 ILE CD1 C -0.504 -10.115 -1.503 1.00 . A A . 11 ILE CD1 1 1 2 565 1 1 11 ILE CG1 C 0.226 -9.384 -2.654 1.00 . A A . 11 ILE CG1 1 1 2 566 1 1 11 ILE CG2 C 2.547 -10.349 -2.181 1.00 . A A . 11 ILE CG2 1 1 2 567 1 1 11 ILE H H 0.634 -6.695 -1.915 1.00 . A A . 11 ILE H 1 1 2 568 1 1 11 ILE HA H 1.561 -8.875 -0.155 1.00 . A A . 11 ILE HA 1 1 2 569 1 1 11 ILE HB H 2.124 -8.434 -3.061 1.00 . A A . 11 ILE HB 1 1 2 570 1 1 11 ILE HD11 H 0.074 -10.961 -1.160 1.00 . A A . 11 ILE HD11 1 1 2 571 1 1 11 ILE HD12 H -0.671 -9.445 -0.673 1.00 . A A . 11 ILE HD12 1 1 2 572 1 1 11 ILE HD13 H -1.461 -10.473 -1.853 1.00 . A A . 11 ILE HD13 1 1 2 573 1 1 11 ILE HG12 H -0.302 -8.470 -2.883 1.00 . A A . 11 ILE HG12 1 1 2 574 1 1 11 ILE HG13 H 0.206 -10.007 -3.536 1.00 . A A . 11 ILE HG13 1 1 2 575 1 1 11 ILE HG21 H 2.353 -10.855 -1.247 1.00 . A A . 11 ILE HG21 1 1 2 576 1 1 11 ILE HG22 H 2.307 -11.017 -2.996 1.00 . A A . 11 ILE HG22 1 1 2 577 1 1 11 ILE HG23 H 3.600 -10.111 -2.233 1.00 . A A . 11 ILE HG23 1 1 2 578 1 1 11 ILE N N 0.844 -7.092 -1.044 1.00 . A A . 11 ILE N 1 1 2 579 1 1 11 ILE O O 4.032 -8.261 -0.098 1.00 . A A . 11 ILE O 1 1 2 580 1 1 12 SER C C 4.908 -5.099 -0.061 1.00 . A A . 12 SER C 1 1 2 581 1 1 12 SER CA C 4.804 -5.906 -1.372 1.00 . A A . 12 SER CA 1 1 2 582 1 1 12 SER CB C 4.938 -5.013 -2.636 1.00 . A A . 12 SER CB 1 1 2 583 1 1 12 SER H H 2.784 -6.152 -1.991 1.00 . A A . 12 SER H 1 1 2 584 1 1 12 SER HA H 5.565 -6.667 -1.383 1.00 . A A . 12 SER HA 1 1 2 585 1 1 12 SER HB2 H 4.840 -5.596 -3.540 1.00 . A A . 12 SER HB2 1 1 2 586 1 1 12 SER HB3 H 4.221 -4.204 -2.643 1.00 . A A . 12 SER HB3 1 1 2 587 1 1 12 SER HG H 6.238 -3.727 -1.976 1.00 . A A . 12 SER HG 1 1 2 588 1 1 12 SER N N 3.477 -6.568 -1.445 1.00 . A A . 12 SER N 1 1 2 589 1 1 12 SER O O 4.974 -5.690 1.000 1.00 . A A . 12 SER O 1 1 2 590 1 1 12 SER OG O 6.255 -4.485 -2.562 1.00 . A A . 12 SER OG 1 1 2 591 1 1 13 ALA C C 6.307 -3.072 1.859 1.00 . A A . 13 ALA C 1 1 2 592 1 1 13 ALA CA C 5.023 -2.876 1.023 1.00 . A A . 13 ALA CA 1 1 2 593 1 1 13 ALA CB C 3.787 -3.094 1.925 1.00 . A A . 13 ALA CB 1 1 2 594 1 1 13 ALA H H 4.860 -3.392 -1.059 1.00 . A A . 13 ALA H 1 1 2 595 1 1 13 ALA HA H 5.013 -1.860 0.663 1.00 . A A . 13 ALA HA 1 1 2 596 1 1 13 ALA HB1 H 2.911 -3.276 1.319 1.00 . A A . 13 ALA HB1 1 1 2 597 1 1 13 ALA HB2 H 3.936 -3.939 2.581 1.00 . A A . 13 ALA HB2 1 1 2 598 1 1 13 ALA HB3 H 3.613 -2.215 2.527 1.00 . A A . 13 ALA HB3 1 1 2 599 1 1 13 ALA N N 4.922 -3.789 -0.167 1.00 . A A . 13 ALA N 1 1 2 600 1 1 13 ALA O O 6.524 -2.361 2.822 1.00 . A A . 13 ALA O 1 1 2 601 1 1 14 ALA C C 9.469 -3.270 1.890 1.00 . A A . 14 ALA C 1 1 2 602 1 1 14 ALA CA C 8.392 -4.319 2.190 1.00 . A A . 14 ALA CA 1 1 2 603 1 1 14 ALA CB C 8.879 -5.707 1.764 1.00 . A A . 14 ALA CB 1 1 2 604 1 1 14 ALA H H 6.892 -4.557 0.677 1.00 . A A . 14 ALA H 1 1 2 605 1 1 14 ALA HA H 8.193 -4.321 3.253 1.00 . A A . 14 ALA HA 1 1 2 606 1 1 14 ALA HB1 H 8.133 -6.451 2.006 1.00 . A A . 14 ALA HB1 1 1 2 607 1 1 14 ALA HB2 H 9.060 -5.731 0.699 1.00 . A A . 14 ALA HB2 1 1 2 608 1 1 14 ALA HB3 H 9.795 -5.956 2.280 1.00 . A A . 14 ALA HB3 1 1 2 609 1 1 14 ALA N N 7.118 -4.023 1.465 1.00 . A A . 14 ALA N 1 1 2 610 1 1 14 ALA O O 10.286 -2.971 2.737 1.00 . A A . 14 ALA O 1 1 2 611 1 1 15 LEU C C 10.398 -0.507 1.200 1.00 . A A . 15 LEU C 1 1 2 612 1 1 15 LEU CA C 10.417 -1.716 0.251 1.00 . A A . 15 LEU CA 1 1 2 613 1 1 15 LEU CB C 10.061 -1.260 -1.176 1.00 . A A . 15 LEU CB 1 1 2 614 1 1 15 LEU CD1 C 9.233 -3.319 -2.430 1.00 . A A . 15 LEU CD1 1 1 2 615 1 1 15 LEU CD2 C 10.776 -1.686 -3.559 1.00 . A A . 15 LEU CD2 1 1 2 616 1 1 15 LEU CG C 10.430 -2.360 -2.214 1.00 . A A . 15 LEU CG 1 1 2 617 1 1 15 LEU H H 8.746 -3.038 0.053 1.00 . A A . 15 LEU H 1 1 2 618 1 1 15 LEU HA H 11.399 -2.161 0.270 1.00 . A A . 15 LEU HA 1 1 2 619 1 1 15 LEU HB2 H 9.007 -1.030 -1.232 1.00 . A A . 15 LEU HB2 1 1 2 620 1 1 15 LEU HB3 H 10.610 -0.357 -1.395 1.00 . A A . 15 LEU HB3 1 1 2 621 1 1 15 LEU HD11 H 8.321 -2.761 -2.579 1.00 . A A . 15 LEU HD11 1 1 2 622 1 1 15 LEU HD12 H 9.404 -3.937 -3.300 1.00 . A A . 15 LEU HD12 1 1 2 623 1 1 15 LEU HD13 H 9.110 -3.967 -1.574 1.00 . A A . 15 LEU HD13 1 1 2 624 1 1 15 LEU HD21 H 11.611 -1.011 -3.432 1.00 . A A . 15 LEU HD21 1 1 2 625 1 1 15 LEU HD22 H 11.045 -2.432 -4.293 1.00 . A A . 15 LEU HD22 1 1 2 626 1 1 15 LEU HD23 H 9.930 -1.124 -3.927 1.00 . A A . 15 LEU HD23 1 1 2 627 1 1 15 LEU HG H 11.286 -2.926 -1.876 1.00 . A A . 15 LEU HG 1 1 2 628 1 1 15 LEU N N 9.431 -2.749 0.687 1.00 . A A . 15 LEU N 1 1 2 629 1 1 15 LEU O O 11.421 0.085 1.484 1.00 . A A . 15 LEU O 1 1 2 630 1 1 16 GLY C C 7.619 1.583 2.297 1.00 . A A . 16 GLY C 1 1 2 631 1 1 16 GLY CA C 8.983 0.941 2.580 1.00 . A A . 16 GLY CA 1 1 2 632 1 1 16 GLY H H 8.439 -0.725 1.372 1.00 . A A . 16 GLY H 1 1 2 633 1 1 16 GLY HA2 H 9.013 0.586 3.601 1.00 . A A . 16 GLY HA2 1 1 2 634 1 1 16 GLY HA3 H 9.754 1.672 2.420 1.00 . A A . 16 GLY HA3 1 1 2 635 1 1 16 GLY N N 9.210 -0.198 1.651 1.00 . A A . 16 GLY N 1 1 2 636 1 1 16 GLY O O 7.247 2.551 2.933 1.00 . A A . 16 GLY O 1 1 2 637 1 1 17 CYS C C 4.563 1.425 2.102 1.00 . A A . 17 CYS C 1 1 2 638 1 1 17 CYS CA C 5.572 1.538 0.954 1.00 . A A . 17 CYS CA 1 1 2 639 1 1 17 CYS CB C 5.053 0.741 -0.259 1.00 . A A . 17 CYS CB 1 1 2 640 1 1 17 CYS H H 7.283 0.241 0.875 1.00 . A A . 17 CYS H 1 1 2 641 1 1 17 CYS HA H 5.674 2.577 0.683 1.00 . A A . 17 CYS HA 1 1 2 642 1 1 17 CYS HB2 H 4.202 0.143 0.030 1.00 . A A . 17 CYS HB2 1 1 2 643 1 1 17 CYS HB3 H 4.687 1.461 -0.977 1.00 . A A . 17 CYS HB3 1 1 2 644 1 1 17 CYS N N 6.917 1.020 1.343 1.00 . A A . 17 CYS N 1 1 2 645 1 1 17 CYS O O 4.659 0.545 2.936 1.00 . A A . 17 CYS O 1 1 2 646 1 1 17 CYS SG S 6.199 -0.342 -1.149 1.00 . A A . 17 CYS SG 1 1 2 647 1 1 18 SER C C 1.216 2.579 2.409 1.00 . A A . 18 SER C 1 1 2 648 1 1 18 SER CA C 2.555 2.391 3.127 1.00 . A A . 18 SER CA 1 1 2 649 1 1 18 SER CB C 2.821 3.572 4.066 1.00 . A A . 18 SER CB 1 1 2 650 1 1 18 SER H H 3.630 3.013 1.376 1.00 . A A . 18 SER H 1 1 2 651 1 1 18 SER HA H 2.532 1.461 3.678 1.00 . A A . 18 SER HA 1 1 2 652 1 1 18 SER HB2 H 2.939 4.495 3.517 1.00 . A A . 18 SER HB2 1 1 2 653 1 1 18 SER HB3 H 2.045 3.674 4.809 1.00 . A A . 18 SER HB3 1 1 2 654 1 1 18 SER HG H 4.547 4.048 4.829 1.00 . A A . 18 SER HG 1 1 2 655 1 1 18 SER N N 3.628 2.340 2.088 1.00 . A A . 18 SER N 1 1 2 656 1 1 18 SER O O 1.095 3.443 1.561 1.00 . A A . 18 SER O 1 1 2 657 1 1 18 SER OG O 4.048 3.238 4.700 1.00 . A A . 18 SER OG 1 1 2 658 1 1 19 CYS C C -1.806 3.153 2.572 1.00 . A A . 19 CYS C 1 1 2 659 1 1 19 CYS CA C -1.087 1.882 2.109 1.00 . A A . 19 CYS CA 1 1 2 660 1 1 19 CYS CB C -1.936 0.655 2.456 1.00 . A A . 19 CYS CB 1 1 2 661 1 1 19 CYS H H 0.407 1.089 3.452 1.00 . A A . 19 CYS H 1 1 2 662 1 1 19 CYS HA H -0.948 1.924 1.040 1.00 . A A . 19 CYS HA 1 1 2 663 1 1 19 CYS HB2 H -1.396 -0.225 2.138 1.00 . A A . 19 CYS HB2 1 1 2 664 1 1 19 CYS HB3 H -2.072 0.601 3.525 1.00 . A A . 19 CYS HB3 1 1 2 665 1 1 19 CYS N N 0.251 1.767 2.763 1.00 . A A . 19 CYS N 1 1 2 666 1 1 19 CYS O O -2.044 3.357 3.747 1.00 . A A . 19 CYS O 1 1 2 667 1 1 19 CYS SG S -3.563 0.614 1.665 1.00 . A A . 19 CYS SG 1 1 2 668 1 1 20 LYS C C -3.529 5.676 0.542 1.00 . A A . 20 LYS C 1 1 2 669 1 1 20 LYS CA C -2.828 5.259 1.838 1.00 . A A . 20 LYS CA 1 1 2 670 1 1 20 LYS CB C -1.796 6.342 2.263 1.00 . A A . 20 LYS CB 1 1 2 671 1 1 20 LYS CD C -0.568 7.457 0.314 1.00 . A A . 20 LYS CD 1 1 2 672 1 1 20 LYS CE C 0.171 7.032 -0.971 1.00 . A A . 20 LYS CE 1 1 2 673 1 1 20 LYS CG C -0.525 6.315 1.359 1.00 . A A . 20 LYS CG 1 1 2 674 1 1 20 LYS H H -1.888 3.718 0.681 1.00 . A A . 20 LYS H 1 1 2 675 1 1 20 LYS HA H -3.572 5.121 2.609 1.00 . A A . 20 LYS HA 1 1 2 676 1 1 20 LYS HB2 H -2.261 7.317 2.237 1.00 . A A . 20 LYS HB2 1 1 2 677 1 1 20 LYS HB3 H -1.499 6.147 3.283 1.00 . A A . 20 LYS HB3 1 1 2 678 1 1 20 LYS HD2 H -1.589 7.693 0.059 1.00 . A A . 20 LYS HD2 1 1 2 679 1 1 20 LYS HD3 H -0.102 8.342 0.725 1.00 . A A . 20 LYS HD3 1 1 2 680 1 1 20 LYS HE2 H -0.447 6.359 -1.545 1.00 . A A . 20 LYS HE2 1 1 2 681 1 1 20 LYS HE3 H 0.393 7.900 -1.574 1.00 . A A . 20 LYS HE3 1 1 2 682 1 1 20 LYS HG2 H 0.349 6.446 1.980 1.00 . A A . 20 LYS HG2 1 1 2 683 1 1 20 LYS HG3 H -0.433 5.368 0.852 1.00 . A A . 20 LYS HG3 1 1 2 684 1 1 20 LYS HZ1 H 1.994 6.920 0.026 1.00 . A A . 20 LYS HZ1 1 1 2 685 1 1 20 LYS HZ2 H 1.250 5.413 -0.223 1.00 . A A . 20 LYS HZ2 1 1 2 686 1 1 20 LYS HZ3 H 2.003 6.212 -1.516 1.00 . A A . 20 LYS HZ3 1 1 2 687 1 1 20 LYS N N -2.123 3.965 1.599 1.00 . A A . 20 LYS N 1 1 2 688 1 1 20 LYS NZ N 1.450 6.342 -0.645 1.00 . A A . 20 LYS NZ 1 1 2 689 1 1 20 LYS O O -3.025 5.424 -0.536 1.00 . A A . 20 LYS O 1 1 2 690 1 1 21 ASN C C -5.702 5.605 -1.462 1.00 . A A . 21 ASN C 1 1 2 691 1 1 21 ASN CA C -5.479 6.772 -0.481 1.00 . A A . 21 ASN CA 1 1 2 692 1 1 21 ASN CB C -4.717 7.941 -1.166 1.00 . A A . 21 ASN CB 1 1 2 693 1 1 21 ASN CG C -4.516 9.070 -0.147 1.00 . A A . 21 ASN CG 1 1 2 694 1 1 21 ASN H H -5.010 6.469 1.599 1.00 . A A . 21 ASN H 1 1 2 695 1 1 21 ASN HA H -6.441 7.112 -0.126 1.00 . A A . 21 ASN HA 1 1 2 696 1 1 21 ASN HB2 H -3.752 7.617 -1.527 1.00 . A A . 21 ASN HB2 1 1 2 697 1 1 21 ASN HB3 H -5.291 8.325 -1.997 1.00 . A A . 21 ASN HB3 1 1 2 698 1 1 21 ASN HD21 H -6.317 9.840 -0.453 1.00 . A A . 21 ASN HD21 1 1 2 699 1 1 21 ASN HD22 H -5.367 10.652 0.695 1.00 . A A . 21 ASN HD22 1 1 2 700 1 1 21 ASN N N -4.673 6.303 0.694 1.00 . A A . 21 ASN N 1 1 2 701 1 1 21 ASN ND2 N -5.481 9.925 0.048 1.00 . A A . 21 ASN ND2 1 1 2 702 1 1 21 ASN O O -5.361 5.680 -2.628 1.00 . A A . 21 ASN O 1 1 2 703 1 1 21 ASN OD1 O -3.481 9.182 0.480 1.00 . A A . 21 ASN OD1 1 1 2 704 1 1 22 LYS C C -5.543 2.851 -2.682 1.00 . A A . 22 LYS C 1 1 2 705 1 1 22 LYS CA C -6.604 3.293 -1.649 1.00 . A A . 22 LYS CA 1 1 2 706 1 1 22 LYS CB C -8.000 3.470 -2.340 1.00 . A A . 22 LYS CB 1 1 2 707 1 1 22 LYS CD C -9.246 4.518 -4.269 1.00 . A A . 22 LYS CD 1 1 2 708 1 1 22 LYS CE C -9.281 5.707 -5.251 1.00 . A A . 22 LYS CE 1 1 2 709 1 1 22 LYS CG C -8.022 4.652 -3.340 1.00 . A A . 22 LYS CG 1 1 2 710 1 1 22 LYS H H -6.506 4.613 0.039 1.00 . A A . 22 LYS H 1 1 2 711 1 1 22 LYS HA H -6.688 2.506 -0.915 1.00 . A A . 22 LYS HA 1 1 2 712 1 1 22 LYS HB2 H -8.251 2.558 -2.860 1.00 . A A . 22 LYS HB2 1 1 2 713 1 1 22 LYS HB3 H -8.747 3.627 -1.575 1.00 . A A . 22 LYS HB3 1 1 2 714 1 1 22 LYS HD2 H -9.182 3.592 -4.823 1.00 . A A . 22 LYS HD2 1 1 2 715 1 1 22 LYS HD3 H -10.155 4.508 -3.683 1.00 . A A . 22 LYS HD3 1 1 2 716 1 1 22 LYS HE2 H -9.866 6.515 -4.834 1.00 . A A . 22 LYS HE2 1 1 2 717 1 1 22 LYS HE3 H -8.283 6.069 -5.459 1.00 . A A . 22 LYS HE3 1 1 2 718 1 1 22 LYS HG2 H -8.079 5.587 -2.801 1.00 . A A . 22 LYS HG2 1 1 2 719 1 1 22 LYS HG3 H -7.128 4.650 -3.942 1.00 . A A . 22 LYS HG3 1 1 2 720 1 1 22 LYS HZ1 H -10.847 4.889 -6.352 1.00 . A A . 22 LYS HZ1 1 1 2 721 1 1 22 LYS HZ2 H -9.985 6.104 -7.169 1.00 . A A . 22 LYS HZ2 1 1 2 722 1 1 22 LYS HZ3 H -9.306 4.558 -6.985 1.00 . A A . 22 LYS HZ3 1 1 2 723 1 1 22 LYS N N -6.277 4.560 -0.912 1.00 . A A . 22 LYS N 1 1 2 724 1 1 22 LYS NZ N -9.903 5.282 -6.536 1.00 . A A . 22 LYS NZ 1 1 2 725 1 1 22 LYS O O -5.863 2.385 -3.759 1.00 . A A . 22 LYS O 1 1 2 726 1 1 23 VAL C C -1.977 2.272 -2.224 1.00 . A A . 23 VAL C 1 1 2 727 1 1 23 VAL CA C -3.143 2.651 -3.157 1.00 . A A . 23 VAL CA 1 1 2 728 1 1 23 VAL CB C -2.843 3.882 -4.072 1.00 . A A . 23 VAL CB 1 1 2 729 1 1 23 VAL CG1 C -1.581 4.662 -3.652 1.00 . A A . 23 VAL CG1 1 1 2 730 1 1 23 VAL CG2 C -2.706 3.401 -5.529 1.00 . A A . 23 VAL CG2 1 1 2 731 1 1 23 VAL H H -4.103 3.415 -1.435 1.00 . A A . 23 VAL H 1 1 2 732 1 1 23 VAL HA H -3.417 1.782 -3.724 1.00 . A A . 23 VAL HA 1 1 2 733 1 1 23 VAL HB H -3.682 4.558 -4.005 1.00 . A A . 23 VAL HB 1 1 2 734 1 1 23 VAL HG11 H -0.719 4.015 -3.660 1.00 . A A . 23 VAL HG11 1 1 2 735 1 1 23 VAL HG12 H -1.410 5.489 -4.327 1.00 . A A . 23 VAL HG12 1 1 2 736 1 1 23 VAL HG13 H -1.714 5.056 -2.657 1.00 . A A . 23 VAL HG13 1 1 2 737 1 1 23 VAL HG21 H -1.969 2.615 -5.598 1.00 . A A . 23 VAL HG21 1 1 2 738 1 1 23 VAL HG22 H -3.654 3.018 -5.876 1.00 . A A . 23 VAL HG22 1 1 2 739 1 1 23 VAL HG23 H -2.414 4.218 -6.172 1.00 . A A . 23 VAL HG23 1 1 2 740 1 1 23 VAL N N -4.300 3.023 -2.303 1.00 . A A . 23 VAL N 1 1 2 741 1 1 23 VAL O O -1.817 2.874 -1.179 1.00 . A A . 23 VAL O 1 1 2 742 1 1 24 CYS C C 1.277 1.405 -2.333 1.00 . A A . 24 CYS C 1 1 2 743 1 1 24 CYS CA C -0.038 0.858 -1.777 1.00 . A A . 24 CYS CA 1 1 2 744 1 1 24 CYS CB C 0.006 -0.672 -1.748 1.00 . A A . 24 CYS CB 1 1 2 745 1 1 24 CYS H H -1.369 0.852 -3.483 1.00 . A A . 24 CYS H 1 1 2 746 1 1 24 CYS HA H -0.159 1.223 -0.769 1.00 . A A . 24 CYS HA 1 1 2 747 1 1 24 CYS HB2 H -0.977 -1.035 -1.489 1.00 . A A . 24 CYS HB2 1 1 2 748 1 1 24 CYS HB3 H 0.235 -1.037 -2.738 1.00 . A A . 24 CYS HB3 1 1 2 749 1 1 24 CYS N N -1.197 1.297 -2.623 1.00 . A A . 24 CYS N 1 1 2 750 1 1 24 CYS O O 2.113 0.658 -2.803 1.00 . A A . 24 CYS O 1 1 2 751 1 1 24 CYS SG S 1.183 -1.423 -0.598 1.00 . A A . 24 CYS SG 1 1 2 752 1 1 25 TYR C C 3.448 3.938 -1.572 1.00 . A A . 25 TYR C 1 1 2 753 1 1 25 TYR CA C 2.638 3.403 -2.756 1.00 . A A . 25 TYR CA 1 1 2 754 1 1 25 TYR CB C 2.214 4.569 -3.656 1.00 . A A . 25 TYR CB 1 1 2 755 1 1 25 TYR CD1 C 1.352 2.785 -5.320 1.00 . A A . 25 TYR CD1 1 1 2 756 1 1 25 TYR CD2 C 0.922 5.082 -5.748 1.00 . A A . 25 TYR CD2 1 1 2 757 1 1 25 TYR CE1 C 0.680 2.445 -6.471 1.00 . A A . 25 TYR CE1 1 1 2 758 1 1 25 TYR CE2 C 0.249 4.741 -6.899 1.00 . A A . 25 TYR CE2 1 1 2 759 1 1 25 TYR CG C 1.483 4.113 -4.939 1.00 . A A . 25 TYR CG 1 1 2 760 1 1 25 TYR CZ C 0.124 3.418 -7.271 1.00 . A A . 25 TYR CZ 1 1 2 761 1 1 25 TYR H H 0.698 3.242 -1.860 1.00 . A A . 25 TYR H 1 1 2 762 1 1 25 TYR HA H 3.254 2.726 -3.332 1.00 . A A . 25 TYR HA 1 1 2 763 1 1 25 TYR HB2 H 1.565 5.234 -3.109 1.00 . A A . 25 TYR HB2 1 1 2 764 1 1 25 TYR HB3 H 3.083 5.135 -3.937 1.00 . A A . 25 TYR HB3 1 1 2 765 1 1 25 TYR HD1 H 1.776 1.994 -4.728 1.00 . A A . 25 TYR HD1 1 1 2 766 1 1 25 TYR HD2 H 1.010 6.123 -5.475 1.00 . A A . 25 TYR HD2 1 1 2 767 1 1 25 TYR HE1 H 0.592 1.404 -6.742 1.00 . A A . 25 TYR HE1 1 1 2 768 1 1 25 TYR HE2 H -0.180 5.520 -7.510 1.00 . A A . 25 TYR HE2 1 1 2 769 1 1 25 TYR HH H 0.074 2.636 -9.008 1.00 . A A . 25 TYR HH 1 1 2 770 1 1 25 TYR N N 1.412 2.704 -2.257 1.00 . A A . 25 TYR N 1 1 2 771 1 1 25 TYR O O 2.983 3.940 -0.449 1.00 . A A . 25 TYR O 1 1 2 772 1 1 25 TYR OH O -0.550 3.072 -8.424 1.00 . A A . 25 TYR OH 1 1 2 773 1 1 26 ARG C C 5.425 6.467 -0.908 1.00 . A A . 26 ARG C 1 1 2 774 1 1 26 ARG CA C 5.548 4.936 -0.816 1.00 . A A . 26 ARG CA 1 1 2 775 1 1 26 ARG CB C 6.992 4.457 -1.102 1.00 . A A . 26 ARG CB 1 1 2 776 1 1 26 ARG CD C 9.002 3.538 0.116 1.00 . A A . 26 ARG CD 1 1 2 777 1 1 26 ARG CG C 7.842 4.545 0.188 1.00 . A A . 26 ARG CG 1 1 2 778 1 1 26 ARG CZ C 11.045 3.296 -1.205 1.00 . A A . 26 ARG CZ 1 1 2 779 1 1 26 ARG H H 4.953 4.338 -2.800 1.00 . A A . 26 ARG H 1 1 2 780 1 1 26 ARG HA H 5.211 4.619 0.160 1.00 . A A . 26 ARG HA 1 1 2 781 1 1 26 ARG HB2 H 6.962 3.437 -1.458 1.00 . A A . 26 ARG HB2 1 1 2 782 1 1 26 ARG HB3 H 7.442 5.074 -1.866 1.00 . A A . 26 ARG HB3 1 1 2 783 1 1 26 ARG HD2 H 9.528 3.517 1.060 1.00 . A A . 26 ARG HD2 1 1 2 784 1 1 26 ARG HD3 H 8.640 2.546 -0.113 1.00 . A A . 26 ARG HD3 1 1 2 785 1 1 26 ARG HE H 9.754 4.777 -1.476 1.00 . A A . 26 ARG HE 1 1 2 786 1 1 26 ARG HG2 H 8.240 5.544 0.296 1.00 . A A . 26 ARG HG2 1 1 2 787 1 1 26 ARG HG3 H 7.237 4.325 1.056 1.00 . A A . 26 ARG HG3 1 1 2 788 1 1 26 ARG HH11 H 10.716 1.896 0.194 1.00 . A A . 26 ARG HH11 1 1 2 789 1 1 26 ARG HH12 H 12.170 1.711 -0.727 1.00 . A A . 26 ARG HH12 1 1 2 790 1 1 26 ARG HH21 H 11.589 4.562 -2.656 1.00 . A A . 26 ARG HH21 1 1 2 791 1 1 26 ARG HH22 H 12.674 3.242 -2.368 1.00 . A A . 26 ARG HH22 1 1 2 792 1 1 26 ARG N N 4.645 4.376 -1.871 1.00 . A A . 26 ARG N 1 1 2 793 1 1 26 ARG NE N 9.950 3.972 -0.954 1.00 . A A . 26 ARG NE 1 1 2 794 1 1 26 ARG NH1 N 11.332 2.217 -0.526 1.00 . A A . 26 ARG NH1 1 1 2 795 1 1 26 ARG NH2 N 11.831 3.734 -2.150 1.00 . A A . 26 ARG NH2 1 1 2 796 1 1 26 ARG O O 6.387 7.199 -0.773 1.00 . A A . 26 ARG O 1 1 2 797 1 1 27 ASN C C 4.676 8.991 -2.372 1.00 . A A . 27 ASN C 1 1 2 798 1 1 27 ASN CA C 3.835 8.321 -1.274 1.00 . A A . 27 ASN CA 1 1 2 799 1 1 27 ASN CB C 4.052 9.011 0.105 1.00 . A A . 27 ASN CB 1 1 2 800 1 1 27 ASN CG C 3.072 10.183 0.239 1.00 . A A . 27 ASN CG 1 1 2 801 1 1 27 ASN H H 3.496 6.206 -1.230 1.00 . A A . 27 ASN H 1 1 2 802 1 1 27 ASN HA H 2.797 8.376 -1.566 1.00 . A A . 27 ASN HA 1 1 2 803 1 1 27 ASN HB2 H 3.864 8.312 0.907 1.00 . A A . 27 ASN HB2 1 1 2 804 1 1 27 ASN HB3 H 5.062 9.383 0.204 1.00 . A A . 27 ASN HB3 1 1 2 805 1 1 27 ASN HD21 H 4.249 11.453 -0.734 1.00 . A A . 27 ASN HD21 1 1 2 806 1 1 27 ASN HD22 H 2.775 12.098 -0.195 1.00 . A A . 27 ASN HD22 1 1 2 807 1 1 27 ASN N N 4.202 6.878 -1.140 1.00 . A A . 27 ASN N 1 1 2 808 1 1 27 ASN ND2 N 3.391 11.341 -0.273 1.00 . A A . 27 ASN ND2 1 1 2 809 1 1 27 ASN O O 5.174 10.089 -2.209 1.00 . A A . 27 ASN O 1 1 2 810 1 1 27 ASN OD1 O 2.006 10.055 0.808 1.00 . A A . 27 ASN OD1 1 1 2 811 1 1 28 GLY C C 5.941 7.773 -5.665 1.00 . A A . 28 GLY C 1 1 2 812 1 1 28 GLY CA C 5.594 8.829 -4.613 1.00 . A A . 28 GLY CA 1 1 2 813 1 1 28 GLY H H 4.380 7.414 -3.552 1.00 . A A . 28 GLY H 1 1 2 814 1 1 28 GLY HA2 H 5.029 9.621 -5.079 1.00 . A A . 28 GLY HA2 1 1 2 815 1 1 28 GLY HA3 H 6.514 9.225 -4.220 1.00 . A A . 28 GLY HA3 1 1 2 816 1 1 28 GLY N N 4.802 8.292 -3.472 1.00 . A A . 28 GLY N 1 1 2 817 1 1 28 GLY O O 6.029 8.095 -6.835 1.00 . A A . 28 GLY O 1 1 2 818 1 1 29 ILE C C 5.314 4.427 -6.242 1.00 . A A . 29 ILE C 1 1 2 819 1 1 29 ILE CA C 6.476 5.440 -6.166 1.00 . A A . 29 ILE CA 1 1 2 820 1 1 29 ILE CB C 7.784 4.765 -5.649 1.00 . A A . 29 ILE CB 1 1 2 821 1 1 29 ILE CD1 C 9.851 3.486 -6.380 1.00 . A A . 29 ILE CD1 1 1 2 822 1 1 29 ILE CG1 C 8.447 3.960 -6.802 1.00 . A A . 29 ILE CG1 1 1 2 823 1 1 29 ILE CG2 C 7.506 3.830 -4.445 1.00 . A A . 29 ILE CG2 1 1 2 824 1 1 29 ILE H H 6.036 6.357 -4.272 1.00 . A A . 29 ILE H 1 1 2 825 1 1 29 ILE HA H 6.667 5.857 -7.142 1.00 . A A . 29 ILE HA 1 1 2 826 1 1 29 ILE HB H 8.454 5.548 -5.325 1.00 . A A . 29 ILE HB 1 1 2 827 1 1 29 ILE HD11 H 10.417 4.308 -5.965 1.00 . A A . 29 ILE HD11 1 1 2 828 1 1 29 ILE HD12 H 9.774 2.705 -5.638 1.00 . A A . 29 ILE HD12 1 1 2 829 1 1 29 ILE HD13 H 10.381 3.098 -7.237 1.00 . A A . 29 ILE HD13 1 1 2 830 1 1 29 ILE HG12 H 7.839 3.105 -7.060 1.00 . A A . 29 ILE HG12 1 1 2 831 1 1 29 ILE HG13 H 8.542 4.587 -7.677 1.00 . A A . 29 ILE HG13 1 1 2 832 1 1 29 ILE HG21 H 6.773 4.279 -3.794 1.00 . A A . 29 ILE HG21 1 1 2 833 1 1 29 ILE HG22 H 7.131 2.875 -4.785 1.00 . A A . 29 ILE HG22 1 1 2 834 1 1 29 ILE HG23 H 8.415 3.668 -3.886 1.00 . A A . 29 ILE HG23 1 1 2 835 1 1 29 ILE N N 6.127 6.552 -5.227 1.00 . A A . 29 ILE N 1 1 2 836 1 1 29 ILE O O 4.756 4.081 -5.220 1.00 . A A . 29 ILE O 1 1 2 837 1 1 30 PRO C C 4.707 1.559 -7.132 1.00 . A A . 30 PRO C 1 1 2 838 1 1 30 PRO CA C 4.015 2.848 -7.583 1.00 . A A . 30 PRO CA 1 1 2 839 1 1 30 PRO CB C 3.621 2.838 -9.062 1.00 . A A . 30 PRO CB 1 1 2 840 1 1 30 PRO CD C 5.452 4.501 -8.737 1.00 . A A . 30 PRO CD 1 1 2 841 1 1 30 PRO CG C 4.581 3.796 -9.793 1.00 . A A . 30 PRO CG 1 1 2 842 1 1 30 PRO HA H 3.162 3.034 -6.951 1.00 . A A . 30 PRO HA 1 1 2 843 1 1 30 PRO HB2 H 3.695 1.845 -9.480 1.00 . A A . 30 PRO HB2 1 1 2 844 1 1 30 PRO HB3 H 2.599 3.177 -9.164 1.00 . A A . 30 PRO HB3 1 1 2 845 1 1 30 PRO HD2 H 6.497 4.254 -8.857 1.00 . A A . 30 PRO HD2 1 1 2 846 1 1 30 PRO HD3 H 5.315 5.572 -8.770 1.00 . A A . 30 PRO HD3 1 1 2 847 1 1 30 PRO HG2 H 5.209 3.240 -10.475 1.00 . A A . 30 PRO HG2 1 1 2 848 1 1 30 PRO HG3 H 4.017 4.526 -10.355 1.00 . A A . 30 PRO HG3 1 1 2 849 1 1 30 PRO N N 4.968 3.976 -7.427 1.00 . A A . 30 PRO N 1 1 2 850 1 1 30 PRO O O 5.445 0.943 -7.877 1.00 . A A . 30 PRO O 1 1 3 851 1 1 1 CYS C C 4.174 -1.049 -5.968 1.00 . A A . 1 CYS C 1 1 3 852 1 1 1 CYS CA C 4.983 0.112 -5.389 1.00 . A A . 1 CYS CA 1 1 3 853 1 1 1 CYS CB C 4.881 0.122 -3.861 1.00 . A A . 1 CYS CB 1 1 3 854 1 1 1 CYS HA H 6.014 0.030 -5.703 1.00 . A A . 1 CYS HA 1 1 3 855 1 1 1 CYS HB2 H 4.103 0.809 -3.585 1.00 . A A . 1 CYS HB2 1 1 3 856 1 1 1 CYS HB3 H 4.571 -0.858 -3.527 1.00 . A A . 1 CYS HB3 1 1 3 857 1 1 1 CYS N N 4.388 1.373 -5.930 1.00 . A A . 1 CYS N 1 1 3 858 1 1 1 CYS O O 4.735 -2.006 -6.466 1.00 . A A . 1 CYS O 1 1 3 859 1 1 1 CYS SG S 6.327 0.573 -2.875 1.00 . A A . 1 CYS SG 1 1 3 860 1 1 2 GLY C C 0.664 -1.313 -6.877 1.00 . A A . 2 GLY C 1 1 3 861 1 1 2 GLY CA C 1.962 -1.964 -6.404 1.00 . A A . 2 GLY CA 1 1 3 862 1 1 2 GLY H H 2.474 -0.120 -5.466 1.00 . A A . 2 GLY H 1 1 3 863 1 1 2 GLY HA2 H 2.426 -2.464 -7.240 1.00 . A A . 2 GLY HA2 1 1 3 864 1 1 2 GLY HA3 H 1.750 -2.678 -5.622 1.00 . A A . 2 GLY HA3 1 1 3 865 1 1 2 GLY N N 2.871 -0.915 -5.881 1.00 . A A . 2 GLY N 1 1 3 866 1 1 2 GLY O O 0.547 -0.940 -8.028 1.00 . A A . 2 GLY O 1 1 3 867 1 1 3 GLU C C -2.511 -0.693 -4.990 1.00 . A A . 3 GLU C 1 1 3 868 1 1 3 GLU CA C -1.602 -0.585 -6.224 1.00 . A A . 3 GLU CA 1 1 3 869 1 1 3 GLU CB C -2.291 -1.316 -7.402 1.00 . A A . 3 GLU CB 1 1 3 870 1 1 3 GLU CD C -4.322 -0.961 -8.853 1.00 . A A . 3 GLU CD 1 1 3 871 1 1 3 GLU CG C -3.046 -0.304 -8.301 1.00 . A A . 3 GLU CG 1 1 3 872 1 1 3 GLU H H -0.043 -1.503 -5.051 1.00 . A A . 3 GLU H 1 1 3 873 1 1 3 GLU HA H -1.455 0.461 -6.443 1.00 . A A . 3 GLU HA 1 1 3 874 1 1 3 GLU HB2 H -1.554 -1.833 -7.984 1.00 . A A . 3 GLU HB2 1 1 3 875 1 1 3 GLU HB3 H -2.966 -2.064 -7.012 1.00 . A A . 3 GLU HB3 1 1 3 876 1 1 3 GLU HG2 H -3.326 0.579 -7.744 1.00 . A A . 3 GLU HG2 1 1 3 877 1 1 3 GLU HG3 H -2.413 -0.002 -9.124 1.00 . A A . 3 GLU HG3 1 1 3 878 1 1 3 GLU N N -0.256 -1.191 -5.952 1.00 . A A . 3 GLU N 1 1 3 879 1 1 3 GLU O O -2.055 -0.994 -3.903 1.00 . A A . 3 GLU O 1 1 3 880 1 1 3 GLU OE1 O -5.261 -1.050 -8.077 1.00 . A A . 3 GLU OE1 1 1 3 881 1 1 3 GLU OE2 O -4.287 -1.338 -10.013 1.00 . A A . 3 GLU OE2 1 1 3 882 1 1 4 SER C C -4.702 -1.677 -3.186 1.00 . A A . 4 SER C 1 1 3 883 1 1 4 SER CA C -4.821 -0.500 -4.153 1.00 . A A . 4 SER CA 1 1 3 884 1 1 4 SER CB C -6.209 -0.536 -4.806 1.00 . A A . 4 SER CB 1 1 3 885 1 1 4 SER H H -4.062 -0.221 -6.129 1.00 . A A . 4 SER H 1 1 3 886 1 1 4 SER HA H -4.736 0.397 -3.569 1.00 . A A . 4 SER HA 1 1 3 887 1 1 4 SER HB2 H -6.410 -1.505 -5.230 1.00 . A A . 4 SER HB2 1 1 3 888 1 1 4 SER HB3 H -6.979 -0.280 -4.096 1.00 . A A . 4 SER HB3 1 1 3 889 1 1 4 SER HG H -5.524 1.117 -5.595 1.00 . A A . 4 SER HG 1 1 3 890 1 1 4 SER N N -3.780 -0.449 -5.221 1.00 . A A . 4 SER N 1 1 3 891 1 1 4 SER O O -4.296 -2.771 -3.528 1.00 . A A . 4 SER O 1 1 3 892 1 1 4 SER OG O -6.176 0.453 -5.829 1.00 . A A . 4 SER OG 1 1 3 893 1 1 5 CYS C C -6.422 -2.109 -0.082 1.00 . A A . 5 CYS C 1 1 3 894 1 1 5 CYS CA C -5.087 -2.271 -0.828 1.00 . A A . 5 CYS CA 1 1 3 895 1 1 5 CYS CB C -3.871 -1.878 0.022 1.00 . A A . 5 CYS CB 1 1 3 896 1 1 5 CYS H H -5.401 -0.434 -1.849 1.00 . A A . 5 CYS H 1 1 3 897 1 1 5 CYS HA H -5.013 -3.278 -1.193 1.00 . A A . 5 CYS HA 1 1 3 898 1 1 5 CYS HB2 H -4.075 -2.093 1.058 1.00 . A A . 5 CYS HB2 1 1 3 899 1 1 5 CYS HB3 H -3.026 -2.479 -0.282 1.00 . A A . 5 CYS HB3 1 1 3 900 1 1 5 CYS N N -5.091 -1.345 -1.987 1.00 . A A . 5 CYS N 1 1 3 901 1 1 5 CYS O O -6.476 -2.030 1.131 1.00 . A A . 5 CYS O 1 1 3 902 1 1 5 CYS SG S -3.396 -0.134 -0.102 1.00 . A A . 5 CYS SG 1 1 3 903 1 1 6 VAL C C -9.349 -3.276 0.197 1.00 . A A . 6 VAL C 1 1 3 904 1 1 6 VAL CA C -8.847 -1.915 -0.303 1.00 . A A . 6 VAL CA 1 1 3 905 1 1 6 VAL CB C -9.760 -1.352 -1.427 1.00 . A A . 6 VAL CB 1 1 3 906 1 1 6 VAL CG1 C -11.209 -1.192 -0.911 1.00 . A A . 6 VAL CG1 1 1 3 907 1 1 6 VAL CG2 C -9.224 0.030 -1.858 1.00 . A A . 6 VAL CG2 1 1 3 908 1 1 6 VAL H H -7.351 -2.140 -1.832 1.00 . A A . 6 VAL H 1 1 3 909 1 1 6 VAL HA H -8.819 -1.222 0.525 1.00 . A A . 6 VAL HA 1 1 3 910 1 1 6 VAL HB H -9.750 -2.020 -2.277 1.00 . A A . 6 VAL HB 1 1 3 911 1 1 6 VAL HG11 H -11.219 -0.631 0.013 1.00 . A A . 6 VAL HG11 1 1 3 912 1 1 6 VAL HG12 H -11.811 -0.669 -1.641 1.00 . A A . 6 VAL HG12 1 1 3 913 1 1 6 VAL HG13 H -11.650 -2.161 -0.735 1.00 . A A . 6 VAL HG13 1 1 3 914 1 1 6 VAL HG21 H -8.200 -0.054 -2.194 1.00 . A A . 6 VAL HG21 1 1 3 915 1 1 6 VAL HG22 H -9.819 0.427 -2.668 1.00 . A A . 6 VAL HG22 1 1 3 916 1 1 6 VAL HG23 H -9.257 0.721 -1.028 1.00 . A A . 6 VAL HG23 1 1 3 917 1 1 6 VAL N N -7.471 -2.068 -0.862 1.00 . A A . 6 VAL N 1 1 3 918 1 1 6 VAL O O -9.540 -3.470 1.382 1.00 . A A . 6 VAL O 1 1 3 919 1 1 7 TRP C C -8.980 -6.334 0.384 1.00 . A A . 7 TRP C 1 1 3 920 1 1 7 TRP CA C -10.025 -5.544 -0.415 1.00 . A A . 7 TRP CA 1 1 3 921 1 1 7 TRP CB C -10.342 -6.245 -1.741 1.00 . A A . 7 TRP CB 1 1 3 922 1 1 7 TRP CD1 C -11.003 -8.716 -1.403 1.00 . A A . 7 TRP CD1 1 1 3 923 1 1 7 TRP CD2 C -12.675 -7.264 -1.323 1.00 . A A . 7 TRP CD2 1 1 3 924 1 1 7 TRP CE2 C -13.210 -8.536 -1.121 1.00 . A A . 7 TRP CE2 1 1 3 925 1 1 7 TRP CE3 C -13.515 -6.150 -1.322 1.00 . A A . 7 TRP CE3 1 1 3 926 1 1 7 TRP CG C -11.329 -7.392 -1.493 1.00 . A A . 7 TRP CG 1 1 3 927 1 1 7 TRP CH2 C -15.416 -7.582 -0.918 1.00 . A A . 7 TRP CH2 1 1 3 928 1 1 7 TRP CZ2 C -14.579 -8.694 -0.920 1.00 . A A . 7 TRP CZ2 1 1 3 929 1 1 7 TRP CZ3 C -14.884 -6.309 -1.119 1.00 . A A . 7 TRP CZ3 1 1 3 930 1 1 7 TRP H H -9.365 -3.944 -1.668 1.00 . A A . 7 TRP H 1 1 3 931 1 1 7 TRP HA H -10.920 -5.444 0.175 1.00 . A A . 7 TRP HA 1 1 3 932 1 1 7 TRP HB2 H -10.783 -5.542 -2.429 1.00 . A A . 7 TRP HB2 1 1 3 933 1 1 7 TRP HB3 H -9.445 -6.639 -2.189 1.00 . A A . 7 TRP HB3 1 1 3 934 1 1 7 TRP HD1 H -10.027 -9.166 -1.490 1.00 . A A . 7 TRP HD1 1 1 3 935 1 1 7 TRP HE1 H -12.215 -10.285 -1.080 1.00 . A A . 7 TRP HE1 1 1 3 936 1 1 7 TRP HE3 H -13.104 -5.164 -1.477 1.00 . A A . 7 TRP HE3 1 1 3 937 1 1 7 TRP HH2 H -16.477 -7.705 -0.762 1.00 . A A . 7 TRP HH2 1 1 3 938 1 1 7 TRP HZ2 H -14.989 -9.680 -0.763 1.00 . A A . 7 TRP HZ2 1 1 3 939 1 1 7 TRP HZ3 H -15.534 -5.447 -1.119 1.00 . A A . 7 TRP HZ3 1 1 3 940 1 1 7 TRP N N -9.540 -4.173 -0.735 1.00 . A A . 7 TRP N 1 1 3 941 1 1 7 TRP NE1 N -12.150 -9.314 -1.186 1.00 . A A . 7 TRP NE1 1 1 3 942 1 1 7 TRP O O -9.308 -6.979 1.362 1.00 . A A . 7 TRP O 1 1 3 943 1 1 8 ILE C C -5.601 -5.909 1.096 1.00 . A A . 8 ILE C 1 1 3 944 1 1 8 ILE CA C -6.611 -6.948 0.573 1.00 . A A . 8 ILE CA 1 1 3 945 1 1 8 ILE CB C -5.924 -7.875 -0.465 1.00 . A A . 8 ILE CB 1 1 3 946 1 1 8 ILE CD1 C -6.748 -6.977 -2.776 1.00 . A A . 8 ILE CD1 1 1 3 947 1 1 8 ILE CG1 C -5.560 -7.118 -1.793 1.00 . A A . 8 ILE CG1 1 1 3 948 1 1 8 ILE CG2 C -6.779 -9.146 -0.705 1.00 . A A . 8 ILE CG2 1 1 3 949 1 1 8 ILE H H -7.569 -5.717 -0.863 1.00 . A A . 8 ILE H 1 1 3 950 1 1 8 ILE HA H -6.987 -7.520 1.401 1.00 . A A . 8 ILE HA 1 1 3 951 1 1 8 ILE HB H -4.990 -8.195 -0.043 1.00 . A A . 8 ILE HB 1 1 3 952 1 1 8 ILE HD11 H -7.593 -7.580 -2.484 1.00 . A A . 8 ILE HD11 1 1 3 953 1 1 8 ILE HD12 H -7.062 -5.944 -2.825 1.00 . A A . 8 ILE HD12 1 1 3 954 1 1 8 ILE HD13 H -6.435 -7.286 -3.762 1.00 . A A . 8 ILE HD13 1 1 3 955 1 1 8 ILE HG12 H -5.190 -6.131 -1.554 1.00 . A A . 8 ILE HG12 1 1 3 956 1 1 8 ILE HG13 H -4.762 -7.652 -2.287 1.00 . A A . 8 ILE HG13 1 1 3 957 1 1 8 ILE HG21 H -7.831 -8.898 -0.751 1.00 . A A . 8 ILE HG21 1 1 3 958 1 1 8 ILE HG22 H -6.491 -9.624 -1.629 1.00 . A A . 8 ILE HG22 1 1 3 959 1 1 8 ILE HG23 H -6.630 -9.845 0.104 1.00 . A A . 8 ILE HG23 1 1 3 960 1 1 8 ILE N N -7.755 -6.251 -0.072 1.00 . A A . 8 ILE N 1 1 3 961 1 1 8 ILE O O -5.680 -4.757 0.720 1.00 . A A . 8 ILE O 1 1 3 962 1 1 9 PRO C C -2.473 -5.553 1.095 1.00 . A A . 9 PRO C 1 1 3 963 1 1 9 PRO CA C -3.473 -5.502 2.269 1.00 . A A . 9 PRO CA 1 1 3 964 1 1 9 PRO CB C -2.914 -6.115 3.551 1.00 . A A . 9 PRO CB 1 1 3 965 1 1 9 PRO CD C -4.706 -7.613 2.687 1.00 . A A . 9 PRO CD 1 1 3 966 1 1 9 PRO CG C -3.510 -7.532 3.654 1.00 . A A . 9 PRO CG 1 1 3 967 1 1 9 PRO HA H -3.768 -4.476 2.439 1.00 . A A . 9 PRO HA 1 1 3 968 1 1 9 PRO HB2 H -1.835 -6.167 3.527 1.00 . A A . 9 PRO HB2 1 1 3 969 1 1 9 PRO HB3 H -3.217 -5.525 4.404 1.00 . A A . 9 PRO HB3 1 1 3 970 1 1 9 PRO HD2 H -4.591 -8.438 2.002 1.00 . A A . 9 PRO HD2 1 1 3 971 1 1 9 PRO HD3 H -5.637 -7.704 3.228 1.00 . A A . 9 PRO HD3 1 1 3 972 1 1 9 PRO HG2 H -2.766 -8.265 3.379 1.00 . A A . 9 PRO HG2 1 1 3 973 1 1 9 PRO HG3 H -3.836 -7.726 4.665 1.00 . A A . 9 PRO HG3 1 1 3 974 1 1 9 PRO N N -4.680 -6.317 1.941 1.00 . A A . 9 PRO N 1 1 3 975 1 1 9 PRO O O -2.780 -6.072 0.039 1.00 . A A . 9 PRO O 1 1 3 976 1 1 10 CYS C C 0.400 -6.398 0.162 1.00 . A A . 10 CYS C 1 1 3 977 1 1 10 CYS CA C -0.240 -4.994 0.267 1.00 . A A . 10 CYS CA 1 1 3 978 1 1 10 CYS CB C 0.821 -3.969 0.649 1.00 . A A . 10 CYS CB 1 1 3 979 1 1 10 CYS H H -1.123 -4.602 2.196 1.00 . A A . 10 CYS H 1 1 3 980 1 1 10 CYS HA H -0.659 -4.719 -0.680 1.00 . A A . 10 CYS HA 1 1 3 981 1 1 10 CYS HB2 H 1.336 -4.377 1.498 1.00 . A A . 10 CYS HB2 1 1 3 982 1 1 10 CYS HB3 H 1.534 -3.908 -0.160 1.00 . A A . 10 CYS HB3 1 1 3 983 1 1 10 CYS N N -1.304 -5.008 1.321 1.00 . A A . 10 CYS N 1 1 3 984 1 1 10 CYS O O -0.118 -7.357 0.700 1.00 . A A . 10 CYS O 1 1 3 985 1 1 10 CYS SG S 0.358 -2.268 1.068 1.00 . A A . 10 CYS SG 1 1 3 986 1 1 11 ILE C C 3.743 -7.504 -0.535 1.00 . A A . 11 ILE C 1 1 3 987 1 1 11 ILE CA C 2.243 -7.759 -0.723 1.00 . A A . 11 ILE CA 1 1 3 988 1 1 11 ILE CB C 1.993 -8.324 -2.157 1.00 . A A . 11 ILE CB 1 1 3 989 1 1 11 ILE CD1 C 1.978 -7.619 -4.593 1.00 . A A . 11 ILE CD1 1 1 3 990 1 1 11 ILE CG1 C 1.548 -7.219 -3.168 1.00 . A A . 11 ILE CG1 1 1 3 991 1 1 11 ILE CG2 C 0.927 -9.444 -2.091 1.00 . A A . 11 ILE CG2 1 1 3 992 1 1 11 ILE H H 1.874 -5.662 -0.949 1.00 . A A . 11 ILE H 1 1 3 993 1 1 11 ILE HA H 1.928 -8.469 0.028 1.00 . A A . 11 ILE HA 1 1 3 994 1 1 11 ILE HB H 2.920 -8.750 -2.503 1.00 . A A . 11 ILE HB 1 1 3 995 1 1 11 ILE HD11 H 1.639 -8.617 -4.827 1.00 . A A . 11 ILE HD11 1 1 3 996 1 1 11 ILE HD12 H 1.560 -6.932 -5.313 1.00 . A A . 11 ILE HD12 1 1 3 997 1 1 11 ILE HD13 H 3.057 -7.589 -4.672 1.00 . A A . 11 ILE HD13 1 1 3 998 1 1 11 ILE HG12 H 0.476 -7.090 -3.136 1.00 . A A . 11 ILE HG12 1 1 3 999 1 1 11 ILE HG13 H 2.008 -6.273 -2.927 1.00 . A A . 11 ILE HG13 1 1 3 1000 1 1 11 ILE HG21 H 1.253 -10.225 -1.418 1.00 . A A . 11 ILE HG21 1 1 3 1001 1 1 11 ILE HG22 H -0.015 -9.051 -1.736 1.00 . A A . 11 ILE HG22 1 1 3 1002 1 1 11 ILE HG23 H 0.778 -9.876 -3.070 1.00 . A A . 11 ILE HG23 1 1 3 1003 1 1 11 ILE N N 1.509 -6.470 -0.534 1.00 . A A . 11 ILE N 1 1 3 1004 1 1 11 ILE O O 4.379 -8.113 0.304 1.00 . A A . 11 ILE O 1 1 3 1005 1 1 12 SER C C 6.106 -5.686 0.085 1.00 . A A . 12 SER C 1 1 3 1006 1 1 12 SER CA C 5.693 -6.226 -1.295 1.00 . A A . 12 SER CA 1 1 3 1007 1 1 12 SER CB C 5.934 -5.174 -2.400 1.00 . A A . 12 SER CB 1 1 3 1008 1 1 12 SER H H 3.673 -6.159 -1.987 1.00 . A A . 12 SER H 1 1 3 1009 1 1 12 SER HA H 6.279 -7.104 -1.511 1.00 . A A . 12 SER HA 1 1 3 1010 1 1 12 SER HB2 H 5.282 -4.321 -2.295 1.00 . A A . 12 SER HB2 1 1 3 1011 1 1 12 SER HB3 H 6.962 -4.854 -2.426 1.00 . A A . 12 SER HB3 1 1 3 1012 1 1 12 SER HG H 6.072 -6.703 -3.598 1.00 . A A . 12 SER HG 1 1 3 1013 1 1 12 SER N N 4.251 -6.602 -1.336 1.00 . A A . 12 SER N 1 1 3 1014 1 1 12 SER O O 6.620 -6.433 0.895 1.00 . A A . 12 SER O 1 1 3 1015 1 1 12 SER OG O 5.620 -5.856 -3.605 1.00 . A A . 12 SER OG 1 1 3 1016 1 1 13 ALA C C 7.743 -3.624 1.829 1.00 . A A . 13 ALA C 1 1 3 1017 1 1 13 ALA CA C 6.221 -3.734 1.603 1.00 . A A . 13 ALA CA 1 1 3 1018 1 1 13 ALA CB C 5.582 -4.512 2.783 1.00 . A A . 13 ALA CB 1 1 3 1019 1 1 13 ALA H H 5.452 -3.882 -0.399 1.00 . A A . 13 ALA H 1 1 3 1020 1 1 13 ALA HA H 5.812 -2.734 1.572 1.00 . A A . 13 ALA HA 1 1 3 1021 1 1 13 ALA HB1 H 4.607 -4.879 2.500 1.00 . A A . 13 ALA HB1 1 1 3 1022 1 1 13 ALA HB2 H 6.199 -5.348 3.074 1.00 . A A . 13 ALA HB2 1 1 3 1023 1 1 13 ALA HB3 H 5.471 -3.854 3.633 1.00 . A A . 13 ALA HB3 1 1 3 1024 1 1 13 ALA N N 5.873 -4.413 0.308 1.00 . A A . 13 ALA N 1 1 3 1025 1 1 13 ALA O O 8.177 -2.870 2.679 1.00 . A A . 13 ALA O 1 1 3 1026 1 1 14 ALA C C 10.509 -2.988 0.723 1.00 . A A . 14 ALA C 1 1 3 1027 1 1 14 ALA CA C 10.000 -4.353 1.193 1.00 . A A . 14 ALA CA 1 1 3 1028 1 1 14 ALA CB C 10.584 -5.470 0.320 1.00 . A A . 14 ALA CB 1 1 3 1029 1 1 14 ALA H H 8.104 -4.962 0.401 1.00 . A A . 14 ALA H 1 1 3 1030 1 1 14 ALA HA H 10.272 -4.501 2.228 1.00 . A A . 14 ALA HA 1 1 3 1031 1 1 14 ALA HB1 H 10.290 -5.333 -0.711 1.00 . A A . 14 ALA HB1 1 1 3 1032 1 1 14 ALA HB2 H 11.663 -5.461 0.379 1.00 . A A . 14 ALA HB2 1 1 3 1033 1 1 14 ALA HB3 H 10.224 -6.430 0.659 1.00 . A A . 14 ALA HB3 1 1 3 1034 1 1 14 ALA N N 8.508 -4.374 1.069 1.00 . A A . 14 ALA N 1 1 3 1035 1 1 14 ALA O O 11.472 -2.462 1.249 1.00 . A A . 14 ALA O 1 1 3 1036 1 1 15 LEU C C 9.916 -0.008 0.175 1.00 . A A . 15 LEU C 1 1 3 1037 1 1 15 LEU CA C 10.175 -1.134 -0.848 1.00 . A A . 15 LEU CA 1 1 3 1038 1 1 15 LEU CB C 9.317 -0.913 -2.116 1.00 . A A . 15 LEU CB 1 1 3 1039 1 1 15 LEU CD1 C 9.089 -1.796 -4.476 1.00 . A A . 15 LEU CD1 1 1 3 1040 1 1 15 LEU CD2 C 10.955 -0.199 -3.908 1.00 . A A . 15 LEU CD2 1 1 3 1041 1 1 15 LEU CG C 10.093 -1.370 -3.381 1.00 . A A . 15 LEU CG 1 1 3 1042 1 1 15 LEU H H 9.065 -2.956 -0.636 1.00 . A A . 15 LEU H 1 1 3 1043 1 1 15 LEU HA H 11.224 -1.146 -1.094 1.00 . A A . 15 LEU HA 1 1 3 1044 1 1 15 LEU HB2 H 8.408 -1.490 -2.024 1.00 . A A . 15 LEU HB2 1 1 3 1045 1 1 15 LEU HB3 H 9.043 0.129 -2.209 1.00 . A A . 15 LEU HB3 1 1 3 1046 1 1 15 LEU HD11 H 8.437 -0.976 -4.737 1.00 . A A . 15 LEU HD11 1 1 3 1047 1 1 15 LEU HD12 H 9.619 -2.115 -5.361 1.00 . A A . 15 LEU HD12 1 1 3 1048 1 1 15 LEU HD13 H 8.485 -2.620 -4.124 1.00 . A A . 15 LEU HD13 1 1 3 1049 1 1 15 LEU HD21 H 11.599 0.172 -3.125 1.00 . A A . 15 LEU HD21 1 1 3 1050 1 1 15 LEU HD22 H 11.569 -0.534 -4.730 1.00 . A A . 15 LEU HD22 1 1 3 1051 1 1 15 LEU HD23 H 10.327 0.610 -4.251 1.00 . A A . 15 LEU HD23 1 1 3 1052 1 1 15 LEU HG H 10.732 -2.209 -3.146 1.00 . A A . 15 LEU HG 1 1 3 1053 1 1 15 LEU N N 9.825 -2.464 -0.265 1.00 . A A . 15 LEU N 1 1 3 1054 1 1 15 LEU O O 10.231 1.139 -0.077 1.00 . A A . 15 LEU O 1 1 3 1055 1 1 16 GLY C C 7.696 1.280 2.097 1.00 . A A . 16 GLY C 1 1 3 1056 1 1 16 GLY CA C 9.030 0.583 2.382 1.00 . A A . 16 GLY CA 1 1 3 1057 1 1 16 GLY H H 9.122 -1.319 1.437 1.00 . A A . 16 GLY H 1 1 3 1058 1 1 16 GLY HA2 H 8.960 0.049 3.317 1.00 . A A . 16 GLY HA2 1 1 3 1059 1 1 16 GLY HA3 H 9.823 1.307 2.442 1.00 . A A . 16 GLY HA3 1 1 3 1060 1 1 16 GLY N N 9.348 -0.382 1.296 1.00 . A A . 16 GLY N 1 1 3 1061 1 1 16 GLY O O 7.446 2.368 2.581 1.00 . A A . 16 GLY O 1 1 3 1062 1 1 17 CYS C C 4.565 1.148 2.132 1.00 . A A . 17 CYS C 1 1 3 1063 1 1 17 CYS CA C 5.544 1.186 0.952 1.00 . A A . 17 CYS CA 1 1 3 1064 1 1 17 CYS CB C 4.955 0.386 -0.224 1.00 . A A . 17 CYS CB 1 1 3 1065 1 1 17 CYS H H 7.144 -0.254 0.960 1.00 . A A . 17 CYS H 1 1 3 1066 1 1 17 CYS HA H 5.681 2.211 0.654 1.00 . A A . 17 CYS HA 1 1 3 1067 1 1 17 CYS HB2 H 4.174 -0.269 0.131 1.00 . A A . 17 CYS HB2 1 1 3 1068 1 1 17 CYS HB3 H 4.481 1.098 -0.884 1.00 . A A . 17 CYS HB3 1 1 3 1069 1 1 17 CYS N N 6.877 0.621 1.313 1.00 . A A . 17 CYS N 1 1 3 1070 1 1 17 CYS O O 4.747 0.410 3.081 1.00 . A A . 17 CYS O 1 1 3 1071 1 1 17 CYS SG S 6.077 -0.598 -1.249 1.00 . A A . 17 CYS SG 1 1 3 1072 1 1 18 SER C C 1.168 2.348 2.328 1.00 . A A . 18 SER C 1 1 3 1073 1 1 18 SER CA C 2.488 2.080 3.052 1.00 . A A . 18 SER CA 1 1 3 1074 1 1 18 SER CB C 2.819 3.247 3.998 1.00 . A A . 18 SER CB 1 1 3 1075 1 1 18 SER H H 3.492 2.524 1.209 1.00 . A A . 18 SER H 1 1 3 1076 1 1 18 SER HA H 2.411 1.149 3.594 1.00 . A A . 18 SER HA 1 1 3 1077 1 1 18 SER HB2 H 2.995 4.164 3.455 1.00 . A A . 18 SER HB2 1 1 3 1078 1 1 18 SER HB3 H 2.046 3.393 4.741 1.00 . A A . 18 SER HB3 1 1 3 1079 1 1 18 SER HG H 4.707 2.774 3.975 1.00 . A A . 18 SER HG 1 1 3 1080 1 1 18 SER N N 3.553 1.968 2.010 1.00 . A A . 18 SER N 1 1 3 1081 1 1 18 SER O O 1.105 3.197 1.458 1.00 . A A . 18 SER O 1 1 3 1082 1 1 18 SER OG O 4.017 2.841 4.641 1.00 . A A . 18 SER OG 1 1 3 1083 1 1 19 CYS C C -1.808 3.129 2.489 1.00 . A A . 19 CYS C 1 1 3 1084 1 1 19 CYS CA C -1.183 1.796 2.064 1.00 . A A . 19 CYS CA 1 1 3 1085 1 1 19 CYS CB C -2.094 0.634 2.467 1.00 . A A . 19 CYS CB 1 1 3 1086 1 1 19 CYS H H 0.264 0.945 3.414 1.00 . A A . 19 CYS H 1 1 3 1087 1 1 19 CYS HA H -1.061 1.791 0.993 1.00 . A A . 19 CYS HA 1 1 3 1088 1 1 19 CYS HB2 H -1.611 -0.285 2.166 1.00 . A A . 19 CYS HB2 1 1 3 1089 1 1 19 CYS HB3 H -2.201 0.621 3.540 1.00 . A A . 19 CYS HB3 1 1 3 1090 1 1 19 CYS N N 0.151 1.614 2.707 1.00 . A A . 19 CYS N 1 1 3 1091 1 1 19 CYS O O -2.181 3.316 3.630 1.00 . A A . 19 CYS O 1 1 3 1092 1 1 19 CYS SG S -3.742 0.659 1.721 1.00 . A A . 19 CYS SG 1 1 3 1093 1 1 20 LYS C C -3.345 5.724 0.539 1.00 . A A . 20 LYS C 1 1 3 1094 1 1 20 LYS CA C -2.468 5.370 1.747 1.00 . A A . 20 LYS CA 1 1 3 1095 1 1 20 LYS CB C -1.317 6.390 1.895 1.00 . A A . 20 LYS CB 1 1 3 1096 1 1 20 LYS CD C 0.446 7.240 3.500 1.00 . A A . 20 LYS CD 1 1 3 1097 1 1 20 LYS CE C 1.184 6.936 4.819 1.00 . A A . 20 LYS CE 1 1 3 1098 1 1 20 LYS CG C -0.502 6.068 3.172 1.00 . A A . 20 LYS CG 1 1 3 1099 1 1 20 LYS H H -1.561 3.776 0.635 1.00 . A A . 20 LYS H 1 1 3 1100 1 1 20 LYS HA H -3.085 5.362 2.635 1.00 . A A . 20 LYS HA 1 1 3 1101 1 1 20 LYS HB2 H -0.669 6.341 1.032 1.00 . A A . 20 LYS HB2 1 1 3 1102 1 1 20 LYS HB3 H -1.725 7.389 1.962 1.00 . A A . 20 LYS HB3 1 1 3 1103 1 1 20 LYS HD2 H 1.166 7.365 2.704 1.00 . A A . 20 LYS HD2 1 1 3 1104 1 1 20 LYS HD3 H -0.121 8.155 3.601 1.00 . A A . 20 LYS HD3 1 1 3 1105 1 1 20 LYS HE2 H 0.514 6.493 5.540 1.00 . A A . 20 LYS HE2 1 1 3 1106 1 1 20 LYS HE3 H 2.004 6.257 4.639 1.00 . A A . 20 LYS HE3 1 1 3 1107 1 1 20 LYS HG2 H -1.174 5.903 4.002 1.00 . A A . 20 LYS HG2 1 1 3 1108 1 1 20 LYS HG3 H 0.077 5.169 3.015 1.00 . A A . 20 LYS HG3 1 1 3 1109 1 1 20 LYS HZ1 H 2.323 8.675 4.693 1.00 . A A . 20 LYS HZ1 1 1 3 1110 1 1 20 LYS HZ2 H 0.946 8.816 5.679 1.00 . A A . 20 LYS HZ2 1 1 3 1111 1 1 20 LYS HZ3 H 2.306 7.965 6.236 1.00 . A A . 20 LYS HZ3 1 1 3 1112 1 1 20 LYS N N -1.889 4.012 1.526 1.00 . A A . 20 LYS N 1 1 3 1113 1 1 20 LYS NZ N 1.731 8.194 5.400 1.00 . A A . 20 LYS NZ 1 1 3 1114 1 1 20 LYS O O -2.923 5.594 -0.595 1.00 . A A . 20 LYS O 1 1 3 1115 1 1 21 ASN C C -5.752 5.422 -1.235 1.00 . A A . 21 ASN C 1 1 3 1116 1 1 21 ASN CA C -5.538 6.555 -0.211 1.00 . A A . 21 ASN CA 1 1 3 1117 1 1 21 ASN CB C -5.026 7.850 -0.908 1.00 . A A . 21 ASN CB 1 1 3 1118 1 1 21 ASN CG C -6.193 8.535 -1.634 1.00 . A A . 21 ASN CG 1 1 3 1119 1 1 21 ASN H H -4.799 6.234 1.781 1.00 . A A . 21 ASN H 1 1 3 1120 1 1 21 ASN HA H -6.481 6.753 0.278 1.00 . A A . 21 ASN HA 1 1 3 1121 1 1 21 ASN HB2 H -4.635 8.536 -0.171 1.00 . A A . 21 ASN HB2 1 1 3 1122 1 1 21 ASN HB3 H -4.248 7.629 -1.625 1.00 . A A . 21 ASN HB3 1 1 3 1123 1 1 21 ASN HD21 H -5.926 7.505 -3.311 1.00 . A A . 21 ASN HD21 1 1 3 1124 1 1 21 ASN HD22 H -7.206 8.619 -3.340 1.00 . A A . 21 ASN HD22 1 1 3 1125 1 1 21 ASN N N -4.544 6.162 0.837 1.00 . A A . 21 ASN N 1 1 3 1126 1 1 21 ASN ND2 N -6.464 8.192 -2.864 1.00 . A A . 21 ASN ND2 1 1 3 1127 1 1 21 ASN O O -5.411 5.548 -2.396 1.00 . A A . 21 ASN O 1 1 3 1128 1 1 21 ASN OD1 O -6.866 9.388 -1.089 1.00 . A A . 21 ASN OD1 1 1 3 1129 1 1 22 LYS C C -5.582 2.774 -2.624 1.00 . A A . 22 LYS C 1 1 3 1130 1 1 22 LYS CA C -6.628 3.117 -1.541 1.00 . A A . 22 LYS CA 1 1 3 1131 1 1 22 LYS CB C -8.041 3.308 -2.188 1.00 . A A . 22 LYS CB 1 1 3 1132 1 1 22 LYS CD C -9.349 4.507 -4.003 1.00 . A A . 22 LYS CD 1 1 3 1133 1 1 22 LYS CE C -9.053 3.666 -5.259 1.00 . A A . 22 LYS CE 1 1 3 1134 1 1 22 LYS CG C -8.098 4.563 -3.102 1.00 . A A . 22 LYS CG 1 1 3 1135 1 1 22 LYS H H -6.547 4.351 0.217 1.00 . A A . 22 LYS H 1 1 3 1136 1 1 22 LYS HA H -6.680 2.281 -0.858 1.00 . A A . 22 LYS HA 1 1 3 1137 1 1 22 LYS HB2 H -8.289 2.429 -2.763 1.00 . A A . 22 LYS HB2 1 1 3 1138 1 1 22 LYS HB3 H -8.774 3.410 -1.401 1.00 . A A . 22 LYS HB3 1 1 3 1139 1 1 22 LYS HD2 H -10.182 4.081 -3.463 1.00 . A A . 22 LYS HD2 1 1 3 1140 1 1 22 LYS HD3 H -9.614 5.512 -4.302 1.00 . A A . 22 LYS HD3 1 1 3 1141 1 1 22 LYS HE2 H -8.221 4.084 -5.807 1.00 . A A . 22 LYS HE2 1 1 3 1142 1 1 22 LYS HE3 H -8.821 2.646 -4.991 1.00 . A A . 22 LYS HE3 1 1 3 1143 1 1 22 LYS HG2 H -8.152 5.451 -2.489 1.00 . A A . 22 LYS HG2 1 1 3 1144 1 1 22 LYS HG3 H -7.212 4.624 -3.718 1.00 . A A . 22 LYS HG3 1 1 3 1145 1 1 22 LYS HZ1 H -10.481 4.638 -6.416 1.00 . A A . 22 LYS HZ1 1 1 3 1146 1 1 22 LYS HZ2 H -10.043 3.107 -7.004 1.00 . A A . 22 LYS HZ2 1 1 3 1147 1 1 22 LYS HZ3 H -11.052 3.238 -5.643 1.00 . A A . 22 LYS HZ3 1 1 3 1148 1 1 22 LYS N N -6.318 4.349 -0.735 1.00 . A A . 22 LYS N 1 1 3 1149 1 1 22 LYS NZ N -10.247 3.661 -6.149 1.00 . A A . 22 LYS NZ 1 1 3 1150 1 1 22 LYS O O -5.919 2.357 -3.715 1.00 . A A . 22 LYS O 1 1 3 1151 1 1 23 VAL C C -1.995 2.331 -2.251 1.00 . A A . 23 VAL C 1 1 3 1152 1 1 23 VAL CA C -3.183 2.707 -3.163 1.00 . A A . 23 VAL CA 1 1 3 1153 1 1 23 VAL CB C -2.947 4.011 -3.979 1.00 . A A . 23 VAL CB 1 1 3 1154 1 1 23 VAL CG1 C -1.505 4.113 -4.446 1.00 . A A . 23 VAL CG1 1 1 3 1155 1 1 23 VAL CG2 C -3.876 4.042 -5.218 1.00 . A A . 23 VAL CG2 1 1 3 1156 1 1 23 VAL H H -4.126 3.318 -1.385 1.00 . A A . 23 VAL H 1 1 3 1157 1 1 23 VAL HA H -3.418 1.866 -3.787 1.00 . A A . 23 VAL HA 1 1 3 1158 1 1 23 VAL HB H -3.161 4.866 -3.355 1.00 . A A . 23 VAL HB 1 1 3 1159 1 1 23 VAL HG11 H -1.222 3.197 -4.937 1.00 . A A . 23 VAL HG11 1 1 3 1160 1 1 23 VAL HG12 H -1.409 4.937 -5.136 1.00 . A A . 23 VAL HG12 1 1 3 1161 1 1 23 VAL HG13 H -0.847 4.287 -3.606 1.00 . A A . 23 VAL HG13 1 1 3 1162 1 1 23 VAL HG21 H -3.896 3.078 -5.708 1.00 . A A . 23 VAL HG21 1 1 3 1163 1 1 23 VAL HG22 H -4.880 4.304 -4.921 1.00 . A A . 23 VAL HG22 1 1 3 1164 1 1 23 VAL HG23 H -3.530 4.780 -5.926 1.00 . A A . 23 VAL HG23 1 1 3 1165 1 1 23 VAL N N -4.336 2.975 -2.269 1.00 . A A . 23 VAL N 1 1 3 1166 1 1 23 VAL O O -1.792 2.991 -1.250 1.00 . A A . 23 VAL O 1 1 3 1167 1 1 24 CYS C C 1.230 1.368 -2.382 1.00 . A A . 24 CYS C 1 1 3 1168 1 1 24 CYS CA C -0.080 0.910 -1.737 1.00 . A A . 24 CYS CA 1 1 3 1169 1 1 24 CYS CB C -0.033 -0.629 -1.544 1.00 . A A . 24 CYS CB 1 1 3 1170 1 1 24 CYS H H -1.444 0.808 -3.425 1.00 . A A . 24 CYS H 1 1 3 1171 1 1 24 CYS HA H -0.157 1.377 -0.769 1.00 . A A . 24 CYS HA 1 1 3 1172 1 1 24 CYS HB2 H -0.989 -0.964 -1.174 1.00 . A A . 24 CYS HB2 1 1 3 1173 1 1 24 CYS HB3 H 0.151 -1.115 -2.491 1.00 . A A . 24 CYS HB3 1 1 3 1174 1 1 24 CYS N N -1.246 1.307 -2.601 1.00 . A A . 24 CYS N 1 1 3 1175 1 1 24 CYS O O 1.918 0.594 -3.021 1.00 . A A . 24 CYS O 1 1 3 1176 1 1 24 CYS SG S 1.243 -1.157 -0.371 1.00 . A A . 24 CYS SG 1 1 3 1177 1 1 25 TYR C C 3.684 3.699 -1.583 1.00 . A A . 25 TYR C 1 1 3 1178 1 1 25 TYR CA C 2.756 3.280 -2.727 1.00 . A A . 25 TYR CA 1 1 3 1179 1 1 25 TYR CB C 2.364 4.524 -3.526 1.00 . A A . 25 TYR CB 1 1 3 1180 1 1 25 TYR CD1 C 1.372 2.921 -5.299 1.00 . A A . 25 TYR CD1 1 1 3 1181 1 1 25 TYR CD2 C 1.209 5.266 -5.626 1.00 . A A . 25 TYR CD2 1 1 3 1182 1 1 25 TYR CE1 C 0.706 2.705 -6.484 1.00 . A A . 25 TYR CE1 1 1 3 1183 1 1 25 TYR CE2 C 0.542 5.051 -6.812 1.00 . A A . 25 TYR CE2 1 1 3 1184 1 1 25 TYR CG C 1.634 4.207 -4.850 1.00 . A A . 25 TYR CG 1 1 3 1185 1 1 25 TYR CZ C 0.284 3.769 -7.251 1.00 . A A . 25 TYR CZ 1 1 3 1186 1 1 25 TYR H H 0.910 3.178 -1.646 1.00 . A A . 25 TYR H 1 1 3 1187 1 1 25 TYR HA H 3.284 2.601 -3.376 1.00 . A A . 25 TYR HA 1 1 3 1188 1 1 25 TYR HB2 H 1.727 5.150 -2.919 1.00 . A A . 25 TYR HB2 1 1 3 1189 1 1 25 TYR HB3 H 3.245 5.095 -3.750 1.00 . A A . 25 TYR HB3 1 1 3 1190 1 1 25 TYR HD1 H 1.689 2.064 -4.735 1.00 . A A . 25 TYR HD1 1 1 3 1191 1 1 25 TYR HD2 H 1.400 6.278 -5.301 1.00 . A A . 25 TYR HD2 1 1 3 1192 1 1 25 TYR HE1 H 0.512 1.692 -6.801 1.00 . A A . 25 TYR HE1 1 1 3 1193 1 1 25 TYR HE2 H 0.218 5.902 -7.391 1.00 . A A . 25 TYR HE2 1 1 3 1194 1 1 25 TYR HH H -1.180 3.054 -8.242 1.00 . A A . 25 TYR HH 1 1 3 1195 1 1 25 TYR N N 1.521 2.631 -2.179 1.00 . A A . 25 TYR N 1 1 3 1196 1 1 25 TYR O O 3.304 3.669 -0.428 1.00 . A A . 25 TYR O 1 1 3 1197 1 1 25 TYR OH O -0.383 3.552 -8.439 1.00 . A A . 25 TYR OH 1 1 3 1198 1 1 26 ARG C C 5.824 6.059 -0.848 1.00 . A A . 26 ARG C 1 1 3 1199 1 1 26 ARG CA C 5.898 4.527 -0.949 1.00 . A A . 26 ARG CA 1 1 3 1200 1 1 26 ARG CB C 7.292 4.054 -1.430 1.00 . A A . 26 ARG CB 1 1 3 1201 1 1 26 ARG CD C 9.649 4.283 -0.575 1.00 . A A . 26 ARG CD 1 1 3 1202 1 1 26 ARG CG C 8.229 3.816 -0.222 1.00 . A A . 26 ARG CG 1 1 3 1203 1 1 26 ARG CZ C 10.524 6.446 -1.348 1.00 . A A . 26 ARG CZ 1 1 3 1204 1 1 26 ARG H H 5.110 4.081 -2.906 1.00 . A A . 26 ARG H 1 1 3 1205 1 1 26 ARG HA H 5.661 4.118 0.020 1.00 . A A . 26 ARG HA 1 1 3 1206 1 1 26 ARG HB2 H 7.186 3.129 -1.979 1.00 . A A . 26 ARG HB2 1 1 3 1207 1 1 26 ARG HB3 H 7.715 4.794 -2.092 1.00 . A A . 26 ARG HB3 1 1 3 1208 1 1 26 ARG HD2 H 10.349 3.979 0.189 1.00 . A A . 26 ARG HD2 1 1 3 1209 1 1 26 ARG HD3 H 9.952 3.868 -1.526 1.00 . A A . 26 ARG HD3 1 1 3 1210 1 1 26 ARG HE H 8.935 6.273 -0.180 1.00 . A A . 26 ARG HE 1 1 3 1211 1 1 26 ARG HG2 H 7.880 4.353 0.649 1.00 . A A . 26 ARG HG2 1 1 3 1212 1 1 26 ARG HG3 H 8.250 2.763 0.007 1.00 . A A . 26 ARG HG3 1 1 3 1213 1 1 26 ARG HH11 H 11.534 4.829 -1.968 1.00 . A A . 26 ARG HH11 1 1 3 1214 1 1 26 ARG HH12 H 12.142 6.353 -2.520 1.00 . A A . 26 ARG HH12 1 1 3 1215 1 1 26 ARG HH21 H 9.690 8.198 -0.862 1.00 . A A . 26 ARG HH21 1 1 3 1216 1 1 26 ARG HH22 H 11.086 8.291 -1.883 1.00 . A A . 26 ARG HH22 1 1 3 1217 1 1 26 ARG N N 4.881 4.084 -1.953 1.00 . A A . 26 ARG N 1 1 3 1218 1 1 26 ARG NE N 9.634 5.778 -0.656 1.00 . A A . 26 ARG NE 1 1 3 1219 1 1 26 ARG NH1 N 11.474 5.826 -1.996 1.00 . A A . 26 ARG NH1 1 1 3 1220 1 1 26 ARG NH2 N 10.426 7.747 -1.365 1.00 . A A . 26 ARG NH2 1 1 3 1221 1 1 26 ARG O O 6.827 6.747 -0.785 1.00 . A A . 26 ARG O 1 1 3 1222 1 1 27 ASN C C 4.994 8.786 -1.867 1.00 . A A . 27 ASN C 1 1 3 1223 1 1 27 ASN CA C 4.300 7.995 -0.744 1.00 . A A . 27 ASN CA 1 1 3 1224 1 1 27 ASN CB C 4.756 8.491 0.659 1.00 . A A . 27 ASN CB 1 1 3 1225 1 1 27 ASN CG C 3.984 9.761 1.033 1.00 . A A . 27 ASN CG 1 1 3 1226 1 1 27 ASN H H 3.851 5.904 -0.890 1.00 . A A . 27 ASN H 1 1 3 1227 1 1 27 ASN HA H 3.235 8.119 -0.860 1.00 . A A . 27 ASN HA 1 1 3 1228 1 1 27 ASN HB2 H 4.556 7.735 1.405 1.00 . A A . 27 ASN HB2 1 1 3 1229 1 1 27 ASN HB3 H 5.814 8.709 0.667 1.00 . A A . 27 ASN HB3 1 1 3 1230 1 1 27 ASN HD21 H 2.340 8.765 1.538 1.00 . A A . 27 ASN HD21 1 1 3 1231 1 1 27 ASN HD22 H 2.247 10.452 1.701 1.00 . A A . 27 ASN HD22 1 1 3 1232 1 1 27 ASN N N 4.600 6.533 -0.837 1.00 . A A . 27 ASN N 1 1 3 1233 1 1 27 ASN ND2 N 2.755 9.649 1.460 1.00 . A A . 27 ASN ND2 1 1 3 1234 1 1 27 ASN O O 5.522 9.860 -1.647 1.00 . A A . 27 ASN O 1 1 3 1235 1 1 27 ASN OD1 O 4.488 10.862 0.940 1.00 . A A . 27 ASN OD1 1 1 3 1236 1 1 28 GLY C C 5.869 7.950 -5.401 1.00 . A A . 28 GLY C 1 1 3 1237 1 1 28 GLY CA C 5.603 8.888 -4.218 1.00 . A A . 28 GLY CA 1 1 3 1238 1 1 28 GLY H H 4.526 7.356 -3.170 1.00 . A A . 28 GLY H 1 1 3 1239 1 1 28 GLY HA2 H 4.962 9.692 -4.546 1.00 . A A . 28 GLY HA2 1 1 3 1240 1 1 28 GLY HA3 H 6.546 9.291 -3.895 1.00 . A A . 28 GLY HA3 1 1 3 1241 1 1 28 GLY N N 4.965 8.219 -3.049 1.00 . A A . 28 GLY N 1 1 3 1242 1 1 28 GLY O O 5.761 8.368 -6.537 1.00 . A A . 28 GLY O 1 1 3 1243 1 1 29 ILE C C 5.380 4.651 -6.228 1.00 . A A . 29 ILE C 1 1 3 1244 1 1 29 ILE CA C 6.497 5.716 -6.181 1.00 . A A . 29 ILE CA 1 1 3 1245 1 1 29 ILE CB C 7.890 5.071 -5.876 1.00 . A A . 29 ILE CB 1 1 3 1246 1 1 29 ILE CD1 C 9.942 4.029 -6.954 1.00 . A A . 29 ILE CD1 1 1 3 1247 1 1 29 ILE CG1 C 8.470 4.431 -7.167 1.00 . A A . 29 ILE CG1 1 1 3 1248 1 1 29 ILE CG2 C 7.788 4.002 -4.758 1.00 . A A . 29 ILE CG2 1 1 3 1249 1 1 29 ILE H H 6.269 6.445 -4.168 1.00 . A A . 29 ILE H 1 1 3 1250 1 1 29 ILE HA H 6.552 6.229 -7.129 1.00 . A A . 29 ILE HA 1 1 3 1251 1 1 29 ILE HB H 8.555 5.854 -5.540 1.00 . A A . 29 ILE HB 1 1 3 1252 1 1 29 ILE HD11 H 10.502 4.852 -6.532 1.00 . A A . 29 ILE HD11 1 1 3 1253 1 1 29 ILE HD12 H 10.007 3.182 -6.286 1.00 . A A . 29 ILE HD12 1 1 3 1254 1 1 29 ILE HD13 H 10.386 3.757 -7.900 1.00 . A A . 29 ILE HD13 1 1 3 1255 1 1 29 ILE HG12 H 7.894 3.558 -7.441 1.00 . A A . 29 ILE HG12 1 1 3 1256 1 1 29 ILE HG13 H 8.420 5.143 -7.979 1.00 . A A . 29 ILE HG13 1 1 3 1257 1 1 29 ILE HG21 H 7.065 4.315 -4.023 1.00 . A A . 29 ILE HG21 1 1 3 1258 1 1 29 ILE HG22 H 7.476 3.051 -5.165 1.00 . A A . 29 ILE HG22 1 1 3 1259 1 1 29 ILE HG23 H 8.744 3.878 -4.273 1.00 . A A . 29 ILE HG23 1 1 3 1260 1 1 29 ILE N N 6.208 6.718 -5.105 1.00 . A A . 29 ILE N 1 1 3 1261 1 1 29 ILE O O 4.926 4.220 -5.185 1.00 . A A . 29 ILE O 1 1 3 1262 1 1 30 PRO C C 4.703 1.806 -7.124 1.00 . A A . 30 PRO C 1 1 3 1263 1 1 30 PRO CA C 4.011 3.110 -7.539 1.00 . A A . 30 PRO CA 1 1 3 1264 1 1 30 PRO CB C 3.566 3.105 -9.004 1.00 . A A . 30 PRO CB 1 1 3 1265 1 1 30 PRO CD C 5.332 4.841 -8.724 1.00 . A A . 30 PRO CD 1 1 3 1266 1 1 30 PRO CG C 4.466 4.101 -9.758 1.00 . A A . 30 PRO CG 1 1 3 1267 1 1 30 PRO HA H 3.174 3.289 -6.889 1.00 . A A . 30 PRO HA 1 1 3 1268 1 1 30 PRO HB2 H 3.654 2.119 -9.436 1.00 . A A . 30 PRO HB2 1 1 3 1269 1 1 30 PRO HB3 H 2.533 3.414 -9.066 1.00 . A A . 30 PRO HB3 1 1 3 1270 1 1 30 PRO HD2 H 6.384 4.680 -8.911 1.00 . A A . 30 PRO HD2 1 1 3 1271 1 1 30 PRO HD3 H 5.110 5.897 -8.719 1.00 . A A . 30 PRO HD3 1 1 3 1272 1 1 30 PRO HG2 H 5.098 3.572 -10.456 1.00 . A A . 30 PRO HG2 1 1 3 1273 1 1 30 PRO HG3 H 3.860 4.807 -10.306 1.00 . A A . 30 PRO HG3 1 1 3 1274 1 1 30 PRO N N 4.957 4.247 -7.405 1.00 . A A . 30 PRO N 1 1 3 1275 1 1 30 PRO O O 5.484 1.246 -7.870 1.00 . A A . 30 PRO O 1 1 4 1276 1 1 1 CYS C C 4.252 -1.008 -6.147 1.00 . A A . 1 CYS C 1 1 4 1277 1 1 1 CYS CA C 5.089 0.034 -5.400 1.00 . A A . 1 CYS CA 1 1 4 1278 1 1 1 CYS CB C 5.055 -0.276 -3.903 1.00 . A A . 1 CYS CB 1 1 4 1279 1 1 1 CYS HA H 6.107 0.012 -5.763 1.00 . A A . 1 CYS HA 1 1 4 1280 1 1 1 CYS HB2 H 4.197 0.217 -3.479 1.00 . A A . 1 CYS HB2 1 1 4 1281 1 1 1 CYS HB3 H 4.905 -1.337 -3.777 1.00 . A A . 1 CYS HB3 1 1 4 1282 1 1 1 CYS N N 4.481 1.376 -5.664 1.00 . A A . 1 CYS N 1 1 4 1283 1 1 1 CYS O O 4.791 -1.872 -6.812 1.00 . A A . 1 CYS O 1 1 4 1284 1 1 1 CYS SG S 6.487 0.186 -2.897 1.00 . A A . 1 CYS SG 1 1 4 1285 1 1 2 GLY C C 0.716 -1.094 -6.980 1.00 . A A . 2 GLY C 1 1 4 1286 1 1 2 GLY CA C 2.018 -1.825 -6.676 1.00 . A A . 2 GLY CA 1 1 4 1287 1 1 2 GLY H H 2.577 -0.164 -5.457 1.00 . A A . 2 GLY H 1 1 4 1288 1 1 2 GLY HA2 H 2.450 -2.174 -7.604 1.00 . A A . 2 GLY HA2 1 1 4 1289 1 1 2 GLY HA3 H 1.825 -2.664 -6.024 1.00 . A A . 2 GLY HA3 1 1 4 1290 1 1 2 GLY N N 2.954 -0.884 -6.007 1.00 . A A . 2 GLY N 1 1 4 1291 1 1 2 GLY O O 0.560 -0.545 -8.054 1.00 . A A . 2 GLY O 1 1 4 1292 1 1 3 GLU C C -2.412 -0.618 -4.929 1.00 . A A . 3 GLU C 1 1 4 1293 1 1 3 GLU CA C -1.502 -0.431 -6.159 1.00 . A A . 3 GLU CA 1 1 4 1294 1 1 3 GLU CB C -2.229 -0.998 -7.401 1.00 . A A . 3 GLU CB 1 1 4 1295 1 1 3 GLU CD C -4.032 -0.376 -9.028 1.00 . A A . 3 GLU CD 1 1 4 1296 1 1 3 GLU CG C -2.826 0.157 -8.237 1.00 . A A . 3 GLU CG 1 1 4 1297 1 1 3 GLU H H 0.053 -1.553 -5.174 1.00 . A A . 3 GLU H 1 1 4 1298 1 1 3 GLU HA H -1.318 0.626 -6.272 1.00 . A A . 3 GLU HA 1 1 4 1299 1 1 3 GLU HB2 H -1.536 -1.555 -8.002 1.00 . A A . 3 GLU HB2 1 1 4 1300 1 1 3 GLU HB3 H -3.000 -1.685 -7.085 1.00 . A A . 3 GLU HB3 1 1 4 1301 1 1 3 GLU HG2 H -3.152 0.967 -7.599 1.00 . A A . 3 GLU HG2 1 1 4 1302 1 1 3 GLU HG3 H -2.085 0.538 -8.925 1.00 . A A . 3 GLU HG3 1 1 4 1303 1 1 3 GLU N N -0.171 -1.102 -6.012 1.00 . A A . 3 GLU N 1 1 4 1304 1 1 3 GLU O O -1.976 -1.030 -3.872 1.00 . A A . 3 GLU O 1 1 4 1305 1 1 3 GLU OE1 O -5.114 -0.324 -8.466 1.00 . A A . 3 GLU OE1 1 1 4 1306 1 1 3 GLU OE2 O -3.801 -0.803 -10.149 1.00 . A A . 3 GLU OE2 1 1 4 1307 1 1 4 SER C C -4.696 -1.526 -3.091 1.00 . A A . 4 SER C 1 1 4 1308 1 1 4 SER CA C -4.742 -0.393 -4.113 1.00 . A A . 4 SER CA 1 1 4 1309 1 1 4 SER CB C -6.097 -0.451 -4.838 1.00 . A A . 4 SER CB 1 1 4 1310 1 1 4 SER H H -3.924 0.012 -6.034 1.00 . A A . 4 SER H 1 1 4 1311 1 1 4 SER HA H -4.706 0.520 -3.553 1.00 . A A . 4 SER HA 1 1 4 1312 1 1 4 SER HB2 H -6.894 -0.754 -4.178 1.00 . A A . 4 SER HB2 1 1 4 1313 1 1 4 SER HB3 H -6.332 0.505 -5.275 1.00 . A A . 4 SER HB3 1 1 4 1314 1 1 4 SER HG H -5.238 -1.127 -6.446 1.00 . A A . 4 SER HG 1 1 4 1315 1 1 4 SER N N -3.667 -0.302 -5.143 1.00 . A A . 4 SER N 1 1 4 1316 1 1 4 SER O O -4.310 -2.645 -3.361 1.00 . A A . 4 SER O 1 1 4 1317 1 1 4 SER OG O -5.935 -1.427 -5.858 1.00 . A A . 4 SER OG 1 1 4 1318 1 1 5 CYS C C -6.668 -2.255 -0.361 1.00 . A A . 5 CYS C 1 1 4 1319 1 1 5 CYS CA C -5.201 -1.984 -0.725 1.00 . A A . 5 CYS CA 1 1 4 1320 1 1 5 CYS CB C -4.476 -1.252 0.378 1.00 . A A . 5 CYS CB 1 1 4 1321 1 1 5 CYS H H -5.407 -0.191 -1.831 1.00 . A A . 5 CYS H 1 1 4 1322 1 1 5 CYS HA H -4.732 -2.905 -0.953 1.00 . A A . 5 CYS HA 1 1 4 1323 1 1 5 CYS HB2 H -5.076 -0.396 0.611 1.00 . A A . 5 CYS HB2 1 1 4 1324 1 1 5 CYS HB3 H -4.443 -1.875 1.254 1.00 . A A . 5 CYS HB3 1 1 4 1325 1 1 5 CYS N N -5.124 -1.118 -1.925 1.00 . A A . 5 CYS N 1 1 4 1326 1 1 5 CYS O O -6.991 -2.642 0.746 1.00 . A A . 5 CYS O 1 1 4 1327 1 1 5 CYS SG S -2.802 -0.664 0.020 1.00 . A A . 5 CYS SG 1 1 4 1328 1 1 6 VAL C C -9.294 -3.732 -1.316 1.00 . A A . 6 VAL C 1 1 4 1329 1 1 6 VAL CA C -8.975 -2.236 -1.202 1.00 . A A . 6 VAL CA 1 1 4 1330 1 1 6 VAL CB C -9.695 -1.431 -2.321 1.00 . A A . 6 VAL CB 1 1 4 1331 1 1 6 VAL CG1 C -11.225 -1.646 -2.241 1.00 . A A . 6 VAL CG1 1 1 4 1332 1 1 6 VAL CG2 C -9.388 0.068 -2.143 1.00 . A A . 6 VAL CG2 1 1 4 1333 1 1 6 VAL H H -7.125 -1.738 -2.197 1.00 . A A . 6 VAL H 1 1 4 1334 1 1 6 VAL HA H -9.288 -1.872 -0.234 1.00 . A A . 6 VAL HA 1 1 4 1335 1 1 6 VAL HB H -9.337 -1.749 -3.290 1.00 . A A . 6 VAL HB 1 1 4 1336 1 1 6 VAL HG11 H -11.579 -1.480 -1.233 1.00 . A A . 6 VAL HG11 1 1 4 1337 1 1 6 VAL HG12 H -11.731 -0.959 -2.904 1.00 . A A . 6 VAL HG12 1 1 4 1338 1 1 6 VAL HG13 H -11.476 -2.653 -2.537 1.00 . A A . 6 VAL HG13 1 1 4 1339 1 1 6 VAL HG21 H -8.320 0.227 -2.152 1.00 . A A . 6 VAL HG21 1 1 4 1340 1 1 6 VAL HG22 H -9.828 0.634 -2.952 1.00 . A A . 6 VAL HG22 1 1 4 1341 1 1 6 VAL HG23 H -9.788 0.430 -1.207 1.00 . A A . 6 VAL HG23 1 1 4 1342 1 1 6 VAL N N -7.500 -2.038 -1.345 1.00 . A A . 6 VAL N 1 1 4 1343 1 1 6 VAL O O -9.675 -4.363 -0.349 1.00 . A A . 6 VAL O 1 1 4 1344 1 1 7 TRP C C -8.454 -6.557 -1.956 1.00 . A A . 7 TRP C 1 1 4 1345 1 1 7 TRP CA C -9.383 -5.677 -2.798 1.00 . A A . 7 TRP CA 1 1 4 1346 1 1 7 TRP CB C -9.142 -5.913 -4.289 1.00 . A A . 7 TRP CB 1 1 4 1347 1 1 7 TRP CD1 C -9.373 -8.389 -4.991 1.00 . A A . 7 TRP CD1 1 1 4 1348 1 1 7 TRP CD2 C -11.257 -7.224 -4.964 1.00 . A A . 7 TRP CD2 1 1 4 1349 1 1 7 TRP CE2 C -11.573 -8.523 -5.359 1.00 . A A . 7 TRP CE2 1 1 4 1350 1 1 7 TRP CE3 C -12.263 -6.265 -4.859 1.00 . A A . 7 TRP CE3 1 1 4 1351 1 1 7 TRP CG C -9.913 -7.159 -4.743 1.00 . A A . 7 TRP CG 1 1 4 1352 1 1 7 TRP CH2 C -13.897 -7.904 -5.543 1.00 . A A . 7 TRP CH2 1 1 4 1353 1 1 7 TRP CZ2 C -12.892 -8.863 -5.649 1.00 . A A . 7 TRP CZ2 1 1 4 1354 1 1 7 TRP CZ3 C -13.583 -6.605 -5.149 1.00 . A A . 7 TRP CZ3 1 1 4 1355 1 1 7 TRP H H -8.810 -3.669 -3.239 1.00 . A A . 7 TRP H 1 1 4 1356 1 1 7 TRP HA H -10.409 -5.884 -2.537 1.00 . A A . 7 TRP HA 1 1 4 1357 1 1 7 TRP HB2 H -9.486 -5.060 -4.851 1.00 . A A . 7 TRP HB2 1 1 4 1358 1 1 7 TRP HB3 H -8.089 -6.046 -4.484 1.00 . A A . 7 TRP HB3 1 1 4 1359 1 1 7 TRP HD1 H -8.337 -8.688 -4.915 1.00 . A A . 7 TRP HD1 1 1 4 1360 1 1 7 TRP HE1 H -10.303 -10.070 -5.582 1.00 . A A . 7 TRP HE1 1 1 4 1361 1 1 7 TRP HE3 H -12.022 -5.257 -4.554 1.00 . A A . 7 TRP HE3 1 1 4 1362 1 1 7 TRP HH2 H -14.921 -8.166 -5.768 1.00 . A A . 7 TRP HH2 1 1 4 1363 1 1 7 TRP HZ2 H -13.136 -9.869 -5.955 1.00 . A A . 7 TRP HZ2 1 1 4 1364 1 1 7 TRP HZ3 H -14.362 -5.860 -5.067 1.00 . A A . 7 TRP HZ3 1 1 4 1365 1 1 7 TRP N N -9.121 -4.240 -2.510 1.00 . A A . 7 TRP N 1 1 4 1366 1 1 7 TRP NE1 N -10.401 -9.125 -5.343 1.00 . A A . 7 TRP NE1 1 1 4 1367 1 1 7 TRP O O -8.843 -7.601 -1.470 1.00 . A A . 7 TRP O 1 1 4 1368 1 1 8 ILE C C -5.077 -5.784 -0.676 1.00 . A A . 8 ILE C 1 1 4 1369 1 1 8 ILE CA C -6.198 -6.784 -1.045 1.00 . A A . 8 ILE CA 1 1 4 1370 1 1 8 ILE CB C -5.636 -7.971 -1.905 1.00 . A A . 8 ILE CB 1 1 4 1371 1 1 8 ILE CD1 C -4.241 -10.079 -1.691 1.00 . A A . 8 ILE CD1 1 1 4 1372 1 1 8 ILE CG1 C -4.453 -8.652 -1.153 1.00 . A A . 8 ILE CG1 1 1 4 1373 1 1 8 ILE CG2 C -5.174 -7.503 -3.313 1.00 . A A . 8 ILE CG2 1 1 4 1374 1 1 8 ILE H H -7.022 -5.228 -2.255 1.00 . A A . 8 ILE H 1 1 4 1375 1 1 8 ILE HA H -6.661 -7.171 -0.157 1.00 . A A . 8 ILE HA 1 1 4 1376 1 1 8 ILE HB H -6.431 -8.691 -2.034 1.00 . A A . 8 ILE HB 1 1 4 1377 1 1 8 ILE HD11 H -5.142 -10.663 -1.573 1.00 . A A . 8 ILE HD11 1 1 4 1378 1 1 8 ILE HD12 H -3.976 -10.052 -2.738 1.00 . A A . 8 ILE HD12 1 1 4 1379 1 1 8 ILE HD13 H -3.443 -10.560 -1.146 1.00 . A A . 8 ILE HD13 1 1 4 1380 1 1 8 ILE HG12 H -3.546 -8.080 -1.284 1.00 . A A . 8 ILE HG12 1 1 4 1381 1 1 8 ILE HG13 H -4.668 -8.706 -0.096 1.00 . A A . 8 ILE HG13 1 1 4 1382 1 1 8 ILE HG21 H -5.842 -6.755 -3.711 1.00 . A A . 8 ILE HG21 1 1 4 1383 1 1 8 ILE HG22 H -4.176 -7.090 -3.275 1.00 . A A . 8 ILE HG22 1 1 4 1384 1 1 8 ILE HG23 H -5.167 -8.346 -3.990 1.00 . A A . 8 ILE HG23 1 1 4 1385 1 1 8 ILE N N -7.246 -6.077 -1.827 1.00 . A A . 8 ILE N 1 1 4 1386 1 1 8 ILE O O -4.394 -5.293 -1.555 1.00 . A A . 8 ILE O 1 1 4 1387 1 1 9 PRO C C -2.437 -5.595 0.777 1.00 . A A . 9 PRO C 1 1 4 1388 1 1 9 PRO CA C -3.698 -4.791 1.109 1.00 . A A . 9 PRO CA 1 1 4 1389 1 1 9 PRO CB C -3.905 -4.631 2.617 1.00 . A A . 9 PRO CB 1 1 4 1390 1 1 9 PRO CD C -5.878 -5.819 1.688 1.00 . A A . 9 PRO CD 1 1 4 1391 1 1 9 PRO CG C -5.340 -5.085 2.926 1.00 . A A . 9 PRO CG 1 1 4 1392 1 1 9 PRO HA H -3.631 -3.824 0.637 1.00 . A A . 9 PRO HA 1 1 4 1393 1 1 9 PRO HB2 H -3.199 -5.234 3.171 1.00 . A A . 9 PRO HB2 1 1 4 1394 1 1 9 PRO HB3 H -3.775 -3.597 2.901 1.00 . A A . 9 PRO HB3 1 1 4 1395 1 1 9 PRO HD2 H -5.899 -6.886 1.850 1.00 . A A . 9 PRO HD2 1 1 4 1396 1 1 9 PRO HD3 H -6.862 -5.462 1.415 1.00 . A A . 9 PRO HD3 1 1 4 1397 1 1 9 PRO HG2 H -5.348 -5.743 3.782 1.00 . A A . 9 PRO HG2 1 1 4 1398 1 1 9 PRO HG3 H -5.959 -4.225 3.141 1.00 . A A . 9 PRO HG3 1 1 4 1399 1 1 9 PRO N N -4.909 -5.497 0.599 1.00 . A A . 9 PRO N 1 1 4 1400 1 1 9 PRO O O -2.440 -6.810 0.831 1.00 . A A . 9 PRO O 1 1 4 1401 1 1 10 CYS C C 0.550 -6.237 1.283 1.00 . A A . 10 CYS C 1 1 4 1402 1 1 10 CYS CA C -0.097 -5.517 0.089 1.00 . A A . 10 CYS CA 1 1 4 1403 1 1 10 CYS CB C 0.858 -4.434 -0.436 1.00 . A A . 10 CYS CB 1 1 4 1404 1 1 10 CYS H H -1.480 -3.897 0.425 1.00 . A A . 10 CYS H 1 1 4 1405 1 1 10 CYS HA H -0.275 -6.245 -0.691 1.00 . A A . 10 CYS HA 1 1 4 1406 1 1 10 CYS HB2 H 1.871 -4.808 -0.391 1.00 . A A . 10 CYS HB2 1 1 4 1407 1 1 10 CYS HB3 H 0.628 -4.270 -1.478 1.00 . A A . 10 CYS HB3 1 1 4 1408 1 1 10 CYS N N -1.399 -4.874 0.443 1.00 . A A . 10 CYS N 1 1 4 1409 1 1 10 CYS O O 0.051 -6.203 2.391 1.00 . A A . 10 CYS O 1 1 4 1410 1 1 10 CYS SG S 0.853 -2.822 0.387 1.00 . A A . 10 CYS SG 1 1 4 1411 1 1 11 ILE C C 3.916 -7.258 1.797 1.00 . A A . 11 ILE C 1 1 4 1412 1 1 11 ILE CA C 2.444 -7.631 2.001 1.00 . A A . 11 ILE CA 1 1 4 1413 1 1 11 ILE CB C 2.238 -9.165 1.789 1.00 . A A . 11 ILE CB 1 1 4 1414 1 1 11 ILE CD1 C 2.103 -10.970 0.003 1.00 . A A . 11 ILE CD1 1 1 4 1415 1 1 11 ILE CG1 C 1.771 -9.504 0.335 1.00 . A A . 11 ILE CG1 1 1 4 1416 1 1 11 ILE CG2 C 1.185 -9.670 2.800 1.00 . A A . 11 ILE CG2 1 1 4 1417 1 1 11 ILE H H 1.988 -6.851 0.067 1.00 . A A . 11 ILE H 1 1 4 1418 1 1 11 ILE HA H 2.149 -7.331 2.995 1.00 . A A . 11 ILE HA 1 1 4 1419 1 1 11 ILE HB H 3.179 -9.655 1.979 1.00 . A A . 11 ILE HB 1 1 4 1420 1 1 11 ILE HD11 H 3.147 -11.174 0.192 1.00 . A A . 11 ILE HD11 1 1 4 1421 1 1 11 ILE HD12 H 1.502 -11.637 0.602 1.00 . A A . 11 ILE HD12 1 1 4 1422 1 1 11 ILE HD13 H 1.897 -11.162 -1.040 1.00 . A A . 11 ILE HD13 1 1 4 1423 1 1 11 ILE HG12 H 0.707 -9.343 0.236 1.00 . A A . 11 ILE HG12 1 1 4 1424 1 1 11 ILE HG13 H 2.275 -8.872 -0.382 1.00 . A A . 11 ILE HG13 1 1 4 1425 1 1 11 ILE HG21 H 1.505 -9.456 3.808 1.00 . A A . 11 ILE HG21 1 1 4 1426 1 1 11 ILE HG22 H 0.237 -9.183 2.626 1.00 . A A . 11 ILE HG22 1 1 4 1427 1 1 11 ILE HG23 H 1.051 -10.737 2.704 1.00 . A A . 11 ILE HG23 1 1 4 1428 1 1 11 ILE N N 1.656 -6.870 0.987 1.00 . A A . 11 ILE N 1 1 4 1429 1 1 11 ILE O O 4.566 -6.752 2.691 1.00 . A A . 11 ILE O 1 1 4 1430 1 1 12 SER C C 5.955 -5.707 0.133 1.00 . A A . 12 SER C 1 1 4 1431 1 1 12 SER CA C 5.797 -7.227 0.236 1.00 . A A . 12 SER CA 1 1 4 1432 1 1 12 SER CB C 6.099 -7.895 -1.109 1.00 . A A . 12 SER CB 1 1 4 1433 1 1 12 SER H H 3.809 -7.936 -0.063 1.00 . A A . 12 SER H 1 1 4 1434 1 1 12 SER HA H 6.440 -7.611 1.009 1.00 . A A . 12 SER HA 1 1 4 1435 1 1 12 SER HB2 H 5.385 -7.611 -1.868 1.00 . A A . 12 SER HB2 1 1 4 1436 1 1 12 SER HB3 H 7.101 -7.681 -1.440 1.00 . A A . 12 SER HB3 1 1 4 1437 1 1 12 SER HG H 6.661 -9.528 -0.215 1.00 . A A . 12 SER HG 1 1 4 1438 1 1 12 SER N N 4.388 -7.527 0.606 1.00 . A A . 12 SER N 1 1 4 1439 1 1 12 SER O O 6.825 -5.122 0.751 1.00 . A A . 12 SER O 1 1 4 1440 1 1 12 SER OG O 5.975 -9.284 -0.841 1.00 . A A . 12 SER OG 1 1 4 1441 1 1 13 ALA C C 4.689 -2.924 0.423 1.00 . A A . 13 ALA C 1 1 4 1442 1 1 13 ALA CA C 5.102 -3.651 -0.866 1.00 . A A . 13 ALA CA 1 1 4 1443 1 1 13 ALA CB C 4.134 -3.315 -2.005 1.00 . A A . 13 ALA CB 1 1 4 1444 1 1 13 ALA H H 4.420 -5.664 -1.122 1.00 . A A . 13 ALA H 1 1 4 1445 1 1 13 ALA HA H 6.103 -3.359 -1.137 1.00 . A A . 13 ALA HA 1 1 4 1446 1 1 13 ALA HB1 H 3.201 -3.840 -1.876 1.00 . A A . 13 ALA HB1 1 1 4 1447 1 1 13 ALA HB2 H 3.939 -2.254 -2.027 1.00 . A A . 13 ALA HB2 1 1 4 1448 1 1 13 ALA HB3 H 4.567 -3.608 -2.951 1.00 . A A . 13 ALA HB3 1 1 4 1449 1 1 13 ALA N N 5.089 -5.125 -0.657 1.00 . A A . 13 ALA N 1 1 4 1450 1 1 13 ALA O O 4.976 -1.754 0.588 1.00 . A A . 13 ALA O 1 1 4 1451 1 1 14 ALA C C 4.786 -2.692 3.463 1.00 . A A . 14 ALA C 1 1 4 1452 1 1 14 ALA CA C 3.570 -3.049 2.593 1.00 . A A . 14 ALA CA 1 1 4 1453 1 1 14 ALA CB C 2.686 -4.066 3.323 1.00 . A A . 14 ALA CB 1 1 4 1454 1 1 14 ALA H H 3.825 -4.581 1.100 1.00 . A A . 14 ALA H 1 1 4 1455 1 1 14 ALA HA H 3.007 -2.149 2.388 1.00 . A A . 14 ALA HA 1 1 4 1456 1 1 14 ALA HB1 H 1.968 -4.483 2.635 1.00 . A A . 14 ALA HB1 1 1 4 1457 1 1 14 ALA HB2 H 3.285 -4.865 3.733 1.00 . A A . 14 ALA HB2 1 1 4 1458 1 1 14 ALA HB3 H 2.153 -3.580 4.128 1.00 . A A . 14 ALA HB3 1 1 4 1459 1 1 14 ALA N N 4.026 -3.643 1.297 1.00 . A A . 14 ALA N 1 1 4 1460 1 1 14 ALA O O 4.722 -1.793 4.279 1.00 . A A . 14 ALA O 1 1 4 1461 1 1 15 LEU C C 7.770 -1.895 3.511 1.00 . A A . 15 LEU C 1 1 4 1462 1 1 15 LEU CA C 7.112 -3.182 4.026 1.00 . A A . 15 LEU CA 1 1 4 1463 1 1 15 LEU CB C 8.061 -4.397 3.833 1.00 . A A . 15 LEU CB 1 1 4 1464 1 1 15 LEU CD1 C 8.818 -6.570 4.870 1.00 . A A . 15 LEU CD1 1 1 4 1465 1 1 15 LEU CD2 C 9.102 -4.422 6.147 1.00 . A A . 15 LEU CD2 1 1 4 1466 1 1 15 LEU CG C 8.190 -5.191 5.161 1.00 . A A . 15 LEU CG 1 1 4 1467 1 1 15 LEU H H 5.842 -4.132 2.592 1.00 . A A . 15 LEU H 1 1 4 1468 1 1 15 LEU HA H 6.844 -3.055 5.060 1.00 . A A . 15 LEU HA 1 1 4 1469 1 1 15 LEU HB2 H 7.661 -5.048 3.070 1.00 . A A . 15 LEU HB2 1 1 4 1470 1 1 15 LEU HB3 H 9.039 -4.068 3.510 1.00 . A A . 15 LEU HB3 1 1 4 1471 1 1 15 LEU HD11 H 9.782 -6.454 4.397 1.00 . A A . 15 LEU HD11 1 1 4 1472 1 1 15 LEU HD12 H 8.946 -7.117 5.793 1.00 . A A . 15 LEU HD12 1 1 4 1473 1 1 15 LEU HD13 H 8.176 -7.143 4.217 1.00 . A A . 15 LEU HD13 1 1 4 1474 1 1 15 LEU HD21 H 10.070 -4.235 5.705 1.00 . A A . 15 LEU HD21 1 1 4 1475 1 1 15 LEU HD22 H 8.653 -3.476 6.411 1.00 . A A . 15 LEU HD22 1 1 4 1476 1 1 15 LEU HD23 H 9.240 -4.999 7.050 1.00 . A A . 15 LEU HD23 1 1 4 1477 1 1 15 LEU HG H 7.214 -5.329 5.601 1.00 . A A . 15 LEU HG 1 1 4 1478 1 1 15 LEU N N 5.858 -3.419 3.257 1.00 . A A . 15 LEU N 1 1 4 1479 1 1 15 LEU O O 8.021 -0.980 4.270 1.00 . A A . 15 LEU O 1 1 4 1480 1 1 16 GLY C C 7.694 0.492 1.625 1.00 . A A . 16 GLY C 1 1 4 1481 1 1 16 GLY CA C 8.659 -0.696 1.573 1.00 . A A . 16 GLY CA 1 1 4 1482 1 1 16 GLY H H 7.795 -2.655 1.679 1.00 . A A . 16 GLY H 1 1 4 1483 1 1 16 GLY HA2 H 9.570 -0.460 2.094 1.00 . A A . 16 GLY HA2 1 1 4 1484 1 1 16 GLY HA3 H 8.881 -0.936 0.543 1.00 . A A . 16 GLY HA3 1 1 4 1485 1 1 16 GLY N N 8.023 -1.878 2.225 1.00 . A A . 16 GLY N 1 1 4 1486 1 1 16 GLY O O 7.891 1.425 2.379 1.00 . A A . 16 GLY O 1 1 4 1487 1 1 17 CYS C C 4.595 1.260 1.839 1.00 . A A . 17 CYS C 1 1 4 1488 1 1 17 CYS CA C 5.639 1.471 0.735 1.00 . A A . 17 CYS CA 1 1 4 1489 1 1 17 CYS CB C 4.960 1.414 -0.635 1.00 . A A . 17 CYS CB 1 1 4 1490 1 1 17 CYS H H 6.590 -0.382 0.228 1.00 . A A . 17 CYS H 1 1 4 1491 1 1 17 CYS HA H 6.108 2.431 0.879 1.00 . A A . 17 CYS HA 1 1 4 1492 1 1 17 CYS HB2 H 4.622 0.405 -0.815 1.00 . A A . 17 CYS HB2 1 1 4 1493 1 1 17 CYS HB3 H 4.074 2.020 -0.596 1.00 . A A . 17 CYS HB3 1 1 4 1494 1 1 17 CYS N N 6.677 0.402 0.807 1.00 . A A . 17 CYS N 1 1 4 1495 1 1 17 CYS O O 4.717 0.361 2.648 1.00 . A A . 17 CYS O 1 1 4 1496 1 1 17 CYS SG S 5.901 1.939 -2.087 1.00 . A A . 17 CYS SG 1 1 4 1497 1 1 18 SER C C 1.152 2.036 2.099 1.00 . A A . 18 SER C 1 1 4 1498 1 1 18 SER CA C 2.494 2.036 2.837 1.00 . A A . 18 SER CA 1 1 4 1499 1 1 18 SER CB C 2.586 3.255 3.764 1.00 . A A . 18 SER CB 1 1 4 1500 1 1 18 SER H H 3.573 2.807 1.144 1.00 . A A . 18 SER H 1 1 4 1501 1 1 18 SER HA H 2.573 1.121 3.405 1.00 . A A . 18 SER HA 1 1 4 1502 1 1 18 SER HB2 H 2.525 4.184 3.214 1.00 . A A . 18 SER HB2 1 1 4 1503 1 1 18 SER HB3 H 1.831 3.229 4.537 1.00 . A A . 18 SER HB3 1 1 4 1504 1 1 18 SER HG H 4.527 3.175 3.657 1.00 . A A . 18 SER HG 1 1 4 1505 1 1 18 SER N N 3.597 2.107 1.828 1.00 . A A . 18 SER N 1 1 4 1506 1 1 18 SER O O 1.101 2.287 0.911 1.00 . A A . 18 SER O 1 1 4 1507 1 1 18 SER OG O 3.872 3.140 4.357 1.00 . A A . 18 SER OG 1 1 4 1508 1 1 19 CYS C C -2.013 2.997 2.606 1.00 . A A . 19 CYS C 1 1 4 1509 1 1 19 CYS CA C -1.257 1.730 2.192 1.00 . A A . 19 CYS CA 1 1 4 1510 1 1 19 CYS CB C -2.002 0.474 2.658 1.00 . A A . 19 CYS CB 1 1 4 1511 1 1 19 CYS H H 0.197 1.553 3.774 1.00 . A A . 19 CYS H 1 1 4 1512 1 1 19 CYS HA H -1.168 1.705 1.118 1.00 . A A . 19 CYS HA 1 1 4 1513 1 1 19 CYS HB2 H -1.720 0.272 3.679 1.00 . A A . 19 CYS HB2 1 1 4 1514 1 1 19 CYS HB3 H -3.060 0.684 2.634 1.00 . A A . 19 CYS HB3 1 1 4 1515 1 1 19 CYS N N 0.097 1.752 2.820 1.00 . A A . 19 CYS N 1 1 4 1516 1 1 19 CYS O O -2.550 3.084 3.694 1.00 . A A . 19 CYS O 1 1 4 1517 1 1 19 CYS SG S -1.744 -1.039 1.699 1.00 . A A . 19 CYS SG 1 1 4 1518 1 1 20 LYS C C -3.545 5.608 0.704 1.00 . A A . 20 LYS C 1 1 4 1519 1 1 20 LYS CA C -2.703 5.253 1.932 1.00 . A A . 20 LYS CA 1 1 4 1520 1 1 20 LYS CB C -1.627 6.337 2.183 1.00 . A A . 20 LYS CB 1 1 4 1521 1 1 20 LYS CD C -1.870 6.702 4.684 1.00 . A A . 20 LYS CD 1 1 4 1522 1 1 20 LYS CE C -0.414 6.931 5.138 1.00 . A A . 20 LYS CE 1 1 4 1523 1 1 20 LYS CG C -2.098 7.320 3.282 1.00 . A A . 20 LYS CG 1 1 4 1524 1 1 20 LYS H H -1.555 3.790 0.852 1.00 . A A . 20 LYS H 1 1 4 1525 1 1 20 LYS HA H -3.366 5.162 2.782 1.00 . A A . 20 LYS HA 1 1 4 1526 1 1 20 LYS HB2 H -0.703 5.867 2.487 1.00 . A A . 20 LYS HB2 1 1 4 1527 1 1 20 LYS HB3 H -1.433 6.888 1.274 1.00 . A A . 20 LYS HB3 1 1 4 1528 1 1 20 LYS HD2 H -2.542 7.167 5.392 1.00 . A A . 20 LYS HD2 1 1 4 1529 1 1 20 LYS HD3 H -2.082 5.642 4.666 1.00 . A A . 20 LYS HD3 1 1 4 1530 1 1 20 LYS HE2 H 0.278 6.746 4.330 1.00 . A A . 20 LYS HE2 1 1 4 1531 1 1 20 LYS HE3 H -0.286 7.946 5.483 1.00 . A A . 20 LYS HE3 1 1 4 1532 1 1 20 LYS HG2 H -1.550 8.248 3.191 1.00 . A A . 20 LYS HG2 1 1 4 1533 1 1 20 LYS HG3 H -3.149 7.539 3.153 1.00 . A A . 20 LYS HG3 1 1 4 1534 1 1 20 LYS HZ1 H -0.776 6.133 7.026 1.00 . A A . 20 LYS HZ1 1 1 4 1535 1 1 20 LYS HZ2 H -0.124 5.023 5.917 1.00 . A A . 20 LYS HZ2 1 1 4 1536 1 1 20 LYS HZ3 H 0.870 6.212 6.612 1.00 . A A . 20 LYS HZ3 1 1 4 1537 1 1 20 LYS N N -2.016 3.943 1.702 1.00 . A A . 20 LYS N 1 1 4 1538 1 1 20 LYS NZ N -0.086 6.005 6.258 1.00 . A A . 20 LYS NZ 1 1 4 1539 1 1 20 LYS O O -3.122 5.381 -0.414 1.00 . A A . 20 LYS O 1 1 4 1540 1 1 21 ASN C C -5.815 5.416 -1.167 1.00 . A A . 21 ASN C 1 1 4 1541 1 1 21 ASN CA C -5.650 6.559 -0.147 1.00 . A A . 21 ASN CA 1 1 4 1542 1 1 21 ASN CB C -5.079 7.832 -0.833 1.00 . A A . 21 ASN CB 1 1 4 1543 1 1 21 ASN CG C -4.771 8.896 0.229 1.00 . A A . 21 ASN CG 1 1 4 1544 1 1 21 ASN H H -4.978 6.302 1.885 1.00 . A A . 21 ASN H 1 1 4 1545 1 1 21 ASN HA H -6.615 6.775 0.286 1.00 . A A . 21 ASN HA 1 1 4 1546 1 1 21 ASN HB2 H -4.168 7.602 -1.366 1.00 . A A . 21 ASN HB2 1 1 4 1547 1 1 21 ASN HB3 H -5.799 8.236 -1.531 1.00 . A A . 21 ASN HB3 1 1 4 1548 1 1 21 ASN HD21 H -2.981 8.140 0.638 1.00 . A A . 21 ASN HD21 1 1 4 1549 1 1 21 ASN HD22 H -3.407 9.519 1.532 1.00 . A A . 21 ASN HD22 1 1 4 1550 1 1 21 ASN N N -4.712 6.154 0.954 1.00 . A A . 21 ASN N 1 1 4 1551 1 1 21 ASN ND2 N -3.624 8.848 0.852 1.00 . A A . 21 ASN ND2 1 1 4 1552 1 1 21 ASN O O -5.542 5.575 -2.341 1.00 . A A . 21 ASN O 1 1 4 1553 1 1 21 ASN OD1 O -5.565 9.774 0.502 1.00 . A A . 21 ASN OD1 1 1 4 1554 1 1 22 LYS C C -5.428 2.790 -2.527 1.00 . A A . 22 LYS C 1 1 4 1555 1 1 22 LYS CA C -6.501 3.047 -1.447 1.00 . A A . 22 LYS CA 1 1 4 1556 1 1 22 LYS CB C -7.933 3.121 -2.104 1.00 . A A . 22 LYS CB 1 1 4 1557 1 1 22 LYS CD C -9.510 4.322 -3.690 1.00 . A A . 22 LYS CD 1 1 4 1558 1 1 22 LYS CE C -9.269 4.618 -5.183 1.00 . A A . 22 LYS CE 1 1 4 1559 1 1 22 LYS CG C -8.173 4.423 -2.906 1.00 . A A . 22 LYS CG 1 1 4 1560 1 1 22 LYS H H -6.455 4.277 0.313 1.00 . A A . 22 LYS H 1 1 4 1561 1 1 22 LYS HA H -6.482 2.212 -0.762 1.00 . A A . 22 LYS HA 1 1 4 1562 1 1 22 LYS HB2 H -8.050 2.281 -2.771 1.00 . A A . 22 LYS HB2 1 1 4 1563 1 1 22 LYS HB3 H -8.677 3.028 -1.325 1.00 . A A . 22 LYS HB3 1 1 4 1564 1 1 22 LYS HD2 H -9.947 3.339 -3.591 1.00 . A A . 22 LYS HD2 1 1 4 1565 1 1 22 LYS HD3 H -10.211 5.044 -3.296 1.00 . A A . 22 LYS HD3 1 1 4 1566 1 1 22 LYS HE2 H -8.522 3.950 -5.586 1.00 . A A . 22 LYS HE2 1 1 4 1567 1 1 22 LYS HE3 H -10.187 4.492 -5.739 1.00 . A A . 22 LYS HE3 1 1 4 1568 1 1 22 LYS HG2 H -8.231 5.261 -2.228 1.00 . A A . 22 LYS HG2 1 1 4 1569 1 1 22 LYS HG3 H -7.352 4.586 -3.589 1.00 . A A . 22 LYS HG3 1 1 4 1570 1 1 22 LYS HZ1 H -9.376 6.654 -4.763 1.00 . A A . 22 LYS HZ1 1 1 4 1571 1 1 22 LYS HZ2 H -7.804 6.093 -5.071 1.00 . A A . 22 LYS HZ2 1 1 4 1572 1 1 22 LYS HZ3 H -8.898 6.300 -6.353 1.00 . A A . 22 LYS HZ3 1 1 4 1573 1 1 22 LYS N N -6.265 4.297 -0.648 1.00 . A A . 22 LYS N 1 1 4 1574 1 1 22 LYS NZ N -8.801 6.023 -5.356 1.00 . A A . 22 LYS NZ 1 1 4 1575 1 1 22 LYS O O -5.727 2.512 -3.672 1.00 . A A . 22 LYS O 1 1 4 1576 1 1 23 VAL C C -1.862 2.205 -2.049 1.00 . A A . 23 VAL C 1 1 4 1577 1 1 23 VAL CA C -3.004 2.701 -2.960 1.00 . A A . 23 VAL CA 1 1 4 1578 1 1 23 VAL CB C -2.708 4.074 -3.660 1.00 . A A . 23 VAL CB 1 1 4 1579 1 1 23 VAL CG1 C -1.423 4.761 -3.152 1.00 . A A . 23 VAL CG1 1 1 4 1580 1 1 23 VAL CG2 C -2.617 3.845 -5.182 1.00 . A A . 23 VAL CG2 1 1 4 1581 1 1 23 VAL H H -4.029 3.159 -1.170 1.00 . A A . 23 VAL H 1 1 4 1582 1 1 23 VAL HA H -3.236 1.928 -3.666 1.00 . A A . 23 VAL HA 1 1 4 1583 1 1 23 VAL HB H -3.535 4.738 -3.461 1.00 . A A . 23 VAL HB 1 1 4 1584 1 1 23 VAL HG11 H -0.597 4.071 -3.190 1.00 . A A . 23 VAL HG11 1 1 4 1585 1 1 23 VAL HG12 H -1.191 5.622 -3.761 1.00 . A A . 23 VAL HG12 1 1 4 1586 1 1 23 VAL HG13 H -1.543 5.087 -2.132 1.00 . A A . 23 VAL HG13 1 1 4 1587 1 1 23 VAL HG21 H -1.882 3.086 -5.402 1.00 . A A . 23 VAL HG21 1 1 4 1588 1 1 23 VAL HG22 H -3.573 3.516 -5.563 1.00 . A A . 23 VAL HG22 1 1 4 1589 1 1 23 VAL HG23 H -2.339 4.761 -5.684 1.00 . A A . 23 VAL HG23 1 1 4 1590 1 1 23 VAL N N -4.196 2.912 -2.095 1.00 . A A . 23 VAL N 1 1 4 1591 1 1 23 VAL O O -1.694 2.738 -0.968 1.00 . A A . 23 VAL O 1 1 4 1592 1 1 24 CYS C C 1.322 1.441 -1.977 1.00 . A A . 24 CYS C 1 1 4 1593 1 1 24 CYS CA C 0.017 0.702 -1.628 1.00 . A A . 24 CYS CA 1 1 4 1594 1 1 24 CYS CB C 0.202 -0.815 -1.870 1.00 . A A . 24 CYS CB 1 1 4 1595 1 1 24 CYS H H -1.279 0.820 -3.367 1.00 . A A . 24 CYS H 1 1 4 1596 1 1 24 CYS HA H -0.212 0.866 -0.587 1.00 . A A . 24 CYS HA 1 1 4 1597 1 1 24 CYS HB2 H -0.696 -1.331 -1.561 1.00 . A A . 24 CYS HB2 1 1 4 1598 1 1 24 CYS HB3 H 0.336 -0.985 -2.929 1.00 . A A . 24 CYS HB3 1 1 4 1599 1 1 24 CYS N N -1.110 1.219 -2.484 1.00 . A A . 24 CYS N 1 1 4 1600 1 1 24 CYS O O 2.324 0.830 -2.293 1.00 . A A . 24 CYS O 1 1 4 1601 1 1 24 CYS SG S 1.605 -1.578 -1.015 1.00 . A A . 24 CYS SG 1 1 4 1602 1 1 25 TYR C C 3.063 4.227 -0.966 1.00 . A A . 25 TYR C 1 1 4 1603 1 1 25 TYR CA C 2.477 3.590 -2.227 1.00 . A A . 25 TYR CA 1 1 4 1604 1 1 25 TYR CB C 2.078 4.709 -3.194 1.00 . A A . 25 TYR CB 1 1 4 1605 1 1 25 TYR CD1 C 1.433 2.867 -4.892 1.00 . A A . 25 TYR CD1 1 1 4 1606 1 1 25 TYR CD2 C 0.901 5.130 -5.374 1.00 . A A . 25 TYR CD2 1 1 4 1607 1 1 25 TYR CE1 C 0.859 2.480 -6.078 1.00 . A A . 25 TYR CE1 1 1 4 1608 1 1 25 TYR CE2 C 0.327 4.740 -6.562 1.00 . A A . 25 TYR CE2 1 1 4 1609 1 1 25 TYR CG C 1.462 4.203 -4.518 1.00 . A A . 25 TYR CG 1 1 4 1610 1 1 25 TYR CZ C 0.301 3.410 -6.925 1.00 . A A . 25 TYR CZ 1 1 4 1611 1 1 25 TYR H H 0.448 3.190 -1.636 1.00 . A A . 25 TYR H 1 1 4 1612 1 1 25 TYR HA H 3.238 2.983 -2.700 1.00 . A A . 25 TYR HA 1 1 4 1613 1 1 25 TYR HB2 H 1.366 5.355 -2.704 1.00 . A A . 25 TYR HB2 1 1 4 1614 1 1 25 TYR HB3 H 2.943 5.302 -3.421 1.00 . A A . 25 TYR HB3 1 1 4 1615 1 1 25 TYR HD1 H 1.865 2.106 -4.265 1.00 . A A . 25 TYR HD1 1 1 4 1616 1 1 25 TYR HD2 H 0.912 6.177 -5.110 1.00 . A A . 25 TYR HD2 1 1 4 1617 1 1 25 TYR HE1 H 0.852 1.436 -6.338 1.00 . A A . 25 TYR HE1 1 1 4 1618 1 1 25 TYR HE2 H -0.106 5.489 -7.208 1.00 . A A . 25 TYR HE2 1 1 4 1619 1 1 25 TYR HH H -1.022 2.445 -7.904 1.00 . A A . 25 TYR HH 1 1 4 1620 1 1 25 TYR N N 1.277 2.748 -1.906 1.00 . A A . 25 TYR N 1 1 4 1621 1 1 25 TYR O O 2.406 4.319 0.051 1.00 . A A . 25 TYR O 1 1 4 1622 1 1 25 TYR OH O -0.276 3.011 -8.113 1.00 . A A . 25 TYR OH 1 1 4 1623 1 1 26 ARG C C 4.694 6.814 0.027 1.00 . A A . 26 ARG C 1 1 4 1624 1 1 26 ARG CA C 4.981 5.304 0.083 1.00 . A A . 26 ARG CA 1 1 4 1625 1 1 26 ARG CB C 6.502 5.026 -0.017 1.00 . A A . 26 ARG CB 1 1 4 1626 1 1 26 ARG CD C 8.459 5.919 1.340 1.00 . A A . 26 ARG CD 1 1 4 1627 1 1 26 ARG CG C 7.138 5.122 1.397 1.00 . A A . 26 ARG CG 1 1 4 1628 1 1 26 ARG CZ C 10.121 4.137 1.651 1.00 . A A . 26 ARG CZ 1 1 4 1629 1 1 26 ARG H H 4.761 4.558 -1.934 1.00 . A A . 26 ARG H 1 1 4 1630 1 1 26 ARG HA H 4.577 4.905 1.004 1.00 . A A . 26 ARG HA 1 1 4 1631 1 1 26 ARG HB2 H 6.667 4.038 -0.417 1.00 . A A . 26 ARG HB2 1 1 4 1632 1 1 26 ARG HB3 H 6.958 5.735 -0.692 1.00 . A A . 26 ARG HB3 1 1 4 1633 1 1 26 ARG HD2 H 8.375 6.753 0.660 1.00 . A A . 26 ARG HD2 1 1 4 1634 1 1 26 ARG HD3 H 8.713 6.299 2.319 1.00 . A A . 26 ARG HD3 1 1 4 1635 1 1 26 ARG HE H 9.855 5.087 -0.068 1.00 . A A . 26 ARG HE 1 1 4 1636 1 1 26 ARG HG2 H 6.468 5.618 2.084 1.00 . A A . 26 ARG HG2 1 1 4 1637 1 1 26 ARG HG3 H 7.329 4.128 1.774 1.00 . A A . 26 ARG HG3 1 1 4 1638 1 1 26 ARG HH11 H 9.011 4.591 3.258 1.00 . A A . 26 ARG HH11 1 1 4 1639 1 1 26 ARG HH12 H 10.182 3.338 3.486 1.00 . A A . 26 ARG HH12 1 1 4 1640 1 1 26 ARG HH21 H 11.346 3.504 0.200 1.00 . A A . 26 ARG HH21 1 1 4 1641 1 1 26 ARG HH22 H 11.524 2.712 1.731 1.00 . A A . 26 ARG HH22 1 1 4 1642 1 1 26 ARG N N 4.293 4.659 -1.079 1.00 . A A . 26 ARG N 1 1 4 1643 1 1 26 ARG NE N 9.554 5.017 0.862 1.00 . A A . 26 ARG NE 1 1 4 1644 1 1 26 ARG NH1 N 9.741 4.013 2.895 1.00 . A A . 26 ARG NH1 1 1 4 1645 1 1 26 ARG NH2 N 11.071 3.392 1.155 1.00 . A A . 26 ARG NH2 1 1 4 1646 1 1 26 ARG O O 5.557 7.639 0.261 1.00 . A A . 26 ARG O 1 1 4 1647 1 1 27 ASN C C 3.826 9.317 -1.393 1.00 . A A . 27 ASN C 1 1 4 1648 1 1 27 ASN CA C 2.967 8.517 -0.400 1.00 . A A . 27 ASN CA 1 1 4 1649 1 1 27 ASN CB C 3.003 9.151 1.019 1.00 . A A . 27 ASN CB 1 1 4 1650 1 1 27 ASN CG C 1.909 10.220 1.126 1.00 . A A . 27 ASN CG 1 1 4 1651 1 1 27 ASN H H 2.823 6.383 -0.457 1.00 . A A . 27 ASN H 1 1 4 1652 1 1 27 ASN HA H 1.960 8.483 -0.786 1.00 . A A . 27 ASN HA 1 1 4 1653 1 1 27 ASN HB2 H 2.819 8.396 1.771 1.00 . A A . 27 ASN HB2 1 1 4 1654 1 1 27 ASN HB3 H 3.962 9.609 1.217 1.00 . A A . 27 ASN HB3 1 1 4 1655 1 1 27 ASN HD21 H 0.521 8.919 1.698 1.00 . A A . 27 ASN HD21 1 1 4 1656 1 1 27 ASN HD22 H -0.003 10.530 1.568 1.00 . A A . 27 ASN HD22 1 1 4 1657 1 1 27 ASN N N 3.455 7.110 -0.288 1.00 . A A . 27 ASN N 1 1 4 1658 1 1 27 ASN ND2 N 0.709 9.860 1.495 1.00 . A A . 27 ASN ND2 1 1 4 1659 1 1 27 ASN O O 4.094 10.488 -1.198 1.00 . A A . 27 ASN O 1 1 4 1660 1 1 27 ASN OD1 O 2.135 11.387 0.876 1.00 . A A . 27 ASN OD1 1 1 4 1661 1 1 28 GLY C C 5.620 8.317 -4.535 1.00 . A A . 28 GLY C 1 1 4 1662 1 1 28 GLY CA C 5.067 9.289 -3.483 1.00 . A A . 28 GLY CA 1 1 4 1663 1 1 28 GLY H H 3.976 7.703 -2.542 1.00 . A A . 28 GLY H 1 1 4 1664 1 1 28 GLY HA2 H 4.471 10.038 -3.978 1.00 . A A . 28 GLY HA2 1 1 4 1665 1 1 28 GLY HA3 H 5.899 9.761 -2.990 1.00 . A A . 28 GLY HA3 1 1 4 1666 1 1 28 GLY N N 4.228 8.640 -2.440 1.00 . A A . 28 GLY N 1 1 4 1667 1 1 28 GLY O O 5.867 8.732 -5.652 1.00 . A A . 28 GLY O 1 1 4 1668 1 1 29 ILE C C 5.351 4.887 -5.338 1.00 . A A . 29 ILE C 1 1 4 1669 1 1 29 ILE CA C 6.343 6.058 -5.131 1.00 . A A . 29 ILE CA 1 1 4 1670 1 1 29 ILE CB C 7.710 5.563 -4.567 1.00 . A A . 29 ILE CB 1 1 4 1671 1 1 29 ILE CD1 C 10.008 4.723 -5.270 1.00 . A A . 29 ILE CD1 1 1 4 1672 1 1 29 ILE CG1 C 8.550 4.938 -5.720 1.00 . A A . 29 ILE CG1 1 1 4 1673 1 1 29 ILE CG2 C 7.531 4.538 -3.425 1.00 . A A . 29 ILE CG2 1 1 4 1674 1 1 29 ILE H H 5.584 6.788 -3.257 1.00 . A A . 29 ILE H 1 1 4 1675 1 1 29 ILE HA H 6.536 6.547 -6.071 1.00 . A A . 29 ILE HA 1 1 4 1676 1 1 29 ILE HB H 8.220 6.426 -4.165 1.00 . A A . 29 ILE HB 1 1 4 1677 1 1 29 ILE HD11 H 10.397 5.618 -4.806 1.00 . A A . 29 ILE HD11 1 1 4 1678 1 1 29 ILE HD12 H 10.068 3.908 -4.564 1.00 . A A . 29 ILE HD12 1 1 4 1679 1 1 29 ILE HD13 H 10.622 4.483 -6.126 1.00 . A A . 29 ILE HD13 1 1 4 1680 1 1 29 ILE HG12 H 8.122 3.992 -6.022 1.00 . A A . 29 ILE HG12 1 1 4 1681 1 1 29 ILE HG13 H 8.545 5.600 -6.573 1.00 . A A . 29 ILE HG13 1 1 4 1682 1 1 29 ILE HG21 H 6.724 4.841 -2.774 1.00 . A A . 29 ILE HG21 1 1 4 1683 1 1 29 ILE HG22 H 7.307 3.560 -3.828 1.00 . A A . 29 ILE HG22 1 1 4 1684 1 1 29 ILE HG23 H 8.439 4.475 -2.846 1.00 . A A . 29 ILE HG23 1 1 4 1685 1 1 29 ILE N N 5.802 7.070 -4.168 1.00 . A A . 29 ILE N 1 1 4 1686 1 1 29 ILE O O 4.884 4.314 -4.372 1.00 . A A . 29 ILE O 1 1 4 1687 1 1 30 PRO C C 4.834 2.064 -6.721 1.00 . A A . 30 PRO C 1 1 4 1688 1 1 30 PRO CA C 4.139 3.420 -6.890 1.00 . A A . 30 PRO CA 1 1 4 1689 1 1 30 PRO CB C 3.671 3.651 -8.322 1.00 . A A . 30 PRO CB 1 1 4 1690 1 1 30 PRO CD C 5.527 5.234 -7.810 1.00 . A A . 30 PRO CD 1 1 4 1691 1 1 30 PRO CG C 4.642 4.672 -8.942 1.00 . A A . 30 PRO CG 1 1 4 1692 1 1 30 PRO HA H 3.300 3.469 -6.221 1.00 . A A . 30 PRO HA 1 1 4 1693 1 1 30 PRO HB2 H 3.680 2.732 -8.890 1.00 . A A . 30 PRO HB2 1 1 4 1694 1 1 30 PRO HB3 H 2.664 4.037 -8.312 1.00 . A A . 30 PRO HB3 1 1 4 1695 1 1 30 PRO HD2 H 6.571 5.002 -7.959 1.00 . A A . 30 PRO HD2 1 1 4 1696 1 1 30 PRO HD3 H 5.387 6.302 -7.718 1.00 . A A . 30 PRO HD3 1 1 4 1697 1 1 30 PRO HG2 H 5.256 4.192 -9.690 1.00 . A A . 30 PRO HG2 1 1 4 1698 1 1 30 PRO HG3 H 4.086 5.473 -9.410 1.00 . A A . 30 PRO HG3 1 1 4 1699 1 1 30 PRO N N 5.044 4.554 -6.574 1.00 . A A . 30 PRO N 1 1 4 1700 1 1 30 PRO O O 5.657 1.688 -7.533 1.00 . A A . 30 PRO O 1 1 5 1701 1 1 1 CYS C C 4.026 -1.236 -5.825 1.00 . A A . 1 CYS C 1 1 5 1702 1 1 1 CYS CA C 4.897 -0.137 -5.205 1.00 . A A . 1 CYS CA 1 1 5 1703 1 1 1 CYS CB C 4.863 -0.269 -3.676 1.00 . A A . 1 CYS CB 1 1 5 1704 1 1 1 CYS HA H 5.909 -0.223 -5.574 1.00 . A A . 1 CYS HA 1 1 5 1705 1 1 1 CYS HB2 H 4.129 0.430 -3.317 1.00 . A A . 1 CYS HB2 1 1 5 1706 1 1 1 CYS HB3 H 4.519 -1.258 -3.407 1.00 . A A . 1 CYS HB3 1 1 5 1707 1 1 1 CYS N N 4.309 1.174 -5.628 1.00 . A A . 1 CYS N 1 1 5 1708 1 1 1 CYS O O 4.534 -2.153 -6.441 1.00 . A A . 1 CYS O 1 1 5 1709 1 1 1 CYS SG S 6.377 0.035 -2.733 1.00 . A A . 1 CYS SG 1 1 5 1710 1 1 2 GLY C C 0.528 -1.343 -6.682 1.00 . A A . 2 GLY C 1 1 5 1711 1 1 2 GLY CA C 1.765 -2.082 -6.178 1.00 . A A . 2 GLY CA 1 1 5 1712 1 1 2 GLY H H 2.383 -0.332 -5.129 1.00 . A A . 2 GLY H 1 1 5 1713 1 1 2 GLY HA2 H 2.209 -2.624 -7.000 1.00 . A A . 2 GLY HA2 1 1 5 1714 1 1 2 GLY HA3 H 1.482 -2.771 -5.396 1.00 . A A . 2 GLY HA3 1 1 5 1715 1 1 2 GLY N N 2.735 -1.095 -5.636 1.00 . A A . 2 GLY N 1 1 5 1716 1 1 2 GLY O O 0.477 -0.957 -7.835 1.00 . A A . 2 GLY O 1 1 5 1717 1 1 3 GLU C C -2.698 -0.475 -4.948 1.00 . A A . 3 GLU C 1 1 5 1718 1 1 3 GLU CA C -1.704 -0.464 -6.124 1.00 . A A . 3 GLU CA 1 1 5 1719 1 1 3 GLU CB C -2.370 -1.154 -7.338 1.00 . A A . 3 GLU CB 1 1 5 1720 1 1 3 GLU CD C -3.934 -0.707 -9.247 1.00 . A A . 3 GLU CD 1 1 5 1721 1 1 3 GLU CG C -2.837 -0.095 -8.360 1.00 . A A . 3 GLU CG 1 1 5 1722 1 1 3 GLU H H -0.271 -1.495 -4.886 1.00 . A A . 3 GLU H 1 1 5 1723 1 1 3 GLU HA H -1.473 0.563 -6.345 1.00 . A A . 3 GLU HA 1 1 5 1724 1 1 3 GLU HB2 H -1.663 -1.817 -7.797 1.00 . A A . 3 GLU HB2 1 1 5 1725 1 1 3 GLU HB3 H -3.197 -1.759 -7.003 1.00 . A A . 3 GLU HB3 1 1 5 1726 1 1 3 GLU HG2 H -3.233 0.778 -7.860 1.00 . A A . 3 GLU HG2 1 1 5 1727 1 1 3 GLU HG3 H -2.007 0.213 -8.981 1.00 . A A . 3 GLU HG3 1 1 5 1728 1 1 3 GLU N N -0.419 -1.166 -5.793 1.00 . A A . 3 GLU N 1 1 5 1729 1 1 3 GLU O O -2.340 -0.734 -3.817 1.00 . A A . 3 GLU O 1 1 5 1730 1 1 3 GLU OE1 O -3.560 -1.294 -10.248 1.00 . A A . 3 GLU OE1 1 1 5 1731 1 1 3 GLU OE2 O -5.086 -0.553 -8.872 1.00 . A A . 3 GLU OE2 1 1 5 1732 1 1 4 SER C C -5.099 -1.382 -3.363 1.00 . A A . 4 SER C 1 1 5 1733 1 1 4 SER CA C -5.033 -0.149 -4.268 1.00 . A A . 4 SER CA 1 1 5 1734 1 1 4 SER CB C -6.426 0.003 -4.969 1.00 . A A . 4 SER CB 1 1 5 1735 1 1 4 SER H H -4.138 0.007 -6.212 1.00 . A A . 4 SER H 1 1 5 1736 1 1 4 SER HA H -4.840 0.699 -3.640 1.00 . A A . 4 SER HA 1 1 5 1737 1 1 4 SER HB2 H -7.061 -0.849 -4.773 1.00 . A A . 4 SER HB2 1 1 5 1738 1 1 4 SER HB3 H -6.932 0.898 -4.645 1.00 . A A . 4 SER HB3 1 1 5 1739 1 1 4 SER HG H -5.842 -0.753 -6.665 1.00 . A A . 4 SER HG 1 1 5 1740 1 1 4 SER N N -3.933 -0.188 -5.276 1.00 . A A . 4 SER N 1 1 5 1741 1 1 4 SER O O -5.088 -2.511 -3.814 1.00 . A A . 4 SER O 1 1 5 1742 1 1 4 SER OG O -6.191 0.090 -6.367 1.00 . A A . 4 SER OG 1 1 5 1743 1 1 5 CYS C C -6.688 -2.212 -0.523 1.00 . A A . 5 CYS C 1 1 5 1744 1 1 5 CYS CA C -5.238 -2.107 -1.020 1.00 . A A . 5 CYS CA 1 1 5 1745 1 1 5 CYS CB C -4.274 -1.667 0.096 1.00 . A A . 5 CYS CB 1 1 5 1746 1 1 5 CYS H H -5.161 -0.137 -1.840 1.00 . A A . 5 CYS H 1 1 5 1747 1 1 5 CYS HA H -4.947 -3.049 -1.439 1.00 . A A . 5 CYS HA 1 1 5 1748 1 1 5 CYS HB2 H -4.593 -2.098 1.032 1.00 . A A . 5 CYS HB2 1 1 5 1749 1 1 5 CYS HB3 H -3.301 -2.073 -0.123 1.00 . A A . 5 CYS HB3 1 1 5 1750 1 1 5 CYS N N -5.163 -1.078 -2.093 1.00 . A A . 5 CYS N 1 1 5 1751 1 1 5 CYS O O -6.954 -2.454 0.640 1.00 . A A . 5 CYS O 1 1 5 1752 1 1 5 CYS SG S -4.083 0.113 0.364 1.00 . A A . 5 CYS SG 1 1 5 1753 1 1 6 VAL C C -9.491 -3.549 -0.984 1.00 . A A . 6 VAL C 1 1 5 1754 1 1 6 VAL CA C -9.047 -2.088 -1.157 1.00 . A A . 6 VAL CA 1 1 5 1755 1 1 6 VAL CB C -9.815 -1.409 -2.328 1.00 . A A . 6 VAL CB 1 1 5 1756 1 1 6 VAL CG1 C -11.336 -1.419 -2.041 1.00 . A A . 6 VAL CG1 1 1 5 1757 1 1 6 VAL CG2 C -9.344 0.054 -2.470 1.00 . A A . 6 VAL CG2 1 1 5 1758 1 1 6 VAL H H -7.283 -1.844 -2.370 1.00 . A A . 6 VAL H 1 1 5 1759 1 1 6 VAL HA H -9.238 -1.548 -0.243 1.00 . A A . 6 VAL HA 1 1 5 1760 1 1 6 VAL HB H -9.619 -1.934 -3.252 1.00 . A A . 6 VAL HB 1 1 5 1761 1 1 6 VAL HG11 H -11.540 -1.006 -1.064 1.00 . A A . 6 VAL HG11 1 1 5 1762 1 1 6 VAL HG12 H -11.860 -0.834 -2.782 1.00 . A A . 6 VAL HG12 1 1 5 1763 1 1 6 VAL HG13 H -11.713 -2.431 -2.075 1.00 . A A . 6 VAL HG13 1 1 5 1764 1 1 6 VAL HG21 H -9.502 0.593 -1.547 1.00 . A A . 6 VAL HG21 1 1 5 1765 1 1 6 VAL HG22 H -8.292 0.084 -2.712 1.00 . A A . 6 VAL HG22 1 1 5 1766 1 1 6 VAL HG23 H -9.891 0.548 -3.260 1.00 . A A . 6 VAL HG23 1 1 5 1767 1 1 6 VAL N N -7.585 -2.026 -1.456 1.00 . A A . 6 VAL N 1 1 5 1768 1 1 6 VAL O O -9.857 -3.963 0.099 1.00 . A A . 6 VAL O 1 1 5 1769 1 1 7 TRP C C -8.868 -6.580 -1.261 1.00 . A A . 7 TRP C 1 1 5 1770 1 1 7 TRP CA C -9.838 -5.712 -2.072 1.00 . A A . 7 TRP CA 1 1 5 1771 1 1 7 TRP CB C -9.880 -6.195 -3.522 1.00 . A A . 7 TRP CB 1 1 5 1772 1 1 7 TRP CD1 C -12.135 -7.447 -3.666 1.00 . A A . 7 TRP CD1 1 1 5 1773 1 1 7 TRP CD2 C -10.333 -8.736 -3.625 1.00 . A A . 7 TRP CD2 1 1 5 1774 1 1 7 TRP CE2 C -11.446 -9.572 -3.698 1.00 . A A . 7 TRP CE2 1 1 5 1775 1 1 7 TRP CE3 C -9.054 -9.287 -3.585 1.00 . A A . 7 TRP CE3 1 1 5 1776 1 1 7 TRP CG C -10.769 -7.445 -3.606 1.00 . A A . 7 TRP CG 1 1 5 1777 1 1 7 TRP CH2 C -10.000 -11.503 -3.688 1.00 . A A . 7 TRP CH2 1 1 5 1778 1 1 7 TRP CZ2 C -11.281 -10.954 -3.728 1.00 . A A . 7 TRP CZ2 1 1 5 1779 1 1 7 TRP CZ3 C -8.887 -10.669 -3.617 1.00 . A A . 7 TRP CZ3 1 1 5 1780 1 1 7 TRP H H -9.133 -3.876 -2.906 1.00 . A A . 7 TRP H 1 1 5 1781 1 1 7 TRP HA H -10.821 -5.777 -1.634 1.00 . A A . 7 TRP HA 1 1 5 1782 1 1 7 TRP HB2 H -10.289 -5.422 -4.154 1.00 . A A . 7 TRP HB2 1 1 5 1783 1 1 7 TRP HB3 H -8.887 -6.434 -3.872 1.00 . A A . 7 TRP HB3 1 1 5 1784 1 1 7 TRP HD1 H -12.801 -6.599 -3.670 1.00 . A A . 7 TRP HD1 1 1 5 1785 1 1 7 TRP HE1 H -13.381 -9.021 -3.765 1.00 . A A . 7 TRP HE1 1 1 5 1786 1 1 7 TRP HE3 H -8.192 -8.641 -3.532 1.00 . A A . 7 TRP HE3 1 1 5 1787 1 1 7 TRP HH2 H -9.872 -12.575 -3.713 1.00 . A A . 7 TRP HH2 1 1 5 1788 1 1 7 TRP HZ2 H -12.144 -11.600 -3.784 1.00 . A A . 7 TRP HZ2 1 1 5 1789 1 1 7 TRP HZ3 H -7.894 -11.094 -3.586 1.00 . A A . 7 TRP HZ3 1 1 5 1790 1 1 7 TRP N N -9.439 -4.277 -2.070 1.00 . A A . 7 TRP N 1 1 5 1791 1 1 7 TRP NE1 N -12.450 -8.720 -3.716 1.00 . A A . 7 TRP NE1 1 1 5 1792 1 1 7 TRP O O -9.282 -7.465 -0.538 1.00 . A A . 7 TRP O 1 1 5 1793 1 1 8 ILE C C -5.345 -6.088 -0.401 1.00 . A A . 8 ILE C 1 1 5 1794 1 1 8 ILE CA C -6.532 -7.034 -0.706 1.00 . A A . 8 ILE CA 1 1 5 1795 1 1 8 ILE CB C -6.085 -8.237 -1.606 1.00 . A A . 8 ILE CB 1 1 5 1796 1 1 8 ILE CD1 C -5.611 -10.086 0.065 1.00 . A A . 8 ILE CD1 1 1 5 1797 1 1 8 ILE CG1 C -4.974 -9.075 -0.904 1.00 . A A . 8 ILE CG1 1 1 5 1798 1 1 8 ILE CG2 C -5.569 -7.750 -2.988 1.00 . A A . 8 ILE CG2 1 1 5 1799 1 1 8 ILE H H -7.359 -5.557 -2.024 1.00 . A A . 8 ILE H 1 1 5 1800 1 1 8 ILE HA H -6.956 -7.401 0.207 1.00 . A A . 8 ILE HA 1 1 5 1801 1 1 8 ILE HB H -6.944 -8.872 -1.770 1.00 . A A . 8 ILE HB 1 1 5 1802 1 1 8 ILE HD11 H -6.276 -9.588 0.755 1.00 . A A . 8 ILE HD11 1 1 5 1803 1 1 8 ILE HD12 H -6.172 -10.826 -0.487 1.00 . A A . 8 ILE HD12 1 1 5 1804 1 1 8 ILE HD13 H -4.837 -10.585 0.628 1.00 . A A . 8 ILE HD13 1 1 5 1805 1 1 8 ILE HG12 H -4.405 -9.618 -1.645 1.00 . A A . 8 ILE HG12 1 1 5 1806 1 1 8 ILE HG13 H -4.294 -8.437 -0.362 1.00 . A A . 8 ILE HG13 1 1 5 1807 1 1 8 ILE HG21 H -6.138 -6.901 -3.338 1.00 . A A . 8 ILE HG21 1 1 5 1808 1 1 8 ILE HG22 H -4.529 -7.466 -2.926 1.00 . A A . 8 ILE HG22 1 1 5 1809 1 1 8 ILE HG23 H -5.665 -8.545 -3.713 1.00 . A A . 8 ILE HG23 1 1 5 1810 1 1 8 ILE N N -7.603 -6.285 -1.422 1.00 . A A . 8 ILE N 1 1 5 1811 1 1 8 ILE O O -4.832 -5.464 -1.309 1.00 . A A . 8 ILE O 1 1 5 1812 1 1 9 PRO C C -2.442 -5.788 0.783 1.00 . A A . 9 PRO C 1 1 5 1813 1 1 9 PRO CA C -3.765 -5.163 1.249 1.00 . A A . 9 PRO CA 1 1 5 1814 1 1 9 PRO CB C -3.840 -5.048 2.767 1.00 . A A . 9 PRO CB 1 1 5 1815 1 1 9 PRO CD C -5.552 -6.690 2.022 1.00 . A A . 9 PRO CD 1 1 5 1816 1 1 9 PRO CG C -4.785 -6.161 3.247 1.00 . A A . 9 PRO CG 1 1 5 1817 1 1 9 PRO HA H -3.869 -4.188 0.800 1.00 . A A . 9 PRO HA 1 1 5 1818 1 1 9 PRO HB2 H -2.864 -5.165 3.216 1.00 . A A . 9 PRO HB2 1 1 5 1819 1 1 9 PRO HB3 H -4.236 -4.081 3.044 1.00 . A A . 9 PRO HB3 1 1 5 1820 1 1 9 PRO HD2 H -5.432 -7.757 1.919 1.00 . A A . 9 PRO HD2 1 1 5 1821 1 1 9 PRO HD3 H -6.599 -6.432 2.086 1.00 . A A . 9 PRO HD3 1 1 5 1822 1 1 9 PRO HG2 H -4.215 -6.960 3.698 1.00 . A A . 9 PRO HG2 1 1 5 1823 1 1 9 PRO HG3 H -5.477 -5.770 3.978 1.00 . A A . 9 PRO HG3 1 1 5 1824 1 1 9 PRO N N -4.934 -5.999 0.848 1.00 . A A . 9 PRO N 1 1 5 1825 1 1 9 PRO O O -2.320 -6.993 0.671 1.00 . A A . 9 PRO O 1 1 5 1826 1 1 10 CYS C C 0.646 -5.999 1.220 1.00 . A A . 10 CYS C 1 1 5 1827 1 1 10 CYS CA C -0.138 -5.358 0.066 1.00 . A A . 10 CYS CA 1 1 5 1828 1 1 10 CYS CB C 0.617 -4.132 -0.455 1.00 . A A . 10 CYS CB 1 1 5 1829 1 1 10 CYS H H -1.679 -3.969 0.645 1.00 . A A . 10 CYS H 1 1 5 1830 1 1 10 CYS HA H -0.255 -6.084 -0.727 1.00 . A A . 10 CYS HA 1 1 5 1831 1 1 10 CYS HB2 H 1.679 -4.293 -0.342 1.00 . A A . 10 CYS HB2 1 1 5 1832 1 1 10 CYS HB3 H 0.417 -4.036 -1.512 1.00 . A A . 10 CYS HB3 1 1 5 1833 1 1 10 CYS N N -1.494 -4.923 0.529 1.00 . A A . 10 CYS N 1 1 5 1834 1 1 10 CYS O O 0.402 -5.705 2.375 1.00 . A A . 10 CYS O 1 1 5 1835 1 1 10 CYS SG S 0.201 -2.552 0.324 1.00 . A A . 10 CYS SG 1 1 5 1836 1 1 11 ILE C C 3.878 -7.164 1.624 1.00 . A A . 11 ILE C 1 1 5 1837 1 1 11 ILE CA C 2.418 -7.568 1.861 1.00 . A A . 11 ILE CA 1 1 5 1838 1 1 11 ILE CB C 2.241 -9.087 1.686 1.00 . A A . 11 ILE CB 1 1 5 1839 1 1 11 ILE CD1 C 0.501 -10.900 1.297 1.00 . A A . 11 ILE CD1 1 1 5 1840 1 1 11 ILE CG1 C 0.734 -9.466 1.809 1.00 . A A . 11 ILE CG1 1 1 5 1841 1 1 11 ILE CG2 C 3.055 -9.836 2.774 1.00 . A A . 11 ILE CG2 1 1 5 1842 1 1 11 ILE H H 1.699 -7.040 -0.097 1.00 . A A . 11 ILE H 1 1 5 1843 1 1 11 ILE HA H 2.130 -7.299 2.857 1.00 . A A . 11 ILE HA 1 1 5 1844 1 1 11 ILE HB H 2.612 -9.339 0.712 1.00 . A A . 11 ILE HB 1 1 5 1845 1 1 11 ILE HD11 H 1.069 -11.082 0.397 1.00 . A A . 11 ILE HD11 1 1 5 1846 1 1 11 ILE HD12 H 0.795 -11.617 2.049 1.00 . A A . 11 ILE HD12 1 1 5 1847 1 1 11 ILE HD13 H -0.547 -11.041 1.078 1.00 . A A . 11 ILE HD13 1 1 5 1848 1 1 11 ILE HG12 H 0.417 -9.394 2.840 1.00 . A A . 11 ILE HG12 1 1 5 1849 1 1 11 ILE HG13 H 0.129 -8.792 1.221 1.00 . A A . 11 ILE HG13 1 1 5 1850 1 1 11 ILE HG21 H 2.730 -9.536 3.760 1.00 . A A . 11 ILE HG21 1 1 5 1851 1 1 11 ILE HG22 H 2.920 -10.903 2.676 1.00 . A A . 11 ILE HG22 1 1 5 1852 1 1 11 ILE HG23 H 4.107 -9.617 2.675 1.00 . A A . 11 ILE HG23 1 1 5 1853 1 1 11 ILE N N 1.565 -6.857 0.856 1.00 . A A . 11 ILE N 1 1 5 1854 1 1 11 ILE O O 4.582 -6.800 2.546 1.00 . A A . 11 ILE O 1 1 5 1855 1 1 12 SER C C 5.955 -5.411 0.268 1.00 . A A . 12 SER C 1 1 5 1856 1 1 12 SER CA C 5.666 -6.889 -0.024 1.00 . A A . 12 SER CA 1 1 5 1857 1 1 12 SER CB C 5.817 -7.169 -1.521 1.00 . A A . 12 SER CB 1 1 5 1858 1 1 12 SER H H 3.655 -7.550 -0.309 1.00 . A A . 12 SER H 1 1 5 1859 1 1 12 SER HA H 6.348 -7.504 0.541 1.00 . A A . 12 SER HA 1 1 5 1860 1 1 12 SER HB2 H 5.004 -6.745 -2.093 1.00 . A A . 12 SER HB2 1 1 5 1861 1 1 12 SER HB3 H 6.762 -6.812 -1.897 1.00 . A A . 12 SER HB3 1 1 5 1862 1 1 12 SER HG H 6.543 -8.939 -1.166 1.00 . A A . 12 SER HG 1 1 5 1863 1 1 12 SER N N 4.277 -7.246 0.380 1.00 . A A . 12 SER N 1 1 5 1864 1 1 12 SER O O 7.020 -5.068 0.745 1.00 . A A . 12 SER O 1 1 5 1865 1 1 12 SER OG O 5.771 -8.586 -1.615 1.00 . A A . 12 SER OG 1 1 5 1866 1 1 13 ALA C C 5.436 -2.773 1.648 1.00 . A A . 13 ALA C 1 1 5 1867 1 1 13 ALA CA C 5.096 -3.117 0.191 1.00 . A A . 13 ALA CA 1 1 5 1868 1 1 13 ALA CB C 3.770 -2.448 -0.194 1.00 . A A . 13 ALA CB 1 1 5 1869 1 1 13 ALA H H 4.153 -4.948 -0.414 1.00 . A A . 13 ALA H 1 1 5 1870 1 1 13 ALA HA H 5.882 -2.747 -0.448 1.00 . A A . 13 ALA HA 1 1 5 1871 1 1 13 ALA HB1 H 3.439 -2.807 -1.158 1.00 . A A . 13 ALA HB1 1 1 5 1872 1 1 13 ALA HB2 H 3.012 -2.668 0.543 1.00 . A A . 13 ALA HB2 1 1 5 1873 1 1 13 ALA HB3 H 3.900 -1.377 -0.249 1.00 . A A . 13 ALA HB3 1 1 5 1874 1 1 13 ALA N N 4.978 -4.589 -0.032 1.00 . A A . 13 ALA N 1 1 5 1875 1 1 13 ALA O O 5.991 -1.724 1.904 1.00 . A A . 13 ALA O 1 1 5 1876 1 1 14 ALA C C 6.843 -3.042 4.220 1.00 . A A . 14 ALA C 1 1 5 1877 1 1 14 ALA CA C 5.375 -3.442 4.010 1.00 . A A . 14 ALA CA 1 1 5 1878 1 1 14 ALA CB C 5.074 -4.736 4.776 1.00 . A A . 14 ALA CB 1 1 5 1879 1 1 14 ALA H H 4.649 -4.488 2.268 1.00 . A A . 14 ALA H 1 1 5 1880 1 1 14 ALA HA H 4.739 -2.645 4.367 1.00 . A A . 14 ALA HA 1 1 5 1881 1 1 14 ALA HB1 H 4.068 -5.068 4.557 1.00 . A A . 14 ALA HB1 1 1 5 1882 1 1 14 ALA HB2 H 5.768 -5.512 4.490 1.00 . A A . 14 ALA HB2 1 1 5 1883 1 1 14 ALA HB3 H 5.160 -4.566 5.839 1.00 . A A . 14 ALA HB3 1 1 5 1884 1 1 14 ALA N N 5.095 -3.663 2.552 1.00 . A A . 14 ALA N 1 1 5 1885 1 1 14 ALA O O 7.136 -2.125 4.961 1.00 . A A . 14 ALA O 1 1 5 1886 1 1 15 LEU C C 9.558 -2.513 2.510 1.00 . A A . 15 LEU C 1 1 5 1887 1 1 15 LEU CA C 9.173 -3.498 3.631 1.00 . A A . 15 LEU CA 1 1 5 1888 1 1 15 LEU CB C 9.908 -4.856 3.481 1.00 . A A . 15 LEU CB 1 1 5 1889 1 1 15 LEU CD1 C 10.218 -7.078 4.640 1.00 . A A . 15 LEU CD1 1 1 5 1890 1 1 15 LEU CD2 C 11.128 -4.989 5.704 1.00 . A A . 15 LEU CD2 1 1 5 1891 1 1 15 LEU CG C 9.969 -5.573 4.860 1.00 . A A . 15 LEU CG 1 1 5 1892 1 1 15 LEU H H 7.400 -4.480 2.971 1.00 . A A . 15 LEU H 1 1 5 1893 1 1 15 LEU HA H 9.384 -3.048 4.584 1.00 . A A . 15 LEU HA 1 1 5 1894 1 1 15 LEU HB2 H 9.376 -5.473 2.771 1.00 . A A . 15 LEU HB2 1 1 5 1895 1 1 15 LEU HB3 H 10.911 -4.705 3.110 1.00 . A A . 15 LEU HB3 1 1 5 1896 1 1 15 LEU HD11 H 11.111 -7.232 4.050 1.00 . A A . 15 LEU HD11 1 1 5 1897 1 1 15 LEU HD12 H 10.338 -7.579 5.590 1.00 . A A . 15 LEU HD12 1 1 5 1898 1 1 15 LEU HD13 H 9.379 -7.520 4.122 1.00 . A A . 15 LEU HD13 1 1 5 1899 1 1 15 LEU HD21 H 12.066 -5.079 5.175 1.00 . A A . 15 LEU HD21 1 1 5 1900 1 1 15 LEU HD22 H 10.950 -3.944 5.914 1.00 . A A . 15 LEU HD22 1 1 5 1901 1 1 15 LEU HD23 H 11.207 -5.518 6.642 1.00 . A A . 15 LEU HD23 1 1 5 1902 1 1 15 LEU HG H 9.036 -5.443 5.390 1.00 . A A . 15 LEU HG 1 1 5 1903 1 1 15 LEU N N 7.711 -3.756 3.546 1.00 . A A . 15 LEU N 1 1 5 1904 1 1 15 LEU O O 10.536 -2.692 1.807 1.00 . A A . 15 LEU O 1 1 5 1905 1 1 16 GLY C C 7.948 0.682 1.534 1.00 . A A . 16 GLY C 1 1 5 1906 1 1 16 GLY CA C 8.976 -0.439 1.357 1.00 . A A . 16 GLY CA 1 1 5 1907 1 1 16 GLY H H 7.987 -1.395 2.981 1.00 . A A . 16 GLY H 1 1 5 1908 1 1 16 GLY HA2 H 9.968 -0.037 1.478 1.00 . A A . 16 GLY HA2 1 1 5 1909 1 1 16 GLY HA3 H 8.868 -0.881 0.379 1.00 . A A . 16 GLY HA3 1 1 5 1910 1 1 16 GLY N N 8.754 -1.486 2.387 1.00 . A A . 16 GLY N 1 1 5 1911 1 1 16 GLY O O 8.123 1.552 2.365 1.00 . A A . 16 GLY O 1 1 5 1912 1 1 17 CYS C C 4.810 1.360 1.932 1.00 . A A . 17 CYS C 1 1 5 1913 1 1 17 CYS CA C 5.824 1.652 0.811 1.00 . A A . 17 CYS CA 1 1 5 1914 1 1 17 CYS CB C 5.119 1.683 -0.555 1.00 . A A . 17 CYS CB 1 1 5 1915 1 1 17 CYS H H 6.820 -0.107 0.097 1.00 . A A . 17 CYS H 1 1 5 1916 1 1 17 CYS HA H 6.269 2.613 1.011 1.00 . A A . 17 CYS HA 1 1 5 1917 1 1 17 CYS HB2 H 4.553 0.773 -0.679 1.00 . A A . 17 CYS HB2 1 1 5 1918 1 1 17 CYS HB3 H 4.409 2.486 -0.528 1.00 . A A . 17 CYS HB3 1 1 5 1919 1 1 17 CYS N N 6.903 0.622 0.745 1.00 . A A . 17 CYS N 1 1 5 1920 1 1 17 CYS O O 5.068 0.576 2.825 1.00 . A A . 17 CYS O 1 1 5 1921 1 1 17 CYS SG S 6.113 1.916 -2.050 1.00 . A A . 17 CYS SG 1 1 5 1922 1 1 18 SER C C 1.236 2.013 2.135 1.00 . A A . 18 SER C 1 1 5 1923 1 1 18 SER CA C 2.587 1.855 2.844 1.00 . A A . 18 SER CA 1 1 5 1924 1 1 18 SER CB C 2.748 2.928 3.934 1.00 . A A . 18 SER CB 1 1 5 1925 1 1 18 SER H H 3.550 2.642 1.096 1.00 . A A . 18 SER H 1 1 5 1926 1 1 18 SER HA H 2.641 0.864 3.273 1.00 . A A . 18 SER HA 1 1 5 1927 1 1 18 SER HB2 H 3.738 2.907 4.367 1.00 . A A . 18 SER HB2 1 1 5 1928 1 1 18 SER HB3 H 2.527 3.917 3.560 1.00 . A A . 18 SER HB3 1 1 5 1929 1 1 18 SER HG H 0.918 2.720 4.562 1.00 . A A . 18 SER HG 1 1 5 1930 1 1 18 SER N N 3.682 2.020 1.842 1.00 . A A . 18 SER N 1 1 5 1931 1 1 18 SER O O 1.156 2.599 1.073 1.00 . A A . 18 SER O 1 1 5 1932 1 1 18 SER OG O 1.794 2.570 4.925 1.00 . A A . 18 SER OG 1 1 5 1933 1 1 19 CYS C C -1.936 2.721 2.791 1.00 . A A . 19 CYS C 1 1 5 1934 1 1 19 CYS CA C -1.157 1.564 2.165 1.00 . A A . 19 CYS CA 1 1 5 1935 1 1 19 CYS CB C -1.893 0.244 2.415 1.00 . A A . 19 CYS CB 1 1 5 1936 1 1 19 CYS H H 0.348 1.019 3.608 1.00 . A A . 19 CYS H 1 1 5 1937 1 1 19 CYS HA H -1.084 1.725 1.103 1.00 . A A . 19 CYS HA 1 1 5 1938 1 1 19 CYS HB2 H -1.551 -0.464 1.672 1.00 . A A . 19 CYS HB2 1 1 5 1939 1 1 19 CYS HB3 H -1.608 -0.132 3.385 1.00 . A A . 19 CYS HB3 1 1 5 1940 1 1 19 CYS N N 0.214 1.478 2.752 1.00 . A A . 19 CYS N 1 1 5 1941 1 1 19 CYS O O -2.139 2.767 3.990 1.00 . A A . 19 CYS O 1 1 5 1942 1 1 19 CYS SG S -3.701 0.284 2.340 1.00 . A A . 19 CYS SG 1 1 5 1943 1 1 20 LYS C C -3.946 5.314 1.176 1.00 . A A . 20 LYS C 1 1 5 1944 1 1 20 LYS CA C -3.119 4.821 2.369 1.00 . A A . 20 LYS CA 1 1 5 1945 1 1 20 LYS CB C -2.139 5.920 2.834 1.00 . A A . 20 LYS CB 1 1 5 1946 1 1 20 LYS CD C -1.943 7.757 4.556 1.00 . A A . 20 LYS CD 1 1 5 1947 1 1 20 LYS CE C -2.752 8.607 5.550 1.00 . A A . 20 LYS CE 1 1 5 1948 1 1 20 LYS CG C -2.918 6.982 3.647 1.00 . A A . 20 LYS CG 1 1 5 1949 1 1 20 LYS H H -2.131 3.512 0.988 1.00 . A A . 20 LYS H 1 1 5 1950 1 1 20 LYS HA H -3.787 4.535 3.168 1.00 . A A . 20 LYS HA 1 1 5 1951 1 1 20 LYS HB2 H -1.370 5.474 3.448 1.00 . A A . 20 LYS HB2 1 1 5 1952 1 1 20 LYS HB3 H -1.666 6.384 1.980 1.00 . A A . 20 LYS HB3 1 1 5 1953 1 1 20 LYS HD2 H -1.316 7.068 5.102 1.00 . A A . 20 LYS HD2 1 1 5 1954 1 1 20 LYS HD3 H -1.314 8.400 3.956 1.00 . A A . 20 LYS HD3 1 1 5 1955 1 1 20 LYS HE2 H -3.315 9.364 5.024 1.00 . A A . 20 LYS HE2 1 1 5 1956 1 1 20 LYS HE3 H -3.435 7.984 6.109 1.00 . A A . 20 LYS HE3 1 1 5 1957 1 1 20 LYS HG2 H -3.406 7.668 2.970 1.00 . A A . 20 LYS HG2 1 1 5 1958 1 1 20 LYS HG3 H -3.672 6.503 4.253 1.00 . A A . 20 LYS HG3 1 1 5 1959 1 1 20 LYS HZ1 H -1.186 8.574 6.920 1.00 . A A . 20 LYS HZ1 1 1 5 1960 1 1 20 LYS HZ2 H -1.279 10.004 6.008 1.00 . A A . 20 LYS HZ2 1 1 5 1961 1 1 20 LYS HZ3 H -2.386 9.726 7.266 1.00 . A A . 20 LYS HZ3 1 1 5 1962 1 1 20 LYS N N -2.342 3.624 1.937 1.00 . A A . 20 LYS N 1 1 5 1963 1 1 20 LYS NZ N -1.831 9.278 6.508 1.00 . A A . 20 LYS NZ 1 1 5 1964 1 1 20 LYS O O -3.446 5.396 0.070 1.00 . A A . 20 LYS O 1 1 5 1965 1 1 21 ASN C C -6.123 5.201 -0.824 1.00 . A A . 21 ASN C 1 1 5 1966 1 1 21 ASN CA C -6.144 6.118 0.412 1.00 . A A . 21 ASN CA 1 1 5 1967 1 1 21 ASN CB C -5.751 7.572 0.029 1.00 . A A . 21 ASN CB 1 1 5 1968 1 1 21 ASN CG C -6.977 8.293 -0.553 1.00 . A A . 21 ASN CG 1 1 5 1969 1 1 21 ASN H H -5.506 5.526 2.378 1.00 . A A . 21 ASN H 1 1 5 1970 1 1 21 ASN HA H -7.139 6.102 0.833 1.00 . A A . 21 ASN HA 1 1 5 1971 1 1 21 ASN HB2 H -5.424 8.107 0.906 1.00 . A A . 21 ASN HB2 1 1 5 1972 1 1 21 ASN HB3 H -4.959 7.585 -0.705 1.00 . A A . 21 ASN HB3 1 1 5 1973 1 1 21 ASN HD21 H -6.985 7.225 -2.227 1.00 . A A . 21 ASN HD21 1 1 5 1974 1 1 21 ASN HD22 H -8.207 8.394 -2.107 1.00 . A A . 21 ASN HD22 1 1 5 1975 1 1 21 ASN N N -5.190 5.622 1.455 1.00 . A A . 21 ASN N 1 1 5 1976 1 1 21 ASN ND2 N -7.426 7.941 -1.726 1.00 . A A . 21 ASN ND2 1 1 5 1977 1 1 21 ASN O O -5.669 5.579 -1.888 1.00 . A A . 21 ASN O 1 1 5 1978 1 1 21 ASN OD1 O -7.535 9.182 0.057 1.00 . A A . 21 ASN OD1 1 1 5 1979 1 1 22 LYS C C -5.513 2.901 -2.643 1.00 . A A . 22 LYS C 1 1 5 1980 1 1 22 LYS CA C -6.713 2.949 -1.667 1.00 . A A . 22 LYS CA 1 1 5 1981 1 1 22 LYS CB C -8.060 3.165 -2.440 1.00 . A A . 22 LYS CB 1 1 5 1982 1 1 22 LYS CD C -9.464 4.722 -3.859 1.00 . A A . 22 LYS CD 1 1 5 1983 1 1 22 LYS CE C -9.396 5.966 -4.766 1.00 . A A . 22 LYS CE 1 1 5 1984 1 1 22 LYS CG C -8.145 4.576 -3.083 1.00 . A A . 22 LYS CG 1 1 5 1985 1 1 22 LYS H H -6.962 3.804 0.286 1.00 . A A . 22 LYS H 1 1 5 1986 1 1 22 LYS HA H -6.760 1.994 -1.164 1.00 . A A . 22 LYS HA 1 1 5 1987 1 1 22 LYS HB2 H -8.161 2.405 -3.201 1.00 . A A . 22 LYS HB2 1 1 5 1988 1 1 22 LYS HB3 H -8.878 3.049 -1.744 1.00 . A A . 22 LYS HB3 1 1 5 1989 1 1 22 LYS HD2 H -9.635 3.844 -4.463 1.00 . A A . 22 LYS HD2 1 1 5 1990 1 1 22 LYS HD3 H -10.279 4.831 -3.158 1.00 . A A . 22 LYS HD3 1 1 5 1991 1 1 22 LYS HE2 H -8.607 5.857 -5.496 1.00 . A A . 22 LYS HE2 1 1 5 1992 1 1 22 LYS HE3 H -10.335 6.099 -5.285 1.00 . A A . 22 LYS HE3 1 1 5 1993 1 1 22 LYS HG2 H -8.137 5.330 -2.311 1.00 . A A . 22 LYS HG2 1 1 5 1994 1 1 22 LYS HG3 H -7.306 4.741 -3.742 1.00 . A A . 22 LYS HG3 1 1 5 1995 1 1 22 LYS HZ1 H -9.750 7.191 -3.119 1.00 . A A . 22 LYS HZ1 1 1 5 1996 1 1 22 LYS HZ2 H -8.136 7.185 -3.646 1.00 . A A . 22 LYS HZ2 1 1 5 1997 1 1 22 LYS HZ3 H -9.313 8.035 -4.528 1.00 . A A . 22 LYS HZ3 1 1 5 1998 1 1 22 LYS N N -6.626 4.010 -0.610 1.00 . A A . 22 LYS N 1 1 5 1999 1 1 22 LYS NZ N -9.130 7.187 -3.953 1.00 . A A . 22 LYS NZ 1 1 5 2000 1 1 22 LYS O O -5.681 2.790 -3.842 1.00 . A A . 22 LYS O 1 1 5 2001 1 1 23 VAL C C -1.937 2.400 -2.012 1.00 . A A . 23 VAL C 1 1 5 2002 1 1 23 VAL CA C -3.073 2.969 -2.888 1.00 . A A . 23 VAL CA 1 1 5 2003 1 1 23 VAL CB C -2.808 4.442 -3.379 1.00 . A A . 23 VAL CB 1 1 5 2004 1 1 23 VAL CG1 C -1.425 4.999 -2.967 1.00 . A A . 23 VAL CG1 1 1 5 2005 1 1 23 VAL CG2 C -2.948 4.490 -4.916 1.00 . A A . 23 VAL CG2 1 1 5 2006 1 1 23 VAL H H -4.248 3.113 -1.123 1.00 . A A . 23 VAL H 1 1 5 2007 1 1 23 VAL HA H -3.237 2.284 -3.703 1.00 . A A . 23 VAL HA 1 1 5 2008 1 1 23 VAL HB H -3.559 5.087 -2.950 1.00 . A A . 23 VAL HB 1 1 5 2009 1 1 23 VAL HG11 H -0.652 4.296 -3.228 1.00 . A A . 23 VAL HG11 1 1 5 2010 1 1 23 VAL HG12 H -1.229 5.934 -3.473 1.00 . A A . 23 VAL HG12 1 1 5 2011 1 1 23 VAL HG13 H -1.396 5.175 -1.902 1.00 . A A . 23 VAL HG13 1 1 5 2012 1 1 23 VAL HG21 H -2.342 3.721 -5.372 1.00 . A A . 23 VAL HG21 1 1 5 2013 1 1 23 VAL HG22 H -3.978 4.330 -5.195 1.00 . A A . 23 VAL HG22 1 1 5 2014 1 1 23 VAL HG23 H -2.634 5.452 -5.295 1.00 . A A . 23 VAL HG23 1 1 5 2015 1 1 23 VAL N N -4.329 3.006 -2.087 1.00 . A A . 23 VAL N 1 1 5 2016 1 1 23 VAL O O -1.780 2.850 -0.894 1.00 . A A . 23 VAL O 1 1 5 2017 1 1 24 CYS C C 1.276 1.555 -2.013 1.00 . A A . 24 CYS C 1 1 5 2018 1 1 24 CYS CA C -0.060 0.866 -1.690 1.00 . A A . 24 CYS CA 1 1 5 2019 1 1 24 CYS CB C 0.023 -0.646 -1.986 1.00 . A A . 24 CYS CB 1 1 5 2020 1 1 24 CYS H H -1.340 1.106 -3.423 1.00 . A A . 24 CYS H 1 1 5 2021 1 1 24 CYS HA H -0.267 1.013 -0.643 1.00 . A A . 24 CYS HA 1 1 5 2022 1 1 24 CYS HB2 H -0.171 -0.821 -3.031 1.00 . A A . 24 CYS HB2 1 1 5 2023 1 1 24 CYS HB3 H 1.026 -0.991 -1.794 1.00 . A A . 24 CYS HB3 1 1 5 2024 1 1 24 CYS N N -1.180 1.448 -2.513 1.00 . A A . 24 CYS N 1 1 5 2025 1 1 24 CYS O O 2.298 0.911 -2.136 1.00 . A A . 24 CYS O 1 1 5 2026 1 1 24 CYS SG S -1.063 -1.705 -1.004 1.00 . A A . 24 CYS SG 1 1 5 2027 1 1 25 TYR C C 3.025 4.408 -1.259 1.00 . A A . 25 TYR C 1 1 5 2028 1 1 25 TYR CA C 2.453 3.654 -2.456 1.00 . A A . 25 TYR CA 1 1 5 2029 1 1 25 TYR CB C 2.123 4.679 -3.552 1.00 . A A . 25 TYR CB 1 1 5 2030 1 1 25 TYR CD1 C 1.325 2.727 -5.031 1.00 . A A . 25 TYR CD1 1 1 5 2031 1 1 25 TYR CD2 C 0.651 4.939 -5.576 1.00 . A A . 25 TYR CD2 1 1 5 2032 1 1 25 TYR CE1 C 0.622 2.251 -6.108 1.00 . A A . 25 TYR CE1 1 1 5 2033 1 1 25 TYR CE2 C -0.053 4.459 -6.657 1.00 . A A . 25 TYR CE2 1 1 5 2034 1 1 25 TYR CG C 1.349 4.083 -4.748 1.00 . A A . 25 TYR CG 1 1 5 2035 1 1 25 TYR CZ C -0.074 3.108 -6.932 1.00 . A A . 25 TYR CZ 1 1 5 2036 1 1 25 TYR H H 0.380 3.320 -2.005 1.00 . A A . 25 TYR H 1 1 5 2037 1 1 25 TYR HA H 3.220 2.992 -2.832 1.00 . A A . 25 TYR HA 1 1 5 2038 1 1 25 TYR HB2 H 1.549 5.495 -3.136 1.00 . A A . 25 TYR HB2 1 1 5 2039 1 1 25 TYR HB3 H 3.044 5.086 -3.920 1.00 . A A . 25 TYR HB3 1 1 5 2040 1 1 25 TYR HD1 H 1.862 2.026 -4.414 1.00 . A A . 25 TYR HD1 1 1 5 2041 1 1 25 TYR HD2 H 0.656 6.001 -5.377 1.00 . A A . 25 TYR HD2 1 1 5 2042 1 1 25 TYR HE1 H 0.624 1.193 -6.305 1.00 . A A . 25 TYR HE1 1 1 5 2043 1 1 25 TYR HE2 H -0.590 5.152 -7.286 1.00 . A A . 25 TYR HE2 1 1 5 2044 1 1 25 TYR HH H -0.166 2.517 -8.744 1.00 . A A . 25 TYR HH 1 1 5 2045 1 1 25 TYR N N 1.228 2.856 -2.133 1.00 . A A . 25 TYR N 1 1 5 2046 1 1 25 TYR O O 2.366 4.611 -0.257 1.00 . A A . 25 TYR O 1 1 5 2047 1 1 25 TYR OH O -0.779 2.619 -8.012 1.00 . A A . 25 TYR OH 1 1 5 2048 1 1 26 ARG C C 4.767 7.063 -0.608 1.00 . A A . 26 ARG C 1 1 5 2049 1 1 26 ARG CA C 4.998 5.562 -0.373 1.00 . A A . 26 ARG CA 1 1 5 2050 1 1 26 ARG CB C 6.506 5.215 -0.469 1.00 . A A . 26 ARG CB 1 1 5 2051 1 1 26 ARG CD C 8.347 6.234 -1.888 1.00 . A A . 26 ARG CD 1 1 5 2052 1 1 26 ARG CG C 7.039 5.422 -1.917 1.00 . A A . 26 ARG CG 1 1 5 2053 1 1 26 ARG CZ C 8.930 8.606 -2.038 1.00 . A A . 26 ARG CZ 1 1 5 2054 1 1 26 ARG H H 4.717 4.594 -2.273 1.00 . A A . 26 ARG H 1 1 5 2055 1 1 26 ARG HA H 4.600 5.302 0.596 1.00 . A A . 26 ARG HA 1 1 5 2056 1 1 26 ARG HB2 H 7.054 5.823 0.237 1.00 . A A . 26 ARG HB2 1 1 5 2057 1 1 26 ARG HB3 H 6.651 4.183 -0.199 1.00 . A A . 26 ARG HB3 1 1 5 2058 1 1 26 ARG HD2 H 8.888 6.078 -0.967 1.00 . A A . 26 ARG HD2 1 1 5 2059 1 1 26 ARG HD3 H 8.982 5.952 -2.716 1.00 . A A . 26 ARG HD3 1 1 5 2060 1 1 26 ARG HE H 7.059 7.951 -2.071 1.00 . A A . 26 ARG HE 1 1 5 2061 1 1 26 ARG HG2 H 7.231 4.459 -2.367 1.00 . A A . 26 ARG HG2 1 1 5 2062 1 1 26 ARG HG3 H 6.312 5.937 -2.527 1.00 . A A . 26 ARG HG3 1 1 5 2063 1 1 26 ARG HH11 H 10.461 7.319 -1.885 1.00 . A A . 26 ARG HH11 1 1 5 2064 1 1 26 ARG HH12 H 10.894 8.992 -1.984 1.00 . A A . 26 ARG HH12 1 1 5 2065 1 1 26 ARG HH21 H 7.582 10.076 -2.195 1.00 . A A . 26 ARG HH21 1 1 5 2066 1 1 26 ARG HH22 H 9.239 10.579 -2.167 1.00 . A A . 26 ARG HH22 1 1 5 2067 1 1 26 ARG N N 4.263 4.803 -1.430 1.00 . A A . 26 ARG N 1 1 5 2068 1 1 26 ARG NE N 8.000 7.685 -2.011 1.00 . A A . 26 ARG NE 1 1 5 2069 1 1 26 ARG NH1 N 10.193 8.280 -1.963 1.00 . A A . 26 ARG NH1 1 1 5 2070 1 1 26 ARG NH2 N 8.555 9.851 -2.141 1.00 . A A . 26 ARG NH2 1 1 5 2071 1 1 26 ARG O O 5.625 7.887 -0.359 1.00 . A A . 26 ARG O 1 1 5 2072 1 1 27 ASN C C 4.178 9.436 -2.301 1.00 . A A . 27 ASN C 1 1 5 2073 1 1 27 ASN CA C 3.147 8.747 -1.391 1.00 . A A . 27 ASN CA 1 1 5 2074 1 1 27 ASN CB C 2.979 9.507 -0.047 1.00 . A A . 27 ASN CB 1 1 5 2075 1 1 27 ASN CG C 1.953 8.768 0.825 1.00 . A A . 27 ASN CG 1 1 5 2076 1 1 27 ASN H H 2.954 6.615 -1.248 1.00 . A A . 27 ASN H 1 1 5 2077 1 1 27 ASN HA H 2.204 8.704 -1.916 1.00 . A A . 27 ASN HA 1 1 5 2078 1 1 27 ASN HB2 H 3.916 9.560 0.487 1.00 . A A . 27 ASN HB2 1 1 5 2079 1 1 27 ASN HB3 H 2.623 10.511 -0.226 1.00 . A A . 27 ASN HB3 1 1 5 2080 1 1 27 ASN HD21 H 3.235 7.350 1.360 1.00 . A A . 27 ASN HD21 1 1 5 2081 1 1 27 ASN HD22 H 1.675 7.201 2.012 1.00 . A A . 27 ASN HD22 1 1 5 2082 1 1 27 ASN N N 3.580 7.349 -1.087 1.00 . A A . 27 ASN N 1 1 5 2083 1 1 27 ASN ND2 N 2.318 7.682 1.451 1.00 . A A . 27 ASN ND2 1 1 5 2084 1 1 27 ASN O O 4.542 10.580 -2.095 1.00 . A A . 27 ASN O 1 1 5 2085 1 1 27 ASN OD1 O 0.812 9.171 0.944 1.00 . A A . 27 ASN OD1 1 1 5 2086 1 1 28 GLY C C 6.086 8.221 -5.301 1.00 . A A . 28 GLY C 1 1 5 2087 1 1 28 GLY CA C 5.617 9.237 -4.250 1.00 . A A . 28 GLY CA 1 1 5 2088 1 1 28 GLY H H 4.286 7.784 -3.407 1.00 . A A . 28 GLY H 1 1 5 2089 1 1 28 GLY HA2 H 5.176 10.081 -4.756 1.00 . A A . 28 GLY HA2 1 1 5 2090 1 1 28 GLY HA3 H 6.475 9.564 -3.689 1.00 . A A . 28 GLY HA3 1 1 5 2091 1 1 28 GLY N N 4.615 8.697 -3.292 1.00 . A A . 28 GLY N 1 1 5 2092 1 1 28 GLY O O 6.562 8.623 -6.345 1.00 . A A . 28 GLY O 1 1 5 2093 1 1 29 ILE C C 5.413 4.686 -5.895 1.00 . A A . 29 ILE C 1 1 5 2094 1 1 29 ILE CA C 6.378 5.888 -5.981 1.00 . A A . 29 ILE CA 1 1 5 2095 1 1 29 ILE CB C 7.838 5.464 -5.629 1.00 . A A . 29 ILE CB 1 1 5 2096 1 1 29 ILE CD1 C 9.467 7.387 -5.259 1.00 . A A . 29 ILE CD1 1 1 5 2097 1 1 29 ILE CG1 C 8.865 6.434 -6.306 1.00 . A A . 29 ILE CG1 1 1 5 2098 1 1 29 ILE CG2 C 8.151 4.007 -6.075 1.00 . A A . 29 ILE CG2 1 1 5 2099 1 1 29 ILE H H 5.548 6.685 -4.154 1.00 . A A . 29 ILE H 1 1 5 2100 1 1 29 ILE HA H 6.364 6.299 -6.968 1.00 . A A . 29 ILE HA 1 1 5 2101 1 1 29 ILE HB H 7.922 5.524 -4.563 1.00 . A A . 29 ILE HB 1 1 5 2102 1 1 29 ILE HD11 H 8.687 7.895 -4.714 1.00 . A A . 29 ILE HD11 1 1 5 2103 1 1 29 ILE HD12 H 10.079 6.835 -4.562 1.00 . A A . 29 ILE HD12 1 1 5 2104 1 1 29 ILE HD13 H 10.084 8.126 -5.749 1.00 . A A . 29 ILE HD13 1 1 5 2105 1 1 29 ILE HG12 H 9.670 5.874 -6.759 1.00 . A A . 29 ILE HG12 1 1 5 2106 1 1 29 ILE HG13 H 8.392 7.015 -7.085 1.00 . A A . 29 ILE HG13 1 1 5 2107 1 1 29 ILE HG21 H 7.888 3.862 -7.113 1.00 . A A . 29 ILE HG21 1 1 5 2108 1 1 29 ILE HG22 H 9.204 3.798 -5.952 1.00 . A A . 29 ILE HG22 1 1 5 2109 1 1 29 ILE HG23 H 7.596 3.302 -5.473 1.00 . A A . 29 ILE HG23 1 1 5 2110 1 1 29 ILE N N 5.945 6.948 -5.012 1.00 . A A . 29 ILE N 1 1 5 2111 1 1 29 ILE O O 5.154 4.205 -4.809 1.00 . A A . 29 ILE O 1 1 5 2112 1 1 30 PRO C C 4.662 1.738 -6.757 1.00 . A A . 30 PRO C 1 1 5 2113 1 1 30 PRO CA C 3.975 3.076 -7.067 1.00 . A A . 30 PRO CA 1 1 5 2114 1 1 30 PRO CB C 3.360 3.089 -8.466 1.00 . A A . 30 PRO CB 1 1 5 2115 1 1 30 PRO CD C 5.176 4.785 -8.390 1.00 . A A . 30 PRO CD 1 1 5 2116 1 1 30 PRO CG C 4.254 3.991 -9.331 1.00 . A A . 30 PRO CG 1 1 5 2117 1 1 30 PRO HA H 3.209 3.252 -6.338 1.00 . A A . 30 PRO HA 1 1 5 2118 1 1 30 PRO HB2 H 3.319 2.094 -8.885 1.00 . A A . 30 PRO HB2 1 1 5 2119 1 1 30 PRO HB3 H 2.357 3.487 -8.421 1.00 . A A . 30 PRO HB3 1 1 5 2120 1 1 30 PRO HD2 H 6.216 4.644 -8.643 1.00 . A A . 30 PRO HD2 1 1 5 2121 1 1 30 PRO HD3 H 4.923 5.836 -8.414 1.00 . A A . 30 PRO HD3 1 1 5 2122 1 1 30 PRO HG2 H 4.845 3.388 -10.004 1.00 . A A . 30 PRO HG2 1 1 5 2123 1 1 30 PRO HG3 H 3.643 4.667 -9.913 1.00 . A A . 30 PRO HG3 1 1 5 2124 1 1 30 PRO N N 4.908 4.231 -7.025 1.00 . A A . 30 PRO N 1 1 5 2125 1 1 30 PRO O O 5.475 1.267 -7.528 1.00 . A A . 30 PRO O 1 1 6 2126 1 1 1 CYS C C 4.131 -0.736 -6.071 1.00 . A A . 1 CYS C 1 1 6 2127 1 1 1 CYS CA C 4.974 0.415 -5.516 1.00 . A A . 1 CYS CA 1 1 6 2128 1 1 1 CYS CB C 4.935 0.414 -3.990 1.00 . A A . 1 CYS CB 1 1 6 2129 1 1 1 CYS HA H 5.988 0.340 -5.882 1.00 . A A . 1 CYS HA 1 1 6 2130 1 1 1 CYS HB2 H 4.195 1.127 -3.685 1.00 . A A . 1 CYS HB2 1 1 6 2131 1 1 1 CYS HB3 H 4.594 -0.553 -3.650 1.00 . A A . 1 CYS HB3 1 1 6 2132 1 1 1 CYS N N 4.338 1.669 -6.023 1.00 . A A . 1 CYS N 1 1 6 2133 1 1 1 CYS O O 4.659 -1.683 -6.620 1.00 . A A . 1 CYS O 1 1 6 2134 1 1 1 CYS SG S 6.427 0.792 -3.043 1.00 . A A . 1 CYS SG 1 1 6 2135 1 1 2 GLY C C 0.597 -0.964 -6.834 1.00 . A A . 2 GLY C 1 1 6 2136 1 1 2 GLY CA C 1.892 -1.637 -6.389 1.00 . A A . 2 GLY CA 1 1 6 2137 1 1 2 GLY H H 2.460 0.183 -5.448 1.00 . A A . 2 GLY H 1 1 6 2138 1 1 2 GLY HA2 H 2.322 -2.154 -7.233 1.00 . A A . 2 GLY HA2 1 1 6 2139 1 1 2 GLY HA3 H 1.683 -2.340 -5.595 1.00 . A A . 2 GLY HA3 1 1 6 2140 1 1 2 GLY N N 2.835 -0.603 -5.902 1.00 . A A . 2 GLY N 1 1 6 2141 1 1 2 GLY O O 0.482 -0.556 -7.975 1.00 . A A . 2 GLY O 1 1 6 2142 1 1 3 GLU C C -2.635 -0.446 -4.984 1.00 . A A . 3 GLU C 1 1 6 2143 1 1 3 GLU CA C -1.664 -0.239 -6.164 1.00 . A A . 3 GLU CA 1 1 6 2144 1 1 3 GLU CB C -2.287 -0.865 -7.427 1.00 . A A . 3 GLU CB 1 1 6 2145 1 1 3 GLU CD C -2.789 -0.397 -9.836 1.00 . A A . 3 GLU CD 1 1 6 2146 1 1 3 GLU CG C -2.627 0.237 -8.446 1.00 . A A . 3 GLU CG 1 1 6 2147 1 1 3 GLU H H -0.121 -1.202 -5.015 1.00 . A A . 3 GLU H 1 1 6 2148 1 1 3 GLU HA H -1.513 0.822 -6.282 1.00 . A A . 3 GLU HA 1 1 6 2149 1 1 3 GLU HB2 H -1.604 -1.577 -7.852 1.00 . A A . 3 GLU HB2 1 1 6 2150 1 1 3 GLU HB3 H -3.171 -1.417 -7.155 1.00 . A A . 3 GLU HB3 1 1 6 2151 1 1 3 GLU HG2 H -3.548 0.726 -8.163 1.00 . A A . 3 GLU HG2 1 1 6 2152 1 1 3 GLU HG3 H -1.840 0.978 -8.487 1.00 . A A . 3 GLU HG3 1 1 6 2153 1 1 3 GLU N N -0.325 -0.864 -5.906 1.00 . A A . 3 GLU N 1 1 6 2154 1 1 3 GLU O O -2.241 -0.860 -3.913 1.00 . A A . 3 GLU O 1 1 6 2155 1 1 3 GLU OE1 O -3.907 -0.789 -10.129 1.00 . A A . 3 GLU OE1 1 1 6 2156 1 1 3 GLU OE2 O -1.783 -0.454 -10.526 1.00 . A A . 3 GLU OE2 1 1 6 2157 1 1 4 SER C C -4.891 -1.471 -3.294 1.00 . A A . 4 SER C 1 1 6 2158 1 1 4 SER CA C -4.991 -0.277 -4.243 1.00 . A A . 4 SER CA 1 1 6 2159 1 1 4 SER CB C -6.334 -0.350 -4.986 1.00 . A A . 4 SER CB 1 1 6 2160 1 1 4 SER H H -4.121 0.169 -6.142 1.00 . A A . 4 SER H 1 1 6 2161 1 1 4 SER HA H -4.980 0.611 -3.642 1.00 . A A . 4 SER HA 1 1 6 2162 1 1 4 SER HB2 H -7.110 -0.770 -4.367 1.00 . A A . 4 SER HB2 1 1 6 2163 1 1 4 SER HB3 H -6.632 0.631 -5.320 1.00 . A A . 4 SER HB3 1 1 6 2164 1 1 4 SER HG H -5.579 -1.946 -5.812 1.00 . A A . 4 SER HG 1 1 6 2165 1 1 4 SER N N -3.887 -0.150 -5.247 1.00 . A A . 4 SER N 1 1 6 2166 1 1 4 SER O O -4.421 -2.536 -3.643 1.00 . A A . 4 SER O 1 1 6 2167 1 1 4 SER OG O -6.112 -1.202 -6.102 1.00 . A A . 4 SER OG 1 1 6 2168 1 1 5 CYS C C -6.738 -2.238 -0.302 1.00 . A A . 5 CYS C 1 1 6 2169 1 1 5 CYS CA C -5.374 -2.206 -1.007 1.00 . A A . 5 CYS CA 1 1 6 2170 1 1 5 CYS CB C -4.228 -1.805 -0.068 1.00 . A A . 5 CYS CB 1 1 6 2171 1 1 5 CYS H H -5.728 -0.318 -1.931 1.00 . A A . 5 CYS H 1 1 6 2172 1 1 5 CYS HA H -5.210 -3.169 -1.443 1.00 . A A . 5 CYS HA 1 1 6 2173 1 1 5 CYS HB2 H -4.493 -2.062 0.944 1.00 . A A . 5 CYS HB2 1 1 6 2174 1 1 5 CYS HB3 H -3.356 -2.379 -0.336 1.00 . A A . 5 CYS HB3 1 1 6 2175 1 1 5 CYS N N -5.365 -1.206 -2.106 1.00 . A A . 5 CYS N 1 1 6 2176 1 1 5 CYS O O -6.840 -2.516 0.878 1.00 . A A . 5 CYS O 1 1 6 2177 1 1 5 CYS SG S -3.775 -0.052 -0.073 1.00 . A A . 5 CYS SG 1 1 6 2178 1 1 6 VAL C C -9.609 -3.384 -0.312 1.00 . A A . 6 VAL C 1 1 6 2179 1 1 6 VAL CA C -9.152 -1.937 -0.551 1.00 . A A . 6 VAL CA 1 1 6 2180 1 1 6 VAL CB C -10.083 -1.245 -1.589 1.00 . A A . 6 VAL CB 1 1 6 2181 1 1 6 VAL CG1 C -11.514 -1.125 -1.011 1.00 . A A . 6 VAL CG1 1 1 6 2182 1 1 6 VAL CG2 C -9.555 0.172 -1.903 1.00 . A A . 6 VAL CG2 1 1 6 2183 1 1 6 VAL H H -7.578 -1.747 -2.019 1.00 . A A . 6 VAL H 1 1 6 2184 1 1 6 VAL HA H -9.170 -1.401 0.386 1.00 . A A . 6 VAL HA 1 1 6 2185 1 1 6 VAL HB H -10.110 -1.825 -2.501 1.00 . A A . 6 VAL HB 1 1 6 2186 1 1 6 VAL HG11 H -11.493 -0.617 -0.058 1.00 . A A . 6 VAL HG11 1 1 6 2187 1 1 6 VAL HG12 H -12.143 -0.566 -1.689 1.00 . A A . 6 VAL HG12 1 1 6 2188 1 1 6 VAL HG13 H -11.945 -2.105 -0.875 1.00 . A A . 6 VAL HG13 1 1 6 2189 1 1 6 VAL HG21 H -9.452 0.742 -0.990 1.00 . A A . 6 VAL HG21 1 1 6 2190 1 1 6 VAL HG22 H -8.593 0.117 -2.391 1.00 . A A . 6 VAL HG22 1 1 6 2191 1 1 6 VAL HG23 H -10.242 0.689 -2.558 1.00 . A A . 6 VAL HG23 1 1 6 2192 1 1 6 VAL N N -7.751 -1.952 -1.078 1.00 . A A . 6 VAL N 1 1 6 2193 1 1 6 VAL O O -10.111 -3.714 0.745 1.00 . A A . 6 VAL O 1 1 6 2194 1 1 7 TRP C C -8.854 -6.404 -0.319 1.00 . A A . 7 TRP C 1 1 6 2195 1 1 7 TRP CA C -9.794 -5.631 -1.254 1.00 . A A . 7 TRP CA 1 1 6 2196 1 1 7 TRP CB C -9.733 -6.207 -2.679 1.00 . A A . 7 TRP CB 1 1 6 2197 1 1 7 TRP CD1 C -10.225 -8.739 -2.519 1.00 . A A . 7 TRP CD1 1 1 6 2198 1 1 7 TRP CD2 C -11.942 -7.472 -3.116 1.00 . A A . 7 TRP CD2 1 1 6 2199 1 1 7 TRP CE2 C -12.386 -8.793 -3.081 1.00 . A A . 7 TRP CE2 1 1 6 2200 1 1 7 TRP CE3 C -12.829 -6.452 -3.466 1.00 . A A . 7 TRP CE3 1 1 6 2201 1 1 7 TRP CG C -10.623 -7.454 -2.771 1.00 . A A . 7 TRP CG 1 1 6 2202 1 1 7 TRP CH2 C -14.592 -8.078 -3.745 1.00 . A A . 7 TRP CH2 1 1 6 2203 1 1 7 TRP CZ2 C -13.708 -9.098 -3.395 1.00 . A A . 7 TRP CZ2 1 1 6 2204 1 1 7 TRP CZ3 C -14.152 -6.757 -3.780 1.00 . A A . 7 TRP CZ3 1 1 6 2205 1 1 7 TRP H H -9.000 -3.856 -2.139 1.00 . A A . 7 TRP H 1 1 6 2206 1 1 7 TRP HA H -10.799 -5.685 -0.875 1.00 . A A . 7 TRP HA 1 1 6 2207 1 1 7 TRP HB2 H -10.086 -5.475 -3.391 1.00 . A A . 7 TRP HB2 1 1 6 2208 1 1 7 TRP HB3 H -8.719 -6.472 -2.938 1.00 . A A . 7 TRP HB3 1 1 6 2209 1 1 7 TRP HD1 H -9.247 -9.088 -2.222 1.00 . A A . 7 TRP HD1 1 1 6 2210 1 1 7 TRP HE1 H -11.310 -10.428 -2.611 1.00 . A A . 7 TRP HE1 1 1 6 2211 1 1 7 TRP HE3 H -12.492 -5.426 -3.495 1.00 . A A . 7 TRP HE3 1 1 6 2212 1 1 7 TRP HH2 H -15.618 -8.313 -3.988 1.00 . A A . 7 TRP HH2 1 1 6 2213 1 1 7 TRP HZ2 H -14.049 -10.122 -3.367 1.00 . A A . 7 TRP HZ2 1 1 6 2214 1 1 7 TRP HZ3 H -14.838 -5.967 -4.051 1.00 . A A . 7 TRP HZ3 1 1 6 2215 1 1 7 TRP N N -9.409 -4.194 -1.320 1.00 . A A . 7 TRP N 1 1 6 2216 1 1 7 TRP NE1 N -11.306 -9.454 -2.722 1.00 . A A . 7 TRP NE1 1 1 6 2217 1 1 7 TRP O O -9.301 -7.120 0.556 1.00 . A A . 7 TRP O 1 1 6 2218 1 1 8 ILE C C -5.318 -5.940 0.437 1.00 . A A . 8 ILE C 1 1 6 2219 1 1 8 ILE CA C -6.524 -6.894 0.261 1.00 . A A . 8 ILE CA 1 1 6 2220 1 1 8 ILE CB C -6.060 -8.185 -0.464 1.00 . A A . 8 ILE CB 1 1 6 2221 1 1 8 ILE CD1 C -5.145 -9.009 -2.690 1.00 . A A . 8 ILE CD1 1 1 6 2222 1 1 8 ILE CG1 C -6.110 -8.016 -2.017 1.00 . A A . 8 ILE CG1 1 1 6 2223 1 1 8 ILE CG2 C -6.947 -9.374 -0.031 1.00 . A A . 8 ILE CG2 1 1 6 2224 1 1 8 ILE H H -7.285 -5.638 -1.266 1.00 . A A . 8 ILE H 1 1 6 2225 1 1 8 ILE HA H -6.949 -7.124 1.218 1.00 . A A . 8 ILE HA 1 1 6 2226 1 1 8 ILE HB H -5.042 -8.373 -0.169 1.00 . A A . 8 ILE HB 1 1 6 2227 1 1 8 ILE HD11 H -4.193 -9.022 -2.179 1.00 . A A . 8 ILE HD11 1 1 6 2228 1 1 8 ILE HD12 H -5.563 -10.004 -2.677 1.00 . A A . 8 ILE HD12 1 1 6 2229 1 1 8 ILE HD13 H -4.980 -8.717 -3.718 1.00 . A A . 8 ILE HD13 1 1 6 2230 1 1 8 ILE HG12 H -7.113 -8.189 -2.382 1.00 . A A . 8 ILE HG12 1 1 6 2231 1 1 8 ILE HG13 H -5.819 -7.012 -2.292 1.00 . A A . 8 ILE HG13 1 1 6 2232 1 1 8 ILE HG21 H -6.918 -9.485 1.044 1.00 . A A . 8 ILE HG21 1 1 6 2233 1 1 8 ILE HG22 H -7.970 -9.216 -0.335 1.00 . A A . 8 ILE HG22 1 1 6 2234 1 1 8 ILE HG23 H -6.587 -10.289 -0.480 1.00 . A A . 8 ILE HG23 1 1 6 2235 1 1 8 ILE N N -7.577 -6.224 -0.547 1.00 . A A . 8 ILE N 1 1 6 2236 1 1 8 ILE O O -4.871 -5.368 -0.538 1.00 . A A . 8 ILE O 1 1 6 2237 1 1 9 PRO C C -2.331 -5.597 1.340 1.00 . A A . 9 PRO C 1 1 6 2238 1 1 9 PRO CA C -3.606 -4.951 1.910 1.00 . A A . 9 PRO CA 1 1 6 2239 1 1 9 PRO CB C -3.537 -4.790 3.427 1.00 . A A . 9 PRO CB 1 1 6 2240 1 1 9 PRO CD C -5.366 -6.392 2.897 1.00 . A A . 9 PRO CD 1 1 6 2241 1 1 9 PRO CG C -4.483 -5.842 4.031 1.00 . A A . 9 PRO CG 1 1 6 2242 1 1 9 PRO HA H -3.744 -3.986 1.448 1.00 . A A . 9 PRO HA 1 1 6 2243 1 1 9 PRO HB2 H -2.530 -4.941 3.789 1.00 . A A . 9 PRO HB2 1 1 6 2244 1 1 9 PRO HB3 H -3.863 -3.799 3.706 1.00 . A A . 9 PRO HB3 1 1 6 2245 1 1 9 PRO HD2 H -5.303 -7.469 2.836 1.00 . A A . 9 PRO HD2 1 1 6 2246 1 1 9 PRO HD3 H -6.394 -6.084 3.029 1.00 . A A . 9 PRO HD3 1 1 6 2247 1 1 9 PRO HG2 H -3.909 -6.644 4.472 1.00 . A A . 9 PRO HG2 1 1 6 2248 1 1 9 PRO HG3 H -5.097 -5.391 4.796 1.00 . A A . 9 PRO HG3 1 1 6 2249 1 1 9 PRO N N -4.817 -5.784 1.647 1.00 . A A . 9 PRO N 1 1 6 2250 1 1 9 PRO O O -2.249 -6.803 1.207 1.00 . A A . 9 PRO O 1 1 6 2251 1 1 10 CYS C C 0.713 -6.015 1.515 1.00 . A A . 10 CYS C 1 1 6 2252 1 1 10 CYS CA C -0.074 -5.223 0.459 1.00 . A A . 10 CYS CA 1 1 6 2253 1 1 10 CYS CB C 0.745 -3.996 0.002 1.00 . A A . 10 CYS CB 1 1 6 2254 1 1 10 CYS H H -1.528 -3.796 1.166 1.00 . A A . 10 CYS H 1 1 6 2255 1 1 10 CYS HA H -0.268 -5.864 -0.388 1.00 . A A . 10 CYS HA 1 1 6 2256 1 1 10 CYS HB2 H 1.781 -4.147 0.266 1.00 . A A . 10 CYS HB2 1 1 6 2257 1 1 10 CYS HB3 H 0.698 -3.950 -1.076 1.00 . A A . 10 CYS HB3 1 1 6 2258 1 1 10 CYS N N -1.380 -4.754 1.026 1.00 . A A . 10 CYS N 1 1 6 2259 1 1 10 CYS O O 0.609 -5.738 2.694 1.00 . A A . 10 CYS O 1 1 6 2260 1 1 10 CYS SG S 0.259 -2.368 0.628 1.00 . A A . 10 CYS SG 1 1 6 2261 1 1 11 ILE C C 3.783 -7.544 1.681 1.00 . A A . 11 ILE C 1 1 6 2262 1 1 11 ILE CA C 2.302 -7.839 1.949 1.00 . A A . 11 ILE CA 1 1 6 2263 1 1 11 ILE CB C 1.991 -9.324 1.661 1.00 . A A . 11 ILE CB 1 1 6 2264 1 1 11 ILE CD1 C -0.250 -9.184 2.933 1.00 . A A . 11 ILE CD1 1 1 6 2265 1 1 11 ILE CG1 C 0.454 -9.605 1.622 1.00 . A A . 11 ILE CG1 1 1 6 2266 1 1 11 ILE CG2 C 2.689 -10.237 2.703 1.00 . A A . 11 ILE CG2 1 1 6 2267 1 1 11 ILE H H 1.498 -7.132 0.079 1.00 . A A . 11 ILE H 1 1 6 2268 1 1 11 ILE HA H 2.080 -7.632 2.977 1.00 . A A . 11 ILE HA 1 1 6 2269 1 1 11 ILE HB H 2.397 -9.541 0.693 1.00 . A A . 11 ILE HB 1 1 6 2270 1 1 11 ILE HD11 H 0.311 -9.509 3.795 1.00 . A A . 11 ILE HD11 1 1 6 2271 1 1 11 ILE HD12 H -0.364 -8.112 2.973 1.00 . A A . 11 ILE HD12 1 1 6 2272 1 1 11 ILE HD13 H -1.232 -9.633 2.974 1.00 . A A . 11 ILE HD13 1 1 6 2273 1 1 11 ILE HG12 H 0.012 -9.069 0.794 1.00 . A A . 11 ILE HG12 1 1 6 2274 1 1 11 ILE HG13 H 0.291 -10.659 1.458 1.00 . A A . 11 ILE HG13 1 1 6 2275 1 1 11 ILE HG21 H 2.518 -9.878 3.707 1.00 . A A . 11 ILE HG21 1 1 6 2276 1 1 11 ILE HG22 H 2.312 -11.247 2.626 1.00 . A A . 11 ILE HG22 1 1 6 2277 1 1 11 ILE HG23 H 3.754 -10.255 2.521 1.00 . A A . 11 ILE HG23 1 1 6 2278 1 1 11 ILE N N 1.472 -6.975 1.046 1.00 . A A . 11 ILE N 1 1 6 2279 1 1 11 ILE O O 4.521 -7.189 2.578 1.00 . A A . 11 ILE O 1 1 6 2280 1 1 12 SER C C 5.884 -5.963 0.175 1.00 . A A . 12 SER C 1 1 6 2281 1 1 12 SER CA C 5.571 -7.455 0.016 1.00 . A A . 12 SER CA 1 1 6 2282 1 1 12 SER CB C 5.730 -7.877 -1.452 1.00 . A A . 12 SER CB 1 1 6 2283 1 1 12 SER H H 3.512 -7.996 -0.229 1.00 . A A . 12 SER H 1 1 6 2284 1 1 12 SER HA H 6.218 -8.035 0.653 1.00 . A A . 12 SER HA 1 1 6 2285 1 1 12 SER HB2 H 5.211 -8.802 -1.652 1.00 . A A . 12 SER HB2 1 1 6 2286 1 1 12 SER HB3 H 5.389 -7.111 -2.135 1.00 . A A . 12 SER HB3 1 1 6 2287 1 1 12 SER HG H 7.401 -8.790 -1.047 1.00 . A A . 12 SER HG 1 1 6 2288 1 1 12 SER N N 4.163 -7.705 0.438 1.00 . A A . 12 SER N 1 1 6 2289 1 1 12 SER O O 6.939 -5.582 0.641 1.00 . A A . 12 SER O 1 1 6 2290 1 1 12 SER OG O 7.128 -8.065 -1.615 1.00 . A A . 12 SER OG 1 1 6 2291 1 1 13 ALA C C 4.766 -3.162 1.260 1.00 . A A . 13 ALA C 1 1 6 2292 1 1 13 ALA CA C 5.035 -3.694 -0.159 1.00 . A A . 13 ALA CA 1 1 6 2293 1 1 13 ALA CB C 4.029 -3.086 -1.159 1.00 . A A . 13 ALA CB 1 1 6 2294 1 1 13 ALA H H 4.108 -5.572 -0.598 1.00 . A A . 13 ALA H 1 1 6 2295 1 1 13 ALA HA H 6.035 -3.426 -0.451 1.00 . A A . 13 ALA HA 1 1 6 2296 1 1 13 ALA HB1 H 3.399 -3.858 -1.575 1.00 . A A . 13 ALA HB1 1 1 6 2297 1 1 13 ALA HB2 H 3.399 -2.350 -0.683 1.00 . A A . 13 ALA HB2 1 1 6 2298 1 1 13 ALA HB3 H 4.563 -2.612 -1.968 1.00 . A A . 13 ALA HB3 1 1 6 2299 1 1 13 ALA N N 4.923 -5.176 -0.233 1.00 . A A . 13 ALA N 1 1 6 2300 1 1 13 ALA O O 5.104 -2.033 1.559 1.00 . A A . 13 ALA O 1 1 6 2301 1 1 14 ALA C C 4.997 -2.894 4.238 1.00 . A A . 14 ALA C 1 1 6 2302 1 1 14 ALA CA C 3.846 -3.600 3.502 1.00 . A A . 14 ALA CA 1 1 6 2303 1 1 14 ALA CB C 3.458 -4.860 4.285 1.00 . A A . 14 ALA CB 1 1 6 2304 1 1 14 ALA H H 3.932 -4.887 1.774 1.00 . A A . 14 ALA H 1 1 6 2305 1 1 14 ALA HA H 2.998 -2.931 3.475 1.00 . A A . 14 ALA HA 1 1 6 2306 1 1 14 ALA HB1 H 2.772 -5.460 3.710 1.00 . A A . 14 ALA HB1 1 1 6 2307 1 1 14 ALA HB2 H 4.336 -5.453 4.503 1.00 . A A . 14 ALA HB2 1 1 6 2308 1 1 14 ALA HB3 H 2.986 -4.587 5.216 1.00 . A A . 14 ALA HB3 1 1 6 2309 1 1 14 ALA N N 4.171 -3.989 2.088 1.00 . A A . 14 ALA N 1 1 6 2310 1 1 14 ALA O O 4.791 -1.888 4.890 1.00 . A A . 14 ALA O 1 1 6 2311 1 1 15 LEU C C 7.780 -1.511 4.184 1.00 . A A . 15 LEU C 1 1 6 2312 1 1 15 LEU CA C 7.384 -2.882 4.761 1.00 . A A . 15 LEU CA 1 1 6 2313 1 1 15 LEU CB C 8.573 -3.893 4.615 1.00 . A A . 15 LEU CB 1 1 6 2314 1 1 15 LEU CD1 C 9.911 -4.908 2.714 1.00 . A A . 15 LEU CD1 1 1 6 2315 1 1 15 LEU CD2 C 7.863 -6.099 3.564 1.00 . A A . 15 LEU CD2 1 1 6 2316 1 1 15 LEU CG C 8.495 -4.709 3.289 1.00 . A A . 15 LEU CG 1 1 6 2317 1 1 15 LEU H H 6.261 -4.259 3.563 1.00 . A A . 15 LEU H 1 1 6 2318 1 1 15 LEU HA H 7.162 -2.769 5.805 1.00 . A A . 15 LEU HA 1 1 6 2319 1 1 15 LEU HB2 H 9.503 -3.345 4.652 1.00 . A A . 15 LEU HB2 1 1 6 2320 1 1 15 LEU HB3 H 8.561 -4.563 5.462 1.00 . A A . 15 LEU HB3 1 1 6 2321 1 1 15 LEU HD11 H 10.371 -3.951 2.517 1.00 . A A . 15 LEU HD11 1 1 6 2322 1 1 15 LEU HD12 H 10.527 -5.454 3.414 1.00 . A A . 15 LEU HD12 1 1 6 2323 1 1 15 LEU HD13 H 9.860 -5.463 1.789 1.00 . A A . 15 LEU HD13 1 1 6 2324 1 1 15 LEU HD21 H 8.382 -6.592 4.374 1.00 . A A . 15 LEU HD21 1 1 6 2325 1 1 15 LEU HD22 H 6.823 -5.998 3.833 1.00 . A A . 15 LEU HD22 1 1 6 2326 1 1 15 LEU HD23 H 7.931 -6.723 2.684 1.00 . A A . 15 LEU HD23 1 1 6 2327 1 1 15 LEU HG H 7.898 -4.172 2.570 1.00 . A A . 15 LEU HG 1 1 6 2328 1 1 15 LEU N N 6.173 -3.452 4.104 1.00 . A A . 15 LEU N 1 1 6 2329 1 1 15 LEU O O 7.410 -0.497 4.743 1.00 . A A . 15 LEU O 1 1 6 2330 1 1 16 GLY C C 7.762 0.679 2.177 1.00 . A A . 16 GLY C 1 1 6 2331 1 1 16 GLY CA C 8.954 -0.242 2.448 1.00 . A A . 16 GLY CA 1 1 6 2332 1 1 16 GLY H H 8.776 -2.367 2.694 1.00 . A A . 16 GLY H 1 1 6 2333 1 1 16 GLY HA2 H 9.652 0.252 3.104 1.00 . A A . 16 GLY HA2 1 1 6 2334 1 1 16 GLY HA3 H 9.445 -0.473 1.514 1.00 . A A . 16 GLY HA3 1 1 6 2335 1 1 16 GLY N N 8.511 -1.515 3.094 1.00 . A A . 16 GLY N 1 1 6 2336 1 1 16 GLY O O 7.640 1.736 2.765 1.00 . A A . 16 GLY O 1 1 6 2337 1 1 17 CYS C C 4.668 0.979 2.051 1.00 . A A . 17 CYS C 1 1 6 2338 1 1 17 CYS CA C 5.702 1.013 0.915 1.00 . A A . 17 CYS CA 1 1 6 2339 1 1 17 CYS CB C 5.111 0.409 -0.367 1.00 . A A . 17 CYS CB 1 1 6 2340 1 1 17 CYS H H 7.083 -0.635 0.858 1.00 . A A . 17 CYS H 1 1 6 2341 1 1 17 CYS HA H 5.983 2.040 0.741 1.00 . A A . 17 CYS HA 1 1 6 2342 1 1 17 CYS HB2 H 4.305 -0.264 -0.113 1.00 . A A . 17 CYS HB2 1 1 6 2343 1 1 17 CYS HB3 H 4.677 1.218 -0.934 1.00 . A A . 17 CYS HB3 1 1 6 2344 1 1 17 CYS N N 6.916 0.230 1.287 1.00 . A A . 17 CYS N 1 1 6 2345 1 1 17 CYS O O 4.852 0.303 3.046 1.00 . A A . 17 CYS O 1 1 6 2346 1 1 17 CYS SG S 6.225 -0.478 -1.486 1.00 . A A . 17 CYS SG 1 1 6 2347 1 1 18 SER C C 1.185 2.038 2.125 1.00 . A A . 18 SER C 1 1 6 2348 1 1 18 SER CA C 2.506 1.801 2.861 1.00 . A A . 18 SER CA 1 1 6 2349 1 1 18 SER CB C 2.778 2.968 3.829 1.00 . A A . 18 SER CB 1 1 6 2350 1 1 18 SER H H 3.536 2.235 1.025 1.00 . A A . 18 SER H 1 1 6 2351 1 1 18 SER HA H 2.442 0.868 3.403 1.00 . A A . 18 SER HA 1 1 6 2352 1 1 18 SER HB2 H 2.866 3.910 3.308 1.00 . A A . 18 SER HB2 1 1 6 2353 1 1 18 SER HB3 H 2.018 3.033 4.594 1.00 . A A . 18 SER HB3 1 1 6 2354 1 1 18 SER HG H 4.711 2.772 3.772 1.00 . A A . 18 SER HG 1 1 6 2355 1 1 18 SER N N 3.608 1.721 1.855 1.00 . A A . 18 SER N 1 1 6 2356 1 1 18 SER O O 1.146 2.766 1.150 1.00 . A A . 18 SER O 1 1 6 2357 1 1 18 SER OG O 4.024 2.650 4.433 1.00 . A A . 18 SER OG 1 1 6 2358 1 1 19 CYS C C -1.829 2.911 2.405 1.00 . A A . 19 CYS C 1 1 6 2359 1 1 19 CYS CA C -1.200 1.580 1.970 1.00 . A A . 19 CYS CA 1 1 6 2360 1 1 19 CYS CB C -2.103 0.401 2.377 1.00 . A A . 19 CYS CB 1 1 6 2361 1 1 19 CYS H H 0.236 0.842 3.402 1.00 . A A . 19 CYS H 1 1 6 2362 1 1 19 CYS HA H -1.085 1.580 0.899 1.00 . A A . 19 CYS HA 1 1 6 2363 1 1 19 CYS HB2 H -1.693 -0.501 1.944 1.00 . A A . 19 CYS HB2 1 1 6 2364 1 1 19 CYS HB3 H -2.079 0.293 3.450 1.00 . A A . 19 CYS HB3 1 1 6 2365 1 1 19 CYS N N 0.139 1.416 2.613 1.00 . A A . 19 CYS N 1 1 6 2366 1 1 19 CYS O O -2.603 2.977 3.341 1.00 . A A . 19 CYS O 1 1 6 2367 1 1 19 CYS SG S -3.833 0.526 1.861 1.00 . A A . 19 CYS SG 1 1 6 2368 1 1 20 LYS C C -2.988 5.643 0.873 1.00 . A A . 20 LYS C 1 1 6 2369 1 1 20 LYS CA C -1.961 5.317 1.955 1.00 . A A . 20 LYS CA 1 1 6 2370 1 1 20 LYS CB C -0.788 6.310 1.892 1.00 . A A . 20 LYS CB 1 1 6 2371 1 1 20 LYS CD C 1.182 7.130 3.259 1.00 . A A . 20 LYS CD 1 1 6 2372 1 1 20 LYS CE C 0.524 8.026 4.325 1.00 . A A . 20 LYS CE 1 1 6 2373 1 1 20 LYS CG C 0.269 5.921 2.954 1.00 . A A . 20 LYS CG 1 1 6 2374 1 1 20 LYS H H -0.825 3.799 0.948 1.00 . A A . 20 LYS H 1 1 6 2375 1 1 20 LYS HA H -2.438 5.358 2.924 1.00 . A A . 20 LYS HA 1 1 6 2376 1 1 20 LYS HB2 H -0.341 6.290 0.909 1.00 . A A . 20 LYS HB2 1 1 6 2377 1 1 20 LYS HB3 H -1.160 7.308 2.080 1.00 . A A . 20 LYS HB3 1 1 6 2378 1 1 20 LYS HD2 H 2.133 6.774 3.627 1.00 . A A . 20 LYS HD2 1 1 6 2379 1 1 20 LYS HD3 H 1.359 7.703 2.360 1.00 . A A . 20 LYS HD3 1 1 6 2380 1 1 20 LYS HE2 H -0.399 8.446 3.952 1.00 . A A . 20 LYS HE2 1 1 6 2381 1 1 20 LYS HE3 H 0.314 7.457 5.219 1.00 . A A . 20 LYS HE3 1 1 6 2382 1 1 20 LYS HG2 H -0.213 5.586 3.862 1.00 . A A . 20 LYS HG2 1 1 6 2383 1 1 20 LYS HG3 H 0.874 5.111 2.572 1.00 . A A . 20 LYS HG3 1 1 6 2384 1 1 20 LYS HZ1 H 1.712 9.657 3.817 1.00 . A A . 20 LYS HZ1 1 1 6 2385 1 1 20 LYS HZ2 H 0.960 9.793 5.335 1.00 . A A . 20 LYS HZ2 1 1 6 2386 1 1 20 LYS HZ3 H 2.294 8.759 5.136 1.00 . A A . 20 LYS HZ3 1 1 6 2387 1 1 20 LYS N N -1.454 3.937 1.686 1.00 . A A . 20 LYS N 1 1 6 2388 1 1 20 LYS NZ N 1.441 9.144 4.680 1.00 . A A . 20 LYS NZ 1 1 6 2389 1 1 20 LYS O O -2.829 5.216 -0.254 1.00 . A A . 20 LYS O 1 1 6 2390 1 1 21 ASN C C -5.485 5.636 -0.630 1.00 . A A . 21 ASN C 1 1 6 2391 1 1 21 ASN CA C -5.101 6.793 0.315 1.00 . A A . 21 ASN CA 1 1 6 2392 1 1 21 ASN CB C -4.625 8.060 -0.484 1.00 . A A . 21 ASN CB 1 1 6 2393 1 1 21 ASN CG C -3.350 7.803 -1.304 1.00 . A A . 21 ASN CG 1 1 6 2394 1 1 21 ASN H H -4.041 6.686 2.185 1.00 . A A . 21 ASN H 1 1 6 2395 1 1 21 ASN HA H -5.969 7.050 0.905 1.00 . A A . 21 ASN HA 1 1 6 2396 1 1 21 ASN HB2 H -5.408 8.383 -1.155 1.00 . A A . 21 ASN HB2 1 1 6 2397 1 1 21 ASN HB3 H -4.425 8.863 0.211 1.00 . A A . 21 ASN HB3 1 1 6 2398 1 1 21 ASN HD21 H -2.137 8.230 0.208 1.00 . A A . 21 ASN HD21 1 1 6 2399 1 1 21 ASN HD22 H -1.366 7.797 -1.243 1.00 . A A . 21 ASN HD22 1 1 6 2400 1 1 21 ASN N N -4.002 6.386 1.253 1.00 . A A . 21 ASN N 1 1 6 2401 1 1 21 ASN ND2 N -2.187 7.956 -0.733 1.00 . A A . 21 ASN ND2 1 1 6 2402 1 1 21 ASN O O -5.455 5.758 -1.840 1.00 . A A . 21 ASN O 1 1 6 2403 1 1 21 ASN OD1 O -3.400 7.462 -2.469 1.00 . A A . 21 ASN OD1 1 1 6 2404 1 1 22 LYS C C -5.397 2.916 -1.906 1.00 . A A . 22 LYS C 1 1 6 2405 1 1 22 LYS CA C -6.248 3.266 -0.671 1.00 . A A . 22 LYS CA 1 1 6 2406 1 1 22 LYS CB C -7.768 3.375 -1.060 1.00 . A A . 22 LYS CB 1 1 6 2407 1 1 22 LYS CD C -9.451 4.336 -2.702 1.00 . A A . 22 LYS CD 1 1 6 2408 1 1 22 LYS CE C -9.287 3.534 -4.007 1.00 . A A . 22 LYS CE 1 1 6 2409 1 1 22 LYS CG C -8.069 4.543 -2.035 1.00 . A A . 22 LYS CG 1 1 6 2410 1 1 22 LYS H H -5.814 4.557 0.985 1.00 . A A . 22 LYS H 1 1 6 2411 1 1 22 LYS HA H -6.136 2.464 0.043 1.00 . A A . 22 LYS HA 1 1 6 2412 1 1 22 LYS HB2 H -8.073 2.445 -1.512 1.00 . A A . 22 LYS HB2 1 1 6 2413 1 1 22 LYS HB3 H -8.347 3.512 -0.158 1.00 . A A . 22 LYS HB3 1 1 6 2414 1 1 22 LYS HD2 H -10.122 3.815 -2.035 1.00 . A A . 22 LYS HD2 1 1 6 2415 1 1 22 LYS HD3 H -9.881 5.301 -2.932 1.00 . A A . 22 LYS HD3 1 1 6 2416 1 1 22 LYS HE2 H -8.618 4.046 -4.683 1.00 . A A . 22 LYS HE2 1 1 6 2417 1 1 22 LYS HE3 H -8.892 2.549 -3.801 1.00 . A A . 22 LYS HE3 1 1 6 2418 1 1 22 LYS HG2 H -8.083 5.472 -1.483 1.00 . A A . 22 LYS HG2 1 1 6 2419 1 1 22 LYS HG3 H -7.309 4.609 -2.798 1.00 . A A . 22 LYS HG3 1 1 6 2420 1 1 22 LYS HZ1 H -11.345 3.215 -3.963 1.00 . A A . 22 LYS HZ1 1 1 6 2421 1 1 22 LYS HZ2 H -10.830 4.252 -5.205 1.00 . A A . 22 LYS HZ2 1 1 6 2422 1 1 22 LYS HZ3 H -10.575 2.578 -5.336 1.00 . A A . 22 LYS HZ3 1 1 6 2423 1 1 22 LYS N N -5.831 4.541 0.006 1.00 . A A . 22 LYS N 1 1 6 2424 1 1 22 LYS NZ N -10.610 3.383 -4.678 1.00 . A A . 22 LYS NZ 1 1 6 2425 1 1 22 LYS O O -5.908 2.531 -2.939 1.00 . A A . 22 LYS O 1 1 6 2426 1 1 23 VAL C C -1.810 2.371 -2.028 1.00 . A A . 23 VAL C 1 1 6 2427 1 1 23 VAL CA C -3.095 2.799 -2.779 1.00 . A A . 23 VAL CA 1 1 6 2428 1 1 23 VAL CB C -2.915 4.106 -3.591 1.00 . A A . 23 VAL CB 1 1 6 2429 1 1 23 VAL CG1 C -1.621 4.056 -4.379 1.00 . A A . 23 VAL CG1 1 1 6 2430 1 1 23 VAL CG2 C -4.091 4.291 -4.581 1.00 . A A . 23 VAL CG2 1 1 6 2431 1 1 23 VAL H H -3.760 3.396 -0.882 1.00 . A A . 23 VAL H 1 1 6 2432 1 1 23 VAL HA H -3.439 1.979 -3.381 1.00 . A A . 23 VAL HA 1 1 6 2433 1 1 23 VAL HB H -2.883 4.948 -2.915 1.00 . A A . 23 VAL HB 1 1 6 2434 1 1 23 VAL HG11 H -1.544 3.119 -4.912 1.00 . A A . 23 VAL HG11 1 1 6 2435 1 1 23 VAL HG12 H -1.589 4.872 -5.085 1.00 . A A . 23 VAL HG12 1 1 6 2436 1 1 23 VAL HG13 H -0.789 4.150 -3.699 1.00 . A A . 23 VAL HG13 1 1 6 2437 1 1 23 VAL HG21 H -4.299 3.367 -5.102 1.00 . A A . 23 VAL HG21 1 1 6 2438 1 1 23 VAL HG22 H -4.979 4.599 -4.051 1.00 . A A . 23 VAL HG22 1 1 6 2439 1 1 23 VAL HG23 H -3.854 5.052 -5.309 1.00 . A A . 23 VAL HG23 1 1 6 2440 1 1 23 VAL N N -4.107 3.076 -1.731 1.00 . A A . 23 VAL N 1 1 6 2441 1 1 23 VAL O O -1.428 3.015 -1.070 1.00 . A A . 23 VAL O 1 1 6 2442 1 1 24 CYS C C 1.333 1.423 -2.434 1.00 . A A . 24 CYS C 1 1 6 2443 1 1 24 CYS CA C 0.073 0.820 -1.804 1.00 . A A . 24 CYS CA 1 1 6 2444 1 1 24 CYS CB C 0.107 -0.718 -1.909 1.00 . A A . 24 CYS CB 1 1 6 2445 1 1 24 CYS H H -1.514 0.830 -3.261 1.00 . A A . 24 CYS H 1 1 6 2446 1 1 24 CYS HA H 0.053 1.092 -0.762 1.00 . A A . 24 CYS HA 1 1 6 2447 1 1 24 CYS HB2 H -0.110 -1.012 -2.923 1.00 . A A . 24 CYS HB2 1 1 6 2448 1 1 24 CYS HB3 H 1.113 -1.043 -1.699 1.00 . A A . 24 CYS HB3 1 1 6 2449 1 1 24 CYS N N -1.177 1.311 -2.476 1.00 . A A . 24 CYS N 1 1 6 2450 1 1 24 CYS O O 2.055 0.745 -3.139 1.00 . A A . 24 CYS O 1 1 6 2451 1 1 24 CYS SG S -0.977 -1.651 -0.801 1.00 . A A . 24 CYS SG 1 1 6 2452 1 1 25 TYR C C 3.692 3.779 -1.536 1.00 . A A . 25 TYR C 1 1 6 2453 1 1 25 TYR CA C 2.740 3.426 -2.685 1.00 . A A . 25 TYR CA 1 1 6 2454 1 1 25 TYR CB C 2.276 4.716 -3.364 1.00 . A A . 25 TYR CB 1 1 6 2455 1 1 25 TYR CD1 C 1.272 3.221 -5.226 1.00 . A A . 25 TYR CD1 1 1 6 2456 1 1 25 TYR CD2 C 1.101 5.582 -5.409 1.00 . A A . 25 TYR CD2 1 1 6 2457 1 1 25 TYR CE1 C 0.591 3.075 -6.412 1.00 . A A . 25 TYR CE1 1 1 6 2458 1 1 25 TYR CE2 C 0.420 5.436 -6.598 1.00 . A A . 25 TYR CE2 1 1 6 2459 1 1 25 TYR CG C 1.537 4.480 -4.702 1.00 . A A . 25 TYR CG 1 1 6 2460 1 1 25 TYR CZ C 0.159 4.182 -7.110 1.00 . A A . 25 TYR CZ 1 1 6 2461 1 1 25 TYR H H 0.925 3.166 -1.574 1.00 . A A . 25 TYR H 1 1 6 2462 1 1 25 TYR HA H 3.266 2.828 -3.412 1.00 . A A . 25 TYR HA 1 1 6 2463 1 1 25 TYR HB2 H 1.615 5.242 -2.695 1.00 . A A . 25 TYR HB2 1 1 6 2464 1 1 25 TYR HB3 H 3.125 5.349 -3.546 1.00 . A A . 25 TYR HB3 1 1 6 2465 1 1 25 TYR HD1 H 1.595 2.331 -4.721 1.00 . A A . 25 TYR HD1 1 1 6 2466 1 1 25 TYR HD2 H 1.296 6.573 -5.028 1.00 . A A . 25 TYR HD2 1 1 6 2467 1 1 25 TYR HE1 H 0.392 2.082 -6.786 1.00 . A A . 25 TYR HE1 1 1 6 2468 1 1 25 TYR HE2 H 0.082 6.315 -7.122 1.00 . A A . 25 TYR HE2 1 1 6 2469 1 1 25 TYR HH H -0.241 3.215 -8.709 1.00 . A A . 25 TYR HH 1 1 6 2470 1 1 25 TYR N N 1.551 2.685 -2.152 1.00 . A A . 25 TYR N 1 1 6 2471 1 1 25 TYR O O 3.335 3.676 -0.379 1.00 . A A . 25 TYR O 1 1 6 2472 1 1 25 TYR OH O -0.522 4.037 -8.301 1.00 . A A . 25 TYR OH 1 1 6 2473 1 1 26 ARG C C 6.221 6.061 -1.131 1.00 . A A . 26 ARG C 1 1 6 2474 1 1 26 ARG CA C 5.922 4.575 -0.906 1.00 . A A . 26 ARG CA 1 1 6 2475 1 1 26 ARG CB C 7.188 3.701 -1.130 1.00 . A A . 26 ARG CB 1 1 6 2476 1 1 26 ARG CD C 9.414 4.314 0.000 1.00 . A A . 26 ARG CD 1 1 6 2477 1 1 26 ARG CG C 8.034 3.622 0.168 1.00 . A A . 26 ARG CG 1 1 6 2478 1 1 26 ARG CZ C 10.705 2.856 1.500 1.00 . A A . 26 ARG CZ 1 1 6 2479 1 1 26 ARG H H 5.076 4.246 -2.863 1.00 . A A . 26 ARG H 1 1 6 2480 1 1 26 ARG HA H 5.538 4.441 0.096 1.00 . A A . 26 ARG HA 1 1 6 2481 1 1 26 ARG HB2 H 6.874 2.702 -1.391 1.00 . A A . 26 ARG HB2 1 1 6 2482 1 1 26 ARG HB3 H 7.782 4.080 -1.946 1.00 . A A . 26 ARG HB3 1 1 6 2483 1 1 26 ARG HD2 H 9.558 4.688 -1.004 1.00 . A A . 26 ARG HD2 1 1 6 2484 1 1 26 ARG HD3 H 9.512 5.138 0.691 1.00 . A A . 26 ARG HD3 1 1 6 2485 1 1 26 ARG HE H 11.053 2.991 -0.445 1.00 . A A . 26 ARG HE 1 1 6 2486 1 1 26 ARG HG2 H 7.511 4.071 1.000 1.00 . A A . 26 ARG HG2 1 1 6 2487 1 1 26 ARG HG3 H 8.192 2.579 0.397 1.00 . A A . 26 ARG HG3 1 1 6 2488 1 1 26 ARG HH11 H 9.249 3.936 2.357 1.00 . A A . 26 ARG HH11 1 1 6 2489 1 1 26 ARG HH12 H 10.147 2.908 3.423 1.00 . A A . 26 ARG HH12 1 1 6 2490 1 1 26 ARG HH21 H 12.206 1.687 0.883 1.00 . A A . 26 ARG HH21 1 1 6 2491 1 1 26 ARG HH22 H 11.847 1.615 2.576 1.00 . A A . 26 ARG HH22 1 1 6 2492 1 1 26 ARG N N 4.878 4.190 -1.906 1.00 . A A . 26 ARG N 1 1 6 2493 1 1 26 ARG NE N 10.493 3.314 0.289 1.00 . A A . 26 ARG NE 1 1 6 2494 1 1 26 ARG NH1 N 9.976 3.267 2.505 1.00 . A A . 26 ARG NH1 1 1 6 2495 1 1 26 ARG NH2 N 11.660 1.985 1.666 1.00 . A A . 26 ARG NH2 1 1 6 2496 1 1 26 ARG O O 7.092 6.430 -1.896 1.00 . A A . 26 ARG O 1 1 6 2497 1 1 27 ASN C C 5.286 8.842 -1.947 1.00 . A A . 27 ASN C 1 1 6 2498 1 1 27 ASN CA C 5.593 8.360 -0.516 1.00 . A A . 27 ASN CA 1 1 6 2499 1 1 27 ASN CB C 7.042 8.776 -0.090 1.00 . A A . 27 ASN CB 1 1 6 2500 1 1 27 ASN CG C 7.387 8.126 1.259 1.00 . A A . 27 ASN CG 1 1 6 2501 1 1 27 ASN H H 4.783 6.487 0.158 1.00 . A A . 27 ASN H 1 1 6 2502 1 1 27 ASN HA H 4.873 8.803 0.157 1.00 . A A . 27 ASN HA 1 1 6 2503 1 1 27 ASN HB2 H 7.776 8.472 -0.822 1.00 . A A . 27 ASN HB2 1 1 6 2504 1 1 27 ASN HB3 H 7.095 9.848 0.024 1.00 . A A . 27 ASN HB3 1 1 6 2505 1 1 27 ASN HD21 H 7.908 6.396 0.437 1.00 . A A . 27 ASN HD21 1 1 6 2506 1 1 27 ASN HD22 H 8.033 6.461 2.129 1.00 . A A . 27 ASN HD22 1 1 6 2507 1 1 27 ASN N N 5.462 6.871 -0.435 1.00 . A A . 27 ASN N 1 1 6 2508 1 1 27 ASN ND2 N 7.812 6.892 1.277 1.00 . A A . 27 ASN ND2 1 1 6 2509 1 1 27 ASN O O 6.045 9.568 -2.561 1.00 . A A . 27 ASN O 1 1 6 2510 1 1 27 ASN OD1 O 7.273 8.735 2.304 1.00 . A A . 27 ASN OD1 1 1 6 2511 1 1 28 GLY C C 4.306 7.969 -4.952 1.00 . A A . 28 GLY C 1 1 6 2512 1 1 28 GLY CA C 3.674 8.758 -3.795 1.00 . A A . 28 GLY CA 1 1 6 2513 1 1 28 GLY H H 3.591 7.816 -1.879 1.00 . A A . 28 GLY H 1 1 6 2514 1 1 28 GLY HA2 H 2.605 8.599 -3.826 1.00 . A A . 28 GLY HA2 1 1 6 2515 1 1 28 GLY HA3 H 3.858 9.807 -3.944 1.00 . A A . 28 GLY HA3 1 1 6 2516 1 1 28 GLY N N 4.150 8.398 -2.428 1.00 . A A . 28 GLY N 1 1 6 2517 1 1 28 GLY O O 3.919 8.180 -6.086 1.00 . A A . 28 GLY O 1 1 6 2518 1 1 29 ILE C C 5.066 5.012 -5.987 1.00 . A A . 29 ILE C 1 1 6 2519 1 1 29 ILE CA C 5.881 6.307 -5.773 1.00 . A A . 29 ILE CA 1 1 6 2520 1 1 29 ILE CB C 7.371 5.998 -5.371 1.00 . A A . 29 ILE CB 1 1 6 2521 1 1 29 ILE CD1 C 8.161 4.420 -7.284 1.00 . A A . 29 ILE CD1 1 1 6 2522 1 1 29 ILE CG1 C 8.270 5.829 -6.644 1.00 . A A . 29 ILE CG1 1 1 6 2523 1 1 29 ILE CG2 C 7.502 4.780 -4.427 1.00 . A A . 29 ILE CG2 1 1 6 2524 1 1 29 ILE H H 5.521 6.955 -3.737 1.00 . A A . 29 ILE H 1 1 6 2525 1 1 29 ILE HA H 5.876 6.908 -6.668 1.00 . A A . 29 ILE HA 1 1 6 2526 1 1 29 ILE HB H 7.745 6.858 -4.834 1.00 . A A . 29 ILE HB 1 1 6 2527 1 1 29 ILE HD11 H 7.162 4.024 -7.203 1.00 . A A . 29 ILE HD11 1 1 6 2528 1 1 29 ILE HD12 H 8.425 4.474 -8.330 1.00 . A A . 29 ILE HD12 1 1 6 2529 1 1 29 ILE HD13 H 8.842 3.738 -6.795 1.00 . A A . 29 ILE HD13 1 1 6 2530 1 1 29 ILE HG12 H 7.998 6.571 -7.381 1.00 . A A . 29 ILE HG12 1 1 6 2531 1 1 29 ILE HG13 H 9.299 6.001 -6.366 1.00 . A A . 29 ILE HG13 1 1 6 2532 1 1 29 ILE HG21 H 6.759 4.852 -3.650 1.00 . A A . 29 ILE HG21 1 1 6 2533 1 1 29 ILE HG22 H 7.354 3.847 -4.949 1.00 . A A . 29 ILE HG22 1 1 6 2534 1 1 29 ILE HG23 H 8.482 4.773 -3.974 1.00 . A A . 29 ILE HG23 1 1 6 2535 1 1 29 ILE N N 5.242 7.094 -4.666 1.00 . A A . 29 ILE N 1 1 6 2536 1 1 29 ILE O O 4.782 4.317 -5.030 1.00 . A A . 29 ILE O 1 1 6 2537 1 1 30 PRO C C 4.683 2.201 -7.166 1.00 . A A . 30 PRO C 1 1 6 2538 1 1 30 PRO CA C 3.911 3.481 -7.512 1.00 . A A . 30 PRO CA 1 1 6 2539 1 1 30 PRO CB C 3.551 3.560 -8.998 1.00 . A A . 30 PRO CB 1 1 6 2540 1 1 30 PRO CD C 4.999 5.508 -8.440 1.00 . A A . 30 PRO CD 1 1 6 2541 1 1 30 PRO CG C 4.301 4.764 -9.590 1.00 . A A . 30 PRO CG 1 1 6 2542 1 1 30 PRO HA H 3.016 3.513 -6.918 1.00 . A A . 30 PRO HA 1 1 6 2543 1 1 30 PRO HB2 H 3.830 2.655 -9.519 1.00 . A A . 30 PRO HB2 1 1 6 2544 1 1 30 PRO HB3 H 2.483 3.694 -9.096 1.00 . A A . 30 PRO HB3 1 1 6 2545 1 1 30 PRO HD2 H 6.066 5.556 -8.593 1.00 . A A . 30 PRO HD2 1 1 6 2546 1 1 30 PRO HD3 H 4.593 6.503 -8.325 1.00 . A A . 30 PRO HD3 1 1 6 2547 1 1 30 PRO HG2 H 5.034 4.426 -10.309 1.00 . A A . 30 PRO HG2 1 1 6 2548 1 1 30 PRO HG3 H 3.604 5.423 -10.088 1.00 . A A . 30 PRO HG3 1 1 6 2549 1 1 30 PRO N N 4.699 4.707 -7.215 1.00 . A A . 30 PRO N 1 1 6 2550 1 1 30 PRO O O 5.535 1.751 -7.908 1.00 . A A . 30 PRO O 1 1 7 2551 1 1 1 CYS C C 6.276 0.947 0.876 1.00 . A A . 1 CYS C 1 1 7 2552 1 1 1 CYS CA C 6.330 -0.583 0.923 1.00 . A A . 1 CYS CA 1 1 7 2553 1 1 1 CYS CB C 5.473 -1.178 -0.189 1.00 . A A . 1 CYS CB 1 1 7 2554 1 1 1 CYS HA H 7.355 -0.910 0.825 1.00 . A A . 1 CYS HA 1 1 7 2555 1 1 1 CYS HB2 H 4.482 -1.318 0.197 1.00 . A A . 1 CYS HB2 1 1 7 2556 1 1 1 CYS HB3 H 5.395 -0.455 -0.986 1.00 . A A . 1 CYS HB3 1 1 7 2557 1 1 1 CYS N N 5.785 -1.030 2.239 1.00 . A A . 1 CYS N 1 1 7 2558 1 1 1 CYS O O 7.240 1.588 0.505 1.00 . A A . 1 CYS O 1 1 7 2559 1 1 1 CYS SG S 5.980 -2.746 -0.935 1.00 . A A . 1 CYS SG 1 1 7 2560 1 1 2 GLY C C 4.033 3.341 2.424 1.00 . A A . 2 GLY C 1 1 7 2561 1 1 2 GLY CA C 4.948 2.951 1.266 1.00 . A A . 2 GLY CA 1 1 7 2562 1 1 2 GLY H H 4.395 0.904 1.546 1.00 . A A . 2 GLY H 1 1 7 2563 1 1 2 GLY HA2 H 5.899 3.449 1.386 1.00 . A A . 2 GLY HA2 1 1 7 2564 1 1 2 GLY HA3 H 4.496 3.254 0.332 1.00 . A A . 2 GLY HA3 1 1 7 2565 1 1 2 GLY N N 5.139 1.476 1.259 1.00 . A A . 2 GLY N 1 1 7 2566 1 1 2 GLY O O 4.505 3.667 3.496 1.00 . A A . 2 GLY O 1 1 7 2567 1 1 3 GLU C C 0.304 3.530 2.596 1.00 . A A . 3 GLU C 1 1 7 2568 1 1 3 GLU CA C 1.710 3.636 3.183 1.00 . A A . 3 GLU CA 1 1 7 2569 1 1 3 GLU CB C 1.916 5.078 3.668 1.00 . A A . 3 GLU CB 1 1 7 2570 1 1 3 GLU CD C 0.948 6.488 5.511 1.00 . A A . 3 GLU CD 1 1 7 2571 1 1 3 GLU CG C 1.684 5.175 5.194 1.00 . A A . 3 GLU CG 1 1 7 2572 1 1 3 GLU H H 2.474 2.984 1.271 1.00 . A A . 3 GLU H 1 1 7 2573 1 1 3 GLU HA H 1.789 2.933 3.995 1.00 . A A . 3 GLU HA 1 1 7 2574 1 1 3 GLU HB2 H 2.915 5.361 3.421 1.00 . A A . 3 GLU HB2 1 1 7 2575 1 1 3 GLU HB3 H 1.255 5.744 3.133 1.00 . A A . 3 GLU HB3 1 1 7 2576 1 1 3 GLU HG2 H 1.087 4.349 5.555 1.00 . A A . 3 GLU HG2 1 1 7 2577 1 1 3 GLU HG3 H 2.634 5.160 5.711 1.00 . A A . 3 GLU HG3 1 1 7 2578 1 1 3 GLU N N 2.751 3.280 2.161 1.00 . A A . 3 GLU N 1 1 7 2579 1 1 3 GLU O O 0.127 3.014 1.514 1.00 . A A . 3 GLU O 1 1 7 2580 1 1 3 GLU OE1 O -0.261 6.484 5.339 1.00 . A A . 3 GLU OE1 1 1 7 2581 1 1 3 GLU OE2 O 1.631 7.418 5.906 1.00 . A A . 3 GLU OE2 1 1 7 2582 1 1 4 SER C C -2.307 4.436 1.460 1.00 . A A . 4 SER C 1 1 7 2583 1 1 4 SER CA C -2.079 4.014 2.910 1.00 . A A . 4 SER CA 1 1 7 2584 1 1 4 SER CB C -2.899 4.934 3.823 1.00 . A A . 4 SER CB 1 1 7 2585 1 1 4 SER H H -0.423 4.445 4.197 1.00 . A A . 4 SER H 1 1 7 2586 1 1 4 SER HA H -2.432 3.006 3.009 1.00 . A A . 4 SER HA 1 1 7 2587 1 1 4 SER HB2 H -2.734 5.969 3.574 1.00 . A A . 4 SER HB2 1 1 7 2588 1 1 4 SER HB3 H -3.950 4.704 3.762 1.00 . A A . 4 SER HB3 1 1 7 2589 1 1 4 SER HG H -2.183 3.744 5.192 1.00 . A A . 4 SER HG 1 1 7 2590 1 1 4 SER N N -0.650 4.038 3.337 1.00 . A A . 4 SER N 1 1 7 2591 1 1 4 SER O O -1.612 5.267 0.910 1.00 . A A . 4 SER O 1 1 7 2592 1 1 4 SER OG O -2.442 4.667 5.143 1.00 . A A . 4 SER OG 1 1 7 2593 1 1 5 CYS C C -5.266 4.253 -0.519 1.00 . A A . 5 CYS C 1 1 7 2594 1 1 5 CYS CA C -3.746 4.028 -0.486 1.00 . A A . 5 CYS CA 1 1 7 2595 1 1 5 CYS CB C -3.319 2.782 -1.270 1.00 . A A . 5 CYS CB 1 1 7 2596 1 1 5 CYS H H -3.803 3.165 1.456 1.00 . A A . 5 CYS H 1 1 7 2597 1 1 5 CYS HA H -3.265 4.915 -0.845 1.00 . A A . 5 CYS HA 1 1 7 2598 1 1 5 CYS HB2 H -3.980 2.655 -2.110 1.00 . A A . 5 CYS HB2 1 1 7 2599 1 1 5 CYS HB3 H -2.321 2.934 -1.653 1.00 . A A . 5 CYS HB3 1 1 7 2600 1 1 5 CYS N N -3.313 3.808 0.916 1.00 . A A . 5 CYS N 1 1 7 2601 1 1 5 CYS O O -5.950 3.880 -1.454 1.00 . A A . 5 CYS O 1 1 7 2602 1 1 5 CYS SG S -3.336 1.226 -0.346 1.00 . A A . 5 CYS SG 1 1 7 2603 1 1 6 VAL C C -7.648 6.140 -0.433 1.00 . A A . 6 VAL C 1 1 7 2604 1 1 6 VAL CA C -7.192 5.181 0.677 1.00 . A A . 6 VAL CA 1 1 7 2605 1 1 6 VAL CB C -7.418 5.810 2.081 1.00 . A A . 6 VAL CB 1 1 7 2606 1 1 6 VAL CG1 C -8.900 6.226 2.254 1.00 . A A . 6 VAL CG1 1 1 7 2607 1 1 6 VAL CG2 C -7.063 4.772 3.166 1.00 . A A . 6 VAL CG2 1 1 7 2608 1 1 6 VAL H H -5.109 5.146 1.233 1.00 . A A . 6 VAL H 1 1 7 2609 1 1 6 VAL HA H -7.746 4.257 0.596 1.00 . A A . 6 VAL HA 1 1 7 2610 1 1 6 VAL HB H -6.784 6.678 2.196 1.00 . A A . 6 VAL HB 1 1 7 2611 1 1 6 VAL HG11 H -9.555 5.414 1.976 1.00 . A A . 6 VAL HG11 1 1 7 2612 1 1 6 VAL HG12 H -9.094 6.492 3.284 1.00 . A A . 6 VAL HG12 1 1 7 2613 1 1 6 VAL HG13 H -9.122 7.081 1.633 1.00 . A A . 6 VAL HG13 1 1 7 2614 1 1 6 VAL HG21 H -6.047 4.431 3.039 1.00 . A A . 6 VAL HG21 1 1 7 2615 1 1 6 VAL HG22 H -7.157 5.215 4.147 1.00 . A A . 6 VAL HG22 1 1 7 2616 1 1 6 VAL HG23 H -7.725 3.921 3.104 1.00 . A A . 6 VAL HG23 1 1 7 2617 1 1 6 VAL N N -5.736 4.875 0.531 1.00 . A A . 6 VAL N 1 1 7 2618 1 1 6 VAL O O -8.539 5.824 -1.198 1.00 . A A . 6 VAL O 1 1 7 2619 1 1 7 TRP C C -6.964 7.830 -2.901 1.00 . A A . 7 TRP C 1 1 7 2620 1 1 7 TRP CA C -7.340 8.315 -1.497 1.00 . A A . 7 TRP CA 1 1 7 2621 1 1 7 TRP CB C -6.570 9.604 -1.151 1.00 . A A . 7 TRP CB 1 1 7 2622 1 1 7 TRP CD1 C -8.324 11.001 -2.466 1.00 . A A . 7 TRP CD1 1 1 7 2623 1 1 7 TRP CD2 C -6.252 11.787 -2.503 1.00 . A A . 7 TRP CD2 1 1 7 2624 1 1 7 TRP CE2 C -7.048 12.652 -3.251 1.00 . A A . 7 TRP CE2 1 1 7 2625 1 1 7 TRP CE3 C -4.889 12.052 -2.361 1.00 . A A . 7 TRP CE3 1 1 7 2626 1 1 7 TRP CG C -7.044 10.781 -2.027 1.00 . A A . 7 TRP CG 1 1 7 2627 1 1 7 TRP CH2 C -5.129 14.037 -3.713 1.00 . A A . 7 TRP CH2 1 1 7 2628 1 1 7 TRP CZ2 C -6.490 13.774 -3.855 1.00 . A A . 7 TRP CZ2 1 1 7 2629 1 1 7 TRP CZ3 C -4.330 13.175 -2.966 1.00 . A A . 7 TRP CZ3 1 1 7 2630 1 1 7 TRP H H -6.306 7.462 0.173 1.00 . A A . 7 TRP H 1 1 7 2631 1 1 7 TRP HA H -8.401 8.491 -1.450 1.00 . A A . 7 TRP HA 1 1 7 2632 1 1 7 TRP HB2 H -6.732 9.857 -0.115 1.00 . A A . 7 TRP HB2 1 1 7 2633 1 1 7 TRP HB3 H -5.511 9.456 -1.304 1.00 . A A . 7 TRP HB3 1 1 7 2634 1 1 7 TRP HD1 H -9.204 10.405 -2.277 1.00 . A A . 7 TRP HD1 1 1 7 2635 1 1 7 TRP HE1 H -9.024 12.500 -3.606 1.00 . A A . 7 TRP HE1 1 1 7 2636 1 1 7 TRP HE3 H -4.266 11.387 -1.782 1.00 . A A . 7 TRP HE3 1 1 7 2637 1 1 7 TRP HH2 H -4.695 14.907 -4.182 1.00 . A A . 7 TRP HH2 1 1 7 2638 1 1 7 TRP HZ2 H -7.111 14.443 -4.435 1.00 . A A . 7 TRP HZ2 1 1 7 2639 1 1 7 TRP HZ3 H -3.274 13.378 -2.856 1.00 . A A . 7 TRP HZ3 1 1 7 2640 1 1 7 TRP N N -7.011 7.281 -0.476 1.00 . A A . 7 TRP N 1 1 7 2641 1 1 7 TRP NE1 N -8.241 12.104 -3.167 1.00 . A A . 7 TRP NE1 1 1 7 2642 1 1 7 TRP O O -7.788 7.816 -3.795 1.00 . A A . 7 TRP O 1 1 7 2643 1 1 8 ILE C C -4.180 5.799 -4.088 1.00 . A A . 8 ILE C 1 1 7 2644 1 1 8 ILE CA C -5.183 6.951 -4.329 1.00 . A A . 8 ILE CA 1 1 7 2645 1 1 8 ILE CB C -4.466 8.112 -5.093 1.00 . A A . 8 ILE CB 1 1 7 2646 1 1 8 ILE CD1 C -2.894 8.808 -3.201 1.00 . A A . 8 ILE CD1 1 1 7 2647 1 1 8 ILE CG1 C -4.003 9.277 -4.163 1.00 . A A . 8 ILE CG1 1 1 7 2648 1 1 8 ILE CG2 C -5.424 8.688 -6.158 1.00 . A A . 8 ILE CG2 1 1 7 2649 1 1 8 ILE H H -5.118 7.496 -2.270 1.00 . A A . 8 ILE H 1 1 7 2650 1 1 8 ILE HA H -6.014 6.577 -4.894 1.00 . A A . 8 ILE HA 1 1 7 2651 1 1 8 ILE HB H -3.601 7.705 -5.588 1.00 . A A . 8 ILE HB 1 1 7 2652 1 1 8 ILE HD11 H -2.225 8.121 -3.698 1.00 . A A . 8 ILE HD11 1 1 7 2653 1 1 8 ILE HD12 H -2.324 9.659 -2.861 1.00 . A A . 8 ILE HD12 1 1 7 2654 1 1 8 ILE HD13 H -3.325 8.317 -2.341 1.00 . A A . 8 ILE HD13 1 1 7 2655 1 1 8 ILE HG12 H -3.614 10.083 -4.769 1.00 . A A . 8 ILE HG12 1 1 7 2656 1 1 8 ILE HG13 H -4.840 9.657 -3.600 1.00 . A A . 8 ILE HG13 1 1 7 2657 1 1 8 ILE HG21 H -5.746 7.908 -6.832 1.00 . A A . 8 ILE HG21 1 1 7 2658 1 1 8 ILE HG22 H -6.295 9.121 -5.686 1.00 . A A . 8 ILE HG22 1 1 7 2659 1 1 8 ILE HG23 H -4.924 9.453 -6.733 1.00 . A A . 8 ILE HG23 1 1 7 2660 1 1 8 ILE N N -5.720 7.451 -3.034 1.00 . A A . 8 ILE N 1 1 7 2661 1 1 8 ILE O O -3.497 5.798 -3.083 1.00 . A A . 8 ILE O 1 1 7 2662 1 1 9 PRO C C -1.709 4.192 -5.231 1.00 . A A . 9 PRO C 1 1 7 2663 1 1 9 PRO CA C -3.140 3.720 -4.929 1.00 . A A . 9 PRO CA 1 1 7 2664 1 1 9 PRO CB C -3.633 2.694 -5.943 1.00 . A A . 9 PRO CB 1 1 7 2665 1 1 9 PRO CD C -4.979 4.765 -6.219 1.00 . A A . 9 PRO CD 1 1 7 2666 1 1 9 PRO CG C -4.584 3.439 -6.894 1.00 . A A . 9 PRO CG 1 1 7 2667 1 1 9 PRO HA H -3.166 3.300 -3.938 1.00 . A A . 9 PRO HA 1 1 7 2668 1 1 9 PRO HB2 H -2.809 2.265 -6.496 1.00 . A A . 9 PRO HB2 1 1 7 2669 1 1 9 PRO HB3 H -4.164 1.901 -5.436 1.00 . A A . 9 PRO HB3 1 1 7 2670 1 1 9 PRO HD2 H -4.784 5.609 -6.863 1.00 . A A . 9 PRO HD2 1 1 7 2671 1 1 9 PRO HD3 H -6.020 4.747 -5.927 1.00 . A A . 9 PRO HD3 1 1 7 2672 1 1 9 PRO HG2 H -4.088 3.638 -7.833 1.00 . A A . 9 PRO HG2 1 1 7 2673 1 1 9 PRO HG3 H -5.465 2.843 -7.083 1.00 . A A . 9 PRO HG3 1 1 7 2674 1 1 9 PRO N N -4.113 4.852 -5.002 1.00 . A A . 9 PRO N 1 1 7 2675 1 1 9 PRO O O -1.514 5.203 -5.879 1.00 . A A . 9 PRO O 1 1 7 2676 1 1 10 CYS C C 1.066 3.444 -6.414 1.00 . A A . 10 CYS C 1 1 7 2677 1 1 10 CYS CA C 0.683 3.782 -4.970 1.00 . A A . 10 CYS CA 1 1 7 2678 1 1 10 CYS CB C 1.560 2.978 -3.990 1.00 . A A . 10 CYS CB 1 1 7 2679 1 1 10 CYS H H -0.988 2.637 -4.232 1.00 . A A . 10 CYS H 1 1 7 2680 1 1 10 CYS HA H 0.825 4.841 -4.803 1.00 . A A . 10 CYS HA 1 1 7 2681 1 1 10 CYS HB2 H 2.588 3.084 -4.307 1.00 . A A . 10 CYS HB2 1 1 7 2682 1 1 10 CYS HB3 H 1.485 3.442 -3.019 1.00 . A A . 10 CYS HB3 1 1 7 2683 1 1 10 CYS N N -0.755 3.437 -4.746 1.00 . A A . 10 CYS N 1 1 7 2684 1 1 10 CYS O O 0.557 2.496 -6.978 1.00 . A A . 10 CYS O 1 1 7 2685 1 1 10 CYS SG S 1.248 1.205 -3.779 1.00 . A A . 10 CYS SG 1 1 7 2686 1 1 11 ILE C C 3.708 3.194 -8.376 1.00 . A A . 11 ILE C 1 1 7 2687 1 1 11 ILE CA C 2.423 4.031 -8.365 1.00 . A A . 11 ILE CA 1 1 7 2688 1 1 11 ILE CB C 2.676 5.409 -9.011 1.00 . A A . 11 ILE CB 1 1 7 2689 1 1 11 ILE CD1 C 1.733 7.766 -9.212 1.00 . A A . 11 ILE CD1 1 1 7 2690 1 1 11 ILE CG1 C 1.391 6.290 -8.923 1.00 . A A . 11 ILE CG1 1 1 7 2691 1 1 11 ILE CG2 C 3.085 5.233 -10.498 1.00 . A A . 11 ILE CG2 1 1 7 2692 1 1 11 ILE H H 2.318 4.981 -6.436 1.00 . A A . 11 ILE H 1 1 7 2693 1 1 11 ILE HA H 1.665 3.532 -8.934 1.00 . A A . 11 ILE HA 1 1 7 2694 1 1 11 ILE HB H 3.477 5.868 -8.465 1.00 . A A . 11 ILE HB 1 1 7 2695 1 1 11 ILE HD11 H 2.643 8.051 -8.703 1.00 . A A . 11 ILE HD11 1 1 7 2696 1 1 11 ILE HD12 H 1.863 7.920 -10.273 1.00 . A A . 11 ILE HD12 1 1 7 2697 1 1 11 ILE HD13 H 0.931 8.400 -8.866 1.00 . A A . 11 ILE HD13 1 1 7 2698 1 1 11 ILE HG12 H 0.655 5.941 -9.633 1.00 . A A . 11 ILE HG12 1 1 7 2699 1 1 11 ILE HG13 H 0.960 6.228 -7.934 1.00 . A A . 11 ILE HG13 1 1 7 2700 1 1 11 ILE HG21 H 2.308 4.716 -11.042 1.00 . A A . 11 ILE HG21 1 1 7 2701 1 1 11 ILE HG22 H 3.249 6.196 -10.956 1.00 . A A . 11 ILE HG22 1 1 7 2702 1 1 11 ILE HG23 H 4.000 4.664 -10.573 1.00 . A A . 11 ILE HG23 1 1 7 2703 1 1 11 ILE N N 1.953 4.238 -6.960 1.00 . A A . 11 ILE N 1 1 7 2704 1 1 11 ILE O O 3.819 2.228 -9.108 1.00 . A A . 11 ILE O 1 1 7 2705 1 1 12 SER C C 5.743 1.488 -6.876 1.00 . A A . 12 SER C 1 1 7 2706 1 1 12 SER CA C 5.945 2.893 -7.447 1.00 . A A . 12 SER CA 1 1 7 2707 1 1 12 SER CB C 6.868 3.712 -6.533 1.00 . A A . 12 SER CB 1 1 7 2708 1 1 12 SER H H 4.485 4.384 -6.989 1.00 . A A . 12 SER H 1 1 7 2709 1 1 12 SER HA H 6.369 2.822 -8.434 1.00 . A A . 12 SER HA 1 1 7 2710 1 1 12 SER HB2 H 6.412 3.913 -5.575 1.00 . A A . 12 SER HB2 1 1 7 2711 1 1 12 SER HB3 H 7.822 3.228 -6.401 1.00 . A A . 12 SER HB3 1 1 7 2712 1 1 12 SER HG H 7.925 5.267 -7.026 1.00 . A A . 12 SER HG 1 1 7 2713 1 1 12 SER N N 4.639 3.601 -7.552 1.00 . A A . 12 SER N 1 1 7 2714 1 1 12 SER O O 6.122 0.503 -7.480 1.00 . A A . 12 SER O 1 1 7 2715 1 1 12 SER OG O 7.049 4.933 -7.234 1.00 . A A . 12 SER OG 1 1 7 2716 1 1 13 ALA C C 3.803 -0.678 -5.739 1.00 . A A . 13 ALA C 1 1 7 2717 1 1 13 ALA CA C 4.862 0.173 -5.013 1.00 . A A . 13 ALA CA 1 1 7 2718 1 1 13 ALA CB C 4.403 0.512 -3.582 1.00 . A A . 13 ALA CB 1 1 7 2719 1 1 13 ALA H H 4.866 2.294 -5.295 1.00 . A A . 13 ALA H 1 1 7 2720 1 1 13 ALA HA H 5.784 -0.383 -4.967 1.00 . A A . 13 ALA HA 1 1 7 2721 1 1 13 ALA HB1 H 3.904 1.468 -3.562 1.00 . A A . 13 ALA HB1 1 1 7 2722 1 1 13 ALA HB2 H 3.729 -0.239 -3.198 1.00 . A A . 13 ALA HB2 1 1 7 2723 1 1 13 ALA HB3 H 5.265 0.567 -2.935 1.00 . A A . 13 ALA HB3 1 1 7 2724 1 1 13 ALA N N 5.140 1.457 -5.715 1.00 . A A . 13 ALA N 1 1 7 2725 1 1 13 ALA O O 3.535 -1.790 -5.331 1.00 . A A . 13 ALA O 1 1 7 2726 1 1 14 ALA C C 2.801 -2.185 -8.150 1.00 . A A . 14 ALA C 1 1 7 2727 1 1 14 ALA CA C 2.192 -0.905 -7.559 1.00 . A A . 14 ALA CA 1 1 7 2728 1 1 14 ALA CB C 1.651 -0.021 -8.695 1.00 . A A . 14 ALA CB 1 1 7 2729 1 1 14 ALA H H 3.484 0.756 -7.081 1.00 . A A . 14 ALA H 1 1 7 2730 1 1 14 ALA HA H 1.388 -1.173 -6.888 1.00 . A A . 14 ALA HA 1 1 7 2731 1 1 14 ALA HB1 H 1.687 1.017 -8.409 1.00 . A A . 14 ALA HB1 1 1 7 2732 1 1 14 ALA HB2 H 2.237 -0.144 -9.594 1.00 . A A . 14 ALA HB2 1 1 7 2733 1 1 14 ALA HB3 H 0.625 -0.286 -8.911 1.00 . A A . 14 ALA HB3 1 1 7 2734 1 1 14 ALA N N 3.231 -0.146 -6.793 1.00 . A A . 14 ALA N 1 1 7 2735 1 1 14 ALA O O 2.246 -3.259 -8.020 1.00 . A A . 14 ALA O 1 1 7 2736 1 1 15 LEU C C 5.513 -3.874 -8.367 1.00 . A A . 15 LEU C 1 1 7 2737 1 1 15 LEU CA C 4.668 -3.132 -9.417 1.00 . A A . 15 LEU CA 1 1 7 2738 1 1 15 LEU CB C 5.545 -2.533 -10.543 1.00 . A A . 15 LEU CB 1 1 7 2739 1 1 15 LEU CD1 C 5.436 -0.844 -12.429 1.00 . A A . 15 LEU CD1 1 1 7 2740 1 1 15 LEU CD2 C 4.142 -2.996 -12.615 1.00 . A A . 15 LEU CD2 1 1 7 2741 1 1 15 LEU CG C 4.634 -1.901 -11.641 1.00 . A A . 15 LEU CG 1 1 7 2742 1 1 15 LEU H H 4.320 -1.113 -8.846 1.00 . A A . 15 LEU H 1 1 7 2743 1 1 15 LEU HA H 3.946 -3.812 -9.835 1.00 . A A . 15 LEU HA 1 1 7 2744 1 1 15 LEU HB2 H 6.193 -1.777 -10.123 1.00 . A A . 15 LEU HB2 1 1 7 2745 1 1 15 LEU HB3 H 6.161 -3.307 -10.971 1.00 . A A . 15 LEU HB3 1 1 7 2746 1 1 15 LEU HD11 H 6.309 -1.293 -12.879 1.00 . A A . 15 LEU HD11 1 1 7 2747 1 1 15 LEU HD12 H 4.821 -0.418 -13.208 1.00 . A A . 15 LEU HD12 1 1 7 2748 1 1 15 LEU HD13 H 5.752 -0.051 -11.768 1.00 . A A . 15 LEU HD13 1 1 7 2749 1 1 15 LEU HD21 H 4.981 -3.480 -13.095 1.00 . A A . 15 LEU HD21 1 1 7 2750 1 1 15 LEU HD22 H 3.569 -3.740 -12.083 1.00 . A A . 15 LEU HD22 1 1 7 2751 1 1 15 LEU HD23 H 3.513 -2.556 -13.375 1.00 . A A . 15 LEU HD23 1 1 7 2752 1 1 15 LEU HG H 3.779 -1.420 -11.189 1.00 . A A . 15 LEU HG 1 1 7 2753 1 1 15 LEU N N 3.934 -2.007 -8.782 1.00 . A A . 15 LEU N 1 1 7 2754 1 1 15 LEU O O 6.721 -3.739 -8.308 1.00 . A A . 15 LEU O 1 1 7 2755 1 1 16 GLY C C 4.463 -5.576 -5.333 1.00 . A A . 16 GLY C 1 1 7 2756 1 1 16 GLY CA C 5.462 -5.438 -6.480 1.00 . A A . 16 GLY CA 1 1 7 2757 1 1 16 GLY H H 3.854 -4.697 -7.665 1.00 . A A . 16 GLY H 1 1 7 2758 1 1 16 GLY HA2 H 5.734 -6.412 -6.856 1.00 . A A . 16 GLY HA2 1 1 7 2759 1 1 16 GLY HA3 H 6.332 -4.914 -6.130 1.00 . A A . 16 GLY HA3 1 1 7 2760 1 1 16 GLY N N 4.821 -4.641 -7.562 1.00 . A A . 16 GLY N 1 1 7 2761 1 1 16 GLY O O 3.990 -6.656 -5.035 1.00 . A A . 16 GLY O 1 1 7 2762 1 1 17 CYS C C 1.787 -4.251 -4.109 1.00 . A A . 17 CYS C 1 1 7 2763 1 1 17 CYS CA C 3.224 -4.385 -3.586 1.00 . A A . 17 CYS CA 1 1 7 2764 1 1 17 CYS CB C 3.595 -3.176 -2.713 1.00 . A A . 17 CYS CB 1 1 7 2765 1 1 17 CYS H H 4.612 -3.626 -5.037 1.00 . A A . 17 CYS H 1 1 7 2766 1 1 17 CYS HA H 3.299 -5.292 -3.008 1.00 . A A . 17 CYS HA 1 1 7 2767 1 1 17 CYS HB2 H 2.920 -2.355 -2.907 1.00 . A A . 17 CYS HB2 1 1 7 2768 1 1 17 CYS HB3 H 3.445 -3.468 -1.687 1.00 . A A . 17 CYS HB3 1 1 7 2769 1 1 17 CYS N N 4.182 -4.451 -4.730 1.00 . A A . 17 CYS N 1 1 7 2770 1 1 17 CYS O O 1.571 -3.892 -5.252 1.00 . A A . 17 CYS O 1 1 7 2771 1 1 17 CYS SG S 5.290 -2.549 -2.822 1.00 . A A . 17 CYS SG 1 1 7 2772 1 1 18 SER C C -1.375 -3.809 -2.456 1.00 . A A . 18 SER C 1 1 7 2773 1 1 18 SER CA C -0.602 -4.465 -3.604 1.00 . A A . 18 SER CA 1 1 7 2774 1 1 18 SER CB C -1.138 -5.886 -3.857 1.00 . A A . 18 SER CB 1 1 7 2775 1 1 18 SER H H 1.103 -4.830 -2.342 1.00 . A A . 18 SER H 1 1 7 2776 1 1 18 SER HA H -0.723 -3.858 -4.491 1.00 . A A . 18 SER HA 1 1 7 2777 1 1 18 SER HB2 H -1.009 -6.523 -2.994 1.00 . A A . 18 SER HB2 1 1 7 2778 1 1 18 SER HB3 H -2.177 -5.872 -4.157 1.00 . A A . 18 SER HB3 1 1 7 2779 1 1 18 SER HG H -0.129 -5.645 -5.511 1.00 . A A . 18 SER HG 1 1 7 2780 1 1 18 SER N N 0.849 -4.547 -3.244 1.00 . A A . 18 SER N 1 1 7 2781 1 1 18 SER O O -1.200 -4.170 -1.307 1.00 . A A . 18 SER O 1 1 7 2782 1 1 18 SER OG O -0.348 -6.378 -4.931 1.00 . A A . 18 SER OG 1 1 7 2783 1 1 19 CYS C C -4.089 -3.051 -1.143 1.00 . A A . 19 CYS C 1 1 7 2784 1 1 19 CYS CA C -3.018 -2.150 -1.766 1.00 . A A . 19 CYS CA 1 1 7 2785 1 1 19 CYS CB C -3.694 -0.928 -2.399 1.00 . A A . 19 CYS CB 1 1 7 2786 1 1 19 CYS H H -2.307 -2.620 -3.747 1.00 . A A . 19 CYS H 1 1 7 2787 1 1 19 CYS HA H -2.353 -1.817 -0.986 1.00 . A A . 19 CYS HA 1 1 7 2788 1 1 19 CYS HB2 H -2.926 -0.287 -2.808 1.00 . A A . 19 CYS HB2 1 1 7 2789 1 1 19 CYS HB3 H -4.322 -1.255 -3.213 1.00 . A A . 19 CYS HB3 1 1 7 2790 1 1 19 CYS N N -2.212 -2.862 -2.803 1.00 . A A . 19 CYS N 1 1 7 2791 1 1 19 CYS O O -4.835 -3.714 -1.836 1.00 . A A . 19 CYS O 1 1 7 2792 1 1 19 CYS SG S -4.705 0.071 -1.278 1.00 . A A . 19 CYS SG 1 1 7 2793 1 1 20 LYS C C -5.199 -3.214 2.352 1.00 . A A . 20 LYS C 1 1 7 2794 1 1 20 LYS CA C -5.086 -3.839 0.954 1.00 . A A . 20 LYS CA 1 1 7 2795 1 1 20 LYS CB C -4.574 -5.303 1.054 1.00 . A A . 20 LYS CB 1 1 7 2796 1 1 20 LYS CD C -4.861 -7.629 0.111 1.00 . A A . 20 LYS CD 1 1 7 2797 1 1 20 LYS CE C -5.744 -8.509 -0.790 1.00 . A A . 20 LYS CE 1 1 7 2798 1 1 20 LYS CG C -5.503 -6.232 0.238 1.00 . A A . 20 LYS CG 1 1 7 2799 1 1 20 LYS H H -3.471 -2.465 0.644 1.00 . A A . 20 LYS H 1 1 7 2800 1 1 20 LYS HA H -6.053 -3.787 0.473 1.00 . A A . 20 LYS HA 1 1 7 2801 1 1 20 LYS HB2 H -3.565 -5.366 0.671 1.00 . A A . 20 LYS HB2 1 1 7 2802 1 1 20 LYS HB3 H -4.565 -5.631 2.084 1.00 . A A . 20 LYS HB3 1 1 7 2803 1 1 20 LYS HD2 H -3.876 -7.544 -0.324 1.00 . A A . 20 LYS HD2 1 1 7 2804 1 1 20 LYS HD3 H -4.770 -8.083 1.087 1.00 . A A . 20 LYS HD3 1 1 7 2805 1 1 20 LYS HE2 H -6.734 -8.610 -0.369 1.00 . A A . 20 LYS HE2 1 1 7 2806 1 1 20 LYS HE3 H -5.823 -8.077 -1.777 1.00 . A A . 20 LYS HE3 1 1 7 2807 1 1 20 LYS HG2 H -6.457 -6.316 0.740 1.00 . A A . 20 LYS HG2 1 1 7 2808 1 1 20 LYS HG3 H -5.668 -5.820 -0.747 1.00 . A A . 20 LYS HG3 1 1 7 2809 1 1 20 LYS HZ1 H -4.111 -9.783 -0.996 1.00 . A A . 20 LYS HZ1 1 1 7 2810 1 1 20 LYS HZ2 H -5.384 -10.432 -0.077 1.00 . A A . 20 LYS HZ2 1 1 7 2811 1 1 20 LYS HZ3 H -5.521 -10.334 -1.767 1.00 . A A . 20 LYS HZ3 1 1 7 2812 1 1 20 LYS N N -4.112 -3.028 0.166 1.00 . A A . 20 LYS N 1 1 7 2813 1 1 20 LYS NZ N -5.145 -9.868 -0.917 1.00 . A A . 20 LYS NZ 1 1 7 2814 1 1 20 LYS O O -4.202 -2.992 3.014 1.00 . A A . 20 LYS O 1 1 7 2815 1 1 21 ASN C C -5.889 -1.078 4.357 1.00 . A A . 21 ASN C 1 1 7 2816 1 1 21 ASN CA C -6.726 -2.341 4.078 1.00 . A A . 21 ASN CA 1 1 7 2817 1 1 21 ASN CB C -6.477 -3.407 5.178 1.00 . A A . 21 ASN CB 1 1 7 2818 1 1 21 ASN CG C -7.126 -2.942 6.490 1.00 . A A . 21 ASN CG 1 1 7 2819 1 1 21 ASN H H -7.164 -3.164 2.143 1.00 . A A . 21 ASN H 1 1 7 2820 1 1 21 ASN HA H -7.771 -2.062 4.082 1.00 . A A . 21 ASN HA 1 1 7 2821 1 1 21 ASN HB2 H -6.916 -4.351 4.890 1.00 . A A . 21 ASN HB2 1 1 7 2822 1 1 21 ASN HB3 H -5.419 -3.551 5.344 1.00 . A A . 21 ASN HB3 1 1 7 2823 1 1 21 ASN HD21 H -8.843 -3.868 6.117 1.00 . A A . 21 ASN HD21 1 1 7 2824 1 1 21 ASN HD22 H -8.779 -3.018 7.586 1.00 . A A . 21 ASN HD22 1 1 7 2825 1 1 21 ASN N N -6.421 -2.951 2.745 1.00 . A A . 21 ASN N 1 1 7 2826 1 1 21 ASN ND2 N -8.351 -3.306 6.752 1.00 . A A . 21 ASN ND2 1 1 7 2827 1 1 21 ASN O O -4.938 -1.109 5.113 1.00 . A A . 21 ASN O 1 1 7 2828 1 1 21 ASN OD1 O -6.526 -2.245 7.283 1.00 . A A . 21 ASN OD1 1 1 7 2829 1 1 22 LYS C C -4.086 1.311 4.003 1.00 . A A . 22 LYS C 1 1 7 2830 1 1 22 LYS CA C -5.626 1.334 3.841 1.00 . A A . 22 LYS CA 1 1 7 2831 1 1 22 LYS CB C -6.293 2.077 5.045 1.00 . A A . 22 LYS CB 1 1 7 2832 1 1 22 LYS CD C -6.619 2.141 7.565 1.00 . A A . 22 LYS CD 1 1 7 2833 1 1 22 LYS CE C -8.135 1.931 7.735 1.00 . A A . 22 LYS CE 1 1 7 2834 1 1 22 LYS CG C -6.103 1.301 6.381 1.00 . A A . 22 LYS CG 1 1 7 2835 1 1 22 LYS H H -7.069 -0.086 3.125 1.00 . A A . 22 LYS H 1 1 7 2836 1 1 22 LYS HA H -5.848 1.890 2.941 1.00 . A A . 22 LYS HA 1 1 7 2837 1 1 22 LYS HB2 H -5.871 3.068 5.127 1.00 . A A . 22 LYS HB2 1 1 7 2838 1 1 22 LYS HB3 H -7.349 2.179 4.845 1.00 . A A . 22 LYS HB3 1 1 7 2839 1 1 22 LYS HD2 H -6.115 1.823 8.465 1.00 . A A . 22 LYS HD2 1 1 7 2840 1 1 22 LYS HD3 H -6.408 3.188 7.406 1.00 . A A . 22 LYS HD3 1 1 7 2841 1 1 22 LYS HE2 H -8.666 2.234 6.844 1.00 . A A . 22 LYS HE2 1 1 7 2842 1 1 22 LYS HE3 H -8.351 0.891 7.936 1.00 . A A . 22 LYS HE3 1 1 7 2843 1 1 22 LYS HG2 H -6.647 0.370 6.347 1.00 . A A . 22 LYS HG2 1 1 7 2844 1 1 22 LYS HG3 H -5.057 1.080 6.540 1.00 . A A . 22 LYS HG3 1 1 7 2845 1 1 22 LYS HZ1 H -7.988 2.632 9.689 1.00 . A A . 22 LYS HZ1 1 1 7 2846 1 1 22 LYS HZ2 H -8.671 3.746 8.601 1.00 . A A . 22 LYS HZ2 1 1 7 2847 1 1 22 LYS HZ3 H -9.584 2.421 9.148 1.00 . A A . 22 LYS HZ3 1 1 7 2848 1 1 22 LYS N N -6.292 -0.007 3.717 1.00 . A A . 22 LYS N 1 1 7 2849 1 1 22 LYS NZ N -8.632 2.744 8.880 1.00 . A A . 22 LYS NZ 1 1 7 2850 1 1 22 LYS O O -3.527 2.058 4.782 1.00 . A A . 22 LYS O 1 1 7 2851 1 1 23 VAL C C -1.516 -0.206 1.902 1.00 . A A . 23 VAL C 1 1 7 2852 1 1 23 VAL CA C -1.972 0.287 3.290 1.00 . A A . 23 VAL CA 1 1 7 2853 1 1 23 VAL CB C -1.651 -0.712 4.457 1.00 . A A . 23 VAL CB 1 1 7 2854 1 1 23 VAL CG1 C -0.985 -2.023 3.987 1.00 . A A . 23 VAL CG1 1 1 7 2855 1 1 23 VAL CG2 C -0.757 -0.004 5.490 1.00 . A A . 23 VAL CG2 1 1 7 2856 1 1 23 VAL H H -3.949 -0.150 2.665 1.00 . A A . 23 VAL H 1 1 7 2857 1 1 23 VAL HA H -1.542 1.256 3.460 1.00 . A A . 23 VAL HA 1 1 7 2858 1 1 23 VAL HB H -2.576 -0.975 4.944 1.00 . A A . 23 VAL HB 1 1 7 2859 1 1 23 VAL HG11 H -0.151 -1.803 3.342 1.00 . A A . 23 VAL HG11 1 1 7 2860 1 1 23 VAL HG12 H -0.634 -2.592 4.834 1.00 . A A . 23 VAL HG12 1 1 7 2861 1 1 23 VAL HG13 H -1.696 -2.624 3.439 1.00 . A A . 23 VAL HG13 1 1 7 2862 1 1 23 VAL HG21 H 0.101 0.432 5.003 1.00 . A A . 23 VAL HG21 1 1 7 2863 1 1 23 VAL HG22 H -1.314 0.784 5.976 1.00 . A A . 23 VAL HG22 1 1 7 2864 1 1 23 VAL HG23 H -0.420 -0.702 6.243 1.00 . A A . 23 VAL HG23 1 1 7 2865 1 1 23 VAL N N -3.453 0.436 3.261 1.00 . A A . 23 VAL N 1 1 7 2866 1 1 23 VAL O O -2.142 -1.096 1.361 1.00 . A A . 23 VAL O 1 1 7 2867 1 1 24 CYS C C 1.316 -0.895 0.192 1.00 . A A . 24 CYS C 1 1 7 2868 1 1 24 CYS CA C 0.021 -0.089 0.005 1.00 . A A . 24 CYS CA 1 1 7 2869 1 1 24 CYS CB C 0.231 1.179 -0.881 1.00 . A A . 24 CYS CB 1 1 7 2870 1 1 24 CYS H H 0.023 1.080 1.838 1.00 . A A . 24 CYS H 1 1 7 2871 1 1 24 CYS HA H -0.712 -0.727 -0.460 1.00 . A A . 24 CYS HA 1 1 7 2872 1 1 24 CYS HB2 H -0.312 1.992 -0.429 1.00 . A A . 24 CYS HB2 1 1 7 2873 1 1 24 CYS HB3 H 1.273 1.464 -0.903 1.00 . A A . 24 CYS HB3 1 1 7 2874 1 1 24 CYS N N -0.459 0.362 1.361 1.00 . A A . 24 CYS N 1 1 7 2875 1 1 24 CYS O O 2.354 -0.601 -0.368 1.00 . A A . 24 CYS O 1 1 7 2876 1 1 24 CYS SG S -0.379 1.120 -2.584 1.00 . A A . 24 CYS SG 1 1 7 2877 1 1 25 TYR C C 2.259 -4.107 0.481 1.00 . A A . 25 TYR C 1 1 7 2878 1 1 25 TYR CA C 2.273 -2.857 1.360 1.00 . A A . 25 TYR CA 1 1 7 2879 1 1 25 TYR CB C 2.108 -3.262 2.828 1.00 . A A . 25 TYR CB 1 1 7 2880 1 1 25 TYR CD1 C 2.605 -0.788 3.371 1.00 . A A . 25 TYR CD1 1 1 7 2881 1 1 25 TYR CD2 C 2.174 -2.303 5.152 1.00 . A A . 25 TYR CD2 1 1 7 2882 1 1 25 TYR CE1 C 2.763 0.232 4.277 1.00 . A A . 25 TYR CE1 1 1 7 2883 1 1 25 TYR CE2 C 2.334 -1.279 6.058 1.00 . A A . 25 TYR CE2 1 1 7 2884 1 1 25 TYR CG C 2.306 -2.075 3.797 1.00 . A A . 25 TYR CG 1 1 7 2885 1 1 25 TYR CZ C 2.630 -0.001 5.627 1.00 . A A . 25 TYR CZ 1 1 7 2886 1 1 25 TYR H H 0.286 -2.072 1.400 1.00 . A A . 25 TYR H 1 1 7 2887 1 1 25 TYR HA H 3.227 -2.368 1.259 1.00 . A A . 25 TYR HA 1 1 7 2888 1 1 25 TYR HB2 H 1.117 -3.664 2.979 1.00 . A A . 25 TYR HB2 1 1 7 2889 1 1 25 TYR HB3 H 2.813 -4.036 3.078 1.00 . A A . 25 TYR HB3 1 1 7 2890 1 1 25 TYR HD1 H 2.720 -0.562 2.323 1.00 . A A . 25 TYR HD1 1 1 7 2891 1 1 25 TYR HD2 H 1.943 -3.296 5.509 1.00 . A A . 25 TYR HD2 1 1 7 2892 1 1 25 TYR HE1 H 2.994 1.220 3.916 1.00 . A A . 25 TYR HE1 1 1 7 2893 1 1 25 TYR HE2 H 2.223 -1.484 7.112 1.00 . A A . 25 TYR HE2 1 1 7 2894 1 1 25 TYR HH H 2.323 1.797 6.189 1.00 . A A . 25 TYR HH 1 1 7 2895 1 1 25 TYR N N 1.166 -1.914 1.003 1.00 . A A . 25 TYR N 1 1 7 2896 1 1 25 TYR O O 1.338 -4.321 -0.283 1.00 . A A . 25 TYR O 1 1 7 2897 1 1 25 TYR OH O 2.788 1.029 6.531 1.00 . A A . 25 TYR OH 1 1 7 2898 1 1 26 ARG C C 2.828 -7.291 0.706 1.00 . A A . 26 ARG C 1 1 7 2899 1 1 26 ARG CA C 3.420 -6.162 -0.157 1.00 . A A . 26 ARG CA 1 1 7 2900 1 1 26 ARG CB C 4.920 -6.399 -0.456 1.00 . A A . 26 ARG CB 1 1 7 2901 1 1 26 ARG CD C 6.567 -7.464 -2.028 1.00 . A A . 26 ARG CD 1 1 7 2902 1 1 26 ARG CG C 5.075 -7.315 -1.687 1.00 . A A . 26 ARG CG 1 1 7 2903 1 1 26 ARG CZ C 7.789 -8.313 -3.974 1.00 . A A . 26 ARG CZ 1 1 7 2904 1 1 26 ARG H H 3.999 -4.652 1.264 1.00 . A A . 26 ARG H 1 1 7 2905 1 1 26 ARG HA H 2.843 -6.084 -1.066 1.00 . A A . 26 ARG HA 1 1 7 2906 1 1 26 ARG HB2 H 5.403 -5.451 -0.647 1.00 . A A . 26 ARG HB2 1 1 7 2907 1 1 26 ARG HB3 H 5.397 -6.864 0.395 1.00 . A A . 26 ARG HB3 1 1 7 2908 1 1 26 ARG HD2 H 7.101 -6.539 -1.867 1.00 . A A . 26 ARG HD2 1 1 7 2909 1 1 26 ARG HD3 H 7.007 -8.244 -1.422 1.00 . A A . 26 ARG HD3 1 1 7 2910 1 1 26 ARG HE H 5.898 -7.725 -4.058 1.00 . A A . 26 ARG HE 1 1 7 2911 1 1 26 ARG HG2 H 4.655 -8.288 -1.479 1.00 . A A . 26 ARG HG2 1 1 7 2912 1 1 26 ARG HG3 H 4.552 -6.892 -2.531 1.00 . A A . 26 ARG HG3 1 1 7 2913 1 1 26 ARG HH11 H 8.814 -8.235 -2.251 1.00 . A A . 26 ARG HH11 1 1 7 2914 1 1 26 ARG HH12 H 9.688 -8.841 -3.617 1.00 . A A . 26 ARG HH12 1 1 7 2915 1 1 26 ARG HH21 H 6.986 -8.482 -5.798 1.00 . A A . 26 ARG HH21 1 1 7 2916 1 1 26 ARG HH22 H 8.639 -8.983 -5.657 1.00 . A A . 26 ARG HH22 1 1 7 2917 1 1 26 ARG N N 3.294 -4.896 0.629 1.00 . A A . 26 ARG N 1 1 7 2918 1 1 26 ARG NE N 6.677 -7.838 -3.472 1.00 . A A . 26 ARG NE 1 1 7 2919 1 1 26 ARG NH1 N 8.846 -8.476 -3.222 1.00 . A A . 26 ARG NH1 1 1 7 2920 1 1 26 ARG NH2 N 7.806 -8.617 -5.242 1.00 . A A . 26 ARG NH2 1 1 7 2921 1 1 26 ARG O O 3.336 -8.395 0.755 1.00 . A A . 26 ARG O 1 1 7 2922 1 1 27 ASN C C 1.931 -8.471 3.343 1.00 . A A . 27 ASN C 1 1 7 2923 1 1 27 ASN CA C 1.007 -7.883 2.261 1.00 . A A . 27 ASN CA 1 1 7 2924 1 1 27 ASN CB C 0.387 -9.003 1.378 1.00 . A A . 27 ASN CB 1 1 7 2925 1 1 27 ASN CG C -0.780 -9.660 2.124 1.00 . A A . 27 ASN CG 1 1 7 2926 1 1 27 ASN H H 1.406 -6.033 1.258 1.00 . A A . 27 ASN H 1 1 7 2927 1 1 27 ASN HA H 0.232 -7.319 2.757 1.00 . A A . 27 ASN HA 1 1 7 2928 1 1 27 ASN HB2 H 0.011 -8.583 0.456 1.00 . A A . 27 ASN HB2 1 1 7 2929 1 1 27 ASN HB3 H 1.123 -9.759 1.141 1.00 . A A . 27 ASN HB3 1 1 7 2930 1 1 27 ASN HD21 H -2.008 -8.133 1.808 1.00 . A A . 27 ASN HD21 1 1 7 2931 1 1 27 ASN HD22 H -2.669 -9.425 2.687 1.00 . A A . 27 ASN HD22 1 1 7 2932 1 1 27 ASN N N 1.745 -6.944 1.362 1.00 . A A . 27 ASN N 1 1 7 2933 1 1 27 ASN ND2 N -1.913 -9.020 2.214 1.00 . A A . 27 ASN ND2 1 1 7 2934 1 1 27 ASN O O 1.849 -9.637 3.678 1.00 . A A . 27 ASN O 1 1 7 2935 1 1 27 ASN OD1 O -0.671 -10.759 2.630 1.00 . A A . 27 ASN OD1 1 1 7 2936 1 1 28 GLY C C 4.843 -7.056 5.235 1.00 . A A . 28 GLY C 1 1 7 2937 1 1 28 GLY CA C 3.740 -8.073 4.915 1.00 . A A . 28 GLY CA 1 1 7 2938 1 1 28 GLY H H 2.813 -6.701 3.552 1.00 . A A . 28 GLY H 1 1 7 2939 1 1 28 GLY HA2 H 3.176 -8.272 5.812 1.00 . A A . 28 GLY HA2 1 1 7 2940 1 1 28 GLY HA3 H 4.209 -8.982 4.577 1.00 . A A . 28 GLY HA3 1 1 7 2941 1 1 28 GLY N N 2.791 -7.626 3.859 1.00 . A A . 28 GLY N 1 1 7 2942 1 1 28 GLY O O 5.250 -6.951 6.377 1.00 . A A . 28 GLY O 1 1 7 2943 1 1 29 ILE C C 5.857 -3.910 4.086 1.00 . A A . 29 ILE C 1 1 7 2944 1 1 29 ILE CA C 6.375 -5.324 4.430 1.00 . A A . 29 ILE CA 1 1 7 2945 1 1 29 ILE CB C 7.578 -5.737 3.525 1.00 . A A . 29 ILE CB 1 1 7 2946 1 1 29 ILE CD1 C 10.117 -5.749 3.410 1.00 . A A . 29 ILE CD1 1 1 7 2947 1 1 29 ILE CG1 C 8.887 -5.078 4.048 1.00 . A A . 29 ILE CG1 1 1 7 2948 1 1 29 ILE CG2 C 7.343 -5.352 2.040 1.00 . A A . 29 ILE CG2 1 1 7 2949 1 1 29 ILE H H 4.923 -6.471 3.337 1.00 . A A . 29 ILE H 1 1 7 2950 1 1 29 ILE HA H 6.690 -5.351 5.462 1.00 . A A . 29 ILE HA 1 1 7 2951 1 1 29 ILE HB H 7.671 -6.812 3.580 1.00 . A A . 29 ILE HB 1 1 7 2952 1 1 29 ILE HD11 H 10.065 -6.823 3.524 1.00 . A A . 29 ILE HD11 1 1 7 2953 1 1 29 ILE HD12 H 10.172 -5.510 2.357 1.00 . A A . 29 ILE HD12 1 1 7 2954 1 1 29 ILE HD13 H 11.017 -5.395 3.892 1.00 . A A . 29 ILE HD13 1 1 7 2955 1 1 29 ILE HG12 H 8.889 -4.022 3.819 1.00 . A A . 29 ILE HG12 1 1 7 2956 1 1 29 ILE HG13 H 8.949 -5.197 5.120 1.00 . A A . 29 ILE HG13 1 1 7 2957 1 1 29 ILE HG21 H 6.315 -5.538 1.768 1.00 . A A . 29 ILE HG21 1 1 7 2958 1 1 29 ILE HG22 H 7.560 -4.306 1.875 1.00 . A A . 29 ILE HG22 1 1 7 2959 1 1 29 ILE HG23 H 7.979 -5.945 1.399 1.00 . A A . 29 ILE HG23 1 1 7 2960 1 1 29 ILE N N 5.295 -6.342 4.233 1.00 . A A . 29 ILE N 1 1 7 2961 1 1 29 ILE O O 5.163 -3.755 3.099 1.00 . A A . 29 ILE O 1 1 7 2962 1 1 30 PRO C C 6.524 -1.020 3.318 1.00 . A A . 30 PRO C 1 1 7 2963 1 1 30 PRO CA C 5.807 -1.509 4.581 1.00 . A A . 30 PRO CA 1 1 7 2964 1 1 30 PRO CB C 6.181 -0.694 5.824 1.00 . A A . 30 PRO CB 1 1 7 2965 1 1 30 PRO CD C 6.963 -3.035 6.156 1.00 . A A . 30 PRO CD 1 1 7 2966 1 1 30 PRO CG C 7.012 -1.611 6.736 1.00 . A A . 30 PRO CG 1 1 7 2967 1 1 30 PRO HA H 4.745 -1.478 4.410 1.00 . A A . 30 PRO HA 1 1 7 2968 1 1 30 PRO HB2 H 6.751 0.185 5.560 1.00 . A A . 30 PRO HB2 1 1 7 2969 1 1 30 PRO HB3 H 5.283 -0.378 6.334 1.00 . A A . 30 PRO HB3 1 1 7 2970 1 1 30 PRO HD2 H 7.957 -3.397 5.947 1.00 . A A . 30 PRO HD2 1 1 7 2971 1 1 30 PRO HD3 H 6.452 -3.709 6.830 1.00 . A A . 30 PRO HD3 1 1 7 2972 1 1 30 PRO HG2 H 8.034 -1.264 6.771 1.00 . A A . 30 PRO HG2 1 1 7 2973 1 1 30 PRO HG3 H 6.607 -1.603 7.738 1.00 . A A . 30 PRO HG3 1 1 7 2974 1 1 30 PRO N N 6.190 -2.914 4.883 1.00 . A A . 30 PRO N 1 1 7 2975 1 1 30 PRO O O 7.686 -0.661 3.350 1.00 . A A . 30 PRO O 1 1 8 2976 1 1 1 CYS C C 6.198 1.053 0.929 1.00 . A A . 1 CYS C 1 1 8 2977 1 1 1 CYS CA C 6.276 -0.475 0.899 1.00 . A A . 1 CYS CA 1 1 8 2978 1 1 1 CYS CB C 5.421 -1.036 -0.235 1.00 . A A . 1 CYS CB 1 1 8 2979 1 1 1 CYS HA H 7.305 -0.777 0.766 1.00 . A A . 1 CYS HA 1 1 8 2980 1 1 1 CYS HB2 H 4.426 -1.176 0.145 1.00 . A A . 1 CYS HB2 1 1 8 2981 1 1 1 CYS HB3 H 5.357 -0.299 -1.023 1.00 . A A . 1 CYS HB3 1 1 8 2982 1 1 1 CYS N N 5.760 -1.028 2.185 1.00 . A A . 1 CYS N 1 1 8 2983 1 1 1 CYS O O 7.135 1.725 0.541 1.00 . A A . 1 CYS O 1 1 8 2984 1 1 1 CYS SG S 5.943 -2.602 -0.977 1.00 . A A . 1 CYS SG 1 1 8 2985 1 1 2 GLY C C 3.940 3.346 2.635 1.00 . A A . 2 GLY C 1 1 8 2986 1 1 2 GLY CA C 4.874 3.021 1.473 1.00 . A A . 2 GLY CA 1 1 8 2987 1 1 2 GLY H H 4.356 0.955 1.689 1.00 . A A . 2 GLY H 1 1 8 2988 1 1 2 GLY HA2 H 5.821 3.516 1.633 1.00 . A A . 2 GLY HA2 1 1 8 2989 1 1 2 GLY HA3 H 4.434 3.370 0.550 1.00 . A A . 2 GLY HA3 1 1 8 2990 1 1 2 GLY N N 5.077 1.548 1.391 1.00 . A A . 2 GLY N 1 1 8 2991 1 1 2 GLY O O 4.391 3.644 3.724 1.00 . A A . 2 GLY O 1 1 8 2992 1 1 3 GLU C C 0.206 3.486 2.734 1.00 . A A . 3 GLU C 1 1 8 2993 1 1 3 GLU CA C 1.597 3.556 3.370 1.00 . A A . 3 GLU CA 1 1 8 2994 1 1 3 GLU CB C 1.801 4.963 3.944 1.00 . A A . 3 GLU CB 1 1 8 2995 1 1 3 GLU CD C 1.032 6.136 6.033 1.00 . A A . 3 GLU CD 1 1 8 2996 1 1 3 GLU CG C 1.817 4.928 5.493 1.00 . A A . 3 GLU CG 1 1 8 2997 1 1 3 GLU H H 2.397 3.000 1.451 1.00 . A A . 3 GLU H 1 1 8 2998 1 1 3 GLU HA H 1.651 2.800 4.136 1.00 . A A . 3 GLU HA 1 1 8 2999 1 1 3 GLU HB2 H 2.732 5.331 3.569 1.00 . A A . 3 GLU HB2 1 1 8 3000 1 1 3 GLU HB3 H 1.033 5.624 3.573 1.00 . A A . 3 GLU HB3 1 1 8 3001 1 1 3 GLU HG2 H 1.369 4.022 5.874 1.00 . A A . 3 GLU HG2 1 1 8 3002 1 1 3 GLU HG3 H 2.837 4.980 5.850 1.00 . A A . 3 GLU HG3 1 1 8 3003 1 1 3 GLU N N 2.661 3.266 2.353 1.00 . A A . 3 GLU N 1 1 8 3004 1 1 3 GLU O O 0.060 3.020 1.624 1.00 . A A . 3 GLU O 1 1 8 3005 1 1 3 GLU OE1 O 1.660 7.172 6.185 1.00 . A A . 3 GLU OE1 1 1 8 3006 1 1 3 GLU OE2 O -0.154 5.951 6.262 1.00 . A A . 3 GLU OE2 1 1 8 3007 1 1 4 SER C C -2.374 4.421 1.542 1.00 . A A . 4 SER C 1 1 8 3008 1 1 4 SER CA C -2.183 3.966 2.984 1.00 . A A . 4 SER CA 1 1 8 3009 1 1 4 SER CB C -3.032 4.869 3.897 1.00 . A A . 4 SER CB 1 1 8 3010 1 1 4 SER H H -0.575 4.334 4.349 1.00 . A A . 4 SER H 1 1 8 3011 1 1 4 SER HA H -2.538 2.955 3.049 1.00 . A A . 4 SER HA 1 1 8 3012 1 1 4 SER HB2 H -3.939 5.182 3.409 1.00 . A A . 4 SER HB2 1 1 8 3013 1 1 4 SER HB3 H -3.274 4.356 4.813 1.00 . A A . 4 SER HB3 1 1 8 3014 1 1 4 SER HG H -1.394 5.715 4.524 1.00 . A A . 4 SER HG 1 1 8 3015 1 1 4 SER N N -0.770 3.964 3.464 1.00 . A A . 4 SER N 1 1 8 3016 1 1 4 SER O O -1.722 5.326 1.056 1.00 . A A . 4 SER O 1 1 8 3017 1 1 4 SER OG O -2.234 6.013 4.168 1.00 . A A . 4 SER OG 1 1 8 3018 1 1 5 CYS C C -5.136 4.443 -0.540 1.00 . A A . 5 CYS C 1 1 8 3019 1 1 5 CYS CA C -3.675 3.975 -0.485 1.00 . A A . 5 CYS CA 1 1 8 3020 1 1 5 CYS CB C -3.441 2.648 -1.240 1.00 . A A . 5 CYS CB 1 1 8 3021 1 1 5 CYS H H -3.754 3.029 1.426 1.00 . A A . 5 CYS H 1 1 8 3022 1 1 5 CYS HA H -3.054 4.758 -0.870 1.00 . A A . 5 CYS HA 1 1 8 3023 1 1 5 CYS HB2 H -4.105 2.604 -2.088 1.00 . A A . 5 CYS HB2 1 1 8 3024 1 1 5 CYS HB3 H -2.431 2.659 -1.621 1.00 . A A . 5 CYS HB3 1 1 8 3025 1 1 5 CYS N N -3.296 3.731 0.929 1.00 . A A . 5 CYS N 1 1 8 3026 1 1 5 CYS O O -5.875 4.143 -1.458 1.00 . A A . 5 CYS O 1 1 8 3027 1 1 5 CYS SG S -3.649 1.103 -0.321 1.00 . A A . 5 CYS SG 1 1 8 3028 1 1 6 VAL C C -7.009 6.979 -0.282 1.00 . A A . 6 VAL C 1 1 8 3029 1 1 6 VAL CA C -6.872 5.737 0.608 1.00 . A A . 6 VAL CA 1 1 8 3030 1 1 6 VAL CB C -7.125 6.096 2.099 1.00 . A A . 6 VAL CB 1 1 8 3031 1 1 6 VAL CG1 C -8.536 6.708 2.273 1.00 . A A . 6 VAL CG1 1 1 8 3032 1 1 6 VAL CG2 C -7.024 4.817 2.950 1.00 . A A . 6 VAL CG2 1 1 8 3033 1 1 6 VAL H H -4.825 5.383 1.170 1.00 . A A . 6 VAL H 1 1 8 3034 1 1 6 VAL HA H -7.581 4.987 0.289 1.00 . A A . 6 VAL HA 1 1 8 3035 1 1 6 VAL HB H -6.382 6.804 2.439 1.00 . A A . 6 VAL HB 1 1 8 3036 1 1 6 VAL HG11 H -9.280 6.077 1.808 1.00 . A A . 6 VAL HG11 1 1 8 3037 1 1 6 VAL HG12 H -8.772 6.809 3.322 1.00 . A A . 6 VAL HG12 1 1 8 3038 1 1 6 VAL HG13 H -8.576 7.686 1.818 1.00 . A A . 6 VAL HG13 1 1 8 3039 1 1 6 VAL HG21 H -6.048 4.371 2.830 1.00 . A A . 6 VAL HG21 1 1 8 3040 1 1 6 VAL HG22 H -7.168 5.054 3.994 1.00 . A A . 6 VAL HG22 1 1 8 3041 1 1 6 VAL HG23 H -7.773 4.101 2.646 1.00 . A A . 6 VAL HG23 1 1 8 3042 1 1 6 VAL N N -5.490 5.185 0.478 1.00 . A A . 6 VAL N 1 1 8 3043 1 1 6 VAL O O -7.721 6.965 -1.268 1.00 . A A . 6 VAL O 1 1 8 3044 1 1 7 TRP C C -5.827 9.108 -2.075 1.00 . A A . 7 TRP C 1 1 8 3045 1 1 7 TRP CA C -6.325 9.304 -0.642 1.00 . A A . 7 TRP CA 1 1 8 3046 1 1 7 TRP CB C -5.427 10.300 0.094 1.00 . A A . 7 TRP CB 1 1 8 3047 1 1 7 TRP CD1 C -5.067 12.412 -1.347 1.00 . A A . 7 TRP CD1 1 1 8 3048 1 1 7 TRP CD2 C -6.776 12.503 0.061 1.00 . A A . 7 TRP CD2 1 1 8 3049 1 1 7 TRP CE2 C -6.733 13.713 -0.629 1.00 . A A . 7 TRP CE2 1 1 8 3050 1 1 7 TRP CE3 C -7.766 12.286 1.019 1.00 . A A . 7 TRP CE3 1 1 8 3051 1 1 7 TRP CG C -5.754 11.721 -0.388 1.00 . A A . 7 TRP CG 1 1 8 3052 1 1 7 TRP CH2 C -8.662 14.485 0.595 1.00 . A A . 7 TRP CH2 1 1 8 3053 1 1 7 TRP CZ2 C -7.674 14.703 -0.363 1.00 . A A . 7 TRP CZ2 1 1 8 3054 1 1 7 TRP CZ3 C -8.707 13.277 1.287 1.00 . A A . 7 TRP CZ3 1 1 8 3055 1 1 7 TRP H H -5.758 7.949 0.911 1.00 . A A . 7 TRP H 1 1 8 3056 1 1 7 TRP HA H -7.343 9.661 -0.661 1.00 . A A . 7 TRP HA 1 1 8 3057 1 1 7 TRP HB2 H -5.598 10.235 1.157 1.00 . A A . 7 TRP HB2 1 1 8 3058 1 1 7 TRP HB3 H -4.385 10.088 -0.099 1.00 . A A . 7 TRP HB3 1 1 8 3059 1 1 7 TRP HD1 H -4.203 12.087 -1.908 1.00 . A A . 7 TRP HD1 1 1 8 3060 1 1 7 TRP HE1 H -5.414 14.262 -2.047 1.00 . A A . 7 TRP HE1 1 1 8 3061 1 1 7 TRP HE3 H -7.803 11.350 1.557 1.00 . A A . 7 TRP HE3 1 1 8 3062 1 1 7 TRP HH2 H -9.393 15.254 0.801 1.00 . A A . 7 TRP HH2 1 1 8 3063 1 1 7 TRP HZ2 H -7.638 15.640 -0.900 1.00 . A A . 7 TRP HZ2 1 1 8 3064 1 1 7 TRP HZ3 H -9.472 13.108 2.028 1.00 . A A . 7 TRP HZ3 1 1 8 3065 1 1 7 TRP N N -6.308 8.015 0.108 1.00 . A A . 7 TRP N 1 1 8 3066 1 1 7 TRP NE1 N -5.697 13.558 -1.427 1.00 . A A . 7 TRP NE1 1 1 8 3067 1 1 7 TRP O O -6.398 9.626 -3.015 1.00 . A A . 7 TRP O 1 1 8 3068 1 1 8 ILE C C -3.392 6.700 -3.394 1.00 . A A . 8 ILE C 1 1 8 3069 1 1 8 ILE CA C -4.139 8.052 -3.487 1.00 . A A . 8 ILE CA 1 1 8 3070 1 1 8 ILE CB C -3.166 9.228 -3.853 1.00 . A A . 8 ILE CB 1 1 8 3071 1 1 8 ILE CD1 C -3.467 9.372 -6.370 1.00 . A A . 8 ILE CD1 1 1 8 3072 1 1 8 ILE CG1 C -2.500 8.973 -5.239 1.00 . A A . 8 ILE CG1 1 1 8 3073 1 1 8 ILE CG2 C -2.066 9.421 -2.776 1.00 . A A . 8 ILE CG2 1 1 8 3074 1 1 8 ILE H H -4.370 7.979 -1.360 1.00 . A A . 8 ILE H 1 1 8 3075 1 1 8 ILE HA H -4.931 7.993 -4.209 1.00 . A A . 8 ILE HA 1 1 8 3076 1 1 8 ILE HB H -3.742 10.142 -3.904 1.00 . A A . 8 ILE HB 1 1 8 3077 1 1 8 ILE HD11 H -4.429 8.901 -6.234 1.00 . A A . 8 ILE HD11 1 1 8 3078 1 1 8 ILE HD12 H -3.601 10.444 -6.382 1.00 . A A . 8 ILE HD12 1 1 8 3079 1 1 8 ILE HD13 H -3.061 9.062 -7.322 1.00 . A A . 8 ILE HD13 1 1 8 3080 1 1 8 ILE HG12 H -1.601 9.565 -5.327 1.00 . A A . 8 ILE HG12 1 1 8 3081 1 1 8 ILE HG13 H -2.229 7.934 -5.349 1.00 . A A . 8 ILE HG13 1 1 8 3082 1 1 8 ILE HG21 H -2.478 9.319 -1.783 1.00 . A A . 8 ILE HG21 1 1 8 3083 1 1 8 ILE HG22 H -1.276 8.694 -2.901 1.00 . A A . 8 ILE HG22 1 1 8 3084 1 1 8 ILE HG23 H -1.639 10.409 -2.868 1.00 . A A . 8 ILE HG23 1 1 8 3085 1 1 8 ILE N N -4.764 8.354 -2.172 1.00 . A A . 8 ILE N 1 1 8 3086 1 1 8 ILE O O -2.520 6.552 -2.559 1.00 . A A . 8 ILE O 1 1 8 3087 1 1 9 PRO C C -1.627 4.620 -4.940 1.00 . A A . 9 PRO C 1 1 8 3088 1 1 9 PRO CA C -3.014 4.446 -4.309 1.00 . A A . 9 PRO CA 1 1 8 3089 1 1 9 PRO CB C -3.903 3.515 -5.129 1.00 . A A . 9 PRO CB 1 1 8 3090 1 1 9 PRO CD C -4.880 5.808 -5.197 1.00 . A A . 9 PRO CD 1 1 8 3091 1 1 9 PRO CG C -4.980 4.393 -5.792 1.00 . A A . 9 PRO CG 1 1 8 3092 1 1 9 PRO HA H -2.895 4.058 -3.309 1.00 . A A . 9 PRO HA 1 1 8 3093 1 1 9 PRO HB2 H -3.330 2.996 -5.884 1.00 . A A . 9 PRO HB2 1 1 8 3094 1 1 9 PRO HB3 H -4.365 2.784 -4.482 1.00 . A A . 9 PRO HB3 1 1 8 3095 1 1 9 PRO HD2 H -4.663 6.539 -5.962 1.00 . A A . 9 PRO HD2 1 1 8 3096 1 1 9 PRO HD3 H -5.787 6.068 -4.672 1.00 . A A . 9 PRO HD3 1 1 8 3097 1 1 9 PRO HG2 H -4.820 4.430 -6.860 1.00 . A A . 9 PRO HG2 1 1 8 3098 1 1 9 PRO HG3 H -5.962 3.982 -5.601 1.00 . A A . 9 PRO HG3 1 1 8 3099 1 1 9 PRO N N -3.741 5.745 -4.232 1.00 . A A . 9 PRO N 1 1 8 3100 1 1 9 PRO O O -1.438 5.446 -5.812 1.00 . A A . 9 PRO O 1 1 8 3101 1 1 10 CYS C C 0.748 3.351 -6.423 1.00 . A A . 10 CYS C 1 1 8 3102 1 1 10 CYS CA C 0.699 3.874 -4.983 1.00 . A A . 10 CYS CA 1 1 8 3103 1 1 10 CYS CB C 1.596 3.015 -4.081 1.00 . A A . 10 CYS CB 1 1 8 3104 1 1 10 CYS H H -0.939 3.183 -3.761 1.00 . A A . 10 CYS H 1 1 8 3105 1 1 10 CYS HA H 1.038 4.901 -4.969 1.00 . A A . 10 CYS HA 1 1 8 3106 1 1 10 CYS HB2 H 2.598 3.059 -4.484 1.00 . A A . 10 CYS HB2 1 1 8 3107 1 1 10 CYS HB3 H 1.628 3.475 -3.105 1.00 . A A . 10 CYS HB3 1 1 8 3108 1 1 10 CYS N N -0.703 3.822 -4.465 1.00 . A A . 10 CYS N 1 1 8 3109 1 1 10 CYS O O -0.034 2.499 -6.797 1.00 . A A . 10 CYS O 1 1 8 3110 1 1 10 CYS SG S 1.176 1.267 -3.860 1.00 . A A . 10 CYS SG 1 1 8 3111 1 1 11 ILE C C 3.091 2.596 -8.726 1.00 . A A . 11 ILE C 1 1 8 3112 1 1 11 ILE CA C 1.850 3.488 -8.606 1.00 . A A . 11 ILE CA 1 1 8 3113 1 1 11 ILE CB C 2.015 4.755 -9.469 1.00 . A A . 11 ILE CB 1 1 8 3114 1 1 11 ILE CD1 C -0.486 5.341 -9.221 1.00 . A A . 11 ILE CD1 1 1 8 3115 1 1 11 ILE CG1 C 0.968 5.856 -9.099 1.00 . A A . 11 ILE CG1 1 1 8 3116 1 1 11 ILE CG2 C 1.916 4.394 -10.972 1.00 . A A . 11 ILE CG2 1 1 8 3117 1 1 11 ILE H H 2.262 4.573 -6.795 1.00 . A A . 11 ILE H 1 1 8 3118 1 1 11 ILE HA H 0.992 2.947 -8.953 1.00 . A A . 11 ILE HA 1 1 8 3119 1 1 11 ILE HB H 2.999 5.134 -9.271 1.00 . A A . 11 ILE HB 1 1 8 3120 1 1 11 ILE HD11 H -0.678 4.972 -10.217 1.00 . A A . 11 ILE HD11 1 1 8 3121 1 1 11 ILE HD12 H -0.671 4.549 -8.511 1.00 . A A . 11 ILE HD12 1 1 8 3122 1 1 11 ILE HD13 H -1.173 6.149 -9.014 1.00 . A A . 11 ILE HD13 1 1 8 3123 1 1 11 ILE HG12 H 1.141 6.193 -8.087 1.00 . A A . 11 ILE HG12 1 1 8 3124 1 1 11 ILE HG13 H 1.096 6.705 -9.755 1.00 . A A . 11 ILE HG13 1 1 8 3125 1 1 11 ILE HG21 H 1.042 3.788 -11.163 1.00 . A A . 11 ILE HG21 1 1 8 3126 1 1 11 ILE HG22 H 1.852 5.293 -11.569 1.00 . A A . 11 ILE HG22 1 1 8 3127 1 1 11 ILE HG23 H 2.792 3.842 -11.277 1.00 . A A . 11 ILE HG23 1 1 8 3128 1 1 11 ILE N N 1.671 3.890 -7.176 1.00 . A A . 11 ILE N 1 1 8 3129 1 1 11 ILE O O 3.073 1.585 -9.401 1.00 . A A . 11 ILE O 1 1 8 3130 1 1 12 SER C C 5.236 0.954 -7.287 1.00 . A A . 12 SER C 1 1 8 3131 1 1 12 SER CA C 5.416 2.256 -8.069 1.00 . A A . 12 SER CA 1 1 8 3132 1 1 12 SER CB C 6.503 3.126 -7.423 1.00 . A A . 12 SER CB 1 1 8 3133 1 1 12 SER H H 4.083 3.834 -7.528 1.00 . A A . 12 SER H 1 1 8 3134 1 1 12 SER HA H 5.666 2.034 -9.091 1.00 . A A . 12 SER HA 1 1 8 3135 1 1 12 SER HB2 H 6.195 3.505 -6.460 1.00 . A A . 12 SER HB2 1 1 8 3136 1 1 12 SER HB3 H 7.435 2.592 -7.334 1.00 . A A . 12 SER HB3 1 1 8 3137 1 1 12 SER HG H 6.721 5.017 -7.821 1.00 . A A . 12 SER HG 1 1 8 3138 1 1 12 SER N N 4.135 3.012 -8.053 1.00 . A A . 12 SER N 1 1 8 3139 1 1 12 SER O O 5.439 -0.124 -7.810 1.00 . A A . 12 SER O 1 1 8 3140 1 1 12 SER OG O 6.662 4.206 -8.331 1.00 . A A . 12 SER OG 1 1 8 3141 1 1 13 ALA C C 3.486 -0.938 -5.676 1.00 . A A . 13 ALA C 1 1 8 3142 1 1 13 ALA CA C 4.627 -0.054 -5.149 1.00 . A A . 13 ALA CA 1 1 8 3143 1 1 13 ALA CB C 4.298 0.471 -3.739 1.00 . A A . 13 ALA CB 1 1 8 3144 1 1 13 ALA H H 4.707 2.015 -5.698 1.00 . A A . 13 ALA H 1 1 8 3145 1 1 13 ALA HA H 5.537 -0.630 -5.119 1.00 . A A . 13 ALA HA 1 1 8 3146 1 1 13 ALA HB1 H 3.898 1.472 -3.792 1.00 . A A . 13 ALA HB1 1 1 8 3147 1 1 13 ALA HB2 H 3.578 -0.166 -3.245 1.00 . A A . 13 ALA HB2 1 1 8 3148 1 1 13 ALA HB3 H 5.200 0.497 -3.146 1.00 . A A . 13 ALA HB3 1 1 8 3149 1 1 13 ALA N N 4.850 1.113 -6.045 1.00 . A A . 13 ALA N 1 1 8 3150 1 1 13 ALA O O 3.439 -2.113 -5.374 1.00 . A A . 13 ALA O 1 1 8 3151 1 1 14 ALA C C 1.924 -2.374 -7.775 1.00 . A A . 14 ALA C 1 1 8 3152 1 1 14 ALA CA C 1.445 -1.121 -7.022 1.00 . A A . 14 ALA CA 1 1 8 3153 1 1 14 ALA CB C 0.663 -0.207 -7.985 1.00 . A A . 14 ALA CB 1 1 8 3154 1 1 14 ALA H H 2.697 0.600 -6.655 1.00 . A A . 14 ALA H 1 1 8 3155 1 1 14 ALA HA H 0.804 -1.430 -6.208 1.00 . A A . 14 ALA HA 1 1 8 3156 1 1 14 ALA HB1 H 1.129 0.762 -8.040 1.00 . A A . 14 ALA HB1 1 1 8 3157 1 1 14 ALA HB2 H 0.628 -0.625 -8.981 1.00 . A A . 14 ALA HB2 1 1 8 3158 1 1 14 ALA HB3 H -0.349 -0.084 -7.630 1.00 . A A . 14 ALA HB3 1 1 8 3159 1 1 14 ALA N N 2.601 -0.353 -6.449 1.00 . A A . 14 ALA N 1 1 8 3160 1 1 14 ALA O O 1.209 -3.353 -7.866 1.00 . A A . 14 ALA O 1 1 8 3161 1 1 15 LEU C C 4.007 -4.603 -8.093 1.00 . A A . 15 LEU C 1 1 8 3162 1 1 15 LEU CA C 3.734 -3.421 -9.042 1.00 . A A . 15 LEU CA 1 1 8 3163 1 1 15 LEU CB C 5.043 -2.914 -9.695 1.00 . A A . 15 LEU CB 1 1 8 3164 1 1 15 LEU CD1 C 5.977 -1.020 -11.087 1.00 . A A . 15 LEU CD1 1 1 8 3165 1 1 15 LEU CD2 C 4.314 -2.603 -12.109 1.00 . A A . 15 LEU CD2 1 1 8 3166 1 1 15 LEU CG C 4.723 -1.874 -10.808 1.00 . A A . 15 LEU CG 1 1 8 3167 1 1 15 LEU H H 3.650 -1.473 -8.179 1.00 . A A . 15 LEU H 1 1 8 3168 1 1 15 LEU HA H 3.035 -3.731 -9.798 1.00 . A A . 15 LEU HA 1 1 8 3169 1 1 15 LEU HB2 H 5.661 -2.453 -8.936 1.00 . A A . 15 LEU HB2 1 1 8 3170 1 1 15 LEU HB3 H 5.587 -3.748 -10.110 1.00 . A A . 15 LEU HB3 1 1 8 3171 1 1 15 LEU HD11 H 6.817 -1.650 -11.340 1.00 . A A . 15 LEU HD11 1 1 8 3172 1 1 15 LEU HD12 H 5.789 -0.345 -11.910 1.00 . A A . 15 LEU HD12 1 1 8 3173 1 1 15 LEU HD13 H 6.233 -0.434 -10.217 1.00 . A A . 15 LEU HD13 1 1 8 3174 1 1 15 LEU HD21 H 3.457 -3.236 -11.937 1.00 . A A . 15 LEU HD21 1 1 8 3175 1 1 15 LEU HD22 H 4.057 -1.880 -12.869 1.00 . A A . 15 LEU HD22 1 1 8 3176 1 1 15 LEU HD23 H 5.130 -3.212 -12.473 1.00 . A A . 15 LEU HD23 1 1 8 3177 1 1 15 LEU HG H 3.919 -1.223 -10.492 1.00 . A A . 15 LEU HG 1 1 8 3178 1 1 15 LEU N N 3.128 -2.291 -8.287 1.00 . A A . 15 LEU N 1 1 8 3179 1 1 15 LEU O O 3.232 -5.538 -8.047 1.00 . A A . 15 LEU O 1 1 8 3180 1 1 16 GLY C C 4.423 -5.711 -5.293 1.00 . A A . 16 GLY C 1 1 8 3181 1 1 16 GLY CA C 5.468 -5.606 -6.408 1.00 . A A . 16 GLY CA 1 1 8 3182 1 1 16 GLY H H 5.677 -3.746 -7.449 1.00 . A A . 16 GLY H 1 1 8 3183 1 1 16 GLY HA2 H 5.529 -6.536 -6.946 1.00 . A A . 16 GLY HA2 1 1 8 3184 1 1 16 GLY HA3 H 6.429 -5.377 -5.973 1.00 . A A . 16 GLY HA3 1 1 8 3185 1 1 16 GLY N N 5.094 -4.524 -7.366 1.00 . A A . 16 GLY N 1 1 8 3186 1 1 16 GLY O O 3.844 -6.756 -5.068 1.00 . A A . 16 GLY O 1 1 8 3187 1 1 17 CYS C C 1.810 -4.456 -4.072 1.00 . A A . 17 CYS C 1 1 8 3188 1 1 17 CYS CA C 3.240 -4.518 -3.515 1.00 . A A . 17 CYS CA 1 1 8 3189 1 1 17 CYS CB C 3.540 -3.255 -2.677 1.00 . A A . 17 CYS CB 1 1 8 3190 1 1 17 CYS H H 4.736 -3.801 -4.883 1.00 . A A . 17 CYS H 1 1 8 3191 1 1 17 CYS HA H 3.335 -5.402 -2.907 1.00 . A A . 17 CYS HA 1 1 8 3192 1 1 17 CYS HB2 H 2.805 -2.488 -2.878 1.00 . A A . 17 CYS HB2 1 1 8 3193 1 1 17 CYS HB3 H 3.432 -3.524 -1.640 1.00 . A A . 17 CYS HB3 1 1 8 3194 1 1 17 CYS N N 4.226 -4.599 -4.635 1.00 . A A . 17 CYS N 1 1 8 3195 1 1 17 CYS O O 1.613 -4.263 -5.256 1.00 . A A . 17 CYS O 1 1 8 3196 1 1 17 CYS SG S 5.181 -2.505 -2.843 1.00 . A A . 17 CYS SG 1 1 8 3197 1 1 18 SER C C -1.398 -3.937 -2.466 1.00 . A A . 18 SER C 1 1 8 3198 1 1 18 SER CA C -0.583 -4.587 -3.589 1.00 . A A . 18 SER CA 1 1 8 3199 1 1 18 SER CB C -1.086 -6.018 -3.832 1.00 . A A . 18 SER CB 1 1 8 3200 1 1 18 SER H H 1.095 -4.777 -2.252 1.00 . A A . 18 SER H 1 1 8 3201 1 1 18 SER HA H -0.695 -3.994 -4.486 1.00 . A A . 18 SER HA 1 1 8 3202 1 1 18 SER HB2 H -1.015 -6.621 -2.940 1.00 . A A . 18 SER HB2 1 1 8 3203 1 1 18 SER HB3 H -2.102 -6.017 -4.202 1.00 . A A . 18 SER HB3 1 1 8 3204 1 1 18 SER HG H -0.094 -5.869 -5.504 1.00 . A A . 18 SER HG 1 1 8 3205 1 1 18 SER N N 0.858 -4.624 -3.190 1.00 . A A . 18 SER N 1 1 8 3206 1 1 18 SER O O -1.345 -4.371 -1.330 1.00 . A A . 18 SER O 1 1 8 3207 1 1 18 SER OG O -0.219 -6.539 -4.829 1.00 . A A . 18 SER OG 1 1 8 3208 1 1 19 CYS C C -4.040 -3.104 -1.214 1.00 . A A . 19 CYS C 1 1 8 3209 1 1 19 CYS CA C -2.969 -2.192 -1.819 1.00 . A A . 19 CYS CA 1 1 8 3210 1 1 19 CYS CB C -3.637 -0.988 -2.494 1.00 . A A . 19 CYS CB 1 1 8 3211 1 1 19 CYS H H -2.126 -2.622 -3.759 1.00 . A A . 19 CYS H 1 1 8 3212 1 1 19 CYS HA H -2.325 -1.844 -1.031 1.00 . A A . 19 CYS HA 1 1 8 3213 1 1 19 CYS HB2 H -2.860 -0.308 -2.809 1.00 . A A . 19 CYS HB2 1 1 8 3214 1 1 19 CYS HB3 H -4.151 -1.332 -3.379 1.00 . A A . 19 CYS HB3 1 1 8 3215 1 1 19 CYS N N -2.130 -2.913 -2.824 1.00 . A A . 19 CYS N 1 1 8 3216 1 1 19 CYS O O -4.776 -3.766 -1.920 1.00 . A A . 19 CYS O 1 1 8 3217 1 1 19 CYS SG S -4.821 -0.047 -1.496 1.00 . A A . 19 CYS SG 1 1 8 3218 1 1 20 LYS C C -5.263 -3.276 2.228 1.00 . A A . 20 LYS C 1 1 8 3219 1 1 20 LYS CA C -5.051 -3.926 0.854 1.00 . A A . 20 LYS CA 1 1 8 3220 1 1 20 LYS CB C -4.480 -5.362 1.004 1.00 . A A . 20 LYS CB 1 1 8 3221 1 1 20 LYS CD C -6.742 -6.470 1.469 1.00 . A A . 20 LYS CD 1 1 8 3222 1 1 20 LYS CE C -6.384 -7.182 2.793 1.00 . A A . 20 LYS CE 1 1 8 3223 1 1 20 LYS CG C -5.510 -6.414 0.524 1.00 . A A . 20 LYS CG 1 1 8 3224 1 1 20 LYS H H -3.441 -2.536 0.586 1.00 . A A . 20 LYS H 1 1 8 3225 1 1 20 LYS HA H -5.992 -3.927 0.322 1.00 . A A . 20 LYS HA 1 1 8 3226 1 1 20 LYS HB2 H -3.593 -5.455 0.395 1.00 . A A . 20 LYS HB2 1 1 8 3227 1 1 20 LYS HB3 H -4.197 -5.560 2.028 1.00 . A A . 20 LYS HB3 1 1 8 3228 1 1 20 LYS HD2 H -7.109 -5.475 1.675 1.00 . A A . 20 LYS HD2 1 1 8 3229 1 1 20 LYS HD3 H -7.530 -7.021 0.978 1.00 . A A . 20 LYS HD3 1 1 8 3230 1 1 20 LYS HE2 H -7.272 -7.629 3.218 1.00 . A A . 20 LYS HE2 1 1 8 3231 1 1 20 LYS HE3 H -5.651 -7.959 2.629 1.00 . A A . 20 LYS HE3 1 1 8 3232 1 1 20 LYS HG2 H -5.839 -6.166 -0.475 1.00 . A A . 20 LYS HG2 1 1 8 3233 1 1 20 LYS HG3 H -5.035 -7.383 0.488 1.00 . A A . 20 LYS HG3 1 1 8 3234 1 1 20 LYS HZ1 H -5.883 -5.246 3.375 1.00 . A A . 20 LYS HZ1 1 1 8 3235 1 1 20 LYS HZ2 H -6.395 -6.243 4.651 1.00 . A A . 20 LYS HZ2 1 1 8 3236 1 1 20 LYS HZ3 H -4.845 -6.445 3.983 1.00 . A A . 20 LYS HZ3 1 1 8 3237 1 1 20 LYS N N -4.073 -3.097 0.093 1.00 . A A . 20 LYS N 1 1 8 3238 1 1 20 LYS NZ N -5.835 -6.205 3.774 1.00 . A A . 20 LYS NZ 1 1 8 3239 1 1 20 LYS O O -4.314 -3.038 2.951 1.00 . A A . 20 LYS O 1 1 8 3240 1 1 21 ASN C C -6.060 -1.128 4.133 1.00 . A A . 21 ASN C 1 1 8 3241 1 1 21 ASN CA C -6.907 -2.380 3.826 1.00 . A A . 21 ASN CA 1 1 8 3242 1 1 21 ASN CB C -6.759 -3.448 4.946 1.00 . A A . 21 ASN CB 1 1 8 3243 1 1 21 ASN CG C -7.203 -2.863 6.296 1.00 . A A . 21 ASN CG 1 1 8 3244 1 1 21 ASN H H -7.210 -3.243 1.882 1.00 . A A . 21 ASN H 1 1 8 3245 1 1 21 ASN HA H -7.943 -2.080 3.749 1.00 . A A . 21 ASN HA 1 1 8 3246 1 1 21 ASN HB2 H -7.384 -4.299 4.721 1.00 . A A . 21 ASN HB2 1 1 8 3247 1 1 21 ASN HB3 H -5.733 -3.778 5.028 1.00 . A A . 21 ASN HB3 1 1 8 3248 1 1 21 ASN HD21 H -5.454 -3.222 7.163 1.00 . A A . 21 ASN HD21 1 1 8 3249 1 1 21 ASN HD22 H -6.620 -2.488 8.155 1.00 . A A . 21 ASN HD22 1 1 8 3250 1 1 21 ASN N N -6.512 -3.014 2.529 1.00 . A A . 21 ASN N 1 1 8 3251 1 1 21 ASN ND2 N -6.355 -2.857 7.288 1.00 . A A . 21 ASN ND2 1 1 8 3252 1 1 21 ASN O O -5.190 -1.144 4.982 1.00 . A A . 21 ASN O 1 1 8 3253 1 1 21 ASN OD1 O -8.318 -2.408 6.457 1.00 . A A . 21 ASN OD1 1 1 8 3254 1 1 22 LYS C C -4.167 1.189 3.826 1.00 . A A . 22 LYS C 1 1 8 3255 1 1 22 LYS CA C -5.681 1.248 3.520 1.00 . A A . 22 LYS CA 1 1 8 3256 1 1 22 LYS CB C -6.438 2.072 4.614 1.00 . A A . 22 LYS CB 1 1 8 3257 1 1 22 LYS CD C -6.849 2.385 7.092 1.00 . A A . 22 LYS CD 1 1 8 3258 1 1 22 LYS CE C -5.626 3.191 7.568 1.00 . A A . 22 LYS CE 1 1 8 3259 1 1 22 LYS CG C -6.425 1.376 6.001 1.00 . A A . 22 LYS CG 1 1 8 3260 1 1 22 LYS H H -7.084 -0.178 2.741 1.00 . A A . 22 LYS H 1 1 8 3261 1 1 22 LYS HA H -5.800 1.759 2.576 1.00 . A A . 22 LYS HA 1 1 8 3262 1 1 22 LYS HB2 H -5.990 3.053 4.684 1.00 . A A . 22 LYS HB2 1 1 8 3263 1 1 22 LYS HB3 H -7.463 2.199 4.298 1.00 . A A . 22 LYS HB3 1 1 8 3264 1 1 22 LYS HD2 H -7.602 3.059 6.710 1.00 . A A . 22 LYS HD2 1 1 8 3265 1 1 22 LYS HD3 H -7.268 1.848 7.931 1.00 . A A . 22 LYS HD3 1 1 8 3266 1 1 22 LYS HE2 H -4.937 2.549 8.096 1.00 . A A . 22 LYS HE2 1 1 8 3267 1 1 22 LYS HE3 H -5.115 3.643 6.730 1.00 . A A . 22 LYS HE3 1 1 8 3268 1 1 22 LYS HG2 H -7.127 0.555 5.995 1.00 . A A . 22 LYS HG2 1 1 8 3269 1 1 22 LYS HG3 H -5.444 0.986 6.228 1.00 . A A . 22 LYS HG3 1 1 8 3270 1 1 22 LYS HZ1 H -6.742 3.886 9.182 1.00 . A A . 22 LYS HZ1 1 1 8 3271 1 1 22 LYS HZ2 H -5.242 4.661 8.992 1.00 . A A . 22 LYS HZ2 1 1 8 3272 1 1 22 LYS HZ3 H -6.527 5.029 7.945 1.00 . A A . 22 LYS HZ3 1 1 8 3273 1 1 22 LYS N N -6.367 -0.083 3.401 1.00 . A A . 22 LYS N 1 1 8 3274 1 1 22 LYS NZ N -6.068 4.274 8.491 1.00 . A A . 22 LYS NZ 1 1 8 3275 1 1 22 LYS O O -3.667 1.869 4.703 1.00 . A A . 22 LYS O 1 1 8 3276 1 1 23 VAL C C -1.517 -0.260 1.809 1.00 . A A . 23 VAL C 1 1 8 3277 1 1 23 VAL CA C -2.023 0.152 3.208 1.00 . A A . 23 VAL CA 1 1 8 3278 1 1 23 VAL CB C -1.811 -0.948 4.314 1.00 . A A . 23 VAL CB 1 1 8 3279 1 1 23 VAL CG1 C -1.086 -2.211 3.800 1.00 . A A . 23 VAL CG1 1 1 8 3280 1 1 23 VAL CG2 C -1.018 -0.336 5.488 1.00 . A A . 23 VAL CG2 1 1 8 3281 1 1 23 VAL H H -3.951 -0.176 2.405 1.00 . A A . 23 VAL H 1 1 8 3282 1 1 23 VAL HA H -1.579 1.096 3.469 1.00 . A A . 23 VAL HA 1 1 8 3283 1 1 23 VAL HB H -2.778 -1.254 4.682 1.00 . A A . 23 VAL HB 1 1 8 3284 1 1 23 VAL HG11 H -0.194 -1.925 3.270 1.00 . A A . 23 VAL HG11 1 1 8 3285 1 1 23 VAL HG12 H -0.812 -2.853 4.624 1.00 . A A . 23 VAL HG12 1 1 8 3286 1 1 23 VAL HG13 H -1.726 -2.768 3.131 1.00 . A A . 23 VAL HG13 1 1 8 3287 1 1 23 VAL HG21 H -0.137 0.172 5.124 1.00 . A A . 23 VAL HG21 1 1 8 3288 1 1 23 VAL HG22 H -1.638 0.378 6.013 1.00 . A A . 23 VAL HG22 1 1 8 3289 1 1 23 VAL HG23 H -0.717 -1.106 6.183 1.00 . A A . 23 VAL HG23 1 1 8 3290 1 1 23 VAL N N -3.492 0.352 3.079 1.00 . A A . 23 VAL N 1 1 8 3291 1 1 23 VAL O O -2.109 -1.150 1.229 1.00 . A A . 23 VAL O 1 1 8 3292 1 1 24 CYS C C 1.264 -0.943 0.060 1.00 . A A . 24 CYS C 1 1 8 3293 1 1 24 CYS CA C 0.013 -0.058 -0.078 1.00 . A A . 24 CYS CA 1 1 8 3294 1 1 24 CYS CB C 0.307 1.231 -0.908 1.00 . A A . 24 CYS CB 1 1 8 3295 1 1 24 CYS H H -0.012 1.070 1.787 1.00 . A A . 24 CYS H 1 1 8 3296 1 1 24 CYS HA H -0.748 -0.624 -0.589 1.00 . A A . 24 CYS HA 1 1 8 3297 1 1 24 CYS HB2 H -0.122 2.077 -0.399 1.00 . A A . 24 CYS HB2 1 1 8 3298 1 1 24 CYS HB3 H 1.370 1.406 -0.979 1.00 . A A . 24 CYS HB3 1 1 8 3299 1 1 24 CYS N N -0.475 0.353 1.291 1.00 . A A . 24 CYS N 1 1 8 3300 1 1 24 CYS O O 2.255 -0.783 -0.626 1.00 . A A . 24 CYS O 1 1 8 3301 1 1 24 CYS SG S -0.386 1.286 -2.579 1.00 . A A . 24 CYS SG 1 1 8 3302 1 1 25 TYR C C 2.078 -4.111 0.445 1.00 . A A . 25 TYR C 1 1 8 3303 1 1 25 TYR CA C 2.212 -2.858 1.302 1.00 . A A . 25 TYR CA 1 1 8 3304 1 1 25 TYR CB C 2.101 -3.249 2.778 1.00 . A A . 25 TYR CB 1 1 8 3305 1 1 25 TYR CD1 C 2.639 -0.782 3.285 1.00 . A A . 25 TYR CD1 1 1 8 3306 1 1 25 TYR CD2 C 2.058 -2.233 5.076 1.00 . A A . 25 TYR CD2 1 1 8 3307 1 1 25 TYR CE1 C 2.778 0.255 4.173 1.00 . A A . 25 TYR CE1 1 1 8 3308 1 1 25 TYR CE2 C 2.198 -1.191 5.964 1.00 . A A . 25 TYR CE2 1 1 8 3309 1 1 25 TYR CG C 2.276 -2.045 3.725 1.00 . A A . 25 TYR CG 1 1 8 3310 1 1 25 TYR CZ C 2.560 0.064 5.519 1.00 . A A . 25 TYR CZ 1 1 8 3311 1 1 25 TYR H H 0.296 -1.929 1.470 1.00 . A A . 25 TYR H 1 1 8 3312 1 1 25 TYR HA H 3.185 -2.418 1.138 1.00 . A A . 25 TYR HA 1 1 8 3313 1 1 25 TYR HB2 H 1.137 -3.700 2.961 1.00 . A A . 25 TYR HB2 1 1 8 3314 1 1 25 TYR HB3 H 2.848 -3.983 3.017 1.00 . A A . 25 TYR HB3 1 1 8 3315 1 1 25 TYR HD1 H 2.821 -0.590 2.239 1.00 . A A . 25 TYR HD1 1 1 8 3316 1 1 25 TYR HD2 H 1.775 -3.209 5.443 1.00 . A A . 25 TYR HD2 1 1 8 3317 1 1 25 TYR HE1 H 3.060 1.225 3.804 1.00 . A A . 25 TYR HE1 1 1 8 3318 1 1 25 TYR HE2 H 2.020 -1.365 7.015 1.00 . A A . 25 TYR HE2 1 1 8 3319 1 1 25 TYR HH H 2.432 1.920 5.950 1.00 . A A . 25 TYR HH 1 1 8 3320 1 1 25 TYR N N 1.137 -1.872 0.975 1.00 . A A . 25 TYR N 1 1 8 3321 1 1 25 TYR O O 1.086 -4.299 -0.232 1.00 . A A . 25 TYR O 1 1 8 3322 1 1 25 TYR OH O 2.701 1.116 6.401 1.00 . A A . 25 TYR OH 1 1 8 3323 1 1 26 ARG C C 2.480 -7.291 0.629 1.00 . A A . 26 ARG C 1 1 8 3324 1 1 26 ARG CA C 3.097 -6.209 -0.271 1.00 . A A . 26 ARG CA 1 1 8 3325 1 1 26 ARG CB C 4.558 -6.540 -0.637 1.00 . A A . 26 ARG CB 1 1 8 3326 1 1 26 ARG CD C 5.466 -8.769 -1.443 1.00 . A A . 26 ARG CD 1 1 8 3327 1 1 26 ARG CG C 4.624 -7.537 -1.828 1.00 . A A . 26 ARG CG 1 1 8 3328 1 1 26 ARG CZ C 7.606 -9.122 -0.297 1.00 . A A . 26 ARG CZ 1 1 8 3329 1 1 26 ARG H H 3.860 -4.713 1.078 1.00 . A A . 26 ARG H 1 1 8 3330 1 1 26 ARG HA H 2.474 -6.100 -1.145 1.00 . A A . 26 ARG HA 1 1 8 3331 1 1 26 ARG HB2 H 5.075 -5.630 -0.911 1.00 . A A . 26 ARG HB2 1 1 8 3332 1 1 26 ARG HB3 H 5.047 -6.955 0.232 1.00 . A A . 26 ARG HB3 1 1 8 3333 1 1 26 ARG HD2 H 4.955 -9.350 -0.689 1.00 . A A . 26 ARG HD2 1 1 8 3334 1 1 26 ARG HD3 H 5.645 -9.387 -2.310 1.00 . A A . 26 ARG HD3 1 1 8 3335 1 1 26 ARG HE H 7.030 -7.358 -0.993 1.00 . A A . 26 ARG HE 1 1 8 3336 1 1 26 ARG HG2 H 3.632 -7.861 -2.113 1.00 . A A . 26 ARG HG2 1 1 8 3337 1 1 26 ARG HG3 H 5.078 -7.050 -2.679 1.00 . A A . 26 ARG HG3 1 1 8 3338 1 1 26 ARG HH11 H 6.437 -10.736 -0.512 1.00 . A A . 26 ARG HH11 1 1 8 3339 1 1 26 ARG HH12 H 7.941 -11.003 0.302 1.00 . A A . 26 ARG HH12 1 1 8 3340 1 1 26 ARG HH21 H 8.939 -7.667 0.039 1.00 . A A . 26 ARG HH21 1 1 8 3341 1 1 26 ARG HH22 H 9.381 -9.239 0.619 1.00 . A A . 26 ARG HH22 1 1 8 3342 1 1 26 ARG N N 3.092 -4.935 0.509 1.00 . A A . 26 ARG N 1 1 8 3343 1 1 26 ARG NE N 6.782 -8.301 -0.899 1.00 . A A . 26 ARG NE 1 1 8 3344 1 1 26 ARG NH1 N 7.304 -10.385 -0.158 1.00 . A A . 26 ARG NH1 1 1 8 3345 1 1 26 ARG NH2 N 8.730 -8.637 0.156 1.00 . A A . 26 ARG NH2 1 1 8 3346 1 1 26 ARG O O 2.892 -8.436 0.625 1.00 . A A . 26 ARG O 1 1 8 3347 1 1 27 ASN C C 1.737 -8.480 3.255 1.00 . A A . 27 ASN C 1 1 8 3348 1 1 27 ASN CA C 0.752 -7.747 2.330 1.00 . A A . 27 ASN CA 1 1 8 3349 1 1 27 ASN CB C -0.098 -8.749 1.500 1.00 . A A . 27 ASN CB 1 1 8 3350 1 1 27 ASN CG C -1.000 -7.961 0.537 1.00 . A A . 27 ASN CG 1 1 8 3351 1 1 27 ASN H H 1.224 -5.925 1.311 1.00 . A A . 27 ASN H 1 1 8 3352 1 1 27 ASN HA H 0.111 -7.127 2.940 1.00 . A A . 27 ASN HA 1 1 8 3353 1 1 27 ASN HB2 H 0.533 -9.410 0.924 1.00 . A A . 27 ASN HB2 1 1 8 3354 1 1 27 ASN HB3 H -0.721 -9.341 2.155 1.00 . A A . 27 ASN HB3 1 1 8 3355 1 1 27 ASN HD21 H -2.602 -8.122 1.699 1.00 . A A . 27 ASN HD21 1 1 8 3356 1 1 27 ASN HD22 H -2.838 -7.267 0.252 1.00 . A A . 27 ASN HD22 1 1 8 3357 1 1 27 ASN N N 1.492 -6.863 1.379 1.00 . A A . 27 ASN N 1 1 8 3358 1 1 27 ASN ND2 N -2.250 -7.767 0.856 1.00 . A A . 27 ASN ND2 1 1 8 3359 1 1 27 ASN O O 1.584 -9.649 3.553 1.00 . A A . 27 ASN O 1 1 8 3360 1 1 27 ASN OD1 O -0.575 -7.515 -0.511 1.00 . A A . 27 ASN OD1 1 1 8 3361 1 1 28 GLY C C 4.952 -7.353 4.827 1.00 . A A . 28 GLY C 1 1 8 3362 1 1 28 GLY CA C 3.771 -8.304 4.583 1.00 . A A . 28 GLY CA 1 1 8 3363 1 1 28 GLY H H 2.799 -6.805 3.406 1.00 . A A . 28 GLY H 1 1 8 3364 1 1 28 GLY HA2 H 3.309 -8.536 5.529 1.00 . A A . 28 GLY HA2 1 1 8 3365 1 1 28 GLY HA3 H 4.149 -9.207 4.134 1.00 . A A . 28 GLY HA3 1 1 8 3366 1 1 28 GLY N N 2.733 -7.740 3.681 1.00 . A A . 28 GLY N 1 1 8 3367 1 1 28 GLY O O 5.588 -7.445 5.860 1.00 . A A . 28 GLY O 1 1 8 3368 1 1 29 ILE C C 5.854 -4.060 3.792 1.00 . A A . 29 ILE C 1 1 8 3369 1 1 29 ILE CA C 6.350 -5.505 4.036 1.00 . A A . 29 ILE CA 1 1 8 3370 1 1 29 ILE CB C 7.456 -5.928 3.016 1.00 . A A . 29 ILE CB 1 1 8 3371 1 1 29 ILE CD1 C 9.974 -6.125 2.738 1.00 . A A . 29 ILE CD1 1 1 8 3372 1 1 29 ILE CG1 C 8.840 -5.412 3.501 1.00 . A A . 29 ILE CG1 1 1 8 3373 1 1 29 ILE CG2 C 7.169 -5.408 1.584 1.00 . A A . 29 ILE CG2 1 1 8 3374 1 1 29 ILE H H 4.673 -6.440 3.076 1.00 . A A . 29 ILE H 1 1 8 3375 1 1 29 ILE HA H 6.744 -5.589 5.037 1.00 . A A . 29 ILE HA 1 1 8 3376 1 1 29 ILE HB H 7.455 -7.008 2.983 1.00 . A A . 29 ILE HB 1 1 8 3377 1 1 29 ILE HD11 H 9.845 -7.197 2.783 1.00 . A A . 29 ILE HD11 1 1 8 3378 1 1 29 ILE HD12 H 9.983 -5.816 1.702 1.00 . A A . 29 ILE HD12 1 1 8 3379 1 1 29 ILE HD13 H 10.927 -5.872 3.182 1.00 . A A . 29 ILE HD13 1 1 8 3380 1 1 29 ILE HG12 H 8.915 -4.345 3.343 1.00 . A A . 29 ILE HG12 1 1 8 3381 1 1 29 ILE HG13 H 8.957 -5.610 4.556 1.00 . A A . 29 ILE HG13 1 1 8 3382 1 1 29 ILE HG21 H 6.121 -5.509 1.353 1.00 . A A . 29 ILE HG21 1 1 8 3383 1 1 29 ILE HG22 H 7.444 -4.366 1.495 1.00 . A A . 29 ILE HG22 1 1 8 3384 1 1 29 ILE HG23 H 7.736 -5.978 0.862 1.00 . A A . 29 ILE HG23 1 1 8 3385 1 1 29 ILE N N 5.218 -6.473 3.889 1.00 . A A . 29 ILE N 1 1 8 3386 1 1 29 ILE O O 5.151 -3.825 2.828 1.00 . A A . 29 ILE O 1 1 8 3387 1 1 30 PRO C C 6.517 -1.110 3.247 1.00 . A A . 30 PRO C 1 1 8 3388 1 1 30 PRO CA C 5.815 -1.703 4.474 1.00 . A A . 30 PRO CA 1 1 8 3389 1 1 30 PRO CB C 6.199 -0.997 5.776 1.00 . A A . 30 PRO CB 1 1 8 3390 1 1 30 PRO CD C 7.047 -3.339 5.873 1.00 . A A . 30 PRO CD 1 1 8 3391 1 1 30 PRO CG C 7.095 -1.967 6.567 1.00 . A A . 30 PRO CG 1 1 8 3392 1 1 30 PRO HA H 4.749 -1.666 4.317 1.00 . A A . 30 PRO HA 1 1 8 3393 1 1 30 PRO HB2 H 6.729 -0.075 5.583 1.00 . A A . 30 PRO HB2 1 1 8 3394 1 1 30 PRO HB3 H 5.305 -0.770 6.338 1.00 . A A . 30 PRO HB3 1 1 8 3395 1 1 30 PRO HD2 H 8.034 -3.668 5.587 1.00 . A A . 30 PRO HD2 1 1 8 3396 1 1 30 PRO HD3 H 6.575 -4.074 6.508 1.00 . A A . 30 PRO HD3 1 1 8 3397 1 1 30 PRO HG2 H 8.112 -1.601 6.583 1.00 . A A . 30 PRO HG2 1 1 8 3398 1 1 30 PRO HG3 H 6.742 -2.056 7.585 1.00 . A A . 30 PRO HG3 1 1 8 3399 1 1 30 PRO N N 6.216 -3.126 4.648 1.00 . A A . 30 PRO N 1 1 8 3400 1 1 30 PRO O O 7.682 -0.758 3.290 1.00 . A A . 30 PRO O 1 1 9 3401 1 1 1 CYS C C 6.327 1.141 0.502 1.00 . A A . 1 CYS C 1 1 9 3402 1 1 1 CYS CA C 6.484 -0.381 0.433 1.00 . A A . 1 CYS CA 1 1 9 3403 1 1 1 CYS CB C 5.555 -0.965 -0.631 1.00 . A A . 1 CYS CB 1 1 9 3404 1 1 1 CYS HA H 7.517 -0.639 0.244 1.00 . A A . 1 CYS HA 1 1 9 3405 1 1 1 CYS HB2 H 4.591 -1.102 -0.179 1.00 . A A . 1 CYS HB2 1 1 9 3406 1 1 1 CYS HB3 H 5.433 -0.236 -1.419 1.00 . A A . 1 CYS HB3 1 1 9 3407 1 1 1 CYS N N 6.070 -0.883 1.780 1.00 . A A . 1 CYS N 1 1 9 3408 1 1 1 CYS O O 7.219 1.884 0.142 1.00 . A A . 1 CYS O 1 1 9 3409 1 1 1 CYS SG S 5.961 -2.537 -1.427 1.00 . A A . 1 CYS SG 1 1 9 3410 1 1 2 GLY C C 3.875 3.086 2.304 1.00 . A A . 2 GLY C 1 1 9 3411 1 1 2 GLY CA C 4.832 2.972 1.119 1.00 . A A . 2 GLY CA 1 1 9 3412 1 1 2 GLY H H 4.490 0.880 1.237 1.00 . A A . 2 GLY H 1 1 9 3413 1 1 2 GLY HA2 H 5.725 3.544 1.322 1.00 . A A . 2 GLY HA2 1 1 9 3414 1 1 2 GLY HA3 H 4.354 3.328 0.218 1.00 . A A . 2 GLY HA3 1 1 9 3415 1 1 2 GLY N N 5.168 1.536 0.972 1.00 . A A . 2 GLY N 1 1 9 3416 1 1 2 GLY O O 4.305 3.224 3.432 1.00 . A A . 2 GLY O 1 1 9 3417 1 1 3 GLU C C 0.132 3.174 2.258 1.00 . A A . 3 GLU C 1 1 9 3418 1 1 3 GLU CA C 1.489 3.099 2.981 1.00 . A A . 3 GLU CA 1 1 9 3419 1 1 3 GLU CB C 1.653 4.369 3.860 1.00 . A A . 3 GLU CB 1 1 9 3420 1 1 3 GLU CD C 0.181 5.020 5.816 1.00 . A A . 3 GLU CD 1 1 9 3421 1 1 3 GLU CG C 1.273 4.050 5.329 1.00 . A A . 3 GLU CG 1 1 9 3422 1 1 3 GLU H H 2.385 2.871 1.045 1.00 . A A . 3 GLU H 1 1 9 3423 1 1 3 GLU HA H 1.494 2.202 3.579 1.00 . A A . 3 GLU HA 1 1 9 3424 1 1 3 GLU HB2 H 2.665 4.720 3.825 1.00 . A A . 3 GLU HB2 1 1 9 3425 1 1 3 GLU HB3 H 1.037 5.162 3.461 1.00 . A A . 3 GLU HB3 1 1 9 3426 1 1 3 GLU HG2 H 0.913 3.035 5.434 1.00 . A A . 3 GLU HG2 1 1 9 3427 1 1 3 GLU HG3 H 2.147 4.161 5.951 1.00 . A A . 3 GLU HG3 1 1 9 3428 1 1 3 GLU N N 2.606 3.007 1.984 1.00 . A A . 3 GLU N 1 1 9 3429 1 1 3 GLU O O 0.016 2.792 1.111 1.00 . A A . 3 GLU O 1 1 9 3430 1 1 3 GLU OE1 O 0.528 6.168 6.043 1.00 . A A . 3 GLU OE1 1 1 9 3431 1 1 3 GLU OE2 O -0.943 4.559 5.935 1.00 . A A . 3 GLU OE2 1 1 9 3432 1 1 4 SER C C -2.366 4.219 1.007 1.00 . A A . 4 SER C 1 1 9 3433 1 1 4 SER CA C -2.242 3.839 2.478 1.00 . A A . 4 SER CA 1 1 9 3434 1 1 4 SER CB C -2.956 4.906 3.325 1.00 . A A . 4 SER CB 1 1 9 3435 1 1 4 SER H H -0.651 3.952 3.894 1.00 . A A . 4 SER H 1 1 9 3436 1 1 4 SER HA H -2.750 2.901 2.610 1.00 . A A . 4 SER HA 1 1 9 3437 1 1 4 SER HB2 H -3.789 5.340 2.798 1.00 . A A . 4 SER HB2 1 1 9 3438 1 1 4 SER HB3 H -3.300 4.481 4.254 1.00 . A A . 4 SER HB3 1 1 9 3439 1 1 4 SER HG H -1.877 5.997 4.523 1.00 . A A . 4 SER HG 1 1 9 3440 1 1 4 SER N N -0.844 3.673 2.978 1.00 . A A . 4 SER N 1 1 9 3441 1 1 4 SER O O -1.603 4.996 0.467 1.00 . A A . 4 SER O 1 1 9 3442 1 1 4 SER OG O -1.984 5.915 3.573 1.00 . A A . 4 SER OG 1 1 9 3443 1 1 5 CYS C C -5.238 4.034 -1.104 1.00 . A A . 5 CYS C 1 1 9 3444 1 1 5 CYS CA C -3.722 3.802 -0.993 1.00 . A A . 5 CYS CA 1 1 9 3445 1 1 5 CYS CB C -3.257 2.528 -1.704 1.00 . A A . 5 CYS CB 1 1 9 3446 1 1 5 CYS H H -3.922 3.017 0.972 1.00 . A A . 5 CYS H 1 1 9 3447 1 1 5 CYS HA H -3.217 4.681 -1.341 1.00 . A A . 5 CYS HA 1 1 9 3448 1 1 5 CYS HB2 H -3.843 2.389 -2.596 1.00 . A A . 5 CYS HB2 1 1 9 3449 1 1 5 CYS HB3 H -2.224 2.647 -1.998 1.00 . A A . 5 CYS HB3 1 1 9 3450 1 1 5 CYS N N -3.372 3.618 0.436 1.00 . A A . 5 CYS N 1 1 9 3451 1 1 5 CYS O O -5.873 3.679 -2.080 1.00 . A A . 5 CYS O 1 1 9 3452 1 1 5 CYS SG S -3.394 1.020 -0.712 1.00 . A A . 5 CYS SG 1 1 9 3453 1 1 6 VAL C C -7.576 6.095 -0.941 1.00 . A A . 6 VAL C 1 1 9 3454 1 1 6 VAL CA C -7.213 4.955 0.021 1.00 . A A . 6 VAL CA 1 1 9 3455 1 1 6 VAL CB C -7.539 5.353 1.487 1.00 . A A . 6 VAL CB 1 1 9 3456 1 1 6 VAL CG1 C -9.040 5.709 1.630 1.00 . A A . 6 VAL CG1 1 1 9 3457 1 1 6 VAL CG2 C -7.217 4.171 2.420 1.00 . A A . 6 VAL CG2 1 1 9 3458 1 1 6 VAL H H -5.159 4.895 0.667 1.00 . A A . 6 VAL H 1 1 9 3459 1 1 6 VAL HA H -7.776 4.070 -0.242 1.00 . A A . 6 VAL HA 1 1 9 3460 1 1 6 VAL HB H -6.939 6.204 1.775 1.00 . A A . 6 VAL HB 1 1 9 3461 1 1 6 VAL HG11 H -9.654 4.937 1.190 1.00 . A A . 6 VAL HG11 1 1 9 3462 1 1 6 VAL HG12 H -9.302 5.810 2.673 1.00 . A A . 6 VAL HG12 1 1 9 3463 1 1 6 VAL HG13 H -9.249 6.645 1.134 1.00 . A A . 6 VAL HG13 1 1 9 3464 1 1 6 VAL HG21 H -7.770 3.293 2.121 1.00 . A A . 6 VAL HG21 1 1 9 3465 1 1 6 VAL HG22 H -6.160 3.946 2.387 1.00 . A A . 6 VAL HG22 1 1 9 3466 1 1 6 VAL HG23 H -7.484 4.422 3.437 1.00 . A A . 6 VAL HG23 1 1 9 3467 1 1 6 VAL N N -5.755 4.640 -0.068 1.00 . A A . 6 VAL N 1 1 9 3468 1 1 6 VAL O O -8.341 5.916 -1.869 1.00 . A A . 6 VAL O 1 1 9 3469 1 1 7 TRP C C -6.680 8.339 -2.911 1.00 . A A . 7 TRP C 1 1 9 3470 1 1 7 TRP CA C -7.234 8.457 -1.487 1.00 . A A . 7 TRP CA 1 1 9 3471 1 1 7 TRP CB C -6.578 9.642 -0.763 1.00 . A A . 7 TRP CB 1 1 9 3472 1 1 7 TRP CD1 C -6.593 11.857 -2.089 1.00 . A A . 7 TRP CD1 1 1 9 3473 1 1 7 TRP CD2 C -8.450 11.407 -0.967 1.00 . A A . 7 TRP CD2 1 1 9 3474 1 1 7 TRP CE2 C -8.636 12.625 -1.618 1.00 . A A . 7 TRP CE2 1 1 9 3475 1 1 7 TRP CE3 C -9.472 10.878 -0.180 1.00 . A A . 7 TRP CE3 1 1 9 3476 1 1 7 TRP CG C -7.200 10.951 -1.265 1.00 . A A . 7 TRP CG 1 1 9 3477 1 1 7 TRP CH2 C -10.859 12.783 -0.696 1.00 . A A . 7 TRP CH2 1 1 9 3478 1 1 7 TRP CZ2 C -9.839 13.313 -1.483 1.00 . A A . 7 TRP CZ2 1 1 9 3479 1 1 7 TRP CZ3 C -10.675 11.567 -0.045 1.00 . A A . 7 TRP CZ3 1 1 9 3480 1 1 7 TRP H H -6.393 7.297 0.095 1.00 . A A . 7 TRP H 1 1 9 3481 1 1 7 TRP HA H -8.298 8.608 -1.540 1.00 . A A . 7 TRP HA 1 1 9 3482 1 1 7 TRP HB2 H -6.740 9.557 0.299 1.00 . A A . 7 TRP HB2 1 1 9 3483 1 1 7 TRP HB3 H -5.514 9.659 -0.944 1.00 . A A . 7 TRP HB3 1 1 9 3484 1 1 7 TRP HD1 H -5.601 11.809 -2.515 1.00 . A A . 7 TRP HD1 1 1 9 3485 1 1 7 TRP HE1 H -7.322 13.587 -2.802 1.00 . A A . 7 TRP HE1 1 1 9 3486 1 1 7 TRP HE3 H -9.333 9.935 0.328 1.00 . A A . 7 TRP HE3 1 1 9 3487 1 1 7 TRP HH2 H -11.792 13.316 -0.591 1.00 . A A . 7 TRP HH2 1 1 9 3488 1 1 7 TRP HZ2 H -9.981 14.257 -1.989 1.00 . A A . 7 TRP HZ2 1 1 9 3489 1 1 7 TRP HZ3 H -11.467 11.155 0.566 1.00 . A A . 7 TRP HZ3 1 1 9 3490 1 1 7 TRP N N -6.999 7.237 -0.669 1.00 . A A . 7 TRP N 1 1 9 3491 1 1 7 TRP NE1 N -7.491 12.798 -2.247 1.00 . A A . 7 TRP NE1 1 1 9 3492 1 1 7 TRP O O -7.363 8.651 -3.867 1.00 . A A . 7 TRP O 1 1 9 3493 1 1 8 ILE C C -4.014 6.367 -4.350 1.00 . A A . 8 ILE C 1 1 9 3494 1 1 8 ILE CA C -4.765 7.713 -4.300 1.00 . A A . 8 ILE CA 1 1 9 3495 1 1 8 ILE CB C -3.761 8.895 -4.508 1.00 . A A . 8 ILE CB 1 1 9 3496 1 1 8 ILE CD1 C -2.377 8.425 -2.410 1.00 . A A . 8 ILE CD1 1 1 9 3497 1 1 8 ILE CG1 C -3.207 9.479 -3.171 1.00 . A A . 8 ILE CG1 1 1 9 3498 1 1 8 ILE CG2 C -4.468 10.026 -5.286 1.00 . A A . 8 ILE CG2 1 1 9 3499 1 1 8 ILE H H -4.968 7.656 -2.181 1.00 . A A . 8 ILE H 1 1 9 3500 1 1 8 ILE HA H -5.516 7.707 -5.067 1.00 . A A . 8 ILE HA 1 1 9 3501 1 1 8 ILE HB H -2.925 8.539 -5.086 1.00 . A A . 8 ILE HB 1 1 9 3502 1 1 8 ILE HD11 H -1.783 7.838 -3.095 1.00 . A A . 8 ILE HD11 1 1 9 3503 1 1 8 ILE HD12 H -1.714 8.918 -1.715 1.00 . A A . 8 ILE HD12 1 1 9 3504 1 1 8 ILE HD13 H -3.027 7.766 -1.853 1.00 . A A . 8 ILE HD13 1 1 9 3505 1 1 8 ILE HG12 H -2.567 10.321 -3.394 1.00 . A A . 8 ILE HG12 1 1 9 3506 1 1 8 ILE HG13 H -4.014 9.832 -2.549 1.00 . A A . 8 ILE HG13 1 1 9 3507 1 1 8 ILE HG21 H -4.827 9.658 -6.236 1.00 . A A . 8 ILE HG21 1 1 9 3508 1 1 8 ILE HG22 H -5.308 10.402 -4.720 1.00 . A A . 8 ILE HG22 1 1 9 3509 1 1 8 ILE HG23 H -3.781 10.839 -5.469 1.00 . A A . 8 ILE HG23 1 1 9 3510 1 1 8 ILE N N -5.454 7.887 -2.992 1.00 . A A . 8 ILE N 1 1 9 3511 1 1 8 ILE O O -3.785 5.769 -3.319 1.00 . A A . 8 ILE O 1 1 9 3512 1 1 9 PRO C C -1.365 4.973 -5.181 1.00 . A A . 9 PRO C 1 1 9 3513 1 1 9 PRO CA C -2.787 4.713 -5.708 1.00 . A A . 9 PRO CA 1 1 9 3514 1 1 9 PRO CB C -2.802 4.402 -7.204 1.00 . A A . 9 PRO CB 1 1 9 3515 1 1 9 PRO CD C -4.047 6.528 -6.842 1.00 . A A . 9 PRO CD 1 1 9 3516 1 1 9 PRO CG C -3.424 5.618 -7.914 1.00 . A A . 9 PRO CG 1 1 9 3517 1 1 9 PRO HA H -3.220 3.889 -5.156 1.00 . A A . 9 PRO HA 1 1 9 3518 1 1 9 PRO HB2 H -1.803 4.226 -7.577 1.00 . A A . 9 PRO HB2 1 1 9 3519 1 1 9 PRO HB3 H -3.401 3.522 -7.391 1.00 . A A . 9 PRO HB3 1 1 9 3520 1 1 9 PRO HD2 H -3.654 7.531 -6.913 1.00 . A A . 9 PRO HD2 1 1 9 3521 1 1 9 PRO HD3 H -5.124 6.541 -6.925 1.00 . A A . 9 PRO HD3 1 1 9 3522 1 1 9 PRO HG2 H -2.662 6.158 -8.456 1.00 . A A . 9 PRO HG2 1 1 9 3523 1 1 9 PRO HG3 H -4.183 5.294 -8.610 1.00 . A A . 9 PRO HG3 1 1 9 3524 1 1 9 PRO N N -3.652 5.918 -5.535 1.00 . A A . 9 PRO N 1 1 9 3525 1 1 9 PRO O O -0.978 6.104 -4.957 1.00 . A A . 9 PRO O 1 1 9 3526 1 1 10 CYS C C 1.749 4.475 -5.580 1.00 . A A . 10 CYS C 1 1 9 3527 1 1 10 CYS CA C 0.771 3.990 -4.498 1.00 . A A . 10 CYS CA 1 1 9 3528 1 1 10 CYS CB C 1.210 2.607 -4.001 1.00 . A A . 10 CYS CB 1 1 9 3529 1 1 10 CYS H H -1.018 3.023 -5.210 1.00 . A A . 10 CYS H 1 1 9 3530 1 1 10 CYS HA H 0.807 4.675 -3.667 1.00 . A A . 10 CYS HA 1 1 9 3531 1 1 10 CYS HB2 H 2.007 2.253 -4.631 1.00 . A A . 10 CYS HB2 1 1 9 3532 1 1 10 CYS HB3 H 1.625 2.735 -3.012 1.00 . A A . 10 CYS HB3 1 1 9 3533 1 1 10 CYS N N -0.635 3.900 -5.005 1.00 . A A . 10 CYS N 1 1 9 3534 1 1 10 CYS O O 1.397 4.589 -6.739 1.00 . A A . 10 CYS O 1 1 9 3535 1 1 10 CYS SG S -0.020 1.284 -3.888 1.00 . A A . 10 CYS SG 1 1 9 3536 1 1 11 ILE C C 4.874 4.008 -6.486 1.00 . A A . 11 ILE C 1 1 9 3537 1 1 11 ILE CA C 4.036 5.222 -6.058 1.00 . A A . 11 ILE CA 1 1 9 3538 1 1 11 ILE CB C 4.964 6.257 -5.337 1.00 . A A . 11 ILE CB 1 1 9 3539 1 1 11 ILE CD1 C 4.754 5.855 -2.836 1.00 . A A . 11 ILE CD1 1 1 9 3540 1 1 11 ILE CG1 C 4.367 6.793 -3.998 1.00 . A A . 11 ILE CG1 1 1 9 3541 1 1 11 ILE CG2 C 5.219 7.451 -6.287 1.00 . A A . 11 ILE CG2 1 1 9 3542 1 1 11 ILE H H 3.147 4.620 -4.191 1.00 . A A . 11 ILE H 1 1 9 3543 1 1 11 ILE HA H 3.605 5.672 -6.934 1.00 . A A . 11 ILE HA 1 1 9 3544 1 1 11 ILE HB H 5.912 5.784 -5.150 1.00 . A A . 11 ILE HB 1 1 9 3545 1 1 11 ILE HD11 H 4.723 4.821 -3.145 1.00 . A A . 11 ILE HD11 1 1 9 3546 1 1 11 ILE HD12 H 5.754 6.084 -2.496 1.00 . A A . 11 ILE HD12 1 1 9 3547 1 1 11 ILE HD13 H 4.069 5.992 -2.012 1.00 . A A . 11 ILE HD13 1 1 9 3548 1 1 11 ILE HG12 H 4.763 7.777 -3.787 1.00 . A A . 11 ILE HG12 1 1 9 3549 1 1 11 ILE HG13 H 3.292 6.875 -4.064 1.00 . A A . 11 ILE HG13 1 1 9 3550 1 1 11 ILE HG21 H 5.646 7.102 -7.216 1.00 . A A . 11 ILE HG21 1 1 9 3551 1 1 11 ILE HG22 H 4.293 7.966 -6.501 1.00 . A A . 11 ILE HG22 1 1 9 3552 1 1 11 ILE HG23 H 5.907 8.150 -5.834 1.00 . A A . 11 ILE HG23 1 1 9 3553 1 1 11 ILE N N 2.953 4.742 -5.142 1.00 . A A . 11 ILE N 1 1 9 3554 1 1 11 ILE O O 5.228 3.872 -7.641 1.00 . A A . 11 ILE O 1 1 9 3555 1 1 12 SER C C 5.120 0.882 -6.519 1.00 . A A . 12 SER C 1 1 9 3556 1 1 12 SER CA C 5.965 1.936 -5.769 1.00 . A A . 12 SER CA 1 1 9 3557 1 1 12 SER CB C 6.453 1.425 -4.386 1.00 . A A . 12 SER CB 1 1 9 3558 1 1 12 SER H H 4.843 3.343 -4.618 1.00 . A A . 12 SER H 1 1 9 3559 1 1 12 SER HA H 6.816 2.201 -6.372 1.00 . A A . 12 SER HA 1 1 9 3560 1 1 12 SER HB2 H 7.071 2.163 -3.896 1.00 . A A . 12 SER HB2 1 1 9 3561 1 1 12 SER HB3 H 5.633 1.147 -3.740 1.00 . A A . 12 SER HB3 1 1 9 3562 1 1 12 SER HG H 6.645 -0.457 -4.845 1.00 . A A . 12 SER HG 1 1 9 3563 1 1 12 SER N N 5.161 3.166 -5.523 1.00 . A A . 12 SER N 1 1 9 3564 1 1 12 SER O O 4.905 1.027 -7.706 1.00 . A A . 12 SER O 1 1 9 3565 1 1 12 SER OG O 7.240 0.279 -4.682 1.00 . A A . 12 SER OG 1 1 9 3566 1 1 13 ALA C C 4.589 -2.075 -7.475 1.00 . A A . 13 ALA C 1 1 9 3567 1 1 13 ALA CA C 3.838 -1.234 -6.421 1.00 . A A . 13 ALA CA 1 1 9 3568 1 1 13 ALA CB C 2.572 -0.617 -7.065 1.00 . A A . 13 ALA CB 1 1 9 3569 1 1 13 ALA H H 4.884 -0.182 -4.865 1.00 . A A . 13 ALA H 1 1 9 3570 1 1 13 ALA HA H 3.535 -1.897 -5.625 1.00 . A A . 13 ALA HA 1 1 9 3571 1 1 13 ALA HB1 H 2.229 0.226 -6.482 1.00 . A A . 13 ALA HB1 1 1 9 3572 1 1 13 ALA HB2 H 2.776 -0.284 -8.072 1.00 . A A . 13 ALA HB2 1 1 9 3573 1 1 13 ALA HB3 H 1.784 -1.354 -7.098 1.00 . A A . 13 ALA HB3 1 1 9 3574 1 1 13 ALA N N 4.670 -0.136 -5.819 1.00 . A A . 13 ALA N 1 1 9 3575 1 1 13 ALA O O 4.088 -3.096 -7.906 1.00 . A A . 13 ALA O 1 1 9 3576 1 1 14 ALA C C 7.043 -3.702 -8.306 1.00 . A A . 14 ALA C 1 1 9 3577 1 1 14 ALA CA C 6.583 -2.357 -8.873 1.00 . A A . 14 ALA CA 1 1 9 3578 1 1 14 ALA CB C 7.795 -1.489 -9.234 1.00 . A A . 14 ALA CB 1 1 9 3579 1 1 14 ALA H H 6.115 -0.803 -7.470 1.00 . A A . 14 ALA H 1 1 9 3580 1 1 14 ALA HA H 5.979 -2.533 -9.752 1.00 . A A . 14 ALA HA 1 1 9 3581 1 1 14 ALA HB1 H 8.388 -1.291 -8.352 1.00 . A A . 14 ALA HB1 1 1 9 3582 1 1 14 ALA HB2 H 8.409 -1.991 -9.966 1.00 . A A . 14 ALA HB2 1 1 9 3583 1 1 14 ALA HB3 H 7.459 -0.548 -9.647 1.00 . A A . 14 ALA HB3 1 1 9 3584 1 1 14 ALA N N 5.762 -1.629 -7.856 1.00 . A A . 14 ALA N 1 1 9 3585 1 1 14 ALA O O 7.026 -4.706 -8.992 1.00 . A A . 14 ALA O 1 1 9 3586 1 1 15 LEU C C 6.786 -5.931 -6.283 1.00 . A A . 15 LEU C 1 1 9 3587 1 1 15 LEU CA C 7.916 -4.896 -6.359 1.00 . A A . 15 LEU CA 1 1 9 3588 1 1 15 LEU CB C 8.373 -4.510 -4.942 1.00 . A A . 15 LEU CB 1 1 9 3589 1 1 15 LEU CD1 C 10.021 -2.999 -3.778 1.00 . A A . 15 LEU CD1 1 1 9 3590 1 1 15 LEU CD2 C 10.841 -5.077 -4.943 1.00 . A A . 15 LEU CD2 1 1 9 3591 1 1 15 LEU CG C 9.810 -3.925 -4.992 1.00 . A A . 15 LEU CG 1 1 9 3592 1 1 15 LEU H H 7.431 -2.819 -6.569 1.00 . A A . 15 LEU H 1 1 9 3593 1 1 15 LEU HA H 8.735 -5.307 -6.926 1.00 . A A . 15 LEU HA 1 1 9 3594 1 1 15 LEU HB2 H 7.689 -3.774 -4.543 1.00 . A A . 15 LEU HB2 1 1 9 3595 1 1 15 LEU HB3 H 8.346 -5.376 -4.298 1.00 . A A . 15 LEU HB3 1 1 9 3596 1 1 15 LEU HD11 H 9.837 -3.534 -2.857 1.00 . A A . 15 LEU HD11 1 1 9 3597 1 1 15 LEU HD12 H 11.035 -2.625 -3.766 1.00 . A A . 15 LEU HD12 1 1 9 3598 1 1 15 LEU HD13 H 9.345 -2.159 -3.832 1.00 . A A . 15 LEU HD13 1 1 9 3599 1 1 15 LEU HD21 H 10.688 -5.752 -5.772 1.00 . A A . 15 LEU HD21 1 1 9 3600 1 1 15 LEU HD22 H 11.846 -4.684 -5.003 1.00 . A A . 15 LEU HD22 1 1 9 3601 1 1 15 LEU HD23 H 10.741 -5.633 -4.021 1.00 . A A . 15 LEU HD23 1 1 9 3602 1 1 15 LEU HG H 9.951 -3.354 -5.900 1.00 . A A . 15 LEU HG 1 1 9 3603 1 1 15 LEU N N 7.442 -3.668 -7.059 1.00 . A A . 15 LEU N 1 1 9 3604 1 1 15 LEU O O 7.024 -7.122 -6.333 1.00 . A A . 15 LEU O 1 1 9 3605 1 1 16 GLY C C 3.538 -5.839 -4.857 1.00 . A A . 16 GLY C 1 1 9 3606 1 1 16 GLY CA C 4.363 -6.255 -6.076 1.00 . A A . 16 GLY CA 1 1 9 3607 1 1 16 GLY H H 5.482 -4.450 -6.134 1.00 . A A . 16 GLY H 1 1 9 3608 1 1 16 GLY HA2 H 3.773 -6.126 -6.971 1.00 . A A . 16 GLY HA2 1 1 9 3609 1 1 16 GLY HA3 H 4.651 -7.285 -5.973 1.00 . A A . 16 GLY HA3 1 1 9 3610 1 1 16 GLY N N 5.587 -5.418 -6.166 1.00 . A A . 16 GLY N 1 1 9 3611 1 1 16 GLY O O 2.804 -6.639 -4.308 1.00 . A A . 16 GLY O 1 1 9 3612 1 1 17 CYS C C 1.422 -4.075 -3.583 1.00 . A A . 17 CYS C 1 1 9 3613 1 1 17 CYS CA C 2.927 -4.074 -3.294 1.00 . A A . 17 CYS CA 1 1 9 3614 1 1 17 CYS CB C 3.412 -2.650 -2.980 1.00 . A A . 17 CYS CB 1 1 9 3615 1 1 17 CYS H H 4.285 -3.995 -4.957 1.00 . A A . 17 CYS H 1 1 9 3616 1 1 17 CYS HA H 3.128 -4.710 -2.451 1.00 . A A . 17 CYS HA 1 1 9 3617 1 1 17 CYS HB2 H 2.820 -1.927 -3.520 1.00 . A A . 17 CYS HB2 1 1 9 3618 1 1 17 CYS HB3 H 3.224 -2.480 -1.932 1.00 . A A . 17 CYS HB3 1 1 9 3619 1 1 17 CYS N N 3.681 -4.593 -4.471 1.00 . A A . 17 CYS N 1 1 9 3620 1 1 17 CYS O O 0.931 -3.301 -4.382 1.00 . A A . 17 CYS O 1 1 9 3621 1 1 17 CYS SG S 5.157 -2.260 -3.259 1.00 . A A . 17 CYS SG 1 1 9 3622 1 1 18 SER C C -1.438 -4.188 -2.065 1.00 . A A . 18 SER C 1 1 9 3623 1 1 18 SER CA C -0.733 -5.106 -3.068 1.00 . A A . 18 SER CA 1 1 9 3624 1 1 18 SER CB C -1.125 -6.567 -2.813 1.00 . A A . 18 SER CB 1 1 9 3625 1 1 18 SER H H 1.217 -5.556 -2.282 1.00 . A A . 18 SER H 1 1 9 3626 1 1 18 SER HA H -1.014 -4.819 -4.071 1.00 . A A . 18 SER HA 1 1 9 3627 1 1 18 SER HB2 H -0.834 -6.890 -1.824 1.00 . A A . 18 SER HB2 1 1 9 3628 1 1 18 SER HB3 H -2.182 -6.725 -2.964 1.00 . A A . 18 SER HB3 1 1 9 3629 1 1 18 SER HG H 0.533 -7.301 -3.523 1.00 . A A . 18 SER HG 1 1 9 3630 1 1 18 SER N N 0.745 -4.967 -2.907 1.00 . A A . 18 SER N 1 1 9 3631 1 1 18 SER O O -1.147 -4.221 -0.883 1.00 . A A . 18 SER O 1 1 9 3632 1 1 18 SER OG O -0.392 -7.299 -3.785 1.00 . A A . 18 SER OG 1 1 9 3633 1 1 19 CYS C C -4.248 -3.185 -0.985 1.00 . A A . 19 CYS C 1 1 9 3634 1 1 19 CYS CA C -3.106 -2.455 -1.703 1.00 . A A . 19 CYS CA 1 1 9 3635 1 1 19 CYS CB C -3.675 -1.309 -2.561 1.00 . A A . 19 CYS CB 1 1 9 3636 1 1 19 CYS H H -2.530 -3.424 -3.539 1.00 . A A . 19 CYS H 1 1 9 3637 1 1 19 CYS HA H -2.437 -2.040 -0.965 1.00 . A A . 19 CYS HA 1 1 9 3638 1 1 19 CYS HB2 H -2.850 -0.752 -2.981 1.00 . A A . 19 CYS HB2 1 1 9 3639 1 1 19 CYS HB3 H -4.246 -1.724 -3.379 1.00 . A A . 19 CYS HB3 1 1 9 3640 1 1 19 CYS N N -2.348 -3.397 -2.576 1.00 . A A . 19 CYS N 1 1 9 3641 1 1 19 CYS O O -5.280 -3.461 -1.568 1.00 . A A . 19 CYS O 1 1 9 3642 1 1 19 CYS SG S -4.735 -0.146 -1.669 1.00 . A A . 19 CYS SG 1 1 9 3643 1 1 20 LYS C C -5.050 -3.535 2.502 1.00 . A A . 20 LYS C 1 1 9 3644 1 1 20 LYS CA C -5.020 -4.186 1.116 1.00 . A A . 20 LYS CA 1 1 9 3645 1 1 20 LYS CB C -4.628 -5.671 1.247 1.00 . A A . 20 LYS CB 1 1 9 3646 1 1 20 LYS CD C -4.661 -7.900 0.033 1.00 . A A . 20 LYS CD 1 1 9 3647 1 1 20 LYS CE C -5.803 -8.547 -0.775 1.00 . A A . 20 LYS CE 1 1 9 3648 1 1 20 LYS CG C -4.710 -6.358 -0.136 1.00 . A A . 20 LYS CG 1 1 9 3649 1 1 20 LYS H H -3.150 -3.223 0.664 1.00 . A A . 20 LYS H 1 1 9 3650 1 1 20 LYS HA H -6.000 -4.093 0.670 1.00 . A A . 20 LYS HA 1 1 9 3651 1 1 20 LYS HB2 H -3.624 -5.751 1.640 1.00 . A A . 20 LYS HB2 1 1 9 3652 1 1 20 LYS HB3 H -5.308 -6.155 1.933 1.00 . A A . 20 LYS HB3 1 1 9 3653 1 1 20 LYS HD2 H -3.713 -8.271 -0.328 1.00 . A A . 20 LYS HD2 1 1 9 3654 1 1 20 LYS HD3 H -4.759 -8.178 1.072 1.00 . A A . 20 LYS HD3 1 1 9 3655 1 1 20 LYS HE2 H -6.755 -8.126 -0.486 1.00 . A A . 20 LYS HE2 1 1 9 3656 1 1 20 LYS HE3 H -5.653 -8.386 -1.832 1.00 . A A . 20 LYS HE3 1 1 9 3657 1 1 20 LYS HG2 H -5.623 -6.061 -0.633 1.00 . A A . 20 LYS HG2 1 1 9 3658 1 1 20 LYS HG3 H -3.876 -6.041 -0.745 1.00 . A A . 20 LYS HG3 1 1 9 3659 1 1 20 LYS HZ1 H -5.071 -10.276 0.130 1.00 . A A . 20 LYS HZ1 1 1 9 3660 1 1 20 LYS HZ2 H -6.755 -10.268 -0.094 1.00 . A A . 20 LYS HZ2 1 1 9 3661 1 1 20 LYS HZ3 H -5.723 -10.526 -1.418 1.00 . A A . 20 LYS HZ3 1 1 9 3662 1 1 20 LYS N N -4.011 -3.476 0.269 1.00 . A A . 20 LYS N 1 1 9 3663 1 1 20 LYS NZ N -5.840 -10.015 -0.519 1.00 . A A . 20 LYS NZ 1 1 9 3664 1 1 20 LYS O O -4.032 -3.081 2.991 1.00 . A A . 20 LYS O 1 1 9 3665 1 1 21 ASN C C -5.823 -1.500 4.506 1.00 . A A . 21 ASN C 1 1 9 3666 1 1 21 ASN CA C -6.432 -2.913 4.442 1.00 . A A . 21 ASN CA 1 1 9 3667 1 1 21 ASN CB C -5.780 -3.851 5.494 1.00 . A A . 21 ASN CB 1 1 9 3668 1 1 21 ASN CG C -6.402 -5.248 5.373 1.00 . A A . 21 ASN CG 1 1 9 3669 1 1 21 ASN H H -6.993 -3.904 2.617 1.00 . A A . 21 ASN H 1 1 9 3670 1 1 21 ASN HA H -7.494 -2.836 4.624 1.00 . A A . 21 ASN HA 1 1 9 3671 1 1 21 ASN HB2 H -4.715 -3.929 5.333 1.00 . A A . 21 ASN HB2 1 1 9 3672 1 1 21 ASN HB3 H -5.959 -3.477 6.491 1.00 . A A . 21 ASN HB3 1 1 9 3673 1 1 21 ASN HD21 H -5.199 -5.786 3.890 1.00 . A A . 21 ASN HD21 1 1 9 3674 1 1 21 ASN HD22 H -6.318 -6.965 4.376 1.00 . A A . 21 ASN HD22 1 1 9 3675 1 1 21 ASN N N -6.226 -3.514 3.083 1.00 . A A . 21 ASN N 1 1 9 3676 1 1 21 ASN ND2 N -5.935 -6.068 4.472 1.00 . A A . 21 ASN ND2 1 1 9 3677 1 1 21 ASN O O -4.973 -1.212 5.326 1.00 . A A . 21 ASN O 1 1 9 3678 1 1 21 ASN OD1 O -7.314 -5.603 6.092 1.00 . A A . 21 ASN OD1 1 1 9 3679 1 1 22 LYS C C -4.363 0.988 3.668 1.00 . A A . 22 LYS C 1 1 9 3680 1 1 22 LYS CA C -5.873 0.754 3.460 1.00 . A A . 22 LYS CA 1 1 9 3681 1 1 22 LYS CB C -6.702 1.634 4.461 1.00 . A A . 22 LYS CB 1 1 9 3682 1 1 22 LYS CD C -7.173 2.250 6.873 1.00 . A A . 22 LYS CD 1 1 9 3683 1 1 22 LYS CE C -8.169 1.595 7.847 1.00 . A A . 22 LYS CE 1 1 9 3684 1 1 22 LYS CG C -6.566 1.175 5.933 1.00 . A A . 22 LYS CG 1 1 9 3685 1 1 22 LYS H H -6.990 -1.018 2.993 1.00 . A A . 22 LYS H 1 1 9 3686 1 1 22 LYS HA H -6.115 1.066 2.454 1.00 . A A . 22 LYS HA 1 1 9 3687 1 1 22 LYS HB2 H -6.365 2.656 4.381 1.00 . A A . 22 LYS HB2 1 1 9 3688 1 1 22 LYS HB3 H -7.742 1.606 4.165 1.00 . A A . 22 LYS HB3 1 1 9 3689 1 1 22 LYS HD2 H -6.381 2.720 7.437 1.00 . A A . 22 LYS HD2 1 1 9 3690 1 1 22 LYS HD3 H -7.683 3.015 6.304 1.00 . A A . 22 LYS HD3 1 1 9 3691 1 1 22 LYS HE2 H -8.885 0.993 7.308 1.00 . A A . 22 LYS HE2 1 1 9 3692 1 1 22 LYS HE3 H -7.645 0.970 8.555 1.00 . A A . 22 LYS HE3 1 1 9 3693 1 1 22 LYS HG2 H -7.074 0.230 6.063 1.00 . A A . 22 LYS HG2 1 1 9 3694 1 1 22 LYS HG3 H -5.524 1.042 6.187 1.00 . A A . 22 LYS HG3 1 1 9 3695 1 1 22 LYS HZ1 H -9.247 3.374 7.932 1.00 . A A . 22 LYS HZ1 1 1 9 3696 1 1 22 LYS HZ2 H -9.720 2.222 9.087 1.00 . A A . 22 LYS HZ2 1 1 9 3697 1 1 22 LYS HZ3 H -8.274 3.089 9.294 1.00 . A A . 22 LYS HZ3 1 1 9 3698 1 1 22 LYS N N -6.306 -0.676 3.606 1.00 . A A . 22 LYS N 1 1 9 3699 1 1 22 LYS NZ N -8.908 2.649 8.597 1.00 . A A . 22 LYS NZ 1 1 9 3700 1 1 22 LYS O O -3.945 1.928 4.317 1.00 . A A . 22 LYS O 1 1 9 3701 1 1 23 VAL C C -1.566 -0.509 1.891 1.00 . A A . 23 VAL C 1 1 9 3702 1 1 23 VAL CA C -2.113 0.142 3.172 1.00 . A A . 23 VAL CA 1 1 9 3703 1 1 23 VAL CB C -1.687 -0.611 4.480 1.00 . A A . 23 VAL CB 1 1 9 3704 1 1 23 VAL CG1 C -0.916 -1.927 4.213 1.00 . A A . 23 VAL CG1 1 1 9 3705 1 1 23 VAL CG2 C -0.812 0.335 5.331 1.00 . A A . 23 VAL CG2 1 1 9 3706 1 1 23 VAL H H -3.992 -0.647 2.605 1.00 . A A . 23 VAL H 1 1 9 3707 1 1 23 VAL HA H -1.815 1.174 3.181 1.00 . A A . 23 VAL HA 1 1 9 3708 1 1 23 VAL HB H -2.578 -0.855 5.037 1.00 . A A . 23 VAL HB 1 1 9 3709 1 1 23 VAL HG11 H -0.045 -1.730 3.607 1.00 . A A . 23 VAL HG11 1 1 9 3710 1 1 23 VAL HG12 H -0.602 -2.367 5.147 1.00 . A A . 23 VAL HG12 1 1 9 3711 1 1 23 VAL HG13 H -1.547 -2.635 3.699 1.00 . A A . 23 VAL HG13 1 1 9 3712 1 1 23 VAL HG21 H 0.026 0.693 4.750 1.00 . A A . 23 VAL HG21 1 1 9 3713 1 1 23 VAL HG22 H -1.396 1.185 5.657 1.00 . A A . 23 VAL HG22 1 1 9 3714 1 1 23 VAL HG23 H -0.439 -0.179 6.204 1.00 . A A . 23 VAL HG23 1 1 9 3715 1 1 23 VAL N N -3.595 0.093 3.098 1.00 . A A . 23 VAL N 1 1 9 3716 1 1 23 VAL O O -2.118 -1.491 1.431 1.00 . A A . 23 VAL O 1 1 9 3717 1 1 24 CYS C C 1.462 -1.125 0.424 1.00 . A A . 24 CYS C 1 1 9 3718 1 1 24 CYS CA C 0.094 -0.523 0.103 1.00 . A A . 24 CYS CA 1 1 9 3719 1 1 24 CYS CB C 0.259 0.582 -0.948 1.00 . A A . 24 CYS CB 1 1 9 3720 1 1 24 CYS H H -0.100 0.838 1.775 1.00 . A A . 24 CYS H 1 1 9 3721 1 1 24 CYS HA H -0.539 -1.301 -0.297 1.00 . A A . 24 CYS HA 1 1 9 3722 1 1 24 CYS HB2 H -0.693 1.069 -1.089 1.00 . A A . 24 CYS HB2 1 1 9 3723 1 1 24 CYS HB3 H 0.958 1.320 -0.586 1.00 . A A . 24 CYS HB3 1 1 9 3724 1 1 24 CYS N N -0.506 0.048 1.355 1.00 . A A . 24 CYS N 1 1 9 3725 1 1 24 CYS O O 2.478 -0.477 0.272 1.00 . A A . 24 CYS O 1 1 9 3726 1 1 24 CYS SG S 0.843 0.026 -2.567 1.00 . A A . 24 CYS SG 1 1 9 3727 1 1 25 TYR C C 2.754 -4.374 0.350 1.00 . A A . 25 TYR C 1 1 9 3728 1 1 25 TYR CA C 2.653 -3.125 1.231 1.00 . A A . 25 TYR CA 1 1 9 3729 1 1 25 TYR CB C 2.557 -3.552 2.695 1.00 . A A . 25 TYR CB 1 1 9 3730 1 1 25 TYR CD1 C 2.954 -1.087 3.350 1.00 . A A . 25 TYR CD1 1 1 9 3731 1 1 25 TYR CD2 C 2.146 -2.607 4.985 1.00 . A A . 25 TYR CD2 1 1 9 3732 1 1 25 TYR CE1 C 2.932 -0.075 4.280 1.00 . A A . 25 TYR CE1 1 1 9 3733 1 1 25 TYR CE2 C 2.124 -1.593 5.916 1.00 . A A . 25 TYR CE2 1 1 9 3734 1 1 25 TYR CG C 2.560 -2.371 3.690 1.00 . A A . 25 TYR CG 1 1 9 3735 1 1 25 TYR CZ C 2.517 -0.317 5.571 1.00 . A A . 25 TYR CZ 1 1 9 3736 1 1 25 TYR H H 0.563 -2.810 0.953 1.00 . A A . 25 TYR H 1 1 9 3737 1 1 25 TYR HA H 3.537 -2.521 1.080 1.00 . A A . 25 TYR HA 1 1 9 3738 1 1 25 TYR HB2 H 1.646 -4.115 2.835 1.00 . A A . 25 TYR HB2 1 1 9 3739 1 1 25 TYR HB3 H 3.376 -4.204 2.928 1.00 . A A . 25 TYR HB3 1 1 9 3740 1 1 25 TYR HD1 H 3.292 -0.859 2.354 1.00 . A A . 25 TYR HD1 1 1 9 3741 1 1 25 TYR HD2 H 1.835 -3.598 5.276 1.00 . A A . 25 TYR HD2 1 1 9 3742 1 1 25 TYR HE1 H 3.244 0.914 3.989 1.00 . A A . 25 TYR HE1 1 1 9 3743 1 1 25 TYR HE2 H 1.794 -1.806 6.921 1.00 . A A . 25 TYR HE2 1 1 9 3744 1 1 25 TYR HH H 2.056 1.458 6.100 1.00 . A A . 25 TYR HH 1 1 9 3745 1 1 25 TYR N N 1.425 -2.358 0.861 1.00 . A A . 25 TYR N 1 1 9 3746 1 1 25 TYR O O 1.813 -4.725 -0.337 1.00 . A A . 25 TYR O 1 1 9 3747 1 1 25 TYR OH O 2.496 0.704 6.499 1.00 . A A . 25 TYR OH 1 1 9 3748 1 1 26 ARG C C 3.794 -7.452 0.499 1.00 . A A . 26 ARG C 1 1 9 3749 1 1 26 ARG CA C 4.137 -6.247 -0.394 1.00 . A A . 26 ARG CA 1 1 9 3750 1 1 26 ARG CB C 5.628 -6.259 -0.841 1.00 . A A . 26 ARG CB 1 1 9 3751 1 1 26 ARG CD C 6.672 -8.065 -2.296 1.00 . A A . 26 ARG CD 1 1 9 3752 1 1 26 ARG CG C 5.763 -6.818 -2.287 1.00 . A A . 26 ARG CG 1 1 9 3753 1 1 26 ARG CZ C 8.077 -9.184 -3.961 1.00 . A A . 26 ARG CZ 1 1 9 3754 1 1 26 ARG H H 4.608 -4.661 0.990 1.00 . A A . 26 ARG H 1 1 9 3755 1 1 26 ARG HA H 3.474 -6.265 -1.245 1.00 . A A . 26 ARG HA 1 1 9 3756 1 1 26 ARG HB2 H 6.012 -5.249 -0.829 1.00 . A A . 26 ARG HB2 1 1 9 3757 1 1 26 ARG HB3 H 6.217 -6.843 -0.147 1.00 . A A . 26 ARG HB3 1 1 9 3758 1 1 26 ARG HD2 H 7.399 -8.031 -1.498 1.00 . A A . 26 ARG HD2 1 1 9 3759 1 1 26 ARG HD3 H 6.070 -8.955 -2.191 1.00 . A A . 26 ARG HD3 1 1 9 3760 1 1 26 ARG HE H 7.378 -7.343 -4.200 1.00 . A A . 26 ARG HE 1 1 9 3761 1 1 26 ARG HG2 H 4.797 -7.097 -2.683 1.00 . A A . 26 ARG HG2 1 1 9 3762 1 1 26 ARG HG3 H 6.180 -6.053 -2.927 1.00 . A A . 26 ARG HG3 1 1 9 3763 1 1 26 ARG HH11 H 7.648 -10.233 -2.305 1.00 . A A . 26 ARG HH11 1 1 9 3764 1 1 26 ARG HH12 H 8.643 -11.041 -3.469 1.00 . A A . 26 ARG HH12 1 1 9 3765 1 1 26 ARG HH21 H 8.649 -8.356 -5.691 1.00 . A A . 26 ARG HH21 1 1 9 3766 1 1 26 ARG HH22 H 9.213 -9.968 -5.407 1.00 . A A . 26 ARG HH22 1 1 9 3767 1 1 26 ARG N N 3.900 -5.007 0.410 1.00 . A A . 26 ARG N 1 1 9 3768 1 1 26 ARG NE N 7.403 -8.119 -3.601 1.00 . A A . 26 ARG NE 1 1 9 3769 1 1 26 ARG NH1 N 8.126 -10.234 -3.182 1.00 . A A . 26 ARG NH1 1 1 9 3770 1 1 26 ARG NH2 N 8.695 -9.167 -5.109 1.00 . A A . 26 ARG NH2 1 1 9 3771 1 1 26 ARG O O 4.477 -8.459 0.515 1.00 . A A . 26 ARG O 1 1 9 3772 1 1 27 ASN C C 3.244 -8.753 3.191 1.00 . A A . 27 ASN C 1 1 9 3773 1 1 27 ASN CA C 2.185 -8.316 2.161 1.00 . A A . 27 ASN CA 1 1 9 3774 1 1 27 ASN CB C 1.692 -9.524 1.313 1.00 . A A . 27 ASN CB 1 1 9 3775 1 1 27 ASN CG C 0.557 -10.240 2.055 1.00 . A A . 27 ASN CG 1 1 9 3776 1 1 27 ASN H H 2.222 -6.436 1.140 1.00 . A A . 27 ASN H 1 1 9 3777 1 1 27 ASN HA H 1.360 -7.876 2.703 1.00 . A A . 27 ASN HA 1 1 9 3778 1 1 27 ASN HB2 H 1.315 -9.179 0.361 1.00 . A A . 27 ASN HB2 1 1 9 3779 1 1 27 ASN HB3 H 2.492 -10.227 1.132 1.00 . A A . 27 ASN HB3 1 1 9 3780 1 1 27 ASN HD21 H 1.793 -11.385 3.105 1.00 . A A . 27 ASN HD21 1 1 9 3781 1 1 27 ASN HD22 H 0.143 -11.629 3.412 1.00 . A A . 27 ASN HD22 1 1 9 3782 1 1 27 ASN N N 2.711 -7.281 1.221 1.00 . A A . 27 ASN N 1 1 9 3783 1 1 27 ASN ND2 N 0.855 -11.161 2.930 1.00 . A A . 27 ASN ND2 1 1 9 3784 1 1 27 ASN O O 3.389 -9.924 3.488 1.00 . A A . 27 ASN O 1 1 9 3785 1 1 27 ASN OD1 O -0.608 -9.968 1.846 1.00 . A A . 27 ASN OD1 1 1 9 3786 1 1 28 GLY C C 6.039 -6.967 4.901 1.00 . A A . 28 GLY C 1 1 9 3787 1 1 28 GLY CA C 5.012 -8.088 4.717 1.00 . A A . 28 GLY CA 1 1 9 3788 1 1 28 GLY H H 3.803 -6.859 3.437 1.00 . A A . 28 GLY H 1 1 9 3789 1 1 28 GLY HA2 H 4.534 -8.286 5.664 1.00 . A A . 28 GLY HA2 1 1 9 3790 1 1 28 GLY HA3 H 5.537 -8.968 4.391 1.00 . A A . 28 GLY HA3 1 1 9 3791 1 1 28 GLY N N 3.957 -7.784 3.709 1.00 . A A . 28 GLY N 1 1 9 3792 1 1 28 GLY O O 6.615 -6.849 5.966 1.00 . A A . 28 GLY O 1 1 9 3793 1 1 29 ILE C C 6.518 -3.712 3.659 1.00 . A A . 29 ILE C 1 1 9 3794 1 1 29 ILE CA C 7.226 -5.054 3.943 1.00 . A A . 29 ILE CA 1 1 9 3795 1 1 29 ILE CB C 8.347 -5.349 2.900 1.00 . A A . 29 ILE CB 1 1 9 3796 1 1 29 ILE CD1 C 10.828 -5.045 2.439 1.00 . A A . 29 ILE CD1 1 1 9 3797 1 1 29 ILE CG1 C 9.625 -4.540 3.259 1.00 . A A . 29 ILE CG1 1 1 9 3798 1 1 29 ILE CG2 C 7.890 -5.019 1.457 1.00 . A A . 29 ILE CG2 1 1 9 3799 1 1 29 ILE H H 5.746 -6.318 3.041 1.00 . A A . 29 ILE H 1 1 9 3800 1 1 29 ILE HA H 7.659 -5.033 4.929 1.00 . A A . 29 ILE HA 1 1 9 3801 1 1 29 ILE HB H 8.556 -6.408 2.949 1.00 . A A . 29 ILE HB 1 1 9 3802 1 1 29 ILE HD11 H 10.908 -6.120 2.506 1.00 . A A . 29 ILE HD11 1 1 9 3803 1 1 29 ILE HD12 H 10.720 -4.764 1.402 1.00 . A A . 29 ILE HD12 1 1 9 3804 1 1 29 ILE HD13 H 11.739 -4.607 2.822 1.00 . A A . 29 ILE HD13 1 1 9 3805 1 1 29 ILE HG12 H 9.469 -3.489 3.063 1.00 . A A . 29 ILE HG12 1 1 9 3806 1 1 29 ILE HG13 H 9.851 -4.664 4.308 1.00 . A A . 29 ILE HG13 1 1 9 3807 1 1 29 ILE HG21 H 6.866 -5.328 1.319 1.00 . A A . 29 ILE HG21 1 1 9 3808 1 1 29 ILE HG22 H 7.963 -3.957 1.265 1.00 . A A . 29 ILE HG22 1 1 9 3809 1 1 29 ILE HG23 H 8.507 -5.544 0.744 1.00 . A A . 29 ILE HG23 1 1 9 3810 1 1 29 ILE N N 6.242 -6.178 3.873 1.00 . A A . 29 ILE N 1 1 9 3811 1 1 29 ILE O O 5.694 -3.650 2.767 1.00 . A A . 29 ILE O 1 1 9 3812 1 1 30 PRO C C 6.859 -0.763 2.817 1.00 . A A . 30 PRO C 1 1 9 3813 1 1 30 PRO CA C 6.290 -1.323 4.128 1.00 . A A . 30 PRO CA 1 1 9 3814 1 1 30 PRO CB C 6.655 -0.470 5.349 1.00 . A A . 30 PRO CB 1 1 9 3815 1 1 30 PRO CD C 7.748 -2.693 5.590 1.00 . A A . 30 PRO CD 1 1 9 3816 1 1 30 PRO CG C 7.677 -1.270 6.172 1.00 . A A . 30 PRO CG 1 1 9 3817 1 1 30 PRO HA H 5.221 -1.406 4.037 1.00 . A A . 30 PRO HA 1 1 9 3818 1 1 30 PRO HB2 H 7.074 0.481 5.055 1.00 . A A . 30 PRO HB2 1 1 9 3819 1 1 30 PRO HB3 H 5.768 -0.287 5.939 1.00 . A A . 30 PRO HB3 1 1 9 3820 1 1 30 PRO HD2 H 8.752 -2.932 5.275 1.00 . A A . 30 PRO HD2 1 1 9 3821 1 1 30 PRO HD3 H 7.395 -3.419 6.308 1.00 . A A . 30 PRO HD3 1 1 9 3822 1 1 30 PRO HG2 H 8.647 -0.799 6.113 1.00 . A A . 30 PRO HG2 1 1 9 3823 1 1 30 PRO HG3 H 7.371 -1.308 7.207 1.00 . A A . 30 PRO HG3 1 1 9 3824 1 1 30 PRO N N 6.837 -2.676 4.404 1.00 . A A . 30 PRO N 1 1 9 3825 1 1 30 PRO O O 7.965 -0.256 2.780 1.00 . A A . 30 PRO O 1 1 10 3826 1 1 1 CYS C C 6.328 0.761 1.072 1.00 . A A . 1 CYS C 1 1 10 3827 1 1 1 CYS CA C 6.385 -0.770 1.060 1.00 . A A . 1 CYS CA 1 1 10 3828 1 1 1 CYS CB C 5.545 -1.336 -0.091 1.00 . A A . 1 CYS CB 1 1 10 3829 1 1 1 CYS HA H 7.412 -1.097 0.982 1.00 . A A . 1 CYS HA 1 1 10 3830 1 1 1 CYS HB2 H 4.572 -1.572 0.292 1.00 . A A . 1 CYS HB2 1 1 10 3831 1 1 1 CYS HB3 H 5.412 -0.565 -0.837 1.00 . A A . 1 CYS HB3 1 1 10 3832 1 1 1 CYS N N 5.803 -1.231 2.359 1.00 . A A . 1 CYS N 1 1 10 3833 1 1 1 CYS O O 7.314 1.419 0.800 1.00 . A A . 1 CYS O 1 1 10 3834 1 1 1 CYS SG S 6.126 -2.813 -0.959 1.00 . A A . 1 CYS SG 1 1 10 3835 1 1 2 GLY C C 3.987 3.037 2.595 1.00 . A A . 2 GLY C 1 1 10 3836 1 1 2 GLY CA C 4.951 2.743 1.447 1.00 . A A . 2 GLY CA 1 1 10 3837 1 1 2 GLY H H 4.400 0.690 1.596 1.00 . A A . 2 GLY H 1 1 10 3838 1 1 2 GLY HA2 H 5.888 3.249 1.629 1.00 . A A . 2 GLY HA2 1 1 10 3839 1 1 2 GLY HA3 H 4.524 3.082 0.514 1.00 . A A . 2 GLY HA3 1 1 10 3840 1 1 2 GLY N N 5.162 1.272 1.390 1.00 . A A . 2 GLY N 1 1 10 3841 1 1 2 GLY O O 4.410 3.241 3.717 1.00 . A A . 2 GLY O 1 1 10 3842 1 1 3 GLU C C 0.257 3.362 2.537 1.00 . A A . 3 GLU C 1 1 10 3843 1 1 3 GLU CA C 1.622 3.308 3.240 1.00 . A A . 3 GLU CA 1 1 10 3844 1 1 3 GLU CB C 1.890 4.650 3.936 1.00 . A A . 3 GLU CB 1 1 10 3845 1 1 3 GLU CD C 0.642 4.195 6.073 1.00 . A A . 3 GLU CD 1 1 10 3846 1 1 3 GLU CG C 2.031 4.429 5.450 1.00 . A A . 3 GLU CG 1 1 10 3847 1 1 3 GLU H H 2.479 2.852 1.340 1.00 . A A . 3 GLU H 1 1 10 3848 1 1 3 GLU HA H 1.594 2.493 3.943 1.00 . A A . 3 GLU HA 1 1 10 3849 1 1 3 GLU HB2 H 2.798 5.073 3.547 1.00 . A A . 3 GLU HB2 1 1 10 3850 1 1 3 GLU HB3 H 1.101 5.348 3.714 1.00 . A A . 3 GLU HB3 1 1 10 3851 1 1 3 GLU HG2 H 2.666 3.579 5.660 1.00 . A A . 3 GLU HG2 1 1 10 3852 1 1 3 GLU HG3 H 2.482 5.306 5.881 1.00 . A A . 3 GLU HG3 1 1 10 3853 1 1 3 GLU N N 2.719 3.038 2.262 1.00 . A A . 3 GLU N 1 1 10 3854 1 1 3 GLU O O 0.137 2.985 1.389 1.00 . A A . 3 GLU O 1 1 10 3855 1 1 3 GLU OE1 O 0.245 3.041 6.110 1.00 . A A . 3 GLU OE1 1 1 10 3856 1 1 3 GLU OE2 O 0.053 5.185 6.474 1.00 . A A . 3 GLU OE2 1 1 10 3857 1 1 4 SER C C -2.237 4.426 1.297 1.00 . A A . 4 SER C 1 1 10 3858 1 1 4 SER CA C -2.124 3.969 2.749 1.00 . A A . 4 SER CA 1 1 10 3859 1 1 4 SER CB C -2.911 4.957 3.626 1.00 . A A . 4 SER CB 1 1 10 3860 1 1 4 SER H H -0.539 4.130 4.179 1.00 . A A . 4 SER H 1 1 10 3861 1 1 4 SER HA H -2.587 3.002 2.815 1.00 . A A . 4 SER HA 1 1 10 3862 1 1 4 SER HB2 H -2.687 5.976 3.361 1.00 . A A . 4 SER HB2 1 1 10 3863 1 1 4 SER HB3 H -3.972 4.782 3.546 1.00 . A A . 4 SER HB3 1 1 10 3864 1 1 4 SER HG H -1.571 4.925 5.033 1.00 . A A . 4 SER HG 1 1 10 3865 1 1 4 SER N N -0.725 3.842 3.263 1.00 . A A . 4 SER N 1 1 10 3866 1 1 4 SER O O -1.460 5.219 0.801 1.00 . A A . 4 SER O 1 1 10 3867 1 1 4 SER OG O -2.499 4.691 4.961 1.00 . A A . 4 SER OG 1 1 10 3868 1 1 5 CYS C C -5.059 4.565 -0.834 1.00 . A A . 5 CYS C 1 1 10 3869 1 1 5 CYS CA C -3.587 4.130 -0.732 1.00 . A A . 5 CYS CA 1 1 10 3870 1 1 5 CYS CB C -3.282 2.816 -1.483 1.00 . A A . 5 CYS CB 1 1 10 3871 1 1 5 CYS H H -3.803 3.252 1.194 1.00 . A A . 5 CYS H 1 1 10 3872 1 1 5 CYS HA H -2.976 4.938 -1.081 1.00 . A A . 5 CYS HA 1 1 10 3873 1 1 5 CYS HB2 H -3.962 2.713 -2.312 1.00 . A A . 5 CYS HB2 1 1 10 3874 1 1 5 CYS HB3 H -2.281 2.874 -1.884 1.00 . A A . 5 CYS HB3 1 1 10 3875 1 1 5 CYS N N -3.246 3.869 0.688 1.00 . A A . 5 CYS N 1 1 10 3876 1 1 5 CYS O O -5.744 4.287 -1.800 1.00 . A A . 5 CYS O 1 1 10 3877 1 1 5 CYS SG S -3.397 1.292 -0.512 1.00 . A A . 5 CYS SG 1 1 10 3878 1 1 6 VAL C C -7.013 7.059 -0.526 1.00 . A A . 6 VAL C 1 1 10 3879 1 1 6 VAL CA C -6.884 5.762 0.286 1.00 . A A . 6 VAL CA 1 1 10 3880 1 1 6 VAL CB C -7.230 6.018 1.779 1.00 . A A . 6 VAL CB 1 1 10 3881 1 1 6 VAL CG1 C -8.671 6.572 1.907 1.00 . A A . 6 VAL CG1 1 1 10 3882 1 1 6 VAL CG2 C -7.138 4.694 2.553 1.00 . A A . 6 VAL CG2 1 1 10 3883 1 1 6 VAL H H -4.853 5.432 0.927 1.00 . A A . 6 VAL H 1 1 10 3884 1 1 6 VAL HA H -7.556 5.016 -0.113 1.00 . A A . 6 VAL HA 1 1 10 3885 1 1 6 VAL HB H -6.532 6.725 2.206 1.00 . A A . 6 VAL HB 1 1 10 3886 1 1 6 VAL HG11 H -9.365 5.949 1.362 1.00 . A A . 6 VAL HG11 1 1 10 3887 1 1 6 VAL HG12 H -8.970 6.596 2.945 1.00 . A A . 6 VAL HG12 1 1 10 3888 1 1 6 VAL HG13 H -8.722 7.576 1.514 1.00 . A A . 6 VAL HG13 1 1 10 3889 1 1 6 VAL HG21 H -7.808 3.959 2.130 1.00 . A A . 6 VAL HG21 1 1 10 3890 1 1 6 VAL HG22 H -6.129 4.311 2.510 1.00 . A A . 6 VAL HG22 1 1 10 3891 1 1 6 VAL HG23 H -7.404 4.854 3.588 1.00 . A A . 6 VAL HG23 1 1 10 3892 1 1 6 VAL N N -5.481 5.251 0.197 1.00 . A A . 6 VAL N 1 1 10 3893 1 1 6 VAL O O -7.657 7.086 -1.557 1.00 . A A . 6 VAL O 1 1 10 3894 1 1 7 TRP C C -5.886 9.348 -2.106 1.00 . A A . 7 TRP C 1 1 10 3895 1 1 7 TRP CA C -6.402 9.432 -0.668 1.00 . A A . 7 TRP CA 1 1 10 3896 1 1 7 TRP CB C -5.517 10.373 0.151 1.00 . A A . 7 TRP CB 1 1 10 3897 1 1 7 TRP CD1 C -5.095 12.605 -1.075 1.00 . A A . 7 TRP CD1 1 1 10 3898 1 1 7 TRP CD2 C -6.896 12.554 0.218 1.00 . A A . 7 TRP CD2 1 1 10 3899 1 1 7 TRP CE2 C -6.828 13.821 -0.360 1.00 . A A . 7 TRP CE2 1 1 10 3900 1 1 7 TRP CE3 C -7.942 12.243 1.086 1.00 . A A . 7 TRP CE3 1 1 10 3901 1 1 7 TRP CG C -5.833 11.825 -0.228 1.00 . A A . 7 TRP CG 1 1 10 3902 1 1 7 TRP CH2 C -8.846 14.461 0.795 1.00 . A A . 7 TRP CH2 1 1 10 3903 1 1 7 TRP CZ2 C -7.802 14.774 -0.072 1.00 . A A . 7 TRP CZ2 1 1 10 3904 1 1 7 TRP CZ3 C -8.916 13.196 1.374 1.00 . A A . 7 TRP CZ3 1 1 10 3905 1 1 7 TRP H H -5.889 7.984 0.819 1.00 . A A . 7 TRP H 1 1 10 3906 1 1 7 TRP HA H -7.421 9.785 -0.675 1.00 . A A . 7 TRP HA 1 1 10 3907 1 1 7 TRP HB2 H -5.703 10.229 1.203 1.00 . A A . 7 TRP HB2 1 1 10 3908 1 1 7 TRP HB3 H -4.474 10.172 -0.042 1.00 . A A . 7 TRP HB3 1 1 10 3909 1 1 7 TRP HD1 H -4.191 12.341 -1.603 1.00 . A A . 7 TRP HD1 1 1 10 3910 1 1 7 TRP HE1 H -5.427 14.506 -1.635 1.00 . A A . 7 TRP HE1 1 1 10 3911 1 1 7 TRP HE3 H -7.999 11.262 1.536 1.00 . A A . 7 TRP HE3 1 1 10 3912 1 1 7 TRP HH2 H -9.601 15.199 1.020 1.00 . A A . 7 TRP HH2 1 1 10 3913 1 1 7 TRP HZ2 H -7.747 15.755 -0.520 1.00 . A A . 7 TRP HZ2 1 1 10 3914 1 1 7 TRP HZ3 H -9.726 12.954 2.046 1.00 . A A . 7 TRP HZ3 1 1 10 3915 1 1 7 TRP N N -6.386 8.090 -0.016 1.00 . A A . 7 TRP N 1 1 10 3916 1 1 7 TRP NE1 N -5.739 13.748 -1.098 1.00 . A A . 7 TRP NE1 1 1 10 3917 1 1 7 TRP O O -6.428 9.957 -3.008 1.00 . A A . 7 TRP O 1 1 10 3918 1 1 8 ILE C C -3.551 6.965 -3.579 1.00 . A A . 8 ILE C 1 1 10 3919 1 1 8 ILE CA C -4.196 8.369 -3.569 1.00 . A A . 8 ILE CA 1 1 10 3920 1 1 8 ILE CB C -3.126 9.493 -3.792 1.00 . A A . 8 ILE CB 1 1 10 3921 1 1 8 ILE CD1 C -1.622 10.495 -5.576 1.00 . A A . 8 ILE CD1 1 1 10 3922 1 1 8 ILE CG1 C -2.352 9.220 -5.116 1.00 . A A . 8 ILE CG1 1 1 10 3923 1 1 8 ILE CG2 C -2.130 9.589 -2.601 1.00 . A A . 8 ILE CG2 1 1 10 3924 1 1 8 ILE H H -4.471 8.128 -1.464 1.00 . A A . 8 ILE H 1 1 10 3925 1 1 8 ILE HA H -4.959 8.439 -4.319 1.00 . A A . 8 ILE HA 1 1 10 3926 1 1 8 ILE HB H -3.646 10.437 -3.880 1.00 . A A . 8 ILE HB 1 1 10 3927 1 1 8 ILE HD11 H -2.320 11.313 -5.676 1.00 . A A . 8 ILE HD11 1 1 10 3928 1 1 8 ILE HD12 H -0.860 10.770 -4.861 1.00 . A A . 8 ILE HD12 1 1 10 3929 1 1 8 ILE HD13 H -1.151 10.321 -6.532 1.00 . A A . 8 ILE HD13 1 1 10 3930 1 1 8 ILE HG12 H -1.634 8.426 -4.973 1.00 . A A . 8 ILE HG12 1 1 10 3931 1 1 8 ILE HG13 H -3.045 8.916 -5.888 1.00 . A A . 8 ILE HG13 1 1 10 3932 1 1 8 ILE HG21 H -2.634 9.429 -1.660 1.00 . A A . 8 ILE HG21 1 1 10 3933 1 1 8 ILE HG22 H -1.341 8.858 -2.700 1.00 . A A . 8 ILE HG22 1 1 10 3934 1 1 8 ILE HG23 H -1.683 10.573 -2.582 1.00 . A A . 8 ILE HG23 1 1 10 3935 1 1 8 ILE N N -4.840 8.579 -2.247 1.00 . A A . 8 ILE N 1 1 10 3936 1 1 8 ILE O O -2.645 6.718 -2.807 1.00 . A A . 8 ILE O 1 1 10 3937 1 1 9 PRO C C -1.997 4.791 -5.092 1.00 . A A . 9 PRO C 1 1 10 3938 1 1 9 PRO CA C -3.432 4.715 -4.558 1.00 . A A . 9 PRO CA 1 1 10 3939 1 1 9 PRO CB C -4.355 3.939 -5.497 1.00 . A A . 9 PRO CB 1 1 10 3940 1 1 9 PRO CD C -5.170 6.290 -5.363 1.00 . A A . 9 PRO CD 1 1 10 3941 1 1 9 PRO CG C -5.377 4.938 -6.066 1.00 . A A . 9 PRO CG 1 1 10 3942 1 1 9 PRO HA H -3.418 4.259 -3.584 1.00 . A A . 9 PRO HA 1 1 10 3943 1 1 9 PRO HB2 H -3.796 3.482 -6.302 1.00 . A A . 9 PRO HB2 1 1 10 3944 1 1 9 PRO HB3 H -4.864 3.162 -4.946 1.00 . A A . 9 PRO HB3 1 1 10 3945 1 1 9 PRO HD2 H -4.920 7.063 -6.076 1.00 . A A . 9 PRO HD2 1 1 10 3946 1 1 9 PRO HD3 H -6.047 6.570 -4.798 1.00 . A A . 9 PRO HD3 1 1 10 3947 1 1 9 PRO HG2 H -5.229 5.050 -7.130 1.00 . A A . 9 PRO HG2 1 1 10 3948 1 1 9 PRO HG3 H -6.381 4.580 -5.890 1.00 . A A . 9 PRO HG3 1 1 10 3949 1 1 9 PRO N N -4.021 6.078 -4.432 1.00 . A A . 9 PRO N 1 1 10 3950 1 1 9 PRO O O -1.686 5.635 -5.910 1.00 . A A . 9 PRO O 1 1 10 3951 1 1 10 CYS C C 0.342 3.545 -6.543 1.00 . A A . 10 CYS C 1 1 10 3952 1 1 10 CYS CA C 0.257 3.864 -5.044 1.00 . A A . 10 CYS CA 1 1 10 3953 1 1 10 CYS CB C 1.013 2.790 -4.251 1.00 . A A . 10 CYS CB 1 1 10 3954 1 1 10 CYS H H -1.495 3.249 -3.945 1.00 . A A . 10 CYS H 1 1 10 3955 1 1 10 CYS HA H 0.700 4.834 -4.865 1.00 . A A . 10 CYS HA 1 1 10 3956 1 1 10 CYS HB2 H 1.886 2.502 -4.817 1.00 . A A . 10 CYS HB2 1 1 10 3957 1 1 10 CYS HB3 H 1.368 3.241 -3.337 1.00 . A A . 10 CYS HB3 1 1 10 3958 1 1 10 CYS N N -1.172 3.898 -4.604 1.00 . A A . 10 CYS N 1 1 10 3959 1 1 10 CYS O O -0.535 2.903 -7.088 1.00 . A A . 10 CYS O 1 1 10 3960 1 1 10 CYS SG S 0.141 1.266 -3.807 1.00 . A A . 10 CYS SG 1 1 10 3961 1 1 11 ILE C C 2.795 2.809 -8.815 1.00 . A A . 11 ILE C 1 1 10 3962 1 1 11 ILE CA C 1.626 3.782 -8.614 1.00 . A A . 11 ILE CA 1 1 10 3963 1 1 11 ILE CB C 1.930 5.136 -9.287 1.00 . A A . 11 ILE CB 1 1 10 3964 1 1 11 ILE CD1 C -0.566 5.798 -9.254 1.00 . A A . 11 ILE CD1 1 1 10 3965 1 1 11 ILE CG1 C 0.877 6.228 -8.900 1.00 . A A . 11 ILE CG1 1 1 10 3966 1 1 11 ILE CG2 C 2.002 4.971 -10.827 1.00 . A A . 11 ILE CG2 1 1 10 3967 1 1 11 ILE H H 2.066 4.520 -6.640 1.00 . A A . 11 ILE H 1 1 10 3968 1 1 11 ILE HA H 0.746 3.370 -9.065 1.00 . A A . 11 ILE HA 1 1 10 3969 1 1 11 ILE HB H 2.892 5.447 -8.930 1.00 . A A . 11 ILE HB 1 1 10 3970 1 1 11 ILE HD11 H -0.623 5.444 -10.272 1.00 . A A . 11 ILE HD11 1 1 10 3971 1 1 11 ILE HD12 H -0.902 5.015 -8.592 1.00 . A A . 11 ILE HD12 1 1 10 3972 1 1 11 ILE HD13 H -1.230 6.643 -9.148 1.00 . A A . 11 ILE HD13 1 1 10 3973 1 1 11 ILE HG12 H 0.937 6.426 -7.840 1.00 . A A . 11 ILE HG12 1 1 10 3974 1 1 11 ILE HG13 H 1.107 7.146 -9.421 1.00 . A A . 11 ILE HG13 1 1 10 3975 1 1 11 ILE HG21 H 1.183 4.364 -11.185 1.00 . A A . 11 ILE HG21 1 1 10 3976 1 1 11 ILE HG22 H 1.957 5.935 -11.314 1.00 . A A . 11 ILE HG22 1 1 10 3977 1 1 11 ILE HG23 H 2.931 4.494 -11.102 1.00 . A A . 11 ILE HG23 1 1 10 3978 1 1 11 ILE N N 1.403 4.010 -7.152 1.00 . A A . 11 ILE N 1 1 10 3979 1 1 11 ILE O O 2.670 1.823 -9.516 1.00 . A A . 11 ILE O 1 1 10 3980 1 1 12 SER C C 4.902 0.960 -7.539 1.00 . A A . 12 SER C 1 1 10 3981 1 1 12 SER CA C 5.120 2.282 -8.282 1.00 . A A . 12 SER CA 1 1 10 3982 1 1 12 SER CB C 6.293 3.059 -7.669 1.00 . A A . 12 SER CB 1 1 10 3983 1 1 12 SER H H 3.931 3.933 -7.636 1.00 . A A . 12 SER H 1 1 10 3984 1 1 12 SER HA H 5.309 2.082 -9.323 1.00 . A A . 12 SER HA 1 1 10 3985 1 1 12 SER HB2 H 6.083 3.377 -6.659 1.00 . A A . 12 SER HB2 1 1 10 3986 1 1 12 SER HB3 H 7.205 2.486 -7.696 1.00 . A A . 12 SER HB3 1 1 10 3987 1 1 12 SER HG H 6.540 3.897 -9.409 1.00 . A A . 12 SER HG 1 1 10 3988 1 1 12 SER N N 3.898 3.126 -8.185 1.00 . A A . 12 SER N 1 1 10 3989 1 1 12 SER O O 5.008 -0.108 -8.113 1.00 . A A . 12 SER O 1 1 10 3990 1 1 12 SER OG O 6.429 4.200 -8.506 1.00 . A A . 12 SER OG 1 1 10 3991 1 1 13 ALA C C 3.118 -0.894 -5.844 1.00 . A A . 13 ALA C 1 1 10 3992 1 1 13 ALA CA C 4.352 -0.091 -5.397 1.00 . A A . 13 ALA CA 1 1 10 3993 1 1 13 ALA CB C 4.168 0.411 -3.957 1.00 . A A . 13 ALA CB 1 1 10 3994 1 1 13 ALA H H 4.534 1.987 -5.886 1.00 . A A . 13 ALA H 1 1 10 3995 1 1 13 ALA HA H 5.221 -0.726 -5.445 1.00 . A A . 13 ALA HA 1 1 10 3996 1 1 13 ALA HB1 H 3.509 1.266 -3.940 1.00 . A A . 13 ALA HB1 1 1 10 3997 1 1 13 ALA HB2 H 3.748 -0.364 -3.333 1.00 . A A . 13 ALA HB2 1 1 10 3998 1 1 13 ALA HB3 H 5.123 0.704 -3.547 1.00 . A A . 13 ALA HB3 1 1 10 3999 1 1 13 ALA N N 4.599 1.091 -6.272 1.00 . A A . 13 ALA N 1 1 10 4000 1 1 13 ALA O O 2.900 -1.991 -5.371 1.00 . A A . 13 ALA O 1 1 10 4001 1 1 14 ALA C C 1.473 -2.386 -7.857 1.00 . A A . 14 ALA C 1 1 10 4002 1 1 14 ALA CA C 1.121 -1.017 -7.253 1.00 . A A . 14 ALA CA 1 1 10 4003 1 1 14 ALA CB C 0.463 -0.130 -8.319 1.00 . A A . 14 ALA CB 1 1 10 4004 1 1 14 ALA H H 2.578 0.561 -7.086 1.00 . A A . 14 ALA H 1 1 10 4005 1 1 14 ALA HA H 0.438 -1.163 -6.428 1.00 . A A . 14 ALA HA 1 1 10 4006 1 1 14 ALA HB1 H 0.482 0.901 -8.004 1.00 . A A . 14 ALA HB1 1 1 10 4007 1 1 14 ALA HB2 H 0.988 -0.212 -9.259 1.00 . A A . 14 ALA HB2 1 1 10 4008 1 1 14 ALA HB3 H -0.564 -0.430 -8.467 1.00 . A A . 14 ALA HB3 1 1 10 4009 1 1 14 ALA N N 2.348 -0.328 -6.742 1.00 . A A . 14 ALA N 1 1 10 4010 1 1 14 ALA O O 0.828 -3.375 -7.568 1.00 . A A . 14 ALA O 1 1 10 4011 1 1 15 LEU C C 3.575 -4.613 -8.330 1.00 . A A . 15 LEU C 1 1 10 4012 1 1 15 LEU CA C 2.952 -3.642 -9.344 1.00 . A A . 15 LEU CA 1 1 10 4013 1 1 15 LEU CB C 3.975 -3.255 -10.425 1.00 . A A . 15 LEU CB 1 1 10 4014 1 1 15 LEU CD1 C 2.756 -4.026 -12.529 1.00 . A A . 15 LEU CD1 1 1 10 4015 1 1 15 LEU CD2 C 2.121 -1.799 -11.502 1.00 . A A . 15 LEU CD2 1 1 10 4016 1 1 15 LEU CG C 3.276 -2.803 -11.739 1.00 . A A . 15 LEU CG 1 1 10 4017 1 1 15 LEU H H 2.971 -1.563 -8.885 1.00 . A A . 15 LEU H 1 1 10 4018 1 1 15 LEU HA H 2.104 -4.107 -9.812 1.00 . A A . 15 LEU HA 1 1 10 4019 1 1 15 LEU HB2 H 4.595 -2.448 -10.062 1.00 . A A . 15 LEU HB2 1 1 10 4020 1 1 15 LEU HB3 H 4.617 -4.098 -10.639 1.00 . A A . 15 LEU HB3 1 1 10 4021 1 1 15 LEU HD11 H 3.549 -4.746 -12.668 1.00 . A A . 15 LEU HD11 1 1 10 4022 1 1 15 LEU HD12 H 1.941 -4.504 -12.005 1.00 . A A . 15 LEU HD12 1 1 10 4023 1 1 15 LEU HD13 H 2.403 -3.711 -13.500 1.00 . A A . 15 LEU HD13 1 1 10 4024 1 1 15 LEU HD21 H 2.465 -0.972 -10.898 1.00 . A A . 15 LEU HD21 1 1 10 4025 1 1 15 LEU HD22 H 1.782 -1.411 -12.452 1.00 . A A . 15 LEU HD22 1 1 10 4026 1 1 15 LEU HD23 H 1.286 -2.275 -11.009 1.00 . A A . 15 LEU HD23 1 1 10 4027 1 1 15 LEU HG H 4.023 -2.295 -12.317 1.00 . A A . 15 LEU HG 1 1 10 4028 1 1 15 LEU N N 2.492 -2.391 -8.682 1.00 . A A . 15 LEU N 1 1 10 4029 1 1 15 LEU O O 3.022 -5.663 -8.065 1.00 . A A . 15 LEU O 1 1 10 4030 1 1 16 GLY C C 4.538 -5.373 -5.598 1.00 . A A . 16 GLY C 1 1 10 4031 1 1 16 GLY CA C 5.436 -5.056 -6.796 1.00 . A A . 16 GLY CA 1 1 10 4032 1 1 16 GLY H H 5.087 -3.361 -8.066 1.00 . A A . 16 GLY H 1 1 10 4033 1 1 16 GLY HA2 H 5.748 -5.971 -7.271 1.00 . A A . 16 GLY HA2 1 1 10 4034 1 1 16 GLY HA3 H 6.306 -4.514 -6.454 1.00 . A A . 16 GLY HA3 1 1 10 4035 1 1 16 GLY N N 4.707 -4.221 -7.798 1.00 . A A . 16 GLY N 1 1 10 4036 1 1 16 GLY O O 4.113 -6.497 -5.414 1.00 . A A . 16 GLY O 1 1 10 4037 1 1 17 CYS C C 1.940 -4.533 -4.049 1.00 . A A . 17 CYS C 1 1 10 4038 1 1 17 CYS CA C 3.418 -4.494 -3.611 1.00 . A A . 17 CYS CA 1 1 10 4039 1 1 17 CYS CB C 3.698 -3.292 -2.692 1.00 . A A . 17 CYS CB 1 1 10 4040 1 1 17 CYS H H 4.663 -3.476 -5.038 1.00 . A A . 17 CYS H 1 1 10 4041 1 1 17 CYS HA H 3.660 -5.419 -3.108 1.00 . A A . 17 CYS HA 1 1 10 4042 1 1 17 CYS HB2 H 2.966 -2.517 -2.867 1.00 . A A . 17 CYS HB2 1 1 10 4043 1 1 17 CYS HB3 H 3.570 -3.623 -1.675 1.00 . A A . 17 CYS HB3 1 1 10 4044 1 1 17 CYS N N 4.282 -4.352 -4.822 1.00 . A A . 17 CYS N 1 1 10 4045 1 1 17 CYS O O 1.654 -4.568 -5.231 1.00 . A A . 17 CYS O 1 1 10 4046 1 1 17 CYS SG S 5.340 -2.535 -2.798 1.00 . A A . 17 CYS SG 1 1 10 4047 1 1 18 SER C C -1.215 -3.813 -2.332 1.00 . A A . 18 SER C 1 1 10 4048 1 1 18 SER CA C -0.419 -4.561 -3.408 1.00 . A A . 18 SER CA 1 1 10 4049 1 1 18 SER CB C -0.896 -6.020 -3.469 1.00 . A A . 18 SER CB 1 1 10 4050 1 1 18 SER H H 1.341 -4.499 -2.158 1.00 . A A . 18 SER H 1 1 10 4051 1 1 18 SER HA H -0.588 -4.076 -4.360 1.00 . A A . 18 SER HA 1 1 10 4052 1 1 18 SER HB2 H -0.546 -6.588 -2.621 1.00 . A A . 18 SER HB2 1 1 10 4053 1 1 18 SER HB3 H -1.972 -6.083 -3.541 1.00 . A A . 18 SER HB3 1 1 10 4054 1 1 18 SER HG H 0.641 -6.580 -4.523 1.00 . A A . 18 SER HG 1 1 10 4055 1 1 18 SER N N 1.046 -4.526 -3.091 1.00 . A A . 18 SER N 1 1 10 4056 1 1 18 SER O O -1.052 -4.063 -1.152 1.00 . A A . 18 SER O 1 1 10 4057 1 1 18 SER OG O -0.309 -6.535 -4.655 1.00 . A A . 18 SER OG 1 1 10 4058 1 1 19 CYS C C -4.016 -2.983 -1.224 1.00 . A A . 19 CYS C 1 1 10 4059 1 1 19 CYS CA C -2.891 -2.126 -1.816 1.00 . A A . 19 CYS CA 1 1 10 4060 1 1 19 CYS CB C -3.501 -0.917 -2.536 1.00 . A A . 19 CYS CB 1 1 10 4061 1 1 19 CYS H H -2.147 -2.766 -3.739 1.00 . A A . 19 CYS H 1 1 10 4062 1 1 19 CYS HA H -2.258 -1.774 -1.017 1.00 . A A . 19 CYS HA 1 1 10 4063 1 1 19 CYS HB2 H -2.694 -0.277 -2.862 1.00 . A A . 19 CYS HB2 1 1 10 4064 1 1 19 CYS HB3 H -4.028 -1.258 -3.415 1.00 . A A . 19 CYS HB3 1 1 10 4065 1 1 19 CYS N N -2.061 -2.916 -2.775 1.00 . A A . 19 CYS N 1 1 10 4066 1 1 19 CYS O O -4.805 -3.565 -1.944 1.00 . A A . 19 CYS O 1 1 10 4067 1 1 19 CYS SG S -4.641 0.092 -1.556 1.00 . A A . 19 CYS SG 1 1 10 4068 1 1 20 LYS C C -5.223 -3.199 2.227 1.00 . A A . 20 LYS C 1 1 10 4069 1 1 20 LYS CA C -5.066 -3.811 0.828 1.00 . A A . 20 LYS CA 1 1 10 4070 1 1 20 LYS CB C -4.599 -5.282 0.932 1.00 . A A . 20 LYS CB 1 1 10 4071 1 1 20 LYS CD C -5.479 -7.564 1.558 1.00 . A A . 20 LYS CD 1 1 10 4072 1 1 20 LYS CE C -6.748 -8.425 1.633 1.00 . A A . 20 LYS CE 1 1 10 4073 1 1 20 LYS CG C -5.833 -6.211 0.909 1.00 . A A . 20 LYS CG 1 1 10 4074 1 1 20 LYS H H -3.364 -2.531 0.589 1.00 . A A . 20 LYS H 1 1 10 4075 1 1 20 LYS HA H -6.009 -3.734 0.305 1.00 . A A . 20 LYS HA 1 1 10 4076 1 1 20 LYS HB2 H -3.961 -5.523 0.093 1.00 . A A . 20 LYS HB2 1 1 10 4077 1 1 20 LYS HB3 H -4.031 -5.429 1.840 1.00 . A A . 20 LYS HB3 1 1 10 4078 1 1 20 LYS HD2 H -4.730 -8.071 0.966 1.00 . A A . 20 LYS HD2 1 1 10 4079 1 1 20 LYS HD3 H -5.088 -7.409 2.553 1.00 . A A . 20 LYS HD3 1 1 10 4080 1 1 20 LYS HE2 H -7.487 -7.953 2.264 1.00 . A A . 20 LYS HE2 1 1 10 4081 1 1 20 LYS HE3 H -7.166 -8.565 0.646 1.00 . A A . 20 LYS HE3 1 1 10 4082 1 1 20 LYS HG2 H -6.652 -5.754 1.445 1.00 . A A . 20 LYS HG2 1 1 10 4083 1 1 20 LYS HG3 H -6.141 -6.372 -0.114 1.00 . A A . 20 LYS HG3 1 1 10 4084 1 1 20 LYS HZ1 H -5.563 -10.132 1.746 1.00 . A A . 20 LYS HZ1 1 1 10 4085 1 1 20 LYS HZ2 H -6.258 -9.672 3.226 1.00 . A A . 20 LYS HZ2 1 1 10 4086 1 1 20 LYS HZ3 H -7.213 -10.415 2.033 1.00 . A A . 20 LYS HZ3 1 1 10 4087 1 1 20 LYS N N -4.038 -3.026 0.083 1.00 . A A . 20 LYS N 1 1 10 4088 1 1 20 LYS NZ N -6.421 -9.762 2.203 1.00 . A A . 20 LYS NZ 1 1 10 4089 1 1 20 LYS O O -4.243 -2.858 2.861 1.00 . A A . 20 LYS O 1 1 10 4090 1 1 21 ASN C C -6.071 -1.152 4.206 1.00 . A A . 21 ASN C 1 1 10 4091 1 1 21 ASN CA C -6.784 -2.503 4.001 1.00 . A A . 21 ASN CA 1 1 10 4092 1 1 21 ASN CB C -6.358 -3.525 5.096 1.00 . A A . 21 ASN CB 1 1 10 4093 1 1 21 ASN CG C -7.086 -4.855 4.867 1.00 . A A . 21 ASN CG 1 1 10 4094 1 1 21 ASN H H -7.189 -3.382 2.078 1.00 . A A . 21 ASN H 1 1 10 4095 1 1 21 ASN HA H -7.850 -2.337 4.051 1.00 . A A . 21 ASN HA 1 1 10 4096 1 1 21 ASN HB2 H -5.293 -3.702 5.065 1.00 . A A . 21 ASN HB2 1 1 10 4097 1 1 21 ASN HB3 H -6.620 -3.151 6.075 1.00 . A A . 21 ASN HB3 1 1 10 4098 1 1 21 ASN HD21 H -5.807 -5.458 3.474 1.00 . A A . 21 ASN HD21 1 1 10 4099 1 1 21 ASN HD22 H -7.065 -6.544 3.822 1.00 . A A . 21 ASN HD22 1 1 10 4100 1 1 21 ASN N N -6.457 -3.082 2.655 1.00 . A A . 21 ASN N 1 1 10 4101 1 1 21 ASN ND2 N -6.614 -5.689 3.981 1.00 . A A . 21 ASN ND2 1 1 10 4102 1 1 21 ASN O O -5.257 -0.995 5.096 1.00 . A A . 21 ASN O 1 1 10 4103 1 1 21 ASN OD1 O -8.088 -5.149 5.490 1.00 . A A . 21 ASN OD1 1 1 10 4104 1 1 22 LYS C C -4.357 1.253 3.675 1.00 . A A . 22 LYS C 1 1 10 4105 1 1 22 LYS CA C -5.863 1.169 3.344 1.00 . A A . 22 LYS CA 1 1 10 4106 1 1 22 LYS CB C -6.697 2.039 4.351 1.00 . A A . 22 LYS CB 1 1 10 4107 1 1 22 LYS CD C -7.356 2.487 6.737 1.00 . A A . 22 LYS CD 1 1 10 4108 1 1 22 LYS CE C -7.397 1.906 8.159 1.00 . A A . 22 LYS CE 1 1 10 4109 1 1 22 LYS CG C -6.709 1.461 5.786 1.00 . A A . 22 LYS CG 1 1 10 4110 1 1 22 LYS H H -7.090 -0.457 2.666 1.00 . A A . 22 LYS H 1 1 10 4111 1 1 22 LYS HA H -6.002 1.575 2.353 1.00 . A A . 22 LYS HA 1 1 10 4112 1 1 22 LYS HB2 H -6.280 3.035 4.374 1.00 . A A . 22 LYS HB2 1 1 10 4113 1 1 22 LYS HB3 H -7.712 2.114 3.987 1.00 . A A . 22 LYS HB3 1 1 10 4114 1 1 22 LYS HD2 H -6.780 3.402 6.737 1.00 . A A . 22 LYS HD2 1 1 10 4115 1 1 22 LYS HD3 H -8.362 2.710 6.410 1.00 . A A . 22 LYS HD3 1 1 10 4116 1 1 22 LYS HE2 H -7.939 0.971 8.171 1.00 . A A . 22 LYS HE2 1 1 10 4117 1 1 22 LYS HE3 H -6.395 1.738 8.528 1.00 . A A . 22 LYS HE3 1 1 10 4118 1 1 22 LYS HG2 H -7.283 0.546 5.809 1.00 . A A . 22 LYS HG2 1 1 10 4119 1 1 22 LYS HG3 H -5.702 1.254 6.115 1.00 . A A . 22 LYS HG3 1 1 10 4120 1 1 22 LYS HZ1 H -7.732 3.824 8.893 1.00 . A A . 22 LYS HZ1 1 1 10 4121 1 1 22 LYS HZ2 H -9.109 2.829 8.897 1.00 . A A . 22 LYS HZ2 1 1 10 4122 1 1 22 LYS HZ3 H -7.891 2.599 10.059 1.00 . A A . 22 LYS HZ3 1 1 10 4123 1 1 22 LYS N N -6.423 -0.225 3.345 1.00 . A A . 22 LYS N 1 1 10 4124 1 1 22 LYS NZ N -8.084 2.862 9.072 1.00 . A A . 22 LYS NZ 1 1 10 4125 1 1 22 LYS O O -3.918 2.077 4.455 1.00 . A A . 22 LYS O 1 1 10 4126 1 1 23 VAL C C -1.551 -0.269 1.920 1.00 . A A . 23 VAL C 1 1 10 4127 1 1 23 VAL CA C -2.145 0.279 3.229 1.00 . A A . 23 VAL CA 1 1 10 4128 1 1 23 VAL CB C -1.886 -0.649 4.468 1.00 . A A . 23 VAL CB 1 1 10 4129 1 1 23 VAL CG1 C -1.164 -1.973 4.118 1.00 . A A . 23 VAL CG1 1 1 10 4130 1 1 23 VAL CG2 C -1.061 0.133 5.504 1.00 . A A . 23 VAL CG2 1 1 10 4131 1 1 23 VAL H H -4.038 -0.275 2.452 1.00 . A A . 23 VAL H 1 1 10 4132 1 1 23 VAL HA H -1.768 1.272 3.383 1.00 . A A . 23 VAL HA 1 1 10 4133 1 1 23 VAL HB H -2.837 -0.901 4.910 1.00 . A A . 23 VAL HB 1 1 10 4134 1 1 23 VAL HG11 H -0.269 -1.774 3.551 1.00 . A A . 23 VAL HG11 1 1 10 4135 1 1 23 VAL HG12 H -0.896 -2.502 5.020 1.00 . A A . 23 VAL HG12 1 1 10 4136 1 1 23 VAL HG13 H -1.812 -2.608 3.533 1.00 . A A . 23 VAL HG13 1 1 10 4137 1 1 23 VAL HG21 H -0.172 0.533 5.040 1.00 . A A . 23 VAL HG21 1 1 10 4138 1 1 23 VAL HG22 H -1.646 0.951 5.895 1.00 . A A . 23 VAL HG22 1 1 10 4139 1 1 23 VAL HG23 H -0.773 -0.508 6.325 1.00 . A A . 23 VAL HG23 1 1 10 4140 1 1 23 VAL N N -3.620 0.365 3.054 1.00 . A A . 23 VAL N 1 1 10 4141 1 1 23 VAL O O -2.099 -1.203 1.369 1.00 . A A . 23 VAL O 1 1 10 4142 1 1 24 CYS C C 1.408 -1.014 0.490 1.00 . A A . 24 CYS C 1 1 10 4143 1 1 24 CYS CA C 0.150 -0.196 0.178 1.00 . A A . 24 CYS CA 1 1 10 4144 1 1 24 CYS CB C 0.534 0.988 -0.747 1.00 . A A . 24 CYS CB 1 1 10 4145 1 1 24 CYS H H -0.054 1.056 1.934 1.00 . A A . 24 CYS H 1 1 10 4146 1 1 24 CYS HA H -0.545 -0.832 -0.347 1.00 . A A . 24 CYS HA 1 1 10 4147 1 1 24 CYS HB2 H -0.349 1.575 -0.956 1.00 . A A . 24 CYS HB2 1 1 10 4148 1 1 24 CYS HB3 H 1.245 1.622 -0.239 1.00 . A A . 24 CYS HB3 1 1 10 4149 1 1 24 CYS N N -0.466 0.305 1.452 1.00 . A A . 24 CYS N 1 1 10 4150 1 1 24 CYS O O 2.509 -0.626 0.148 1.00 . A A . 24 CYS O 1 1 10 4151 1 1 24 CYS SG S 1.278 0.498 -2.324 1.00 . A A . 24 CYS SG 1 1 10 4152 1 1 25 TYR C C 2.311 -4.262 0.609 1.00 . A A . 25 TYR C 1 1 10 4153 1 1 25 TYR CA C 2.331 -3.035 1.513 1.00 . A A . 25 TYR CA 1 1 10 4154 1 1 25 TYR CB C 2.183 -3.483 2.974 1.00 . A A . 25 TYR CB 1 1 10 4155 1 1 25 TYR CD1 C 2.624 -1.021 3.617 1.00 . A A . 25 TYR CD1 1 1 10 4156 1 1 25 TYR CD2 C 1.815 -2.522 5.274 1.00 . A A . 25 TYR CD2 1 1 10 4157 1 1 25 TYR CE1 C 2.633 -0.005 4.544 1.00 . A A . 25 TYR CE1 1 1 10 4158 1 1 25 TYR CE2 C 1.824 -1.501 6.200 1.00 . A A . 25 TYR CE2 1 1 10 4159 1 1 25 TYR CG C 2.213 -2.300 3.970 1.00 . A A . 25 TYR CG 1 1 10 4160 1 1 25 TYR CZ C 2.233 -0.233 5.842 1.00 . A A . 25 TYR CZ 1 1 10 4161 1 1 25 TYR H H 0.294 -2.394 1.393 1.00 . A A . 25 TYR H 1 1 10 4162 1 1 25 TYR HA H 3.274 -2.532 1.390 1.00 . A A . 25 TYR HA 1 1 10 4163 1 1 25 TYR HB2 H 1.275 -4.053 3.113 1.00 . A A . 25 TYR HB2 1 1 10 4164 1 1 25 TYR HB3 H 3.004 -4.134 3.207 1.00 . A A . 25 TYR HB3 1 1 10 4165 1 1 25 TYR HD1 H 2.947 -0.803 2.612 1.00 . A A . 25 TYR HD1 1 1 10 4166 1 1 25 TYR HD2 H 1.491 -3.507 5.574 1.00 . A A . 25 TYR HD2 1 1 10 4167 1 1 25 TYR HE1 H 2.960 0.977 4.245 1.00 . A A . 25 TYR HE1 1 1 10 4168 1 1 25 TYR HE2 H 1.506 -1.703 7.212 1.00 . A A . 25 TYR HE2 1 1 10 4169 1 1 25 TYR HH H 2.862 0.566 7.458 1.00 . A A . 25 TYR HH 1 1 10 4170 1 1 25 TYR N N 1.201 -2.132 1.140 1.00 . A A . 25 TYR N 1 1 10 4171 1 1 25 TYR O O 1.338 -4.515 -0.073 1.00 . A A . 25 TYR O 1 1 10 4172 1 1 25 TYR OH O 2.239 0.793 6.764 1.00 . A A . 25 TYR OH 1 1 10 4173 1 1 26 ARG C C 2.954 -7.412 0.611 1.00 . A A . 26 ARG C 1 1 10 4174 1 1 26 ARG CA C 3.490 -6.227 -0.209 1.00 . A A . 26 ARG CA 1 1 10 4175 1 1 26 ARG CB C 4.975 -6.438 -0.605 1.00 . A A . 26 ARG CB 1 1 10 4176 1 1 26 ARG CD C 7.167 -7.231 0.390 1.00 . A A . 26 ARG CD 1 1 10 4177 1 1 26 ARG CG C 5.897 -6.384 0.644 1.00 . A A . 26 ARG CG 1 1 10 4178 1 1 26 ARG CZ C 6.931 -8.875 2.200 1.00 . A A . 26 ARG CZ 1 1 10 4179 1 1 26 ARG H H 4.144 -4.734 1.208 1.00 . A A . 26 ARG H 1 1 10 4180 1 1 26 ARG HA H 2.872 -6.113 -1.087 1.00 . A A . 26 ARG HA 1 1 10 4181 1 1 26 ARG HB2 H 5.073 -7.387 -1.112 1.00 . A A . 26 ARG HB2 1 1 10 4182 1 1 26 ARG HB3 H 5.269 -5.660 -1.294 1.00 . A A . 26 ARG HB3 1 1 10 4183 1 1 26 ARG HD2 H 6.998 -8.002 -0.347 1.00 . A A . 26 ARG HD2 1 1 10 4184 1 1 26 ARG HD3 H 7.968 -6.592 0.046 1.00 . A A . 26 ARG HD3 1 1 10 4185 1 1 26 ARG HE H 8.396 -7.543 2.128 1.00 . A A . 26 ARG HE 1 1 10 4186 1 1 26 ARG HG2 H 6.186 -5.358 0.821 1.00 . A A . 26 ARG HG2 1 1 10 4187 1 1 26 ARG HG3 H 5.377 -6.744 1.519 1.00 . A A . 26 ARG HG3 1 1 10 4188 1 1 26 ARG HH11 H 5.534 -8.935 0.766 1.00 . A A . 26 ARG HH11 1 1 10 4189 1 1 26 ARG HH12 H 5.357 -10.102 2.033 1.00 . A A . 26 ARG HH12 1 1 10 4190 1 1 26 ARG HH21 H 8.198 -9.015 3.744 1.00 . A A . 26 ARG HH21 1 1 10 4191 1 1 26 ARG HH22 H 6.887 -10.148 3.743 1.00 . A A . 26 ARG HH22 1 1 10 4192 1 1 26 ARG N N 3.394 -4.994 0.633 1.00 . A A . 26 ARG N 1 1 10 4193 1 1 26 ARG NE N 7.595 -7.875 1.672 1.00 . A A . 26 ARG NE 1 1 10 4194 1 1 26 ARG NH1 N 5.857 -9.340 1.621 1.00 . A A . 26 ARG NH1 1 1 10 4195 1 1 26 ARG NH2 N 7.373 -9.385 3.316 1.00 . A A . 26 ARG NH2 1 1 10 4196 1 1 26 ARG O O 3.420 -8.530 0.503 1.00 . A A . 26 ARG O 1 1 10 4197 1 1 27 ASN C C 2.318 -8.859 3.131 1.00 . A A . 27 ASN C 1 1 10 4198 1 1 27 ASN CA C 1.284 -8.076 2.306 1.00 . A A . 27 ASN CA 1 1 10 4199 1 1 27 ASN CB C 0.427 -9.017 1.416 1.00 . A A . 27 ASN CB 1 1 10 4200 1 1 27 ASN CG C -0.606 -8.168 0.660 1.00 . A A . 27 ASN CG 1 1 10 4201 1 1 27 ASN H H 1.655 -6.164 1.419 1.00 . A A . 27 ASN H 1 1 10 4202 1 1 27 ASN HA H 0.647 -7.531 2.987 1.00 . A A . 27 ASN HA 1 1 10 4203 1 1 27 ASN HB2 H 1.043 -9.539 0.698 1.00 . A A . 27 ASN HB2 1 1 10 4204 1 1 27 ASN HB3 H -0.093 -9.742 2.025 1.00 . A A . 27 ASN HB3 1 1 10 4205 1 1 27 ASN HD21 H -2.095 -8.634 1.890 1.00 . A A . 27 ASN HD21 1 1 10 4206 1 1 27 ASN HD22 H -2.504 -7.587 0.619 1.00 . A A . 27 ASN HD22 1 1 10 4207 1 1 27 ASN N N 1.964 -7.092 1.411 1.00 . A A . 27 ASN N 1 1 10 4208 1 1 27 ASN ND2 N -1.837 -8.126 1.092 1.00 . A A . 27 ASN ND2 1 1 10 4209 1 1 27 ASN O O 2.310 -10.075 3.176 1.00 . A A . 27 ASN O 1 1 10 4210 1 1 27 ASN OD1 O -0.301 -7.533 -0.331 1.00 . A A . 27 ASN OD1 1 1 10 4211 1 1 28 GLY C C 5.257 -7.709 5.152 1.00 . A A . 28 GLY C 1 1 10 4212 1 1 28 GLY CA C 4.249 -8.726 4.603 1.00 . A A . 28 GLY CA 1 1 10 4213 1 1 28 GLY H H 3.142 -7.133 3.688 1.00 . A A . 28 GLY H 1 1 10 4214 1 1 28 GLY HA2 H 3.774 -9.227 5.431 1.00 . A A . 28 GLY HA2 1 1 10 4215 1 1 28 GLY HA3 H 4.777 -9.447 4.003 1.00 . A A . 28 GLY HA3 1 1 10 4216 1 1 28 GLY N N 3.187 -8.107 3.763 1.00 . A A . 28 GLY N 1 1 10 4217 1 1 28 GLY O O 5.809 -7.921 6.215 1.00 . A A . 28 GLY O 1 1 10 4218 1 1 29 ILE C C 5.991 -4.216 4.336 1.00 . A A . 29 ILE C 1 1 10 4219 1 1 29 ILE CA C 6.441 -5.590 4.877 1.00 . A A . 29 ILE CA 1 1 10 4220 1 1 29 ILE CB C 7.861 -6.009 4.356 1.00 . A A . 29 ILE CB 1 1 10 4221 1 1 29 ILE CD1 C 9.944 -7.154 5.214 1.00 . A A . 29 ILE CD1 1 1 10 4222 1 1 29 ILE CG1 C 8.869 -6.101 5.535 1.00 . A A . 29 ILE CG1 1 1 10 4223 1 1 29 ILE CG2 C 8.434 -5.066 3.261 1.00 . A A . 29 ILE CG2 1 1 10 4224 1 1 29 ILE H H 5.005 -6.519 3.575 1.00 . A A . 29 ILE H 1 1 10 4225 1 1 29 ILE HA H 6.427 -5.571 5.953 1.00 . A A . 29 ILE HA 1 1 10 4226 1 1 29 ILE HB H 7.744 -6.990 3.933 1.00 . A A . 29 ILE HB 1 1 10 4227 1 1 29 ILE HD11 H 10.465 -6.896 4.303 1.00 . A A . 29 ILE HD11 1 1 10 4228 1 1 29 ILE HD12 H 10.661 -7.204 6.020 1.00 . A A . 29 ILE HD12 1 1 10 4229 1 1 29 ILE HD13 H 9.489 -8.126 5.093 1.00 . A A . 29 ILE HD13 1 1 10 4230 1 1 29 ILE HG12 H 9.344 -5.144 5.695 1.00 . A A . 29 ILE HG12 1 1 10 4231 1 1 29 ILE HG13 H 8.365 -6.387 6.447 1.00 . A A . 29 ILE HG13 1 1 10 4232 1 1 29 ILE HG21 H 7.748 -4.992 2.431 1.00 . A A . 29 ILE HG21 1 1 10 4233 1 1 29 ILE HG22 H 8.606 -4.078 3.663 1.00 . A A . 29 ILE HG22 1 1 10 4234 1 1 29 ILE HG23 H 9.372 -5.456 2.893 1.00 . A A . 29 ILE HG23 1 1 10 4235 1 1 29 ILE N N 5.474 -6.640 4.425 1.00 . A A . 29 ILE N 1 1 10 4236 1 1 29 ILE O O 5.436 -4.151 3.256 1.00 . A A . 29 ILE O 1 1 10 4237 1 1 30 PRO C C 6.540 -1.308 3.438 1.00 . A A . 30 PRO C 1 1 10 4238 1 1 30 PRO CA C 5.803 -1.793 4.693 1.00 . A A . 30 PRO CA 1 1 10 4239 1 1 30 PRO CB C 6.076 -0.902 5.905 1.00 . A A . 30 PRO CB 1 1 10 4240 1 1 30 PRO CD C 6.961 -3.174 6.393 1.00 . A A . 30 PRO CD 1 1 10 4241 1 1 30 PRO CG C 6.961 -1.712 6.866 1.00 . A A . 30 PRO CG 1 1 10 4242 1 1 30 PRO HA H 4.747 -1.823 4.495 1.00 . A A . 30 PRO HA 1 1 10 4243 1 1 30 PRO HB2 H 6.579 0.009 5.615 1.00 . A A . 30 PRO HB2 1 1 10 4244 1 1 30 PRO HB3 H 5.143 -0.644 6.384 1.00 . A A . 30 PRO HB3 1 1 10 4245 1 1 30 PRO HD2 H 7.968 -3.535 6.247 1.00 . A A . 30 PRO HD2 1 1 10 4246 1 1 30 PRO HD3 H 6.434 -3.802 7.096 1.00 . A A . 30 PRO HD3 1 1 10 4247 1 1 30 PRO HG2 H 7.969 -1.323 6.858 1.00 . A A . 30 PRO HG2 1 1 10 4248 1 1 30 PRO HG3 H 6.571 -1.650 7.872 1.00 . A A . 30 PRO HG3 1 1 10 4249 1 1 30 PRO N N 6.237 -3.161 5.085 1.00 . A A . 30 PRO N 1 1 10 4250 1 1 30 PRO O O 7.723 -1.028 3.479 1.00 . A A . 30 PRO O 1 1 11 4251 1 1 1 CYS C C 6.292 0.724 0.962 1.00 . A A . 1 CYS C 1 1 11 4252 1 1 1 CYS CA C 6.387 -0.801 1.035 1.00 . A A . 1 CYS CA 1 1 11 4253 1 1 1 CYS CB C 5.542 -1.450 -0.056 1.00 . A A . 1 CYS CB 1 1 11 4254 1 1 1 CYS HA H 7.421 -1.108 0.956 1.00 . A A . 1 CYS HA 1 1 11 4255 1 1 1 CYS HB2 H 4.627 -1.773 0.400 1.00 . A A . 1 CYS HB2 1 1 11 4256 1 1 1 CYS HB3 H 5.281 -0.702 -0.791 1.00 . A A . 1 CYS HB3 1 1 11 4257 1 1 1 CYS N N 5.840 -1.207 2.365 1.00 . A A . 1 CYS N 1 1 11 4258 1 1 1 CYS O O 7.242 1.386 0.594 1.00 . A A . 1 CYS O 1 1 11 4259 1 1 1 CYS SG S 6.191 -2.873 -0.964 1.00 . A A . 1 CYS SG 1 1 11 4260 1 1 2 GLY C C 3.944 3.036 2.457 1.00 . A A . 2 GLY C 1 1 11 4261 1 1 2 GLY CA C 4.886 2.681 1.309 1.00 . A A . 2 GLY CA 1 1 11 4262 1 1 2 GLY H H 4.401 0.629 1.608 1.00 . A A . 2 GLY H 1 1 11 4263 1 1 2 GLY HA2 H 5.817 3.211 1.442 1.00 . A A . 2 GLY HA2 1 1 11 4264 1 1 2 GLY HA3 H 4.435 2.959 0.367 1.00 . A A . 2 GLY HA3 1 1 11 4265 1 1 2 GLY N N 5.132 1.218 1.323 1.00 . A A . 2 GLY N 1 1 11 4266 1 1 2 GLY O O 4.390 3.315 3.554 1.00 . A A . 2 GLY O 1 1 11 4267 1 1 3 GLU C C 0.205 3.381 2.450 1.00 . A A . 3 GLU C 1 1 11 4268 1 1 3 GLU CA C 1.583 3.321 3.136 1.00 . A A . 3 GLU CA 1 1 11 4269 1 1 3 GLU CB C 1.848 4.696 3.802 1.00 . A A . 3 GLU CB 1 1 11 4270 1 1 3 GLU CD C 0.848 5.882 5.786 1.00 . A A . 3 GLU CD 1 1 11 4271 1 1 3 GLU CG C 1.575 4.609 5.324 1.00 . A A . 3 GLU CG 1 1 11 4272 1 1 3 GLU H H 2.431 2.734 1.242 1.00 . A A . 3 GLU H 1 1 11 4273 1 1 3 GLU HA H 1.555 2.530 3.867 1.00 . A A . 3 GLU HA 1 1 11 4274 1 1 3 GLU HB2 H 2.862 5.001 3.633 1.00 . A A . 3 GLU HB2 1 1 11 4275 1 1 3 GLU HB3 H 1.218 5.439 3.337 1.00 . A A . 3 GLU HB3 1 1 11 4276 1 1 3 GLU HG2 H 0.964 3.750 5.564 1.00 . A A . 3 GLU HG2 1 1 11 4277 1 1 3 GLU HG3 H 2.509 4.521 5.860 1.00 . A A . 3 GLU HG3 1 1 11 4278 1 1 3 GLU N N 2.670 2.999 2.150 1.00 . A A . 3 GLU N 1 1 11 4279 1 1 3 GLU O O 0.052 2.973 1.318 1.00 . A A . 3 GLU O 1 1 11 4280 1 1 3 GLU OE1 O 1.549 6.849 6.039 1.00 . A A . 3 GLU OE1 1 1 11 4281 1 1 3 GLU OE2 O -0.367 5.815 5.858 1.00 . A A . 3 GLU OE2 1 1 11 4282 1 1 4 SER C C -2.326 4.487 1.217 1.00 . A A . 4 SER C 1 1 11 4283 1 1 4 SER CA C -2.155 4.038 2.666 1.00 . A A . 4 SER CA 1 1 11 4284 1 1 4 SER CB C -2.916 5.018 3.567 1.00 . A A . 4 SER CB 1 1 11 4285 1 1 4 SER H H -0.557 4.224 4.076 1.00 . A A . 4 SER H 1 1 11 4286 1 1 4 SER HA H -2.612 3.070 2.747 1.00 . A A . 4 SER HA 1 1 11 4287 1 1 4 SER HB2 H -3.871 5.282 3.143 1.00 . A A . 4 SER HB2 1 1 11 4288 1 1 4 SER HB3 H -3.061 4.599 4.546 1.00 . A A . 4 SER HB3 1 1 11 4289 1 1 4 SER HG H -1.198 5.904 3.819 1.00 . A A . 4 SER HG 1 1 11 4290 1 1 4 SER N N -0.755 3.905 3.172 1.00 . A A . 4 SER N 1 1 11 4291 1 1 4 SER O O -1.562 5.263 0.676 1.00 . A A . 4 SER O 1 1 11 4292 1 1 4 SER OG O -2.099 6.179 3.640 1.00 . A A . 4 SER OG 1 1 11 4293 1 1 5 CYS C C -5.246 4.667 -0.772 1.00 . A A . 5 CYS C 1 1 11 4294 1 1 5 CYS CA C -3.789 4.189 -0.733 1.00 . A A . 5 CYS CA 1 1 11 4295 1 1 5 CYS CB C -3.586 2.870 -1.502 1.00 . A A . 5 CYS CB 1 1 11 4296 1 1 5 CYS H H -3.907 3.328 1.217 1.00 . A A . 5 CYS H 1 1 11 4297 1 1 5 CYS HA H -3.179 4.979 -1.119 1.00 . A A . 5 CYS HA 1 1 11 4298 1 1 5 CYS HB2 H -4.320 2.803 -2.287 1.00 . A A . 5 CYS HB2 1 1 11 4299 1 1 5 CYS HB3 H -2.620 2.904 -1.976 1.00 . A A . 5 CYS HB3 1 1 11 4300 1 1 5 CYS N N -3.375 3.936 0.671 1.00 . A A . 5 CYS N 1 1 11 4301 1 1 5 CYS O O -5.969 4.451 -1.726 1.00 . A A . 5 CYS O 1 1 11 4302 1 1 5 CYS SG S -3.689 1.338 -0.541 1.00 . A A . 5 CYS SG 1 1 11 4303 1 1 6 VAL C C -7.104 7.159 -0.369 1.00 . A A . 6 VAL C 1 1 11 4304 1 1 6 VAL CA C -7.001 5.861 0.442 1.00 . A A . 6 VAL CA 1 1 11 4305 1 1 6 VAL CB C -7.280 6.127 1.949 1.00 . A A . 6 VAL CB 1 1 11 4306 1 1 6 VAL CG1 C -8.719 6.666 2.136 1.00 . A A . 6 VAL CG1 1 1 11 4307 1 1 6 VAL CG2 C -7.136 4.811 2.737 1.00 . A A . 6 VAL CG2 1 1 11 4308 1 1 6 VAL H H -4.961 5.453 1.015 1.00 . A A . 6 VAL H 1 1 11 4309 1 1 6 VAL HA H -7.705 5.137 0.060 1.00 . A A . 6 VAL HA 1 1 11 4310 1 1 6 VAL HB H -6.573 6.847 2.336 1.00 . A A . 6 VAL HB 1 1 11 4311 1 1 6 VAL HG11 H -9.436 6.000 1.677 1.00 . A A . 6 VAL HG11 1 1 11 4312 1 1 6 VAL HG12 H -8.950 6.752 3.188 1.00 . A A . 6 VAL HG12 1 1 11 4313 1 1 6 VAL HG13 H -8.813 7.642 1.684 1.00 . A A . 6 VAL HG13 1 1 11 4314 1 1 6 VAL HG21 H -7.807 4.060 2.346 1.00 . A A . 6 VAL HG21 1 1 11 4315 1 1 6 VAL HG22 H -6.123 4.444 2.664 1.00 . A A . 6 VAL HG22 1 1 11 4316 1 1 6 VAL HG23 H -7.367 4.974 3.780 1.00 . A A . 6 VAL HG23 1 1 11 4317 1 1 6 VAL N N -5.616 5.320 0.299 1.00 . A A . 6 VAL N 1 1 11 4318 1 1 6 VAL O O -7.827 7.233 -1.345 1.00 . A A . 6 VAL O 1 1 11 4319 1 1 7 TRP C C -5.403 9.473 -1.796 1.00 . A A . 7 TRP C 1 1 11 4320 1 1 7 TRP CA C -6.335 9.472 -0.580 1.00 . A A . 7 TRP CA 1 1 11 4321 1 1 7 TRP CB C -5.860 10.503 0.449 1.00 . A A . 7 TRP CB 1 1 11 4322 1 1 7 TRP CD1 C -5.783 12.804 -0.725 1.00 . A A . 7 TRP CD1 1 1 11 4323 1 1 7 TRP CD2 C -7.592 12.412 0.492 1.00 . A A . 7 TRP CD2 1 1 11 4324 1 1 7 TRP CE2 C -7.723 13.686 -0.060 1.00 . A A . 7 TRP CE2 1 1 11 4325 1 1 7 TRP CE3 C -8.598 11.902 1.312 1.00 . A A . 7 TRP CE3 1 1 11 4326 1 1 7 TRP CG C -6.404 11.888 0.078 1.00 . A A . 7 TRP CG 1 1 11 4327 1 1 7 TRP CH2 C -9.862 13.938 1.026 1.00 . A A . 7 TRP CH2 1 1 11 4328 1 1 7 TRP CZ2 C -8.858 14.449 0.207 1.00 . A A . 7 TRP CZ2 1 1 11 4329 1 1 7 TRP CZ3 C -9.732 12.665 1.578 1.00 . A A . 7 TRP CZ3 1 1 11 4330 1 1 7 TRP H H -5.807 8.005 0.867 1.00 . A A . 7 TRP H 1 1 11 4331 1 1 7 TRP HA H -7.337 9.702 -0.899 1.00 . A A . 7 TRP HA 1 1 11 4332 1 1 7 TRP HB2 H -6.215 10.234 1.431 1.00 . A A . 7 TRP HB2 1 1 11 4333 1 1 7 TRP HB3 H -4.780 10.538 0.477 1.00 . A A . 7 TRP HB3 1 1 11 4334 1 1 7 TRP HD1 H -4.828 12.716 -1.221 1.00 . A A . 7 TRP HD1 1 1 11 4335 1 1 7 TRP HE1 H -6.418 14.632 -1.265 1.00 . A A . 7 TRP HE1 1 1 11 4336 1 1 7 TRP HE3 H -8.500 10.915 1.740 1.00 . A A . 7 TRP HE3 1 1 11 4337 1 1 7 TRP HH2 H -10.742 14.529 1.233 1.00 . A A . 7 TRP HH2 1 1 11 4338 1 1 7 TRP HZ2 H -8.959 15.435 -0.222 1.00 . A A . 7 TRP HZ2 1 1 11 4339 1 1 7 TRP HZ3 H -10.512 12.269 2.212 1.00 . A A . 7 TRP HZ3 1 1 11 4340 1 1 7 TRP N N -6.362 8.140 0.077 1.00 . A A . 7 TRP N 1 1 11 4341 1 1 7 TRP NE1 N -6.613 13.819 -0.754 1.00 . A A . 7 TRP NE1 1 1 11 4342 1 1 7 TRP O O -5.722 10.038 -2.823 1.00 . A A . 7 TRP O 1 1 11 4343 1 1 8 ILE C C -2.854 7.249 -2.916 1.00 . A A . 8 ILE C 1 1 11 4344 1 1 8 ILE CA C -3.243 8.726 -2.682 1.00 . A A . 8 ILE CA 1 1 11 4345 1 1 8 ILE CB C -2.005 9.566 -2.247 1.00 . A A . 8 ILE CB 1 1 11 4346 1 1 8 ILE CD1 C -0.296 9.820 -0.385 1.00 . A A . 8 ILE CD1 1 1 11 4347 1 1 8 ILE CG1 C -1.757 9.457 -0.707 1.00 . A A . 8 ILE CG1 1 1 11 4348 1 1 8 ILE CG2 C -2.237 11.043 -2.635 1.00 . A A . 8 ILE CG2 1 1 11 4349 1 1 8 ILE H H -4.087 8.401 -0.766 1.00 . A A . 8 ILE H 1 1 11 4350 1 1 8 ILE HA H -3.647 9.133 -3.589 1.00 . A A . 8 ILE HA 1 1 11 4351 1 1 8 ILE HB H -1.143 9.191 -2.772 1.00 . A A . 8 ILE HB 1 1 11 4352 1 1 8 ILE HD11 H 0.380 9.195 -0.949 1.00 . A A . 8 ILE HD11 1 1 11 4353 1 1 8 ILE HD12 H -0.102 10.854 -0.628 1.00 . A A . 8 ILE HD12 1 1 11 4354 1 1 8 ILE HD13 H -0.107 9.673 0.668 1.00 . A A . 8 ILE HD13 1 1 11 4355 1 1 8 ILE HG12 H -2.418 10.128 -0.174 1.00 . A A . 8 ILE HG12 1 1 11 4356 1 1 8 ILE HG13 H -1.950 8.452 -0.366 1.00 . A A . 8 ILE HG13 1 1 11 4357 1 1 8 ILE HG21 H -2.400 11.126 -3.699 1.00 . A A . 8 ILE HG21 1 1 11 4358 1 1 8 ILE HG22 H -3.102 11.435 -2.119 1.00 . A A . 8 ILE HG22 1 1 11 4359 1 1 8 ILE HG23 H -1.376 11.639 -2.373 1.00 . A A . 8 ILE HG23 1 1 11 4360 1 1 8 ILE N N -4.275 8.832 -1.618 1.00 . A A . 8 ILE N 1 1 11 4361 1 1 8 ILE O O -1.940 6.751 -2.285 1.00 . A A . 8 ILE O 1 1 11 4362 1 1 9 PRO C C -1.782 5.092 -4.804 1.00 . A A . 9 PRO C 1 1 11 4363 1 1 9 PRO CA C -3.204 5.192 -4.231 1.00 . A A . 9 PRO CA 1 1 11 4364 1 1 9 PRO CB C -4.261 4.784 -5.258 1.00 . A A . 9 PRO CB 1 1 11 4365 1 1 9 PRO CD C -4.768 7.099 -4.511 1.00 . A A . 9 PRO CD 1 1 11 4366 1 1 9 PRO CG C -5.315 5.901 -5.298 1.00 . A A . 9 PRO CG 1 1 11 4367 1 1 9 PRO HA H -3.274 4.551 -3.369 1.00 . A A . 9 PRO HA 1 1 11 4368 1 1 9 PRO HB2 H -3.820 4.658 -6.236 1.00 . A A . 9 PRO HB2 1 1 11 4369 1 1 9 PRO HB3 H -4.720 3.852 -4.961 1.00 . A A . 9 PRO HB3 1 1 11 4370 1 1 9 PRO HD2 H -4.487 7.903 -5.176 1.00 . A A . 9 PRO HD2 1 1 11 4371 1 1 9 PRO HD3 H -5.487 7.446 -3.784 1.00 . A A . 9 PRO HD3 1 1 11 4372 1 1 9 PRO HG2 H -5.512 6.187 -6.322 1.00 . A A . 9 PRO HG2 1 1 11 4373 1 1 9 PRO HG3 H -6.235 5.555 -4.849 1.00 . A A . 9 PRO HG3 1 1 11 4374 1 1 9 PRO N N -3.552 6.580 -3.810 1.00 . A A . 9 PRO N 1 1 11 4375 1 1 9 PRO O O -1.319 5.983 -5.490 1.00 . A A . 9 PRO O 1 1 11 4376 1 1 10 CYS C C 0.289 3.505 -6.486 1.00 . A A . 10 CYS C 1 1 11 4377 1 1 10 CYS CA C 0.254 3.738 -4.968 1.00 . A A . 10 CYS CA 1 1 11 4378 1 1 10 CYS CB C 0.813 2.499 -4.238 1.00 . A A . 10 CYS CB 1 1 11 4379 1 1 10 CYS H H -1.589 3.325 -3.931 1.00 . A A . 10 CYS H 1 1 11 4380 1 1 10 CYS HA H 0.865 4.598 -4.736 1.00 . A A . 10 CYS HA 1 1 11 4381 1 1 10 CYS HB2 H 1.431 1.933 -4.919 1.00 . A A . 10 CYS HB2 1 1 11 4382 1 1 10 CYS HB3 H 1.457 2.851 -3.445 1.00 . A A . 10 CYS HB3 1 1 11 4383 1 1 10 CYS N N -1.141 3.992 -4.491 1.00 . A A . 10 CYS N 1 1 11 4384 1 1 10 CYS O O -0.726 3.246 -7.103 1.00 . A A . 10 CYS O 1 1 11 4385 1 1 10 CYS SG S -0.369 1.351 -3.491 1.00 . A A . 10 CYS SG 1 1 11 4386 1 1 11 ILE C C 2.892 2.459 -8.655 1.00 . A A . 11 ILE C 1 1 11 4387 1 1 11 ILE CA C 1.703 3.413 -8.492 1.00 . A A . 11 ILE CA 1 1 11 4388 1 1 11 ILE CB C 2.007 4.781 -9.149 1.00 . A A . 11 ILE CB 1 1 11 4389 1 1 11 ILE CD1 C -0.442 5.609 -9.118 1.00 . A A . 11 ILE CD1 1 1 11 4390 1 1 11 ILE CG1 C 1.015 5.894 -8.679 1.00 . A A . 11 ILE CG1 1 1 11 4391 1 1 11 ILE CG2 C 1.993 4.652 -10.691 1.00 . A A . 11 ILE CG2 1 1 11 4392 1 1 11 ILE H H 2.244 3.820 -6.453 1.00 . A A . 11 ILE H 1 1 11 4393 1 1 11 ILE HA H 0.838 2.978 -8.952 1.00 . A A . 11 ILE HA 1 1 11 4394 1 1 11 ILE HB H 2.996 5.059 -8.843 1.00 . A A . 11 ILE HB 1 1 11 4395 1 1 11 ILE HD11 H -0.579 4.577 -9.407 1.00 . A A . 11 ILE HD11 1 1 11 4396 1 1 11 ILE HD12 H -1.117 5.828 -8.302 1.00 . A A . 11 ILE HD12 1 1 11 4397 1 1 11 ILE HD13 H -0.703 6.237 -9.957 1.00 . A A . 11 ILE HD13 1 1 11 4398 1 1 11 ILE HG12 H 1.054 5.983 -7.603 1.00 . A A . 11 ILE HG12 1 1 11 4399 1 1 11 ILE HG13 H 1.327 6.841 -9.096 1.00 . A A . 11 ILE HG13 1 1 11 4400 1 1 11 ILE HG21 H 1.104 4.136 -11.024 1.00 . A A . 11 ILE HG21 1 1 11 4401 1 1 11 ILE HG22 H 2.018 5.630 -11.149 1.00 . A A . 11 ILE HG22 1 1 11 4402 1 1 11 ILE HG23 H 2.859 4.098 -11.020 1.00 . A A . 11 ILE HG23 1 1 11 4403 1 1 11 ILE N N 1.478 3.608 -7.026 1.00 . A A . 11 ILE N 1 1 11 4404 1 1 11 ILE O O 2.774 1.405 -9.249 1.00 . A A . 11 ILE O 1 1 11 4405 1 1 12 SER C C 5.070 0.830 -7.294 1.00 . A A . 12 SER C 1 1 11 4406 1 1 12 SER CA C 5.255 2.068 -8.176 1.00 . A A . 12 SER CA 1 1 11 4407 1 1 12 SER CB C 6.422 2.928 -7.672 1.00 . A A . 12 SER CB 1 1 11 4408 1 1 12 SER H H 4.024 3.738 -7.651 1.00 . A A . 12 SER H 1 1 11 4409 1 1 12 SER HA H 5.409 1.774 -9.199 1.00 . A A . 12 SER HA 1 1 11 4410 1 1 12 SER HB2 H 6.414 3.908 -8.124 1.00 . A A . 12 SER HB2 1 1 11 4411 1 1 12 SER HB3 H 6.429 3.016 -6.595 1.00 . A A . 12 SER HB3 1 1 11 4412 1 1 12 SER HG H 8.172 2.143 -7.345 1.00 . A A . 12 SER HG 1 1 11 4413 1 1 12 SER N N 4.007 2.878 -8.111 1.00 . A A . 12 SER N 1 1 11 4414 1 1 12 SER O O 5.267 -0.287 -7.732 1.00 . A A . 12 SER O 1 1 11 4415 1 1 12 SER OG O 7.580 2.222 -8.097 1.00 . A A . 12 SER OG 1 1 11 4416 1 1 13 ALA C C 3.301 -0.890 -5.535 1.00 . A A . 13 ALA C 1 1 11 4417 1 1 13 ALA CA C 4.462 0.003 -5.076 1.00 . A A . 13 ALA CA 1 1 11 4418 1 1 13 ALA CB C 4.139 0.636 -3.713 1.00 . A A . 13 ALA CB 1 1 11 4419 1 1 13 ALA H H 4.559 2.020 -5.795 1.00 . A A . 13 ALA H 1 1 11 4420 1 1 13 ALA HA H 5.362 -0.584 -5.009 1.00 . A A . 13 ALA HA 1 1 11 4421 1 1 13 ALA HB1 H 3.419 1.431 -3.828 1.00 . A A . 13 ALA HB1 1 1 11 4422 1 1 13 ALA HB2 H 3.735 -0.105 -3.037 1.00 . A A . 13 ALA HB2 1 1 11 4423 1 1 13 ALA HB3 H 5.038 1.044 -3.276 1.00 . A A . 13 ALA HB3 1 1 11 4424 1 1 13 ALA N N 4.692 1.091 -6.068 1.00 . A A . 13 ALA N 1 1 11 4425 1 1 13 ALA O O 3.291 -2.073 -5.262 1.00 . A A . 13 ALA O 1 1 11 4426 1 1 14 ALA C C 1.595 -2.289 -7.559 1.00 . A A . 14 ALA C 1 1 11 4427 1 1 14 ALA CA C 1.172 -1.064 -6.727 1.00 . A A . 14 ALA CA 1 1 11 4428 1 1 14 ALA CB C 0.311 -0.126 -7.583 1.00 . A A . 14 ALA CB 1 1 11 4429 1 1 14 ALA H H 2.428 0.662 -6.413 1.00 . A A . 14 ALA H 1 1 11 4430 1 1 14 ALA HA H 0.599 -1.404 -5.877 1.00 . A A . 14 ALA HA 1 1 11 4431 1 1 14 ALA HB1 H 0.227 0.837 -7.102 1.00 . A A . 14 ALA HB1 1 1 11 4432 1 1 14 ALA HB2 H 0.754 0.009 -8.560 1.00 . A A . 14 ALA HB2 1 1 11 4433 1 1 14 ALA HB3 H -0.679 -0.541 -7.702 1.00 . A A . 14 ALA HB3 1 1 11 4434 1 1 14 ALA N N 2.357 -0.297 -6.224 1.00 . A A . 14 ALA N 1 1 11 4435 1 1 14 ALA O O 0.882 -3.273 -7.617 1.00 . A A . 14 ALA O 1 1 11 4436 1 1 15 LEU C C 3.760 -4.449 -8.122 1.00 . A A . 15 LEU C 1 1 11 4437 1 1 15 LEU CA C 3.283 -3.291 -9.014 1.00 . A A . 15 LEU CA 1 1 11 4438 1 1 15 LEU CB C 4.445 -2.730 -9.864 1.00 . A A . 15 LEU CB 1 1 11 4439 1 1 15 LEU CD1 C 5.027 -0.725 -11.290 1.00 . A A . 15 LEU CD1 1 1 11 4440 1 1 15 LEU CD2 C 3.388 -2.427 -12.150 1.00 . A A . 15 LEU CD2 1 1 11 4441 1 1 15 LEU CG C 3.897 -1.695 -10.888 1.00 . A A . 15 LEU CG 1 1 11 4442 1 1 15 LEU H H 3.275 -1.367 -8.094 1.00 . A A . 15 LEU H 1 1 11 4443 1 1 15 LEU HA H 2.492 -3.641 -9.652 1.00 . A A . 15 LEU HA 1 1 11 4444 1 1 15 LEU HB2 H 5.168 -2.260 -9.215 1.00 . A A . 15 LEU HB2 1 1 11 4445 1 1 15 LEU HB3 H 4.934 -3.542 -10.380 1.00 . A A . 15 LEU HB3 1 1 11 4446 1 1 15 LEU HD11 H 5.849 -1.266 -11.736 1.00 . A A . 15 LEU HD11 1 1 11 4447 1 1 15 LEU HD12 H 4.661 0.000 -12.003 1.00 . A A . 15 LEU HD12 1 1 11 4448 1 1 15 LEU HD13 H 5.390 -0.198 -10.420 1.00 . A A . 15 LEU HD13 1 1 11 4449 1 1 15 LEU HD21 H 2.609 -3.129 -11.888 1.00 . A A . 15 LEU HD21 1 1 11 4450 1 1 15 LEU HD22 H 2.985 -1.715 -12.855 1.00 . A A . 15 LEU HD22 1 1 11 4451 1 1 15 LEU HD23 H 4.194 -2.967 -12.625 1.00 . A A . 15 LEU HD23 1 1 11 4452 1 1 15 LEU HG H 3.086 -1.126 -10.455 1.00 . A A . 15 LEU HG 1 1 11 4453 1 1 15 LEU N N 2.747 -2.184 -8.176 1.00 . A A . 15 LEU N 1 1 11 4454 1 1 15 LEU O O 3.079 -5.451 -8.008 1.00 . A A . 15 LEU O 1 1 11 4455 1 1 16 GLY C C 4.529 -5.558 -5.444 1.00 . A A . 16 GLY C 1 1 11 4456 1 1 16 GLY CA C 5.482 -5.330 -6.620 1.00 . A A . 16 GLY CA 1 1 11 4457 1 1 16 GLY H H 5.409 -3.449 -7.651 1.00 . A A . 16 GLY H 1 1 11 4458 1 1 16 GLY HA2 H 5.600 -6.240 -7.185 1.00 . A A . 16 GLY HA2 1 1 11 4459 1 1 16 GLY HA3 H 6.441 -5.001 -6.249 1.00 . A A . 16 GLY HA3 1 1 11 4460 1 1 16 GLY N N 4.911 -4.278 -7.516 1.00 . A A . 16 GLY N 1 1 11 4461 1 1 16 GLY O O 4.018 -6.643 -5.245 1.00 . A A . 16 GLY O 1 1 11 4462 1 1 17 CYS C C 1.964 -4.503 -4.009 1.00 . A A . 17 CYS C 1 1 11 4463 1 1 17 CYS CA C 3.424 -4.534 -3.517 1.00 . A A . 17 CYS CA 1 1 11 4464 1 1 17 CYS CB C 3.732 -3.311 -2.635 1.00 . A A . 17 CYS CB 1 1 11 4465 1 1 17 CYS H H 4.783 -3.663 -4.937 1.00 . A A . 17 CYS H 1 1 11 4466 1 1 17 CYS HA H 3.590 -5.445 -2.966 1.00 . A A . 17 CYS HA 1 1 11 4467 1 1 17 CYS HB2 H 3.002 -2.535 -2.813 1.00 . A A . 17 CYS HB2 1 1 11 4468 1 1 17 CYS HB3 H 3.623 -3.619 -1.607 1.00 . A A . 17 CYS HB3 1 1 11 4469 1 1 17 CYS N N 4.328 -4.498 -4.704 1.00 . A A . 17 CYS N 1 1 11 4470 1 1 17 CYS O O 1.718 -4.455 -5.200 1.00 . A A . 17 CYS O 1 1 11 4471 1 1 17 CYS SG S 5.374 -2.562 -2.784 1.00 . A A . 17 CYS SG 1 1 11 4472 1 1 18 SER C C -1.213 -3.752 -2.380 1.00 . A A . 18 SER C 1 1 11 4473 1 1 18 SER CA C -0.414 -4.506 -3.446 1.00 . A A . 18 SER CA 1 1 11 4474 1 1 18 SER CB C -0.933 -5.952 -3.558 1.00 . A A . 18 SER CB 1 1 11 4475 1 1 18 SER H H 1.302 -4.569 -2.140 1.00 . A A . 18 SER H 1 1 11 4476 1 1 18 SER HA H -0.537 -3.996 -4.391 1.00 . A A . 18 SER HA 1 1 11 4477 1 1 18 SER HB2 H -0.720 -6.526 -2.668 1.00 . A A . 18 SER HB2 1 1 11 4478 1 1 18 SER HB3 H -1.990 -5.976 -3.773 1.00 . A A . 18 SER HB3 1 1 11 4479 1 1 18 SER HG H 0.706 -6.553 -4.415 1.00 . A A . 18 SER HG 1 1 11 4480 1 1 18 SER N N 1.040 -4.532 -3.081 1.00 . A A . 18 SER N 1 1 11 4481 1 1 18 SER O O -1.065 -4.008 -1.199 1.00 . A A . 18 SER O 1 1 11 4482 1 1 18 SER OG O -0.221 -6.501 -4.658 1.00 . A A . 18 SER OG 1 1 11 4483 1 1 19 CYS C C -3.996 -2.911 -1.303 1.00 . A A . 19 CYS C 1 1 11 4484 1 1 19 CYS CA C -2.871 -2.046 -1.877 1.00 . A A . 19 CYS CA 1 1 11 4485 1 1 19 CYS CB C -3.475 -0.839 -2.603 1.00 . A A . 19 CYS CB 1 1 11 4486 1 1 19 CYS H H -2.115 -2.680 -3.792 1.00 . A A . 19 CYS H 1 1 11 4487 1 1 19 CYS HA H -2.241 -1.698 -1.073 1.00 . A A . 19 CYS HA 1 1 11 4488 1 1 19 CYS HB2 H -2.675 -0.150 -2.828 1.00 . A A . 19 CYS HB2 1 1 11 4489 1 1 19 CYS HB3 H -3.900 -1.173 -3.537 1.00 . A A . 19 CYS HB3 1 1 11 4490 1 1 19 CYS N N -2.040 -2.841 -2.829 1.00 . A A . 19 CYS N 1 1 11 4491 1 1 19 CYS O O -4.768 -3.507 -2.029 1.00 . A A . 19 CYS O 1 1 11 4492 1 1 19 CYS SG S -4.754 0.076 -1.703 1.00 . A A . 19 CYS SG 1 1 11 4493 1 1 20 LYS C C -5.113 -3.215 2.178 1.00 . A A . 20 LYS C 1 1 11 4494 1 1 20 LYS CA C -5.067 -3.732 0.739 1.00 . A A . 20 LYS CA 1 1 11 4495 1 1 20 LYS CB C -4.677 -5.234 0.715 1.00 . A A . 20 LYS CB 1 1 11 4496 1 1 20 LYS CD C -5.440 -7.421 -0.341 1.00 . A A . 20 LYS CD 1 1 11 4497 1 1 20 LYS CE C -5.199 -7.247 -1.858 1.00 . A A . 20 LYS CE 1 1 11 4498 1 1 20 LYS CG C -5.901 -6.082 0.284 1.00 . A A . 20 LYS CG 1 1 11 4499 1 1 20 LYS H H -3.374 -2.433 0.512 1.00 . A A . 20 LYS H 1 1 11 4500 1 1 20 LYS HA H -6.030 -3.557 0.280 1.00 . A A . 20 LYS HA 1 1 11 4501 1 1 20 LYS HB2 H -3.855 -5.385 0.032 1.00 . A A . 20 LYS HB2 1 1 11 4502 1 1 20 LYS HB3 H -4.354 -5.556 1.695 1.00 . A A . 20 LYS HB3 1 1 11 4503 1 1 20 LYS HD2 H -4.539 -7.776 0.140 1.00 . A A . 20 LYS HD2 1 1 11 4504 1 1 20 LYS HD3 H -6.214 -8.160 -0.193 1.00 . A A . 20 LYS HD3 1 1 11 4505 1 1 20 LYS HE2 H -5.210 -8.211 -2.343 1.00 . A A . 20 LYS HE2 1 1 11 4506 1 1 20 LYS HE3 H -5.967 -6.630 -2.302 1.00 . A A . 20 LYS HE3 1 1 11 4507 1 1 20 LYS HG2 H -6.510 -6.289 1.152 1.00 . A A . 20 LYS HG2 1 1 11 4508 1 1 20 LYS HG3 H -6.507 -5.539 -0.428 1.00 . A A . 20 LYS HG3 1 1 11 4509 1 1 20 LYS HZ1 H -3.209 -6.888 -1.357 1.00 . A A . 20 LYS HZ1 1 1 11 4510 1 1 20 LYS HZ2 H -3.511 -6.922 -3.028 1.00 . A A . 20 LYS HZ2 1 1 11 4511 1 1 20 LYS HZ3 H -3.982 -5.575 -2.108 1.00 . A A . 20 LYS HZ3 1 1 11 4512 1 1 20 LYS N N -4.037 -2.942 0.003 1.00 . A A . 20 LYS N 1 1 11 4513 1 1 20 LYS NZ N -3.874 -6.609 -2.106 1.00 . A A . 20 LYS NZ 1 1 11 4514 1 1 20 LYS O O -4.085 -2.901 2.749 1.00 . A A . 20 LYS O 1 1 11 4515 1 1 21 ASN C C -5.849 -1.273 4.273 1.00 . A A . 21 ASN C 1 1 11 4516 1 1 21 ASN CA C -6.512 -2.655 4.119 1.00 . A A . 21 ASN CA 1 1 11 4517 1 1 21 ASN CB C -5.891 -3.692 5.104 1.00 . A A . 21 ASN CB 1 1 11 4518 1 1 21 ASN CG C -6.355 -5.104 4.717 1.00 . A A . 21 ASN CG 1 1 11 4519 1 1 21 ASN H H -7.086 -3.418 2.187 1.00 . A A . 21 ASN H 1 1 11 4520 1 1 21 ASN HA H -7.572 -2.554 4.302 1.00 . A A . 21 ASN HA 1 1 11 4521 1 1 21 ASN HB2 H -4.811 -3.662 5.073 1.00 . A A . 21 ASN HB2 1 1 11 4522 1 1 21 ASN HB3 H -6.216 -3.485 6.113 1.00 . A A . 21 ASN HB3 1 1 11 4523 1 1 21 ASN HD21 H -8.072 -4.944 5.698 1.00 . A A . 21 ASN HD21 1 1 11 4524 1 1 21 ASN HD22 H -7.824 -6.424 4.904 1.00 . A A . 21 ASN HD22 1 1 11 4525 1 1 21 ASN N N -6.309 -3.144 2.715 1.00 . A A . 21 ASN N 1 1 11 4526 1 1 21 ASN ND2 N -7.513 -5.526 5.142 1.00 . A A . 21 ASN ND2 1 1 11 4527 1 1 21 ASN O O -5.031 -1.055 5.145 1.00 . A A . 21 ASN O 1 1 11 4528 1 1 21 ASN OD1 O -5.667 -5.831 4.026 1.00 . A A . 21 ASN OD1 1 1 11 4529 1 1 22 LYS C C -4.249 1.172 3.609 1.00 . A A . 22 LYS C 1 1 11 4530 1 1 22 LYS CA C -5.757 1.022 3.319 1.00 . A A . 22 LYS CA 1 1 11 4531 1 1 22 LYS CB C -6.601 1.901 4.315 1.00 . A A . 22 LYS CB 1 1 11 4532 1 1 22 LYS CD C -7.208 2.420 6.717 1.00 . A A . 22 LYS CD 1 1 11 4533 1 1 22 LYS CE C -8.738 2.486 6.541 1.00 . A A . 22 LYS CE 1 1 11 4534 1 1 22 LYS CG C -6.605 1.359 5.765 1.00 . A A . 22 LYS CG 1 1 11 4535 1 1 22 LYS H H -6.921 -0.681 2.729 1.00 . A A . 22 LYS H 1 1 11 4536 1 1 22 LYS HA H -5.935 1.385 2.317 1.00 . A A . 22 LYS HA 1 1 11 4537 1 1 22 LYS HB2 H -6.200 2.904 4.313 1.00 . A A . 22 LYS HB2 1 1 11 4538 1 1 22 LYS HB3 H -7.616 1.953 3.949 1.00 . A A . 22 LYS HB3 1 1 11 4539 1 1 22 LYS HD2 H -6.978 2.154 7.738 1.00 . A A . 22 LYS HD2 1 1 11 4540 1 1 22 LYS HD3 H -6.777 3.390 6.512 1.00 . A A . 22 LYS HD3 1 1 11 4541 1 1 22 LYS HE2 H -8.990 2.881 5.568 1.00 . A A . 22 LYS HE2 1 1 11 4542 1 1 22 LYS HE3 H -9.176 1.504 6.648 1.00 . A A . 22 LYS HE3 1 1 11 4543 1 1 22 LYS HG2 H -7.187 0.450 5.821 1.00 . A A . 22 LYS HG2 1 1 11 4544 1 1 22 LYS HG3 H -5.595 1.145 6.082 1.00 . A A . 22 LYS HG3 1 1 11 4545 1 1 22 LYS HZ1 H -8.836 4.298 7.566 1.00 . A A . 22 LYS HZ1 1 1 11 4546 1 1 22 LYS HZ2 H -10.337 3.523 7.379 1.00 . A A . 22 LYS HZ2 1 1 11 4547 1 1 22 LYS HZ3 H -9.216 2.942 8.516 1.00 . A A . 22 LYS HZ3 1 1 11 4548 1 1 22 LYS N N -6.254 -0.394 3.387 1.00 . A A . 22 LYS N 1 1 11 4549 1 1 22 LYS NZ N -9.327 3.380 7.579 1.00 . A A . 22 LYS NZ 1 1 11 4550 1 1 22 LYS O O -3.825 2.034 4.356 1.00 . A A . 22 LYS O 1 1 11 4551 1 1 23 VAL C C -1.414 -0.298 1.834 1.00 . A A . 23 VAL C 1 1 11 4552 1 1 23 VAL CA C -2.010 0.274 3.141 1.00 . A A . 23 VAL CA 1 1 11 4553 1 1 23 VAL CB C -1.703 -0.591 4.413 1.00 . A A . 23 VAL CB 1 1 11 4554 1 1 23 VAL CG1 C -0.986 -1.920 4.098 1.00 . A A . 23 VAL CG1 1 1 11 4555 1 1 23 VAL CG2 C -0.872 0.243 5.408 1.00 . A A . 23 VAL CG2 1 1 11 4556 1 1 23 VAL H H -3.887 -0.385 2.427 1.00 . A A . 23 VAL H 1 1 11 4557 1 1 23 VAL HA H -1.682 1.293 3.243 1.00 . A A . 23 VAL HA 1 1 11 4558 1 1 23 VAL HB H -2.639 -0.840 4.886 1.00 . A A . 23 VAL HB 1 1 11 4559 1 1 23 VAL HG11 H -0.130 -1.746 3.466 1.00 . A A . 23 VAL HG11 1 1 11 4560 1 1 23 VAL HG12 H -0.659 -2.390 5.013 1.00 . A A . 23 VAL HG12 1 1 11 4561 1 1 23 VAL HG13 H -1.659 -2.595 3.591 1.00 . A A . 23 VAL HG13 1 1 11 4562 1 1 23 VAL HG21 H -0.024 0.693 4.912 1.00 . A A . 23 VAL HG21 1 1 11 4563 1 1 23 VAL HG22 H -1.491 1.027 5.821 1.00 . A A . 23 VAL HG22 1 1 11 4564 1 1 23 VAL HG23 H -0.517 -0.374 6.219 1.00 . A A . 23 VAL HG23 1 1 11 4565 1 1 23 VAL N N -3.490 0.294 2.998 1.00 . A A . 23 VAL N 1 1 11 4566 1 1 23 VAL O O -1.961 -1.240 1.294 1.00 . A A . 23 VAL O 1 1 11 4567 1 1 24 CYS C C 1.505 -1.132 0.438 1.00 . A A . 24 CYS C 1 1 11 4568 1 1 24 CYS CA C 0.314 -0.229 0.097 1.00 . A A . 24 CYS CA 1 1 11 4569 1 1 24 CYS CB C 0.786 0.983 -0.728 1.00 . A A . 24 CYS CB 1 1 11 4570 1 1 24 CYS H H 0.085 1.024 1.834 1.00 . A A . 24 CYS H 1 1 11 4571 1 1 24 CYS HA H -0.401 -0.799 -0.478 1.00 . A A . 24 CYS HA 1 1 11 4572 1 1 24 CYS HB2 H 1.361 1.639 -0.095 1.00 . A A . 24 CYS HB2 1 1 11 4573 1 1 24 CYS HB3 H 1.454 0.623 -1.491 1.00 . A A . 24 CYS HB3 1 1 11 4574 1 1 24 CYS N N -0.327 0.267 1.362 1.00 . A A . 24 CYS N 1 1 11 4575 1 1 24 CYS O O 2.624 -0.848 0.060 1.00 . A A . 24 CYS O 1 1 11 4576 1 1 24 CYS SG S -0.470 1.970 -1.572 1.00 . A A . 24 CYS SG 1 1 11 4577 1 1 25 TYR C C 2.306 -4.412 0.668 1.00 . A A . 25 TYR C 1 1 11 4578 1 1 25 TYR CA C 2.295 -3.165 1.555 1.00 . A A . 25 TYR CA 1 1 11 4579 1 1 25 TYR CB C 2.046 -3.575 3.004 1.00 . A A . 25 TYR CB 1 1 11 4580 1 1 25 TYR CD1 C 2.566 -1.110 3.619 1.00 . A A . 25 TYR CD1 1 1 11 4581 1 1 25 TYR CD2 C 1.994 -2.651 5.337 1.00 . A A . 25 TYR CD2 1 1 11 4582 1 1 25 TYR CE1 C 2.685 -0.111 4.557 1.00 . A A . 25 TYR CE1 1 1 11 4583 1 1 25 TYR CE2 C 2.115 -1.650 6.273 1.00 . A A . 25 TYR CE2 1 1 11 4584 1 1 25 TYR CG C 2.216 -2.401 3.999 1.00 . A A . 25 TYR CG 1 1 11 4585 1 1 25 TYR CZ C 2.462 -0.370 5.891 1.00 . A A . 25 TYR CZ 1 1 11 4586 1 1 25 TYR H H 0.303 -2.373 1.416 1.00 . A A . 25 TYR H 1 1 11 4587 1 1 25 TYR HA H 3.263 -2.693 1.508 1.00 . A A . 25 TYR HA 1 1 11 4588 1 1 25 TYR HB2 H 1.044 -3.960 3.092 1.00 . A A . 25 TYR HB2 1 1 11 4589 1 1 25 TYR HB3 H 2.722 -4.364 3.281 1.00 . A A . 25 TYR HB3 1 1 11 4590 1 1 25 TYR HD1 H 2.756 -0.863 2.589 1.00 . A A . 25 TYR HD1 1 1 11 4591 1 1 25 TYR HD2 H 1.724 -3.645 5.659 1.00 . A A . 25 TYR HD2 1 1 11 4592 1 1 25 TYR HE1 H 2.956 0.883 4.235 1.00 . A A . 25 TYR HE1 1 1 11 4593 1 1 25 TYR HE2 H 1.933 -1.875 7.312 1.00 . A A . 25 TYR HE2 1 1 11 4594 1 1 25 TYR HH H 3.473 0.993 6.760 1.00 . A A . 25 TYR HH 1 1 11 4595 1 1 25 TYR N N 1.227 -2.197 1.146 1.00 . A A . 25 TYR N 1 1 11 4596 1 1 25 TYR O O 1.373 -4.661 -0.071 1.00 . A A . 25 TYR O 1 1 11 4597 1 1 25 TYR OH O 2.584 0.636 6.828 1.00 . A A . 25 TYR OH 1 1 11 4598 1 1 26 ARG C C 3.067 -7.562 0.899 1.00 . A A . 26 ARG C 1 1 11 4599 1 1 26 ARG CA C 3.533 -6.416 -0.016 1.00 . A A . 26 ARG CA 1 1 11 4600 1 1 26 ARG CB C 5.033 -6.566 -0.419 1.00 . A A . 26 ARG CB 1 1 11 4601 1 1 26 ARG CD C 5.565 -8.793 -1.552 1.00 . A A . 26 ARG CD 1 1 11 4602 1 1 26 ARG CG C 5.173 -7.319 -1.775 1.00 . A A . 26 ARG CG 1 1 11 4603 1 1 26 ARG CZ C 4.342 -10.848 -1.014 1.00 . A A . 26 ARG CZ 1 1 11 4604 1 1 26 ARG H H 4.080 -4.884 1.406 1.00 . A A . 26 ARG H 1 1 11 4605 1 1 26 ARG HA H 2.895 -6.377 -0.887 1.00 . A A . 26 ARG HA 1 1 11 4606 1 1 26 ARG HB2 H 5.465 -5.582 -0.533 1.00 . A A . 26 ARG HB2 1 1 11 4607 1 1 26 ARG HB3 H 5.582 -7.080 0.357 1.00 . A A . 26 ARG HB3 1 1 11 4608 1 1 26 ARG HD2 H 6.057 -9.182 -2.432 1.00 . A A . 26 ARG HD2 1 1 11 4609 1 1 26 ARG HD3 H 6.221 -8.905 -0.701 1.00 . A A . 26 ARG HD3 1 1 11 4610 1 1 26 ARG HE H 3.446 -9.124 -1.390 1.00 . A A . 26 ARG HE 1 1 11 4611 1 1 26 ARG HG2 H 4.248 -7.291 -2.331 1.00 . A A . 26 ARG HG2 1 1 11 4612 1 1 26 ARG HG3 H 5.937 -6.839 -2.368 1.00 . A A . 26 ARG HG3 1 1 11 4613 1 1 26 ARG HH11 H 6.342 -10.999 -1.064 1.00 . A A . 26 ARG HH11 1 1 11 4614 1 1 26 ARG HH12 H 5.489 -12.456 -0.679 1.00 . A A . 26 ARG HH12 1 1 11 4615 1 1 26 ARG HH21 H 2.347 -10.944 -0.905 1.00 . A A . 26 ARG HH21 1 1 11 4616 1 1 26 ARG HH22 H 3.187 -12.426 -0.589 1.00 . A A . 26 ARG HH22 1 1 11 4617 1 1 26 ARG N N 3.377 -5.159 0.783 1.00 . A A . 26 ARG N 1 1 11 4618 1 1 26 ARG NE N 4.312 -9.575 -1.317 1.00 . A A . 26 ARG NE 1 1 11 4619 1 1 26 ARG NH1 N 5.480 -11.483 -0.911 1.00 . A A . 26 ARG NH1 1 1 11 4620 1 1 26 ARG NH2 N 3.203 -11.455 -0.821 1.00 . A A . 26 ARG NH2 1 1 11 4621 1 1 26 ARG O O 3.751 -8.546 1.109 1.00 . A A . 26 ARG O 1 1 11 4622 1 1 27 ASN C C 2.140 -8.771 3.512 1.00 . A A . 27 ASN C 1 1 11 4623 1 1 27 ASN CA C 1.230 -8.352 2.339 1.00 . A A . 27 ASN CA 1 1 11 4624 1 1 27 ASN CB C 0.812 -9.585 1.488 1.00 . A A . 27 ASN CB 1 1 11 4625 1 1 27 ASN CG C -0.368 -10.301 2.157 1.00 . A A . 27 ASN CG 1 1 11 4626 1 1 27 ASN H H 1.399 -6.542 1.199 1.00 . A A . 27 ASN H 1 1 11 4627 1 1 27 ASN HA H 0.362 -7.871 2.762 1.00 . A A . 27 ASN HA 1 1 11 4628 1 1 27 ASN HB2 H 0.503 -9.268 0.503 1.00 . A A . 27 ASN HB2 1 1 11 4629 1 1 27 ASN HB3 H 1.634 -10.279 1.385 1.00 . A A . 27 ASN HB3 1 1 11 4630 1 1 27 ASN HD21 H 0.787 -11.647 3.053 1.00 . A A . 27 ASN HD21 1 1 11 4631 1 1 27 ASN HD22 H -0.876 -11.804 3.352 1.00 . A A . 27 ASN HD22 1 1 11 4632 1 1 27 ASN N N 1.880 -7.367 1.420 1.00 . A A . 27 ASN N 1 1 11 4633 1 1 27 ASN ND2 N -0.133 -11.336 2.918 1.00 . A A . 27 ASN ND2 1 1 11 4634 1 1 27 ASN O O 2.146 -9.916 3.922 1.00 . A A . 27 ASN O 1 1 11 4635 1 1 27 ASN OD1 O -1.511 -9.925 1.997 1.00 . A A . 27 ASN OD1 1 1 11 4636 1 1 28 GLY C C 4.877 -7.043 5.396 1.00 . A A . 28 GLY C 1 1 11 4637 1 1 28 GLY CA C 3.803 -8.111 5.155 1.00 . A A . 28 GLY CA 1 1 11 4638 1 1 28 GLY H H 2.841 -6.917 3.649 1.00 . A A . 28 GLY H 1 1 11 4639 1 1 28 GLY HA2 H 3.209 -8.216 6.049 1.00 . A A . 28 GLY HA2 1 1 11 4640 1 1 28 GLY HA3 H 4.300 -9.042 4.947 1.00 . A A . 28 GLY HA3 1 1 11 4641 1 1 28 GLY N N 2.885 -7.819 4.017 1.00 . A A . 28 GLY N 1 1 11 4642 1 1 28 GLY O O 5.234 -6.796 6.532 1.00 . A A . 28 GLY O 1 1 11 4643 1 1 29 ILE C C 5.817 -3.986 4.221 1.00 . A A . 29 ILE C 1 1 11 4644 1 1 29 ILE CA C 6.415 -5.388 4.464 1.00 . A A . 29 ILE CA 1 1 11 4645 1 1 29 ILE CB C 7.539 -5.706 3.430 1.00 . A A . 29 ILE CB 1 1 11 4646 1 1 29 ILE CD1 C 10.009 -5.373 2.927 1.00 . A A . 29 ILE CD1 1 1 11 4647 1 1 29 ILE CG1 C 8.827 -4.921 3.806 1.00 . A A . 29 ILE CG1 1 1 11 4648 1 1 29 ILE CG2 C 7.095 -5.340 1.993 1.00 . A A . 29 ILE CG2 1 1 11 4649 1 1 29 ILE H H 5.021 -6.681 3.449 1.00 . A A . 29 ILE H 1 1 11 4650 1 1 29 ILE HA H 6.836 -5.442 5.454 1.00 . A A . 29 ILE HA 1 1 11 4651 1 1 29 ILE HB H 7.747 -6.766 3.467 1.00 . A A . 29 ILE HB 1 1 11 4652 1 1 29 ILE HD11 H 10.066 -6.452 2.893 1.00 . A A . 29 ILE HD11 1 1 11 4653 1 1 29 ILE HD12 H 9.894 -4.994 1.922 1.00 . A A . 29 ILE HD12 1 1 11 4654 1 1 29 ILE HD13 H 10.933 -4.991 3.336 1.00 . A A . 29 ILE HD13 1 1 11 4655 1 1 29 ILE HG12 H 8.666 -3.860 3.679 1.00 . A A . 29 ILE HG12 1 1 11 4656 1 1 29 ILE HG13 H 9.076 -5.108 4.841 1.00 . A A . 29 ILE HG13 1 1 11 4657 1 1 29 ILE HG21 H 6.048 -5.566 1.863 1.00 . A A . 29 ILE HG21 1 1 11 4658 1 1 29 ILE HG22 H 7.249 -4.288 1.803 1.00 . A A . 29 ILE HG22 1 1 11 4659 1 1 29 ILE HG23 H 7.664 -5.912 1.274 1.00 . A A . 29 ILE HG23 1 1 11 4660 1 1 29 ILE N N 5.358 -6.442 4.336 1.00 . A A . 29 ILE N 1 1 11 4661 1 1 29 ILE O O 5.017 -3.828 3.320 1.00 . A A . 29 ILE O 1 1 11 4662 1 1 30 PRO C C 6.569 -1.136 3.448 1.00 . A A . 30 PRO C 1 1 11 4663 1 1 30 PRO CA C 5.846 -1.592 4.718 1.00 . A A . 30 PRO CA 1 1 11 4664 1 1 30 PRO CB C 6.254 -0.789 5.959 1.00 . A A . 30 PRO CB 1 1 11 4665 1 1 30 PRO CD C 7.010 -3.149 6.254 1.00 . A A . 30 PRO CD 1 1 11 4666 1 1 30 PRO CG C 7.000 -1.751 6.901 1.00 . A A . 30 PRO CG 1 1 11 4667 1 1 30 PRO HA H 4.783 -1.537 4.557 1.00 . A A . 30 PRO HA 1 1 11 4668 1 1 30 PRO HB2 H 6.890 0.043 5.698 1.00 . A A . 30 PRO HB2 1 1 11 4669 1 1 30 PRO HB3 H 5.368 -0.405 6.442 1.00 . A A . 30 PRO HB3 1 1 11 4670 1 1 30 PRO HD2 H 8.014 -3.455 6.000 1.00 . A A . 30 PRO HD2 1 1 11 4671 1 1 30 PRO HD3 H 6.546 -3.880 6.901 1.00 . A A . 30 PRO HD3 1 1 11 4672 1 1 30 PRO HG2 H 8.012 -1.406 7.052 1.00 . A A . 30 PRO HG2 1 1 11 4673 1 1 30 PRO HG3 H 6.499 -1.789 7.857 1.00 . A A . 30 PRO HG3 1 1 11 4674 1 1 30 PRO N N 6.203 -3.004 5.008 1.00 . A A . 30 PRO N 1 1 11 4675 1 1 30 PRO O O 7.722 -0.751 3.476 1.00 . A A . 30 PRO O 1 1 12 4676 1 1 1 CYS C C 6.236 0.753 0.825 1.00 . A A . 1 CYS C 1 1 12 4677 1 1 1 CYS CA C 6.361 -0.764 0.960 1.00 . A A . 1 CYS CA 1 1 12 4678 1 1 1 CYS CB C 5.551 -1.458 -0.127 1.00 . A A . 1 CYS CB 1 1 12 4679 1 1 1 CYS HA H 7.402 -1.048 0.892 1.00 . A A . 1 CYS HA 1 1 12 4680 1 1 1 CYS HB2 H 4.600 -1.734 0.291 1.00 . A A . 1 CYS HB2 1 1 12 4681 1 1 1 CYS HB3 H 5.346 -0.747 -0.915 1.00 . A A . 1 CYS HB3 1 1 12 4682 1 1 1 CYS N N 5.816 -1.156 2.295 1.00 . A A . 1 CYS N 1 1 12 4683 1 1 1 CYS O O 7.166 1.411 0.396 1.00 . A A . 1 CYS O 1 1 12 4684 1 1 1 CYS SG S 6.228 -2.936 -0.915 1.00 . A A . 1 CYS SG 1 1 12 4685 1 1 2 GLY C C 3.914 3.157 2.245 1.00 . A A . 2 GLY C 1 1 12 4686 1 1 2 GLY CA C 4.838 2.717 1.116 1.00 . A A . 2 GLY CA 1 1 12 4687 1 1 2 GLY H H 4.365 0.681 1.535 1.00 . A A . 2 GLY H 1 1 12 4688 1 1 2 GLY HA2 H 5.773 3.248 1.212 1.00 . A A . 2 GLY HA2 1 1 12 4689 1 1 2 GLY HA3 H 4.386 2.951 0.163 1.00 . A A . 2 GLY HA3 1 1 12 4690 1 1 2 GLY N N 5.083 1.257 1.198 1.00 . A A . 2 GLY N 1 1 12 4691 1 1 2 GLY O O 4.377 3.515 3.311 1.00 . A A . 2 GLY O 1 1 12 4692 1 1 3 GLU C C 0.168 3.439 2.359 1.00 . A A . 3 GLU C 1 1 12 4693 1 1 3 GLU CA C 1.582 3.504 2.955 1.00 . A A . 3 GLU CA 1 1 12 4694 1 1 3 GLU CB C 1.825 4.952 3.436 1.00 . A A . 3 GLU CB 1 1 12 4695 1 1 3 GLU CD C 0.777 6.398 5.213 1.00 . A A . 3 GLU CD 1 1 12 4696 1 1 3 GLU CG C 1.525 5.079 4.953 1.00 . A A . 3 GLU CG 1 1 12 4697 1 1 3 GLU H H 2.374 2.767 1.082 1.00 . A A . 3 GLU H 1 1 12 4698 1 1 3 GLU HA H 1.627 2.808 3.777 1.00 . A A . 3 GLU HA 1 1 12 4699 1 1 3 GLU HB2 H 2.844 5.220 3.250 1.00 . A A . 3 GLU HB2 1 1 12 4700 1 1 3 GLU HB3 H 1.211 5.628 2.860 1.00 . A A . 3 GLU HB3 1 1 12 4701 1 1 3 GLU HG2 H 0.913 4.259 5.304 1.00 . A A . 3 GLU HG2 1 1 12 4702 1 1 3 GLU HG3 H 2.451 5.074 5.511 1.00 . A A . 3 GLU HG3 1 1 12 4703 1 1 3 GLU N N 2.635 3.099 1.964 1.00 . A A . 3 GLU N 1 1 12 4704 1 1 3 GLU O O -0.034 2.962 1.261 1.00 . A A . 3 GLU O 1 1 12 4705 1 1 3 GLU OE1 O -0.407 6.420 4.918 1.00 . A A . 3 GLU OE1 1 1 12 4706 1 1 3 GLU OE2 O 1.428 7.311 5.692 1.00 . A A . 3 GLU OE2 1 1 12 4707 1 1 4 SER C C -2.483 4.429 1.290 1.00 . A A . 4 SER C 1 1 12 4708 1 1 4 SER CA C -2.200 3.973 2.717 1.00 . A A . 4 SER CA 1 1 12 4709 1 1 4 SER CB C -2.987 4.881 3.670 1.00 . A A . 4 SER CB 1 1 12 4710 1 1 4 SER H H -0.520 4.329 3.991 1.00 . A A . 4 SER H 1 1 12 4711 1 1 4 SER HA H -2.564 2.969 2.803 1.00 . A A . 4 SER HA 1 1 12 4712 1 1 4 SER HB2 H -2.770 5.919 3.489 1.00 . A A . 4 SER HB2 1 1 12 4713 1 1 4 SER HB3 H -4.047 4.707 3.575 1.00 . A A . 4 SER HB3 1 1 12 4714 1 1 4 SER HG H -1.623 4.596 5.032 1.00 . A A . 4 SER HG 1 1 12 4715 1 1 4 SER N N -0.767 3.949 3.123 1.00 . A A . 4 SER N 1 1 12 4716 1 1 4 SER O O -1.805 5.259 0.716 1.00 . A A . 4 SER O 1 1 12 4717 1 1 4 SER OG O -2.576 4.504 4.977 1.00 . A A . 4 SER OG 1 1 12 4718 1 1 5 CYS C C -5.379 4.802 -0.523 1.00 . A A . 5 CYS C 1 1 12 4719 1 1 5 CYS CA C -4.048 4.040 -0.567 1.00 . A A . 5 CYS CA 1 1 12 4720 1 1 5 CYS CB C -4.186 2.664 -1.182 1.00 . A A . 5 CYS CB 1 1 12 4721 1 1 5 CYS H H -3.985 3.171 1.364 1.00 . A A . 5 CYS H 1 1 12 4722 1 1 5 CYS HA H -3.342 4.624 -1.103 1.00 . A A . 5 CYS HA 1 1 12 4723 1 1 5 CYS HB2 H -5.113 2.253 -0.834 1.00 . A A . 5 CYS HB2 1 1 12 4724 1 1 5 CYS HB3 H -4.253 2.759 -2.248 1.00 . A A . 5 CYS HB3 1 1 12 4725 1 1 5 CYS N N -3.524 3.815 0.801 1.00 . A A . 5 CYS N 1 1 12 4726 1 1 5 CYS O O -6.197 4.704 -1.418 1.00 . A A . 5 CYS O 1 1 12 4727 1 1 5 CYS SG S -2.874 1.477 -0.798 1.00 . A A . 5 CYS SG 1 1 12 4728 1 1 6 VAL C C -6.630 7.687 0.003 1.00 . A A . 6 VAL C 1 1 12 4729 1 1 6 VAL CA C -6.763 6.362 0.759 1.00 . A A . 6 VAL CA 1 1 12 4730 1 1 6 VAL CB C -6.929 6.604 2.286 1.00 . A A . 6 VAL CB 1 1 12 4731 1 1 6 VAL CG1 C -8.179 7.472 2.555 1.00 . A A . 6 VAL CG1 1 1 12 4732 1 1 6 VAL CG2 C -7.104 5.247 2.996 1.00 . A A . 6 VAL CG2 1 1 12 4733 1 1 6 VAL H H -4.805 5.562 1.198 1.00 . A A . 6 VAL H 1 1 12 4734 1 1 6 VAL HA H -7.618 5.821 0.379 1.00 . A A . 6 VAL HA 1 1 12 4735 1 1 6 VAL HB H -6.053 7.100 2.678 1.00 . A A . 6 VAL HB 1 1 12 4736 1 1 6 VAL HG11 H -9.040 7.063 2.045 1.00 . A A . 6 VAL HG11 1 1 12 4737 1 1 6 VAL HG12 H -8.388 7.507 3.615 1.00 . A A . 6 VAL HG12 1 1 12 4738 1 1 6 VAL HG13 H -8.015 8.481 2.205 1.00 . A A . 6 VAL HG13 1 1 12 4739 1 1 6 VAL HG21 H -6.265 4.605 2.775 1.00 . A A . 6 VAL HG21 1 1 12 4740 1 1 6 VAL HG22 H -7.156 5.392 4.066 1.00 . A A . 6 VAL HG22 1 1 12 4741 1 1 6 VAL HG23 H -8.011 4.761 2.666 1.00 . A A . 6 VAL HG23 1 1 12 4742 1 1 6 VAL N N -5.530 5.546 0.539 1.00 . A A . 6 VAL N 1 1 12 4743 1 1 6 VAL O O -7.354 7.938 -0.940 1.00 . A A . 6 VAL O 1 1 12 4744 1 1 7 TRP C C -5.057 9.637 -1.646 1.00 . A A . 7 TRP C 1 1 12 4745 1 1 7 TRP CA C -5.435 9.817 -0.171 1.00 . A A . 7 TRP CA 1 1 12 4746 1 1 7 TRP CB C -4.292 10.491 0.586 1.00 . A A . 7 TRP CB 1 1 12 4747 1 1 7 TRP CD1 C -3.614 12.588 -0.759 1.00 . A A . 7 TRP CD1 1 1 12 4748 1 1 7 TRP CD2 C -4.962 12.955 0.961 1.00 . A A . 7 TRP CD2 1 1 12 4749 1 1 7 TRP CE2 C -4.705 14.184 0.356 1.00 . A A . 7 TRP CE2 1 1 12 4750 1 1 7 TRP CE3 C -5.790 12.891 2.080 1.00 . A A . 7 TRP CE3 1 1 12 4751 1 1 7 TRP CG C -4.290 11.992 0.269 1.00 . A A . 7 TRP CG 1 1 12 4752 1 1 7 TRP CH2 C -6.102 15.281 1.989 1.00 . A A . 7 TRP CH2 1 1 12 4753 1 1 7 TRP CZ2 C -5.275 15.347 0.870 1.00 . A A . 7 TRP CZ2 1 1 12 4754 1 1 7 TRP CZ3 C -6.360 14.053 2.593 1.00 . A A . 7 TRP CZ3 1 1 12 4755 1 1 7 TRP H H -5.155 8.216 1.219 1.00 . A A . 7 TRP H 1 1 12 4756 1 1 7 TRP HA H -6.338 10.404 -0.100 1.00 . A A . 7 TRP HA 1 1 12 4757 1 1 7 TRP HB2 H -4.418 10.350 1.648 1.00 . A A . 7 TRP HB2 1 1 12 4758 1 1 7 TRP HB3 H -3.344 10.064 0.294 1.00 . A A . 7 TRP HB3 1 1 12 4759 1 1 7 TRP HD1 H -2.984 12.119 -1.501 1.00 . A A . 7 TRP HD1 1 1 12 4760 1 1 7 TRP HE1 H -3.552 14.533 -1.257 1.00 . A A . 7 TRP HE1 1 1 12 4761 1 1 7 TRP HE3 H -5.992 11.940 2.551 1.00 . A A . 7 TRP HE3 1 1 12 4762 1 1 7 TRP HH2 H -6.544 16.183 2.387 1.00 . A A . 7 TRP HH2 1 1 12 4763 1 1 7 TRP HZ2 H -5.073 16.298 0.401 1.00 . A A . 7 TRP HZ2 1 1 12 4764 1 1 7 TRP HZ3 H -7.002 14.002 3.461 1.00 . A A . 7 TRP HZ3 1 1 12 4765 1 1 7 TRP N N -5.698 8.489 0.453 1.00 . A A . 7 TRP N 1 1 12 4766 1 1 7 TRP NE1 N -3.907 13.860 -0.638 1.00 . A A . 7 TRP NE1 1 1 12 4767 1 1 7 TRP O O -5.491 10.376 -2.507 1.00 . A A . 7 TRP O 1 1 12 4768 1 1 8 ILE C C -3.206 6.845 -3.191 1.00 . A A . 8 ILE C 1 1 12 4769 1 1 8 ILE CA C -3.760 8.290 -3.220 1.00 . A A . 8 ILE CA 1 1 12 4770 1 1 8 ILE CB C -2.649 9.313 -3.638 1.00 . A A . 8 ILE CB 1 1 12 4771 1 1 8 ILE CD1 C -1.364 10.137 -5.663 1.00 . A A . 8 ILE CD1 1 1 12 4772 1 1 8 ILE CG1 C -2.069 8.925 -5.029 1.00 . A A . 8 ILE CG1 1 1 12 4773 1 1 8 ILE CG2 C -1.506 9.378 -2.585 1.00 . A A . 8 ILE CG2 1 1 12 4774 1 1 8 ILE H H -3.949 8.093 -1.102 1.00 . A A . 8 ILE H 1 1 12 4775 1 1 8 ILE HA H -4.598 8.359 -3.888 1.00 . A A . 8 ILE HA 1 1 12 4776 1 1 8 ILE HB H -3.103 10.292 -3.706 1.00 . A A . 8 ILE HB 1 1 12 4777 1 1 8 ILE HD11 H -2.041 10.978 -5.721 1.00 . A A . 8 ILE HD11 1 1 12 4778 1 1 8 ILE HD12 H -0.503 10.419 -5.075 1.00 . A A . 8 ILE HD12 1 1 12 4779 1 1 8 ILE HD13 H -1.035 9.890 -6.661 1.00 . A A . 8 ILE HD13 1 1 12 4780 1 1 8 ILE HG12 H -1.361 8.116 -4.925 1.00 . A A . 8 ILE HG12 1 1 12 4781 1 1 8 ILE HG13 H -2.865 8.600 -5.682 1.00 . A A . 8 ILE HG13 1 1 12 4782 1 1 8 ILE HG21 H -1.904 9.361 -1.582 1.00 . A A . 8 ILE HG21 1 1 12 4783 1 1 8 ILE HG22 H -0.828 8.545 -2.702 1.00 . A A . 8 ILE HG22 1 1 12 4784 1 1 8 ILE HG23 H -0.947 10.294 -2.711 1.00 . A A . 8 ILE HG23 1 1 12 4785 1 1 8 ILE N N -4.245 8.634 -1.859 1.00 . A A . 8 ILE N 1 1 12 4786 1 1 8 ILE O O -2.337 6.555 -2.391 1.00 . A A . 8 ILE O 1 1 12 4787 1 1 9 PRO C C -1.742 4.710 -4.862 1.00 . A A . 9 PRO C 1 1 12 4788 1 1 9 PRO CA C -3.129 4.611 -4.220 1.00 . A A . 9 PRO CA 1 1 12 4789 1 1 9 PRO CB C -4.118 3.842 -5.097 1.00 . A A . 9 PRO CB 1 1 12 4790 1 1 9 PRO CD C -4.896 6.205 -4.920 1.00 . A A . 9 PRO CD 1 1 12 4791 1 1 9 PRO CG C -5.155 4.857 -5.611 1.00 . A A . 9 PRO CG 1 1 12 4792 1 1 9 PRO HA H -3.032 4.142 -3.255 1.00 . A A . 9 PRO HA 1 1 12 4793 1 1 9 PRO HB2 H -3.614 3.373 -5.930 1.00 . A A . 9 PRO HB2 1 1 12 4794 1 1 9 PRO HB3 H -4.610 3.077 -4.515 1.00 . A A . 9 PRO HB3 1 1 12 4795 1 1 9 PRO HD2 H -4.667 6.974 -5.644 1.00 . A A . 9 PRO HD2 1 1 12 4796 1 1 9 PRO HD3 H -5.741 6.500 -4.315 1.00 . A A . 9 PRO HD3 1 1 12 4797 1 1 9 PRO HG2 H -5.061 4.967 -6.682 1.00 . A A . 9 PRO HG2 1 1 12 4798 1 1 9 PRO HG3 H -6.153 4.511 -5.383 1.00 . A A . 9 PRO HG3 1 1 12 4799 1 1 9 PRO N N -3.709 5.973 -4.041 1.00 . A A . 9 PRO N 1 1 12 4800 1 1 9 PRO O O -1.485 5.609 -5.641 1.00 . A A . 9 PRO O 1 1 12 4801 1 1 10 CYS C C 0.495 3.461 -6.576 1.00 . A A . 10 CYS C 1 1 12 4802 1 1 10 CYS CA C 0.495 3.777 -5.073 1.00 . A A . 10 CYS CA 1 1 12 4803 1 1 10 CYS CB C 1.347 2.729 -4.332 1.00 . A A . 10 CYS CB 1 1 12 4804 1 1 10 CYS H H -1.167 3.084 -3.875 1.00 . A A . 10 CYS H 1 1 12 4805 1 1 10 CYS HA H 0.929 4.757 -4.928 1.00 . A A . 10 CYS HA 1 1 12 4806 1 1 10 CYS HB2 H 2.219 2.509 -4.931 1.00 . A A . 10 CYS HB2 1 1 12 4807 1 1 10 CYS HB3 H 1.706 3.185 -3.422 1.00 . A A . 10 CYS HB3 1 1 12 4808 1 1 10 CYS N N -0.891 3.780 -4.509 1.00 . A A . 10 CYS N 1 1 12 4809 1 1 10 CYS O O -0.527 3.139 -7.154 1.00 . A A . 10 CYS O 1 1 12 4810 1 1 10 CYS SG S 0.597 1.140 -3.891 1.00 . A A . 10 CYS SG 1 1 12 4811 1 1 11 ILE C C 3.088 2.388 -8.736 1.00 . A A . 11 ILE C 1 1 12 4812 1 1 11 ILE CA C 1.868 3.304 -8.606 1.00 . A A . 11 ILE CA 1 1 12 4813 1 1 11 ILE CB C 2.118 4.649 -9.359 1.00 . A A . 11 ILE CB 1 1 12 4814 1 1 11 ILE CD1 C 3.384 6.851 -9.209 1.00 . A A . 11 ILE CD1 1 1 12 4815 1 1 11 ILE CG1 C 2.637 5.775 -8.402 1.00 . A A . 11 ILE CG1 1 1 12 4816 1 1 11 ILE CG2 C 0.799 5.107 -10.023 1.00 . A A . 11 ILE CG2 1 1 12 4817 1 1 11 ILE H H 2.439 3.837 -6.616 1.00 . A A . 11 ILE H 1 1 12 4818 1 1 11 ILE HA H 1.010 2.787 -9.009 1.00 . A A . 11 ILE HA 1 1 12 4819 1 1 11 ILE HB H 2.859 4.471 -10.121 1.00 . A A . 11 ILE HB 1 1 12 4820 1 1 11 ILE HD11 H 4.193 6.403 -9.768 1.00 . A A . 11 ILE HD11 1 1 12 4821 1 1 11 ILE HD12 H 2.711 7.343 -9.896 1.00 . A A . 11 ILE HD12 1 1 12 4822 1 1 11 ILE HD13 H 3.796 7.590 -8.538 1.00 . A A . 11 ILE HD13 1 1 12 4823 1 1 11 ILE HG12 H 1.809 6.229 -7.876 1.00 . A A . 11 ILE HG12 1 1 12 4824 1 1 11 ILE HG13 H 3.318 5.368 -7.669 1.00 . A A . 11 ILE HG13 1 1 12 4825 1 1 11 ILE HG21 H 0.449 4.354 -10.715 1.00 . A A . 11 ILE HG21 1 1 12 4826 1 1 11 ILE HG22 H 0.038 5.270 -9.273 1.00 . A A . 11 ILE HG22 1 1 12 4827 1 1 11 ILE HG23 H 0.951 6.028 -10.567 1.00 . A A . 11 ILE HG23 1 1 12 4828 1 1 11 ILE N N 1.664 3.570 -7.151 1.00 . A A . 11 ILE N 1 1 12 4829 1 1 11 ILE O O 3.006 1.300 -9.275 1.00 . A A . 11 ILE O 1 1 12 4830 1 1 12 SER C C 5.338 0.878 -7.382 1.00 . A A . 12 SER C 1 1 12 4831 1 1 12 SER CA C 5.470 2.126 -8.257 1.00 . A A . 12 SER CA 1 1 12 4832 1 1 12 SER CB C 6.589 3.052 -7.736 1.00 . A A . 12 SER CB 1 1 12 4833 1 1 12 SER H H 4.174 3.759 -7.807 1.00 . A A . 12 SER H 1 1 12 4834 1 1 12 SER HA H 5.670 1.840 -9.275 1.00 . A A . 12 SER HA 1 1 12 4835 1 1 12 SER HB2 H 7.514 2.518 -7.589 1.00 . A A . 12 SER HB2 1 1 12 4836 1 1 12 SER HB3 H 6.739 3.877 -8.411 1.00 . A A . 12 SER HB3 1 1 12 4837 1 1 12 SER HG H 5.269 3.957 -6.623 1.00 . A A . 12 SER HG 1 1 12 4838 1 1 12 SER N N 4.188 2.878 -8.224 1.00 . A A . 12 SER N 1 1 12 4839 1 1 12 SER O O 5.529 -0.235 -7.834 1.00 . A A . 12 SER O 1 1 12 4840 1 1 12 SER OG O 6.134 3.564 -6.489 1.00 . A A . 12 SER OG 1 1 12 4841 1 1 13 ALA C C 3.623 -0.841 -5.523 1.00 . A A . 13 ALA C 1 1 12 4842 1 1 13 ALA CA C 4.828 0.034 -5.150 1.00 . A A . 13 ALA CA 1 1 12 4843 1 1 13 ALA CB C 4.623 0.657 -3.764 1.00 . A A . 13 ALA CB 1 1 12 4844 1 1 13 ALA H H 4.874 2.055 -5.867 1.00 . A A . 13 ALA H 1 1 12 4845 1 1 13 ALA HA H 5.722 -0.568 -5.152 1.00 . A A . 13 ALA HA 1 1 12 4846 1 1 13 ALA HB1 H 3.861 1.420 -3.805 1.00 . A A . 13 ALA HB1 1 1 12 4847 1 1 13 ALA HB2 H 4.325 -0.099 -3.051 1.00 . A A . 13 ALA HB2 1 1 12 4848 1 1 13 ALA HB3 H 5.545 1.107 -3.426 1.00 . A A . 13 ALA HB3 1 1 12 4849 1 1 13 ALA N N 5.005 1.127 -6.143 1.00 . A A . 13 ALA N 1 1 12 4850 1 1 13 ALA O O 3.627 -2.028 -5.267 1.00 . A A . 13 ALA O 1 1 12 4851 1 1 14 ALA C C 1.739 -2.206 -7.413 1.00 . A A . 14 ALA C 1 1 12 4852 1 1 14 ALA CA C 1.400 -0.993 -6.528 1.00 . A A . 14 ALA CA 1 1 12 4853 1 1 14 ALA CB C 0.464 -0.047 -7.289 1.00 . A A . 14 ALA CB 1 1 12 4854 1 1 14 ALA H H 2.685 0.728 -6.303 1.00 . A A . 14 ALA H 1 1 12 4855 1 1 14 ALA HA H 0.904 -1.346 -5.635 1.00 . A A . 14 ALA HA 1 1 12 4856 1 1 14 ALA HB1 H 0.963 0.367 -8.152 1.00 . A A . 14 ALA HB1 1 1 12 4857 1 1 14 ALA HB2 H -0.417 -0.578 -7.617 1.00 . A A . 14 ALA HB2 1 1 12 4858 1 1 14 ALA HB3 H 0.159 0.758 -6.640 1.00 . A A . 14 ALA HB3 1 1 12 4859 1 1 14 ALA N N 2.627 -0.233 -6.121 1.00 . A A . 14 ALA N 1 1 12 4860 1 1 14 ALA O O 1.002 -3.172 -7.438 1.00 . A A . 14 ALA O 1 1 12 4861 1 1 15 LEU C C 3.745 -4.423 -8.159 1.00 . A A . 15 LEU C 1 1 12 4862 1 1 15 LEU CA C 3.288 -3.221 -9.003 1.00 . A A . 15 LEU CA 1 1 12 4863 1 1 15 LEU CB C 4.439 -2.694 -9.888 1.00 . A A . 15 LEU CB 1 1 12 4864 1 1 15 LEU CD1 C 4.996 -0.660 -11.284 1.00 . A A . 15 LEU CD1 1 1 12 4865 1 1 15 LEU CD2 C 3.419 -2.392 -12.190 1.00 . A A . 15 LEU CD2 1 1 12 4866 1 1 15 LEU CG C 3.886 -1.662 -10.912 1.00 . A A . 15 LEU CG 1 1 12 4867 1 1 15 LEU H H 3.398 -1.311 -8.054 1.00 . A A . 15 LEU H 1 1 12 4868 1 1 15 LEU HA H 2.454 -3.512 -9.615 1.00 . A A . 15 LEU HA 1 1 12 4869 1 1 15 LEU HB2 H 5.187 -2.231 -9.260 1.00 . A A . 15 LEU HB2 1 1 12 4870 1 1 15 LEU HB3 H 4.902 -3.521 -10.404 1.00 . A A . 15 LEU HB3 1 1 12 4871 1 1 15 LEU HD11 H 5.860 -1.180 -11.672 1.00 . A A . 15 LEU HD11 1 1 12 4872 1 1 15 LEU HD12 H 4.639 0.032 -12.034 1.00 . A A . 15 LEU HD12 1 1 12 4873 1 1 15 LEU HD13 H 5.294 -0.097 -10.412 1.00 . A A . 15 LEU HD13 1 1 12 4874 1 1 15 LEU HD21 H 2.658 -3.121 -11.949 1.00 . A A . 15 LEU HD21 1 1 12 4875 1 1 15 LEU HD22 H 3.004 -1.683 -12.892 1.00 . A A . 15 LEU HD22 1 1 12 4876 1 1 15 LEU HD23 H 4.249 -2.900 -12.659 1.00 . A A . 15 LEU HD23 1 1 12 4877 1 1 15 LEU HG H 3.052 -1.119 -10.488 1.00 . A A . 15 LEU HG 1 1 12 4878 1 1 15 LEU N N 2.845 -2.114 -8.110 1.00 . A A . 15 LEU N 1 1 12 4879 1 1 15 LEU O O 3.032 -5.403 -8.056 1.00 . A A . 15 LEU O 1 1 12 4880 1 1 16 GLY C C 4.563 -5.631 -5.524 1.00 . A A . 16 GLY C 1 1 12 4881 1 1 16 GLY CA C 5.476 -5.405 -6.732 1.00 . A A . 16 GLY CA 1 1 12 4882 1 1 16 GLY H H 5.438 -3.493 -7.707 1.00 . A A . 16 GLY H 1 1 12 4883 1 1 16 GLY HA2 H 5.542 -6.303 -7.322 1.00 . A A . 16 GLY HA2 1 1 12 4884 1 1 16 GLY HA3 H 6.461 -5.120 -6.390 1.00 . A A . 16 GLY HA3 1 1 12 4885 1 1 16 GLY N N 4.917 -4.309 -7.580 1.00 . A A . 16 GLY N 1 1 12 4886 1 1 16 GLY O O 4.060 -6.715 -5.305 1.00 . A A . 16 GLY O 1 1 12 4887 1 1 17 CYS C C 2.048 -4.558 -3.982 1.00 . A A . 17 CYS C 1 1 12 4888 1 1 17 CYS CA C 3.527 -4.596 -3.563 1.00 . A A . 17 CYS CA 1 1 12 4889 1 1 17 CYS CB C 3.870 -3.377 -2.694 1.00 . A A . 17 CYS CB 1 1 12 4890 1 1 17 CYS H H 4.838 -3.735 -5.028 1.00 . A A . 17 CYS H 1 1 12 4891 1 1 17 CYS HA H 3.704 -5.509 -3.019 1.00 . A A . 17 CYS HA 1 1 12 4892 1 1 17 CYS HB2 H 3.182 -2.571 -2.906 1.00 . A A . 17 CYS HB2 1 1 12 4893 1 1 17 CYS HB3 H 3.710 -3.660 -1.667 1.00 . A A . 17 CYS HB3 1 1 12 4894 1 1 17 CYS N N 4.389 -4.568 -4.780 1.00 . A A . 17 CYS N 1 1 12 4895 1 1 17 CYS O O 1.733 -4.659 -5.154 1.00 . A A . 17 CYS O 1 1 12 4896 1 1 17 CYS SG S 5.546 -2.700 -2.800 1.00 . A A . 17 CYS SG 1 1 12 4897 1 1 18 SER C C -0.973 -3.425 -2.284 1.00 . A A . 18 SER C 1 1 12 4898 1 1 18 SER CA C -0.280 -4.359 -3.278 1.00 . A A . 18 SER CA 1 1 12 4899 1 1 18 SER CB C -0.859 -5.779 -3.157 1.00 . A A . 18 SER CB 1 1 12 4900 1 1 18 SER H H 1.515 -4.336 -2.085 1.00 . A A . 18 SER H 1 1 12 4901 1 1 18 SER HA H -0.442 -3.974 -4.276 1.00 . A A . 18 SER HA 1 1 12 4902 1 1 18 SER HB2 H -0.328 -6.477 -3.786 1.00 . A A . 18 SER HB2 1 1 12 4903 1 1 18 SER HB3 H -0.862 -6.123 -2.133 1.00 . A A . 18 SER HB3 1 1 12 4904 1 1 18 SER HG H -2.190 -5.159 -4.439 1.00 . A A . 18 SER HG 1 1 12 4905 1 1 18 SER N N 1.189 -4.412 -3.007 1.00 . A A . 18 SER N 1 1 12 4906 1 1 18 SER O O -0.507 -3.225 -1.179 1.00 . A A . 18 SER O 1 1 12 4907 1 1 18 SER OG O -2.198 -5.656 -3.617 1.00 . A A . 18 SER OG 1 1 12 4908 1 1 19 CYS C C -4.093 -2.700 -1.328 1.00 . A A . 19 CYS C 1 1 12 4909 1 1 19 CYS CA C -2.874 -1.954 -1.880 1.00 . A A . 19 CYS CA 1 1 12 4910 1 1 19 CYS CB C -3.302 -0.751 -2.736 1.00 . A A . 19 CYS CB 1 1 12 4911 1 1 19 CYS H H -2.387 -3.102 -3.633 1.00 . A A . 19 CYS H 1 1 12 4912 1 1 19 CYS HA H -2.272 -1.605 -1.059 1.00 . A A . 19 CYS HA 1 1 12 4913 1 1 19 CYS HB2 H -3.298 -1.046 -3.773 1.00 . A A . 19 CYS HB2 1 1 12 4914 1 1 19 CYS HB3 H -4.309 -0.472 -2.469 1.00 . A A . 19 CYS HB3 1 1 12 4915 1 1 19 CYS N N -2.079 -2.887 -2.728 1.00 . A A . 19 CYS N 1 1 12 4916 1 1 19 CYS O O -5.055 -2.948 -2.030 1.00 . A A . 19 CYS O 1 1 12 4917 1 1 19 CYS SG S -2.282 0.735 -2.580 1.00 . A A . 19 CYS SG 1 1 12 4918 1 1 20 LYS C C -5.263 -3.135 2.031 1.00 . A A . 20 LYS C 1 1 12 4919 1 1 20 LYS CA C -5.083 -3.765 0.647 1.00 . A A . 20 LYS CA 1 1 12 4920 1 1 20 LYS CB C -4.685 -5.248 0.783 1.00 . A A . 20 LYS CB 1 1 12 4921 1 1 20 LYS CD C -4.401 -7.427 -0.461 1.00 . A A . 20 LYS CD 1 1 12 4922 1 1 20 LYS CE C -4.806 -8.176 -1.744 1.00 . A A . 20 LYS CE 1 1 12 4923 1 1 20 LYS CG C -4.749 -5.928 -0.604 1.00 . A A . 20 LYS CG 1 1 12 4924 1 1 20 LYS H H -3.181 -2.794 0.426 1.00 . A A . 20 LYS H 1 1 12 4925 1 1 20 LYS HA H -6.009 -3.667 0.098 1.00 . A A . 20 LYS HA 1 1 12 4926 1 1 20 LYS HB2 H -3.682 -5.322 1.179 1.00 . A A . 20 LYS HB2 1 1 12 4927 1 1 20 LYS HB3 H -5.363 -5.746 1.463 1.00 . A A . 20 LYS HB3 1 1 12 4928 1 1 20 LYS HD2 H -3.340 -7.540 -0.295 1.00 . A A . 20 LYS HD2 1 1 12 4929 1 1 20 LYS HD3 H -4.930 -7.853 0.379 1.00 . A A . 20 LYS HD3 1 1 12 4930 1 1 20 LYS HE2 H -4.614 -9.232 -1.631 1.00 . A A . 20 LYS HE2 1 1 12 4931 1 1 20 LYS HE3 H -5.857 -8.033 -1.951 1.00 . A A . 20 LYS HE3 1 1 12 4932 1 1 20 LYS HG2 H -5.740 -5.815 -1.020 1.00 . A A . 20 LYS HG2 1 1 12 4933 1 1 20 LYS HG3 H -4.039 -5.462 -1.271 1.00 . A A . 20 LYS HG3 1 1 12 4934 1 1 20 LYS HZ1 H -3.003 -7.725 -2.685 1.00 . A A . 20 LYS HZ1 1 1 12 4935 1 1 20 LYS HZ2 H -4.222 -8.260 -3.742 1.00 . A A . 20 LYS HZ2 1 1 12 4936 1 1 20 LYS HZ3 H -4.282 -6.688 -3.102 1.00 . A A . 20 LYS HZ3 1 1 12 4937 1 1 20 LYS N N -3.993 -3.032 -0.066 1.00 . A A . 20 LYS N 1 1 12 4938 1 1 20 LYS NZ N -4.018 -7.674 -2.907 1.00 . A A . 20 LYS NZ 1 1 12 4939 1 1 20 LYS O O -4.294 -2.779 2.675 1.00 . A A . 20 LYS O 1 1 12 4940 1 1 21 ASN C C -6.110 -1.102 3.986 1.00 . A A . 21 ASN C 1 1 12 4941 1 1 21 ASN CA C -6.862 -2.425 3.762 1.00 . A A . 21 ASN CA 1 1 12 4942 1 1 21 ASN CB C -6.513 -3.447 4.877 1.00 . A A . 21 ASN CB 1 1 12 4943 1 1 21 ASN CG C -7.307 -3.100 6.145 1.00 . A A . 21 ASN CG 1 1 12 4944 1 1 21 ASN H H -7.224 -3.338 1.850 1.00 . A A . 21 ASN H 1 1 12 4945 1 1 21 ASN HA H -7.923 -2.221 3.765 1.00 . A A . 21 ASN HA 1 1 12 4946 1 1 21 ASN HB2 H -6.777 -4.445 4.564 1.00 . A A . 21 ASN HB2 1 1 12 4947 1 1 21 ASN HB3 H -5.459 -3.420 5.111 1.00 . A A . 21 ASN HB3 1 1 12 4948 1 1 21 ASN HD21 H -8.616 -4.570 5.883 1.00 . A A . 21 ASN HD21 1 1 12 4949 1 1 21 ASN HD22 H -8.867 -3.612 7.262 1.00 . A A . 21 ASN HD22 1 1 12 4950 1 1 21 ASN N N -6.505 -3.022 2.435 1.00 . A A . 21 ASN N 1 1 12 4951 1 1 21 ASN ND2 N -8.350 -3.820 6.456 1.00 . A A . 21 ASN ND2 1 1 12 4952 1 1 21 ASN O O -5.298 -0.982 4.883 1.00 . A A . 21 ASN O 1 1 12 4953 1 1 21 ASN OD1 O -6.986 -2.173 6.862 1.00 . A A . 21 ASN OD1 1 1 12 4954 1 1 22 LYS C C -4.308 1.226 3.528 1.00 . A A . 22 LYS C 1 1 12 4955 1 1 22 LYS CA C -5.812 1.215 3.172 1.00 . A A . 22 LYS CA 1 1 12 4956 1 1 22 LYS CB C -6.633 2.089 4.188 1.00 . A A . 22 LYS CB 1 1 12 4957 1 1 22 LYS CD C -7.445 2.368 6.586 1.00 . A A . 22 LYS CD 1 1 12 4958 1 1 22 LYS CE C -8.978 2.184 6.589 1.00 . A A . 22 LYS CE 1 1 12 4959 1 1 22 LYS CG C -6.781 1.409 5.576 1.00 . A A . 22 LYS CG 1 1 12 4960 1 1 22 LYS H H -7.088 -0.353 2.444 1.00 . A A . 22 LYS H 1 1 12 4961 1 1 22 LYS HA H -5.918 1.649 2.187 1.00 . A A . 22 LYS HA 1 1 12 4962 1 1 22 LYS HB2 H -6.147 3.045 4.309 1.00 . A A . 22 LYS HB2 1 1 12 4963 1 1 22 LYS HB3 H -7.612 2.265 3.770 1.00 . A A . 22 LYS HB3 1 1 12 4964 1 1 22 LYS HD2 H -7.066 2.140 7.571 1.00 . A A . 22 LYS HD2 1 1 12 4965 1 1 22 LYS HD3 H -7.196 3.392 6.352 1.00 . A A . 22 LYS HD3 1 1 12 4966 1 1 22 LYS HE2 H -9.238 1.147 6.748 1.00 . A A . 22 LYS HE2 1 1 12 4967 1 1 22 LYS HE3 H -9.415 2.775 7.379 1.00 . A A . 22 LYS HE3 1 1 12 4968 1 1 22 LYS HG2 H -7.378 0.513 5.490 1.00 . A A . 22 LYS HG2 1 1 12 4969 1 1 22 LYS HG3 H -5.807 1.140 5.955 1.00 . A A . 22 LYS HG3 1 1 12 4970 1 1 22 LYS HZ1 H -9.079 3.496 4.975 1.00 . A A . 22 LYS HZ1 1 1 12 4971 1 1 22 LYS HZ2 H -9.431 1.882 4.579 1.00 . A A . 22 LYS HZ2 1 1 12 4972 1 1 22 LYS HZ3 H -10.575 2.820 5.414 1.00 . A A . 22 LYS HZ3 1 1 12 4973 1 1 22 LYS N N -6.424 -0.155 3.135 1.00 . A A . 22 LYS N 1 1 12 4974 1 1 22 LYS NZ N -9.560 2.630 5.291 1.00 . A A . 22 LYS NZ 1 1 12 4975 1 1 22 LYS O O -3.863 1.998 4.355 1.00 . A A . 22 LYS O 1 1 12 4976 1 1 23 VAL C C -1.474 -0.318 1.794 1.00 . A A . 23 VAL C 1 1 12 4977 1 1 23 VAL CA C -2.111 0.209 3.098 1.00 . A A . 23 VAL CA 1 1 12 4978 1 1 23 VAL CB C -1.917 -0.753 4.325 1.00 . A A . 23 VAL CB 1 1 12 4979 1 1 23 VAL CG1 C -1.227 -2.095 3.970 1.00 . A A . 23 VAL CG1 1 1 12 4980 1 1 23 VAL CG2 C -1.106 -0.019 5.409 1.00 . A A . 23 VAL CG2 1 1 12 4981 1 1 23 VAL H H -3.995 -0.266 2.254 1.00 . A A . 23 VAL H 1 1 12 4982 1 1 23 VAL HA H -1.718 1.189 3.292 1.00 . A A . 23 VAL HA 1 1 12 4983 1 1 23 VAL HB H -2.889 -0.986 4.729 1.00 . A A . 23 VAL HB 1 1 12 4984 1 1 23 VAL HG11 H -0.305 -1.913 3.442 1.00 . A A . 23 VAL HG11 1 1 12 4985 1 1 23 VAL HG12 H -1.014 -2.654 4.869 1.00 . A A . 23 VAL HG12 1 1 12 4986 1 1 23 VAL HG13 H -1.871 -2.693 3.345 1.00 . A A . 23 VAL HG13 1 1 12 4987 1 1 23 VAL HG21 H -0.210 0.405 4.983 1.00 . A A . 23 VAL HG21 1 1 12 4988 1 1 23 VAL HG22 H -1.698 0.781 5.831 1.00 . A A . 23 VAL HG22 1 1 12 4989 1 1 23 VAL HG23 H -0.833 -0.698 6.203 1.00 . A A . 23 VAL HG23 1 1 12 4990 1 1 23 VAL N N -3.579 0.340 2.890 1.00 . A A . 23 VAL N 1 1 12 4991 1 1 23 VAL O O -1.981 -1.274 1.238 1.00 . A A . 23 VAL O 1 1 12 4992 1 1 24 CYS C C 1.478 -1.029 0.461 1.00 . A A . 24 CYS C 1 1 12 4993 1 1 24 CYS CA C 0.255 -0.190 0.070 1.00 . A A . 24 CYS CA 1 1 12 4994 1 1 24 CYS CB C 0.718 1.005 -0.799 1.00 . A A . 24 CYS CB 1 1 12 4995 1 1 24 CYS H H -0.021 1.058 1.822 1.00 . A A . 24 CYS H 1 1 12 4996 1 1 24 CYS HA H -0.428 -0.803 -0.495 1.00 . A A . 24 CYS HA 1 1 12 4997 1 1 24 CYS HB2 H -0.144 1.575 -1.109 1.00 . A A . 24 CYS HB2 1 1 12 4998 1 1 24 CYS HB3 H 1.349 1.650 -0.204 1.00 . A A . 24 CYS HB3 1 1 12 4999 1 1 24 CYS N N -0.401 0.291 1.338 1.00 . A A . 24 CYS N 1 1 12 5000 1 1 24 CYS O O 2.605 -0.634 0.234 1.00 . A A . 24 CYS O 1 1 12 5001 1 1 24 CYS SG S 1.659 0.548 -2.278 1.00 . A A . 24 CYS SG 1 1 12 5002 1 1 25 TYR C C 2.316 -4.389 0.653 1.00 . A A . 25 TYR C 1 1 12 5003 1 1 25 TYR CA C 2.285 -3.106 1.492 1.00 . A A . 25 TYR CA 1 1 12 5004 1 1 25 TYR CB C 2.045 -3.475 2.955 1.00 . A A . 25 TYR CB 1 1 12 5005 1 1 25 TYR CD1 C 2.574 -1.008 3.549 1.00 . A A . 25 TYR CD1 1 1 12 5006 1 1 25 TYR CD2 C 1.784 -2.468 5.247 1.00 . A A . 25 TYR CD2 1 1 12 5007 1 1 25 TYR CE1 C 2.633 0.021 4.461 1.00 . A A . 25 TYR CE1 1 1 12 5008 1 1 25 TYR CE2 C 1.844 -1.437 6.159 1.00 . A A . 25 TYR CE2 1 1 12 5009 1 1 25 TYR CG C 2.146 -2.274 3.929 1.00 . A A . 25 TYR CG 1 1 12 5010 1 1 25 TYR CZ C 2.269 -0.185 5.773 1.00 . A A . 25 TYR CZ 1 1 12 5011 1 1 25 TYR H H 0.269 -2.423 1.187 1.00 . A A . 25 TYR H 1 1 12 5012 1 1 25 TYR HA H 3.248 -2.626 1.430 1.00 . A A . 25 TYR HA 1 1 12 5013 1 1 25 TYR HB2 H 1.065 -3.915 3.037 1.00 . A A . 25 TYR HB2 1 1 12 5014 1 1 25 TYR HB3 H 2.756 -4.222 3.253 1.00 . A A . 25 TYR HB3 1 1 12 5015 1 1 25 TYR HD1 H 2.875 -0.804 2.537 1.00 . A A . 25 TYR HD1 1 1 12 5016 1 1 25 TYR HD2 H 1.449 -3.442 5.571 1.00 . A A . 25 TYR HD2 1 1 12 5017 1 1 25 TYR HE1 H 2.966 0.997 4.139 1.00 . A A . 25 TYR HE1 1 1 12 5018 1 1 25 TYR HE2 H 1.553 -1.615 7.183 1.00 . A A . 25 TYR HE2 1 1 12 5019 1 1 25 TYR HH H 1.846 1.594 6.316 1.00 . A A . 25 TYR HH 1 1 12 5020 1 1 25 TYR N N 1.204 -2.170 1.043 1.00 . A A . 25 TYR N 1 1 12 5021 1 1 25 TYR O O 1.351 -4.739 0.003 1.00 . A A . 25 TYR O 1 1 12 5022 1 1 25 TYR OH O 2.329 0.850 6.682 1.00 . A A . 25 TYR OH 1 1 12 5023 1 1 26 ARG C C 3.520 -7.459 0.973 1.00 . A A . 26 ARG C 1 1 12 5024 1 1 26 ARG CA C 3.640 -6.323 -0.053 1.00 . A A . 26 ARG CA 1 1 12 5025 1 1 26 ARG CB C 5.044 -6.304 -0.726 1.00 . A A . 26 ARG CB 1 1 12 5026 1 1 26 ARG CD C 5.742 -8.651 -1.426 1.00 . A A . 26 ARG CD 1 1 12 5027 1 1 26 ARG CG C 5.105 -7.331 -1.891 1.00 . A A . 26 ARG CG 1 1 12 5028 1 1 26 ARG CZ C 6.716 -10.597 -2.550 1.00 . A A . 26 ARG CZ 1 1 12 5029 1 1 26 ARG H H 4.168 -4.692 1.264 1.00 . A A . 26 ARG H 1 1 12 5030 1 1 26 ARG HA H 2.861 -6.430 -0.795 1.00 . A A . 26 ARG HA 1 1 12 5031 1 1 26 ARG HB2 H 5.222 -5.320 -1.129 1.00 . A A . 26 ARG HB2 1 1 12 5032 1 1 26 ARG HB3 H 5.820 -6.509 -0.006 1.00 . A A . 26 ARG HB3 1 1 12 5033 1 1 26 ARG HD2 H 6.594 -8.470 -0.787 1.00 . A A . 26 ARG HD2 1 1 12 5034 1 1 26 ARG HD3 H 5.017 -9.253 -0.897 1.00 . A A . 26 ARG HD3 1 1 12 5035 1 1 26 ARG HE H 6.106 -8.982 -3.522 1.00 . A A . 26 ARG HE 1 1 12 5036 1 1 26 ARG HG2 H 4.115 -7.535 -2.274 1.00 . A A . 26 ARG HG2 1 1 12 5037 1 1 26 ARG HG3 H 5.697 -6.914 -2.694 1.00 . A A . 26 ARG HG3 1 1 12 5038 1 1 26 ARG HH11 H 6.559 -10.711 -0.553 1.00 . A A . 26 ARG HH11 1 1 12 5039 1 1 26 ARG HH12 H 7.247 -12.095 -1.333 1.00 . A A . 26 ARG HH12 1 1 12 5040 1 1 26 ARG HH21 H 6.977 -10.723 -4.530 1.00 . A A . 26 ARG HH21 1 1 12 5041 1 1 26 ARG HH22 H 7.489 -12.103 -3.617 1.00 . A A . 26 ARG HH22 1 1 12 5042 1 1 26 ARG N N 3.446 -5.048 0.707 1.00 . A A . 26 ARG N 1 1 12 5043 1 1 26 ARG NE N 6.197 -9.398 -2.640 1.00 . A A . 26 ARG NE 1 1 12 5044 1 1 26 ARG NH1 N 6.851 -11.179 -1.387 1.00 . A A . 26 ARG NH1 1 1 12 5045 1 1 26 ARG NH2 N 7.089 -11.187 -3.652 1.00 . A A . 26 ARG NH2 1 1 12 5046 1 1 26 ARG O O 4.475 -8.130 1.312 1.00 . A A . 26 ARG O 1 1 12 5047 1 1 27 ASN C C 2.656 -8.399 3.791 1.00 . A A . 27 ASN C 1 1 12 5048 1 1 27 ASN CA C 1.952 -8.659 2.444 1.00 . A A . 27 ASN CA 1 1 12 5049 1 1 27 ASN CB C 2.343 -10.060 1.878 1.00 . A A . 27 ASN CB 1 1 12 5050 1 1 27 ASN CG C 1.657 -11.150 2.711 1.00 . A A . 27 ASN CG 1 1 12 5051 1 1 27 ASN H H 1.597 -7.021 1.101 1.00 . A A . 27 ASN H 1 1 12 5052 1 1 27 ASN HA H 0.884 -8.618 2.604 1.00 . A A . 27 ASN HA 1 1 12 5053 1 1 27 ASN HB2 H 2.016 -10.153 0.853 1.00 . A A . 27 ASN HB2 1 1 12 5054 1 1 27 ASN HB3 H 3.411 -10.218 1.918 1.00 . A A . 27 ASN HB3 1 1 12 5055 1 1 27 ASN HD21 H -0.095 -10.921 1.806 1.00 . A A . 27 ASN HD21 1 1 12 5056 1 1 27 ASN HD22 H -0.053 -12.110 3.018 1.00 . A A . 27 ASN HD22 1 1 12 5057 1 1 27 ASN N N 2.304 -7.615 1.433 1.00 . A A . 27 ASN N 1 1 12 5058 1 1 27 ASN ND2 N 0.399 -11.416 2.493 1.00 . A A . 27 ASN ND2 1 1 12 5059 1 1 27 ASN O O 3.640 -9.027 4.135 1.00 . A A . 27 ASN O 1 1 12 5060 1 1 27 ASN OD1 O 2.261 -11.767 3.566 1.00 . A A . 27 ASN OD1 1 1 12 5061 1 1 28 GLY C C 3.938 -6.243 5.861 1.00 . A A . 28 GLY C 1 1 12 5062 1 1 28 GLY CA C 2.634 -7.056 5.847 1.00 . A A . 28 GLY CA 1 1 12 5063 1 1 28 GLY H H 1.318 -6.987 4.164 1.00 . A A . 28 GLY H 1 1 12 5064 1 1 28 GLY HA2 H 1.872 -6.473 6.343 1.00 . A A . 28 GLY HA2 1 1 12 5065 1 1 28 GLY HA3 H 2.784 -7.956 6.418 1.00 . A A . 28 GLY HA3 1 1 12 5066 1 1 28 GLY N N 2.104 -7.452 4.509 1.00 . A A . 28 GLY N 1 1 12 5067 1 1 28 GLY O O 4.224 -5.613 6.861 1.00 . A A . 28 GLY O 1 1 12 5068 1 1 29 ILE C C 5.705 -4.037 4.256 1.00 . A A . 29 ILE C 1 1 12 5069 1 1 29 ILE CA C 5.971 -5.474 4.773 1.00 . A A . 29 ILE CA 1 1 12 5070 1 1 29 ILE CB C 7.003 -6.226 3.865 1.00 . A A . 29 ILE CB 1 1 12 5071 1 1 29 ILE CD1 C 9.068 -6.195 5.348 1.00 . A A . 29 ILE CD1 1 1 12 5072 1 1 29 ILE CG1 C 8.435 -5.643 4.058 1.00 . A A . 29 ILE CG1 1 1 12 5073 1 1 29 ILE CG2 C 6.625 -6.117 2.382 1.00 . A A . 29 ILE CG2 1 1 12 5074 1 1 29 ILE H H 4.422 -6.772 3.999 1.00 . A A . 29 ILE H 1 1 12 5075 1 1 29 ILE HA H 6.361 -5.449 5.776 1.00 . A A . 29 ILE HA 1 1 12 5076 1 1 29 ILE HB H 7.007 -7.271 4.138 1.00 . A A . 29 ILE HB 1 1 12 5077 1 1 29 ILE HD11 H 9.139 -7.272 5.298 1.00 . A A . 29 ILE HD11 1 1 12 5078 1 1 29 ILE HD12 H 10.062 -5.789 5.467 1.00 . A A . 29 ILE HD12 1 1 12 5079 1 1 29 ILE HD13 H 8.480 -5.924 6.212 1.00 . A A . 29 ILE HD13 1 1 12 5080 1 1 29 ILE HG12 H 9.058 -5.928 3.222 1.00 . A A . 29 ILE HG12 1 1 12 5081 1 1 29 ILE HG13 H 8.401 -4.564 4.097 1.00 . A A . 29 ILE HG13 1 1 12 5082 1 1 29 ILE HG21 H 5.554 -6.161 2.272 1.00 . A A . 29 ILE HG21 1 1 12 5083 1 1 29 ILE HG22 H 6.980 -5.184 1.968 1.00 . A A . 29 ILE HG22 1 1 12 5084 1 1 29 ILE HG23 H 7.071 -6.935 1.836 1.00 . A A . 29 ILE HG23 1 1 12 5085 1 1 29 ILE N N 4.692 -6.256 4.787 1.00 . A A . 29 ILE N 1 1 12 5086 1 1 29 ILE O O 5.113 -3.873 3.206 1.00 . A A . 29 ILE O 1 1 12 5087 1 1 30 PRO C C 6.578 -1.197 3.356 1.00 . A A . 30 PRO C 1 1 12 5088 1 1 30 PRO CA C 5.847 -1.616 4.638 1.00 . A A . 30 PRO CA 1 1 12 5089 1 1 30 PRO CB C 6.275 -0.786 5.849 1.00 . A A . 30 PRO CB 1 1 12 5090 1 1 30 PRO CD C 6.949 -3.152 6.238 1.00 . A A . 30 PRO CD 1 1 12 5091 1 1 30 PRO CG C 7.083 -1.716 6.772 1.00 . A A . 30 PRO CG 1 1 12 5092 1 1 30 PRO HA H 4.786 -1.521 4.479 1.00 . A A . 30 PRO HA 1 1 12 5093 1 1 30 PRO HB2 H 6.878 0.060 5.555 1.00 . A A . 30 PRO HB2 1 1 12 5094 1 1 30 PRO HB3 H 5.396 -0.419 6.358 1.00 . A A . 30 PRO HB3 1 1 12 5095 1 1 30 PRO HD2 H 7.913 -3.575 5.997 1.00 . A A . 30 PRO HD2 1 1 12 5096 1 1 30 PRO HD3 H 6.430 -3.777 6.950 1.00 . A A . 30 PRO HD3 1 1 12 5097 1 1 30 PRO HG2 H 8.122 -1.422 6.776 1.00 . A A . 30 PRO HG2 1 1 12 5098 1 1 30 PRO HG3 H 6.701 -1.660 7.780 1.00 . A A . 30 PRO HG3 1 1 12 5099 1 1 30 PRO N N 6.137 -3.032 4.990 1.00 . A A . 30 PRO N 1 1 12 5100 1 1 30 PRO O O 7.766 -0.937 3.362 1.00 . A A . 30 PRO O 1 1 stop_ save_
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